From 67cfc3ede8742a4bf3c94e91434c73b518ee40a3 Mon Sep 17 00:00:00 2001 From: acthiel212 Date: Thu, 23 Oct 2025 12:53:03 -0500 Subject: [PATCH 01/18] Added support to RBE Estimator to move select residues to discrete end states when performing free energy estimates at other specified sites. --- .../groovy/test/RaoBlackwellEstimator.groovy | 40 +++++++++++++++---- 1 file changed, 32 insertions(+), 8 deletions(-) diff --git a/modules/algorithms/src/main/groovy/ffx/algorithms/groovy/test/RaoBlackwellEstimator.groovy b/modules/algorithms/src/main/groovy/ffx/algorithms/groovy/test/RaoBlackwellEstimator.groovy index 5961bb9392..3d590080ff 100644 --- a/modules/algorithms/src/main/groovy/ffx/algorithms/groovy/test/RaoBlackwellEstimator.groovy +++ b/modules/algorithms/src/main/groovy/ffx/algorithms/groovy/test/RaoBlackwellEstimator.groovy @@ -45,9 +45,11 @@ import ffx.potential.ForceFieldEnergy import ffx.potential.bonded.Residue import ffx.potential.extended.ExtendedSystem import ffx.potential.parsers.XPHFilter +import org.codehaus.groovy.runtime.ArrayUtil import picocli.CommandLine.Command import picocli.CommandLine.Option import picocli.CommandLine.Parameters +import org.apache.commons.lang3.ArrayUtils import static java.lang.String.format import static ffx.numerics.estimator.EstimateBootstrapper.getBootstrapIndices @@ -74,6 +76,14 @@ class RaoBlackwellEstimator extends AlgorithmsScript { description = "Specified residues to do analysis.") private String specified = "" + @Option(names = ["--discreteStateResidues", "--dsR"], paramLabel = "", defaultValue = "", + description = "Specified residues are set to discrete state when doing analysis.") + private String discreteStateResidues = "" + + @Option(names = ["--discreteState", "--dS"], paramLabel = "", defaultValue = "0.0", + description = "Specified residues are set to discrete state when doing analysis.") + private double discreteState = 0.0 + @Option(names = ['--startSnap'], paramLabel = "-1", description = 'Start energy evaluations at a snap other than 2.') private int startSnap = -1 @@ -115,14 +125,6 @@ class RaoBlackwellEstimator extends AlgorithmsScript { super(binding) } - /** - * RaoBlackwellEstimator constructor that sets the command line arguments. - * @param args Command line arguments. - */ - RaoBlackwellEstimator(String[] args) { - super(args) - } - RaoBlackwellEstimator run() { if (!init()) { @@ -223,6 +225,25 @@ class RaoBlackwellEstimator extends AlgorithmsScript { specifiedResidues[i] = Integer.parseInt(specifiedResiduesString[i].trim()) } } + + int[] dsResidueNums = null + Residue[] dsResidues = null + if(discreteStateResidues != ""){ + String[] discreteStateResiduesString = discreteStateResidues.split(",") + dsResidueNums = new int[discreteStateResiduesString.length] + dsResidues = new Residue[dsResidueNums.length] + for (int i = 0; i < discreteStateResiduesString.length; i++) { + dsResidueNums[i] = Integer.parseInt(discreteStateResiduesString[i].trim()) + } + int index=0 + for (Residue residue : esvSystem.getTitratingResidueList()) { + if (ArrayUtils.contains(dsResidueNums, residue.getResidueNumber())) { + dsResidues[index] = residue + index++ + } + } + } + ArrayList onlyResidues = new ArrayList<>() ArrayList onlyResidueIndices = new ArrayList<>() if(specifiedResidues != null){ @@ -310,6 +331,9 @@ class RaoBlackwellEstimator extends AlgorithmsScript { xphFilter.readNext() } } + for(Residue dsResidue: dsResidues){ + esvSystem.setTitrationLambda(dsResidue, discreteState, false) + } // Get coordinates/energies with each new snap and calculate energy differences forceFieldEnergy.getCoordinates(x) From 495616be0634579024d82b04cbc2e769665f6f9d Mon Sep 17 00:00:00 2001 From: acthiel212 Date: Fri, 31 Oct 2025 14:59:41 -0500 Subject: [PATCH 02/18] Added Villin headpiece protein to resources directory for usage in pH unit tests that will be implemented. --- .../src/test/resources/hp36_1vii_solv.key | 55 + .../src/test/resources/hp36_1vii_solv.pdb | 15132 ++++++++++++++++ 2 files changed, 15187 insertions(+) create mode 100644 modules/algorithms/src/test/resources/hp36_1vii_solv.key create mode 100644 modules/algorithms/src/test/resources/hp36_1vii_solv.pdb diff --git a/modules/algorithms/src/test/resources/hp36_1vii_solv.key b/modules/algorithms/src/test/resources/hp36_1vii_solv.key new file mode 100644 index 0000000000..5a99be13ff --- /dev/null +++ b/modules/algorithms/src/test/resources/hp36_1vii_solv.key @@ -0,0 +1,55 @@ +forcefield amoeba-bio-2018-cphmd + +esv.friction 0.5 +pH.Windows 1.00 1.50 2.00 2.50 3.00 3.50 4.00 4.50 5.00 5.50 6.00 6.50 +esv.special.residues 44 45 46 72 +esv.special.residues.pka 3.1 4.0 3.5 4.4 +guess.titration.state true + +ASH.titration.bias.magnitude 4.0 +ASH.tautomer.bias.magnitude 2.0 +ASH.cubic 12.730 +ASH.quadratic -107.430 +ASH.linear 166.369 +ASH1toASH2.quadratic -35.305 +ASH1toASH2.linear 35.305 + +HIS.titration.bias.magnitude 6.0 +HIS.tautomer.bias.magnitude 4.0 +HID.cubic 0.0 +HID.quadratic -64.317 +HID.linear 30.35 +HIE.cubic 0.0 +HIE.quadratic -62.931 +HIE.linear 32.00 +HIDtoHIE.cubic 0.0 +HIDtoHIE.quadratic -36.83 +HIDtoHIE.linear 34.325 + +GLH.titration.bias.magnitude 4.0 +GLH.tautomer.bias.magnitude 2.0 +GLH.cubic 28.024 +GLH.quadratic -131.270 +GLH.linear 189.980 +GLH1toGLH2.quadratic -29.395 +GLH1toGLH2.linear 29.395 + +LYS.titration.bias.magnitude 4.0 +LYS.cubic 6.752 +LYS.quadratic -78.804 +LYS.linear 26.894 + +CYS.titration.bias.magnitude 4.0 +CYS.cubic 44.247 +CYS.quadratic -183.990 +CYS.linear 226.710 + +vdw-lambda-alpha 0.0 +vdw-lambda-exponent 1.0 + +permanent-lambda-exponent 1.0 +permanent-lambda-start 0.0 +permanent-lambda-alpha 0.0 +polarization-lambda-exponent 1.0 +polarization-lambda-start 0.0 + diff --git a/modules/algorithms/src/test/resources/hp36_1vii_solv.pdb b/modules/algorithms/src/test/resources/hp36_1vii_solv.pdb new file mode 100644 index 0000000000..4a7f47d1dd --- /dev/null +++ b/modules/algorithms/src/test/resources/hp36_1vii_solv.pdb @@ -0,0 +1,15132 @@ +SEQRES 1 A 36 MET LEU SER ASP GLU ASP PHE LYS ALA VAL PHE GLY MET +SEQRES 2 A 36 THR ARG SER ALA PHE ALA ASN LEU PRO LEU TRP LYS GLN +SEQRES 3 A 36 GLN ASN LEU LYS LYS GLU LYS GLY LEU PHE +REMARK 999 Lambda: 1.00000000 +REMARK 999 Temp: 298.15 +REMARK 999 Time: 1.000e-03 +REMARK 999 pH: 7.40 +MODEL 1 +CRYST1 53.683 53.683 53.683 90.00 90.00 90.00 P 1 +ATOM 1 C ACE A 40 18.536 10.086 25.228 1.00 0.00 C 0 +ATOM 2 O ACE A 40 19.431 10.189 26.100 1.00 0.00 O 0 +ATOM 3 CH3 ACE A 40 17.902 8.740 24.932 1.00 0.00 C 0 +ATOM 4 H1 ACE A 40 18.659 8.136 24.340 1.00 0.00 H 0 +ATOM 5 H2 ACE A 40 17.724 8.274 25.889 1.00 0.00 H 0 +ATOM 6 H3 ACE A 40 16.955 8.748 24.304 1.00 0.00 H 0 +ATOM 7 N MET A 41 18.088 11.124 24.430 1.00 0.00 N 0 +ATOM 8 CA MET A 41 18.638 12.461 24.543 1.00 0.00 C 0 +ATOM 9 C MET A 41 18.082 13.145 25.824 1.00 0.00 C 0 +ATOM 10 O MET A 41 16.961 12.803 26.157 1.00 0.00 O 0 +ATOM 11 H MET A 41 17.416 11.009 23.697 1.00 0.00 H 0 +ATOM 12 HA MET A 41 19.729 12.261 24.737 1.00 0.00 H 0 +ATOM 13 CB MET A 41 18.435 13.353 23.253 1.00 0.00 C 0 +ATOM 14 CE MET A 41 20.794 11.896 20.052 1.00 0.00 C 0 +ATOM 15 CG MET A 41 18.882 12.740 21.946 1.00 0.00 C 0 +ATOM 16 HB2 MET A 41 17.300 13.570 23.135 1.00 0.00 H 0 +ATOM 17 HB3 MET A 41 18.832 14.297 23.296 1.00 0.00 H 0 +ATOM 18 HE1 MET A 41 20.506 12.647 19.321 1.00 0.00 H 0 +ATOM 19 HE2 MET A 41 21.753 11.495 19.743 1.00 0.00 H 0 +ATOM 20 HE3 MET A 41 20.028 11.070 20.034 1.00 0.00 H 0 +ATOM 21 HG2 MET A 41 18.326 11.792 21.865 1.00 0.00 H 0 +ATOM 22 HG3 MET A 41 18.456 13.392 21.080 1.00 0.00 H 0 +ATOM 23 SD MET A 41 20.761 12.524 21.817 1.00 0.00 S 0 +ATOM 24 N LEU A 42 18.734 14.137 26.427 1.00 0.00 N 0 +ATOM 25 CA LEU A 42 18.240 14.931 27.575 1.00 0.00 C 0 +ATOM 26 C LEU A 42 17.199 15.969 26.921 1.00 0.00 C 0 +ATOM 27 O LEU A 42 17.598 16.608 25.925 1.00 0.00 O 0 +ATOM 28 H LEU A 42 19.680 14.363 26.115 1.00 0.00 H 0 +ATOM 29 HA LEU A 42 17.693 14.244 28.252 1.00 0.00 H 0 +ATOM 30 CB LEU A 42 19.391 15.600 28.295 1.00 0.00 C 0 +ATOM 31 CD1 LEU A 42 18.574 15.201 30.796 1.00 0.00 C 0 +ATOM 32 CD2 LEU A 42 20.779 16.331 30.248 1.00 0.00 C 0 +ATOM 33 CG LEU A 42 19.273 16.084 29.778 1.00 0.00 C 0 +ATOM 34 HB2 LEU A 42 20.250 14.855 28.307 1.00 0.00 H 0 +ATOM 35 HB3 LEU A 42 19.765 16.472 27.659 1.00 0.00 H 0 +ATOM 36 HD11 LEU A 42 18.908 14.097 30.772 1.00 0.00 H 0 +ATOM 37 HD12 LEU A 42 18.629 15.589 31.825 1.00 0.00 H 0 +ATOM 38 HD13 LEU A 42 17.477 15.158 30.591 1.00 0.00 H 0 +ATOM 39 HD21 LEU A 42 21.244 17.094 29.594 1.00 0.00 H 0 +ATOM 40 HD22 LEU A 42 20.780 16.754 31.329 1.00 0.00 H 0 +ATOM 41 HD23 LEU A 42 21.384 15.345 30.277 1.00 0.00 H 0 +ATOM 42 HG LEU A 42 18.726 17.066 29.820 1.00 0.00 H 0 +ATOM 43 N SER A 43 16.041 16.166 27.519 1.00 0.00 N 0 +ATOM 44 CA SER A 43 15.209 17.314 27.102 1.00 0.00 C 0 +ATOM 45 C SER A 43 16.072 18.678 27.178 1.00 0.00 C 0 +ATOM 46 O SER A 43 16.880 18.999 28.014 1.00 0.00 O 0 +ATOM 47 H SER A 43 15.968 15.737 28.431 1.00 0.00 H 0 +ATOM 48 HA SER A 43 15.110 17.275 25.982 1.00 0.00 H 0 +ATOM 49 CB SER A 43 13.834 17.289 27.687 1.00 0.00 C 0 +ATOM 50 HB2 SER A 43 13.999 17.359 28.806 1.00 0.00 H 0 +ATOM 51 HB3 SER A 43 13.172 18.135 27.495 1.00 0.00 H 0 +ATOM 52 HG SER A 43 12.310 16.182 27.743 1.00 0.00 H 0 +ATOM 53 OG SER A 43 13.140 16.133 27.231 1.00 0.00 O 0 +ATOM 54 N ASD A 44 15.725 19.646 26.299 1.00 0.00 N 0 +ATOM 55 CA ASD A 44 16.289 20.962 26.361 1.00 0.00 C 0 +ATOM 56 C ASD A 44 16.058 21.732 27.711 1.00 0.00 C 0 +ATOM 57 O ASD A 44 16.972 22.448 28.042 1.00 0.00 O 0 +ATOM 58 H ASD A 44 14.960 19.435 25.686 1.00 0.00 H 0 +ATOM 59 HA ASD A 44 17.400 20.859 26.219 1.00 0.00 H 0 +ATOM 60 CB ASD A 44 15.720 21.790 25.200 0.00 1.00 C 0 +ATOM 61 CG ASD A 44 16.116 21.314 23.822 0.00 1.00 C 0 +ATOM 62 HB2 ASD A 44 16.045 22.888 25.378 0.00 1.00 H 0 +ATOM 63 HB3 ASD A 44 14.624 21.799 25.348 0.00 1.00 H 0 +ATOM 64 HD1 ASD A 44 17.392 20.715 22.607 0.00 1.00 H 0 +ATOM 65 HD2 ASD A 44 15.677 21.122 22.003 0.00 1.00 H 0 +ATOM 66 OD1 ASD A 44 17.365 20.830 23.574 0.00 1.00 O 0 +ATOM 67 OD2 ASD A 44 15.201 21.339 22.828 0.00 1.00 O 0 +ATOM 68 N GLD A 45 15.003 21.572 28.487 1.00 0.00 N 0 +ATOM 69 CA GLD A 45 14.668 22.146 29.786 1.00 0.00 C 0 +ATOM 70 C GLD A 45 15.623 21.608 30.858 1.00 0.00 C 0 +ATOM 71 O GLD A 45 16.118 22.313 31.752 1.00 0.00 O 0 +ATOM 72 H GLD A 45 14.190 21.050 28.018 1.00 0.00 H 0 +ATOM 73 HA GLD A 45 15.030 23.219 29.800 1.00 0.00 H 0 +ATOM 74 CB GLD A 45 13.208 21.974 30.216 0.00 1.00 C 0 +ATOM 75 CD GLD A 45 10.760 22.363 29.712 0.00 1.00 C 0 +ATOM 76 CG GLD A 45 12.199 22.453 29.245 0.00 1.00 C 0 +ATOM 77 HB2 GLD A 45 13.112 22.587 31.203 0.00 1.00 H 0 +ATOM 78 HB3 GLD A 45 13.023 20.855 30.418 0.00 1.00 H 0 +ATOM 79 HE1 GLD A 45 9.134 21.372 29.891 0.00 1.00 H 0 +ATOM 80 HE2 GLD A 45 9.340 23.165 30.706 0.00 1.00 H 0 +ATOM 81 HG2 GLD A 45 12.295 21.894 28.280 0.00 1.00 H 0 +ATOM 82 HG3 GLD A 45 12.380 23.602 29.134 0.00 1.00 H 0 +ATOM 83 OE1 GLD A 45 10.131 21.184 29.613 0.00 1.00 O 0 +ATOM 84 OE2 GLD A 45 10.218 23.413 30.329 0.00 1.00 O 0 +ATOM 85 N ASD A 46 15.983 20.298 30.675 1.00 0.00 N 0 +ATOM 86 CA ASD A 46 17.014 19.686 31.543 1.00 0.00 C 0 +ATOM 87 C ASD A 46 18.444 19.984 31.091 1.00 0.00 C 0 +ATOM 88 O ASD A 46 19.355 19.745 31.883 1.00 0.00 O 0 +ATOM 89 H ASD A 46 15.717 19.801 29.850 1.00 0.00 H 0 +ATOM 90 HA ASD A 46 16.997 20.251 32.455 1.00 0.00 H 0 +ATOM 91 CB ASD A 46 16.713 18.217 31.786 0.00 1.00 C 0 +ATOM 92 CG ASD A 46 15.458 17.688 32.374 0.00 1.00 C 0 +ATOM 93 HB2 ASD A 46 17.517 17.863 32.493 0.00 1.00 H 0 +ATOM 94 HB3 ASD A 46 16.954 17.680 30.841 0.00 1.00 H 0 +ATOM 95 HD1 ASD A 46 14.270 17.637 33.863 0.00 1.00 H 0 +ATOM 96 HD2 ASD A 46 13.947 16.746 32.067 0.00 1.00 H 0 +ATOM 97 OD1 ASD A 46 15.059 18.125 33.582 0.00 1.00 O 0 +ATOM 98 OD2 ASD A 46 14.849 16.763 31.662 0.00 1.00 O 0 +ATOM 99 N PHE A 47 18.672 20.431 29.827 1.00 0.00 N 0 +ATOM 100 CA PHE A 47 19.953 20.939 29.339 1.00 0.00 C 0 +ATOM 101 C PHE A 47 20.220 22.329 29.821 1.00 0.00 C 0 +ATOM 102 O PHE A 47 21.288 22.620 30.386 1.00 0.00 O 0 +ATOM 103 H PHE A 47 17.887 20.431 29.115 1.00 0.00 H 0 +ATOM 104 HA PHE A 47 20.720 20.302 29.908 1.00 0.00 H 0 +ATOM 105 CB PHE A 47 20.043 20.889 27.799 1.00 0.00 C 0 +ATOM 106 CD1 PHE A 47 22.454 20.388 27.049 1.00 0.00 C 0 +ATOM 107 CD2 PHE A 47 21.574 22.703 27.006 1.00 0.00 C 0 +ATOM 108 CE1 PHE A 47 23.682 20.869 26.615 1.00 0.00 C 0 +ATOM 109 CE2 PHE A 47 22.857 23.162 26.746 1.00 0.00 C 0 +ATOM 110 CG PHE A 47 21.390 21.306 27.283 1.00 0.00 C 0 +ATOM 111 CZ PHE A 47 23.857 22.300 26.426 1.00 0.00 C 0 +ATOM 112 HB2 PHE A 47 19.735 19.872 27.493 1.00 0.00 H 0 +ATOM 113 HB3 PHE A 47 19.268 21.523 27.319 1.00 0.00 H 0 +ATOM 114 HD1 PHE A 47 22.358 19.367 27.373 1.00 0.00 H 0 +ATOM 115 HD2 PHE A 47 20.764 23.450 27.261 1.00 0.00 H 0 +ATOM 116 HE1 PHE A 47 24.571 20.262 26.594 1.00 0.00 H 0 +ATOM 117 HE2 PHE A 47 22.939 24.286 26.574 1.00 0.00 H 0 +ATOM 118 HZ PHE A 47 24.858 22.632 26.202 1.00 0.00 H 0 +ATOM 119 N LYS A 48 19.169 23.198 29.692 1.00 0.00 N 0 +ATOM 120 CA LYS A 48 19.305 24.589 30.080 1.00 0.00 C 0 +ATOM 121 C LYS A 48 19.732 24.897 31.511 1.00 0.00 C 0 +ATOM 122 O LYS A 48 20.474 25.860 31.816 1.00 0.00 O 0 +ATOM 123 H LYS A 48 18.353 22.894 29.115 1.00 0.00 H 0 +ATOM 124 HA LYS A 48 20.181 25.047 29.418 1.00 0.00 H 0 +ATOM 125 CB LYS A 48 17.986 25.353 29.749 1.00 0.00 C 0 +ATOM 126 CD LYS A 48 16.870 27.665 29.267 1.00 0.00 C 0 +ATOM 127 CE LYS A 48 16.221 28.857 29.988 1.00 0.00 C 0 +ATOM 128 CG LYS A 48 18.021 26.946 29.986 1.00 0.00 C 0 +ATOM 129 HB2 LYS A 48 17.842 25.208 28.674 1.00 0.00 H 0 +ATOM 130 HB3 LYS A 48 17.045 24.934 30.229 1.00 0.00 H 0 +ATOM 131 HD2 LYS A 48 17.205 27.923 28.178 1.00 0.00 H 0 +ATOM 132 HD3 LYS A 48 16.056 26.870 29.127 1.00 0.00 H 0 +ATOM 133 HE2 LYS A 48 15.731 29.412 29.207 1.00 0.00 H 0 +ATOM 134 HE3 LYS A 48 15.432 28.556 30.656 1.00 0.00 H 0 +ATOM 135 HG2 LYS A 48 17.905 27.185 31.107 1.00 0.00 H 0 +ATOM 136 HG3 LYS A 48 18.952 27.365 29.808 1.00 0.00 H 0 +ATOM 137 HZ1 LYS A 48 17.124 29.504 31.699 1.00 0.00 H 0 +ATOM 138 HZ2 LYS A 48 18.009 29.885 30.297 1.00 0.00 H 0 +ATOM 139 HZ3 LYS A 48 16.736 30.721 30.681 1.00 0.00 H 0 +ATOM 140 NZ LYS A 48 17.077 29.777 30.712 1.00 0.00 N 0 +ATOM 141 N ALA A 49 19.158 24.053 32.433 1.00 0.00 N 0 +ATOM 142 CA ALA A 49 19.630 24.128 33.807 1.00 0.00 C 0 +ATOM 143 C ALA A 49 20.942 23.412 34.160 1.00 0.00 C 0 +ATOM 144 O ALA A 49 21.439 23.721 35.227 1.00 0.00 O 0 +ATOM 145 H ALA A 49 18.467 23.373 32.089 1.00 0.00 H 0 +ATOM 146 HA ALA A 49 19.905 25.175 33.992 1.00 0.00 H 0 +ATOM 147 CB ALA A 49 18.515 23.530 34.724 1.00 0.00 C 0 +ATOM 148 HB1 ALA A 49 17.525 24.101 34.864 1.00 0.00 H 0 +ATOM 149 HB2 ALA A 49 18.361 22.480 34.406 1.00 0.00 H 0 +ATOM 150 HB3 ALA A 49 18.825 23.522 35.837 1.00 0.00 H 0 +ATOM 151 N VAL A 50 21.608 22.771 33.195 1.00 0.00 N 0 +ATOM 152 CA VAL A 50 23.030 22.327 33.250 1.00 0.00 C 0 +ATOM 153 C VAL A 50 23.899 23.540 33.376 1.00 0.00 C 0 +ATOM 154 O VAL A 50 24.569 23.707 34.388 1.00 0.00 O 0 +ATOM 155 H VAL A 50 21.204 22.352 32.385 1.00 0.00 H 0 +ATOM 156 HA VAL A 50 23.158 21.798 34.184 1.00 0.00 H 0 +ATOM 157 CB VAL A 50 23.403 21.354 32.106 1.00 0.00 C 0 +ATOM 158 CG1 VAL A 50 24.895 21.063 32.120 1.00 0.00 C 0 +ATOM 159 CG2 VAL A 50 22.717 19.971 32.245 1.00 0.00 C 0 +ATOM 160 HB VAL A 50 23.198 21.723 31.078 1.00 0.00 H 0 +ATOM 161 HG11 VAL A 50 25.259 20.454 31.246 1.00 0.00 H 0 +ATOM 162 HG12 VAL A 50 25.452 21.998 31.958 1.00 0.00 H 0 +ATOM 163 HG13 VAL A 50 25.245 20.615 33.117 1.00 0.00 H 0 +ATOM 164 HG21 VAL A 50 23.120 19.570 33.214 1.00 0.00 H 0 +ATOM 165 HG22 VAL A 50 21.602 20.072 32.359 1.00 0.00 H 0 +ATOM 166 HG23 VAL A 50 22.910 19.384 31.327 1.00 0.00 H 0 +ATOM 167 N PHE A 51 23.912 24.441 32.417 1.00 0.00 N 0 +ATOM 168 CA PHE A 51 24.795 25.567 32.399 1.00 0.00 C 0 +ATOM 169 C PHE A 51 24.212 26.975 32.616 1.00 0.00 C 0 +ATOM 170 O PHE A 51 24.930 27.947 32.639 1.00 0.00 O 0 +ATOM 171 H PHE A 51 23.460 24.258 31.499 1.00 0.00 H 0 +ATOM 172 HA PHE A 51 25.547 25.464 33.174 1.00 0.00 H 0 +ATOM 173 CB PHE A 51 25.467 25.651 30.985 1.00 0.00 C 0 +ATOM 174 CD1 PHE A 51 27.401 24.119 31.148 1.00 0.00 C 0 +ATOM 175 CD2 PHE A 51 25.683 23.587 29.573 1.00 0.00 C 0 +ATOM 176 CE1 PHE A 51 28.193 23.012 30.778 1.00 0.00 C 0 +ATOM 177 CE2 PHE A 51 26.511 22.536 29.155 1.00 0.00 C 0 +ATOM 178 CG PHE A 51 26.149 24.368 30.594 1.00 0.00 C 0 +ATOM 179 CZ PHE A 51 27.769 22.224 29.787 1.00 0.00 C 0 +ATOM 180 HB2 PHE A 51 24.718 25.866 30.165 1.00 0.00 H 0 +ATOM 181 HB3 PHE A 51 26.217 26.532 31.010 1.00 0.00 H 0 +ATOM 182 HD1 PHE A 51 27.728 24.728 32.028 1.00 0.00 H 0 +ATOM 183 HD2 PHE A 51 24.714 23.842 29.068 1.00 0.00 H 0 +ATOM 184 HE1 PHE A 51 29.143 22.882 31.276 1.00 0.00 H 0 +ATOM 185 HE2 PHE A 51 26.315 21.991 28.193 1.00 0.00 H 0 +ATOM 186 HZ PHE A 51 28.440 21.505 29.316 1.00 0.00 H 0 +ATOM 187 N GLY A 52 22.887 27.036 32.660 1.00 0.00 N 0 +ATOM 188 CA GLY A 52 22.209 28.340 32.704 1.00 0.00 C 0 +ATOM 189 C GLY A 52 21.953 28.929 31.297 1.00 0.00 C 0 +ATOM 190 O GLY A 52 21.970 30.179 31.137 1.00 0.00 O 0 +ATOM 191 H GLY A 52 22.266 26.224 32.838 1.00 0.00 H 0 +ATOM 192 HA2 GLY A 52 21.224 28.124 33.249 1.00 0.00 H 0 +ATOM 193 HA3 GLY A 52 22.753 29.070 33.365 1.00 0.00 H 0 +ATOM 194 N MET A 53 21.941 27.996 30.245 1.00 0.00 N 0 +ATOM 195 CA MET A 53 22.108 28.394 28.875 1.00 0.00 C 0 +ATOM 196 C MET A 53 21.189 27.620 27.965 1.00 0.00 C 0 +ATOM 197 O MET A 53 21.185 26.361 27.982 1.00 0.00 O 0 +ATOM 198 H MET A 53 21.748 27.000 30.424 1.00 0.00 H 0 +ATOM 199 HA MET A 53 21.777 29.518 28.731 1.00 0.00 H 0 +ATOM 200 CB MET A 53 23.553 28.456 28.448 1.00 0.00 C 0 +ATOM 201 CE MET A 53 25.641 30.628 26.923 1.00 0.00 C 0 +ATOM 202 CG MET A 53 24.508 29.482 29.151 1.00 0.00 C 0 +ATOM 203 HB2 MET A 53 24.065 27.539 28.496 1.00 0.00 H 0 +ATOM 204 HB3 MET A 53 23.547 28.726 27.314 1.00 0.00 H 0 +ATOM 205 HE1 MET A 53 25.526 31.726 27.152 1.00 0.00 H 0 +ATOM 206 HE2 MET A 53 26.390 30.572 26.121 1.00 0.00 H 0 +ATOM 207 HE3 MET A 53 24.701 30.279 26.447 1.00 0.00 H 0 +ATOM 208 HG2 MET A 53 24.074 30.485 29.169 1.00 0.00 H 0 +ATOM 209 HG3 MET A 53 24.654 29.099 30.260 1.00 0.00 H 0 +ATOM 210 SD MET A 53 26.149 29.627 28.356 1.00 0.00 S 0 +ATOM 211 N THR A 54 20.362 28.330 27.274 1.00 0.00 N 0 +ATOM 212 CA THR A 54 19.572 27.753 26.184 1.00 0.00 C 0 +ATOM 213 C THR A 54 20.605 27.146 25.229 1.00 0.00 C 0 +ATOM 214 O THR A 54 21.643 27.785 24.972 1.00 0.00 O 0 +ATOM 215 H THR A 54 20.457 29.398 27.211 1.00 0.00 H 0 +ATOM 216 HA THR A 54 18.837 26.998 26.403 1.00 0.00 H 0 +ATOM 217 CB THR A 54 18.833 28.965 25.379 1.00 0.00 C 0 +ATOM 218 CG2 THR A 54 17.834 28.468 24.301 1.00 0.00 C 0 +ATOM 219 HB THR A 54 19.665 29.504 24.921 1.00 0.00 H 0 +ATOM 220 HG1 THR A 54 18.394 30.560 26.396 1.00 0.00 H 0 +ATOM 221 HG21 THR A 54 17.466 29.357 23.733 1.00 0.00 H 0 +ATOM 222 HG22 THR A 54 18.394 27.892 23.561 1.00 0.00 H 0 +ATOM 223 HG23 THR A 54 16.972 27.925 24.756 1.00 0.00 H 0 +ATOM 224 OG1 THR A 54 18.018 29.713 26.300 1.00 0.00 O 0 +ATOM 225 N ARG A 55 20.428 25.916 24.644 1.00 0.00 N 0 +ATOM 226 CA ARG A 55 21.303 25.057 23.833 1.00 0.00 C 0 +ATOM 227 C ARG A 55 21.835 25.827 22.625 1.00 0.00 C 0 +ATOM 228 O ARG A 55 23.043 25.726 22.286 1.00 0.00 O 0 +ATOM 229 H ARG A 55 19.496 25.533 24.830 1.00 0.00 H 0 +ATOM 230 HA ARG A 55 22.187 24.777 24.470 1.00 0.00 H 0 +ATOM 231 CB ARG A 55 20.548 23.743 23.378 1.00 0.00 C 0 +ATOM 232 CD ARG A 55 20.895 21.647 21.844 1.00 0.00 C 0 +ATOM 233 CG ARG A 55 21.485 22.815 22.555 1.00 0.00 C 0 +ATOM 234 CZ ARG A 55 20.560 20.078 23.833 1.00 0.00 C 0 +ATOM 235 HB2 ARG A 55 19.978 23.333 24.249 1.00 0.00 H 0 +ATOM 236 HB3 ARG A 55 19.760 24.008 22.664 1.00 0.00 H 0 +ATOM 237 HD2 ARG A 55 20.218 21.976 21.046 1.00 0.00 H 0 +ATOM 238 HD3 ARG A 55 21.684 21.065 21.345 1.00 0.00 H 0 +ATOM 239 HE ARG A 55 19.103 20.961 22.890 1.00 0.00 H 0 +ATOM 240 HG2 ARG A 55 22.024 23.324 21.786 1.00 0.00 H 0 +ATOM 241 HG3 ARG A 55 22.301 22.531 23.276 1.00 0.00 H 0 +ATOM 242 HH11 ARG A 55 22.537 20.414 23.520 1.00 0.00 H 0 +ATOM 243 HH12 ARG A 55 22.229 19.046 24.550 1.00 0.00 H 0 +ATOM 244 HH21 ARG A 55 18.716 19.611 24.473 1.00 0.00 H 0 +ATOM 245 HH22 ARG A 55 20.079 18.721 25.220 1.00 0.00 H 0 +ATOM 246 NE ARG A 55 20.122 20.768 22.761 1.00 0.00 N 0 +ATOM 247 NH1 ARG A 55 21.901 19.824 23.933 1.00 0.00 N 0 +ATOM 248 NH2 ARG A 55 19.703 19.501 24.691 1.00 0.00 N 0 +ATOM 249 N SER A 56 20.995 26.535 21.898 1.00 0.00 N 0 +ATOM 250 CA SER A 56 21.353 27.354 20.692 1.00 0.00 C 0 +ATOM 251 C SER A 56 22.368 28.505 21.144 1.00 0.00 C 0 +ATOM 252 O SER A 56 23.303 28.818 20.387 1.00 0.00 O 0 +ATOM 253 H SER A 56 20.010 26.562 22.122 1.00 0.00 H 0 +ATOM 254 HA SER A 56 21.997 26.767 19.960 1.00 0.00 H 0 +ATOM 255 CB SER A 56 20.142 27.979 20.019 1.00 0.00 C 0 +ATOM 256 HB2 SER A 56 20.452 28.764 19.381 1.00 0.00 H 0 +ATOM 257 HB3 SER A 56 19.476 27.196 19.567 1.00 0.00 H 0 +ATOM 258 HG SER A 56 18.626 28.940 20.688 1.00 0.00 H 0 +ATOM 259 OG SER A 56 19.384 28.510 21.083 1.00 0.00 O 0 +ATOM 260 N ALA A 57 22.224 29.144 22.375 1.00 0.00 N 0 +ATOM 261 CA ALA A 57 23.179 30.176 22.888 1.00 0.00 C 0 +ATOM 262 C ALA A 57 24.560 29.625 23.333 1.00 0.00 C 0 +ATOM 263 O ALA A 57 25.595 30.206 23.218 1.00 0.00 O 0 +ATOM 264 H ALA A 57 21.362 28.901 22.928 1.00 0.00 H 0 +ATOM 265 HA ALA A 57 23.359 30.808 22.026 1.00 0.00 H 0 +ATOM 266 CB ALA A 57 22.708 31.125 23.974 1.00 0.00 C 0 +ATOM 267 HB1 ALA A 57 23.467 32.007 23.935 1.00 0.00 H 0 +ATOM 268 HB2 ALA A 57 21.733 31.527 23.690 1.00 0.00 H 0 +ATOM 269 HB3 ALA A 57 22.782 30.684 25.074 1.00 0.00 H 0 +ATOM 270 N PHE A 58 24.493 28.388 23.899 1.00 0.00 N 0 +ATOM 271 CA PHE A 58 25.652 27.540 24.202 1.00 0.00 C 0 +ATOM 272 C PHE A 58 26.461 27.098 22.981 1.00 0.00 C 0 +ATOM 273 O PHE A 58 27.674 27.320 22.812 1.00 0.00 O 0 +ATOM 274 H PHE A 58 23.546 28.082 24.077 1.00 0.00 H 0 +ATOM 275 HA PHE A 58 26.407 28.224 24.764 1.00 0.00 H 0 +ATOM 276 CB PHE A 58 25.100 26.369 25.035 1.00 0.00 C 0 +ATOM 277 CD1 PHE A 58 27.100 25.718 26.528 1.00 0.00 C 0 +ATOM 278 CD2 PHE A 58 26.642 24.279 24.743 1.00 0.00 C 0 +ATOM 279 CE1 PHE A 58 28.049 24.859 27.002 1.00 0.00 C 0 +ATOM 280 CE2 PHE A 58 27.726 23.423 25.103 1.00 0.00 C 0 +ATOM 281 CG PHE A 58 26.266 25.432 25.403 1.00 0.00 C 0 +ATOM 282 CZ PHE A 58 28.327 23.645 26.333 1.00 0.00 C 0 +ATOM 283 HB2 PHE A 58 24.523 26.709 25.939 1.00 0.00 H 0 +ATOM 284 HB3 PHE A 58 24.450 25.659 24.445 1.00 0.00 H 0 +ATOM 285 HD1 PHE A 58 27.075 26.661 27.087 1.00 0.00 H 0 +ATOM 286 HD2 PHE A 58 26.025 23.928 23.857 1.00 0.00 H 0 +ATOM 287 HE1 PHE A 58 28.582 24.886 27.895 1.00 0.00 H 0 +ATOM 288 HE2 PHE A 58 28.078 22.650 24.337 1.00 0.00 H 0 +ATOM 289 HZ PHE A 58 29.049 23.006 26.829 1.00 0.00 H 0 +ATOM 290 N ALA A 59 25.785 26.676 21.881 1.00 0.00 N 0 +ATOM 291 CA ALA A 59 26.285 26.278 20.514 1.00 0.00 C 0 +ATOM 292 C ALA A 59 26.566 27.479 19.545 1.00 0.00 C 0 +ATOM 293 O ALA A 59 27.290 27.310 18.533 1.00 0.00 O 0 +ATOM 294 H ALA A 59 24.884 26.371 21.964 1.00 0.00 H 0 +ATOM 295 HA ALA A 59 27.235 25.722 20.646 1.00 0.00 H 0 +ATOM 296 CB ALA A 59 25.288 25.287 19.877 1.00 0.00 C 0 +ATOM 297 HB1 ALA A 59 25.477 25.122 18.834 1.00 0.00 H 0 +ATOM 298 HB2 ALA A 59 25.420 24.199 20.332 1.00 0.00 H 0 +ATOM 299 HB3 ALA A 59 24.213 25.584 19.811 1.00 0.00 H 0 +ATOM 300 N ASN A 60 26.210 28.761 19.873 1.00 0.00 N 0 +ATOM 301 CA ASN A 60 26.726 29.970 19.303 1.00 0.00 C 0 +ATOM 302 C ASN A 60 28.110 30.326 19.904 1.00 0.00 C 0 +ATOM 303 O ASN A 60 28.868 31.019 19.129 1.00 0.00 O 0 +ATOM 304 H ASN A 60 25.611 28.849 20.700 1.00 0.00 H 0 +ATOM 305 HA ASN A 60 26.787 29.908 18.203 1.00 0.00 H 0 +ATOM 306 CB ASN A 60 25.809 31.234 19.601 1.00 0.00 C 0 +ATOM 307 CG ASN A 60 24.498 31.257 18.873 1.00 0.00 C 0 +ATOM 308 HB2 ASN A 60 25.758 31.407 20.697 1.00 0.00 H 0 +ATOM 309 HB3 ASN A 60 26.367 32.097 19.179 1.00 0.00 H 0 +ATOM 310 HD21 ASN A 60 25.284 30.675 17.004 1.00 0.00 H 0 +ATOM 311 HD22 ASN A 60 23.600 30.776 17.150 1.00 0.00 H 0 +ATOM 312 ND2 ASN A 60 24.465 30.846 17.606 1.00 0.00 N 0 +ATOM 313 OD1 ASN A 60 23.533 31.595 19.524 1.00 0.00 O 0 +ATOM 314 N LEU A 61 28.493 29.903 21.136 1.00 0.00 N 0 +ATOM 315 CA LEU A 61 29.782 30.213 21.818 1.00 0.00 C 0 +ATOM 316 C LEU A 61 31.008 29.775 20.908 1.00 0.00 C 0 +ATOM 317 O LEU A 61 30.942 28.760 20.145 1.00 0.00 O 0 +ATOM 318 H LEU A 61 27.779 29.380 21.744 1.00 0.00 H 0 +ATOM 319 HA LEU A 61 29.679 31.296 21.831 1.00 0.00 H 0 +ATOM 320 CB LEU A 61 29.895 29.515 23.286 1.00 0.00 C 0 +ATOM 321 CD1 LEU A 61 29.092 29.421 25.784 1.00 0.00 C 0 +ATOM 322 CD2 LEU A 61 29.843 31.562 24.802 1.00 0.00 C 0 +ATOM 323 CG LEU A 61 29.158 30.211 24.478 1.00 0.00 C 0 +ATOM 324 HB2 LEU A 61 29.542 28.473 23.181 1.00 0.00 H 0 +ATOM 325 HB3 LEU A 61 30.894 29.407 23.701 1.00 0.00 H 0 +ATOM 326 HD11 LEU A 61 30.116 28.982 25.963 1.00 0.00 H 0 +ATOM 327 HD12 LEU A 61 28.834 30.000 26.669 1.00 0.00 H 0 +ATOM 328 HD13 LEU A 61 28.342 28.595 25.750 1.00 0.00 H 0 +ATOM 329 HD21 LEU A 61 30.848 31.502 25.320 1.00 0.00 H 0 +ATOM 330 HD22 LEU A 61 29.985 32.162 23.906 1.00 0.00 H 0 +ATOM 331 HD23 LEU A 61 29.135 32.153 25.420 1.00 0.00 H 0 +ATOM 332 HG LEU A 61 28.096 30.380 24.107 1.00 0.00 H 0 +ATOM 333 N PRO A 62 32.218 30.381 21.116 1.00 0.00 N 0 +ATOM 334 CA PRO A 62 33.481 29.769 20.718 1.00 0.00 C 0 +ATOM 335 C PRO A 62 33.540 28.312 21.072 1.00 0.00 C 0 +ATOM 336 O PRO A 62 33.277 27.978 22.226 1.00 0.00 O 0 +ATOM 337 HA PRO A 62 33.632 29.916 19.599 1.00 0.00 H 0 +ATOM 338 CB PRO A 62 34.546 30.510 21.461 1.00 0.00 C 0 +ATOM 339 CD PRO A 62 32.426 31.591 21.831 1.00 0.00 C 0 +ATOM 340 CG PRO A 62 33.869 31.949 21.610 1.00 0.00 C 0 +ATOM 341 HB2 PRO A 62 34.827 30.181 22.459 1.00 0.00 H 0 +ATOM 342 HB3 PRO A 62 35.442 30.645 20.789 1.00 0.00 H 0 +ATOM 343 HD2 PRO A 62 32.336 31.383 22.921 1.00 0.00 H 0 +ATOM 344 HD3 PRO A 62 31.811 32.445 21.512 1.00 0.00 H 0 +ATOM 345 HG2 PRO A 62 34.356 32.548 22.401 1.00 0.00 H 0 +ATOM 346 HG3 PRO A 62 33.976 32.500 20.645 1.00 0.00 H 0 +ATOM 347 N LEU A 63 34.076 27.449 20.171 1.00 0.00 N 0 +ATOM 348 CA LEU A 63 34.214 26.051 20.579 1.00 0.00 C 0 +ATOM 349 C LEU A 63 35.224 25.780 21.708 1.00 0.00 C 0 +ATOM 350 O LEU A 63 34.982 24.980 22.587 1.00 0.00 O 0 +ATOM 351 H LEU A 63 34.497 27.603 19.233 1.00 0.00 H 0 +ATOM 352 HA LEU A 63 33.350 25.678 21.241 1.00 0.00 H 0 +ATOM 353 CB LEU A 63 34.412 25.164 19.302 1.00 0.00 C 0 +ATOM 354 CD1 LEU A 63 32.700 23.285 19.816 1.00 0.00 C 0 +ATOM 355 CD2 LEU A 63 34.715 22.903 18.231 1.00 0.00 C 0 +ATOM 356 CG LEU A 63 34.280 23.652 19.518 1.00 0.00 C 0 +ATOM 357 HB2 LEU A 63 33.731 25.528 18.562 1.00 0.00 H 0 +ATOM 358 HB3 LEU A 63 35.476 25.388 18.944 1.00 0.00 H 0 +ATOM 359 HD11 LEU A 63 32.610 22.206 20.074 1.00 0.00 H 0 +ATOM 360 HD12 LEU A 63 32.416 23.942 20.678 1.00 0.00 H 0 +ATOM 361 HD13 LEU A 63 32.100 23.400 18.875 1.00 0.00 H 0 +ATOM 362 HD21 LEU A 63 33.955 22.951 17.441 1.00 0.00 H 0 +ATOM 363 HD22 LEU A 63 35.741 23.304 17.995 1.00 0.00 H 0 +ATOM 364 HD23 LEU A 63 34.887 21.830 18.451 1.00 0.00 H 0 +ATOM 365 HG LEU A 63 34.883 23.279 20.405 1.00 0.00 H 0 +ATOM 366 N TRP A 64 36.295 26.590 21.778 1.00 0.00 N 0 +ATOM 367 CA TRP A 64 37.237 26.414 22.875 1.00 0.00 C 0 +ATOM 368 C TRP A 64 36.681 26.731 24.243 1.00 0.00 C 0 +ATOM 369 O TRP A 64 37.127 26.103 25.187 1.00 0.00 O 0 +ATOM 370 H TRP A 64 36.414 27.396 21.123 1.00 0.00 H 0 +ATOM 371 HA TRP A 64 37.452 25.352 22.934 1.00 0.00 H 0 +ATOM 372 CB TRP A 64 38.601 27.235 22.710 1.00 0.00 C 0 +ATOM 373 CD1 TRP A 64 37.955 29.537 21.684 1.00 0.00 C 0 +ATOM 374 CD2 TRP A 64 38.811 29.609 23.755 1.00 0.00 C 0 +ATOM 375 CE2 TRP A 64 38.396 30.875 23.397 1.00 0.00 C 0 +ATOM 376 CE3 TRP A 64 39.270 29.226 25.005 1.00 0.00 C 0 +ATOM 377 CG TRP A 64 38.571 28.763 22.657 1.00 0.00 C 0 +ATOM 378 CH2 TRP A 64 39.073 31.564 25.634 1.00 0.00 C 0 +ATOM 379 CZ2 TRP A 64 38.450 31.909 24.402 1.00 0.00 C 0 +ATOM 380 CZ3 TRP A 64 39.494 30.275 25.914 1.00 0.00 C 0 +ATOM 381 HB2 TRP A 64 39.343 26.936 23.542 1.00 0.00 H 0 +ATOM 382 HB3 TRP A 64 39.127 26.940 21.787 1.00 0.00 H 0 +ATOM 383 HD1 TRP A 64 37.584 29.177 20.704 1.00 0.00 H 0 +ATOM 384 HE1 TRP A 64 37.357 31.644 21.735 1.00 0.00 H 0 +ATOM 385 HE3 TRP A 64 39.619 28.194 25.371 1.00 0.00 H 0 +ATOM 386 HH2 TRP A 64 39.369 32.385 26.400 1.00 0.00 H 0 +ATOM 387 HZ2 TRP A 64 38.148 32.972 24.136 1.00 0.00 H 0 +ATOM 388 HZ3 TRP A 64 39.962 30.081 26.866 1.00 0.00 H 0 +ATOM 389 NE1 TRP A 64 37.888 30.837 22.148 1.00 0.00 N 0 +ATOM 390 N LYS A 65 35.600 27.625 24.313 1.00 0.00 N 0 +ATOM 391 CA LYS A 65 34.943 27.948 25.547 1.00 0.00 C 0 +ATOM 392 C LYS A 65 33.928 26.866 25.952 1.00 0.00 C 0 +ATOM 393 O LYS A 65 33.885 26.586 27.144 1.00 0.00 O 0 +ATOM 394 H LYS A 65 35.184 28.061 23.410 1.00 0.00 H 0 +ATOM 395 HA LYS A 65 35.626 28.028 26.377 1.00 0.00 H 0 +ATOM 396 CB LYS A 65 34.224 29.357 25.499 0.97 0.00 C 0 +ATOM 397 CD LYS A 65 33.904 31.536 27.018 0.97 0.00 C 0 +ATOM 398 CE LYS A 65 35.324 32.066 27.340 0.97 0.00 C 0 +ATOM 399 CG LYS A 65 33.800 29.977 26.833 0.97 0.00 C 0 +ATOM 400 HB2 LYS A 65 34.966 30.031 25.065 0.97 0.00 H 0 +ATOM 401 HB3 LYS A 65 33.422 29.345 24.780 0.97 0.00 H 0 +ATOM 402 HD2 LYS A 65 33.504 32.141 26.159 0.97 0.00 H 0 +ATOM 403 HD3 LYS A 65 33.263 31.774 27.904 0.97 0.00 H 0 +ATOM 404 HE2 LYS A 65 35.789 31.573 28.195 0.97 0.00 H 0 +ATOM 405 HE3 LYS A 65 35.949 31.816 26.418 0.97 0.00 H 0 +ATOM 406 HG2 LYS A 65 32.666 29.572 26.961 0.97 0.00 H 0 +ATOM 407 HG3 LYS A 65 34.375 29.458 27.724 0.97 0.00 H 0 +ATOM 408 HZ1 LYS A 65 36.358 33.806 27.654 0.97 0.00 H 0 +ATOM 409 HZ2 LYS A 65 35.111 34.022 26.602 0.97 0.00 H 0 +ATOM 410 HZ3 LYS A 65 34.817 33.998 28.126 0.97 0.00 H 0 +ATOM 411 NZ LYS A 65 35.379 33.525 27.442 0.97 0.00 N 0 +ATOM 412 N GLN A 66 33.174 26.294 25.056 1.00 0.00 N 0 +ATOM 413 CA GLN A 66 32.342 25.143 25.335 1.00 0.00 C 0 +ATOM 414 C GLN A 66 33.157 24.087 25.976 1.00 0.00 C 0 +ATOM 415 O GLN A 66 32.847 23.691 27.144 1.00 0.00 O 0 +ATOM 416 H GLN A 66 33.229 26.555 24.029 1.00 0.00 H 0 +ATOM 417 HA GLN A 66 31.569 25.396 26.202 1.00 0.00 H 0 +ATOM 418 CB GLN A 66 31.523 24.552 24.097 1.00 0.00 C 0 +ATOM 419 CD GLN A 66 30.097 24.904 22.070 1.00 0.00 C 0 +ATOM 420 CG GLN A 66 30.563 25.528 23.375 1.00 0.00 C 0 +ATOM 421 HB2 GLN A 66 32.312 24.114 23.364 1.00 0.00 H 0 +ATOM 422 HB3 GLN A 66 31.030 23.563 24.319 1.00 0.00 H 0 +ATOM 423 HE21 GLN A 66 30.233 26.761 21.228 1.00 0.00 H 0 +ATOM 424 HE22 GLN A 66 29.945 25.428 20.043 1.00 0.00 H 0 +ATOM 425 HG2 GLN A 66 29.722 25.659 24.075 1.00 0.00 H 0 +ATOM 426 HG3 GLN A 66 30.978 26.515 23.139 1.00 0.00 H 0 +ATOM 427 NE2 GLN A 66 30.089 25.763 21.012 1.00 0.00 N 0 +ATOM 428 OE1 GLN A 66 29.847 23.669 21.946 1.00 0.00 O 0 +ATOM 429 N GLN A 67 34.332 23.671 25.417 1.00 0.00 N 0 +ATOM 430 CA GLN A 67 35.214 22.730 26.069 1.00 0.00 C 0 +ATOM 431 C GLN A 67 35.653 23.049 27.534 1.00 0.00 C 0 +ATOM 432 O GLN A 67 36.008 22.157 28.284 1.00 0.00 O 0 +ATOM 433 H GLN A 67 34.803 24.202 24.643 1.00 0.00 H 0 +ATOM 434 HA GLN A 67 34.611 21.732 26.222 1.00 0.00 H 0 +ATOM 435 CB GLN A 67 36.423 22.386 25.203 1.00 0.00 C 0 +ATOM 436 CD GLN A 67 35.676 20.341 23.923 1.00 0.00 C 0 +ATOM 437 CG GLN A 67 36.032 21.780 23.830 1.00 0.00 C 0 +ATOM 438 HB2 GLN A 67 37.016 23.364 25.015 1.00 0.00 H 0 +ATOM 439 HB3 GLN A 67 37.062 21.633 25.768 1.00 0.00 H 0 +ATOM 440 HE21 GLN A 67 35.075 20.332 21.843 1.00 0.00 H 0 +ATOM 441 HE22 GLN A 67 34.951 18.925 22.807 1.00 0.00 H 0 +ATOM 442 HG2 GLN A 67 35.121 22.317 23.361 1.00 0.00 H 0 +ATOM 443 HG3 GLN A 67 36.867 21.879 23.101 1.00 0.00 H 0 +ATOM 444 NE2 GLN A 67 35.223 19.853 22.739 1.00 0.00 N 0 +ATOM 445 OE1 GLN A 67 35.809 19.671 24.944 1.00 0.00 O 0 +ATOM 446 N ASN A 68 35.711 24.286 27.907 1.00 0.00 N 0 +ATOM 447 CA ASN A 68 36.006 24.640 29.283 1.00 0.00 C 0 +ATOM 448 C ASN A 68 34.932 24.501 30.267 1.00 0.00 C 0 +ATOM 449 O ASN A 68 35.164 24.249 31.454 1.00 0.00 O 0 +ATOM 450 H ASN A 68 35.846 25.060 27.292 1.00 0.00 H 0 +ATOM 451 HA ASN A 68 36.880 24.038 29.668 1.00 0.00 H 0 +ATOM 452 CB ASN A 68 36.431 26.239 29.284 1.00 0.00 C 0 +ATOM 453 CG ASN A 68 37.619 26.668 28.338 1.00 0.00 C 0 +ATOM 454 HB2 ASN A 68 35.461 26.854 29.005 1.00 0.00 H 0 +ATOM 455 HB3 ASN A 68 36.772 26.590 30.351 1.00 0.00 H 0 +ATOM 456 HD21 ASN A 68 37.104 28.686 28.531 1.00 0.00 H 0 +ATOM 457 HD22 ASN A 68 38.529 28.304 27.539 1.00 0.00 H 0 +ATOM 458 ND2 ASN A 68 37.736 27.972 28.138 1.00 0.00 N 0 +ATOM 459 OD1 ASN A 68 38.315 25.786 27.796 1.00 0.00 O 0 +ATOM 460 N LEU A 69 33.657 24.660 29.828 1.00 0.00 N 0 +ATOM 461 CA LEU A 69 32.378 24.403 30.619 1.00 0.00 C 0 +ATOM 462 C LEU A 69 32.057 22.847 30.799 1.00 0.00 C 0 +ATOM 463 O LEU A 69 31.788 22.374 31.925 1.00 0.00 O 0 +ATOM 464 H LEU A 69 33.487 25.073 28.933 1.00 0.00 H 0 +ATOM 465 HA LEU A 69 32.467 24.830 31.667 1.00 0.00 H 0 +ATOM 466 CB LEU A 69 31.154 25.148 29.972 1.00 0.00 C 0 +ATOM 467 CD1 LEU A 69 30.320 27.523 29.285 1.00 0.00 C 0 +ATOM 468 CD2 LEU A 69 32.006 27.317 31.008 1.00 0.00 C 0 +ATOM 469 CG LEU A 69 31.523 26.620 29.647 1.00 0.00 C 0 +ATOM 470 HB2 LEU A 69 30.672 24.564 29.254 1.00 0.00 H 0 +ATOM 471 HB3 LEU A 69 30.256 25.151 30.695 1.00 0.00 H 0 +ATOM 472 HD11 LEU A 69 30.662 28.559 28.882 1.00 0.00 H 0 +ATOM 473 HD12 LEU A 69 29.851 27.072 28.420 1.00 0.00 H 0 +ATOM 474 HD13 LEU A 69 29.553 27.613 30.103 1.00 0.00 H 0 +ATOM 475 HD21 LEU A 69 31.392 27.107 31.928 1.00 0.00 H 0 +ATOM 476 HD22 LEU A 69 32.995 26.808 31.289 1.00 0.00 H 0 +ATOM 477 HD23 LEU A 69 32.139 28.367 30.855 1.00 0.00 H 0 +ATOM 478 HG LEU A 69 32.366 26.730 28.881 1.00 0.00 H 0 +ATOM 479 N LYS A 70 32.288 22.107 29.686 1.00 0.00 N 0 +ATOM 480 CA LYS A 70 32.173 20.653 29.693 1.00 0.00 C 0 +ATOM 481 C LYS A 70 33.081 19.939 30.695 1.00 0.00 C 0 +ATOM 482 O LYS A 70 32.863 18.784 31.001 1.00 0.00 O 0 +ATOM 483 H LYS A 70 32.479 22.564 28.746 1.00 0.00 H 0 +ATOM 484 HA LYS A 70 31.161 20.333 30.181 1.00 0.00 H 0 +ATOM 485 CB LYS A 70 32.404 20.116 28.250 0.99 0.00 C 0 +ATOM 486 CD LYS A 70 31.061 19.667 26.031 0.99 0.00 C 0 +ATOM 487 CE LYS A 70 32.306 19.116 25.316 0.99 0.00 C 0 +ATOM 488 CG LYS A 70 31.348 20.590 27.211 0.99 0.00 C 0 +ATOM 489 HB2 LYS A 70 33.474 20.280 27.953 0.99 0.00 H 0 +ATOM 490 HB3 LYS A 70 32.204 18.967 28.424 0.99 0.00 H 0 +ATOM 491 HD2 LYS A 70 30.451 18.834 26.388 0.99 0.00 H 0 +ATOM 492 HD3 LYS A 70 30.381 20.228 25.415 0.99 0.00 H 0 +ATOM 493 HE2 LYS A 70 33.036 19.937 24.985 0.99 0.00 H 0 +ATOM 494 HE3 LYS A 70 32.852 18.372 26.016 0.99 0.00 H 0 +ATOM 495 HG2 LYS A 70 30.356 20.691 27.778 0.99 0.00 H 0 +ATOM 496 HG3 LYS A 70 31.481 21.616 26.792 0.99 0.00 H 0 +ATOM 497 HZ1 LYS A 70 31.349 17.644 24.246 0.99 0.00 H 0 +ATOM 498 HZ2 LYS A 70 31.929 19.065 23.349 0.99 0.00 H 0 +ATOM 499 HZ3 LYS A 70 32.820 17.774 23.773 0.99 0.00 H 0 +ATOM 500 NZ LYS A 70 32.072 18.333 24.102 0.99 0.00 N 0 +ATOM 501 N LYS A 71 34.213 20.590 31.031 1.00 0.00 N 0 +ATOM 502 CA LYS A 71 35.304 19.969 31.818 1.00 0.00 C 0 +ATOM 503 C LYS A 71 34.911 19.548 33.157 1.00 0.00 C 0 +ATOM 504 O LYS A 71 35.106 18.369 33.506 1.00 0.00 O 0 +ATOM 505 H LYS A 71 34.390 21.561 30.754 1.00 0.00 H 0 +ATOM 506 HA LYS A 71 35.605 19.061 31.274 1.00 0.00 H 0 +ATOM 507 CB LYS A 71 36.534 20.993 31.940 1.00 0.00 C 0 +ATOM 508 CD LYS A 71 38.465 19.281 31.927 1.00 0.00 C 0 +ATOM 509 CE LYS A 71 38.863 18.091 32.801 1.00 0.00 C 0 +ATOM 510 CG LYS A 71 37.742 20.394 32.694 1.00 0.00 C 0 +ATOM 511 HB2 LYS A 71 36.893 21.332 30.900 1.00 0.00 H 0 +ATOM 512 HB3 LYS A 71 36.155 21.952 32.467 1.00 0.00 H 0 +ATOM 513 HD2 LYS A 71 37.822 18.964 31.135 1.00 0.00 H 0 +ATOM 514 HD3 LYS A 71 39.301 19.658 31.418 1.00 0.00 H 0 +ATOM 515 HE2 LYS A 71 38.170 17.876 33.600 1.00 0.00 H 0 +ATOM 516 HE3 LYS A 71 38.756 17.155 32.247 1.00 0.00 H 0 +ATOM 517 HG2 LYS A 71 38.367 21.185 32.985 1.00 0.00 H 0 +ATOM 518 HG3 LYS A 71 37.395 19.987 33.623 1.00 0.00 H 0 +ATOM 519 HZ1 LYS A 71 40.531 17.190 33.648 1.00 0.00 H 0 +ATOM 520 HZ2 LYS A 71 40.886 18.561 32.605 1.00 0.00 H 0 +ATOM 521 HZ3 LYS A 71 40.261 18.719 34.220 1.00 0.00 H 0 +ATOM 522 NZ LYS A 71 40.234 18.180 33.308 1.00 0.00 N 0 +ATOM 523 N GLD A 72 34.497 20.492 34.035 1.00 0.00 N 0 +ATOM 524 CA GLD A 72 34.022 20.114 35.325 1.00 0.00 C 0 +ATOM 525 C GLD A 72 32.491 20.196 35.591 1.00 0.00 C 0 +ATOM 526 O GLD A 72 32.043 19.591 36.599 1.00 0.00 O 0 +ATOM 527 H GLD A 72 34.363 21.468 33.809 1.00 0.00 H 0 +ATOM 528 HA GLD A 72 34.251 19.125 35.559 1.00 0.00 H 0 +ATOM 529 CB GLD A 72 34.558 21.096 36.537 0.00 1.00 C 0 +ATOM 530 CD GLD A 72 36.623 22.528 37.175 0.00 1.00 C 0 +ATOM 531 CG GLD A 72 36.116 21.395 36.332 0.00 1.00 C 0 +ATOM 532 HB2 GLD A 72 34.424 20.642 37.574 0.00 1.00 H 0 +ATOM 533 HB3 GLD A 72 34.030 22.087 36.560 0.00 1.00 H 0 +ATOM 534 HE1 GLD A 72 36.415 24.289 37.621 0.00 1.00 H 0 +ATOM 535 HE2 GLD A 72 37.909 23.251 38.295 0.00 1.00 H 0 +ATOM 536 HG2 GLD A 72 36.316 21.486 35.285 0.00 1.00 H 0 +ATOM 537 HG3 GLD A 72 36.723 20.539 36.553 0.00 1.00 H 0 +ATOM 538 OE1 GLD A 72 35.968 23.672 37.017 0.00 1.00 O 0 +ATOM 539 OE2 GLD A 72 37.684 22.338 38.006 0.00 1.00 O 0 +ATOM 540 N LYS A 73 31.658 20.827 34.703 1.00 0.00 N 0 +ATOM 541 CA LYS A 73 30.141 20.830 34.994 1.00 0.00 C 0 +ATOM 542 C LYS A 73 29.509 19.797 34.008 1.00 0.00 C 0 +ATOM 543 O LYS A 73 30.218 19.318 33.082 1.00 0.00 O 0 +ATOM 544 H LYS A 73 32.005 21.048 33.745 1.00 0.00 H 0 +ATOM 545 HA LYS A 73 29.953 20.621 36.077 1.00 0.00 H 0 +ATOM 546 CB LYS A 73 29.640 22.291 34.447 1.00 0.00 C 0 +ATOM 547 CD LYS A 73 29.460 24.921 34.808 1.00 0.00 C 0 +ATOM 548 CE LYS A 73 29.276 26.018 35.846 1.00 0.00 C 0 +ATOM 549 CG LYS A 73 29.997 23.511 35.261 1.00 0.00 C 0 +ATOM 550 HB2 LYS A 73 29.917 22.457 33.398 1.00 0.00 H 0 +ATOM 551 HB3 LYS A 73 28.532 22.174 34.593 1.00 0.00 H 0 +ATOM 552 HD2 LYS A 73 30.127 25.275 33.971 1.00 0.00 H 0 +ATOM 553 HD3 LYS A 73 28.558 24.789 34.274 1.00 0.00 H 0 +ATOM 554 HE2 LYS A 73 28.301 25.810 36.390 1.00 0.00 H 0 +ATOM 555 HE3 LYS A 73 30.094 25.904 36.581 1.00 0.00 H 0 +ATOM 556 HG2 LYS A 73 29.690 23.347 36.273 1.00 0.00 H 0 +ATOM 557 HG3 LYS A 73 31.047 23.675 35.405 1.00 0.00 H 0 +ATOM 558 HZ1 LYS A 73 28.728 27.326 34.425 1.00 0.00 H 0 +ATOM 559 HZ2 LYS A 73 28.812 27.996 35.946 1.00 0.00 H 0 +ATOM 560 HZ3 LYS A 73 30.161 27.665 35.062 1.00 0.00 H 0 +ATOM 561 NZ LYS A 73 29.239 27.323 35.288 1.00 0.00 N 0 +ATOM 562 N GLY A 74 28.193 19.426 34.208 1.00 0.00 N 0 +ATOM 563 CA GLY A 74 27.386 18.517 33.420 1.00 0.00 C 0 +ATOM 564 C GLY A 74 27.657 17.033 33.697 1.00 0.00 C 0 +ATOM 565 O GLY A 74 27.396 16.196 32.837 1.00 0.00 O 0 +ATOM 566 H GLY A 74 27.667 19.866 34.950 1.00 0.00 H 0 +ATOM 567 HA2 GLY A 74 26.399 18.624 33.767 1.00 0.00 H 0 +ATOM 568 HA3 GLY A 74 27.489 18.711 32.301 1.00 0.00 H 0 +ATOM 569 N LEU A 75 28.115 16.570 34.953 1.00 0.00 N 0 +ATOM 570 CA LEU A 75 28.490 15.202 35.172 1.00 0.00 C 0 +ATOM 571 C LEU A 75 27.332 14.560 36.020 1.00 0.00 C 0 +ATOM 572 O LEU A 75 27.363 14.526 37.250 1.00 0.00 O 0 +ATOM 573 H LEU A 75 28.256 17.331 35.667 1.00 0.00 H 0 +ATOM 574 HA LEU A 75 28.527 14.498 34.342 1.00 0.00 H 0 +ATOM 575 CB LEU A 75 29.837 15.073 35.985 1.00 0.00 C 0 +ATOM 576 CD1 LEU A 75 31.298 16.075 34.166 1.00 0.00 C 0 +ATOM 577 CD2 LEU A 75 32.328 14.824 36.131 1.00 0.00 C 0 +ATOM 578 CG LEU A 75 31.162 14.921 35.161 1.00 0.00 C 0 +ATOM 579 HB2 LEU A 75 30.014 15.956 36.704 1.00 0.00 H 0 +ATOM 580 HB3 LEU A 75 29.841 14.105 36.656 1.00 0.00 H 0 +ATOM 581 HD11 LEU A 75 32.249 16.013 33.662 1.00 0.00 H 0 +ATOM 582 HD12 LEU A 75 30.485 16.067 33.438 1.00 0.00 H 0 +ATOM 583 HD13 LEU A 75 31.307 17.013 34.674 1.00 0.00 H 0 +ATOM 584 HD21 LEU A 75 32.404 13.979 36.872 1.00 0.00 H 0 +ATOM 585 HD22 LEU A 75 33.290 14.892 35.606 1.00 0.00 H 0 +ATOM 586 HD23 LEU A 75 32.342 15.708 36.761 1.00 0.00 H 0 +ATOM 587 HG LEU A 75 31.094 13.997 34.507 1.00 0.00 H 0 +ATOM 588 N PHE A 76 26.344 13.981 35.257 1.00 0.00 N 0 +ATOM 589 CA PHE A 76 25.266 13.160 35.893 1.00 0.00 C 0 +ATOM 590 C PHE A 76 25.807 11.849 36.479 1.00 0.00 C 0 +ATOM 591 O PHE A 76 26.384 10.975 35.860 1.00 0.00 O 0 +ATOM 592 H PHE A 76 26.349 14.121 34.224 1.00 0.00 H 0 +ATOM 593 HA PHE A 76 24.861 13.853 36.726 1.00 0.00 H 0 +ATOM 594 CB PHE A 76 24.140 12.683 34.893 1.00 0.00 C 0 +ATOM 595 CD1 PHE A 76 23.094 14.942 34.326 1.00 0.00 C 0 +ATOM 596 CD2 PHE A 76 24.233 13.812 32.564 1.00 0.00 C 0 +ATOM 597 CE1 PHE A 76 22.932 16.014 33.459 1.00 0.00 C 0 +ATOM 598 CE2 PHE A 76 24.065 14.908 31.720 1.00 0.00 C 0 +ATOM 599 CG PHE A 76 23.814 13.817 33.909 1.00 0.00 C 0 +ATOM 600 CZ PHE A 76 23.467 16.036 32.187 1.00 0.00 C 0 +ATOM 601 HB2 PHE A 76 24.457 11.889 34.161 1.00 0.00 H 0 +ATOM 602 HB3 PHE A 76 23.238 12.356 35.380 1.00 0.00 H 0 +ATOM 603 HD1 PHE A 76 22.562 14.891 35.340 1.00 0.00 H 0 +ATOM 604 HD2 PHE A 76 24.764 12.883 32.250 1.00 0.00 H 0 +ATOM 605 HE1 PHE A 76 22.327 16.853 33.803 1.00 0.00 H 0 +ATOM 606 HE2 PHE A 76 24.756 14.963 30.912 1.00 0.00 H 0 +ATOM 607 HZ PHE A 76 23.559 17.067 31.681 1.00 0.00 H 0 +ATOM 608 N NME A 77 25.432 11.689 37.782 1.00 0.00 N 0 +ATOM 609 CH3 NME A 77 25.930 10.620 38.598 1.00 0.00 C 0 +ATOM 610 H NME A 77 24.925 12.388 38.305 1.00 0.00 H 0 +ATOM 611 H1 NME A 77 25.058 10.359 39.330 1.00 0.00 H 0 +ATOM 612 H2 NME A 77 26.231 9.711 37.989 1.00 0.00 H 0 +ATOM 613 H3 NME A 77 26.815 10.902 39.096 1.00 0.00 H 0 +TER 614 NME A 77 +HETATM 615 NA NA A 78 25.275 29.108 45.473 1.00 0.00 NA 0 +HETATM 616 NA NA A 79 39.099 16.812 47.929 1.00 0.00 NA 0 +HETATM 617 NA NA A 80 32.440 9.994 40.743 1.00 0.00 NA 0 +HETATM 618 NA NA A 81 18.779 49.555 31.130 1.00 0.00 NA 0 +HETATM 619 NA NA A 82 24.368 34.186 44.822 1.00 0.00 NA 0 +HETATM 620 NA NA A 83 25.043 6.839 32.164 1.00 0.00 NA 0 +HETATM 621 NA NA A 84 19.723 46.041 32.602 1.00 0.00 NA 0 +HETATM 622 NA NA A 85 29.570 52.374 46.632 1.00 0.00 NA 0 +HETATM 623 NA NA A 86 36.582 5.751 9.671 1.00 0.00 NA 0 +HETATM 624 NA NA A 87 33.523 26.789 14.244 1.00 0.00 NA 0 +HETATM 625 NA NA A 88 51.158 17.198 48.241 1.00 0.00 NA 0 +HETATM 626 NA NA A 89 41.685 0.372 30.924 1.00 0.00 NA 0 +HETATM 627 NA NA A 90 22.636 27.724 1.987 1.00 0.00 NA 0 +HETATM 628 NA NA A 91 30.674 4.822 9.732 1.00 0.00 NA 0 +HETATM 629 CL CL A 92 49.156 20.763 20.366 1.00 0.00 CL 0 +HETATM 630 CL CL A 93 25.802 49.500 42.979 1.00 0.00 CL 0 +HETATM 631 CL CL A 94 41.319 8.934 8.099 1.00 0.00 CL 0 +HETATM 632 CL CL A 95 42.018 15.465 34.458 1.00 0.00 CL 0 +HETATM 633 CL CL A 96 38.310 1.325 16.804 1.00 0.00 CL 0 +HETATM 634 CL CL A 97 19.601 14.319 46.065 1.00 0.00 CL 0 +HETATM 635 CL CL A 98 32.831 31.524 30.708 1.00 0.00 CL 0 +HETATM 636 CL CL A 99 38.398 12.328 42.169 1.00 0.00 CL 0 +HETATM 637 CL CL A 100 26.183 53.248 36.026 1.00 0.00 CL 0 +HETATM 638 CL CL A 101 26.516 31.844 9.644 1.00 0.00 CL 0 +HETATM 639 CL CL A 102 19.547 30.996 35.906 1.00 0.00 CL 0 +HETATM 640 CL CL A 103 18.446 43.766 28.712 1.00 0.00 CL 0 +HETATM 641 CL CL A 104 10.531 22.867 0.020 1.00 0.00 CL 0 +HETATM 642 CL CL A 105 37.343 26.268 52.940 1.00 0.00 CL 0 +HETATM 643 CL CL A 106 50.709 4.412 37.120 1.00 0.00 CL 0 +HETATM 644 CL CL A 107 20.087 31.868 26.404 1.00 0.00 CL 0 +HETATM 645 O HOH A 108 21.524 29.360 49.124 1.00 0.00 O 0 +HETATM 646 H1 HOH A 108 21.972 30.148 48.922 1.00 0.00 H 0 +HETATM 647 H2 HOH A 108 20.908 29.131 48.466 1.00 0.00 H 0 +HETATM 648 O HOH A 109 2.892 45.137 43.432 1.00 0.00 O 0 +HETATM 649 H1 HOH A 109 3.825 45.293 43.196 1.00 0.00 H 0 +HETATM 650 H2 HOH A 109 2.601 44.240 43.352 1.00 0.00 H 0 +HETATM 651 O HOH A 110 48.513 46.050 26.423 1.00 0.00 O 0 +HETATM 652 H1 HOH A 110 47.743 46.567 26.169 1.00 0.00 H 0 +HETATM 653 H2 HOH A 110 49.254 46.578 26.223 1.00 0.00 H 0 +HETATM 654 O HOH A 111 22.086 35.318 20.634 1.00 0.00 O 0 +HETATM 655 H1 HOH A 111 22.889 34.756 20.848 1.00 0.00 H 0 +HETATM 656 H2 HOH A 111 21.307 34.812 20.407 1.00 0.00 H 0 +HETATM 657 O HOH A 112 36.796 34.484 5.063 1.00 0.00 O 0 +HETATM 658 H1 HOH A 112 37.622 34.047 5.227 1.00 0.00 H 0 +HETATM 659 H2 HOH A 112 36.034 33.859 5.316 1.00 0.00 H 0 +HETATM 660 O HOH A 113 4.533 24.563 37.775 1.00 0.00 O 0 +HETATM 661 H1 HOH A 113 3.610 24.394 38.033 1.00 0.00 H 0 +HETATM 662 H2 HOH A 113 4.959 24.404 38.657 1.00 0.00 H 0 +HETATM 663 O HOH A 114 32.438 0.859 26.498 1.00 0.00 O 0 +HETATM 664 H1 HOH A 114 33.348 0.852 26.822 1.00 0.00 H 0 +HETATM 665 H2 HOH A 114 32.096 1.717 26.901 1.00 0.00 H 0 +HETATM 666 O HOH A 115 18.299 14.901 41.466 1.00 0.00 O 0 +HETATM 667 H1 HOH A 115 19.204 14.535 41.397 1.00 0.00 H 0 +HETATM 668 H2 HOH A 115 17.900 14.990 40.642 1.00 0.00 H 0 +HETATM 669 O HOH A 116 51.073 18.082 0.907 1.00 0.00 O 0 +HETATM 670 H1 HOH A 116 51.109 18.708 0.165 1.00 0.00 H 0 +HETATM 671 H2 HOH A 116 50.311 18.316 1.425 1.00 0.00 H 0 +HETATM 672 O HOH A 117 52.624 4.261 44.960 1.00 0.00 O 0 +HETATM 673 H1 HOH A 117 52.371 3.901 44.071 1.00 0.00 H 0 +HETATM 674 H2 HOH A 117 53.152 5.030 44.847 1.00 0.00 H 0 +HETATM 675 O HOH A 118 14.411 20.043 7.844 1.00 0.00 O 0 +HETATM 676 H1 HOH A 118 14.176 19.425 8.526 1.00 0.00 H 0 +HETATM 677 H2 HOH A 118 13.714 20.018 7.115 1.00 0.00 H 0 +HETATM 678 O HOH A 119 52.821 16.166 15.209 1.00 0.00 O 0 +HETATM 679 H1 HOH A 119 53.071 15.273 15.465 1.00 0.00 H 0 +HETATM 680 H2 HOH A 119 52.248 16.312 15.899 1.00 0.00 H 0 +HETATM 681 O HOH A 120 31.644 37.568 22.656 1.00 0.00 O 0 +HETATM 682 H1 HOH A 120 31.116 38.294 22.546 1.00 0.00 H 0 +HETATM 683 H2 HOH A 120 32.556 37.862 22.457 1.00 0.00 H 0 +HETATM 684 O HOH A 121 33.179 50.582 43.258 1.00 0.00 O 0 +HETATM 685 H1 HOH A 121 32.669 51.012 42.471 1.00 0.00 H 0 +HETATM 686 H2 HOH A 121 33.115 49.675 43.110 1.00 0.00 H 0 +HETATM 687 O HOH A 122 22.837 8.080 49.276 1.00 0.00 O 0 +HETATM 688 H1 HOH A 122 23.766 8.365 49.232 1.00 0.00 H 0 +HETATM 689 H2 HOH A 122 22.552 7.554 48.571 1.00 0.00 H 0 +HETATM 690 O HOH A 123 18.052 50.576 18.312 1.00 0.00 O 0 +HETATM 691 H1 HOH A 123 18.140 51.324 17.708 1.00 0.00 H 0 +HETATM 692 H2 HOH A 123 17.751 49.849 17.773 1.00 0.00 H 0 +HETATM 693 O HOH A 124 49.496 27.749 1.168 1.00 0.00 O 0 +HETATM 694 H1 HOH A 124 49.462 27.404 2.035 1.00 0.00 H 0 +HETATM 695 H2 HOH A 124 50.009 27.134 0.597 1.00 0.00 H 0 +HETATM 696 O HOH A 125 1.224 35.790 17.238 1.00 0.00 O 0 +HETATM 697 H1 HOH A 125 1.693 34.889 17.212 1.00 0.00 H 0 +HETATM 698 H2 HOH A 125 0.517 35.689 17.891 1.00 0.00 H 0 +HETATM 699 O HOH A 126 19.344 7.441 36.082 1.00 0.00 O 0 +HETATM 700 H1 HOH A 126 18.662 6.951 35.634 1.00 0.00 H 0 +HETATM 701 H2 HOH A 126 19.191 7.326 37.039 1.00 0.00 H 0 +HETATM 702 O HOH A 127 45.325 14.337 40.482 1.00 0.00 O 0 +HETATM 703 H1 HOH A 127 45.770 15.162 40.258 1.00 0.00 H 0 +HETATM 704 H2 HOH A 127 44.621 14.091 39.964 1.00 0.00 H 0 +HETATM 705 O HOH A 128 33.149 18.203 38.514 1.00 0.00 O 0 +HETATM 706 H1 HOH A 128 32.772 18.727 37.823 1.00 0.00 H 0 +HETATM 707 H2 HOH A 128 33.520 17.415 38.132 1.00 0.00 H 0 +HETATM 708 O HOH A 129 22.196 35.144 48.732 1.00 0.00 O 0 +HETATM 709 H1 HOH A 129 22.135 34.531 47.970 1.00 0.00 H 0 +HETATM 710 H2 HOH A 129 23.026 34.916 49.204 1.00 0.00 H 0 +HETATM 711 O HOH A 130 10.979 14.220 15.303 1.00 0.00 O 0 +HETATM 712 H1 HOH A 130 10.626 14.200 14.433 1.00 0.00 H 0 +HETATM 713 H2 HOH A 130 10.262 14.667 15.885 1.00 0.00 H 0 +HETATM 714 O HOH A 131 46.179 14.773 13.303 1.00 0.00 O 0 +HETATM 715 H1 HOH A 131 45.668 14.055 12.984 1.00 0.00 H 0 +HETATM 716 H2 HOH A 131 45.577 15.117 13.941 1.00 0.00 H 0 +HETATM 717 O HOH A 132 21.465 53.427 52.980 1.00 0.00 O 0 +HETATM 718 H1 HOH A 132 20.969 54.177 53.358 1.00 0.00 H 0 +HETATM 719 H2 HOH A 132 22.048 53.195 53.746 1.00 0.00 H 0 +HETATM 720 O HOH A 133 48.199 2.882 38.552 1.00 0.00 O 0 +HETATM 721 H1 HOH A 133 48.980 3.300 38.144 1.00 0.00 H 0 +HETATM 722 H2 HOH A 133 47.422 3.118 38.014 1.00 0.00 H 0 +HETATM 723 O HOH A 134 38.617 5.654 21.081 1.00 0.00 O 0 +HETATM 724 H1 HOH A 134 38.428 6.616 21.210 1.00 0.00 H 0 +HETATM 725 H2 HOH A 134 37.976 5.274 20.480 1.00 0.00 H 0 +HETATM 726 O HOH A 135 47.221 49.589 19.181 1.00 0.00 O 0 +HETATM 727 H1 HOH A 135 46.310 49.517 18.876 1.00 0.00 H 0 +HETATM 728 H2 HOH A 135 47.522 48.783 19.578 1.00 0.00 H 0 +HETATM 729 O HOH A 136 41.652 23.831 4.527 1.00 0.00 O 0 +HETATM 730 H1 HOH A 136 41.975 23.780 5.406 1.00 0.00 H 0 +HETATM 731 H2 HOH A 136 42.320 23.530 3.932 1.00 0.00 H 0 +HETATM 732 O HOH A 137 19.123 19.748 49.942 1.00 0.00 O 0 +HETATM 733 H1 HOH A 137 19.307 20.709 50.139 1.00 0.00 H 0 +HETATM 734 H2 HOH A 137 18.449 19.759 49.266 1.00 0.00 H 0 +HETATM 735 O HOH A 138 53.556 48.312 45.993 1.00 0.00 O 0 +HETATM 736 H1 HOH A 138 53.036 47.829 45.354 1.00 0.00 H 0 +HETATM 737 H2 HOH A 138 53.065 48.309 46.819 1.00 0.00 H 0 +HETATM 738 O HOH A 139 18.381 40.647 30.203 1.00 0.00 O 0 +HETATM 739 H1 HOH A 139 18.492 41.474 29.753 1.00 0.00 H 0 +HETATM 740 H2 HOH A 139 17.484 40.479 29.952 1.00 0.00 H 0 +HETATM 741 O HOH A 140 3.849 24.704 44.570 1.00 0.00 O 0 +HETATM 742 H1 HOH A 140 4.136 25.570 44.661 1.00 0.00 H 0 +HETATM 743 H2 HOH A 140 3.123 24.678 43.877 1.00 0.00 H 0 +HETATM 744 O HOH A 141 16.026 14.763 34.135 1.00 0.00 O 0 +HETATM 745 H1 HOH A 141 15.208 15.302 34.143 1.00 0.00 H 0 +HETATM 746 H2 HOH A 141 16.699 15.392 34.339 1.00 0.00 H 0 +HETATM 747 O HOH A 142 0.470 11.160 46.073 1.00 0.00 O 0 +HETATM 748 H1 HOH A 142 -0.066 10.924 45.330 1.00 0.00 H 0 +HETATM 749 H2 HOH A 142 0.117 10.542 46.727 1.00 0.00 H 0 +HETATM 750 O HOH A 143 26.270 33.812 3.104 1.00 0.00 O 0 +HETATM 751 H1 HOH A 143 25.658 33.188 2.648 1.00 0.00 H 0 +HETATM 752 H2 HOH A 143 25.820 34.651 3.064 1.00 0.00 H 0 +HETATM 753 O HOH A 144 48.353 50.501 31.740 1.00 0.00 O 0 +HETATM 754 H1 HOH A 144 49.251 50.056 31.943 1.00 0.00 H 0 +HETATM 755 H2 HOH A 144 48.721 51.425 31.730 1.00 0.00 H 0 +HETATM 756 O HOH A 145 8.248 35.025 19.036 1.00 0.00 O 0 +HETATM 757 H1 HOH A 145 8.406 35.267 18.165 1.00 0.00 H 0 +HETATM 758 H2 HOH A 145 8.651 34.125 19.127 1.00 0.00 H 0 +HETATM 759 O HOH A 146 13.347 38.303 14.009 1.00 0.00 O 0 +HETATM 760 H1 HOH A 146 13.330 39.105 13.467 1.00 0.00 H 0 +HETATM 761 H2 HOH A 146 13.587 38.447 14.987 1.00 0.00 H 0 +HETATM 762 O HOH A 147 31.879 21.842 47.803 1.00 0.00 O 0 +HETATM 763 H1 HOH A 147 32.484 22.364 48.382 1.00 0.00 H 0 +HETATM 764 H2 HOH A 147 32.099 20.960 47.847 1.00 0.00 H 0 +HETATM 765 O HOH A 148 33.315 36.495 36.491 1.00 0.00 O 0 +HETATM 766 H1 HOH A 148 33.555 35.545 36.465 1.00 0.00 H 0 +HETATM 767 H2 HOH A 148 32.634 36.531 35.817 1.00 0.00 H 0 +HETATM 768 O HOH A 149 49.155 1.718 35.106 1.00 0.00 O 0 +HETATM 769 H1 HOH A 149 49.930 2.134 35.545 1.00 0.00 H 0 +HETATM 770 H2 HOH A 149 49.292 0.677 35.009 1.00 0.00 H 0 +HETATM 771 O HOH A 150 45.241 27.385 27.953 1.00 0.00 O 0 +HETATM 772 H1 HOH A 150 45.905 26.715 27.878 1.00 0.00 H 0 +HETATM 773 H2 HOH A 150 45.065 27.804 27.110 1.00 0.00 H 0 +HETATM 774 O HOH A 151 18.782 41.365 17.495 1.00 0.00 O 0 +HETATM 775 H1 HOH A 151 18.140 41.607 18.202 1.00 0.00 H 0 +HETATM 776 H2 HOH A 151 19.007 40.420 17.677 1.00 0.00 H 0 +HETATM 777 O HOH A 152 7.145 20.070 33.745 1.00 0.00 O 0 +HETATM 778 H1 HOH A 152 6.434 20.680 33.391 1.00 0.00 H 0 +HETATM 779 H2 HOH A 152 7.807 20.094 33.075 1.00 0.00 H 0 +HETATM 780 O HOH A 153 50.213 16.152 31.905 1.00 0.00 O 0 +HETATM 781 H1 HOH A 153 51.210 16.330 31.751 1.00 0.00 H 0 +HETATM 782 H2 HOH A 153 50.326 15.402 32.461 1.00 0.00 H 0 +HETATM 783 O HOH A 154 24.882 28.102 15.828 1.00 0.00 O 0 +HETATM 784 H1 HOH A 154 25.756 27.819 15.695 1.00 0.00 H 0 +HETATM 785 H2 HOH A 154 24.477 28.139 14.985 1.00 0.00 H 0 +HETATM 786 O HOH A 155 19.501 52.060 50.872 1.00 0.00 O 0 +HETATM 787 H1 HOH A 155 19.340 52.692 50.159 1.00 0.00 H 0 +HETATM 788 H2 HOH A 155 19.913 52.473 51.652 1.00 0.00 H 0 +HETATM 789 O HOH A 156 4.263 41.923 18.567 1.00 0.00 O 0 +HETATM 790 H1 HOH A 156 3.695 41.349 19.068 1.00 0.00 H 0 +HETATM 791 H2 HOH A 156 3.888 42.003 17.684 1.00 0.00 H 0 +HETATM 792 O HOH A 157 10.939 44.324 42.860 1.00 0.00 O 0 +HETATM 793 H1 HOH A 157 10.431 43.477 42.986 1.00 0.00 H 0 +HETATM 794 H2 HOH A 157 11.483 44.198 41.983 1.00 0.00 H 0 +HETATM 795 O HOH A 158 8.636 47.229 4.854 1.00 0.00 O 0 +HETATM 796 H1 HOH A 158 7.913 47.224 4.169 1.00 0.00 H 0 +HETATM 797 H2 HOH A 158 8.529 46.445 5.377 1.00 0.00 H 0 +HETATM 798 O HOH A 159 48.347 7.370 19.985 1.00 0.00 O 0 +HETATM 799 H1 HOH A 159 49.054 7.344 20.653 1.00 0.00 H 0 +HETATM 800 H2 HOH A 159 47.916 6.533 19.979 1.00 0.00 H 0 +HETATM 801 O HOH A 160 27.991 38.015 34.551 1.00 0.00 O 0 +HETATM 802 H1 HOH A 160 28.365 37.142 34.389 1.00 0.00 H 0 +HETATM 803 H2 HOH A 160 28.307 38.144 35.467 1.00 0.00 H 0 +HETATM 804 O HOH A 161 1.975 23.728 4.766 1.00 0.00 O 0 +HETATM 805 H1 HOH A 161 1.040 23.888 4.439 1.00 0.00 H 0 +HETATM 806 H2 HOH A 161 2.509 23.347 4.069 1.00 0.00 H 0 +HETATM 807 O HOH A 162 0.835 20.674 49.272 1.00 0.00 O 0 +HETATM 808 H1 HOH A 162 0.479 19.965 49.805 1.00 0.00 H 0 +HETATM 809 H2 HOH A 162 1.584 21.000 49.822 1.00 0.00 H 0 +HETATM 810 O HOH A 163 26.570 5.692 25.515 1.00 0.00 O 0 +HETATM 811 H1 HOH A 163 25.969 6.304 25.874 1.00 0.00 H 0 +HETATM 812 H2 HOH A 163 27.442 5.852 25.895 1.00 0.00 H 0 +HETATM 813 O HOH A 164 22.007 26.260 12.615 1.00 0.00 O 0 +HETATM 814 H1 HOH A 164 21.539 25.666 13.223 1.00 0.00 H 0 +HETATM 815 H2 HOH A 164 21.375 26.115 11.832 1.00 0.00 H 0 +HETATM 816 O HOH A 165 46.847 41.570 13.379 1.00 0.00 O 0 +HETATM 817 H1 HOH A 165 47.379 41.507 12.575 1.00 0.00 H 0 +HETATM 818 H2 HOH A 165 46.689 40.719 13.705 1.00 0.00 H 0 +HETATM 819 O HOH A 166 51.530 10.365 19.354 1.00 0.00 O 0 +HETATM 820 H1 HOH A 166 51.346 9.699 18.700 1.00 0.00 H 0 +HETATM 821 H2 HOH A 166 50.750 10.700 19.735 1.00 0.00 H 0 +HETATM 822 O HOH A 167 51.297 29.135 14.560 1.00 0.00 O 0 +HETATM 823 H1 HOH A 167 50.713 29.055 15.333 1.00 0.00 H 0 +HETATM 824 H2 HOH A 167 51.173 30.012 14.297 1.00 0.00 H 0 +HETATM 825 O HOH A 168 30.708 31.179 11.798 1.00 0.00 O 0 +HETATM 826 H1 HOH A 168 30.008 31.698 12.205 1.00 0.00 H 0 +HETATM 827 H2 HOH A 168 30.412 30.816 10.956 1.00 0.00 H 0 +HETATM 828 O HOH A 169 45.554 48.248 23.094 1.00 0.00 O 0 +HETATM 829 H1 HOH A 169 45.216 49.024 23.481 1.00 0.00 H 0 +HETATM 830 H2 HOH A 169 46.501 48.454 22.999 1.00 0.00 H 0 +HETATM 831 O HOH A 170 3.027 17.895 44.064 1.00 0.00 O 0 +HETATM 832 H1 HOH A 170 3.085 17.705 45.020 1.00 0.00 H 0 +HETATM 833 H2 HOH A 170 3.765 18.500 43.970 1.00 0.00 H 0 +HETATM 834 O HOH A 171 30.077 14.281 12.820 1.00 0.00 O 0 +HETATM 835 H1 HOH A 171 30.712 13.746 12.329 1.00 0.00 H 0 +HETATM 836 H2 HOH A 171 29.600 14.759 12.138 1.00 0.00 H 0 +HETATM 837 O HOH A 172 43.851 17.249 44.079 1.00 0.00 O 0 +HETATM 838 H1 HOH A 172 43.442 18.107 44.100 1.00 0.00 H 0 +HETATM 839 H2 HOH A 172 44.813 17.231 43.761 1.00 0.00 H 0 +HETATM 840 O HOH A 173 51.546 42.263 51.697 1.00 0.00 O 0 +HETATM 841 H1 HOH A 173 52.237 42.745 52.176 1.00 0.00 H 0 +HETATM 842 H2 HOH A 173 50.873 42.913 51.412 1.00 0.00 H 0 +HETATM 843 O HOH A 174 26.890 13.074 0.266 1.00 0.00 O 0 +HETATM 844 H1 HOH A 174 27.248 13.637 0.937 1.00 0.00 H 0 +HETATM 845 H2 HOH A 174 26.598 13.586 -0.468 1.00 0.00 H 0 +HETATM 846 O HOH A 175 13.265 4.825 41.136 1.00 0.00 O 0 +HETATM 847 H1 HOH A 175 12.696 5.128 41.894 1.00 0.00 H 0 +HETATM 848 H2 HOH A 175 13.972 5.495 40.994 1.00 0.00 H 0 +HETATM 849 O HOH A 176 24.975 14.246 8.584 1.00 0.00 O 0 +HETATM 850 H1 HOH A 176 25.025 14.808 9.364 1.00 0.00 H 0 +HETATM 851 H2 HOH A 176 24.859 14.738 7.796 1.00 0.00 H 0 +HETATM 852 O HOH A 177 52.088 43.892 5.069 1.00 0.00 O 0 +HETATM 853 H1 HOH A 177 51.335 43.654 5.579 1.00 0.00 H 0 +HETATM 854 H2 HOH A 177 52.195 44.816 5.031 1.00 0.00 H 0 +HETATM 855 O HOH A 178 15.621 47.141 0.889 1.00 0.00 O 0 +HETATM 856 H1 HOH A 178 15.834 48.050 0.624 1.00 0.00 H 0 +HETATM 857 H2 HOH A 178 14.749 47.272 1.366 1.00 0.00 H 0 +HETATM 858 O HOH A 179 29.737 50.717 23.599 1.00 0.00 O 0 +HETATM 859 H1 HOH A 179 29.477 50.069 24.275 1.00 0.00 H 0 +HETATM 860 H2 HOH A 179 29.515 51.573 23.821 1.00 0.00 H 0 +HETATM 861 O HOH A 180 17.500 32.830 39.788 1.00 0.00 O 0 +HETATM 862 H1 HOH A 180 17.038 33.550 40.267 1.00 0.00 H 0 +HETATM 863 H2 HOH A 180 17.137 31.975 40.147 1.00 0.00 H 0 +HETATM 864 O HOH A 181 39.550 52.627 20.981 1.00 0.00 O 0 +HETATM 865 H1 HOH A 181 39.599 52.229 20.028 1.00 0.00 H 0 +HETATM 866 H2 HOH A 181 39.378 53.572 20.883 1.00 0.00 H 0 +HETATM 867 O HOH A 182 20.302 42.782 35.720 1.00 0.00 O 0 +HETATM 868 H1 HOH A 182 19.748 42.177 35.242 1.00 0.00 H 0 +HETATM 869 H2 HOH A 182 20.873 42.187 36.231 1.00 0.00 H 0 +HETATM 870 O HOH A 183 33.982 35.139 29.366 1.00 0.00 O 0 +HETATM 871 H1 HOH A 183 33.948 34.673 30.145 1.00 0.00 H 0 +HETATM 872 H2 HOH A 183 34.172 36.031 29.676 1.00 0.00 H 0 +HETATM 873 O HOH A 184 9.900 15.161 46.398 1.00 0.00 O 0 +HETATM 874 H1 HOH A 184 9.984 15.106 45.419 1.00 0.00 H 0 +HETATM 875 H2 HOH A 184 10.754 14.570 46.720 1.00 0.00 H 0 +HETATM 876 O HOH A 185 48.067 49.268 34.709 1.00 0.00 O 0 +HETATM 877 H1 HOH A 185 48.572 50.046 34.498 1.00 0.00 H 0 +HETATM 878 H2 HOH A 185 48.712 48.706 35.213 1.00 0.00 H 0 +HETATM 879 O HOH A 186 48.124 50.409 37.378 1.00 0.00 O 0 +HETATM 880 H1 HOH A 186 47.421 51.032 37.581 1.00 0.00 H 0 +HETATM 881 H2 HOH A 186 47.852 49.987 36.534 1.00 0.00 H 0 +HETATM 882 O HOH A 187 34.409 22.747 9.541 1.00 0.00 O 0 +HETATM 883 H1 HOH A 187 34.341 21.778 9.672 1.00 0.00 H 0 +HETATM 884 H2 HOH A 187 34.806 22.905 8.685 1.00 0.00 H 0 +HETATM 885 O HOH A 188 40.302 47.267 14.231 1.00 0.00 O 0 +HETATM 886 H1 HOH A 188 40.555 47.223 13.283 1.00 0.00 H 0 +HETATM 887 H2 HOH A 188 40.639 48.093 14.595 1.00 0.00 H 0 +HETATM 888 O HOH A 189 27.805 50.824 13.020 1.00 0.00 O 0 +HETATM 889 H1 HOH A 189 28.018 51.585 12.541 1.00 0.00 H 0 +HETATM 890 H2 HOH A 189 28.501 50.766 13.742 1.00 0.00 H 0 +HETATM 891 O HOH A 190 42.594 31.988 25.045 1.00 0.00 O 0 +HETATM 892 H1 HOH A 190 42.540 32.324 25.928 1.00 0.00 H 0 +HETATM 893 H2 HOH A 190 42.243 31.071 25.245 1.00 0.00 H 0 +HETATM 894 O HOH A 191 6.384 50.665 25.957 1.00 0.00 O 0 +HETATM 895 H1 HOH A 191 7.101 50.119 26.385 1.00 0.00 H 0 +HETATM 896 H2 HOH A 191 6.516 51.611 26.115 1.00 0.00 H 0 +HETATM 897 O HOH A 192 11.999 41.021 5.347 1.00 0.00 O 0 +HETATM 898 H1 HOH A 192 11.553 40.598 6.096 1.00 0.00 H 0 +HETATM 899 H2 HOH A 192 12.915 40.905 5.530 1.00 0.00 H 0 +HETATM 900 O HOH A 193 34.853 14.881 51.275 1.00 0.00 O 0 +HETATM 901 H1 HOH A 193 34.285 14.250 51.712 1.00 0.00 H 0 +HETATM 902 H2 HOH A 193 35.745 14.718 51.563 1.00 0.00 H 0 +HETATM 903 O HOH A 194 2.999 51.231 9.625 1.00 0.00 O 0 +HETATM 904 H1 HOH A 194 2.785 50.633 10.362 1.00 0.00 H 0 +HETATM 905 H2 HOH A 194 2.531 50.914 8.806 1.00 0.00 H 0 +HETATM 906 O HOH A 195 23.376 17.563 22.723 1.00 0.00 O 0 +HETATM 907 H1 HOH A 195 22.782 16.828 22.869 1.00 0.00 H 0 +HETATM 908 H2 HOH A 195 23.673 17.475 21.755 1.00 0.00 H 0 +HETATM 909 O HOH A 196 43.768 8.633 2.628 1.00 0.00 O 0 +HETATM 910 H1 HOH A 196 44.396 8.513 1.906 1.00 0.00 H 0 +HETATM 911 H2 HOH A 196 42.984 8.148 2.464 1.00 0.00 H 0 +HETATM 912 O HOH A 197 44.556 40.268 26.689 1.00 0.00 O 0 +HETATM 913 H1 HOH A 197 45.305 40.683 27.078 1.00 0.00 H 0 +HETATM 914 H2 HOH A 197 44.315 39.685 27.368 1.00 0.00 H 0 +HETATM 915 O HOH A 198 9.850 30.421 30.133 1.00 0.00 O 0 +HETATM 916 H1 HOH A 198 9.420 30.696 29.275 1.00 0.00 H 0 +HETATM 917 H2 HOH A 198 9.180 29.981 30.673 1.00 0.00 H 0 +HETATM 918 O HOH A 199 42.715 13.768 10.532 1.00 0.00 O 0 +HETATM 919 H1 HOH A 199 43.610 14.096 10.510 1.00 0.00 H 0 +HETATM 920 H2 HOH A 199 42.164 14.125 9.787 1.00 0.00 H 0 +HETATM 921 O HOH A 200 2.839 15.424 31.719 1.00 0.00 O 0 +HETATM 922 H1 HOH A 200 3.562 14.813 31.821 1.00 0.00 H 0 +HETATM 923 H2 HOH A 200 2.524 15.524 32.654 1.00 0.00 H 0 +HETATM 924 O HOH A 201 8.402 11.952 37.710 1.00 0.00 O 0 +HETATM 925 H1 HOH A 201 8.321 12.296 38.617 1.00 0.00 H 0 +HETATM 926 H2 HOH A 201 8.817 11.028 37.837 1.00 0.00 H 0 +HETATM 927 O HOH A 202 48.121 49.526 43.659 1.00 0.00 O 0 +HETATM 928 H1 HOH A 202 47.483 50.244 43.438 1.00 0.00 H 0 +HETATM 929 H2 HOH A 202 48.017 49.264 44.579 1.00 0.00 H 0 +HETATM 930 O HOH A 203 4.032 15.352 36.828 1.00 0.00 O 0 +HETATM 931 H1 HOH A 203 4.721 14.670 36.957 1.00 0.00 H 0 +HETATM 932 H2 HOH A 203 3.520 15.269 37.659 1.00 0.00 H 0 +HETATM 933 O HOH A 204 50.052 37.775 33.033 1.00 0.00 O 0 +HETATM 934 H1 HOH A 204 49.812 36.862 32.888 1.00 0.00 H 0 +HETATM 935 H2 HOH A 204 50.042 38.186 32.174 1.00 0.00 H 0 +HETATM 936 O HOH A 205 31.180 46.782 31.988 1.00 0.00 O 0 +HETATM 937 H1 HOH A 205 31.524 46.463 32.809 1.00 0.00 H 0 +HETATM 938 H2 HOH A 205 30.546 46.134 31.574 1.00 0.00 H 0 +HETATM 939 O HOH A 206 46.777 24.252 18.701 1.00 0.00 O 0 +HETATM 940 H1 HOH A 206 46.512 23.858 19.570 1.00 0.00 H 0 +HETATM 941 H2 HOH A 206 46.847 23.503 18.141 1.00 0.00 H 0 +HETATM 942 O HOH A 207 38.747 15.365 35.102 1.00 0.00 O 0 +HETATM 943 H1 HOH A 207 38.274 14.556 35.193 1.00 0.00 H 0 +HETATM 944 H2 HOH A 207 39.706 15.336 34.872 1.00 0.00 H 0 +HETATM 945 O HOH A 208 46.107 43.617 34.898 1.00 0.00 O 0 +HETATM 946 H1 HOH A 208 45.684 42.851 34.497 1.00 0.00 H 0 +HETATM 947 H2 HOH A 208 45.250 44.131 35.020 1.00 0.00 H 0 +HETATM 948 O HOH A 209 30.274 45.602 9.378 1.00 0.00 O 0 +HETATM 949 H1 HOH A 209 30.298 46.417 9.907 1.00 0.00 H 0 +HETATM 950 H2 HOH A 209 31.158 45.191 9.664 1.00 0.00 H 0 +HETATM 951 O HOH A 210 7.556 39.217 52.399 1.00 0.00 O 0 +HETATM 952 H1 HOH A 210 8.391 39.638 52.142 1.00 0.00 H 0 +HETATM 953 H2 HOH A 210 7.764 38.839 53.235 1.00 0.00 H 0 +HETATM 954 O HOH A 211 2.071 18.073 31.340 1.00 0.00 O 0 +HETATM 955 H1 HOH A 211 2.952 18.035 30.909 1.00 0.00 H 0 +HETATM 956 H2 HOH A 211 1.811 17.144 31.432 1.00 0.00 H 0 +HETATM 957 O HOH A 212 32.178 7.491 48.871 1.00 0.00 O 0 +HETATM 958 H1 HOH A 212 32.648 8.310 48.940 1.00 0.00 H 0 +HETATM 959 H2 HOH A 212 31.286 7.565 49.273 1.00 0.00 H 0 +HETATM 960 O HOH A 213 28.857 15.337 39.285 1.00 0.00 O 0 +HETATM 961 H1 HOH A 213 29.031 16.274 39.430 1.00 0.00 H 0 +HETATM 962 H2 HOH A 213 28.455 15.252 38.407 1.00 0.00 H 0 +HETATM 963 O HOH A 214 37.303 11.166 53.215 1.00 0.00 O 0 +HETATM 964 H1 HOH A 214 37.473 11.108 52.335 1.00 0.00 H 0 +HETATM 965 H2 HOH A 214 36.714 10.449 53.372 1.00 0.00 H 0 +HETATM 966 O HOH A 215 31.089 36.466 40.175 1.00 0.00 O 0 +HETATM 967 H1 HOH A 215 30.572 37.283 40.272 1.00 0.00 H 0 +HETATM 968 H2 HOH A 215 31.941 36.772 39.922 1.00 0.00 H 0 +HETATM 969 O HOH A 216 8.087 4.838 18.718 1.00 0.00 O 0 +HETATM 970 H1 HOH A 216 7.949 4.038 18.217 1.00 0.00 H 0 +HETATM 971 H2 HOH A 216 7.274 5.374 18.706 1.00 0.00 H 0 +HETATM 972 O HOH A 217 20.307 44.899 10.855 1.00 0.00 O 0 +HETATM 973 H1 HOH A 217 19.406 44.799 10.727 1.00 0.00 H 0 +HETATM 974 H2 HOH A 217 20.494 45.020 11.767 1.00 0.00 H 0 +HETATM 975 O HOH A 218 16.241 49.280 41.463 1.00 0.00 O 0 +HETATM 976 H1 HOH A 218 17.099 48.894 41.165 1.00 0.00 H 0 +HETATM 977 H2 HOH A 218 16.558 49.790 42.213 1.00 0.00 H 0 +HETATM 978 O HOH A 219 50.931 36.409 21.723 1.00 0.00 O 0 +HETATM 979 H1 HOH A 219 50.971 35.428 22.029 1.00 0.00 H 0 +HETATM 980 H2 HOH A 219 51.793 36.517 21.306 1.00 0.00 H 0 +HETATM 981 O HOH A 220 3.716 28.723 11.384 1.00 0.00 O 0 +HETATM 982 H1 HOH A 220 4.050 29.388 11.978 1.00 0.00 H 0 +HETATM 983 H2 HOH A 220 4.311 28.008 11.538 1.00 0.00 H 0 +HETATM 984 O HOH A 221 22.561 26.429 41.532 1.00 0.00 O 0 +HETATM 985 H1 HOH A 221 21.848 26.067 40.979 1.00 0.00 H 0 +HETATM 986 H2 HOH A 221 22.192 26.406 42.446 1.00 0.00 H 0 +HETATM 987 O HOH A 222 43.284 35.229 7.725 1.00 0.00 O 0 +HETATM 988 H1 HOH A 222 43.104 35.323 6.836 1.00 0.00 H 0 +HETATM 989 H2 HOH A 222 43.196 36.117 8.140 1.00 0.00 H 0 +HETATM 990 O HOH A 223 44.733 38.712 41.058 1.00 0.00 O 0 +HETATM 991 H1 HOH A 223 45.312 38.874 40.334 1.00 0.00 H 0 +HETATM 992 H2 HOH A 223 44.429 39.570 41.363 1.00 0.00 H 0 +HETATM 993 O HOH A 224 41.199 12.752 22.655 1.00 0.00 O 0 +HETATM 994 H1 HOH A 224 40.742 13.559 23.064 1.00 0.00 H 0 +HETATM 995 H2 HOH A 224 41.156 12.917 21.694 1.00 0.00 H 0 +HETATM 996 O HOH A 225 12.466 16.628 21.761 1.00 0.00 O 0 +HETATM 997 H1 HOH A 225 11.789 16.745 22.519 1.00 0.00 H 0 +HETATM 998 H2 HOH A 225 12.161 16.141 20.945 1.00 0.00 H 0 +HETATM 999 O HOH A 226 12.767 39.959 39.927 1.00 0.00 O 0 +HETATM 1000 H1 HOH A 226 12.490 39.287 39.257 1.00 0.00 H 0 +HETATM 1001 H2 HOH A 226 12.083 40.624 39.921 1.00 0.00 H 0 +HETATM 1002 O HOH A 227 10.916 29.185 33.747 1.00 0.00 O 0 +HETATM 1003 H1 HOH A 227 10.745 30.124 33.793 1.00 0.00 H 0 +HETATM 1004 H2 HOH A 227 10.530 28.864 34.611 1.00 0.00 H 0 +HETATM 1005 O HOH A 228 36.301 52.328 30.560 1.00 0.00 O 0 +HETATM 1006 H1 HOH A 228 35.610 52.791 31.106 1.00 0.00 H 0 +HETATM 1007 H2 HOH A 228 36.135 51.382 30.473 1.00 0.00 H 0 +HETATM 1008 O HOH A 229 16.138 1.469 43.932 1.00 0.00 O 0 +HETATM 1009 H1 HOH A 229 16.866 1.091 43.436 1.00 0.00 H 0 +HETATM 1010 H2 HOH A 229 15.372 1.524 43.312 1.00 0.00 H 0 +HETATM 1011 O HOH A 230 52.870 24.217 5.101 1.00 0.00 O 0 +HETATM 1012 H1 HOH A 230 53.136 23.506 5.701 1.00 0.00 H 0 +HETATM 1013 H2 HOH A 230 52.741 25.069 5.585 1.00 0.00 H 0 +HETATM 1014 O HOH A 231 38.436 10.138 39.819 1.00 0.00 O 0 +HETATM 1015 H1 HOH A 231 38.242 10.753 40.505 1.00 0.00 H 0 +HETATM 1016 H2 HOH A 231 38.196 9.313 40.228 1.00 0.00 H 0 +HETATM 1017 O HOH A 232 17.677 6.297 47.305 1.00 0.00 O 0 +HETATM 1018 H1 HOH A 232 17.870 6.952 48.001 1.00 0.00 H 0 +HETATM 1019 H2 HOH A 232 17.299 5.525 47.802 1.00 0.00 H 0 +HETATM 1020 O HOH A 233 2.226 15.310 38.817 1.00 0.00 O 0 +HETATM 1021 H1 HOH A 233 2.340 15.297 39.745 1.00 0.00 H 0 +HETATM 1022 H2 HOH A 233 1.984 16.160 38.477 1.00 0.00 H 0 +HETATM 1023 O HOH A 234 19.949 35.114 15.672 1.00 0.00 O 0 +HETATM 1024 H1 HOH A 234 19.831 35.042 16.578 1.00 0.00 H 0 +HETATM 1025 H2 HOH A 234 20.672 35.713 15.588 1.00 0.00 H 0 +HETATM 1026 O HOH A 235 28.511 29.714 3.610 1.00 0.00 O 0 +HETATM 1027 H1 HOH A 235 27.652 29.272 3.814 1.00 0.00 H 0 +HETATM 1028 H2 HOH A 235 28.372 30.452 3.014 1.00 0.00 H 0 +HETATM 1029 O HOH A 236 52.020 40.502 13.328 1.00 0.00 O 0 +HETATM 1030 H1 HOH A 236 51.652 40.678 12.411 1.00 0.00 H 0 +HETATM 1031 H2 HOH A 236 51.981 39.564 13.337 1.00 0.00 H 0 +HETATM 1032 O HOH A 237 39.076 20.188 27.326 1.00 0.00 O 0 +HETATM 1033 H1 HOH A 237 38.269 19.895 27.721 1.00 0.00 H 0 +HETATM 1034 H2 HOH A 237 39.707 19.498 27.316 1.00 0.00 H 0 +HETATM 1035 O HOH A 238 51.786 2.863 4.524 1.00 0.00 O 0 +HETATM 1036 H1 HOH A 238 51.938 1.982 5.005 1.00 0.00 H 0 +HETATM 1037 H2 HOH A 238 51.724 2.523 3.635 1.00 0.00 H 0 +HETATM 1038 O HOH A 239 20.922 28.697 16.746 1.00 0.00 O 0 +HETATM 1039 H1 HOH A 239 21.711 28.197 17.072 1.00 0.00 H 0 +HETATM 1040 H2 HOH A 239 21.136 29.120 15.982 1.00 0.00 H 0 +HETATM 1041 O HOH A 240 40.614 25.758 8.229 1.00 0.00 O 0 +HETATM 1042 H1 HOH A 240 40.553 26.648 8.688 1.00 0.00 H 0 +HETATM 1043 H2 HOH A 240 40.842 26.100 7.360 1.00 0.00 H 0 +HETATM 1044 O HOH A 241 32.500 29.650 51.248 1.00 0.00 O 0 +HETATM 1045 H1 HOH A 241 33.051 28.859 51.076 1.00 0.00 H 0 +HETATM 1046 H2 HOH A 241 32.396 30.049 50.393 1.00 0.00 H 0 +HETATM 1047 O HOH A 242 7.917 6.680 46.209 1.00 0.00 O 0 +HETATM 1048 H1 HOH A 242 7.881 7.326 45.469 1.00 0.00 H 0 +HETATM 1049 H2 HOH A 242 7.520 5.916 45.827 1.00 0.00 H 0 +HETATM 1050 O HOH A 243 5.059 28.996 51.098 1.00 0.00 O 0 +HETATM 1051 H1 HOH A 243 6.003 28.925 51.276 1.00 0.00 H 0 +HETATM 1052 H2 HOH A 243 4.994 29.634 50.373 1.00 0.00 H 0 +HETATM 1053 O HOH A 244 43.943 34.499 12.545 1.00 0.00 O 0 +HETATM 1054 H1 HOH A 244 43.004 34.261 12.642 1.00 0.00 H 0 +HETATM 1055 H2 HOH A 244 43.960 35.460 12.424 1.00 0.00 H 0 +HETATM 1056 O HOH A 245 23.082 39.942 40.396 1.00 0.00 O 0 +HETATM 1057 H1 HOH A 245 23.012 39.538 39.535 1.00 0.00 H 0 +HETATM 1058 H2 HOH A 245 23.953 39.686 40.703 1.00 0.00 H 0 +HETATM 1059 O HOH A 246 10.327 8.517 30.637 1.00 0.00 O 0 +HETATM 1060 H1 HOH A 246 9.369 8.742 30.839 1.00 0.00 H 0 +HETATM 1061 H2 HOH A 246 10.872 9.259 30.905 1.00 0.00 H 0 +HETATM 1062 O HOH A 247 22.525 10.267 45.813 1.00 0.00 O 0 +HETATM 1063 H1 HOH A 247 21.926 10.253 45.070 1.00 0.00 H 0 +HETATM 1064 H2 HOH A 247 21.915 10.439 46.553 1.00 0.00 H 0 +HETATM 1065 O HOH A 248 22.940 31.744 33.234 1.00 0.00 O 0 +HETATM 1066 H1 HOH A 248 22.424 31.190 32.579 1.00 0.00 H 0 +HETATM 1067 H2 HOH A 248 22.950 31.167 34.046 1.00 0.00 H 0 +HETATM 1068 O HOH A 249 32.085 51.296 28.300 1.00 0.00 O 0 +HETATM 1069 H1 HOH A 249 31.632 51.843 27.684 1.00 0.00 H 0 +HETATM 1070 H2 HOH A 249 32.969 51.217 27.938 1.00 0.00 H 0 +HETATM 1071 O HOH A 250 33.229 13.880 15.498 1.00 0.00 O 0 +HETATM 1072 H1 HOH A 250 33.984 14.426 15.366 1.00 0.00 H 0 +HETATM 1073 H2 HOH A 250 32.465 14.508 15.358 1.00 0.00 H 0 +HETATM 1074 O HOH A 251 19.218 2.813 45.771 1.00 0.00 O 0 +HETATM 1075 H1 HOH A 251 18.229 2.990 45.876 1.00 0.00 H 0 +HETATM 1076 H2 HOH A 251 19.434 2.759 44.836 1.00 0.00 H 0 +HETATM 1077 O HOH A 252 7.920 21.925 38.773 1.00 0.00 O 0 +HETATM 1078 H1 HOH A 252 8.501 21.978 39.547 1.00 0.00 H 0 +HETATM 1079 H2 HOH A 252 8.287 22.502 38.025 1.00 0.00 H 0 +HETATM 1080 O HOH A 253 33.646 51.604 25.228 1.00 0.00 O 0 +HETATM 1081 H1 HOH A 253 34.170 51.336 26.043 1.00 0.00 H 0 +HETATM 1082 H2 HOH A 253 34.249 51.764 24.505 1.00 0.00 H 0 +HETATM 1083 O HOH A 254 37.147 21.548 13.341 1.00 0.00 O 0 +HETATM 1084 H1 HOH A 254 36.988 21.372 12.373 1.00 0.00 H 0 +HETATM 1085 H2 HOH A 254 38.032 21.288 13.534 1.00 0.00 H 0 +HETATM 1086 O HOH A 255 43.457 21.934 52.586 1.00 0.00 O 0 +HETATM 1087 H1 HOH A 255 42.606 22.150 52.971 1.00 0.00 H 0 +HETATM 1088 H2 HOH A 255 43.504 21.011 52.760 1.00 0.00 H 0 +HETATM 1089 O HOH A 256 6.237 2.297 43.046 1.00 0.00 O 0 +HETATM 1090 H1 HOH A 256 5.360 2.717 43.337 1.00 0.00 H 0 +HETATM 1091 H2 HOH A 256 6.508 1.776 43.809 1.00 0.00 H 0 +HETATM 1092 O HOH A 257 48.819 38.954 16.303 1.00 0.00 O 0 +HETATM 1093 H1 HOH A 257 49.649 39.331 16.098 1.00 0.00 H 0 +HETATM 1094 H2 HOH A 257 48.207 39.517 15.776 1.00 0.00 H 0 +HETATM 1095 O HOH A 258 32.143 11.377 34.149 1.00 0.00 O 0 +HETATM 1096 H1 HOH A 258 31.338 11.671 33.617 1.00 0.00 H 0 +HETATM 1097 H2 HOH A 258 31.729 10.816 34.774 1.00 0.00 H 0 +HETATM 1098 O HOH A 259 34.073 19.541 46.470 1.00 0.00 O 0 +HETATM 1099 H1 HOH A 259 34.666 18.914 46.684 1.00 0.00 H 0 +HETATM 1100 H2 HOH A 259 33.219 19.238 46.857 1.00 0.00 H 0 +HETATM 1101 O HOH A 260 47.382 6.044 26.339 1.00 0.00 O 0 +HETATM 1102 H1 HOH A 260 47.737 6.892 26.465 1.00 0.00 H 0 +HETATM 1103 H2 HOH A 260 47.314 5.929 25.413 1.00 0.00 H 0 +HETATM 1104 O HOH A 261 18.602 16.703 15.580 1.00 0.00 O 0 +HETATM 1105 H1 HOH A 261 17.666 16.828 15.478 1.00 0.00 H 0 +HETATM 1106 H2 HOH A 261 18.822 15.749 15.717 1.00 0.00 H 0 +HETATM 1107 O HOH A 262 25.102 17.433 14.476 1.00 0.00 O 0 +HETATM 1108 H1 HOH A 262 24.598 17.883 13.724 1.00 0.00 H 0 +HETATM 1109 H2 HOH A 262 24.405 17.234 15.140 1.00 0.00 H 0 +HETATM 1110 O HOH A 263 7.082 23.503 16.845 1.00 0.00 O 0 +HETATM 1111 H1 HOH A 263 7.467 23.250 16.004 1.00 0.00 H 0 +HETATM 1112 H2 HOH A 263 6.461 24.213 16.612 1.00 0.00 H 0 +HETATM 1113 O HOH A 264 23.935 51.014 6.426 1.00 0.00 O 0 +HETATM 1114 H1 HOH A 264 23.160 51.413 6.796 1.00 0.00 H 0 +HETATM 1115 H2 HOH A 264 23.588 50.238 6.042 1.00 0.00 H 0 +HETATM 1116 O HOH A 265 16.000 2.860 34.741 1.00 0.00 O 0 +HETATM 1117 H1 HOH A 265 15.783 2.704 35.714 1.00 0.00 H 0 +HETATM 1118 H2 HOH A 265 15.150 2.940 34.310 1.00 0.00 H 0 +HETATM 1119 O HOH A 266 16.699 36.228 48.341 1.00 0.00 O 0 +HETATM 1120 H1 HOH A 266 16.753 36.690 49.140 1.00 0.00 H 0 +HETATM 1121 H2 HOH A 266 15.764 36.099 48.147 1.00 0.00 H 0 +HETATM 1122 O HOH A 267 32.218 38.833 53.504 1.00 0.00 O 0 +HETATM 1123 H1 HOH A 267 32.814 39.567 53.459 1.00 0.00 H 0 +HETATM 1124 H2 HOH A 267 32.857 38.046 53.263 1.00 0.00 H 0 +HETATM 1125 O HOH A 268 7.671 19.823 36.516 1.00 0.00 O 0 +HETATM 1126 H1 HOH A 268 8.330 20.452 36.887 1.00 0.00 H 0 +HETATM 1127 H2 HOH A 268 7.495 20.000 35.581 1.00 0.00 H 0 +HETATM 1128 O HOH A 269 14.313 28.522 23.415 1.00 0.00 O 0 +HETATM 1129 H1 HOH A 269 14.785 28.793 24.210 1.00 0.00 H 0 +HETATM 1130 H2 HOH A 269 13.866 27.703 23.627 1.00 0.00 H 0 +HETATM 1131 O HOH A 270 20.427 52.479 13.965 1.00 0.00 O 0 +HETATM 1132 H1 HOH A 270 20.162 52.716 14.857 1.00 0.00 H 0 +HETATM 1133 H2 HOH A 270 21.314 52.068 14.034 1.00 0.00 H 0 +HETATM 1134 O HOH A 271 35.217 27.648 15.556 1.00 0.00 O 0 +HETATM 1135 H1 HOH A 271 35.957 28.073 15.063 1.00 0.00 H 0 +HETATM 1136 H2 HOH A 271 34.749 28.361 15.944 1.00 0.00 H 0 +HETATM 1137 O HOH A 272 25.162 18.690 7.907 1.00 0.00 O 0 +HETATM 1138 H1 HOH A 272 25.593 19.446 7.437 1.00 0.00 H 0 +HETATM 1139 H2 HOH A 272 25.763 18.540 8.582 1.00 0.00 H 0 +HETATM 1140 O HOH A 273 46.987 34.277 0.170 1.00 0.00 O 0 +HETATM 1141 H1 HOH A 273 47.309 33.358 0.172 1.00 0.00 H 0 +HETATM 1142 H2 HOH A 273 46.203 34.256 0.716 1.00 0.00 H 0 +HETATM 1143 O HOH A 274 41.149 7.867 3.332 1.00 0.00 O 0 +HETATM 1144 H1 HOH A 274 40.786 8.563 3.909 1.00 0.00 H 0 +HETATM 1145 H2 HOH A 274 40.435 7.733 2.765 1.00 0.00 H 0 +HETATM 1146 O HOH A 275 50.542 49.234 42.089 1.00 0.00 O 0 +HETATM 1147 H1 HOH A 275 50.291 48.384 41.653 1.00 0.00 H 0 +HETATM 1148 H2 HOH A 275 49.759 49.390 42.622 1.00 0.00 H 0 +HETATM 1149 O HOH A 276 39.078 14.602 47.175 1.00 0.00 O 0 +HETATM 1150 H1 HOH A 276 38.212 14.325 46.905 1.00 0.00 H 0 +HETATM 1151 H2 HOH A 276 39.724 14.579 46.425 1.00 0.00 H 0 +HETATM 1152 O HOH A 277 48.862 38.460 10.736 1.00 0.00 O 0 +HETATM 1153 H1 HOH A 277 48.596 37.991 9.886 1.00 0.00 H 0 +HETATM 1154 H2 HOH A 277 49.493 39.226 10.600 1.00 0.00 H 0 +HETATM 1155 O HOH A 278 11.187 20.695 36.716 1.00 0.00 O 0 +HETATM 1156 H1 HOH A 278 11.461 20.225 37.517 1.00 0.00 H 0 +HETATM 1157 H2 HOH A 278 10.897 20.060 36.088 1.00 0.00 H 0 +HETATM 1158 O HOH A 279 41.861 45.276 7.952 1.00 0.00 O 0 +HETATM 1159 H1 HOH A 279 41.351 45.633 7.206 1.00 0.00 H 0 +HETATM 1160 H2 HOH A 279 41.239 44.742 8.471 1.00 0.00 H 0 +HETATM 1161 O HOH A 280 28.191 9.699 49.734 1.00 0.00 O 0 +HETATM 1162 H1 HOH A 280 28.765 8.948 49.886 1.00 0.00 H 0 +HETATM 1163 H2 HOH A 280 28.448 10.178 49.008 1.00 0.00 H 0 +HETATM 1164 O HOH A 281 8.776 16.280 23.127 1.00 0.00 O 0 +HETATM 1165 H1 HOH A 281 8.592 16.399 24.068 1.00 0.00 H 0 +HETATM 1166 H2 HOH A 281 9.396 15.521 23.081 1.00 0.00 H 0 +HETATM 1167 O HOH A 282 21.197 17.564 45.771 1.00 0.00 O 0 +HETATM 1168 H1 HOH A 282 21.541 17.854 44.905 1.00 0.00 H 0 +HETATM 1169 H2 HOH A 282 20.231 17.453 45.733 1.00 0.00 H 0 +HETATM 1170 O HOH A 283 47.185 2.541 15.208 1.00 0.00 O 0 +HETATM 1171 H1 HOH A 283 48.035 2.933 15.435 1.00 0.00 H 0 +HETATM 1172 H2 HOH A 283 47.288 2.149 14.338 1.00 0.00 H 0 +HETATM 1173 O HOH A 284 21.198 34.425 46.355 1.00 0.00 O 0 +HETATM 1174 H1 HOH A 284 20.422 34.982 46.512 1.00 0.00 H 0 +HETATM 1175 H2 HOH A 284 21.788 34.780 45.679 1.00 0.00 H 0 +HETATM 1176 O HOH A 285 31.178 29.225 17.205 1.00 0.00 O 0 +HETATM 1177 H1 HOH A 285 31.122 29.173 18.193 1.00 0.00 H 0 +HETATM 1178 H2 HOH A 285 30.978 28.312 16.880 1.00 0.00 H 0 +HETATM 1179 O HOH A 286 3.694 8.829 2.720 1.00 0.00 O 0 +HETATM 1180 H1 HOH A 286 3.423 8.770 1.758 1.00 0.00 H 0 +HETATM 1181 H2 HOH A 286 4.448 8.248 2.818 1.00 0.00 H 0 +HETATM 1182 O HOH A 287 30.768 5.111 30.972 1.00 0.00 O 0 +HETATM 1183 H1 HOH A 287 31.447 4.430 31.266 1.00 0.00 H 0 +HETATM 1184 H2 HOH A 287 31.149 5.501 30.146 1.00 0.00 H 0 +HETATM 1185 O HOH A 288 40.687 25.602 32.781 1.00 0.00 O 0 +HETATM 1186 H1 HOH A 288 40.883 24.888 33.393 1.00 0.00 H 0 +HETATM 1187 H2 HOH A 288 40.309 25.161 31.950 1.00 0.00 H 0 +HETATM 1188 O HOH A 289 43.017 24.190 44.615 1.00 0.00 O 0 +HETATM 1189 H1 HOH A 289 43.911 24.595 44.283 1.00 0.00 H 0 +HETATM 1190 H2 HOH A 289 43.063 24.453 45.572 1.00 0.00 H 0 +HETATM 1191 O HOH A 290 -0.246 21.318 40.847 1.00 0.00 O 0 +HETATM 1192 H1 HOH A 290 0.120 21.951 40.255 1.00 0.00 H 0 +HETATM 1193 H2 HOH A 290 0.474 20.785 41.054 1.00 0.00 H 0 +HETATM 1194 O HOH A 291 0.206 27.234 34.448 1.00 0.00 O 0 +HETATM 1195 H1 HOH A 291 0.171 27.502 33.517 1.00 0.00 H 0 +HETATM 1196 H2 HOH A 291 -0.248 26.424 34.443 1.00 0.00 H 0 +HETATM 1197 O HOH A 292 24.435 22.875 49.041 1.00 0.00 O 0 +HETATM 1198 H1 HOH A 292 25.228 23.467 49.116 1.00 0.00 H 0 +HETATM 1199 H2 HOH A 292 24.446 22.277 48.259 1.00 0.00 H 0 +HETATM 1200 O HOH A 293 10.365 3.827 20.284 1.00 0.00 O 0 +HETATM 1201 H1 HOH A 293 11.126 3.434 19.791 1.00 0.00 H 0 +HETATM 1202 H2 HOH A 293 9.908 4.370 19.683 1.00 0.00 H 0 +HETATM 1203 O HOH A 294 1.412 37.643 34.721 1.00 0.00 O 0 +HETATM 1204 H1 HOH A 294 1.271 36.859 35.281 1.00 0.00 H 0 +HETATM 1205 H2 HOH A 294 0.596 37.834 34.256 1.00 0.00 H 0 +HETATM 1206 O HOH A 295 30.642 21.680 10.584 1.00 0.00 O 0 +HETATM 1207 H1 HOH A 295 30.417 20.912 10.036 1.00 0.00 H 0 +HETATM 1208 H2 HOH A 295 30.061 21.677 11.329 1.00 0.00 H 0 +HETATM 1209 O HOH A 296 15.516 36.791 15.816 1.00 0.00 O 0 +HETATM 1210 H1 HOH A 296 16.277 36.282 15.436 1.00 0.00 H 0 +HETATM 1211 H2 HOH A 296 14.705 36.357 15.512 1.00 0.00 H 0 +HETATM 1212 O HOH A 297 27.512 19.164 13.138 1.00 0.00 O 0 +HETATM 1213 H1 HOH A 297 26.670 19.607 13.307 1.00 0.00 H 0 +HETATM 1214 H2 HOH A 297 27.800 18.597 13.881 1.00 0.00 H 0 +HETATM 1215 O HOH A 298 48.693 47.418 20.352 1.00 0.00 O 0 +HETATM 1216 H1 HOH A 298 48.746 46.877 19.657 1.00 0.00 H 0 +HETATM 1217 H2 HOH A 298 48.505 46.828 21.108 1.00 0.00 H 0 +HETATM 1218 O HOH A 299 50.520 14.835 18.958 1.00 0.00 O 0 +HETATM 1219 H1 HOH A 299 50.344 15.239 19.812 1.00 0.00 H 0 +HETATM 1220 H2 HOH A 299 50.755 15.617 18.473 1.00 0.00 H 0 +HETATM 1221 O HOH A 300 4.938 43.338 40.278 1.00 0.00 O 0 +HETATM 1222 H1 HOH A 300 5.026 43.478 39.311 1.00 0.00 H 0 +HETATM 1223 H2 HOH A 300 5.291 44.128 40.770 1.00 0.00 H 0 +HETATM 1224 O HOH A 301 50.161 16.882 12.703 1.00 0.00 O 0 +HETATM 1225 H1 HOH A 301 50.986 17.422 12.491 1.00 0.00 H 0 +HETATM 1226 H2 HOH A 301 50.582 16.318 13.335 1.00 0.00 H 0 +HETATM 1227 O HOH A 302 8.687 22.563 19.174 1.00 0.00 O 0 +HETATM 1228 H1 HOH A 302 8.586 22.938 18.341 1.00 0.00 H 0 +HETATM 1229 H2 HOH A 302 7.837 22.732 19.524 1.00 0.00 H 0 +HETATM 1230 O HOH A 303 38.169 24.515 8.695 1.00 0.00 O 0 +HETATM 1231 H1 HOH A 303 37.565 25.273 8.729 1.00 0.00 H 0 +HETATM 1232 H2 HOH A 303 39.056 24.775 8.423 1.00 0.00 H 0 +HETATM 1233 O HOH A 304 24.938 1.765 22.206 1.00 0.00 O 0 +HETATM 1234 H1 HOH A 304 24.707 2.328 22.959 1.00 0.00 H 0 +HETATM 1235 H2 HOH A 304 24.683 2.330 21.449 1.00 0.00 H 0 +HETATM 1236 O HOH A 305 4.441 36.877 37.471 1.00 0.00 O 0 +HETATM 1237 H1 HOH A 305 5.354 37.109 37.527 1.00 0.00 H 0 +HETATM 1238 H2 HOH A 305 3.889 37.672 37.462 1.00 0.00 H 0 +HETATM 1239 O HOH A 306 2.629 36.806 25.713 1.00 0.00 O 0 +HETATM 1240 H1 HOH A 306 1.939 36.679 25.090 1.00 0.00 H 0 +HETATM 1241 H2 HOH A 306 2.577 37.774 25.890 1.00 0.00 H 0 +HETATM 1242 O HOH A 307 21.828 52.025 8.765 1.00 0.00 O 0 +HETATM 1243 H1 HOH A 307 20.888 52.041 8.978 1.00 0.00 H 0 +HETATM 1244 H2 HOH A 307 22.087 52.918 8.866 1.00 0.00 H 0 +HETATM 1245 O HOH A 308 29.111 28.843 38.011 1.00 0.00 O 0 +HETATM 1246 H1 HOH A 308 29.839 28.289 38.398 1.00 0.00 H 0 +HETATM 1247 H2 HOH A 308 29.373 29.793 38.197 1.00 0.00 H 0 +HETATM 1248 O HOH A 309 12.320 42.854 50.426 1.00 0.00 O 0 +HETATM 1249 H1 HOH A 309 12.243 41.866 50.472 1.00 0.00 H 0 +HETATM 1250 H2 HOH A 309 13.200 43.128 50.430 1.00 0.00 H 0 +HETATM 1251 O HOH A 310 46.355 38.988 11.896 1.00 0.00 O 0 +HETATM 1252 H1 HOH A 310 47.240 38.884 11.487 1.00 0.00 H 0 +HETATM 1253 H2 HOH A 310 46.349 38.351 12.557 1.00 0.00 H 0 +HETATM 1254 O HOH A 311 22.152 50.778 40.013 1.00 0.00 O 0 +HETATM 1255 H1 HOH A 311 22.952 51.152 40.408 1.00 0.00 H 0 +HETATM 1256 H2 HOH A 311 22.237 50.931 39.074 1.00 0.00 H 0 +HETATM 1257 O HOH A 312 3.984 33.403 46.393 1.00 0.00 O 0 +HETATM 1258 H1 HOH A 312 4.375 33.644 47.217 1.00 0.00 H 0 +HETATM 1259 H2 HOH A 312 3.397 32.643 46.435 1.00 0.00 H 0 +HETATM 1260 O HOH A 313 52.545 3.718 7.817 1.00 0.00 O 0 +HETATM 1261 H1 HOH A 313 52.213 4.615 7.941 1.00 0.00 H 0 +HETATM 1262 H2 HOH A 313 52.465 3.178 8.538 1.00 0.00 H 0 +HETATM 1263 O HOH A 314 17.596 20.256 19.582 1.00 0.00 O 0 +HETATM 1264 H1 HOH A 314 17.146 21.018 19.978 1.00 0.00 H 0 +HETATM 1265 H2 HOH A 314 16.743 19.743 19.424 1.00 0.00 H 0 +HETATM 1266 O HOH A 315 31.527 48.784 48.547 1.00 0.00 O 0 +HETATM 1267 H1 HOH A 315 31.989 47.947 48.335 1.00 0.00 H 0 +HETATM 1268 H2 HOH A 315 30.751 48.547 49.043 1.00 0.00 H 0 +HETATM 1269 O HOH A 316 28.297 31.303 39.975 1.00 0.00 O 0 +HETATM 1270 H1 HOH A 316 28.648 30.504 40.421 1.00 0.00 H 0 +HETATM 1271 H2 HOH A 316 27.445 31.042 39.594 1.00 0.00 H 0 +HETATM 1272 O HOH A 317 0.582 16.694 27.046 1.00 0.00 O 0 +HETATM 1273 H1 HOH A 317 0.904 16.582 26.187 1.00 0.00 H 0 +HETATM 1274 H2 HOH A 317 1.265 16.594 27.691 1.00 0.00 H 0 +HETATM 1275 O HOH A 318 7.491 4.818 37.386 1.00 0.00 O 0 +HETATM 1276 H1 HOH A 318 7.766 5.678 36.883 1.00 0.00 H 0 +HETATM 1277 H2 HOH A 318 7.543 4.079 36.728 1.00 0.00 H 0 +HETATM 1278 O HOH A 319 36.946 17.689 11.252 1.00 0.00 O 0 +HETATM 1279 H1 HOH A 319 37.623 17.995 10.672 1.00 0.00 H 0 +HETATM 1280 H2 HOH A 319 36.439 17.070 10.716 1.00 0.00 H 0 +HETATM 1281 O HOH A 320 27.028 8.203 9.173 1.00 0.00 O 0 +HETATM 1282 H1 HOH A 320 27.776 7.753 8.882 1.00 0.00 H 0 +HETATM 1283 H2 HOH A 320 26.766 7.648 9.910 1.00 0.00 H 0 +HETATM 1284 O HOH A 321 23.986 19.026 35.412 1.00 0.00 O 0 +HETATM 1285 H1 HOH A 321 24.496 19.767 35.760 1.00 0.00 H 0 +HETATM 1286 H2 HOH A 321 23.070 19.199 35.690 1.00 0.00 H 0 +HETATM 1287 O HOH A 322 5.576 51.803 30.346 1.00 0.00 O 0 +HETATM 1288 H1 HOH A 322 6.011 51.235 29.659 1.00 0.00 H 0 +HETATM 1289 H2 HOH A 322 5.744 51.480 31.235 1.00 0.00 H 0 +HETATM 1290 O HOH A 323 25.716 44.742 28.740 1.00 0.00 O 0 +HETATM 1291 H1 HOH A 323 26.199 45.419 28.289 1.00 0.00 H 0 +HETATM 1292 H2 HOH A 323 25.702 45.053 29.665 1.00 0.00 H 0 +HETATM 1293 O HOH A 324 30.948 12.420 20.969 1.00 0.00 O 0 +HETATM 1294 H1 HOH A 324 31.647 11.742 20.870 1.00 0.00 H 0 +HETATM 1295 H2 HOH A 324 30.081 11.966 20.746 1.00 0.00 H 0 +HETATM 1296 O HOH A 325 40.993 22.722 0.305 1.00 0.00 O 0 +HETATM 1297 H1 HOH A 325 40.508 23.610 0.374 1.00 0.00 H 0 +HETATM 1298 H2 HOH A 325 40.519 22.090 0.847 1.00 0.00 H 0 +HETATM 1299 O HOH A 326 31.344 50.824 14.664 1.00 0.00 O 0 +HETATM 1300 H1 HOH A 326 30.484 50.592 14.955 1.00 0.00 H 0 +HETATM 1301 H2 HOH A 326 31.964 50.411 15.239 1.00 0.00 H 0 +HETATM 1302 O HOH A 327 26.995 47.916 5.797 1.00 0.00 O 0 +HETATM 1303 H1 HOH A 327 26.780 47.439 6.592 1.00 0.00 H 0 +HETATM 1304 H2 HOH A 327 26.294 48.583 5.680 1.00 0.00 H 0 +HETATM 1305 O HOH A 328 34.973 17.540 50.892 1.00 0.00 O 0 +HETATM 1306 H1 HOH A 328 34.295 17.754 50.189 1.00 0.00 H 0 +HETATM 1307 H2 HOH A 328 34.698 16.587 51.088 1.00 0.00 H 0 +HETATM 1308 O HOH A 329 35.124 40.765 48.414 1.00 0.00 O 0 +HETATM 1309 H1 HOH A 329 34.924 41.487 47.801 1.00 0.00 H 0 +HETATM 1310 H2 HOH A 329 35.783 40.200 48.017 1.00 0.00 H 0 +HETATM 1311 O HOH A 330 1.142 3.600 35.676 1.00 0.00 O 0 +HETATM 1312 H1 HOH A 330 0.540 3.749 36.429 1.00 0.00 H 0 +HETATM 1313 H2 HOH A 330 1.015 4.479 35.303 1.00 0.00 H 0 +HETATM 1314 O HOH A 331 18.315 38.875 0.294 1.00 0.00 O 0 +HETATM 1315 H1 HOH A 331 18.859 38.083 0.328 1.00 0.00 H 0 +HETATM 1316 H2 HOH A 331 18.696 39.526 -0.258 1.00 0.00 H 0 +HETATM 1317 O HOH A 332 10.291 40.711 23.074 1.00 0.00 O 0 +HETATM 1318 H1 HOH A 332 10.034 41.492 22.515 1.00 0.00 H 0 +HETATM 1319 H2 HOH A 332 11.193 40.429 22.794 1.00 0.00 H 0 +HETATM 1320 O HOH A 333 10.702 45.931 17.923 1.00 0.00 O 0 +HETATM 1321 H1 HOH A 333 10.103 46.483 18.512 1.00 0.00 H 0 +HETATM 1322 H2 HOH A 333 11.612 45.958 18.220 1.00 0.00 H 0 +HETATM 1323 O HOH A 334 26.777 40.032 14.569 1.00 0.00 O 0 +HETATM 1324 H1 HOH A 334 27.386 40.733 14.820 1.00 0.00 H 0 +HETATM 1325 H2 HOH A 334 26.003 40.497 14.357 1.00 0.00 H 0 +HETATM 1326 O HOH A 335 52.169 21.103 2.108 1.00 0.00 O 0 +HETATM 1327 H1 HOH A 335 52.227 22.121 2.204 1.00 0.00 H 0 +HETATM 1328 H2 HOH A 335 51.184 20.991 2.092 1.00 0.00 H 0 +HETATM 1329 O HOH A 336 29.465 30.242 9.626 1.00 0.00 O 0 +HETATM 1330 H1 HOH A 336 28.466 30.393 9.649 1.00 0.00 H 0 +HETATM 1331 H2 HOH A 336 29.766 30.485 8.747 1.00 0.00 H 0 +HETATM 1332 O HOH A 337 41.283 33.175 23.132 1.00 0.00 O 0 +HETATM 1333 H1 HOH A 337 41.750 33.024 23.905 1.00 0.00 H 0 +HETATM 1334 H2 HOH A 337 40.499 32.611 23.306 1.00 0.00 H 0 +HETATM 1335 O HOH A 338 26.000 37.693 30.967 1.00 0.00 O 0 +HETATM 1336 H1 HOH A 338 26.090 36.715 30.877 1.00 0.00 H 0 +HETATM 1337 H2 HOH A 338 26.873 38.078 31.094 1.00 0.00 H 0 +HETATM 1338 O HOH A 339 44.389 43.129 0.775 1.00 0.00 O 0 +HETATM 1339 H1 HOH A 339 43.689 43.732 0.313 1.00 0.00 H 0 +HETATM 1340 H2 HOH A 339 43.914 42.250 0.928 1.00 0.00 H 0 +HETATM 1341 O HOH A 340 52.258 6.805 19.617 1.00 0.00 O 0 +HETATM 1342 H1 HOH A 340 52.508 5.876 19.811 1.00 0.00 H 0 +HETATM 1343 H2 HOH A 340 51.686 6.749 18.893 1.00 0.00 H 0 +HETATM 1344 O HOH A 341 32.749 4.994 22.588 1.00 0.00 O 0 +HETATM 1345 H1 HOH A 341 32.355 4.687 21.741 1.00 0.00 H 0 +HETATM 1346 H2 HOH A 341 33.693 5.050 22.421 1.00 0.00 H 0 +HETATM 1347 O HOH A 342 46.008 20.988 51.432 1.00 0.00 O 0 +HETATM 1348 H1 HOH A 342 45.354 20.598 50.845 1.00 0.00 H 0 +HETATM 1349 H2 HOH A 342 45.654 20.676 52.328 1.00 0.00 H 0 +HETATM 1350 O HOH A 343 1.397 33.878 3.598 1.00 0.00 O 0 +HETATM 1351 H1 HOH A 343 1.421 34.295 2.733 1.00 0.00 H 0 +HETATM 1352 H2 HOH A 343 2.020 33.154 3.705 1.00 0.00 H 0 +HETATM 1353 O HOH A 344 30.849 14.465 31.269 1.00 0.00 O 0 +HETATM 1354 H1 HOH A 344 30.515 15.341 31.084 1.00 0.00 H 0 +HETATM 1355 H2 HOH A 344 31.834 14.623 31.307 1.00 0.00 H 0 +HETATM 1356 O HOH A 345 45.493 17.974 7.877 1.00 0.00 O 0 +HETATM 1357 H1 HOH A 345 44.990 17.180 8.196 1.00 0.00 H 0 +HETATM 1358 H2 HOH A 345 44.999 18.153 7.082 1.00 0.00 H 0 +HETATM 1359 O HOH A 346 39.935 24.293 22.541 1.00 0.00 O 0 +HETATM 1360 H1 HOH A 346 40.915 24.380 22.510 1.00 0.00 H 0 +HETATM 1361 H2 HOH A 346 39.604 24.558 23.441 1.00 0.00 H 0 +HETATM 1362 O HOH A 347 7.667 12.135 40.496 1.00 0.00 O 0 +HETATM 1363 H1 HOH A 347 7.885 12.571 41.312 1.00 0.00 H 0 +HETATM 1364 H2 HOH A 347 6.728 11.977 40.579 1.00 0.00 H 0 +HETATM 1365 O HOH A 348 42.308 49.789 39.693 1.00 0.00 O 0 +HETATM 1366 H1 HOH A 348 41.552 49.181 40.050 1.00 0.00 H 0 +HETATM 1367 H2 HOH A 348 42.985 49.978 40.353 1.00 0.00 H 0 +HETATM 1368 O HOH A 349 50.443 7.120 50.744 1.00 0.00 O 0 +HETATM 1369 H1 HOH A 349 50.120 6.180 50.912 1.00 0.00 H 0 +HETATM 1370 H2 HOH A 349 49.587 7.582 50.680 1.00 0.00 H 0 +HETATM 1371 O HOH A 350 14.157 33.989 26.544 1.00 0.00 O 0 +HETATM 1372 H1 HOH A 350 13.606 34.708 26.360 1.00 0.00 H 0 +HETATM 1373 H2 HOH A 350 14.955 34.274 27.097 1.00 0.00 H 0 +HETATM 1374 O HOH A 351 2.508 0.856 19.418 1.00 0.00 O 0 +HETATM 1375 H1 HOH A 351 2.410 1.201 18.604 1.00 0.00 H 0 +HETATM 1376 H2 HOH A 351 3.451 0.540 19.473 1.00 0.00 H 0 +HETATM 1377 O HOH A 352 45.308 10.616 51.751 1.00 0.00 O 0 +HETATM 1378 H1 HOH A 352 44.473 10.753 52.160 1.00 0.00 H 0 +HETATM 1379 H2 HOH A 352 45.692 11.371 51.388 1.00 0.00 H 0 +HETATM 1380 O HOH A 353 10.456 12.109 51.240 1.00 0.00 O 0 +HETATM 1381 H1 HOH A 353 10.858 12.319 52.110 1.00 0.00 H 0 +HETATM 1382 H2 HOH A 353 9.480 11.825 51.405 1.00 0.00 H 0 +HETATM 1383 O HOH A 354 39.473 52.364 7.910 1.00 0.00 O 0 +HETATM 1384 H1 HOH A 354 40.286 52.132 8.361 1.00 0.00 H 0 +HETATM 1385 H2 HOH A 354 38.972 52.900 8.525 1.00 0.00 H 0 +HETATM 1386 O HOH A 355 5.077 49.551 33.415 1.00 0.00 O 0 +HETATM 1387 H1 HOH A 355 4.555 50.327 33.625 1.00 0.00 H 0 +HETATM 1388 H2 HOH A 355 5.792 49.366 34.011 1.00 0.00 H 0 +HETATM 1389 O HOH A 356 29.793 29.427 43.419 1.00 0.00 O 0 +HETATM 1390 H1 HOH A 356 30.264 29.381 42.548 1.00 0.00 H 0 +HETATM 1391 H2 HOH A 356 30.215 30.097 43.950 1.00 0.00 H 0 +HETATM 1392 O HOH A 357 40.949 23.699 14.926 1.00 0.00 O 0 +HETATM 1393 H1 HOH A 357 41.485 24.526 15.167 1.00 0.00 H 0 +HETATM 1394 H2 HOH A 357 41.421 22.845 15.070 1.00 0.00 H 0 +HETATM 1395 O HOH A 358 43.589 16.693 46.695 1.00 0.00 O 0 +HETATM 1396 H1 HOH A 358 43.891 17.499 47.053 1.00 0.00 H 0 +HETATM 1397 H2 HOH A 358 43.618 16.818 45.738 1.00 0.00 H 0 +HETATM 1398 O HOH A 359 23.723 47.495 44.603 1.00 0.00 O 0 +HETATM 1399 H1 HOH A 359 23.235 48.247 44.916 1.00 0.00 H 0 +HETATM 1400 H2 HOH A 359 24.454 47.891 44.186 1.00 0.00 H 0 +HETATM 1401 O HOH A 360 7.261 1.376 45.729 1.00 0.00 O 0 +HETATM 1402 H1 HOH A 360 6.429 0.946 45.540 1.00 0.00 H 0 +HETATM 1403 H2 HOH A 360 8.022 0.751 45.726 1.00 0.00 H 0 +HETATM 1404 O HOH A 361 38.917 33.495 39.481 1.00 0.00 O 0 +HETATM 1405 H1 HOH A 361 39.790 33.815 39.220 1.00 0.00 H 0 +HETATM 1406 H2 HOH A 361 38.313 33.650 38.740 1.00 0.00 H 0 +HETATM 1407 O HOH A 362 38.683 32.674 1.216 1.00 0.00 O 0 +HETATM 1408 H1 HOH A 362 39.400 32.481 0.627 1.00 0.00 H 0 +HETATM 1409 H2 HOH A 362 38.295 31.804 1.454 1.00 0.00 H 0 +HETATM 1410 O HOH A 363 10.263 1.159 31.944 1.00 0.00 O 0 +HETATM 1411 H1 HOH A 363 10.653 1.935 32.461 1.00 0.00 H 0 +HETATM 1412 H2 HOH A 363 9.337 1.102 32.197 1.00 0.00 H 0 +HETATM 1413 O HOH A 364 0.831 44.720 20.765 1.00 0.00 O 0 +HETATM 1414 H1 HOH A 364 1.076 45.065 19.878 1.00 0.00 H 0 +HETATM 1415 H2 HOH A 364 1.568 44.679 21.349 1.00 0.00 H 0 +HETATM 1416 O HOH A 365 20.771 4.628 6.573 1.00 0.00 O 0 +HETATM 1417 H1 HOH A 365 20.898 5.472 6.957 1.00 0.00 H 0 +HETATM 1418 H2 HOH A 365 20.073 4.915 5.950 1.00 0.00 H 0 +HETATM 1419 O HOH A 366 44.914 53.325 8.075 1.00 0.00 O 0 +HETATM 1420 H1 HOH A 366 45.323 54.019 7.560 1.00 0.00 H 0 +HETATM 1421 H2 HOH A 366 44.237 53.659 8.722 1.00 0.00 H 0 +HETATM 1422 O HOH A 367 44.047 41.323 14.627 1.00 0.00 O 0 +HETATM 1423 H1 HOH A 367 44.157 41.307 13.613 1.00 0.00 H 0 +HETATM 1424 H2 HOH A 367 44.482 40.514 14.871 1.00 0.00 H 0 +HETATM 1425 O HOH A 368 2.060 8.477 4.862 1.00 0.00 O 0 +HETATM 1426 H1 HOH A 368 2.754 8.526 4.205 1.00 0.00 H 0 +HETATM 1427 H2 HOH A 368 1.351 7.868 4.565 1.00 0.00 H 0 +HETATM 1428 O HOH A 369 15.512 26.985 19.119 1.00 0.00 O 0 +HETATM 1429 H1 HOH A 369 16.188 26.450 19.622 1.00 0.00 H 0 +HETATM 1430 H2 HOH A 369 14.738 26.446 19.187 1.00 0.00 H 0 +HETATM 1431 O HOH A 370 13.788 22.370 43.395 1.00 0.00 O 0 +HETATM 1432 H1 HOH A 370 13.247 23.144 43.474 1.00 0.00 H 0 +HETATM 1433 H2 HOH A 370 13.253 21.626 43.653 1.00 0.00 H 0 +HETATM 1434 O HOH A 371 22.909 52.649 26.177 1.00 0.00 O 0 +HETATM 1435 H1 HOH A 371 22.590 52.869 25.339 1.00 0.00 H 0 +HETATM 1436 H2 HOH A 371 22.146 52.506 26.742 1.00 0.00 H 0 +HETATM 1437 O HOH A 372 12.179 3.170 30.229 1.00 0.00 O 0 +HETATM 1438 H1 HOH A 372 12.161 3.519 29.269 1.00 0.00 H 0 +HETATM 1439 H2 HOH A 372 13.034 3.372 30.734 1.00 0.00 H 0 +HETATM 1440 O HOH A 373 15.820 18.180 36.126 1.00 0.00 O 0 +HETATM 1441 H1 HOH A 373 15.473 17.973 35.220 1.00 0.00 H 0 +HETATM 1442 H2 HOH A 373 16.370 18.909 36.038 1.00 0.00 H 0 +HETATM 1443 O HOH A 374 46.859 41.581 27.613 1.00 0.00 O 0 +HETATM 1444 H1 HOH A 374 47.573 41.271 27.060 1.00 0.00 H 0 +HETATM 1445 H2 HOH A 374 46.938 42.535 27.727 1.00 0.00 H 0 +HETATM 1446 O HOH A 375 4.050 34.625 11.221 1.00 0.00 O 0 +HETATM 1447 H1 HOH A 375 4.989 34.495 10.986 1.00 0.00 H 0 +HETATM 1448 H2 HOH A 375 3.638 33.715 11.352 1.00 0.00 H 0 +HETATM 1449 O HOH A 376 39.549 39.007 28.613 1.00 0.00 O 0 +HETATM 1450 H1 HOH A 376 40.421 39.023 28.269 1.00 0.00 H 0 +HETATM 1451 H2 HOH A 376 39.330 39.934 28.736 1.00 0.00 H 0 +HETATM 1452 O HOH A 377 20.585 32.918 42.541 1.00 0.00 O 0 +HETATM 1453 H1 HOH A 377 20.107 32.309 41.907 1.00 0.00 H 0 +HETATM 1454 H2 HOH A 377 19.955 33.570 42.899 1.00 0.00 H 0 +HETATM 1455 O HOH A 378 6.444 8.056 10.724 1.00 0.00 O 0 +HETATM 1456 H1 HOH A 378 5.520 8.187 11.107 1.00 0.00 H 0 +HETATM 1457 H2 HOH A 378 6.951 7.527 11.366 1.00 0.00 H 0 +HETATM 1458 O HOH A 379 6.344 12.830 10.767 1.00 0.00 O 0 +HETATM 1459 H1 HOH A 379 5.370 12.654 10.799 1.00 0.00 H 0 +HETATM 1460 H2 HOH A 379 6.650 12.016 10.377 1.00 0.00 H 0 +HETATM 1461 O HOH A 380 21.711 14.090 25.565 1.00 0.00 O 0 +HETATM 1462 H1 HOH A 380 22.133 13.343 25.160 1.00 0.00 H 0 +HETATM 1463 H2 HOH A 380 22.153 14.128 26.419 1.00 0.00 H 0 +HETATM 1464 O HOH A 381 50.867 25.310 21.713 1.00 0.00 O 0 +HETATM 1465 H1 HOH A 381 50.912 26.264 21.827 1.00 0.00 H 0 +HETATM 1466 H2 HOH A 381 50.629 25.232 20.794 1.00 0.00 H 0 +HETATM 1467 O HOH A 382 33.083 51.434 4.952 1.00 0.00 O 0 +HETATM 1468 H1 HOH A 382 33.399 50.493 4.754 1.00 0.00 H 0 +HETATM 1469 H2 HOH A 382 33.892 51.949 4.689 1.00 0.00 H 0 +HETATM 1470 O HOH A 383 31.893 47.158 20.379 1.00 0.00 O 0 +HETATM 1471 H1 HOH A 383 31.807 46.678 19.583 1.00 0.00 H 0 +HETATM 1472 H2 HOH A 383 31.887 46.596 21.106 1.00 0.00 H 0 +HETATM 1473 O HOH A 384 10.574 41.021 11.691 1.00 0.00 O 0 +HETATM 1474 H1 HOH A 384 11.288 40.857 12.291 1.00 0.00 H 0 +HETATM 1475 H2 HOH A 384 9.874 41.531 12.137 1.00 0.00 H 0 +HETATM 1476 O HOH A 385 19.371 5.799 50.619 1.00 0.00 O 0 +HETATM 1477 H1 HOH A 385 18.751 5.831 49.868 1.00 0.00 H 0 +HETATM 1478 H2 HOH A 385 19.960 6.513 50.650 1.00 0.00 H 0 +HETATM 1479 O HOH A 386 39.799 27.693 15.017 1.00 0.00 O 0 +HETATM 1480 H1 HOH A 386 39.902 26.898 15.503 1.00 0.00 H 0 +HETATM 1481 H2 HOH A 386 40.330 28.336 15.472 1.00 0.00 H 0 +HETATM 1482 O HOH A 387 41.251 39.817 17.487 1.00 0.00 O 0 +HETATM 1483 H1 HOH A 387 41.743 40.614 17.659 1.00 0.00 H 0 +HETATM 1484 H2 HOH A 387 40.898 39.554 18.352 1.00 0.00 H 0 +HETATM 1485 O HOH A 388 47.080 5.101 29.538 1.00 0.00 O 0 +HETATM 1486 H1 HOH A 388 46.883 5.988 29.886 1.00 0.00 H 0 +HETATM 1487 H2 HOH A 388 48.025 5.049 29.494 1.00 0.00 H 0 +HETATM 1488 O HOH A 389 29.892 12.081 32.574 1.00 0.00 O 0 +HETATM 1489 H1 HOH A 389 30.408 12.695 32.025 1.00 0.00 H 0 +HETATM 1490 H2 HOH A 389 28.981 12.449 32.745 1.00 0.00 H 0 +HETATM 1491 O HOH A 390 31.090 4.067 37.816 1.00 0.00 O 0 +HETATM 1492 H1 HOH A 390 31.203 3.163 37.350 1.00 0.00 H 0 +HETATM 1493 H2 HOH A 390 30.601 3.987 38.666 1.00 0.00 H 0 +HETATM 1494 O HOH A 391 5.505 16.130 2.423 1.00 0.00 O 0 +HETATM 1495 H1 HOH A 391 5.808 17.023 2.204 1.00 0.00 H 0 +HETATM 1496 H2 HOH A 391 6.169 15.780 3.077 1.00 0.00 H 0 +HETATM 1497 O HOH A 392 27.093 30.358 12.634 1.00 0.00 O 0 +HETATM 1498 H1 HOH A 392 27.828 29.724 12.632 1.00 0.00 H 0 +HETATM 1499 H2 HOH A 392 27.180 30.705 11.760 1.00 0.00 H 0 +HETATM 1500 O HOH A 393 42.234 40.903 9.568 1.00 0.00 O 0 +HETATM 1501 H1 HOH A 393 42.837 40.958 10.363 1.00 0.00 H 0 +HETATM 1502 H2 HOH A 393 41.616 41.595 9.712 1.00 0.00 H 0 +HETATM 1503 O HOH A 394 37.341 43.393 51.968 1.00 0.00 O 0 +HETATM 1504 H1 HOH A 394 36.706 44.095 52.053 1.00 0.00 H 0 +HETATM 1505 H2 HOH A 394 37.334 42.886 52.801 1.00 0.00 H 0 +HETATM 1506 O HOH A 395 53.289 43.942 53.405 1.00 0.00 O 0 +HETATM 1507 H1 HOH A 395 54.203 43.882 53.754 1.00 0.00 H 0 +HETATM 1508 H2 HOH A 395 53.418 44.488 52.544 1.00 0.00 H 0 +HETATM 1509 O HOH A 396 47.529 14.794 9.192 1.00 0.00 O 0 +HETATM 1510 H1 HOH A 396 46.694 15.271 9.261 1.00 0.00 H 0 +HETATM 1511 H2 HOH A 396 48.142 15.499 9.035 1.00 0.00 H 0 +HETATM 1512 O HOH A 397 52.007 35.563 29.677 1.00 0.00 O 0 +HETATM 1513 H1 HOH A 397 52.777 35.731 29.314 1.00 0.00 H 0 +HETATM 1514 H2 HOH A 397 51.318 35.638 28.941 1.00 0.00 H 0 +HETATM 1515 O HOH A 398 19.980 8.877 22.127 1.00 0.00 O 0 +HETATM 1516 H1 HOH A 398 20.494 8.882 21.324 1.00 0.00 H 0 +HETATM 1517 H2 HOH A 398 20.444 8.176 22.588 1.00 0.00 H 0 +HETATM 1518 O HOH A 399 34.512 15.875 41.329 1.00 0.00 O 0 +HETATM 1519 H1 HOH A 399 33.727 16.390 41.219 1.00 0.00 H 0 +HETATM 1520 H2 HOH A 399 34.386 15.213 42.014 1.00 0.00 H 0 +HETATM 1521 O HOH A 400 14.597 4.026 30.977 1.00 0.00 O 0 +HETATM 1522 H1 HOH A 400 15.150 3.409 30.515 1.00 0.00 H 0 +HETATM 1523 H2 HOH A 400 14.825 4.974 30.723 1.00 0.00 H 0 +HETATM 1524 O HOH A 401 28.252 31.973 2.035 1.00 0.00 O 0 +HETATM 1525 H1 HOH A 401 29.028 32.549 2.074 1.00 0.00 H 0 +HETATM 1526 H2 HOH A 401 27.584 32.602 2.461 1.00 0.00 H 0 +HETATM 1527 O HOH A 402 14.243 13.718 28.004 1.00 0.00 O 0 +HETATM 1528 H1 HOH A 402 14.484 13.057 27.303 1.00 0.00 H 0 +HETATM 1529 H2 HOH A 402 13.904 14.461 27.436 1.00 0.00 H 0 +HETATM 1530 O HOH A 403 44.333 44.916 26.404 1.00 0.00 O 0 +HETATM 1531 H1 HOH A 403 45.049 45.422 26.049 1.00 0.00 H 0 +HETATM 1532 H2 HOH A 403 44.304 44.126 25.853 1.00 0.00 H 0 +HETATM 1533 O HOH A 404 28.390 15.375 10.889 1.00 0.00 O 0 +HETATM 1534 H1 HOH A 404 28.104 14.753 10.258 1.00 0.00 H 0 +HETATM 1535 H2 HOH A 404 27.689 15.410 11.539 1.00 0.00 H 0 +HETATM 1536 O HOH A 405 16.388 1.855 8.267 1.00 0.00 O 0 +HETATM 1537 H1 HOH A 405 15.982 1.016 8.170 1.00 0.00 H 0 +HETATM 1538 H2 HOH A 405 16.982 1.947 7.504 1.00 0.00 H 0 +HETATM 1539 O HOH A 406 48.747 41.950 34.317 1.00 0.00 O 0 +HETATM 1540 H1 HOH A 406 49.553 41.941 34.895 1.00 0.00 H 0 +HETATM 1541 H2 HOH A 406 48.111 42.690 34.481 1.00 0.00 H 0 +HETATM 1542 O HOH A 407 8.888 18.845 9.059 1.00 0.00 O 0 +HETATM 1543 H1 HOH A 407 8.594 18.813 9.957 1.00 0.00 H 0 +HETATM 1544 H2 HOH A 407 9.750 19.296 9.053 1.00 0.00 H 0 +HETATM 1545 O HOH A 408 37.581 24.353 32.818 1.00 0.00 O 0 +HETATM 1546 H1 HOH A 408 36.693 24.162 32.308 1.00 0.00 H 0 +HETATM 1547 H2 HOH A 408 38.318 24.226 32.181 1.00 0.00 H 0 +HETATM 1548 O HOH A 409 22.538 42.618 23.514 1.00 0.00 O 0 +HETATM 1549 H1 HOH A 409 22.203 43.333 24.060 1.00 0.00 H 0 +HETATM 1550 H2 HOH A 409 23.111 42.038 24.103 1.00 0.00 H 0 +HETATM 1551 O HOH A 410 34.875 0.239 27.311 1.00 0.00 O 0 +HETATM 1552 H1 HOH A 410 35.047 -0.607 27.785 1.00 0.00 H 0 +HETATM 1553 H2 HOH A 410 35.685 0.801 27.548 1.00 0.00 H 0 +HETATM 1554 O HOH A 411 33.182 30.685 48.819 1.00 0.00 O 0 +HETATM 1555 H1 HOH A 411 32.929 31.158 47.988 1.00 0.00 H 0 +HETATM 1556 H2 HOH A 411 34.029 31.038 49.129 1.00 0.00 H 0 +HETATM 1557 O HOH A 412 11.088 20.486 4.704 1.00 0.00 O 0 +HETATM 1558 H1 HOH A 412 10.164 20.246 4.430 1.00 0.00 H 0 +HETATM 1559 H2 HOH A 412 11.622 20.618 3.942 1.00 0.00 H 0 +HETATM 1560 O HOH A 413 17.232 7.800 0.755 1.00 0.00 O 0 +HETATM 1561 H1 HOH A 413 17.866 8.517 0.522 1.00 0.00 H 0 +HETATM 1562 H2 HOH A 413 16.468 8.207 1.141 1.00 0.00 H 0 +HETATM 1563 O HOH A 414 6.251 8.312 7.840 1.00 0.00 O 0 +HETATM 1564 H1 HOH A 414 5.283 8.525 7.884 1.00 0.00 H 0 +HETATM 1565 H2 HOH A 414 6.444 8.135 8.731 1.00 0.00 H 0 +HETATM 1566 O HOH A 415 53.015 49.593 53.454 1.00 0.00 O 0 +HETATM 1567 H1 HOH A 415 52.981 50.390 52.885 1.00 0.00 H 0 +HETATM 1568 H2 HOH A 415 53.169 48.763 52.912 1.00 0.00 H 0 +HETATM 1569 O HOH A 416 27.985 4.901 15.761 1.00 0.00 O 0 +HETATM 1570 H1 HOH A 416 27.778 3.967 15.943 1.00 0.00 H 0 +HETATM 1571 H2 HOH A 416 27.130 5.342 15.593 1.00 0.00 H 0 +HETATM 1572 O HOH A 417 12.831 21.224 19.256 1.00 0.00 O 0 +HETATM 1573 H1 HOH A 417 12.997 20.599 19.937 1.00 0.00 H 0 +HETATM 1574 H2 HOH A 417 12.077 20.855 18.760 1.00 0.00 H 0 +HETATM 1575 O HOH A 418 18.854 33.427 4.210 1.00 0.00 O 0 +HETATM 1576 H1 HOH A 418 17.919 33.238 4.350 1.00 0.00 H 0 +HETATM 1577 H2 HOH A 418 19.000 33.976 5.017 1.00 0.00 H 0 +HETATM 1578 O HOH A 419 13.951 9.829 6.651 1.00 0.00 O 0 +HETATM 1579 H1 HOH A 419 14.482 9.917 5.797 1.00 0.00 H 0 +HETATM 1580 H2 HOH A 419 13.727 10.651 7.026 1.00 0.00 H 0 +HETATM 1581 O HOH A 420 20.860 50.088 31.748 1.00 0.00 O 0 +HETATM 1582 H1 HOH A 420 21.443 49.843 32.489 1.00 0.00 H 0 +HETATM 1583 H2 HOH A 420 21.395 50.697 31.193 1.00 0.00 H 0 +HETATM 1584 O HOH A 421 26.173 45.844 31.279 1.00 0.00 O 0 +HETATM 1585 H1 HOH A 421 25.823 46.742 31.207 1.00 0.00 H 0 +HETATM 1586 H2 HOH A 421 25.683 45.500 32.075 1.00 0.00 H 0 +HETATM 1587 O HOH A 422 4.495 21.555 27.704 1.00 0.00 O 0 +HETATM 1588 H1 HOH A 422 3.848 20.885 28.119 1.00 0.00 H 0 +HETATM 1589 H2 HOH A 422 4.718 22.209 28.402 1.00 0.00 H 0 +HETATM 1590 O HOH A 423 41.113 0.754 23.547 1.00 0.00 O 0 +HETATM 1591 H1 HOH A 423 41.889 1.018 22.981 1.00 0.00 H 0 +HETATM 1592 H2 HOH A 423 41.487 0.085 24.157 1.00 0.00 H 0 +HETATM 1593 O HOH A 424 3.091 29.313 8.505 1.00 0.00 O 0 +HETATM 1594 H1 HOH A 424 2.848 28.440 8.096 1.00 0.00 H 0 +HETATM 1595 H2 HOH A 424 3.173 29.151 9.429 1.00 0.00 H 0 +HETATM 1596 O HOH A 425 25.169 50.236 33.106 1.00 0.00 O 0 +HETATM 1597 H1 HOH A 425 25.310 49.622 32.436 1.00 0.00 H 0 +HETATM 1598 H2 HOH A 425 25.502 51.086 32.781 1.00 0.00 H 0 +HETATM 1599 O HOH A 426 8.041 45.018 43.034 1.00 0.00 O 0 +HETATM 1600 H1 HOH A 426 7.195 44.580 43.132 1.00 0.00 H 0 +HETATM 1601 H2 HOH A 426 8.582 44.758 43.846 1.00 0.00 H 0 +HETATM 1602 O HOH A 427 1.426 21.671 52.570 1.00 0.00 O 0 +HETATM 1603 H1 HOH A 427 2.234 21.725 51.998 1.00 0.00 H 0 +HETATM 1604 H2 HOH A 427 0.610 21.920 52.033 1.00 0.00 H 0 +HETATM 1605 O HOH A 428 37.497 19.594 53.480 1.00 0.00 O 0 +HETATM 1606 H1 HOH A 428 38.081 19.597 52.768 1.00 0.00 H 0 +HETATM 1607 H2 HOH A 428 36.675 19.913 53.060 1.00 0.00 H 0 +HETATM 1608 O HOH A 429 36.120 0.607 42.934 1.00 0.00 O 0 +HETATM 1609 H1 HOH A 429 36.059 -0.357 43.041 1.00 0.00 H 0 +HETATM 1610 H2 HOH A 429 36.106 0.918 43.880 1.00 0.00 H 0 +HETATM 1611 O HOH A 430 42.092 7.908 33.870 1.00 0.00 O 0 +HETATM 1612 H1 HOH A 430 42.124 7.678 34.848 1.00 0.00 H 0 +HETATM 1613 H2 HOH A 430 43.018 7.717 33.600 1.00 0.00 H 0 +HETATM 1614 O HOH A 431 29.208 27.754 46.408 1.00 0.00 O 0 +HETATM 1615 H1 HOH A 431 29.977 27.290 46.803 1.00 0.00 H 0 +HETATM 1616 H2 HOH A 431 28.420 27.673 47.006 1.00 0.00 H 0 +HETATM 1617 O HOH A 432 38.070 31.315 7.042 1.00 0.00 O 0 +HETATM 1618 H1 HOH A 432 37.867 30.929 7.900 1.00 0.00 H 0 +HETATM 1619 H2 HOH A 432 38.817 31.895 7.136 1.00 0.00 H 0 +HETATM 1620 O HOH A 433 5.688 49.092 29.469 1.00 0.00 O 0 +HETATM 1621 H1 HOH A 433 6.595 48.754 29.333 1.00 0.00 H 0 +HETATM 1622 H2 HOH A 433 5.141 48.379 29.862 1.00 0.00 H 0 +HETATM 1623 O HOH A 434 17.883 22.755 2.704 1.00 0.00 O 0 +HETATM 1624 H1 HOH A 434 17.476 23.478 3.060 1.00 0.00 H 0 +HETATM 1625 H2 HOH A 434 17.565 22.059 3.278 1.00 0.00 H 0 +HETATM 1626 O HOH A 435 5.482 22.862 42.849 1.00 0.00 O 0 +HETATM 1627 H1 HOH A 435 5.133 23.310 43.677 1.00 0.00 H 0 +HETATM 1628 H2 HOH A 435 6.241 22.237 43.068 1.00 0.00 H 0 +HETATM 1629 O HOH A 436 52.296 48.886 13.072 1.00 0.00 O 0 +HETATM 1630 H1 HOH A 436 52.966 48.218 12.934 1.00 0.00 H 0 +HETATM 1631 H2 HOH A 436 51.394 48.492 13.011 1.00 0.00 H 0 +HETATM 1632 O HOH A 437 32.233 20.649 42.715 1.00 0.00 O 0 +HETATM 1633 H1 HOH A 437 32.853 20.112 43.178 1.00 0.00 H 0 +HETATM 1634 H2 HOH A 437 32.140 21.381 43.239 1.00 0.00 H 0 +HETATM 1635 O HOH A 438 34.065 1.061 11.133 1.00 0.00 O 0 +HETATM 1636 H1 HOH A 438 34.633 1.266 10.306 1.00 0.00 H 0 +HETATM 1637 H2 HOH A 438 34.302 1.766 11.762 1.00 0.00 H 0 +HETATM 1638 O HOH A 439 33.305 20.412 10.995 1.00 0.00 O 0 +HETATM 1639 H1 HOH A 439 32.594 21.003 10.691 1.00 0.00 H 0 +HETATM 1640 H2 HOH A 439 32.850 20.029 11.788 1.00 0.00 H 0 +HETATM 1641 O HOH A 440 33.489 13.553 21.725 1.00 0.00 O 0 +HETATM 1642 H1 HOH A 440 32.616 13.460 21.215 1.00 0.00 H 0 +HETATM 1643 H2 HOH A 440 34.120 12.996 21.288 1.00 0.00 H 0 +HETATM 1644 O HOH A 441 0.001 29.126 20.230 1.00 0.00 O 0 +HETATM 1645 H1 HOH A 441 0.735 29.478 20.660 1.00 0.00 H 0 +HETATM 1646 H2 HOH A 441 0.178 28.145 20.364 1.00 0.00 H 0 +HETATM 1647 O HOH A 442 33.594 41.621 9.197 1.00 0.00 O 0 +HETATM 1648 H1 HOH A 442 34.488 41.401 9.489 1.00 0.00 H 0 +HETATM 1649 H2 HOH A 442 33.105 40.860 9.462 1.00 0.00 H 0 +HETATM 1650 O HOH A 443 8.566 42.612 12.805 1.00 0.00 O 0 +HETATM 1651 H1 HOH A 443 8.378 43.357 12.186 1.00 0.00 H 0 +HETATM 1652 H2 HOH A 443 9.198 42.958 13.445 1.00 0.00 H 0 +HETATM 1653 O HOH A 444 31.355 6.873 10.949 1.00 0.00 O 0 +HETATM 1654 H1 HOH A 444 32.106 6.974 11.521 1.00 0.00 H 0 +HETATM 1655 H2 HOH A 444 30.673 7.452 11.270 1.00 0.00 H 0 +HETATM 1656 O HOH A 445 21.287 44.352 50.880 1.00 0.00 O 0 +HETATM 1657 H1 HOH A 445 20.944 44.763 51.662 1.00 0.00 H 0 +HETATM 1658 H2 HOH A 445 21.614 45.135 50.342 1.00 0.00 H 0 +HETATM 1659 O HOH A 446 18.125 42.198 4.498 1.00 0.00 O 0 +HETATM 1660 H1 HOH A 446 18.302 41.592 3.771 1.00 0.00 H 0 +HETATM 1661 H2 HOH A 446 17.263 42.643 4.165 1.00 0.00 H 0 +HETATM 1662 O HOH A 447 23.394 42.968 28.347 1.00 0.00 O 0 +HETATM 1663 H1 HOH A 447 23.714 42.157 27.979 1.00 0.00 H 0 +HETATM 1664 H2 HOH A 447 24.169 43.592 28.268 1.00 0.00 H 0 +HETATM 1665 O HOH A 448 33.172 46.944 25.444 1.00 0.00 O 0 +HETATM 1666 H1 HOH A 448 33.327 47.754 24.916 1.00 0.00 H 0 +HETATM 1667 H2 HOH A 448 32.343 46.602 25.103 1.00 0.00 H 0 +HETATM 1668 O HOH A 449 0.370 7.066 30.181 1.00 0.00 O 0 +HETATM 1669 H1 HOH A 449 1.026 7.744 30.416 1.00 0.00 H 0 +HETATM 1670 H2 HOH A 449 -0.529 7.430 30.123 1.00 0.00 H 0 +HETATM 1671 O HOH A 450 9.926 53.218 50.823 1.00 0.00 O 0 +HETATM 1672 H1 HOH A 450 10.387 52.408 50.892 1.00 0.00 H 0 +HETATM 1673 H2 HOH A 450 9.229 53.263 51.548 1.00 0.00 H 0 +HETATM 1674 O HOH A 451 6.641 52.704 37.063 1.00 0.00 O 0 +HETATM 1675 H1 HOH A 451 7.021 52.464 36.230 1.00 0.00 H 0 +HETATM 1676 H2 HOH A 451 7.268 53.220 37.442 1.00 0.00 H 0 +HETATM 1677 O HOH A 452 46.932 2.764 41.139 1.00 0.00 O 0 +HETATM 1678 H1 HOH A 452 47.513 2.670 40.402 1.00 0.00 H 0 +HETATM 1679 H2 HOH A 452 46.108 2.804 40.622 1.00 0.00 H 0 +HETATM 1680 O HOH A 453 53.389 22.991 19.312 1.00 0.00 O 0 +HETATM 1681 H1 HOH A 453 52.465 23.000 18.920 1.00 0.00 H 0 +HETATM 1682 H2 HOH A 453 53.267 23.285 20.226 1.00 0.00 H 0 +HETATM 1683 O HOH A 454 49.623 15.048 48.267 1.00 0.00 O 0 +HETATM 1684 H1 HOH A 454 49.010 15.594 47.774 1.00 0.00 H 0 +HETATM 1685 H2 HOH A 454 49.013 14.466 48.701 1.00 0.00 H 0 +HETATM 1686 O HOH A 455 31.776 28.276 34.497 1.00 0.00 O 0 +HETATM 1687 H1 HOH A 455 32.372 27.753 33.921 1.00 0.00 H 0 +HETATM 1688 H2 HOH A 455 31.942 29.208 34.266 1.00 0.00 H 0 +HETATM 1689 O HOH A 456 18.709 5.241 20.115 1.00 0.00 O 0 +HETATM 1690 H1 HOH A 456 18.535 5.428 20.974 1.00 0.00 H 0 +HETATM 1691 H2 HOH A 456 19.623 4.843 20.064 1.00 0.00 H 0 +HETATM 1692 O HOH A 457 43.397 30.869 42.749 1.00 0.00 O 0 +HETATM 1693 H1 HOH A 457 44.275 31.147 42.914 1.00 0.00 H 0 +HETATM 1694 H2 HOH A 457 43.209 30.269 43.458 1.00 0.00 H 0 +HETATM 1695 O HOH A 458 22.164 41.655 52.077 1.00 0.00 O 0 +HETATM 1696 H1 HOH A 458 22.214 41.439 53.039 1.00 0.00 H 0 +HETATM 1697 H2 HOH A 458 21.214 41.367 51.853 1.00 0.00 H 0 +HETATM 1698 O HOH A 459 48.795 10.382 16.500 1.00 0.00 O 0 +HETATM 1699 H1 HOH A 459 48.151 10.135 15.806 1.00 0.00 H 0 +HETATM 1700 H2 HOH A 459 48.366 10.032 17.281 1.00 0.00 H 0 +HETATM 1701 O HOH A 460 49.951 11.876 33.598 1.00 0.00 O 0 +HETATM 1702 H1 HOH A 460 49.053 11.829 33.248 1.00 0.00 H 0 +HETATM 1703 H2 HOH A 460 49.882 12.468 34.415 1.00 0.00 H 0 +HETATM 1704 O HOH A 461 38.916 19.316 51.108 1.00 0.00 O 0 +HETATM 1705 H1 HOH A 461 38.634 18.515 50.644 1.00 0.00 H 0 +HETATM 1706 H2 HOH A 461 39.079 19.981 50.454 1.00 0.00 H 0 +HETATM 1707 O HOH A 462 47.578 13.891 20.648 1.00 0.00 O 0 +HETATM 1708 H1 HOH A 462 48.264 13.209 20.673 1.00 0.00 H 0 +HETATM 1709 H2 HOH A 462 47.751 14.424 19.857 1.00 0.00 H 0 +HETATM 1710 O HOH A 463 9.649 38.114 38.302 1.00 0.00 O 0 +HETATM 1711 H1 HOH A 463 9.126 37.268 38.081 1.00 0.00 H 0 +HETATM 1712 H2 HOH A 463 9.309 38.503 39.081 1.00 0.00 H 0 +HETATM 1713 O HOH A 464 18.895 4.722 30.413 1.00 0.00 O 0 +HETATM 1714 H1 HOH A 464 19.802 4.399 30.424 1.00 0.00 H 0 +HETATM 1715 H2 HOH A 464 18.795 5.449 31.111 1.00 0.00 H 0 +HETATM 1716 O HOH A 465 24.742 48.180 30.452 1.00 0.00 O 0 +HETATM 1717 H1 HOH A 465 24.016 47.574 30.259 1.00 0.00 H 0 +HETATM 1718 H2 HOH A 465 24.822 48.800 29.693 1.00 0.00 H 0 +HETATM 1719 O HOH A 466 22.977 9.944 28.020 1.00 0.00 O 0 +HETATM 1720 H1 HOH A 466 23.709 9.795 28.583 1.00 0.00 H 0 +HETATM 1721 H2 HOH A 466 22.620 9.080 27.661 1.00 0.00 H 0 +HETATM 1722 O HOH A 467 1.053 49.428 20.134 1.00 0.00 O 0 +HETATM 1723 H1 HOH A 467 0.275 49.060 19.716 1.00 0.00 H 0 +HETATM 1724 H2 HOH A 467 1.684 48.707 20.403 1.00 0.00 H 0 +HETATM 1725 O HOH A 468 6.035 0.395 13.707 1.00 0.00 O 0 +HETATM 1726 H1 HOH A 468 5.149 -0.041 13.884 1.00 0.00 H 0 +HETATM 1727 H2 HOH A 468 5.940 1.279 14.001 1.00 0.00 H 0 +HETATM 1728 O HOH A 469 23.060 38.825 23.255 1.00 0.00 O 0 +HETATM 1729 H1 HOH A 469 22.796 38.135 23.851 1.00 0.00 H 0 +HETATM 1730 H2 HOH A 469 23.109 38.412 22.367 1.00 0.00 H 0 +HETATM 1731 O HOH A 470 34.019 50.389 37.324 1.00 0.00 O 0 +HETATM 1732 H1 HOH A 470 33.560 50.126 38.129 1.00 0.00 H 0 +HETATM 1733 H2 HOH A 470 34.862 50.631 37.622 1.00 0.00 H 0 +HETATM 1734 O HOH A 471 9.736 33.936 25.684 1.00 0.00 O 0 +HETATM 1735 H1 HOH A 471 9.560 34.673 25.062 1.00 0.00 H 0 +HETATM 1736 H2 HOH A 471 10.435 33.480 25.224 1.00 0.00 H 0 +HETATM 1737 O HOH A 472 38.970 15.103 20.146 1.00 0.00 O 0 +HETATM 1738 H1 HOH A 472 39.481 15.983 20.318 1.00 0.00 H 0 +HETATM 1739 H2 HOH A 472 39.638 14.403 20.170 1.00 0.00 H 0 +HETATM 1740 O HOH A 473 37.045 48.328 11.436 1.00 0.00 O 0 +HETATM 1741 H1 HOH A 473 37.776 48.882 11.180 1.00 0.00 H 0 +HETATM 1742 H2 HOH A 473 36.393 49.007 11.647 1.00 0.00 H 0 +HETATM 1743 O HOH A 474 53.074 14.086 37.531 1.00 0.00 O 0 +HETATM 1744 H1 HOH A 474 52.471 14.833 37.387 1.00 0.00 H 0 +HETATM 1745 H2 HOH A 474 54.003 14.337 37.742 1.00 0.00 H 0 +HETATM 1746 O HOH A 475 27.979 47.608 2.175 1.00 0.00 O 0 +HETATM 1747 H1 HOH A 475 27.580 46.864 2.556 1.00 0.00 H 0 +HETATM 1748 H2 HOH A 475 27.825 48.319 2.737 1.00 0.00 H 0 +HETATM 1749 O HOH A 476 41.793 53.166 42.057 1.00 0.00 O 0 +HETATM 1750 H1 HOH A 476 40.888 53.494 42.010 1.00 0.00 H 0 +HETATM 1751 H2 HOH A 476 41.946 53.278 41.134 1.00 0.00 H 0 +HETATM 1752 O HOH A 477 34.961 30.175 8.849 1.00 0.00 O 0 +HETATM 1753 H1 HOH A 477 35.159 29.936 9.731 1.00 0.00 H 0 +HETATM 1754 H2 HOH A 477 34.877 31.136 8.814 1.00 0.00 H 0 +HETATM 1755 O HOH A 478 23.809 43.914 51.814 1.00 0.00 O 0 +HETATM 1756 H1 HOH A 478 23.257 43.162 51.914 1.00 0.00 H 0 +HETATM 1757 H2 HOH A 478 23.232 44.641 52.054 1.00 0.00 H 0 +HETATM 1758 O HOH A 479 4.091 12.620 6.441 1.00 0.00 O 0 +HETATM 1759 H1 HOH A 479 4.714 13.051 6.983 1.00 0.00 H 0 +HETATM 1760 H2 HOH A 479 4.473 12.611 5.548 1.00 0.00 H 0 +HETATM 1761 O HOH A 480 35.544 48.917 0.926 1.00 0.00 O 0 +HETATM 1762 H1 HOH A 480 35.875 49.727 1.380 1.00 0.00 H 0 +HETATM 1763 H2 HOH A 480 34.581 48.902 1.204 1.00 0.00 H 0 +HETATM 1764 O HOH A 481 30.484 18.085 43.156 1.00 0.00 O 0 +HETATM 1765 H1 HOH A 481 30.929 18.989 43.116 1.00 0.00 H 0 +HETATM 1766 H2 HOH A 481 29.544 18.074 43.363 1.00 0.00 H 0 +HETATM 1767 O HOH A 482 35.884 47.516 36.912 1.00 0.00 O 0 +HETATM 1768 H1 HOH A 482 34.988 47.860 36.943 1.00 0.00 H 0 +HETATM 1769 H2 HOH A 482 36.033 46.757 37.509 1.00 0.00 H 0 +HETATM 1770 O HOH A 483 50.516 33.723 12.014 1.00 0.00 O 0 +HETATM 1771 H1 HOH A 483 49.958 34.477 12.319 1.00 0.00 H 0 +HETATM 1772 H2 HOH A 483 50.027 33.404 11.196 1.00 0.00 H 0 +HETATM 1773 O HOH A 484 13.087 29.076 27.793 1.00 0.00 O 0 +HETATM 1774 H1 HOH A 484 12.907 29.376 28.720 1.00 0.00 H 0 +HETATM 1775 H2 HOH A 484 12.338 28.584 27.523 1.00 0.00 H 0 +HETATM 1776 O HOH A 485 47.899 42.359 3.785 1.00 0.00 O 0 +HETATM 1777 H1 HOH A 485 48.100 42.220 2.833 1.00 0.00 H 0 +HETATM 1778 H2 HOH A 485 48.542 41.894 4.297 1.00 0.00 H 0 +HETATM 1779 O HOH A 486 16.969 13.063 36.169 1.00 0.00 O 0 +HETATM 1780 H1 HOH A 486 16.920 13.498 36.996 1.00 0.00 H 0 +HETATM 1781 H2 HOH A 486 16.551 13.676 35.575 1.00 0.00 H 0 +HETATM 1782 O HOH A 487 39.755 45.403 22.570 1.00 0.00 O 0 +HETATM 1783 H1 HOH A 487 39.864 46.301 22.215 1.00 0.00 H 0 +HETATM 1784 H2 HOH A 487 40.552 45.259 23.069 1.00 0.00 H 0 +HETATM 1785 O HOH A 488 29.930 46.667 52.743 1.00 0.00 O 0 +HETATM 1786 H1 HOH A 488 29.557 45.792 52.635 1.00 0.00 H 0 +HETATM 1787 H2 HOH A 488 30.755 46.636 53.237 1.00 0.00 H 0 +HETATM 1788 O HOH A 489 3.462 10.047 13.956 1.00 0.00 O 0 +HETATM 1789 H1 HOH A 489 4.204 10.321 13.404 1.00 0.00 H 0 +HETATM 1790 H2 HOH A 489 3.880 9.988 14.774 1.00 0.00 H 0 +HETATM 1791 O HOH A 490 6.467 52.975 17.546 1.00 0.00 O 0 +HETATM 1792 H1 HOH A 490 7.286 52.422 17.294 1.00 0.00 H 0 +HETATM 1793 H2 HOH A 490 5.773 52.847 16.851 1.00 0.00 H 0 +HETATM 1794 O HOH A 491 50.680 6.545 7.902 1.00 0.00 O 0 +HETATM 1795 H1 HOH A 491 50.918 7.484 7.777 1.00 0.00 H 0 +HETATM 1796 H2 HOH A 491 50.007 6.378 7.261 1.00 0.00 H 0 +HETATM 1797 O HOH A 492 30.110 40.544 30.208 1.00 0.00 O 0 +HETATM 1798 H1 HOH A 492 29.602 40.618 29.396 1.00 0.00 H 0 +HETATM 1799 H2 HOH A 492 30.995 40.991 30.026 1.00 0.00 H 0 +HETATM 1800 O HOH A 493 52.734 23.467 30.191 1.00 0.00 O 0 +HETATM 1801 H1 HOH A 493 53.276 22.670 30.435 1.00 0.00 H 0 +HETATM 1802 H2 HOH A 493 51.850 23.179 30.341 1.00 0.00 H 0 +HETATM 1803 O HOH A 494 35.807 12.092 32.901 1.00 0.00 O 0 +HETATM 1804 H1 HOH A 494 36.359 11.356 32.686 1.00 0.00 H 0 +HETATM 1805 H2 HOH A 494 36.260 12.901 32.549 1.00 0.00 H 0 +HETATM 1806 O HOH A 495 12.438 23.298 48.549 1.00 0.00 O 0 +HETATM 1807 H1 HOH A 495 12.630 23.682 49.462 1.00 0.00 H 0 +HETATM 1808 H2 HOH A 495 13.301 22.961 48.333 1.00 0.00 H 0 +HETATM 1809 O HOH A 496 25.596 5.032 37.563 1.00 0.00 O 0 +HETATM 1810 H1 HOH A 496 25.257 4.298 37.071 1.00 0.00 H 0 +HETATM 1811 H2 HOH A 496 25.047 5.806 37.385 1.00 0.00 H 0 +HETATM 1812 O HOH A 497 12.585 34.348 20.994 1.00 0.00 O 0 +HETATM 1813 H1 HOH A 497 13.372 34.229 21.510 1.00 0.00 H 0 +HETATM 1814 H2 HOH A 497 12.109 35.137 21.375 1.00 0.00 H 0 +HETATM 1815 O HOH A 498 46.508 27.910 23.834 1.00 0.00 O 0 +HETATM 1816 H1 HOH A 498 46.616 26.998 24.256 1.00 0.00 H 0 +HETATM 1817 H2 HOH A 498 47.274 28.126 23.370 1.00 0.00 H 0 +HETATM 1818 O HOH A 499 29.993 40.170 20.031 1.00 0.00 O 0 +HETATM 1819 H1 HOH A 499 29.806 40.054 20.959 1.00 0.00 H 0 +HETATM 1820 H2 HOH A 499 30.971 40.255 19.939 1.00 0.00 H 0 +HETATM 1821 O HOH A 500 3.379 11.525 51.514 1.00 0.00 O 0 +HETATM 1822 H1 HOH A 500 2.958 10.637 51.329 1.00 0.00 H 0 +HETATM 1823 H2 HOH A 500 3.157 11.798 52.420 1.00 0.00 H 0 +HETATM 1824 O HOH A 501 26.694 38.849 49.939 1.00 0.00 O 0 +HETATM 1825 H1 HOH A 501 27.508 39.250 49.576 1.00 0.00 H 0 +HETATM 1826 H2 HOH A 501 26.527 39.426 50.695 1.00 0.00 H 0 +HETATM 1827 O HOH A 502 51.673 19.336 52.093 1.00 0.00 O 0 +HETATM 1828 H1 HOH A 502 52.415 18.786 51.944 1.00 0.00 H 0 +HETATM 1829 H2 HOH A 502 51.869 20.126 51.585 1.00 0.00 H 0 +HETATM 1830 O HOH A 503 24.867 3.395 24.764 1.00 0.00 O 0 +HETATM 1831 H1 HOH A 503 25.464 4.027 25.160 1.00 0.00 H 0 +HETATM 1832 H2 HOH A 503 23.989 3.479 25.238 1.00 0.00 H 0 +HETATM 1833 O HOH A 504 33.761 7.414 12.383 1.00 0.00 O 0 +HETATM 1834 H1 HOH A 504 34.318 7.342 11.544 1.00 0.00 H 0 +HETATM 1835 H2 HOH A 504 33.713 8.354 12.555 1.00 0.00 H 0 +HETATM 1836 O HOH A 505 33.085 13.179 52.150 1.00 0.00 O 0 +HETATM 1837 H1 HOH A 505 33.023 12.434 51.525 1.00 0.00 H 0 +HETATM 1838 H2 HOH A 505 33.212 12.783 53.048 1.00 0.00 H 0 +HETATM 1839 O HOH A 506 31.322 26.108 8.670 1.00 0.00 O 0 +HETATM 1840 H1 HOH A 506 31.413 25.632 7.824 1.00 0.00 H 0 +HETATM 1841 H2 HOH A 506 31.860 26.870 8.637 1.00 0.00 H 0 +HETATM 1842 O HOH A 507 17.038 3.416 15.342 1.00 0.00 O 0 +HETATM 1843 H1 HOH A 507 16.887 2.804 16.127 1.00 0.00 H 0 +HETATM 1844 H2 HOH A 507 17.398 2.832 14.670 1.00 0.00 H 0 +HETATM 1845 O HOH A 508 38.776 20.283 4.280 1.00 0.00 O 0 +HETATM 1846 H1 HOH A 508 39.207 20.847 4.977 1.00 0.00 H 0 +HETATM 1847 H2 HOH A 508 38.535 20.950 3.635 1.00 0.00 H 0 +HETATM 1848 O HOH A 509 40.400 38.652 11.749 1.00 0.00 O 0 +HETATM 1849 H1 HOH A 509 40.945 39.341 12.214 1.00 0.00 H 0 +HETATM 1850 H2 HOH A 509 39.970 39.124 11.095 1.00 0.00 H 0 +HETATM 1851 O HOH A 510 33.328 30.555 33.655 1.00 0.00 O 0 +HETATM 1852 H1 HOH A 510 34.197 30.095 33.663 1.00 0.00 H 0 +HETATM 1853 H2 HOH A 510 33.091 30.533 32.746 1.00 0.00 H 0 +HETATM 1854 O HOH A 511 0.368 28.196 29.631 1.00 0.00 O 0 +HETATM 1855 H1 HOH A 511 0.262 27.289 29.903 1.00 0.00 H 0 +HETATM 1856 H2 HOH A 511 0.012 28.390 28.759 1.00 0.00 H 0 +HETATM 1857 O HOH A 512 36.199 2.530 52.524 1.00 0.00 O 0 +HETATM 1858 H1 HOH A 512 35.581 3.188 52.677 1.00 0.00 H 0 +HETATM 1859 H2 HOH A 512 36.572 2.398 53.355 1.00 0.00 H 0 +HETATM 1860 O HOH A 513 45.091 16.773 15.488 1.00 0.00 O 0 +HETATM 1861 H1 HOH A 513 44.174 17.013 15.303 1.00 0.00 H 0 +HETATM 1862 H2 HOH A 513 45.518 17.436 14.999 1.00 0.00 H 0 +HETATM 1863 O HOH A 514 50.702 53.094 28.247 1.00 0.00 O 0 +HETATM 1864 H1 HOH A 514 50.553 53.564 27.398 1.00 0.00 H 0 +HETATM 1865 H2 HOH A 514 50.879 53.735 28.939 1.00 0.00 H 0 +HETATM 1866 O HOH A 515 9.473 37.724 15.414 1.00 0.00 O 0 +HETATM 1867 H1 HOH A 515 10.312 37.209 15.732 1.00 0.00 H 0 +HETATM 1868 H2 HOH A 515 8.825 37.050 15.406 1.00 0.00 H 0 +HETATM 1869 O HOH A 516 47.119 27.847 14.646 1.00 0.00 O 0 +HETATM 1870 H1 HOH A 516 46.452 28.447 14.996 1.00 0.00 H 0 +HETATM 1871 H2 HOH A 516 46.912 27.041 15.097 1.00 0.00 H 0 +HETATM 1872 O HOH A 517 28.837 15.612 15.607 1.00 0.00 O 0 +HETATM 1873 H1 HOH A 517 29.116 15.354 14.700 1.00 0.00 H 0 +HETATM 1874 H2 HOH A 517 28.030 15.154 15.739 1.00 0.00 H 0 +HETATM 1875 O HOH A 518 0.323 21.057 31.425 1.00 0.00 O 0 +HETATM 1876 H1 HOH A 518 -0.103 20.443 30.890 1.00 0.00 H 0 +HETATM 1877 H2 HOH A 518 1.239 20.927 31.224 1.00 0.00 H 0 +HETATM 1878 O HOH A 519 50.180 5.874 17.522 1.00 0.00 O 0 +HETATM 1879 H1 HOH A 519 50.026 6.784 17.500 1.00 0.00 H 0 +HETATM 1880 H2 HOH A 519 49.381 5.514 17.894 1.00 0.00 H 0 +HETATM 1881 O HOH A 520 1.641 35.560 36.724 1.00 0.00 O 0 +HETATM 1882 H1 HOH A 520 1.675 34.547 36.719 1.00 0.00 H 0 +HETATM 1883 H2 HOH A 520 2.537 35.846 36.885 1.00 0.00 H 0 +HETATM 1884 O HOH A 521 2.790 44.274 0.308 1.00 0.00 O 0 +HETATM 1885 H1 HOH A 521 2.781 45.197 0.160 1.00 0.00 H 0 +HETATM 1886 H2 HOH A 521 2.710 44.207 1.293 1.00 0.00 H 0 +HETATM 1887 O HOH A 522 6.563 22.317 11.578 1.00 0.00 O 0 +HETATM 1888 H1 HOH A 522 6.302 21.430 11.649 1.00 0.00 H 0 +HETATM 1889 H2 HOH A 522 7.186 22.344 10.846 1.00 0.00 H 0 +HETATM 1890 O HOH A 523 52.640 2.686 30.591 1.00 0.00 O 0 +HETATM 1891 H1 HOH A 523 52.963 2.837 29.678 1.00 0.00 H 0 +HETATM 1892 H2 HOH A 523 52.980 3.528 30.985 1.00 0.00 H 0 +HETATM 1893 O HOH A 524 3.772 30.603 36.574 1.00 0.00 O 0 +HETATM 1894 H1 HOH A 524 2.951 30.247 37.019 1.00 0.00 H 0 +HETATM 1895 H2 HOH A 524 4.381 29.834 36.335 1.00 0.00 H 0 +HETATM 1896 O HOH A 525 12.828 43.798 41.057 1.00 0.00 O 0 +HETATM 1897 H1 HOH A 525 13.783 43.848 40.926 1.00 0.00 H 0 +HETATM 1898 H2 HOH A 525 12.416 43.859 40.228 1.00 0.00 H 0 +HETATM 1899 O HOH A 526 0.125 14.861 22.499 1.00 0.00 O 0 +HETATM 1900 H1 HOH A 526 0.604 15.307 23.188 1.00 0.00 H 0 +HETATM 1901 H2 HOH A 526 -0.720 14.496 22.880 1.00 0.00 H 0 +HETATM 1902 O HOH A 527 29.298 23.874 1.177 1.00 0.00 O 0 +HETATM 1903 H1 HOH A 527 30.150 23.410 1.017 1.00 0.00 H 0 +HETATM 1904 H2 HOH A 527 29.544 24.729 1.500 1.00 0.00 H 0 +HETATM 1905 O HOH A 528 40.957 14.171 37.727 1.00 0.00 O 0 +HETATM 1906 H1 HOH A 528 41.083 14.636 36.898 1.00 0.00 H 0 +HETATM 1907 H2 HOH A 528 40.305 14.721 38.249 1.00 0.00 H 0 +HETATM 1908 O HOH A 529 10.336 25.638 37.102 1.00 0.00 O 0 +HETATM 1909 H1 HOH A 529 10.863 24.910 36.702 1.00 0.00 H 0 +HETATM 1910 H2 HOH A 529 10.435 25.463 38.042 1.00 0.00 H 0 +HETATM 1911 O HOH A 530 15.967 17.276 23.542 1.00 0.00 O 0 +HETATM 1912 H1 HOH A 530 16.348 16.877 24.314 1.00 0.00 H 0 +HETATM 1913 H2 HOH A 530 16.660 17.729 23.082 1.00 0.00 H 0 +HETATM 1914 O HOH A 531 51.824 37.624 14.325 1.00 0.00 O 0 +HETATM 1915 H1 HOH A 531 52.630 37.047 14.370 1.00 0.00 H 0 +HETATM 1916 H2 HOH A 531 51.845 38.005 15.194 1.00 0.00 H 0 +HETATM 1917 O HOH A 532 26.028 4.763 45.218 1.00 0.00 O 0 +HETATM 1918 H1 HOH A 532 26.580 4.635 44.386 1.00 0.00 H 0 +HETATM 1919 H2 HOH A 532 25.087 4.691 44.963 1.00 0.00 H 0 +HETATM 1920 O HOH A 533 19.592 49.861 26.272 1.00 0.00 O 0 +HETATM 1921 H1 HOH A 533 18.865 49.393 25.792 1.00 0.00 H 0 +HETATM 1922 H2 HOH A 533 20.369 49.318 26.191 1.00 0.00 H 0 +HETATM 1923 O HOH A 534 33.607 27.114 11.927 1.00 0.00 O 0 +HETATM 1924 H1 HOH A 534 34.139 27.806 11.503 1.00 0.00 H 0 +HETATM 1925 H2 HOH A 534 32.861 26.969 11.299 1.00 0.00 H 0 +HETATM 1926 O HOH A 535 34.899 4.537 10.635 1.00 0.00 O 0 +HETATM 1927 H1 HOH A 535 35.423 3.866 11.012 1.00 0.00 H 0 +HETATM 1928 H2 HOH A 535 34.489 5.054 11.352 1.00 0.00 H 0 +HETATM 1929 O HOH A 536 18.740 41.922 12.739 1.00 0.00 O 0 +HETATM 1930 H1 HOH A 536 18.467 41.099 12.337 1.00 0.00 H 0 +HETATM 1931 H2 HOH A 536 18.161 41.970 13.446 1.00 0.00 H 0 +HETATM 1932 O HOH A 537 23.828 42.378 33.778 1.00 0.00 O 0 +HETATM 1933 H1 HOH A 537 22.992 41.915 33.735 1.00 0.00 H 0 +HETATM 1934 H2 HOH A 537 24.374 42.104 34.503 1.00 0.00 H 0 +HETATM 1935 O HOH A 538 31.459 15.736 14.625 1.00 0.00 O 0 +HETATM 1936 H1 HOH A 538 32.114 16.482 14.651 1.00 0.00 H 0 +HETATM 1937 H2 HOH A 538 31.393 15.434 13.767 1.00 0.00 H 0 +HETATM 1938 O HOH A 539 35.525 5.678 22.672 1.00 0.00 O 0 +HETATM 1939 H1 HOH A 539 35.438 6.623 22.529 1.00 0.00 H 0 +HETATM 1940 H2 HOH A 539 36.468 5.419 22.504 1.00 0.00 H 0 +HETATM 1941 O HOH A 540 46.181 5.813 6.480 1.00 0.00 O 0 +HETATM 1942 H1 HOH A 540 45.693 5.374 5.678 1.00 0.00 H 0 +HETATM 1943 H2 HOH A 540 45.540 6.406 6.956 1.00 0.00 H 0 +HETATM 1944 O HOH A 541 31.869 7.791 53.291 1.00 0.00 O 0 +HETATM 1945 H1 HOH A 541 31.287 8.477 52.845 1.00 0.00 H 0 +HETATM 1946 H2 HOH A 541 32.517 7.502 52.603 1.00 0.00 H 0 +HETATM 1947 O HOH A 542 11.821 48.147 20.804 1.00 0.00 O 0 +HETATM 1948 H1 HOH A 542 11.302 47.373 21.025 1.00 0.00 H 0 +HETATM 1949 H2 HOH A 542 12.328 48.371 21.599 1.00 0.00 H 0 +HETATM 1950 O HOH A 543 26.687 20.455 36.411 1.00 0.00 O 0 +HETATM 1951 H1 HOH A 543 27.029 19.785 37.067 1.00 0.00 H 0 +HETATM 1952 H2 HOH A 543 26.174 21.059 36.999 1.00 0.00 H 0 +HETATM 1953 O HOH A 544 42.364 52.220 21.498 1.00 0.00 O 0 +HETATM 1954 H1 HOH A 544 41.465 52.698 21.675 1.00 0.00 H 0 +HETATM 1955 H2 HOH A 544 43.072 52.936 21.600 1.00 0.00 H 0 +HETATM 1956 O HOH A 545 34.867 20.405 14.627 1.00 0.00 O 0 +HETATM 1957 H1 HOH A 545 34.456 21.209 14.962 1.00 0.00 H 0 +HETATM 1958 H2 HOH A 545 35.597 20.718 14.057 1.00 0.00 H 0 +HETATM 1959 O HOH A 546 52.096 9.783 4.875 1.00 0.00 O 0 +HETATM 1960 H1 HOH A 546 51.766 9.565 5.779 1.00 0.00 H 0 +HETATM 1961 H2 HOH A 546 52.630 8.987 4.656 1.00 0.00 H 0 +HETATM 1962 O HOH A 547 27.560 1.699 39.528 1.00 0.00 O 0 +HETATM 1963 H1 HOH A 547 28.170 1.069 39.997 1.00 0.00 H 0 +HETATM 1964 H2 HOH A 547 26.972 2.074 40.207 1.00 0.00 H 0 +HETATM 1965 O HOH A 548 14.140 33.030 17.195 1.00 0.00 O 0 +HETATM 1966 H1 HOH A 548 14.127 32.231 17.810 1.00 0.00 H 0 +HETATM 1967 H2 HOH A 548 15.030 33.374 17.315 1.00 0.00 H 0 +HETATM 1968 O HOH A 549 35.502 52.663 4.082 1.00 0.00 O 0 +HETATM 1969 H1 HOH A 549 35.003 53.261 3.459 1.00 0.00 H 0 +HETATM 1970 H2 HOH A 549 35.741 51.967 3.549 1.00 0.00 H 0 +HETATM 1971 O HOH A 550 14.792 40.702 6.200 1.00 0.00 O 0 +HETATM 1972 H1 HOH A 550 15.078 39.781 6.102 1.00 0.00 H 0 +HETATM 1973 H2 HOH A 550 15.473 41.242 5.854 1.00 0.00 H 0 +HETATM 1974 O HOH A 551 27.496 1.343 30.306 1.00 0.00 O 0 +HETATM 1975 H1 HOH A 551 27.854 1.483 29.439 1.00 0.00 H 0 +HETATM 1976 H2 HOH A 551 28.075 0.724 30.807 1.00 0.00 H 0 +HETATM 1977 O HOH A 552 7.590 8.900 44.889 1.00 0.00 O 0 +HETATM 1978 H1 HOH A 552 7.631 9.470 45.715 1.00 0.00 H 0 +HETATM 1979 H2 HOH A 552 8.334 9.048 44.302 1.00 0.00 H 0 +HETATM 1980 O HOH A 553 16.594 32.271 30.108 1.00 0.00 O 0 +HETATM 1981 H1 HOH A 553 17.317 32.623 29.544 1.00 0.00 H 0 +HETATM 1982 H2 HOH A 553 16.361 32.823 30.846 1.00 0.00 H 0 +HETATM 1983 O HOH A 554 27.534 45.864 23.931 1.00 0.00 O 0 +HETATM 1984 H1 HOH A 554 26.854 45.583 24.551 1.00 0.00 H 0 +HETATM 1985 H2 HOH A 554 28.045 46.543 24.398 1.00 0.00 H 0 +HETATM 1986 O HOH A 555 7.349 34.771 51.829 1.00 0.00 O 0 +HETATM 1987 H1 HOH A 555 8.240 34.590 52.036 1.00 0.00 H 0 +HETATM 1988 H2 HOH A 555 7.234 34.873 50.862 1.00 0.00 H 0 +HETATM 1989 O HOH A 556 52.455 21.372 23.271 1.00 0.00 O 0 +HETATM 1990 H1 HOH A 556 51.493 21.399 22.961 1.00 0.00 H 0 +HETATM 1991 H2 HOH A 556 52.857 22.163 23.038 1.00 0.00 H 0 +HETATM 1992 O HOH A 557 50.738 19.914 32.160 1.00 0.00 O 0 +HETATM 1993 H1 HOH A 557 49.900 19.704 32.583 1.00 0.00 H 0 +HETATM 1994 H2 HOH A 557 51.393 19.532 32.739 1.00 0.00 H 0 +HETATM 1995 O HOH A 558 35.710 29.071 33.845 1.00 0.00 O 0 +HETATM 1996 H1 HOH A 558 36.140 28.265 34.086 1.00 0.00 H 0 +HETATM 1997 H2 HOH A 558 36.454 29.729 33.889 1.00 0.00 H 0 +HETATM 1998 O HOH A 559 2.001 33.710 32.102 1.00 0.00 O 0 +HETATM 1999 H1 HOH A 559 2.124 32.742 32.200 1.00 0.00 H 0 +HETATM 2000 H2 HOH A 559 2.733 34.039 32.594 1.00 0.00 H 0 +HETATM 2001 O HOH A 560 25.041 38.223 28.038 1.00 0.00 O 0 +HETATM 2002 H1 HOH A 560 25.337 38.203 28.973 1.00 0.00 H 0 +HETATM 2003 H2 HOH A 560 25.847 38.429 27.516 1.00 0.00 H 0 +HETATM 2004 O HOH A 561 14.847 2.449 25.314 1.00 0.00 O 0 +HETATM 2005 H1 HOH A 561 15.147 2.998 26.041 1.00 0.00 H 0 +HETATM 2006 H2 HOH A 561 13.951 2.747 25.134 1.00 0.00 H 0 +HETATM 2007 O HOH A 562 35.621 29.469 11.611 1.00 0.00 O 0 +HETATM 2008 H1 HOH A 562 36.232 28.935 12.157 1.00 0.00 H 0 +HETATM 2009 H2 HOH A 562 35.025 29.825 12.271 1.00 0.00 H 0 +HETATM 2010 O HOH A 563 29.148 41.417 10.614 1.00 0.00 O 0 +HETATM 2011 H1 HOH A 563 29.806 41.370 11.271 1.00 0.00 H 0 +HETATM 2012 H2 HOH A 563 28.916 42.381 10.612 1.00 0.00 H 0 +HETATM 2013 O HOH A 564 9.966 53.490 18.606 1.00 0.00 O 0 +HETATM 2014 H1 HOH A 564 10.308 53.350 19.509 1.00 0.00 H 0 +HETATM 2015 H2 HOH A 564 9.592 52.603 18.416 1.00 0.00 H 0 +HETATM 2016 O HOH A 565 53.186 8.156 41.249 1.00 0.00 O 0 +HETATM 2017 H1 HOH A 565 52.802 7.262 41.106 1.00 0.00 H 0 +HETATM 2018 H2 HOH A 565 53.976 8.245 40.666 1.00 0.00 H 0 +HETATM 2019 O HOH A 566 42.832 12.674 33.407 1.00 0.00 O 0 +HETATM 2020 H1 HOH A 566 42.205 12.020 33.758 1.00 0.00 H 0 +HETATM 2021 H2 HOH A 566 42.509 13.570 33.648 1.00 0.00 H 0 +HETATM 2022 O HOH A 567 15.945 48.320 22.820 1.00 0.00 O 0 +HETATM 2023 H1 HOH A 567 16.747 48.146 23.419 1.00 0.00 H 0 +HETATM 2024 H2 HOH A 567 16.363 48.405 21.896 1.00 0.00 H 0 +HETATM 2025 O HOH A 568 27.045 13.315 19.124 1.00 0.00 O 0 +HETATM 2026 H1 HOH A 568 27.987 13.475 19.102 1.00 0.00 H 0 +HETATM 2027 H2 HOH A 568 26.756 13.840 19.892 1.00 0.00 H 0 +HETATM 2028 O HOH A 569 50.887 16.635 44.057 1.00 0.00 O 0 +HETATM 2029 H1 HOH A 569 51.422 17.047 43.453 1.00 0.00 H 0 +HETATM 2030 H2 HOH A 569 50.604 15.887 43.560 1.00 0.00 H 0 +HETATM 2031 O HOH A 570 24.185 32.715 11.445 1.00 0.00 O 0 +HETATM 2032 H1 HOH A 570 24.259 32.737 12.414 1.00 0.00 H 0 +HETATM 2033 H2 HOH A 570 25.042 32.391 11.113 1.00 0.00 H 0 +HETATM 2034 O HOH A 571 22.195 4.890 53.334 1.00 0.00 O 0 +HETATM 2035 H1 HOH A 571 21.536 5.058 54.046 1.00 0.00 H 0 +HETATM 2036 H2 HOH A 571 22.169 5.768 52.894 1.00 0.00 H 0 +HETATM 2037 O HOH A 572 15.473 1.557 3.632 1.00 0.00 O 0 +HETATM 2038 H1 HOH A 572 14.548 1.776 3.860 1.00 0.00 H 0 +HETATM 2039 H2 HOH A 572 15.805 1.059 4.397 1.00 0.00 H 0 +HETATM 2040 O HOH A 573 10.925 53.164 7.526 1.00 0.00 O 0 +HETATM 2041 H1 HOH A 573 11.429 53.588 8.290 1.00 0.00 H 0 +HETATM 2042 H2 HOH A 573 10.151 53.727 7.360 1.00 0.00 H 0 +HETATM 2043 O HOH A 574 7.428 12.129 32.059 1.00 0.00 O 0 +HETATM 2044 H1 HOH A 574 7.713 13.049 31.947 1.00 0.00 H 0 +HETATM 2045 H2 HOH A 574 7.788 11.870 32.930 1.00 0.00 H 0 +HETATM 2046 O HOH A 575 37.093 52.213 13.852 1.00 0.00 O 0 +HETATM 2047 H1 HOH A 575 36.803 53.167 13.930 1.00 0.00 H 0 +HETATM 2048 H2 HOH A 575 36.480 51.623 14.249 1.00 0.00 H 0 +HETATM 2049 O HOH A 576 42.596 44.165 32.216 1.00 0.00 O 0 +HETATM 2050 H1 HOH A 576 42.115 44.805 32.724 1.00 0.00 H 0 +HETATM 2051 H2 HOH A 576 42.725 44.648 31.363 1.00 0.00 H 0 +HETATM 2052 O HOH A 577 35.280 44.159 42.941 1.00 0.00 O 0 +HETATM 2053 H1 HOH A 577 35.768 44.002 42.072 1.00 0.00 H 0 +HETATM 2054 H2 HOH A 577 34.748 44.972 42.842 1.00 0.00 H 0 +HETATM 2055 O HOH A 578 39.821 50.053 44.629 1.00 0.00 O 0 +HETATM 2056 H1 HOH A 578 39.362 50.556 43.924 1.00 0.00 H 0 +HETATM 2057 H2 HOH A 578 40.747 50.425 44.634 1.00 0.00 H 0 +HETATM 2058 O HOH A 579 2.988 39.741 1.547 1.00 0.00 O 0 +HETATM 2059 H1 HOH A 579 3.813 40.343 1.325 1.00 0.00 H 0 +HETATM 2060 H2 HOH A 579 3.363 38.863 1.679 1.00 0.00 H 0 +HETATM 2061 O HOH A 580 28.005 44.492 37.267 1.00 0.00 O 0 +HETATM 2062 H1 HOH A 580 27.235 44.896 37.689 1.00 0.00 H 0 +HETATM 2063 H2 HOH A 580 27.828 44.716 36.314 1.00 0.00 H 0 +HETATM 2064 O HOH A 581 36.365 26.944 8.685 1.00 0.00 O 0 +HETATM 2065 H1 HOH A 581 37.070 27.535 8.311 1.00 0.00 H 0 +HETATM 2066 H2 HOH A 581 36.000 26.280 8.080 1.00 0.00 H 0 +HETATM 2067 O HOH A 582 35.608 11.812 20.678 1.00 0.00 O 0 +HETATM 2068 H1 HOH A 582 35.571 10.976 21.136 1.00 0.00 H 0 +HETATM 2069 H2 HOH A 582 35.319 11.638 19.772 1.00 0.00 H 0 +HETATM 2070 O HOH A 583 14.579 46.301 8.955 1.00 0.00 O 0 +HETATM 2071 H1 HOH A 583 14.327 45.917 9.810 1.00 0.00 H 0 +HETATM 2072 H2 HOH A 583 14.212 47.186 9.125 1.00 0.00 H 0 +HETATM 2073 O HOH A 584 52.341 8.090 52.804 1.00 0.00 O 0 +HETATM 2074 H1 HOH A 584 51.716 7.868 52.088 1.00 0.00 H 0 +HETATM 2075 H2 HOH A 584 52.892 7.366 52.951 1.00 0.00 H 0 +HETATM 2076 O HOH A 585 23.210 13.632 47.350 1.00 0.00 O 0 +HETATM 2077 H1 HOH A 585 23.277 12.986 48.113 1.00 0.00 H 0 +HETATM 2078 H2 HOH A 585 24.134 13.854 47.023 1.00 0.00 H 0 +HETATM 2079 O HOH A 586 30.974 34.957 20.266 1.00 0.00 O 0 +HETATM 2080 H1 HOH A 586 31.389 34.084 19.898 1.00 0.00 H 0 +HETATM 2081 H2 HOH A 586 30.521 34.800 21.110 1.00 0.00 H 0 +HETATM 2082 O HOH A 587 6.763 26.821 4.920 1.00 0.00 O 0 +HETATM 2083 H1 HOH A 587 6.191 26.148 4.618 1.00 0.00 H 0 +HETATM 2084 H2 HOH A 587 6.981 27.057 5.866 1.00 0.00 H 0 +HETATM 2085 O HOH A 588 36.555 42.885 45.326 1.00 0.00 O 0 +HETATM 2086 H1 HOH A 588 35.756 42.552 45.784 1.00 0.00 H 0 +HETATM 2087 H2 HOH A 588 36.184 43.506 44.706 1.00 0.00 H 0 +HETATM 2088 O HOH A 589 29.331 21.739 6.064 1.00 0.00 O 0 +HETATM 2089 H1 HOH A 589 28.597 21.126 5.924 1.00 0.00 H 0 +HETATM 2090 H2 HOH A 589 29.354 21.926 7.012 1.00 0.00 H 0 +HETATM 2091 O HOH A 590 11.113 42.146 0.507 1.00 0.00 O 0 +HETATM 2092 H1 HOH A 590 10.814 41.662 1.298 1.00 0.00 H 0 +HETATM 2093 H2 HOH A 590 12.061 41.917 0.548 1.00 0.00 H 0 +HETATM 2094 O HOH A 591 36.259 49.389 26.896 1.00 0.00 O 0 +HETATM 2095 H1 HOH A 591 36.992 49.069 27.405 1.00 0.00 H 0 +HETATM 2096 H2 HOH A 591 35.542 48.791 27.152 1.00 0.00 H 0 +HETATM 2097 O HOH A 592 5.274 18.161 25.370 1.00 0.00 O 0 +HETATM 2098 H1 HOH A 592 5.139 18.922 24.711 1.00 0.00 H 0 +HETATM 2099 H2 HOH A 592 4.558 18.126 25.968 1.00 0.00 H 0 +HETATM 2100 O HOH A 593 20.785 47.859 52.224 1.00 0.00 O 0 +HETATM 2101 H1 HOH A 593 20.684 48.829 52.455 1.00 0.00 H 0 +HETATM 2102 H2 HOH A 593 20.986 47.721 51.291 1.00 0.00 H 0 +HETATM 2103 O HOH A 594 43.753 8.667 5.653 1.00 0.00 O 0 +HETATM 2104 H1 HOH A 594 43.782 8.015 4.927 1.00 0.00 H 0 +HETATM 2105 H2 HOH A 594 42.953 8.668 6.147 1.00 0.00 H 0 +HETATM 2106 O HOH A 595 20.651 30.243 41.128 1.00 0.00 O 0 +HETATM 2107 H1 HOH A 595 19.847 29.696 40.891 1.00 0.00 H 0 +HETATM 2108 H2 HOH A 595 20.627 31.029 40.568 1.00 0.00 H 0 +HETATM 2109 O HOH A 596 14.907 24.492 1.995 1.00 0.00 O 0 +HETATM 2110 H1 HOH A 596 14.330 23.822 1.557 1.00 0.00 H 0 +HETATM 2111 H2 HOH A 596 15.378 23.996 2.663 1.00 0.00 H 0 +HETATM 2112 O HOH A 597 49.474 25.160 18.907 1.00 0.00 O 0 +HETATM 2113 H1 HOH A 597 48.581 25.032 18.683 1.00 0.00 H 0 +HETATM 2114 H2 HOH A 597 49.855 25.624 18.131 1.00 0.00 H 0 +HETATM 2115 O HOH A 598 24.921 3.474 15.443 1.00 0.00 O 0 +HETATM 2116 H1 HOH A 598 25.606 3.670 14.816 1.00 0.00 H 0 +HETATM 2117 H2 HOH A 598 24.154 3.365 14.845 1.00 0.00 H 0 +HETATM 2118 O HOH A 599 11.426 35.625 16.089 1.00 0.00 O 0 +HETATM 2119 H1 HOH A 599 10.718 35.014 16.470 1.00 0.00 H 0 +HETATM 2120 H2 HOH A 599 12.013 35.735 16.837 1.00 0.00 H 0 +HETATM 2121 O HOH A 600 47.150 43.868 45.140 1.00 0.00 O 0 +HETATM 2122 H1 HOH A 600 46.846 43.076 44.693 1.00 0.00 H 0 +HETATM 2123 H2 HOH A 600 48.007 44.313 44.856 1.00 0.00 H 0 +HETATM 2124 O HOH A 601 8.077 44.464 19.958 1.00 0.00 O 0 +HETATM 2125 H1 HOH A 601 8.505 43.964 19.210 1.00 0.00 H 0 +HETATM 2126 H2 HOH A 601 8.418 45.351 19.980 1.00 0.00 H 0 +HETATM 2127 O HOH A 602 36.346 1.498 14.124 1.00 0.00 O 0 +HETATM 2128 H1 HOH A 602 35.403 1.586 14.109 1.00 0.00 H 0 +HETATM 2129 H2 HOH A 602 36.595 1.780 15.019 1.00 0.00 H 0 +HETATM 2130 O HOH A 603 6.471 40.302 21.889 1.00 0.00 O 0 +HETATM 2131 H1 HOH A 603 6.776 41.213 22.015 1.00 0.00 H 0 +HETATM 2132 H2 HOH A 603 5.707 40.254 21.295 1.00 0.00 H 0 +HETATM 2133 O HOH A 604 0.568 12.745 20.899 1.00 0.00 O 0 +HETATM 2134 H1 HOH A 604 0.267 13.471 21.408 1.00 0.00 H 0 +HETATM 2135 H2 HOH A 604 0.409 13.080 19.976 1.00 0.00 H 0 +HETATM 2136 O HOH A 605 33.543 0.214 41.601 1.00 0.00 O 0 +HETATM 2137 H1 HOH A 605 34.003 0.247 42.443 1.00 0.00 H 0 +HETATM 2138 H2 HOH A 605 32.850 0.849 41.691 1.00 0.00 H 0 +HETATM 2139 O HOH A 606 32.801 8.926 6.275 1.00 0.00 O 0 +HETATM 2140 H1 HOH A 606 31.998 8.727 5.746 1.00 0.00 H 0 +HETATM 2141 H2 HOH A 606 32.716 8.349 7.038 1.00 0.00 H 0 +HETATM 2142 O HOH A 607 43.963 49.348 0.418 1.00 0.00 O 0 +HETATM 2143 H1 HOH A 607 43.821 49.004 1.321 1.00 0.00 H 0 +HETATM 2144 H2 HOH A 607 43.548 48.688 -0.113 1.00 0.00 H 0 +HETATM 2145 O HOH A 608 50.866 31.800 14.079 1.00 0.00 O 0 +HETATM 2146 H1 HOH A 608 50.768 32.462 13.370 1.00 0.00 H 0 +HETATM 2147 H2 HOH A 608 50.120 32.019 14.627 1.00 0.00 H 0 +HETATM 2148 O HOH A 609 14.567 34.909 44.364 1.00 0.00 O 0 +HETATM 2149 H1 HOH A 609 14.153 35.766 44.641 1.00 0.00 H 0 +HETATM 2150 H2 HOH A 609 15.333 35.151 43.787 1.00 0.00 H 0 +HETATM 2151 O HOH A 610 34.728 8.518 15.847 1.00 0.00 O 0 +HETATM 2152 H1 HOH A 610 35.655 8.731 15.680 1.00 0.00 H 0 +HETATM 2153 H2 HOH A 610 34.249 9.376 15.790 1.00 0.00 H 0 +HETATM 2154 O HOH A 611 39.443 29.637 18.239 1.00 0.00 O 0 +HETATM 2155 H1 HOH A 611 39.550 28.720 18.438 1.00 0.00 H 0 +HETATM 2156 H2 HOH A 611 40.009 29.885 17.477 1.00 0.00 H 0 +HETATM 2157 O HOH A 612 12.679 30.420 18.577 1.00 0.00 O 0 +HETATM 2158 H1 HOH A 612 12.850 30.284 19.504 1.00 0.00 H 0 +HETATM 2159 H2 HOH A 612 12.881 29.590 18.190 1.00 0.00 H 0 +HETATM 2160 O HOH A 613 44.575 22.376 42.592 1.00 0.00 O 0 +HETATM 2161 H1 HOH A 613 44.911 21.473 42.394 1.00 0.00 H 0 +HETATM 2162 H2 HOH A 613 43.640 22.251 42.636 1.00 0.00 H 0 +HETATM 2163 O HOH A 614 16.583 52.161 50.700 1.00 0.00 O 0 +HETATM 2164 H1 HOH A 614 17.329 51.543 50.677 1.00 0.00 H 0 +HETATM 2165 H2 HOH A 614 15.801 51.842 50.182 1.00 0.00 H 0 +HETATM 2166 O HOH A 615 47.722 44.766 33.074 1.00 0.00 O 0 +HETATM 2167 H1 HOH A 615 47.344 45.626 32.911 1.00 0.00 H 0 +HETATM 2168 H2 HOH A 615 47.174 44.305 33.696 1.00 0.00 H 0 +HETATM 2169 O HOH A 616 1.415 24.896 18.493 1.00 0.00 O 0 +HETATM 2170 H1 HOH A 616 2.263 24.560 18.314 1.00 0.00 H 0 +HETATM 2171 H2 HOH A 616 0.995 24.099 18.835 1.00 0.00 H 0 +HETATM 2172 O HOH A 617 51.678 24.504 44.759 1.00 0.00 O 0 +HETATM 2173 H1 HOH A 617 50.858 24.318 45.325 1.00 0.00 H 0 +HETATM 2174 H2 HOH A 617 52.397 24.277 45.310 1.00 0.00 H 0 +HETATM 2175 O HOH A 618 19.415 1.564 53.512 1.00 0.00 O 0 +HETATM 2176 H1 HOH A 618 18.582 1.116 53.540 1.00 0.00 H 0 +HETATM 2177 H2 HOH A 618 19.207 2.459 53.200 1.00 0.00 H 0 +HETATM 2178 O HOH A 619 22.664 11.518 25.434 1.00 0.00 O 0 +HETATM 2179 H1 HOH A 619 22.798 11.118 26.278 1.00 0.00 H 0 +HETATM 2180 H2 HOH A 619 22.571 10.818 24.766 1.00 0.00 H 0 +HETATM 2181 O HOH A 620 6.489 16.019 16.849 1.00 0.00 O 0 +HETATM 2182 H1 HOH A 620 5.755 16.274 16.216 1.00 0.00 H 0 +HETATM 2183 H2 HOH A 620 6.067 15.236 17.308 1.00 0.00 H 0 +HETATM 2184 O HOH A 621 47.869 51.774 27.480 1.00 0.00 O 0 +HETATM 2185 H1 HOH A 621 47.620 51.696 28.371 1.00 0.00 H 0 +HETATM 2186 H2 HOH A 621 48.775 52.038 27.551 1.00 0.00 H 0 +HETATM 2187 O HOH A 622 47.609 36.629 47.785 1.00 0.00 O 0 +HETATM 2188 H1 HOH A 622 48.323 36.979 47.291 1.00 0.00 H 0 +HETATM 2189 H2 HOH A 622 46.805 36.989 47.332 1.00 0.00 H 0 +HETATM 2190 O HOH A 623 5.734 20.323 23.137 1.00 0.00 O 0 +HETATM 2191 H1 HOH A 623 6.671 20.177 22.954 1.00 0.00 H 0 +HETATM 2192 H2 HOH A 623 5.660 21.034 23.761 1.00 0.00 H 0 +HETATM 2193 O HOH A 624 13.990 7.487 4.269 1.00 0.00 O 0 +HETATM 2194 H1 HOH A 624 13.793 6.561 4.061 1.00 0.00 H 0 +HETATM 2195 H2 HOH A 624 14.238 7.839 3.361 1.00 0.00 H 0 +HETATM 2196 O HOH A 625 34.518 46.250 3.347 1.00 0.00 O 0 +HETATM 2197 H1 HOH A 625 34.533 45.851 4.228 1.00 0.00 H 0 +HETATM 2198 H2 HOH A 625 34.207 47.130 3.551 1.00 0.00 H 0 +HETATM 2199 O HOH A 626 36.924 6.722 3.175 1.00 0.00 O 0 +HETATM 2200 H1 HOH A 626 37.279 7.378 2.586 1.00 0.00 H 0 +HETATM 2201 H2 HOH A 626 35.984 6.980 3.370 1.00 0.00 H 0 +HETATM 2202 O HOH A 627 15.834 23.200 49.855 1.00 0.00 O 0 +HETATM 2203 H1 HOH A 627 15.132 23.733 50.337 1.00 0.00 H 0 +HETATM 2204 H2 HOH A 627 15.527 22.384 49.437 1.00 0.00 H 0 +HETATM 2205 O HOH A 628 9.148 31.451 27.689 1.00 0.00 O 0 +HETATM 2206 H1 HOH A 628 9.779 31.794 27.050 1.00 0.00 H 0 +HETATM 2207 H2 HOH A 628 8.491 32.089 27.726 1.00 0.00 H 0 +HETATM 2208 O HOH A 629 32.249 17.391 50.093 1.00 0.00 O 0 +HETATM 2209 H1 HOH A 629 31.658 18.056 50.543 1.00 0.00 H 0 +HETATM 2210 H2 HOH A 629 32.098 16.574 50.584 1.00 0.00 H 0 +HETATM 2211 O HOH A 630 22.436 18.693 40.074 1.00 0.00 O 0 +HETATM 2212 H1 HOH A 630 22.795 18.914 41.005 1.00 0.00 H 0 +HETATM 2213 H2 HOH A 630 22.413 19.553 39.638 1.00 0.00 H 0 +HETATM 2214 O HOH A 631 44.339 21.601 17.312 1.00 0.00 O 0 +HETATM 2215 H1 HOH A 631 45.309 21.523 17.308 1.00 0.00 H 0 +HETATM 2216 H2 HOH A 631 44.030 21.736 18.244 1.00 0.00 H 0 +HETATM 2217 O HOH A 632 14.348 22.548 9.121 1.00 0.00 O 0 +HETATM 2218 H1 HOH A 632 13.603 22.723 9.708 1.00 0.00 H 0 +HETATM 2219 H2 HOH A 632 14.307 21.620 8.846 1.00 0.00 H 0 +HETATM 2220 O HOH A 633 39.712 20.401 11.732 1.00 0.00 O 0 +HETATM 2221 H1 HOH A 633 39.500 19.880 12.539 1.00 0.00 H 0 +HETATM 2222 H2 HOH A 633 40.514 20.911 11.907 1.00 0.00 H 0 +HETATM 2223 O HOH A 634 47.015 7.970 32.384 1.00 0.00 O 0 +HETATM 2224 H1 HOH A 634 47.274 8.501 33.106 1.00 0.00 H 0 +HETATM 2225 H2 HOH A 634 46.823 8.466 31.588 1.00 0.00 H 0 +HETATM 2226 O HOH A 635 39.423 39.699 37.691 1.00 0.00 O 0 +HETATM 2227 H1 HOH A 635 39.630 38.779 37.451 1.00 0.00 H 0 +HETATM 2228 H2 HOH A 635 39.179 39.713 38.607 1.00 0.00 H 0 +HETATM 2229 O HOH A 636 50.039 3.363 24.841 1.00 0.00 O 0 +HETATM 2230 H1 HOH A 636 50.454 2.441 24.991 1.00 0.00 H 0 +HETATM 2231 H2 HOH A 636 50.056 3.721 25.737 1.00 0.00 H 0 +HETATM 2232 O HOH A 637 3.520 49.618 52.096 1.00 0.00 O 0 +HETATM 2233 H1 HOH A 637 2.951 50.258 51.575 1.00 0.00 H 0 +HETATM 2234 H2 HOH A 637 4.399 49.298 51.680 1.00 0.00 H 0 +HETATM 2235 O HOH A 638 8.444 1.692 40.773 1.00 0.00 O 0 +HETATM 2236 H1 HOH A 638 8.745 1.646 41.697 1.00 0.00 H 0 +HETATM 2237 H2 HOH A 638 7.577 1.305 40.739 1.00 0.00 H 0 +HETATM 2238 O HOH A 639 26.161 8.981 14.011 1.00 0.00 O 0 +HETATM 2239 H1 HOH A 639 26.049 8.094 14.454 1.00 0.00 H 0 +HETATM 2240 H2 HOH A 639 26.096 8.868 13.088 1.00 0.00 H 0 +HETATM 2241 O HOH A 640 19.144 3.230 42.890 1.00 0.00 O 0 +HETATM 2242 H1 HOH A 640 18.950 4.080 42.422 1.00 0.00 H 0 +HETATM 2243 H2 HOH A 640 18.703 2.494 42.415 1.00 0.00 H 0 +HETATM 2244 O HOH A 641 18.345 5.470 5.154 1.00 0.00 O 0 +HETATM 2245 H1 HOH A 641 17.456 5.580 5.528 1.00 0.00 H 0 +HETATM 2246 H2 HOH A 641 18.434 6.139 4.441 1.00 0.00 H 0 +HETATM 2247 O HOH A 642 1.585 17.687 16.046 1.00 0.00 O 0 +HETATM 2248 H1 HOH A 642 1.089 17.017 16.504 1.00 0.00 H 0 +HETATM 2249 H2 HOH A 642 1.694 18.453 16.626 1.00 0.00 H 0 +HETATM 2250 O HOH A 643 4.008 1.124 50.169 1.00 0.00 O 0 +HETATM 2251 H1 HOH A 643 4.522 0.474 50.683 1.00 0.00 H 0 +HETATM 2252 H2 HOH A 643 3.155 1.113 50.678 1.00 0.00 H 0 +HETATM 2253 O HOH A 644 35.307 24.758 7.246 1.00 0.00 O 0 +HETATM 2254 H1 HOH A 644 36.108 24.272 6.863 1.00 0.00 H 0 +HETATM 2255 H2 HOH A 644 34.853 24.999 6.420 1.00 0.00 H 0 +HETATM 2256 O HOH A 645 32.333 18.074 4.985 1.00 0.00 O 0 +HETATM 2257 H1 HOH A 645 32.065 18.998 5.280 1.00 0.00 H 0 +HETATM 2258 H2 HOH A 645 33.295 18.059 5.097 1.00 0.00 H 0 +HETATM 2259 O HOH A 646 12.949 8.779 17.389 1.00 0.00 O 0 +HETATM 2260 H1 HOH A 646 12.293 7.999 17.495 1.00 0.00 H 0 +HETATM 2261 H2 HOH A 646 13.620 8.693 18.071 1.00 0.00 H 0 +HETATM 2262 O HOH A 647 16.259 15.530 19.680 1.00 0.00 O 0 +HETATM 2263 H1 HOH A 647 15.668 15.199 20.388 1.00 0.00 H 0 +HETATM 2264 H2 HOH A 647 15.937 16.439 19.594 1.00 0.00 H 0 +HETATM 2265 O HOH A 648 9.945 7.872 53.054 1.00 0.00 O 0 +HETATM 2266 H1 HOH A 648 9.692 7.711 54.005 1.00 0.00 H 0 +HETATM 2267 H2 HOH A 648 10.306 7.028 52.878 1.00 0.00 H 0 +HETATM 2268 O HOH A 649 49.021 6.107 5.786 1.00 0.00 O 0 +HETATM 2269 H1 HOH A 649 48.082 6.101 6.034 1.00 0.00 H 0 +HETATM 2270 H2 HOH A 649 49.204 6.969 5.513 1.00 0.00 H 0 +HETATM 2271 O HOH A 650 7.307 4.899 14.992 1.00 0.00 O 0 +HETATM 2272 H1 HOH A 650 6.913 5.085 14.128 1.00 0.00 H 0 +HETATM 2273 H2 HOH A 650 6.853 5.534 15.583 1.00 0.00 H 0 +HETATM 2274 O HOH A 651 5.936 2.770 7.539 1.00 0.00 O 0 +HETATM 2275 H1 HOH A 651 6.231 3.273 6.720 1.00 0.00 H 0 +HETATM 2276 H2 HOH A 651 5.167 2.195 7.398 1.00 0.00 H 0 +HETATM 2277 O HOH A 652 43.492 40.874 44.560 1.00 0.00 O 0 +HETATM 2278 H1 HOH A 652 42.696 41.299 44.365 1.00 0.00 H 0 +HETATM 2279 H2 HOH A 652 43.617 41.209 45.435 1.00 0.00 H 0 +HETATM 2280 O HOH A 653 46.186 19.017 20.314 1.00 0.00 O 0 +HETATM 2281 H1 HOH A 653 46.928 19.645 20.249 1.00 0.00 H 0 +HETATM 2282 H2 HOH A 653 45.754 19.022 19.470 1.00 0.00 H 0 +HETATM 2283 O HOH A 654 45.660 29.204 33.388 1.00 0.00 O 0 +HETATM 2284 H1 HOH A 654 46.117 28.410 32.991 1.00 0.00 H 0 +HETATM 2285 H2 HOH A 654 46.083 29.967 33.053 1.00 0.00 H 0 +HETATM 2286 O HOH A 655 52.356 46.973 43.398 1.00 0.00 O 0 +HETATM 2287 H1 HOH A 655 53.084 46.695 42.852 1.00 0.00 H 0 +HETATM 2288 H2 HOH A 655 51.929 47.679 42.923 1.00 0.00 H 0 +HETATM 2289 O HOH A 656 32.450 36.840 47.030 1.00 0.00 O 0 +HETATM 2290 H1 HOH A 656 32.389 36.178 47.721 1.00 0.00 H 0 +HETATM 2291 H2 HOH A 656 33.450 37.108 46.968 1.00 0.00 H 0 +HETATM 2292 O HOH A 657 10.936 11.171 48.537 1.00 0.00 O 0 +HETATM 2293 H1 HOH A 657 10.013 10.932 48.275 1.00 0.00 H 0 +HETATM 2294 H2 HOH A 657 10.885 11.419 49.487 1.00 0.00 H 0 +HETATM 2295 O HOH A 658 23.843 10.162 42.339 1.00 0.00 O 0 +HETATM 2296 H1 HOH A 658 24.004 10.556 41.480 1.00 0.00 H 0 +HETATM 2297 H2 HOH A 658 24.311 9.372 42.320 1.00 0.00 H 0 +HETATM 2298 O HOH A 659 9.441 39.295 31.171 1.00 0.00 O 0 +HETATM 2299 H1 HOH A 659 10.183 38.999 31.682 1.00 0.00 H 0 +HETATM 2300 H2 HOH A 659 8.972 39.894 31.697 1.00 0.00 H 0 +HETATM 2301 O HOH A 660 50.614 10.113 49.469 1.00 0.00 O 0 +HETATM 2302 H1 HOH A 660 50.065 10.773 49.044 1.00 0.00 H 0 +HETATM 2303 H2 HOH A 660 50.588 10.363 50.372 1.00 0.00 H 0 +HETATM 2304 O HOH A 661 25.706 5.694 22.632 1.00 0.00 O 0 +HETATM 2305 H1 HOH A 661 25.983 5.837 23.545 1.00 0.00 H 0 +HETATM 2306 H2 HOH A 661 26.176 4.895 22.307 1.00 0.00 H 0 +HETATM 2307 O HOH A 662 30.964 31.656 44.857 1.00 0.00 O 0 +HETATM 2308 H1 HOH A 662 31.623 32.108 45.420 1.00 0.00 H 0 +HETATM 2309 H2 HOH A 662 30.673 32.363 44.324 1.00 0.00 H 0 +HETATM 2310 O HOH A 663 4.387 12.015 37.458 1.00 0.00 O 0 +HETATM 2311 H1 HOH A 663 4.866 11.191 37.329 1.00 0.00 H 0 +HETATM 2312 H2 HOH A 663 4.640 12.656 36.780 1.00 0.00 H 0 +HETATM 2313 O HOH A 664 6.332 48.310 8.168 1.00 0.00 O 0 +HETATM 2314 H1 HOH A 664 7.164 48.403 7.660 1.00 0.00 H 0 +HETATM 2315 H2 HOH A 664 5.735 48.222 7.438 1.00 0.00 H 0 +HETATM 2316 O HOH A 665 4.314 7.801 12.353 1.00 0.00 O 0 +HETATM 2317 H1 HOH A 665 3.400 7.786 11.938 1.00 0.00 H 0 +HETATM 2318 H2 HOH A 665 4.175 8.493 12.986 1.00 0.00 H 0 +HETATM 2319 O HOH A 666 35.637 1.648 8.856 1.00 0.00 O 0 +HETATM 2320 H1 HOH A 666 36.098 1.189 8.173 1.00 0.00 H 0 +HETATM 2321 H2 HOH A 666 36.104 2.503 8.859 1.00 0.00 H 0 +HETATM 2322 O HOH A 667 20.474 2.654 2.236 1.00 0.00 O 0 +HETATM 2323 H1 HOH A 667 20.066 2.352 1.456 1.00 0.00 H 0 +HETATM 2324 H2 HOH A 667 19.777 2.605 2.893 1.00 0.00 H 0 +HETATM 2325 O HOH A 668 24.176 13.646 15.126 1.00 0.00 O 0 +HETATM 2326 H1 HOH A 668 23.403 14.160 15.075 1.00 0.00 H 0 +HETATM 2327 H2 HOH A 668 24.021 12.803 14.734 1.00 0.00 H 0 +HETATM 2328 O HOH A 669 12.176 24.873 1.811 1.00 0.00 O 0 +HETATM 2329 H1 HOH A 669 11.722 24.117 1.317 1.00 0.00 H 0 +HETATM 2330 H2 HOH A 669 11.392 25.064 2.372 1.00 0.00 H 0 +HETATM 2331 O HOH A 670 21.873 26.488 44.248 1.00 0.00 O 0 +HETATM 2332 H1 HOH A 670 22.811 26.457 44.487 1.00 0.00 H 0 +HETATM 2333 H2 HOH A 670 21.429 26.450 45.059 1.00 0.00 H 0 +HETATM 2334 O HOH A 671 34.689 46.772 44.370 1.00 0.00 O 0 +HETATM 2335 H1 HOH A 671 34.371 47.451 44.967 1.00 0.00 H 0 +HETATM 2336 H2 HOH A 671 35.069 46.102 44.878 1.00 0.00 H 0 +HETATM 2337 O HOH A 672 38.270 2.461 37.876 1.00 0.00 O 0 +HETATM 2338 H1 HOH A 672 38.303 2.834 36.959 1.00 0.00 H 0 +HETATM 2339 H2 HOH A 672 38.198 1.503 37.662 1.00 0.00 H 0 +HETATM 2340 O HOH A 673 1.841 30.849 21.361 1.00 0.00 O 0 +HETATM 2341 H1 HOH A 673 2.375 31.422 20.789 1.00 0.00 H 0 +HETATM 2342 H2 HOH A 673 2.268 30.863 22.246 1.00 0.00 H 0 +HETATM 2343 O HOH A 674 37.148 1.757 50.100 1.00 0.00 O 0 +HETATM 2344 H1 HOH A 674 36.456 1.435 49.504 1.00 0.00 H 0 +HETATM 2345 H2 HOH A 674 36.655 1.997 50.899 1.00 0.00 H 0 +HETATM 2346 O HOH A 675 11.514 46.028 28.477 1.00 0.00 O 0 +HETATM 2347 H1 HOH A 675 11.237 45.686 29.330 1.00 0.00 H 0 +HETATM 2348 H2 HOH A 675 10.699 46.119 28.002 1.00 0.00 H 0 +HETATM 2349 O HOH A 676 45.734 25.098 11.199 1.00 0.00 O 0 +HETATM 2350 H1 HOH A 676 44.876 25.166 10.793 1.00 0.00 H 0 +HETATM 2351 H2 HOH A 676 45.635 24.557 11.952 1.00 0.00 H 0 +HETATM 2352 O HOH A 677 28.939 32.523 28.259 1.00 0.00 O 0 +HETATM 2353 H1 HOH A 677 28.438 32.160 28.998 1.00 0.00 H 0 +HETATM 2354 H2 HOH A 677 29.895 32.355 28.424 1.00 0.00 H 0 +HETATM 2355 O HOH A 678 49.507 1.796 18.194 1.00 0.00 O 0 +HETATM 2356 H1 HOH A 678 50.412 1.942 18.577 1.00 0.00 H 0 +HETATM 2357 H2 HOH A 678 49.335 0.842 18.285 1.00 0.00 H 0 +HETATM 2358 O HOH A 679 36.307 29.206 51.066 1.00 0.00 O 0 +HETATM 2359 H1 HOH A 679 35.965 30.072 50.792 1.00 0.00 H 0 +HETATM 2360 H2 HOH A 679 35.637 28.968 51.680 1.00 0.00 H 0 +HETATM 2361 O HOH A 680 13.043 11.830 40.770 1.00 0.00 O 0 +HETATM 2362 H1 HOH A 680 12.211 12.068 41.190 1.00 0.00 H 0 +HETATM 2363 H2 HOH A 680 13.713 12.450 41.117 1.00 0.00 H 0 +HETATM 2364 O HOH A 681 26.436 37.987 20.571 1.00 0.00 O 0 +HETATM 2365 H1 HOH A 681 26.272 37.227 21.200 1.00 0.00 H 0 +HETATM 2366 H2 HOH A 681 26.915 37.622 19.811 1.00 0.00 H 0 +HETATM 2367 O HOH A 682 3.282 30.410 4.844 1.00 0.00 O 0 +HETATM 2368 H1 HOH A 682 4.079 30.818 4.650 1.00 0.00 H 0 +HETATM 2369 H2 HOH A 682 3.494 29.491 4.879 1.00 0.00 H 0 +HETATM 2370 O HOH A 683 33.005 49.286 19.140 1.00 0.00 O 0 +HETATM 2371 H1 HOH A 683 33.065 48.409 19.399 1.00 0.00 H 0 +HETATM 2372 H2 HOH A 683 32.095 49.622 19.194 1.00 0.00 H 0 +HETATM 2373 O HOH A 684 39.822 47.823 21.333 1.00 0.00 O 0 +HETATM 2374 H1 HOH A 684 40.398 48.445 21.737 1.00 0.00 H 0 +HETATM 2375 H2 HOH A 684 38.904 47.907 21.653 1.00 0.00 H 0 +HETATM 2376 O HOH A 685 37.429 50.934 34.588 1.00 0.00 O 0 +HETATM 2377 H1 HOH A 685 38.128 51.013 33.928 1.00 0.00 H 0 +HETATM 2378 H2 HOH A 685 37.780 50.474 35.446 1.00 0.00 H 0 +HETATM 2379 O HOH A 686 48.560 30.639 19.973 1.00 0.00 O 0 +HETATM 2380 H1 HOH A 686 48.383 30.904 19.097 1.00 0.00 H 0 +HETATM 2381 H2 HOH A 686 48.241 31.350 20.640 1.00 0.00 H 0 +HETATM 2382 O HOH A 687 6.809 14.622 26.828 1.00 0.00 O 0 +HETATM 2383 H1 HOH A 687 6.270 14.890 27.559 1.00 0.00 H 0 +HETATM 2384 H2 HOH A 687 7.479 15.415 26.682 1.00 0.00 H 0 +HETATM 2385 O HOH A 688 45.183 48.686 49.116 1.00 0.00 O 0 +HETATM 2386 H1 HOH A 688 45.693 49.472 49.370 1.00 0.00 H 0 +HETATM 2387 H2 HOH A 688 45.633 47.881 49.410 1.00 0.00 H 0 +HETATM 2388 O HOH A 689 51.374 34.786 15.718 1.00 0.00 O 0 +HETATM 2389 H1 HOH A 689 51.952 34.049 15.527 1.00 0.00 H 0 +HETATM 2390 H2 HOH A 689 51.258 35.389 15.012 1.00 0.00 H 0 +HETATM 2391 O HOH A 690 35.615 20.908 42.460 1.00 0.00 O 0 +HETATM 2392 H1 HOH A 690 35.233 21.792 42.446 1.00 0.00 H 0 +HETATM 2393 H2 HOH A 690 34.891 20.446 42.993 1.00 0.00 H 0 +HETATM 2394 O HOH A 691 41.129 23.442 18.774 1.00 0.00 O 0 +HETATM 2395 H1 HOH A 691 40.629 23.672 19.509 1.00 0.00 H 0 +HETATM 2396 H2 HOH A 691 41.219 22.487 18.690 1.00 0.00 H 0 +HETATM 2397 O HOH A 692 9.347 27.418 12.681 1.00 0.00 O 0 +HETATM 2398 H1 HOH A 692 9.678 26.799 13.427 1.00 0.00 H 0 +HETATM 2399 H2 HOH A 692 10.186 27.732 12.366 1.00 0.00 H 0 +HETATM 2400 O HOH A 693 1.704 42.719 31.676 1.00 0.00 O 0 +HETATM 2401 H1 HOH A 693 1.936 41.755 31.814 1.00 0.00 H 0 +HETATM 2402 H2 HOH A 693 2.507 43.061 32.088 1.00 0.00 H 0 +HETATM 2403 O HOH A 694 13.721 1.586 42.667 1.00 0.00 O 0 +HETATM 2404 H1 HOH A 694 13.376 0.639 42.796 1.00 0.00 H 0 +HETATM 2405 H2 HOH A 694 13.311 2.016 43.432 1.00 0.00 H 0 +HETATM 2406 O HOH A 695 2.136 5.139 17.207 1.00 0.00 O 0 +HETATM 2407 H1 HOH A 695 2.523 5.770 16.644 1.00 0.00 H 0 +HETATM 2408 H2 HOH A 695 1.225 5.451 17.384 1.00 0.00 H 0 +HETATM 2409 O HOH A 696 5.292 15.896 33.584 1.00 0.00 O 0 +HETATM 2410 H1 HOH A 696 4.407 16.140 33.266 1.00 0.00 H 0 +HETATM 2411 H2 HOH A 696 5.486 16.372 34.414 1.00 0.00 H 0 +HETATM 2412 O HOH A 697 33.893 33.766 3.053 1.00 0.00 O 0 +HETATM 2413 H1 HOH A 697 33.901 32.988 3.599 1.00 0.00 H 0 +HETATM 2414 H2 HOH A 697 34.492 33.632 2.323 1.00 0.00 H 0 +HETATM 2415 O HOH A 698 17.721 15.392 9.499 1.00 0.00 O 0 +HETATM 2416 H1 HOH A 698 18.466 15.512 10.105 1.00 0.00 H 0 +HETATM 2417 H2 HOH A 698 17.203 14.638 9.730 1.00 0.00 H 0 +HETATM 2418 O HOH A 699 39.140 24.752 37.766 1.00 0.00 O 0 +HETATM 2419 H1 HOH A 699 38.663 23.930 38.108 1.00 0.00 H 0 +HETATM 2420 H2 HOH A 699 39.140 24.623 36.820 1.00 0.00 H 0 +HETATM 2421 O HOH A 700 41.084 31.757 0.585 1.00 0.00 O 0 +HETATM 2422 H1 HOH A 700 41.250 30.953 1.066 1.00 0.00 H 0 +HETATM 2423 H2 HOH A 700 41.550 31.649 -0.268 1.00 0.00 H 0 +HETATM 2424 O HOH A 701 35.882 2.308 2.711 1.00 0.00 O 0 +HETATM 2425 H1 HOH A 701 36.195 2.911 2.014 1.00 0.00 H 0 +HETATM 2426 H2 HOH A 701 36.634 2.138 3.312 1.00 0.00 H 0 +HETATM 2427 O HOH A 702 0.781 3.890 51.867 1.00 0.00 O 0 +HETATM 2428 H1 HOH A 702 0.789 3.969 50.927 1.00 0.00 H 0 +HETATM 2429 H2 HOH A 702 1.652 3.485 52.110 1.00 0.00 H 0 +HETATM 2430 O HOH A 703 14.010 46.828 44.381 1.00 0.00 O 0 +HETATM 2431 H1 HOH A 703 13.771 45.986 44.782 1.00 0.00 H 0 +HETATM 2432 H2 HOH A 703 14.849 47.131 44.742 1.00 0.00 H 0 +HETATM 2433 O HOH A 704 6.040 20.007 39.129 1.00 0.00 O 0 +HETATM 2434 H1 HOH A 704 5.989 19.143 38.572 1.00 0.00 H 0 +HETATM 2435 H2 HOH A 704 6.748 20.588 38.741 1.00 0.00 H 0 +HETATM 2436 O HOH A 705 31.700 9.557 16.668 1.00 0.00 O 0 +HETATM 2437 H1 HOH A 705 31.321 9.480 17.547 1.00 0.00 H 0 +HETATM 2438 H2 HOH A 705 30.952 9.264 16.111 1.00 0.00 H 0 +HETATM 2439 O HOH A 706 49.159 39.441 49.077 1.00 0.00 O 0 +HETATM 2440 H1 HOH A 706 48.401 39.571 48.458 1.00 0.00 H 0 +HETATM 2441 H2 HOH A 706 49.618 40.288 49.019 1.00 0.00 H 0 +HETATM 2442 O HOH A 707 39.069 53.129 36.719 1.00 0.00 O 0 +HETATM 2443 H1 HOH A 707 38.844 53.185 37.688 1.00 0.00 H 0 +HETATM 2444 H2 HOH A 707 38.256 53.395 36.262 1.00 0.00 H 0 +HETATM 2445 O HOH A 708 39.378 21.596 6.600 1.00 0.00 O 0 +HETATM 2446 H1 HOH A 708 40.165 22.162 6.704 1.00 0.00 H 0 +HETATM 2447 H2 HOH A 708 39.564 20.699 6.989 1.00 0.00 H 0 +HETATM 2448 O HOH A 709 14.413 10.881 29.941 1.00 0.00 O 0 +HETATM 2449 H1 HOH A 709 14.624 11.049 29.006 1.00 0.00 H 0 +HETATM 2450 H2 HOH A 709 15.215 10.627 30.274 1.00 0.00 H 0 +HETATM 2451 O HOH A 710 24.254 7.139 36.378 1.00 0.00 O 0 +HETATM 2452 H1 HOH A 710 24.769 7.235 35.568 1.00 0.00 H 0 +HETATM 2453 H2 HOH A 710 23.448 6.655 36.086 1.00 0.00 H 0 +HETATM 2454 O HOH A 711 21.895 2.863 42.844 1.00 0.00 O 0 +HETATM 2455 H1 HOH A 711 22.241 3.148 43.705 1.00 0.00 H 0 +HETATM 2456 H2 HOH A 711 20.940 2.869 42.840 1.00 0.00 H 0 +HETATM 2457 O HOH A 712 46.795 25.468 16.019 1.00 0.00 O 0 +HETATM 2458 H1 HOH A 712 47.044 25.308 16.889 1.00 0.00 H 0 +HETATM 2459 H2 HOH A 712 45.839 25.272 15.967 1.00 0.00 H 0 +HETATM 2460 O HOH A 713 35.619 3.813 32.559 1.00 0.00 O 0 +HETATM 2461 H1 HOH A 713 35.825 4.461 33.206 1.00 0.00 H 0 +HETATM 2462 H2 HOH A 713 36.107 3.063 32.895 1.00 0.00 H 0 +HETATM 2463 O HOH A 714 22.629 30.409 15.291 1.00 0.00 O 0 +HETATM 2464 H1 HOH A 714 22.983 29.789 14.668 1.00 0.00 H 0 +HETATM 2465 H2 HOH A 714 22.082 30.944 14.672 1.00 0.00 H 0 +HETATM 2466 O HOH A 715 40.509 21.507 29.733 1.00 0.00 O 0 +HETATM 2467 H1 HOH A 715 40.904 20.745 30.127 1.00 0.00 H 0 +HETATM 2468 H2 HOH A 715 40.015 21.242 28.956 1.00 0.00 H 0 +HETATM 2469 O HOH A 716 12.131 18.963 38.645 1.00 0.00 O 0 +HETATM 2470 H1 HOH A 716 12.219 19.375 39.540 1.00 0.00 H 0 +HETATM 2471 H2 HOH A 716 13.014 18.747 38.339 1.00 0.00 H 0 +HETATM 2472 O HOH A 717 31.117 10.429 44.467 1.00 0.00 O 0 +HETATM 2473 H1 HOH A 717 31.965 10.858 44.338 1.00 0.00 H 0 +HETATM 2474 H2 HOH A 717 30.480 11.173 44.608 1.00 0.00 H 0 +HETATM 2475 O HOH A 718 27.041 2.029 45.955 1.00 0.00 O 0 +HETATM 2476 H1 HOH A 718 26.821 2.897 45.680 1.00 0.00 H 0 +HETATM 2477 H2 HOH A 718 26.507 1.915 46.752 1.00 0.00 H 0 +HETATM 2478 O HOH A 719 40.468 36.633 3.353 1.00 0.00 O 0 +HETATM 2479 H1 HOH A 719 40.456 35.769 2.902 1.00 0.00 H 0 +HETATM 2480 H2 HOH A 719 41.345 37.026 3.169 1.00 0.00 H 0 +HETATM 2481 O HOH A 720 11.927 33.185 47.010 1.00 0.00 O 0 +HETATM 2482 H1 HOH A 720 11.596 33.240 46.073 1.00 0.00 H 0 +HETATM 2483 H2 HOH A 720 12.447 32.352 46.941 1.00 0.00 H 0 +HETATM 2484 O HOH A 721 0.942 0.440 5.741 1.00 0.00 O 0 +HETATM 2485 H1 HOH A 721 0.712 1.277 5.337 1.00 0.00 H 0 +HETATM 2486 H2 HOH A 721 0.454 0.167 6.553 1.00 0.00 H 0 +HETATM 2487 O HOH A 722 31.667 22.725 45.041 1.00 0.00 O 0 +HETATM 2488 H1 HOH A 722 31.086 23.492 45.260 1.00 0.00 H 0 +HETATM 2489 H2 HOH A 722 31.798 22.211 45.850 1.00 0.00 H 0 +HETATM 2490 O HOH A 723 15.099 42.508 44.547 1.00 0.00 O 0 +HETATM 2491 H1 HOH A 723 14.725 41.619 44.576 1.00 0.00 H 0 +HETATM 2492 H2 HOH A 723 15.419 42.607 43.646 1.00 0.00 H 0 +HETATM 2493 O HOH A 724 25.232 15.585 0.281 1.00 0.00 O 0 +HETATM 2494 H1 HOH A 724 25.462 15.489 1.181 1.00 0.00 H 0 +HETATM 2495 H2 HOH A 724 24.342 15.178 0.284 1.00 0.00 H 0 +HETATM 2496 O HOH A 725 49.481 4.557 27.278 1.00 0.00 O 0 +HETATM 2497 H1 HOH A 725 49.194 3.847 27.858 1.00 0.00 H 0 +HETATM 2498 H2 HOH A 725 48.736 5.119 27.160 1.00 0.00 H 0 +HETATM 2499 O HOH A 726 23.702 50.000 25.816 1.00 0.00 O 0 +HETATM 2500 H1 HOH A 726 23.899 49.744 24.924 1.00 0.00 H 0 +HETATM 2501 H2 HOH A 726 23.720 51.007 25.812 1.00 0.00 H 0 +HETATM 2502 O HOH A 727 28.395 23.699 4.103 1.00 0.00 O 0 +HETATM 2503 H1 HOH A 727 28.768 22.953 4.582 1.00 0.00 H 0 +HETATM 2504 H2 HOH A 727 28.470 23.564 3.170 1.00 0.00 H 0 +HETATM 2505 O HOH A 728 11.285 20.635 9.549 1.00 0.00 O 0 +HETATM 2506 H1 HOH A 728 11.424 21.269 10.259 1.00 0.00 H 0 +HETATM 2507 H2 HOH A 728 11.232 21.160 8.720 1.00 0.00 H 0 +HETATM 2508 O HOH A 729 6.083 8.769 26.154 1.00 0.00 O 0 +HETATM 2509 H1 HOH A 729 5.169 8.481 25.908 1.00 0.00 H 0 +HETATM 2510 H2 HOH A 729 6.541 7.920 26.132 1.00 0.00 H 0 +HETATM 2511 O HOH A 730 30.581 36.731 12.197 1.00 0.00 O 0 +HETATM 2512 H1 HOH A 730 30.198 36.331 12.967 1.00 0.00 H 0 +HETATM 2513 H2 HOH A 730 31.509 36.595 12.454 1.00 0.00 H 0 +HETATM 2514 O HOH A 731 11.540 28.009 20.721 1.00 0.00 O 0 +HETATM 2515 H1 HOH A 731 11.173 27.155 21.134 1.00 0.00 H 0 +HETATM 2516 H2 HOH A 731 10.940 28.255 20.019 1.00 0.00 H 0 +HETATM 2517 O HOH A 732 8.331 28.606 27.117 1.00 0.00 O 0 +HETATM 2518 H1 HOH A 732 8.691 29.474 27.166 1.00 0.00 H 0 +HETATM 2519 H2 HOH A 732 8.252 28.281 28.015 1.00 0.00 H 0 +HETATM 2520 O HOH A 733 50.115 51.284 12.629 1.00 0.00 O 0 +HETATM 2521 H1 HOH A 733 50.238 50.357 12.898 1.00 0.00 H 0 +HETATM 2522 H2 HOH A 733 51.037 51.627 12.721 1.00 0.00 H 0 +HETATM 2523 O HOH A 734 4.292 35.050 24.324 1.00 0.00 O 0 +HETATM 2524 H1 HOH A 734 3.834 35.691 24.876 1.00 0.00 H 0 +HETATM 2525 H2 HOH A 734 4.997 34.739 24.822 1.00 0.00 H 0 +HETATM 2526 O HOH A 735 45.216 23.440 13.520 1.00 0.00 O 0 +HETATM 2527 H1 HOH A 735 44.814 23.726 14.368 1.00 0.00 H 0 +HETATM 2528 H2 HOH A 735 44.719 22.777 13.045 1.00 0.00 H 0 +HETATM 2529 O HOH A 736 36.678 50.676 51.768 1.00 0.00 O 0 +HETATM 2530 H1 HOH A 736 36.242 50.193 52.521 1.00 0.00 H 0 +HETATM 2531 H2 HOH A 736 36.882 51.606 52.166 1.00 0.00 H 0 +HETATM 2532 O HOH A 737 38.177 24.115 11.404 1.00 0.00 O 0 +HETATM 2533 H1 HOH A 737 38.193 23.961 10.447 1.00 0.00 H 0 +HETATM 2534 H2 HOH A 737 37.221 24.156 11.672 1.00 0.00 H 0 +HETATM 2535 O HOH A 738 22.879 44.996 42.961 1.00 0.00 O 0 +HETATM 2536 H1 HOH A 738 22.689 44.476 42.178 1.00 0.00 H 0 +HETATM 2537 H2 HOH A 738 23.798 45.304 42.941 1.00 0.00 H 0 +HETATM 2538 O HOH A 739 33.416 19.672 17.245 1.00 0.00 O 0 +HETATM 2539 H1 HOH A 739 33.922 20.218 16.691 1.00 0.00 H 0 +HETATM 2540 H2 HOH A 739 32.595 20.135 17.392 1.00 0.00 H 0 +HETATM 2541 O HOH A 740 9.743 28.287 36.201 1.00 0.00 O 0 +HETATM 2542 H1 HOH A 740 10.079 27.419 36.390 1.00 0.00 H 0 +HETATM 2543 H2 HOH A 740 8.749 28.300 36.256 1.00 0.00 H 0 +HETATM 2544 O HOH A 741 36.280 44.405 49.181 1.00 0.00 O 0 +HETATM 2545 H1 HOH A 741 36.411 43.443 49.258 1.00 0.00 H 0 +HETATM 2546 H2 HOH A 741 37.148 44.793 49.223 1.00 0.00 H 0 +HETATM 2547 O HOH A 742 5.069 19.407 41.573 1.00 0.00 O 0 +HETATM 2548 H1 HOH A 742 5.534 19.644 40.775 1.00 0.00 H 0 +HETATM 2549 H2 HOH A 742 5.097 18.457 41.613 1.00 0.00 H 0 +HETATM 2550 O HOH A 743 23.384 8.675 10.729 1.00 0.00 O 0 +HETATM 2551 H1 HOH A 743 23.037 7.780 10.652 1.00 0.00 H 0 +HETATM 2552 H2 HOH A 743 22.909 9.053 11.484 1.00 0.00 H 0 +HETATM 2553 O HOH A 744 28.526 39.949 0.600 1.00 0.00 O 0 +HETATM 2554 H1 HOH A 744 27.660 39.797 0.391 1.00 0.00 H 0 +HETATM 2555 H2 HOH A 744 28.613 39.424 1.337 1.00 0.00 H 0 +HETATM 2556 O HOH A 745 27.343 51.690 50.645 1.00 0.00 O 0 +HETATM 2557 H1 HOH A 745 27.146 52.432 49.955 1.00 0.00 H 0 +HETATM 2558 H2 HOH A 745 26.776 51.826 51.374 1.00 0.00 H 0 +HETATM 2559 O HOH A 746 37.284 18.283 17.543 1.00 0.00 O 0 +HETATM 2560 H1 HOH A 746 38.239 18.038 17.443 1.00 0.00 H 0 +HETATM 2561 H2 HOH A 746 37.149 18.172 18.473 1.00 0.00 H 0 +HETATM 2562 O HOH A 747 52.876 23.868 47.166 1.00 0.00 O 0 +HETATM 2563 H1 HOH A 747 52.149 23.761 47.775 1.00 0.00 H 0 +HETATM 2564 H2 HOH A 747 53.035 22.905 46.863 1.00 0.00 H 0 +HETATM 2565 O HOH A 748 13.594 44.594 33.092 1.00 0.00 O 0 +HETATM 2566 H1 HOH A 748 14.578 44.761 32.883 1.00 0.00 H 0 +HETATM 2567 H2 HOH A 748 13.080 45.295 32.610 1.00 0.00 H 0 +HETATM 2568 O HOH A 749 5.130 49.480 46.806 1.00 0.00 O 0 +HETATM 2569 H1 HOH A 749 4.594 48.859 46.273 1.00 0.00 H 0 +HETATM 2570 H2 HOH A 749 4.505 50.127 47.122 1.00 0.00 H 0 +HETATM 2571 O HOH A 750 10.390 30.103 38.067 1.00 0.00 O 0 +HETATM 2572 H1 HOH A 750 10.425 30.944 37.671 1.00 0.00 H 0 +HETATM 2573 H2 HOH A 750 10.001 29.622 37.345 1.00 0.00 H 0 +HETATM 2574 O HOH A 751 35.716 6.225 45.738 1.00 0.00 O 0 +HETATM 2575 H1 HOH A 751 35.048 5.562 45.439 1.00 0.00 H 0 +HETATM 2576 H2 HOH A 751 36.504 5.795 45.337 1.00 0.00 H 0 +HETATM 2577 O HOH A 752 11.457 47.578 45.583 1.00 0.00 O 0 +HETATM 2578 H1 HOH A 752 12.376 47.365 45.230 1.00 0.00 H 0 +HETATM 2579 H2 HOH A 752 11.049 47.450 44.709 1.00 0.00 H 0 +HETATM 2580 O HOH A 753 25.150 36.016 42.741 1.00 0.00 O 0 +HETATM 2581 H1 HOH A 753 25.062 36.119 41.737 1.00 0.00 H 0 +HETATM 2582 H2 HOH A 753 26.006 36.505 42.961 1.00 0.00 H 0 +HETATM 2583 O HOH A 754 43.962 42.370 25.087 1.00 0.00 O 0 +HETATM 2584 H1 HOH A 754 44.009 41.578 25.593 1.00 0.00 H 0 +HETATM 2585 H2 HOH A 754 44.873 42.497 24.806 1.00 0.00 H 0 +HETATM 2586 O HOH A 755 14.423 24.665 37.042 1.00 0.00 O 0 +HETATM 2587 H1 HOH A 755 14.319 25.187 37.830 1.00 0.00 H 0 +HETATM 2588 H2 HOH A 755 13.577 24.282 36.892 1.00 0.00 H 0 +HETATM 2589 O HOH A 756 47.354 2.743 25.330 1.00 0.00 O 0 +HETATM 2590 H1 HOH A 756 48.200 3.142 24.971 1.00 0.00 H 0 +HETATM 2591 H2 HOH A 756 47.654 1.832 25.534 1.00 0.00 H 0 +HETATM 2592 O HOH A 757 7.250 47.664 38.956 1.00 0.00 O 0 +HETATM 2593 H1 HOH A 757 7.292 47.414 38.076 1.00 0.00 H 0 +HETATM 2594 H2 HOH A 757 7.852 47.011 39.403 1.00 0.00 H 0 +HETATM 2595 O HOH A 758 23.000 41.082 19.657 1.00 0.00 O 0 +HETATM 2596 H1 HOH A 758 22.051 41.028 19.957 1.00 0.00 H 0 +HETATM 2597 H2 HOH A 758 23.295 40.260 19.181 1.00 0.00 H 0 +HETATM 2598 O HOH A 759 37.533 42.508 30.957 1.00 0.00 O 0 +HETATM 2599 H1 HOH A 759 37.467 42.114 30.065 1.00 0.00 H 0 +HETATM 2600 H2 HOH A 759 38.455 42.539 31.222 1.00 0.00 H 0 +HETATM 2601 O HOH A 760 25.114 4.483 52.885 1.00 0.00 O 0 +HETATM 2602 H1 HOH A 760 25.369 5.234 52.340 1.00 0.00 H 0 +HETATM 2603 H2 HOH A 760 24.163 4.520 52.959 1.00 0.00 H 0 +HETATM 2604 O HOH A 761 24.136 44.357 2.913 1.00 0.00 O 0 +HETATM 2605 H1 HOH A 761 24.430 44.167 1.951 1.00 0.00 H 0 +HETATM 2606 H2 HOH A 761 23.946 43.427 3.315 1.00 0.00 H 0 +HETATM 2607 O HOH A 762 30.806 10.015 51.847 1.00 0.00 O 0 +HETATM 2608 H1 HOH A 762 30.142 10.664 52.183 1.00 0.00 H 0 +HETATM 2609 H2 HOH A 762 31.361 10.475 51.175 1.00 0.00 H 0 +HETATM 2610 O HOH A 763 50.502 19.190 25.150 1.00 0.00 O 0 +HETATM 2611 H1 HOH A 763 50.610 18.209 25.236 1.00 0.00 H 0 +HETATM 2612 H2 HOH A 763 49.777 19.364 24.588 1.00 0.00 H 0 +HETATM 2613 O HOH A 764 11.079 17.282 13.062 1.00 0.00 O 0 +HETATM 2614 H1 HOH A 764 11.904 16.953 12.669 1.00 0.00 H 0 +HETATM 2615 H2 HOH A 764 11.211 17.544 13.941 1.00 0.00 H 0 +HETATM 2616 O HOH A 765 40.241 36.657 15.332 1.00 0.00 O 0 +HETATM 2617 H1 HOH A 765 39.553 37.310 15.135 1.00 0.00 H 0 +HETATM 2618 H2 HOH A 765 41.090 37.149 15.483 1.00 0.00 H 0 +HETATM 2619 O HOH A 766 8.407 17.138 36.413 1.00 0.00 O 0 +HETATM 2620 H1 HOH A 766 8.211 16.463 35.779 1.00 0.00 H 0 +HETATM 2621 H2 HOH A 766 7.883 17.882 36.253 1.00 0.00 H 0 +HETATM 2622 O HOH A 767 52.938 24.484 27.093 1.00 0.00 O 0 +HETATM 2623 H1 HOH A 767 52.213 24.131 26.601 1.00 0.00 H 0 +HETATM 2624 H2 HOH A 767 53.034 24.212 28.056 1.00 0.00 H 0 +HETATM 2625 O HOH A 768 19.075 23.214 38.284 1.00 0.00 O 0 +HETATM 2626 H1 HOH A 768 19.117 22.896 39.159 1.00 0.00 H 0 +HETATM 2627 H2 HOH A 768 19.112 24.165 38.367 1.00 0.00 H 0 +HETATM 2628 O HOH A 769 4.532 31.458 13.761 1.00 0.00 O 0 +HETATM 2629 H1 HOH A 769 3.876 31.813 14.459 1.00 0.00 H 0 +HETATM 2630 H2 HOH A 769 4.682 30.554 13.990 1.00 0.00 H 0 +HETATM 2631 O HOH A 770 1.484 1.075 40.439 1.00 0.00 O 0 +HETATM 2632 H1 HOH A 770 1.537 1.675 41.231 1.00 0.00 H 0 +HETATM 2633 H2 HOH A 770 2.014 0.279 40.491 1.00 0.00 H 0 +HETATM 2634 O HOH A 771 48.194 50.897 16.830 1.00 0.00 O 0 +HETATM 2635 H1 HOH A 771 47.540 51.446 16.412 1.00 0.00 H 0 +HETATM 2636 H2 HOH A 771 47.811 50.507 17.585 1.00 0.00 H 0 +HETATM 2637 O HOH A 772 46.939 33.239 45.299 1.00 0.00 O 0 +HETATM 2638 H1 HOH A 772 46.304 33.249 46.055 1.00 0.00 H 0 +HETATM 2639 H2 HOH A 772 47.814 32.933 45.554 1.00 0.00 H 0 +HETATM 2640 O HOH A 773 6.195 6.750 5.584 1.00 0.00 O 0 +HETATM 2641 H1 HOH A 773 5.312 6.401 5.929 1.00 0.00 H 0 +HETATM 2642 H2 HOH A 773 6.524 7.216 6.387 1.00 0.00 H 0 +HETATM 2643 O HOH A 774 17.069 17.743 0.150 1.00 0.00 O 0 +HETATM 2644 H1 HOH A 774 17.769 18.414 0.264 1.00 0.00 H 0 +HETATM 2645 H2 HOH A 774 17.214 17.244 0.969 1.00 0.00 H 0 +HETATM 2646 O HOH A 775 7.104 23.848 1.277 1.00 0.00 O 0 +HETATM 2647 H1 HOH A 775 7.824 23.345 1.639 1.00 0.00 H 0 +HETATM 2648 H2 HOH A 775 6.713 23.397 0.544 1.00 0.00 H 0 +HETATM 2649 O HOH A 776 34.846 11.297 18.052 1.00 0.00 O 0 +HETATM 2650 H1 HOH A 776 35.027 11.206 17.103 1.00 0.00 H 0 +HETATM 2651 H2 HOH A 776 33.940 11.586 17.995 1.00 0.00 H 0 +HETATM 2652 O HOH A 777 31.699 38.644 27.001 1.00 0.00 O 0 +HETATM 2653 H1 HOH A 777 32.462 39.168 27.286 1.00 0.00 H 0 +HETATM 2654 H2 HOH A 777 31.109 39.391 26.701 1.00 0.00 H 0 +HETATM 2655 O HOH A 778 33.645 45.709 41.506 1.00 0.00 O 0 +HETATM 2656 H1 HOH A 778 33.227 44.922 41.158 1.00 0.00 H 0 +HETATM 2657 H2 HOH A 778 34.164 46.155 40.799 1.00 0.00 H 0 +HETATM 2658 O HOH A 779 32.933 52.947 44.631 1.00 0.00 O 0 +HETATM 2659 H1 HOH A 779 32.868 51.982 44.571 1.00 0.00 H 0 +HETATM 2660 H2 HOH A 779 32.147 53.469 44.400 1.00 0.00 H 0 +HETATM 2661 O HOH A 780 14.479 16.877 53.393 1.00 0.00 O 0 +HETATM 2662 H1 HOH A 780 15.430 17.031 53.422 1.00 0.00 H 0 +HETATM 2663 H2 HOH A 780 14.215 16.193 53.976 1.00 0.00 H 0 +HETATM 2664 O HOH A 781 12.394 3.226 22.216 1.00 0.00 O 0 +HETATM 2665 H1 HOH A 781 12.693 2.428 22.696 1.00 0.00 H 0 +HETATM 2666 H2 HOH A 781 11.414 3.165 22.073 1.00 0.00 H 0 +HETATM 2667 O HOH A 782 21.786 24.336 48.023 1.00 0.00 O 0 +HETATM 2668 H1 HOH A 782 22.672 24.634 48.186 1.00 0.00 H 0 +HETATM 2669 H2 HOH A 782 21.839 23.418 47.768 1.00 0.00 H 0 +HETATM 2670 O HOH A 783 41.341 43.152 2.538 1.00 0.00 O 0 +HETATM 2671 H1 HOH A 783 41.686 43.426 1.658 1.00 0.00 H 0 +HETATM 2672 H2 HOH A 783 41.326 44.015 3.041 1.00 0.00 H 0 +HETATM 2673 O HOH A 784 36.409 38.962 52.352 1.00 0.00 O 0 +HETATM 2674 H1 HOH A 784 37.330 39.378 52.441 1.00 0.00 H 0 +HETATM 2675 H2 HOH A 784 36.565 38.018 52.688 1.00 0.00 H 0 +HETATM 2676 O HOH A 785 3.884 4.924 19.318 1.00 0.00 O 0 +HETATM 2677 H1 HOH A 785 3.141 4.930 18.703 1.00 0.00 H 0 +HETATM 2678 H2 HOH A 785 3.534 5.317 20.132 1.00 0.00 H 0 +HETATM 2679 O HOH A 786 44.911 44.878 46.764 1.00 0.00 O 0 +HETATM 2680 H1 HOH A 786 45.634 44.308 46.267 1.00 0.00 H 0 +HETATM 2681 H2 HOH A 786 45.131 45.781 46.532 1.00 0.00 H 0 +HETATM 2682 O HOH A 787 3.069 38.534 13.288 1.00 0.00 O 0 +HETATM 2683 H1 HOH A 787 2.757 37.639 13.447 1.00 0.00 H 0 +HETATM 2684 H2 HOH A 787 2.236 39.033 13.033 1.00 0.00 H 0 +HETATM 2685 O HOH A 788 16.436 10.887 8.167 1.00 0.00 O 0 +HETATM 2686 H1 HOH A 788 15.690 10.524 7.654 1.00 0.00 H 0 +HETATM 2687 H2 HOH A 788 16.906 11.331 7.468 1.00 0.00 H 0 +HETATM 2688 O HOH A 789 21.405 7.689 17.345 1.00 0.00 O 0 +HETATM 2689 H1 HOH A 789 21.409 8.599 17.246 1.00 0.00 H 0 +HETATM 2690 H2 HOH A 789 20.409 7.470 17.332 1.00 0.00 H 0 +HETATM 2691 O HOH A 790 3.159 17.520 46.946 1.00 0.00 O 0 +HETATM 2692 H1 HOH A 790 3.228 18.429 47.140 1.00 0.00 H 0 +HETATM 2693 H2 HOH A 790 3.663 16.940 47.548 1.00 0.00 H 0 +HETATM 2694 O HOH A 791 32.960 5.636 50.960 1.00 0.00 O 0 +HETATM 2695 H1 HOH A 791 32.019 5.505 51.145 1.00 0.00 H 0 +HETATM 2696 H2 HOH A 791 33.078 6.516 50.497 1.00 0.00 H 0 +HETATM 2697 O HOH A 792 25.326 38.636 34.940 1.00 0.00 O 0 +HETATM 2698 H1 HOH A 792 26.294 38.568 34.751 1.00 0.00 H 0 +HETATM 2699 H2 HOH A 792 25.213 38.162 35.751 1.00 0.00 H 0 +HETATM 2700 O HOH A 793 13.722 51.191 45.177 1.00 0.00 O 0 +HETATM 2701 H1 HOH A 793 13.717 51.602 44.334 1.00 0.00 H 0 +HETATM 2702 H2 HOH A 793 14.137 51.768 45.802 1.00 0.00 H 0 +HETATM 2703 O HOH A 794 44.770 32.948 23.655 1.00 0.00 O 0 +HETATM 2704 H1 HOH A 794 44.501 33.768 23.194 1.00 0.00 H 0 +HETATM 2705 H2 HOH A 794 44.001 32.636 24.060 1.00 0.00 H 0 +HETATM 2706 O HOH A 795 9.561 28.080 18.751 1.00 0.00 O 0 +HETATM 2707 H1 HOH A 795 8.828 28.280 19.367 1.00 0.00 H 0 +HETATM 2708 H2 HOH A 795 9.338 27.226 18.377 1.00 0.00 H 0 +HETATM 2709 O HOH A 796 28.972 48.472 9.047 1.00 0.00 O 0 +HETATM 2710 H1 HOH A 796 28.367 47.798 8.655 1.00 0.00 H 0 +HETATM 2711 H2 HOH A 796 29.909 48.174 8.863 1.00 0.00 H 0 +HETATM 2712 O HOH A 797 2.522 23.501 7.497 1.00 0.00 O 0 +HETATM 2713 H1 HOH A 797 3.317 22.986 7.364 1.00 0.00 H 0 +HETATM 2714 H2 HOH A 797 2.287 23.675 6.524 1.00 0.00 H 0 +HETATM 2715 O HOH A 798 19.087 37.649 27.603 1.00 0.00 O 0 +HETATM 2716 H1 HOH A 798 18.651 37.395 26.809 1.00 0.00 H 0 +HETATM 2717 H2 HOH A 798 18.384 37.853 28.256 1.00 0.00 H 0 +HETATM 2718 O HOH A 799 8.806 13.821 7.539 1.00 0.00 O 0 +HETATM 2719 H1 HOH A 799 9.314 13.146 8.008 1.00 0.00 H 0 +HETATM 2720 H2 HOH A 799 8.704 14.559 8.130 1.00 0.00 H 0 +HETATM 2721 O HOH A 800 1.137 50.944 1.370 1.00 0.00 O 0 +HETATM 2722 H1 HOH A 800 0.488 50.470 0.842 1.00 0.00 H 0 +HETATM 2723 H2 HOH A 800 0.696 51.540 1.983 1.00 0.00 H 0 +HETATM 2724 O HOH A 801 48.367 9.219 38.049 1.00 0.00 O 0 +HETATM 2725 H1 HOH A 801 49.313 9.210 38.271 1.00 0.00 H 0 +HETATM 2726 H2 HOH A 801 47.919 8.778 38.763 1.00 0.00 H 0 +HETATM 2727 O HOH A 802 44.620 49.514 41.495 1.00 0.00 O 0 +HETATM 2728 H1 HOH A 802 44.446 48.899 42.264 1.00 0.00 H 0 +HETATM 2729 H2 HOH A 802 44.971 48.927 40.840 1.00 0.00 H 0 +HETATM 2730 O HOH A 803 15.732 30.350 0.617 1.00 0.00 O 0 +HETATM 2731 H1 HOH A 803 15.512 31.243 0.668 1.00 0.00 H 0 +HETATM 2732 H2 HOH A 803 16.583 30.312 0.184 1.00 0.00 H 0 +HETATM 2733 O HOH A 804 7.635 23.798 26.810 1.00 0.00 O 0 +HETATM 2734 H1 HOH A 804 8.323 24.274 27.332 1.00 0.00 H 0 +HETATM 2735 H2 HOH A 804 8.075 23.629 26.014 1.00 0.00 H 0 +HETATM 2736 O HOH A 805 37.478 35.397 8.441 1.00 0.00 O 0 +HETATM 2737 H1 HOH A 805 36.942 34.654 8.661 1.00 0.00 H 0 +HETATM 2738 H2 HOH A 805 38.358 35.077 8.548 1.00 0.00 H 0 +HETATM 2739 O HOH A 806 14.482 29.588 20.774 1.00 0.00 O 0 +HETATM 2740 H1 HOH A 806 14.683 28.947 20.058 1.00 0.00 H 0 +HETATM 2741 H2 HOH A 806 14.598 29.161 21.667 1.00 0.00 H 0 +HETATM 2742 O HOH A 807 1.387 35.262 52.129 1.00 0.00 O 0 +HETATM 2743 H1 HOH A 807 1.287 34.832 51.302 1.00 0.00 H 0 +HETATM 2744 H2 HOH A 807 1.852 36.104 51.910 1.00 0.00 H 0 +HETATM 2745 O HOH A 808 12.981 44.278 45.079 1.00 0.00 O 0 +HETATM 2746 H1 HOH A 808 12.403 44.230 44.308 1.00 0.00 H 0 +HETATM 2747 H2 HOH A 808 13.576 43.537 44.976 1.00 0.00 H 0 +HETATM 2748 O HOH A 809 30.582 46.643 41.188 1.00 0.00 O 0 +HETATM 2749 H1 HOH A 809 31.046 45.797 40.971 1.00 0.00 H 0 +HETATM 2750 H2 HOH A 809 30.610 47.051 40.301 1.00 0.00 H 0 +HETATM 2751 O HOH A 810 32.006 40.077 11.236 1.00 0.00 O 0 +HETATM 2752 H1 HOH A 810 31.311 39.823 10.658 1.00 0.00 H 0 +HETATM 2753 H2 HOH A 810 31.831 39.750 12.156 1.00 0.00 H 0 +HETATM 2754 O HOH A 811 1.377 50.669 7.085 1.00 0.00 O 0 +HETATM 2755 H1 HOH A 811 1.193 49.730 6.840 1.00 0.00 H 0 +HETATM 2756 H2 HOH A 811 1.973 51.009 6.385 1.00 0.00 H 0 +HETATM 2757 O HOH A 812 43.889 30.823 7.035 1.00 0.00 O 0 +HETATM 2758 H1 HOH A 812 43.411 31.466 7.597 1.00 0.00 H 0 +HETATM 2759 H2 HOH A 812 43.505 30.055 7.453 1.00 0.00 H 0 +HETATM 2760 O HOH A 813 16.531 31.450 20.428 1.00 0.00 O 0 +HETATM 2761 H1 HOH A 813 15.861 30.772 20.497 1.00 0.00 H 0 +HETATM 2762 H2 HOH A 813 17.369 31.059 20.469 1.00 0.00 H 0 +HETATM 2763 O HOH A 814 0.428 46.539 11.603 1.00 0.00 O 0 +HETATM 2764 H1 HOH A 814 1.160 46.469 12.231 1.00 0.00 H 0 +HETATM 2765 H2 HOH A 814 0.678 46.067 10.830 1.00 0.00 H 0 +HETATM 2766 O HOH A 815 30.069 42.050 0.761 1.00 0.00 O 0 +HETATM 2767 H1 HOH A 815 30.511 41.345 1.329 1.00 0.00 H 0 +HETATM 2768 H2 HOH A 815 29.244 41.607 0.508 1.00 0.00 H 0 +HETATM 2769 O HOH A 816 11.320 7.926 39.000 1.00 0.00 O 0 +HETATM 2770 H1 HOH A 816 12.140 8.339 38.832 1.00 0.00 H 0 +HETATM 2771 H2 HOH A 816 11.472 6.957 38.696 1.00 0.00 H 0 +HETATM 2772 O HOH A 817 41.481 35.661 48.271 1.00 0.00 O 0 +HETATM 2773 H1 HOH A 817 41.740 36.154 47.450 1.00 0.00 H 0 +HETATM 2774 H2 HOH A 817 42.226 35.234 48.746 1.00 0.00 H 0 +HETATM 2775 O HOH A 818 8.996 39.072 1.429 1.00 0.00 O 0 +HETATM 2776 H1 HOH A 818 8.422 38.659 2.025 1.00 0.00 H 0 +HETATM 2777 H2 HOH A 818 9.346 39.775 2.068 1.00 0.00 H 0 +HETATM 2778 O HOH A 819 51.332 51.787 6.735 1.00 0.00 O 0 +HETATM 2779 H1 HOH A 819 51.783 51.033 6.267 1.00 0.00 H 0 +HETATM 2780 H2 HOH A 819 50.606 51.503 7.312 1.00 0.00 H 0 +HETATM 2781 O HOH A 820 11.863 0.480 29.626 1.00 0.00 O 0 +HETATM 2782 H1 HOH A 820 10.915 0.561 29.879 1.00 0.00 H 0 +HETATM 2783 H2 HOH A 820 12.263 1.352 29.764 1.00 0.00 H 0 +HETATM 2784 O HOH A 821 27.202 21.017 50.698 1.00 0.00 O 0 +HETATM 2785 H1 HOH A 821 27.809 21.695 50.698 1.00 0.00 H 0 +HETATM 2786 H2 HOH A 821 26.473 21.361 51.258 1.00 0.00 H 0 +HETATM 2787 O HOH A 822 18.665 3.292 9.917 1.00 0.00 O 0 +HETATM 2788 H1 HOH A 822 19.319 3.107 9.239 1.00 0.00 H 0 +HETATM 2789 H2 HOH A 822 17.802 2.952 9.611 1.00 0.00 H 0 +HETATM 2790 O HOH A 823 18.789 33.781 33.683 1.00 0.00 O 0 +HETATM 2791 H1 HOH A 823 19.152 33.277 34.393 1.00 0.00 H 0 +HETATM 2792 H2 HOH A 823 19.638 34.018 33.192 1.00 0.00 H 0 +HETATM 2793 O HOH A 824 22.223 8.773 2.848 1.00 0.00 O 0 +HETATM 2794 H1 HOH A 824 22.834 8.824 2.046 1.00 0.00 H 0 +HETATM 2795 H2 HOH A 824 22.142 9.676 3.149 1.00 0.00 H 0 +HETATM 2796 O HOH A 825 18.568 10.073 3.517 1.00 0.00 O 0 +HETATM 2797 H1 HOH A 825 17.629 9.887 3.755 1.00 0.00 H 0 +HETATM 2798 H2 HOH A 825 18.509 10.604 2.729 1.00 0.00 H 0 +HETATM 2799 O HOH A 826 35.574 49.762 30.843 1.00 0.00 O 0 +HETATM 2800 H1 HOH A 826 34.827 49.327 30.532 1.00 0.00 H 0 +HETATM 2801 H2 HOH A 826 35.580 49.812 31.853 1.00 0.00 H 0 +HETATM 2802 O HOH A 827 30.146 37.065 4.502 1.00 0.00 O 0 +HETATM 2803 H1 HOH A 827 30.646 37.527 3.749 1.00 0.00 H 0 +HETATM 2804 H2 HOH A 827 30.818 36.397 4.754 1.00 0.00 H 0 +HETATM 2805 O HOH A 828 9.506 28.876 7.763 1.00 0.00 O 0 +HETATM 2806 H1 HOH A 828 9.240 27.921 7.683 1.00 0.00 H 0 +HETATM 2807 H2 HOH A 828 8.871 29.199 8.421 1.00 0.00 H 0 +HETATM 2808 O HOH A 829 10.674 13.188 29.673 1.00 0.00 O 0 +HETATM 2809 H1 HOH A 829 9.909 13.079 29.048 1.00 0.00 H 0 +HETATM 2810 H2 HOH A 829 11.230 13.923 29.267 1.00 0.00 H 0 +HETATM 2811 O HOH A 830 0.428 18.409 51.048 1.00 0.00 O 0 +HETATM 2812 H1 HOH A 830 0.911 18.205 51.871 1.00 0.00 H 0 +HETATM 2813 H2 HOH A 830 0.035 17.552 50.726 1.00 0.00 H 0 +HETATM 2814 O HOH A 831 30.701 25.310 4.366 1.00 0.00 O 0 +HETATM 2815 H1 HOH A 831 29.707 24.971 4.269 1.00 0.00 H 0 +HETATM 2816 H2 HOH A 831 31.163 25.329 3.516 1.00 0.00 H 0 +HETATM 2817 O HOH A 832 0.955 5.797 43.976 1.00 0.00 O 0 +HETATM 2818 H1 HOH A 832 1.504 6.349 44.540 1.00 0.00 H 0 +HETATM 2819 H2 HOH A 832 0.966 6.037 42.996 1.00 0.00 H 0 +HETATM 2820 O HOH A 833 46.153 3.012 49.918 1.00 0.00 O 0 +HETATM 2821 H1 HOH A 833 46.414 3.697 50.522 1.00 0.00 H 0 +HETATM 2822 H2 HOH A 833 46.973 2.483 49.832 1.00 0.00 H 0 +HETATM 2823 O HOH A 834 11.158 36.653 21.745 1.00 0.00 O 0 +HETATM 2824 H1 HOH A 834 10.878 37.436 21.223 1.00 0.00 H 0 +HETATM 2825 H2 HOH A 834 11.437 37.020 22.532 1.00 0.00 H 0 +HETATM 2826 O HOH A 835 10.349 47.859 34.586 1.00 0.00 O 0 +HETATM 2827 H1 HOH A 835 11.283 47.910 34.824 1.00 0.00 H 0 +HETATM 2828 H2 HOH A 835 10.164 48.717 34.191 1.00 0.00 H 0 +HETATM 2829 O HOH A 836 4.232 37.799 43.552 1.00 0.00 O 0 +HETATM 2830 H1 HOH A 836 3.821 37.050 43.985 1.00 0.00 H 0 +HETATM 2831 H2 HOH A 836 4.065 37.813 42.604 1.00 0.00 H 0 +HETATM 2832 O HOH A 837 7.878 51.760 11.117 1.00 0.00 O 0 +HETATM 2833 H1 HOH A 837 8.305 52.494 10.595 1.00 0.00 H 0 +HETATM 2834 H2 HOH A 837 7.254 51.222 10.612 1.00 0.00 H 0 +HETATM 2835 O HOH A 838 40.780 37.178 37.060 1.00 0.00 O 0 +HETATM 2836 H1 HOH A 838 41.283 37.365 36.229 1.00 0.00 H 0 +HETATM 2837 H2 HOH A 838 41.340 37.206 37.838 1.00 0.00 H 0 +HETATM 2838 O HOH A 839 27.219 14.087 41.345 1.00 0.00 O 0 +HETATM 2839 H1 HOH A 839 27.774 14.494 40.660 1.00 0.00 H 0 +HETATM 2840 H2 HOH A 839 26.348 14.508 41.196 1.00 0.00 H 0 +HETATM 2841 O HOH A 840 33.470 53.408 47.432 1.00 0.00 O 0 +HETATM 2842 H1 HOH A 840 33.428 53.093 46.515 1.00 0.00 H 0 +HETATM 2843 H2 HOH A 840 34.300 53.037 47.753 1.00 0.00 H 0 +HETATM 2844 O HOH A 841 30.253 39.228 6.183 1.00 0.00 O 0 +HETATM 2845 H1 HOH A 841 30.268 38.367 5.746 1.00 0.00 H 0 +HETATM 2846 H2 HOH A 841 29.757 39.851 5.612 1.00 0.00 H 0 +HETATM 2847 O HOH A 842 17.338 19.071 47.791 1.00 0.00 O 0 +HETATM 2848 H1 HOH A 842 17.973 18.331 47.653 1.00 0.00 H 0 +HETATM 2849 H2 HOH A 842 17.535 19.713 47.042 1.00 0.00 H 0 +HETATM 2850 O HOH A 843 48.877 1.300 9.382 1.00 0.00 O 0 +HETATM 2851 H1 HOH A 843 49.149 0.439 9.720 1.00 0.00 H 0 +HETATM 2852 H2 HOH A 843 49.068 1.883 10.129 1.00 0.00 H 0 +HETATM 2853 O HOH A 844 7.950 30.461 41.197 1.00 0.00 O 0 +HETATM 2854 H1 HOH A 844 7.036 30.825 41.330 1.00 0.00 H 0 +HETATM 2855 H2 HOH A 844 7.984 30.223 40.262 1.00 0.00 H 0 +HETATM 2856 O HOH A 845 8.431 31.817 24.467 1.00 0.00 O 0 +HETATM 2857 H1 HOH A 845 8.623 32.520 25.128 1.00 0.00 H 0 +HETATM 2858 H2 HOH A 845 7.851 31.248 25.059 1.00 0.00 H 0 +HETATM 2859 O HOH A 846 43.700 43.859 5.703 1.00 0.00 O 0 +HETATM 2860 H1 HOH A 846 44.283 43.914 4.951 1.00 0.00 H 0 +HETATM 2861 H2 HOH A 846 42.887 44.180 5.364 1.00 0.00 H 0 +HETATM 2862 O HOH A 847 2.830 36.708 1.770 1.00 0.00 O 0 +HETATM 2863 H1 HOH A 847 3.470 36.816 2.448 1.00 0.00 H 0 +HETATM 2864 H2 HOH A 847 3.236 36.052 1.176 1.00 0.00 H 0 +HETATM 2865 O HOH A 848 15.156 6.963 41.283 1.00 0.00 O 0 +HETATM 2866 H1 HOH A 848 15.404 6.688 42.194 1.00 0.00 H 0 +HETATM 2867 H2 HOH A 848 15.069 7.946 41.313 1.00 0.00 H 0 +HETATM 2868 O HOH A 849 46.888 30.533 44.854 1.00 0.00 O 0 +HETATM 2869 H1 HOH A 849 46.007 30.571 45.203 1.00 0.00 H 0 +HETATM 2870 H2 HOH A 849 47.454 30.425 45.657 1.00 0.00 H 0 +HETATM 2871 O HOH A 850 43.618 24.694 25.083 1.00 0.00 O 0 +HETATM 2872 H1 HOH A 850 43.732 23.868 25.603 1.00 0.00 H 0 +HETATM 2873 H2 HOH A 850 44.537 25.059 25.033 1.00 0.00 H 0 +HETATM 2874 O HOH A 851 15.151 10.123 33.867 1.00 0.00 O 0 +HETATM 2875 H1 HOH A 851 15.122 10.937 33.393 1.00 0.00 H 0 +HETATM 2876 H2 HOH A 851 14.232 9.899 34.107 1.00 0.00 H 0 +HETATM 2877 O HOH A 852 1.592 53.051 36.560 1.00 0.00 O 0 +HETATM 2878 H1 HOH A 852 1.318 53.401 35.757 1.00 0.00 H 0 +HETATM 2879 H2 HOH A 852 2.036 53.741 37.074 1.00 0.00 H 0 +HETATM 2880 O HOH A 853 24.676 33.890 40.428 1.00 0.00 O 0 +HETATM 2881 H1 HOH A 853 25.022 33.002 40.083 1.00 0.00 H 0 +HETATM 2882 H2 HOH A 853 24.349 33.712 41.311 1.00 0.00 H 0 +HETATM 2883 O HOH A 854 39.522 16.170 15.146 1.00 0.00 O 0 +HETATM 2884 H1 HOH A 854 39.948 16.731 15.857 1.00 0.00 H 0 +HETATM 2885 H2 HOH A 854 40.137 15.628 14.700 1.00 0.00 H 0 +HETATM 2886 O HOH A 855 8.323 35.798 6.096 1.00 0.00 O 0 +HETATM 2887 H1 HOH A 855 8.410 36.079 7.031 1.00 0.00 H 0 +HETATM 2888 H2 HOH A 855 8.064 36.609 5.619 1.00 0.00 H 0 +HETATM 2889 O HOH A 856 10.631 39.856 36.494 1.00 0.00 O 0 +HETATM 2890 H1 HOH A 856 10.281 39.385 35.719 1.00 0.00 H 0 +HETATM 2891 H2 HOH A 856 10.478 39.245 37.189 1.00 0.00 H 0 +HETATM 2892 O HOH A 857 52.507 46.880 27.870 1.00 0.00 O 0 +HETATM 2893 H1 HOH A 857 53.232 46.252 28.083 1.00 0.00 H 0 +HETATM 2894 H2 HOH A 857 51.911 46.658 28.507 1.00 0.00 H 0 +HETATM 2895 O HOH A 858 34.362 33.701 36.173 1.00 0.00 O 0 +HETATM 2896 H1 HOH A 858 33.862 32.922 36.304 1.00 0.00 H 0 +HETATM 2897 H2 HOH A 858 34.515 33.728 35.241 1.00 0.00 H 0 +HETATM 2898 O HOH A 859 30.370 46.182 28.813 1.00 0.00 O 0 +HETATM 2899 H1 HOH A 859 30.012 45.512 28.214 1.00 0.00 H 0 +HETATM 2900 H2 HOH A 859 29.919 45.907 29.640 1.00 0.00 H 0 +HETATM 2901 O HOH A 860 50.532 50.114 0.742 1.00 0.00 O 0 +HETATM 2902 H1 HOH A 860 50.719 50.571 1.545 1.00 0.00 H 0 +HETATM 2903 H2 HOH A 860 51.321 49.680 0.458 1.00 0.00 H 0 +HETATM 2904 O HOH A 861 2.769 1.793 14.234 1.00 0.00 O 0 +HETATM 2905 H1 HOH A 861 2.766 0.990 13.585 1.00 0.00 H 0 +HETATM 2906 H2 HOH A 861 3.611 2.248 14.219 1.00 0.00 H 0 +HETATM 2907 O HOH A 862 47.837 46.080 22.767 1.00 0.00 O 0 +HETATM 2908 H1 HOH A 862 47.536 45.371 22.161 1.00 0.00 H 0 +HETATM 2909 H2 HOH A 862 48.653 45.826 23.168 1.00 0.00 H 0 +HETATM 2910 O HOH A 863 11.404 9.308 2.288 1.00 0.00 O 0 +HETATM 2911 H1 HOH A 863 10.979 9.871 2.968 1.00 0.00 H 0 +HETATM 2912 H2 HOH A 863 11.272 8.421 2.611 1.00 0.00 H 0 +HETATM 2913 O HOH A 864 33.700 39.381 44.172 1.00 0.00 O 0 +HETATM 2914 H1 HOH A 864 33.840 40.333 44.014 1.00 0.00 H 0 +HETATM 2915 H2 HOH A 864 34.417 38.969 43.643 1.00 0.00 H 0 +HETATM 2916 O HOH A 865 18.949 41.455 26.172 1.00 0.00 O 0 +HETATM 2917 H1 HOH A 865 19.097 41.828 25.265 1.00 0.00 H 0 +HETATM 2918 H2 HOH A 865 18.690 42.265 26.615 1.00 0.00 H 0 +HETATM 2919 O HOH A 866 30.320 47.103 15.459 1.00 0.00 O 0 +HETATM 2920 H1 HOH A 866 30.837 46.925 14.740 1.00 0.00 H 0 +HETATM 2921 H2 HOH A 866 29.450 47.226 15.060 1.00 0.00 H 0 +HETATM 2922 O HOH A 867 9.669 8.250 22.370 1.00 0.00 O 0 +HETATM 2923 H1 HOH A 867 8.790 7.950 22.465 1.00 0.00 H 0 +HETATM 2924 H2 HOH A 867 9.823 8.571 21.439 1.00 0.00 H 0 +HETATM 2925 O HOH A 868 8.745 22.703 36.241 1.00 0.00 O 0 +HETATM 2926 H1 HOH A 868 9.547 23.177 36.041 1.00 0.00 H 0 +HETATM 2927 H2 HOH A 868 8.331 22.506 35.434 1.00 0.00 H 0 +HETATM 2928 O HOH A 869 25.998 33.053 23.232 1.00 0.00 O 0 +HETATM 2929 H1 HOH A 869 26.061 32.067 23.097 1.00 0.00 H 0 +HETATM 2930 H2 HOH A 869 26.313 33.254 24.165 1.00 0.00 H 0 +HETATM 2931 O HOH A 870 24.826 12.609 5.419 1.00 0.00 O 0 +HETATM 2932 H1 HOH A 870 25.737 12.502 5.103 1.00 0.00 H 0 +HETATM 2933 H2 HOH A 870 24.485 13.329 4.837 1.00 0.00 H 0 +HETATM 2934 O HOH A 871 21.991 38.747 37.761 1.00 0.00 O 0 +HETATM 2935 H1 HOH A 871 22.566 38.091 37.449 1.00 0.00 H 0 +HETATM 2936 H2 HOH A 871 21.248 38.253 38.071 1.00 0.00 H 0 +HETATM 2937 O HOH A 872 11.551 20.959 44.003 1.00 0.00 O 0 +HETATM 2938 H1 HOH A 872 11.457 20.436 44.718 1.00 0.00 H 0 +HETATM 2939 H2 HOH A 872 10.951 21.747 44.195 1.00 0.00 H 0 +HETATM 2940 O HOH A 873 12.715 17.158 44.841 1.00 0.00 O 0 +HETATM 2941 H1 HOH A 873 12.273 17.470 44.058 1.00 0.00 H 0 +HETATM 2942 H2 HOH A 873 13.617 16.985 44.515 1.00 0.00 H 0 +HETATM 2943 O HOH A 874 15.823 52.856 31.415 1.00 0.00 O 0 +HETATM 2944 H1 HOH A 874 15.848 53.173 32.273 1.00 0.00 H 0 +HETATM 2945 H2 HOH A 874 14.891 52.494 31.270 1.00 0.00 H 0 +HETATM 2946 O HOH A 875 43.718 38.477 28.583 1.00 0.00 O 0 +HETATM 2947 H1 HOH A 875 43.300 38.785 29.379 1.00 0.00 H 0 +HETATM 2948 H2 HOH A 875 44.166 37.696 28.862 1.00 0.00 H 0 +HETATM 2949 O HOH A 876 52.074 2.023 19.471 1.00 0.00 O 0 +HETATM 2950 H1 HOH A 876 52.521 2.789 19.864 1.00 0.00 H 0 +HETATM 2951 H2 HOH A 876 51.856 1.343 20.057 1.00 0.00 H 0 +HETATM 2952 O HOH A 877 49.011 32.828 34.743 1.00 0.00 O 0 +HETATM 2953 H1 HOH A 877 49.525 32.145 34.266 1.00 0.00 H 0 +HETATM 2954 H2 HOH A 877 48.757 32.491 35.605 1.00 0.00 H 0 +HETATM 2955 O HOH A 878 22.350 31.974 49.192 1.00 0.00 O 0 +HETATM 2956 H1 HOH A 878 22.351 32.657 48.476 1.00 0.00 H 0 +HETATM 2957 H2 HOH A 878 22.998 32.278 49.837 1.00 0.00 H 0 +HETATM 2958 O HOH A 879 7.549 17.301 45.840 1.00 0.00 O 0 +HETATM 2959 H1 HOH A 879 8.367 17.060 45.432 1.00 0.00 H 0 +HETATM 2960 H2 HOH A 879 7.608 17.118 46.813 1.00 0.00 H 0 +HETATM 2961 O HOH A 880 22.475 47.590 37.213 1.00 0.00 O 0 +HETATM 2962 H1 HOH A 880 21.846 46.885 37.267 1.00 0.00 H 0 +HETATM 2963 H2 HOH A 880 22.820 47.827 38.136 1.00 0.00 H 0 +HETATM 2964 O HOH A 881 39.613 11.026 1.199 1.00 0.00 O 0 +HETATM 2965 H1 HOH A 881 40.257 10.409 0.735 1.00 0.00 H 0 +HETATM 2966 H2 HOH A 881 39.027 11.280 0.568 1.00 0.00 H 0 +HETATM 2967 O HOH A 882 12.968 0.974 12.404 1.00 0.00 O 0 +HETATM 2968 H1 HOH A 882 13.543 1.728 12.224 1.00 0.00 H 0 +HETATM 2969 H2 HOH A 882 12.235 1.295 12.970 1.00 0.00 H 0 +HETATM 2970 O HOH A 883 45.782 3.247 36.682 1.00 0.00 O 0 +HETATM 2971 H1 HOH A 883 45.600 2.378 36.947 1.00 0.00 H 0 +HETATM 2972 H2 HOH A 883 45.626 3.209 35.818 1.00 0.00 H 0 +HETATM 2973 O HOH A 884 27.694 18.756 24.831 1.00 0.00 O 0 +HETATM 2974 H1 HOH A 884 27.724 19.602 24.487 1.00 0.00 H 0 +HETATM 2975 H2 HOH A 884 26.755 18.550 24.763 1.00 0.00 H 0 +HETATM 2976 O HOH A 885 18.419 28.333 40.474 1.00 0.00 O 0 +HETATM 2977 H1 HOH A 885 17.680 28.691 40.950 1.00 0.00 H 0 +HETATM 2978 H2 HOH A 885 18.269 28.422 39.538 1.00 0.00 H 0 +HETATM 2979 O HOH A 886 28.182 39.277 37.222 1.00 0.00 O 0 +HETATM 2980 H1 HOH A 886 28.948 39.133 37.780 1.00 0.00 H 0 +HETATM 2981 H2 HOH A 886 27.958 40.211 37.362 1.00 0.00 H 0 +HETATM 2982 O HOH A 887 29.973 13.914 18.592 1.00 0.00 O 0 +HETATM 2983 H1 HOH A 887 30.405 14.708 18.295 1.00 0.00 H 0 +HETATM 2984 H2 HOH A 887 30.784 13.373 18.770 1.00 0.00 H 0 +HETATM 2985 O HOH A 888 19.216 36.283 20.043 1.00 0.00 O 0 +HETATM 2986 H1 HOH A 888 18.772 37.065 19.718 1.00 0.00 H 0 +HETATM 2987 H2 HOH A 888 19.226 35.569 19.322 1.00 0.00 H 0 +HETATM 2988 O HOH A 889 24.378 3.048 34.749 1.00 0.00 O 0 +HETATM 2989 H1 HOH A 889 25.005 3.016 35.486 1.00 0.00 H 0 +HETATM 2990 H2 HOH A 889 24.904 3.447 34.034 1.00 0.00 H 0 +HETATM 2991 O HOH A 890 47.121 47.504 32.653 1.00 0.00 O 0 +HETATM 2992 H1 HOH A 890 47.458 47.843 31.831 1.00 0.00 H 0 +HETATM 2993 H2 HOH A 890 47.357 48.266 33.233 1.00 0.00 H 0 +HETATM 2994 O HOH A 891 34.709 33.528 51.777 1.00 0.00 O 0 +HETATM 2995 H1 HOH A 891 35.046 33.678 52.676 1.00 0.00 H 0 +HETATM 2996 H2 HOH A 891 33.810 33.200 51.901 1.00 0.00 H 0 +HETATM 2997 O HOH A 892 12.542 34.600 42.456 1.00 0.00 O 0 +HETATM 2998 H1 HOH A 892 12.191 33.730 42.419 1.00 0.00 H 0 +HETATM 2999 H2 HOH A 892 13.306 34.504 43.118 1.00 0.00 H 0 +HETATM 3000 O HOH A 893 49.871 22.728 4.614 1.00 0.00 O 0 +HETATM 3001 H1 HOH A 893 49.036 22.764 5.134 1.00 0.00 H 0 +HETATM 3002 H2 HOH A 893 50.693 22.844 5.167 1.00 0.00 H 0 +HETATM 3003 O HOH A 894 46.757 7.882 29.416 1.00 0.00 O 0 +HETATM 3004 H1 HOH A 894 47.470 8.487 29.137 1.00 0.00 H 0 +HETATM 3005 H2 HOH A 894 46.077 8.100 28.782 1.00 0.00 H 0 +HETATM 3006 O HOH A 895 36.637 46.858 19.471 1.00 0.00 O 0 +HETATM 3007 H1 HOH A 895 35.977 46.749 18.761 1.00 0.00 H 0 +HETATM 3008 H2 HOH A 895 36.090 46.928 20.284 1.00 0.00 H 0 +HETATM 3009 O HOH A 896 17.317 36.248 25.888 1.00 0.00 O 0 +HETATM 3010 H1 HOH A 896 18.095 35.708 25.597 1.00 0.00 H 0 +HETATM 3011 H2 HOH A 896 16.793 35.847 26.567 1.00 0.00 H 0 +HETATM 3012 O HOH A 897 27.545 15.244 1.859 1.00 0.00 O 0 +HETATM 3013 H1 HOH A 897 28.080 15.652 1.094 1.00 0.00 H 0 +HETATM 3014 H2 HOH A 897 28.138 15.091 2.602 1.00 0.00 H 0 +HETATM 3015 O HOH A 898 33.749 42.069 22.834 1.00 0.00 O 0 +HETATM 3016 H1 HOH A 898 34.294 41.372 23.350 1.00 0.00 H 0 +HETATM 3017 H2 HOH A 898 32.833 42.019 23.231 1.00 0.00 H 0 +HETATM 3018 O HOH A 899 19.717 7.250 43.558 1.00 0.00 O 0 +HETATM 3019 H1 HOH A 899 18.925 7.710 43.903 1.00 0.00 H 0 +HETATM 3020 H2 HOH A 899 19.912 6.543 44.209 1.00 0.00 H 0 +HETATM 3021 O HOH A 900 44.271 43.132 16.810 1.00 0.00 O 0 +HETATM 3022 H1 HOH A 900 43.685 42.591 17.349 1.00 0.00 H 0 +HETATM 3023 H2 HOH A 900 44.233 42.669 15.984 1.00 0.00 H 0 +HETATM 3024 O HOH A 901 12.963 51.589 11.557 1.00 0.00 O 0 +HETATM 3025 H1 HOH A 901 12.950 52.585 11.596 1.00 0.00 H 0 +HETATM 3026 H2 HOH A 901 13.666 51.386 10.927 1.00 0.00 H 0 +HETATM 3027 O HOH A 902 5.424 31.959 17.436 1.00 0.00 O 0 +HETATM 3028 H1 HOH A 902 4.595 31.463 17.283 1.00 0.00 H 0 +HETATM 3029 H2 HOH A 902 5.925 31.494 18.121 1.00 0.00 H 0 +HETATM 3030 O HOH A 903 34.913 27.997 52.933 1.00 0.00 O 0 +HETATM 3031 H1 HOH A 903 35.727 27.588 53.024 1.00 0.00 H 0 +HETATM 3032 H2 HOH A 903 34.254 27.307 52.881 1.00 0.00 H 0 +HETATM 3033 O HOH A 904 4.135 34.238 41.945 1.00 0.00 O 0 +HETATM 3034 H1 HOH A 904 3.807 34.533 41.101 1.00 0.00 H 0 +HETATM 3035 H2 HOH A 904 5.062 34.154 41.709 1.00 0.00 H 0 +HETATM 3036 O HOH A 905 17.017 49.550 1.468 1.00 0.00 O 0 +HETATM 3037 H1 HOH A 905 17.505 48.757 1.760 1.00 0.00 H 0 +HETATM 3038 H2 HOH A 905 17.730 50.104 1.094 1.00 0.00 H 0 +HETATM 3039 O HOH A 906 53.290 35.005 19.260 1.00 0.00 O 0 +HETATM 3040 H1 HOH A 906 52.699 34.285 18.908 1.00 0.00 H 0 +HETATM 3041 H2 HOH A 906 52.843 35.756 19.687 1.00 0.00 H 0 +HETATM 3042 O HOH A 907 42.094 32.463 51.530 1.00 0.00 O 0 +HETATM 3043 H1 HOH A 907 43.042 32.604 51.655 1.00 0.00 H 0 +HETATM 3044 H2 HOH A 907 41.865 32.011 50.743 1.00 0.00 H 0 +HETATM 3045 O HOH A 908 15.217 12.735 4.258 1.00 0.00 O 0 +HETATM 3046 H1 HOH A 908 15.633 13.248 3.577 1.00 0.00 H 0 +HETATM 3047 H2 HOH A 908 14.316 12.916 4.054 1.00 0.00 H 0 +HETATM 3048 O HOH A 909 18.774 11.423 29.035 1.00 0.00 O 0 +HETATM 3049 H1 HOH A 909 18.826 10.660 28.517 1.00 0.00 H 0 +HETATM 3050 H2 HOH A 909 19.719 11.602 29.074 1.00 0.00 H 0 +HETATM 3051 O HOH A 910 53.339 7.353 3.739 1.00 0.00 O 0 +HETATM 3052 H1 HOH A 910 52.757 7.672 3.098 1.00 0.00 H 0 +HETATM 3053 H2 HOH A 910 52.876 6.604 4.150 1.00 0.00 H 0 +HETATM 3054 O HOH A 911 4.845 26.480 12.396 1.00 0.00 O 0 +HETATM 3055 H1 HOH A 911 5.838 26.300 12.362 1.00 0.00 H 0 +HETATM 3056 H2 HOH A 911 4.319 25.721 12.649 1.00 0.00 H 0 +HETATM 3057 O HOH A 912 40.192 35.917 19.425 1.00 0.00 O 0 +HETATM 3058 H1 HOH A 912 39.689 36.330 18.723 1.00 0.00 H 0 +HETATM 3059 H2 HOH A 912 39.766 35.030 19.395 1.00 0.00 H 0 +HETATM 3060 O HOH A 913 1.811 24.040 42.528 1.00 0.00 O 0 +HETATM 3061 H1 HOH A 913 0.909 23.721 42.543 1.00 0.00 H 0 +HETATM 3062 H2 HOH A 913 2.333 23.225 42.235 1.00 0.00 H 0 +HETATM 3063 O HOH A 914 4.027 19.005 21.408 1.00 0.00 O 0 +HETATM 3064 H1 HOH A 914 4.703 19.444 21.914 1.00 0.00 H 0 +HETATM 3065 H2 HOH A 914 4.297 18.115 21.388 1.00 0.00 H 0 +HETATM 3066 O HOH A 915 30.276 18.179 19.303 1.00 0.00 O 0 +HETATM 3067 H1 HOH A 915 30.594 17.533 18.607 1.00 0.00 H 0 +HETATM 3068 H2 HOH A 915 30.772 18.034 20.114 1.00 0.00 H 0 +HETATM 3069 O HOH A 916 33.192 27.702 5.552 1.00 0.00 O 0 +HETATM 3070 H1 HOH A 916 33.922 28.365 5.741 1.00 0.00 H 0 +HETATM 3071 H2 HOH A 916 32.860 27.501 6.420 1.00 0.00 H 0 +HETATM 3072 O HOH A 917 3.318 38.172 49.216 1.00 0.00 O 0 +HETATM 3073 H1 HOH A 917 4.120 38.681 49.105 1.00 0.00 H 0 +HETATM 3074 H2 HOH A 917 3.377 37.703 50.037 1.00 0.00 H 0 +HETATM 3075 O HOH A 918 48.686 46.942 37.955 1.00 0.00 O 0 +HETATM 3076 H1 HOH A 918 47.931 46.824 37.396 1.00 0.00 H 0 +HETATM 3077 H2 HOH A 918 49.384 47.355 37.373 1.00 0.00 H 0 +HETATM 3078 O HOH A 919 7.912 26.653 16.431 1.00 0.00 O 0 +HETATM 3079 H1 HOH A 919 7.697 27.318 15.802 1.00 0.00 H 0 +HETATM 3080 H2 HOH A 919 7.032 26.374 16.679 1.00 0.00 H 0 +HETATM 3081 O HOH A 920 5.108 36.069 28.124 1.00 0.00 O 0 +HETATM 3082 H1 HOH A 920 4.672 36.160 28.999 1.00 0.00 H 0 +HETATM 3083 H2 HOH A 920 4.595 35.456 27.495 1.00 0.00 H 0 +HETATM 3084 O HOH A 921 37.475 44.958 24.176 1.00 0.00 O 0 +HETATM 3085 H1 HOH A 921 36.879 44.835 23.446 1.00 0.00 H 0 +HETATM 3086 H2 HOH A 921 38.394 44.938 23.825 1.00 0.00 H 0 +HETATM 3087 O HOH A 922 4.588 36.225 47.647 1.00 0.00 O 0 +HETATM 3088 H1 HOH A 922 4.817 35.533 48.314 1.00 0.00 H 0 +HETATM 3089 H2 HOH A 922 3.907 36.873 47.941 1.00 0.00 H 0 +HETATM 3090 O HOH A 923 29.142 30.294 32.151 1.00 0.00 O 0 +HETATM 3091 H1 HOH A 923 28.406 30.569 31.576 1.00 0.00 H 0 +HETATM 3092 H2 HOH A 923 29.928 30.754 31.897 1.00 0.00 H 0 +HETATM 3093 O HOH A 924 1.102 38.916 -0.344 1.00 0.00 O 0 +HETATM 3094 H1 HOH A 924 1.803 39.330 0.294 1.00 0.00 H 0 +HETATM 3095 H2 HOH A 924 0.494 38.468 0.231 1.00 0.00 H 0 +HETATM 3096 O HOH A 925 32.547 44.140 10.448 1.00 0.00 O 0 +HETATM 3097 H1 HOH A 925 32.809 43.286 10.043 1.00 0.00 H 0 +HETATM 3098 H2 HOH A 925 32.301 43.927 11.415 1.00 0.00 H 0 +HETATM 3099 O HOH A 926 40.999 15.366 45.361 1.00 0.00 O 0 +HETATM 3100 H1 HOH A 926 41.838 15.173 45.777 1.00 0.00 H 0 +HETATM 3101 H2 HOH A 926 41.069 15.391 44.406 1.00 0.00 H 0 +HETATM 3102 O HOH A 927 6.840 15.401 4.746 1.00 0.00 O 0 +HETATM 3103 H1 HOH A 927 6.636 14.456 4.771 1.00 0.00 H 0 +HETATM 3104 H2 HOH A 927 6.401 15.800 5.468 1.00 0.00 H 0 +HETATM 3105 O HOH A 928 1.260 42.635 50.325 1.00 0.00 O 0 +HETATM 3106 H1 HOH A 928 1.296 42.977 49.430 1.00 0.00 H 0 +HETATM 3107 H2 HOH A 928 1.050 41.714 50.252 1.00 0.00 H 0 +HETATM 3108 O HOH A 929 50.680 6.083 10.799 1.00 0.00 O 0 +HETATM 3109 H1 HOH A 929 50.947 6.205 9.870 1.00 0.00 H 0 +HETATM 3110 H2 HOH A 929 51.448 6.469 11.300 1.00 0.00 H 0 +HETATM 3111 O HOH A 930 11.161 16.856 8.474 1.00 0.00 O 0 +HETATM 3112 H1 HOH A 930 11.513 16.051 8.044 1.00 0.00 H 0 +HETATM 3113 H2 HOH A 930 10.296 16.721 8.860 1.00 0.00 H 0 +HETATM 3114 O HOH A 931 35.449 32.551 6.624 1.00 0.00 O 0 +HETATM 3115 H1 HOH A 931 35.114 32.529 7.536 1.00 0.00 H 0 +HETATM 3116 H2 HOH A 931 36.293 32.231 6.700 1.00 0.00 H 0 +HETATM 3117 O HOH A 932 6.576 28.594 39.754 1.00 0.00 O 0 +HETATM 3118 H1 HOH A 932 5.854 28.898 40.282 1.00 0.00 H 0 +HETATM 3119 H2 HOH A 932 7.014 27.926 40.331 1.00 0.00 H 0 +HETATM 3120 O HOH A 933 3.685 31.244 28.130 1.00 0.00 O 0 +HETATM 3121 H1 HOH A 933 3.775 30.461 27.618 1.00 0.00 H 0 +HETATM 3122 H2 HOH A 933 3.927 31.086 29.038 1.00 0.00 H 0 +HETATM 3123 O HOH A 934 36.173 7.270 38.513 1.00 0.00 O 0 +HETATM 3124 H1 HOH A 934 36.657 6.975 39.307 1.00 0.00 H 0 +HETATM 3125 H2 HOH A 934 36.799 7.109 37.825 1.00 0.00 H 0 +HETATM 3126 O HOH A 935 22.238 40.148 15.957 1.00 0.00 O 0 +HETATM 3127 H1 HOH A 935 21.509 40.860 15.752 1.00 0.00 H 0 +HETATM 3128 H2 HOH A 935 22.269 39.515 15.169 1.00 0.00 H 0 +HETATM 3129 O HOH A 936 19.783 21.910 52.133 1.00 0.00 O 0 +HETATM 3130 H1 HOH A 936 20.343 22.566 51.596 1.00 0.00 H 0 +HETATM 3131 H2 HOH A 936 18.940 22.237 52.130 1.00 0.00 H 0 +HETATM 3132 O HOH A 937 7.172 49.084 13.539 1.00 0.00 O 0 +HETATM 3133 H1 HOH A 937 7.433 48.257 13.173 1.00 0.00 H 0 +HETATM 3134 H2 HOH A 937 7.841 49.686 13.270 1.00 0.00 H 0 +HETATM 3135 O HOH A 938 29.243 34.878 34.431 1.00 0.00 O 0 +HETATM 3136 H1 HOH A 938 29.066 34.850 33.445 1.00 0.00 H 0 +HETATM 3137 H2 HOH A 938 29.530 33.962 34.688 1.00 0.00 H 0 +HETATM 3138 O HOH A 939 10.923 7.060 24.339 1.00 0.00 O 0 +HETATM 3139 H1 HOH A 939 10.521 7.440 23.534 1.00 0.00 H 0 +HETATM 3140 H2 HOH A 939 10.952 7.802 24.938 1.00 0.00 H 0 +HETATM 3141 O HOH A 940 37.527 30.193 2.001 1.00 0.00 O 0 +HETATM 3142 H1 HOH A 940 37.667 30.074 2.998 1.00 0.00 H 0 +HETATM 3143 H2 HOH A 940 37.924 29.409 1.608 1.00 0.00 H 0 +HETATM 3144 O HOH A 941 33.353 27.035 50.335 1.00 0.00 O 0 +HETATM 3145 H1 HOH A 941 32.668 27.036 49.615 1.00 0.00 H 0 +HETATM 3146 H2 HOH A 941 34.248 26.918 49.940 1.00 0.00 H 0 +HETATM 3147 O HOH A 942 37.914 26.282 40.209 1.00 0.00 O 0 +HETATM 3148 H1 HOH A 942 38.211 27.165 39.952 1.00 0.00 H 0 +HETATM 3149 H2 HOH A 942 38.666 25.754 40.510 1.00 0.00 H 0 +HETATM 3150 O HOH A 943 1.250 20.173 1.272 1.00 0.00 O 0 +HETATM 3151 H1 HOH A 943 0.279 20.234 1.575 1.00 0.00 H 0 +HETATM 3152 H2 HOH A 943 1.268 20.663 0.373 1.00 0.00 H 0 +HETATM 3153 O HOH A 944 27.581 21.472 44.077 1.00 0.00 O 0 +HETATM 3154 H1 HOH A 944 27.933 21.717 44.941 1.00 0.00 H 0 +HETATM 3155 H2 HOH A 944 28.290 21.505 43.436 1.00 0.00 H 0 +HETATM 3156 O HOH A 945 37.038 10.069 50.580 1.00 0.00 O 0 +HETATM 3157 H1 HOH A 945 37.847 10.281 50.137 1.00 0.00 H 0 +HETATM 3158 H2 HOH A 945 36.314 10.069 49.904 1.00 0.00 H 0 +HETATM 3159 O HOH A 946 42.439 52.642 39.416 1.00 0.00 O 0 +HETATM 3160 H1 HOH A 946 42.325 51.694 39.329 1.00 0.00 H 0 +HETATM 3161 H2 HOH A 946 42.056 53.060 38.596 1.00 0.00 H 0 +HETATM 3162 O HOH A 947 13.322 17.595 51.039 1.00 0.00 O 0 +HETATM 3163 H1 HOH A 947 13.178 16.644 50.853 1.00 0.00 H 0 +HETATM 3164 H2 HOH A 947 13.473 17.514 51.955 1.00 0.00 H 0 +HETATM 3165 O HOH A 948 40.547 24.771 41.438 1.00 0.00 O 0 +HETATM 3166 H1 HOH A 948 39.720 24.584 41.894 1.00 0.00 H 0 +HETATM 3167 H2 HOH A 948 41.074 25.506 41.845 1.00 0.00 H 0 +HETATM 3168 O HOH A 949 3.408 47.885 45.328 1.00 0.00 O 0 +HETATM 3169 H1 HOH A 949 2.784 48.498 44.843 1.00 0.00 H 0 +HETATM 3170 H2 HOH A 949 2.838 47.287 45.732 1.00 0.00 H 0 +HETATM 3171 O HOH A 950 36.894 2.889 11.647 1.00 0.00 O 0 +HETATM 3172 H1 HOH A 950 36.770 2.353 12.449 1.00 0.00 H 0 +HETATM 3173 H2 HOH A 950 37.559 3.616 11.821 1.00 0.00 H 0 +HETATM 3174 O HOH A 951 7.173 42.890 22.453 1.00 0.00 O 0 +HETATM 3175 H1 HOH A 951 7.226 43.323 23.358 1.00 0.00 H 0 +HETATM 3176 H2 HOH A 951 7.125 43.652 21.795 1.00 0.00 H 0 +HETATM 3177 O HOH A 952 53.788 34.540 0.836 1.00 0.00 O 0 +HETATM 3178 H1 HOH A 952 52.824 34.727 0.642 1.00 0.00 H 0 +HETATM 3179 H2 HOH A 952 54.278 34.898 0.018 1.00 0.00 H 0 +HETATM 3180 O HOH A 953 25.623 51.221 9.296 1.00 0.00 O 0 +HETATM 3181 H1 HOH A 953 26.541 51.469 9.309 1.00 0.00 H 0 +HETATM 3182 H2 HOH A 953 25.398 51.245 8.419 1.00 0.00 H 0 +HETATM 3183 O HOH A 954 22.649 41.163 44.036 1.00 0.00 O 0 +HETATM 3184 H1 HOH A 954 22.439 40.206 44.044 1.00 0.00 H 0 +HETATM 3185 H2 HOH A 954 23.448 41.347 43.496 1.00 0.00 H 0 +HETATM 3186 O HOH A 955 48.363 19.289 23.400 1.00 0.00 O 0 +HETATM 3187 H1 HOH A 955 47.505 19.745 23.480 1.00 0.00 H 0 +HETATM 3188 H2 HOH A 955 48.582 19.544 22.498 1.00 0.00 H 0 +HETATM 3189 O HOH A 956 49.132 33.088 15.835 1.00 0.00 O 0 +HETATM 3190 H1 HOH A 956 48.427 33.407 15.254 1.00 0.00 H 0 +HETATM 3191 H2 HOH A 956 49.748 33.850 16.028 1.00 0.00 H 0 +HETATM 3192 O HOH A 957 28.602 27.051 7.171 1.00 0.00 O 0 +HETATM 3193 H1 HOH A 957 28.457 28.012 7.066 1.00 0.00 H 0 +HETATM 3194 H2 HOH A 957 29.507 26.912 6.821 1.00 0.00 H 0 +HETATM 3195 O HOH A 958 21.492 38.927 2.118 1.00 0.00 O 0 +HETATM 3196 H1 HOH A 958 22.263 38.575 2.670 1.00 0.00 H 0 +HETATM 3197 H2 HOH A 958 21.147 38.114 1.793 1.00 0.00 H 0 +HETATM 3198 O HOH A 959 5.146 21.418 14.356 1.00 0.00 O 0 +HETATM 3199 H1 HOH A 959 6.018 21.776 14.043 1.00 0.00 H 0 +HETATM 3200 H2 HOH A 959 4.888 20.838 13.609 1.00 0.00 H 0 +HETATM 3201 O HOH A 960 4.524 1.434 22.253 1.00 0.00 O 0 +HETATM 3202 H1 HOH A 960 3.831 1.967 22.564 1.00 0.00 H 0 +HETATM 3203 H2 HOH A 960 4.819 1.934 21.519 1.00 0.00 H 0 +HETATM 3204 O HOH A 961 49.657 40.130 24.085 1.00 0.00 O 0 +HETATM 3205 H1 HOH A 961 50.141 40.814 23.616 1.00 0.00 H 0 +HETATM 3206 H2 HOH A 961 48.997 39.800 23.380 1.00 0.00 H 0 +HETATM 3207 O HOH A 962 43.960 0.811 52.486 1.00 0.00 O 0 +HETATM 3208 H1 HOH A 962 43.881 -0.110 52.327 1.00 0.00 H 0 +HETATM 3209 H2 HOH A 962 43.839 1.192 51.556 1.00 0.00 H 0 +HETATM 3210 O HOH A 963 7.594 31.516 18.876 1.00 0.00 O 0 +HETATM 3211 H1 HOH A 963 7.710 30.822 19.445 1.00 0.00 H 0 +HETATM 3212 H2 HOH A 963 8.301 31.287 18.219 1.00 0.00 H 0 +HETATM 3213 O HOH A 964 32.403 25.118 42.286 1.00 0.00 O 0 +HETATM 3214 H1 HOH A 964 33.111 25.425 42.876 1.00 0.00 H 0 +HETATM 3215 H2 HOH A 964 32.600 25.427 41.405 1.00 0.00 H 0 +HETATM 3216 O HOH A 965 52.794 11.152 37.208 1.00 0.00 O 0 +HETATM 3217 H1 HOH A 965 52.711 12.107 37.168 1.00 0.00 H 0 +HETATM 3218 H2 HOH A 965 53.683 10.935 37.564 1.00 0.00 H 0 +HETATM 3219 O HOH A 966 8.642 49.370 6.543 1.00 0.00 O 0 +HETATM 3220 H1 HOH A 966 8.458 48.719 5.876 1.00 0.00 H 0 +HETATM 3221 H2 HOH A 966 9.579 49.702 6.622 1.00 0.00 H 0 +HETATM 3222 O HOH A 967 24.491 20.514 22.410 1.00 0.00 O 0 +HETATM 3223 H1 HOH A 967 24.585 20.711 21.433 1.00 0.00 H 0 +HETATM 3224 H2 HOH A 967 24.176 19.602 22.402 1.00 0.00 H 0 +HETATM 3225 O HOH A 968 16.050 35.069 40.694 1.00 0.00 O 0 +HETATM 3226 H1 HOH A 968 15.165 35.429 40.503 1.00 0.00 H 0 +HETATM 3227 H2 HOH A 968 16.262 35.628 41.411 1.00 0.00 H 0 +HETATM 3228 O HOH A 969 34.131 16.448 18.894 1.00 0.00 O 0 +HETATM 3229 H1 HOH A 969 34.882 15.903 18.651 1.00 0.00 H 0 +HETATM 3230 H2 HOH A 969 33.962 16.978 18.117 1.00 0.00 H 0 +HETATM 3231 O HOH A 970 19.870 48.652 8.362 1.00 0.00 O 0 +HETATM 3232 H1 HOH A 970 19.914 47.772 7.947 1.00 0.00 H 0 +HETATM 3233 H2 HOH A 970 20.707 48.825 8.736 1.00 0.00 H 0 +HETATM 3234 O HOH A 971 24.903 8.041 46.006 1.00 0.00 O 0 +HETATM 3235 H1 HOH A 971 25.042 7.427 46.759 1.00 0.00 H 0 +HETATM 3236 H2 HOH A 971 24.149 8.618 46.262 1.00 0.00 H 0 +HETATM 3237 O HOH A 972 19.184 50.163 39.624 1.00 0.00 O 0 +HETATM 3238 H1 HOH A 972 19.704 50.093 38.818 1.00 0.00 H 0 +HETATM 3239 H2 HOH A 972 18.904 49.294 39.925 1.00 0.00 H 0 +HETATM 3240 O HOH A 973 41.284 29.015 0.983 1.00 0.00 O 0 +HETATM 3241 H1 HOH A 973 41.514 29.187 0.046 1.00 0.00 H 0 +HETATM 3242 H2 HOH A 973 40.493 28.487 0.998 1.00 0.00 H 0 +HETATM 3243 O HOH A 974 40.699 7.374 52.352 1.00 0.00 O 0 +HETATM 3244 H1 HOH A 974 40.996 8.152 52.873 1.00 0.00 H 0 +HETATM 3245 H2 HOH A 974 41.070 7.432 51.471 1.00 0.00 H 0 +HETATM 3246 O HOH A 975 41.669 33.484 40.041 1.00 0.00 O 0 +HETATM 3247 H1 HOH A 975 41.652 33.346 40.963 1.00 0.00 H 0 +HETATM 3248 H2 HOH A 975 41.441 32.672 39.475 1.00 0.00 H 0 +HETATM 3249 O HOH A 976 6.055 28.504 23.069 1.00 0.00 O 0 +HETATM 3250 H1 HOH A 976 5.537 28.061 22.397 1.00 0.00 H 0 +HETATM 3251 H2 HOH A 976 5.742 28.397 23.964 1.00 0.00 H 0 +HETATM 3252 O HOH A 977 30.785 40.541 16.234 1.00 0.00 O 0 +HETATM 3253 H1 HOH A 977 29.865 40.968 16.276 1.00 0.00 H 0 +HETATM 3254 H2 HOH A 977 31.309 41.275 16.654 1.00 0.00 H 0 +HETATM 3255 O HOH A 978 11.311 7.816 49.160 1.00 0.00 O 0 +HETATM 3256 H1 HOH A 978 10.564 8.374 49.604 1.00 0.00 H 0 +HETATM 3257 H2 HOH A 978 11.594 8.463 48.458 1.00 0.00 H 0 +HETATM 3258 O HOH A 979 23.070 44.004 37.992 1.00 0.00 O 0 +HETATM 3259 H1 HOH A 979 23.159 43.138 37.665 1.00 0.00 H 0 +HETATM 3260 H2 HOH A 979 23.895 44.579 37.857 1.00 0.00 H 0 +HETATM 3261 O HOH A 980 16.227 3.452 22.890 1.00 0.00 O 0 +HETATM 3262 H1 HOH A 980 16.167 4.335 22.633 1.00 0.00 H 0 +HETATM 3263 H2 HOH A 980 15.550 3.288 23.570 1.00 0.00 H 0 +HETATM 3264 O HOH A 981 44.315 31.054 46.718 1.00 0.00 O 0 +HETATM 3265 H1 HOH A 981 45.181 30.751 47.061 1.00 0.00 H 0 +HETATM 3266 H2 HOH A 981 44.189 32.036 46.769 1.00 0.00 H 0 +HETATM 3267 O HOH A 982 4.643 26.246 32.671 1.00 0.00 O 0 +HETATM 3268 H1 HOH A 982 3.913 25.957 33.244 1.00 0.00 H 0 +HETATM 3269 H2 HOH A 982 4.507 25.916 31.780 1.00 0.00 H 0 +HETATM 3270 O HOH A 983 35.042 2.353 17.007 1.00 0.00 O 0 +HETATM 3271 H1 HOH A 983 35.027 1.426 16.711 1.00 0.00 H 0 +HETATM 3272 H2 HOH A 983 35.657 2.968 16.627 1.00 0.00 H 0 +HETATM 3273 O HOH A 984 3.257 21.775 50.534 1.00 0.00 O 0 +HETATM 3274 H1 HOH A 984 4.079 21.279 50.497 1.00 0.00 H 0 +HETATM 3275 H2 HOH A 984 3.318 22.563 49.974 1.00 0.00 H 0 +HETATM 3276 O HOH A 985 16.320 20.790 12.668 1.00 0.00 O 0 +HETATM 3277 H1 HOH A 985 15.645 20.973 13.330 1.00 0.00 H 0 +HETATM 3278 H2 HOH A 985 17.201 20.848 13.137 1.00 0.00 H 0 +HETATM 3279 O HOH A 986 15.436 19.057 42.200 1.00 0.00 O 0 +HETATM 3280 H1 HOH A 986 16.149 19.489 42.757 1.00 0.00 H 0 +HETATM 3281 H2 HOH A 986 15.861 18.930 41.338 1.00 0.00 H 0 +HETATM 3282 O HOH A 987 42.924 19.586 7.471 1.00 0.00 O 0 +HETATM 3283 H1 HOH A 987 43.441 20.319 7.801 1.00 0.00 H 0 +HETATM 3284 H2 HOH A 987 43.025 18.844 8.096 1.00 0.00 H 0 +HETATM 3285 O HOH A 988 23.918 0.924 42.768 1.00 0.00 O 0 +HETATM 3286 H1 HOH A 988 23.161 1.516 42.563 1.00 0.00 H 0 +HETATM 3287 H2 HOH A 988 24.780 1.444 42.549 1.00 0.00 H 0 +HETATM 3288 O HOH A 989 50.112 22.703 31.218 1.00 0.00 O 0 +HETATM 3289 H1 HOH A 989 49.378 22.674 30.658 1.00 0.00 H 0 +HETATM 3290 H2 HOH A 989 50.403 21.841 31.495 1.00 0.00 H 0 +HETATM 3291 O HOH A 990 39.962 41.716 32.508 1.00 0.00 O 0 +HETATM 3292 H1 HOH A 990 40.497 42.162 31.888 1.00 0.00 H 0 +HETATM 3293 H2 HOH A 990 40.367 41.472 33.407 1.00 0.00 H 0 +HETATM 3294 O HOH A 991 41.752 44.580 38.563 1.00 0.00 O 0 +HETATM 3295 H1 HOH A 991 42.002 45.458 38.530 1.00 0.00 H 0 +HETATM 3296 H2 HOH A 991 40.996 44.465 39.183 1.00 0.00 H 0 +HETATM 3297 O HOH A 992 0.723 45.268 2.270 1.00 0.00 O 0 +HETATM 3298 H1 HOH A 992 -0.043 45.834 2.289 1.00 0.00 H 0 +HETATM 3299 H2 HOH A 992 0.429 44.342 2.488 1.00 0.00 H 0 +HETATM 3300 O HOH A 993 38.687 6.854 8.450 1.00 0.00 O 0 +HETATM 3301 H1 HOH A 993 39.405 7.485 8.568 1.00 0.00 H 0 +HETATM 3302 H2 HOH A 993 38.622 6.610 7.533 1.00 0.00 H 0 +HETATM 3303 O HOH A 994 39.966 53.437 5.194 1.00 0.00 O 0 +HETATM 3304 H1 HOH A 994 39.339 53.146 5.864 1.00 0.00 H 0 +HETATM 3305 H2 HOH A 994 40.543 54.158 5.507 1.00 0.00 H 0 +HETATM 3306 O HOH A 995 33.936 19.148 19.706 1.00 0.00 O 0 +HETATM 3307 H1 HOH A 995 34.290 18.215 19.875 1.00 0.00 H 0 +HETATM 3308 H2 HOH A 995 33.854 19.238 18.737 1.00 0.00 H 0 +HETATM 3309 O HOH A 996 35.245 19.337 40.354 1.00 0.00 O 0 +HETATM 3310 H1 HOH A 996 34.689 18.663 39.941 1.00 0.00 H 0 +HETATM 3311 H2 HOH A 996 35.599 18.879 41.100 1.00 0.00 H 0 +HETATM 3312 O HOH A 997 31.391 39.806 46.735 1.00 0.00 O 0 +HETATM 3313 H1 HOH A 997 31.662 38.882 46.817 1.00 0.00 H 0 +HETATM 3314 H2 HOH A 997 32.070 40.129 46.152 1.00 0.00 H 0 +HETATM 3315 O HOH A 998 21.237 2.515 11.769 1.00 0.00 O 0 +HETATM 3316 H1 HOH A 998 20.754 3.330 11.622 1.00 0.00 H 0 +HETATM 3317 H2 HOH A 998 21.938 2.609 11.070 1.00 0.00 H 0 +HETATM 3318 O HOH A 999 37.604 4.539 44.748 1.00 0.00 O 0 +HETATM 3319 H1 HOH A 999 37.265 4.314 43.798 1.00 0.00 H 0 +HETATM 3320 H2 HOH A 999 37.649 3.695 45.262 1.00 0.00 H 0 +HETATM 3321 O HOH A1000 37.317 17.028 45.877 1.00 0.00 O 0 +HETATM 3322 H1 HOH A1000 37.108 16.058 45.911 1.00 0.00 H 0 +HETATM 3323 H2 HOH A1000 37.610 17.291 44.937 1.00 0.00 H 0 +HETATM 3324 O HOH A1001 45.976 28.872 2.564 1.00 0.00 O 0 +HETATM 3325 H1 HOH A1001 45.026 28.586 2.683 1.00 0.00 H 0 +HETATM 3326 H2 HOH A1001 46.083 29.791 2.732 1.00 0.00 H 0 +HETATM 3327 O HOH A1002 1.907 39.957 40.029 1.00 0.00 O 0 +HETATM 3328 H1 HOH A1002 0.984 40.088 39.877 1.00 0.00 H 0 +HETATM 3329 H2 HOH A1002 2.134 40.740 40.562 1.00 0.00 H 0 +HETATM 3330 O HOH A1003 39.116 -0.188 41.577 1.00 0.00 O 0 +HETATM 3331 H1 HOH A1003 38.845 0.089 40.646 1.00 0.00 H 0 +HETATM 3332 H2 HOH A1003 38.598 0.449 42.146 1.00 0.00 H 0 +HETATM 3333 O HOH A1004 42.295 41.869 22.840 1.00 0.00 O 0 +HETATM 3334 H1 HOH A1004 41.563 41.373 23.194 1.00 0.00 H 0 +HETATM 3335 H2 HOH A1004 42.950 41.905 23.568 1.00 0.00 H 0 +HETATM 3336 O HOH A1005 34.069 36.593 2.412 1.00 0.00 O 0 +HETATM 3337 H1 HOH A1005 34.857 36.932 2.070 1.00 0.00 H 0 +HETATM 3338 H2 HOH A1005 34.245 35.730 2.774 1.00 0.00 H 0 +HETATM 3339 O HOH A1006 9.958 11.867 21.172 1.00 0.00 O 0 +HETATM 3340 H1 HOH A1006 10.578 12.218 20.566 1.00 0.00 H 0 +HETATM 3341 H2 HOH A1006 10.515 11.366 21.721 1.00 0.00 H 0 +HETATM 3342 O HOH A1007 17.870 11.799 1.269 1.00 0.00 O 0 +HETATM 3343 H1 HOH A1007 18.547 12.396 1.641 1.00 0.00 H 0 +HETATM 3344 H2 HOH A1007 18.383 11.312 0.600 1.00 0.00 H 0 +HETATM 3345 O HOH A1008 39.120 38.333 40.243 1.00 0.00 O 0 +HETATM 3346 H1 HOH A1008 39.800 37.678 40.328 1.00 0.00 H 0 +HETATM 3347 H2 HOH A1008 39.317 39.097 40.799 1.00 0.00 H 0 +HETATM 3348 O HOH A1009 30.940 0.944 43.935 1.00 0.00 O 0 +HETATM 3349 H1 HOH A1009 30.672 1.634 43.314 1.00 0.00 H 0 +HETATM 3350 H2 HOH A1009 30.065 0.698 44.356 1.00 0.00 H 0 +HETATM 3351 O HOH A1010 5.308 26.612 35.957 1.00 0.00 O 0 +HETATM 3352 H1 HOH A1010 5.041 26.189 36.808 1.00 0.00 H 0 +HETATM 3353 H2 HOH A1010 4.569 26.560 35.389 1.00 0.00 H 0 +HETATM 3354 O HOH A1011 16.195 6.897 5.938 1.00 0.00 O 0 +HETATM 3355 H1 HOH A1011 15.627 6.963 6.650 1.00 0.00 H 0 +HETATM 3356 H2 HOH A1011 15.695 7.506 5.301 1.00 0.00 H 0 +HETATM 3357 O HOH A1012 11.500 16.188 4.690 1.00 0.00 O 0 +HETATM 3358 H1 HOH A1012 10.517 16.409 4.605 1.00 0.00 H 0 +HETATM 3359 H2 HOH A1012 11.942 17.044 4.731 1.00 0.00 H 0 +HETATM 3360 O HOH A1013 47.412 25.294 27.747 1.00 0.00 O 0 +HETATM 3361 H1 HOH A1013 47.423 24.354 27.853 1.00 0.00 H 0 +HETATM 3362 H2 HOH A1013 48.355 25.555 27.851 1.00 0.00 H 0 +HETATM 3363 O HOH A1014 6.110 12.938 24.848 1.00 0.00 O 0 +HETATM 3364 H1 HOH A1014 5.135 12.837 24.602 1.00 0.00 H 0 +HETATM 3365 H2 HOH A1014 6.161 13.631 25.554 1.00 0.00 H 0 +HETATM 3366 O HOH A1015 40.966 47.682 11.647 1.00 0.00 O 0 +HETATM 3367 H1 HOH A1015 40.764 48.637 11.477 1.00 0.00 H 0 +HETATM 3368 H2 HOH A1015 41.907 47.595 11.344 1.00 0.00 H 0 +HETATM 3369 O HOH A1016 2.637 38.921 37.184 1.00 0.00 O 0 +HETATM 3370 H1 HOH A1016 2.153 38.955 36.350 1.00 0.00 H 0 +HETATM 3371 H2 HOH A1016 2.147 39.349 37.867 1.00 0.00 H 0 +HETATM 3372 O HOH A1017 38.714 14.116 39.179 1.00 0.00 O 0 +HETATM 3373 H1 HOH A1017 38.243 13.406 38.732 1.00 0.00 H 0 +HETATM 3374 H2 HOH A1017 38.896 13.843 40.087 1.00 0.00 H 0 +HETATM 3375 O HOH A1018 36.040 7.795 10.357 1.00 0.00 O 0 +HETATM 3376 H1 HOH A1018 35.564 8.279 9.677 1.00 0.00 H 0 +HETATM 3377 H2 HOH A1018 36.656 8.383 10.706 1.00 0.00 H 0 +HETATM 3378 O HOH A1019 44.984 11.968 37.151 1.00 0.00 O 0 +HETATM 3379 H1 HOH A1019 44.440 11.223 37.280 1.00 0.00 H 0 +HETATM 3380 H2 HOH A1019 44.550 12.564 37.801 1.00 0.00 H 0 +HETATM 3381 O HOH A1020 32.763 52.455 20.894 1.00 0.00 O 0 +HETATM 3382 H1 HOH A1020 33.646 52.744 21.262 1.00 0.00 H 0 +HETATM 3383 H2 HOH A1020 32.425 51.637 21.313 1.00 0.00 H 0 +HETATM 3384 O HOH A1021 20.750 2.348 8.134 1.00 0.00 O 0 +HETATM 3385 H1 HOH A1021 21.602 1.807 8.349 1.00 0.00 H 0 +HETATM 3386 H2 HOH A1021 21.057 3.125 7.712 1.00 0.00 H 0 +HETATM 3387 O HOH A1022 42.131 6.266 36.382 1.00 0.00 O 0 +HETATM 3388 H1 HOH A1022 43.043 6.541 36.475 1.00 0.00 H 0 +HETATM 3389 H2 HOH A1022 41.662 6.666 37.128 1.00 0.00 H 0 +HETATM 3390 O HOH A1023 37.752 7.141 18.369 1.00 0.00 O 0 +HETATM 3391 H1 HOH A1023 38.346 6.399 18.172 1.00 0.00 H 0 +HETATM 3392 H2 HOH A1023 36.884 6.823 18.505 1.00 0.00 H 0 +HETATM 3393 O HOH A1024 50.087 49.961 26.436 1.00 0.00 O 0 +HETATM 3394 H1 HOH A1024 50.289 49.200 25.918 1.00 0.00 H 0 +HETATM 3395 H2 HOH A1024 50.257 50.632 25.788 1.00 0.00 H 0 +HETATM 3396 O HOH A1025 18.761 30.319 19.014 1.00 0.00 O 0 +HETATM 3397 H1 HOH A1025 18.487 30.406 18.098 1.00 0.00 H 0 +HETATM 3398 H2 HOH A1025 19.533 30.918 19.108 1.00 0.00 H 0 +HETATM 3399 O HOH A1026 50.398 41.726 30.266 1.00 0.00 O 0 +HETATM 3400 H1 HOH A1026 50.554 42.168 31.153 1.00 0.00 H 0 +HETATM 3401 H2 HOH A1026 49.628 41.249 30.286 1.00 0.00 H 0 +HETATM 3402 O HOH A1027 16.701 24.485 13.597 1.00 0.00 O 0 +HETATM 3403 H1 HOH A1027 16.832 23.775 12.904 1.00 0.00 H 0 +HETATM 3404 H2 HOH A1027 16.933 23.990 14.374 1.00 0.00 H 0 +HETATM 3405 O HOH A1028 39.717 8.987 5.385 1.00 0.00 O 0 +HETATM 3406 H1 HOH A1028 38.892 9.499 5.538 1.00 0.00 H 0 +HETATM 3407 H2 HOH A1028 40.225 8.969 6.219 1.00 0.00 H 0 +HETATM 3408 O HOH A1029 20.572 27.855 36.318 1.00 0.00 O 0 +HETATM 3409 H1 HOH A1029 21.497 27.937 36.040 1.00 0.00 H 0 +HETATM 3410 H2 HOH A1029 20.237 28.750 36.134 1.00 0.00 H 0 +HETATM 3411 O HOH A1030 39.603 24.816 25.356 1.00 0.00 O 0 +HETATM 3412 H1 HOH A1030 40.099 25.433 25.869 1.00 0.00 H 0 +HETATM 3413 H2 HOH A1030 38.707 24.966 25.699 1.00 0.00 H 0 +HETATM 3414 O HOH A1031 51.263 41.925 35.582 1.00 0.00 O 0 +HETATM 3415 H1 HOH A1031 51.609 42.690 36.101 1.00 0.00 H 0 +HETATM 3416 H2 HOH A1031 51.985 41.273 35.637 1.00 0.00 H 0 +HETATM 3417 O HOH A1032 42.982 23.251 29.239 1.00 0.00 O 0 +HETATM 3418 H1 HOH A1032 42.365 23.940 28.834 1.00 0.00 H 0 +HETATM 3419 H2 HOH A1032 42.313 22.694 29.631 1.00 0.00 H 0 +HETATM 3420 O HOH A1033 15.340 39.309 2.755 1.00 0.00 O 0 +HETATM 3421 H1 HOH A1033 16.071 38.879 3.159 1.00 0.00 H 0 +HETATM 3422 H2 HOH A1033 15.663 40.185 2.517 1.00 0.00 H 0 +HETATM 3423 O HOH A1034 35.747 35.642 23.103 1.00 0.00 O 0 +HETATM 3424 H1 HOH A1034 36.601 35.994 23.346 1.00 0.00 H 0 +HETATM 3425 H2 HOH A1034 35.340 35.408 23.904 1.00 0.00 H 0 +HETATM 3426 O HOH A1035 11.626 31.320 16.146 1.00 0.00 O 0 +HETATM 3427 H1 HOH A1035 11.300 32.213 16.115 1.00 0.00 H 0 +HETATM 3428 H2 HOH A1035 11.916 31.158 17.060 1.00 0.00 H 0 +HETATM 3429 O HOH A1036 42.968 22.416 26.521 1.00 0.00 O 0 +HETATM 3430 H1 HOH A1036 42.034 22.249 26.586 1.00 0.00 H 0 +HETATM 3431 H2 HOH A1036 43.323 22.117 27.397 1.00 0.00 H 0 +HETATM 3432 O HOH A1037 37.425 45.557 34.839 1.00 0.00 O 0 +HETATM 3433 H1 HOH A1037 37.313 45.767 35.750 1.00 0.00 H 0 +HETATM 3434 H2 HOH A1037 37.515 44.593 34.963 1.00 0.00 H 0 +HETATM 3435 O HOH A1038 13.129 48.100 10.746 1.00 0.00 O 0 +HETATM 3436 H1 HOH A1038 12.601 48.884 10.879 1.00 0.00 H 0 +HETATM 3437 H2 HOH A1038 13.320 47.832 11.666 1.00 0.00 H 0 +HETATM 3438 O HOH A1039 31.095 7.164 22.831 1.00 0.00 O 0 +HETATM 3439 H1 HOH A1039 30.915 7.382 21.876 1.00 0.00 H 0 +HETATM 3440 H2 HOH A1039 31.796 6.463 22.900 1.00 0.00 H 0 +HETATM 3441 O HOH A1040 30.627 0.696 51.525 1.00 0.00 O 0 +HETATM 3442 H1 HOH A1040 30.604 -0.272 51.574 1.00 0.00 H 0 +HETATM 3443 H2 HOH A1040 29.926 1.081 52.143 1.00 0.00 H 0 +HETATM 3444 O HOH A1041 31.622 43.351 51.315 1.00 0.00 O 0 +HETATM 3445 H1 HOH A1041 32.455 43.369 51.836 1.00 0.00 H 0 +HETATM 3446 H2 HOH A1041 31.808 42.685 50.624 1.00 0.00 H 0 +HETATM 3447 O HOH A1042 31.619 50.582 31.050 1.00 0.00 O 0 +HETATM 3448 H1 HOH A1042 31.323 51.070 30.311 1.00 0.00 H 0 +HETATM 3449 H2 HOH A1042 30.769 50.369 31.448 1.00 0.00 H 0 +HETATM 3450 O HOH A1043 50.268 3.136 10.808 1.00 0.00 O 0 +HETATM 3451 H1 HOH A1043 50.319 2.751 11.628 1.00 0.00 H 0 +HETATM 3452 H2 HOH A1043 50.382 4.048 10.936 1.00 0.00 H 0 +HETATM 3453 O HOH A1044 0.257 38.647 50.551 1.00 0.00 O 0 +HETATM 3454 H1 HOH A1044 0.655 38.619 51.436 1.00 0.00 H 0 +HETATM 3455 H2 HOH A1044 -0.274 39.456 50.566 1.00 0.00 H 0 +HETATM 3456 O HOH A1045 20.941 49.226 19.164 1.00 0.00 O 0 +HETATM 3457 H1 HOH A1045 20.855 48.331 18.763 1.00 0.00 H 0 +HETATM 3458 H2 HOH A1045 20.165 49.712 18.832 1.00 0.00 H 0 +HETATM 3459 O HOH A1046 42.665 25.479 0.263 1.00 0.00 O 0 +HETATM 3460 H1 HOH A1046 43.078 25.876 -0.509 1.00 0.00 H 0 +HETATM 3461 H2 HOH A1046 43.242 24.839 0.652 1.00 0.00 H 0 +HETATM 3462 O HOH A1047 47.325 19.673 40.671 1.00 0.00 O 0 +HETATM 3463 H1 HOH A1047 48.258 19.660 40.847 1.00 0.00 H 0 +HETATM 3464 H2 HOH A1047 47.118 19.841 39.769 1.00 0.00 H 0 +HETATM 3465 O HOH A1048 46.475 34.058 10.937 1.00 0.00 O 0 +HETATM 3466 H1 HOH A1048 46.772 34.894 11.359 1.00 0.00 H 0 +HETATM 3467 H2 HOH A1048 45.662 33.827 11.414 1.00 0.00 H 0 +HETATM 3468 O HOH A1049 6.881 33.064 27.709 1.00 0.00 O 0 +HETATM 3469 H1 HOH A1049 6.621 33.799 27.184 1.00 0.00 H 0 +HETATM 3470 H2 HOH A1049 6.316 33.052 28.527 1.00 0.00 H 0 +HETATM 3471 O HOH A1050 4.027 35.396 18.463 1.00 0.00 O 0 +HETATM 3472 H1 HOH A1050 3.220 35.016 18.745 1.00 0.00 H 0 +HETATM 3473 H2 HOH A1050 4.618 35.295 19.137 1.00 0.00 H 0 +HETATM 3474 O HOH A1051 48.281 10.753 52.546 1.00 0.00 O 0 +HETATM 3475 H1 HOH A1051 48.761 11.523 52.320 1.00 0.00 H 0 +HETATM 3476 H2 HOH A1051 47.451 11.134 52.950 1.00 0.00 H 0 +HETATM 3477 O HOH A1052 5.583 44.007 48.659 1.00 0.00 O 0 +HETATM 3478 H1 HOH A1052 5.545 43.976 47.725 1.00 0.00 H 0 +HETATM 3479 H2 HOH A1052 6.417 44.486 48.920 1.00 0.00 H 0 +HETATM 3480 O HOH A1053 10.149 11.949 11.747 1.00 0.00 O 0 +HETATM 3481 H1 HOH A1053 9.470 11.661 12.280 1.00 0.00 H 0 +HETATM 3482 H2 HOH A1053 10.231 12.918 11.916 1.00 0.00 H 0 +HETATM 3483 O HOH A1054 4.172 20.237 47.008 1.00 0.00 O 0 +HETATM 3484 H1 HOH A1054 4.871 20.187 46.362 1.00 0.00 H 0 +HETATM 3485 H2 HOH A1054 4.267 21.141 47.394 1.00 0.00 H 0 +HETATM 3486 O HOH A1055 5.293 30.265 30.677 1.00 0.00 O 0 +HETATM 3487 H1 HOH A1055 5.090 31.216 30.618 1.00 0.00 H 0 +HETATM 3488 H2 HOH A1055 5.021 29.904 31.526 1.00 0.00 H 0 +HETATM 3489 O HOH A1056 28.716 32.647 12.934 1.00 0.00 O 0 +HETATM 3490 H1 HOH A1056 28.327 33.403 12.441 1.00 0.00 H 0 +HETATM 3491 H2 HOH A1056 27.989 31.990 12.966 1.00 0.00 H 0 +HETATM 3492 O HOH A1057 14.810 11.331 20.256 1.00 0.00 O 0 +HETATM 3493 H1 HOH A1057 15.477 11.628 19.592 1.00 0.00 H 0 +HETATM 3494 H2 HOH A1057 15.281 11.091 21.072 1.00 0.00 H 0 +HETATM 3495 O HOH A1058 3.032 7.096 15.336 1.00 0.00 O 0 +HETATM 3496 H1 HOH A1058 2.872 8.081 15.498 1.00 0.00 H 0 +HETATM 3497 H2 HOH A1058 2.496 6.941 14.537 1.00 0.00 H 0 +HETATM 3498 O HOH A1059 52.673 39.746 6.776 1.00 0.00 O 0 +HETATM 3499 H1 HOH A1059 51.881 39.572 6.195 1.00 0.00 H 0 +HETATM 3500 H2 HOH A1059 53.541 39.338 6.408 1.00 0.00 H 0 +HETATM 3501 O HOH A1060 27.571 19.508 27.553 1.00 0.00 O 0 +HETATM 3502 H1 HOH A1060 27.480 19.559 26.614 1.00 0.00 H 0 +HETATM 3503 H2 HOH A1060 28.127 18.715 27.755 1.00 0.00 H 0 +HETATM 3504 O HOH A1061 33.269 28.661 44.253 1.00 0.00 O 0 +HETATM 3505 H1 HOH A1061 33.040 28.977 45.168 1.00 0.00 H 0 +HETATM 3506 H2 HOH A1061 33.516 27.754 44.365 1.00 0.00 H 0 +HETATM 3507 O HOH A1062 42.460 45.549 23.524 1.00 0.00 O 0 +HETATM 3508 H1 HOH A1062 43.374 45.231 23.855 1.00 0.00 H 0 +HETATM 3509 H2 HOH A1062 42.710 46.046 22.758 1.00 0.00 H 0 +HETATM 3510 O HOH A1063 4.962 13.538 21.124 1.00 0.00 O 0 +HETATM 3511 H1 HOH A1063 4.320 12.900 21.351 1.00 0.00 H 0 +HETATM 3512 H2 HOH A1063 5.767 13.160 21.665 1.00 0.00 H 0 +HETATM 3513 O HOH A1064 19.872 23.384 5.039 1.00 0.00 O 0 +HETATM 3514 H1 HOH A1064 19.269 23.110 4.389 1.00 0.00 H 0 +HETATM 3515 H2 HOH A1064 19.952 24.315 5.062 1.00 0.00 H 0 +HETATM 3516 O HOH A1065 35.102 36.920 19.297 1.00 0.00 O 0 +HETATM 3517 H1 HOH A1065 34.631 37.120 20.098 1.00 0.00 H 0 +HETATM 3518 H2 HOH A1065 35.617 37.704 19.180 1.00 0.00 H 0 +HETATM 3519 O HOH A1066 6.546 38.547 36.693 1.00 0.00 O 0 +HETATM 3520 H1 HOH A1066 5.951 39.062 37.218 1.00 0.00 H 0 +HETATM 3521 H2 HOH A1066 7.373 38.563 37.115 1.00 0.00 H 0 +HETATM 3522 O HOH A1067 43.761 35.891 37.313 1.00 0.00 O 0 +HETATM 3523 H1 HOH A1067 44.550 35.333 37.514 1.00 0.00 H 0 +HETATM 3524 H2 HOH A1067 43.202 36.015 38.091 1.00 0.00 H 0 +HETATM 3525 O HOH A1068 53.556 3.400 38.269 1.00 0.00 O 0 +HETATM 3526 H1 HOH A1068 53.667 2.650 38.880 1.00 0.00 H 0 +HETATM 3527 H2 HOH A1068 52.660 3.426 38.040 1.00 0.00 H 0 +HETATM 3528 O HOH A1069 30.566 45.978 24.547 1.00 0.00 O 0 +HETATM 3529 H1 HOH A1069 30.238 45.307 25.145 1.00 0.00 H 0 +HETATM 3530 H2 HOH A1069 30.743 45.500 23.690 1.00 0.00 H 0 +HETATM 3531 O HOH A1070 27.407 19.986 5.265 1.00 0.00 O 0 +HETATM 3532 H1 HOH A1070 26.793 20.475 4.770 1.00 0.00 H 0 +HETATM 3533 H2 HOH A1070 27.470 19.170 4.781 1.00 0.00 H 0 +HETATM 3534 O HOH A1071 43.589 39.522 48.533 1.00 0.00 O 0 +HETATM 3535 H1 HOH A1071 42.741 39.265 48.247 1.00 0.00 H 0 +HETATM 3536 H2 HOH A1071 43.492 39.567 49.495 1.00 0.00 H 0 +HETATM 3537 O HOH A1072 22.191 50.100 33.992 1.00 0.00 O 0 +HETATM 3538 H1 HOH A1072 21.867 50.731 34.662 1.00 0.00 H 0 +HETATM 3539 H2 HOH A1072 23.198 50.085 34.035 1.00 0.00 H 0 +HETATM 3540 O HOH A1073 42.109 28.034 31.913 1.00 0.00 O 0 +HETATM 3541 H1 HOH A1073 41.672 27.212 32.189 1.00 0.00 H 0 +HETATM 3542 H2 HOH A1073 41.938 28.532 32.722 1.00 0.00 H 0 +HETATM 3543 O HOH A1074 13.446 8.501 21.456 1.00 0.00 O 0 +HETATM 3544 H1 HOH A1074 14.075 8.641 20.660 1.00 0.00 H 0 +HETATM 3545 H2 HOH A1074 12.834 7.774 21.262 1.00 0.00 H 0 +HETATM 3546 O HOH A1075 9.558 31.547 48.345 1.00 0.00 O 0 +HETATM 3547 H1 HOH A1075 9.077 31.141 47.620 1.00 0.00 H 0 +HETATM 3548 H2 HOH A1075 10.298 32.137 47.938 1.00 0.00 H 0 +HETATM 3549 O HOH A1076 29.658 6.164 26.263 1.00 0.00 O 0 +HETATM 3550 H1 HOH A1076 29.427 6.120 27.208 1.00 0.00 H 0 +HETATM 3551 H2 HOH A1076 30.583 5.788 26.131 1.00 0.00 H 0 +HETATM 3552 O HOH A1077 50.118 2.360 13.378 1.00 0.00 O 0 +HETATM 3553 H1 HOH A1077 50.565 1.686 13.813 1.00 0.00 H 0 +HETATM 3554 H2 HOH A1077 49.917 3.038 14.035 1.00 0.00 H 0 +HETATM 3555 O HOH A1078 14.337 28.429 8.053 1.00 0.00 O 0 +HETATM 3556 H1 HOH A1078 13.462 28.779 8.374 1.00 0.00 H 0 +HETATM 3557 H2 HOH A1078 14.165 27.513 7.907 1.00 0.00 H 0 +HETATM 3558 O HOH A1079 52.771 40.614 43.316 1.00 0.00 O 0 +HETATM 3559 H1 HOH A1079 53.225 41.391 42.904 1.00 0.00 H 0 +HETATM 3560 H2 HOH A1079 51.988 40.927 43.757 1.00 0.00 H 0 +HETATM 3561 O HOH A1080 26.227 48.927 21.213 1.00 0.00 O 0 +HETATM 3562 H1 HOH A1080 27.170 49.146 21.242 1.00 0.00 H 0 +HETATM 3563 H2 HOH A1080 25.980 49.094 22.117 1.00 0.00 H 0 +HETATM 3564 O HOH A1081 48.114 37.470 4.305 1.00 0.00 O 0 +HETATM 3565 H1 HOH A1081 48.294 36.574 3.920 1.00 0.00 H 0 +HETATM 3566 H2 HOH A1081 48.101 38.140 3.632 1.00 0.00 H 0 +HETATM 3567 O HOH A1082 13.215 42.504 15.535 1.00 0.00 O 0 +HETATM 3568 H1 HOH A1082 12.444 42.359 16.063 1.00 0.00 H 0 +HETATM 3569 H2 HOH A1082 13.949 41.840 15.766 1.00 0.00 H 0 +HETATM 3570 O HOH A1083 45.880 20.317 23.370 1.00 0.00 O 0 +HETATM 3571 H1 HOH A1083 45.361 20.253 24.113 1.00 0.00 H 0 +HETATM 3572 H2 HOH A1083 45.344 19.944 22.661 1.00 0.00 H 0 +HETATM 3573 O HOH A1084 33.089 10.011 12.641 1.00 0.00 O 0 +HETATM 3574 H1 HOH A1084 33.278 10.293 13.522 1.00 0.00 H 0 +HETATM 3575 H2 HOH A1084 33.377 10.699 12.028 1.00 0.00 H 0 +HETATM 3576 O HOH A1085 34.407 12.306 35.339 1.00 0.00 O 0 +HETATM 3577 H1 HOH A1085 33.479 12.169 35.048 1.00 0.00 H 0 +HETATM 3578 H2 HOH A1085 34.882 12.342 34.460 1.00 0.00 H 0 +HETATM 3579 O HOH A1086 12.132 1.627 47.163 1.00 0.00 O 0 +HETATM 3580 H1 HOH A1086 11.193 1.494 47.375 1.00 0.00 H 0 +HETATM 3581 H2 HOH A1086 12.294 2.540 47.226 1.00 0.00 H 0 +HETATM 3582 O HOH A1087 23.249 42.615 4.785 1.00 0.00 O 0 +HETATM 3583 H1 HOH A1087 23.028 41.721 5.038 1.00 0.00 H 0 +HETATM 3584 H2 HOH A1087 22.437 43.022 4.456 1.00 0.00 H 0 +HETATM 3585 O HOH A1088 47.483 2.046 28.958 1.00 0.00 O 0 +HETATM 3586 H1 HOH A1088 47.088 2.938 28.986 1.00 0.00 H 0 +HETATM 3587 H2 HOH A1088 46.976 1.632 28.214 1.00 0.00 H 0 +HETATM 3588 O HOH A1089 18.371 48.398 44.170 1.00 0.00 O 0 +HETATM 3589 H1 HOH A1089 18.623 47.864 43.409 1.00 0.00 H 0 +HETATM 3590 H2 HOH A1089 19.028 48.489 44.868 1.00 0.00 H 0 +HETATM 3591 O HOH A1090 10.918 31.902 7.013 1.00 0.00 O 0 +HETATM 3592 H1 HOH A1090 10.185 31.998 7.685 1.00 0.00 H 0 +HETATM 3593 H2 HOH A1090 10.513 32.058 6.153 1.00 0.00 H 0 +HETATM 3594 O HOH A1091 52.692 52.318 13.158 1.00 0.00 O 0 +HETATM 3595 H1 HOH A1091 52.795 51.636 13.816 1.00 0.00 H 0 +HETATM 3596 H2 HOH A1091 53.315 52.081 12.456 1.00 0.00 H 0 +HETATM 3597 O HOH A1092 13.263 12.752 12.815 1.00 0.00 O 0 +HETATM 3598 H1 HOH A1092 14.109 13.087 12.799 1.00 0.00 H 0 +HETATM 3599 H2 HOH A1092 12.616 13.536 12.977 1.00 0.00 H 0 +HETATM 3600 O HOH A1093 9.856 22.667 45.489 1.00 0.00 O 0 +HETATM 3601 H1 HOH A1093 9.121 23.212 45.567 1.00 0.00 H 0 +HETATM 3602 H2 HOH A1093 9.808 22.037 46.185 1.00 0.00 H 0 +HETATM 3603 O HOH A1094 34.306 37.731 14.510 1.00 0.00 O 0 +HETATM 3604 H1 HOH A1094 33.426 37.908 14.847 1.00 0.00 H 0 +HETATM 3605 H2 HOH A1094 34.193 37.005 13.871 1.00 0.00 H 0 +HETATM 3606 O HOH A1095 7.890 36.942 43.201 1.00 0.00 O 0 +HETATM 3607 H1 HOH A1095 8.266 36.064 43.019 1.00 0.00 H 0 +HETATM 3608 H2 HOH A1095 8.449 37.710 43.033 1.00 0.00 H 0 +HETATM 3609 O HOH A1096 27.032 3.785 21.149 1.00 0.00 O 0 +HETATM 3610 H1 HOH A1096 26.670 2.861 21.321 1.00 0.00 H 0 +HETATM 3611 H2 HOH A1096 28.019 3.886 21.460 1.00 0.00 H 0 +HETATM 3612 O HOH A1097 3.210 5.984 21.925 1.00 0.00 O 0 +HETATM 3613 H1 HOH A1097 2.414 6.542 22.134 1.00 0.00 H 0 +HETATM 3614 H2 HOH A1097 3.862 6.349 22.535 1.00 0.00 H 0 +HETATM 3615 O HOH A1098 8.899 33.230 30.736 1.00 0.00 O 0 +HETATM 3616 H1 HOH A1098 9.234 33.820 30.056 1.00 0.00 H 0 +HETATM 3617 H2 HOH A1098 9.327 32.422 30.627 1.00 0.00 H 0 +HETATM 3618 O HOH A1099 29.155 40.383 42.351 1.00 0.00 O 0 +HETATM 3619 H1 HOH A1099 28.598 40.781 41.738 1.00 0.00 H 0 +HETATM 3620 H2 HOH A1099 30.014 40.810 42.453 1.00 0.00 H 0 +HETATM 3621 O HOH A1100 49.817 3.541 15.899 1.00 0.00 O 0 +HETATM 3622 H1 HOH A1100 50.329 4.284 16.188 1.00 0.00 H 0 +HETATM 3623 H2 HOH A1100 49.950 2.886 16.607 1.00 0.00 H 0 +HETATM 3624 O HOH A1101 10.954 50.861 16.619 1.00 0.00 O 0 +HETATM 3625 H1 HOH A1101 11.401 51.641 16.474 1.00 0.00 H 0 +HETATM 3626 H2 HOH A1101 11.263 50.229 15.896 1.00 0.00 H 0 +HETATM 3627 O HOH A1102 33.882 24.960 4.809 1.00 0.00 O 0 +HETATM 3628 H1 HOH A1102 34.348 24.951 3.880 1.00 0.00 H 0 +HETATM 3629 H2 HOH A1102 33.503 25.887 4.925 1.00 0.00 H 0 +HETATM 3630 O HOH A1103 8.895 30.216 16.820 1.00 0.00 O 0 +HETATM 3631 H1 HOH A1103 9.316 29.550 17.486 1.00 0.00 H 0 +HETATM 3632 H2 HOH A1103 9.409 30.812 16.310 1.00 0.00 H 0 +HETATM 3633 O HOH A1104 42.117 46.622 33.749 1.00 0.00 O 0 +HETATM 3634 H1 HOH A1104 41.261 47.036 33.564 1.00 0.00 H 0 +HETATM 3635 H2 HOH A1104 42.908 47.187 33.482 1.00 0.00 H 0 +HETATM 3636 O HOH A1105 36.570 48.859 47.929 1.00 0.00 O 0 +HETATM 3637 H1 HOH A1105 35.821 48.549 47.440 1.00 0.00 H 0 +HETATM 3638 H2 HOH A1105 36.186 49.507 48.538 1.00 0.00 H 0 +HETATM 3639 O HOH A1106 6.968 41.801 43.439 1.00 0.00 O 0 +HETATM 3640 H1 HOH A1106 6.352 42.372 43.968 1.00 0.00 H 0 +HETATM 3641 H2 HOH A1106 6.876 40.913 43.784 1.00 0.00 H 0 +HETATM 3642 O HOH A1107 36.808 19.786 48.951 1.00 0.00 O 0 +HETATM 3643 H1 HOH A1107 36.196 19.141 48.662 1.00 0.00 H 0 +HETATM 3644 H2 HOH A1107 36.530 20.541 48.412 1.00 0.00 H 0 +HETATM 3645 O HOH A1108 0.789 22.179 12.836 1.00 0.00 O 0 +HETATM 3646 H1 HOH A1108 0.703 21.834 13.741 1.00 0.00 H 0 +HETATM 3647 H2 HOH A1108 -0.110 22.630 12.717 1.00 0.00 H 0 +HETATM 3648 O HOH A1109 38.045 35.106 51.519 1.00 0.00 O 0 +HETATM 3649 H1 HOH A1109 38.407 34.226 51.543 1.00 0.00 H 0 +HETATM 3650 H2 HOH A1109 37.531 35.220 50.693 1.00 0.00 H 0 +HETATM 3651 O HOH A1110 53.397 12.491 49.459 1.00 0.00 O 0 +HETATM 3652 H1 HOH A1110 54.280 12.685 49.196 1.00 0.00 H 0 +HETATM 3653 H2 HOH A1110 53.161 13.109 50.160 1.00 0.00 H 0 +HETATM 3654 O HOH A1111 26.327 33.563 26.052 1.00 0.00 O 0 +HETATM 3655 H1 HOH A1111 27.046 33.391 26.717 1.00 0.00 H 0 +HETATM 3656 H2 HOH A1111 25.721 34.212 26.334 1.00 0.00 H 0 +HETATM 3657 O HOH A1112 33.858 16.383 23.130 1.00 0.00 O 0 +HETATM 3658 H1 HOH A1112 34.794 16.644 22.993 1.00 0.00 H 0 +HETATM 3659 H2 HOH A1112 33.657 15.602 22.617 1.00 0.00 H 0 +HETATM 3660 O HOH A1113 32.354 6.813 20.139 1.00 0.00 O 0 +HETATM 3661 H1 HOH A1113 33.308 6.690 20.231 1.00 0.00 H 0 +HETATM 3662 H2 HOH A1113 32.007 6.293 19.422 1.00 0.00 H 0 +HETATM 3663 O HOH A1114 30.357 7.099 3.879 1.00 0.00 O 0 +HETATM 3664 H1 HOH A1114 30.294 8.026 4.115 1.00 0.00 H 0 +HETATM 3665 H2 HOH A1114 29.766 7.057 3.089 1.00 0.00 H 0 +HETATM 3666 O HOH A1115 11.010 1.629 14.254 1.00 0.00 O 0 +HETATM 3667 H1 HOH A1115 10.177 1.240 13.997 1.00 0.00 H 0 +HETATM 3668 H2 HOH A1115 10.789 2.577 14.329 1.00 0.00 H 0 +HETATM 3669 O HOH A1116 10.353 9.933 24.679 1.00 0.00 O 0 +HETATM 3670 H1 HOH A1116 9.474 9.686 24.261 1.00 0.00 H 0 +HETATM 3671 H2 HOH A1116 10.906 10.036 23.893 1.00 0.00 H 0 +HETATM 3672 O HOH A1117 32.146 3.947 1.566 1.00 0.00 O 0 +HETATM 3673 H1 HOH A1117 32.923 3.754 0.987 1.00 0.00 H 0 +HETATM 3674 H2 HOH A1117 31.793 3.063 1.873 1.00 0.00 H 0 +HETATM 3675 O HOH A1118 51.577 35.797 42.490 1.00 0.00 O 0 +HETATM 3676 H1 HOH A1118 50.683 36.077 42.707 1.00 0.00 H 0 +HETATM 3677 H2 HOH A1118 52.024 36.620 42.200 1.00 0.00 H 0 +HETATM 3678 O HOH A1119 34.078 22.294 49.685 1.00 0.00 O 0 +HETATM 3679 H1 HOH A1119 34.755 22.421 48.999 1.00 0.00 H 0 +HETATM 3680 H2 HOH A1119 34.555 22.196 50.454 1.00 0.00 H 0 +HETATM 3681 O HOH A1120 10.661 10.639 27.366 1.00 0.00 O 0 +HETATM 3682 H1 HOH A1120 10.496 10.489 26.423 1.00 0.00 H 0 +HETATM 3683 H2 HOH A1120 10.042 11.298 27.561 1.00 0.00 H 0 +HETATM 3684 O HOH A1121 11.005 28.958 5.473 1.00 0.00 O 0 +HETATM 3685 H1 HOH A1121 10.908 29.091 6.403 1.00 0.00 H 0 +HETATM 3686 H2 HOH A1121 11.419 29.826 5.092 1.00 0.00 H 0 +HETATM 3687 O HOH A1122 49.744 48.134 13.253 1.00 0.00 O 0 +HETATM 3688 H1 HOH A1122 49.427 48.368 14.136 1.00 0.00 H 0 +HETATM 3689 H2 HOH A1122 49.558 47.229 13.062 1.00 0.00 H 0 +HETATM 3690 O HOH A1123 29.209 21.419 13.071 1.00 0.00 O 0 +HETATM 3691 H1 HOH A1123 28.646 20.628 12.921 1.00 0.00 H 0 +HETATM 3692 H2 HOH A1123 29.996 21.193 13.633 1.00 0.00 H 0 +HETATM 3693 O HOH A1124 20.492 7.683 32.443 1.00 0.00 O 0 +HETATM 3694 H1 HOH A1124 20.057 8.448 32.851 1.00 0.00 H 0 +HETATM 3695 H2 HOH A1124 19.814 7.046 32.473 1.00 0.00 H 0 +HETATM 3696 O HOH A1125 53.273 38.905 38.822 1.00 0.00 O 0 +HETATM 3697 H1 HOH A1125 52.281 38.944 38.842 1.00 0.00 H 0 +HETATM 3698 H2 HOH A1125 53.566 38.054 38.792 1.00 0.00 H 0 +HETATM 3699 O HOH A1126 31.369 47.618 38.667 1.00 0.00 O 0 +HETATM 3700 H1 HOH A1126 30.616 48.191 38.476 1.00 0.00 H 0 +HETATM 3701 H2 HOH A1126 31.814 47.175 37.969 1.00 0.00 H 0 +HETATM 3702 O HOH A1127 7.337 37.254 31.757 1.00 0.00 O 0 +HETATM 3703 H1 HOH A1127 7.656 36.966 32.596 1.00 0.00 H 0 +HETATM 3704 H2 HOH A1127 8.008 37.767 31.384 1.00 0.00 H 0 +HETATM 3705 O HOH A1128 35.127 15.084 28.454 1.00 0.00 O 0 +HETATM 3706 H1 HOH A1128 34.585 15.379 27.658 1.00 0.00 H 0 +HETATM 3707 H2 HOH A1128 35.809 15.752 28.560 1.00 0.00 H 0 +HETATM 3708 O HOH A1129 43.799 8.483 15.435 1.00 0.00 O 0 +HETATM 3709 H1 HOH A1129 44.241 7.805 14.958 1.00 0.00 H 0 +HETATM 3710 H2 HOH A1129 43.882 9.323 14.897 1.00 0.00 H 0 +HETATM 3711 O HOH A1130 22.801 4.836 22.056 1.00 0.00 O 0 +HETATM 3712 H1 HOH A1130 23.628 5.054 22.612 1.00 0.00 H 0 +HETATM 3713 H2 HOH A1130 22.519 3.916 22.186 1.00 0.00 H 0 +HETATM 3714 O HOH A1131 37.208 45.695 12.240 1.00 0.00 O 0 +HETATM 3715 H1 HOH A1131 38.135 45.492 12.194 1.00 0.00 H 0 +HETATM 3716 H2 HOH A1131 37.274 46.670 12.112 1.00 0.00 H 0 +HETATM 3717 O HOH A1132 5.762 49.377 23.693 1.00 0.00 O 0 +HETATM 3718 H1 HOH A1132 4.944 48.857 23.865 1.00 0.00 H 0 +HETATM 3719 H2 HOH A1132 5.751 50.059 24.395 1.00 0.00 H 0 +HETATM 3720 O HOH A1133 52.122 14.010 51.950 1.00 0.00 O 0 +HETATM 3721 H1 HOH A1133 52.735 13.499 52.484 1.00 0.00 H 0 +HETATM 3722 H2 HOH A1133 51.543 14.431 52.554 1.00 0.00 H 0 +HETATM 3723 O HOH A1134 26.728 44.411 40.660 1.00 0.00 O 0 +HETATM 3724 H1 HOH A1134 26.106 45.043 41.140 1.00 0.00 H 0 +HETATM 3725 H2 HOH A1134 27.132 44.869 39.894 1.00 0.00 H 0 +HETATM 3726 O HOH A1135 52.569 50.245 10.673 1.00 0.00 O 0 +HETATM 3727 H1 HOH A1135 53.376 50.881 10.812 1.00 0.00 H 0 +HETATM 3728 H2 HOH A1135 52.165 50.016 11.486 1.00 0.00 H 0 +HETATM 3729 O HOH A1136 41.005 12.212 26.375 1.00 0.00 O 0 +HETATM 3730 H1 HOH A1136 41.028 11.346 25.990 1.00 0.00 H 0 +HETATM 3731 H2 HOH A1136 40.106 12.582 26.347 1.00 0.00 H 0 +HETATM 3732 O HOH A1137 27.451 3.133 12.720 1.00 0.00 O 0 +HETATM 3733 H1 HOH A1137 27.435 2.772 13.603 1.00 0.00 H 0 +HETATM 3734 H2 HOH A1137 26.875 3.934 12.729 1.00 0.00 H 0 +HETATM 3735 O HOH A1138 37.832 9.530 19.763 1.00 0.00 O 0 +HETATM 3736 H1 HOH A1138 38.027 8.631 19.425 1.00 0.00 H 0 +HETATM 3737 H2 HOH A1138 36.864 9.674 19.538 1.00 0.00 H 0 +HETATM 3738 O HOH A1139 36.068 48.508 16.621 1.00 0.00 O 0 +HETATM 3739 H1 HOH A1139 35.359 47.937 16.890 1.00 0.00 H 0 +HETATM 3740 H2 HOH A1139 36.590 47.870 16.164 1.00 0.00 H 0 +HETATM 3741 O HOH A1140 7.401 24.066 50.443 1.00 0.00 O 0 +HETATM 3742 H1 HOH A1140 6.427 24.104 50.234 1.00 0.00 H 0 +HETATM 3743 H2 HOH A1140 7.867 24.044 49.613 1.00 0.00 H 0 +HETATM 3744 O HOH A1141 37.420 20.670 44.536 1.00 0.00 O 0 +HETATM 3745 H1 HOH A1141 38.010 21.407 44.365 1.00 0.00 H 0 +HETATM 3746 H2 HOH A1141 36.971 20.661 43.672 1.00 0.00 H 0 +HETATM 3747 O HOH A1142 7.245 3.105 48.065 1.00 0.00 O 0 +HETATM 3748 H1 HOH A1142 6.957 2.718 47.280 1.00 0.00 H 0 +HETATM 3749 H2 HOH A1142 6.463 3.331 48.560 1.00 0.00 H 0 +HETATM 3750 O HOH A1143 4.311 30.906 24.571 1.00 0.00 O 0 +HETATM 3751 H1 HOH A1143 3.528 30.394 24.677 1.00 0.00 H 0 +HETATM 3752 H2 HOH A1143 3.988 31.800 24.689 1.00 0.00 H 0 +HETATM 3753 O HOH A1144 37.993 31.493 41.259 1.00 0.00 O 0 +HETATM 3754 H1 HOH A1144 38.434 31.945 40.588 1.00 0.00 H 0 +HETATM 3755 H2 HOH A1144 37.946 32.164 41.931 1.00 0.00 H 0 +HETATM 3756 O HOH A1145 38.204 48.451 3.390 1.00 0.00 O 0 +HETATM 3757 H1 HOH A1145 37.798 48.726 4.231 1.00 0.00 H 0 +HETATM 3758 H2 HOH A1145 37.824 47.602 3.050 1.00 0.00 H 0 +HETATM 3759 O HOH A1146 3.570 1.202 10.770 1.00 0.00 O 0 +HETATM 3760 H1 HOH A1146 2.651 1.216 10.547 1.00 0.00 H 0 +HETATM 3761 H2 HOH A1146 3.870 0.518 10.155 1.00 0.00 H 0 +HETATM 3762 O HOH A1147 17.360 34.556 11.328 1.00 0.00 O 0 +HETATM 3763 H1 HOH A1147 18.242 34.302 11.360 1.00 0.00 H 0 +HETATM 3764 H2 HOH A1147 16.932 34.240 12.176 1.00 0.00 H 0 +HETATM 3765 O HOH A1148 31.280 23.560 13.173 1.00 0.00 O 0 +HETATM 3766 H1 HOH A1148 31.585 23.922 12.305 1.00 0.00 H 0 +HETATM 3767 H2 HOH A1148 30.411 23.214 12.993 1.00 0.00 H 0 +HETATM 3768 O HOH A1149 22.578 2.224 14.286 1.00 0.00 O 0 +HETATM 3769 H1 HOH A1149 22.056 2.255 13.446 1.00 0.00 H 0 +HETATM 3770 H2 HOH A1149 22.961 1.347 14.211 1.00 0.00 H 0 +HETATM 3771 O HOH A1150 44.429 34.448 34.739 1.00 0.00 O 0 +HETATM 3772 H1 HOH A1150 43.851 34.310 35.495 1.00 0.00 H 0 +HETATM 3773 H2 HOH A1150 44.755 33.606 34.364 1.00 0.00 H 0 +HETATM 3774 O HOH A1151 27.758 48.560 11.397 1.00 0.00 O 0 +HETATM 3775 H1 HOH A1151 28.224 48.659 10.558 1.00 0.00 H 0 +HETATM 3776 H2 HOH A1151 27.804 49.325 11.968 1.00 0.00 H 0 +HETATM 3777 O HOH A1152 43.027 12.650 47.279 1.00 0.00 O 0 +HETATM 3778 H1 HOH A1152 42.872 12.910 46.338 1.00 0.00 H 0 +HETATM 3779 H2 HOH A1152 43.818 11.999 47.310 1.00 0.00 H 0 +HETATM 3780 O HOH A1153 38.583 51.769 46.573 1.00 0.00 O 0 +HETATM 3781 H1 HOH A1153 38.210 51.213 47.199 1.00 0.00 H 0 +HETATM 3782 H2 HOH A1153 39.132 51.133 46.143 1.00 0.00 H 0 +HETATM 3783 O HOH A1154 25.602 45.199 43.316 1.00 0.00 O 0 +HETATM 3784 H1 HOH A1154 26.509 45.351 43.122 1.00 0.00 H 0 +HETATM 3785 H2 HOH A1154 25.577 45.389 44.274 1.00 0.00 H 0 +HETATM 3786 O HOH A1155 16.267 5.967 43.522 1.00 0.00 O 0 +HETATM 3787 H1 HOH A1155 16.292 5.258 44.198 1.00 0.00 H 0 +HETATM 3788 H2 HOH A1155 17.074 5.954 43.022 1.00 0.00 H 0 +HETATM 3789 O HOH A1156 45.525 32.519 43.105 1.00 0.00 O 0 +HETATM 3790 H1 HOH A1156 46.100 32.774 43.847 1.00 0.00 H 0 +HETATM 3791 H2 HOH A1156 45.065 33.420 42.887 1.00 0.00 H 0 +HETATM 3792 O HOH A1157 37.863 10.000 35.926 1.00 0.00 O 0 +HETATM 3793 H1 HOH A1157 38.397 10.352 36.636 1.00 0.00 H 0 +HETATM 3794 H2 HOH A1157 37.104 9.581 36.257 1.00 0.00 H 0 +HETATM 3795 O HOH A1158 2.941 2.533 1.551 1.00 0.00 O 0 +HETATM 3796 H1 HOH A1158 3.015 3.489 1.648 1.00 0.00 H 0 +HETATM 3797 H2 HOH A1158 3.579 2.311 0.853 1.00 0.00 H 0 +HETATM 3798 O HOH A1159 48.357 34.242 49.159 1.00 0.00 O 0 +HETATM 3799 H1 HOH A1159 49.087 34.505 49.662 1.00 0.00 H 0 +HETATM 3800 H2 HOH A1159 48.130 35.023 48.648 1.00 0.00 H 0 +HETATM 3801 O HOH A1160 3.053 47.769 32.173 1.00 0.00 O 0 +HETATM 3802 H1 HOH A1160 3.884 48.075 32.497 1.00 0.00 H 0 +HETATM 3803 H2 HOH A1160 2.593 47.534 32.988 1.00 0.00 H 0 +HETATM 3804 O HOH A1161 43.715 49.003 3.100 1.00 0.00 O 0 +HETATM 3805 H1 HOH A1161 42.765 48.790 3.261 1.00 0.00 H 0 +HETATM 3806 H2 HOH A1161 44.271 48.434 3.615 1.00 0.00 H 0 +HETATM 3807 O HOH A1162 47.553 31.722 41.815 1.00 0.00 O 0 +HETATM 3808 H1 HOH A1162 46.715 31.823 42.233 1.00 0.00 H 0 +HETATM 3809 H2 HOH A1162 47.823 30.820 42.005 1.00 0.00 H 0 +HETATM 3810 O HOH A1163 5.774 49.522 41.698 1.00 0.00 O 0 +HETATM 3811 H1 HOH A1163 6.427 48.828 41.750 1.00 0.00 H 0 +HETATM 3812 H2 HOH A1163 5.684 49.822 42.633 1.00 0.00 H 0 +HETATM 3813 O HOH A1164 17.508 30.376 10.236 1.00 0.00 O 0 +HETATM 3814 H1 HOH A1164 16.844 29.649 10.351 1.00 0.00 H 0 +HETATM 3815 H2 HOH A1164 17.082 30.982 9.555 1.00 0.00 H 0 +HETATM 3816 O HOH A1165 40.555 16.162 49.850 1.00 0.00 O 0 +HETATM 3817 H1 HOH A1165 40.605 15.631 50.688 1.00 0.00 H 0 +HETATM 3818 H2 HOH A1165 41.295 15.824 49.355 1.00 0.00 H 0 +HETATM 3819 O HOH A1166 1.321 41.747 15.137 1.00 0.00 O 0 +HETATM 3820 H1 HOH A1166 0.939 41.096 15.734 1.00 0.00 H 0 +HETATM 3821 H2 HOH A1166 1.259 41.429 14.247 1.00 0.00 H 0 +HETATM 3822 O HOH A1167 24.116 12.008 44.703 1.00 0.00 O 0 +HETATM 3823 H1 HOH A1167 23.629 11.485 45.394 1.00 0.00 H 0 +HETATM 3824 H2 HOH A1167 24.056 11.422 43.922 1.00 0.00 H 0 +HETATM 3825 O HOH A1168 36.805 34.931 12.782 1.00 0.00 O 0 +HETATM 3826 H1 HOH A1168 37.720 35.358 12.690 1.00 0.00 H 0 +HETATM 3827 H2 HOH A1168 36.098 35.438 12.290 1.00 0.00 H 0 +HETATM 3828 O HOH A1169 47.296 31.537 9.849 1.00 0.00 O 0 +HETATM 3829 H1 HOH A1169 47.084 32.421 10.238 1.00 0.00 H 0 +HETATM 3830 H2 HOH A1169 47.622 31.730 8.964 1.00 0.00 H 0 +HETATM 3831 O HOH A1170 30.413 51.852 4.096 1.00 0.00 O 0 +HETATM 3832 H1 HOH A1170 30.408 51.600 3.102 1.00 0.00 H 0 +HETATM 3833 H2 HOH A1170 31.377 51.728 4.366 1.00 0.00 H 0 +HETATM 3834 O HOH A1171 34.730 15.659 9.617 1.00 0.00 O 0 +HETATM 3835 H1 HOH A1171 34.440 16.588 9.519 1.00 0.00 H 0 +HETATM 3836 H2 HOH A1171 34.051 15.113 9.186 1.00 0.00 H 0 +HETATM 3837 O HOH A1172 23.714 43.036 18.021 1.00 0.00 O 0 +HETATM 3838 H1 HOH A1172 24.694 42.787 18.097 1.00 0.00 H 0 +HETATM 3839 H2 HOH A1172 23.293 42.307 18.575 1.00 0.00 H 0 +HETATM 3840 O HOH A1173 28.238 15.458 43.417 1.00 0.00 O 0 +HETATM 3841 H1 HOH A1173 29.168 15.226 43.548 1.00 0.00 H 0 +HETATM 3842 H2 HOH A1173 27.951 14.833 42.798 1.00 0.00 H 0 +HETATM 3843 O HOH A1174 36.103 7.237 26.318 1.00 0.00 O 0 +HETATM 3844 H1 HOH A1174 35.678 6.317 26.310 1.00 0.00 H 0 +HETATM 3845 H2 HOH A1174 35.394 7.920 26.486 1.00 0.00 H 0 +HETATM 3846 O HOH A1175 14.571 3.763 9.186 1.00 0.00 O 0 +HETATM 3847 H1 HOH A1175 14.964 2.937 8.865 1.00 0.00 H 0 +HETATM 3848 H2 HOH A1175 13.611 3.682 9.303 1.00 0.00 H 0 +HETATM 3849 O HOH A1176 31.599 11.782 27.821 1.00 0.00 O 0 +HETATM 3850 H1 HOH A1176 30.778 12.128 28.132 1.00 0.00 H 0 +HETATM 3851 H2 HOH A1176 31.412 11.263 27.015 1.00 0.00 H 0 +HETATM 3852 O HOH A1177 41.232 40.768 13.207 1.00 0.00 O 0 +HETATM 3853 H1 HOH A1177 40.397 41.267 13.258 1.00 0.00 H 0 +HETATM 3854 H2 HOH A1177 41.787 41.453 12.836 1.00 0.00 H 0 +HETATM 3855 O HOH A1178 21.640 6.000 35.867 1.00 0.00 O 0 +HETATM 3856 H1 HOH A1178 21.574 5.296 35.211 1.00 0.00 H 0 +HETATM 3857 H2 HOH A1178 20.782 6.428 35.959 1.00 0.00 H 0 +HETATM 3858 O HOH A1179 11.605 6.348 2.303 1.00 0.00 O 0 +HETATM 3859 H1 HOH A1179 11.043 5.691 1.922 1.00 0.00 H 0 +HETATM 3860 H2 HOH A1179 12.297 5.897 2.825 1.00 0.00 H 0 +HETATM 3861 O HOH A1180 22.038 36.671 24.613 1.00 0.00 O 0 +HETATM 3862 H1 HOH A1180 21.175 36.514 24.156 1.00 0.00 H 0 +HETATM 3863 H2 HOH A1180 22.591 35.901 24.654 1.00 0.00 H 0 +HETATM 3864 O HOH A1181 20.277 26.160 10.195 1.00 0.00 O 0 +HETATM 3865 H1 HOH A1181 19.339 25.906 10.264 1.00 0.00 H 0 +HETATM 3866 H2 HOH A1181 20.271 27.088 10.032 1.00 0.00 H 0 +HETATM 3867 O HOH A1182 42.545 32.735 8.577 1.00 0.00 O 0 +HETATM 3868 H1 HOH A1182 42.826 33.625 8.530 1.00 0.00 H 0 +HETATM 3869 H2 HOH A1182 41.731 32.733 8.011 1.00 0.00 H 0 +HETATM 3870 O HOH A1183 38.026 18.306 20.551 1.00 0.00 O 0 +HETATM 3871 H1 HOH A1183 37.360 17.935 21.156 1.00 0.00 H 0 +HETATM 3872 H2 HOH A1183 38.895 18.099 20.803 1.00 0.00 H 0 +HETATM 3873 O HOH A1184 53.062 0.114 31.990 1.00 0.00 O 0 +HETATM 3874 H1 HOH A1184 53.828 -0.300 31.507 1.00 0.00 H 0 +HETATM 3875 H2 HOH A1184 52.915 0.962 31.499 1.00 0.00 H 0 +HETATM 3876 O HOH A1185 35.579 1.627 19.605 1.00 0.00 O 0 +HETATM 3877 H1 HOH A1185 35.381 1.976 18.688 1.00 0.00 H 0 +HETATM 3878 H2 HOH A1185 36.035 0.791 19.343 1.00 0.00 H 0 +HETATM 3879 O HOH A1186 43.943 45.695 15.457 1.00 0.00 O 0 +HETATM 3880 H1 HOH A1186 43.112 45.507 14.992 1.00 0.00 H 0 +HETATM 3881 H2 HOH A1186 44.018 45.121 16.257 1.00 0.00 H 0 +HETATM 3882 O HOH A1187 9.876 8.224 12.004 1.00 0.00 O 0 +HETATM 3883 H1 HOH A1187 10.281 9.076 12.176 1.00 0.00 H 0 +HETATM 3884 H2 HOH A1187 10.316 7.556 12.595 1.00 0.00 H 0 +HETATM 3885 O HOH A1188 33.445 11.892 1.235 1.00 0.00 O 0 +HETATM 3886 H1 HOH A1188 33.461 11.039 1.701 1.00 0.00 H 0 +HETATM 3887 H2 HOH A1188 34.346 12.346 1.405 1.00 0.00 H 0 +HETATM 3888 O HOH A1189 24.123 26.020 48.263 1.00 0.00 O 0 +HETATM 3889 H1 HOH A1189 24.900 25.513 48.463 1.00 0.00 H 0 +HETATM 3890 H2 HOH A1189 23.800 26.476 49.074 1.00 0.00 H 0 +HETATM 3891 O HOH A1190 1.085 40.304 12.683 1.00 0.00 O 0 +HETATM 3892 H1 HOH A1190 0.220 40.587 12.882 1.00 0.00 H 0 +HETATM 3893 H2 HOH A1190 1.137 40.314 11.720 1.00 0.00 H 0 +HETATM 3894 O HOH A1191 16.946 20.698 35.744 1.00 0.00 O 0 +HETATM 3895 H1 HOH A1191 16.376 21.030 35.039 1.00 0.00 H 0 +HETATM 3896 H2 HOH A1191 16.844 21.297 36.551 1.00 0.00 H 0 +HETATM 3897 O HOH A1192 30.747 17.439 2.606 1.00 0.00 O 0 +HETATM 3898 H1 HOH A1192 31.313 17.704 3.351 1.00 0.00 H 0 +HETATM 3899 H2 HOH A1192 31.278 16.943 2.006 1.00 0.00 H 0 +HETATM 3900 O HOH A1193 47.515 34.666 21.500 1.00 0.00 O 0 +HETATM 3901 H1 HOH A1193 47.506 33.699 21.596 1.00 0.00 H 0 +HETATM 3902 H2 HOH A1193 47.937 34.903 22.394 1.00 0.00 H 0 +HETATM 3903 O HOH A1194 26.415 6.407 47.534 1.00 0.00 O 0 +HETATM 3904 H1 HOH A1194 26.613 5.910 46.751 1.00 0.00 H 0 +HETATM 3905 H2 HOH A1194 26.641 5.713 48.185 1.00 0.00 H 0 +HETATM 3906 O HOH A1195 1.471 5.185 9.962 1.00 0.00 O 0 +HETATM 3907 H1 HOH A1195 2.229 4.745 10.274 1.00 0.00 H 0 +HETATM 3908 H2 HOH A1195 1.384 5.068 8.984 1.00 0.00 H 0 +HETATM 3909 O HOH A1196 36.291 30.724 15.460 1.00 0.00 O 0 +HETATM 3910 H1 HOH A1196 36.210 30.590 16.445 1.00 0.00 H 0 +HETATM 3911 H2 HOH A1196 36.203 31.691 15.525 1.00 0.00 H 0 +HETATM 3912 O HOH A1197 30.577 1.282 16.066 1.00 0.00 O 0 +HETATM 3913 H1 HOH A1197 31.224 1.758 16.622 1.00 0.00 H 0 +HETATM 3914 H2 HOH A1197 30.154 0.623 16.575 1.00 0.00 H 0 +HETATM 3915 O HOH A1198 40.338 20.157 23.702 1.00 0.00 O 0 +HETATM 3916 H1 HOH A1198 40.517 20.711 22.886 1.00 0.00 H 0 +HETATM 3917 H2 HOH A1198 40.225 20.843 24.392 1.00 0.00 H 0 +HETATM 3918 O HOH A1199 18.189 19.040 43.205 1.00 0.00 O 0 +HETATM 3919 H1 HOH A1199 19.026 19.252 42.792 1.00 0.00 H 0 +HETATM 3920 H2 HOH A1199 18.111 18.067 43.329 1.00 0.00 H 0 +HETATM 3921 O HOH A1200 48.792 17.781 15.694 1.00 0.00 O 0 +HETATM 3922 H1 HOH A1200 49.120 18.644 15.488 1.00 0.00 H 0 +HETATM 3923 H2 HOH A1200 48.850 17.249 14.898 1.00 0.00 H 0 +HETATM 3924 O HOH A1201 10.470 51.694 42.461 1.00 0.00 O 0 +HETATM 3925 H1 HOH A1201 9.962 52.499 42.432 1.00 0.00 H 0 +HETATM 3926 H2 HOH A1201 10.068 51.092 43.098 1.00 0.00 H 0 +HETATM 3927 O HOH A1202 27.158 45.288 0.512 1.00 0.00 O 0 +HETATM 3928 H1 HOH A1202 28.076 45.051 0.762 1.00 0.00 H 0 +HETATM 3929 H2 HOH A1202 27.157 45.548 -0.448 1.00 0.00 H 0 +HETATM 3930 O HOH A1203 15.273 52.721 5.108 1.00 0.00 O 0 +HETATM 3931 H1 HOH A1203 14.980 52.807 6.035 1.00 0.00 H 0 +HETATM 3932 H2 HOH A1203 15.135 51.841 4.715 1.00 0.00 H 0 +HETATM 3933 O HOH A1204 42.236 49.422 22.406 1.00 0.00 O 0 +HETATM 3934 H1 HOH A1204 42.382 50.366 22.125 1.00 0.00 H 0 +HETATM 3935 H2 HOH A1204 42.455 49.277 23.357 1.00 0.00 H 0 +HETATM 3936 O HOH A1205 45.462 37.950 47.015 1.00 0.00 O 0 +HETATM 3937 H1 HOH A1205 44.867 38.017 46.233 1.00 0.00 H 0 +HETATM 3938 H2 HOH A1205 45.005 38.507 47.698 1.00 0.00 H 0 +HETATM 3939 O HOH A1206 30.407 17.348 31.190 1.00 0.00 O 0 +HETATM 3940 H1 HOH A1206 31.319 17.707 31.213 1.00 0.00 H 0 +HETATM 3941 H2 HOH A1206 30.118 17.738 32.026 1.00 0.00 H 0 +HETATM 3942 O HOH A1207 12.024 10.762 22.486 1.00 0.00 O 0 +HETATM 3943 H1 HOH A1207 12.502 11.613 22.455 1.00 0.00 H 0 +HETATM 3944 H2 HOH A1207 12.629 10.100 22.097 1.00 0.00 H 0 +HETATM 3945 O HOH A1208 19.664 26.168 38.397 1.00 0.00 O 0 +HETATM 3946 H1 HOH A1208 19.121 26.759 38.953 1.00 0.00 H 0 +HETATM 3947 H2 HOH A1208 20.132 26.795 37.842 1.00 0.00 H 0 +HETATM 3948 O HOH A1209 31.338 44.486 6.794 1.00 0.00 O 0 +HETATM 3949 H1 HOH A1209 30.899 44.983 7.502 1.00 0.00 H 0 +HETATM 3950 H2 HOH A1209 31.697 45.228 6.251 1.00 0.00 H 0 +HETATM 3951 O HOH A1210 43.241 37.503 2.573 1.00 0.00 O 0 +HETATM 3952 H1 HOH A1210 43.901 37.123 1.985 1.00 0.00 H 0 +HETATM 3953 H2 HOH A1210 43.587 38.333 2.946 1.00 0.00 H 0 +HETATM 3954 O HOH A1211 16.402 47.327 45.722 1.00 0.00 O 0 +HETATM 3955 H1 HOH A1211 16.229 47.947 46.412 1.00 0.00 H 0 +HETATM 3956 H2 HOH A1211 17.091 47.760 45.163 1.00 0.00 H 0 +HETATM 3957 O HOH A1212 8.462 48.400 51.724 1.00 0.00 O 0 +HETATM 3958 H1 HOH A1212 8.869 48.816 50.986 1.00 0.00 H 0 +HETATM 3959 H2 HOH A1212 8.621 47.472 51.658 1.00 0.00 H 0 +HETATM 3960 O HOH A1213 46.671 23.151 23.335 1.00 0.00 O 0 +HETATM 3961 H1 HOH A1213 46.931 22.251 23.286 1.00 0.00 H 0 +HETATM 3962 H2 HOH A1213 46.194 23.365 22.573 1.00 0.00 H 0 +HETATM 3963 O HOH A1214 37.846 4.171 23.306 1.00 0.00 O 0 +HETATM 3964 H1 HOH A1214 38.539 4.781 22.775 1.00 0.00 H 0 +HETATM 3965 H2 HOH A1214 38.165 3.279 23.157 1.00 0.00 H 0 +HETATM 3966 O HOH A1215 53.369 29.027 27.077 1.00 0.00 O 0 +HETATM 3967 H1 HOH A1215 52.386 28.875 27.016 1.00 0.00 H 0 +HETATM 3968 H2 HOH A1215 53.441 29.962 27.218 1.00 0.00 H 0 +HETATM 3969 O HOH A1216 5.416 30.697 42.542 1.00 0.00 O 0 +HETATM 3970 H1 HOH A1216 4.614 31.221 42.387 1.00 0.00 H 0 +HETATM 3971 H2 HOH A1216 5.229 29.789 42.748 1.00 0.00 H 0 +HETATM 3972 O HOH A1217 43.990 37.071 11.207 1.00 0.00 O 0 +HETATM 3973 H1 HOH A1217 44.750 37.634 11.267 1.00 0.00 H 0 +HETATM 3974 H2 HOH A1217 43.493 37.282 10.444 1.00 0.00 H 0 +HETATM 3975 O HOH A1218 14.421 14.345 48.663 1.00 0.00 O 0 +HETATM 3976 H1 HOH A1218 15.115 13.647 48.795 1.00 0.00 H 0 +HETATM 3977 H2 HOH A1218 14.872 15.143 48.334 1.00 0.00 H 0 +HETATM 3978 O HOH A1219 5.974 50.639 44.432 1.00 0.00 O 0 +HETATM 3979 H1 HOH A1219 5.853 51.615 44.561 1.00 0.00 H 0 +HETATM 3980 H2 HOH A1219 5.655 50.251 45.261 1.00 0.00 H 0 +HETATM 3981 O HOH A1220 45.896 9.597 42.398 1.00 0.00 O 0 +HETATM 3982 H1 HOH A1220 45.078 9.462 41.959 1.00 0.00 H 0 +HETATM 3983 H2 HOH A1220 46.318 8.712 42.526 1.00 0.00 H 0 +HETATM 3984 O HOH A1221 5.840 7.099 15.919 1.00 0.00 O 0 +HETATM 3985 H1 HOH A1221 4.930 7.143 15.568 1.00 0.00 H 0 +HETATM 3986 H2 HOH A1221 6.364 7.964 15.846 1.00 0.00 H 0 +HETATM 3987 O HOH A1222 7.541 26.780 43.276 1.00 0.00 O 0 +HETATM 3988 H1 HOH A1222 7.963 27.614 43.509 1.00 0.00 H 0 +HETATM 3989 H2 HOH A1222 6.648 27.080 43.055 1.00 0.00 H 0 +HETATM 3990 O HOH A1223 37.699 51.416 11.270 1.00 0.00 O 0 +HETATM 3991 H1 HOH A1223 37.258 51.741 12.009 1.00 0.00 H 0 +HETATM 3992 H2 HOH A1223 37.868 52.239 10.752 1.00 0.00 H 0 +HETATM 3993 O HOH A1224 43.998 34.769 49.291 1.00 0.00 O 0 +HETATM 3994 H1 HOH A1224 44.136 34.222 50.121 1.00 0.00 H 0 +HETATM 3995 H2 HOH A1224 44.405 35.648 49.451 1.00 0.00 H 0 +HETATM 3996 O HOH A1225 34.087 19.064 43.810 1.00 0.00 O 0 +HETATM 3997 H1 HOH A1225 34.378 19.156 44.776 1.00 0.00 H 0 +HETATM 3998 H2 HOH A1225 34.695 18.458 43.366 1.00 0.00 H 0 +HETATM 3999 O HOH A1226 2.513 11.028 25.652 1.00 0.00 O 0 +HETATM 4000 H1 HOH A1226 2.762 11.849 25.130 1.00 0.00 H 0 +HETATM 4001 H2 HOH A1226 2.684 11.253 26.580 1.00 0.00 H 0 +HETATM 4002 O HOH A1227 50.408 46.515 7.458 1.00 0.00 O 0 +HETATM 4003 H1 HOH A1227 51.044 46.871 8.124 1.00 0.00 H 0 +HETATM 4004 H2 HOH A1227 50.893 46.512 6.572 1.00 0.00 H 0 +HETATM 4005 O HOH A1228 45.049 7.551 22.511 1.00 0.00 O 0 +HETATM 4006 H1 HOH A1228 44.341 7.419 23.086 1.00 0.00 H 0 +HETATM 4007 H2 HOH A1228 44.734 7.955 21.673 1.00 0.00 H 0 +HETATM 4008 O HOH A1229 12.731 20.159 41.499 1.00 0.00 O 0 +HETATM 4009 H1 HOH A1229 13.598 19.870 41.782 1.00 0.00 H 0 +HETATM 4010 H2 HOH A1229 12.259 20.346 42.384 1.00 0.00 H 0 +HETATM 4011 O HOH A1230 13.459 0.321 49.105 1.00 0.00 O 0 +HETATM 4012 H1 HOH A1230 13.320 -0.598 49.174 1.00 0.00 H 0 +HETATM 4013 H2 HOH A1230 13.083 0.660 48.333 1.00 0.00 H 0 +HETATM 4014 O HOH A1231 41.280 18.036 42.225 1.00 0.00 O 0 +HETATM 4015 H1 HOH A1231 40.500 18.565 42.052 1.00 0.00 H 0 +HETATM 4016 H2 HOH A1231 41.972 18.255 41.573 1.00 0.00 H 0 +HETATM 4017 O HOH A1232 29.436 16.744 0.046 1.00 0.00 O 0 +HETATM 4018 H1 HOH A1232 29.797 17.184 0.811 1.00 0.00 H 0 +HETATM 4019 H2 HOH A1232 28.915 17.367 -0.467 1.00 0.00 H 0 +HETATM 4020 O HOH A1233 40.136 35.789 8.028 1.00 0.00 O 0 +HETATM 4021 H1 HOH A1233 40.023 36.147 7.160 1.00 0.00 H 0 +HETATM 4022 H2 HOH A1233 40.797 36.339 8.535 1.00 0.00 H 0 +HETATM 4023 O HOH A1234 0.283 35.907 14.739 1.00 0.00 O 0 +HETATM 4024 H1 HOH A1234 0.530 35.853 15.639 1.00 0.00 H 0 +HETATM 4025 H2 HOH A1234 1.055 35.731 14.192 1.00 0.00 H 0 +HETATM 4026 O HOH A1235 45.862 17.088 37.559 1.00 0.00 O 0 +HETATM 4027 H1 HOH A1235 44.936 17.243 37.694 1.00 0.00 H 0 +HETATM 4028 H2 HOH A1235 45.858 16.459 36.842 1.00 0.00 H 0 +HETATM 4029 O HOH A1236 16.529 7.116 38.764 1.00 0.00 O 0 +HETATM 4030 H1 HOH A1236 16.586 6.171 38.553 1.00 0.00 H 0 +HETATM 4031 H2 HOH A1236 15.909 7.082 39.527 1.00 0.00 H 0 +HETATM 4032 O HOH A1237 12.774 52.571 38.187 1.00 0.00 O 0 +HETATM 4033 H1 HOH A1237 12.771 53.455 38.630 1.00 0.00 H 0 +HETATM 4034 H2 HOH A1237 12.322 51.914 38.754 1.00 0.00 H 0 +HETATM 4035 O HOH A1238 44.259 9.347 49.430 1.00 0.00 O 0 +HETATM 4036 H1 HOH A1238 44.871 9.587 50.206 1.00 0.00 H 0 +HETATM 4037 H2 HOH A1238 44.665 9.796 48.662 1.00 0.00 H 0 +HETATM 4038 O HOH A1239 20.186 32.432 38.920 1.00 0.00 O 0 +HETATM 4039 H1 HOH A1239 19.340 32.555 39.352 1.00 0.00 H 0 +HETATM 4040 H2 HOH A1239 19.949 31.985 38.073 1.00 0.00 H 0 +HETATM 4041 O HOH A1240 13.458 43.893 7.526 1.00 0.00 O 0 +HETATM 4042 H1 HOH A1240 13.747 44.707 7.922 1.00 0.00 H 0 +HETATM 4043 H2 HOH A1240 13.862 43.193 8.047 1.00 0.00 H 0 +HETATM 4044 O HOH A1241 40.637 30.278 28.893 1.00 0.00 O 0 +HETATM 4045 H1 HOH A1241 40.078 29.547 29.115 1.00 0.00 H 0 +HETATM 4046 H2 HOH A1241 41.151 30.354 29.708 1.00 0.00 H 0 +HETATM 4047 O HOH A1242 1.781 39.557 25.208 1.00 0.00 O 0 +HETATM 4048 H1 HOH A1242 1.552 39.148 24.374 1.00 0.00 H 0 +HETATM 4049 H2 HOH A1242 1.112 39.251 25.850 1.00 0.00 H 0 +HETATM 4050 O HOH A1243 22.064 40.707 48.186 1.00 0.00 O 0 +HETATM 4051 H1 HOH A1243 22.427 41.385 47.550 1.00 0.00 H 0 +HETATM 4052 H2 HOH A1243 22.889 40.265 48.315 1.00 0.00 H 0 +HETATM 4053 O HOH A1244 21.225 2.496 22.537 1.00 0.00 O 0 +HETATM 4054 H1 HOH A1244 21.338 1.692 21.938 1.00 0.00 H 0 +HETATM 4055 H2 HOH A1244 20.284 2.459 22.789 1.00 0.00 H 0 +HETATM 4056 O HOH A1245 29.636 5.104 5.734 1.00 0.00 O 0 +HETATM 4057 H1 HOH A1245 29.758 5.958 5.231 1.00 0.00 H 0 +HETATM 4058 H2 HOH A1245 28.958 4.653 5.233 1.00 0.00 H 0 +HETATM 4059 O HOH A1246 12.487 15.013 6.765 1.00 0.00 O 0 +HETATM 4060 H1 HOH A1246 12.497 14.093 6.782 1.00 0.00 H 0 +HETATM 4061 H2 HOH A1246 12.153 15.436 6.000 1.00 0.00 H 0 +HETATM 4062 O HOH A1247 31.297 19.790 40.122 1.00 0.00 O 0 +HETATM 4063 H1 HOH A1247 31.737 19.977 40.995 1.00 0.00 H 0 +HETATM 4064 H2 HOH A1247 31.899 19.399 39.505 1.00 0.00 H 0 +HETATM 4065 O HOH A1248 9.457 46.985 15.602 1.00 0.00 O 0 +HETATM 4066 H1 HOH A1248 10.155 46.665 16.177 1.00 0.00 H 0 +HETATM 4067 H2 HOH A1248 8.833 47.540 16.068 1.00 0.00 H 0 +HETATM 4068 O HOH A1249 30.938 20.378 18.115 1.00 0.00 O 0 +HETATM 4069 H1 HOH A1249 30.577 19.681 18.566 1.00 0.00 H 0 +HETATM 4070 H2 HOH A1249 30.635 21.192 18.604 1.00 0.00 H 0 +HETATM 4071 O HOH A1250 8.548 21.132 25.425 1.00 0.00 O 0 +HETATM 4072 H1 HOH A1250 8.466 20.674 24.631 1.00 0.00 H 0 +HETATM 4073 H2 HOH A1250 8.079 20.532 26.029 1.00 0.00 H 0 +HETATM 4074 O HOH A1251 9.195 9.221 50.717 1.00 0.00 O 0 +HETATM 4075 H1 HOH A1251 9.274 8.915 51.617 1.00 0.00 H 0 +HETATM 4076 H2 HOH A1251 8.700 10.112 50.685 1.00 0.00 H 0 +HETATM 4077 O HOH A1252 19.699 8.988 50.815 1.00 0.00 O 0 +HETATM 4078 H1 HOH A1252 20.053 9.872 50.670 1.00 0.00 H 0 +HETATM 4079 H2 HOH A1252 18.937 8.736 50.265 1.00 0.00 H 0 +HETATM 4080 O HOH A1253 37.992 7.947 52.307 1.00 0.00 O 0 +HETATM 4081 H1 HOH A1253 37.809 8.634 51.637 1.00 0.00 H 0 +HETATM 4082 H2 HOH A1253 38.826 7.598 52.023 1.00 0.00 H 0 +HETATM 4083 O HOH A1254 25.036 15.982 10.640 1.00 0.00 O 0 +HETATM 4084 H1 HOH A1254 25.288 16.951 10.464 1.00 0.00 H 0 +HETATM 4085 H2 HOH A1254 25.420 15.740 11.474 1.00 0.00 H 0 +HETATM 4086 O HOH A1255 16.386 52.803 14.373 1.00 0.00 O 0 +HETATM 4087 H1 HOH A1255 16.299 53.588 13.818 1.00 0.00 H 0 +HETATM 4088 H2 HOH A1255 15.442 52.536 14.628 1.00 0.00 H 0 +HETATM 4089 O HOH A1256 8.119 39.058 40.221 1.00 0.00 O 0 +HETATM 4090 H1 HOH A1256 7.343 38.452 40.177 1.00 0.00 H 0 +HETATM 4091 H2 HOH A1256 8.392 39.070 41.131 1.00 0.00 H 0 +HETATM 4092 O HOH A1257 46.275 3.161 10.752 1.00 0.00 O 0 +HETATM 4093 H1 HOH A1257 45.538 3.871 10.780 1.00 0.00 H 0 +HETATM 4094 H2 HOH A1257 46.387 3.006 9.811 1.00 0.00 H 0 +HETATM 4095 O HOH A1258 41.795 49.097 47.911 1.00 0.00 O 0 +HETATM 4096 H1 HOH A1258 40.916 49.150 48.290 1.00 0.00 H 0 +HETATM 4097 H2 HOH A1258 42.352 49.026 48.677 1.00 0.00 H 0 +HETATM 4098 O HOH A1259 21.616 4.190 15.942 1.00 0.00 O 0 +HETATM 4099 H1 HOH A1259 22.090 3.393 15.635 1.00 0.00 H 0 +HETATM 4100 H2 HOH A1259 20.864 4.009 15.387 1.00 0.00 H 0 +HETATM 4101 O HOH A1260 7.974 27.308 49.722 1.00 0.00 O 0 +HETATM 4102 H1 HOH A1260 7.898 27.766 50.592 1.00 0.00 H 0 +HETATM 4103 H2 HOH A1260 8.850 27.442 49.293 1.00 0.00 H 0 +HETATM 4104 O HOH A1261 48.086 9.462 7.697 1.00 0.00 O 0 +HETATM 4105 H1 HOH A1261 48.649 9.647 6.958 1.00 0.00 H 0 +HETATM 4106 H2 HOH A1261 48.706 9.590 8.391 1.00 0.00 H 0 +HETATM 4107 O HOH A1262 27.592 18.071 42.529 1.00 0.00 O 0 +HETATM 4108 H1 HOH A1262 27.211 17.176 42.806 1.00 0.00 H 0 +HETATM 4109 H2 HOH A1262 26.859 18.725 42.671 1.00 0.00 H 0 +HETATM 4110 O HOH A1263 11.966 53.155 4.877 1.00 0.00 O 0 +HETATM 4111 H1 HOH A1263 12.497 52.573 4.264 1.00 0.00 H 0 +HETATM 4112 H2 HOH A1263 12.237 52.946 5.767 1.00 0.00 H 0 +HETATM 4113 O HOH A1264 13.888 33.393 12.259 1.00 0.00 O 0 +HETATM 4114 H1 HOH A1264 13.872 32.801 13.011 1.00 0.00 H 0 +HETATM 4115 H2 HOH A1264 13.526 34.265 12.545 1.00 0.00 H 0 +HETATM 4116 O HOH A1265 48.288 32.295 37.416 1.00 0.00 O 0 +HETATM 4117 H1 HOH A1265 47.556 32.357 38.021 1.00 0.00 H 0 +HETATM 4118 H2 HOH A1265 48.674 31.442 37.563 1.00 0.00 H 0 +HETATM 4119 O HOH A1266 8.360 10.571 47.117 1.00 0.00 O 0 +HETATM 4120 H1 HOH A1266 7.913 10.105 47.854 1.00 0.00 H 0 +HETATM 4121 H2 HOH A1266 8.361 11.494 47.481 1.00 0.00 H 0 +HETATM 4122 O HOH A1267 22.641 37.815 53.473 1.00 0.00 O 0 +HETATM 4123 H1 HOH A1267 22.948 38.693 53.757 1.00 0.00 H 0 +HETATM 4124 H2 HOH A1267 22.752 37.635 52.510 1.00 0.00 H 0 +HETATM 4125 O HOH A1268 9.245 22.239 2.951 1.00 0.00 O 0 +HETATM 4126 H1 HOH A1268 9.730 22.484 2.127 1.00 0.00 H 0 +HETATM 4127 H2 HOH A1268 9.857 22.415 3.654 1.00 0.00 H 0 +HETATM 4128 O HOH A1269 27.912 14.600 23.665 1.00 0.00 O 0 +HETATM 4129 H1 HOH A1269 28.124 14.711 22.729 1.00 0.00 H 0 +HETATM 4130 H2 HOH A1269 27.235 13.947 23.706 1.00 0.00 H 0 +HETATM 4131 O HOH A1270 33.789 40.234 28.058 1.00 0.00 O 0 +HETATM 4132 H1 HOH A1270 33.587 40.813 28.857 1.00 0.00 H 0 +HETATM 4133 H2 HOH A1270 34.486 40.760 27.600 1.00 0.00 H 0 +HETATM 4134 O HOH A1271 52.774 4.850 17.444 1.00 0.00 O 0 +HETATM 4135 H1 HOH A1271 52.667 3.998 17.895 1.00 0.00 H 0 +HETATM 4136 H2 HOH A1271 51.910 5.293 17.537 1.00 0.00 H 0 +HETATM 4137 O HOH A1272 40.447 15.230 23.883 1.00 0.00 O 0 +HETATM 4138 H1 HOH A1272 39.619 15.732 23.824 1.00 0.00 H 0 +HETATM 4139 H2 HOH A1272 41.168 15.856 23.849 1.00 0.00 H 0 +HETATM 4140 O HOH A1273 6.767 1.128 32.817 1.00 0.00 O 0 +HETATM 4141 H1 HOH A1273 6.049 1.097 32.211 1.00 0.00 H 0 +HETATM 4142 H2 HOH A1273 7.197 1.981 32.686 1.00 0.00 H 0 +HETATM 4143 O HOH A1274 2.449 20.846 44.800 1.00 0.00 O 0 +HETATM 4144 H1 HOH A1274 2.672 20.667 43.900 1.00 0.00 H 0 +HETATM 4145 H2 HOH A1274 3.174 20.451 45.276 1.00 0.00 H 0 +HETATM 4146 O HOH A1275 49.986 52.574 31.056 1.00 0.00 O 0 +HETATM 4147 H1 HOH A1275 49.807 53.382 30.572 1.00 0.00 H 0 +HETATM 4148 H2 HOH A1275 50.818 52.870 31.484 1.00 0.00 H 0 +HETATM 4149 O HOH A1276 47.725 16.149 22.189 1.00 0.00 O 0 +HETATM 4150 H1 HOH A1276 47.826 15.297 21.796 1.00 0.00 H 0 +HETATM 4151 H2 HOH A1276 46.952 16.437 21.766 1.00 0.00 H 0 +HETATM 4152 O HOH A1277 50.764 38.303 27.682 1.00 0.00 O 0 +HETATM 4153 H1 HOH A1277 50.255 37.560 27.368 1.00 0.00 H 0 +HETATM 4154 H2 HOH A1277 50.630 38.344 28.616 1.00 0.00 H 0 +HETATM 4155 O HOH A1278 3.816 9.727 41.519 1.00 0.00 O 0 +HETATM 4156 H1 HOH A1278 4.255 10.528 41.196 1.00 0.00 H 0 +HETATM 4157 H2 HOH A1278 3.194 10.062 42.132 1.00 0.00 H 0 +HETATM 4158 O HOH A1279 44.504 28.314 30.573 1.00 0.00 O 0 +HETATM 4159 H1 HOH A1279 45.314 27.776 30.646 1.00 0.00 H 0 +HETATM 4160 H2 HOH A1279 43.679 28.011 31.099 1.00 0.00 H 0 +HETATM 4161 O HOH A1280 23.130 18.810 12.766 1.00 0.00 O 0 +HETATM 4162 H1 HOH A1280 22.326 18.660 13.313 1.00 0.00 H 0 +HETATM 4163 H2 HOH A1280 22.799 18.804 11.813 1.00 0.00 H 0 +HETATM 4164 O HOH A1281 27.734 24.576 12.652 1.00 0.00 O 0 +HETATM 4165 H1 HOH A1281 27.231 25.423 12.536 1.00 0.00 H 0 +HETATM 4166 H2 HOH A1281 28.109 24.444 11.785 1.00 0.00 H 0 +HETATM 4167 O HOH A1282 49.862 45.689 34.324 1.00 0.00 O 0 +HETATM 4168 H1 HOH A1282 50.478 46.025 33.628 1.00 0.00 H 0 +HETATM 4169 H2 HOH A1282 49.143 45.191 33.842 1.00 0.00 H 0 +HETATM 4170 O HOH A1283 9.240 14.468 39.413 1.00 0.00 O 0 +HETATM 4171 H1 HOH A1283 9.854 15.163 39.157 1.00 0.00 H 0 +HETATM 4172 H2 HOH A1283 9.481 14.287 40.280 1.00 0.00 H 0 +HETATM 4173 O HOH A1284 43.588 24.949 18.716 1.00 0.00 O 0 +HETATM 4174 H1 HOH A1284 43.186 24.084 18.779 1.00 0.00 H 0 +HETATM 4175 H2 HOH A1284 44.548 24.817 18.560 1.00 0.00 H 0 +HETATM 4176 O HOH A1285 28.811 50.895 26.451 1.00 0.00 O 0 +HETATM 4177 H1 HOH A1285 28.101 51.190 25.763 1.00 0.00 H 0 +HETATM 4178 H2 HOH A1285 29.602 51.377 26.259 1.00 0.00 H 0 +HETATM 4179 O HOH A1286 20.136 5.089 11.383 1.00 0.00 O 0 +HETATM 4180 H1 HOH A1286 20.737 5.550 10.742 1.00 0.00 H 0 +HETATM 4181 H2 HOH A1286 19.480 4.715 10.808 1.00 0.00 H 0 +HETATM 4182 O HOH A1287 1.121 45.442 50.605 1.00 0.00 O 0 +HETATM 4183 H1 HOH A1287 1.087 44.482 50.680 1.00 0.00 H 0 +HETATM 4184 H2 HOH A1287 2.072 45.615 50.324 1.00 0.00 H 0 +HETATM 4185 O HOH A1288 12.240 20.757 2.126 1.00 0.00 O 0 +HETATM 4186 H1 HOH A1288 11.753 21.481 1.746 1.00 0.00 H 0 +HETATM 4187 H2 HOH A1288 11.997 19.895 1.745 1.00 0.00 H 0 +HETATM 4188 O HOH A1289 18.327 2.732 4.172 1.00 0.00 O 0 +HETATM 4189 H1 HOH A1289 18.316 3.685 4.450 1.00 0.00 H 0 +HETATM 4190 H2 HOH A1289 17.502 2.386 3.900 1.00 0.00 H 0 +HETATM 4191 O HOH A1290 38.842 41.524 40.099 1.00 0.00 O 0 +HETATM 4192 H1 HOH A1290 39.215 41.181 40.953 1.00 0.00 H 0 +HETATM 4193 H2 HOH A1290 39.399 42.282 39.821 1.00 0.00 H 0 +HETATM 4194 O HOH A1291 44.714 15.676 9.448 1.00 0.00 O 0 +HETATM 4195 H1 HOH A1291 44.005 16.136 9.962 1.00 0.00 H 0 +HETATM 4196 H2 HOH A1291 44.289 15.211 8.714 1.00 0.00 H 0 +HETATM 4197 O HOH A1292 26.749 16.576 30.250 1.00 0.00 O 0 +HETATM 4198 H1 HOH A1292 26.786 16.394 31.191 1.00 0.00 H 0 +HETATM 4199 H2 HOH A1292 26.083 17.211 30.096 1.00 0.00 H 0 +HETATM 4200 O HOH A1293 39.311 20.964 46.690 1.00 0.00 O 0 +HETATM 4201 H1 HOH A1293 38.314 20.999 46.521 1.00 0.00 H 0 +HETATM 4202 H2 HOH A1293 39.688 20.893 45.825 1.00 0.00 H 0 +HETATM 4203 O HOH A1294 22.869 27.254 50.648 1.00 0.00 O 0 +HETATM 4204 H1 HOH A1294 23.501 27.681 51.183 1.00 0.00 H 0 +HETATM 4205 H2 HOH A1294 22.359 27.924 50.171 1.00 0.00 H 0 +HETATM 4206 O HOH A1295 51.613 10.873 45.138 1.00 0.00 O 0 +HETATM 4207 H1 HOH A1295 51.256 9.944 45.085 1.00 0.00 H 0 +HETATM 4208 H2 HOH A1295 51.308 11.331 45.998 1.00 0.00 H 0 +HETATM 4209 O HOH A1296 38.860 48.215 28.001 1.00 0.00 O 0 +HETATM 4210 H1 HOH A1296 38.605 48.405 28.930 1.00 0.00 H 0 +HETATM 4211 H2 HOH A1296 39.805 48.595 27.909 1.00 0.00 H 0 +HETATM 4212 O HOH A1297 6.879 28.701 36.762 1.00 0.00 O 0 +HETATM 4213 H1 HOH A1297 6.351 27.949 36.388 1.00 0.00 H 0 +HETATM 4214 H2 HOH A1297 6.783 28.670 37.723 1.00 0.00 H 0 +HETATM 4215 O HOH A1298 20.408 53.767 30.594 1.00 0.00 O 0 +HETATM 4216 H1 HOH A1298 20.348 54.026 31.518 1.00 0.00 H 0 +HETATM 4217 H2 HOH A1298 20.960 52.985 30.486 1.00 0.00 H 0 +HETATM 4218 O HOH A1299 32.709 11.160 50.395 1.00 0.00 O 0 +HETATM 4219 H1 HOH A1299 33.461 10.540 50.379 1.00 0.00 H 0 +HETATM 4220 H2 HOH A1299 32.397 11.286 49.579 1.00 0.00 H 0 +HETATM 4221 O HOH A1300 36.147 6.701 6.985 1.00 0.00 O 0 +HETATM 4222 H1 HOH A1300 36.890 6.930 6.458 1.00 0.00 H 0 +HETATM 4223 H2 HOH A1300 35.466 7.063 6.428 1.00 0.00 H 0 +HETATM 4224 O HOH A1301 46.823 46.578 43.687 1.00 0.00 O 0 +HETATM 4225 H1 HOH A1301 46.650 45.683 44.056 1.00 0.00 H 0 +HETATM 4226 H2 HOH A1301 47.180 47.105 44.383 1.00 0.00 H 0 +HETATM 4227 O HOH A1302 47.811 22.849 29.540 1.00 0.00 O 0 +HETATM 4228 H1 HOH A1302 47.282 23.541 29.904 1.00 0.00 H 0 +HETATM 4229 H2 HOH A1302 47.259 22.063 29.484 1.00 0.00 H 0 +HETATM 4230 O HOH A1303 38.031 41.040 4.600 1.00 0.00 O 0 +HETATM 4231 H1 HOH A1303 38.816 40.489 4.456 1.00 0.00 H 0 +HETATM 4232 H2 HOH A1303 37.426 40.579 5.082 1.00 0.00 H 0 +HETATM 4233 O HOH A1304 30.934 8.992 35.324 1.00 0.00 O 0 +HETATM 4234 H1 HOH A1304 30.074 8.976 35.775 1.00 0.00 H 0 +HETATM 4235 H2 HOH A1304 30.869 8.250 34.675 1.00 0.00 H 0 +HETATM 4236 O HOH A1305 23.435 48.810 15.193 1.00 0.00 O 0 +HETATM 4237 H1 HOH A1305 23.275 49.285 16.006 1.00 0.00 H 0 +HETATM 4238 H2 HOH A1305 24.397 48.758 15.075 1.00 0.00 H 0 +HETATM 4239 O HOH A1306 22.182 46.123 20.987 1.00 0.00 O 0 +HETATM 4240 H1 HOH A1306 21.279 45.946 20.801 1.00 0.00 H 0 +HETATM 4241 H2 HOH A1306 22.566 45.431 21.485 1.00 0.00 H 0 +HETATM 4242 O HOH A1307 30.441 19.842 15.174 1.00 0.00 O 0 +HETATM 4243 H1 HOH A1307 30.829 20.008 16.048 1.00 0.00 H 0 +HETATM 4244 H2 HOH A1307 29.439 19.636 15.348 1.00 0.00 H 0 +HETATM 4245 O HOH A1308 45.251 31.404 16.613 1.00 0.00 O 0 +HETATM 4246 H1 HOH A1308 45.028 31.243 17.527 1.00 0.00 H 0 +HETATM 4247 H2 HOH A1308 45.261 30.570 16.130 1.00 0.00 H 0 +HETATM 4248 O HOH A1309 53.037 33.892 48.444 1.00 0.00 O 0 +HETATM 4249 H1 HOH A1309 53.739 34.427 48.774 1.00 0.00 H 0 +HETATM 4250 H2 HOH A1309 53.303 33.753 47.502 1.00 0.00 H 0 +HETATM 4251 O HOH A1310 3.229 29.578 53.241 1.00 0.00 O 0 +HETATM 4252 H1 HOH A1310 2.879 30.508 53.075 1.00 0.00 H 0 +HETATM 4253 H2 HOH A1310 3.919 29.385 52.584 1.00 0.00 H 0 +HETATM 4254 O HOH A1311 24.521 48.803 23.448 1.00 0.00 O 0 +HETATM 4255 H1 HOH A1311 23.947 48.986 22.709 1.00 0.00 H 0 +HETATM 4256 H2 HOH A1311 24.503 47.839 23.809 1.00 0.00 H 0 +HETATM 4257 O HOH A1312 24.740 23.166 16.343 1.00 0.00 O 0 +HETATM 4258 H1 HOH A1312 24.093 23.833 16.474 1.00 0.00 H 0 +HETATM 4259 H2 HOH A1312 24.819 22.969 15.380 1.00 0.00 H 0 +HETATM 4260 O HOH A1313 9.626 31.509 21.948 1.00 0.00 O 0 +HETATM 4261 H1 HOH A1313 9.385 31.807 22.834 1.00 0.00 H 0 +HETATM 4262 H2 HOH A1313 10.479 31.084 22.145 1.00 0.00 H 0 +HETATM 4263 O HOH A1314 50.785 21.697 12.756 1.00 0.00 O 0 +HETATM 4264 H1 HOH A1314 50.599 22.368 12.051 1.00 0.00 H 0 +HETATM 4265 H2 HOH A1314 51.159 20.970 12.364 1.00 0.00 H 0 +HETATM 4266 O HOH A1315 45.057 49.475 15.219 1.00 0.00 O 0 +HETATM 4267 H1 HOH A1315 45.571 50.238 15.095 1.00 0.00 H 0 +HETATM 4268 H2 HOH A1315 44.257 49.343 14.747 1.00 0.00 H 0 +HETATM 4269 O HOH A1316 23.368 50.715 10.672 1.00 0.00 O 0 +HETATM 4270 H1 HOH A1316 24.202 50.903 10.212 1.00 0.00 H 0 +HETATM 4271 H2 HOH A1316 22.775 51.311 10.208 1.00 0.00 H 0 +HETATM 4272 O HOH A1317 13.269 16.493 11.542 1.00 0.00 O 0 +HETATM 4273 H1 HOH A1317 14.211 16.481 11.773 1.00 0.00 H 0 +HETATM 4274 H2 HOH A1317 13.309 17.264 10.951 1.00 0.00 H 0 +HETATM 4275 O HOH A1318 33.826 21.916 40.194 1.00 0.00 O 0 +HETATM 4276 H1 HOH A1318 33.178 21.635 40.853 1.00 0.00 H 0 +HETATM 4277 H2 HOH A1318 34.594 21.361 40.210 1.00 0.00 H 0 +HETATM 4278 O HOH A1319 13.832 41.585 29.380 1.00 0.00 O 0 +HETATM 4279 H1 HOH A1319 14.315 42.373 29.021 1.00 0.00 H 0 +HETATM 4280 H2 HOH A1319 13.521 41.913 30.238 1.00 0.00 H 0 +HETATM 4281 O HOH A1320 17.835 47.141 6.155 1.00 0.00 O 0 +HETATM 4282 H1 HOH A1320 18.635 47.063 5.620 1.00 0.00 H 0 +HETATM 4283 H2 HOH A1320 17.883 46.321 6.685 1.00 0.00 H 0 +HETATM 4284 O HOH A1321 48.594 12.842 11.050 1.00 0.00 O 0 +HETATM 4285 H1 HOH A1321 48.527 13.590 10.463 1.00 0.00 H 0 +HETATM 4286 H2 HOH A1321 49.332 13.082 11.587 1.00 0.00 H 0 +HETATM 4287 O HOH A1322 45.665 6.953 51.678 1.00 0.00 O 0 +HETATM 4288 H1 HOH A1322 46.361 7.586 51.292 1.00 0.00 H 0 +HETATM 4289 H2 HOH A1322 46.111 6.135 51.897 1.00 0.00 H 0 +HETATM 4290 O HOH A1323 9.513 41.087 19.236 1.00 0.00 O 0 +HETATM 4291 H1 HOH A1323 9.395 40.608 18.420 1.00 0.00 H 0 +HETATM 4292 H2 HOH A1323 8.685 41.559 19.338 1.00 0.00 H 0 +HETATM 4293 O HOH A1324 43.149 7.157 24.324 1.00 0.00 O 0 +HETATM 4294 H1 HOH A1324 42.268 6.881 24.016 1.00 0.00 H 0 +HETATM 4295 H2 HOH A1324 43.420 6.441 24.953 1.00 0.00 H 0 +HETATM 4296 O HOH A1325 43.887 22.414 3.452 1.00 0.00 O 0 +HETATM 4297 H1 HOH A1325 44.104 22.794 2.564 1.00 0.00 H 0 +HETATM 4298 H2 HOH A1325 44.783 22.142 3.684 1.00 0.00 H 0 +HETATM 4299 O HOH A1326 32.512 32.831 41.039 1.00 0.00 O 0 +HETATM 4300 H1 HOH A1326 32.419 32.087 41.641 1.00 0.00 H 0 +HETATM 4301 H2 HOH A1326 32.155 33.550 41.545 1.00 0.00 H 0 +HETATM 4302 O HOH A1327 3.803 26.494 51.087 1.00 0.00 O 0 +HETATM 4303 H1 HOH A1327 3.781 26.109 51.938 1.00 0.00 H 0 +HETATM 4304 H2 HOH A1327 4.208 27.431 51.172 1.00 0.00 H 0 +HETATM 4305 O HOH A1328 46.535 49.390 0.937 1.00 0.00 O 0 +HETATM 4306 H1 HOH A1328 45.569 49.510 0.796 1.00 0.00 H 0 +HETATM 4307 H2 HOH A1328 46.803 49.584 1.813 1.00 0.00 H 0 +HETATM 4308 O HOH A1329 44.504 21.577 7.303 1.00 0.00 O 0 +HETATM 4309 H1 HOH A1329 44.982 22.271 7.802 1.00 0.00 H 0 +HETATM 4310 H2 HOH A1329 45.034 21.474 6.481 1.00 0.00 H 0 +HETATM 4311 O HOH A1330 37.923 3.792 35.576 1.00 0.00 O 0 +HETATM 4312 H1 HOH A1330 37.121 3.420 35.057 1.00 0.00 H 0 +HETATM 4313 H2 HOH A1330 38.583 3.744 34.894 1.00 0.00 H 0 +HETATM 4314 O HOH A1331 16.299 1.574 17.573 1.00 0.00 O 0 +HETATM 4315 H1 HOH A1331 16.334 2.028 18.426 1.00 0.00 H 0 +HETATM 4316 H2 HOH A1331 16.732 0.744 17.548 1.00 0.00 H 0 +HETATM 4317 O HOH A1332 19.515 45.350 13.966 1.00 0.00 O 0 +HETATM 4318 H1 HOH A1332 19.641 44.500 14.402 1.00 0.00 H 0 +HETATM 4319 H2 HOH A1332 20.002 45.982 14.458 1.00 0.00 H 0 +HETATM 4320 O HOH A1333 50.556 46.887 45.574 1.00 0.00 O 0 +HETATM 4321 H1 HOH A1333 50.956 47.217 44.772 1.00 0.00 H 0 +HETATM 4322 H2 HOH A1333 49.675 47.247 45.690 1.00 0.00 H 0 +HETATM 4323 O HOH A1334 50.906 21.422 8.405 1.00 0.00 O 0 +HETATM 4324 H1 HOH A1334 51.676 21.823 7.884 1.00 0.00 H 0 +HETATM 4325 H2 HOH A1334 50.198 22.055 8.423 1.00 0.00 H 0 +HETATM 4326 O HOH A1335 5.586 13.308 35.207 1.00 0.00 O 0 +HETATM 4327 H1 HOH A1335 6.519 13.248 35.504 1.00 0.00 H 0 +HETATM 4328 H2 HOH A1335 5.548 13.884 34.415 1.00 0.00 H 0 +HETATM 4329 O HOH A1336 26.365 12.504 22.505 1.00 0.00 O 0 +HETATM 4330 H1 HOH A1336 25.969 13.271 22.143 1.00 0.00 H 0 +HETATM 4331 H2 HOH A1336 25.950 11.773 22.099 1.00 0.00 H 0 +HETATM 4332 O HOH A1337 24.600 40.561 24.832 1.00 0.00 O 0 +HETATM 4333 H1 HOH A1337 24.301 39.843 24.280 1.00 0.00 H 0 +HETATM 4334 H2 HOH A1337 24.046 40.427 25.659 1.00 0.00 H 0 +HETATM 4335 O HOH A1338 4.785 29.101 33.267 1.00 0.00 O 0 +HETATM 4336 H1 HOH A1338 4.807 28.087 33.152 1.00 0.00 H 0 +HETATM 4337 H2 HOH A1338 5.488 29.316 33.920 1.00 0.00 H 0 +HETATM 4338 O HOH A1339 15.390 34.525 9.204 1.00 0.00 O 0 +HETATM 4339 H1 HOH A1339 15.735 34.291 10.127 1.00 0.00 H 0 +HETATM 4340 H2 HOH A1339 14.430 34.637 9.256 1.00 0.00 H 0 +HETATM 4341 O HOH A1340 2.094 8.300 7.500 1.00 0.00 O 0 +HETATM 4342 H1 HOH A1340 1.198 8.107 7.891 1.00 0.00 H 0 +HETATM 4343 H2 HOH A1340 1.943 8.400 6.550 1.00 0.00 H 0 +HETATM 4344 O HOH A1341 47.714 3.492 47.214 1.00 0.00 O 0 +HETATM 4345 H1 HOH A1341 46.963 3.492 47.779 1.00 0.00 H 0 +HETATM 4346 H2 HOH A1341 48.165 4.328 47.297 1.00 0.00 H 0 +HETATM 4347 O HOH A1342 27.272 19.945 1.264 1.00 0.00 O 0 +HETATM 4348 H1 HOH A1342 27.113 20.870 1.489 1.00 0.00 H 0 +HETATM 4349 H2 HOH A1342 26.590 19.757 0.672 1.00 0.00 H 0 +HETATM 4350 O HOH A1343 43.233 46.192 30.064 1.00 0.00 O 0 +HETATM 4351 H1 HOH A1343 44.147 46.640 30.016 1.00 0.00 H 0 +HETATM 4352 H2 HOH A1343 42.967 45.864 29.177 1.00 0.00 H 0 +HETATM 4353 O HOH A1344 41.716 12.011 40.848 1.00 0.00 O 0 +HETATM 4354 H1 HOH A1344 40.968 12.283 41.432 1.00 0.00 H 0 +HETATM 4355 H2 HOH A1344 42.155 11.266 41.239 1.00 0.00 H 0 +HETATM 4356 O HOH A1345 25.414 48.182 18.608 1.00 0.00 O 0 +HETATM 4357 H1 HOH A1345 25.108 47.219 18.415 1.00 0.00 H 0 +HETATM 4358 H2 HOH A1345 25.266 48.380 19.541 1.00 0.00 H 0 +HETATM 4359 O HOH A1346 39.649 44.059 40.629 1.00 0.00 O 0 +HETATM 4360 H1 HOH A1346 40.067 43.748 41.465 1.00 0.00 H 0 +HETATM 4361 H2 HOH A1346 39.023 44.754 40.973 1.00 0.00 H 0 +HETATM 4362 O HOH A1347 15.696 22.562 45.639 1.00 0.00 O 0 +HETATM 4363 H1 HOH A1347 15.829 23.476 45.824 1.00 0.00 H 0 +HETATM 4364 H2 HOH A1347 15.111 22.616 44.846 1.00 0.00 H 0 +HETATM 4365 O HOH A1348 22.928 22.838 19.397 1.00 0.00 O 0 +HETATM 4366 H1 HOH A1348 21.996 22.844 19.120 1.00 0.00 H 0 +HETATM 4367 H2 HOH A1348 23.322 23.402 18.725 1.00 0.00 H 0 +HETATM 4368 O HOH A1349 44.806 29.372 25.772 1.00 0.00 O 0 +HETATM 4369 H1 HOH A1349 45.258 29.035 25.019 1.00 0.00 H 0 +HETATM 4370 H2 HOH A1349 43.939 29.594 25.524 1.00 0.00 H 0 +HETATM 4371 O HOH A1350 12.676 30.624 30.248 1.00 0.00 O 0 +HETATM 4372 H1 HOH A1350 11.717 30.760 30.259 1.00 0.00 H 0 +HETATM 4373 H2 HOH A1350 13.151 31.399 29.783 1.00 0.00 H 0 +HETATM 4374 O HOH A1351 9.827 17.438 44.243 1.00 0.00 O 0 +HETATM 4375 H1 HOH A1351 10.497 17.799 44.815 1.00 0.00 H 0 +HETATM 4376 H2 HOH A1351 10.160 16.582 43.893 1.00 0.00 H 0 +HETATM 4377 O HOH A1352 16.577 48.713 17.038 1.00 0.00 O 0 +HETATM 4378 H1 HOH A1352 15.759 48.592 17.474 1.00 0.00 H 0 +HETATM 4379 H2 HOH A1352 16.255 48.946 16.134 1.00 0.00 H 0 +HETATM 4380 O HOH A1353 8.641 7.577 1.614 1.00 0.00 O 0 +HETATM 4381 H1 HOH A1353 8.030 8.297 1.447 1.00 0.00 H 0 +HETATM 4382 H2 HOH A1353 8.895 7.630 2.579 1.00 0.00 H 0 +HETATM 4383 O HOH A1354 9.730 43.828 48.780 1.00 0.00 O 0 +HETATM 4384 H1 HOH A1354 10.721 43.684 48.958 1.00 0.00 H 0 +HETATM 4385 H2 HOH A1354 9.667 44.452 48.022 1.00 0.00 H 0 +HETATM 4386 O HOH A1355 8.195 15.366 34.477 1.00 0.00 O 0 +HETATM 4387 H1 HOH A1355 8.383 14.422 34.658 1.00 0.00 H 0 +HETATM 4388 H2 HOH A1355 8.728 15.648 33.757 1.00 0.00 H 0 +HETATM 4389 O HOH A1356 3.269 41.794 37.678 1.00 0.00 O 0 +HETATM 4390 H1 HOH A1356 3.478 41.844 36.662 1.00 0.00 H 0 +HETATM 4391 H2 HOH A1356 2.770 42.573 37.989 1.00 0.00 H 0 +HETATM 4392 O HOH A1357 43.634 26.052 7.033 1.00 0.00 O 0 +HETATM 4393 H1 HOH A1357 43.186 26.638 6.451 1.00 0.00 H 0 +HETATM 4394 H2 HOH A1357 44.522 25.956 6.689 1.00 0.00 H 0 +HETATM 4395 O HOH A1358 5.875 30.364 45.716 1.00 0.00 O 0 +HETATM 4396 H1 HOH A1358 6.044 30.591 44.860 1.00 0.00 H 0 +HETATM 4397 H2 HOH A1358 5.091 29.766 45.807 1.00 0.00 H 0 +HETATM 4398 O HOH A1359 18.775 18.534 4.254 1.00 0.00 O 0 +HETATM 4399 H1 HOH A1359 18.184 17.997 4.839 1.00 0.00 H 0 +HETATM 4400 H2 HOH A1359 18.716 18.126 3.434 1.00 0.00 H 0 +HETATM 4401 O HOH A1360 21.129 44.229 19.374 1.00 0.00 O 0 +HETATM 4402 H1 HOH A1360 21.129 44.779 18.641 1.00 0.00 H 0 +HETATM 4403 H2 HOH A1360 21.911 43.727 19.154 1.00 0.00 H 0 +HETATM 4404 O HOH A1361 16.665 33.261 13.590 1.00 0.00 O 0 +HETATM 4405 H1 HOH A1361 17.132 32.455 13.363 1.00 0.00 H 0 +HETATM 4406 H2 HOH A1361 15.844 33.052 13.979 1.00 0.00 H 0 +HETATM 4407 O HOH A1362 33.256 1.403 51.614 1.00 0.00 O 0 +HETATM 4408 H1 HOH A1362 32.396 1.095 51.822 1.00 0.00 H 0 +HETATM 4409 H2 HOH A1362 33.762 1.568 52.416 1.00 0.00 H 0 +HETATM 4410 O HOH A1363 5.791 23.728 35.127 1.00 0.00 O 0 +HETATM 4411 H1 HOH A1363 5.496 23.877 36.015 1.00 0.00 H 0 +HETATM 4412 H2 HOH A1363 6.531 24.315 35.098 1.00 0.00 H 0 +HETATM 4413 O HOH A1364 1.703 35.664 10.659 1.00 0.00 O 0 +HETATM 4414 H1 HOH A1364 1.141 35.006 11.033 1.00 0.00 H 0 +HETATM 4415 H2 HOH A1364 2.580 35.520 10.992 1.00 0.00 H 0 +HETATM 4416 O HOH A1365 0.360 26.333 38.423 1.00 0.00 O 0 +HETATM 4417 H1 HOH A1365 -0.142 25.963 39.104 1.00 0.00 H 0 +HETATM 4418 H2 HOH A1365 0.946 25.572 38.208 1.00 0.00 H 0 +HETATM 4419 O HOH A1366 45.242 51.617 49.599 1.00 0.00 O 0 +HETATM 4420 H1 HOH A1366 45.681 52.206 50.265 1.00 0.00 H 0 +HETATM 4421 H2 HOH A1366 44.360 51.907 49.434 1.00 0.00 H 0 +HETATM 4422 O HOH A1367 3.312 38.121 20.407 1.00 0.00 O 0 +HETATM 4423 H1 HOH A1367 3.674 37.345 20.800 1.00 0.00 H 0 +HETATM 4424 H2 HOH A1367 3.286 37.855 19.461 1.00 0.00 H 0 +HETATM 4425 O HOH A1368 26.776 40.360 4.029 1.00 0.00 O 0 +HETATM 4426 H1 HOH A1368 27.730 40.535 4.061 1.00 0.00 H 0 +HETATM 4427 H2 HOH A1368 26.690 39.434 4.169 1.00 0.00 H 0 +HETATM 4428 O HOH A1369 53.519 28.627 36.761 1.00 0.00 O 0 +HETATM 4429 H1 HOH A1369 53.764 27.819 37.307 1.00 0.00 H 0 +HETATM 4430 H2 HOH A1369 53.738 28.326 35.849 1.00 0.00 H 0 +HETATM 4431 O HOH A1370 19.378 31.716 50.067 1.00 0.00 O 0 +HETATM 4432 H1 HOH A1370 19.231 32.609 49.710 1.00 0.00 H 0 +HETATM 4433 H2 HOH A1370 20.298 31.530 49.974 1.00 0.00 H 0 +HETATM 4434 O HOH A1371 42.034 45.947 27.623 1.00 0.00 O 0 +HETATM 4435 H1 HOH A1371 41.387 45.190 27.794 1.00 0.00 H 0 +HETATM 4436 H2 HOH A1371 42.722 45.550 27.096 1.00 0.00 H 0 +HETATM 4437 O HOH A1372 30.433 12.581 6.172 1.00 0.00 O 0 +HETATM 4438 H1 HOH A1372 31.263 12.208 6.414 1.00 0.00 H 0 +HETATM 4439 H2 HOH A1372 30.675 13.064 5.384 1.00 0.00 H 0 +HETATM 4440 O HOH A1373 1.110 25.297 23.467 1.00 0.00 O 0 +HETATM 4441 H1 HOH A1373 1.667 24.633 23.789 1.00 0.00 H 0 +HETATM 4442 H2 HOH A1373 0.687 25.767 24.192 1.00 0.00 H 0 +HETATM 4443 O HOH A1374 45.070 37.612 15.764 1.00 0.00 O 0 +HETATM 4444 H1 HOH A1374 44.067 37.740 15.712 1.00 0.00 H 0 +HETATM 4445 H2 HOH A1374 45.184 36.966 16.548 1.00 0.00 H 0 +HETATM 4446 O HOH A1375 17.387 53.009 27.555 1.00 0.00 O 0 +HETATM 4447 H1 HOH A1375 16.549 53.450 27.600 1.00 0.00 H 0 +HETATM 4448 H2 HOH A1375 17.926 53.500 26.925 1.00 0.00 H 0 +HETATM 4449 O HOH A1376 25.640 0.138 50.777 1.00 0.00 O 0 +HETATM 4450 H1 HOH A1376 25.900 0.516 51.634 1.00 0.00 H 0 +HETATM 4451 H2 HOH A1376 24.663 0.013 50.845 1.00 0.00 H 0 +HETATM 4452 O HOH A1377 44.358 22.566 47.151 1.00 0.00 O 0 +HETATM 4453 H1 HOH A1377 44.270 22.171 48.008 1.00 0.00 H 0 +HETATM 4454 H2 HOH A1377 43.801 23.304 47.311 1.00 0.00 H 0 +HETATM 4455 O HOH A1378 28.810 28.309 13.170 1.00 0.00 O 0 +HETATM 4456 H1 HOH A1378 29.022 27.834 12.334 1.00 0.00 H 0 +HETATM 4457 H2 HOH A1378 29.666 28.713 13.426 1.00 0.00 H 0 +HETATM 4458 O HOH A1379 12.528 27.630 14.299 1.00 0.00 O 0 +HETATM 4459 H1 HOH A1379 13.110 27.743 13.560 1.00 0.00 H 0 +HETATM 4460 H2 HOH A1379 11.705 28.122 14.106 1.00 0.00 H 0 +HETATM 4461 O HOH A1380 16.263 49.129 30.672 1.00 0.00 O 0 +HETATM 4462 H1 HOH A1380 15.325 48.946 30.931 1.00 0.00 H 0 +HETATM 4463 H2 HOH A1380 16.122 50.127 30.647 1.00 0.00 H 0 +HETATM 4464 O HOH A1381 44.712 33.032 51.727 1.00 0.00 O 0 +HETATM 4465 H1 HOH A1381 45.600 32.737 51.429 1.00 0.00 H 0 +HETATM 4466 H2 HOH A1381 44.780 33.578 52.605 1.00 0.00 H 0 +HETATM 4467 O HOH A1382 40.884 47.729 30.460 1.00 0.00 O 0 +HETATM 4468 H1 HOH A1382 41.712 47.189 30.391 1.00 0.00 H 0 +HETATM 4469 H2 HOH A1382 40.324 47.152 30.952 1.00 0.00 H 0 +HETATM 4470 O HOH A1383 50.604 19.469 47.691 1.00 0.00 O 0 +HETATM 4471 H1 HOH A1383 49.682 19.785 47.819 1.00 0.00 H 0 +HETATM 4472 H2 HOH A1383 50.901 19.872 46.834 1.00 0.00 H 0 +HETATM 4473 O HOH A1384 51.478 12.848 47.284 1.00 0.00 O 0 +HETATM 4474 H1 HOH A1384 50.847 13.526 47.587 1.00 0.00 H 0 +HETATM 4475 H2 HOH A1384 52.125 12.732 47.976 1.00 0.00 H 0 +HETATM 4476 O HOH A1385 52.655 50.133 4.845 1.00 0.00 O 0 +HETATM 4477 H1 HOH A1385 52.797 49.174 4.558 1.00 0.00 H 0 +HETATM 4478 H2 HOH A1385 53.413 50.654 4.650 1.00 0.00 H 0 +HETATM 4479 O HOH A1386 36.390 53.540 47.854 1.00 0.00 O 0 +HETATM 4480 H1 HOH A1386 37.115 53.672 47.194 1.00 0.00 H 0 +HETATM 4481 H2 HOH A1386 36.850 53.097 48.643 1.00 0.00 H 0 +HETATM 4482 O HOH A1387 31.304 0.666 11.428 1.00 0.00 O 0 +HETATM 4483 H1 HOH A1387 31.499 0.377 12.336 1.00 0.00 H 0 +HETATM 4484 H2 HOH A1387 32.204 0.917 11.108 1.00 0.00 H 0 +HETATM 4485 O HOH A1388 34.811 53.138 16.519 1.00 0.00 O 0 +HETATM 4486 H1 HOH A1388 34.814 52.486 15.808 1.00 0.00 H 0 +HETATM 4487 H2 HOH A1388 35.580 52.869 17.018 1.00 0.00 H 0 +HETATM 4488 O HOH A1389 39.124 39.308 50.170 1.00 0.00 O 0 +HETATM 4489 H1 HOH A1389 39.215 39.082 51.090 1.00 0.00 H 0 +HETATM 4490 H2 HOH A1389 38.743 40.182 50.185 1.00 0.00 H 0 +HETATM 4491 O HOH A1390 -0.211 21.006 46.167 1.00 0.00 O 0 +HETATM 4492 H1 HOH A1390 -0.016 20.426 46.954 1.00 0.00 H 0 +HETATM 4493 H2 HOH A1390 0.640 20.991 45.676 1.00 0.00 H 0 +HETATM 4494 O HOH A1391 12.732 49.016 38.611 1.00 0.00 O 0 +HETATM 4495 H1 HOH A1391 12.265 49.867 38.842 1.00 0.00 H 0 +HETATM 4496 H2 HOH A1391 12.333 48.357 39.236 1.00 0.00 H 0 +HETATM 4497 O HOH A1392 2.195 2.078 17.004 1.00 0.00 O 0 +HETATM 4498 H1 HOH A1392 2.278 3.026 17.036 1.00 0.00 H 0 +HETATM 4499 H2 HOH A1392 2.319 1.908 16.057 1.00 0.00 H 0 +HETATM 4500 O HOH A1393 2.510 23.109 24.375 1.00 0.00 O 0 +HETATM 4501 H1 HOH A1393 3.352 22.729 24.655 1.00 0.00 H 0 +HETATM 4502 H2 HOH A1393 1.894 22.370 24.609 1.00 0.00 H 0 +HETATM 4503 O HOH A1394 12.053 1.003 36.538 1.00 0.00 O 0 +HETATM 4504 H1 HOH A1394 12.327 1.347 37.400 1.00 0.00 H 0 +HETATM 4505 H2 HOH A1394 11.987 1.772 35.924 1.00 0.00 H 0 +HETATM 4506 O HOH A1395 20.023 46.365 4.277 1.00 0.00 O 0 +HETATM 4507 H1 HOH A1395 20.070 45.412 4.097 1.00 0.00 H 0 +HETATM 4508 H2 HOH A1395 20.963 46.615 4.154 1.00 0.00 H 0 +HETATM 4509 O HOH A1396 37.329 27.120 4.003 1.00 0.00 O 0 +HETATM 4510 H1 HOH A1396 36.618 27.581 4.524 1.00 0.00 H 0 +HETATM 4511 H2 HOH A1396 36.759 26.456 3.526 1.00 0.00 H 0 +HETATM 4512 O HOH A1397 29.307 3.043 33.968 1.00 0.00 O 0 +HETATM 4513 H1 HOH A1397 30.226 3.287 34.091 1.00 0.00 H 0 +HETATM 4514 H2 HOH A1397 28.683 3.690 34.214 1.00 0.00 H 0 +HETATM 4515 O HOH A1398 13.539 46.798 49.518 1.00 0.00 O 0 +HETATM 4516 H1 HOH A1398 13.288 46.767 50.449 1.00 0.00 H 0 +HETATM 4517 H2 HOH A1398 13.432 45.924 49.256 1.00 0.00 H 0 +HETATM 4518 O HOH A1399 45.285 4.242 33.920 1.00 0.00 O 0 +HETATM 4519 H1 HOH A1399 44.802 4.985 33.590 1.00 0.00 H 0 +HETATM 4520 H2 HOH A1399 45.673 3.821 33.158 1.00 0.00 H 0 +HETATM 4521 O HOH A1400 45.523 48.683 35.798 1.00 0.00 O 0 +HETATM 4522 H1 HOH A1400 44.920 48.992 36.534 1.00 0.00 H 0 +HETATM 4523 H2 HOH A1400 46.111 49.392 35.517 1.00 0.00 H 0 +HETATM 4524 O HOH A1401 18.938 16.758 47.958 1.00 0.00 O 0 +HETATM 4525 H1 HOH A1401 18.934 16.621 48.893 1.00 0.00 H 0 +HETATM 4526 H2 HOH A1401 19.189 15.855 47.668 1.00 0.00 H 0 +HETATM 4527 O HOH A1402 21.632 12.004 29.341 1.00 0.00 O 0 +HETATM 4528 H1 HOH A1402 21.736 11.761 30.276 1.00 0.00 H 0 +HETATM 4529 H2 HOH A1402 22.179 11.378 28.892 1.00 0.00 H 0 +HETATM 4530 O HOH A1403 46.221 32.141 39.453 1.00 0.00 O 0 +HETATM 4531 H1 HOH A1403 46.782 32.070 40.278 1.00 0.00 H 0 +HETATM 4532 H2 HOH A1403 45.601 32.839 39.698 1.00 0.00 H 0 +HETATM 4533 O HOH A1404 10.704 44.218 52.336 1.00 0.00 O 0 +HETATM 4534 H1 HOH A1404 11.156 43.748 51.640 1.00 0.00 H 0 +HETATM 4535 H2 HOH A1404 10.651 43.596 53.093 1.00 0.00 H 0 +HETATM 4536 O HOH A1405 52.155 36.597 6.265 1.00 0.00 O 0 +HETATM 4537 H1 HOH A1405 51.427 37.177 6.223 1.00 0.00 H 0 +HETATM 4538 H2 HOH A1405 52.942 37.137 6.396 1.00 0.00 H 0 +HETATM 4539 O HOH A1406 16.363 38.911 43.372 1.00 0.00 O 0 +HETATM 4540 H1 HOH A1406 15.826 39.297 42.621 1.00 0.00 H 0 +HETATM 4541 H2 HOH A1406 17.241 39.338 43.305 1.00 0.00 H 0 +HETATM 4542 O HOH A1407 4.048 27.871 16.273 1.00 0.00 O 0 +HETATM 4543 H1 HOH A1407 4.618 28.358 15.709 1.00 0.00 H 0 +HETATM 4544 H2 HOH A1407 3.673 28.543 16.894 1.00 0.00 H 0 +HETATM 4545 O HOH A1408 48.172 48.066 30.070 1.00 0.00 O 0 +HETATM 4546 H1 HOH A1408 48.751 48.821 29.870 1.00 0.00 H 0 +HETATM 4547 H2 HOH A1408 48.694 47.339 29.832 1.00 0.00 H 0 +HETATM 4548 O HOH A1409 46.316 5.466 45.191 1.00 0.00 O 0 +HETATM 4549 H1 HOH A1409 46.235 4.518 44.735 1.00 0.00 H 0 +HETATM 4550 H2 HOH A1409 47.091 5.334 45.770 1.00 0.00 H 0 +HETATM 4551 O HOH A1410 0.802 36.869 31.654 1.00 0.00 O 0 +HETATM 4552 H1 HOH A1410 1.331 36.224 32.075 1.00 0.00 H 0 +HETATM 4553 H2 HOH A1410 0.719 36.638 30.724 1.00 0.00 H 0 +HETATM 4554 O HOH A1411 29.648 22.948 42.899 1.00 0.00 O 0 +HETATM 4555 H1 HOH A1411 30.558 23.073 43.176 1.00 0.00 H 0 +HETATM 4556 H2 HOH A1411 29.693 22.945 41.946 1.00 0.00 H 0 +HETATM 4557 O HOH A1412 31.071 3.657 27.614 1.00 0.00 O 0 +HETATM 4558 H1 HOH A1412 31.314 3.638 26.636 1.00 0.00 H 0 +HETATM 4559 H2 HOH A1412 31.466 4.354 28.123 1.00 0.00 H 0 +HETATM 4560 O HOH A1413 10.770 16.290 28.892 1.00 0.00 O 0 +HETATM 4561 H1 HOH A1413 11.138 16.637 29.734 1.00 0.00 H 0 +HETATM 4562 H2 HOH A1413 9.904 15.819 29.145 1.00 0.00 H 0 +HETATM 4563 O HOH A1414 40.784 48.912 2.770 1.00 0.00 O 0 +HETATM 4564 H1 HOH A1414 39.949 48.659 3.210 1.00 0.00 H 0 +HETATM 4565 H2 HOH A1414 41.085 49.759 3.211 1.00 0.00 H 0 +HETATM 4566 O HOH A1415 18.650 8.040 7.164 1.00 0.00 O 0 +HETATM 4567 H1 HOH A1415 18.607 8.963 6.765 1.00 0.00 H 0 +HETATM 4568 H2 HOH A1415 17.866 7.548 6.894 1.00 0.00 H 0 +HETATM 4569 O HOH A1416 29.774 13.466 28.953 1.00 0.00 O 0 +HETATM 4570 H1 HOH A1416 28.867 13.661 29.119 1.00 0.00 H 0 +HETATM 4571 H2 HOH A1416 30.324 13.631 29.670 1.00 0.00 H 0 +HETATM 4572 O HOH A1417 15.258 17.929 19.388 1.00 0.00 O 0 +HETATM 4573 H1 HOH A1417 14.475 17.933 18.798 1.00 0.00 H 0 +HETATM 4574 H2 HOH A1417 14.869 18.217 20.225 1.00 0.00 H 0 +HETATM 4575 O HOH A1418 40.933 3.844 13.337 1.00 0.00 O 0 +HETATM 4576 H1 HOH A1418 41.534 3.100 13.437 1.00 0.00 H 0 +HETATM 4577 H2 HOH A1418 41.565 4.538 13.343 1.00 0.00 H 0 +HETATM 4578 O HOH A1419 17.070 8.702 21.192 1.00 0.00 O 0 +HETATM 4579 H1 HOH A1419 16.698 9.280 21.845 1.00 0.00 H 0 +HETATM 4580 H2 HOH A1419 17.976 8.554 21.479 1.00 0.00 H 0 +HETATM 4581 O HOH A1420 15.653 32.873 51.646 1.00 0.00 O 0 +HETATM 4582 H1 HOH A1420 15.452 33.075 50.704 1.00 0.00 H 0 +HETATM 4583 H2 HOH A1420 15.842 31.949 51.540 1.00 0.00 H 0 +HETATM 4584 O HOH A1421 48.562 43.229 15.023 1.00 0.00 O 0 +HETATM 4585 H1 HOH A1421 47.844 42.647 14.615 1.00 0.00 H 0 +HETATM 4586 H2 HOH A1421 49.354 42.619 15.048 1.00 0.00 H 0 +HETATM 4587 O HOH A1422 1.383 48.639 40.420 1.00 0.00 O 0 +HETATM 4588 H1 HOH A1422 2.255 48.597 40.012 1.00 0.00 H 0 +HETATM 4589 H2 HOH A1422 0.948 48.917 39.605 1.00 0.00 H 0 +HETATM 4590 O HOH A1423 46.173 2.691 43.747 1.00 0.00 O 0 +HETATM 4591 H1 HOH A1423 46.736 1.853 43.883 1.00 0.00 H 0 +HETATM 4592 H2 HOH A1423 46.228 2.936 42.765 1.00 0.00 H 0 +HETATM 4593 O HOH A1424 16.740 7.687 16.603 1.00 0.00 O 0 +HETATM 4594 H1 HOH A1424 16.327 8.090 15.854 1.00 0.00 H 0 +HETATM 4595 H2 HOH A1424 17.295 6.947 16.191 1.00 0.00 H 0 +HETATM 4596 O HOH A1425 10.417 49.448 36.786 1.00 0.00 O 0 +HETATM 4597 H1 HOH A1425 9.945 49.679 37.576 1.00 0.00 H 0 +HETATM 4598 H2 HOH A1425 10.287 48.466 36.692 1.00 0.00 H 0 +HETATM 4599 O HOH A1426 22.086 8.751 19.935 1.00 0.00 O 0 +HETATM 4600 H1 HOH A1426 21.703 8.179 19.219 1.00 0.00 H 0 +HETATM 4601 H2 HOH A1426 22.997 8.470 20.087 1.00 0.00 H 0 +HETATM 4602 O HOH A1427 23.345 7.050 4.596 1.00 0.00 O 0 +HETATM 4603 H1 HOH A1427 22.928 7.724 4.040 1.00 0.00 H 0 +HETATM 4604 H2 HOH A1427 22.529 6.698 4.988 1.00 0.00 H 0 +HETATM 4605 O HOH A1428 42.210 36.783 45.850 1.00 0.00 O 0 +HETATM 4606 H1 HOH A1428 42.755 37.535 45.892 1.00 0.00 H 0 +HETATM 4607 H2 HOH A1428 42.575 36.226 45.180 1.00 0.00 H 0 +HETATM 4608 O HOH A1429 16.336 46.305 3.967 1.00 0.00 O 0 +HETATM 4609 H1 HOH A1429 17.013 46.699 3.377 1.00 0.00 H 0 +HETATM 4610 H2 HOH A1429 16.731 46.393 4.851 1.00 0.00 H 0 +HETATM 4611 O HOH A1430 46.742 39.855 50.804 1.00 0.00 O 0 +HETATM 4612 H1 HOH A1430 46.298 39.050 50.518 1.00 0.00 H 0 +HETATM 4613 H2 HOH A1430 47.580 39.825 50.313 1.00 0.00 H 0 +HETATM 4614 O HOH A1431 47.014 37.010 52.621 1.00 0.00 O 0 +HETATM 4615 H1 HOH A1431 47.011 36.043 52.867 1.00 0.00 H 0 +HETATM 4616 H2 HOH A1431 47.877 37.316 52.312 1.00 0.00 H 0 +HETATM 4617 O HOH A1432 45.332 29.390 10.168 1.00 0.00 O 0 +HETATM 4618 H1 HOH A1432 45.972 30.109 10.177 1.00 0.00 H 0 +HETATM 4619 H2 HOH A1432 45.262 29.041 11.010 1.00 0.00 H 0 +HETATM 4620 O HOH A1433 43.416 11.404 7.531 1.00 0.00 O 0 +HETATM 4621 H1 HOH A1433 44.389 11.478 7.673 1.00 0.00 H 0 +HETATM 4622 H2 HOH A1433 43.199 10.494 7.841 1.00 0.00 H 0 +HETATM 4623 O HOH A1434 25.712 8.605 48.999 1.00 0.00 O 0 +HETATM 4624 H1 HOH A1434 25.997 7.837 48.650 1.00 0.00 H 0 +HETATM 4625 H2 HOH A1434 26.496 8.980 49.280 1.00 0.00 H 0 +HETATM 4626 O HOH A1435 7.920 42.800 17.504 1.00 0.00 O 0 +HETATM 4627 H1 HOH A1435 7.265 43.529 17.655 1.00 0.00 H 0 +HETATM 4628 H2 HOH A1435 7.381 41.971 17.228 1.00 0.00 H 0 +HETATM 4629 O HOH A1436 40.721 44.387 17.668 1.00 0.00 O 0 +HETATM 4630 H1 HOH A1436 41.162 45.103 17.169 1.00 0.00 H 0 +HETATM 4631 H2 HOH A1436 40.137 44.983 18.203 1.00 0.00 H 0 +HETATM 4632 O HOH A1437 1.371 41.192 20.067 1.00 0.00 O 0 +HETATM 4633 H1 HOH A1437 0.445 40.914 20.052 1.00 0.00 H 0 +HETATM 4634 H2 HOH A1437 1.528 42.087 20.412 1.00 0.00 H 0 +HETATM 4635 O HOH A1438 41.728 18.855 44.769 1.00 0.00 O 0 +HETATM 4636 H1 HOH A1438 42.038 19.729 44.933 1.00 0.00 H 0 +HETATM 4637 H2 HOH A1438 41.696 18.656 43.865 1.00 0.00 H 0 +HETATM 4638 O HOH A1439 1.456 4.624 6.535 1.00 0.00 O 0 +HETATM 4639 H1 HOH A1439 0.625 4.206 6.835 1.00 0.00 H 0 +HETATM 4640 H2 HOH A1439 1.523 4.171 5.705 1.00 0.00 H 0 +HETATM 4641 O HOH A1440 52.752 47.517 18.942 1.00 0.00 O 0 +HETATM 4642 H1 HOH A1440 52.371 47.160 19.737 1.00 0.00 H 0 +HETATM 4643 H2 HOH A1440 53.413 46.828 18.667 1.00 0.00 H 0 +HETATM 4644 O HOH A1441 5.069 39.895 15.106 1.00 0.00 O 0 +HETATM 4645 H1 HOH A1441 4.471 39.304 14.598 1.00 0.00 H 0 +HETATM 4646 H2 HOH A1441 5.980 39.894 14.701 1.00 0.00 H 0 +HETATM 4647 O HOH A1442 25.830 39.680 53.562 1.00 0.00 O 0 +HETATM 4648 H1 HOH A1442 25.632 40.204 52.738 1.00 0.00 H 0 +HETATM 4649 H2 HOH A1442 25.525 40.072 54.314 1.00 0.00 H 0 +HETATM 4650 O HOH A1443 21.231 2.005 47.566 1.00 0.00 O 0 +HETATM 4651 H1 HOH A1443 20.885 2.632 48.209 1.00 0.00 H 0 +HETATM 4652 H2 HOH A1443 20.732 2.177 46.767 1.00 0.00 H 0 +HETATM 4653 O HOH A1444 26.490 5.645 7.273 1.00 0.00 O 0 +HETATM 4654 H1 HOH A1444 26.449 6.630 7.033 1.00 0.00 H 0 +HETATM 4655 H2 HOH A1444 26.729 5.103 6.433 1.00 0.00 H 0 +HETATM 4656 O HOH A1445 31.907 36.791 8.355 1.00 0.00 O 0 +HETATM 4657 H1 HOH A1445 30.993 37.040 8.583 1.00 0.00 H 0 +HETATM 4658 H2 HOH A1445 32.108 36.954 7.451 1.00 0.00 H 0 +HETATM 4659 O HOH A1446 37.973 41.539 28.401 1.00 0.00 O 0 +HETATM 4660 H1 HOH A1446 37.150 41.210 27.993 1.00 0.00 H 0 +HETATM 4661 H2 HOH A1446 38.264 42.353 27.967 1.00 0.00 H 0 +HETATM 4662 O HOH A1447 15.975 40.308 21.186 1.00 0.00 O 0 +HETATM 4663 H1 HOH A1447 15.466 39.518 21.034 1.00 0.00 H 0 +HETATM 4664 H2 HOH A1447 16.699 39.979 21.832 1.00 0.00 H 0 +HETATM 4665 O HOH A1448 27.170 7.626 18.896 1.00 0.00 O 0 +HETATM 4666 H1 HOH A1448 27.079 8.102 18.012 1.00 0.00 H 0 +HETATM 4667 H2 HOH A1448 26.875 6.683 18.682 1.00 0.00 H 0 +HETATM 4668 O HOH A1449 33.619 24.841 36.414 1.00 0.00 O 0 +HETATM 4669 H1 HOH A1449 33.008 24.405 37.045 1.00 0.00 H 0 +HETATM 4670 H2 HOH A1449 34.541 24.532 36.648 1.00 0.00 H 0 +HETATM 4671 O HOH A1450 14.961 16.448 43.481 1.00 0.00 O 0 +HETATM 4672 H1 HOH A1450 15.846 16.336 43.805 1.00 0.00 H 0 +HETATM 4673 H2 HOH A1450 14.996 17.157 42.792 1.00 0.00 H 0 +HETATM 4674 O HOH A1451 34.719 9.612 26.968 1.00 0.00 O 0 +HETATM 4675 H1 HOH A1451 34.982 10.297 26.339 1.00 0.00 H 0 +HETATM 4676 H2 HOH A1451 34.523 10.090 27.764 1.00 0.00 H 0 +HETATM 4677 O HOH A1452 40.694 11.598 37.066 1.00 0.00 O 0 +HETATM 4678 H1 HOH A1452 40.918 10.935 37.786 1.00 0.00 H 0 +HETATM 4679 H2 HOH A1452 40.899 12.467 37.499 1.00 0.00 H 0 +HETATM 4680 O HOH A1453 0.513 40.115 17.118 1.00 0.00 O 0 +HETATM 4681 H1 HOH A1453 0.405 40.761 17.848 1.00 0.00 H 0 +HETATM 4682 H2 HOH A1453 1.246 39.557 17.395 1.00 0.00 H 0 +HETATM 4683 O HOH A1454 45.667 0.320 19.877 1.00 0.00 O 0 +HETATM 4684 H1 HOH A1454 45.060 -0.161 19.363 1.00 0.00 H 0 +HETATM 4685 H2 HOH A1454 45.869 1.139 19.427 1.00 0.00 H 0 +HETATM 4686 O HOH A1455 26.607 24.800 48.771 1.00 0.00 O 0 +HETATM 4687 H1 HOH A1455 27.241 25.177 49.474 1.00 0.00 H 0 +HETATM 4688 H2 HOH A1455 27.250 24.209 48.201 1.00 0.00 H 0 +HETATM 4689 O HOH A1456 36.647 9.288 31.868 1.00 0.00 O 0 +HETATM 4690 H1 HOH A1456 35.672 9.395 31.810 1.00 0.00 H 0 +HETATM 4691 H2 HOH A1456 36.896 9.891 31.179 1.00 0.00 H 0 +HETATM 4692 O HOH A1457 30.670 33.288 2.526 1.00 0.00 O 0 +HETATM 4693 H1 HOH A1457 30.401 34.138 2.189 1.00 0.00 H 0 +HETATM 4694 H2 HOH A1457 31.361 32.934 2.036 1.00 0.00 H 0 +HETATM 4695 O HOH A1458 32.089 51.640 40.978 1.00 0.00 O 0 +HETATM 4696 H1 HOH A1458 32.608 52.466 40.883 1.00 0.00 H 0 +HETATM 4697 H2 HOH A1458 31.219 51.834 40.583 1.00 0.00 H 0 +HETATM 4698 O HOH A1459 27.134 10.673 33.275 1.00 0.00 O 0 +HETATM 4699 H1 HOH A1459 26.941 10.702 34.248 1.00 0.00 H 0 +HETATM 4700 H2 HOH A1459 26.555 11.324 32.856 1.00 0.00 H 0 +HETATM 4701 O HOH A1460 10.065 13.265 4.728 1.00 0.00 O 0 +HETATM 4702 H1 HOH A1460 10.365 12.422 5.051 1.00 0.00 H 0 +HETATM 4703 H2 HOH A1460 9.618 13.638 5.521 1.00 0.00 H 0 +HETATM 4704 O HOH A1461 37.807 42.843 34.973 1.00 0.00 O 0 +HETATM 4705 H1 HOH A1461 38.720 42.688 34.707 1.00 0.00 H 0 +HETATM 4706 H2 HOH A1461 37.265 42.370 34.327 1.00 0.00 H 0 +HETATM 4707 O HOH A1462 17.791 27.373 6.457 1.00 0.00 O 0 +HETATM 4708 H1 HOH A1462 17.201 28.104 6.217 1.00 0.00 H 0 +HETATM 4709 H2 HOH A1462 18.316 27.669 7.170 1.00 0.00 H 0 +HETATM 4710 O HOH A1463 44.877 37.844 8.299 1.00 0.00 O 0 +HETATM 4711 H1 HOH A1463 45.104 38.194 7.332 1.00 0.00 H 0 +HETATM 4712 H2 HOH A1463 45.743 37.496 8.559 1.00 0.00 H 0 +HETATM 4713 O HOH A1464 38.437 24.496 20.310 1.00 0.00 O 0 +HETATM 4714 H1 HOH A1464 38.257 23.527 20.083 1.00 0.00 H 0 +HETATM 4715 H2 HOH A1464 38.925 24.350 21.128 1.00 0.00 H 0 +HETATM 4716 O HOH A1465 40.908 9.138 30.014 1.00 0.00 O 0 +HETATM 4717 H1 HOH A1465 41.398 9.239 30.816 1.00 0.00 H 0 +HETATM 4718 H2 HOH A1465 40.657 9.965 29.551 1.00 0.00 H 0 +HETATM 4719 O HOH A1466 12.014 39.939 8.911 1.00 0.00 O 0 +HETATM 4720 H1 HOH A1466 11.502 40.017 9.740 1.00 0.00 H 0 +HETATM 4721 H2 HOH A1466 12.523 39.149 9.051 1.00 0.00 H 0 +HETATM 4722 O HOH A1467 38.829 29.557 52.490 1.00 0.00 O 0 +HETATM 4723 H1 HOH A1467 39.729 29.413 52.099 1.00 0.00 H 0 +HETATM 4724 H2 HOH A1467 38.149 29.243 51.935 1.00 0.00 H 0 +HETATM 4725 O HOH A1468 2.944 41.421 7.458 1.00 0.00 O 0 +HETATM 4726 H1 HOH A1468 2.085 41.959 7.265 1.00 0.00 H 0 +HETATM 4727 H2 HOH A1468 2.763 40.652 8.106 1.00 0.00 H 0 +HETATM 4728 O HOH A1469 10.232 41.294 2.800 1.00 0.00 O 0 +HETATM 4729 H1 HOH A1469 10.868 41.032 3.548 1.00 0.00 H 0 +HETATM 4730 H2 HOH A1469 9.579 41.988 3.158 1.00 0.00 H 0 +HETATM 4731 O HOH A1470 43.375 2.734 19.855 1.00 0.00 O 0 +HETATM 4732 H1 HOH A1470 43.741 3.519 20.305 1.00 0.00 H 0 +HETATM 4733 H2 HOH A1470 43.909 2.546 19.073 1.00 0.00 H 0 +HETATM 4734 O HOH A1471 45.886 28.417 36.200 1.00 0.00 O 0 +HETATM 4735 H1 HOH A1471 45.896 29.056 35.503 1.00 0.00 H 0 +HETATM 4736 H2 HOH A1471 45.707 28.818 37.054 1.00 0.00 H 0 +HETATM 4737 O HOH A1472 39.340 52.748 25.933 1.00 0.00 O 0 +HETATM 4738 H1 HOH A1472 39.028 52.296 25.163 1.00 0.00 H 0 +HETATM 4739 H2 HOH A1472 40.277 52.829 25.878 1.00 0.00 H 0 +HETATM 4740 O HOH A1473 34.856 37.818 29.437 1.00 0.00 O 0 +HETATM 4741 H1 HOH A1473 35.819 37.816 29.260 1.00 0.00 H 0 +HETATM 4742 H2 HOH A1473 34.501 38.664 29.083 1.00 0.00 H 0 +HETATM 4743 O HOH A1474 50.475 25.665 39.719 1.00 0.00 O 0 +HETATM 4744 H1 HOH A1474 50.450 26.080 38.797 1.00 0.00 H 0 +HETATM 4745 H2 HOH A1474 51.437 25.757 39.956 1.00 0.00 H 0 +HETATM 4746 O HOH A1475 12.884 37.752 23.636 1.00 0.00 O 0 +HETATM 4747 H1 HOH A1475 13.421 37.113 23.219 1.00 0.00 H 0 +HETATM 4748 H2 HOH A1475 12.907 38.627 23.169 1.00 0.00 H 0 +HETATM 4749 O HOH A1476 9.313 40.355 16.369 1.00 0.00 O 0 +HETATM 4750 H1 HOH A1476 8.485 40.551 15.835 1.00 0.00 H 0 +HETATM 4751 H2 HOH A1476 9.456 39.437 16.160 1.00 0.00 H 0 +HETATM 4752 O HOH A1477 14.789 41.536 47.697 1.00 0.00 O 0 +HETATM 4753 H1 HOH A1477 14.783 41.304 46.744 1.00 0.00 H 0 +HETATM 4754 H2 HOH A1477 15.622 41.377 48.164 1.00 0.00 H 0 +HETATM 4755 O HOH A1478 44.455 49.937 29.166 1.00 0.00 O 0 +HETATM 4756 H1 HOH A1478 43.839 49.913 29.945 1.00 0.00 H 0 +HETATM 4757 H2 HOH A1478 44.705 49.044 29.093 1.00 0.00 H 0 +HETATM 4758 O HOH A1479 38.692 6.052 30.253 1.00 0.00 O 0 +HETATM 4759 H1 HOH A1479 39.338 6.465 30.874 1.00 0.00 H 0 +HETATM 4760 H2 HOH A1479 38.559 6.790 29.676 1.00 0.00 H 0 +HETATM 4761 O HOH A1480 26.334 28.468 40.788 1.00 0.00 O 0 +HETATM 4762 H1 HOH A1480 26.379 28.836 41.680 1.00 0.00 H 0 +HETATM 4763 H2 HOH A1480 25.560 27.950 40.679 1.00 0.00 H 0 +HETATM 4764 O HOH A1481 51.407 11.051 14.681 1.00 0.00 O 0 +HETATM 4765 H1 HOH A1481 52.167 10.475 14.799 1.00 0.00 H 0 +HETATM 4766 H2 HOH A1481 50.993 11.407 15.448 1.00 0.00 H 0 +HETATM 4767 O HOH A1482 25.543 47.392 10.355 1.00 0.00 O 0 +HETATM 4768 H1 HOH A1482 25.035 47.147 11.095 1.00 0.00 H 0 +HETATM 4769 H2 HOH A1482 26.283 47.958 10.741 1.00 0.00 H 0 +HETATM 4770 O HOH A1483 39.577 51.461 18.228 1.00 0.00 O 0 +HETATM 4771 H1 HOH A1483 39.009 50.681 18.281 1.00 0.00 H 0 +HETATM 4772 H2 HOH A1483 39.555 51.774 17.310 1.00 0.00 H 0 +HETATM 4773 O HOH A1484 34.472 9.736 9.234 1.00 0.00 O 0 +HETATM 4774 H1 HOH A1484 34.088 10.394 9.911 1.00 0.00 H 0 +HETATM 4775 H2 HOH A1484 33.652 9.286 8.805 1.00 0.00 H 0 +HETATM 4776 O HOH A1485 42.028 0.843 8.921 1.00 0.00 O 0 +HETATM 4777 H1 HOH A1485 41.223 0.979 9.387 1.00 0.00 H 0 +HETATM 4778 H2 HOH A1485 41.884 0.840 7.943 1.00 0.00 H 0 +HETATM 4779 O HOH A1486 46.357 30.598 6.026 1.00 0.00 O 0 +HETATM 4780 H1 HOH A1486 46.418 31.191 5.234 1.00 0.00 H 0 +HETATM 4781 H2 HOH A1486 45.481 30.694 6.470 1.00 0.00 H 0 +HETATM 4782 O HOH A1487 45.088 42.642 50.533 1.00 0.00 O 0 +HETATM 4783 H1 HOH A1487 45.932 42.923 50.229 1.00 0.00 H 0 +HETATM 4784 H2 HOH A1487 44.470 43.189 50.037 1.00 0.00 H 0 +HETATM 4785 O HOH A1488 44.999 16.329 21.483 1.00 0.00 O 0 +HETATM 4786 H1 HOH A1488 44.704 15.786 22.221 1.00 0.00 H 0 +HETATM 4787 H2 HOH A1488 44.906 15.903 20.656 1.00 0.00 H 0 +HETATM 4788 O HOH A1489 16.580 9.618 14.478 1.00 0.00 O 0 +HETATM 4789 H1 HOH A1489 16.953 10.326 14.990 1.00 0.00 H 0 +HETATM 4790 H2 HOH A1489 17.234 9.454 13.768 1.00 0.00 H 0 +HETATM 4791 O HOH A1490 11.692 23.755 18.911 1.00 0.00 O 0 +HETATM 4792 H1 HOH A1490 12.088 22.995 19.351 1.00 0.00 H 0 +HETATM 4793 H2 HOH A1490 11.547 23.373 18.012 1.00 0.00 H 0 +HETATM 4794 O HOH A1491 39.967 42.754 20.593 1.00 0.00 O 0 +HETATM 4795 H1 HOH A1491 39.863 43.635 21.062 1.00 0.00 H 0 +HETATM 4796 H2 HOH A1491 40.911 42.656 20.324 1.00 0.00 H 0 +HETATM 4797 O HOH A1492 33.681 26.293 33.639 1.00 0.00 O 0 +HETATM 4798 H1 HOH A1492 34.336 26.455 34.216 1.00 0.00 H 0 +HETATM 4799 H2 HOH A1492 33.931 25.469 33.229 1.00 0.00 H 0 +HETATM 4800 O HOH A1493 26.521 11.077 47.784 1.00 0.00 O 0 +HETATM 4801 H1 HOH A1493 26.187 10.393 47.216 1.00 0.00 H 0 +HETATM 4802 H2 HOH A1493 25.916 11.765 47.941 1.00 0.00 H 0 +HETATM 4803 O HOH A1494 17.897 48.564 35.781 1.00 0.00 O 0 +HETATM 4804 H1 HOH A1494 18.564 49.044 36.288 1.00 0.00 H 0 +HETATM 4805 H2 HOH A1494 17.069 49.137 35.860 1.00 0.00 H 0 +HETATM 4806 O HOH A1495 45.206 24.687 30.206 1.00 0.00 O 0 +HETATM 4807 H1 HOH A1495 44.485 23.967 30.095 1.00 0.00 H 0 +HETATM 4808 H2 HOH A1495 45.137 25.203 29.425 1.00 0.00 H 0 +HETATM 4809 O HOH A1496 10.250 16.931 38.489 1.00 0.00 O 0 +HETATM 4810 H1 HOH A1496 9.557 17.134 37.915 1.00 0.00 H 0 +HETATM 4811 H2 HOH A1496 10.788 17.762 38.695 1.00 0.00 H 0 +HETATM 4812 O HOH A1497 32.813 48.922 16.367 1.00 0.00 O 0 +HETATM 4813 H1 HOH A1497 32.111 48.306 16.436 1.00 0.00 H 0 +HETATM 4814 H2 HOH A1497 33.091 49.017 17.279 1.00 0.00 H 0 +HETATM 4815 O HOH A1498 35.427 40.219 24.653 1.00 0.00 O 0 +HETATM 4816 H1 HOH A1498 36.111 40.888 24.909 1.00 0.00 H 0 +HETATM 4817 H2 HOH A1498 35.954 39.648 24.084 1.00 0.00 H 0 +HETATM 4818 O HOH A1499 30.430 9.050 19.233 1.00 0.00 O 0 +HETATM 4819 H1 HOH A1499 29.613 9.483 19.537 1.00 0.00 H 0 +HETATM 4820 H2 HOH A1499 30.267 8.077 19.223 1.00 0.00 H 0 +HETATM 4821 O HOH A1500 10.438 4.369 31.881 1.00 0.00 O 0 +HETATM 4822 H1 HOH A1500 10.772 5.305 31.932 1.00 0.00 H 0 +HETATM 4823 H2 HOH A1500 11.029 3.903 31.200 1.00 0.00 H 0 +HETATM 4824 O HOH A1501 49.689 33.644 26.052 1.00 0.00 O 0 +HETATM 4825 H1 HOH A1501 50.108 32.765 26.189 1.00 0.00 H 0 +HETATM 4826 H2 HOH A1501 48.865 33.470 25.505 1.00 0.00 H 0 +HETATM 4827 O HOH A1502 47.291 27.248 53.492 1.00 0.00 O 0 +HETATM 4828 H1 HOH A1502 47.273 26.853 52.603 1.00 0.00 H 0 +HETATM 4829 H2 HOH A1502 48.160 27.435 53.790 1.00 0.00 H 0 +HETATM 4830 O HOH A1503 48.759 18.059 2.646 1.00 0.00 O 0 +HETATM 4831 H1 HOH A1503 47.923 17.599 2.480 1.00 0.00 H 0 +HETATM 4832 H2 HOH A1503 49.169 17.730 3.445 1.00 0.00 H 0 +HETATM 4833 O HOH A1504 39.562 28.194 30.434 1.00 0.00 O 0 +HETATM 4834 H1 HOH A1504 40.333 28.037 30.932 1.00 0.00 H 0 +HETATM 4835 H2 HOH A1504 38.718 28.054 30.864 1.00 0.00 H 0 +HETATM 4836 O HOH A1505 31.902 19.327 52.299 1.00 0.00 O 0 +HETATM 4837 H1 HOH A1505 31.390 19.134 53.100 1.00 0.00 H 0 +HETATM 4838 H2 HOH A1505 32.835 19.309 52.582 1.00 0.00 H 0 +HETATM 4839 O HOH A1506 30.246 33.978 6.421 1.00 0.00 O 0 +HETATM 4840 H1 HOH A1506 29.450 33.529 6.324 1.00 0.00 H 0 +HETATM 4841 H2 HOH A1506 30.240 34.252 7.349 1.00 0.00 H 0 +HETATM 4842 O HOH A1507 10.793 52.154 35.746 1.00 0.00 O 0 +HETATM 4843 H1 HOH A1507 10.922 51.284 36.043 1.00 0.00 H 0 +HETATM 4844 H2 HOH A1507 11.263 52.838 36.330 1.00 0.00 H 0 +HETATM 4845 O HOH A1508 0.954 52.667 10.942 1.00 0.00 O 0 +HETATM 4846 H1 HOH A1508 0.496 53.422 10.619 1.00 0.00 H 0 +HETATM 4847 H2 HOH A1508 1.540 52.370 10.186 1.00 0.00 H 0 +HETATM 4848 O HOH A1509 23.245 5.799 14.501 1.00 0.00 O 0 +HETATM 4849 H1 HOH A1509 22.713 5.244 15.126 1.00 0.00 H 0 +HETATM 4850 H2 HOH A1509 22.591 6.450 14.216 1.00 0.00 H 0 +HETATM 4851 O HOH A1510 29.639 33.559 38.818 1.00 0.00 O 0 +HETATM 4852 H1 HOH A1510 30.533 33.447 39.070 1.00 0.00 H 0 +HETATM 4853 H2 HOH A1510 29.255 32.662 38.895 1.00 0.00 H 0 +HETATM 4854 O HOH A1511 36.261 6.046 50.263 1.00 0.00 O 0 +HETATM 4855 H1 HOH A1511 36.543 6.698 49.578 1.00 0.00 H 0 +HETATM 4856 H2 HOH A1511 36.194 5.166 49.885 1.00 0.00 H 0 +HETATM 4857 O HOH A1512 16.450 8.425 31.972 1.00 0.00 O 0 +HETATM 4858 H1 HOH A1512 15.856 8.767 32.717 1.00 0.00 H 0 +HETATM 4859 H2 HOH A1512 16.913 9.238 31.700 1.00 0.00 H 0 +HETATM 4860 O HOH A1513 4.846 11.409 2.596 1.00 0.00 O 0 +HETATM 4861 H1 HOH A1513 4.476 10.505 2.636 1.00 0.00 H 0 +HETATM 4862 H2 HOH A1513 4.100 11.958 2.892 1.00 0.00 H 0 +HETATM 4863 O HOH A1514 7.102 18.379 14.360 1.00 0.00 O 0 +HETATM 4864 H1 HOH A1514 6.076 18.448 14.401 1.00 0.00 H 0 +HETATM 4865 H2 HOH A1514 7.327 18.768 15.178 1.00 0.00 H 0 +HETATM 4866 O HOH A1515 42.811 17.764 10.286 1.00 0.00 O 0 +HETATM 4867 H1 HOH A1515 42.011 17.714 10.788 1.00 0.00 H 0 +HETATM 4868 H2 HOH A1515 43.247 18.587 10.605 1.00 0.00 H 0 +HETATM 4869 O HOH A1516 10.108 44.301 14.570 1.00 0.00 O 0 +HETATM 4870 H1 HOH A1516 10.303 43.894 15.451 1.00 0.00 H 0 +HETATM 4871 H2 HOH A1516 9.527 45.175 14.650 1.00 0.00 H 0 +HETATM 4872 O HOH A1517 34.319 31.984 18.179 1.00 0.00 O 0 +HETATM 4873 H1 HOH A1517 34.078 32.776 17.597 1.00 0.00 H 0 +HETATM 4874 H2 HOH A1517 35.167 32.111 18.647 1.00 0.00 H 0 +HETATM 4875 O HOH A1518 29.789 1.056 22.705 1.00 0.00 O 0 +HETATM 4876 H1 HOH A1518 30.692 1.078 22.996 1.00 0.00 H 0 +HETATM 4877 H2 HOH A1518 29.579 1.982 22.661 1.00 0.00 H 0 +HETATM 4878 O HOH A1519 49.973 49.294 15.622 1.00 0.00 O 0 +HETATM 4879 H1 HOH A1519 49.421 49.962 15.943 1.00 0.00 H 0 +HETATM 4880 H2 HOH A1519 50.846 49.618 15.482 1.00 0.00 H 0 +HETATM 4881 O HOH A1520 49.870 12.606 51.001 1.00 0.00 O 0 +HETATM 4882 H1 HOH A1520 50.643 13.034 51.132 1.00 0.00 H 0 +HETATM 4883 H2 HOH A1520 49.167 13.174 50.755 1.00 0.00 H 0 +HETATM 4884 O HOH A1521 5.077 23.302 29.722 1.00 0.00 O 0 +HETATM 4885 H1 HOH A1521 4.499 24.069 29.876 1.00 0.00 H 0 +HETATM 4886 H2 HOH A1521 5.991 23.586 29.854 1.00 0.00 H 0 +HETATM 4887 O HOH A1522 34.173 51.851 10.799 1.00 0.00 O 0 +HETATM 4888 H1 HOH A1522 34.243 52.741 11.257 1.00 0.00 H 0 +HETATM 4889 H2 HOH A1522 33.346 51.822 10.333 1.00 0.00 H 0 +HETATM 4890 O HOH A1523 44.074 7.024 45.656 1.00 0.00 O 0 +HETATM 4891 H1 HOH A1523 44.853 6.355 45.719 1.00 0.00 H 0 +HETATM 4892 H2 HOH A1523 44.511 7.804 45.312 1.00 0.00 H 0 +HETATM 4893 O HOH A1524 18.905 43.063 38.503 1.00 0.00 O 0 +HETATM 4894 H1 HOH A1524 19.426 43.686 37.934 1.00 0.00 H 0 +HETATM 4895 H2 HOH A1524 18.852 43.443 39.364 1.00 0.00 H 0 +HETATM 4896 O HOH A1525 24.345 8.092 17.384 1.00 0.00 O 0 +HETATM 4897 H1 HOH A1525 24.293 8.879 16.858 1.00 0.00 H 0 +HETATM 4898 H2 HOH A1525 23.513 7.623 17.289 1.00 0.00 H 0 +HETATM 4899 O HOH A1526 22.512 31.820 36.098 1.00 0.00 O 0 +HETATM 4900 H1 HOH A1526 21.748 31.336 36.020 1.00 0.00 H 0 +HETATM 4901 H2 HOH A1526 22.321 32.755 36.213 1.00 0.00 H 0 +HETATM 4902 O HOH A1527 52.738 31.747 16.276 1.00 0.00 O 0 +HETATM 4903 H1 HOH A1527 52.963 30.833 16.350 1.00 0.00 H 0 +HETATM 4904 H2 HOH A1527 52.073 31.837 15.530 1.00 0.00 H 0 +HETATM 4905 O HOH A1528 41.896 19.745 31.259 1.00 0.00 O 0 +HETATM 4906 H1 HOH A1528 42.638 19.819 31.874 1.00 0.00 H 0 +HETATM 4907 H2 HOH A1528 41.887 18.888 30.777 1.00 0.00 H 0 +HETATM 4908 O HOH A1529 16.469 24.694 40.602 1.00 0.00 O 0 +HETATM 4909 H1 HOH A1529 16.184 23.795 40.889 1.00 0.00 H 0 +HETATM 4910 H2 HOH A1529 15.629 25.211 40.328 1.00 0.00 H 0 +HETATM 4911 O HOH A1530 12.232 47.996 25.712 1.00 0.00 O 0 +HETATM 4912 H1 HOH A1530 12.469 47.076 25.587 1.00 0.00 H 0 +HETATM 4913 H2 HOH A1530 11.393 47.955 26.239 1.00 0.00 H 0 +HETATM 4914 O HOH A1531 46.082 41.877 43.305 1.00 0.00 O 0 +HETATM 4915 H1 HOH A1531 45.868 42.420 42.563 1.00 0.00 H 0 +HETATM 4916 H2 HOH A1531 45.264 41.389 43.640 1.00 0.00 H 0 +HETATM 4917 O HOH A1532 35.179 45.351 38.544 1.00 0.00 O 0 +HETATM 4918 H1 HOH A1532 34.239 45.390 38.346 1.00 0.00 H 0 +HETATM 4919 H2 HOH A1532 35.381 44.423 38.488 1.00 0.00 H 0 +HETATM 4920 O HOH A1533 39.820 13.820 53.044 1.00 0.00 O 0 +HETATM 4921 H1 HOH A1533 40.348 14.669 53.080 1.00 0.00 H 0 +HETATM 4922 H2 HOH A1533 40.469 13.250 52.629 1.00 0.00 H 0 +HETATM 4923 O HOH A1534 16.269 24.776 47.225 1.00 0.00 O 0 +HETATM 4924 H1 HOH A1534 15.729 25.577 47.223 1.00 0.00 H 0 +HETATM 4925 H2 HOH A1534 16.132 24.332 48.131 1.00 0.00 H 0 +HETATM 4926 O HOH A1535 22.584 45.868 53.364 1.00 0.00 O 0 +HETATM 4927 H1 HOH A1535 23.402 46.218 53.835 1.00 0.00 H 0 +HETATM 4928 H2 HOH A1535 22.104 46.625 53.033 1.00 0.00 H 0 +HETATM 4929 O HOH A1536 33.239 1.859 21.133 1.00 0.00 O 0 +HETATM 4930 H1 HOH A1536 33.942 1.657 20.518 1.00 0.00 H 0 +HETATM 4931 H2 HOH A1536 32.687 1.010 21.272 1.00 0.00 H 0 +HETATM 4932 O HOH A1537 21.376 3.584 29.915 1.00 0.00 O 0 +HETATM 4933 H1 HOH A1537 21.580 2.961 30.595 1.00 0.00 H 0 +HETATM 4934 H2 HOH A1537 20.946 3.104 29.212 1.00 0.00 H 0 +HETATM 4935 O HOH A1538 13.377 35.320 39.942 1.00 0.00 O 0 +HETATM 4936 H1 HOH A1538 13.203 35.341 40.891 1.00 0.00 H 0 +HETATM 4937 H2 HOH A1538 12.951 36.117 39.611 1.00 0.00 H 0 +HETATM 4938 O HOH A1539 17.682 39.012 34.560 1.00 0.00 O 0 +HETATM 4939 H1 HOH A1539 18.404 39.102 35.143 1.00 0.00 H 0 +HETATM 4940 H2 HOH A1539 17.784 38.070 34.450 1.00 0.00 H 0 +HETATM 4941 O HOH A1540 23.128 37.354 5.916 1.00 0.00 O 0 +HETATM 4942 H1 HOH A1540 24.082 37.066 6.046 1.00 0.00 H 0 +HETATM 4943 H2 HOH A1540 23.255 38.307 5.658 1.00 0.00 H 0 +HETATM 4944 O HOH A1541 24.467 33.035 14.291 1.00 0.00 O 0 +HETATM 4945 H1 HOH A1541 23.718 32.760 14.700 1.00 0.00 H 0 +HETATM 4946 H2 HOH A1541 24.650 33.936 14.645 1.00 0.00 H 0 +HETATM 4947 O HOH A1542 21.240 9.598 42.967 1.00 0.00 O 0 +HETATM 4948 H1 HOH A1542 20.905 8.744 43.296 1.00 0.00 H 0 +HETATM 4949 H2 HOH A1542 22.152 9.638 43.065 1.00 0.00 H 0 +HETATM 4950 O HOH A1543 30.653 43.635 38.136 1.00 0.00 O 0 +HETATM 4951 H1 HOH A1543 29.855 44.116 37.934 1.00 0.00 H 0 +HETATM 4952 H2 HOH A1543 31.207 43.295 37.365 1.00 0.00 H 0 +HETATM 4953 O HOH A1544 20.881 39.845 27.366 1.00 0.00 O 0 +HETATM 4954 H1 HOH A1544 20.472 38.977 27.509 1.00 0.00 H 0 +HETATM 4955 H2 HOH A1544 20.236 40.338 26.886 1.00 0.00 H 0 +HETATM 4956 O HOH A1545 35.798 12.341 44.785 1.00 0.00 O 0 +HETATM 4957 H1 HOH A1545 36.533 11.989 44.193 1.00 0.00 H 0 +HETATM 4958 H2 HOH A1545 35.030 12.551 44.194 1.00 0.00 H 0 +HETATM 4959 O HOH A1546 26.364 37.422 37.192 1.00 0.00 O 0 +HETATM 4960 H1 HOH A1546 26.925 36.589 37.068 1.00 0.00 H 0 +HETATM 4961 H2 HOH A1546 26.909 38.224 37.301 1.00 0.00 H 0 +HETATM 4962 O HOH A1547 44.332 16.481 5.228 1.00 0.00 O 0 +HETATM 4963 H1 HOH A1547 45.347 16.450 5.086 1.00 0.00 H 0 +HETATM 4964 H2 HOH A1547 43.990 15.823 4.628 1.00 0.00 H 0 +HETATM 4965 O HOH A1548 2.640 7.557 34.637 1.00 0.00 O 0 +HETATM 4966 H1 HOH A1548 2.464 8.462 34.343 1.00 0.00 H 0 +HETATM 4967 H2 HOH A1548 3.101 7.496 35.440 1.00 0.00 H 0 +HETATM 4968 O HOH A1549 2.417 48.746 15.163 1.00 0.00 O 0 +HETATM 4969 H1 HOH A1549 1.698 49.074 15.694 1.00 0.00 H 0 +HETATM 4970 H2 HOH A1549 3.224 49.190 15.361 1.00 0.00 H 0 +HETATM 4971 O HOH A1550 36.051 47.173 8.495 1.00 0.00 O 0 +HETATM 4972 H1 HOH A1550 35.224 47.545 8.261 1.00 0.00 H 0 +HETATM 4973 H2 HOH A1550 36.577 47.833 8.961 1.00 0.00 H 0 +HETATM 4974 O HOH A1551 0.702 5.673 39.407 1.00 0.00 O 0 +HETATM 4975 H1 HOH A1551 1.650 5.616 39.740 1.00 0.00 H 0 +HETATM 4976 H2 HOH A1551 0.487 4.834 38.961 1.00 0.00 H 0 +HETATM 4977 O HOH A1552 6.870 5.760 0.313 1.00 0.00 O 0 +HETATM 4978 H1 HOH A1552 7.225 5.814 -0.643 1.00 0.00 H 0 +HETATM 4979 H2 HOH A1552 6.773 4.782 0.510 1.00 0.00 H 0 +HETATM 4980 O HOH A1553 50.836 34.118 45.218 1.00 0.00 O 0 +HETATM 4981 H1 HOH A1553 50.420 34.194 44.405 1.00 0.00 H 0 +HETATM 4982 H2 HOH A1553 50.837 34.920 45.724 1.00 0.00 H 0 +HETATM 4983 O HOH A1554 2.831 6.905 28.079 1.00 0.00 O 0 +HETATM 4984 H1 HOH A1554 3.763 6.537 28.170 1.00 0.00 H 0 +HETATM 4985 H2 HOH A1554 2.217 6.092 28.125 1.00 0.00 H 0 +HETATM 4986 O HOH A1555 15.707 30.264 50.845 1.00 0.00 O 0 +HETATM 4987 H1 HOH A1555 15.409 29.443 51.319 1.00 0.00 H 0 +HETATM 4988 H2 HOH A1555 15.563 30.135 49.877 1.00 0.00 H 0 +HETATM 4989 O HOH A1556 17.530 27.056 13.661 1.00 0.00 O 0 +HETATM 4990 H1 HOH A1556 18.090 27.472 12.940 1.00 0.00 H 0 +HETATM 4991 H2 HOH A1556 17.250 26.122 13.395 1.00 0.00 H 0 +HETATM 4992 O HOH A1557 2.892 15.691 5.255 1.00 0.00 O 0 +HETATM 4993 H1 HOH A1557 3.104 14.942 4.664 1.00 0.00 H 0 +HETATM 4994 H2 HOH A1557 3.743 15.912 5.791 1.00 0.00 H 0 +HETATM 4995 O HOH A1558 26.119 27.753 37.874 1.00 0.00 O 0 +HETATM 4996 H1 HOH A1558 26.994 28.114 38.126 1.00 0.00 H 0 +HETATM 4997 H2 HOH A1558 25.461 28.431 37.998 1.00 0.00 H 0 +HETATM 4998 O HOH A1559 44.258 4.406 47.522 1.00 0.00 O 0 +HETATM 4999 H1 HOH A1559 43.389 4.425 48.018 1.00 0.00 H 0 +HETATM 5000 H2 HOH A1559 44.052 4.112 46.609 1.00 0.00 H 0 +HETATM 5001 O HOH A1560 15.817 28.126 10.395 1.00 0.00 O 0 +HETATM 5002 H1 HOH A1560 15.360 28.282 9.502 1.00 0.00 H 0 +HETATM 5003 H2 HOH A1560 16.274 27.239 10.411 1.00 0.00 H 0 +HETATM 5004 O HOH A1561 32.137 1.321 30.415 1.00 0.00 O 0 +HETATM 5005 H1 HOH A1561 32.408 1.667 29.502 1.00 0.00 H 0 +HETATM 5006 H2 HOH A1561 32.462 1.918 31.121 1.00 0.00 H 0 +HETATM 5007 O HOH A1562 4.292 35.796 21.625 1.00 0.00 O 0 +HETATM 5008 H1 HOH A1562 3.540 35.279 21.328 1.00 0.00 H 0 +HETATM 5009 H2 HOH A1562 4.408 35.598 22.600 1.00 0.00 H 0 +HETATM 5010 O HOH A1563 16.424 0.082 34.113 1.00 0.00 O 0 +HETATM 5011 H1 HOH A1563 17.308 -0.063 34.418 1.00 0.00 H 0 +HETATM 5012 H2 HOH A1563 16.223 0.956 34.286 1.00 0.00 H 0 +HETATM 5013 O HOH A1564 8.715 20.058 46.469 1.00 0.00 O 0 +HETATM 5014 H1 HOH A1564 7.931 19.744 45.901 1.00 0.00 H 0 +HETATM 5015 H2 HOH A1564 9.099 19.222 46.903 1.00 0.00 H 0 +HETATM 5016 O HOH A1565 3.639 7.420 37.349 1.00 0.00 O 0 +HETATM 5017 H1 HOH A1565 3.737 6.439 37.631 1.00 0.00 H 0 +HETATM 5018 H2 HOH A1565 2.984 7.925 37.853 1.00 0.00 H 0 +HETATM 5019 O HOH A1566 44.296 35.762 28.509 1.00 0.00 O 0 +HETATM 5020 H1 HOH A1566 44.432 35.017 27.962 1.00 0.00 H 0 +HETATM 5021 H2 HOH A1566 43.366 35.746 28.622 1.00 0.00 H 0 +HETATM 5022 O HOH A1567 27.826 34.129 48.205 1.00 0.00 O 0 +HETATM 5023 H1 HOH A1567 28.025 33.223 48.429 1.00 0.00 H 0 +HETATM 5024 H2 HOH A1567 27.861 34.200 47.238 1.00 0.00 H 0 +HETATM 5025 O HOH A1568 15.290 29.752 25.720 1.00 0.00 O 0 +HETATM 5026 H1 HOH A1568 14.597 29.415 26.350 1.00 0.00 H 0 +HETATM 5027 H2 HOH A1568 16.140 29.835 26.143 1.00 0.00 H 0 +HETATM 5028 O HOH A1569 49.376 8.835 5.240 1.00 0.00 O 0 +HETATM 5029 H1 HOH A1569 48.672 8.953 4.654 1.00 0.00 H 0 +HETATM 5030 H2 HOH A1569 50.198 9.098 4.825 1.00 0.00 H 0 +HETATM 5031 O HOH A1570 11.666 4.469 27.597 1.00 0.00 O 0 +HETATM 5032 H1 HOH A1570 10.844 4.718 27.201 1.00 0.00 H 0 +HETATM 5033 H2 HOH A1570 11.835 3.537 27.403 1.00 0.00 H 0 +HETATM 5034 O HOH A1571 16.639 46.980 51.382 1.00 0.00 O 0 +HETATM 5035 H1 HOH A1571 15.868 46.479 51.106 1.00 0.00 H 0 +HETATM 5036 H2 HOH A1571 16.208 47.766 51.677 1.00 0.00 H 0 +HETATM 5037 O HOH A1572 7.842 24.690 45.140 1.00 0.00 O 0 +HETATM 5038 H1 HOH A1572 7.660 24.941 46.029 1.00 0.00 H 0 +HETATM 5039 H2 HOH A1572 7.493 25.464 44.590 1.00 0.00 H 0 +HETATM 5040 O HOH A1573 24.775 9.266 32.509 1.00 0.00 O 0 +HETATM 5041 H1 HOH A1573 25.474 9.812 32.779 1.00 0.00 H 0 +HETATM 5042 H2 HOH A1573 24.321 9.159 33.333 1.00 0.00 H 0 +HETATM 5043 O HOH A1574 53.641 33.856 45.750 1.00 0.00 O 0 +HETATM 5044 H1 HOH A1574 52.781 33.811 45.350 1.00 0.00 H 0 +HETATM 5045 H2 HOH A1574 53.894 34.740 45.549 1.00 0.00 H 0 +HETATM 5046 O HOH A1575 16.202 50.299 26.904 1.00 0.00 O 0 +HETATM 5047 H1 HOH A1575 16.806 50.913 27.436 1.00 0.00 H 0 +HETATM 5048 H2 HOH A1575 16.308 49.427 27.324 1.00 0.00 H 0 +HETATM 5049 O HOH A1576 30.819 5.934 17.657 1.00 0.00 O 0 +HETATM 5050 H1 HOH A1576 29.953 5.412 17.815 1.00 0.00 H 0 +HETATM 5051 H2 HOH A1576 30.827 6.105 16.672 1.00 0.00 H 0 +HETATM 5052 O HOH A1577 6.622 34.434 40.661 1.00 0.00 O 0 +HETATM 5053 H1 HOH A1577 7.458 34.452 41.137 1.00 0.00 H 0 +HETATM 5054 H2 HOH A1577 6.591 33.768 39.977 1.00 0.00 H 0 +HETATM 5055 O HOH A1578 43.189 43.378 20.975 1.00 0.00 O 0 +HETATM 5056 H1 HOH A1578 43.160 44.201 21.449 1.00 0.00 H 0 +HETATM 5057 H2 HOH A1578 42.753 42.720 21.502 1.00 0.00 H 0 +HETATM 5058 O HOH A1579 7.073 26.780 29.089 1.00 0.00 O 0 +HETATM 5059 H1 HOH A1579 7.375 25.946 29.449 1.00 0.00 H 0 +HETATM 5060 H2 HOH A1579 6.183 26.740 28.740 1.00 0.00 H 0 +HETATM 5061 O HOH A1580 29.915 22.951 8.325 1.00 0.00 O 0 +HETATM 5062 H1 HOH A1580 30.385 22.719 9.088 1.00 0.00 H 0 +HETATM 5063 H2 HOH A1580 30.522 23.431 7.774 1.00 0.00 H 0 +HETATM 5064 O HOH A1581 8.792 34.939 0.864 1.00 0.00 O 0 +HETATM 5065 H1 HOH A1581 8.362 35.630 1.348 1.00 0.00 H 0 +HETATM 5066 H2 HOH A1581 8.536 34.131 1.330 1.00 0.00 H 0 +HETATM 5067 O HOH A1582 35.454 29.338 5.842 1.00 0.00 O 0 +HETATM 5068 H1 HOH A1582 35.808 29.463 6.709 1.00 0.00 H 0 +HETATM 5069 H2 HOH A1582 35.308 30.219 5.534 1.00 0.00 H 0 +HETATM 5070 O HOH A1583 40.776 12.971 48.719 1.00 0.00 O 0 +HETATM 5071 H1 HOH A1583 41.451 12.838 48.014 1.00 0.00 H 0 +HETATM 5072 H2 HOH A1583 40.024 13.471 48.285 1.00 0.00 H 0 +HETATM 5073 O HOH A1584 41.599 6.858 46.981 1.00 0.00 O 0 +HETATM 5074 H1 HOH A1584 41.031 6.477 46.296 1.00 0.00 H 0 +HETATM 5075 H2 HOH A1584 42.496 7.001 46.622 1.00 0.00 H 0 +HETATM 5076 O HOH A1585 18.360 48.189 24.631 1.00 0.00 O 0 +HETATM 5077 H1 HOH A1585 18.941 47.756 23.937 1.00 0.00 H 0 +HETATM 5078 H2 HOH A1585 18.075 47.510 25.309 1.00 0.00 H 0 +HETATM 5079 O HOH A1586 4.411 23.556 10.168 1.00 0.00 O 0 +HETATM 5080 H1 HOH A1586 4.601 23.154 9.339 1.00 0.00 H 0 +HETATM 5081 H2 HOH A1586 5.239 23.564 10.681 1.00 0.00 H 0 +HETATM 5082 O HOH A1587 26.944 7.655 31.322 1.00 0.00 O 0 +HETATM 5083 H1 HOH A1587 27.651 8.307 31.470 1.00 0.00 H 0 +HETATM 5084 H2 HOH A1587 27.005 7.479 30.352 1.00 0.00 H 0 +HETATM 5085 O HOH A1588 37.324 16.841 0.363 1.00 0.00 O 0 +HETATM 5086 H1 HOH A1588 38.144 16.769 0.813 1.00 0.00 H 0 +HETATM 5087 H2 HOH A1588 37.314 17.837 0.143 1.00 0.00 H 0 +HETATM 5088 O HOH A1589 43.430 35.165 44.043 1.00 0.00 O 0 +HETATM 5089 H1 HOH A1589 44.018 35.559 43.390 1.00 0.00 H 0 +HETATM 5090 H2 HOH A1589 42.926 34.432 43.628 1.00 0.00 H 0 +HETATM 5091 O HOH A1590 34.944 44.371 22.247 1.00 0.00 O 0 +HETATM 5092 H1 HOH A1590 34.389 43.717 22.639 1.00 0.00 H 0 +HETATM 5093 H2 HOH A1590 34.920 44.039 21.381 1.00 0.00 H 0 +HETATM 5094 O HOH A1591 13.842 35.271 47.863 1.00 0.00 O 0 +HETATM 5095 H1 HOH A1591 13.183 34.754 47.344 1.00 0.00 H 0 +HETATM 5096 H2 HOH A1591 13.566 35.299 48.779 1.00 0.00 H 0 +HETATM 5097 O HOH A1592 41.746 4.713 48.836 1.00 0.00 O 0 +HETATM 5098 H1 HOH A1592 41.186 3.949 48.917 1.00 0.00 H 0 +HETATM 5099 H2 HOH A1592 41.358 5.274 48.169 1.00 0.00 H 0 +HETATM 5100 O HOH A1593 7.652 3.889 31.979 1.00 0.00 O 0 +HETATM 5101 H1 HOH A1593 7.062 4.550 31.557 1.00 0.00 H 0 +HETATM 5102 H2 HOH A1593 8.483 4.248 31.751 1.00 0.00 H 0 +HETATM 5103 O HOH A1594 3.833 25.592 -0.233 1.00 0.00 O 0 +HETATM 5104 H1 HOH A1594 3.461 24.846 0.233 1.00 0.00 H 0 +HETATM 5105 H2 HOH A1594 3.921 26.291 0.371 1.00 0.00 H 0 +HETATM 5106 O HOH A1595 47.800 5.526 41.146 1.00 0.00 O 0 +HETATM 5107 H1 HOH A1595 48.715 5.582 41.182 1.00 0.00 H 0 +HETATM 5108 H2 HOH A1595 47.614 4.638 41.366 1.00 0.00 H 0 +HETATM 5109 O HOH A1596 3.756 50.352 20.168 1.00 0.00 O 0 +HETATM 5110 H1 HOH A1596 4.731 50.419 20.422 1.00 0.00 H 0 +HETATM 5111 H2 HOH A1596 3.636 49.452 19.998 1.00 0.00 H 0 +HETATM 5112 O HOH A1597 20.803 13.795 41.504 1.00 0.00 O 0 +HETATM 5113 H1 HOH A1597 21.585 13.882 42.073 1.00 0.00 H 0 +HETATM 5114 H2 HOH A1597 20.406 12.931 41.675 1.00 0.00 H 0 +HETATM 5115 O HOH A1598 42.005 19.376 1.055 1.00 0.00 O 0 +HETATM 5116 H1 HOH A1598 41.531 19.149 0.233 1.00 0.00 H 0 +HETATM 5117 H2 HOH A1598 41.489 20.072 1.454 1.00 0.00 H 0 +HETATM 5118 O HOH A1599 36.814 53.571 35.370 1.00 0.00 O 0 +HETATM 5119 H1 HOH A1599 36.928 52.701 35.010 1.00 0.00 H 0 +HETATM 5120 H2 HOH A1599 35.938 53.406 35.729 1.00 0.00 H 0 +HETATM 5121 O HOH A1600 17.420 46.052 26.146 1.00 0.00 O 0 +HETATM 5122 H1 HOH A1600 16.866 45.268 25.814 1.00 0.00 H 0 +HETATM 5123 H2 HOH A1600 18.158 45.668 26.655 1.00 0.00 H 0 +HETATM 5124 O HOH A1601 42.426 17.123 30.933 1.00 0.00 O 0 +HETATM 5125 H1 HOH A1601 43.043 16.782 31.588 1.00 0.00 H 0 +HETATM 5126 H2 HOH A1601 42.439 16.461 30.277 1.00 0.00 H 0 +HETATM 5127 O HOH A1602 45.064 28.034 45.563 1.00 0.00 O 0 +HETATM 5128 H1 HOH A1602 44.168 28.356 45.596 1.00 0.00 H 0 +HETATM 5129 H2 HOH A1602 45.544 28.463 46.341 1.00 0.00 H 0 +HETATM 5130 O HOH A1603 10.265 15.354 51.525 1.00 0.00 O 0 +HETATM 5131 H1 HOH A1603 11.124 14.925 51.214 1.00 0.00 H 0 +HETATM 5132 H2 HOH A1603 10.243 15.325 52.494 1.00 0.00 H 0 +HETATM 5133 O HOH A1604 5.762 45.311 36.684 1.00 0.00 O 0 +HETATM 5134 H1 HOH A1604 6.259 44.542 36.313 1.00 0.00 H 0 +HETATM 5135 H2 HOH A1604 5.099 45.670 36.068 1.00 0.00 H 0 +HETATM 5136 O HOH A1605 18.728 11.672 44.089 1.00 0.00 O 0 +HETATM 5137 H1 HOH A1605 19.547 12.119 44.040 1.00 0.00 H 0 +HETATM 5138 H2 HOH A1605 18.162 12.036 43.428 1.00 0.00 H 0 +HETATM 5139 O HOH A1606 9.110 46.524 27.132 1.00 0.00 O 0 +HETATM 5140 H1 HOH A1606 8.925 46.307 26.225 1.00 0.00 H 0 +HETATM 5141 H2 HOH A1606 8.649 47.362 27.408 1.00 0.00 H 0 +HETATM 5142 O HOH A1607 21.010 6.421 23.539 1.00 0.00 O 0 +HETATM 5143 H1 HOH A1607 21.706 6.603 24.206 1.00 0.00 H 0 +HETATM 5144 H2 HOH A1607 21.407 5.917 22.845 1.00 0.00 H 0 +HETATM 5145 O HOH A1608 49.625 45.192 10.212 1.00 0.00 O 0 +HETATM 5146 H1 HOH A1608 49.951 45.074 9.328 1.00 0.00 H 0 +HETATM 5147 H2 HOH A1608 49.037 45.955 10.187 1.00 0.00 H 0 +HETATM 5148 O HOH A1609 11.020 1.769 1.719 1.00 0.00 O 0 +HETATM 5149 H1 HOH A1609 10.653 2.686 1.465 1.00 0.00 H 0 +HETATM 5150 H2 HOH A1609 10.294 1.203 1.958 1.00 0.00 H 0 +HETATM 5151 O HOH A1610 50.861 8.410 17.313 1.00 0.00 O 0 +HETATM 5152 H1 HOH A1610 51.303 8.045 16.571 1.00 0.00 H 0 +HETATM 5153 H2 HOH A1610 50.162 8.937 16.892 1.00 0.00 H 0 +HETATM 5154 O HOH A1611 53.146 10.312 34.427 1.00 0.00 O 0 +HETATM 5155 H1 HOH A1611 52.848 10.537 35.318 1.00 0.00 H 0 +HETATM 5156 H2 HOH A1611 53.038 9.381 34.343 1.00 0.00 H 0 +HETATM 5157 O HOH A1612 44.342 20.170 25.595 1.00 0.00 O 0 +HETATM 5158 H1 HOH A1612 44.083 21.043 25.862 1.00 0.00 H 0 +HETATM 5159 H2 HOH A1612 44.576 19.579 26.398 1.00 0.00 H 0 +HETATM 5160 O HOH A1613 26.255 36.835 53.467 1.00 0.00 O 0 +HETATM 5161 H1 HOH A1613 25.556 36.364 52.899 1.00 0.00 H 0 +HETATM 5162 H2 HOH A1613 26.239 37.803 53.239 1.00 0.00 H 0 +HETATM 5163 O HOH A1614 4.197 14.206 14.124 1.00 0.00 O 0 +HETATM 5164 H1 HOH A1614 5.006 14.671 14.214 1.00 0.00 H 0 +HETATM 5165 H2 HOH A1614 3.713 14.505 14.875 1.00 0.00 H 0 +HETATM 5166 O HOH A1615 26.257 50.959 0.325 1.00 0.00 O 0 +HETATM 5167 H1 HOH A1615 26.400 51.830 -0.129 1.00 0.00 H 0 +HETATM 5168 H2 HOH A1615 26.877 50.349 -0.013 1.00 0.00 H 0 +HETATM 5169 O HOH A1616 5.944 15.573 44.413 1.00 0.00 O 0 +HETATM 5170 H1 HOH A1616 6.235 16.285 45.011 1.00 0.00 H 0 +HETATM 5171 H2 HOH A1616 5.205 15.079 44.859 1.00 0.00 H 0 +HETATM 5172 O HOH A1617 49.876 26.217 27.717 1.00 0.00 O 0 +HETATM 5173 H1 HOH A1617 50.527 26.493 28.402 1.00 0.00 H 0 +HETATM 5174 H2 HOH A1617 50.241 25.500 27.195 1.00 0.00 H 0 +HETATM 5175 O HOH A1618 5.951 38.484 7.221 1.00 0.00 O 0 +HETATM 5176 H1 HOH A1618 6.492 38.027 6.595 1.00 0.00 H 0 +HETATM 5177 H2 HOH A1618 6.287 39.370 7.243 1.00 0.00 H 0 +HETATM 5178 O HOH A1619 0.504 22.013 38.272 1.00 0.00 O 0 +HETATM 5179 H1 HOH A1619 1.033 21.414 37.788 1.00 0.00 H 0 +HETATM 5180 H2 HOH A1619 -0.062 22.346 37.597 1.00 0.00 H 0 +HETATM 5181 O HOH A1620 44.585 52.466 44.890 1.00 0.00 O 0 +HETATM 5182 H1 HOH A1620 45.301 52.187 44.301 1.00 0.00 H 0 +HETATM 5183 H2 HOH A1620 44.924 51.984 45.656 1.00 0.00 H 0 +HETATM 5184 O HOH A1621 36.363 4.288 15.357 1.00 0.00 O 0 +HETATM 5185 H1 HOH A1621 37.298 4.205 15.181 1.00 0.00 H 0 +HETATM 5186 H2 HOH A1621 35.917 4.237 14.483 1.00 0.00 H 0 +HETATM 5187 O HOH A1622 50.690 13.280 12.873 1.00 0.00 O 0 +HETATM 5188 H1 HOH A1622 51.117 12.476 13.341 1.00 0.00 H 0 +HETATM 5189 H2 HOH A1622 50.149 13.742 13.540 1.00 0.00 H 0 +HETATM 5190 O HOH A1623 22.766 17.368 6.799 1.00 0.00 O 0 +HETATM 5191 H1 HOH A1623 23.449 18.059 6.922 1.00 0.00 H 0 +HETATM 5192 H2 HOH A1623 21.985 17.952 6.791 1.00 0.00 H 0 +HETATM 5193 O HOH A1624 53.033 2.674 10.541 1.00 0.00 O 0 +HETATM 5194 H1 HOH A1624 53.614 3.042 11.295 1.00 0.00 H 0 +HETATM 5195 H2 HOH A1624 52.690 1.836 10.939 1.00 0.00 H 0 +HETATM 5196 O HOH A1625 2.449 19.850 35.759 1.00 0.00 O 0 +HETATM 5197 H1 HOH A1625 3.254 20.049 36.213 1.00 0.00 H 0 +HETATM 5198 H2 HOH A1625 2.660 19.503 34.933 1.00 0.00 H 0 +HETATM 5199 O HOH A1626 13.970 8.872 37.170 1.00 0.00 O 0 +HETATM 5200 H1 HOH A1626 14.286 9.768 37.377 1.00 0.00 H 0 +HETATM 5201 H2 HOH A1626 13.433 9.059 36.399 1.00 0.00 H 0 +HETATM 5202 O HOH A1627 46.233 19.047 17.242 1.00 0.00 O 0 +HETATM 5203 H1 HOH A1627 45.595 19.128 16.487 1.00 0.00 H 0 +HETATM 5204 H2 HOH A1627 46.888 18.309 17.171 1.00 0.00 H 0 +HETATM 5205 O HOH A1628 5.595 43.803 53.219 1.00 0.00 O 0 +HETATM 5206 H1 HOH A1628 6.321 43.327 52.760 1.00 0.00 H 0 +HETATM 5207 H2 HOH A1628 4.801 43.322 53.043 1.00 0.00 H 0 +HETATM 5208 O HOH A1629 11.316 12.472 42.797 1.00 0.00 O 0 +HETATM 5209 H1 HOH A1629 10.804 11.673 42.783 1.00 0.00 H 0 +HETATM 5210 H2 HOH A1629 11.884 12.342 43.527 1.00 0.00 H 0 +HETATM 5211 O HOH A1630 49.114 32.770 46.749 1.00 0.00 O 0 +HETATM 5212 H1 HOH A1630 48.760 33.300 47.424 1.00 0.00 H 0 +HETATM 5213 H2 HOH A1630 49.662 33.302 46.250 1.00 0.00 H 0 +HETATM 5214 O HOH A1631 52.172 6.780 48.648 1.00 0.00 O 0 +HETATM 5215 H1 HOH A1631 51.764 6.214 47.987 1.00 0.00 H 0 +HETATM 5216 H2 HOH A1631 51.506 7.016 49.264 1.00 0.00 H 0 +HETATM 5217 O HOH A1632 15.598 3.890 37.439 1.00 0.00 O 0 +HETATM 5218 H1 HOH A1632 15.002 4.564 37.117 1.00 0.00 H 0 +HETATM 5219 H2 HOH A1632 15.228 3.709 38.323 1.00 0.00 H 0 +HETATM 5220 O HOH A1633 13.578 31.716 6.690 1.00 0.00 O 0 +HETATM 5221 H1 HOH A1633 13.595 32.648 6.494 1.00 0.00 H 0 +HETATM 5222 H2 HOH A1633 12.708 31.608 6.925 1.00 0.00 H 0 +HETATM 5223 O HOH A1634 9.513 41.913 42.200 1.00 0.00 O 0 +HETATM 5224 H1 HOH A1634 8.579 41.879 41.963 1.00 0.00 H 0 +HETATM 5225 H2 HOH A1634 9.677 41.052 42.664 1.00 0.00 H 0 +HETATM 5226 O HOH A1635 24.541 10.494 21.464 1.00 0.00 O 0 +HETATM 5227 H1 HOH A1635 23.965 10.324 22.149 1.00 0.00 H 0 +HETATM 5228 H2 HOH A1635 24.821 9.604 21.194 1.00 0.00 H 0 +HETATM 5229 O HOH A1636 0.973 2.810 4.008 1.00 0.00 O 0 +HETATM 5230 H1 HOH A1636 0.627 3.635 3.717 1.00 0.00 H 0 +HETATM 5231 H2 HOH A1636 1.416 2.442 3.209 1.00 0.00 H 0 +HETATM 5232 O HOH A1637 13.816 19.402 21.154 1.00 0.00 O 0 +HETATM 5233 H1 HOH A1637 14.226 19.948 21.768 1.00 0.00 H 0 +HETATM 5234 H2 HOH A1637 13.310 18.685 21.553 1.00 0.00 H 0 +HETATM 5235 O HOH A1638 51.646 19.359 18.096 1.00 0.00 O 0 +HETATM 5236 H1 HOH A1638 51.156 19.949 18.646 1.00 0.00 H 0 +HETATM 5237 H2 HOH A1638 52.575 19.596 18.299 1.00 0.00 H 0 +HETATM 5238 O HOH A1639 18.701 45.445 23.458 1.00 0.00 O 0 +HETATM 5239 H1 HOH A1639 17.947 44.839 23.615 1.00 0.00 H 0 +HETATM 5240 H2 HOH A1639 18.785 45.559 22.537 1.00 0.00 H 0 +HETATM 5241 O HOH A1640 48.116 13.457 35.584 1.00 0.00 O 0 +HETATM 5242 H1 HOH A1640 48.018 12.809 36.382 1.00 0.00 H 0 +HETATM 5243 H2 HOH A1640 47.199 13.680 35.430 1.00 0.00 H 0 +HETATM 5244 O HOH A1641 34.101 49.023 46.117 1.00 0.00 O 0 +HETATM 5245 H1 HOH A1641 34.374 49.837 45.741 1.00 0.00 H 0 +HETATM 5246 H2 HOH A1641 33.074 49.043 46.128 1.00 0.00 H 0 +HETATM 5247 O HOH A1642 25.636 36.508 6.585 1.00 0.00 O 0 +HETATM 5248 H1 HOH A1642 25.552 36.732 7.527 1.00 0.00 H 0 +HETATM 5249 H2 HOH A1642 26.382 37.039 6.152 1.00 0.00 H 0 +HETATM 5250 O HOH A1643 5.866 53.662 6.774 1.00 0.00 O 0 +HETATM 5251 H1 HOH A1643 5.741 53.206 5.987 1.00 0.00 H 0 +HETATM 5252 H2 HOH A1643 5.022 53.739 7.191 1.00 0.00 H 0 +HETATM 5253 O HOH A1644 29.329 48.262 25.126 1.00 0.00 O 0 +HETATM 5254 H1 HOH A1644 29.953 47.605 24.825 1.00 0.00 H 0 +HETATM 5255 H2 HOH A1644 29.600 48.555 25.991 1.00 0.00 H 0 +HETATM 5256 O HOH A1645 39.933 15.913 10.741 1.00 0.00 O 0 +HETATM 5257 H1 HOH A1645 39.675 16.835 10.492 1.00 0.00 H 0 +HETATM 5258 H2 HOH A1645 40.162 15.418 9.945 1.00 0.00 H 0 +HETATM 5259 O HOH A1646 42.071 32.952 17.015 1.00 0.00 O 0 +HETATM 5260 H1 HOH A1646 41.855 32.033 16.829 1.00 0.00 H 0 +HETATM 5261 H2 HOH A1646 42.886 33.097 16.574 1.00 0.00 H 0 +HETATM 5262 O HOH A1647 46.185 19.251 31.652 1.00 0.00 O 0 +HETATM 5263 H1 HOH A1647 46.808 19.244 32.369 1.00 0.00 H 0 +HETATM 5264 H2 HOH A1647 46.472 19.850 30.968 1.00 0.00 H 0 +HETATM 5265 O HOH A1648 15.728 39.709 29.971 1.00 0.00 O 0 +HETATM 5266 H1 HOH A1648 15.808 39.016 29.244 1.00 0.00 H 0 +HETATM 5267 H2 HOH A1648 15.006 40.278 29.623 1.00 0.00 H 0 +HETATM 5268 O HOH A1649 2.992 10.356 46.970 1.00 0.00 O 0 +HETATM 5269 H1 HOH A1649 3.162 9.436 46.976 1.00 0.00 H 0 +HETATM 5270 H2 HOH A1649 2.139 10.414 46.552 1.00 0.00 H 0 +HETATM 5271 O HOH A1650 29.977 16.495 47.150 1.00 0.00 O 0 +HETATM 5272 H1 HOH A1650 29.154 16.630 47.612 1.00 0.00 H 0 +HETATM 5273 H2 HOH A1650 30.531 16.032 47.735 1.00 0.00 H 0 +HETATM 5274 O HOH A1651 8.945 12.826 24.401 1.00 0.00 O 0 +HETATM 5275 H1 HOH A1651 8.971 11.843 24.278 1.00 0.00 H 0 +HETATM 5276 H2 HOH A1651 8.044 13.170 24.540 1.00 0.00 H 0 +HETATM 5277 O HOH A1652 14.703 -0.388 1.597 1.00 0.00 O 0 +HETATM 5278 H1 HOH A1652 14.894 0.304 2.321 1.00 0.00 H 0 +HETATM 5279 H2 HOH A1652 14.088 0.122 0.987 1.00 0.00 H 0 +HETATM 5280 O HOH A1653 45.886 53.530 24.068 1.00 0.00 O 0 +HETATM 5281 H1 HOH A1653 45.719 52.610 23.927 1.00 0.00 H 0 +HETATM 5282 H2 HOH A1653 46.513 53.857 23.440 1.00 0.00 H 0 +HETATM 5283 O HOH A1654 51.424 3.400 48.936 1.00 0.00 O 0 +HETATM 5284 H1 HOH A1654 51.958 2.620 49.179 1.00 0.00 H 0 +HETATM 5285 H2 HOH A1654 51.898 4.080 49.477 1.00 0.00 H 0 +HETATM 5286 O HOH A1655 21.341 15.365 19.994 1.00 0.00 O 0 +HETATM 5287 H1 HOH A1655 20.450 15.743 20.028 1.00 0.00 H 0 +HETATM 5288 H2 HOH A1655 21.248 14.797 20.783 1.00 0.00 H 0 +HETATM 5289 O HOH A1656 12.740 15.731 16.793 1.00 0.00 O 0 +HETATM 5290 H1 HOH A1656 13.578 15.192 16.780 1.00 0.00 H 0 +HETATM 5291 H2 HOH A1656 12.048 15.379 16.203 1.00 0.00 H 0 +HETATM 5292 O HOH A1657 24.624 51.798 20.464 1.00 0.00 O 0 +HETATM 5293 H1 HOH A1657 24.553 50.825 20.601 1.00 0.00 H 0 +HETATM 5294 H2 HOH A1657 25.013 51.826 19.613 1.00 0.00 H 0 +HETATM 5295 O HOH A1658 14.437 17.233 3.228 1.00 0.00 O 0 +HETATM 5296 H1 HOH A1658 14.351 17.048 4.142 1.00 0.00 H 0 +HETATM 5297 H2 HOH A1658 13.760 16.769 2.695 1.00 0.00 H 0 +HETATM 5298 O HOH A1659 51.164 9.160 38.326 1.00 0.00 O 0 +HETATM 5299 H1 HOH A1659 51.674 9.748 37.802 1.00 0.00 H 0 +HETATM 5300 H2 HOH A1659 51.621 8.256 38.324 1.00 0.00 H 0 +HETATM 5301 O HOH A1660 44.684 34.310 39.819 1.00 0.00 O 0 +HETATM 5302 H1 HOH A1660 43.781 33.988 39.917 1.00 0.00 H 0 +HETATM 5303 H2 HOH A1660 44.716 35.038 40.464 1.00 0.00 H 0 +HETATM 5304 O HOH A1661 28.342 50.440 21.241 1.00 0.00 O 0 +HETATM 5305 H1 HOH A1661 28.316 51.364 20.946 1.00 0.00 H 0 +HETATM 5306 H2 HOH A1661 28.764 50.350 22.142 1.00 0.00 H 0 +HETATM 5307 O HOH A1662 11.788 5.197 43.580 1.00 0.00 O 0 +HETATM 5308 H1 HOH A1662 12.107 5.773 44.306 1.00 0.00 H 0 +HETATM 5309 H2 HOH A1662 10.912 5.618 43.377 1.00 0.00 H 0 +HETATM 5310 O HOH A1663 28.707 43.968 45.319 1.00 0.00 O 0 +HETATM 5311 H1 HOH A1663 28.675 44.410 44.455 1.00 0.00 H 0 +HETATM 5312 H2 HOH A1663 28.168 43.112 45.167 1.00 0.00 H 0 +HETATM 5313 O HOH A1664 36.020 5.090 42.341 1.00 0.00 O 0 +HETATM 5314 H1 HOH A1664 35.802 4.220 41.913 1.00 0.00 H 0 +HETATM 5315 H2 HOH A1664 35.150 5.376 42.688 1.00 0.00 H 0 +HETATM 5316 O HOH A1665 18.523 46.205 53.275 1.00 0.00 O 0 +HETATM 5317 H1 HOH A1665 19.268 46.739 52.820 1.00 0.00 H 0 +HETATM 5318 H2 HOH A1665 17.781 46.337 52.706 1.00 0.00 H 0 +HETATM 5319 O HOH A1666 34.166 13.196 5.744 1.00 0.00 O 0 +HETATM 5320 H1 HOH A1666 34.834 13.806 6.047 1.00 0.00 H 0 +HETATM 5321 H2 HOH A1666 33.434 13.727 5.481 1.00 0.00 H 0 +HETATM 5322 O HOH A1667 9.866 11.284 8.969 1.00 0.00 O 0 +HETATM 5323 H1 HOH A1667 10.668 10.848 8.746 1.00 0.00 H 0 +HETATM 5324 H2 HOH A1667 10.011 11.473 9.940 1.00 0.00 H 0 +HETATM 5325 O HOH A1668 14.967 51.568 40.107 1.00 0.00 O 0 +HETATM 5326 H1 HOH A1668 15.545 50.810 40.264 1.00 0.00 H 0 +HETATM 5327 H2 HOH A1668 14.618 51.351 39.240 1.00 0.00 H 0 +HETATM 5328 O HOH A1669 24.020 11.072 49.301 1.00 0.00 O 0 +HETATM 5329 H1 HOH A1669 24.249 10.137 49.243 1.00 0.00 H 0 +HETATM 5330 H2 HOH A1669 24.689 11.511 49.837 1.00 0.00 H 0 +HETATM 5331 O HOH A1670 25.220 23.510 8.510 1.00 0.00 O 0 +HETATM 5332 H1 HOH A1670 24.873 23.389 9.406 1.00 0.00 H 0 +HETATM 5333 H2 HOH A1670 26.044 24.050 8.678 1.00 0.00 H 0 +HETATM 5334 O HOH A1671 15.588 12.499 32.643 1.00 0.00 O 0 +HETATM 5335 H1 HOH A1671 14.925 12.826 31.975 1.00 0.00 H 0 +HETATM 5336 H2 HOH A1671 15.904 13.256 33.032 1.00 0.00 H 0 +HETATM 5337 O HOH A1672 19.122 4.676 25.591 1.00 0.00 O 0 +HETATM 5338 H1 HOH A1672 19.776 5.142 25.122 1.00 0.00 H 0 +HETATM 5339 H2 HOH A1672 19.134 3.751 25.388 1.00 0.00 H 0 +HETATM 5340 O HOH A1673 23.113 53.188 1.663 1.00 0.00 O 0 +HETATM 5341 H1 HOH A1673 22.661 53.518 2.451 1.00 0.00 H 0 +HETATM 5342 H2 HOH A1673 23.703 53.883 1.412 1.00 0.00 H 0 +HETATM 5343 O HOH A1674 3.316 8.274 25.445 1.00 0.00 O 0 +HETATM 5344 H1 HOH A1674 3.119 9.218 25.403 1.00 0.00 H 0 +HETATM 5345 H2 HOH A1674 3.125 8.103 26.344 1.00 0.00 H 0 +HETATM 5346 O HOH A1675 28.753 1.550 -0.129 1.00 0.00 O 0 +HETATM 5347 H1 HOH A1675 28.776 1.038 0.653 1.00 0.00 H 0 +HETATM 5348 H2 HOH A1675 28.487 2.423 0.213 1.00 0.00 H 0 +HETATM 5349 O HOH A1676 52.145 19.368 21.142 1.00 0.00 O 0 +HETATM 5350 H1 HOH A1676 52.386 19.720 21.960 1.00 0.00 H 0 +HETATM 5351 H2 HOH A1676 51.470 19.960 20.793 1.00 0.00 H 0 +HETATM 5352 O HOH A1677 4.418 28.189 46.399 1.00 0.00 O 0 +HETATM 5353 H1 HOH A1677 5.074 27.624 46.859 1.00 0.00 H 0 +HETATM 5354 H2 HOH A1677 3.823 28.397 47.221 1.00 0.00 H 0 +HETATM 5355 O HOH A1678 38.590 27.856 1.500 1.00 0.00 O 0 +HETATM 5356 H1 HOH A1678 38.404 27.300 0.713 1.00 0.00 H 0 +HETATM 5357 H2 HOH A1678 38.064 27.554 2.259 1.00 0.00 H 0 +HETATM 5358 O HOH A1679 26.921 48.144 16.310 1.00 0.00 O 0 +HETATM 5359 H1 HOH A1679 25.973 47.930 16.348 1.00 0.00 H 0 +HETATM 5360 H2 HOH A1679 27.171 47.894 15.456 1.00 0.00 H 0 +HETATM 5361 O HOH A1680 7.210 4.552 21.457 1.00 0.00 O 0 +HETATM 5362 H1 HOH A1680 7.751 4.766 20.675 1.00 0.00 H 0 +HETATM 5363 H2 HOH A1680 6.611 3.860 21.021 1.00 0.00 H 0 +HETATM 5364 O HOH A1681 26.265 20.334 16.427 1.00 0.00 O 0 +HETATM 5365 H1 HOH A1681 25.742 20.472 15.647 1.00 0.00 H 0 +HETATM 5366 H2 HOH A1681 25.604 20.212 17.088 1.00 0.00 H 0 +HETATM 5367 O HOH A1682 14.078 48.081 18.244 1.00 0.00 O 0 +HETATM 5368 H1 HOH A1682 13.741 48.493 18.995 1.00 0.00 H 0 +HETATM 5369 H2 HOH A1682 13.921 47.211 18.507 1.00 0.00 H 0 +HETATM 5370 O HOH A1683 -0.112 17.950 44.317 1.00 0.00 O 0 +HETATM 5371 H1 HOH A1683 0.554 18.412 43.834 1.00 0.00 H 0 +HETATM 5372 H2 HOH A1683 0.087 16.987 44.181 1.00 0.00 H 0 +HETATM 5373 O HOH A1684 37.152 12.524 24.153 1.00 0.00 O 0 +HETATM 5374 H1 HOH A1684 37.125 13.202 23.433 1.00 0.00 H 0 +HETATM 5375 H2 HOH A1684 37.631 11.751 23.673 1.00 0.00 H 0 +HETATM 5376 O HOH A1685 11.998 6.577 14.745 1.00 0.00 O 0 +HETATM 5377 H1 HOH A1685 12.474 7.422 14.809 1.00 0.00 H 0 +HETATM 5378 H2 HOH A1685 12.144 6.340 13.768 1.00 0.00 H 0 +HETATM 5379 O HOH A1686 20.593 35.924 10.002 1.00 0.00 O 0 +HETATM 5380 H1 HOH A1686 20.766 36.262 9.076 1.00 0.00 H 0 +HETATM 5381 H2 HOH A1686 20.497 34.966 9.971 1.00 0.00 H 0 +HETATM 5382 O HOH A1687 13.565 7.231 50.771 1.00 0.00 O 0 +HETATM 5383 H1 HOH A1687 13.320 7.705 51.592 1.00 0.00 H 0 +HETATM 5384 H2 HOH A1687 12.775 7.161 50.279 1.00 0.00 H 0 +HETATM 5385 O HOH A1688 9.733 33.488 17.014 1.00 0.00 O 0 +HETATM 5386 H1 HOH A1688 9.986 33.118 17.891 1.00 0.00 H 0 +HETATM 5387 H2 HOH A1688 9.088 32.898 16.616 1.00 0.00 H 0 +HETATM 5388 O HOH A1689 4.933 21.641 33.072 1.00 0.00 O 0 +HETATM 5389 H1 HOH A1689 4.912 21.949 32.133 1.00 0.00 H 0 +HETATM 5390 H2 HOH A1689 4.937 22.370 33.689 1.00 0.00 H 0 +HETATM 5391 O HOH A1690 1.849 13.782 28.398 1.00 0.00 O 0 +HETATM 5392 H1 HOH A1690 1.888 14.086 29.275 1.00 0.00 H 0 +HETATM 5393 H2 HOH A1690 1.048 14.073 28.050 1.00 0.00 H 0 +HETATM 5394 O HOH A1691 48.203 0.675 0.142 1.00 0.00 O 0 +HETATM 5395 H1 HOH A1691 48.189 -0.307 0.372 1.00 0.00 H 0 +HETATM 5396 H2 HOH A1691 48.455 1.200 0.920 1.00 0.00 H 0 +HETATM 5397 O HOH A1692 12.596 1.099 23.915 1.00 0.00 O 0 +HETATM 5398 H1 HOH A1692 11.896 0.556 23.699 1.00 0.00 H 0 +HETATM 5399 H2 HOH A1692 13.418 0.645 23.858 1.00 0.00 H 0 +HETATM 5400 O HOH A1693 0.716 26.504 25.979 1.00 0.00 O 0 +HETATM 5401 H1 HOH A1693 0.075 25.895 26.383 1.00 0.00 H 0 +HETATM 5402 H2 HOH A1693 0.338 27.355 26.210 1.00 0.00 H 0 +HETATM 5403 O HOH A1694 16.921 31.872 37.077 1.00 0.00 O 0 +HETATM 5404 H1 HOH A1694 17.720 31.493 36.725 1.00 0.00 H 0 +HETATM 5405 H2 HOH A1694 17.188 32.274 37.917 1.00 0.00 H 0 +HETATM 5406 O HOH A1695 2.218 3.240 27.600 1.00 0.00 O 0 +HETATM 5407 H1 HOH A1695 2.733 2.848 28.325 1.00 0.00 H 0 +HETATM 5408 H2 HOH A1695 1.295 3.016 27.685 1.00 0.00 H 0 +HETATM 5409 O HOH A1696 19.950 37.093 12.507 1.00 0.00 O 0 +HETATM 5410 H1 HOH A1696 19.079 36.731 12.585 1.00 0.00 H 0 +HETATM 5411 H2 HOH A1696 20.370 36.738 11.730 1.00 0.00 H 0 +HETATM 5412 O HOH A1697 23.547 28.549 13.615 1.00 0.00 O 0 +HETATM 5413 H1 HOH A1697 22.872 27.874 13.340 1.00 0.00 H 0 +HETATM 5414 H2 HOH A1697 23.862 28.976 12.786 1.00 0.00 H 0 +HETATM 5415 O HOH A1698 11.214 48.906 14.548 1.00 0.00 O 0 +HETATM 5416 H1 HOH A1698 10.667 48.159 14.819 1.00 0.00 H 0 +HETATM 5417 H2 HOH A1698 12.026 48.544 14.138 1.00 0.00 H 0 +HETATM 5418 O HOH A1699 5.604 5.061 9.004 1.00 0.00 O 0 +HETATM 5419 H1 HOH A1699 5.035 5.712 8.495 1.00 0.00 H 0 +HETATM 5420 H2 HOH A1699 5.609 4.210 8.617 1.00 0.00 H 0 +HETATM 5421 O HOH A1700 7.002 50.085 35.341 1.00 0.00 O 0 +HETATM 5422 H1 HOH A1700 7.778 49.553 35.584 1.00 0.00 H 0 +HETATM 5423 H2 HOH A1700 7.434 50.859 34.813 1.00 0.00 H 0 +HETATM 5424 O HOH A1701 39.045 42.161 7.389 1.00 0.00 O 0 +HETATM 5425 H1 HOH A1701 39.289 41.227 7.137 1.00 0.00 H 0 +HETATM 5426 H2 HOH A1701 39.762 42.574 6.926 1.00 0.00 H 0 +HETATM 5427 O HOH A1702 38.646 11.608 15.868 1.00 0.00 O 0 +HETATM 5428 H1 HOH A1702 39.251 11.531 16.666 1.00 0.00 H 0 +HETATM 5429 H2 HOH A1702 38.319 12.516 15.807 1.00 0.00 H 0 +HETATM 5430 O HOH A1703 43.323 5.275 26.474 1.00 0.00 O 0 +HETATM 5431 H1 HOH A1703 44.026 4.692 26.752 1.00 0.00 H 0 +HETATM 5432 H2 HOH A1703 42.566 4.747 26.096 1.00 0.00 H 0 +HETATM 5433 O HOH A1704 7.999 36.193 34.303 1.00 0.00 O 0 +HETATM 5434 H1 HOH A1704 8.951 35.912 34.341 1.00 0.00 H 0 +HETATM 5435 H2 HOH A1704 7.628 35.491 34.885 1.00 0.00 H 0 +HETATM 5436 O HOH A1705 24.278 34.914 27.626 1.00 0.00 O 0 +HETATM 5437 H1 HOH A1705 23.742 34.107 27.601 1.00 0.00 H 0 +HETATM 5438 H2 HOH A1705 23.586 35.552 27.653 1.00 0.00 H 0 +HETATM 5439 O HOH A1706 39.256 40.049 52.856 1.00 0.00 O 0 +HETATM 5440 H1 HOH A1706 39.756 39.669 53.605 1.00 0.00 H 0 +HETATM 5441 H2 HOH A1706 38.846 40.856 53.269 1.00 0.00 H 0 +HETATM 5442 O HOH A1707 53.519 18.387 47.316 1.00 0.00 O 0 +HETATM 5443 H1 HOH A1707 53.304 18.141 46.417 1.00 0.00 H 0 +HETATM 5444 H2 HOH A1707 53.818 17.554 47.717 1.00 0.00 H 0 +HETATM 5445 O HOH A1708 1.894 24.118 11.068 1.00 0.00 O 0 +HETATM 5446 H1 HOH A1708 2.809 23.984 10.755 1.00 0.00 H 0 +HETATM 5447 H2 HOH A1708 1.913 23.853 12.015 1.00 0.00 H 0 +HETATM 5448 O HOH A1709 53.727 16.526 12.603 1.00 0.00 O 0 +HETATM 5449 H1 HOH A1709 53.353 16.533 13.468 1.00 0.00 H 0 +HETATM 5450 H2 HOH A1709 53.361 15.766 12.091 1.00 0.00 H 0 +HETATM 5451 O HOH A1710 12.816 6.843 45.865 1.00 0.00 O 0 +HETATM 5452 H1 HOH A1710 12.312 7.636 46.001 1.00 0.00 H 0 +HETATM 5453 H2 HOH A1710 13.773 7.142 45.672 1.00 0.00 H 0 +HETATM 5454 O HOH A1711 52.400 50.900 15.511 1.00 0.00 O 0 +HETATM 5455 H1 HOH A1711 52.180 51.490 16.245 1.00 0.00 H 0 +HETATM 5456 H2 HOH A1711 53.016 50.319 15.988 1.00 0.00 H 0 +HETATM 5457 O HOH A1712 48.101 45.868 13.838 1.00 0.00 O 0 +HETATM 5458 H1 HOH A1712 47.528 46.189 14.580 1.00 0.00 H 0 +HETATM 5459 H2 HOH A1712 48.384 45.003 14.133 1.00 0.00 H 0 +HETATM 5460 O HOH A1713 23.821 16.895 27.192 1.00 0.00 O 0 +HETATM 5461 H1 HOH A1713 23.562 15.992 27.445 1.00 0.00 H 0 +HETATM 5462 H2 HOH A1713 24.440 17.260 27.821 1.00 0.00 H 0 +HETATM 5463 O HOH A1714 5.353 49.041 15.930 1.00 0.00 O 0 +HETATM 5464 H1 HOH A1714 5.218 50.013 16.076 1.00 0.00 H 0 +HETATM 5465 H2 HOH A1714 5.760 48.912 15.069 1.00 0.00 H 0 +HETATM 5466 O HOH A1715 51.294 42.081 22.706 1.00 0.00 O 0 +HETATM 5467 H1 HOH A1715 52.209 42.269 23.028 1.00 0.00 H 0 +HETATM 5468 H2 HOH A1715 50.828 42.852 22.894 1.00 0.00 H 0 +HETATM 5469 O HOH A1716 30.578 15.545 44.562 1.00 0.00 O 0 +HETATM 5470 H1 HOH A1716 30.707 16.362 44.004 1.00 0.00 H 0 +HETATM 5471 H2 HOH A1716 30.038 15.778 45.346 1.00 0.00 H 0 +HETATM 5472 O HOH A1717 41.834 22.475 42.462 1.00 0.00 O 0 +HETATM 5473 H1 HOH A1717 41.547 23.164 41.926 1.00 0.00 H 0 +HETATM 5474 H2 HOH A1717 41.184 21.800 42.294 1.00 0.00 H 0 +HETATM 5475 O HOH A1718 43.040 24.358 22.388 1.00 0.00 O 0 +HETATM 5476 H1 HOH A1718 43.184 25.239 22.011 1.00 0.00 H 0 +HETATM 5477 H2 HOH A1718 43.334 24.382 23.319 1.00 0.00 H 0 +HETATM 5478 O HOH A1719 36.715 23.079 15.351 1.00 0.00 O 0 +HETATM 5479 H1 HOH A1719 37.242 23.928 15.488 1.00 0.00 H 0 +HETATM 5480 H2 HOH A1719 36.955 22.836 14.450 1.00 0.00 H 0 +HETATM 5481 O HOH A1720 48.504 14.282 39.429 1.00 0.00 O 0 +HETATM 5482 H1 HOH A1720 47.938 15.046 39.661 1.00 0.00 H 0 +HETATM 5483 H2 HOH A1720 48.025 13.626 38.902 1.00 0.00 H 0 +HETATM 5484 O HOH A1721 31.749 18.625 47.621 1.00 0.00 O 0 +HETATM 5485 H1 HOH A1721 32.013 18.116 48.424 1.00 0.00 H 0 +HETATM 5486 H2 HOH A1721 31.346 17.889 47.101 1.00 0.00 H 0 +HETATM 5487 O HOH A1722 -0.080 43.910 33.822 1.00 0.00 O 0 +HETATM 5488 H1 HOH A1722 0.283 44.190 33.010 1.00 0.00 H 0 +HETATM 5489 H2 HOH A1722 0.441 43.148 34.083 1.00 0.00 H 0 +HETATM 5490 O HOH A1723 7.730 40.725 32.816 1.00 0.00 O 0 +HETATM 5491 H1 HOH A1723 7.795 41.657 32.657 1.00 0.00 H 0 +HETATM 5492 H2 HOH A1723 6.805 40.343 32.763 1.00 0.00 H 0 +HETATM 5493 O HOH A1724 32.024 43.184 33.799 1.00 0.00 O 0 +HETATM 5494 H1 HOH A1724 32.587 42.635 33.262 1.00 0.00 H 0 +HETATM 5495 H2 HOH A1724 32.058 42.882 34.716 1.00 0.00 H 0 +HETATM 5496 O HOH A1725 28.049 53.004 23.992 1.00 0.00 O 0 +HETATM 5497 H1 HOH A1725 27.384 53.136 23.356 1.00 0.00 H 0 +HETATM 5498 H2 HOH A1725 28.853 53.419 23.557 1.00 0.00 H 0 +HETATM 5499 O HOH A1726 31.020 6.783 33.150 1.00 0.00 O 0 +HETATM 5500 H1 HOH A1726 30.852 6.340 32.314 1.00 0.00 H 0 +HETATM 5501 H2 HOH A1726 31.995 6.791 33.190 1.00 0.00 H 0 +HETATM 5502 O HOH A1727 3.704 52.424 22.285 1.00 0.00 O 0 +HETATM 5503 H1 HOH A1727 4.578 52.699 21.975 1.00 0.00 H 0 +HETATM 5504 H2 HOH A1727 3.466 51.637 21.795 1.00 0.00 H 0 +HETATM 5505 O HOH A1728 3.358 40.313 44.377 1.00 0.00 O 0 +HETATM 5506 H1 HOH A1728 4.084 40.444 45.029 1.00 0.00 H 0 +HETATM 5507 H2 HOH A1728 3.378 39.372 44.184 1.00 0.00 H 0 +HETATM 5508 O HOH A1729 12.615 46.428 52.070 1.00 0.00 O 0 +HETATM 5509 H1 HOH A1729 13.362 45.930 52.413 1.00 0.00 H 0 +HETATM 5510 H2 HOH A1729 11.915 45.809 52.243 1.00 0.00 H 0 +HETATM 5511 O HOH A1730 13.554 14.772 38.658 1.00 0.00 O 0 +HETATM 5512 H1 HOH A1730 13.558 14.660 39.635 1.00 0.00 H 0 +HETATM 5513 H2 HOH A1730 12.800 14.306 38.308 1.00 0.00 H 0 +HETATM 5514 O HOH A1731 17.535 22.755 15.615 1.00 0.00 O 0 +HETATM 5515 H1 HOH A1731 17.052 22.316 16.286 1.00 0.00 H 0 +HETATM 5516 H2 HOH A1731 18.026 22.084 15.119 1.00 0.00 H 0 +HETATM 5517 O HOH A1732 13.526 37.714 8.657 1.00 0.00 O 0 +HETATM 5518 H1 HOH A1732 13.284 36.817 8.794 1.00 0.00 H 0 +HETATM 5519 H2 HOH A1732 14.049 37.734 7.819 1.00 0.00 H 0 +HETATM 5520 O HOH A1733 9.753 25.349 3.117 1.00 0.00 O 0 +HETATM 5521 H1 HOH A1733 8.964 24.884 2.858 1.00 0.00 H 0 +HETATM 5522 H2 HOH A1733 9.627 26.292 2.854 1.00 0.00 H 0 +HETATM 5523 O HOH A1734 24.211 39.382 7.738 1.00 0.00 O 0 +HETATM 5524 H1 HOH A1734 25.042 39.868 7.953 1.00 0.00 H 0 +HETATM 5525 H2 HOH A1734 24.398 38.420 8.004 1.00 0.00 H 0 +HETATM 5526 O HOH A1735 45.003 1.132 38.880 1.00 0.00 O 0 +HETATM 5527 H1 HOH A1735 44.267 0.575 39.062 1.00 0.00 H 0 +HETATM 5528 H2 HOH A1735 45.510 1.248 39.670 1.00 0.00 H 0 +HETATM 5529 O HOH A1736 35.656 51.705 43.007 1.00 0.00 O 0 +HETATM 5530 H1 HOH A1736 36.249 51.013 42.833 1.00 0.00 H 0 +HETATM 5531 H2 HOH A1736 34.832 51.224 43.109 1.00 0.00 H 0 +HETATM 5532 O HOH A1737 13.094 30.756 46.882 1.00 0.00 O 0 +HETATM 5533 H1 HOH A1737 12.577 30.302 47.545 1.00 0.00 H 0 +HETATM 5534 H2 HOH A1737 12.985 30.348 45.942 1.00 0.00 H 0 +HETATM 5535 O HOH A1738 2.198 51.571 50.385 1.00 0.00 O 0 +HETATM 5536 H1 HOH A1738 2.484 51.372 49.517 1.00 0.00 H 0 +HETATM 5537 H2 HOH A1738 2.859 52.181 50.794 1.00 0.00 H 0 +HETATM 5538 O HOH A1739 36.335 32.542 44.057 1.00 0.00 O 0 +HETATM 5539 H1 HOH A1739 37.296 32.315 44.209 1.00 0.00 H 0 +HETATM 5540 H2 HOH A1739 36.157 32.582 43.129 1.00 0.00 H 0 +HETATM 5541 O HOH A1740 31.835 11.412 47.739 1.00 0.00 O 0 +HETATM 5542 H1 HOH A1740 31.180 10.739 47.591 1.00 0.00 H 0 +HETATM 5543 H2 HOH A1740 32.538 10.985 47.187 1.00 0.00 H 0 +HETATM 5544 O HOH A1741 28.419 30.291 34.875 1.00 0.00 O 0 +HETATM 5545 H1 HOH A1741 28.686 30.425 33.945 1.00 0.00 H 0 +HETATM 5546 H2 HOH A1741 28.860 31.013 35.290 1.00 0.00 H 0 +HETATM 5547 O HOH A1742 6.698 30.810 26.142 1.00 0.00 O 0 +HETATM 5548 H1 HOH A1742 5.972 31.059 25.568 1.00 0.00 H 0 +HETATM 5549 H2 HOH A1742 6.860 31.446 26.766 1.00 0.00 H 0 +HETATM 5550 O HOH A1743 29.343 39.541 49.380 1.00 0.00 O 0 +HETATM 5551 H1 HOH A1743 29.744 40.385 49.103 1.00 0.00 H 0 +HETATM 5552 H2 HOH A1743 29.721 39.435 50.317 1.00 0.00 H 0 +HETATM 5553 O HOH A1744 27.241 41.792 37.843 1.00 0.00 O 0 +HETATM 5554 H1 HOH A1744 27.612 42.666 37.775 1.00 0.00 H 0 +HETATM 5555 H2 HOH A1744 26.864 41.622 38.743 1.00 0.00 H 0 +HETATM 5556 O HOH A1745 11.561 50.081 5.365 1.00 0.00 O 0 +HETATM 5557 H1 HOH A1745 11.148 50.636 4.659 1.00 0.00 H 0 +HETATM 5558 H2 HOH A1745 11.636 49.271 4.953 1.00 0.00 H 0 +HETATM 5559 O HOH A1746 12.580 26.833 3.973 1.00 0.00 O 0 +HETATM 5560 H1 HOH A1746 12.050 27.473 4.474 1.00 0.00 H 0 +HETATM 5561 H2 HOH A1746 12.579 27.315 3.177 1.00 0.00 H 0 +HETATM 5562 O HOH A1747 23.323 21.210 44.640 1.00 0.00 O 0 +HETATM 5563 H1 HOH A1747 22.861 21.580 45.465 1.00 0.00 H 0 +HETATM 5564 H2 HOH A1747 23.037 21.747 43.860 1.00 0.00 H 0 +HETATM 5565 O HOH A1748 35.789 6.005 34.268 1.00 0.00 O 0 +HETATM 5566 H1 HOH A1748 35.343 5.800 35.049 1.00 0.00 H 0 +HETATM 5567 H2 HOH A1748 35.130 6.504 33.738 1.00 0.00 H 0 +HETATM 5568 O HOH A1749 38.669 38.461 14.380 1.00 0.00 O 0 +HETATM 5569 H1 HOH A1749 38.968 39.249 14.886 1.00 0.00 H 0 +HETATM 5570 H2 HOH A1749 38.934 38.755 13.499 1.00 0.00 H 0 +HETATM 5571 O HOH A1750 13.734 14.729 41.426 1.00 0.00 O 0 +HETATM 5572 H1 HOH A1750 14.522 14.716 41.984 1.00 0.00 H 0 +HETATM 5573 H2 HOH A1750 12.981 15.067 41.919 1.00 0.00 H 0 +HETATM 5574 O HOH A1751 47.773 23.422 48.650 1.00 0.00 O 0 +HETATM 5575 H1 HOH A1751 47.766 22.898 49.421 1.00 0.00 H 0 +HETATM 5576 H2 HOH A1751 47.557 22.911 47.866 1.00 0.00 H 0 +HETATM 5577 O HOH A1752 7.203 32.759 48.349 1.00 0.00 O 0 +HETATM 5578 H1 HOH A1752 6.998 32.920 47.408 1.00 0.00 H 0 +HETATM 5579 H2 HOH A1752 8.110 33.054 48.545 1.00 0.00 H 0 +HETATM 5580 O HOH A1753 4.759 12.587 31.195 1.00 0.00 O 0 +HETATM 5581 H1 HOH A1753 4.689 11.803 30.643 1.00 0.00 H 0 +HETATM 5582 H2 HOH A1753 5.701 12.507 31.507 1.00 0.00 H 0 +HETATM 5583 O HOH A1754 35.200 6.377 30.073 1.00 0.00 O 0 +HETATM 5584 H1 HOH A1754 35.869 7.066 30.071 1.00 0.00 H 0 +HETATM 5585 H2 HOH A1754 35.624 5.518 29.968 1.00 0.00 H 0 +HETATM 5586 O HOH A1755 46.012 41.193 5.704 1.00 0.00 O 0 +HETATM 5587 H1 HOH A1755 45.857 41.734 4.901 1.00 0.00 H 0 +HETATM 5588 H2 HOH A1755 45.207 41.301 6.237 1.00 0.00 H 0 +HETATM 5589 O HOH A1756 35.740 38.793 42.207 1.00 0.00 O 0 +HETATM 5590 H1 HOH A1756 35.392 38.067 41.584 1.00 0.00 H 0 +HETATM 5591 H2 HOH A1756 36.047 39.479 41.647 1.00 0.00 H 0 +HETATM 5592 O HOH A1757 23.444 40.421 27.267 1.00 0.00 O 0 +HETATM 5593 H1 HOH A1757 23.819 39.700 27.797 1.00 0.00 H 0 +HETATM 5594 H2 HOH A1757 22.536 40.140 27.078 1.00 0.00 H 0 +HETATM 5595 O HOH A1758 4.317 46.359 29.821 1.00 0.00 O 0 +HETATM 5596 H1 HOH A1758 3.907 46.046 29.088 1.00 0.00 H 0 +HETATM 5597 H2 HOH A1758 3.692 46.217 30.457 1.00 0.00 H 0 +HETATM 5598 O HOH A1759 24.788 35.856 51.435 1.00 0.00 O 0 +HETATM 5599 H1 HOH A1759 25.515 35.708 50.788 1.00 0.00 H 0 +HETATM 5600 H2 HOH A1759 24.315 36.623 51.055 1.00 0.00 H 0 +HETATM 5601 O HOH A1760 35.034 31.139 1.942 1.00 0.00 O 0 +HETATM 5602 H1 HOH A1760 35.822 30.612 1.941 1.00 0.00 H 0 +HETATM 5603 H2 HOH A1760 34.683 31.120 2.785 1.00 0.00 H 0 +HETATM 5604 O HOH A1761 20.579 18.278 14.100 1.00 0.00 O 0 +HETATM 5605 H1 HOH A1761 20.083 18.290 13.231 1.00 0.00 H 0 +HETATM 5606 H2 HOH A1761 19.949 17.967 14.744 1.00 0.00 H 0 +HETATM 5607 O HOH A1762 43.555 53.359 18.530 1.00 0.00 O 0 +HETATM 5608 H1 HOH A1762 43.079 52.546 18.636 1.00 0.00 H 0 +HETATM 5609 H2 HOH A1762 43.810 53.425 17.612 1.00 0.00 H 0 +HETATM 5610 O HOH A1763 50.525 17.280 21.592 1.00 0.00 O 0 +HETATM 5611 H1 HOH A1763 49.783 17.406 21.059 1.00 0.00 H 0 +HETATM 5612 H2 HOH A1763 51.151 17.959 21.385 1.00 0.00 H 0 +HETATM 5613 O HOH A1764 1.719 13.589 7.696 1.00 0.00 O 0 +HETATM 5614 H1 HOH A1764 0.965 14.022 7.223 1.00 0.00 H 0 +HETATM 5615 H2 HOH A1764 2.335 13.184 7.034 1.00 0.00 H 0 +HETATM 5616 O HOH A1765 41.860 33.974 35.902 1.00 0.00 O 0 +HETATM 5617 H1 HOH A1765 41.881 34.900 36.140 1.00 0.00 H 0 +HETATM 5618 H2 HOH A1765 41.049 33.832 35.578 1.00 0.00 H 0 +HETATM 5619 O HOH A1766 11.830 25.418 16.004 1.00 0.00 O 0 +HETATM 5620 H1 HOH A1766 11.426 25.882 16.738 1.00 0.00 H 0 +HETATM 5621 H2 HOH A1766 11.906 26.005 15.245 1.00 0.00 H 0 +HETATM 5622 O HOH A1767 35.588 33.763 33.454 1.00 0.00 O 0 +HETATM 5623 H1 HOH A1767 35.738 32.889 33.774 1.00 0.00 H 0 +HETATM 5624 H2 HOH A1767 36.217 34.348 33.945 1.00 0.00 H 0 +HETATM 5625 O HOH A1768 7.344 11.612 44.884 1.00 0.00 O 0 +HETATM 5626 H1 HOH A1768 7.600 12.261 45.600 1.00 0.00 H 0 +HETATM 5627 H2 HOH A1768 6.452 11.394 44.914 1.00 0.00 H 0 +HETATM 5628 O HOH A1769 50.981 35.222 53.773 1.00 0.00 O 0 +HETATM 5629 H1 HOH A1769 51.011 34.358 53.421 1.00 0.00 H 0 +HETATM 5630 H2 HOH A1769 51.235 35.830 53.057 1.00 0.00 H 0 +HETATM 5631 O HOH A1770 25.980 28.682 4.634 1.00 0.00 O 0 +HETATM 5632 H1 HOH A1770 26.128 27.737 4.763 1.00 0.00 H 0 +HETATM 5633 H2 HOH A1770 25.098 28.738 4.989 1.00 0.00 H 0 +HETATM 5634 O HOH A1771 28.667 6.453 29.013 1.00 0.00 O 0 +HETATM 5635 H1 HOH A1771 27.943 5.814 29.112 1.00 0.00 H 0 +HETATM 5636 H2 HOH A1771 29.201 6.429 29.804 1.00 0.00 H 0 +HETATM 5637 O HOH A1772 48.093 8.718 50.715 1.00 0.00 O 0 +HETATM 5638 H1 HOH A1772 47.931 9.033 49.796 1.00 0.00 H 0 +HETATM 5639 H2 HOH A1772 48.136 9.481 51.275 1.00 0.00 H 0 +HETATM 5640 O HOH A1773 3.222 22.598 16.050 1.00 0.00 O 0 +HETATM 5641 H1 HOH A1773 2.340 22.400 15.734 1.00 0.00 H 0 +HETATM 5642 H2 HOH A1773 3.876 22.293 15.415 1.00 0.00 H 0 +HETATM 5643 O HOH A1774 14.249 23.894 15.897 1.00 0.00 O 0 +HETATM 5644 H1 HOH A1774 13.432 24.380 15.990 1.00 0.00 H 0 +HETATM 5645 H2 HOH A1774 14.584 23.609 16.802 1.00 0.00 H 0 +HETATM 5646 O HOH A1775 0.629 26.212 0.718 1.00 0.00 O 0 +HETATM 5647 H1 HOH A1775 -0.370 26.352 0.612 1.00 0.00 H 0 +HETATM 5648 H2 HOH A1775 0.987 26.741 1.500 1.00 0.00 H 0 +HETATM 5649 O HOH A1776 0.737 1.102 34.400 1.00 0.00 O 0 +HETATM 5650 H1 HOH A1776 0.061 0.899 33.733 1.00 0.00 H 0 +HETATM 5651 H2 HOH A1776 0.615 2.042 34.555 1.00 0.00 H 0 +HETATM 5652 O HOH A1777 29.427 41.289 4.314 1.00 0.00 O 0 +HETATM 5653 H1 HOH A1777 29.219 42.148 4.091 1.00 0.00 H 0 +HETATM 5654 H2 HOH A1777 30.245 41.050 3.722 1.00 0.00 H 0 +HETATM 5655 O HOH A1778 42.912 29.810 21.619 1.00 0.00 O 0 +HETATM 5656 H1 HOH A1778 43.758 30.328 21.419 1.00 0.00 H 0 +HETATM 5657 H2 HOH A1778 42.192 30.319 21.248 1.00 0.00 H 0 +HETATM 5658 O HOH A1779 11.525 14.367 10.537 1.00 0.00 O 0 +HETATM 5659 H1 HOH A1779 11.865 13.496 10.393 1.00 0.00 H 0 +HETATM 5660 H2 HOH A1779 12.139 14.957 10.927 1.00 0.00 H 0 +HETATM 5661 O HOH A1780 6.046 35.935 45.367 1.00 0.00 O 0 +HETATM 5662 H1 HOH A1780 5.401 36.224 46.034 1.00 0.00 H 0 +HETATM 5663 H2 HOH A1780 6.180 36.544 44.653 1.00 0.00 H 0 +HETATM 5664 O HOH A1781 9.849 4.334 1.163 1.00 0.00 O 0 +HETATM 5665 H1 HOH A1781 8.861 4.160 1.023 1.00 0.00 H 0 +HETATM 5666 H2 HOH A1781 10.246 4.514 0.219 1.00 0.00 H 0 +HETATM 5667 O HOH A1782 12.582 23.866 4.461 1.00 0.00 O 0 +HETATM 5668 H1 HOH A1782 12.789 24.011 3.490 1.00 0.00 H 0 +HETATM 5669 H2 HOH A1782 12.655 24.787 4.748 1.00 0.00 H 0 +HETATM 5670 O HOH A1783 15.058 9.799 40.954 1.00 0.00 O 0 +HETATM 5671 H1 HOH A1783 14.285 10.429 40.751 1.00 0.00 H 0 +HETATM 5672 H2 HOH A1783 15.431 9.642 40.000 1.00 0.00 H 0 +HETATM 5673 O HOH A1784 43.938 19.775 33.004 1.00 0.00 O 0 +HETATM 5674 H1 HOH A1784 44.693 19.427 32.572 1.00 0.00 H 0 +HETATM 5675 H2 HOH A1784 43.810 19.247 33.750 1.00 0.00 H 0 +HETATM 5676 O HOH A1785 0.694 4.845 49.219 1.00 0.00 O 0 +HETATM 5677 H1 HOH A1785 -0.039 5.451 49.175 1.00 0.00 H 0 +HETATM 5678 H2 HOH A1785 0.699 4.252 48.477 1.00 0.00 H 0 +HETATM 5679 O HOH A1786 25.660 24.407 52.399 1.00 0.00 O 0 +HETATM 5680 H1 HOH A1786 24.776 24.705 52.185 1.00 0.00 H 0 +HETATM 5681 H2 HOH A1786 25.558 23.415 52.412 1.00 0.00 H 0 +HETATM 5682 O HOH A1787 38.984 22.846 34.610 1.00 0.00 O 0 +HETATM 5683 H1 HOH A1787 39.899 23.160 34.681 1.00 0.00 H 0 +HETATM 5684 H2 HOH A1787 38.555 23.554 34.097 1.00 0.00 H 0 +HETATM 5685 O HOH A1788 35.320 25.731 2.446 1.00 0.00 O 0 +HETATM 5686 H1 HOH A1788 35.534 25.068 1.804 1.00 0.00 H 0 +HETATM 5687 H2 HOH A1788 35.062 26.622 2.116 1.00 0.00 H 0 +HETATM 5688 O HOH A1789 12.656 24.389 12.877 1.00 0.00 O 0 +HETATM 5689 H1 HOH A1789 12.308 25.298 12.878 1.00 0.00 H 0 +HETATM 5690 H2 HOH A1789 13.267 24.367 13.655 1.00 0.00 H 0 +HETATM 5691 O HOH A1790 16.425 33.741 32.229 1.00 0.00 O 0 +HETATM 5692 H1 HOH A1790 15.589 33.501 32.678 1.00 0.00 H 0 +HETATM 5693 H2 HOH A1790 17.286 33.552 32.733 1.00 0.00 H 0 +HETATM 5694 O HOH A1791 27.763 18.426 52.078 1.00 0.00 O 0 +HETATM 5695 H1 HOH A1791 27.961 19.258 51.498 1.00 0.00 H 0 +HETATM 5696 H2 HOH A1791 26.857 18.540 52.395 1.00 0.00 H 0 +HETATM 5697 O HOH A1792 7.079 51.966 0.773 1.00 0.00 O 0 +HETATM 5698 H1 HOH A1792 7.709 51.215 0.730 1.00 0.00 H 0 +HETATM 5699 H2 HOH A1792 7.628 52.553 1.307 1.00 0.00 H 0 +HETATM 5700 O HOH A1793 51.350 16.478 35.863 1.00 0.00 O 0 +HETATM 5701 H1 HOH A1793 50.749 15.744 36.224 1.00 0.00 H 0 +HETATM 5702 H2 HOH A1793 52.042 15.990 35.493 1.00 0.00 H 0 +HETATM 5703 O HOH A1794 34.188 48.869 4.671 1.00 0.00 O 0 +HETATM 5704 H1 HOH A1794 35.198 48.910 4.642 1.00 0.00 H 0 +HETATM 5705 H2 HOH A1794 34.001 48.370 5.525 1.00 0.00 H 0 +HETATM 5706 O HOH A1795 25.479 31.225 39.795 1.00 0.00 O 0 +HETATM 5707 H1 HOH A1795 25.462 31.015 38.902 1.00 0.00 H 0 +HETATM 5708 H2 HOH A1795 25.217 30.456 40.344 1.00 0.00 H 0 +HETATM 5709 O HOH A1796 51.478 53.489 21.062 1.00 0.00 O 0 +HETATM 5710 H1 HOH A1796 50.917 52.756 21.047 1.00 0.00 H 0 +HETATM 5711 H2 HOH A1796 52.356 53.133 21.114 1.00 0.00 H 0 +HETATM 5712 O HOH A1797 6.600 34.575 31.915 1.00 0.00 O 0 +HETATM 5713 H1 HOH A1797 7.496 34.204 31.562 1.00 0.00 H 0 +HETATM 5714 H2 HOH A1797 6.756 35.548 31.952 1.00 0.00 H 0 +HETATM 5715 O HOH A1798 53.360 49.380 26.862 1.00 0.00 O 0 +HETATM 5716 H1 HOH A1798 53.172 50.117 27.520 1.00 0.00 H 0 +HETATM 5717 H2 HOH A1798 52.950 48.529 27.186 1.00 0.00 H 0 +HETATM 5718 O HOH A1799 39.578 32.900 29.873 1.00 0.00 O 0 +HETATM 5719 H1 HOH A1799 40.460 32.576 29.749 1.00 0.00 H 0 +HETATM 5720 H2 HOH A1799 39.518 33.283 30.796 1.00 0.00 H 0 +HETATM 5721 O HOH A1800 8.229 22.009 9.473 1.00 0.00 O 0 +HETATM 5722 H1 HOH A1800 8.092 22.909 9.218 1.00 0.00 H 0 +HETATM 5723 H2 HOH A1800 8.331 21.525 8.589 1.00 0.00 H 0 +HETATM 5724 O HOH A1801 36.759 26.385 42.969 1.00 0.00 O 0 +HETATM 5725 H1 HOH A1801 37.121 26.442 42.096 1.00 0.00 H 0 +HETATM 5726 H2 HOH A1801 37.383 26.948 43.466 1.00 0.00 H 0 +HETATM 5727 O HOH A1802 41.111 33.423 12.611 1.00 0.00 O 0 +HETATM 5728 H1 HOH A1802 40.786 33.693 13.497 1.00 0.00 H 0 +HETATM 5729 H2 HOH A1802 40.634 33.991 11.998 1.00 0.00 H 0 +HETATM 5730 O HOH A1803 39.890 5.040 2.975 1.00 0.00 O 0 +HETATM 5731 H1 HOH A1803 39.332 5.144 3.765 1.00 0.00 H 0 +HETATM 5732 H2 HOH A1803 40.278 4.197 3.199 1.00 0.00 H 0 +HETATM 5733 O HOH A1804 23.828 16.698 20.216 1.00 0.00 O 0 +HETATM 5734 H1 HOH A1804 24.465 16.824 19.484 1.00 0.00 H 0 +HETATM 5735 H2 HOH A1804 23.038 16.213 19.865 1.00 0.00 H 0 +HETATM 5736 O HOH A1805 12.374 21.642 22.975 1.00 0.00 O 0 +HETATM 5737 H1 HOH A1805 12.137 21.992 23.828 1.00 0.00 H 0 +HETATM 5738 H2 HOH A1805 13.318 21.641 22.805 1.00 0.00 H 0 +HETATM 5739 O HOH A1806 38.512 24.116 47.021 1.00 0.00 O 0 +HETATM 5740 H1 HOH A1806 38.871 23.779 47.795 1.00 0.00 H 0 +HETATM 5741 H2 HOH A1806 38.746 23.405 46.366 1.00 0.00 H 0 +HETATM 5742 O HOH A1807 40.884 39.377 48.108 1.00 0.00 O 0 +HETATM 5743 H1 HOH A1807 40.140 39.357 48.870 1.00 0.00 H 0 +HETATM 5744 H2 HOH A1807 40.655 40.152 47.666 1.00 0.00 H 0 +HETATM 5745 O HOH A1808 15.327 45.968 31.536 1.00 0.00 O 0 +HETATM 5746 H1 HOH A1808 14.782 46.188 30.756 1.00 0.00 H 0 +HETATM 5747 H2 HOH A1808 16.254 45.843 31.268 1.00 0.00 H 0 +HETATM 5748 O HOH A1809 12.604 6.330 11.850 1.00 0.00 O 0 +HETATM 5749 H1 HOH A1809 12.749 7.299 11.787 1.00 0.00 H 0 +HETATM 5750 H2 HOH A1809 13.184 6.021 11.164 1.00 0.00 H 0 +HETATM 5751 O HOH A1810 11.838 31.281 26.469 1.00 0.00 O 0 +HETATM 5752 H1 HOH A1810 12.333 31.773 25.834 1.00 0.00 H 0 +HETATM 5753 H2 HOH A1810 12.472 30.704 26.895 1.00 0.00 H 0 +HETATM 5754 O HOH A1811 36.789 37.280 39.128 1.00 0.00 O 0 +HETATM 5755 H1 HOH A1811 37.601 37.613 39.465 1.00 0.00 H 0 +HETATM 5756 H2 HOH A1811 36.571 36.657 39.851 1.00 0.00 H 0 +HETATM 5757 O HOH A1812 14.461 46.738 41.706 1.00 0.00 O 0 +HETATM 5758 H1 HOH A1812 13.978 46.657 42.578 1.00 0.00 H 0 +HETATM 5759 H2 HOH A1812 14.882 47.592 41.664 1.00 0.00 H 0 +HETATM 5760 O HOH A1813 22.575 52.411 48.401 1.00 0.00 O 0 +HETATM 5761 H1 HOH A1813 22.940 52.789 47.648 1.00 0.00 H 0 +HETATM 5762 H2 HOH A1813 22.655 52.996 49.140 1.00 0.00 H 0 +HETATM 5763 O HOH A1814 52.474 14.249 28.654 1.00 0.00 O 0 +HETATM 5764 H1 HOH A1814 51.657 13.761 28.533 1.00 0.00 H 0 +HETATM 5765 H2 HOH A1814 53.000 13.922 29.341 1.00 0.00 H 0 +HETATM 5766 O HOH A1815 6.209 32.530 6.678 1.00 0.00 O 0 +HETATM 5767 H1 HOH A1815 6.116 33.410 6.274 1.00 0.00 H 0 +HETATM 5768 H2 HOH A1815 5.580 32.490 7.439 1.00 0.00 H 0 +HETATM 5769 O HOH A1816 11.818 46.976 40.426 1.00 0.00 O 0 +HETATM 5770 H1 HOH A1816 12.649 46.496 40.696 1.00 0.00 H 0 +HETATM 5771 H2 HOH A1816 11.200 46.268 40.162 1.00 0.00 H 0 +HETATM 5772 O HOH A1817 20.071 36.198 22.870 1.00 0.00 O 0 +HETATM 5773 H1 HOH A1817 20.615 36.173 22.086 1.00 0.00 H 0 +HETATM 5774 H2 HOH A1817 19.187 36.467 22.594 1.00 0.00 H 0 +HETATM 5775 O HOH A1818 36.387 38.282 9.632 1.00 0.00 O 0 +HETATM 5776 H1 HOH A1818 36.593 37.456 9.127 1.00 0.00 H 0 +HETATM 5777 H2 HOH A1818 35.516 38.156 10.098 1.00 0.00 H 0 +HETATM 5778 O HOH A1819 30.616 39.713 35.555 1.00 0.00 O 0 +HETATM 5779 H1 HOH A1819 30.842 38.753 35.409 1.00 0.00 H 0 +HETATM 5780 H2 HOH A1819 29.652 39.805 35.545 1.00 0.00 H 0 +HETATM 5781 O HOH A1820 24.783 33.420 49.352 1.00 0.00 O 0 +HETATM 5782 H1 HOH A1820 24.876 32.885 50.157 1.00 0.00 H 0 +HETATM 5783 H2 HOH A1820 25.680 33.761 49.110 1.00 0.00 H 0 +HETATM 5784 O HOH A1821 23.612 35.394 10.668 1.00 0.00 O 0 +HETATM 5785 H1 HOH A1821 23.752 34.496 10.990 1.00 0.00 H 0 +HETATM 5786 H2 HOH A1821 22.923 35.303 10.005 1.00 0.00 H 0 +HETATM 5787 O HOH A1822 24.299 20.494 19.580 1.00 0.00 O 0 +HETATM 5788 H1 HOH A1822 23.816 19.698 19.321 1.00 0.00 H 0 +HETATM 5789 H2 HOH A1822 23.601 21.196 19.398 1.00 0.00 H 0 +HETATM 5790 O HOH A1823 49.179 27.895 25.580 1.00 0.00 O 0 +HETATM 5791 H1 HOH A1823 49.355 27.292 26.322 1.00 0.00 H 0 +HETATM 5792 H2 HOH A1823 49.690 27.590 24.788 1.00 0.00 H 0 +HETATM 5793 O HOH A1824 51.030 0.576 25.763 1.00 0.00 O 0 +HETATM 5794 H1 HOH A1824 51.898 0.214 25.733 1.00 0.00 H 0 +HETATM 5795 H2 HOH A1824 50.572 0.049 25.102 1.00 0.00 H 0 +HETATM 5796 O HOH A1825 51.498 0.564 2.383 1.00 0.00 O 0 +HETATM 5797 H1 HOH A1825 50.787 1.060 1.956 1.00 0.00 H 0 +HETATM 5798 H2 HOH A1825 51.196 0.788 3.253 1.00 0.00 H 0 +HETATM 5799 O HOH A1826 35.666 1.526 45.473 1.00 0.00 O 0 +HETATM 5800 H1 HOH A1826 36.360 1.666 46.080 1.00 0.00 H 0 +HETATM 5801 H2 HOH A1826 35.016 0.830 45.771 1.00 0.00 H 0 +HETATM 5802 O HOH A1827 32.616 15.526 0.979 1.00 0.00 O 0 +HETATM 5803 H1 HOH A1827 32.695 15.519 0.039 1.00 0.00 H 0 +HETATM 5804 H2 HOH A1827 33.447 15.961 1.324 1.00 0.00 H 0 +HETATM 5805 O HOH A1828 17.093 27.983 3.136 1.00 0.00 O 0 +HETATM 5806 H1 HOH A1828 17.339 28.840 3.539 1.00 0.00 H 0 +HETATM 5807 H2 HOH A1828 17.857 27.572 2.710 1.00 0.00 H 0 +HETATM 5808 O HOH A1829 36.599 48.602 5.698 1.00 0.00 O 0 +HETATM 5809 H1 HOH A1829 36.879 47.664 5.854 1.00 0.00 H 0 +HETATM 5810 H2 HOH A1829 37.053 49.017 6.431 1.00 0.00 H 0 +HETATM 5811 O HOH A1830 7.319 9.557 16.286 1.00 0.00 O 0 +HETATM 5812 H1 HOH A1830 8.238 9.446 16.729 1.00 0.00 H 0 +HETATM 5813 H2 HOH A1830 7.320 9.886 15.396 1.00 0.00 H 0 +HETATM 5814 O HOH A1831 39.324 29.092 41.455 1.00 0.00 O 0 +HETATM 5815 H1 HOH A1831 39.218 29.111 40.539 1.00 0.00 H 0 +HETATM 5816 H2 HOH A1831 38.828 29.868 41.652 1.00 0.00 H 0 +HETATM 5817 O HOH A1832 23.071 25.233 37.198 1.00 0.00 O 0 +HETATM 5818 H1 HOH A1832 22.687 24.638 36.492 1.00 0.00 H 0 +HETATM 5819 H2 HOH A1832 22.391 25.320 37.891 1.00 0.00 H 0 +HETATM 5820 O HOH A1833 5.283 25.661 27.174 1.00 0.00 O 0 +HETATM 5821 H1 HOH A1833 4.570 24.981 27.187 1.00 0.00 H 0 +HETATM 5822 H2 HOH A1833 6.135 25.274 26.984 1.00 0.00 H 0 +HETATM 5823 O HOH A1834 8.929 17.190 4.454 1.00 0.00 O 0 +HETATM 5824 H1 HOH A1834 8.159 16.561 4.401 1.00 0.00 H 0 +HETATM 5825 H2 HOH A1834 8.702 17.578 5.282 1.00 0.00 H 0 +HETATM 5826 O HOH A1835 48.692 38.760 21.776 1.00 0.00 O 0 +HETATM 5827 H1 HOH A1835 48.578 38.993 20.818 1.00 0.00 H 0 +HETATM 5828 H2 HOH A1835 49.379 38.097 21.831 1.00 0.00 H 0 +HETATM 5829 O HOH A1836 32.618 30.861 0.218 1.00 0.00 O 0 +HETATM 5830 H1 HOH A1836 32.665 30.541 -0.678 1.00 0.00 H 0 +HETATM 5831 H2 HOH A1836 33.519 30.731 0.638 1.00 0.00 H 0 +HETATM 5832 O HOH A1837 20.786 43.765 1.019 1.00 0.00 O 0 +HETATM 5833 H1 HOH A1837 21.429 42.997 0.862 1.00 0.00 H 0 +HETATM 5834 H2 HOH A1837 21.215 44.545 0.571 1.00 0.00 H 0 +HETATM 5835 O HOH A1838 41.223 30.306 16.137 1.00 0.00 O 0 +HETATM 5836 H1 HOH A1838 41.634 30.352 15.262 1.00 0.00 H 0 +HETATM 5837 H2 HOH A1838 41.975 30.029 16.819 1.00 0.00 H 0 +HETATM 5838 O HOH A1839 6.309 23.178 20.655 1.00 0.00 O 0 +HETATM 5839 H1 HOH A1839 6.085 22.544 21.412 1.00 0.00 H 0 +HETATM 5840 H2 HOH A1839 6.445 24.079 21.109 1.00 0.00 H 0 +HETATM 5841 O HOH A1840 45.587 41.634 21.162 1.00 0.00 O 0 +HETATM 5842 H1 HOH A1840 44.935 42.380 20.983 1.00 0.00 H 0 +HETATM 5843 H2 HOH A1840 46.411 41.970 21.500 1.00 0.00 H 0 +HETATM 5844 O HOH A1841 49.184 29.007 16.223 1.00 0.00 O 0 +HETATM 5845 H1 HOH A1841 48.358 28.767 15.831 1.00 0.00 H 0 +HETATM 5846 H2 HOH A1841 48.867 29.763 16.850 1.00 0.00 H 0 +HETATM 5847 O HOH A1842 39.736 4.063 33.441 1.00 0.00 O 0 +HETATM 5848 H1 HOH A1842 39.630 4.930 33.003 1.00 0.00 H 0 +HETATM 5849 H2 HOH A1842 40.627 4.103 33.704 1.00 0.00 H 0 +HETATM 5850 O HOH A1843 10.267 26.119 44.315 1.00 0.00 O 0 +HETATM 5851 H1 HOH A1843 10.128 27.033 43.980 1.00 0.00 H 0 +HETATM 5852 H2 HOH A1843 9.542 25.547 43.971 1.00 0.00 H 0 +HETATM 5853 O HOH A1844 47.043 9.735 14.536 1.00 0.00 O 0 +HETATM 5854 H1 HOH A1844 47.350 9.534 13.713 1.00 0.00 H 0 +HETATM 5855 H2 HOH A1844 46.275 10.341 14.455 1.00 0.00 H 0 +HETATM 5856 O HOH A1845 16.440 4.505 26.760 1.00 0.00 O 0 +HETATM 5857 H1 HOH A1845 17.046 3.897 27.156 1.00 0.00 H 0 +HETATM 5858 H2 HOH A1845 17.013 4.869 26.101 1.00 0.00 H 0 +HETATM 5859 O HOH A1846 41.225 18.294 51.985 1.00 0.00 O 0 +HETATM 5860 H1 HOH A1846 40.316 18.672 51.799 1.00 0.00 H 0 +HETATM 5861 H2 HOH A1846 41.636 18.575 51.120 1.00 0.00 H 0 +HETATM 5862 O HOH A1847 9.470 8.372 41.102 1.00 0.00 O 0 +HETATM 5863 H1 HOH A1847 10.141 8.132 40.459 1.00 0.00 H 0 +HETATM 5864 H2 HOH A1847 9.346 7.538 41.577 1.00 0.00 H 0 +HETATM 5865 O HOH A1848 29.002 9.792 37.038 1.00 0.00 O 0 +HETATM 5866 H1 HOH A1848 29.716 10.407 37.269 1.00 0.00 H 0 +HETATM 5867 H2 HOH A1848 28.476 10.296 36.439 1.00 0.00 H 0 +HETATM 5868 O HOH A1849 18.744 47.571 48.640 1.00 0.00 O 0 +HETATM 5869 H1 HOH A1849 17.830 47.835 48.736 1.00 0.00 H 0 +HETATM 5870 H2 HOH A1849 18.986 47.736 47.719 1.00 0.00 H 0 +HETATM 5871 O HOH A1850 4.903 36.913 3.708 1.00 0.00 O 0 +HETATM 5872 H1 HOH A1850 4.638 37.732 4.120 1.00 0.00 H 0 +HETATM 5873 H2 HOH A1850 4.922 36.286 4.380 1.00 0.00 H 0 +HETATM 5874 O HOH A1851 39.841 43.653 27.213 1.00 0.00 O 0 +HETATM 5875 H1 HOH A1851 40.565 43.450 26.624 1.00 0.00 H 0 +HETATM 5876 H2 HOH A1851 39.138 44.210 26.855 1.00 0.00 H 0 +HETATM 5877 O HOH A1852 23.650 45.748 18.664 1.00 0.00 O 0 +HETATM 5878 H1 HOH A1852 23.864 44.814 18.597 1.00 0.00 H 0 +HETATM 5879 H2 HOH A1852 23.090 45.910 19.449 1.00 0.00 H 0 +HETATM 5880 O HOH A1853 21.709 21.042 2.226 1.00 0.00 O 0 +HETATM 5881 H1 HOH A1853 21.344 20.851 3.097 1.00 0.00 H 0 +HETATM 5882 H2 HOH A1853 21.115 21.738 1.862 1.00 0.00 H 0 +HETATM 5883 O HOH A1854 47.504 9.788 18.850 1.00 0.00 O 0 +HETATM 5884 H1 HOH A1854 47.355 10.522 19.522 1.00 0.00 H 0 +HETATM 5885 H2 HOH A1854 47.944 9.015 19.315 1.00 0.00 H 0 +HETATM 5886 O HOH A1855 51.492 20.258 44.582 1.00 0.00 O 0 +HETATM 5887 H1 HOH A1855 52.003 19.453 44.464 1.00 0.00 H 0 +HETATM 5888 H2 HOH A1855 51.980 20.850 45.174 1.00 0.00 H 0 +HETATM 5889 O HOH A1856 6.231 46.370 3.346 1.00 0.00 O 0 +HETATM 5890 H1 HOH A1856 6.213 45.836 2.567 1.00 0.00 H 0 +HETATM 5891 H2 HOH A1856 6.020 45.707 4.077 1.00 0.00 H 0 +HETATM 5892 O HOH A1857 1.769 19.459 41.319 1.00 0.00 O 0 +HETATM 5893 H1 HOH A1857 2.716 19.449 41.329 1.00 0.00 H 0 +HETATM 5894 H2 HOH A1857 1.600 19.190 40.374 1.00 0.00 H 0 +HETATM 5895 O HOH A1858 12.054 14.235 32.932 1.00 0.00 O 0 +HETATM 5896 H1 HOH A1858 12.616 14.065 32.205 1.00 0.00 H 0 +HETATM 5897 H2 HOH A1858 12.610 14.757 33.556 1.00 0.00 H 0 +HETATM 5898 O HOH A1859 1.551 11.072 5.815 1.00 0.00 O 0 +HETATM 5899 H1 HOH A1859 1.592 10.094 5.645 1.00 0.00 H 0 +HETATM 5900 H2 HOH A1859 2.386 11.358 6.365 1.00 0.00 H 0 +HETATM 5901 O HOH A1860 35.635 24.826 39.603 1.00 0.00 O 0 +HETATM 5902 H1 HOH A1860 35.737 24.185 38.853 1.00 0.00 H 0 +HETATM 5903 H2 HOH A1860 36.429 25.390 39.514 1.00 0.00 H 0 +HETATM 5904 O HOH A1861 22.024 15.378 9.885 1.00 0.00 O 0 +HETATM 5905 H1 HOH A1861 21.750 16.098 9.354 1.00 0.00 H 0 +HETATM 5906 H2 HOH A1861 22.855 15.609 10.328 1.00 0.00 H 0 +HETATM 5907 O HOH A1862 44.763 9.529 44.760 1.00 0.00 O 0 +HETATM 5908 H1 HOH A1862 45.395 10.021 44.255 1.00 0.00 H 0 +HETATM 5909 H2 HOH A1862 43.987 9.504 44.153 1.00 0.00 H 0 +HETATM 5910 O HOH A1863 43.033 14.304 26.696 1.00 0.00 O 0 +HETATM 5911 H1 HOH A1863 43.896 13.953 26.979 1.00 0.00 H 0 +HETATM 5912 H2 HOH A1863 42.506 13.567 26.348 1.00 0.00 H 0 +HETATM 5913 O HOH A1864 3.563 47.692 23.847 1.00 0.00 O 0 +HETATM 5914 H1 HOH A1864 3.112 47.585 23.016 1.00 0.00 H 0 +HETATM 5915 H2 HOH A1864 2.911 47.936 24.563 1.00 0.00 H 0 +HETATM 5916 O HOH A1865 4.624 3.367 48.863 1.00 0.00 O 0 +HETATM 5917 H1 HOH A1865 4.481 4.071 49.572 1.00 0.00 H 0 +HETATM 5918 H2 HOH A1865 4.499 2.556 49.413 1.00 0.00 H 0 +HETATM 5919 O HOH A1866 22.789 25.012 52.221 1.00 0.00 O 0 +HETATM 5920 H1 HOH A1866 22.727 25.899 51.851 1.00 0.00 H 0 +HETATM 5921 H2 HOH A1866 22.560 25.182 53.167 1.00 0.00 H 0 +HETATM 5922 O HOH A1867 53.053 23.008 51.113 1.00 0.00 O 0 +HETATM 5923 H1 HOH A1867 53.486 23.761 50.573 1.00 0.00 H 0 +HETATM 5924 H2 HOH A1867 52.138 23.168 51.207 1.00 0.00 H 0 +HETATM 5925 O HOH A1868 30.604 16.241 5.456 1.00 0.00 O 0 +HETATM 5926 H1 HOH A1868 30.012 16.255 6.298 1.00 0.00 H 0 +HETATM 5927 H2 HOH A1868 31.237 16.885 5.623 1.00 0.00 H 0 +HETATM 5928 O HOH A1869 46.251 1.430 34.222 1.00 0.00 O 0 +HETATM 5929 H1 HOH A1869 46.574 1.146 33.352 1.00 0.00 H 0 +HETATM 5930 H2 HOH A1869 46.990 1.329 34.758 1.00 0.00 H 0 +HETATM 5931 O HOH A1870 13.200 41.070 24.602 1.00 0.00 O 0 +HETATM 5932 H1 HOH A1870 12.863 41.917 24.960 1.00 0.00 H 0 +HETATM 5933 H2 HOH A1870 13.280 40.430 25.343 1.00 0.00 H 0 +HETATM 5934 O HOH A1871 35.954 41.949 11.898 1.00 0.00 O 0 +HETATM 5935 H1 HOH A1871 36.644 41.794 11.212 1.00 0.00 H 0 +HETATM 5936 H2 HOH A1871 35.794 41.109 12.362 1.00 0.00 H 0 +HETATM 5937 O HOH A1872 39.795 40.463 22.247 1.00 0.00 O 0 +HETATM 5938 H1 HOH A1872 39.655 41.298 21.819 1.00 0.00 H 0 +HETATM 5939 H2 HOH A1872 39.982 39.875 21.501 1.00 0.00 H 0 +HETATM 5940 O HOH A1873 42.221 48.215 52.413 1.00 0.00 O 0 +HETATM 5941 H1 HOH A1873 42.144 47.433 51.859 1.00 0.00 H 0 +HETATM 5942 H2 HOH A1873 41.838 49.012 51.962 1.00 0.00 H 0 +HETATM 5943 O HOH A1874 15.250 10.853 43.638 1.00 0.00 O 0 +HETATM 5944 H1 HOH A1874 14.997 10.092 43.118 1.00 0.00 H 0 +HETATM 5945 H2 HOH A1874 15.996 11.244 43.086 1.00 0.00 H 0 +HETATM 5946 O HOH A1875 46.130 26.279 32.436 1.00 0.00 O 0 +HETATM 5947 H1 HOH A1875 45.693 26.052 33.294 1.00 0.00 H 0 +HETATM 5948 H2 HOH A1875 45.786 25.694 31.710 1.00 0.00 H 0 +HETATM 5949 O HOH A1876 0.526 49.406 17.062 1.00 0.00 O 0 +HETATM 5950 H1 HOH A1876 1.039 50.060 17.547 1.00 0.00 H 0 +HETATM 5951 H2 HOH A1876 0.081 48.769 17.745 1.00 0.00 H 0 +HETATM 5952 O HOH A1877 21.488 17.383 25.531 1.00 0.00 O 0 +HETATM 5953 H1 HOH A1877 22.092 17.015 26.143 1.00 0.00 H 0 +HETATM 5954 H2 HOH A1877 21.420 16.721 24.832 1.00 0.00 H 0 +HETATM 5955 O HOH A1878 20.557 32.918 30.660 1.00 0.00 O 0 +HETATM 5956 H1 HOH A1878 20.525 33.878 30.394 1.00 0.00 H 0 +HETATM 5957 H2 HOH A1878 20.844 32.944 31.612 1.00 0.00 H 0 +HETATM 5958 O HOH A1879 32.392 26.731 52.959 1.00 0.00 O 0 +HETATM 5959 H1 HOH A1879 32.542 26.582 52.045 1.00 0.00 H 0 +HETATM 5960 H2 HOH A1879 32.004 25.992 53.398 1.00 0.00 H 0 +HETATM 5961 O HOH A1880 46.017 44.965 19.312 1.00 0.00 O 0 +HETATM 5962 H1 HOH A1880 46.170 44.513 18.497 1.00 0.00 H 0 +HETATM 5963 H2 HOH A1880 45.298 45.530 19.148 1.00 0.00 H 0 +HETATM 5964 O HOH A1881 50.047 51.875 9.390 1.00 0.00 O 0 +HETATM 5965 H1 HOH A1881 50.482 51.306 10.031 1.00 0.00 H 0 +HETATM 5966 H2 HOH A1881 49.094 51.681 9.426 1.00 0.00 H 0 +HETATM 5967 O HOH A1882 33.881 36.079 50.152 1.00 0.00 O 0 +HETATM 5968 H1 HOH A1882 33.972 35.985 51.157 1.00 0.00 H 0 +HETATM 5969 H2 HOH A1882 33.849 37.065 49.962 1.00 0.00 H 0 +HETATM 5970 O HOH A1883 37.589 10.733 29.732 1.00 0.00 O 0 +HETATM 5971 H1 HOH A1883 38.417 11.232 29.796 1.00 0.00 H 0 +HETATM 5972 H2 HOH A1883 36.958 11.398 29.291 1.00 0.00 H 0 +HETATM 5973 O HOH A1884 41.707 15.648 28.798 1.00 0.00 O 0 +HETATM 5974 H1 HOH A1884 41.081 15.091 29.249 1.00 0.00 H 0 +HETATM 5975 H2 HOH A1884 42.079 15.054 28.078 1.00 0.00 H 0 +HETATM 5976 O HOH A1885 29.248 38.571 39.997 1.00 0.00 O 0 +HETATM 5977 H1 HOH A1885 29.422 39.542 40.133 1.00 0.00 H 0 +HETATM 5978 H2 HOH A1885 28.525 38.343 40.580 1.00 0.00 H 0 +HETATM 5979 O HOH A1886 44.376 3.758 40.493 1.00 0.00 O 0 +HETATM 5980 H1 HOH A1886 43.812 3.620 39.747 1.00 0.00 H 0 +HETATM 5981 H2 HOH A1886 43.887 3.499 41.331 1.00 0.00 H 0 +HETATM 5982 O HOH A1887 0.380 43.000 7.242 1.00 0.00 O 0 +HETATM 5983 H1 HOH A1887 -0.269 42.660 7.820 1.00 0.00 H 0 +HETATM 5984 H2 HOH A1887 -0.065 43.257 6.427 1.00 0.00 H 0 +HETATM 5985 O HOH A1888 15.513 38.565 27.397 1.00 0.00 O 0 +HETATM 5986 H1 HOH A1888 15.215 37.706 27.165 1.00 0.00 H 0 +HETATM 5987 H2 HOH A1888 16.148 38.903 26.738 1.00 0.00 H 0 +HETATM 5988 O HOH A1889 46.667 19.640 9.591 1.00 0.00 O 0 +HETATM 5989 H1 HOH A1889 46.422 18.864 9.038 1.00 0.00 H 0 +HETATM 5990 H2 HOH A1889 47.289 19.460 10.294 1.00 0.00 H 0 +HETATM 5991 O HOH A1890 39.934 1.866 10.825 1.00 0.00 O 0 +HETATM 5992 H1 HOH A1890 39.855 2.781 10.807 1.00 0.00 H 0 +HETATM 5993 H2 HOH A1890 40.696 1.735 11.424 1.00 0.00 H 0 +HETATM 5994 O HOH A1891 25.528 49.065 13.729 1.00 0.00 O 0 +HETATM 5995 H1 HOH A1891 25.920 48.308 13.338 1.00 0.00 H 0 +HETATM 5996 H2 HOH A1891 26.232 49.700 13.670 1.00 0.00 H 0 +HETATM 5997 O HOH A1892 15.413 13.667 6.901 1.00 0.00 O 0 +HETATM 5998 H1 HOH A1892 15.587 13.288 6.053 1.00 0.00 H 0 +HETATM 5999 H2 HOH A1892 16.188 14.034 7.203 1.00 0.00 H 0 +HETATM 6000 O HOH A1893 18.957 16.702 23.547 1.00 0.00 O 0 +HETATM 6001 H1 HOH A1893 18.950 17.582 23.263 1.00 0.00 H 0 +HETATM 6002 H2 HOH A1893 18.764 16.786 24.547 1.00 0.00 H 0 +HETATM 6003 O HOH A1894 3.886 42.426 15.879 1.00 0.00 O 0 +HETATM 6004 H1 HOH A1894 4.438 41.653 15.636 1.00 0.00 H 0 +HETATM 6005 H2 HOH A1894 2.967 42.288 15.590 1.00 0.00 H 0 +HETATM 6006 O HOH A1895 48.382 29.238 22.343 1.00 0.00 O 0 +HETATM 6007 H1 HOH A1895 48.367 29.405 21.399 1.00 0.00 H 0 +HETATM 6008 H2 HOH A1895 48.724 30.153 22.701 1.00 0.00 H 0 +HETATM 6009 O HOH A1896 42.531 13.312 44.364 1.00 0.00 O 0 +HETATM 6010 H1 HOH A1896 42.188 12.667 43.748 1.00 0.00 H 0 +HETATM 6011 H2 HOH A1896 43.164 13.784 43.830 1.00 0.00 H 0 +HETATM 6012 O HOH A1897 6.966 19.560 27.340 1.00 0.00 O 0 +HETATM 6013 H1 HOH A1897 6.843 20.283 28.029 1.00 0.00 H 0 +HETATM 6014 H2 HOH A1897 6.138 19.380 26.980 1.00 0.00 H 0 +HETATM 6015 O HOH A1898 21.547 7.620 7.328 1.00 0.00 O 0 +HETATM 6016 H1 HOH A1898 21.790 8.495 7.610 1.00 0.00 H 0 +HETATM 6017 H2 HOH A1898 20.560 7.558 7.413 1.00 0.00 H 0 +HETATM 6018 O HOH A1899 14.296 26.701 47.269 1.00 0.00 O 0 +HETATM 6019 H1 HOH A1899 13.513 26.173 47.161 1.00 0.00 H 0 +HETATM 6020 H2 HOH A1899 13.925 27.276 48.011 1.00 0.00 H 0 +HETATM 6021 O HOH A1900 13.280 9.313 14.799 1.00 0.00 O 0 +HETATM 6022 H1 HOH A1900 13.300 9.415 15.759 1.00 0.00 H 0 +HETATM 6023 H2 HOH A1900 14.185 9.632 14.522 1.00 0.00 H 0 +HETATM 6024 O HOH A1901 7.355 10.474 24.421 1.00 0.00 O 0 +HETATM 6025 H1 HOH A1901 6.855 11.328 24.523 1.00 0.00 H 0 +HETATM 6026 H2 HOH A1901 6.761 9.757 24.798 1.00 0.00 H 0 +HETATM 6027 O HOH A1902 22.798 37.922 20.406 1.00 0.00 O 0 +HETATM 6028 H1 HOH A1902 23.015 38.034 19.464 1.00 0.00 H 0 +HETATM 6029 H2 HOH A1902 22.656 36.998 20.529 1.00 0.00 H 0 +HETATM 6030 O HOH A1903 6.684 42.950 35.557 1.00 0.00 O 0 +HETATM 6031 H1 HOH A1903 7.265 43.156 34.760 1.00 0.00 H 0 +HETATM 6032 H2 HOH A1903 7.209 42.318 36.172 1.00 0.00 H 0 +HETATM 6033 O HOH A1904 42.433 39.859 5.501 1.00 0.00 O 0 +HETATM 6034 H1 HOH A1904 42.727 38.921 5.598 1.00 0.00 H 0 +HETATM 6035 H2 HOH A1904 43.075 40.326 6.093 1.00 0.00 H 0 +HETATM 6036 O HOH A1905 10.194 15.554 0.748 1.00 0.00 O 0 +HETATM 6037 H1 HOH A1905 9.750 14.824 1.156 1.00 0.00 H 0 +HETATM 6038 H2 HOH A1905 9.859 16.415 1.054 1.00 0.00 H 0 +HETATM 6039 O HOH A1906 0.051 37.268 1.820 1.00 0.00 O 0 +HETATM 6040 H1 HOH A1906 -0.574 36.477 1.557 1.00 0.00 H 0 +HETATM 6041 H2 HOH A1906 0.977 36.999 1.942 1.00 0.00 H 0 +HETATM 6042 O HOH A1907 18.734 50.299 28.954 1.00 0.00 O 0 +HETATM 6043 H1 HOH A1907 18.999 50.013 28.078 1.00 0.00 H 0 +HETATM 6044 H2 HOH A1907 18.789 51.309 28.906 1.00 0.00 H 0 +HETATM 6045 O HOH A1908 20.742 26.476 46.707 1.00 0.00 O 0 +HETATM 6046 H1 HOH A1908 20.510 27.403 46.915 1.00 0.00 H 0 +HETATM 6047 H2 HOH A1908 20.983 25.990 47.561 1.00 0.00 H 0 +HETATM 6048 O HOH A1909 14.102 2.950 19.798 1.00 0.00 O 0 +HETATM 6049 H1 HOH A1909 13.522 3.016 20.552 1.00 0.00 H 0 +HETATM 6050 H2 HOH A1909 14.191 2.027 19.608 1.00 0.00 H 0 +HETATM 6051 O HOH A1910 20.446 46.829 18.096 1.00 0.00 O 0 +HETATM 6052 H1 HOH A1910 19.427 46.840 17.993 1.00 0.00 H 0 +HETATM 6053 H2 HOH A1910 20.763 46.915 17.224 1.00 0.00 H 0 +HETATM 6054 O HOH A1911 53.075 10.203 22.470 1.00 0.00 O 0 +HETATM 6055 H1 HOH A1911 52.086 10.097 22.658 1.00 0.00 H 0 +HETATM 6056 H2 HOH A1911 53.055 10.875 21.795 1.00 0.00 H 0 +HETATM 6057 O HOH A1912 25.693 47.481 40.156 1.00 0.00 O 0 +HETATM 6058 H1 HOH A1912 25.906 47.934 41.008 1.00 0.00 H 0 +HETATM 6059 H2 HOH A1912 25.962 48.232 39.625 1.00 0.00 H 0 +HETATM 6060 O HOH A1913 31.295 51.588 47.826 1.00 0.00 O 0 +HETATM 6061 H1 HOH A1913 31.601 50.687 47.878 1.00 0.00 H 0 +HETATM 6062 H2 HOH A1913 32.092 52.202 47.608 1.00 0.00 H 0 +HETATM 6063 O HOH A1914 39.816 5.619 40.574 1.00 0.00 O 0 +HETATM 6064 H1 HOH A1914 39.163 6.203 41.017 1.00 0.00 H 0 +HETATM 6065 H2 HOH A1914 39.449 4.762 40.635 1.00 0.00 H 0 +HETATM 6066 O HOH A1915 37.406 35.783 16.723 1.00 0.00 O 0 +HETATM 6067 H1 HOH A1915 36.574 35.884 16.281 1.00 0.00 H 0 +HETATM 6068 H2 HOH A1915 37.962 35.172 16.157 1.00 0.00 H 0 +HETATM 6069 O HOH A1916 47.057 43.007 17.309 1.00 0.00 O 0 +HETATM 6070 H1 HOH A1916 47.638 43.312 16.640 1.00 0.00 H 0 +HETATM 6071 H2 HOH A1916 46.080 42.946 16.986 1.00 0.00 H 0 +HETATM 6072 O HOH A1917 15.189 36.499 34.056 1.00 0.00 O 0 +HETATM 6073 H1 HOH A1917 14.541 36.410 33.357 1.00 0.00 H 0 +HETATM 6074 H2 HOH A1917 15.632 37.332 33.813 1.00 0.00 H 0 +HETATM 6075 O HOH A1918 32.739 32.923 46.499 1.00 0.00 O 0 +HETATM 6076 H1 HOH A1918 33.737 32.652 46.622 1.00 0.00 H 0 +HETATM 6077 H2 HOH A1918 32.483 33.417 47.277 1.00 0.00 H 0 +HETATM 6078 O HOH A1919 35.554 28.960 46.243 1.00 0.00 O 0 +HETATM 6079 H1 HOH A1919 35.399 28.814 45.282 1.00 0.00 H 0 +HETATM 6080 H2 HOH A1919 35.662 29.874 46.400 1.00 0.00 H 0 +HETATM 6081 O HOH A1920 17.643 16.040 43.926 1.00 0.00 O 0 +HETATM 6082 H1 HOH A1920 17.882 15.709 43.058 1.00 0.00 H 0 +HETATM 6083 H2 HOH A1920 18.311 15.737 44.612 1.00 0.00 H 0 +HETATM 6084 O HOH A1921 43.832 8.580 20.192 1.00 0.00 O 0 +HETATM 6085 H1 HOH A1921 43.490 9.464 20.296 1.00 0.00 H 0 +HETATM 6086 H2 HOH A1921 44.203 8.526 19.318 1.00 0.00 H 0 +HETATM 6087 O HOH A1922 22.596 16.394 15.950 1.00 0.00 O 0 +HETATM 6088 H1 HOH A1922 22.328 15.657 16.469 1.00 0.00 H 0 +HETATM 6089 H2 HOH A1922 21.816 16.601 15.380 1.00 0.00 H 0 +HETATM 6090 O HOH A1923 50.778 21.290 27.064 1.00 0.00 O 0 +HETATM 6091 H1 HOH A1923 50.329 20.779 27.728 1.00 0.00 H 0 +HETATM 6092 H2 HOH A1923 50.838 20.718 26.319 1.00 0.00 H 0 +HETATM 6093 O HOH A1924 9.203 49.234 21.134 1.00 0.00 O 0 +HETATM 6094 H1 HOH A1924 10.021 48.824 21.180 1.00 0.00 H 0 +HETATM 6095 H2 HOH A1924 9.269 50.188 21.410 1.00 0.00 H 0 +HETATM 6096 O HOH A1925 27.130 13.829 29.534 1.00 0.00 O 0 +HETATM 6097 H1 HOH A1925 26.853 14.760 29.535 1.00 0.00 H 0 +HETATM 6098 H2 HOH A1925 26.417 13.405 29.077 1.00 0.00 H 0 +HETATM 6099 O HOH A1926 48.213 37.983 36.932 1.00 0.00 O 0 +HETATM 6100 H1 HOH A1926 48.139 38.224 35.972 1.00 0.00 H 0 +HETATM 6101 H2 HOH A1926 48.372 37.003 37.070 1.00 0.00 H 0 +HETATM 6102 O HOH A1927 24.279 0.621 11.183 1.00 0.00 O 0 +HETATM 6103 H1 HOH A1927 23.929 0.453 12.104 1.00 0.00 H 0 +HETATM 6104 H2 HOH A1927 25.212 0.664 11.173 1.00 0.00 H 0 +HETATM 6105 O HOH A1928 22.864 16.284 47.842 1.00 0.00 O 0 +HETATM 6106 H1 HOH A1928 22.464 16.573 46.962 1.00 0.00 H 0 +HETATM 6107 H2 HOH A1928 22.995 15.271 47.785 1.00 0.00 H 0 +HETATM 6108 O HOH A1929 11.612 39.717 50.509 1.00 0.00 O 0 +HETATM 6109 H1 HOH A1929 12.342 39.240 50.853 1.00 0.00 H 0 +HETATM 6110 H2 HOH A1929 11.335 39.275 49.693 1.00 0.00 H 0 +HETATM 6111 O HOH A1930 37.930 38.891 43.740 1.00 0.00 O 0 +HETATM 6112 H1 HOH A1930 38.812 38.549 43.569 1.00 0.00 H 0 +HETATM 6113 H2 HOH A1930 37.315 38.542 43.095 1.00 0.00 H 0 +HETATM 6114 O HOH A1931 19.908 24.059 43.187 1.00 0.00 O 0 +HETATM 6115 H1 HOH A1931 19.604 24.207 44.060 1.00 0.00 H 0 +HETATM 6116 H2 HOH A1931 19.450 24.815 42.691 1.00 0.00 H 0 +HETATM 6117 O HOH A1932 2.021 24.253 39.101 1.00 0.00 O 0 +HETATM 6118 H1 HOH A1932 2.080 24.100 40.076 1.00 0.00 H 0 +HETATM 6119 H2 HOH A1932 1.549 23.517 38.728 1.00 0.00 H 0 +HETATM 6120 O HOH A1933 18.212 10.907 46.983 1.00 0.00 O 0 +HETATM 6121 H1 HOH A1933 18.452 11.315 46.180 1.00 0.00 H 0 +HETATM 6122 H2 HOH A1933 17.526 11.448 47.324 1.00 0.00 H 0 +HETATM 6123 O HOH A1934 14.451 3.265 12.006 1.00 0.00 O 0 +HETATM 6124 H1 HOH A1934 14.446 3.660 11.100 1.00 0.00 H 0 +HETATM 6125 H2 HOH A1934 14.446 3.957 12.696 1.00 0.00 H 0 +HETATM 6126 O HOH A1935 7.541 5.633 51.205 1.00 0.00 O 0 +HETATM 6127 H1 HOH A1935 8.147 4.866 51.055 1.00 0.00 H 0 +HETATM 6128 H2 HOH A1935 7.340 6.118 50.369 1.00 0.00 H 0 +HETATM 6129 O HOH A1936 40.845 44.093 42.928 1.00 0.00 O 0 +HETATM 6130 H1 HOH A1936 41.144 44.969 42.935 1.00 0.00 H 0 +HETATM 6131 H2 HOH A1936 40.406 44.008 43.779 1.00 0.00 H 0 +HETATM 6132 O HOH A1937 20.870 37.718 50.642 1.00 0.00 O 0 +HETATM 6133 H1 HOH A1937 21.194 38.354 51.327 1.00 0.00 H 0 +HETATM 6134 H2 HOH A1937 21.397 37.847 49.819 1.00 0.00 H 0 +HETATM 6135 O HOH A1938 30.491 29.484 40.766 1.00 0.00 O 0 +HETATM 6136 H1 HOH A1938 31.359 29.939 41.005 1.00 0.00 H 0 +HETATM 6137 H2 HOH A1938 30.811 28.646 40.418 1.00 0.00 H 0 +HETATM 6138 O HOH A1939 15.098 12.589 15.596 1.00 0.00 O 0 +HETATM 6139 H1 HOH A1939 15.554 12.763 14.788 1.00 0.00 H 0 +HETATM 6140 H2 HOH A1939 14.218 12.737 15.281 1.00 0.00 H 0 +HETATM 6141 O HOH A1940 34.712 39.936 2.608 1.00 0.00 O 0 +HETATM 6142 H1 HOH A1940 34.485 40.888 2.777 1.00 0.00 H 0 +HETATM 6143 H2 HOH A1940 34.300 39.352 3.246 1.00 0.00 H 0 +HETATM 6144 O HOH A1941 44.550 20.415 39.079 1.00 0.00 O 0 +HETATM 6145 H1 HOH A1941 45.374 20.116 38.686 1.00 0.00 H 0 +HETATM 6146 H2 HOH A1941 43.855 20.316 38.360 1.00 0.00 H 0 +HETATM 6147 O HOH A1942 19.448 30.599 29.656 1.00 0.00 O 0 +HETATM 6148 H1 HOH A1942 19.910 31.208 30.190 1.00 0.00 H 0 +HETATM 6149 H2 HOH A1942 19.574 30.940 28.764 1.00 0.00 H 0 +HETATM 6150 O HOH A1943 6.332 18.792 18.615 1.00 0.00 O 0 +HETATM 6151 H1 HOH A1943 6.535 17.984 18.230 1.00 0.00 H 0 +HETATM 6152 H2 HOH A1943 6.167 19.450 17.946 1.00 0.00 H 0 +HETATM 6153 O HOH A1944 53.016 24.137 9.765 1.00 0.00 O 0 +HETATM 6154 H1 HOH A1944 53.893 24.047 10.254 1.00 0.00 H 0 +HETATM 6155 H2 HOH A1944 52.234 23.993 10.339 1.00 0.00 H 0 +HETATM 6156 O HOH A1945 29.795 6.919 50.060 1.00 0.00 O 0 +HETATM 6157 H1 HOH A1945 29.176 6.474 49.462 1.00 0.00 H 0 +HETATM 6158 H2 HOH A1945 29.699 6.405 50.826 1.00 0.00 H 0 +HETATM 6159 O HOH A1946 2.458 52.574 53.048 1.00 0.00 O 0 +HETATM 6160 H1 HOH A1946 1.822 52.506 53.762 1.00 0.00 H 0 +HETATM 6161 H2 HOH A1946 3.078 51.840 53.340 1.00 0.00 H 0 +HETATM 6162 O HOH A1947 48.041 49.970 50.691 1.00 0.00 O 0 +HETATM 6163 H1 HOH A1947 48.052 49.478 51.486 1.00 0.00 H 0 +HETATM 6164 H2 HOH A1947 47.934 50.907 50.961 1.00 0.00 H 0 +HETATM 6165 O HOH A1948 23.125 4.275 48.521 1.00 0.00 O 0 +HETATM 6166 H1 HOH A1948 22.696 3.941 49.330 1.00 0.00 H 0 +HETATM 6167 H2 HOH A1948 24.026 4.381 48.779 1.00 0.00 H 0 +HETATM 6168 O HOH A1949 13.267 44.951 13.932 1.00 0.00 O 0 +HETATM 6169 H1 HOH A1949 12.274 44.864 13.904 1.00 0.00 H 0 +HETATM 6170 H2 HOH A1949 13.558 44.112 14.200 1.00 0.00 H 0 +HETATM 6171 O HOH A1950 39.773 47.473 36.160 1.00 0.00 O 0 +HETATM 6172 H1 HOH A1950 39.670 47.019 35.281 1.00 0.00 H 0 +HETATM 6173 H2 HOH A1950 39.205 46.955 36.786 1.00 0.00 H 0 +HETATM 6174 O HOH A1951 32.667 4.171 9.063 1.00 0.00 O 0 +HETATM 6175 H1 HOH A1951 32.665 3.718 8.212 1.00 0.00 H 0 +HETATM 6176 H2 HOH A1951 33.493 3.920 9.483 1.00 0.00 H 0 +HETATM 6177 O HOH A1952 2.298 14.771 34.259 1.00 0.00 O 0 +HETATM 6178 H1 HOH A1952 2.652 13.830 33.992 1.00 0.00 H 0 +HETATM 6179 H2 HOH A1952 2.949 15.011 34.910 1.00 0.00 H 0 +HETATM 6180 O HOH A1953 3.568 12.195 10.911 1.00 0.00 O 0 +HETATM 6181 H1 HOH A1953 3.527 11.376 10.412 1.00 0.00 H 0 +HETATM 6182 H2 HOH A1953 2.656 12.390 11.168 1.00 0.00 H 0 +HETATM 6183 O HOH A1954 51.900 47.890 9.255 1.00 0.00 O 0 +HETATM 6184 H1 HOH A1954 52.173 48.635 8.710 1.00 0.00 H 0 +HETATM 6185 H2 HOH A1954 52.651 47.812 9.900 1.00 0.00 H 0 +HETATM 6186 O HOH A1955 40.467 46.616 5.943 1.00 0.00 O 0 +HETATM 6187 H1 HOH A1955 39.528 46.742 6.122 1.00 0.00 H 0 +HETATM 6188 H2 HOH A1955 40.828 47.518 5.915 1.00 0.00 H 0 +HETATM 6189 O HOH A1956 49.571 29.058 7.844 1.00 0.00 O 0 +HETATM 6190 H1 HOH A1956 49.755 29.040 8.801 1.00 0.00 H 0 +HETATM 6191 H2 HOH A1956 49.184 29.956 7.669 1.00 0.00 H 0 +HETATM 6192 O HOH A1957 0.349 52.134 20.648 1.00 0.00 O 0 +HETATM 6193 H1 HOH A1957 1.078 52.780 20.642 1.00 0.00 H 0 +HETATM 6194 H2 HOH A1957 0.755 51.283 20.768 1.00 0.00 H 0 +HETATM 6195 O HOH A1958 32.984 49.442 39.780 1.00 0.00 O 0 +HETATM 6196 H1 HOH A1958 32.384 48.798 39.514 1.00 0.00 H 0 +HETATM 6197 H2 HOH A1958 32.496 49.963 40.391 1.00 0.00 H 0 +HETATM 6198 O HOH A1959 39.063 11.054 22.743 1.00 0.00 O 0 +HETATM 6199 H1 HOH A1959 39.462 10.122 22.761 1.00 0.00 H 0 +HETATM 6200 H2 HOH A1959 39.866 11.671 22.758 1.00 0.00 H 0 +HETATM 6201 O HOH A1960 42.334 27.652 28.722 1.00 0.00 O 0 +HETATM 6202 H1 HOH A1960 41.876 28.279 29.245 1.00 0.00 H 0 +HETATM 6203 H2 HOH A1960 43.196 27.656 29.061 1.00 0.00 H 0 +HETATM 6204 O HOH A1961 27.084 37.743 43.871 1.00 0.00 O 0 +HETATM 6205 H1 HOH A1961 28.004 37.836 44.131 1.00 0.00 H 0 +HETATM 6206 H2 HOH A1961 26.671 38.409 44.336 1.00 0.00 H 0 +HETATM 6207 O HOH A1962 14.136 27.751 49.716 1.00 0.00 O 0 +HETATM 6208 H1 HOH A1962 13.434 28.268 50.047 1.00 0.00 H 0 +HETATM 6209 H2 HOH A1962 14.933 27.757 50.305 1.00 0.00 H 0 +HETATM 6210 O HOH A1963 3.633 33.941 26.909 1.00 0.00 O 0 +HETATM 6211 H1 HOH A1963 2.858 34.328 27.292 1.00 0.00 H 0 +HETATM 6212 H2 HOH A1963 3.683 33.044 27.295 1.00 0.00 H 0 +HETATM 6213 O HOH A1964 31.240 10.803 25.262 1.00 0.00 O 0 +HETATM 6214 H1 HOH A1964 30.611 10.096 25.070 1.00 0.00 H 0 +HETATM 6215 H2 HOH A1964 30.884 11.592 24.833 1.00 0.00 H 0 +HETATM 6216 O HOH A1965 32.065 34.440 48.762 1.00 0.00 O 0 +HETATM 6217 H1 HOH A1965 32.803 34.721 49.377 1.00 0.00 H 0 +HETATM 6218 H2 HOH A1965 31.247 34.594 49.239 1.00 0.00 H 0 +HETATM 6219 O HOH A1966 6.390 33.256 22.905 1.00 0.00 O 0 +HETATM 6220 H1 HOH A1966 6.714 32.767 23.702 1.00 0.00 H 0 +HETATM 6221 H2 HOH A1966 6.161 34.169 23.298 1.00 0.00 H 0 +HETATM 6222 O HOH A1967 30.021 6.045 35.874 1.00 0.00 O 0 +HETATM 6223 H1 HOH A1967 30.486 6.059 35.076 1.00 0.00 H 0 +HETATM 6224 H2 HOH A1967 30.546 5.552 36.534 1.00 0.00 H 0 +HETATM 6225 O HOH A1968 25.352 7.905 6.343 1.00 0.00 O 0 +HETATM 6226 H1 HOH A1968 24.696 7.677 5.606 1.00 0.00 H 0 +HETATM 6227 H2 HOH A1968 24.923 8.438 6.974 1.00 0.00 H 0 +HETATM 6228 O HOH A1969 51.521 38.749 16.927 1.00 0.00 O 0 +HETATM 6229 H1 HOH A1969 52.242 39.277 17.196 1.00 0.00 H 0 +HETATM 6230 H2 HOH A1969 51.358 38.003 17.535 1.00 0.00 H 0 +HETATM 6231 O HOH A1970 18.780 22.746 49.397 1.00 0.00 O 0 +HETATM 6232 H1 HOH A1970 17.815 22.946 49.517 1.00 0.00 H 0 +HETATM 6233 H2 HOH A1970 18.897 22.608 48.446 1.00 0.00 H 0 +HETATM 6234 O HOH A1971 20.673 34.912 51.351 1.00 0.00 O 0 +HETATM 6235 H1 HOH A1971 20.432 34.559 50.512 1.00 0.00 H 0 +HETATM 6236 H2 HOH A1971 20.988 35.800 51.024 1.00 0.00 H 0 +HETATM 6237 O HOH A1972 32.454 9.950 20.770 1.00 0.00 O 0 +HETATM 6238 H1 HOH A1972 32.594 9.671 21.751 1.00 0.00 H 0 +HETATM 6239 H2 HOH A1972 32.116 9.146 20.433 1.00 0.00 H 0 +HETATM 6240 O HOH A1973 29.351 51.211 40.335 1.00 0.00 O 0 +HETATM 6241 H1 HOH A1973 29.299 50.531 39.698 1.00 0.00 H 0 +HETATM 6242 H2 HOH A1973 29.003 51.937 39.822 1.00 0.00 H 0 +HETATM 6243 O HOH A1974 13.723 41.952 9.441 1.00 0.00 O 0 +HETATM 6244 H1 HOH A1974 13.262 41.275 8.957 1.00 0.00 H 0 +HETATM 6245 H2 HOH A1974 13.047 42.352 9.957 1.00 0.00 H 0 +HETATM 6246 O HOH A1975 34.407 47.792 27.934 1.00 0.00 O 0 +HETATM 6247 H1 HOH A1975 34.016 47.478 27.126 1.00 0.00 H 0 +HETATM 6248 H2 HOH A1975 33.791 47.884 28.667 1.00 0.00 H 0 +HETATM 6249 O HOH A1976 46.846 5.760 23.369 1.00 0.00 O 0 +HETATM 6250 H1 HOH A1976 46.162 6.348 23.011 1.00 0.00 H 0 +HETATM 6251 H2 HOH A1976 47.238 5.356 22.565 1.00 0.00 H 0 +HETATM 6252 O HOH A1977 7.854 17.597 7.012 1.00 0.00 O 0 +HETATM 6253 H1 HOH A1977 8.102 18.099 7.762 1.00 0.00 H 0 +HETATM 6254 H2 HOH A1977 7.399 16.883 7.423 1.00 0.00 H 0 +HETATM 6255 O HOH A1978 21.994 45.071 45.607 1.00 0.00 O 0 +HETATM 6256 H1 HOH A1978 22.377 44.627 44.802 1.00 0.00 H 0 +HETATM 6257 H2 HOH A1978 21.136 44.612 45.812 1.00 0.00 H 0 +HETATM 6258 O HOH A1979 0.794 46.458 23.012 1.00 0.00 O 0 +HETATM 6259 H1 HOH A1979 1.081 45.879 23.706 1.00 0.00 H 0 +HETATM 6260 H2 HOH A1979 0.346 45.992 22.290 1.00 0.00 H 0 +HETATM 6261 O HOH A1980 44.518 4.807 4.361 1.00 0.00 O 0 +HETATM 6262 H1 HOH A1980 44.230 4.490 3.491 1.00 0.00 H 0 +HETATM 6263 H2 HOH A1980 43.766 5.264 4.796 1.00 0.00 H 0 +HETATM 6264 O HOH A1981 12.477 9.616 34.337 1.00 0.00 O 0 +HETATM 6265 H1 HOH A1981 11.874 10.353 34.245 1.00 0.00 H 0 +HETATM 6266 H2 HOH A1981 11.970 8.810 34.213 1.00 0.00 H 0 +HETATM 6267 O HOH A1982 27.855 35.007 36.987 1.00 0.00 O 0 +HETATM 6268 H1 HOH A1982 28.135 35.257 36.119 1.00 0.00 H 0 +HETATM 6269 H2 HOH A1982 28.703 34.889 37.511 1.00 0.00 H 0 +HETATM 6270 O HOH A1983 41.216 41.942 51.353 1.00 0.00 O 0 +HETATM 6271 H1 HOH A1983 40.466 41.373 51.652 1.00 0.00 H 0 +HETATM 6272 H2 HOH A1983 40.910 42.447 50.572 1.00 0.00 H 0 +HETATM 6273 O HOH A1984 48.701 43.684 25.253 1.00 0.00 O 0 +HETATM 6274 H1 HOH A1984 49.262 43.929 24.489 1.00 0.00 H 0 +HETATM 6275 H2 HOH A1984 48.607 44.506 25.693 1.00 0.00 H 0 +HETATM 6276 O HOH A1985 33.319 9.045 1.625 1.00 0.00 O 0 +HETATM 6277 H1 HOH A1985 33.743 8.463 2.242 1.00 0.00 H 0 +HETATM 6278 H2 HOH A1985 32.629 8.532 1.225 1.00 0.00 H 0 +HETATM 6279 O HOH A1986 31.819 1.812 40.093 1.00 0.00 O 0 +HETATM 6280 H1 HOH A1986 31.305 2.244 40.766 1.00 0.00 H 0 +HETATM 6281 H2 HOH A1986 31.353 1.504 39.399 1.00 0.00 H 0 +HETATM 6282 O HOH A1987 43.069 15.071 48.940 1.00 0.00 O 0 +HETATM 6283 H1 HOH A1987 43.499 15.762 48.355 1.00 0.00 H 0 +HETATM 6284 H2 HOH A1987 43.192 14.214 48.482 1.00 0.00 H 0 +HETATM 6285 O HOH A1988 25.120 43.665 9.667 1.00 0.00 O 0 +HETATM 6286 H1 HOH A1988 24.174 43.586 9.610 1.00 0.00 H 0 +HETATM 6287 H2 HOH A1988 25.256 43.446 10.596 1.00 0.00 H 0 +HETATM 6288 O HOH A1989 25.650 2.451 41.252 1.00 0.00 O 0 +HETATM 6289 H1 HOH A1989 24.986 2.297 40.562 1.00 0.00 H 0 +HETATM 6290 H2 HOH A1989 25.538 3.377 41.482 1.00 0.00 H 0 +HETATM 6291 O HOH A1990 35.629 47.983 51.896 1.00 0.00 O 0 +HETATM 6292 H1 HOH A1990 35.672 48.078 52.887 1.00 0.00 H 0 +HETATM 6293 H2 HOH A1990 35.141 48.713 51.534 1.00 0.00 H 0 +HETATM 6294 O HOH A1991 43.154 1.836 26.226 1.00 0.00 O 0 +HETATM 6295 H1 HOH A1991 43.601 1.846 27.104 1.00 0.00 H 0 +HETATM 6296 H2 HOH A1991 42.362 2.285 26.457 1.00 0.00 H 0 +HETATM 6297 O HOH A1992 37.003 36.092 2.715 1.00 0.00 O 0 +HETATM 6298 H1 HOH A1992 36.866 35.546 3.536 1.00 0.00 H 0 +HETATM 6299 H2 HOH A1992 37.628 36.811 2.816 1.00 0.00 H 0 +HETATM 6300 O HOH A1993 1.000 51.009 38.674 1.00 0.00 O 0 +HETATM 6301 H1 HOH A1993 0.127 51.301 38.918 1.00 0.00 H 0 +HETATM 6302 H2 HOH A1993 1.317 51.327 37.837 1.00 0.00 H 0 +HETATM 6303 O HOH A1994 15.666 28.751 16.740 1.00 0.00 O 0 +HETATM 6304 H1 HOH A1994 16.109 28.282 17.451 1.00 0.00 H 0 +HETATM 6305 H2 HOH A1994 14.762 28.473 16.803 1.00 0.00 H 0 +HETATM 6306 O HOH A1995 28.654 26.831 41.040 1.00 0.00 O 0 +HETATM 6307 H1 HOH A1995 27.994 26.196 41.207 1.00 0.00 H 0 +HETATM 6308 H2 HOH A1995 28.268 27.654 40.617 1.00 0.00 H 0 +HETATM 6309 O HOH A1996 52.795 23.512 42.439 1.00 0.00 O 0 +HETATM 6310 H1 HOH A1996 52.369 23.764 43.308 1.00 0.00 H 0 +HETATM 6311 H2 HOH A1996 52.799 22.559 42.204 1.00 0.00 H 0 +HETATM 6312 O HOH A1997 5.094 44.448 19.899 1.00 0.00 O 0 +HETATM 6313 H1 HOH A1997 4.874 43.613 19.508 1.00 0.00 H 0 +HETATM 6314 H2 HOH A1997 6.059 44.599 19.942 1.00 0.00 H 0 +HETATM 6315 O HOH A1998 5.287 46.003 41.700 1.00 0.00 O 0 +HETATM 6316 H1 HOH A1998 4.695 46.170 40.946 1.00 0.00 H 0 +HETATM 6317 H2 HOH A1998 5.951 46.709 41.645 1.00 0.00 H 0 +HETATM 6318 O HOH A1999 0.485 5.804 34.103 1.00 0.00 O 0 +HETATM 6319 H1 HOH A1999 1.101 6.564 34.309 1.00 0.00 H 0 +HETATM 6320 H2 HOH A1999 -0.386 6.215 34.323 1.00 0.00 H 0 +HETATM 6321 O HOH A2000 50.351 43.132 28.076 1.00 0.00 O 0 +HETATM 6322 H1 HOH A2000 50.026 42.417 27.503 1.00 0.00 H 0 +HETATM 6323 H2 HOH A2000 50.141 42.836 28.955 1.00 0.00 H 0 +HETATM 6324 O HOH A2001 38.076 13.463 26.600 1.00 0.00 O 0 +HETATM 6325 H1 HOH A2001 37.291 13.851 26.925 1.00 0.00 H 0 +HETATM 6326 H2 HOH A2001 37.812 13.227 25.674 1.00 0.00 H 0 +HETATM 6327 O HOH A2002 43.507 5.084 51.272 1.00 0.00 O 0 +HETATM 6328 H1 HOH A2002 43.992 5.844 51.064 1.00 0.00 H 0 +HETATM 6329 H2 HOH A2002 42.944 4.885 50.463 1.00 0.00 H 0 +HETATM 6330 O HOH A2003 30.976 48.052 45.348 1.00 0.00 O 0 +HETATM 6331 H1 HOH A2003 31.536 48.245 44.572 1.00 0.00 H 0 +HETATM 6332 H2 HOH A2003 30.768 48.903 45.656 1.00 0.00 H 0 +HETATM 6333 O HOH A2004 52.217 45.559 48.834 1.00 0.00 O 0 +HETATM 6334 H1 HOH A2004 53.111 45.544 49.211 1.00 0.00 H 0 +HETATM 6335 H2 HOH A2004 52.034 46.487 48.683 1.00 0.00 H 0 +HETATM 6336 O HOH A2005 14.655 11.526 38.313 1.00 0.00 O 0 +HETATM 6337 H1 HOH A2005 15.035 12.129 37.645 1.00 0.00 H 0 +HETATM 6338 H2 HOH A2005 13.971 12.003 38.785 1.00 0.00 H 0 +HETATM 6339 O HOH A2006 37.777 43.028 18.950 1.00 0.00 O 0 +HETATM 6340 H1 HOH A2006 38.323 43.785 19.278 1.00 0.00 H 0 +HETATM 6341 H2 HOH A2006 37.852 42.330 19.630 1.00 0.00 H 0 +HETATM 6342 O HOH A2007 0.344 11.905 14.631 1.00 0.00 O 0 +HETATM 6343 H1 HOH A2007 0.117 12.729 15.056 1.00 0.00 H 0 +HETATM 6344 H2 HOH A2007 1.266 11.710 14.955 1.00 0.00 H 0 +HETATM 6345 O HOH A2008 13.578 3.253 33.502 1.00 0.00 O 0 +HETATM 6346 H1 HOH A2008 12.694 3.407 33.866 1.00 0.00 H 0 +HETATM 6347 H2 HOH A2008 13.865 3.756 32.748 1.00 0.00 H 0 +HETATM 6348 O HOH A2009 43.188 12.563 30.050 1.00 0.00 O 0 +HETATM 6349 H1 HOH A2009 42.802 12.649 30.930 1.00 0.00 H 0 +HETATM 6350 H2 HOH A2009 42.477 12.193 29.466 1.00 0.00 H 0 +HETATM 6351 O HOH A2010 23.439 52.950 45.012 1.00 0.00 O 0 +HETATM 6352 H1 HOH A2010 22.530 52.604 44.837 1.00 0.00 H 0 +HETATM 6353 H2 HOH A2010 23.500 53.580 44.311 1.00 0.00 H 0 +HETATM 6354 O HOH A2011 27.615 44.481 34.382 1.00 0.00 O 0 +HETATM 6355 H1 HOH A2011 28.112 43.806 33.855 1.00 0.00 H 0 +HETATM 6356 H2 HOH A2011 26.784 44.723 34.034 1.00 0.00 H 0 +HETATM 6357 O HOH A2012 49.981 31.745 32.219 1.00 0.00 O 0 +HETATM 6358 H1 HOH A2012 50.111 32.589 31.902 1.00 0.00 H 0 +HETATM 6359 H2 HOH A2012 49.076 31.763 32.500 1.00 0.00 H 0 +HETATM 6360 O HOH A2013 52.522 50.654 24.665 1.00 0.00 O 0 +HETATM 6361 H1 HOH A2013 53.125 51.413 24.726 1.00 0.00 H 0 +HETATM 6362 H2 HOH A2013 52.626 50.009 25.406 1.00 0.00 H 0 +HETATM 6363 O HOH A2014 46.921 7.197 43.133 1.00 0.00 O 0 +HETATM 6364 H1 HOH A2014 47.068 6.426 42.605 1.00 0.00 H 0 +HETATM 6365 H2 HOH A2014 46.921 6.876 44.062 1.00 0.00 H 0 +HETATM 6366 O HOH A2015 52.688 0.764 49.322 1.00 0.00 O 0 +HETATM 6367 H1 HOH A2015 51.977 0.256 48.839 1.00 0.00 H 0 +HETATM 6368 H2 HOH A2015 52.777 0.376 50.151 1.00 0.00 H 0 +HETATM 6369 O HOH A2016 52.356 14.493 11.140 1.00 0.00 O 0 +HETATM 6370 H1 HOH A2016 52.044 15.337 10.811 1.00 0.00 H 0 +HETATM 6371 H2 HOH A2016 51.748 14.112 11.806 1.00 0.00 H 0 +HETATM 6372 O HOH A2017 30.405 7.796 43.957 1.00 0.00 O 0 +HETATM 6373 H1 HOH A2017 30.586 8.723 44.176 1.00 0.00 H 0 +HETATM 6374 H2 HOH A2017 29.452 7.699 43.705 1.00 0.00 H 0 +HETATM 6375 O HOH A2018 21.945 40.425 33.953 1.00 0.00 O 0 +HETATM 6376 H1 HOH A2018 21.172 40.310 33.306 1.00 0.00 H 0 +HETATM 6377 H2 HOH A2018 21.585 40.051 34.754 1.00 0.00 H 0 +HETATM 6378 O HOH A2019 16.497 22.659 10.785 1.00 0.00 O 0 +HETATM 6379 H1 HOH A2019 15.706 22.743 10.186 1.00 0.00 H 0 +HETATM 6380 H2 HOH A2019 16.326 21.882 11.371 1.00 0.00 H 0 +HETATM 6381 O HOH A2020 18.012 3.062 28.462 1.00 0.00 O 0 +HETATM 6382 H1 HOH A2020 18.185 3.834 29.062 1.00 0.00 H 0 +HETATM 6383 H2 HOH A2020 17.225 2.607 28.926 1.00 0.00 H 0 +HETATM 6384 O HOH A2021 45.142 6.754 13.647 1.00 0.00 O 0 +HETATM 6385 H1 HOH A2021 45.764 7.302 13.116 1.00 0.00 H 0 +HETATM 6386 H2 HOH A2021 45.631 6.124 14.146 1.00 0.00 H 0 +HETATM 6387 O HOH A2022 32.823 31.344 36.226 1.00 0.00 O 0 +HETATM 6388 H1 HOH A2022 33.126 31.292 35.293 1.00 0.00 H 0 +HETATM 6389 H2 HOH A2022 32.626 30.480 36.642 1.00 0.00 H 0 +HETATM 6390 O HOH A2023 37.985 46.012 42.552 1.00 0.00 O 0 +HETATM 6391 H1 HOH A2023 38.721 46.470 43.000 1.00 0.00 H 0 +HETATM 6392 H2 HOH A2023 37.411 45.747 43.298 1.00 0.00 H 0 +HETATM 6393 O HOH A2024 51.877 16.093 25.407 1.00 0.00 O 0 +HETATM 6394 H1 HOH A2024 51.271 15.935 26.149 1.00 0.00 H 0 +HETATM 6395 H2 HOH A2024 52.657 16.526 25.749 1.00 0.00 H 0 +HETATM 6396 O HOH A2025 32.199 2.638 46.005 1.00 0.00 O 0 +HETATM 6397 H1 HOH A2025 31.885 1.950 45.473 1.00 0.00 H 0 +HETATM 6398 H2 HOH A2025 32.449 2.310 46.860 1.00 0.00 H 0 +HETATM 6399 O HOH A2026 16.141 51.905 19.832 1.00 0.00 O 0 +HETATM 6400 H1 HOH A2026 16.714 51.517 19.191 1.00 0.00 H 0 +HETATM 6401 H2 HOH A2026 16.448 52.847 20.012 1.00 0.00 H 0 +HETATM 6402 O HOH A2027 35.230 42.618 27.389 1.00 0.00 O 0 +HETATM 6403 H1 HOH A2027 35.728 42.614 26.565 1.00 0.00 H 0 +HETATM 6404 H2 HOH A2027 35.123 43.487 27.664 1.00 0.00 H 0 +HETATM 6405 O HOH A2028 27.891 7.169 42.406 1.00 0.00 O 0 +HETATM 6406 H1 HOH A2028 28.026 7.345 41.436 1.00 0.00 H 0 +HETATM 6407 H2 HOH A2028 27.940 6.274 42.650 1.00 0.00 H 0 +HETATM 6408 O HOH A2029 50.163 30.421 25.727 1.00 0.00 O 0 +HETATM 6409 H1 HOH A2029 49.870 29.569 25.651 1.00 0.00 H 0 +HETATM 6410 H2 HOH A2029 50.551 30.521 26.560 1.00 0.00 H 0 +HETATM 6411 O HOH A2030 2.842 15.558 11.837 1.00 0.00 O 0 +HETATM 6412 H1 HOH A2030 2.054 16.063 12.179 1.00 0.00 H 0 +HETATM 6413 H2 HOH A2030 3.024 14.655 12.310 1.00 0.00 H 0 +HETATM 6414 O HOH A2031 1.744 32.167 14.325 1.00 0.00 O 0 +HETATM 6415 H1 HOH A2031 1.347 32.973 13.858 1.00 0.00 H 0 +HETATM 6416 H2 HOH A2031 1.286 31.422 13.862 1.00 0.00 H 0 +HETATM 6417 O HOH A2032 47.897 0.556 43.600 1.00 0.00 O 0 +HETATM 6418 H1 HOH A2032 48.846 0.779 43.658 1.00 0.00 H 0 +HETATM 6419 H2 HOH A2032 47.671 0.499 42.671 1.00 0.00 H 0 +HETATM 6420 O HOH A2033 8.847 1.396 16.662 1.00 0.00 O 0 +HETATM 6421 H1 HOH A2033 8.991 0.949 17.431 1.00 0.00 H 0 +HETATM 6422 H2 HOH A2033 8.902 0.660 15.979 1.00 0.00 H 0 +HETATM 6423 O HOH A2034 47.188 22.012 17.379 1.00 0.00 O 0 +HETATM 6424 H1 HOH A2034 47.318 22.088 16.448 1.00 0.00 H 0 +HETATM 6425 H2 HOH A2034 47.781 21.366 17.751 1.00 0.00 H 0 +HETATM 6426 O HOH A2035 25.342 11.513 25.142 1.00 0.00 O 0 +HETATM 6427 H1 HOH A2035 24.399 11.763 24.957 1.00 0.00 H 0 +HETATM 6428 H2 HOH A2035 25.820 11.848 24.314 1.00 0.00 H 0 +HETATM 6429 O HOH A2036 2.365 18.517 12.318 1.00 0.00 O 0 +HETATM 6430 H1 HOH A2036 2.297 19.019 11.491 1.00 0.00 H 0 +HETATM 6431 H2 HOH A2036 1.591 18.728 12.873 1.00 0.00 H 0 +HETATM 6432 O HOH A2037 2.310 31.174 47.088 1.00 0.00 O 0 +HETATM 6433 H1 HOH A2037 1.650 30.904 46.408 1.00 0.00 H 0 +HETATM 6434 H2 HOH A2037 1.796 31.095 47.949 1.00 0.00 H 0 +HETATM 6435 O HOH A2038 27.197 37.664 4.277 1.00 0.00 O 0 +HETATM 6436 H1 HOH A2038 26.744 37.207 3.575 1.00 0.00 H 0 +HETATM 6437 H2 HOH A2038 28.049 37.325 4.215 1.00 0.00 H 0 +HETATM 6438 O HOH A2039 22.322 46.628 49.776 1.00 0.00 O 0 +HETATM 6439 H1 HOH A2039 22.165 46.887 48.881 1.00 0.00 H 0 +HETATM 6440 H2 HOH A2039 23.149 47.101 50.103 1.00 0.00 H 0 +HETATM 6441 O HOH A2040 18.407 53.612 36.082 1.00 0.00 O 0 +HETATM 6442 H1 HOH A2040 18.094 52.945 36.736 1.00 0.00 H 0 +HETATM 6443 H2 HOH A2040 18.947 53.204 35.376 1.00 0.00 H 0 +HETATM 6444 O HOH A2041 5.877 1.971 24.549 1.00 0.00 O 0 +HETATM 6445 H1 HOH A2041 6.768 2.297 24.333 1.00 0.00 H 0 +HETATM 6446 H2 HOH A2041 5.474 1.709 23.727 1.00 0.00 H 0 +HETATM 6447 O HOH A2042 9.894 25.761 21.207 1.00 0.00 O 0 +HETATM 6448 H1 HOH A2042 9.363 25.586 21.988 1.00 0.00 H 0 +HETATM 6449 H2 HOH A2042 9.259 25.944 20.460 1.00 0.00 H 0 +HETATM 6450 O HOH A2043 22.579 40.143 5.767 1.00 0.00 O 0 +HETATM 6451 H1 HOH A2043 23.292 39.942 6.371 1.00 0.00 H 0 +HETATM 6452 H2 HOH A2043 21.688 39.878 6.112 1.00 0.00 H 0 +HETATM 6453 O HOH A2044 13.583 18.401 24.469 1.00 0.00 O 0 +HETATM 6454 H1 HOH A2044 12.935 17.769 24.824 1.00 0.00 H 0 +HETATM 6455 H2 HOH A2044 14.378 17.982 24.141 1.00 0.00 H 0 +HETATM 6456 O HOH A2045 17.971 24.794 25.882 1.00 0.00 O 0 +HETATM 6457 H1 HOH A2045 17.811 24.810 26.756 1.00 0.00 H 0 +HETATM 6458 H2 HOH A2045 17.091 24.898 25.450 1.00 0.00 H 0 +HETATM 6459 O HOH A2046 15.451 49.187 52.533 1.00 0.00 O 0 +HETATM 6460 H1 HOH A2046 15.789 50.101 52.480 1.00 0.00 H 0 +HETATM 6461 H2 HOH A2046 14.498 49.261 52.714 1.00 0.00 H 0 +HETATM 6462 O HOH A2047 21.950 34.394 39.553 1.00 0.00 O 0 +HETATM 6463 H1 HOH A2047 21.494 33.527 39.360 1.00 0.00 H 0 +HETATM 6464 H2 HOH A2047 22.904 34.313 39.696 1.00 0.00 H 0 +HETATM 6465 O HOH A2048 17.725 20.591 45.316 1.00 0.00 O 0 +HETATM 6466 H1 HOH A2048 16.994 21.288 45.291 1.00 0.00 H 0 +HETATM 6467 H2 HOH A2048 17.770 19.953 44.578 1.00 0.00 H 0 +HETATM 6468 O HOH A2049 13.115 27.887 16.994 1.00 0.00 O 0 +HETATM 6469 H1 HOH A2049 12.921 27.711 16.102 1.00 0.00 H 0 +HETATM 6470 H2 HOH A2049 13.264 26.935 17.378 1.00 0.00 H 0 +HETATM 6471 O HOH A2050 43.623 3.156 44.740 1.00 0.00 O 0 +HETATM 6472 H1 HOH A2050 42.940 2.470 44.724 1.00 0.00 H 0 +HETATM 6473 H2 HOH A2050 44.432 2.684 44.358 1.00 0.00 H 0 +HETATM 6474 O HOH A2051 22.217 18.950 43.671 1.00 0.00 O 0 +HETATM 6475 H1 HOH A2051 21.535 19.208 43.025 1.00 0.00 H 0 +HETATM 6476 H2 HOH A2051 22.483 19.845 44.067 1.00 0.00 H 0 +HETATM 6477 O HOH A2052 38.646 18.283 43.478 1.00 0.00 O 0 +HETATM 6478 H1 HOH A2052 39.564 18.096 43.584 1.00 0.00 H 0 +HETATM 6479 H2 HOH A2052 38.410 19.203 43.828 1.00 0.00 H 0 +HETATM 6480 O HOH A2053 35.188 12.209 25.934 1.00 0.00 O 0 +HETATM 6481 H1 HOH A2053 35.915 12.359 25.251 1.00 0.00 H 0 +HETATM 6482 H2 HOH A2053 34.319 12.527 25.605 1.00 0.00 H 0 +HETATM 6483 O HOH A2054 42.235 37.352 39.426 1.00 0.00 O 0 +HETATM 6484 H1 HOH A2054 42.962 38.017 39.792 1.00 0.00 H 0 +HETATM 6485 H2 HOH A2054 42.110 36.710 40.114 1.00 0.00 H 0 +HETATM 6486 O HOH A2055 4.116 40.932 24.733 1.00 0.00 O 0 +HETATM 6487 H1 HOH A2055 4.835 40.349 24.296 1.00 0.00 H 0 +HETATM 6488 H2 HOH A2055 3.395 40.308 25.012 1.00 0.00 H 0 +HETATM 6489 O HOH A2056 4.093 51.700 16.072 1.00 0.00 O 0 +HETATM 6490 H1 HOH A2056 3.445 51.689 16.797 1.00 0.00 H 0 +HETATM 6491 H2 HOH A2056 3.566 51.917 15.342 1.00 0.00 H 0 +HETATM 6492 O HOH A2057 39.972 34.025 15.291 1.00 0.00 O 0 +HETATM 6493 H1 HOH A2057 40.194 34.927 15.273 1.00 0.00 H 0 +HETATM 6494 H2 HOH A2057 40.641 33.657 15.963 1.00 0.00 H 0 +HETATM 6495 O HOH A2058 12.643 4.472 47.412 1.00 0.00 O 0 +HETATM 6496 H1 HOH A2058 12.521 4.431 48.393 1.00 0.00 H 0 +HETATM 6497 H2 HOH A2058 12.524 5.393 47.073 1.00 0.00 H 0 +HETATM 6498 O HOH A2059 20.349 20.084 41.891 1.00 0.00 O 0 +HETATM 6499 H1 HOH A2059 20.365 19.712 41.003 1.00 0.00 H 0 +HETATM 6500 H2 HOH A2059 19.932 20.931 41.688 1.00 0.00 H 0 +HETATM 6501 O HOH A2060 29.122 37.084 47.932 1.00 0.00 O 0 +HETATM 6502 H1 HOH A2060 29.383 37.475 48.756 1.00 0.00 H 0 +HETATM 6503 H2 HOH A2060 29.405 36.214 48.001 1.00 0.00 H 0 +HETATM 6504 O HOH A2061 20.108 24.855 50.192 1.00 0.00 O 0 +HETATM 6505 H1 HOH A2061 19.435 24.213 50.277 1.00 0.00 H 0 +HETATM 6506 H2 HOH A2061 20.572 24.549 49.475 1.00 0.00 H 0 +HETATM 6507 O HOH A2062 32.286 36.168 18.250 1.00 0.00 O 0 +HETATM 6508 H1 HOH A2062 33.125 36.332 18.620 1.00 0.00 H 0 +HETATM 6509 H2 HOH A2062 31.667 35.912 18.979 1.00 0.00 H 0 +HETATM 6510 O HOH A2063 21.764 46.831 33.312 1.00 0.00 O 0 +HETATM 6511 H1 HOH A2063 21.649 47.536 33.925 1.00 0.00 H 0 +HETATM 6512 H2 HOH A2063 22.019 46.062 33.869 1.00 0.00 H 0 +HETATM 6513 O HOH A2064 12.541 42.630 31.530 1.00 0.00 O 0 +HETATM 6514 H1 HOH A2064 11.726 42.981 31.164 1.00 0.00 H 0 +HETATM 6515 H2 HOH A2064 12.859 43.266 32.165 1.00 0.00 H 0 +HETATM 6516 O HOH A2065 32.992 45.378 14.991 1.00 0.00 O 0 +HETATM 6517 H1 HOH A2065 33.742 44.705 14.842 1.00 0.00 H 0 +HETATM 6518 H2 HOH A2065 33.254 46.191 14.513 1.00 0.00 H 0 +HETATM 6519 O HOH A2066 44.460 49.341 18.289 1.00 0.00 O 0 +HETATM 6520 H1 HOH A2066 43.720 49.907 18.452 1.00 0.00 H 0 +HETATM 6521 H2 HOH A2066 44.567 49.294 17.288 1.00 0.00 H 0 +HETATM 6522 O HOH A2067 42.366 20.148 37.235 1.00 0.00 O 0 +HETATM 6523 H1 HOH A2067 42.332 20.424 36.290 1.00 0.00 H 0 +HETATM 6524 H2 HOH A2067 41.553 20.422 37.646 1.00 0.00 H 0 +HETATM 6525 O HOH A2068 42.770 7.409 28.317 1.00 0.00 O 0 +HETATM 6526 H1 HOH A2068 42.147 8.013 28.761 1.00 0.00 H 0 +HETATM 6527 H2 HOH A2068 42.249 7.085 27.485 1.00 0.00 H 0 +HETATM 6528 O HOH A2069 36.587 7.540 47.990 1.00 0.00 O 0 +HETATM 6529 H1 HOH A2069 36.139 7.125 47.256 1.00 0.00 H 0 +HETATM 6530 H2 HOH A2069 37.494 7.877 47.767 1.00 0.00 H 0 +HETATM 6531 O HOH A2070 23.801 2.347 19.536 1.00 0.00 O 0 +HETATM 6532 H1 HOH A2070 24.102 1.853 18.802 1.00 0.00 H 0 +HETATM 6533 H2 HOH A2070 23.095 2.980 19.271 1.00 0.00 H 0 +HETATM 6534 O HOH A2071 7.837 30.728 10.629 1.00 0.00 O 0 +HETATM 6535 H1 HOH A2071 8.735 30.697 10.968 1.00 0.00 H 0 +HETATM 6536 H2 HOH A2071 7.435 29.824 10.788 1.00 0.00 H 0 +HETATM 6537 O HOH A2072 21.801 0.450 3.994 1.00 0.00 O 0 +HETATM 6538 H1 HOH A2072 21.143 0.115 4.531 1.00 0.00 H 0 +HETATM 6539 H2 HOH A2072 21.511 1.328 3.805 1.00 0.00 H 0 +HETATM 6540 O HOH A2073 43.464 35.258 19.663 1.00 0.00 O 0 +HETATM 6541 H1 HOH A2073 42.548 35.021 19.427 1.00 0.00 H 0 +HETATM 6542 H2 HOH A2073 43.992 35.102 18.878 1.00 0.00 H 0 +HETATM 6543 O HOH A2074 49.528 26.673 47.202 1.00 0.00 O 0 +HETATM 6544 H1 HOH A2074 49.824 27.278 46.477 1.00 0.00 H 0 +HETATM 6545 H2 HOH A2074 50.311 26.415 47.681 1.00 0.00 H 0 +HETATM 6546 O HOH A2075 32.169 23.117 38.438 1.00 0.00 O 0 +HETATM 6547 H1 HOH A2075 32.518 22.338 38.942 1.00 0.00 H 0 +HETATM 6548 H2 HOH A2075 31.228 23.191 38.632 1.00 0.00 H 0 +HETATM 6549 O HOH A2076 43.380 29.709 49.049 1.00 0.00 O 0 +HETATM 6550 H1 HOH A2076 44.248 29.734 49.529 1.00 0.00 H 0 +HETATM 6551 H2 HOH A2076 43.550 29.909 48.129 1.00 0.00 H 0 +HETATM 6552 O HOH A2077 28.146 44.276 10.249 1.00 0.00 O 0 +HETATM 6553 H1 HOH A2077 27.231 44.256 9.893 1.00 0.00 H 0 +HETATM 6554 H2 HOH A2077 28.579 44.977 9.711 1.00 0.00 H 0 +HETATM 6555 O HOH A2078 0.151 53.016 25.049 1.00 0.00 O 0 +HETATM 6556 H1 HOH A2078 0.522 53.403 24.222 1.00 0.00 H 0 +HETATM 6557 H2 HOH A2078 0.712 53.453 25.689 1.00 0.00 H 0 +HETATM 6558 O HOH A2079 7.583 13.872 43.094 1.00 0.00 O 0 +HETATM 6559 H1 HOH A2079 7.318 13.040 43.516 1.00 0.00 H 0 +HETATM 6560 H2 HOH A2079 6.971 14.606 43.448 1.00 0.00 H 0 +HETATM 6561 O HOH A2080 48.281 41.432 1.168 1.00 0.00 O 0 +HETATM 6562 H1 HOH A2080 47.491 41.412 0.510 1.00 0.00 H 0 +HETATM 6563 H2 HOH A2080 48.968 40.930 0.711 1.00 0.00 H 0 +HETATM 6564 O HOH A2081 9.694 22.783 48.847 1.00 0.00 O 0 +HETATM 6565 H1 HOH A2081 10.562 22.878 48.521 1.00 0.00 H 0 +HETATM 6566 H2 HOH A2081 9.807 22.270 49.658 1.00 0.00 H 0 +HETATM 6567 O HOH A2082 23.209 3.812 5.896 1.00 0.00 O 0 +HETATM 6568 H1 HOH A2082 22.281 3.971 5.871 1.00 0.00 H 0 +HETATM 6569 H2 HOH A2082 23.486 3.667 4.950 1.00 0.00 H 0 +HETATM 6570 O HOH A2083 4.817 12.247 40.148 1.00 0.00 O 0 +HETATM 6571 H1 HOH A2083 4.096 12.839 40.347 1.00 0.00 H 0 +HETATM 6572 H2 HOH A2083 4.552 11.983 39.211 1.00 0.00 H 0 +HETATM 6573 O HOH A2084 25.995 1.605 48.426 1.00 0.00 O 0 +HETATM 6574 H1 HOH A2084 25.058 1.521 48.143 1.00 0.00 H 0 +HETATM 6575 H2 HOH A2084 26.049 1.135 49.250 1.00 0.00 H 0 +HETATM 6576 O HOH A2085 10.837 43.008 17.347 1.00 0.00 O 0 +HETATM 6577 H1 HOH A2085 9.963 42.682 17.228 1.00 0.00 H 0 +HETATM 6578 H2 HOH A2085 10.642 43.927 17.513 1.00 0.00 H 0 +HETATM 6579 O HOH A2086 16.520 30.545 41.165 1.00 0.00 O 0 +HETATM 6580 H1 HOH A2086 15.745 30.048 41.226 1.00 0.00 H 0 +HETATM 6581 H2 HOH A2086 16.633 30.927 42.046 1.00 0.00 H 0 +HETATM 6582 O HOH A2087 2.631 30.887 32.735 1.00 0.00 O 0 +HETATM 6583 H1 HOH A2087 3.393 30.376 33.025 1.00 0.00 H 0 +HETATM 6584 H2 HOH A2087 1.856 30.270 32.675 1.00 0.00 H 0 +HETATM 6585 O HOH A2088 41.796 37.694 9.142 1.00 0.00 O 0 +HETATM 6586 H1 HOH A2088 41.891 38.613 8.766 1.00 0.00 H 0 +HETATM 6587 H2 HOH A2088 41.348 37.764 9.956 1.00 0.00 H 0 +HETATM 6588 O HOH A2089 17.555 9.425 37.751 1.00 0.00 O 0 +HETATM 6589 H1 HOH A2089 17.236 8.508 37.848 1.00 0.00 H 0 +HETATM 6590 H2 HOH A2089 17.736 9.644 36.793 1.00 0.00 H 0 +HETATM 6591 O HOH A2090 43.787 14.263 3.501 1.00 0.00 O 0 +HETATM 6592 H1 HOH A2090 42.922 14.377 3.141 1.00 0.00 H 0 +HETATM 6593 H2 HOH A2090 43.655 13.417 3.951 1.00 0.00 H 0 +HETATM 6594 O HOH A2091 44.218 11.345 16.783 1.00 0.00 O 0 +HETATM 6595 H1 HOH A2091 44.733 10.827 17.370 1.00 0.00 H 0 +HETATM 6596 H2 HOH A2091 44.738 11.424 15.993 1.00 0.00 H 0 +HETATM 6597 O HOH A2092 46.559 36.741 13.577 1.00 0.00 O 0 +HETATM 6598 H1 HOH A2092 46.092 36.732 14.425 1.00 0.00 H 0 +HETATM 6599 H2 HOH A2092 47.518 36.935 13.636 1.00 0.00 H 0 +HETATM 6600 O HOH A2093 16.174 16.027 12.825 1.00 0.00 O 0 +HETATM 6601 H1 HOH A2093 16.121 16.591 13.574 1.00 0.00 H 0 +HETATM 6602 H2 HOH A2093 17.048 16.326 12.474 1.00 0.00 H 0 +HETATM 6603 O HOH A2094 20.215 33.326 21.714 1.00 0.00 O 0 +HETATM 6604 H1 HOH A2094 19.670 34.041 21.936 1.00 0.00 H 0 +HETATM 6605 H2 HOH A2094 21.004 33.518 22.249 1.00 0.00 H 0 +HETATM 6606 O HOH A2095 51.614 32.852 18.550 1.00 0.00 O 0 +HETATM 6607 H1 HOH A2095 51.523 32.224 19.280 1.00 0.00 H 0 +HETATM 6608 H2 HOH A2095 51.834 32.276 17.805 1.00 0.00 H 0 +HETATM 6609 O HOH A2096 20.168 23.018 1.057 1.00 0.00 O 0 +HETATM 6610 H1 HOH A2096 19.447 23.218 1.624 1.00 0.00 H 0 +HETATM 6611 H2 HOH A2096 19.838 22.804 0.179 1.00 0.00 H 0 +HETATM 6612 O HOH A2097 26.161 35.960 49.181 1.00 0.00 O 0 +HETATM 6613 H1 HOH A2097 26.285 36.865 49.550 1.00 0.00 H 0 +HETATM 6614 H2 HOH A2097 27.065 35.666 48.921 1.00 0.00 H 0 +HETATM 6615 O HOH A2098 37.045 25.739 14.073 1.00 0.00 O 0 +HETATM 6616 H1 HOH A2098 36.151 25.395 14.197 1.00 0.00 H 0 +HETATM 6617 H2 HOH A2098 36.934 26.177 13.196 1.00 0.00 H 0 +HETATM 6618 O HOH A2099 26.930 4.174 49.085 1.00 0.00 O 0 +HETATM 6619 H1 HOH A2099 26.623 3.334 48.741 1.00 0.00 H 0 +HETATM 6620 H2 HOH A2099 27.883 4.106 49.068 1.00 0.00 H 0 +HETATM 6621 O HOH A2100 23.047 25.087 17.309 1.00 0.00 O 0 +HETATM 6622 H1 HOH A2100 23.031 25.954 17.624 1.00 0.00 H 0 +HETATM 6623 H2 HOH A2100 22.222 24.938 16.906 1.00 0.00 H 0 +HETATM 6624 O HOH A2101 27.056 1.135 10.876 1.00 0.00 O 0 +HETATM 6625 H1 HOH A2101 27.700 0.388 11.014 1.00 0.00 H 0 +HETATM 6626 H2 HOH A2101 27.304 1.904 11.447 1.00 0.00 H 0 +HETATM 6627 O HOH A2102 49.801 50.186 29.330 1.00 0.00 O 0 +HETATM 6628 H1 HOH A2102 50.015 51.011 29.782 1.00 0.00 H 0 +HETATM 6629 H2 HOH A2102 50.187 50.215 28.397 1.00 0.00 H 0 +HETATM 6630 O HOH A2103 7.568 32.065 15.625 1.00 0.00 O 0 +HETATM 6631 H1 HOH A2103 6.747 31.613 16.001 1.00 0.00 H 0 +HETATM 6632 H2 HOH A2103 7.451 32.203 14.667 1.00 0.00 H 0 +HETATM 6633 O HOH A2104 30.001 43.248 19.986 1.00 0.00 O 0 +HETATM 6634 H1 HOH A2104 29.266 43.870 20.083 1.00 0.00 H 0 +HETATM 6635 H2 HOH A2104 29.669 42.359 19.985 1.00 0.00 H 0 +HETATM 6636 O HOH A2105 6.993 7.090 22.295 1.00 0.00 O 0 +HETATM 6637 H1 HOH A2105 6.915 6.153 22.084 1.00 0.00 H 0 +HETATM 6638 H2 HOH A2105 6.456 7.153 23.115 1.00 0.00 H 0 +HETATM 6639 O HOH A2106 34.740 45.273 46.837 1.00 0.00 O 0 +HETATM 6640 H1 HOH A2106 35.023 45.066 47.787 1.00 0.00 H 0 +HETATM 6641 H2 HOH A2106 33.860 45.595 46.874 1.00 0.00 H 0 +HETATM 6642 O HOH A2107 42.878 39.700 30.849 1.00 0.00 O 0 +HETATM 6643 H1 HOH A2107 43.447 40.391 31.225 1.00 0.00 H 0 +HETATM 6644 H2 HOH A2107 42.347 39.369 31.616 1.00 0.00 H 0 +HETATM 6645 O HOH A2108 34.526 40.716 37.502 1.00 0.00 O 0 +HETATM 6646 H1 HOH A2108 34.921 39.805 37.228 1.00 0.00 H 0 +HETATM 6647 H2 HOH A2108 35.277 41.313 37.616 1.00 0.00 H 0 +HETATM 6648 O HOH A2109 25.692 24.975 37.815 1.00 0.00 O 0 +HETATM 6649 H1 HOH A2109 25.932 25.825 38.182 1.00 0.00 H 0 +HETATM 6650 H2 HOH A2109 24.740 25.015 37.667 1.00 0.00 H 0 +HETATM 6651 O HOH A2110 10.827 38.853 26.532 1.00 0.00 O 0 +HETATM 6652 H1 HOH A2110 10.266 38.984 27.289 1.00 0.00 H 0 +HETATM 6653 H2 HOH A2110 11.713 39.117 26.819 1.00 0.00 H 0 +HETATM 6654 O HOH A2111 18.431 34.179 48.897 1.00 0.00 O 0 +HETATM 6655 H1 HOH A2111 17.488 33.921 48.920 1.00 0.00 H 0 +HETATM 6656 H2 HOH A2111 18.371 35.015 48.452 1.00 0.00 H 0 +HETATM 6657 O HOH A2112 34.731 17.116 1.863 1.00 0.00 O 0 +HETATM 6658 H1 HOH A2112 34.851 17.719 2.667 1.00 0.00 H 0 +HETATM 6659 H2 HOH A2112 35.616 16.861 1.554 1.00 0.00 H 0 +HETATM 6660 O HOH A2113 28.218 45.851 49.428 1.00 0.00 O 0 +HETATM 6661 H1 HOH A2113 27.949 46.331 48.657 1.00 0.00 H 0 +HETATM 6662 H2 HOH A2113 27.379 45.718 50.000 1.00 0.00 H 0 +HETATM 6663 O HOH A2114 26.316 26.441 35.346 1.00 0.00 O 0 +HETATM 6664 H1 HOH A2114 26.346 27.062 36.110 1.00 0.00 H 0 +HETATM 6665 H2 HOH A2114 26.054 25.530 35.691 1.00 0.00 H 0 +HETATM 6666 O HOH A2115 34.429 37.962 21.954 1.00 0.00 O 0 +HETATM 6667 H1 HOH A2115 34.768 37.123 22.221 1.00 0.00 H 0 +HETATM 6668 H2 HOH A2115 35.046 38.654 22.300 1.00 0.00 H 0 +HETATM 6669 O HOH A2116 49.541 37.919 30.378 1.00 0.00 O 0 +HETATM 6670 H1 HOH A2116 48.942 38.746 30.448 1.00 0.00 H 0 +HETATM 6671 H2 HOH A2116 48.992 37.190 30.322 1.00 0.00 H 0 +HETATM 6672 O HOH A2117 11.235 52.242 25.415 1.00 0.00 O 0 +HETATM 6673 H1 HOH A2117 10.361 52.750 25.375 1.00 0.00 H 0 +HETATM 6674 H2 HOH A2117 11.343 51.783 24.569 1.00 0.00 H 0 +HETATM 6675 O HOH A2118 37.447 42.445 25.624 1.00 0.00 O 0 +HETATM 6676 H1 HOH A2118 38.230 41.851 25.529 1.00 0.00 H 0 +HETATM 6677 H2 HOH A2118 37.587 43.347 25.295 1.00 0.00 H 0 +HETATM 6678 O HOH A2119 9.478 13.281 2.090 1.00 0.00 O 0 +HETATM 6679 H1 HOH A2119 9.477 13.332 3.045 1.00 0.00 H 0 +HETATM 6680 H2 HOH A2119 8.670 12.906 1.794 1.00 0.00 H 0 +HETATM 6681 O HOH A2120 13.139 38.022 52.077 1.00 0.00 O 0 +HETATM 6682 H1 HOH A2120 12.346 38.088 52.538 1.00 0.00 H 0 +HETATM 6683 H2 HOH A2120 13.867 38.435 52.602 1.00 0.00 H 0 +HETATM 6684 O HOH A2121 37.394 4.470 1.709 1.00 0.00 O 0 +HETATM 6685 H1 HOH A2121 36.902 5.004 2.303 1.00 0.00 H 0 +HETATM 6686 H2 HOH A2121 38.328 4.614 1.827 1.00 0.00 H 0 +HETATM 6687 O HOH A2122 43.302 44.068 48.841 1.00 0.00 O 0 +HETATM 6688 H1 HOH A2122 44.033 44.422 48.221 1.00 0.00 H 0 +HETATM 6689 H2 HOH A2122 42.467 44.009 48.361 1.00 0.00 H 0 +HETATM 6690 O HOH A2123 43.639 47.261 21.551 1.00 0.00 O 0 +HETATM 6691 H1 HOH A2123 43.011 48.094 21.700 1.00 0.00 H 0 +HETATM 6692 H2 HOH A2123 44.494 47.501 21.849 1.00 0.00 H 0 +HETATM 6693 O HOH A2124 24.371 12.296 19.156 1.00 0.00 O 0 +HETATM 6694 H1 HOH A2124 25.310 12.508 19.050 1.00 0.00 H 0 +HETATM 6695 H2 HOH A2124 24.208 11.863 19.961 1.00 0.00 H 0 +HETATM 6696 O HOH A2125 20.515 42.098 15.425 1.00 0.00 O 0 +HETATM 6697 H1 HOH A2125 20.152 42.091 14.485 1.00 0.00 H 0 +HETATM 6698 H2 HOH A2125 19.778 41.881 15.986 1.00 0.00 H 0 +HETATM 6699 O HOH A2126 10.926 18.114 35.644 1.00 0.00 O 0 +HETATM 6700 H1 HOH A2126 11.709 17.625 35.932 1.00 0.00 H 0 +HETATM 6701 H2 HOH A2126 10.105 17.712 36.013 1.00 0.00 H 0 +HETATM 6702 O HOH A2127 18.737 37.061 31.253 1.00 0.00 O 0 +HETATM 6703 H1 HOH A2127 19.189 37.950 31.193 1.00 0.00 H 0 +HETATM 6704 H2 HOH A2127 18.917 36.821 32.156 1.00 0.00 H 0 +HETATM 6705 O HOH A2128 30.222 4.829 51.895 1.00 0.00 O 0 +HETATM 6706 H1 HOH A2128 30.056 5.032 52.824 1.00 0.00 H 0 +HETATM 6707 H2 HOH A2128 29.848 3.932 51.736 1.00 0.00 H 0 +HETATM 6708 O HOH A2129 11.419 5.217 52.507 1.00 0.00 O 0 +HETATM 6709 H1 HOH A2129 12.251 5.055 52.957 1.00 0.00 H 0 +HETATM 6710 H2 HOH A2129 11.586 4.813 51.631 1.00 0.00 H 0 +HETATM 6711 O HOH A2130 38.259 32.816 17.024 1.00 0.00 O 0 +HETATM 6712 H1 HOH A2130 38.112 31.967 16.728 1.00 0.00 H 0 +HETATM 6713 H2 HOH A2130 38.621 33.263 16.241 1.00 0.00 H 0 +HETATM 6714 O HOH A2131 36.629 4.108 8.137 1.00 0.00 O 0 +HETATM 6715 H1 HOH A2131 37.563 4.136 7.803 1.00 0.00 H 0 +HETATM 6716 H2 HOH A2131 36.054 4.434 7.499 1.00 0.00 H 0 +HETATM 6717 O HOH A2132 35.584 51.478 45.774 1.00 0.00 O 0 +HETATM 6718 H1 HOH A2132 35.981 51.732 44.908 1.00 0.00 H 0 +HETATM 6719 H2 HOH A2132 36.265 51.671 46.470 1.00 0.00 H 0 +HETATM 6720 O HOH A2133 24.632 21.893 51.902 1.00 0.00 O 0 +HETATM 6721 H1 HOH A2133 24.125 21.026 51.841 1.00 0.00 H 0 +HETATM 6722 H2 HOH A2133 24.422 22.183 51.000 1.00 0.00 H 0 +HETATM 6723 O HOH A2134 16.656 26.983 50.865 1.00 0.00 O 0 +HETATM 6724 H1 HOH A2134 17.362 27.247 50.281 1.00 0.00 H 0 +HETATM 6725 H2 HOH A2134 17.114 26.774 51.702 1.00 0.00 H 0 +HETATM 6726 O HOH A2135 29.742 44.674 1.444 1.00 0.00 O 0 +HETATM 6727 H1 HOH A2135 29.882 43.816 0.964 1.00 0.00 H 0 +HETATM 6728 H2 HOH A2135 30.587 44.874 1.866 1.00 0.00 H 0 +HETATM 6729 O HOH A2136 42.230 36.512 25.464 1.00 0.00 O 0 +HETATM 6730 H1 HOH A2136 42.029 36.303 24.535 1.00 0.00 H 0 +HETATM 6731 H2 HOH A2136 43.149 36.703 25.475 1.00 0.00 H 0 +HETATM 6732 O HOH A2137 47.391 23.958 41.237 1.00 0.00 O 0 +HETATM 6733 H1 HOH A2137 46.855 24.067 42.053 1.00 0.00 H 0 +HETATM 6734 H2 HOH A2137 46.692 23.724 40.600 1.00 0.00 H 0 +HETATM 6735 O HOH A2138 32.101 24.987 1.643 1.00 0.00 O 0 +HETATM 6736 H1 HOH A2138 32.457 24.136 1.882 1.00 0.00 H 0 +HETATM 6737 H2 HOH A2138 32.657 25.656 2.112 1.00 0.00 H 0 +HETATM 6738 O HOH A2139 49.924 1.462 30.158 1.00 0.00 O 0 +HETATM 6739 H1 HOH A2139 50.565 2.182 30.349 1.00 0.00 H 0 +HETATM 6740 H2 HOH A2139 49.299 1.802 29.506 1.00 0.00 H 0 +HETATM 6741 O HOH A2140 38.707 1.664 22.804 1.00 0.00 O 0 +HETATM 6742 H1 HOH A2140 39.501 1.287 23.237 1.00 0.00 H 0 +HETATM 6743 H2 HOH A2140 38.721 1.780 21.818 1.00 0.00 H 0 +HETATM 6744 O HOH A2141 41.076 28.042 36.707 1.00 0.00 O 0 +HETATM 6745 H1 HOH A2141 40.841 28.089 35.761 1.00 0.00 H 0 +HETATM 6746 H2 HOH A2141 41.835 28.542 36.870 1.00 0.00 H 0 +HETATM 6747 O HOH A2142 51.049 9.932 41.248 1.00 0.00 O 0 +HETATM 6748 H1 HOH A2142 51.932 9.536 41.163 1.00 0.00 H 0 +HETATM 6749 H2 HOH A2142 50.620 9.756 40.378 1.00 0.00 H 0 +HETATM 6750 O HOH A2143 12.532 34.619 53.178 1.00 0.00 O 0 +HETATM 6751 H1 HOH A2143 13.288 34.296 53.682 1.00 0.00 H 0 +HETATM 6752 H2 HOH A2143 12.100 35.244 53.758 1.00 0.00 H 0 +HETATM 6753 O HOH A2144 19.226 38.725 18.361 1.00 0.00 O 0 +HETATM 6754 H1 HOH A2144 19.867 38.216 17.859 1.00 0.00 H 0 +HETATM 6755 H2 HOH A2144 19.566 38.782 19.208 1.00 0.00 H 0 +HETATM 6756 O HOH A2145 37.826 9.346 42.913 1.00 0.00 O 0 +HETATM 6757 H1 HOH A2145 38.620 8.986 43.346 1.00 0.00 H 0 +HETATM 6758 H2 HOH A2145 37.921 10.324 42.781 1.00 0.00 H 0 +HETATM 6759 O HOH A2146 39.974 11.627 13.140 1.00 0.00 O 0 +HETATM 6760 H1 HOH A2146 39.355 12.231 12.750 1.00 0.00 H 0 +HETATM 6761 H2 HOH A2146 39.536 11.505 14.028 1.00 0.00 H 0 +HETATM 6762 O HOH A2147 15.524 6.226 22.875 1.00 0.00 O 0 +HETATM 6763 H1 HOH A2147 14.944 6.574 22.263 1.00 0.00 H 0 +HETATM 6764 H2 HOH A2147 15.067 6.263 23.739 1.00 0.00 H 0 +HETATM 6765 O HOH A2148 44.589 38.363 52.814 1.00 0.00 O 0 +HETATM 6766 H1 HOH A2148 44.480 39.119 52.187 1.00 0.00 H 0 +HETATM 6767 H2 HOH A2148 45.455 37.954 52.714 1.00 0.00 H 0 +HETATM 6768 O HOH A2149 50.969 33.806 22.834 1.00 0.00 O 0 +HETATM 6769 H1 HOH A2149 50.640 34.026 23.775 1.00 0.00 H 0 +HETATM 6770 H2 HOH A2149 51.773 33.258 22.687 1.00 0.00 H 0 +HETATM 6771 O HOH A2150 48.347 27.840 49.754 1.00 0.00 O 0 +HETATM 6772 H1 HOH A2150 48.653 27.446 48.901 1.00 0.00 H 0 +HETATM 6773 H2 HOH A2150 49.051 27.826 50.389 1.00 0.00 H 0 +HETATM 6774 O HOH A2151 3.097 41.813 41.843 1.00 0.00 O 0 +HETATM 6775 H1 HOH A2151 3.520 41.334 42.561 1.00 0.00 H 0 +HETATM 6776 H2 HOH A2151 3.760 42.350 41.376 1.00 0.00 H 0 +HETATM 6777 O HOH A2152 36.179 50.354 24.170 1.00 0.00 O 0 +HETATM 6778 H1 HOH A2152 36.373 50.023 25.118 1.00 0.00 H 0 +HETATM 6779 H2 HOH A2152 36.925 50.860 23.911 1.00 0.00 H 0 +HETATM 6780 O HOH A2153 7.456 24.666 12.579 1.00 0.00 O 0 +HETATM 6781 H1 HOH A2153 8.179 24.431 13.198 1.00 0.00 H 0 +HETATM 6782 H2 HOH A2153 7.107 23.768 12.364 1.00 0.00 H 0 +HETATM 6783 O HOH A2154 5.611 24.652 3.480 1.00 0.00 O 0 +HETATM 6784 H1 HOH A2154 4.811 24.166 3.403 1.00 0.00 H 0 +HETATM 6785 H2 HOH A2154 6.145 24.343 2.647 1.00 0.00 H 0 +HETATM 6786 O HOH A2155 5.618 53.228 51.812 1.00 0.00 O 0 +HETATM 6787 H1 HOH A2155 6.483 53.642 51.878 1.00 0.00 H 0 +HETATM 6788 H2 HOH A2155 5.262 52.988 52.698 1.00 0.00 H 0 +HETATM 6789 O HOH A2156 26.919 28.616 43.789 1.00 0.00 O 0 +HETATM 6790 H1 HOH A2156 27.100 27.667 43.920 1.00 0.00 H 0 +HETATM 6791 H2 HOH A2156 27.767 29.210 43.732 1.00 0.00 H 0 +HETATM 6792 O HOH A2157 44.901 5.017 17.718 1.00 0.00 O 0 +HETATM 6793 H1 HOH A2157 44.875 5.822 18.250 1.00 0.00 H 0 +HETATM 6794 H2 HOH A2157 44.009 4.787 17.548 1.00 0.00 H 0 +HETATM 6795 O HOH A2158 15.802 1.678 47.817 1.00 0.00 O 0 +HETATM 6796 H1 HOH A2158 16.642 1.402 48.129 1.00 0.00 H 0 +HETATM 6797 H2 HOH A2158 15.133 1.199 48.329 1.00 0.00 H 0 +HETATM 6798 O HOH A2159 30.450 13.389 23.844 1.00 0.00 O 0 +HETATM 6799 H1 HOH A2159 29.600 13.848 23.908 1.00 0.00 H 0 +HETATM 6800 H2 HOH A2159 30.721 13.433 22.948 1.00 0.00 H 0 +HETATM 6801 O HOH A2160 7.657 10.654 6.308 1.00 0.00 O 0 +HETATM 6802 H1 HOH A2160 7.224 9.907 6.734 1.00 0.00 H 0 +HETATM 6803 H2 HOH A2160 8.052 11.094 7.010 1.00 0.00 H 0 +HETATM 6804 O HOH A2161 37.418 1.980 33.326 1.00 0.00 O 0 +HETATM 6805 H1 HOH A2161 37.368 1.266 33.920 1.00 0.00 H 0 +HETATM 6806 H2 HOH A2161 38.075 1.816 32.629 1.00 0.00 H 0 +HETATM 6807 O HOH A2162 9.858 9.609 17.464 1.00 0.00 O 0 +HETATM 6808 H1 HOH A2162 10.574 10.273 17.791 1.00 0.00 H 0 +HETATM 6809 H2 HOH A2162 10.351 8.759 17.482 1.00 0.00 H 0 +HETATM 6810 O HOH A2163 45.323 35.387 17.308 1.00 0.00 O 0 +HETATM 6811 H1 HOH A2163 46.149 35.213 17.719 1.00 0.00 H 0 +HETATM 6812 H2 HOH A2163 45.288 34.779 16.581 1.00 0.00 H 0 +HETATM 6813 O HOH A2164 20.522 36.407 38.590 1.00 0.00 O 0 +HETATM 6814 H1 HOH A2164 19.650 36.107 38.771 1.00 0.00 H 0 +HETATM 6815 H2 HOH A2164 21.091 35.637 38.748 1.00 0.00 H 0 +HETATM 6816 O HOH A2165 17.839 40.825 46.122 1.00 0.00 O 0 +HETATM 6817 H1 HOH A2165 17.403 41.245 45.335 1.00 0.00 H 0 +HETATM 6818 H2 HOH A2165 17.099 40.614 46.672 1.00 0.00 H 0 +HETATM 6819 O HOH A2166 45.710 29.754 50.848 1.00 0.00 O 0 +HETATM 6820 H1 HOH A2166 45.591 29.885 51.768 1.00 0.00 H 0 +HETATM 6821 H2 HOH A2166 46.509 29.235 50.755 1.00 0.00 H 0 +HETATM 6822 O HOH A2167 19.114 46.314 20.742 1.00 0.00 O 0 +HETATM 6823 H1 HOH A2167 18.717 47.239 20.790 1.00 0.00 H 0 +HETATM 6824 H2 HOH A2167 18.631 45.928 20.005 1.00 0.00 H 0 +HETATM 6825 O HOH A2168 50.525 34.234 40.426 1.00 0.00 O 0 +HETATM 6826 H1 HOH A2168 51.327 34.613 40.808 1.00 0.00 H 0 +HETATM 6827 H2 HOH A2168 49.925 34.019 41.160 1.00 0.00 H 0 +HETATM 6828 O HOH A2169 17.566 38.341 4.182 1.00 0.00 O 0 +HETATM 6829 H1 HOH A2169 18.161 39.047 3.866 1.00 0.00 H 0 +HETATM 6830 H2 HOH A2169 17.530 38.170 5.146 1.00 0.00 H 0 +HETATM 6831 O HOH A2170 46.801 44.178 0.266 1.00 0.00 O 0 +HETATM 6832 H1 HOH A2170 45.973 43.802 0.485 1.00 0.00 H 0 +HETATM 6833 H2 HOH A2170 47.505 43.635 0.540 1.00 0.00 H 0 +HETATM 6834 O HOH A2171 51.238 47.240 0.158 1.00 0.00 O 0 +HETATM 6835 H1 HOH A2171 51.006 46.399 0.599 1.00 0.00 H 0 +HETATM 6836 H2 HOH A2171 52.085 47.018 -0.259 1.00 0.00 H 0 +HETATM 6837 O HOH A2172 18.774 24.762 45.823 1.00 0.00 O 0 +HETATM 6838 H1 HOH A2172 17.938 25.124 46.055 1.00 0.00 H 0 +HETATM 6839 H2 HOH A2172 19.426 25.368 46.079 1.00 0.00 H 0 +HETATM 6840 O HOH A2173 20.085 48.841 46.396 1.00 0.00 O 0 +HETATM 6841 H1 HOH A2173 20.799 48.261 46.734 1.00 0.00 H 0 +HETATM 6842 H2 HOH A2173 20.133 49.733 46.742 1.00 0.00 H 0 +HETATM 6843 O HOH A2174 5.644 0.515 40.955 1.00 0.00 O 0 +HETATM 6844 H1 HOH A2174 5.695 1.335 41.454 1.00 0.00 H 0 +HETATM 6845 H2 HOH A2174 5.260 0.678 40.069 1.00 0.00 H 0 +HETATM 6846 O HOH A2175 18.650 22.326 40.963 1.00 0.00 O 0 +HETATM 6847 H1 HOH A2175 17.636 22.276 40.986 1.00 0.00 H 0 +HETATM 6848 H2 HOH A2175 18.828 22.748 41.884 1.00 0.00 H 0 +HETATM 6849 O HOH A2176 0.439 15.928 6.311 1.00 0.00 O 0 +HETATM 6850 H1 HOH A2176 1.349 15.940 6.037 1.00 0.00 H 0 +HETATM 6851 H2 HOH A2176 0.290 16.788 6.755 1.00 0.00 H 0 +HETATM 6852 O HOH A2177 15.618 47.773 33.573 1.00 0.00 O 0 +HETATM 6853 H1 HOH A2177 14.968 48.501 33.543 1.00 0.00 H 0 +HETATM 6854 H2 HOH A2177 15.289 47.138 32.978 1.00 0.00 H 0 +HETATM 6855 O HOH A2178 35.261 44.248 13.704 1.00 0.00 O 0 +HETATM 6856 H1 HOH A2178 34.990 43.450 13.277 1.00 0.00 H 0 +HETATM 6857 H2 HOH A2178 35.968 44.667 13.159 1.00 0.00 H 0 +HETATM 6858 O HOH A2179 31.691 24.125 6.748 1.00 0.00 O 0 +HETATM 6859 H1 HOH A2179 31.378 24.483 5.932 1.00 0.00 H 0 +HETATM 6860 H2 HOH A2179 32.671 24.053 6.762 1.00 0.00 H 0 +HETATM 6861 O HOH A2180 1.384 0.361 22.774 1.00 0.00 O 0 +HETATM 6862 H1 HOH A2180 2.230 -0.022 22.516 1.00 0.00 H 0 +HETATM 6863 H2 HOH A2180 1.438 1.350 22.692 1.00 0.00 H 0 +HETATM 6864 O HOH A2181 25.981 45.525 51.237 1.00 0.00 O 0 +HETATM 6865 H1 HOH A2181 25.416 44.760 51.405 1.00 0.00 H 0 +HETATM 6866 H2 HOH A2181 25.389 46.294 51.347 1.00 0.00 H 0 +HETATM 6867 O HOH A2182 35.483 35.586 44.113 1.00 0.00 O 0 +HETATM 6868 H1 HOH A2182 35.037 34.761 44.208 1.00 0.00 H 0 +HETATM 6869 H2 HOH A2182 35.367 36.209 44.887 1.00 0.00 H 0 +HETATM 6870 O HOH A2183 51.247 45.942 31.690 1.00 0.00 O 0 +HETATM 6871 H1 HOH A2183 51.288 45.042 32.030 1.00 0.00 H 0 +HETATM 6872 H2 HOH A2183 52.145 46.197 31.627 1.00 0.00 H 0 +HETATM 6873 O HOH A2184 52.862 17.003 2.879 1.00 0.00 O 0 +HETATM 6874 H1 HOH A2184 52.955 17.862 3.254 1.00 0.00 H 0 +HETATM 6875 H2 HOH A2184 52.352 17.174 2.078 1.00 0.00 H 0 +HETATM 6876 O HOH A2185 45.063 6.712 36.762 1.00 0.00 O 0 +HETATM 6877 H1 HOH A2185 45.765 6.523 36.171 1.00 0.00 H 0 +HETATM 6878 H2 HOH A2185 45.407 6.701 37.686 1.00 0.00 H 0 +HETATM 6879 O HOH A2186 17.056 15.827 51.337 1.00 0.00 O 0 +HETATM 6880 H1 HOH A2186 16.390 16.328 50.964 1.00 0.00 H 0 +HETATM 6881 H2 HOH A2186 17.406 16.328 52.116 1.00 0.00 H 0 +HETATM 6882 O HOH A2187 39.140 3.887 15.340 1.00 0.00 O 0 +HETATM 6883 H1 HOH A2187 38.980 2.968 15.526 1.00 0.00 H 0 +HETATM 6884 H2 HOH A2187 39.670 3.936 14.539 1.00 0.00 H 0 +HETATM 6885 O HOH A2188 23.658 36.435 36.156 1.00 0.00 O 0 +HETATM 6886 H1 HOH A2188 23.981 36.547 35.286 1.00 0.00 H 0 +HETATM 6887 H2 HOH A2188 23.952 35.615 36.550 1.00 0.00 H 0 +HETATM 6888 O HOH A2189 47.964 36.183 18.897 1.00 0.00 O 0 +HETATM 6889 H1 HOH A2189 47.791 35.875 19.837 1.00 0.00 H 0 +HETATM 6890 H2 HOH A2189 47.557 37.055 18.805 1.00 0.00 H 0 +HETATM 6891 O HOH A2190 0.597 6.286 53.189 1.00 0.00 O 0 +HETATM 6892 H1 HOH A2190 0.672 5.478 52.744 1.00 0.00 H 0 +HETATM 6893 H2 HOH A2190 1.507 6.737 53.091 1.00 0.00 H 0 +HETATM 6894 O HOH A2191 25.610 18.671 10.669 1.00 0.00 O 0 +HETATM 6895 H1 HOH A2191 26.322 18.869 11.330 1.00 0.00 H 0 +HETATM 6896 H2 HOH A2191 24.790 19.062 10.902 1.00 0.00 H 0 +HETATM 6897 O HOH A2192 18.250 31.151 12.773 1.00 0.00 O 0 +HETATM 6898 H1 HOH A2192 19.152 31.513 12.705 1.00 0.00 H 0 +HETATM 6899 H2 HOH A2192 18.007 31.109 11.848 1.00 0.00 H 0 +HETATM 6900 O HOH A2193 23.755 47.643 8.140 1.00 0.00 O 0 +HETATM 6901 H1 HOH A2193 24.547 47.568 8.680 1.00 0.00 H 0 +HETATM 6902 H2 HOH A2193 23.060 47.984 8.789 1.00 0.00 H 0 +HETATM 6903 O HOH A2194 13.613 34.122 37.281 1.00 0.00 O 0 +HETATM 6904 H1 HOH A2194 14.505 34.359 36.989 1.00 0.00 H 0 +HETATM 6905 H2 HOH A2194 13.600 34.389 38.199 1.00 0.00 H 0 +HETATM 6906 O HOH A2195 14.643 45.028 53.299 1.00 0.00 O 0 +HETATM 6907 H1 HOH A2195 14.885 44.256 53.821 1.00 0.00 H 0 +HETATM 6908 H2 HOH A2195 15.073 45.790 53.767 1.00 0.00 H 0 +HETATM 6909 O HOH A2196 27.023 21.139 23.376 1.00 0.00 O 0 +HETATM 6910 H1 HOH A2196 27.318 21.174 22.461 1.00 0.00 H 0 +HETATM 6911 H2 HOH A2196 26.064 20.963 23.454 1.00 0.00 H 0 +HETATM 6912 O HOH A2197 19.097 15.430 7.016 1.00 0.00 O 0 +HETATM 6913 H1 HOH A2197 18.318 15.857 6.717 1.00 0.00 H 0 +HETATM 6914 H2 HOH A2197 18.908 15.237 7.936 1.00 0.00 H 0 +HETATM 6915 O HOH A2198 3.819 7.635 47.787 1.00 0.00 O 0 +HETATM 6916 H1 HOH A2198 4.756 7.713 47.986 1.00 0.00 H 0 +HETATM 6917 H2 HOH A2198 3.798 7.090 46.976 1.00 0.00 H 0 +HETATM 6918 O HOH A2199 38.315 8.363 1.312 1.00 0.00 O 0 +HETATM 6919 H1 HOH A2199 38.239 8.348 0.322 1.00 0.00 H 0 +HETATM 6920 H2 HOH A2199 38.563 9.200 1.601 1.00 0.00 H 0 +HETATM 6921 O HOH A2200 1.502 3.052 20.464 1.00 0.00 O 0 +HETATM 6922 H1 HOH A2200 2.370 3.137 20.857 1.00 0.00 H 0 +HETATM 6923 H2 HOH A2200 1.519 2.159 20.106 1.00 0.00 H 0 +HETATM 6924 O HOH A2201 44.925 20.190 44.717 1.00 0.00 O 0 +HETATM 6925 H1 HOH A2201 44.413 21.098 44.712 1.00 0.00 H 0 +HETATM 6926 H2 HOH A2201 45.816 20.404 44.440 1.00 0.00 H 0 +HETATM 6927 O HOH A2202 18.648 47.840 40.965 1.00 0.00 O 0 +HETATM 6928 H1 HOH A2202 18.287 46.968 40.682 1.00 0.00 H 0 +HETATM 6929 H2 HOH A2202 19.519 47.630 41.378 1.00 0.00 H 0 +HETATM 6930 O HOH A2203 15.240 37.768 6.183 1.00 0.00 O 0 +HETATM 6931 H1 HOH A2203 15.823 37.139 6.621 1.00 0.00 H 0 +HETATM 6932 H2 HOH A2203 15.060 37.316 5.345 1.00 0.00 H 0 +HETATM 6933 O HOH A2204 9.782 45.208 33.118 1.00 0.00 O 0 +HETATM 6934 H1 HOH A2204 9.813 46.177 33.051 1.00 0.00 H 0 +HETATM 6935 H2 HOH A2204 10.213 45.063 33.989 1.00 0.00 H 0 +HETATM 6936 O HOH A2205 33.771 24.622 46.596 1.00 0.00 O 0 +HETATM 6937 H1 HOH A2205 33.495 23.700 46.330 1.00 0.00 H 0 +HETATM 6938 H2 HOH A2205 34.420 24.570 47.239 1.00 0.00 H 0 +HETATM 6939 O HOH A2206 12.729 23.872 33.667 1.00 0.00 O 0 +HETATM 6940 H1 HOH A2206 13.651 23.999 33.593 1.00 0.00 H 0 +HETATM 6941 H2 HOH A2206 12.357 24.763 33.439 1.00 0.00 H 0 +HETATM 6942 O HOH A2207 10.668 43.424 7.779 1.00 0.00 O 0 +HETATM 6943 H1 HOH A2207 10.711 42.507 7.756 1.00 0.00 H 0 +HETATM 6944 H2 HOH A2207 11.592 43.631 7.610 1.00 0.00 H 0 +HETATM 6945 O HOH A2208 25.498 36.977 9.288 1.00 0.00 O 0 +HETATM 6946 H1 HOH A2208 24.956 36.402 9.871 1.00 0.00 H 0 +HETATM 6947 H2 HOH A2208 25.552 37.974 9.612 1.00 0.00 H 0 +HETATM 6948 O HOH A2209 17.076 5.623 34.894 1.00 0.00 O 0 +HETATM 6949 H1 HOH A2209 16.828 4.734 34.902 1.00 0.00 H 0 +HETATM 6950 H2 HOH A2209 16.443 6.262 35.185 1.00 0.00 H 0 +HETATM 6951 O HOH A2210 2.843 14.790 17.032 1.00 0.00 O 0 +HETATM 6952 H1 HOH A2210 2.791 15.554 17.562 1.00 0.00 H 0 +HETATM 6953 H2 HOH A2210 3.446 14.219 17.527 1.00 0.00 H 0 +HETATM 6954 O HOH A2211 48.314 53.599 46.979 1.00 0.00 O 0 +HETATM 6955 H1 HOH A2211 47.722 52.947 46.748 1.00 0.00 H 0 +HETATM 6956 H2 HOH A2211 48.480 54.264 46.266 1.00 0.00 H 0 +HETATM 6957 O HOH A2212 15.374 11.409 46.440 1.00 0.00 O 0 +HETATM 6958 H1 HOH A2212 15.600 11.296 45.562 1.00 0.00 H 0 +HETATM 6959 H2 HOH A2212 15.417 12.407 46.573 1.00 0.00 H 0 +HETATM 6960 O HOH A2213 5.108 53.220 45.091 1.00 0.00 O 0 +HETATM 6961 H1 HOH A2213 4.631 53.819 44.408 1.00 0.00 H 0 +HETATM 6962 H2 HOH A2213 4.698 53.344 45.947 1.00 0.00 H 0 +HETATM 6963 O HOH A2214 40.762 0.694 28.642 1.00 0.00 O 0 +HETATM 6964 H1 HOH A2214 39.803 0.494 28.689 1.00 0.00 H 0 +HETATM 6965 H2 HOH A2214 40.960 1.507 28.250 1.00 0.00 H 0 +HETATM 6966 O HOH A2215 22.051 44.541 34.635 1.00 0.00 O 0 +HETATM 6967 H1 HOH A2215 22.500 43.676 34.435 1.00 0.00 H 0 +HETATM 6968 H2 HOH A2215 21.197 44.254 35.005 1.00 0.00 H 0 +HETATM 6969 O HOH A2216 19.858 13.969 16.484 1.00 0.00 O 0 +HETATM 6970 H1 HOH A2216 19.428 14.030 17.358 1.00 0.00 H 0 +HETATM 6971 H2 HOH A2216 20.799 13.757 16.775 1.00 0.00 H 0 +HETATM 6972 O HOH A2217 22.355 11.340 3.967 1.00 0.00 O 0 +HETATM 6973 H1 HOH A2217 23.187 11.794 4.298 1.00 0.00 H 0 +HETATM 6974 H2 HOH A2217 21.852 12.075 3.596 1.00 0.00 H 0 +HETATM 6975 O HOH A2218 33.624 2.519 7.199 1.00 0.00 O 0 +HETATM 6976 H1 HOH A2218 34.160 2.589 6.419 1.00 0.00 H 0 +HETATM 6977 H2 HOH A2218 33.702 1.589 7.600 1.00 0.00 H 0 +HETATM 6978 O HOH A2219 15.348 22.007 17.869 1.00 0.00 O 0 +HETATM 6979 H1 HOH A2219 14.510 21.483 17.992 1.00 0.00 H 0 +HETATM 6980 H2 HOH A2219 15.919 21.372 17.421 1.00 0.00 H 0 +HETATM 6981 O HOH A2220 27.501 9.493 5.897 1.00 0.00 O 0 +HETATM 6982 H1 HOH A2220 26.764 8.885 6.085 1.00 0.00 H 0 +HETATM 6983 H2 HOH A2220 27.352 10.306 6.424 1.00 0.00 H 0 +HETATM 6984 O HOH A2221 14.233 46.313 28.988 1.00 0.00 O 0 +HETATM 6985 H1 HOH A2221 14.631 47.046 28.424 1.00 0.00 H 0 +HETATM 6986 H2 HOH A2221 13.331 46.191 28.650 1.00 0.00 H 0 +HETATM 6987 O HOH A2222 10.566 46.829 11.657 1.00 0.00 O 0 +HETATM 6988 H1 HOH A2222 11.512 46.909 11.433 1.00 0.00 H 0 +HETATM 6989 H2 HOH A2222 10.201 47.721 11.667 1.00 0.00 H 0 +HETATM 6990 O HOH A2223 33.703 53.387 7.680 1.00 0.00 O 0 +HETATM 6991 H1 HOH A2223 34.479 53.188 8.246 1.00 0.00 H 0 +HETATM 6992 H2 HOH A2223 33.654 52.748 6.946 1.00 0.00 H 0 +HETATM 6993 O HOH A2224 9.685 51.330 8.946 1.00 0.00 O 0 +HETATM 6994 H1 HOH A2224 9.195 50.777 8.338 1.00 0.00 H 0 +HETATM 6995 H2 HOH A2224 10.309 51.878 8.364 1.00 0.00 H 0 +HETATM 6996 O HOH A2225 23.623 35.415 17.458 1.00 0.00 O 0 +HETATM 6997 H1 HOH A2225 23.969 35.606 16.598 1.00 0.00 H 0 +HETATM 6998 H2 HOH A2225 24.389 35.256 17.974 1.00 0.00 H 0 +HETATM 6999 O HOH A2226 41.572 26.623 26.149 1.00 0.00 O 0 +HETATM 7000 H1 HOH A2226 41.828 27.068 27.007 1.00 0.00 H 0 +HETATM 7001 H2 HOH A2226 42.222 25.940 25.857 1.00 0.00 H 0 +HETATM 7002 O HOH A2227 17.533 48.343 12.623 1.00 0.00 O 0 +HETATM 7003 H1 HOH A2227 17.347 48.572 11.657 1.00 0.00 H 0 +HETATM 7004 H2 HOH A2227 18.131 49.015 12.944 1.00 0.00 H 0 +HETATM 7005 O HOH A2228 15.548 38.126 0.233 1.00 0.00 O 0 +HETATM 7006 H1 HOH A2228 15.055 38.387 1.024 1.00 0.00 H 0 +HETATM 7007 H2 HOH A2228 16.394 38.660 0.219 1.00 0.00 H 0 +HETATM 7008 O HOH A2229 29.879 52.594 17.497 1.00 0.00 O 0 +HETATM 7009 H1 HOH A2229 30.726 52.559 17.928 1.00 0.00 H 0 +HETATM 7010 H2 HOH A2229 29.324 52.852 18.245 1.00 0.00 H 0 +HETATM 7011 O HOH A2230 37.212 43.690 5.904 1.00 0.00 O 0 +HETATM 7012 H1 HOH A2230 37.455 43.434 5.032 1.00 0.00 H 0 +HETATM 7013 H2 HOH A2230 37.528 43.048 6.514 1.00 0.00 H 0 +HETATM 7014 O HOH A2231 9.686 17.730 47.859 1.00 0.00 O 0 +HETATM 7015 H1 HOH A2231 9.845 16.973 47.472 1.00 0.00 H 0 +HETATM 7016 H2 HOH A2231 10.129 17.726 48.695 1.00 0.00 H 0 +HETATM 7017 O HOH A2232 9.263 7.965 9.193 1.00 0.00 O 0 +HETATM 7018 H1 HOH A2232 9.372 8.039 10.161 1.00 0.00 H 0 +HETATM 7019 H2 HOH A2232 8.963 7.086 9.127 1.00 0.00 H 0 +HETATM 7020 O HOH A2233 16.472 3.677 45.653 1.00 0.00 O 0 +HETATM 7021 H1 HOH A2233 16.137 2.950 45.124 1.00 0.00 H 0 +HETATM 7022 H2 HOH A2233 15.730 3.869 46.311 1.00 0.00 H 0 +HETATM 7023 O HOH A2234 18.301 43.430 -0.177 1.00 0.00 O 0 +HETATM 7024 H1 HOH A2234 18.320 44.411 -0.223 1.00 0.00 H 0 +HETATM 7025 H2 HOH A2234 18.886 43.347 0.594 1.00 0.00 H 0 +HETATM 7026 O HOH A2235 50.977 16.930 17.201 1.00 0.00 O 0 +HETATM 7027 H1 HOH A2235 50.206 17.205 16.749 1.00 0.00 H 0 +HETATM 7028 H2 HOH A2235 51.424 17.673 17.543 1.00 0.00 H 0 +HETATM 7029 O HOH A2236 8.786 9.508 20.079 1.00 0.00 O 0 +HETATM 7030 H1 HOH A2236 9.082 9.398 19.186 1.00 0.00 H 0 +HETATM 7031 H2 HOH A2236 9.176 10.310 20.439 1.00 0.00 H 0 +HETATM 7032 O HOH A2237 1.454 1.237 9.110 1.00 0.00 O 0 +HETATM 7033 H1 HOH A2237 0.863 0.562 8.870 1.00 0.00 H 0 +HETATM 7034 H2 HOH A2237 0.815 1.868 9.403 1.00 0.00 H 0 +HETATM 7035 O HOH A2238 27.732 42.707 14.898 1.00 0.00 O 0 +HETATM 7036 H1 HOH A2238 28.093 43.404 14.284 1.00 0.00 H 0 +HETATM 7037 H2 HOH A2238 27.360 43.284 15.590 1.00 0.00 H 0 +HETATM 7038 O HOH A2239 25.287 18.826 29.006 1.00 0.00 O 0 +HETATM 7039 H1 HOH A2239 24.871 19.639 29.151 1.00 0.00 H 0 +HETATM 7040 H2 HOH A2239 26.168 19.051 28.631 1.00 0.00 H 0 +HETATM 7041 O HOH A2240 43.157 9.049 40.674 1.00 0.00 O 0 +HETATM 7042 H1 HOH A2240 42.537 9.261 39.966 1.00 0.00 H 0 +HETATM 7043 H2 HOH A2240 43.156 8.123 40.787 1.00 0.00 H 0 +HETATM 7044 O HOH A2241 45.471 29.560 38.717 1.00 0.00 O 0 +HETATM 7045 H1 HOH A2241 45.411 28.980 39.575 1.00 0.00 H 0 +HETATM 7046 H2 HOH A2241 45.996 30.380 39.095 1.00 0.00 H 0 +HETATM 7047 O HOH A2242 28.910 1.350 6.468 1.00 0.00 O 0 +HETATM 7048 H1 HOH A2242 28.348 1.546 7.250 1.00 0.00 H 0 +HETATM 7049 H2 HOH A2242 29.739 1.940 6.417 1.00 0.00 H 0 +HETATM 7050 O HOH A2243 20.805 32.218 19.158 1.00 0.00 O 0 +HETATM 7051 H1 HOH A2243 21.700 31.853 19.015 1.00 0.00 H 0 +HETATM 7052 H2 HOH A2243 20.823 32.518 20.063 1.00 0.00 H 0 +HETATM 7053 O HOH A2244 22.529 14.378 0.358 1.00 0.00 O 0 +HETATM 7054 H1 HOH A2244 21.636 14.691 0.430 1.00 0.00 H 0 +HETATM 7055 H2 HOH A2244 22.631 13.992 -0.558 1.00 0.00 H 0 +HETATM 7056 O HOH A2245 50.080 32.770 9.510 1.00 0.00 O 0 +HETATM 7057 H1 HOH A2245 49.906 32.019 8.980 1.00 0.00 H 0 +HETATM 7058 H2 HOH A2245 50.588 33.329 8.867 1.00 0.00 H 0 +HETATM 7059 O HOH A2246 6.432 30.082 5.578 1.00 0.00 O 0 +HETATM 7060 H1 HOH A2246 7.208 29.951 5.015 1.00 0.00 H 0 +HETATM 7061 H2 HOH A2246 6.273 30.977 5.834 1.00 0.00 H 0 +HETATM 7062 O HOH A2247 23.734 2.238 39.228 1.00 0.00 O 0 +HETATM 7063 H1 HOH A2247 23.322 2.792 39.892 1.00 0.00 H 0 +HETATM 7064 H2 HOH A2247 23.464 2.682 38.434 1.00 0.00 H 0 +HETATM 7065 O HOH A2248 41.275 9.574 38.843 1.00 0.00 O 0 +HETATM 7066 H1 HOH A2248 40.478 9.899 39.329 1.00 0.00 H 0 +HETATM 7067 H2 HOH A2248 40.883 8.730 38.511 1.00 0.00 H 0 +HETATM 7068 O HOH A2249 28.849 14.570 4.202 1.00 0.00 O 0 +HETATM 7069 H1 HOH A2249 29.135 15.349 4.694 1.00 0.00 H 0 +HETATM 7070 H2 HOH A2249 28.495 13.928 4.846 1.00 0.00 H 0 +HETATM 7071 O HOH A2250 33.142 13.921 24.512 1.00 0.00 O 0 +HETATM 7072 H1 HOH A2250 33.363 13.652 23.623 1.00 0.00 H 0 +HETATM 7073 H2 HOH A2250 32.190 13.879 24.429 1.00 0.00 H 0 +HETATM 7074 O HOH A2251 47.884 31.283 17.398 1.00 0.00 O 0 +HETATM 7075 H1 HOH A2251 48.461 31.970 17.124 1.00 0.00 H 0 +HETATM 7076 H2 HOH A2251 47.006 31.427 16.953 1.00 0.00 H 0 +HETATM 7077 O HOH A2252 41.794 45.348 46.772 1.00 0.00 O 0 +HETATM 7078 H1 HOH A2252 41.843 46.300 46.942 1.00 0.00 H 0 +HETATM 7079 H2 HOH A2252 42.729 45.175 46.554 1.00 0.00 H 0 +HETATM 7080 O HOH A2253 36.519 27.453 18.170 1.00 0.00 O 0 +HETATM 7081 H1 HOH A2253 36.280 27.443 17.248 1.00 0.00 H 0 +HETATM 7082 H2 HOH A2253 37.363 27.069 18.378 1.00 0.00 H 0 +HETATM 7083 O HOH A2254 51.214 5.255 32.769 1.00 0.00 O 0 +HETATM 7084 H1 HOH A2254 51.769 4.790 33.420 1.00 0.00 H 0 +HETATM 7085 H2 HOH A2254 51.266 4.850 31.909 1.00 0.00 H 0 +HETATM 7086 O HOH A2255 21.075 24.683 40.148 1.00 0.00 O 0 +HETATM 7087 H1 HOH A2255 20.298 24.510 40.729 1.00 0.00 H 0 +HETATM 7088 H2 HOH A2255 20.634 25.242 39.481 1.00 0.00 H 0 +HETATM 7089 O HOH A2256 46.513 34.516 5.315 1.00 0.00 O 0 +HETATM 7090 H1 HOH A2256 46.944 33.719 4.985 1.00 0.00 H 0 +HETATM 7091 H2 HOH A2256 46.428 34.379 6.305 1.00 0.00 H 0 +HETATM 7092 O HOH A2257 41.225 47.146 43.223 1.00 0.00 O 0 +HETATM 7093 H1 HOH A2257 41.139 47.724 43.999 1.00 0.00 H 0 +HETATM 7094 H2 HOH A2257 42.172 47.184 42.995 1.00 0.00 H 0 +HETATM 7095 O HOH A2258 2.568 10.923 17.916 1.00 0.00 O 0 +HETATM 7096 H1 HOH A2258 1.632 10.697 17.642 1.00 0.00 H 0 +HETATM 7097 H2 HOH A2258 2.556 10.580 18.802 1.00 0.00 H 0 +HETATM 7098 O HOH A2259 5.987 2.884 34.948 1.00 0.00 O 0 +HETATM 7099 H1 HOH A2259 6.276 3.724 34.460 1.00 0.00 H 0 +HETATM 7100 H2 HOH A2259 6.201 2.207 34.291 1.00 0.00 H 0 +HETATM 7101 O HOH A2260 38.984 42.395 13.447 1.00 0.00 O 0 +HETATM 7102 H1 HOH A2260 38.091 42.599 13.080 1.00 0.00 H 0 +HETATM 7103 H2 HOH A2260 38.937 42.762 14.345 1.00 0.00 H 0 +HETATM 7104 O HOH A2261 0.664 37.213 44.668 1.00 0.00 O 0 +HETATM 7105 H1 HOH A2261 1.377 36.541 44.995 1.00 0.00 H 0 +HETATM 7106 H2 HOH A2261 0.862 38.158 44.877 1.00 0.00 H 0 +HETATM 7107 O HOH A2262 27.829 24.791 9.370 1.00 0.00 O 0 +HETATM 7108 H1 HOH A2262 28.527 24.222 9.002 1.00 0.00 H 0 +HETATM 7109 H2 HOH A2262 27.957 25.648 8.899 1.00 0.00 H 0 +HETATM 7110 O HOH A2263 7.869 24.488 30.368 1.00 0.00 O 0 +HETATM 7111 H1 HOH A2263 8.726 23.975 30.402 1.00 0.00 H 0 +HETATM 7112 H2 HOH A2263 7.924 24.813 31.300 1.00 0.00 H 0 +HETATM 7113 O HOH A2264 52.905 25.625 40.852 1.00 0.00 O 0 +HETATM 7114 H1 HOH A2264 52.556 24.884 41.455 1.00 0.00 H 0 +HETATM 7115 H2 HOH A2264 52.859 26.364 41.377 1.00 0.00 H 0 +HETATM 7116 O HOH A2265 1.338 3.895 12.837 1.00 0.00 O 0 +HETATM 7117 H1 HOH A2265 1.760 3.106 13.236 1.00 0.00 H 0 +HETATM 7118 H2 HOH A2265 0.500 3.961 13.273 1.00 0.00 H 0 +HETATM 7119 O HOH A2266 12.702 35.139 8.588 1.00 0.00 O 0 +HETATM 7120 H1 HOH A2266 11.885 34.642 8.764 1.00 0.00 H 0 +HETATM 7121 H2 HOH A2266 12.872 34.795 7.701 1.00 0.00 H 0 +HETATM 7122 O HOH A2267 32.008 48.289 9.229 1.00 0.00 O 0 +HETATM 7123 H1 HOH A2267 32.177 48.920 9.914 1.00 0.00 H 0 +HETATM 7124 H2 HOH A2267 32.683 47.569 9.549 1.00 0.00 H 0 +HETATM 7125 O HOH A2268 3.067 35.321 44.446 1.00 0.00 O 0 +HETATM 7126 H1 HOH A2268 3.554 34.873 45.063 1.00 0.00 H 0 +HETATM 7127 H2 HOH A2268 3.209 34.966 43.601 1.00 0.00 H 0 +HETATM 7128 O HOH A2269 45.911 24.321 43.805 1.00 0.00 O 0 +HETATM 7129 H1 HOH A2269 46.530 23.900 44.420 1.00 0.00 H 0 +HETATM 7130 H2 HOH A2269 45.463 23.626 43.257 1.00 0.00 H 0 +HETATM 7131 O HOH A2270 22.141 24.160 9.570 1.00 0.00 O 0 +HETATM 7132 H1 HOH A2270 21.984 24.085 8.615 1.00 0.00 H 0 +HETATM 7133 H2 HOH A2270 21.410 24.679 9.941 1.00 0.00 H 0 +HETATM 7134 O HOH A2271 32.159 53.379 34.313 1.00 0.00 O 0 +HETATM 7135 H1 HOH A2271 31.229 53.035 34.194 1.00 0.00 H 0 +HETATM 7136 H2 HOH A2271 32.670 53.147 33.538 1.00 0.00 H 0 +HETATM 7137 O HOH A2272 16.141 33.215 4.813 1.00 0.00 O 0 +HETATM 7138 H1 HOH A2272 15.639 34.105 4.641 1.00 0.00 H 0 +HETATM 7139 H2 HOH A2272 15.549 32.571 4.436 1.00 0.00 H 0 +HETATM 7140 O HOH A2273 36.775 3.897 29.958 1.00 0.00 O 0 +HETATM 7141 H1 HOH A2273 37.498 4.476 30.156 1.00 0.00 H 0 +HETATM 7142 H2 HOH A2273 36.294 3.784 30.794 1.00 0.00 H 0 +HETATM 7143 O HOH A2274 48.316 40.315 43.007 1.00 0.00 O 0 +HETATM 7144 H1 HOH A2274 48.625 40.034 42.146 1.00 0.00 H 0 +HETATM 7145 H2 HOH A2274 47.693 41.033 42.777 1.00 0.00 H 0 +HETATM 7146 O HOH A2275 32.280 6.071 28.772 1.00 0.00 O 0 +HETATM 7147 H1 HOH A2275 32.104 6.871 28.226 1.00 0.00 H 0 +HETATM 7148 H2 HOH A2275 33.240 6.112 28.904 1.00 0.00 H 0 +HETATM 7149 O HOH A2276 10.664 36.495 45.149 1.00 0.00 O 0 +HETATM 7150 H1 HOH A2276 10.455 37.084 44.413 1.00 0.00 H 0 +HETATM 7151 H2 HOH A2276 9.988 36.726 45.824 1.00 0.00 H 0 +HETATM 7152 O HOH A2277 22.747 0.445 50.701 1.00 0.00 O 0 +HETATM 7153 H1 HOH A2277 22.699 1.437 50.655 1.00 0.00 H 0 +HETATM 7154 H2 HOH A2277 22.378 0.099 51.566 1.00 0.00 H 0 +HETATM 7155 O HOH A2278 9.332 41.861 45.261 1.00 0.00 O 0 +HETATM 7156 H1 HOH A2278 9.475 42.727 45.615 1.00 0.00 H 0 +HETATM 7157 H2 HOH A2278 8.817 41.868 44.456 1.00 0.00 H 0 +HETATM 7158 O HOH A2279 2.050 46.183 14.001 1.00 0.00 O 0 +HETATM 7159 H1 HOH A2279 2.207 47.033 14.403 1.00 0.00 H 0 +HETATM 7160 H2 HOH A2279 1.719 45.642 14.739 1.00 0.00 H 0 +HETATM 7161 O HOH A2280 8.132 49.582 46.809 1.00 0.00 O 0 +HETATM 7162 H1 HOH A2280 7.158 49.645 46.812 1.00 0.00 H 0 +HETATM 7163 H2 HOH A2280 8.441 49.684 45.906 1.00 0.00 H 0 +HETATM 7164 O HOH A2281 14.131 31.417 14.086 1.00 0.00 O 0 +HETATM 7165 H1 HOH A2281 13.508 31.425 14.843 1.00 0.00 H 0 +HETATM 7166 H2 HOH A2281 14.483 30.493 14.075 1.00 0.00 H 0 +HETATM 7167 O HOH A2282 46.866 9.453 23.497 1.00 0.00 O 0 +HETATM 7168 H1 HOH A2282 46.288 8.750 23.327 1.00 0.00 H 0 +HETATM 7169 H2 HOH A2282 46.343 10.260 23.634 1.00 0.00 H 0 +HETATM 7170 O HOH A2283 40.161 20.528 41.373 1.00 0.00 O 0 +HETATM 7171 H1 HOH A2283 40.533 20.361 40.504 1.00 0.00 H 0 +HETATM 7172 H2 HOH A2283 39.400 21.070 41.131 1.00 0.00 H 0 +HETATM 7173 O HOH A2284 43.584 11.436 4.850 1.00 0.00 O 0 +HETATM 7174 H1 HOH A2284 43.128 11.443 5.741 1.00 0.00 H 0 +HETATM 7175 H2 HOH A2284 43.688 10.495 4.534 1.00 0.00 H 0 +HETATM 7176 O HOH A2285 30.848 40.321 8.753 1.00 0.00 O 0 +HETATM 7177 H1 HOH A2285 30.164 40.997 8.871 1.00 0.00 H 0 +HETATM 7178 H2 HOH A2285 30.522 39.759 8.024 1.00 0.00 H 0 +HETATM 7179 O HOH A2286 20.413 52.200 27.226 1.00 0.00 O 0 +HETATM 7180 H1 HOH A2286 19.849 52.981 27.262 1.00 0.00 H 0 +HETATM 7181 H2 HOH A2286 20.042 51.649 26.548 1.00 0.00 H 0 +HETATM 7182 O HOH A2287 4.920 6.410 24.144 1.00 0.00 O 0 +HETATM 7183 H1 HOH A2287 4.334 7.196 24.420 1.00 0.00 H 0 +HETATM 7184 H2 HOH A2287 4.715 5.761 24.805 1.00 0.00 H 0 +HETATM 7185 O HOH A2288 39.049 47.043 32.869 1.00 0.00 O 0 +HETATM 7186 H1 HOH A2288 39.183 47.967 33.089 1.00 0.00 H 0 +HETATM 7187 H2 HOH A2288 38.355 46.684 33.419 1.00 0.00 H 0 +HETATM 7188 O HOH A2289 39.460 33.298 3.769 1.00 0.00 O 0 +HETATM 7189 H1 HOH A2289 39.279 33.098 2.801 1.00 0.00 H 0 +HETATM 7190 H2 HOH A2289 40.377 33.426 4.049 1.00 0.00 H 0 +HETATM 7191 O HOH A2290 43.050 29.422 18.098 1.00 0.00 O 0 +HETATM 7192 H1 HOH A2290 42.687 28.740 18.680 1.00 0.00 H 0 +HETATM 7193 H2 HOH A2290 43.428 30.042 18.704 1.00 0.00 H 0 +HETATM 7194 O HOH A2291 48.336 29.274 34.309 1.00 0.00 O 0 +HETATM 7195 H1 HOH A2291 48.237 29.904 33.617 1.00 0.00 H 0 +HETATM 7196 H2 HOH A2291 48.883 28.613 33.993 1.00 0.00 H 0 +HETATM 7197 O HOH A2292 15.968 41.523 23.853 1.00 0.00 O 0 +HETATM 7198 H1 HOH A2292 15.219 41.372 24.392 1.00 0.00 H 0 +HETATM 7199 H2 HOH A2292 15.778 41.807 22.887 1.00 0.00 H 0 +HETATM 7200 O HOH A2293 6.479 34.369 10.195 1.00 0.00 O 0 +HETATM 7201 H1 HOH A2293 6.715 33.480 9.925 1.00 0.00 H 0 +HETATM 7202 H2 HOH A2293 6.273 34.842 9.365 1.00 0.00 H 0 +HETATM 7203 O HOH A2294 45.658 52.058 11.839 1.00 0.00 O 0 +HETATM 7204 H1 HOH A2294 44.899 51.426 12.098 1.00 0.00 H 0 +HETATM 7205 H2 HOH A2294 45.994 52.150 12.757 1.00 0.00 H 0 +HETATM 7206 O HOH A2295 11.070 32.290 36.616 1.00 0.00 O 0 +HETATM 7207 H1 HOH A2295 12.060 32.469 36.589 1.00 0.00 H 0 +HETATM 7208 H2 HOH A2295 10.760 33.009 37.216 1.00 0.00 H 0 +HETATM 7209 O HOH A2296 52.125 7.714 24.816 1.00 0.00 O 0 +HETATM 7210 H1 HOH A2296 52.427 8.606 24.961 1.00 0.00 H 0 +HETATM 7211 H2 HOH A2296 51.766 7.722 23.931 1.00 0.00 H 0 +HETATM 7212 O HOH A2297 46.729 10.896 27.144 1.00 0.00 O 0 +HETATM 7213 H1 HOH A2297 46.895 10.805 28.095 1.00 0.00 H 0 +HETATM 7214 H2 HOH A2297 45.746 10.829 26.963 1.00 0.00 H 0 +HETATM 7215 O HOH A2298 13.706 49.340 7.277 1.00 0.00 O 0 +HETATM 7216 H1 HOH A2298 13.110 49.630 6.622 1.00 0.00 H 0 +HETATM 7217 H2 HOH A2298 14.543 49.318 6.840 1.00 0.00 H 0 +HETATM 7218 O HOH A2299 27.497 3.910 0.581 1.00 0.00 O 0 +HETATM 7219 H1 HOH A2299 26.659 3.991 0.104 1.00 0.00 H 0 +HETATM 7220 H2 HOH A2299 27.671 4.706 1.082 1.00 0.00 H 0 +HETATM 7221 O HOH A2300 33.709 36.113 52.896 1.00 0.00 O 0 +HETATM 7222 H1 HOH A2300 33.321 35.278 53.075 1.00 0.00 H 0 +HETATM 7223 H2 HOH A2300 34.548 36.133 53.373 1.00 0.00 H 0 +HETATM 7224 O HOH A2301 12.876 48.082 35.842 1.00 0.00 O 0 +HETATM 7225 H1 HOH A2301 13.447 47.330 35.785 1.00 0.00 H 0 +HETATM 7226 H2 HOH A2301 12.517 48.202 36.725 1.00 0.00 H 0 +HETATM 7227 O HOH A2302 20.857 36.799 35.894 1.00 0.00 O 0 +HETATM 7228 H1 HOH A2302 21.838 36.725 35.902 1.00 0.00 H 0 +HETATM 7229 H2 HOH A2302 20.572 36.432 36.729 1.00 0.00 H 0 +HETATM 7230 O HOH A2303 15.157 39.912 41.058 1.00 0.00 O 0 +HETATM 7231 H1 HOH A2303 15.684 39.636 40.336 1.00 0.00 H 0 +HETATM 7232 H2 HOH A2303 14.304 39.954 40.590 1.00 0.00 H 0 +HETATM 7233 O HOH A2304 43.803 42.935 39.713 1.00 0.00 O 0 +HETATM 7234 H1 HOH A2304 43.104 43.519 39.369 1.00 0.00 H 0 +HETATM 7235 H2 HOH A2304 44.533 43.010 39.074 1.00 0.00 H 0 +HETATM 7236 O HOH A2305 0.679 42.927 42.608 1.00 0.00 O 0 +HETATM 7237 H1 HOH A2305 1.467 42.632 42.215 1.00 0.00 H 0 +HETATM 7238 H2 HOH A2305 0.264 43.545 41.994 1.00 0.00 H 0 +HETATM 7239 O HOH A2306 27.477 18.004 19.704 1.00 0.00 O 0 +HETATM 7240 H1 HOH A2306 26.981 18.777 20.089 1.00 0.00 H 0 +HETATM 7241 H2 HOH A2306 28.324 18.269 19.418 1.00 0.00 H 0 +HETATM 7242 O HOH A2307 11.580 29.716 48.993 1.00 0.00 O 0 +HETATM 7243 H1 HOH A2307 12.004 30.109 49.783 1.00 0.00 H 0 +HETATM 7244 H2 HOH A2307 10.743 30.204 48.796 1.00 0.00 H 0 +HETATM 7245 O HOH A2308 1.340 6.878 13.082 1.00 0.00 O 0 +HETATM 7246 H1 HOH A2308 0.455 7.150 12.783 1.00 0.00 H 0 +HETATM 7247 H2 HOH A2308 1.373 5.953 12.691 1.00 0.00 H 0 +HETATM 7248 O HOH A2309 44.330 39.144 36.709 1.00 0.00 O 0 +HETATM 7249 H1 HOH A2309 44.377 38.182 36.762 1.00 0.00 H 0 +HETATM 7250 H2 HOH A2309 43.512 39.406 37.128 1.00 0.00 H 0 +HETATM 7251 O HOH A2310 8.586 19.532 31.324 1.00 0.00 O 0 +HETATM 7252 H1 HOH A2310 9.234 18.996 31.829 1.00 0.00 H 0 +HETATM 7253 H2 HOH A2310 9.057 20.245 30.959 1.00 0.00 H 0 +HETATM 7254 O HOH A2311 45.897 38.779 22.313 1.00 0.00 O 0 +HETATM 7255 H1 HOH A2311 46.813 38.702 21.999 1.00 0.00 H 0 +HETATM 7256 H2 HOH A2311 45.627 39.667 22.119 1.00 0.00 H 0 +HETATM 7257 O HOH A2312 47.135 39.254 2.605 1.00 0.00 O 0 +HETATM 7258 H1 HOH A2312 46.303 39.588 2.942 1.00 0.00 H 0 +HETATM 7259 H2 HOH A2312 47.589 39.984 2.069 1.00 0.00 H 0 +HETATM 7260 O HOH A2313 30.212 40.855 39.154 1.00 0.00 O 0 +HETATM 7261 H1 HOH A2313 31.156 40.618 39.000 1.00 0.00 H 0 +HETATM 7262 H2 HOH A2313 30.224 41.777 38.846 1.00 0.00 H 0 +HETATM 7263 O HOH A2314 37.764 46.763 40.081 1.00 0.00 O 0 +HETATM 7264 H1 HOH A2314 37.541 46.664 41.055 1.00 0.00 H 0 +HETATM 7265 H2 HOH A2314 37.035 47.259 39.795 1.00 0.00 H 0 +HETATM 7266 O HOH A2315 10.492 36.847 19.133 1.00 0.00 O 0 +HETATM 7267 H1 HOH A2315 10.294 35.989 19.389 1.00 0.00 H 0 +HETATM 7268 H2 HOH A2315 9.738 37.337 19.439 1.00 0.00 H 0 +HETATM 7269 O HOH A2316 29.640 13.711 50.384 1.00 0.00 O 0 +HETATM 7270 H1 HOH A2316 29.552 13.101 51.118 1.00 0.00 H 0 +HETATM 7271 H2 HOH A2316 29.240 14.561 50.675 1.00 0.00 H 0 +HETATM 7272 O HOH A2317 38.382 37.075 31.842 1.00 0.00 O 0 +HETATM 7273 H1 HOH A2317 37.571 37.423 32.226 1.00 0.00 H 0 +HETATM 7274 H2 HOH A2317 38.213 36.997 30.900 1.00 0.00 H 0 +HETATM 7275 O HOH A2318 43.065 42.793 36.028 1.00 0.00 O 0 +HETATM 7276 H1 HOH A2318 43.379 43.709 36.154 1.00 0.00 H 0 +HETATM 7277 H2 HOH A2318 43.753 42.359 35.506 1.00 0.00 H 0 +HETATM 7278 O HOH A2319 3.286 9.475 20.865 1.00 0.00 O 0 +HETATM 7279 H1 HOH A2319 3.114 8.696 21.350 1.00 0.00 H 0 +HETATM 7280 H2 HOH A2319 4.268 9.468 20.702 1.00 0.00 H 0 +HETATM 7281 O HOH A2320 20.541 39.590 20.678 1.00 0.00 O 0 +HETATM 7282 H1 HOH A2320 21.362 39.093 20.795 1.00 0.00 H 0 +HETATM 7283 H2 HOH A2320 19.938 39.544 21.418 1.00 0.00 H 0 +HETATM 7284 O HOH A2321 50.942 29.989 0.815 1.00 0.00 O 0 +HETATM 7285 H1 HOH A2321 51.318 30.267 -0.022 1.00 0.00 H 0 +HETATM 7286 H2 HOH A2321 50.377 29.171 0.667 1.00 0.00 H 0 +HETATM 7287 O HOH A2322 26.510 53.022 15.336 1.00 0.00 O 0 +HETATM 7288 H1 HOH A2322 27.070 52.328 15.027 1.00 0.00 H 0 +HETATM 7289 H2 HOH A2322 26.201 53.025 16.169 1.00 0.00 H 0 +HETATM 7290 O HOH A2323 19.875 17.401 37.599 1.00 0.00 O 0 +HETATM 7291 H1 HOH A2323 18.881 17.479 37.442 1.00 0.00 H 0 +HETATM 7292 H2 HOH A2323 20.124 16.492 37.381 1.00 0.00 H 0 +HETATM 7293 O HOH A2324 31.442 43.635 12.958 1.00 0.00 O 0 +HETATM 7294 H1 HOH A2324 31.545 42.752 13.382 1.00 0.00 H 0 +HETATM 7295 H2 HOH A2324 31.863 44.284 13.543 1.00 0.00 H 0 +HETATM 7296 O HOH A2325 40.283 25.561 51.929 1.00 0.00 O 0 +HETATM 7297 H1 HOH A2325 41.016 25.439 52.528 1.00 0.00 H 0 +HETATM 7298 H2 HOH A2325 39.537 26.002 52.516 1.00 0.00 H 0 +HETATM 7299 O HOH A2326 22.874 13.588 51.220 1.00 0.00 O 0 +HETATM 7300 H1 HOH A2326 22.521 14.400 50.890 1.00 0.00 H 0 +HETATM 7301 H2 HOH A2326 22.154 12.911 50.945 1.00 0.00 H 0 +HETATM 7302 O HOH A2327 41.755 46.130 50.650 1.00 0.00 O 0 +HETATM 7303 H1 HOH A2327 40.961 45.864 51.078 1.00 0.00 H 0 +HETATM 7304 H2 HOH A2327 42.208 45.309 50.393 1.00 0.00 H 0 +HETATM 7305 O HOH A2328 44.314 5.398 30.186 1.00 0.00 O 0 +HETATM 7306 H1 HOH A2328 43.509 4.970 30.484 1.00 0.00 H 0 +HETATM 7307 H2 HOH A2328 44.124 5.793 29.322 1.00 0.00 H 0 +HETATM 7308 O HOH A2329 13.565 49.837 33.981 1.00 0.00 O 0 +HETATM 7309 H1 HOH A2329 13.367 49.388 34.841 1.00 0.00 H 0 +HETATM 7310 H2 HOH A2329 13.764 50.769 34.280 1.00 0.00 H 0 +HETATM 7311 O HOH A2330 18.336 5.854 22.754 1.00 0.00 O 0 +HETATM 7312 H1 HOH A2330 17.374 6.186 22.770 1.00 0.00 H 0 +HETATM 7313 H2 HOH A2330 18.762 6.230 23.488 1.00 0.00 H 0 +HETATM 7314 O HOH A2331 50.830 23.546 48.828 1.00 0.00 O 0 +HETATM 7315 H1 HOH A2331 49.986 23.507 48.355 1.00 0.00 H 0 +HETATM 7316 H2 HOH A2331 51.089 22.597 48.925 1.00 0.00 H 0 +HETATM 7317 O HOH A2332 53.948 16.501 20.257 1.00 0.00 O 0 +HETATM 7318 H1 HOH A2332 53.721 16.133 21.136 1.00 0.00 H 0 +HETATM 7319 H2 HOH A2332 53.330 17.287 20.204 1.00 0.00 H 0 +HETATM 7320 O HOH A2333 48.090 6.832 10.613 1.00 0.00 O 0 +HETATM 7321 H1 HOH A2333 47.984 6.664 9.686 1.00 0.00 H 0 +HETATM 7322 H2 HOH A2333 49.008 6.524 10.789 1.00 0.00 H 0 +HETATM 7323 O HOH A2334 23.219 29.052 41.128 1.00 0.00 O 0 +HETATM 7324 H1 HOH A2334 23.011 28.055 41.253 1.00 0.00 H 0 +HETATM 7325 H2 HOH A2334 22.343 29.475 41.007 1.00 0.00 H 0 +HETATM 7326 O HOH A2335 3.835 49.946 27.742 1.00 0.00 O 0 +HETATM 7327 H1 HOH A2335 4.578 49.363 28.126 1.00 0.00 H 0 +HETATM 7328 H2 HOH A2335 4.161 50.439 26.914 1.00 0.00 H 0 +HETATM 7329 O HOH A2336 22.965 9.001 38.011 1.00 0.00 O 0 +HETATM 7330 H1 HOH A2336 22.498 9.475 37.337 1.00 0.00 H 0 +HETATM 7331 H2 HOH A2336 23.439 8.309 37.502 1.00 0.00 H 0 +HETATM 7332 O HOH A2337 48.540 17.628 19.322 1.00 0.00 O 0 +HETATM 7333 H1 HOH A2337 47.612 17.439 19.659 1.00 0.00 H 0 +HETATM 7334 H2 HOH A2337 48.851 18.476 19.622 1.00 0.00 H 0 +HETATM 7335 O HOH A2338 43.532 1.065 22.103 1.00 0.00 O 0 +HETATM 7336 H1 HOH A2338 43.457 1.544 21.259 1.00 0.00 H 0 +HETATM 7337 H2 HOH A2338 44.182 1.586 22.586 1.00 0.00 H 0 +HETATM 7338 O HOH A2339 2.016 18.873 23.364 1.00 0.00 O 0 +HETATM 7339 H1 HOH A2339 2.633 19.292 22.760 1.00 0.00 H 0 +HETATM 7340 H2 HOH A2339 1.793 19.575 24.022 1.00 0.00 H 0 +HETATM 7341 O HOH A2340 47.379 14.343 29.736 1.00 0.00 O 0 +HETATM 7342 H1 HOH A2340 47.351 15.196 30.173 1.00 0.00 H 0 +HETATM 7343 H2 HOH A2340 48.287 14.181 29.427 1.00 0.00 H 0 +HETATM 7344 O HOH A2341 12.630 34.313 5.831 1.00 0.00 O 0 +HETATM 7345 H1 HOH A2341 13.061 34.769 5.018 1.00 0.00 H 0 +HETATM 7346 H2 HOH A2341 11.687 34.350 5.582 1.00 0.00 H 0 +HETATM 7347 O HOH A2342 39.958 20.197 35.348 1.00 0.00 O 0 +HETATM 7348 H1 HOH A2342 39.498 19.725 35.993 1.00 0.00 H 0 +HETATM 7349 H2 HOH A2342 39.646 21.092 35.400 1.00 0.00 H 0 +HETATM 7350 O HOH A2343 18.969 36.361 46.521 1.00 0.00 O 0 +HETATM 7351 H1 HOH A2343 18.132 36.511 46.916 1.00 0.00 H 0 +HETATM 7352 H2 HOH A2343 19.456 37.250 46.413 1.00 0.00 H 0 +HETATM 7353 O HOH A2344 28.302 35.249 45.589 1.00 0.00 O 0 +HETATM 7354 H1 HOH A2344 29.137 35.143 45.165 1.00 0.00 H 0 +HETATM 7355 H2 HOH A2344 28.128 36.170 45.559 1.00 0.00 H 0 +HETATM 7356 O HOH A2345 38.879 1.519 20.052 1.00 0.00 O 0 +HETATM 7357 H1 HOH A2345 39.759 1.836 19.881 1.00 0.00 H 0 +HETATM 7358 H2 HOH A2345 38.518 1.267 19.223 1.00 0.00 H 0 +HETATM 7359 O HOH A2346 50.177 23.758 51.823 1.00 0.00 O 0 +HETATM 7360 H1 HOH A2346 49.387 23.671 52.423 1.00 0.00 H 0 +HETATM 7361 H2 HOH A2346 50.031 23.345 51.018 1.00 0.00 H 0 +HETATM 7362 O HOH A2347 49.621 40.291 40.514 1.00 0.00 O 0 +HETATM 7363 H1 HOH A2347 50.262 41.026 40.452 1.00 0.00 H 0 +HETATM 7364 H2 HOH A2347 49.539 39.846 39.623 1.00 0.00 H 0 +HETATM 7365 O HOH A2348 27.256 5.730 39.469 1.00 0.00 O 0 +HETATM 7366 H1 HOH A2348 26.584 5.649 40.123 1.00 0.00 H 0 +HETATM 7367 H2 HOH A2348 26.884 5.481 38.590 1.00 0.00 H 0 +HETATM 7368 O HOH A2349 10.101 8.104 27.967 1.00 0.00 O 0 +HETATM 7369 H1 HOH A2349 10.087 9.052 27.866 1.00 0.00 H 0 +HETATM 7370 H2 HOH A2349 10.394 7.815 28.810 1.00 0.00 H 0 +HETATM 7371 O HOH A2350 6.909 40.640 27.173 1.00 0.00 O 0 +HETATM 7372 H1 HOH A2350 7.441 40.897 26.393 1.00 0.00 H 0 +HETATM 7373 H2 HOH A2350 7.511 40.157 27.749 1.00 0.00 H 0 +HETATM 7374 O HOH A2351 46.375 41.356 8.822 1.00 0.00 O 0 +HETATM 7375 H1 HOH A2351 46.110 42.121 8.353 1.00 0.00 H 0 +HETATM 7376 H2 HOH A2351 46.055 40.614 8.275 1.00 0.00 H 0 +HETATM 7377 O HOH A2352 24.755 46.507 16.385 1.00 0.00 O 0 +HETATM 7378 H1 HOH A2352 23.822 46.548 16.693 1.00 0.00 H 0 +HETATM 7379 H2 HOH A2352 25.213 45.684 16.527 1.00 0.00 H 0 +HETATM 7380 O HOH A2353 19.886 17.507 17.931 1.00 0.00 O 0 +HETATM 7381 H1 HOH A2353 19.479 16.970 18.572 1.00 0.00 H 0 +HETATM 7382 H2 HOH A2353 19.579 17.219 17.089 1.00 0.00 H 0 +HETATM 7383 O HOH A2354 24.193 36.913 12.842 1.00 0.00 O 0 +HETATM 7384 H1 HOH A2354 23.980 36.473 12.022 1.00 0.00 H 0 +HETATM 7385 H2 HOH A2354 24.702 37.633 12.568 1.00 0.00 H 0 +HETATM 7386 O HOH A2355 37.215 33.107 48.307 1.00 0.00 O 0 +HETATM 7387 H1 HOH A2355 36.911 33.950 48.755 1.00 0.00 H 0 +HETATM 7388 H2 HOH A2355 38.082 33.356 47.962 1.00 0.00 H 0 +HETATM 7389 O HOH A2356 12.527 8.766 53.208 1.00 0.00 O 0 +HETATM 7390 H1 HOH A2356 11.553 8.716 53.073 1.00 0.00 H 0 +HETATM 7391 H2 HOH A2356 12.782 8.072 53.801 1.00 0.00 H 0 +HETATM 7392 O HOH A2357 0.390 30.185 45.108 1.00 0.00 O 0 +HETATM 7393 H1 HOH A2357 0.452 29.238 44.744 1.00 0.00 H 0 +HETATM 7394 H2 HOH A2357 -0.343 30.640 44.683 1.00 0.00 H 0 +HETATM 7395 O HOH A2358 46.622 51.504 29.932 1.00 0.00 O 0 +HETATM 7396 H1 HOH A2358 47.266 50.962 30.317 1.00 0.00 H 0 +HETATM 7397 H2 HOH A2358 45.839 50.957 29.716 1.00 0.00 H 0 +HETATM 7398 O HOH A2359 19.790 5.570 45.679 1.00 0.00 O 0 +HETATM 7399 H1 HOH A2359 19.124 5.776 46.262 1.00 0.00 H 0 +HETATM 7400 H2 HOH A2359 19.610 4.620 45.459 1.00 0.00 H 0 +HETATM 7401 O HOH A2360 52.591 15.835 49.612 1.00 0.00 O 0 +HETATM 7402 H1 HOH A2360 53.521 15.528 49.433 1.00 0.00 H 0 +HETATM 7403 H2 HOH A2360 52.366 15.185 50.313 1.00 0.00 H 0 +HETATM 7404 O HOH A2361 39.074 37.450 52.241 1.00 0.00 O 0 +HETATM 7405 H1 HOH A2361 39.590 37.625 53.049 1.00 0.00 H 0 +HETATM 7406 H2 HOH A2361 39.255 36.558 51.891 1.00 0.00 H 0 +HETATM 7407 O HOH A2362 9.596 3.003 52.291 1.00 0.00 O 0 +HETATM 7408 H1 HOH A2362 10.469 2.738 52.688 1.00 0.00 H 0 +HETATM 7409 H2 HOH A2362 9.781 3.127 51.346 1.00 0.00 H 0 +HETATM 7410 O HOH A2363 32.920 4.195 42.267 1.00 0.00 O 0 +HETATM 7411 H1 HOH A2363 32.924 5.039 42.805 1.00 0.00 H 0 +HETATM 7412 H2 HOH A2363 33.531 3.666 42.815 1.00 0.00 H 0 +HETATM 7413 O HOH A2364 30.742 45.215 49.027 1.00 0.00 O 0 +HETATM 7414 H1 HOH A2364 29.876 45.440 49.402 1.00 0.00 H 0 +HETATM 7415 H2 HOH A2364 31.179 44.648 49.677 1.00 0.00 H 0 +HETATM 7416 O HOH A2365 45.669 36.671 1.806 1.00 0.00 O 0 +HETATM 7417 H1 HOH A2365 46.034 36.721 0.902 1.00 0.00 H 0 +HETATM 7418 H2 HOH A2365 46.103 37.420 2.243 1.00 0.00 H 0 +HETATM 7419 O HOH A2366 5.793 48.085 51.226 1.00 0.00 O 0 +HETATM 7420 H1 HOH A2366 6.683 48.458 51.524 1.00 0.00 H 0 +HETATM 7421 H2 HOH A2366 5.519 47.629 52.039 1.00 0.00 H 0 +HETATM 7422 O HOH A2367 41.971 17.830 23.439 1.00 0.00 O 0 +HETATM 7423 H1 HOH A2367 42.400 17.610 24.290 1.00 0.00 H 0 +HETATM 7424 H2 HOH A2367 41.540 18.698 23.584 1.00 0.00 H 0 +HETATM 7425 O HOH A2368 35.507 8.812 22.461 1.00 0.00 O 0 +HETATM 7426 H1 HOH A2368 34.837 9.187 23.027 1.00 0.00 H 0 +HETATM 7427 H2 HOH A2368 35.230 9.049 21.578 1.00 0.00 H 0 +HETATM 7428 O HOH A2369 47.925 52.977 4.847 1.00 0.00 O 0 +HETATM 7429 H1 HOH A2369 47.875 52.205 5.431 1.00 0.00 H 0 +HETATM 7430 H2 HOH A2369 48.864 53.257 4.728 1.00 0.00 H 0 +HETATM 7431 O HOH A2370 33.344 17.113 15.801 1.00 0.00 O 0 +HETATM 7432 H1 HOH A2370 34.294 17.010 15.584 1.00 0.00 H 0 +HETATM 7433 H2 HOH A2370 33.231 17.939 16.314 1.00 0.00 H 0 +HETATM 7434 O HOH A2371 19.349 11.785 10.234 1.00 0.00 O 0 +HETATM 7435 H1 HOH A2371 19.917 12.082 9.511 1.00 0.00 H 0 +HETATM 7436 H2 HOH A2371 19.034 10.922 10.047 1.00 0.00 H 0 +HETATM 7437 O HOH A2372 5.351 11.232 48.526 1.00 0.00 O 0 +HETATM 7438 H1 HOH A2372 4.511 10.712 48.277 1.00 0.00 H 0 +HETATM 7439 H2 HOH A2372 5.234 12.151 48.081 1.00 0.00 H 0 +HETATM 7440 O HOH A2373 20.342 18.267 9.120 1.00 0.00 O 0 +HETATM 7441 H1 HOH A2373 20.170 18.460 8.161 1.00 0.00 H 0 +HETATM 7442 H2 HOH A2373 20.853 19.059 9.445 1.00 0.00 H 0 +HETATM 7443 O HOH A2374 14.487 17.058 6.067 1.00 0.00 O 0 +HETATM 7444 H1 HOH A2374 13.853 17.755 6.122 1.00 0.00 H 0 +HETATM 7445 H2 HOH A2374 14.169 16.267 6.500 1.00 0.00 H 0 +HETATM 7446 O HOH A2375 19.139 51.804 42.488 1.00 0.00 O 0 +HETATM 7447 H1 HOH A2375 19.224 51.332 41.636 1.00 0.00 H 0 +HETATM 7448 H2 HOH A2375 18.320 51.523 42.955 1.00 0.00 H 0 +HETATM 7449 O HOH A2376 37.517 53.217 39.428 1.00 0.00 O 0 +HETATM 7450 H1 HOH A2376 37.295 52.275 39.509 1.00 0.00 H 0 +HETATM 7451 H2 HOH A2376 36.713 53.718 39.749 1.00 0.00 H 0 +HETATM 7452 O HOH A2377 5.657 5.382 12.982 1.00 0.00 O 0 +HETATM 7453 H1 HOH A2377 5.155 4.721 12.486 1.00 0.00 H 0 +HETATM 7454 H2 HOH A2377 5.241 6.272 12.785 1.00 0.00 H 0 +HETATM 7455 O HOH A2378 12.419 31.368 42.286 1.00 0.00 O 0 +HETATM 7456 H1 HOH A2378 12.915 30.691 41.930 1.00 0.00 H 0 +HETATM 7457 H2 HOH A2378 12.499 31.252 43.238 1.00 0.00 H 0 +HETATM 7458 O HOH A2379 45.739 27.809 12.362 1.00 0.00 O 0 +HETATM 7459 H1 HOH A2379 45.866 27.176 11.595 1.00 0.00 H 0 +HETATM 7460 H2 HOH A2379 46.510 27.829 12.894 1.00 0.00 H 0 +HETATM 7461 O HOH A2380 12.726 20.258 26.692 1.00 0.00 O 0 +HETATM 7462 H1 HOH A2380 12.810 19.579 25.970 1.00 0.00 H 0 +HETATM 7463 H2 HOH A2380 12.445 21.013 26.222 1.00 0.00 H 0 +HETATM 7464 O HOH A2381 9.278 3.760 49.635 1.00 0.00 O 0 +HETATM 7465 H1 HOH A2381 9.813 4.262 49.052 1.00 0.00 H 0 +HETATM 7466 H2 HOH A2381 8.494 3.532 49.128 1.00 0.00 H 0 +HETATM 7467 O HOH A2382 12.802 2.029 3.793 1.00 0.00 O 0 +HETATM 7468 H1 HOH A2382 12.388 1.222 4.205 1.00 0.00 H 0 +HETATM 7469 H2 HOH A2382 12.256 2.197 3.020 1.00 0.00 H 0 +HETATM 7470 O HOH A2383 18.295 6.336 32.581 1.00 0.00 O 0 +HETATM 7471 H1 HOH A2383 17.655 6.977 32.338 1.00 0.00 H 0 +HETATM 7472 H2 HOH A2383 17.872 5.831 33.350 1.00 0.00 H 0 +HETATM 7473 O HOH A2384 45.861 47.513 26.166 1.00 0.00 O 0 +HETATM 7474 H1 HOH A2384 45.218 47.300 25.506 1.00 0.00 H 0 +HETATM 7475 H2 HOH A2384 46.288 48.365 25.781 1.00 0.00 H 0 +HETATM 7476 O HOH A2385 31.632 37.909 2.267 1.00 0.00 O 0 +HETATM 7477 H1 HOH A2385 32.418 37.254 2.216 1.00 0.00 H 0 +HETATM 7478 H2 HOH A2385 31.268 37.964 1.402 1.00 0.00 H 0 +HETATM 7479 O HOH A2386 2.251 11.013 43.401 1.00 0.00 O 0 +HETATM 7480 H1 HOH A2386 1.546 10.469 43.783 1.00 0.00 H 0 +HETATM 7481 H2 HOH A2386 1.840 11.880 43.132 1.00 0.00 H 0 +HETATM 7482 O HOH A2387 1.545 30.274 40.639 1.00 0.00 O 0 +HETATM 7483 H1 HOH A2387 0.718 29.810 40.812 1.00 0.00 H 0 +HETATM 7484 H2 HOH A2387 1.819 30.724 41.486 1.00 0.00 H 0 +HETATM 7485 O HOH A2388 47.939 16.883 24.649 1.00 0.00 O 0 +HETATM 7486 H1 HOH A2388 48.114 17.656 24.143 1.00 0.00 H 0 +HETATM 7487 H2 HOH A2388 48.041 16.246 23.907 1.00 0.00 H 0 +HETATM 7488 O HOH A2389 50.747 11.362 24.978 1.00 0.00 O 0 +HETATM 7489 H1 HOH A2389 51.604 11.248 25.344 1.00 0.00 H 0 +HETATM 7490 H2 HOH A2389 50.245 10.459 24.980 1.00 0.00 H 0 +HETATM 7491 O HOH A2390 5.201 28.816 13.940 1.00 0.00 O 0 +HETATM 7492 H1 HOH A2390 5.171 27.947 13.596 1.00 0.00 H 0 +HETATM 7493 H2 HOH A2390 6.146 28.989 13.971 1.00 0.00 H 0 +HETATM 7494 O HOH A2391 27.029 35.361 21.995 1.00 0.00 O 0 +HETATM 7495 H1 HOH A2391 27.978 35.249 21.857 1.00 0.00 H 0 +HETATM 7496 H2 HOH A2391 26.688 34.501 22.388 1.00 0.00 H 0 +HETATM 7497 O HOH A2392 34.280 53.061 36.208 1.00 0.00 O 0 +HETATM 7498 H1 HOH A2392 34.170 52.096 36.396 1.00 0.00 H 0 +HETATM 7499 H2 HOH A2392 33.571 53.263 35.638 1.00 0.00 H 0 +HETATM 7500 O HOH A2393 39.897 35.959 12.532 1.00 0.00 O 0 +HETATM 7501 H1 HOH A2393 40.224 36.850 12.222 1.00 0.00 H 0 +HETATM 7502 H2 HOH A2393 40.186 35.843 13.430 1.00 0.00 H 0 +HETATM 7503 O HOH A2394 5.642 46.269 44.969 1.00 0.00 O 0 +HETATM 7504 H1 HOH A2394 5.016 47.024 45.077 1.00 0.00 H 0 +HETATM 7505 H2 HOH A2394 6.415 46.347 45.549 1.00 0.00 H 0 +HETATM 7506 O HOH A2395 12.860 8.291 27.161 1.00 0.00 O 0 +HETATM 7507 H1 HOH A2395 13.010 7.472 27.645 1.00 0.00 H 0 +HETATM 7508 H2 HOH A2395 11.895 8.427 27.304 1.00 0.00 H 0 +HETATM 7509 O HOH A2396 53.505 52.813 7.980 1.00 0.00 O 0 +HETATM 7510 H1 HOH A2396 52.647 52.539 7.599 1.00 0.00 H 0 +HETATM 7511 H2 HOH A2396 54.267 52.116 7.891 1.00 0.00 H 0 +HETATM 7512 O HOH A2397 11.036 27.917 29.448 1.00 0.00 O 0 +HETATM 7513 H1 HOH A2397 10.900 27.421 30.344 1.00 0.00 H 0 +HETATM 7514 H2 HOH A2397 10.317 28.532 29.309 1.00 0.00 H 0 +HETATM 7515 O HOH A2398 23.077 48.548 5.632 1.00 0.00 O 0 +HETATM 7516 H1 HOH A2398 23.108 47.764 5.073 1.00 0.00 H 0 +HETATM 7517 H2 HOH A2398 23.346 48.224 6.451 1.00 0.00 H 0 +HETATM 7518 O HOH A2399 37.120 38.975 22.444 1.00 0.00 O 0 +HETATM 7519 H1 HOH A2399 37.272 38.023 22.352 1.00 0.00 H 0 +HETATM 7520 H2 HOH A2399 37.964 39.408 22.572 1.00 0.00 H 0 +HETATM 7521 O HOH A2400 1.080 27.280 3.363 1.00 0.00 O 0 +HETATM 7522 H1 HOH A2400 0.535 28.029 3.741 1.00 0.00 H 0 +HETATM 7523 H2 HOH A2400 1.496 26.917 4.147 1.00 0.00 H 0 +HETATM 7524 O HOH A2401 39.826 5.055 17.701 1.00 0.00 O 0 +HETATM 7525 H1 HOH A2401 39.628 4.463 16.958 1.00 0.00 H 0 +HETATM 7526 H2 HOH A2401 40.060 4.675 18.553 1.00 0.00 H 0 +HETATM 7527 O HOH A2402 50.274 39.405 38.013 1.00 0.00 O 0 +HETATM 7528 H1 HOH A2402 49.886 38.678 37.554 1.00 0.00 H 0 +HETATM 7529 H2 HOH A2402 50.447 40.133 37.439 1.00 0.00 H 0 +HETATM 7530 O HOH A2403 13.069 40.522 33.200 1.00 0.00 O 0 +HETATM 7531 H1 HOH A2403 12.948 41.127 32.458 1.00 0.00 H 0 +HETATM 7532 H2 HOH A2403 13.990 40.182 32.986 1.00 0.00 H 0 +HETATM 7533 O HOH A2404 30.220 51.800 51.050 1.00 0.00 O 0 +HETATM 7534 H1 HOH A2404 30.383 51.564 50.120 1.00 0.00 H 0 +HETATM 7535 H2 HOH A2404 29.239 51.629 51.108 1.00 0.00 H 0 +HETATM 7536 O HOH A2405 7.487 49.817 3.049 1.00 0.00 O 0 +HETATM 7537 H1 HOH A2405 7.785 49.516 2.155 1.00 0.00 H 0 +HETATM 7538 H2 HOH A2405 8.188 50.024 3.646 1.00 0.00 H 0 +HETATM 7539 O HOH A2406 8.454 0.214 2.213 1.00 0.00 O 0 +HETATM 7540 H1 HOH A2406 7.922 0.985 2.577 1.00 0.00 H 0 +HETATM 7541 H2 HOH A2406 8.990 -0.051 2.917 1.00 0.00 H 0 +HETATM 7542 O HOH A2407 5.478 14.974 29.264 1.00 0.00 O 0 +HETATM 7543 H1 HOH A2407 4.743 14.351 29.578 1.00 0.00 H 0 +HETATM 7544 H2 HOH A2407 6.165 14.877 29.946 1.00 0.00 H 0 +HETATM 7545 O HOH A2408 32.329 3.225 17.488 1.00 0.00 O 0 +HETATM 7546 H1 HOH A2408 33.203 2.769 17.503 1.00 0.00 H 0 +HETATM 7547 H2 HOH A2408 32.452 4.096 17.027 1.00 0.00 H 0 +HETATM 7548 O HOH A2409 52.854 4.360 20.876 1.00 0.00 O 0 +HETATM 7549 H1 HOH A2409 53.632 3.873 21.042 1.00 0.00 H 0 +HETATM 7550 H2 HOH A2409 52.261 4.210 21.707 1.00 0.00 H 0 +HETATM 7551 O HOH A2410 20.337 26.784 52.226 1.00 0.00 O 0 +HETATM 7552 H1 HOH A2410 19.465 26.464 52.505 1.00 0.00 H 0 +HETATM 7553 H2 HOH A2410 20.739 26.069 51.792 1.00 0.00 H 0 +HETATM 7554 O HOH A2411 3.451 5.318 1.405 1.00 0.00 O 0 +HETATM 7555 H1 HOH A2411 3.573 5.655 0.440 1.00 0.00 H 0 +HETATM 7556 H2 HOH A2411 3.966 5.890 1.967 1.00 0.00 H 0 +HETATM 7557 O HOH A2412 24.398 48.003 50.989 1.00 0.00 O 0 +HETATM 7558 H1 HOH A2412 24.261 48.459 51.812 1.00 0.00 H 0 +HETATM 7559 H2 HOH A2412 25.233 48.340 50.574 1.00 0.00 H 0 +HETATM 7560 O HOH A2413 48.724 2.631 21.208 1.00 0.00 O 0 +HETATM 7561 H1 HOH A2413 48.455 1.791 21.628 1.00 0.00 H 0 +HETATM 7562 H2 HOH A2413 48.816 2.391 20.275 1.00 0.00 H 0 +HETATM 7563 O HOH A2414 52.966 51.497 51.488 1.00 0.00 O 0 +HETATM 7564 H1 HOH A2414 52.779 52.330 51.894 1.00 0.00 H 0 +HETATM 7565 H2 HOH A2414 53.840 51.590 51.199 1.00 0.00 H 0 +HETATM 7566 O HOH A2415 33.495 36.820 6.220 1.00 0.00 O 0 +HETATM 7567 H1 HOH A2415 33.323 35.998 5.670 1.00 0.00 H 0 +HETATM 7568 H2 HOH A2415 34.460 36.858 6.274 1.00 0.00 H 0 +HETATM 7569 O HOH A2416 44.842 31.849 1.897 1.00 0.00 O 0 +HETATM 7570 H1 HOH A2416 44.860 31.095 1.226 1.00 0.00 H 0 +HETATM 7571 H2 HOH A2416 44.254 31.559 2.635 1.00 0.00 H 0 +HETATM 7572 O HOH A2417 19.371 4.575 14.585 1.00 0.00 O 0 +HETATM 7573 H1 HOH A2417 18.549 4.291 14.849 1.00 0.00 H 0 +HETATM 7574 H2 HOH A2417 19.174 4.534 13.630 1.00 0.00 H 0 +HETATM 7575 O HOH A2418 30.094 3.304 11.584 1.00 0.00 O 0 +HETATM 7576 H1 HOH A2418 30.323 2.391 11.515 1.00 0.00 H 0 +HETATM 7577 H2 HOH A2418 29.170 3.166 11.913 1.00 0.00 H 0 +HETATM 7578 O HOH A2419 21.205 18.416 51.104 1.00 0.00 O 0 +HETATM 7579 H1 HOH A2419 21.871 19.055 50.789 1.00 0.00 H 0 +HETATM 7580 H2 HOH A2419 20.380 18.806 50.778 1.00 0.00 H 0 +HETATM 7581 O HOH A2420 3.335 13.158 24.108 1.00 0.00 O 0 +HETATM 7582 H1 HOH A2420 3.717 14.004 24.018 1.00 0.00 H 0 +HETATM 7583 H2 HOH A2420 3.031 12.812 23.231 1.00 0.00 H 0 +HETATM 7584 O HOH A2421 31.791 13.981 4.341 1.00 0.00 O 0 +HETATM 7585 H1 HOH A2421 31.611 13.768 3.457 1.00 0.00 H 0 +HETATM 7586 H2 HOH A2421 31.475 14.950 4.515 1.00 0.00 H 0 +HETATM 7587 O HOH A2422 45.805 16.451 26.216 1.00 0.00 O 0 +HETATM 7588 H1 HOH A2422 46.526 16.656 25.612 1.00 0.00 H 0 +HETATM 7589 H2 HOH A2422 45.955 15.536 26.568 1.00 0.00 H 0 +HETATM 7590 O HOH A2423 53.362 26.360 16.798 1.00 0.00 O 0 +HETATM 7591 H1 HOH A2423 52.454 26.435 16.973 1.00 0.00 H 0 +HETATM 7592 H2 HOH A2423 53.767 25.743 17.465 1.00 0.00 H 0 +HETATM 7593 O HOH A2424 21.107 8.205 26.952 1.00 0.00 O 0 +HETATM 7594 H1 HOH A2424 20.704 7.305 27.145 1.00 0.00 H 0 +HETATM 7595 H2 HOH A2424 20.455 8.933 26.627 1.00 0.00 H 0 +HETATM 7596 O HOH A2425 15.039 4.836 51.145 1.00 0.00 O 0 +HETATM 7597 H1 HOH A2425 14.672 5.705 51.261 1.00 0.00 H 0 +HETATM 7598 H2 HOH A2425 15.533 4.801 51.975 1.00 0.00 H 0 +HETATM 7599 O HOH A2426 49.696 22.527 37.588 1.00 0.00 O 0 +HETATM 7600 H1 HOH A2426 49.582 22.609 38.570 1.00 0.00 H 0 +HETATM 7601 H2 HOH A2426 50.549 22.782 37.274 1.00 0.00 H 0 +HETATM 7602 O HOH A2427 53.455 39.228 27.540 1.00 0.00 O 0 +HETATM 7603 H1 HOH A2427 53.461 39.639 28.386 1.00 0.00 H 0 +HETATM 7604 H2 HOH A2427 52.615 38.783 27.488 1.00 0.00 H 0 +HETATM 7605 O HOH A2428 46.322 48.520 39.155 1.00 0.00 O 0 +HETATM 7606 H1 HOH A2428 46.682 49.264 38.672 1.00 0.00 H 0 +HETATM 7607 H2 HOH A2428 46.870 48.362 39.952 1.00 0.00 H 0 +HETATM 7608 O HOH A2429 33.169 35.920 12.427 1.00 0.00 O 0 +HETATM 7609 H1 HOH A2429 33.651 36.394 11.759 1.00 0.00 H 0 +HETATM 7610 H2 HOH A2429 33.097 34.965 12.155 1.00 0.00 H 0 +HETATM 7611 O HOH A2430 38.008 6.684 36.336 1.00 0.00 O 0 +HETATM 7612 H1 HOH A2430 37.895 7.398 35.654 1.00 0.00 H 0 +HETATM 7613 H2 HOH A2430 37.962 5.919 35.738 1.00 0.00 H 0 +HETATM 7614 O HOH A2431 8.684 44.349 6.019 1.00 0.00 O 0 +HETATM 7615 H1 HOH A2431 8.675 43.916 5.129 1.00 0.00 H 0 +HETATM 7616 H2 HOH A2431 9.443 43.954 6.473 1.00 0.00 H 0 +HETATM 7617 O HOH A2432 41.956 1.483 6.020 1.00 0.00 O 0 +HETATM 7618 H1 HOH A2432 42.790 1.324 5.609 1.00 0.00 H 0 +HETATM 7619 H2 HOH A2432 42.170 2.279 6.487 1.00 0.00 H 0 +HETATM 7620 O HOH A2433 42.469 36.719 53.313 1.00 0.00 O 0 +HETATM 7621 H1 HOH A2433 43.207 37.287 53.028 1.00 0.00 H 0 +HETATM 7622 H2 HOH A2433 42.062 36.244 52.529 1.00 0.00 H 0 +HETATM 7623 O HOH A2434 22.514 32.473 28.690 1.00 0.00 O 0 +HETATM 7624 H1 HOH A2434 21.816 32.573 29.356 1.00 0.00 H 0 +HETATM 7625 H2 HOH A2434 22.098 32.188 27.892 1.00 0.00 H 0 +HETATM 7626 O HOH A2435 35.698 31.554 49.902 1.00 0.00 O 0 +HETATM 7627 H1 HOH A2435 35.503 32.285 50.549 1.00 0.00 H 0 +HETATM 7628 H2 HOH A2435 36.177 32.001 49.122 1.00 0.00 H 0 +HETATM 7629 O HOH A2436 33.971 9.582 32.020 1.00 0.00 O 0 +HETATM 7630 H1 HOH A2436 33.602 10.004 31.239 1.00 0.00 H 0 +HETATM 7631 H2 HOH A2436 33.717 10.185 32.689 1.00 0.00 H 0 +HETATM 7632 O HOH A2437 46.409 41.400 53.059 1.00 0.00 O 0 +HETATM 7633 H1 HOH A2437 46.363 41.174 52.100 1.00 0.00 H 0 +HETATM 7634 H2 HOH A2437 45.693 42.105 53.051 1.00 0.00 H 0 +HETATM 7635 O HOH A2438 34.461 9.438 48.821 1.00 0.00 O 0 +HETATM 7636 H1 HOH A2438 34.478 10.012 48.013 1.00 0.00 H 0 +HETATM 7637 H2 HOH A2438 35.081 8.716 48.798 1.00 0.00 H 0 +HETATM 7638 O HOH A2439 12.231 37.430 38.426 1.00 0.00 O 0 +HETATM 7639 H1 HOH A2439 11.245 37.551 38.524 1.00 0.00 H 0 +HETATM 7640 H2 HOH A2439 12.542 37.305 37.506 1.00 0.00 H 0 +HETATM 7641 O HOH A2440 2.107 0.480 26.687 1.00 0.00 O 0 +HETATM 7642 H1 HOH A2440 2.780 -0.034 26.127 1.00 0.00 H 0 +HETATM 7643 H2 HOH A2440 2.433 1.435 26.635 1.00 0.00 H 0 +HETATM 7644 O HOH A2441 52.602 41.807 26.433 1.00 0.00 O 0 +HETATM 7645 H1 HOH A2441 52.993 40.972 26.621 1.00 0.00 H 0 +HETATM 7646 H2 HOH A2441 52.122 42.004 27.216 1.00 0.00 H 0 +HETATM 7647 O HOH A2442 34.683 40.758 -0.020 1.00 0.00 O 0 +HETATM 7648 H1 HOH A2442 34.365 40.307 0.800 1.00 0.00 H 0 +HETATM 7649 H2 HOH A2442 35.218 40.128 -0.522 1.00 0.00 H 0 +HETATM 7650 O HOH A2443 38.501 52.331 32.156 1.00 0.00 O 0 +HETATM 7651 H1 HOH A2443 37.796 52.528 31.509 1.00 0.00 H 0 +HETATM 7652 H2 HOH A2443 39.001 53.144 32.277 1.00 0.00 H 0 +HETATM 7653 O HOH A2444 35.726 33.546 15.219 1.00 0.00 O 0 +HETATM 7654 H1 HOH A2444 34.845 33.903 15.368 1.00 0.00 H 0 +HETATM 7655 H2 HOH A2444 36.067 33.930 14.406 1.00 0.00 H 0 +HETATM 7656 O HOH A2445 21.941 38.306 13.777 1.00 0.00 O 0 +HETATM 7657 H1 HOH A2445 21.157 37.814 13.422 1.00 0.00 H 0 +HETATM 7658 H2 HOH A2445 22.659 37.749 13.651 1.00 0.00 H 0 +HETATM 7659 O HOH A2446 43.058 13.333 18.372 1.00 0.00 O 0 +HETATM 7660 H1 HOH A2446 43.070 12.600 17.756 1.00 0.00 H 0 +HETATM 7661 H2 HOH A2446 43.763 13.933 18.094 1.00 0.00 H 0 +HETATM 7662 O HOH A2447 5.991 6.544 18.582 1.00 0.00 O 0 +HETATM 7663 H1 HOH A2447 5.148 6.084 18.801 1.00 0.00 H 0 +HETATM 7664 H2 HOH A2447 5.984 6.746 17.601 1.00 0.00 H 0 +HETATM 7665 O HOH A2448 0.467 31.146 11.515 1.00 0.00 O 0 +HETATM 7666 H1 HOH A2448 0.078 30.764 10.702 1.00 0.00 H 0 +HETATM 7667 H2 HOH A2448 0.318 30.512 12.220 1.00 0.00 H 0 +HETATM 7668 O HOH A2449 51.000 45.482 2.170 1.00 0.00 O 0 +HETATM 7669 H1 HOH A2449 50.239 45.192 2.677 1.00 0.00 H 0 +HETATM 7670 H2 HOH A2449 51.705 44.719 2.203 1.00 0.00 H 0 +HETATM 7671 O HOH A2450 47.278 0.991 6.964 1.00 0.00 O 0 +HETATM 7672 H1 HOH A2450 47.537 0.381 6.321 1.00 0.00 H 0 +HETATM 7673 H2 HOH A2450 47.737 0.860 7.792 1.00 0.00 H 0 +HETATM 7674 O HOH A2451 18.016 48.839 20.884 1.00 0.00 O 0 +HETATM 7675 H1 HOH A2451 18.472 49.514 21.413 1.00 0.00 H 0 +HETATM 7676 H2 HOH A2451 17.922 49.195 20.045 1.00 0.00 H 0 +HETATM 7677 O HOH A2452 44.160 9.288 37.579 1.00 0.00 O 0 +HETATM 7678 H1 HOH A2452 44.190 9.080 38.558 1.00 0.00 H 0 +HETATM 7679 H2 HOH A2452 44.238 8.487 37.056 1.00 0.00 H 0 +HETATM 7680 O HOH A2453 17.516 8.957 44.136 1.00 0.00 O 0 +HETATM 7681 H1 HOH A2453 16.951 8.822 44.865 1.00 0.00 H 0 +HETATM 7682 H2 HOH A2453 18.144 9.723 44.285 1.00 0.00 H 0 +HETATM 7683 O HOH A2454 26.080 41.288 8.412 1.00 0.00 O 0 +HETATM 7684 H1 HOH A2454 26.108 41.534 7.498 1.00 0.00 H 0 +HETATM 7685 H2 HOH A2454 25.876 42.143 8.867 1.00 0.00 H 0 +HETATM 7686 O HOH A2455 23.808 3.299 10.728 1.00 0.00 O 0 +HETATM 7687 H1 HOH A2455 24.090 3.526 9.818 1.00 0.00 H 0 +HETATM 7688 H2 HOH A2455 23.858 2.303 10.825 1.00 0.00 H 0 +HETATM 7689 O HOH A2456 14.745 15.067 22.145 1.00 0.00 O 0 +HETATM 7690 H1 HOH A2456 14.162 15.630 21.563 1.00 0.00 H 0 +HETATM 7691 H2 HOH A2456 15.236 15.707 22.578 1.00 0.00 H 0 +HETATM 7692 O HOH A2457 30.818 8.210 41.161 1.00 0.00 O 0 +HETATM 7693 H1 HOH A2457 30.785 8.021 42.107 1.00 0.00 H 0 +HETATM 7694 H2 HOH A2457 29.980 8.485 40.781 1.00 0.00 H 0 +HETATM 7695 O HOH A2458 25.599 20.807 39.760 1.00 0.00 O 0 +HETATM 7696 H1 HOH A2458 25.567 20.052 39.180 1.00 0.00 H 0 +HETATM 7697 H2 HOH A2458 25.616 20.441 40.596 1.00 0.00 H 0 +HETATM 7698 O HOH A2459 24.698 29.032 10.815 1.00 0.00 O 0 +HETATM 7699 H1 HOH A2459 25.209 28.266 10.960 1.00 0.00 H 0 +HETATM 7700 H2 HOH A2459 25.306 29.770 10.806 1.00 0.00 H 0 +HETATM 7701 O HOH A2460 28.534 45.076 42.822 1.00 0.00 O 0 +HETATM 7702 H1 HOH A2460 29.313 45.324 42.259 1.00 0.00 H 0 +HETATM 7703 H2 HOH A2460 27.939 44.628 42.256 1.00 0.00 H 0 +HETATM 7704 O HOH A2461 -0.078 8.915 14.748 1.00 0.00 O 0 +HETATM 7705 H1 HOH A2461 0.615 8.925 14.044 1.00 0.00 H 0 +HETATM 7706 H2 HOH A2461 -0.326 7.985 14.867 1.00 0.00 H 0 +HETATM 7707 O HOH A2462 46.547 11.476 5.071 1.00 0.00 O 0 +HETATM 7708 H1 HOH A2462 46.714 11.880 5.968 1.00 0.00 H 0 +HETATM 7709 H2 HOH A2462 45.622 11.645 5.000 1.00 0.00 H 0 +HETATM 7710 O HOH A2463 35.747 15.335 34.763 1.00 0.00 O 0 +HETATM 7711 H1 HOH A2463 35.981 14.611 35.344 1.00 0.00 H 0 +HETATM 7712 H2 HOH A2463 36.177 15.142 33.894 1.00 0.00 H 0 +HETATM 7713 O HOH A2464 22.783 46.754 3.449 1.00 0.00 O 0 +HETATM 7714 H1 HOH A2464 22.962 47.124 2.605 1.00 0.00 H 0 +HETATM 7715 H2 HOH A2464 23.207 45.897 3.305 1.00 0.00 H 0 +HETATM 7716 O HOH A2465 46.016 12.006 30.735 1.00 0.00 O 0 +HETATM 7717 H1 HOH A2465 45.092 12.152 30.501 1.00 0.00 H 0 +HETATM 7718 H2 HOH A2465 46.458 12.916 30.788 1.00 0.00 H 0 +HETATM 7719 O HOH A2466 8.564 20.109 22.939 1.00 0.00 O 0 +HETATM 7720 H1 HOH A2466 8.897 19.209 23.139 1.00 0.00 H 0 +HETATM 7721 H2 HOH A2466 9.180 20.571 22.402 1.00 0.00 H 0 +HETATM 7722 O HOH A2467 39.460 43.003 37.537 1.00 0.00 O 0 +HETATM 7723 H1 HOH A2467 40.354 43.318 37.677 1.00 0.00 H 0 +HETATM 7724 H2 HOH A2467 39.401 42.059 37.469 1.00 0.00 H 0 +HETATM 7725 O HOH A2468 24.982 41.184 36.008 1.00 0.00 O 0 +HETATM 7726 H1 HOH A2468 25.809 41.367 36.540 1.00 0.00 H 0 +HETATM 7727 H2 HOH A2468 25.148 40.287 35.592 1.00 0.00 H 0 +HETATM 7728 O HOH A2469 9.512 47.745 31.104 1.00 0.00 O 0 +HETATM 7729 H1 HOH A2469 9.561 48.544 31.647 1.00 0.00 H 0 +HETATM 7730 H2 HOH A2469 8.660 47.412 31.412 1.00 0.00 H 0 +HETATM 7731 O HOH A2470 7.211 10.543 9.545 1.00 0.00 O 0 +HETATM 7732 H1 HOH A2470 8.080 10.545 9.145 1.00 0.00 H 0 +HETATM 7733 H2 HOH A2470 7.070 9.637 9.900 1.00 0.00 H 0 +HETATM 7734 O HOH A2471 0.405 4.801 31.407 1.00 0.00 O 0 +HETATM 7735 H1 HOH A2471 0.503 5.021 32.307 1.00 0.00 H 0 +HETATM 7736 H2 HOH A2471 0.349 5.564 30.832 1.00 0.00 H 0 +HETATM 7737 O HOH A2472 4.129 14.297 50.782 1.00 0.00 O 0 +HETATM 7738 H1 HOH A2472 4.528 13.976 51.552 1.00 0.00 H 0 +HETATM 7739 H2 HOH A2472 3.232 14.521 51.121 1.00 0.00 H 0 +HETATM 7740 O HOH A2473 36.585 2.808 27.518 1.00 0.00 O 0 +HETATM 7741 H1 HOH A2473 36.725 3.171 28.413 1.00 0.00 H 0 +HETATM 7742 H2 HOH A2473 37.428 2.713 27.087 1.00 0.00 H 0 +HETATM 7743 O HOH A2474 41.380 33.313 42.981 1.00 0.00 O 0 +HETATM 7744 H1 HOH A2474 40.634 33.456 43.565 1.00 0.00 H 0 +HETATM 7745 H2 HOH A2474 41.650 32.430 43.155 1.00 0.00 H 0 +HETATM 7746 O HOH A2475 34.986 40.183 13.683 1.00 0.00 O 0 +HETATM 7747 H1 HOH A2475 34.695 39.297 13.826 1.00 0.00 H 0 +HETATM 7748 H2 HOH A2475 35.095 40.461 14.639 1.00 0.00 H 0 +HETATM 7749 O HOH A2476 35.865 4.254 47.741 1.00 0.00 O 0 +HETATM 7750 H1 HOH A2476 35.135 3.684 48.066 1.00 0.00 H 0 +HETATM 7751 H2 HOH A2476 35.484 4.666 46.963 1.00 0.00 H 0 +HETATM 7752 O HOH A2477 30.420 28.553 53.459 1.00 0.00 O 0 +HETATM 7753 H1 HOH A2477 30.669 29.401 53.859 1.00 0.00 H 0 +HETATM 7754 H2 HOH A2477 31.226 28.012 53.217 1.00 0.00 H 0 +HETATM 7755 O HOH A2478 1.488 0.969 51.386 1.00 0.00 O 0 +HETATM 7756 H1 HOH A2478 1.794 0.531 52.149 1.00 0.00 H 0 +HETATM 7757 H2 HOH A2478 0.585 1.255 51.659 1.00 0.00 H 0 +HETATM 7758 O HOH A2479 14.914 50.535 37.633 1.00 0.00 O 0 +HETATM 7759 H1 HOH A2479 14.522 49.682 37.748 1.00 0.00 H 0 +HETATM 7760 H2 HOH A2479 14.560 50.976 36.810 1.00 0.00 H 0 +HETATM 7761 O HOH A2480 40.750 16.964 20.961 1.00 0.00 O 0 +HETATM 7762 H1 HOH A2480 41.097 17.334 21.857 1.00 0.00 H 0 +HETATM 7763 H2 HOH A2480 41.475 16.965 20.356 1.00 0.00 H 0 +HETATM 7764 O HOH A2481 5.690 7.922 43.114 1.00 0.00 O 0 +HETATM 7765 H1 HOH A2481 6.143 8.435 43.784 1.00 0.00 H 0 +HETATM 7766 H2 HOH A2481 5.017 8.446 42.605 1.00 0.00 H 0 +HETATM 7767 O HOH A2482 43.010 46.765 9.907 1.00 0.00 O 0 +HETATM 7768 H1 HOH A2482 42.635 46.394 9.114 1.00 0.00 H 0 +HETATM 7769 H2 HOH A2482 43.751 46.174 10.105 1.00 0.00 H 0 +HETATM 7770 O HOH A2483 42.425 -0.179 36.799 1.00 0.00 O 0 +HETATM 7771 H1 HOH A2483 43.356 0.150 36.686 1.00 0.00 H 0 +HETATM 7772 H2 HOH A2483 41.850 0.573 36.772 1.00 0.00 H 0 +HETATM 7773 O HOH A2484 21.670 48.059 25.996 1.00 0.00 O 0 +HETATM 7774 H1 HOH A2484 21.581 47.618 26.821 1.00 0.00 H 0 +HETATM 7775 H2 HOH A2484 22.480 48.607 26.094 1.00 0.00 H 0 +HETATM 7776 O HOH A2485 21.928 9.452 12.996 1.00 0.00 O 0 +HETATM 7777 H1 HOH A2485 22.569 9.880 13.557 1.00 0.00 H 0 +HETATM 7778 H2 HOH A2485 21.720 8.574 13.343 1.00 0.00 H 0 +HETATM 7779 O HOH A2486 45.754 40.680 18.605 1.00 0.00 O 0 +HETATM 7780 H1 HOH A2486 46.339 41.494 18.584 1.00 0.00 H 0 +HETATM 7781 H2 HOH A2486 45.279 40.756 19.433 1.00 0.00 H 0 +HETATM 7782 O HOH A2487 48.701 45.956 18.093 1.00 0.00 O 0 +HETATM 7783 H1 HOH A2487 49.307 46.378 17.441 1.00 0.00 H 0 +HETATM 7784 H2 HOH A2487 47.806 46.230 17.850 1.00 0.00 H 0 +HETATM 7785 O HOH A2488 4.185 43.577 32.665 1.00 0.00 O 0 +HETATM 7786 H1 HOH A2488 4.191 42.821 33.254 1.00 0.00 H 0 +HETATM 7787 H2 HOH A2488 4.848 43.544 31.997 1.00 0.00 H 0 +HETATM 7788 O HOH A2489 50.285 51.946 24.103 1.00 0.00 O 0 +HETATM 7789 H1 HOH A2489 51.128 51.455 23.996 1.00 0.00 H 0 +HETATM 7790 H2 HOH A2489 49.717 51.880 23.314 1.00 0.00 H 0 +HETATM 7791 O HOH A2490 45.828 43.819 7.599 1.00 0.00 O 0 +HETATM 7792 H1 HOH A2490 46.581 44.073 7.080 1.00 0.00 H 0 +HETATM 7793 H2 HOH A2490 45.093 43.984 7.020 1.00 0.00 H 0 +HETATM 7794 O HOH A2491 16.603 44.828 49.050 1.00 0.00 O 0 +HETATM 7795 H1 HOH A2491 16.942 45.671 49.474 1.00 0.00 H 0 +HETATM 7796 H2 HOH A2491 17.181 44.411 48.383 1.00 0.00 H 0 +HETATM 7797 O HOH A2492 40.744 28.435 8.880 1.00 0.00 O 0 +HETATM 7798 H1 HOH A2492 41.709 28.481 8.720 1.00 0.00 H 0 +HETATM 7799 H2 HOH A2492 40.542 28.864 9.728 1.00 0.00 H 0 +HETATM 7800 O HOH A2493 7.588 47.606 42.376 1.00 0.00 O 0 +HETATM 7801 H1 HOH A2493 7.427 46.978 43.109 1.00 0.00 H 0 +HETATM 7802 H2 HOH A2493 8.342 47.278 41.893 1.00 0.00 H 0 +HETATM 7803 O HOH A2494 38.884 21.386 1.459 1.00 0.00 O 0 +HETATM 7804 H1 HOH A2494 38.350 20.653 1.117 1.00 0.00 H 0 +HETATM 7805 H2 HOH A2494 38.486 22.213 1.301 1.00 0.00 H 0 +HETATM 7806 O HOH A2495 44.585 48.113 33.373 1.00 0.00 O 0 +HETATM 7807 H1 HOH A2495 44.829 48.336 34.292 1.00 0.00 H 0 +HETATM 7808 H2 HOH A2495 45.369 47.710 32.954 1.00 0.00 H 0 +HETATM 7809 O HOH A2496 22.027 3.076 50.738 1.00 0.00 O 0 +HETATM 7810 H1 HOH A2496 22.100 3.589 51.529 1.00 0.00 H 0 +HETATM 7811 H2 HOH A2496 21.076 2.917 50.476 1.00 0.00 H 0 +HETATM 7812 O HOH A2497 49.970 47.939 3.285 1.00 0.00 O 0 +HETATM 7813 H1 HOH A2497 49.275 48.555 2.995 1.00 0.00 H 0 +HETATM 7814 H2 HOH A2497 50.556 47.856 2.513 1.00 0.00 H 0 +HETATM 7815 O HOH A2498 43.241 22.968 10.758 1.00 0.00 O 0 +HETATM 7816 H1 HOH A2498 42.473 23.271 11.270 1.00 0.00 H 0 +HETATM 7817 H2 HOH A2498 43.446 23.784 10.227 1.00 0.00 H 0 +HETATM 7818 O HOH A2499 4.944 19.819 7.038 1.00 0.00 O 0 +HETATM 7819 H1 HOH A2499 4.485 19.551 7.845 1.00 0.00 H 0 +HETATM 7820 H2 HOH A2499 4.368 19.640 6.298 1.00 0.00 H 0 +HETATM 7821 O HOH A2500 42.662 17.145 19.110 1.00 0.00 O 0 +HETATM 7822 H1 HOH A2500 43.434 16.548 19.018 1.00 0.00 H 0 +HETATM 7823 H2 HOH A2500 42.929 17.941 19.532 1.00 0.00 H 0 +HETATM 7824 O HOH A2501 48.816 22.912 0.475 1.00 0.00 O 0 +HETATM 7825 H1 HOH A2501 48.657 22.044 0.840 1.00 0.00 H 0 +HETATM 7826 H2 HOH A2501 49.084 23.473 1.204 1.00 0.00 H 0 +HETATM 7827 O HOH A2502 38.096 5.429 11.358 1.00 0.00 O 0 +HETATM 7828 H1 HOH A2502 39.027 5.336 11.111 1.00 0.00 H 0 +HETATM 7829 H2 HOH A2502 37.953 6.091 12.026 1.00 0.00 H 0 +HETATM 7830 O HOH A2503 28.898 25.037 18.252 1.00 0.00 O 0 +HETATM 7831 H1 HOH A2503 28.306 25.736 18.454 1.00 0.00 H 0 +HETATM 7832 H2 HOH A2503 28.459 24.159 18.129 1.00 0.00 H 0 +HETATM 7833 O HOH A2504 3.202 51.097 47.530 1.00 0.00 O 0 +HETATM 7834 H1 HOH A2504 3.297 52.001 47.376 1.00 0.00 H 0 +HETATM 7835 H2 HOH A2504 2.623 50.785 46.866 1.00 0.00 H 0 +HETATM 7836 O HOH A2505 38.315 7.580 13.515 1.00 0.00 O 0 +HETATM 7837 H1 HOH A2505 39.006 7.153 14.130 1.00 0.00 H 0 +HETATM 7838 H2 HOH A2505 37.949 8.224 14.093 1.00 0.00 H 0 +HETATM 7839 O HOH A2506 47.803 15.126 18.216 1.00 0.00 O 0 +HETATM 7840 H1 HOH A2506 48.557 15.721 18.256 1.00 0.00 H 0 +HETATM 7841 H2 HOH A2506 48.177 14.442 17.575 1.00 0.00 H 0 +HETATM 7842 O HOH A2507 16.881 42.302 36.192 1.00 0.00 O 0 +HETATM 7843 H1 HOH A2507 17.520 42.391 36.882 1.00 0.00 H 0 +HETATM 7844 H2 HOH A2507 16.453 41.408 36.177 1.00 0.00 H 0 +HETATM 7845 O HOH A2508 34.305 3.849 44.681 1.00 0.00 O 0 +HETATM 7846 H1 HOH A2508 35.026 3.235 44.816 1.00 0.00 H 0 +HETATM 7847 H2 HOH A2508 33.567 3.440 45.235 1.00 0.00 H 0 +HETATM 7848 O HOH A2509 38.967 27.368 49.617 1.00 0.00 O 0 +HETATM 7849 H1 HOH A2509 39.156 27.464 50.547 1.00 0.00 H 0 +HETATM 7850 H2 HOH A2509 37.992 27.134 49.554 1.00 0.00 H 0 +HETATM 7851 O HOH A2510 7.907 10.249 13.108 1.00 0.00 O 0 +HETATM 7852 H1 HOH A2510 8.546 10.507 13.854 1.00 0.00 H 0 +HETATM 7853 H2 HOH A2510 8.218 9.451 12.627 1.00 0.00 H 0 +HETATM 7854 O HOH A2511 18.411 10.861 6.207 1.00 0.00 O 0 +HETATM 7855 H1 HOH A2511 18.674 10.662 5.330 1.00 0.00 H 0 +HETATM 7856 H2 HOH A2511 19.086 11.456 6.591 1.00 0.00 H 0 +HETATM 7857 O HOH A2512 13.408 51.231 27.115 1.00 0.00 O 0 +HETATM 7858 H1 HOH A2512 12.832 51.508 26.362 1.00 0.00 H 0 +HETATM 7859 H2 HOH A2512 14.212 50.833 26.756 1.00 0.00 H 0 +HETATM 7860 O HOH A2513 49.852 43.001 6.632 1.00 0.00 O 0 +HETATM 7861 H1 HOH A2513 49.301 42.290 6.343 1.00 0.00 H 0 +HETATM 7862 H2 HOH A2513 49.233 43.772 6.769 1.00 0.00 H 0 +HETATM 7863 O HOH A2514 13.858 51.616 14.387 1.00 0.00 O 0 +HETATM 7864 H1 HOH A2514 13.049 52.050 14.707 1.00 0.00 H 0 +HETATM 7865 H2 HOH A2514 13.627 51.512 13.449 1.00 0.00 H 0 +HETATM 7866 O HOH A2515 40.352 7.858 26.753 1.00 0.00 O 0 +HETATM 7867 H1 HOH A2515 39.972 7.331 26.035 1.00 0.00 H 0 +HETATM 7868 H2 HOH A2515 39.598 8.157 27.338 1.00 0.00 H 0 +HETATM 7869 O HOH A2516 45.532 13.654 27.470 1.00 0.00 O 0 +HETATM 7870 H1 HOH A2516 45.938 14.004 28.285 1.00 0.00 H 0 +HETATM 7871 H2 HOH A2516 45.830 12.744 27.469 1.00 0.00 H 0 +HETATM 7872 O HOH A2517 39.113 18.558 9.687 1.00 0.00 O 0 +HETATM 7873 H1 HOH A2517 39.503 18.743 8.845 1.00 0.00 H 0 +HETATM 7874 H2 HOH A2517 39.385 19.329 10.171 1.00 0.00 H 0 +HETATM 7875 O HOH A2518 18.985 18.943 34.305 1.00 0.00 O 0 +HETATM 7876 H1 HOH A2518 19.039 19.044 33.332 1.00 0.00 H 0 +HETATM 7877 H2 HOH A2518 18.340 19.483 34.684 1.00 0.00 H 0 +HETATM 7878 O HOH A2519 6.207 43.597 2.380 1.00 0.00 O 0 +HETATM 7879 H1 HOH A2519 5.931 42.721 2.599 1.00 0.00 H 0 +HETATM 7880 H2 HOH A2519 5.701 43.746 1.593 1.00 0.00 H 0 +HETATM 7881 O HOH A2520 38.663 47.291 0.273 1.00 0.00 O 0 +HETATM 7882 H1 HOH A2520 38.119 46.726 0.788 1.00 0.00 H 0 +HETATM 7883 H2 HOH A2520 38.938 48.028 0.781 1.00 0.00 H 0 +HETATM 7884 O HOH A2521 50.018 12.414 28.901 1.00 0.00 O 0 +HETATM 7885 H1 HOH A2521 49.838 12.308 27.937 1.00 0.00 H 0 +HETATM 7886 H2 HOH A2521 50.681 11.781 29.169 1.00 0.00 H 0 +HETATM 7887 O HOH A2522 16.933 1.913 12.773 1.00 0.00 O 0 +HETATM 7888 H1 HOH A2522 17.362 1.529 12.019 1.00 0.00 H 0 +HETATM 7889 H2 HOH A2522 16.064 2.114 12.458 1.00 0.00 H 0 +HETATM 7890 O HOH A2523 25.194 21.481 46.588 1.00 0.00 O 0 +HETATM 7891 H1 HOH A2523 25.566 22.399 46.337 1.00 0.00 H 0 +HETATM 7892 H2 HOH A2523 24.904 21.134 45.748 1.00 0.00 H 0 +HETATM 7893 O HOH A2524 24.271 44.387 22.002 1.00 0.00 O 0 +HETATM 7894 H1 HOH A2524 24.241 45.030 22.789 1.00 0.00 H 0 +HETATM 7895 H2 HOH A2524 23.621 43.684 22.354 1.00 0.00 H 0 +HETATM 7896 O HOH A2525 28.940 43.857 22.688 1.00 0.00 O 0 +HETATM 7897 H1 HOH A2525 28.347 43.475 22.074 1.00 0.00 H 0 +HETATM 7898 H2 HOH A2525 28.495 44.626 23.081 1.00 0.00 H 0 +HETATM 7899 O HOH A2526 11.654 1.090 9.836 1.00 0.00 O 0 +HETATM 7900 H1 HOH A2526 12.237 1.071 10.608 1.00 0.00 H 0 +HETATM 7901 H2 HOH A2526 10.770 0.707 10.146 1.00 0.00 H 0 +HETATM 7902 O HOH A2527 0.269 29.540 13.654 1.00 0.00 O 0 +HETATM 7903 H1 HOH A2527 -0.558 29.263 14.117 1.00 0.00 H 0 +HETATM 7904 H2 HOH A2527 0.890 28.783 13.674 1.00 0.00 H 0 +HETATM 7905 O HOH A2528 13.989 18.857 15.760 1.00 0.00 O 0 +HETATM 7906 H1 HOH A2528 13.953 19.705 15.206 1.00 0.00 H 0 +HETATM 7907 H2 HOH A2528 13.860 19.198 16.631 1.00 0.00 H 0 +HETATM 7908 O HOH A2529 14.047 27.358 44.292 1.00 0.00 O 0 +HETATM 7909 H1 HOH A2529 14.773 27.629 43.744 1.00 0.00 H 0 +HETATM 7910 H2 HOH A2529 14.289 27.436 45.252 1.00 0.00 H 0 +HETATM 7911 O HOH A2530 22.058 51.794 29.707 1.00 0.00 O 0 +HETATM 7912 H1 HOH A2530 22.985 51.763 29.543 1.00 0.00 H 0 +HETATM 7913 H2 HOH A2530 21.587 51.902 28.871 1.00 0.00 H 0 +HETATM 7914 O HOH A2531 30.014 38.988 52.096 1.00 0.00 O 0 +HETATM 7915 H1 HOH A2531 31.010 39.067 52.207 1.00 0.00 H 0 +HETATM 7916 H2 HOH A2531 29.536 39.448 52.809 1.00 0.00 H 0 +HETATM 7917 O HOH A2532 42.121 26.296 16.004 1.00 0.00 O 0 +HETATM 7918 H1 HOH A2532 42.671 26.907 15.440 1.00 0.00 H 0 +HETATM 7919 H2 HOH A2532 42.227 26.621 16.968 1.00 0.00 H 0 +HETATM 7920 O HOH A2533 42.537 4.709 16.437 1.00 0.00 O 0 +HETATM 7921 H1 HOH A2533 42.061 3.948 16.763 1.00 0.00 H 0 +HETATM 7922 H2 HOH A2533 42.700 4.550 15.527 1.00 0.00 H 0 +HETATM 7923 O HOH A2534 26.692 1.595 25.689 1.00 0.00 O 0 +HETATM 7924 H1 HOH A2534 26.089 2.126 25.137 1.00 0.00 H 0 +HETATM 7925 H2 HOH A2534 27.013 0.830 25.070 1.00 0.00 H 0 +HETATM 7926 O HOH A2535 31.687 37.839 16.202 1.00 0.00 O 0 +HETATM 7927 H1 HOH A2535 31.302 38.732 16.332 1.00 0.00 H 0 +HETATM 7928 H2 HOH A2535 31.932 37.330 17.036 1.00 0.00 H 0 +HETATM 7929 O HOH A2536 16.374 36.049 30.575 1.00 0.00 O 0 +HETATM 7930 H1 HOH A2536 16.245 35.318 31.259 1.00 0.00 H 0 +HETATM 7931 H2 HOH A2536 17.233 36.377 30.675 1.00 0.00 H 0 +HETATM 7932 O HOH A2537 0.451 37.520 8.770 1.00 0.00 O 0 +HETATM 7933 H1 HOH A2537 0.681 36.963 9.543 1.00 0.00 H 0 +HETATM 7934 H2 HOH A2537 -0.129 38.242 9.152 1.00 0.00 H 0 +HETATM 7935 O HOH A2538 3.678 6.202 7.013 1.00 0.00 O 0 +HETATM 7936 H1 HOH A2538 3.040 5.506 6.788 1.00 0.00 H 0 +HETATM 7937 H2 HOH A2538 3.142 6.921 7.445 1.00 0.00 H 0 +HETATM 7938 O HOH A2539 32.233 47.138 12.819 1.00 0.00 O 0 +HETATM 7939 H1 HOH A2539 32.890 47.073 12.073 1.00 0.00 H 0 +HETATM 7940 H2 HOH A2539 31.659 47.887 12.533 1.00 0.00 H 0 +HETATM 7941 O HOH A2540 22.403 7.245 51.727 1.00 0.00 O 0 +HETATM 7942 H1 HOH A2540 22.294 7.635 50.855 1.00 0.00 H 0 +HETATM 7943 H2 HOH A2540 22.126 7.936 52.358 1.00 0.00 H 0 +HETATM 7944 O HOH A2541 29.773 37.531 43.064 1.00 0.00 O 0 +HETATM 7945 H1 HOH A2541 30.086 38.343 42.586 1.00 0.00 H 0 +HETATM 7946 H2 HOH A2541 30.526 37.137 43.428 1.00 0.00 H 0 +HETATM 7947 O HOH A2542 21.679 15.567 23.334 1.00 0.00 O 0 +HETATM 7948 H1 HOH A2542 20.832 15.664 22.908 1.00 0.00 H 0 +HETATM 7949 H2 HOH A2542 21.602 14.998 24.091 1.00 0.00 H 0 +HETATM 7950 O HOH A2543 51.710 36.035 37.195 1.00 0.00 O 0 +HETATM 7951 H1 HOH A2543 52.099 36.325 37.995 1.00 0.00 H 0 +HETATM 7952 H2 HOH A2543 50.732 36.174 37.333 1.00 0.00 H 0 +HETATM 7953 O HOH A2544 49.855 16.913 29.083 1.00 0.00 O 0 +HETATM 7954 H1 HOH A2544 49.227 16.606 29.826 1.00 0.00 H 0 +HETATM 7955 H2 HOH A2544 49.630 16.476 28.254 1.00 0.00 H 0 +HETATM 7956 O HOH A2545 38.216 45.644 37.502 1.00 0.00 O 0 +HETATM 7957 H1 HOH A2545 37.916 45.887 38.397 1.00 0.00 H 0 +HETATM 7958 H2 HOH A2545 38.551 44.730 37.502 1.00 0.00 H 0 +HETATM 7959 O HOH A2546 30.713 47.558 1.801 1.00 0.00 O 0 +HETATM 7960 H1 HOH A2546 29.764 47.616 1.686 1.00 0.00 H 0 +HETATM 7961 H2 HOH A2546 30.805 46.870 2.407 1.00 0.00 H 0 +HETATM 7962 O HOH A2547 47.555 11.660 43.503 1.00 0.00 O 0 +HETATM 7963 H1 HOH A2547 47.040 11.056 42.918 1.00 0.00 H 0 +HETATM 7964 H2 HOH A2547 48.510 11.526 43.254 1.00 0.00 H 0 +HETATM 7965 O HOH A2548 36.627 39.214 19.529 1.00 0.00 O 0 +HETATM 7966 H1 HOH A2548 36.793 39.121 20.516 1.00 0.00 H 0 +HETATM 7967 H2 HOH A2548 37.281 38.589 19.106 1.00 0.00 H 0 +HETATM 7968 O HOH A2549 49.890 41.390 47.482 1.00 0.00 O 0 +HETATM 7969 H1 HOH A2549 49.667 41.407 46.458 1.00 0.00 H 0 +HETATM 7970 H2 HOH A2549 50.822 41.476 47.486 1.00 0.00 H 0 +HETATM 7971 O HOH A2550 13.813 22.493 53.865 1.00 0.00 O 0 +HETATM 7972 H1 HOH A2550 14.332 22.673 53.038 1.00 0.00 H 0 +HETATM 7973 H2 HOH A2550 12.887 22.656 53.617 1.00 0.00 H 0 +HETATM 7974 O HOH A2551 4.088 26.693 21.142 1.00 0.00 O 0 +HETATM 7975 H1 HOH A2551 3.149 26.653 21.236 1.00 0.00 H 0 +HETATM 7976 H2 HOH A2551 4.225 27.562 20.618 1.00 0.00 H 0 +HETATM 7977 O HOH A2552 18.437 38.958 50.366 1.00 0.00 O 0 +HETATM 7978 H1 HOH A2552 17.508 38.820 50.711 1.00 0.00 H 0 +HETATM 7979 H2 HOH A2552 18.845 38.184 50.041 1.00 0.00 H 0 +HETATM 7980 O HOH A2553 47.994 39.220 18.966 1.00 0.00 O 0 +HETATM 7981 H1 HOH A2553 48.242 39.006 18.103 1.00 0.00 H 0 +HETATM 7982 H2 HOH A2553 47.137 39.621 18.886 1.00 0.00 H 0 +HETATM 7983 O HOH A2554 28.382 51.611 42.937 1.00 0.00 O 0 +HETATM 7984 H1 HOH A2554 27.436 51.292 42.827 1.00 0.00 H 0 +HETATM 7985 H2 HOH A2554 28.878 51.451 42.157 1.00 0.00 H 0 +HETATM 7986 O HOH A2555 24.627 48.978 47.177 1.00 0.00 O 0 +HETATM 7987 H1 HOH A2555 25.472 49.102 46.731 1.00 0.00 H 0 +HETATM 7988 H2 HOH A2555 24.398 49.860 47.441 1.00 0.00 H 0 +HETATM 7989 O HOH A2556 18.752 5.632 41.537 1.00 0.00 O 0 +HETATM 7990 H1 HOH A2556 19.108 6.301 42.149 1.00 0.00 H 0 +HETATM 7991 H2 HOH A2556 19.303 5.666 40.769 1.00 0.00 H 0 +HETATM 7992 O HOH A2557 5.871 10.982 52.314 1.00 0.00 O 0 +HETATM 7993 H1 HOH A2557 4.981 11.256 51.952 1.00 0.00 H 0 +HETATM 7994 H2 HOH A2557 6.618 11.283 51.749 1.00 0.00 H 0 +HETATM 7995 O HOH A2558 3.474 32.761 51.307 1.00 0.00 O 0 +HETATM 7996 H1 HOH A2558 4.061 32.029 51.322 1.00 0.00 H 0 +HETATM 7997 H2 HOH A2558 2.701 32.446 50.884 1.00 0.00 H 0 +HETATM 7998 O HOH A2559 12.249 17.386 30.899 1.00 0.00 O 0 +HETATM 7999 H1 HOH A2559 12.360 18.370 31.111 1.00 0.00 H 0 +HETATM 8000 H2 HOH A2559 13.176 17.094 31.223 1.00 0.00 H 0 +HETATM 8001 O HOH A2560 40.476 31.987 49.129 1.00 0.00 O 0 +HETATM 8002 H1 HOH A2560 39.806 31.995 49.816 1.00 0.00 H 0 +HETATM 8003 H2 HOH A2560 40.498 31.038 48.911 1.00 0.00 H 0 +HETATM 8004 O HOH A2561 18.128 30.174 52.240 1.00 0.00 O 0 +HETATM 8005 H1 HOH A2561 18.621 30.789 51.659 1.00 0.00 H 0 +HETATM 8006 H2 HOH A2561 17.336 29.966 51.736 1.00 0.00 H 0 +HETATM 8007 O HOH A2562 47.093 40.209 47.428 1.00 0.00 O 0 +HETATM 8008 H1 HOH A2562 46.587 39.785 46.752 1.00 0.00 H 0 +HETATM 8009 H2 HOH A2562 46.804 41.144 47.480 1.00 0.00 H 0 +HETATM 8010 O HOH A2563 12.973 26.236 24.715 1.00 0.00 O 0 +HETATM 8011 H1 HOH A2563 12.558 25.731 23.975 1.00 0.00 H 0 +HETATM 8012 H2 HOH A2563 12.258 26.525 25.276 1.00 0.00 H 0 +HETATM 8013 O HOH A2564 11.164 50.819 39.796 1.00 0.00 O 0 +HETATM 8014 H1 HOH A2564 11.085 50.885 40.730 1.00 0.00 H 0 +HETATM 8015 H2 HOH A2564 10.331 50.429 39.543 1.00 0.00 H 0 +HETATM 8016 O HOH A2565 48.459 3.727 33.118 1.00 0.00 O 0 +HETATM 8017 H1 HOH A2565 49.309 4.161 33.025 1.00 0.00 H 0 +HETATM 8018 H2 HOH A2565 48.674 2.955 33.702 1.00 0.00 H 0 +HETATM 8019 O HOH A2566 33.606 37.135 39.199 1.00 0.00 O 0 +HETATM 8020 H1 HOH A2566 33.707 36.909 38.233 1.00 0.00 H 0 +HETATM 8021 H2 HOH A2566 34.252 36.590 39.689 1.00 0.00 H 0 +HETATM 8022 O HOH A2567 37.850 46.555 15.452 1.00 0.00 O 0 +HETATM 8023 H1 HOH A2567 37.383 46.226 14.711 1.00 0.00 H 0 +HETATM 8024 H2 HOH A2567 38.647 47.037 15.071 1.00 0.00 H 0 +HETATM 8025 O HOH A2568 16.443 12.267 49.252 1.00 0.00 O 0 +HETATM 8026 H1 HOH A2568 16.961 12.442 50.092 1.00 0.00 H 0 +HETATM 8027 H2 HOH A2568 15.998 11.497 49.501 1.00 0.00 H 0 +HETATM 8028 O HOH A2569 27.557 41.602 44.504 1.00 0.00 O 0 +HETATM 8029 H1 HOH A2569 27.393 40.952 45.165 1.00 0.00 H 0 +HETATM 8030 H2 HOH A2569 28.290 41.188 43.941 1.00 0.00 H 0 +HETATM 8031 O HOH A2570 51.714 46.473 5.029 1.00 0.00 O 0 +HETATM 8032 H1 HOH A2570 51.062 46.693 4.378 1.00 0.00 H 0 +HETATM 8033 H2 HOH A2570 52.533 46.845 4.736 1.00 0.00 H 0 +HETATM 8034 O HOH A2571 2.320 7.753 10.540 1.00 0.00 O 0 +HETATM 8035 H1 HOH A2571 1.875 6.904 10.398 1.00 0.00 H 0 +HETATM 8036 H2 HOH A2571 2.769 7.831 9.733 1.00 0.00 H 0 +HETATM 8037 O HOH A2572 32.535 44.485 1.836 1.00 0.00 O 0 +HETATM 8038 H1 HOH A2572 33.029 45.207 2.234 1.00 0.00 H 0 +HETATM 8039 H2 HOH A2572 33.004 44.229 1.007 1.00 0.00 H 0 +HETATM 8040 O HOH A2573 34.116 42.625 46.530 1.00 0.00 O 0 +HETATM 8041 H1 HOH A2573 34.302 43.542 46.616 1.00 0.00 H 0 +HETATM 8042 H2 HOH A2573 33.173 42.704 46.261 1.00 0.00 H 0 +HETATM 8043 O HOH A2574 45.308 35.170 31.254 1.00 0.00 O 0 +HETATM 8044 H1 HOH A2574 45.485 36.135 31.600 1.00 0.00 H 0 +HETATM 8045 H2 HOH A2574 45.213 35.277 30.315 1.00 0.00 H 0 +HETATM 8046 O HOH A2575 28.006 35.392 16.499 1.00 0.00 O 0 +HETATM 8047 H1 HOH A2575 28.798 35.734 16.079 1.00 0.00 H 0 +HETATM 8048 H2 HOH A2575 28.219 34.424 16.644 1.00 0.00 H 0 +HETATM 8049 O HOH A2576 36.732 36.970 6.097 1.00 0.00 O 0 +HETATM 8050 H1 HOH A2576 36.533 36.091 5.731 1.00 0.00 H 0 +HETATM 8051 H2 HOH A2576 37.090 36.684 6.912 1.00 0.00 H 0 +HETATM 8052 O HOH A2577 16.265 34.448 36.294 1.00 0.00 O 0 +HETATM 8053 H1 HOH A2577 16.574 33.558 36.392 1.00 0.00 H 0 +HETATM 8054 H2 HOH A2577 16.299 34.729 35.355 1.00 0.00 H 0 +HETATM 8055 O HOH A2578 14.245 21.407 14.438 1.00 0.00 O 0 +HETATM 8056 H1 HOH A2578 13.325 21.471 13.962 1.00 0.00 H 0 +HETATM 8057 H2 HOH A2578 14.377 22.263 14.927 1.00 0.00 H 0 +HETATM 8058 O HOH A2579 11.616 34.061 32.897 1.00 0.00 O 0 +HETATM 8059 H1 HOH A2579 11.453 34.999 33.229 1.00 0.00 H 0 +HETATM 8060 H2 HOH A2579 11.882 34.071 32.011 1.00 0.00 H 0 +HETATM 8061 O HOH A2580 40.370 4.168 29.489 1.00 0.00 O 0 +HETATM 8062 H1 HOH A2580 40.874 4.056 30.265 1.00 0.00 H 0 +HETATM 8063 H2 HOH A2580 39.898 4.964 29.636 1.00 0.00 H 0 +HETATM 8064 O HOH A2581 46.939 32.271 50.407 1.00 0.00 O 0 +HETATM 8065 H1 HOH A2581 46.763 31.472 49.852 1.00 0.00 H 0 +HETATM 8066 H2 HOH A2581 47.430 32.954 49.897 1.00 0.00 H 0 +HETATM 8067 O HOH A2582 13.218 51.566 3.115 1.00 0.00 O 0 +HETATM 8068 H1 HOH A2582 13.849 52.062 2.546 1.00 0.00 H 0 +HETATM 8069 H2 HOH A2582 13.782 50.830 3.334 1.00 0.00 H 0 +HETATM 8070 O HOH A2583 32.258 47.992 42.902 1.00 0.00 O 0 +HETATM 8071 H1 HOH A2583 32.898 47.275 42.847 1.00 0.00 H 0 +HETATM 8072 H2 HOH A2583 31.569 47.672 42.267 1.00 0.00 H 0 +HETATM 8073 O HOH A2584 3.216 6.373 45.263 1.00 0.00 O 0 +HETATM 8074 H1 HOH A2584 3.824 6.699 44.617 1.00 0.00 H 0 +HETATM 8075 H2 HOH A2584 3.523 5.438 45.437 1.00 0.00 H 0 +HETATM 8076 O HOH A2585 5.725 33.837 19.952 1.00 0.00 O 0 +HETATM 8077 H1 HOH A2585 6.007 34.043 20.856 1.00 0.00 H 0 +HETATM 8078 H2 HOH A2585 6.471 33.442 19.470 1.00 0.00 H 0 +HETATM 8079 O HOH A2586 39.667 1.986 31.413 1.00 0.00 O 0 +HETATM 8080 H1 HOH A2586 39.714 2.639 32.162 1.00 0.00 H 0 +HETATM 8081 H2 HOH A2586 39.126 2.288 30.713 1.00 0.00 H 0 +HETATM 8082 O HOH A2587 44.528 30.544 28.907 1.00 0.00 O 0 +HETATM 8083 H1 HOH A2587 44.288 30.018 28.007 1.00 0.00 H 0 +HETATM 8084 H2 HOH A2587 44.957 29.851 29.464 1.00 0.00 H 0 +HETATM 8085 O HOH A2588 45.272 10.753 47.212 1.00 0.00 O 0 +HETATM 8086 H1 HOH A2588 45.116 10.395 46.318 1.00 0.00 H 0 +HETATM 8087 H2 HOH A2588 45.881 11.441 47.108 1.00 0.00 H 0 +HETATM 8088 O HOH A2589 29.390 27.553 10.517 1.00 0.00 O 0 +HETATM 8089 H1 HOH A2589 29.699 26.934 9.851 1.00 0.00 H 0 +HETATM 8090 H2 HOH A2589 29.364 28.387 10.096 1.00 0.00 H 0 +HETATM 8091 O HOH A2590 18.610 2.500 24.080 1.00 0.00 O 0 +HETATM 8092 H1 HOH A2590 17.780 2.814 23.758 1.00 0.00 H 0 +HETATM 8093 H2 HOH A2590 18.287 1.637 24.376 1.00 0.00 H 0 +HETATM 8094 O HOH A2591 46.254 18.977 14.034 1.00 0.00 O 0 +HETATM 8095 H1 HOH A2591 46.915 19.655 14.131 1.00 0.00 H 0 +HETATM 8096 H2 HOH A2591 46.707 18.438 13.383 1.00 0.00 H 0 +HETATM 8097 O HOH A2592 31.481 3.954 20.348 1.00 0.00 O 0 +HETATM 8098 H1 HOH A2592 31.938 3.175 20.609 1.00 0.00 H 0 +HETATM 8099 H2 HOH A2592 31.244 3.873 19.434 1.00 0.00 H 0 +HETATM 8100 O HOH A2593 8.356 48.634 28.676 1.00 0.00 O 0 +HETATM 8101 H1 HOH A2593 8.674 49.591 28.574 1.00 0.00 H 0 +HETATM 8102 H2 HOH A2593 8.887 48.270 29.397 1.00 0.00 H 0 +HETATM 8103 O HOH A2594 24.305 25.098 5.388 1.00 0.00 O 0 +HETATM 8104 H1 HOH A2594 23.795 24.801 6.115 1.00 0.00 H 0 +HETATM 8105 H2 HOH A2594 25.084 25.509 5.752 1.00 0.00 H 0 +HETATM 8106 O HOH A2595 14.026 39.650 44.764 1.00 0.00 O 0 +HETATM 8107 H1 HOH A2595 13.646 39.018 45.377 1.00 0.00 H 0 +HETATM 8108 H2 HOH A2595 14.931 39.380 44.704 1.00 0.00 H 0 +HETATM 8109 O HOH A2596 29.390 36.984 9.879 1.00 0.00 O 0 +HETATM 8110 H1 HOH A2596 28.805 37.766 9.870 1.00 0.00 H 0 +HETATM 8111 H2 HOH A2596 29.801 36.952 10.750 1.00 0.00 H 0 +HETATM 8112 O HOH A2597 28.494 15.126 20.769 1.00 0.00 O 0 +HETATM 8113 H1 HOH A2597 29.021 14.779 20.037 1.00 0.00 H 0 +HETATM 8114 H2 HOH A2597 27.960 15.849 20.405 1.00 0.00 H 0 +HETATM 8115 O HOH A2598 4.838 45.975 33.980 1.00 0.00 O 0 +HETATM 8116 H1 HOH A2598 4.138 46.621 34.136 1.00 0.00 H 0 +HETATM 8117 H2 HOH A2598 4.341 45.231 33.672 1.00 0.00 H 0 +HETATM 8118 O HOH A2599 5.487 44.683 16.476 1.00 0.00 O 0 +HETATM 8119 H1 HOH A2599 5.850 45.066 15.633 1.00 0.00 H 0 +HETATM 8120 H2 HOH A2599 4.896 43.954 16.222 1.00 0.00 H 0 +HETATM 8121 O HOH A2600 19.003 35.306 6.225 1.00 0.00 O 0 +HETATM 8122 H1 HOH A2600 19.754 35.931 6.495 1.00 0.00 H 0 +HETATM 8123 H2 HOH A2600 18.210 35.694 6.656 1.00 0.00 H 0 +HETATM 8124 O HOH A2601 10.134 18.555 27.186 1.00 0.00 O 0 +HETATM 8125 H1 HOH A2601 9.823 19.443 27.424 1.00 0.00 H 0 +HETATM 8126 H2 HOH A2601 10.121 18.112 28.008 1.00 0.00 H 0 +HETATM 8127 O HOH A2602 25.331 36.260 2.350 1.00 0.00 O 0 +HETATM 8128 H1 HOH A2602 24.434 36.658 2.384 1.00 0.00 H 0 +HETATM 8129 H2 HOH A2602 25.637 36.541 1.437 1.00 0.00 H 0 +HETATM 8130 O HOH A2603 39.909 11.155 18.323 1.00 0.00 O 0 +HETATM 8131 H1 HOH A2603 40.796 10.737 18.347 1.00 0.00 H 0 +HETATM 8132 H2 HOH A2603 39.498 10.563 18.905 1.00 0.00 H 0 +HETATM 8133 O HOH A2604 9.909 39.466 43.404 1.00 0.00 O 0 +HETATM 8134 H1 HOH A2604 9.787 39.601 44.380 1.00 0.00 H 0 +HETATM 8135 H2 HOH A2604 10.867 39.247 43.182 1.00 0.00 H 0 +HETATM 8136 O HOH A2605 49.809 19.396 10.238 1.00 0.00 O 0 +HETATM 8137 H1 HOH A2605 50.402 19.242 10.959 1.00 0.00 H 0 +HETATM 8138 H2 HOH A2605 50.196 20.180 9.845 1.00 0.00 H 0 +HETATM 8139 O HOH A2606 20.663 49.800 5.851 1.00 0.00 O 0 +HETATM 8140 H1 HOH A2606 20.426 49.409 6.675 1.00 0.00 H 0 +HETATM 8141 H2 HOH A2606 21.576 49.625 5.747 1.00 0.00 H 0 +HETATM 8142 O HOH A2607 21.553 14.886 5.788 1.00 0.00 O 0 +HETATM 8143 H1 HOH A2607 22.121 15.626 6.147 1.00 0.00 H 0 +HETATM 8144 H2 HOH A2607 20.651 14.943 6.185 1.00 0.00 H 0 +HETATM 8145 O HOH A2608 17.073 42.156 19.447 1.00 0.00 O 0 +HETATM 8146 H1 HOH A2608 17.849 42.375 20.057 1.00 0.00 H 0 +HETATM 8147 H2 HOH A2608 16.602 41.414 19.965 1.00 0.00 H 0 +HETATM 8148 O HOH A2609 9.957 50.891 28.955 1.00 0.00 O 0 +HETATM 8149 H1 HOH A2609 10.079 51.600 28.259 1.00 0.00 H 0 +HETATM 8150 H2 HOH A2609 10.790 50.462 29.001 1.00 0.00 H 0 +HETATM 8151 O HOH A2610 51.268 13.517 6.931 1.00 0.00 O 0 +HETATM 8152 H1 HOH A2610 51.707 14.335 7.138 1.00 0.00 H 0 +HETATM 8153 H2 HOH A2610 51.862 12.756 7.122 1.00 0.00 H 0 +HETATM 8154 O HOH A2611 31.595 1.326 48.922 1.00 0.00 O 0 +HETATM 8155 H1 HOH A2611 31.221 1.041 49.775 1.00 0.00 H 0 +HETATM 8156 H2 HOH A2611 32.228 0.675 48.568 1.00 0.00 H 0 +HETATM 8157 O HOH A2612 8.900 0.954 11.399 1.00 0.00 O 0 +HETATM 8158 H1 HOH A2612 8.482 0.655 12.224 1.00 0.00 H 0 +HETATM 8159 H2 HOH A2612 8.332 0.880 10.641 1.00 0.00 H 0 +HETATM 8160 O HOH A2613 3.378 31.921 11.243 1.00 0.00 O 0 +HETATM 8161 H1 HOH A2613 2.433 31.879 11.407 1.00 0.00 H 0 +HETATM 8162 H2 HOH A2613 3.813 31.670 12.105 1.00 0.00 H 0 +HETATM 8163 O HOH A2614 16.955 32.976 18.209 1.00 0.00 O 0 +HETATM 8164 H1 HOH A2614 16.818 32.500 19.079 1.00 0.00 H 0 +HETATM 8165 H2 HOH A2614 16.595 32.350 17.484 1.00 0.00 H 0 +HETATM 8166 O HOH A2615 5.308 50.294 37.619 1.00 0.00 O 0 +HETATM 8167 H1 HOH A2615 5.750 50.744 38.312 1.00 0.00 H 0 +HETATM 8168 H2 HOH A2615 5.911 50.270 36.872 1.00 0.00 H 0 +HETATM 8169 O HOH A2616 9.513 44.840 45.553 1.00 0.00 O 0 +HETATM 8170 H1 HOH A2616 8.913 45.511 45.827 1.00 0.00 H 0 +HETATM 8171 H2 HOH A2616 10.380 45.314 45.352 1.00 0.00 H 0 +HETATM 8172 O HOH A2617 23.691 38.277 50.626 1.00 0.00 O 0 +HETATM 8173 H1 HOH A2617 24.133 39.092 50.923 1.00 0.00 H 0 +HETATM 8174 H2 HOH A2617 23.489 38.478 49.697 1.00 0.00 H 0 +HETATM 8175 O HOH A2618 50.586 15.553 -0.069 1.00 0.00 O 0 +HETATM 8176 H1 HOH A2618 50.778 16.393 0.333 1.00 0.00 H 0 +HETATM 8177 H2 HOH A2618 50.543 14.960 0.727 1.00 0.00 H 0 +HETATM 8178 O HOH A2619 26.349 16.356 45.201 1.00 0.00 O 0 +HETATM 8179 H1 HOH A2619 27.060 16.194 44.581 1.00 0.00 H 0 +HETATM 8180 H2 HOH A2619 25.528 16.542 44.702 1.00 0.00 H 0 +HETATM 8181 O HOH A2620 48.015 15.136 51.843 1.00 0.00 O 0 +HETATM 8182 H1 HOH A2620 48.831 15.202 52.358 1.00 0.00 H 0 +HETATM 8183 H2 HOH A2620 47.578 15.832 52.257 1.00 0.00 H 0 +HETATM 8184 O HOH A2621 12.647 18.263 18.146 1.00 0.00 O 0 +HETATM 8185 H1 HOH A2621 11.970 18.092 18.785 1.00 0.00 H 0 +HETATM 8186 H2 HOH A2621 12.803 17.490 17.599 1.00 0.00 H 0 +HETATM 8187 O HOH A2622 32.668 28.597 37.051 1.00 0.00 O 0 +HETATM 8188 H1 HOH A2622 32.194 28.086 37.718 1.00 0.00 H 0 +HETATM 8189 H2 HOH A2622 32.388 28.215 36.210 1.00 0.00 H 0 +HETATM 8190 O HOH A2623 19.273 51.818 34.194 1.00 0.00 O 0 +HETATM 8191 H1 HOH A2623 19.145 52.073 33.262 1.00 0.00 H 0 +HETATM 8192 H2 HOH A2623 19.897 51.129 34.393 1.00 0.00 H 0 +HETATM 8193 O HOH A2624 31.097 14.176 40.705 1.00 0.00 O 0 +HETATM 8194 H1 HOH A2624 30.481 14.434 40.015 1.00 0.00 H 0 +HETATM 8195 H2 HOH A2624 31.683 14.983 40.839 1.00 0.00 H 0 +HETATM 8196 O HOH A2625 46.121 46.409 37.341 1.00 0.00 O 0 +HETATM 8197 H1 HOH A2625 45.939 47.003 36.587 1.00 0.00 H 0 +HETATM 8198 H2 HOH A2625 46.102 46.902 38.167 1.00 0.00 H 0 +HETATM 8199 O HOH A2626 47.472 20.315 43.658 1.00 0.00 O 0 +HETATM 8200 H1 HOH A2626 48.286 20.685 43.929 1.00 0.00 H 0 +HETATM 8201 H2 HOH A2626 47.495 20.416 42.707 1.00 0.00 H 0 +HETATM 8202 O HOH A2627 25.455 9.930 29.439 1.00 0.00 O 0 +HETATM 8203 H1 HOH A2627 25.932 9.223 28.986 1.00 0.00 H 0 +HETATM 8204 H2 HOH A2627 25.274 9.606 30.329 1.00 0.00 H 0 +HETATM 8205 O HOH A2628 14.996 28.332 37.542 1.00 0.00 O 0 +HETATM 8206 H1 HOH A2628 14.158 28.855 37.530 1.00 0.00 H 0 +HETATM 8207 H2 HOH A2628 15.109 28.084 36.605 1.00 0.00 H 0 +HETATM 8208 O HOH A2629 23.592 28.003 36.603 1.00 0.00 O 0 +HETATM 8209 H1 HOH A2629 24.431 28.213 36.117 1.00 0.00 H 0 +HETATM 8210 H2 HOH A2629 23.686 27.064 36.801 1.00 0.00 H 0 +HETATM 8211 O HOH A2630 47.206 41.775 40.629 1.00 0.00 O 0 +HETATM 8212 H1 HOH A2630 48.000 41.328 40.516 1.00 0.00 H 0 +HETATM 8213 H2 HOH A2630 46.667 41.501 39.948 1.00 0.00 H 0 +HETATM 8214 O HOH A2631 32.551 44.352 29.492 1.00 0.00 O 0 +HETATM 8215 H1 HOH A2631 31.795 44.938 29.281 1.00 0.00 H 0 +HETATM 8216 H2 HOH A2631 33.352 44.762 29.150 1.00 0.00 H 0 +HETATM 8217 O HOH A2632 3.859 31.643 1.437 1.00 0.00 O 0 +HETATM 8218 H1 HOH A2632 4.169 31.967 2.283 1.00 0.00 H 0 +HETATM 8219 H2 HOH A2632 4.650 31.202 1.124 1.00 0.00 H 0 +HETATM 8220 O HOH A2633 15.726 44.547 15.719 1.00 0.00 O 0 +HETATM 8221 H1 HOH A2633 14.801 44.657 15.946 1.00 0.00 H 0 +HETATM 8222 H2 HOH A2633 15.957 45.226 15.137 1.00 0.00 H 0 +HETATM 8223 O HOH A2634 29.246 23.025 50.670 1.00 0.00 O 0 +HETATM 8224 H1 HOH A2634 29.227 23.216 49.756 1.00 0.00 H 0 +HETATM 8225 H2 HOH A2634 30.170 22.621 50.786 1.00 0.00 H 0 +HETATM 8226 O HOH A2635 42.553 0.506 1.504 1.00 0.00 O 0 +HETATM 8227 H1 HOH A2635 42.777 0.162 0.637 1.00 0.00 H 0 +HETATM 8228 H2 HOH A2635 43.167 0.309 2.167 1.00 0.00 H 0 +HETATM 8229 O HOH A2636 20.366 49.564 37.354 1.00 0.00 O 0 +HETATM 8230 H1 HOH A2636 20.720 50.420 37.047 1.00 0.00 H 0 +HETATM 8231 H2 HOH A2636 21.057 48.886 37.312 1.00 0.00 H 0 +HETATM 8232 O HOH A2637 11.772 25.473 46.756 1.00 0.00 O 0 +HETATM 8233 H1 HOH A2637 11.694 24.680 47.348 1.00 0.00 H 0 +HETATM 8234 H2 HOH A2637 11.122 25.349 45.988 1.00 0.00 H 0 +HETATM 8235 O HOH A2638 3.220 14.543 41.189 1.00 0.00 O 0 +HETATM 8236 H1 HOH A2638 2.679 14.992 41.876 1.00 0.00 H 0 +HETATM 8237 H2 HOH A2638 4.094 15.000 41.199 1.00 0.00 H 0 +HETATM 8238 O HOH A2639 50.370 36.898 25.274 1.00 0.00 O 0 +HETATM 8239 H1 HOH A2639 50.671 37.750 24.940 1.00 0.00 H 0 +HETATM 8240 H2 HOH A2639 51.171 36.431 25.663 1.00 0.00 H 0 +HETATM 8241 O HOH A2640 20.400 11.762 12.862 1.00 0.00 O 0 +HETATM 8242 H1 HOH A2640 19.933 11.789 12.042 1.00 0.00 H 0 +HETATM 8243 H2 HOH A2640 20.579 10.804 13.060 1.00 0.00 H 0 +HETATM 8244 O HOH A2641 44.513 33.882 46.582 1.00 0.00 O 0 +HETATM 8245 H1 HOH A2641 44.194 34.190 47.499 1.00 0.00 H 0 +HETATM 8246 H2 HOH A2641 44.044 34.405 45.856 1.00 0.00 H 0 +HETATM 8247 O HOH A2642 21.231 19.148 35.941 1.00 0.00 O 0 +HETATM 8248 H1 HOH A2642 20.647 18.983 35.226 1.00 0.00 H 0 +HETATM 8249 H2 HOH A2642 20.928 18.361 36.474 1.00 0.00 H 0 +HETATM 8250 O HOH A2643 7.242 36.845 1.858 1.00 0.00 O 0 +HETATM 8251 H1 HOH A2643 6.757 36.733 2.730 1.00 0.00 H 0 +HETATM 8252 H2 HOH A2643 6.590 36.514 1.108 1.00 0.00 H 0 +HETATM 8253 O HOH A2644 31.019 48.704 27.629 1.00 0.00 O 0 +HETATM 8254 H1 HOH A2644 30.946 47.936 28.293 1.00 0.00 H 0 +HETATM 8255 H2 HOH A2644 31.561 49.375 28.045 1.00 0.00 H 0 +HETATM 8256 O HOH A2645 30.127 6.139 14.790 1.00 0.00 O 0 +HETATM 8257 H1 HOH A2645 29.295 5.747 15.069 1.00 0.00 H 0 +HETATM 8258 H2 HOH A2645 29.889 6.928 14.242 1.00 0.00 H 0 +HETATM 8259 O HOH A2646 2.687 27.979 48.538 1.00 0.00 O 0 +HETATM 8260 H1 HOH A2646 3.013 28.011 49.435 1.00 0.00 H 0 +HETATM 8261 H2 HOH A2646 1.807 28.460 48.422 1.00 0.00 H 0 +HETATM 8262 O HOH A2647 43.125 21.354 20.280 1.00 0.00 O 0 +HETATM 8263 H1 HOH A2647 43.292 20.472 20.517 1.00 0.00 H 0 +HETATM 8264 H2 HOH A2647 42.628 21.685 21.017 1.00 0.00 H 0 +HETATM 8265 O HOH A2648 40.455 1.134 35.240 1.00 0.00 O 0 +HETATM 8266 H1 HOH A2648 39.992 1.953 35.482 1.00 0.00 H 0 +HETATM 8267 H2 HOH A2648 39.955 0.467 35.813 1.00 0.00 H 0 +HETATM 8268 O HOH A2649 2.862 12.710 3.868 1.00 0.00 O 0 +HETATM 8269 H1 HOH A2649 2.327 12.222 4.529 1.00 0.00 H 0 +HETATM 8270 H2 HOH A2649 2.261 12.921 3.106 1.00 0.00 H 0 +HETATM 8271 O HOH A2650 47.165 20.280 29.110 1.00 0.00 O 0 +HETATM 8272 H1 HOH A2650 48.108 20.075 29.261 1.00 0.00 H 0 +HETATM 8273 H2 HOH A2650 47.145 20.141 28.128 1.00 0.00 H 0 +HETATM 8274 O HOH A2651 0.926 52.033 4.064 1.00 0.00 O 0 +HETATM 8275 H1 HOH A2651 0.988 52.738 4.701 1.00 0.00 H 0 +HETATM 8276 H2 HOH A2651 1.747 52.168 3.517 1.00 0.00 H 0 +HETATM 8277 O HOH A2652 46.501 40.593 38.048 1.00 0.00 O 0 +HETATM 8278 H1 HOH A2652 47.265 40.055 37.915 1.00 0.00 H 0 +HETATM 8279 H2 HOH A2652 45.757 40.067 37.825 1.00 0.00 H 0 +HETATM 8280 O HOH A2653 29.556 4.081 22.094 1.00 0.00 O 0 +HETATM 8281 H1 HOH A2653 29.765 4.735 22.786 1.00 0.00 H 0 +HETATM 8282 H2 HOH A2653 30.253 4.138 21.362 1.00 0.00 H 0 +HETATM 8283 O HOH A2654 35.236 9.773 36.561 1.00 0.00 O 0 +HETATM 8284 H1 HOH A2654 34.503 9.117 36.546 1.00 0.00 H 0 +HETATM 8285 H2 HOH A2654 34.918 10.594 36.132 1.00 0.00 H 0 +HETATM 8286 O HOH A2655 22.816 2.424 31.971 1.00 0.00 O 0 +HETATM 8287 H1 HOH A2655 23.734 2.522 31.558 1.00 0.00 H 0 +HETATM 8288 H2 HOH A2655 22.563 1.468 32.272 1.00 0.00 H 0 +HETATM 8289 O HOH A2656 13.643 5.519 18.893 1.00 0.00 O 0 +HETATM 8290 H1 HOH A2656 13.896 4.676 19.274 1.00 0.00 H 0 +HETATM 8291 H2 HOH A2656 13.437 5.404 18.022 1.00 0.00 H 0 +HETATM 8292 O HOH A2657 50.946 28.369 45.550 1.00 0.00 O 0 +HETATM 8293 H1 HOH A2657 50.878 28.269 44.620 1.00 0.00 H 0 +HETATM 8294 H2 HOH A2657 51.647 27.696 45.798 1.00 0.00 H 0 +HETATM 8295 O HOH A2658 12.750 40.206 21.567 1.00 0.00 O 0 +HETATM 8296 H1 HOH A2658 13.548 40.775 21.697 1.00 0.00 H 0 +HETATM 8297 H2 HOH A2658 12.556 40.261 20.602 1.00 0.00 H 0 +HETATM 8298 O HOH A2659 4.997 20.876 36.384 1.00 0.00 O 0 +HETATM 8299 H1 HOH A2659 5.159 21.583 35.792 1.00 0.00 H 0 +HETATM 8300 H2 HOH A2659 5.925 20.575 36.574 1.00 0.00 H 0 +HETATM 8301 O HOH A2660 32.479 19.257 13.426 1.00 0.00 O 0 +HETATM 8302 H1 HOH A2660 31.764 19.368 13.981 1.00 0.00 H 0 +HETATM 8303 H2 HOH A2660 33.239 19.515 14.034 1.00 0.00 H 0 +HETATM 8304 O HOH A2661 14.536 45.706 23.095 1.00 0.00 O 0 +HETATM 8305 H1 HOH A2661 14.894 46.593 22.984 1.00 0.00 H 0 +HETATM 8306 H2 HOH A2661 13.688 45.830 23.660 1.00 0.00 H 0 +HETATM 8307 O HOH A2662 26.280 31.242 15.386 1.00 0.00 O 0 +HETATM 8308 H1 HOH A2662 26.669 30.852 14.567 1.00 0.00 H 0 +HETATM 8309 H2 HOH A2662 25.935 32.033 15.024 1.00 0.00 H 0 +HETATM 8310 O HOH A2663 39.451 1.005 51.071 1.00 0.00 O 0 +HETATM 8311 H1 HOH A2663 39.588 1.723 51.714 1.00 0.00 H 0 +HETATM 8312 H2 HOH A2663 38.656 1.213 50.614 1.00 0.00 H 0 +HETATM 8313 O HOH A2664 17.282 42.125 15.139 1.00 0.00 O 0 +HETATM 8314 H1 HOH A2664 16.857 42.947 15.375 1.00 0.00 H 0 +HETATM 8315 H2 HOH A2664 17.660 41.764 15.918 1.00 0.00 H 0 +HETATM 8316 O HOH A2665 31.063 41.820 48.766 1.00 0.00 O 0 +HETATM 8317 H1 HOH A2665 31.364 41.175 48.168 1.00 0.00 H 0 +HETATM 8318 H2 HOH A2665 30.630 42.484 48.297 1.00 0.00 H 0 +HETATM 8319 O HOH A2666 17.853 28.776 37.801 1.00 0.00 O 0 +HETATM 8320 H1 HOH A2666 16.846 28.735 37.682 1.00 0.00 H 0 +HETATM 8321 H2 HOH A2666 18.275 29.392 37.232 1.00 0.00 H 0 +HETATM 8322 O HOH A2667 40.782 8.114 12.230 1.00 0.00 O 0 +HETATM 8323 H1 HOH A2667 39.927 8.234 12.695 1.00 0.00 H 0 +HETATM 8324 H2 HOH A2667 40.729 8.734 11.558 1.00 0.00 H 0 +HETATM 8325 O HOH A2668 7.519 24.582 9.653 1.00 0.00 O 0 +HETATM 8326 H1 HOH A2668 6.641 25.051 9.591 1.00 0.00 H 0 +HETATM 8327 H2 HOH A2668 7.732 24.682 10.585 1.00 0.00 H 0 +HETATM 8328 O HOH A2669 3.230 25.969 5.723 1.00 0.00 O 0 +HETATM 8329 H1 HOH A2669 2.714 25.319 5.183 1.00 0.00 H 0 +HETATM 8330 H2 HOH A2669 2.916 26.076 6.628 1.00 0.00 H 0 +HETATM 8331 O HOH A2670 26.147 18.447 38.539 1.00 0.00 O 0 +HETATM 8332 H1 HOH A2670 25.407 17.967 38.163 1.00 0.00 H 0 +HETATM 8333 H2 HOH A2670 26.528 18.040 39.321 1.00 0.00 H 0 +HETATM 8334 O HOH A2671 27.499 13.462 8.919 1.00 0.00 O 0 +HETATM 8335 H1 HOH A2671 26.537 13.721 8.795 1.00 0.00 H 0 +HETATM 8336 H2 HOH A2671 27.333 12.568 9.246 1.00 0.00 H 0 +HETATM 8337 O HOH A2672 25.474 49.870 28.253 1.00 0.00 O 0 +HETATM 8338 H1 HOH A2672 25.409 50.771 28.625 1.00 0.00 H 0 +HETATM 8339 H2 HOH A2672 24.931 49.736 27.458 1.00 0.00 H 0 +HETATM 8340 O HOH A2673 9.683 24.054 5.917 1.00 0.00 O 0 +HETATM 8341 H1 HOH A2673 9.829 24.418 5.073 1.00 0.00 H 0 +HETATM 8342 H2 HOH A2673 10.399 23.533 6.262 1.00 0.00 H 0 +HETATM 8343 O HOH A2674 46.716 44.377 28.275 1.00 0.00 O 0 +HETATM 8344 H1 HOH A2674 47.053 45.191 27.887 1.00 0.00 H 0 +HETATM 8345 H2 HOH A2674 45.823 44.343 27.962 1.00 0.00 H 0 +HETATM 8346 O HOH A2675 44.726 2.807 23.839 1.00 0.00 O 0 +HETATM 8347 H1 HOH A2675 44.013 2.832 24.498 1.00 0.00 H 0 +HETATM 8348 H2 HOH A2675 45.606 2.901 24.236 1.00 0.00 H 0 +HETATM 8349 O HOH A2676 0.260 12.996 42.730 1.00 0.00 O 0 +HETATM 8350 H1 HOH A2676 0.395 13.888 43.069 1.00 0.00 H 0 +HETATM 8351 H2 HOH A2676 -0.215 13.150 41.931 1.00 0.00 H 0 +HETATM 8352 O HOH A2677 32.055 23.935 10.606 1.00 0.00 O 0 +HETATM 8353 H1 HOH A2677 31.694 24.677 10.118 1.00 0.00 H 0 +HETATM 8354 H2 HOH A2677 32.823 23.551 10.206 1.00 0.00 H 0 +HETATM 8355 O HOH A2678 11.021 36.854 42.090 1.00 0.00 O 0 +HETATM 8356 H1 HOH A2678 11.578 37.504 42.500 1.00 0.00 H 0 +HETATM 8357 H2 HOH A2678 11.551 36.068 42.195 1.00 0.00 H 0 +HETATM 8358 O HOH A2679 36.422 14.448 46.591 1.00 0.00 O 0 +HETATM 8359 H1 HOH A2679 36.289 13.660 45.974 1.00 0.00 H 0 +HETATM 8360 H2 HOH A2679 35.749 14.319 47.361 1.00 0.00 H 0 +HETATM 8361 O HOH A2680 47.606 16.888 31.011 1.00 0.00 O 0 +HETATM 8362 H1 HOH A2680 47.112 17.701 31.084 1.00 0.00 H 0 +HETATM 8363 H2 HOH A2680 47.970 16.735 31.968 1.00 0.00 H 0 +HETATM 8364 O HOH A2681 50.110 24.194 33.688 1.00 0.00 O 0 +HETATM 8365 H1 HOH A2681 49.915 23.595 32.954 1.00 0.00 H 0 +HETATM 8366 H2 HOH A2681 49.477 23.969 34.381 1.00 0.00 H 0 +HETATM 8367 O HOH A2682 26.788 42.104 24.281 1.00 0.00 O 0 +HETATM 8368 H1 HOH A2682 26.676 42.481 23.440 1.00 0.00 H 0 +HETATM 8369 H2 HOH A2682 25.991 41.545 24.377 1.00 0.00 H 0 +HETATM 8370 O HOH A2683 49.733 6.360 2.977 1.00 0.00 O 0 +HETATM 8371 H1 HOH A2683 48.806 6.300 3.155 1.00 0.00 H 0 +HETATM 8372 H2 HOH A2683 49.863 7.190 2.521 1.00 0.00 H 0 +HETATM 8373 O HOH A2684 36.087 51.761 8.795 1.00 0.00 O 0 +HETATM 8374 H1 HOH A2684 35.523 51.697 9.596 1.00 0.00 H 0 +HETATM 8375 H2 HOH A2684 36.638 51.009 8.723 1.00 0.00 H 0 +HETATM 8376 O HOH A2685 9.522 0.613 48.268 1.00 0.00 O 0 +HETATM 8377 H1 HOH A2685 9.564 0.267 49.213 1.00 0.00 H 0 +HETATM 8378 H2 HOH A2685 8.894 1.339 48.402 1.00 0.00 H 0 +HETATM 8379 O HOH A2686 14.747 6.674 30.582 1.00 0.00 O 0 +HETATM 8380 H1 HOH A2686 14.728 6.962 29.661 1.00 0.00 H 0 +HETATM 8381 H2 HOH A2686 15.412 7.202 31.016 1.00 0.00 H 0 +HETATM 8382 O HOH A2687 26.534 25.898 1.424 1.00 0.00 O 0 +HETATM 8383 H1 HOH A2687 26.345 25.516 0.604 1.00 0.00 H 0 +HETATM 8384 H2 HOH A2687 27.396 26.410 1.514 1.00 0.00 H 0 +HETATM 8385 O HOH A2688 1.109 27.841 51.887 1.00 0.00 O 0 +HETATM 8386 H1 HOH A2688 1.009 27.070 52.421 1.00 0.00 H 0 +HETATM 8387 H2 HOH A2688 1.718 28.414 52.369 1.00 0.00 H 0 +HETATM 8388 O HOH A2689 46.538 29.570 47.699 1.00 0.00 O 0 +HETATM 8389 H1 HOH A2689 47.518 29.494 47.466 1.00 0.00 H 0 +HETATM 8390 H2 HOH A2689 46.504 29.668 48.640 1.00 0.00 H 0 +HETATM 8391 O HOH A2690 39.266 23.877 30.773 1.00 0.00 O 0 +HETATM 8392 H1 HOH A2690 39.824 24.408 30.146 1.00 0.00 H 0 +HETATM 8393 H2 HOH A2690 39.550 22.991 30.544 1.00 0.00 H 0 +HETATM 8394 O HOH A2691 53.190 25.858 31.311 1.00 0.00 O 0 +HETATM 8395 H1 HOH A2691 53.237 25.701 32.283 1.00 0.00 H 0 +HETATM 8396 H2 HOH A2691 53.200 24.996 30.903 1.00 0.00 H 0 +HETATM 8397 O HOH A2692 19.194 52.253 9.829 1.00 0.00 O 0 +HETATM 8398 H1 HOH A2692 19.197 53.169 10.276 1.00 0.00 H 0 +HETATM 8399 H2 HOH A2692 18.859 51.616 10.570 1.00 0.00 H 0 +HETATM 8400 O HOH A2693 29.498 48.456 50.318 1.00 0.00 O 0 +HETATM 8401 H1 HOH A2693 28.843 47.928 49.851 1.00 0.00 H 0 +HETATM 8402 H2 HOH A2693 29.883 47.862 51.093 1.00 0.00 H 0 +HETATM 8403 O HOH A2694 8.568 36.432 47.020 1.00 0.00 O 0 +HETATM 8404 H1 HOH A2694 7.837 35.907 46.764 1.00 0.00 H 0 +HETATM 8405 H2 HOH A2694 9.057 35.835 47.636 1.00 0.00 H 0 +HETATM 8406 O HOH A2695 49.098 16.944 8.542 1.00 0.00 O 0 +HETATM 8407 H1 HOH A2695 49.215 17.723 9.168 1.00 0.00 H 0 +HETATM 8408 H2 HOH A2695 49.906 16.972 7.992 1.00 0.00 H 0 +HETATM 8409 O HOH A2696 26.526 4.858 18.560 1.00 0.00 O 0 +HETATM 8410 H1 HOH A2696 26.617 4.435 19.478 1.00 0.00 H 0 +HETATM 8411 H2 HOH A2696 27.313 4.597 18.109 1.00 0.00 H 0 +HETATM 8412 O HOH A2697 18.552 3.973 36.979 1.00 0.00 O 0 +HETATM 8413 H1 HOH A2697 17.655 3.757 36.986 1.00 0.00 H 0 +HETATM 8414 H2 HOH A2697 19.055 3.317 37.523 1.00 0.00 H 0 +HETATM 8415 O HOH A2698 45.709 11.894 20.348 1.00 0.00 O 0 +HETATM 8416 H1 HOH A2698 46.231 12.645 20.456 1.00 0.00 H 0 +HETATM 8417 H2 HOH A2698 44.908 12.208 19.924 1.00 0.00 H 0 +HETATM 8418 O HOH A2699 5.131 35.816 8.050 1.00 0.00 O 0 +HETATM 8419 H1 HOH A2699 4.358 35.230 8.174 1.00 0.00 H 0 +HETATM 8420 H2 HOH A2699 4.978 36.732 8.317 1.00 0.00 H 0 +HETATM 8421 O HOH A2700 13.901 3.981 0.631 1.00 0.00 O 0 +HETATM 8422 H1 HOH A2700 13.589 3.196 0.187 1.00 0.00 H 0 +HETATM 8423 H2 HOH A2700 14.765 4.281 0.304 1.00 0.00 H 0 +HETATM 8424 O HOH A2701 49.404 38.396 51.645 1.00 0.00 O 0 +HETATM 8425 H1 HOH A2701 49.610 38.838 50.776 1.00 0.00 H 0 +HETATM 8426 H2 HOH A2701 49.779 38.887 52.378 1.00 0.00 H 0 +HETATM 8427 O HOH A2702 19.967 52.588 5.360 1.00 0.00 O 0 +HETATM 8428 H1 HOH A2702 20.279 51.767 5.731 1.00 0.00 H 0 +HETATM 8429 H2 HOH A2702 19.291 52.333 4.743 1.00 0.00 H 0 +HETATM 8430 O HOH A2703 41.224 32.152 37.758 1.00 0.00 O 0 +HETATM 8431 H1 HOH A2703 41.578 32.859 37.210 1.00 0.00 H 0 +HETATM 8432 H2 HOH A2703 40.244 32.069 37.522 1.00 0.00 H 0 +HETATM 8433 O HOH A2704 3.568 51.903 5.579 1.00 0.00 O 0 +HETATM 8434 H1 HOH A2704 3.683 52.088 4.665 1.00 0.00 H 0 +HETATM 8435 H2 HOH A2704 4.298 51.388 5.830 1.00 0.00 H 0 +HETATM 8436 O HOH A2705 48.543 6.441 46.592 1.00 0.00 O 0 +HETATM 8437 H1 HOH A2705 48.361 7.251 47.049 1.00 0.00 H 0 +HETATM 8438 H2 HOH A2705 49.436 6.219 47.023 1.00 0.00 H 0 +HETATM 8439 O HOH A2706 23.898 14.073 3.175 1.00 0.00 O 0 +HETATM 8440 H1 HOH A2706 23.085 14.469 2.870 1.00 0.00 H 0 +HETATM 8441 H2 HOH A2706 24.020 13.174 2.702 1.00 0.00 H 0 +HETATM 8442 O HOH A2707 49.277 23.516 8.695 1.00 0.00 O 0 +HETATM 8443 H1 HOH A2707 49.587 24.114 8.001 1.00 0.00 H 0 +HETATM 8444 H2 HOH A2707 49.273 23.926 9.596 1.00 0.00 H 0 +HETATM 8445 O HOH A2708 52.789 18.654 39.452 1.00 0.00 O 0 +HETATM 8446 H1 HOH A2708 52.922 19.465 39.978 1.00 0.00 H 0 +HETATM 8447 H2 HOH A2708 52.737 17.959 40.120 1.00 0.00 H 0 +HETATM 8448 O HOH A2709 11.407 7.759 5.516 1.00 0.00 O 0 +HETATM 8449 H1 HOH A2709 11.556 6.902 5.866 1.00 0.00 H 0 +HETATM 8450 H2 HOH A2709 12.271 7.853 5.099 1.00 0.00 H 0 +HETATM 8451 O HOH A2710 29.119 42.144 25.864 1.00 0.00 O 0 +HETATM 8452 H1 HOH A2710 28.984 41.542 26.669 1.00 0.00 H 0 +HETATM 8453 H2 HOH A2710 28.238 42.262 25.418 1.00 0.00 H 0 +HETATM 8454 O HOH A2711 30.974 34.019 29.603 1.00 0.00 O 0 +HETATM 8455 H1 HOH A2711 31.043 34.906 29.292 1.00 0.00 H 0 +HETATM 8456 H2 HOH A2711 31.746 33.743 30.103 1.00 0.00 H 0 +HETATM 8457 O HOH A2712 4.135 48.630 39.798 1.00 0.00 O 0 +HETATM 8458 H1 HOH A2712 4.609 48.872 40.541 1.00 0.00 H 0 +HETATM 8459 H2 HOH A2712 4.530 49.247 39.135 1.00 0.00 H 0 +HETATM 8460 O HOH A2713 35.491 17.611 47.854 1.00 0.00 O 0 +HETATM 8461 H1 HOH A2713 36.129 17.432 47.079 1.00 0.00 H 0 +HETATM 8462 H2 HOH A2713 34.826 16.844 47.952 1.00 0.00 H 0 +HETATM 8463 O HOH A2714 53.963 36.816 23.959 1.00 0.00 O 0 +HETATM 8464 H1 HOH A2714 53.464 37.632 23.840 1.00 0.00 H 0 +HETATM 8465 H2 HOH A2714 53.282 36.082 23.937 1.00 0.00 H 0 +HETATM 8466 O HOH A2715 8.870 49.897 43.971 1.00 0.00 O 0 +HETATM 8467 H1 HOH A2715 8.023 50.296 44.087 1.00 0.00 H 0 +HETATM 8468 H2 HOH A2715 8.650 49.002 43.577 1.00 0.00 H 0 +HETATM 8469 O HOH A2716 45.870 12.249 11.777 1.00 0.00 O 0 +HETATM 8470 H1 HOH A2716 46.739 12.071 11.448 1.00 0.00 H 0 +HETATM 8471 H2 HOH A2716 45.349 11.598 11.270 1.00 0.00 H 0 +HETATM 8472 O HOH A2717 25.297 43.363 0.466 1.00 0.00 O 0 +HETATM 8473 H1 HOH A2717 24.705 43.582 -0.275 1.00 0.00 H 0 +HETATM 8474 H2 HOH A2717 26.113 43.986 0.415 1.00 0.00 H 0 +HETATM 8475 O HOH A2718 25.028 36.731 39.656 1.00 0.00 O 0 +HETATM 8476 H1 HOH A2718 25.564 36.840 38.793 1.00 0.00 H 0 +HETATM 8477 H2 HOH A2718 24.854 35.803 39.712 1.00 0.00 H 0 +HETATM 8478 O HOH A2719 39.885 39.537 7.042 1.00 0.00 O 0 +HETATM 8479 H1 HOH A2719 40.678 39.699 6.546 1.00 0.00 H 0 +HETATM 8480 H2 HOH A2719 39.452 38.772 6.632 1.00 0.00 H 0 +HETATM 8481 O HOH A2720 11.861 1.488 50.897 1.00 0.00 O 0 +HETATM 8482 H1 HOH A2720 11.106 0.846 50.947 1.00 0.00 H 0 +HETATM 8483 H2 HOH A2720 12.584 1.081 50.408 1.00 0.00 H 0 +HETATM 8484 O HOH A2721 44.021 36.672 33.321 1.00 0.00 O 0 +HETATM 8485 H1 HOH A2721 44.760 37.332 33.206 1.00 0.00 H 0 +HETATM 8486 H2 HOH A2721 44.272 35.905 33.880 1.00 0.00 H 0 +HETATM 8487 O HOH A2722 43.613 27.769 2.546 1.00 0.00 O 0 +HETATM 8488 H1 HOH A2722 43.803 27.013 1.964 1.00 0.00 H 0 +HETATM 8489 H2 HOH A2722 43.136 28.416 1.981 1.00 0.00 H 0 +HETATM 8490 O HOH A2723 40.191 5.827 44.487 1.00 0.00 O 0 +HETATM 8491 H1 HOH A2723 39.285 5.506 44.564 1.00 0.00 H 0 +HETATM 8492 H2 HOH A2723 40.597 5.307 43.841 1.00 0.00 H 0 +HETATM 8493 O HOH A2724 6.831 29.292 8.331 1.00 0.00 O 0 +HETATM 8494 H1 HOH A2724 6.394 30.053 8.784 1.00 0.00 H 0 +HETATM 8495 H2 HOH A2724 6.761 29.531 7.389 1.00 0.00 H 0 +HETATM 8496 O HOH A2725 41.428 13.152 2.477 1.00 0.00 O 0 +HETATM 8497 H1 HOH A2725 40.759 13.016 1.754 1.00 0.00 H 0 +HETATM 8498 H2 HOH A2725 41.001 12.998 3.320 1.00 0.00 H 0 +HETATM 8499 O HOH A2726 31.817 40.931 13.761 1.00 0.00 O 0 +HETATM 8500 H1 HOH A2726 31.464 40.776 14.627 1.00 0.00 H 0 +HETATM 8501 H2 HOH A2726 32.722 40.701 13.806 1.00 0.00 H 0 +HETATM 8502 O HOH A2727 2.577 31.826 42.831 1.00 0.00 O 0 +HETATM 8503 H1 HOH A2727 2.275 31.764 43.767 1.00 0.00 H 0 +HETATM 8504 H2 HOH A2727 2.787 32.717 42.592 1.00 0.00 H 0 +HETATM 8505 O HOH A2728 23.156 12.334 7.782 1.00 0.00 O 0 +HETATM 8506 H1 HOH A2728 23.652 12.416 6.997 1.00 0.00 H 0 +HETATM 8507 H2 HOH A2728 23.658 12.799 8.413 1.00 0.00 H 0 +HETATM 8508 O HOH A2729 28.889 45.252 31.051 1.00 0.00 O 0 +HETATM 8509 H1 HOH A2729 29.037 44.344 31.211 1.00 0.00 H 0 +HETATM 8510 H2 HOH A2729 27.944 45.499 31.079 1.00 0.00 H 0 +HETATM 8511 O HOH A2730 17.156 37.622 23.312 1.00 0.00 O 0 +HETATM 8512 H1 HOH A2730 17.001 37.178 24.143 1.00 0.00 H 0 +HETATM 8513 H2 HOH A2730 16.266 37.570 22.979 1.00 0.00 H 0 +HETATM 8514 O HOH A2731 14.819 43.453 50.789 1.00 0.00 O 0 +HETATM 8515 H1 HOH A2731 15.412 43.857 50.140 1.00 0.00 H 0 +HETATM 8516 H2 HOH A2731 14.735 43.992 51.576 1.00 0.00 H 0 +HETATM 8517 O HOH A2732 22.216 38.091 45.164 1.00 0.00 O 0 +HETATM 8518 H1 HOH A2732 22.141 37.253 44.679 1.00 0.00 H 0 +HETATM 8519 H2 HOH A2732 21.293 38.420 45.367 1.00 0.00 H 0 +HETATM 8520 O HOH A2733 11.457 12.809 38.167 1.00 0.00 O 0 +HETATM 8521 H1 HOH A2733 10.514 12.920 38.290 1.00 0.00 H 0 +HETATM 8522 H2 HOH A2733 11.614 12.166 37.486 1.00 0.00 H 0 +HETATM 8523 O HOH A2734 38.226 49.557 7.880 1.00 0.00 O 0 +HETATM 8524 H1 HOH A2734 38.728 48.805 8.184 1.00 0.00 H 0 +HETATM 8525 H2 HOH A2734 38.784 50.334 7.883 1.00 0.00 H 0 +HETATM 8526 O HOH A2735 39.965 49.411 34.176 1.00 0.00 O 0 +HETATM 8527 H1 HOH A2735 40.683 50.102 34.160 1.00 0.00 H 0 +HETATM 8528 H2 HOH A2735 39.822 49.269 35.096 1.00 0.00 H 0 +HETATM 8529 O HOH A2736 26.386 28.009 47.656 1.00 0.00 O 0 +HETATM 8530 H1 HOH A2736 26.215 28.789 48.201 1.00 0.00 H 0 +HETATM 8531 H2 HOH A2736 25.763 27.351 48.005 1.00 0.00 H 0 +HETATM 8532 O HOH A2737 24.934 33.930 5.722 1.00 0.00 O 0 +HETATM 8533 H1 HOH A2737 25.078 34.830 5.979 1.00 0.00 H 0 +HETATM 8534 H2 HOH A2737 25.246 33.770 4.818 1.00 0.00 H 0 +HETATM 8535 O HOH A2738 1.468 42.045 28.688 1.00 0.00 O 0 +HETATM 8536 H1 HOH A2738 1.923 42.408 29.438 1.00 0.00 H 0 +HETATM 8537 H2 HOH A2738 0.902 41.354 29.004 1.00 0.00 H 0 +HETATM 8538 O HOH A2739 47.127 51.824 9.347 1.00 0.00 O 0 +HETATM 8539 H1 HOH A2739 46.464 52.240 8.736 1.00 0.00 H 0 +HETATM 8540 H2 HOH A2739 46.651 51.787 10.224 1.00 0.00 H 0 +HETATM 8541 O HOH A2740 21.297 0.536 35.630 1.00 0.00 O 0 +HETATM 8542 H1 HOH A2740 21.492 1.151 36.414 1.00 0.00 H 0 +HETATM 8543 H2 HOH A2740 22.139 0.581 35.112 1.00 0.00 H 0 +HETATM 8544 O HOH A2741 27.428 50.026 18.422 1.00 0.00 O 0 +HETATM 8545 H1 HOH A2741 28.034 50.154 19.188 1.00 0.00 H 0 +HETATM 8546 H2 HOH A2741 27.001 49.163 18.439 1.00 0.00 H 0 +HETATM 8547 O HOH A2742 1.056 20.875 25.043 1.00 0.00 O 0 +HETATM 8548 H1 HOH A2742 0.171 20.796 24.659 1.00 0.00 H 0 +HETATM 8549 H2 HOH A2742 0.918 20.788 26.036 1.00 0.00 H 0 +HETATM 8550 O HOH A2743 51.746 49.979 36.939 1.00 0.00 O 0 +HETATM 8551 H1 HOH A2743 51.219 50.109 37.795 1.00 0.00 H 0 +HETATM 8552 H2 HOH A2743 51.676 50.876 36.514 1.00 0.00 H 0 +HETATM 8553 O HOH A2744 40.276 33.221 6.873 1.00 0.00 O 0 +HETATM 8554 H1 HOH A2744 41.101 33.247 6.274 1.00 0.00 H 0 +HETATM 8555 H2 HOH A2744 40.225 34.106 7.156 1.00 0.00 H 0 +HETATM 8556 O HOH A2745 40.649 11.441 34.299 1.00 0.00 O 0 +HETATM 8557 H1 HOH A2745 40.598 11.545 35.232 1.00 0.00 H 0 +HETATM 8558 H2 HOH A2745 40.600 10.490 34.265 1.00 0.00 H 0 +HETATM 8559 O HOH A2746 22.749 44.100 15.534 1.00 0.00 O 0 +HETATM 8560 H1 HOH A2746 21.980 43.490 15.650 1.00 0.00 H 0 +HETATM 8561 H2 HOH A2746 23.297 43.816 16.260 1.00 0.00 H 0 +HETATM 8562 O HOH A2747 34.789 9.929 39.313 1.00 0.00 O 0 +HETATM 8563 H1 HOH A2747 35.155 9.834 38.441 1.00 0.00 H 0 +HETATM 8564 H2 HOH A2747 34.810 9.063 39.666 1.00 0.00 H 0 +HETATM 8565 O HOH A2748 28.217 3.916 31.179 1.00 0.00 O 0 +HETATM 8566 H1 HOH A2748 29.102 4.299 31.216 1.00 0.00 H 0 +HETATM 8567 H2 HOH A2748 28.277 3.135 30.565 1.00 0.00 H 0 +HETATM 8568 O HOH A2749 51.202 43.092 32.648 1.00 0.00 O 0 +HETATM 8569 H1 HOH A2749 52.054 43.325 33.024 1.00 0.00 H 0 +HETATM 8570 H2 HOH A2749 50.636 42.822 33.355 1.00 0.00 H 0 +HETATM 8571 O HOH A2750 44.188 1.837 4.787 1.00 0.00 O 0 +HETATM 8572 H1 HOH A2750 44.161 2.743 4.560 1.00 0.00 H 0 +HETATM 8573 H2 HOH A2750 44.724 1.474 4.036 1.00 0.00 H 0 +HETATM 8574 O HOH A2751 47.293 47.026 11.008 1.00 0.00 O 0 +HETATM 8575 H1 HOH A2751 46.644 46.408 10.610 1.00 0.00 H 0 +HETATM 8576 H2 HOH A2751 47.354 46.751 11.969 1.00 0.00 H 0 +HETATM 8577 O HOH A2752 32.977 32.841 12.074 1.00 0.00 O 0 +HETATM 8578 H1 HOH A2752 32.276 32.211 11.942 1.00 0.00 H 0 +HETATM 8579 H2 HOH A2752 33.625 32.413 12.570 1.00 0.00 H 0 +HETATM 8580 O HOH A2753 42.327 42.276 18.621 1.00 0.00 O 0 +HETATM 8581 H1 HOH A2753 41.659 42.885 18.273 1.00 0.00 H 0 +HETATM 8582 H2 HOH A2753 42.671 42.819 19.335 1.00 0.00 H 0 +HETATM 8583 O HOH A2754 34.320 10.477 46.401 1.00 0.00 O 0 +HETATM 8584 H1 HOH A2754 34.682 9.697 45.876 1.00 0.00 H 0 +HETATM 8585 H2 HOH A2754 34.855 11.295 46.171 1.00 0.00 H 0 +HETATM 8586 O HOH A2755 18.127 52.853 16.544 1.00 0.00 O 0 +HETATM 8587 H1 HOH A2755 18.887 53.474 16.529 1.00 0.00 H 0 +HETATM 8588 H2 HOH A2755 17.732 52.750 15.636 1.00 0.00 H 0 +HETATM 8589 O HOH A2756 49.380 24.671 2.801 1.00 0.00 O 0 +HETATM 8590 H1 HOH A2756 49.691 24.002 3.439 1.00 0.00 H 0 +HETATM 8591 H2 HOH A2756 49.563 25.608 3.105 1.00 0.00 H 0 +HETATM 8592 O HOH A2757 20.620 45.147 37.543 1.00 0.00 O 0 +HETATM 8593 H1 HOH A2757 21.420 44.540 37.489 1.00 0.00 H 0 +HETATM 8594 H2 HOH A2757 20.474 45.453 38.460 1.00 0.00 H 0 +HETATM 8595 O HOH A2758 23.522 38.930 18.001 1.00 0.00 O 0 +HETATM 8596 H1 HOH A2758 22.936 39.372 17.284 1.00 0.00 H 0 +HETATM 8597 H2 HOH A2758 24.413 38.787 17.727 1.00 0.00 H 0 +HETATM 8598 O HOH A2759 4.541 41.870 5.051 1.00 0.00 O 0 +HETATM 8599 H1 HOH A2759 3.775 41.799 4.445 1.00 0.00 H 0 +HETATM 8600 H2 HOH A2759 4.234 41.752 6.012 1.00 0.00 H 0 +HETATM 8601 O HOH A2760 32.563 5.215 3.880 1.00 0.00 O 0 +HETATM 8602 H1 HOH A2760 31.777 5.782 3.919 1.00 0.00 H 0 +HETATM 8603 H2 HOH A2760 32.405 4.812 3.040 1.00 0.00 H 0 +HETATM 8604 O HOH A2761 1.292 9.599 50.079 1.00 0.00 O 0 +HETATM 8605 H1 HOH A2761 0.785 10.056 49.411 1.00 0.00 H 0 +HETATM 8606 H2 HOH A2761 1.442 8.686 49.882 1.00 0.00 H 0 +HETATM 8607 O HOH A2762 47.149 17.558 52.814 1.00 0.00 O 0 +HETATM 8608 H1 HOH A2762 47.560 18.332 52.385 1.00 0.00 H 0 +HETATM 8609 H2 HOH A2762 47.312 17.730 53.728 1.00 0.00 H 0 +HETATM 8610 O HOH A2763 27.400 46.568 27.638 1.00 0.00 O 0 +HETATM 8611 H1 HOH A2763 28.128 46.939 28.218 1.00 0.00 H 0 +HETATM 8612 H2 HOH A2763 27.186 47.303 27.078 1.00 0.00 H 0 +HETATM 8613 O HOH A2764 38.364 35.001 43.549 1.00 0.00 O 0 +HETATM 8614 H1 HOH A2764 37.421 35.301 43.716 1.00 0.00 H 0 +HETATM 8615 H2 HOH A2764 38.426 34.099 43.934 1.00 0.00 H 0 +HETATM 8616 O HOH A2765 30.405 36.021 14.845 1.00 0.00 O 0 +HETATM 8617 H1 HOH A2765 30.886 36.713 15.335 1.00 0.00 H 0 +HETATM 8618 H2 HOH A2765 30.755 35.141 15.124 1.00 0.00 H 0 +HETATM 8619 O HOH A2766 16.512 44.257 24.388 1.00 0.00 O 0 +HETATM 8620 H1 HOH A2766 15.841 44.675 23.798 1.00 0.00 H 0 +HETATM 8621 H2 HOH A2766 16.565 43.300 24.324 1.00 0.00 H 0 +HETATM 8622 O HOH A2767 45.265 33.898 26.892 1.00 0.00 O 0 +HETATM 8623 H1 HOH A2767 45.660 34.695 26.495 1.00 0.00 H 0 +HETATM 8624 H2 HOH A2767 46.033 33.423 27.238 1.00 0.00 H 0 +HETATM 8625 O HOH A2768 2.608 32.943 23.292 1.00 0.00 O 0 +HETATM 8626 H1 HOH A2768 2.290 33.233 22.444 1.00 0.00 H 0 +HETATM 8627 H2 HOH A2768 3.379 33.556 23.490 1.00 0.00 H 0 +HETATM 8628 O HOH A2769 50.342 5.485 29.778 1.00 0.00 O 0 +HETATM 8629 H1 HOH A2769 50.319 5.825 28.812 1.00 0.00 H 0 +HETATM 8630 H2 HOH A2769 50.142 6.165 30.372 1.00 0.00 H 0 +HETATM 8631 O HOH A2770 32.790 49.480 1.931 1.00 0.00 O 0 +HETATM 8632 H1 HOH A2770 32.152 48.840 1.592 1.00 0.00 H 0 +HETATM 8633 H2 HOH A2770 32.875 49.379 2.943 1.00 0.00 H 0 +HETATM 8634 O HOH A2771 6.330 12.564 4.695 1.00 0.00 O 0 +HETATM 8635 H1 HOH A2771 6.776 12.010 5.333 1.00 0.00 H 0 +HETATM 8636 H2 HOH A2771 6.063 12.064 3.842 1.00 0.00 H 0 +HETATM 8637 O HOH A2772 39.865 14.408 30.185 1.00 0.00 O 0 +HETATM 8638 H1 HOH A2772 40.142 14.154 31.014 1.00 0.00 H 0 +HETATM 8639 H2 HOH A2772 38.943 14.735 30.242 1.00 0.00 H 0 +HETATM 8640 O HOH A2773 42.459 48.720 45.204 1.00 0.00 O 0 +HETATM 8641 H1 HOH A2773 42.255 49.012 46.110 1.00 0.00 H 0 +HETATM 8642 H2 HOH A2773 42.544 49.552 44.700 1.00 0.00 H 0 +HETATM 8643 O HOH A2774 27.826 25.433 51.166 1.00 0.00 O 0 +HETATM 8644 H1 HOH A2774 28.646 25.001 51.322 1.00 0.00 H 0 +HETATM 8645 H2 HOH A2774 27.246 25.059 51.876 1.00 0.00 H 0 +HETATM 8646 O HOH A2775 19.220 34.215 18.099 1.00 0.00 O 0 +HETATM 8647 H1 HOH A2775 18.330 33.869 18.194 1.00 0.00 H 0 +HETATM 8648 H2 HOH A2775 19.824 33.595 18.516 1.00 0.00 H 0 +HETATM 8649 O HOH A2776 26.511 1.253 33.231 1.00 0.00 O 0 +HETATM 8650 H1 HOH A2776 26.477 1.220 34.145 1.00 0.00 H 0 +HETATM 8651 H2 HOH A2776 27.446 1.468 33.054 1.00 0.00 H 0 +HETATM 8652 O HOH A2777 35.331 12.054 41.292 1.00 0.00 O 0 +HETATM 8653 H1 HOH A2777 35.325 11.261 40.719 1.00 0.00 H 0 +HETATM 8654 H2 HOH A2777 36.289 12.216 41.525 1.00 0.00 H 0 +HETATM 8655 O HOH A2778 29.073 17.476 28.824 1.00 0.00 O 0 +HETATM 8656 H1 HOH A2778 28.237 17.154 29.271 1.00 0.00 H 0 +HETATM 8657 H2 HOH A2778 29.593 17.582 29.652 1.00 0.00 H 0 +HETATM 8658 O HOH A2779 33.458 42.449 6.342 1.00 0.00 O 0 +HETATM 8659 H1 HOH A2779 33.829 42.159 7.225 1.00 0.00 H 0 +HETATM 8660 H2 HOH A2779 32.519 42.664 6.552 1.00 0.00 H 0 +HETATM 8661 O HOH A2780 22.521 47.239 47.131 1.00 0.00 O 0 +HETATM 8662 H1 HOH A2780 23.432 47.583 47.012 1.00 0.00 H 0 +HETATM 8663 H2 HOH A2780 22.257 46.652 46.406 1.00 0.00 H 0 +HETATM 8664 O HOH A2781 26.681 42.914 21.458 1.00 0.00 O 0 +HETATM 8665 H1 HOH A2781 26.099 43.660 21.441 1.00 0.00 H 0 +HETATM 8666 H2 HOH A2781 26.166 42.046 21.515 1.00 0.00 H 0 +HETATM 8667 O HOH A2782 28.936 27.371 1.704 1.00 0.00 O 0 +HETATM 8668 H1 HOH A2782 28.817 28.103 2.310 1.00 0.00 H 0 +HETATM 8669 H2 HOH A2782 29.619 27.750 1.051 1.00 0.00 H 0 +HETATM 8670 O HOH A2783 49.558 40.718 26.838 1.00 0.00 O 0 +HETATM 8671 H1 HOH A2783 50.038 39.941 27.197 1.00 0.00 H 0 +HETATM 8672 H2 HOH A2783 49.691 40.649 25.852 1.00 0.00 H 0 +HETATM 8673 O HOH A2784 48.426 20.172 13.051 1.00 0.00 O 0 +HETATM 8674 H1 HOH A2784 49.223 20.716 12.873 1.00 0.00 H 0 +HETATM 8675 H2 HOH A2784 48.454 19.517 12.316 1.00 0.00 H 0 +HETATM 8676 O HOH A2785 12.502 5.601 6.907 1.00 0.00 O 0 +HETATM 8677 H1 HOH A2785 13.329 6.002 7.110 1.00 0.00 H 0 +HETATM 8678 H2 HOH A2785 12.283 5.122 7.640 1.00 0.00 H 0 +HETATM 8679 O HOH A2786 46.382 40.130 15.563 1.00 0.00 O 0 +HETATM 8680 H1 HOH A2786 45.926 39.300 15.694 1.00 0.00 H 0 +HETATM 8681 H2 HOH A2786 46.336 40.512 16.426 1.00 0.00 H 0 +HETATM 8682 O HOH A2787 12.957 29.933 38.353 1.00 0.00 O 0 +HETATM 8683 H1 HOH A2787 13.071 30.542 37.577 1.00 0.00 H 0 +HETATM 8684 H2 HOH A2787 12.074 29.655 38.315 1.00 0.00 H 0 +HETATM 8685 O HOH A2788 38.308 28.319 7.451 1.00 0.00 O 0 +HETATM 8686 H1 HOH A2788 38.863 27.748 6.868 1.00 0.00 H 0 +HETATM 8687 H2 HOH A2788 38.916 28.852 7.971 1.00 0.00 H 0 +HETATM 8688 O HOH A2789 40.303 50.176 51.464 1.00 0.00 O 0 +HETATM 8689 H1 HOH A2789 40.114 50.660 52.237 1.00 0.00 H 0 +HETATM 8690 H2 HOH A2789 40.185 50.756 50.756 1.00 0.00 H 0 +HETATM 8691 O HOH A2790 21.394 45.556 7.911 1.00 0.00 O 0 +HETATM 8692 H1 HOH A2790 22.266 45.971 7.751 1.00 0.00 H 0 +HETATM 8693 H2 HOH A2790 21.048 45.983 8.780 1.00 0.00 H 0 +HETATM 8694 O HOH A2791 40.121 16.509 6.186 1.00 0.00 O 0 +HETATM 8695 H1 HOH A2791 40.588 16.622 5.362 1.00 0.00 H 0 +HETATM 8696 H2 HOH A2791 39.216 16.321 5.863 1.00 0.00 H 0 +HETATM 8697 O HOH A2792 44.730 11.182 22.917 1.00 0.00 O 0 +HETATM 8698 H1 HOH A2792 43.845 10.901 22.798 1.00 0.00 H 0 +HETATM 8699 H2 HOH A2792 45.118 11.323 22.029 1.00 0.00 H 0 +HETATM 8700 O HOH A2793 17.701 25.908 53.281 1.00 0.00 O 0 +HETATM 8701 H1 HOH A2793 17.023 26.384 53.749 1.00 0.00 H 0 +HETATM 8702 H2 HOH A2793 17.251 25.093 53.117 1.00 0.00 H 0 +HETATM 8703 O HOH A2794 38.150 52.226 23.467 1.00 0.00 O 0 +HETATM 8704 H1 HOH A2794 37.794 53.118 23.516 1.00 0.00 H 0 +HETATM 8705 H2 HOH A2794 38.595 52.227 22.628 1.00 0.00 H 0 +HETATM 8706 O HOH A2795 28.575 3.041 17.777 1.00 0.00 O 0 +HETATM 8707 H1 HOH A2795 28.213 2.255 18.246 1.00 0.00 H 0 +HETATM 8708 H2 HOH A2795 29.225 2.760 17.119 1.00 0.00 H 0 +HETATM 8709 O HOH A2796 35.622 48.488 40.308 1.00 0.00 O 0 +HETATM 8710 H1 HOH A2796 35.913 48.890 41.115 1.00 0.00 H 0 +HETATM 8711 H2 HOH A2796 34.716 48.474 40.567 1.00 0.00 H 0 +HETATM 8712 O HOH A2797 25.005 2.709 30.091 1.00 0.00 O 0 +HETATM 8713 H1 HOH A2797 25.811 2.300 30.537 1.00 0.00 H 0 +HETATM 8714 H2 HOH A2797 24.818 2.181 29.315 1.00 0.00 H 0 +HETATM 8715 O HOH A2798 22.233 36.585 27.841 1.00 0.00 O 0 +HETATM 8716 H1 HOH A2798 22.548 37.113 28.659 1.00 0.00 H 0 +HETATM 8717 H2 HOH A2798 22.305 37.194 27.066 1.00 0.00 H 0 +HETATM 8718 O HOH A2799 48.752 48.345 48.404 1.00 0.00 O 0 +HETATM 8719 H1 HOH A2799 48.598 48.978 49.111 1.00 0.00 H 0 +HETATM 8720 H2 HOH A2799 48.180 47.620 48.721 1.00 0.00 H 0 +HETATM 8721 O HOH A2800 44.429 40.003 3.345 1.00 0.00 O 0 +HETATM 8722 H1 HOH A2800 44.107 40.349 2.490 1.00 0.00 H 0 +HETATM 8723 H2 HOH A2800 43.854 40.465 3.934 1.00 0.00 H 0 +HETATM 8724 O HOH A2801 2.660 38.820 29.473 1.00 0.00 O 0 +HETATM 8725 H1 HOH A2801 3.018 39.456 28.899 1.00 0.00 H 0 +HETATM 8726 H2 HOH A2801 3.430 38.391 29.791 1.00 0.00 H 0 +HETATM 8727 O HOH A2802 24.662 1.630 6.689 1.00 0.00 O 0 +HETATM 8728 H1 HOH A2802 24.401 1.059 5.979 1.00 0.00 H 0 +HETATM 8729 H2 HOH A2802 24.236 2.427 6.469 1.00 0.00 H 0 +HETATM 8730 O HOH A2803 33.058 34.067 16.337 1.00 0.00 O 0 +HETATM 8731 H1 HOH A2803 32.708 34.860 16.806 1.00 0.00 H 0 +HETATM 8732 H2 HOH A2803 32.412 33.661 15.690 1.00 0.00 H 0 +HETATM 8733 O HOH A2804 33.072 7.743 39.520 1.00 0.00 O 0 +HETATM 8734 H1 HOH A2804 32.207 7.765 39.902 1.00 0.00 H 0 +HETATM 8735 H2 HOH A2804 33.267 6.804 39.473 1.00 0.00 H 0 +HETATM 8736 O HOH A2805 46.062 6.169 48.536 1.00 0.00 O 0 +HETATM 8737 H1 HOH A2805 45.498 6.459 49.241 1.00 0.00 H 0 +HETATM 8738 H2 HOH A2805 45.605 5.466 48.119 1.00 0.00 H 0 +HETATM 8739 O HOH A2806 13.342 48.848 23.260 1.00 0.00 O 0 +HETATM 8740 H1 HOH A2806 13.112 48.460 24.050 1.00 0.00 H 0 +HETATM 8741 H2 HOH A2806 14.271 48.746 23.062 1.00 0.00 H 0 +HETATM 8742 O HOH A2807 14.915 45.208 38.461 1.00 0.00 O 0 +HETATM 8743 H1 HOH A2807 14.493 44.293 38.542 1.00 0.00 H 0 +HETATM 8744 H2 HOH A2807 14.815 45.359 37.512 1.00 0.00 H 0 +HETATM 8745 O HOH A2808 2.740 25.878 34.634 1.00 0.00 O 0 +HETATM 8746 H1 HOH A2808 2.287 25.049 34.919 1.00 0.00 H 0 +HETATM 8747 H2 HOH A2808 1.997 26.558 34.615 1.00 0.00 H 0 +HETATM 8748 O HOH A2809 9.287 21.152 12.173 1.00 0.00 O 0 +HETATM 8749 H1 HOH A2809 8.919 21.450 11.302 1.00 0.00 H 0 +HETATM 8750 H2 HOH A2809 8.997 20.245 12.166 1.00 0.00 H 0 +HETATM 8751 O HOH A2810 9.864 22.006 41.106 1.00 0.00 O 0 +HETATM 8752 H1 HOH A2810 9.752 21.066 41.375 1.00 0.00 H 0 +HETATM 8753 H2 HOH A2810 10.835 22.298 41.025 1.00 0.00 H 0 +HETATM 8754 O HOH A2811 52.500 0.525 52.423 1.00 0.00 O 0 +HETATM 8755 H1 HOH A2811 52.662 0.641 53.410 1.00 0.00 H 0 +HETATM 8756 H2 HOH A2811 51.595 0.968 52.338 1.00 0.00 H 0 +HETATM 8757 O HOH A2812 51.545 36.593 51.419 1.00 0.00 O 0 +HETATM 8758 H1 HOH A2812 52.293 37.210 51.311 1.00 0.00 H 0 +HETATM 8759 H2 HOH A2812 50.802 37.184 51.594 1.00 0.00 H 0 +HETATM 8760 O HOH A2813 28.157 7.195 21.519 1.00 0.00 O 0 +HETATM 8761 H1 HOH A2813 27.941 7.047 20.605 1.00 0.00 H 0 +HETATM 8762 H2 HOH A2813 27.842 6.427 21.957 1.00 0.00 H 0 +HETATM 8763 O HOH A2814 50.279 28.859 42.711 1.00 0.00 O 0 +HETATM 8764 H1 HOH A2814 50.630 29.755 42.631 1.00 0.00 H 0 +HETATM 8765 H2 HOH A2814 49.324 28.889 42.648 1.00 0.00 H 0 +HETATM 8766 O HOH A2815 22.890 46.126 11.755 1.00 0.00 O 0 +HETATM 8767 H1 HOH A2815 22.975 45.179 11.700 1.00 0.00 H 0 +HETATM 8768 H2 HOH A2815 23.601 46.368 12.339 1.00 0.00 H 0 +HETATM 8769 O HOH A2816 51.281 29.393 33.229 1.00 0.00 O 0 +HETATM 8770 H1 HOH A2816 51.402 29.795 34.101 1.00 0.00 H 0 +HETATM 8771 H2 HOH A2816 51.110 28.435 33.351 1.00 0.00 H 0 +HETATM 8772 O HOH A2817 15.700 1.687 29.680 1.00 0.00 O 0 +HETATM 8773 H1 HOH A2817 15.812 0.926 30.219 1.00 0.00 H 0 +HETATM 8774 H2 HOH A2817 15.240 1.372 28.872 1.00 0.00 H 0 +HETATM 8775 O HOH A2818 16.890 36.452 7.775 1.00 0.00 O 0 +HETATM 8776 H1 HOH A2818 17.277 36.856 8.530 1.00 0.00 H 0 +HETATM 8777 H2 HOH A2818 16.337 35.815 8.263 1.00 0.00 H 0 +HETATM 8778 O HOH A2819 8.765 29.785 4.019 1.00 0.00 O 0 +HETATM 8779 H1 HOH A2819 8.426 29.251 3.353 1.00 0.00 H 0 +HETATM 8780 H2 HOH A2819 9.571 29.377 4.429 1.00 0.00 H 0 +HETATM 8781 O HOH A2820 7.194 15.292 14.116 1.00 0.00 O 0 +HETATM 8782 H1 HOH A2820 7.078 16.131 14.575 1.00 0.00 H 0 +HETATM 8783 H2 HOH A2820 7.142 14.585 14.716 1.00 0.00 H 0 +HETATM 8784 O HOH A2821 15.826 42.803 41.941 1.00 0.00 O 0 +HETATM 8785 H1 HOH A2821 15.896 41.785 41.641 1.00 0.00 H 0 +HETATM 8786 H2 HOH A2821 16.569 43.281 41.799 1.00 0.00 H 0 +HETATM 8787 O HOH A2822 1.566 45.253 35.867 1.00 0.00 O 0 +HETATM 8788 H1 HOH A2822 1.719 44.995 36.797 1.00 0.00 H 0 +HETATM 8789 H2 HOH A2822 0.956 44.639 35.573 1.00 0.00 H 0 +HETATM 8790 O HOH A2823 35.369 30.128 40.084 1.00 0.00 O 0 +HETATM 8791 H1 HOH A2823 35.049 29.450 39.497 1.00 0.00 H 0 +HETATM 8792 H2 HOH A2823 36.318 30.123 40.165 1.00 0.00 H 0 +HETATM 8793 O HOH A2824 7.258 9.739 35.016 1.00 0.00 O 0 +HETATM 8794 H1 HOH A2824 7.981 10.285 35.318 1.00 0.00 H 0 +HETATM 8795 H2 HOH A2824 6.665 9.683 35.771 1.00 0.00 H 0 +HETATM 8796 O HOH A2825 28.455 47.964 34.162 1.00 0.00 O 0 +HETATM 8797 H1 HOH A2825 28.571 48.364 33.283 1.00 0.00 H 0 +HETATM 8798 H2 HOH A2825 28.425 46.955 33.938 1.00 0.00 H 0 +HETATM 8799 O HOH A2826 35.980 43.606 16.355 1.00 0.00 O 0 +HETATM 8800 H1 HOH A2826 36.013 43.726 15.413 1.00 0.00 H 0 +HETATM 8801 H2 HOH A2826 35.913 42.690 16.658 1.00 0.00 H 0 +HETATM 8802 O HOH A2827 19.056 35.349 43.549 1.00 0.00 O 0 +HETATM 8803 H1 HOH A2827 19.817 35.619 43.026 1.00 0.00 H 0 +HETATM 8804 H2 HOH A2827 19.126 35.720 44.470 1.00 0.00 H 0 +HETATM 8805 O HOH A2828 50.908 47.417 25.662 1.00 0.00 O 0 +HETATM 8806 H1 HOH A2828 51.427 47.006 26.422 1.00 0.00 H 0 +HETATM 8807 H2 HOH A2828 51.516 47.564 24.929 1.00 0.00 H 0 +HETATM 8808 O HOH A2829 51.027 52.816 48.051 1.00 0.00 O 0 +HETATM 8809 H1 HOH A2829 50.042 52.893 47.838 1.00 0.00 H 0 +HETATM 8810 H2 HOH A2829 50.951 52.184 48.733 1.00 0.00 H 0 +HETATM 8811 O HOH A2830 13.607 52.543 19.373 1.00 0.00 O 0 +HETATM 8812 H1 HOH A2830 14.411 52.046 19.642 1.00 0.00 H 0 +HETATM 8813 H2 HOH A2830 12.969 51.802 19.369 1.00 0.00 H 0 +HETATM 8814 O HOH A2831 43.868 1.713 31.142 1.00 0.00 O 0 +HETATM 8815 H1 HOH A2831 44.708 2.093 31.444 1.00 0.00 H 0 +HETATM 8816 H2 HOH A2831 44.047 1.520 30.213 1.00 0.00 H 0 +HETATM 8817 O HOH A2832 36.696 52.507 18.721 1.00 0.00 O 0 +HETATM 8818 H1 HOH A2832 36.323 51.893 19.405 1.00 0.00 H 0 +HETATM 8819 H2 HOH A2832 37.608 52.255 18.538 1.00 0.00 H 0 +HETATM 8820 O HOH A2833 42.543 29.537 45.221 1.00 0.00 O 0 +HETATM 8821 H1 HOH A2833 41.622 29.719 45.296 1.00 0.00 H 0 +HETATM 8822 H2 HOH A2833 43.024 30.040 45.855 1.00 0.00 H 0 +HETATM 8823 O HOH A2834 44.279 51.757 3.831 1.00 0.00 O 0 +HETATM 8824 H1 HOH A2834 44.460 51.492 4.756 1.00 0.00 H 0 +HETATM 8825 H2 HOH A2834 44.363 50.966 3.329 1.00 0.00 H 0 +HETATM 8826 O HOH A2835 23.649 29.952 43.683 1.00 0.00 O 0 +HETATM 8827 H1 HOH A2835 22.785 30.062 44.026 1.00 0.00 H 0 +HETATM 8828 H2 HOH A2835 23.606 29.490 42.826 1.00 0.00 H 0 +HETATM 8829 O HOH A2836 5.315 20.290 50.814 1.00 0.00 O 0 +HETATM 8830 H1 HOH A2836 6.139 20.108 50.422 1.00 0.00 H 0 +HETATM 8831 H2 HOH A2836 5.003 19.435 51.185 1.00 0.00 H 0 +HETATM 8832 O HOH A2837 27.585 28.237 52.083 1.00 0.00 O 0 +HETATM 8833 H1 HOH A2837 27.439 27.312 51.768 1.00 0.00 H 0 +HETATM 8834 H2 HOH A2837 28.155 28.196 52.932 1.00 0.00 H 0 +HETATM 8835 O HOH A2838 1.497 14.587 51.731 1.00 0.00 O 0 +HETATM 8836 H1 HOH A2838 1.501 13.748 52.214 1.00 0.00 H 0 +HETATM 8837 H2 HOH A2838 1.175 15.221 52.405 1.00 0.00 H 0 +HETATM 8838 O HOH A2839 10.409 26.812 51.668 1.00 0.00 O 0 +HETATM 8839 H1 HOH A2839 9.475 26.493 51.535 1.00 0.00 H 0 +HETATM 8840 H2 HOH A2839 10.673 26.885 50.765 1.00 0.00 H 0 +HETATM 8841 O HOH A2840 6.893 40.676 3.810 1.00 0.00 O 0 +HETATM 8842 H1 HOH A2840 6.212 41.084 4.419 1.00 0.00 H 0 +HETATM 8843 H2 HOH A2840 7.833 40.971 4.055 1.00 0.00 H 0 +HETATM 8844 O HOH A2841 3.314 21.109 38.646 1.00 0.00 O 0 +HETATM 8845 H1 HOH A2841 4.195 20.704 38.649 1.00 0.00 H 0 +HETATM 8846 H2 HOH A2841 3.560 21.960 38.235 1.00 0.00 H 0 +HETATM 8847 O HOH A2842 38.265 35.493 37.073 1.00 0.00 O 0 +HETATM 8848 H1 HOH A2842 39.123 35.784 36.740 1.00 0.00 H 0 +HETATM 8849 H2 HOH A2842 37.926 35.990 37.760 1.00 0.00 H 0 +HETATM 8850 O HOH A2843 40.191 50.595 30.890 1.00 0.00 O 0 +HETATM 8851 H1 HOH A2843 39.675 49.710 30.767 1.00 0.00 H 0 +HETATM 8852 H2 HOH A2843 39.643 51.172 31.366 1.00 0.00 H 0 +HETATM 8853 O HOH A2844 4.861 10.101 29.960 1.00 0.00 O 0 +HETATM 8854 H1 HOH A2844 4.030 9.690 30.193 1.00 0.00 H 0 +HETATM 8855 H2 HOH A2844 5.548 9.577 30.390 1.00 0.00 H 0 +HETATM 8856 O HOH A2845 5.514 39.348 50.431 1.00 0.00 O 0 +HETATM 8857 H1 HOH A2845 5.101 40.256 50.627 1.00 0.00 H 0 +HETATM 8858 H2 HOH A2845 6.016 39.164 51.186 1.00 0.00 H 0 +HETATM 8859 O HOH A2846 53.206 11.732 7.635 1.00 0.00 O 0 +HETATM 8860 H1 HOH A2846 53.888 11.408 7.037 1.00 0.00 H 0 +HETATM 8861 H2 HOH A2846 53.806 11.892 8.405 1.00 0.00 H 0 +HETATM 8862 O HOH A2847 39.107 37.131 46.725 1.00 0.00 O 0 +HETATM 8863 H1 HOH A2847 39.457 37.513 45.936 1.00 0.00 H 0 +HETATM 8864 H2 HOH A2847 39.795 37.029 47.431 1.00 0.00 H 0 +HETATM 8865 O HOH A2848 42.157 29.313 24.673 1.00 0.00 O 0 +HETATM 8866 H1 HOH A2848 41.702 28.535 25.087 1.00 0.00 H 0 +HETATM 8867 H2 HOH A2848 42.122 29.205 23.706 1.00 0.00 H 0 +HETATM 8868 O HOH A2849 46.106 29.761 0.026 1.00 0.00 O 0 +HETATM 8869 H1 HOH A2849 46.860 30.309 0.053 1.00 0.00 H 0 +HETATM 8870 H2 HOH A2849 46.502 28.943 0.206 1.00 0.00 H 0 +HETATM 8871 O HOH A2850 26.635 30.855 45.671 1.00 0.00 O 0 +HETATM 8872 H1 HOH A2850 27.459 30.893 46.068 1.00 0.00 H 0 +HETATM 8873 H2 HOH A2850 26.416 31.729 45.361 1.00 0.00 H 0 +HETATM 8874 O HOH A2851 1.093 13.876 45.445 1.00 0.00 O 0 +HETATM 8875 H1 HOH A2851 0.758 12.940 45.543 1.00 0.00 H 0 +HETATM 8876 H2 HOH A2851 0.639 14.359 46.127 1.00 0.00 H 0 +HETATM 8877 O HOH A2852 4.756 30.560 49.043 1.00 0.00 O 0 +HETATM 8878 H1 HOH A2852 4.049 30.590 48.343 1.00 0.00 H 0 +HETATM 8879 H2 HOH A2852 5.517 30.946 48.659 1.00 0.00 H 0 +HETATM 8880 O HOH A2853 11.136 25.344 9.143 1.00 0.00 O 0 +HETATM 8881 H1 HOH A2853 10.298 25.548 8.594 1.00 0.00 H 0 +HETATM 8882 H2 HOH A2853 11.927 25.376 8.542 1.00 0.00 H 0 +HETATM 8883 O HOH A2854 34.352 18.888 53.216 1.00 0.00 O 0 +HETATM 8884 H1 HOH A2854 34.730 18.465 52.434 1.00 0.00 H 0 +HETATM 8885 H2 HOH A2854 34.365 18.244 53.915 1.00 0.00 H 0 +HETATM 8886 O HOH A2855 1.979 27.104 14.630 1.00 0.00 O 0 +HETATM 8887 H1 HOH A2855 2.755 27.365 15.162 1.00 0.00 H 0 +HETATM 8888 H2 HOH A2855 1.406 26.660 15.258 1.00 0.00 H 0 +HETATM 8889 O HOH A2856 50.910 49.912 32.765 1.00 0.00 O 0 +HETATM 8890 H1 HOH A2856 51.540 49.990 32.059 1.00 0.00 H 0 +HETATM 8891 H2 HOH A2856 51.053 50.719 33.230 1.00 0.00 H 0 +HETATM 8892 O HOH A2857 2.678 39.044 8.758 1.00 0.00 O 0 +HETATM 8893 H1 HOH A2857 1.963 38.400 8.830 1.00 0.00 H 0 +HETATM 8894 H2 HOH A2857 3.425 38.708 9.263 1.00 0.00 H 0 +HETATM 8895 O HOH A2858 49.607 24.919 15.049 1.00 0.00 O 0 +HETATM 8896 H1 HOH A2858 48.707 24.614 15.275 1.00 0.00 H 0 +HETATM 8897 H2 HOH A2858 50.046 24.056 14.805 1.00 0.00 H 0 +HETATM 8898 O HOH A2859 7.318 4.173 5.359 1.00 0.00 O 0 +HETATM 8899 H1 HOH A2859 7.116 5.121 5.315 1.00 0.00 H 0 +HETATM 8900 H2 HOH A2859 8.183 4.171 5.777 1.00 0.00 H 0 +HETATM 8901 O HOH A2860 24.184 25.730 10.608 1.00 0.00 O 0 +HETATM 8902 H1 HOH A2860 23.839 26.125 11.375 1.00 0.00 H 0 +HETATM 8903 H2 HOH A2860 23.596 25.107 10.174 1.00 0.00 H 0 +HETATM 8904 O HOH A2861 6.993 47.342 32.436 1.00 0.00 O 0 +HETATM 8905 H1 HOH A2861 6.895 48.319 32.360 1.00 0.00 H 0 +HETATM 8906 H2 HOH A2861 6.405 46.854 33.071 1.00 0.00 H 0 +HETATM 8907 O HOH A2862 5.825 34.971 5.442 1.00 0.00 O 0 +HETATM 8908 H1 HOH A2862 5.316 35.279 6.214 1.00 0.00 H 0 +HETATM 8909 H2 HOH A2862 6.703 35.100 5.718 1.00 0.00 H 0 +HETATM 8910 O HOH A2863 10.676 42.360 28.062 1.00 0.00 O 0 +HETATM 8911 H1 HOH A2863 9.892 42.879 28.346 1.00 0.00 H 0 +HETATM 8912 H2 HOH A2863 11.332 42.324 28.783 1.00 0.00 H 0 +HETATM 8913 O HOH A2864 47.142 35.600 43.896 1.00 0.00 O 0 +HETATM 8914 H1 HOH A2864 46.803 35.041 44.553 1.00 0.00 H 0 +HETATM 8915 H2 HOH A2864 47.407 36.503 44.257 1.00 0.00 H 0 +HETATM 8916 O HOH A2865 42.978 50.204 12.773 1.00 0.00 O 0 +HETATM 8917 H1 HOH A2865 43.174 50.055 11.872 1.00 0.00 H 0 +HETATM 8918 H2 HOH A2865 42.284 49.611 12.995 1.00 0.00 H 0 +HETATM 8919 O HOH A2866 29.409 17.300 8.993 1.00 0.00 O 0 +HETATM 8920 H1 HOH A2866 29.042 16.709 8.284 1.00 0.00 H 0 +HETATM 8921 H2 HOH A2866 29.233 16.881 9.867 1.00 0.00 H 0 +HETATM 8922 O HOH A2867 45.314 12.849 34.732 1.00 0.00 O 0 +HETATM 8923 H1 HOH A2867 44.596 12.646 34.154 1.00 0.00 H 0 +HETATM 8924 H2 HOH A2867 45.115 12.418 35.550 1.00 0.00 H 0 +HETATM 8925 O HOH A2868 34.626 45.021 5.907 1.00 0.00 O 0 +HETATM 8926 H1 HOH A2868 35.537 44.804 6.066 1.00 0.00 H 0 +HETATM 8927 H2 HOH A2868 34.228 44.170 5.968 1.00 0.00 H 0 +HETATM 8928 O HOH A2869 43.084 37.001 5.572 1.00 0.00 O 0 +HETATM 8929 H1 HOH A2869 44.000 37.254 5.507 1.00 0.00 H 0 +HETATM 8930 H2 HOH A2869 42.822 36.699 4.635 1.00 0.00 H 0 +HETATM 8931 O HOH A2870 0.060 30.249 4.873 1.00 0.00 O 0 +HETATM 8932 H1 HOH A2870 0.015 30.133 3.978 1.00 0.00 H 0 +HETATM 8933 H2 HOH A2870 0.995 30.255 4.912 1.00 0.00 H 0 +HETATM 8934 O HOH A2871 18.596 39.781 22.503 1.00 0.00 O 0 +HETATM 8935 H1 HOH A2871 18.615 40.564 23.060 1.00 0.00 H 0 +HETATM 8936 H2 HOH A2871 18.425 38.977 23.099 1.00 0.00 H 0 +HETATM 8937 O HOH A2872 32.160 34.875 4.986 1.00 0.00 O 0 +HETATM 8938 H1 HOH A2872 31.404 34.449 5.375 1.00 0.00 H 0 +HETATM 8939 H2 HOH A2872 32.354 34.315 4.210 1.00 0.00 H 0 +HETATM 8940 O HOH A2873 49.637 10.159 10.016 1.00 0.00 O 0 +HETATM 8941 H1 HOH A2873 49.308 11.017 10.305 1.00 0.00 H 0 +HETATM 8942 H2 HOH A2873 49.990 9.818 10.881 1.00 0.00 H 0 +HETATM 8943 O HOH A2874 24.184 24.529 2.750 1.00 0.00 O 0 +HETATM 8944 H1 HOH A2874 24.425 24.579 3.670 1.00 0.00 H 0 +HETATM 8945 H2 HOH A2874 24.924 24.778 2.176 1.00 0.00 H 0 +HETATM 8946 O HOH A2875 35.263 31.970 46.443 1.00 0.00 O 0 +HETATM 8947 H1 HOH A2875 35.996 32.231 47.020 1.00 0.00 H 0 +HETATM 8948 H2 HOH A2875 35.539 32.178 45.519 1.00 0.00 H 0 +HETATM 8949 O HOH A2876 51.742 21.170 49.523 1.00 0.00 O 0 +HETATM 8950 H1 HOH A2876 52.733 21.101 49.509 1.00 0.00 H 0 +HETATM 8951 H2 HOH A2876 51.585 20.415 48.865 1.00 0.00 H 0 +HETATM 8952 O HOH A2877 31.300 46.089 4.400 1.00 0.00 O 0 +HETATM 8953 H1 HOH A2877 30.641 45.407 4.429 1.00 0.00 H 0 +HETATM 8954 H2 HOH A2877 30.793 46.786 4.834 1.00 0.00 H 0 +HETATM 8955 O HOH A2878 26.765 48.368 25.627 1.00 0.00 O 0 +HETATM 8956 H1 HOH A2878 25.958 48.494 25.165 1.00 0.00 H 0 +HETATM 8957 H2 HOH A2878 27.552 48.423 24.978 1.00 0.00 H 0 +HETATM 8958 O HOH A2879 45.644 8.070 0.555 1.00 0.00 O 0 +HETATM 8959 H1 HOH A2879 45.957 9.009 0.475 1.00 0.00 H 0 +HETATM 8960 H2 HOH A2879 45.558 7.658 -0.345 1.00 0.00 H 0 +HETATM 8961 O HOH A2880 4.814 29.410 19.994 1.00 0.00 O 0 +HETATM 8962 H1 HOH A2880 5.611 29.190 19.468 1.00 0.00 H 0 +HETATM 8963 H2 HOH A2880 5.003 30.122 20.628 1.00 0.00 H 0 +HETATM 8964 O HOH A2881 40.832 25.194 28.607 1.00 0.00 O 0 +HETATM 8965 H1 HOH A2881 40.124 25.433 27.997 1.00 0.00 H 0 +HETATM 8966 H2 HOH A2881 41.182 26.089 28.800 1.00 0.00 H 0 +HETATM 8967 O HOH A2882 51.316 36.018 10.379 1.00 0.00 O 0 +HETATM 8968 H1 HOH A2882 51.780 35.441 9.784 1.00 0.00 H 0 +HETATM 8969 H2 HOH A2882 51.090 35.376 11.106 1.00 0.00 H 0 +HETATM 8970 O HOH A2883 11.518 21.931 13.739 1.00 0.00 O 0 +HETATM 8971 H1 HOH A2883 11.811 22.760 13.334 1.00 0.00 H 0 +HETATM 8972 H2 HOH A2883 10.830 21.545 13.156 1.00 0.00 H 0 +HETATM 8973 O HOH A2884 16.152 47.741 27.807 1.00 0.00 O 0 +HETATM 8974 H1 HOH A2884 16.555 47.059 27.210 1.00 0.00 H 0 +HETATM 8975 H2 HOH A2884 16.822 47.854 28.561 1.00 0.00 H 0 +HETATM 8976 O HOH A2885 45.208 43.752 12.618 1.00 0.00 O 0 +HETATM 8977 H1 HOH A2885 45.590 42.891 12.855 1.00 0.00 H 0 +HETATM 8978 H2 HOH A2885 45.873 44.307 13.045 1.00 0.00 H 0 +HETATM 8979 O HOH A2886 51.228 12.680 22.540 1.00 0.00 O 0 +HETATM 8980 H1 HOH A2886 51.062 12.116 23.255 1.00 0.00 H 0 +HETATM 8981 H2 HOH A2886 50.870 13.516 22.854 1.00 0.00 H 0 +HETATM 8982 O HOH A2887 9.102 10.438 42.894 1.00 0.00 O 0 +HETATM 8983 H1 HOH A2887 8.479 11.103 43.272 1.00 0.00 H 0 +HETATM 8984 H2 HOH A2887 8.835 10.171 42.033 1.00 0.00 H 0 +HETATM 8985 O HOH A2888 32.104 46.015 46.991 1.00 0.00 O 0 +HETATM 8986 H1 HOH A2888 31.793 46.784 46.577 1.00 0.00 H 0 +HETATM 8987 H2 HOH A2888 31.549 45.824 47.700 1.00 0.00 H 0 +HETATM 8988 O HOH A2889 44.904 15.652 18.202 1.00 0.00 O 0 +HETATM 8989 H1 HOH A2889 44.939 16.227 17.445 1.00 0.00 H 0 +HETATM 8990 H2 HOH A2889 45.889 15.490 18.290 1.00 0.00 H 0 +HETATM 8991 O HOH A2890 33.755 6.788 32.503 1.00 0.00 O 0 +HETATM 8992 H1 HOH A2890 33.870 7.760 32.510 1.00 0.00 H 0 +HETATM 8993 H2 HOH A2890 34.121 6.494 31.558 1.00 0.00 H 0 +HETATM 8994 O HOH A2891 28.132 48.798 29.039 1.00 0.00 O 0 +HETATM 8995 H1 HOH A2891 27.223 49.045 28.826 1.00 0.00 H 0 +HETATM 8996 H2 HOH A2891 28.664 49.319 28.434 1.00 0.00 H 0 +HETATM 8997 O HOH A2892 47.029 42.734 31.014 1.00 0.00 O 0 +HETATM 8998 H1 HOH A2892 46.740 43.105 30.186 1.00 0.00 H 0 +HETATM 8999 H2 HOH A2892 47.355 43.344 31.653 1.00 0.00 H 0 +HETATM 9000 O HOH A2893 1.162 25.278 50.478 1.00 0.00 O 0 +HETATM 9001 H1 HOH A2893 2.010 25.725 50.677 1.00 0.00 H 0 +HETATM 9002 H2 HOH A2893 0.730 25.895 49.884 1.00 0.00 H 0 +HETATM 9003 O HOH A2894 12.617 1.641 39.324 1.00 0.00 O 0 +HETATM 9004 H1 HOH A2894 13.395 2.159 39.696 1.00 0.00 H 0 +HETATM 9005 H2 HOH A2894 11.996 1.581 40.039 1.00 0.00 H 0 +HETATM 9006 O HOH A2895 22.808 18.542 17.865 1.00 0.00 O 0 +HETATM 9007 H1 HOH A2895 23.206 17.767 17.531 1.00 0.00 H 0 +HETATM 9008 H2 HOH A2895 21.935 18.244 17.999 1.00 0.00 H 0 +HETATM 9009 O HOH A2896 23.936 7.515 29.523 1.00 0.00 O 0 +HETATM 9010 H1 HOH A2896 23.618 6.616 29.791 1.00 0.00 H 0 +HETATM 9011 H2 HOH A2896 23.167 8.083 29.675 1.00 0.00 H 0 +HETATM 9012 O HOH A2897 35.077 43.483 19.412 1.00 0.00 O 0 +HETATM 9013 H1 HOH A2897 34.810 44.184 18.786 1.00 0.00 H 0 +HETATM 9014 H2 HOH A2897 36.054 43.523 19.319 1.00 0.00 H 0 +HETATM 9015 O HOH A2898 50.354 26.795 51.857 1.00 0.00 O 0 +HETATM 9016 H1 HOH A2898 51.058 27.412 51.477 1.00 0.00 H 0 +HETATM 9017 H2 HOH A2898 50.512 25.889 51.603 1.00 0.00 H 0 +HETATM 9018 O HOH A2899 3.634 52.363 25.421 1.00 0.00 O 0 +HETATM 9019 H1 HOH A2899 4.463 52.820 25.408 1.00 0.00 H 0 +HETATM 9020 H2 HOH A2899 3.354 52.397 24.446 1.00 0.00 H 0 +HETATM 9021 O HOH A2900 1.557 42.155 35.107 1.00 0.00 O 0 +HETATM 9022 H1 HOH A2900 2.375 41.697 34.767 1.00 0.00 H 0 +HETATM 9023 H2 HOH A2900 1.071 41.464 35.609 1.00 0.00 H 0 +HETATM 9024 O HOH A2901 40.732 38.702 19.965 1.00 0.00 O 0 +HETATM 9025 H1 HOH A2901 40.429 37.799 19.973 1.00 0.00 H 0 +HETATM 9026 H2 HOH A2901 41.554 38.723 20.496 1.00 0.00 H 0 +HETATM 9027 O HOH A2902 22.612 43.024 40.787 1.00 0.00 O 0 +HETATM 9028 H1 HOH A2902 22.651 43.238 39.893 1.00 0.00 H 0 +HETATM 9029 H2 HOH A2902 23.009 42.174 40.866 1.00 0.00 H 0 +HETATM 9030 O HOH A2903 16.422 24.078 4.471 1.00 0.00 O 0 +HETATM 9031 H1 HOH A2903 16.570 23.586 5.350 1.00 0.00 H 0 +HETATM 9032 H2 HOH A2903 16.232 24.969 4.733 1.00 0.00 H 0 +HETATM 9033 O HOH A2904 15.040 7.860 19.105 1.00 0.00 O 0 +HETATM 9034 H1 HOH A2904 14.608 7.030 19.004 1.00 0.00 H 0 +HETATM 9035 H2 HOH A2904 15.776 7.703 18.471 1.00 0.00 H 0 +HETATM 9036 O HOH A2905 24.936 18.100 24.911 1.00 0.00 O 0 +HETATM 9037 H1 HOH A2905 24.681 17.457 25.553 1.00 0.00 H 0 +HETATM 9038 H2 HOH A2905 24.406 17.951 24.105 1.00 0.00 H 0 +HETATM 9039 O HOH A2906 41.023 7.811 20.714 1.00 0.00 O 0 +HETATM 9040 H1 HOH A2906 41.853 7.881 20.184 1.00 0.00 H 0 +HETATM 9041 H2 HOH A2906 40.375 7.145 20.399 1.00 0.00 H 0 +HETATM 9042 O HOH A2907 41.441 2.145 17.150 1.00 0.00 O 0 +HETATM 9043 H1 HOH A2907 41.870 1.402 17.636 1.00 0.00 H 0 +HETATM 9044 H2 HOH A2907 40.490 2.005 16.961 1.00 0.00 H 0 +HETATM 9045 O HOH A2908 29.805 22.311 40.254 1.00 0.00 O 0 +HETATM 9046 H1 HOH A2908 28.972 22.444 39.744 1.00 0.00 H 0 +HETATM 9047 H2 HOH A2908 30.241 21.524 40.011 1.00 0.00 H 0 +HETATM 9048 O HOH A2909 31.893 16.865 40.591 1.00 0.00 O 0 +HETATM 9049 H1 HOH A2909 31.315 17.316 41.235 1.00 0.00 H 0 +HETATM 9050 H2 HOH A2909 32.110 17.487 39.905 1.00 0.00 H 0 +HETATM 9051 O HOH A2910 41.967 52.605 13.921 1.00 0.00 O 0 +HETATM 9052 H1 HOH A2910 42.283 51.765 13.661 1.00 0.00 H 0 +HETATM 9053 H2 HOH A2910 41.119 52.572 14.458 1.00 0.00 H 0 +HETATM 9054 O HOH A2911 0.975 31.636 27.889 1.00 0.00 O 0 +HETATM 9055 H1 HOH A2911 0.653 32.143 28.656 1.00 0.00 H 0 +HETATM 9056 H2 HOH A2911 1.948 31.550 27.954 1.00 0.00 H 0 +HETATM 9057 O HOH A2912 13.369 51.599 31.152 1.00 0.00 O 0 +HETATM 9058 H1 HOH A2912 12.997 52.237 30.542 1.00 0.00 H 0 +HETATM 9059 H2 HOH A2912 12.865 51.767 31.965 1.00 0.00 H 0 +HETATM 9060 O HOH A2913 25.333 40.570 21.789 1.00 0.00 O 0 +HETATM 9061 H1 HOH A2913 25.752 39.729 21.434 1.00 0.00 H 0 +HETATM 9062 H2 HOH A2913 24.398 40.599 21.381 1.00 0.00 H 0 +HETATM 9063 O HOH A2914 27.531 11.239 43.187 1.00 0.00 O 0 +HETATM 9064 H1 HOH A2914 27.914 11.972 43.851 1.00 0.00 H 0 +HETATM 9065 H2 HOH A2914 27.439 11.659 42.344 1.00 0.00 H 0 +HETATM 9066 O HOH A2915 9.456 16.338 17.580 1.00 0.00 O 0 +HETATM 9067 H1 HOH A2915 8.518 16.115 17.634 1.00 0.00 H 0 +HETATM 9068 H2 HOH A2915 9.737 16.580 18.489 1.00 0.00 H 0 +HETATM 9069 O HOH A2916 15.962 16.925 15.430 1.00 0.00 O 0 +HETATM 9070 H1 HOH A2916 15.660 16.123 15.867 1.00 0.00 H 0 +HETATM 9071 H2 HOH A2916 15.365 17.707 15.704 1.00 0.00 H 0 +HETATM 9072 O HOH A2917 19.393 22.259 46.737 1.00 0.00 O 0 +HETATM 9073 H1 HOH A2917 18.833 21.623 46.333 1.00 0.00 H 0 +HETATM 9074 H2 HOH A2917 19.050 23.076 46.388 1.00 0.00 H 0 +HETATM 9075 O HOH A2918 47.465 9.444 3.610 1.00 0.00 O 0 +HETATM 9076 H1 HOH A2918 46.813 8.754 3.443 1.00 0.00 H 0 +HETATM 9077 H2 HOH A2918 47.078 9.967 4.331 1.00 0.00 H 0 +HETATM 9078 O HOH A2919 32.303 47.057 36.257 1.00 0.00 O 0 +HETATM 9079 H1 HOH A2919 32.621 47.789 35.716 1.00 0.00 H 0 +HETATM 9080 H2 HOH A2919 32.575 46.294 35.825 1.00 0.00 H 0 +HETATM 9081 O HOH A2920 48.948 35.167 37.909 1.00 0.00 O 0 +HETATM 9082 H1 HOH A2920 48.790 34.995 38.807 1.00 0.00 H 0 +HETATM 9083 H2 HOH A2920 48.861 34.303 37.430 1.00 0.00 H 0 +HETATM 9084 O HOH A2921 9.144 41.649 25.674 1.00 0.00 O 0 +HETATM 9085 H1 HOH A2921 9.582 41.395 24.822 1.00 0.00 H 0 +HETATM 9086 H2 HOH A2921 9.865 41.726 26.327 1.00 0.00 H 0 +HETATM 9087 O HOH A2922 9.248 52.729 46.048 1.00 0.00 O 0 +HETATM 9088 H1 HOH A2922 9.759 51.900 46.211 1.00 0.00 H 0 +HETATM 9089 H2 HOH A2922 9.220 53.142 46.876 1.00 0.00 H 0 +HETATM 9090 O HOH A2923 46.247 11.674 8.316 1.00 0.00 O 0 +HETATM 9091 H1 HOH A2923 46.964 11.052 8.200 1.00 0.00 H 0 +HETATM 9092 H2 HOH A2923 46.584 12.526 8.039 1.00 0.00 H 0 +HETATM 9093 O HOH A2924 44.428 50.885 26.419 1.00 0.00 O 0 +HETATM 9094 H1 HOH A2924 43.866 50.116 26.415 1.00 0.00 H 0 +HETATM 9095 H2 HOH A2924 44.711 50.980 27.359 1.00 0.00 H 0 +HETATM 9096 O HOH A2925 50.228 44.893 41.599 1.00 0.00 O 0 +HETATM 9097 H1 HOH A2925 49.353 44.822 41.158 1.00 0.00 H 0 +HETATM 9098 H2 HOH A2925 50.446 45.813 41.367 1.00 0.00 H 0 +HETATM 9099 O HOH A2926 49.444 14.668 42.609 1.00 0.00 O 0 +HETATM 9100 H1 HOH A2926 49.295 14.592 41.673 1.00 0.00 H 0 +HETATM 9101 H2 HOH A2926 49.945 13.813 42.785 1.00 0.00 H 0 +HETATM 9102 O HOH A2927 16.721 49.858 6.129 1.00 0.00 O 0 +HETATM 9103 H1 HOH A2927 17.029 50.673 6.581 1.00 0.00 H 0 +HETATM 9104 H2 HOH A2927 17.344 49.115 6.279 1.00 0.00 H 0 +HETATM 9105 O HOH A2928 17.865 37.051 10.158 1.00 0.00 O 0 +HETATM 9106 H1 HOH A2928 18.804 36.915 10.118 1.00 0.00 H 0 +HETATM 9107 H2 HOH A2928 17.470 36.243 10.633 1.00 0.00 H 0 +HETATM 9108 O HOH A2929 28.266 8.465 39.604 1.00 0.00 O 0 +HETATM 9109 H1 HOH A2929 28.092 7.600 39.410 1.00 0.00 H 0 +HETATM 9110 H2 HOH A2929 28.536 8.903 38.819 1.00 0.00 H 0 +HETATM 9111 O HOH A2930 20.186 7.949 38.847 1.00 0.00 O 0 +HETATM 9112 H1 HOH A2930 20.914 8.597 38.661 1.00 0.00 H 0 +HETATM 9113 H2 HOH A2930 19.623 8.330 39.532 1.00 0.00 H 0 +HETATM 9114 O HOH A2931 15.381 9.343 50.128 1.00 0.00 O 0 +HETATM 9115 H1 HOH A2931 14.769 9.884 49.603 1.00 0.00 H 0 +HETATM 9116 H2 HOH A2931 14.943 8.505 50.529 1.00 0.00 H 0 +HETATM 9117 O HOH A2932 2.657 24.554 26.842 1.00 0.00 O 0 +HETATM 9118 H1 HOH A2932 2.487 23.923 26.116 1.00 0.00 H 0 +HETATM 9119 H2 HOH A2932 2.090 25.319 26.682 1.00 0.00 H 0 +HETATM 9120 O HOH A2933 36.282 36.438 53.515 1.00 0.00 O 0 +HETATM 9121 H1 HOH A2933 36.900 36.319 54.271 1.00 0.00 H 0 +HETATM 9122 H2 HOH A2933 36.540 35.925 52.726 1.00 0.00 H 0 +HETATM 9123 O HOH A2934 10.731 22.339 16.536 1.00 0.00 O 0 +HETATM 9124 H1 HOH A2934 10.467 21.523 16.919 1.00 0.00 H 0 +HETATM 9125 H2 HOH A2934 11.062 22.213 15.664 1.00 0.00 H 0 +HETATM 9126 O HOH A2935 4.909 2.464 53.020 1.00 0.00 O 0 +HETATM 9127 H1 HOH A2935 4.871 3.296 52.445 1.00 0.00 H 0 +HETATM 9128 H2 HOH A2935 5.053 1.734 52.394 1.00 0.00 H 0 +HETATM 9129 O HOH A2936 52.813 39.089 3.689 1.00 0.00 O 0 +HETATM 9130 H1 HOH A2936 52.547 38.210 3.436 1.00 0.00 H 0 +HETATM 9131 H2 HOH A2936 53.671 38.954 4.076 1.00 0.00 H 0 +HETATM 9132 O HOH A2937 40.414 26.264 47.345 1.00 0.00 O 0 +HETATM 9133 H1 HOH A2937 39.905 26.308 48.108 1.00 0.00 H 0 +HETATM 9134 H2 HOH A2937 39.778 25.894 46.703 1.00 0.00 H 0 +HETATM 9135 O HOH A2938 8.411 38.149 20.447 1.00 0.00 O 0 +HETATM 9136 H1 HOH A2938 8.041 39.039 20.641 1.00 0.00 H 0 +HETATM 9137 H2 HOH A2938 8.134 37.540 21.154 1.00 0.00 H 0 +HETATM 9138 O HOH A2939 45.806 43.655 38.148 1.00 0.00 O 0 +HETATM 9139 H1 HOH A2939 46.154 43.114 37.363 1.00 0.00 H 0 +HETATM 9140 H2 HOH A2939 45.820 44.562 37.839 1.00 0.00 H 0 +HETATM 9141 O HOH A2940 15.387 52.864 7.789 1.00 0.00 O 0 +HETATM 9142 H1 HOH A2940 14.988 52.153 8.356 1.00 0.00 H 0 +HETATM 9143 H2 HOH A2940 16.297 52.612 7.696 1.00 0.00 H 0 +HETATM 9144 O HOH A2941 23.461 22.496 11.342 1.00 0.00 O 0 +HETATM 9145 H1 HOH A2941 23.705 21.728 10.857 1.00 0.00 H 0 +HETATM 9146 H2 HOH A2941 22.750 23.000 10.884 1.00 0.00 H 0 +HETATM 9147 O HOH A2942 38.455 13.341 11.429 1.00 0.00 O 0 +HETATM 9148 H1 HOH A2942 38.885 14.161 11.231 1.00 0.00 H 0 +HETATM 9149 H2 HOH A2942 37.467 13.591 11.522 1.00 0.00 H 0 +HETATM 9150 O HOH A2943 30.260 32.513 35.912 1.00 0.00 O 0 +HETATM 9151 H1 HOH A2943 30.024 32.839 36.771 1.00 0.00 H 0 +HETATM 9152 H2 HOH A2943 31.216 32.247 35.925 1.00 0.00 H 0 +HETATM 9153 O HOH A2944 36.452 38.404 33.732 1.00 0.00 O 0 +HETATM 9154 H1 HOH A2944 35.674 38.257 33.206 1.00 0.00 H 0 +HETATM 9155 H2 HOH A2944 36.143 38.324 34.608 1.00 0.00 H 0 +HETATM 9156 O HOH A2945 52.300 44.306 36.759 1.00 0.00 O 0 +HETATM 9157 H1 HOH A2945 52.358 44.768 35.876 1.00 0.00 H 0 +HETATM 9158 H2 HOH A2945 52.456 45.007 37.441 1.00 0.00 H 0 +HETATM 9159 O HOH A2946 13.673 5.032 3.293 1.00 0.00 O 0 +HETATM 9160 H1 HOH A2946 13.597 4.196 3.848 1.00 0.00 H 0 +HETATM 9161 H2 HOH A2946 13.860 4.732 2.372 1.00 0.00 H 0 +HETATM 9162 O HOH A2947 48.142 42.172 10.975 1.00 0.00 O 0 +HETATM 9163 H1 HOH A2947 48.332 43.084 10.827 1.00 0.00 H 0 +HETATM 9164 H2 HOH A2947 47.624 41.858 10.184 1.00 0.00 H 0 +HETATM 9165 O HOH A2948 52.995 33.197 36.603 1.00 0.00 O 0 +HETATM 9166 H1 HOH A2948 52.450 33.865 36.170 1.00 0.00 H 0 +HETATM 9167 H2 HOH A2948 52.932 33.395 37.523 1.00 0.00 H 0 +HETATM 9168 O HOH A2949 40.454 43.510 49.002 1.00 0.00 O 0 +HETATM 9169 H1 HOH A2949 40.131 42.649 48.646 1.00 0.00 H 0 +HETATM 9170 H2 HOH A2949 39.808 44.251 48.935 1.00 0.00 H 0 +HETATM 9171 O HOH A2950 53.539 19.084 13.899 1.00 0.00 O 0 +HETATM 9172 H1 HOH A2950 53.794 18.473 14.562 1.00 0.00 H 0 +HETATM 9173 H2 HOH A2950 53.582 19.960 14.323 1.00 0.00 H 0 +HETATM 9174 O HOH A2951 3.625 5.182 40.477 1.00 0.00 O 0 +HETATM 9175 H1 HOH A2951 4.147 5.717 41.054 1.00 0.00 H 0 +HETATM 9176 H2 HOH A2951 4.094 5.158 39.631 1.00 0.00 H 0 +HETATM 9177 O HOH A2952 7.499 43.824 25.060 1.00 0.00 O 0 +HETATM 9178 H1 HOH A2952 7.861 43.132 25.659 1.00 0.00 H 0 +HETATM 9179 H2 HOH A2952 6.570 44.008 25.362 1.00 0.00 H 0 +HETATM 9180 O HOH A2953 32.078 37.066 44.292 1.00 0.00 O 0 +HETATM 9181 H1 HOH A2953 32.200 36.665 45.145 1.00 0.00 H 0 +HETATM 9182 H2 HOH A2953 32.586 37.888 44.398 1.00 0.00 H 0 +HETATM 9183 O HOH A2954 21.105 31.890 0.705 1.00 0.00 O 0 +HETATM 9184 H1 HOH A2954 20.426 32.327 0.196 1.00 0.00 H 0 +HETATM 9185 H2 HOH A2954 20.684 31.016 0.739 1.00 0.00 H 0 +HETATM 9186 O HOH A2955 49.558 38.243 46.512 1.00 0.00 O 0 +HETATM 9187 H1 HOH A2955 50.385 37.778 46.355 1.00 0.00 H 0 +HETATM 9188 H2 HOH A2955 49.782 38.704 47.361 1.00 0.00 H 0 +HETATM 9189 O HOH A2956 17.307 31.190 43.899 1.00 0.00 O 0 +HETATM 9190 H1 HOH A2956 18.218 31.131 44.277 1.00 0.00 H 0 +HETATM 9191 H2 HOH A2956 16.786 31.650 44.592 1.00 0.00 H 0 +HETATM 9192 O HOH A2957 31.667 22.102 51.335 1.00 0.00 O 0 +HETATM 9193 H1 HOH A2957 31.819 21.133 51.291 1.00 0.00 H 0 +HETATM 9194 H2 HOH A2957 32.387 22.481 50.623 1.00 0.00 H 0 +HETATM 9195 O HOH A2958 16.535 11.802 17.867 1.00 0.00 O 0 +HETATM 9196 H1 HOH A2958 16.853 10.879 17.934 1.00 0.00 H 0 +HETATM 9197 H2 HOH A2958 15.943 11.803 17.207 1.00 0.00 H 0 +HETATM 9198 O HOH A2959 4.548 51.236 0.531 1.00 0.00 O 0 +HETATM 9199 H1 HOH A2959 5.513 51.452 0.719 1.00 0.00 H 0 +HETATM 9200 H2 HOH A2959 4.555 50.313 0.145 1.00 0.00 H 0 +HETATM 9201 O HOH A2960 18.851 7.306 3.056 1.00 0.00 O 0 +HETATM 9202 H1 HOH A2960 18.384 7.314 2.251 1.00 0.00 H 0 +HETATM 9203 H2 HOH A2960 19.226 8.219 3.066 1.00 0.00 H 0 +HETATM 9204 O HOH A2961 29.382 4.846 48.167 1.00 0.00 O 0 +HETATM 9205 H1 HOH A2961 29.067 4.522 47.274 1.00 0.00 H 0 +HETATM 9206 H2 HOH A2961 30.321 4.757 48.182 1.00 0.00 H 0 +HETATM 9207 O HOH A2962 3.440 0.352 47.193 1.00 0.00 O 0 +HETATM 9208 H1 HOH A2962 2.502 0.651 47.193 1.00 0.00 H 0 +HETATM 9209 H2 HOH A2962 3.762 0.633 48.041 1.00 0.00 H 0 +HETATM 9210 O HOH A2963 28.753 23.722 47.582 1.00 0.00 O 0 +HETATM 9211 H1 HOH A2963 28.957 22.811 47.295 1.00 0.00 H 0 +HETATM 9212 H2 HOH A2963 29.384 24.300 47.090 1.00 0.00 H 0 +HETATM 9213 O HOH A2964 18.845 36.554 34.003 1.00 0.00 O 0 +HETATM 9214 H1 HOH A2964 18.578 35.615 34.032 1.00 0.00 H 0 +HETATM 9215 H2 HOH A2964 19.568 36.570 34.669 1.00 0.00 H 0 +HETATM 9216 O HOH A2965 15.994 35.753 1.866 1.00 0.00 O 0 +HETATM 9217 H1 HOH A2965 16.114 36.350 1.171 1.00 0.00 H 0 +HETATM 9218 H2 HOH A2965 16.898 35.500 2.225 1.00 0.00 H 0 +HETATM 9219 O HOH A2966 46.901 46.411 2.284 1.00 0.00 O 0 +HETATM 9220 H1 HOH A2966 46.876 47.233 1.732 1.00 0.00 H 0 +HETATM 9221 H2 HOH A2966 46.869 45.645 1.632 1.00 0.00 H 0 +HETATM 9222 O HOH A2967 16.311 6.478 12.632 1.00 0.00 O 0 +HETATM 9223 H1 HOH A2967 15.986 6.040 13.410 1.00 0.00 H 0 +HETATM 9224 H2 HOH A2967 16.710 7.241 12.901 1.00 0.00 H 0 +HETATM 9225 O HOH A2968 48.157 35.828 15.991 1.00 0.00 O 0 +HETATM 9226 H1 HOH A2968 48.238 36.728 15.727 1.00 0.00 H 0 +HETATM 9227 H2 HOH A2968 48.544 35.876 16.863 1.00 0.00 H 0 +HETATM 9228 O HOH A2969 23.036 19.101 0.748 1.00 0.00 O 0 +HETATM 9229 H1 HOH A2969 23.347 18.876 1.614 1.00 0.00 H 0 +HETATM 9230 H2 HOH A2969 22.479 19.870 0.854 1.00 0.00 H 0 +HETATM 9231 O HOH A2970 23.381 32.863 43.108 1.00 0.00 O 0 +HETATM 9232 H1 HOH A2970 22.394 32.851 43.160 1.00 0.00 H 0 +HETATM 9233 H2 HOH A2970 23.797 32.009 43.368 1.00 0.00 H 0 +HETATM 9234 O HOH A2971 30.777 11.854 37.450 1.00 0.00 O 0 +HETATM 9235 H1 HOH A2971 31.242 12.147 38.263 1.00 0.00 H 0 +HETATM 9236 H2 HOH A2971 31.453 11.906 36.836 1.00 0.00 H 0 +HETATM 9237 O HOH A2972 45.624 15.533 34.709 1.00 0.00 O 0 +HETATM 9238 H1 HOH A2972 45.738 14.571 34.623 1.00 0.00 H 0 +HETATM 9239 H2 HOH A2972 44.662 15.721 34.475 1.00 0.00 H 0 +HETATM 9240 O HOH A2973 27.193 1.086 19.140 1.00 0.00 O 0 +HETATM 9241 H1 HOH A2973 27.226 0.569 19.919 1.00 0.00 H 0 +HETATM 9242 H2 HOH A2973 26.606 0.548 18.637 1.00 0.00 H 0 +HETATM 9243 O HOH A2974 53.353 39.969 36.167 1.00 0.00 O 0 +HETATM 9244 H1 HOH A2974 53.070 39.213 35.670 1.00 0.00 H 0 +HETATM 9245 H2 HOH A2974 53.320 39.701 37.040 1.00 0.00 H 0 +HETATM 9246 O HOH A2975 9.126 28.924 23.660 1.00 0.00 O 0 +HETATM 9247 H1 HOH A2975 8.547 29.638 24.054 1.00 0.00 H 0 +HETATM 9248 H2 HOH A2975 10.026 29.281 23.519 1.00 0.00 H 0 +HETATM 9249 O HOH A2976 9.041 15.579 9.578 1.00 0.00 O 0 +HETATM 9250 H1 HOH A2976 8.453 15.840 10.275 1.00 0.00 H 0 +HETATM 9251 H2 HOH A2976 9.768 15.119 9.978 1.00 0.00 H 0 +HETATM 9252 O HOH A2977 17.459 25.633 10.276 1.00 0.00 O 0 +HETATM 9253 H1 HOH A2977 17.198 25.323 9.388 1.00 0.00 H 0 +HETATM 9254 H2 HOH A2977 17.326 24.901 10.856 1.00 0.00 H 0 +HETATM 9255 O HOH A2978 38.933 41.437 46.920 1.00 0.00 O 0 +HETATM 9256 H1 HOH A2978 38.087 41.146 46.582 1.00 0.00 H 0 +HETATM 9257 H2 HOH A2978 39.125 42.281 46.434 1.00 0.00 H 0 +HETATM 9258 O HOH A2979 44.408 38.125 44.548 1.00 0.00 O 0 +HETATM 9259 H1 HOH A2979 45.340 38.459 44.446 1.00 0.00 H 0 +HETATM 9260 H2 HOH A2979 43.938 38.969 44.391 1.00 0.00 H 0 +HETATM 9261 O HOH A2980 50.445 41.437 18.221 1.00 0.00 O 0 +HETATM 9262 H1 HOH A2980 50.648 41.598 17.272 1.00 0.00 H 0 +HETATM 9263 H2 HOH A2980 49.982 40.600 18.270 1.00 0.00 H 0 +HETATM 9264 O HOH A2981 16.314 38.756 17.985 1.00 0.00 O 0 +HETATM 9265 H1 HOH A2981 16.236 38.216 17.190 1.00 0.00 H 0 +HETATM 9266 H2 HOH A2981 17.293 38.892 18.196 1.00 0.00 H 0 +HETATM 9267 O HOH A2982 40.524 18.394 47.063 1.00 0.00 O 0 +HETATM 9268 H1 HOH A2982 41.170 18.201 46.344 1.00 0.00 H 0 +HETATM 9269 H2 HOH A2982 40.054 19.245 46.954 1.00 0.00 H 0 +HETATM 9270 O HOH A2983 34.518 21.976 7.004 1.00 0.00 O 0 +HETATM 9271 H1 HOH A2983 35.084 21.187 7.172 1.00 0.00 H 0 +HETATM 9272 H2 HOH A2983 34.870 22.389 6.204 1.00 0.00 H 0 +HETATM 9273 O HOH A2984 2.854 21.062 30.229 1.00 0.00 O 0 +HETATM 9274 H1 HOH A2984 2.940 22.032 30.140 1.00 0.00 H 0 +HETATM 9275 H2 HOH A2984 3.638 20.755 30.661 1.00 0.00 H 0 +HETATM 9276 O HOH A2985 52.431 48.166 23.535 1.00 0.00 O 0 +HETATM 9277 H1 HOH A2985 52.628 49.091 23.574 1.00 0.00 H 0 +HETATM 9278 H2 HOH A2985 53.332 47.816 23.581 1.00 0.00 H 0 +HETATM 9279 O HOH A2986 46.835 22.379 46.259 1.00 0.00 O 0 +HETATM 9280 H1 HOH A2986 46.942 21.451 46.243 1.00 0.00 H 0 +HETATM 9281 H2 HOH A2986 45.918 22.530 46.524 1.00 0.00 H 0 +HETATM 9282 O HOH A2987 19.358 32.072 46.692 1.00 0.00 O 0 +HETATM 9283 H1 HOH A2987 20.093 32.677 46.501 1.00 0.00 H 0 +HETATM 9284 H2 HOH A2987 18.695 32.507 47.303 1.00 0.00 H 0 +HETATM 9285 O HOH A2988 4.630 23.437 47.279 1.00 0.00 O 0 +HETATM 9286 H1 HOH A2988 4.474 23.745 46.409 1.00 0.00 H 0 +HETATM 9287 H2 HOH A2988 5.413 22.883 47.134 1.00 0.00 H 0 +HETATM 9288 O HOH A2989 19.334 10.192 33.234 1.00 0.00 O 0 +HETATM 9289 H1 HOH A2989 18.750 10.422 32.525 1.00 0.00 H 0 +HETATM 9290 H2 HOH A2989 18.833 10.191 34.079 1.00 0.00 H 0 +HETATM 9291 O HOH A2990 22.316 43.425 9.334 1.00 0.00 O 0 +HETATM 9292 H1 HOH A2990 22.029 43.993 8.605 1.00 0.00 H 0 +HETATM 9293 H2 HOH A2990 21.634 43.734 9.991 1.00 0.00 H 0 +HETATM 9294 O HOH A2991 52.607 53.153 45.365 1.00 0.00 O 0 +HETATM 9295 H1 HOH A2991 52.120 53.476 44.582 1.00 0.00 H 0 +HETATM 9296 H2 HOH A2991 52.039 52.646 45.947 1.00 0.00 H 0 +HETATM 9297 O HOH A2992 39.437 27.521 43.890 1.00 0.00 O 0 +HETATM 9298 H1 HOH A2992 40.278 27.080 43.788 1.00 0.00 H 0 +HETATM 9299 H2 HOH A2992 39.411 27.976 43.063 1.00 0.00 H 0 +HETATM 9300 O HOH A2993 42.604 20.047 4.499 1.00 0.00 O 0 +HETATM 9301 H1 HOH A2993 42.735 19.875 5.388 1.00 0.00 H 0 +HETATM 9302 H2 HOH A2993 42.675 20.989 4.261 1.00 0.00 H 0 +HETATM 9303 O HOH A2994 37.414 7.147 41.206 1.00 0.00 O 0 +HETATM 9304 H1 HOH A2994 36.964 6.438 41.628 1.00 0.00 H 0 +HETATM 9305 H2 HOH A2994 37.443 7.843 41.835 1.00 0.00 H 0 +HETATM 9306 O HOH A2995 22.869 43.471 12.500 1.00 0.00 O 0 +HETATM 9307 H1 HOH A2995 22.941 43.772 13.422 1.00 0.00 H 0 +HETATM 9308 H2 HOH A2995 22.407 42.585 12.499 1.00 0.00 H 0 +HETATM 9309 O HOH A2996 50.146 25.012 6.431 1.00 0.00 O 0 +HETATM 9310 H1 HOH A2996 50.872 25.656 6.319 1.00 0.00 H 0 +HETATM 9311 H2 HOH A2996 49.653 24.929 5.566 1.00 0.00 H 0 +HETATM 9312 O HOH A2997 8.869 38.987 34.812 1.00 0.00 O 0 +HETATM 9313 H1 HOH A2997 8.480 38.198 34.407 1.00 0.00 H 0 +HETATM 9314 H2 HOH A2997 8.541 39.727 34.188 1.00 0.00 H 0 +HETATM 9315 O HOH A2998 29.656 -0.060 30.954 1.00 0.00 O 0 +HETATM 9316 H1 HOH A2998 29.796 -0.490 30.071 1.00 0.00 H 0 +HETATM 9317 H2 HOH A2998 30.443 0.526 31.034 1.00 0.00 H 0 +HETATM 9318 O HOH A2999 7.505 46.188 49.198 1.00 0.00 O 0 +HETATM 9319 H1 HOH A2999 8.240 45.909 49.674 1.00 0.00 H 0 +HETATM 9320 H2 HOH A2999 6.970 46.745 49.752 1.00 0.00 H 0 +HETATM 9321 O HOH A3000 31.137 13.266 1.545 1.00 0.00 O 0 +HETATM 9322 H1 HOH A3000 31.790 12.595 1.441 1.00 0.00 H 0 +HETATM 9323 H2 HOH A3000 31.610 14.046 1.417 1.00 0.00 H 0 +HETATM 9324 O HOH A3001 48.700 48.267 52.867 1.00 0.00 O 0 +HETATM 9325 H1 HOH A3001 48.120 48.530 53.619 1.00 0.00 H 0 +HETATM 9326 H2 HOH A3001 49.524 48.078 53.212 1.00 0.00 H 0 +HETATM 9327 O HOH A3002 9.120 34.694 41.869 1.00 0.00 O 0 +HETATM 9328 H1 HOH A3002 9.572 33.854 41.889 1.00 0.00 H 0 +HETATM 9329 H2 HOH A3002 9.779 35.286 41.560 1.00 0.00 H 0 +HETATM 9330 O HOH A3003 15.741 8.055 46.175 1.00 0.00 O 0 +HETATM 9331 H1 HOH A3003 15.656 8.195 47.160 1.00 0.00 H 0 +HETATM 9332 H2 HOH A3003 16.238 7.205 46.139 1.00 0.00 H 0 +HETATM 9333 O HOH A3004 2.566 26.192 8.637 1.00 0.00 O 0 +HETATM 9334 H1 HOH A3004 2.623 25.218 8.586 1.00 0.00 H 0 +HETATM 9335 H2 HOH A3004 1.689 26.551 8.799 1.00 0.00 H 0 +HETATM 9336 O HOH A3005 11.586 10.863 30.971 1.00 0.00 O 0 +HETATM 9337 H1 HOH A3005 12.472 10.947 30.714 1.00 0.00 H 0 +HETATM 9338 H2 HOH A3005 11.149 11.559 30.479 1.00 0.00 H 0 +HETATM 9339 O HOH A3006 51.775 26.174 48.864 1.00 0.00 O 0 +HETATM 9340 H1 HOH A3006 52.530 26.405 49.394 1.00 0.00 H 0 +HETATM 9341 H2 HOH A3006 51.449 25.274 49.021 1.00 0.00 H 0 +HETATM 9342 O HOH A3007 35.396 12.297 28.757 1.00 0.00 O 0 +HETATM 9343 H1 HOH A3007 35.212 13.256 28.957 1.00 0.00 H 0 +HETATM 9344 H2 HOH A3007 35.256 12.318 27.764 1.00 0.00 H 0 +HETATM 9345 O HOH A3008 18.910 25.642 41.325 1.00 0.00 O 0 +HETATM 9346 H1 HOH A3008 18.036 25.315 41.073 1.00 0.00 H 0 +HETATM 9347 H2 HOH A3008 19.003 26.566 41.117 1.00 0.00 H 0 +HETATM 9348 O HOH A3009 53.827 29.276 32.378 1.00 0.00 O 0 +HETATM 9349 H1 HOH A3009 52.925 29.543 32.692 1.00 0.00 H 0 +HETATM 9350 H2 HOH A3009 53.681 28.909 31.475 1.00 0.00 H 0 +HETATM 9351 O HOH A3010 47.394 31.364 32.120 1.00 0.00 O 0 +HETATM 9352 H1 HOH A3010 47.249 30.898 31.198 1.00 0.00 H 0 +HETATM 9353 H2 HOH A3010 46.570 31.844 32.377 1.00 0.00 H 0 +HETATM 9354 O HOH A3011 10.982 25.707 32.088 1.00 0.00 O 0 +HETATM 9355 H1 HOH A3011 10.338 26.409 32.265 1.00 0.00 H 0 +HETATM 9356 H2 HOH A3011 10.638 25.057 31.475 1.00 0.00 H 0 +HETATM 9357 O HOH A3012 20.638 52.230 44.884 1.00 0.00 O 0 +HETATM 9358 H1 HOH A3012 20.651 51.408 45.337 1.00 0.00 H 0 +HETATM 9359 H2 HOH A3012 20.205 52.067 44.002 1.00 0.00 H 0 +HETATM 9360 O HOH A3013 44.536 41.580 31.835 1.00 0.00 O 0 +HETATM 9361 H1 HOH A3013 43.937 42.417 32.054 1.00 0.00 H 0 +HETATM 9362 H2 HOH A3013 45.477 41.953 31.752 1.00 0.00 H 0 +HETATM 9363 O HOH A3014 42.638 24.805 47.511 1.00 0.00 O 0 +HETATM 9364 H1 HOH A3014 41.736 25.088 47.490 1.00 0.00 H 0 +HETATM 9365 H2 HOH A3014 43.212 25.553 47.818 1.00 0.00 H 0 +HETATM 9366 O HOH A3015 29.252 42.747 32.012 1.00 0.00 O 0 +HETATM 9367 H1 HOH A3015 29.503 42.013 31.459 1.00 0.00 H 0 +HETATM 9368 H2 HOH A3015 29.985 42.800 32.661 1.00 0.00 H 0 +HETATM 9369 O HOH A3016 5.419 6.955 2.606 1.00 0.00 O 0 +HETATM 9370 H1 HOH A3016 5.707 6.891 3.516 1.00 0.00 H 0 +HETATM 9371 H2 HOH A3016 6.155 6.618 2.134 1.00 0.00 H 0 +HETATM 9372 O HOH A3017 22.011 25.325 1.318 1.00 0.00 O 0 +HETATM 9373 H1 HOH A3017 22.680 25.020 1.914 1.00 0.00 H 0 +HETATM 9374 H2 HOH A3017 21.275 24.643 1.424 1.00 0.00 H 0 +HETATM 9375 O HOH A3018 19.927 2.506 18.558 1.00 0.00 O 0 +HETATM 9376 H1 HOH A3018 20.395 3.372 18.643 1.00 0.00 H 0 +HETATM 9377 H2 HOH A3018 19.006 2.616 18.628 1.00 0.00 H 0 +HETATM 9378 O HOH A3019 29.542 52.991 20.536 1.00 0.00 O 0 +HETATM 9379 H1 HOH A3019 29.316 53.564 21.301 1.00 0.00 H 0 +HETATM 9380 H2 HOH A3019 30.516 52.941 20.486 1.00 0.00 H 0 +HETATM 9381 O HOH A3020 47.020 35.829 26.028 1.00 0.00 O 0 +HETATM 9382 H1 HOH A3020 46.635 36.633 25.736 1.00 0.00 H 0 +HETATM 9383 H2 HOH A3020 47.533 36.116 26.798 1.00 0.00 H 0 +HETATM 9384 O HOH A3021 13.667 25.034 50.405 1.00 0.00 O 0 +HETATM 9385 H1 HOH A3021 14.207 25.661 49.896 1.00 0.00 H 0 +HETATM 9386 H2 HOH A3021 13.385 25.401 51.258 1.00 0.00 H 0 +HETATM 9387 O HOH A3022 8.220 7.158 35.505 1.00 0.00 O 0 +HETATM 9388 H1 HOH A3022 9.040 7.186 34.981 1.00 0.00 H 0 +HETATM 9389 H2 HOH A3022 8.342 7.984 35.998 1.00 0.00 H 0 +HETATM 9390 O HOH A3023 30.262 9.523 4.852 1.00 0.00 O 0 +HETATM 9391 H1 HOH A3023 29.383 9.295 5.188 1.00 0.00 H 0 +HETATM 9392 H2 HOH A3023 30.171 10.316 4.370 1.00 0.00 H 0 +HETATM 9393 O HOH A3024 23.409 44.346 47.754 1.00 0.00 O 0 +HETATM 9394 H1 HOH A3024 22.868 44.723 47.081 1.00 0.00 H 0 +HETATM 9395 H2 HOH A3024 23.514 45.075 48.431 1.00 0.00 H 0 +HETATM 9396 O HOH A3025 21.023 44.343 27.058 1.00 0.00 O 0 +HETATM 9397 H1 HOH A3025 21.813 43.845 27.443 1.00 0.00 H 0 +HETATM 9398 H2 HOH A3025 20.324 43.909 27.515 1.00 0.00 H 0 +HETATM 9399 O HOH A3026 14.178 52.261 35.842 1.00 0.00 O 0 +HETATM 9400 H1 HOH A3026 14.949 52.797 35.451 1.00 0.00 H 0 +HETATM 9401 H2 HOH A3026 13.661 52.788 36.456 1.00 0.00 H 0 +HETATM 9402 O HOH A3027 11.553 21.503 33.129 1.00 0.00 O 0 +HETATM 9403 H1 HOH A3027 10.707 21.751 32.802 1.00 0.00 H 0 +HETATM 9404 H2 HOH A3027 12.008 22.313 33.349 1.00 0.00 H 0 +HETATM 9405 O HOH A3028 51.705 8.578 1.905 1.00 0.00 O 0 +HETATM 9406 H1 HOH A3028 51.777 8.331 0.968 1.00 0.00 H 0 +HETATM 9407 H2 HOH A3028 50.895 9.038 1.921 1.00 0.00 H 0 +HETATM 9408 O HOH A3029 50.511 27.529 12.618 1.00 0.00 O 0 +HETATM 9409 H1 HOH A3029 50.870 28.041 13.403 1.00 0.00 H 0 +HETATM 9410 H2 HOH A3029 49.594 27.348 12.729 1.00 0.00 H 0 +HETATM 9411 O HOH A3030 30.400 8.968 12.673 1.00 0.00 O 0 +HETATM 9412 H1 HOH A3030 31.275 9.352 12.648 1.00 0.00 H 0 +HETATM 9413 H2 HOH A3030 30.052 9.427 13.460 1.00 0.00 H 0 +HETATM 9414 O HOH A3031 42.919 40.338 40.216 1.00 0.00 O 0 +HETATM 9415 H1 HOH A3031 43.266 41.241 40.080 1.00 0.00 H 0 +HETATM 9416 H2 HOH A3031 42.361 40.235 39.454 1.00 0.00 H 0 +HETATM 9417 O HOH A3032 5.307 13.937 47.659 1.00 0.00 O 0 +HETATM 9418 H1 HOH A3032 4.817 13.885 46.858 1.00 0.00 H 0 +HETATM 9419 H2 HOH A3032 4.754 14.310 48.371 1.00 0.00 H 0 +HETATM 9420 O HOH A3033 35.116 50.472 49.326 1.00 0.00 O 0 +HETATM 9421 H1 HOH A3033 34.238 50.430 49.066 1.00 0.00 H 0 +HETATM 9422 H2 HOH A3033 35.205 50.952 50.140 1.00 0.00 H 0 +HETATM 9423 O HOH A3034 3.082 35.356 13.883 1.00 0.00 O 0 +HETATM 9424 H1 HOH A3034 3.702 35.120 14.571 1.00 0.00 H 0 +HETATM 9425 H2 HOH A3034 3.394 34.939 13.098 1.00 0.00 H 0 +HETATM 9426 O HOH A3035 4.073 39.194 5.138 1.00 0.00 O 0 +HETATM 9427 H1 HOH A3035 4.310 40.061 4.774 1.00 0.00 H 0 +HETATM 9428 H2 HOH A3035 4.535 39.045 5.978 1.00 0.00 H 0 +HETATM 9429 O HOH A3036 46.285 25.970 51.096 1.00 0.00 O 0 +HETATM 9430 H1 HOH A3036 46.529 25.064 51.364 1.00 0.00 H 0 +HETATM 9431 H2 HOH A3036 46.976 26.337 50.547 1.00 0.00 H 0 +HETATM 9432 O HOH A3037 29.625 5.740 45.398 1.00 0.00 O 0 +HETATM 9433 H1 HOH A3037 30.535 5.487 45.481 1.00 0.00 H 0 +HETATM 9434 H2 HOH A3037 29.431 6.437 45.996 1.00 0.00 H 0 +HETATM 9435 O HOH A3038 40.793 23.858 12.197 1.00 0.00 O 0 +HETATM 9436 H1 HOH A3038 40.734 23.841 13.160 1.00 0.00 H 0 +HETATM 9437 H2 HOH A3038 39.792 23.764 11.941 1.00 0.00 H 0 +HETATM 9438 O HOH A3039 11.975 30.570 3.475 1.00 0.00 O 0 +HETATM 9439 H1 HOH A3039 11.891 29.820 2.839 1.00 0.00 H 0 +HETATM 9440 H2 HOH A3039 11.463 31.340 3.055 1.00 0.00 H 0 +HETATM 9441 O HOH A3040 34.064 5.686 16.686 1.00 0.00 O 0 +HETATM 9442 H1 HOH A3040 34.462 5.108 16.085 1.00 0.00 H 0 +HETATM 9443 H2 HOH A3040 34.365 6.585 16.538 1.00 0.00 H 0 +HETATM 9444 O HOH A3041 27.891 43.914 7.093 1.00 0.00 O 0 +HETATM 9445 H1 HOH A3041 27.197 43.480 6.547 1.00 0.00 H 0 +HETATM 9446 H2 HOH A3041 28.767 43.773 6.779 1.00 0.00 H 0 +HETATM 9447 O HOH A3042 39.848 13.582 32.782 1.00 0.00 O 0 +HETATM 9448 H1 HOH A3042 40.471 14.183 33.147 1.00 0.00 H 0 +HETATM 9449 H2 HOH A3042 40.127 12.666 33.218 1.00 0.00 H 0 +HETATM 9450 O HOH A3043 53.510 20.438 35.894 1.00 0.00 O 0 +HETATM 9451 H1 HOH A3043 54.448 20.213 35.998 1.00 0.00 H 0 +HETATM 9452 H2 HOH A3043 52.957 19.830 36.369 1.00 0.00 H 0 +HETATM 9453 O HOH A3044 9.023 27.703 32.526 1.00 0.00 O 0 +HETATM 9454 H1 HOH A3044 8.447 28.034 31.880 1.00 0.00 H 0 +HETATM 9455 H2 HOH A3044 9.548 28.396 32.915 1.00 0.00 H 0 +HETATM 9456 O HOH A3045 13.987 29.491 40.838 1.00 0.00 O 0 +HETATM 9457 H1 HOH A3045 13.705 29.768 39.991 1.00 0.00 H 0 +HETATM 9458 H2 HOH A3045 14.080 28.501 40.775 1.00 0.00 H 0 +HETATM 9459 O HOH A3046 47.995 13.352 6.880 1.00 0.00 O 0 +HETATM 9460 H1 HOH A3046 47.793 13.738 7.772 1.00 0.00 H 0 +HETATM 9461 H2 HOH A3046 49.007 13.300 6.832 1.00 0.00 H 0 +HETATM 9462 O HOH A3047 34.453 5.611 36.678 1.00 0.00 O 0 +HETATM 9463 H1 HOH A3047 33.734 6.239 36.508 1.00 0.00 H 0 +HETATM 9464 H2 HOH A3047 34.857 5.922 37.511 1.00 0.00 H 0 +HETATM 9465 O HOH A3048 35.445 46.370 33.159 1.00 0.00 O 0 +HETATM 9466 H1 HOH A3048 35.757 46.019 32.337 1.00 0.00 H 0 +HETATM 9467 H2 HOH A3048 35.932 45.822 33.871 1.00 0.00 H 0 +HETATM 9468 O HOH A3049 15.578 33.014 48.904 1.00 0.00 O 0 +HETATM 9469 H1 HOH A3049 15.000 33.696 48.531 1.00 0.00 H 0 +HETATM 9470 H2 HOH A3049 15.777 32.322 48.232 1.00 0.00 H 0 +HETATM 9471 O HOH A3050 47.996 26.889 8.448 1.00 0.00 O 0 +HETATM 9472 H1 HOH A3050 48.477 27.363 7.754 1.00 0.00 H 0 +HETATM 9473 H2 HOH A3050 47.381 27.551 8.741 1.00 0.00 H 0 +HETATM 9474 O HOH A3051 30.882 27.084 39.281 1.00 0.00 O 0 +HETATM 9475 H1 HOH A3051 30.106 26.776 39.844 1.00 0.00 H 0 +HETATM 9476 H2 HOH A3051 31.616 26.433 39.400 1.00 0.00 H 0 +HETATM 9477 O HOH A3052 9.186 39.393 46.387 1.00 0.00 O 0 +HETATM 9478 H1 HOH A3052 9.021 40.325 46.128 1.00 0.00 H 0 +HETATM 9479 H2 HOH A3052 8.458 39.085 46.994 1.00 0.00 H 0 +HETATM 9480 O HOH A3053 31.191 42.151 24.057 1.00 0.00 O 0 +HETATM 9481 H1 HOH A3053 30.946 42.144 24.979 1.00 0.00 H 0 +HETATM 9482 H2 HOH A3053 30.602 42.813 23.686 1.00 0.00 H 0 +HETATM 9483 O HOH A3054 7.867 47.682 23.114 1.00 0.00 O 0 +HETATM 9484 H1 HOH A3054 8.384 48.054 22.342 1.00 0.00 H 0 +HETATM 9485 H2 HOH A3054 7.256 48.424 23.452 1.00 0.00 H 0 +HETATM 9486 O HOH A3055 44.569 6.935 32.582 1.00 0.00 O 0 +HETATM 9487 H1 HOH A3055 44.374 6.587 31.700 1.00 0.00 H 0 +HETATM 9488 H2 HOH A3055 45.483 7.101 32.561 1.00 0.00 H 0 +HETATM 9489 O HOH A3056 44.222 24.123 15.949 1.00 0.00 O 0 +HETATM 9490 H1 HOH A3056 44.091 23.362 16.526 1.00 0.00 H 0 +HETATM 9491 H2 HOH A3056 43.670 24.880 16.238 1.00 0.00 H 0 +HETATM 9492 O HOH A3057 50.357 52.983 40.092 1.00 0.00 O 0 +HETATM 9493 H1 HOH A3057 51.238 53.355 40.335 1.00 0.00 H 0 +HETATM 9494 H2 HOH A3057 50.479 52.047 39.706 1.00 0.00 H 0 +HETATM 9495 O HOH A3058 25.600 44.506 25.728 1.00 0.00 O 0 +HETATM 9496 H1 HOH A3058 25.816 43.585 25.341 1.00 0.00 H 0 +HETATM 9497 H2 HOH A3058 25.671 44.299 26.625 1.00 0.00 H 0 +HETATM 9498 O HOH A3059 5.989 37.409 40.924 1.00 0.00 O 0 +HETATM 9499 H1 HOH A3059 5.029 37.302 40.695 1.00 0.00 H 0 +HETATM 9500 H2 HOH A3059 5.994 37.205 41.846 1.00 0.00 H 0 +HETATM 9501 O HOH A3060 28.520 35.395 27.337 1.00 0.00 O 0 +HETATM 9502 H1 HOH A3060 28.833 34.453 27.168 1.00 0.00 H 0 +HETATM 9503 H2 HOH A3060 28.781 35.484 28.214 1.00 0.00 H 0 +HETATM 9504 O HOH A3061 47.268 6.417 15.813 1.00 0.00 O 0 +HETATM 9505 H1 HOH A3061 46.683 6.747 16.528 1.00 0.00 H 0 +HETATM 9506 H2 HOH A3061 47.581 5.493 16.055 1.00 0.00 H 0 +HETATM 9507 O HOH A3062 24.148 53.673 13.863 1.00 0.00 O 0 +HETATM 9508 H1 HOH A3062 25.048 53.609 14.162 1.00 0.00 H 0 +HETATM 9509 H2 HOH A3062 23.707 52.810 14.017 1.00 0.00 H 0 +HETATM 9510 O HOH A3063 34.111 30.634 13.780 1.00 0.00 O 0 +HETATM 9511 H1 HOH A3063 34.745 30.696 14.511 1.00 0.00 H 0 +HETATM 9512 H2 HOH A3063 33.449 29.996 14.113 1.00 0.00 H 0 +HETATM 9513 O HOH A3064 25.988 38.810 41.134 1.00 0.00 O 0 +HETATM 9514 H1 HOH A3064 25.579 38.076 40.676 1.00 0.00 H 0 +HETATM 9515 H2 HOH A3064 26.409 38.442 41.875 1.00 0.00 H 0 +HETATM 9516 O HOH A3065 38.099 21.353 9.139 1.00 0.00 O 0 +HETATM 9517 H1 HOH A3065 38.282 22.252 8.916 1.00 0.00 H 0 +HETATM 9518 H2 HOH A3065 38.002 21.348 10.116 1.00 0.00 H 0 +HETATM 9519 O HOH A3066 40.168 17.883 17.621 1.00 0.00 O 0 +HETATM 9520 H1 HOH A3066 40.238 18.890 17.584 1.00 0.00 H 0 +HETATM 9521 H2 HOH A3066 40.951 17.527 18.044 1.00 0.00 H 0 +HETATM 9522 O HOH A3067 37.691 21.977 40.749 1.00 0.00 O 0 +HETATM 9523 H1 HOH A3067 37.438 22.111 39.812 1.00 0.00 H 0 +HETATM 9524 H2 HOH A3067 37.333 21.123 41.024 1.00 0.00 H 0 +HETATM 9525 O HOH A3068 49.276 31.612 2.217 1.00 0.00 O 0 +HETATM 9526 H1 HOH A3068 49.896 32.401 2.181 1.00 0.00 H 0 +HETATM 9527 H2 HOH A3068 49.710 30.964 1.698 1.00 0.00 H 0 +HETATM 9528 O HOH A3069 15.336 49.933 3.762 1.00 0.00 O 0 +HETATM 9529 H1 HOH A3069 15.875 49.883 4.556 1.00 0.00 H 0 +HETATM 9530 H2 HOH A3069 15.976 49.952 3.027 1.00 0.00 H 0 +HETATM 9531 O HOH A3070 35.751 39.639 5.976 1.00 0.00 O 0 +HETATM 9532 H1 HOH A3070 35.953 38.788 5.695 1.00 0.00 H 0 +HETATM 9533 H2 HOH A3070 34.908 39.936 5.559 1.00 0.00 H 0 +HETATM 9534 O HOH A3071 36.530 11.577 7.694 1.00 0.00 O 0 +HETATM 9535 H1 HOH A3071 35.813 11.102 8.050 1.00 0.00 H 0 +HETATM 9536 H2 HOH A3071 37.331 11.182 8.108 1.00 0.00 H 0 +HETATM 9537 O HOH A3072 37.757 21.152 17.093 1.00 0.00 O 0 +HETATM 9538 H1 HOH A3072 37.216 21.696 16.491 1.00 0.00 H 0 +HETATM 9539 H2 HOH A3072 37.311 20.300 17.177 1.00 0.00 H 0 +HETATM 9540 O HOH A3073 39.960 40.617 24.970 1.00 0.00 O 0 +HETATM 9541 H1 HOH A3073 40.005 40.317 24.031 1.00 0.00 H 0 +HETATM 9542 H2 HOH A3073 40.567 40.030 25.476 1.00 0.00 H 0 +HETATM 9543 O HOH A3074 40.049 52.968 2.268 1.00 0.00 O 0 +HETATM 9544 H1 HOH A3074 39.880 53.020 3.299 1.00 0.00 H 0 +HETATM 9545 H2 HOH A3074 40.758 53.539 2.062 1.00 0.00 H 0 +HETATM 9546 O HOH A3075 43.326 11.228 1.428 1.00 0.00 O 0 +HETATM 9547 H1 HOH A3075 42.711 11.893 1.837 1.00 0.00 H 0 +HETATM 9548 H2 HOH A3075 43.386 10.449 1.960 1.00 0.00 H 0 +HETATM 9549 O HOH A3076 25.873 13.826 46.372 1.00 0.00 O 0 +HETATM 9550 H1 HOH A3076 25.432 13.322 45.668 1.00 0.00 H 0 +HETATM 9551 H2 HOH A3076 26.276 14.606 46.001 1.00 0.00 H 0 +HETATM 9552 O HOH A3077 22.667 35.836 43.666 1.00 0.00 O 0 +HETATM 9553 H1 HOH A3077 23.571 36.005 43.303 1.00 0.00 H 0 +HETATM 9554 H2 HOH A3077 22.098 35.736 42.909 1.00 0.00 H 0 +HETATM 9555 O HOH A3078 35.056 2.747 23.491 1.00 0.00 O 0 +HETATM 9556 H1 HOH A3078 35.595 3.463 23.166 1.00 0.00 H 0 +HETATM 9557 H2 HOH A3078 34.340 2.619 22.890 1.00 0.00 H 0 +HETATM 9558 O HOH A3079 22.433 6.406 47.004 1.00 0.00 O 0 +HETATM 9559 H1 HOH A3079 21.499 6.110 46.986 1.00 0.00 H 0 +HETATM 9560 H2 HOH A3079 22.733 5.797 47.710 1.00 0.00 H 0 +HETATM 9561 O HOH A3080 40.128 37.197 43.691 1.00 0.00 O 0 +HETATM 9562 H1 HOH A3080 39.547 36.409 43.792 1.00 0.00 H 0 +HETATM 9563 H2 HOH A3080 40.831 37.142 44.391 1.00 0.00 H 0 +HETATM 9564 O HOH A3081 3.733 14.671 0.985 1.00 0.00 O 0 +HETATM 9565 H1 HOH A3081 4.165 15.257 1.641 1.00 0.00 H 0 +HETATM 9566 H2 HOH A3081 4.063 15.109 0.154 1.00 0.00 H 0 +HETATM 9567 O HOH A3082 2.473 47.342 53.482 1.00 0.00 O 0 +HETATM 9568 H1 HOH A3082 2.599 48.184 53.044 1.00 0.00 H 0 +HETATM 9569 H2 HOH A3082 2.460 47.639 54.421 1.00 0.00 H 0 +HETATM 9570 O HOH A3083 21.457 15.579 2.987 1.00 0.00 O 0 +HETATM 9571 H1 HOH A3083 21.423 16.582 2.784 1.00 0.00 H 0 +HETATM 9572 H2 HOH A3083 21.476 15.439 3.914 1.00 0.00 H 0 +HETATM 9573 O HOH A3084 4.081 23.649 18.345 1.00 0.00 O 0 +HETATM 9574 H1 HOH A3084 4.585 23.365 19.177 1.00 0.00 H 0 +HETATM 9575 H2 HOH A3084 4.084 22.871 17.791 1.00 0.00 H 0 +HETATM 9576 O HOH A3085 9.926 28.301 40.603 1.00 0.00 O 0 +HETATM 9577 H1 HOH A3085 10.095 28.792 39.763 1.00 0.00 H 0 +HETATM 9578 H2 HOH A3085 9.280 27.615 40.388 1.00 0.00 H 0 +HETATM 9579 O HOH A3086 47.169 11.370 33.084 1.00 0.00 O 0 +HETATM 9580 H1 HOH A3086 46.531 11.679 33.749 1.00 0.00 H 0 +HETATM 9581 H2 HOH A3086 46.719 11.586 32.285 1.00 0.00 H 0 +HETATM 9582 O HOH A3087 13.480 45.474 18.830 1.00 0.00 O 0 +HETATM 9583 H1 HOH A3087 14.411 45.121 18.686 1.00 0.00 H 0 +HETATM 9584 H2 HOH A3087 13.044 44.893 19.440 1.00 0.00 H 0 +HETATM 9585 O HOH A3088 13.634 25.127 7.701 1.00 0.00 O 0 +HETATM 9586 H1 HOH A3088 14.184 25.226 6.873 1.00 0.00 H 0 +HETATM 9587 H2 HOH A3088 14.209 24.653 8.246 1.00 0.00 H 0 +HETATM 9588 O HOH A3089 1.653 50.288 45.174 1.00 0.00 O 0 +HETATM 9589 H1 HOH A3089 1.546 51.206 44.867 1.00 0.00 H 0 +HETATM 9590 H2 HOH A3089 0.806 49.987 45.550 1.00 0.00 H 0 +HETATM 9591 O HOH A3090 43.418 22.021 34.898 1.00 0.00 O 0 +HETATM 9592 H1 HOH A3090 44.194 22.519 35.254 1.00 0.00 H 0 +HETATM 9593 H2 HOH A3090 43.774 21.459 34.180 1.00 0.00 H 0 +HETATM 9594 O HOH A3091 17.042 38.778 39.053 1.00 0.00 O 0 +HETATM 9595 H1 HOH A3091 17.248 37.818 38.859 1.00 0.00 H 0 +HETATM 9596 H2 HOH A3091 16.671 39.209 38.240 1.00 0.00 H 0 +HETATM 9597 O HOH A3092 35.507 38.061 36.704 1.00 0.00 O 0 +HETATM 9598 H1 HOH A3092 34.732 37.511 36.520 1.00 0.00 H 0 +HETATM 9599 H2 HOH A3092 35.963 37.868 37.537 1.00 0.00 H 0 +HETATM 9600 O HOH A3093 2.290 10.176 34.676 1.00 0.00 O 0 +HETATM 9601 H1 HOH A3093 1.352 10.375 34.485 1.00 0.00 H 0 +HETATM 9602 H2 HOH A3093 2.704 10.921 34.280 1.00 0.00 H 0 +HETATM 9603 O HOH A3094 47.764 52.990 41.012 1.00 0.00 O 0 +HETATM 9604 H1 HOH A3094 48.655 53.019 40.600 1.00 0.00 H 0 +HETATM 9605 H2 HOH A3094 47.093 52.886 40.270 1.00 0.00 H 0 +HETATM 9606 O HOH A3095 36.738 32.036 12.445 1.00 0.00 O 0 +HETATM 9607 H1 HOH A3095 37.159 31.879 13.318 1.00 0.00 H 0 +HETATM 9608 H2 HOH A3095 36.629 32.980 12.293 1.00 0.00 H 0 +HETATM 9609 O HOH A3096 9.063 49.883 0.564 1.00 0.00 O 0 +HETATM 9610 H1 HOH A3096 9.884 49.828 1.122 1.00 0.00 H 0 +HETATM 9611 H2 HOH A3096 9.200 49.462 -0.294 1.00 0.00 H 0 +HETATM 9612 O HOH A3097 0.728 23.818 35.975 1.00 0.00 O 0 +HETATM 9613 H1 HOH A3097 -0.150 24.145 35.976 1.00 0.00 H 0 +HETATM 9614 H2 HOH A3097 0.792 23.380 35.138 1.00 0.00 H 0 +HETATM 9615 O HOH A3098 6.658 36.442 49.609 1.00 0.00 O 0 +HETATM 9616 H1 HOH A3098 6.025 37.100 49.937 1.00 0.00 H 0 +HETATM 9617 H2 HOH A3098 6.966 36.810 48.685 1.00 0.00 H 0 +HETATM 9618 O HOH A3099 12.514 35.750 13.359 1.00 0.00 O 0 +HETATM 9619 H1 HOH A3099 12.899 36.650 13.245 1.00 0.00 H 0 +HETATM 9620 H2 HOH A3099 12.083 35.684 14.237 1.00 0.00 H 0 +HETATM 9621 O HOH A3100 50.612 12.282 4.219 1.00 0.00 O 0 +HETATM 9622 H1 HOH A3100 50.632 12.882 4.966 1.00 0.00 H 0 +HETATM 9623 H2 HOH A3100 51.292 11.564 4.359 1.00 0.00 H 0 +HETATM 9624 O HOH A3101 34.598 49.522 12.300 1.00 0.00 O 0 +HETATM 9625 H1 HOH A3101 34.334 50.266 11.780 1.00 0.00 H 0 +HETATM 9626 H2 HOH A3101 33.849 48.995 12.293 1.00 0.00 H 0 +HETATM 9627 O HOH A3102 28.104 40.600 17.746 1.00 0.00 O 0 +HETATM 9628 H1 HOH A3102 28.821 40.386 18.422 1.00 0.00 H 0 +HETATM 9629 H2 HOH A3102 27.572 39.775 17.647 1.00 0.00 H 0 +HETATM 9630 O HOH A3103 22.866 7.758 25.040 1.00 0.00 O 0 +HETATM 9631 H1 HOH A3103 23.683 7.820 25.534 1.00 0.00 H 0 +HETATM 9632 H2 HOH A3103 22.251 7.821 25.781 1.00 0.00 H 0 +HETATM 9633 O HOH A3104 0.351 21.525 15.629 1.00 0.00 O 0 +HETATM 9634 H1 HOH A3104 0.413 21.060 16.455 1.00 0.00 H 0 +HETATM 9635 H2 HOH A3104 -0.317 22.167 15.784 1.00 0.00 H 0 +HETATM 9636 O HOH A3105 36.344 14.402 7.179 1.00 0.00 O 0 +HETATM 9637 H1 HOH A3105 35.883 14.859 7.868 1.00 0.00 H 0 +HETATM 9638 H2 HOH A3105 36.525 13.595 7.576 1.00 0.00 H 0 +HETATM 9639 O HOH A3106 11.358 2.700 17.742 1.00 0.00 O 0 +HETATM 9640 H1 HOH A3106 12.150 2.122 17.872 1.00 0.00 H 0 +HETATM 9641 H2 HOH A3106 10.594 2.158 17.280 1.00 0.00 H 0 +HETATM 9642 O HOH A3107 27.339 8.509 28.062 1.00 0.00 O 0 +HETATM 9643 H1 HOH A3107 27.992 7.857 28.494 1.00 0.00 H 0 +HETATM 9644 H2 HOH A3107 27.872 8.965 27.399 1.00 0.00 H 0 +HETATM 9645 O HOH A3108 14.717 46.163 35.613 1.00 0.00 O 0 +HETATM 9646 H1 HOH A3108 14.155 45.479 35.132 1.00 0.00 H 0 +HETATM 9647 H2 HOH A3108 15.325 46.556 35.005 1.00 0.00 H 0 +HETATM 9648 O HOH A3109 22.332 14.156 17.674 1.00 0.00 O 0 +HETATM 9649 H1 HOH A3109 21.965 14.425 18.549 1.00 0.00 H 0 +HETATM 9650 H2 HOH A3109 22.937 13.446 17.887 1.00 0.00 H 0 +HETATM 9651 O HOH A3110 26.985 10.506 3.140 1.00 0.00 O 0 +HETATM 9652 H1 HOH A3110 27.722 11.056 2.975 1.00 0.00 H 0 +HETATM 9653 H2 HOH A3110 27.154 10.039 3.961 1.00 0.00 H 0 +HETATM 9654 O HOH A3111 20.308 5.350 39.010 1.00 0.00 O 0 +HETATM 9655 H1 HOH A3111 19.696 5.105 38.292 1.00 0.00 H 0 +HETATM 9656 H2 HOH A3111 20.506 6.291 38.931 1.00 0.00 H 0 +HETATM 9657 O HOH A3112 33.885 10.023 42.676 1.00 0.00 O 0 +HETATM 9658 H1 HOH A3112 34.474 10.790 42.626 1.00 0.00 H 0 +HETATM 9659 H2 HOH A3112 34.492 9.336 43.034 1.00 0.00 H 0 +HETATM 9660 O HOH A3113 3.063 28.198 29.910 1.00 0.00 O 0 +HETATM 9661 H1 HOH A3113 2.124 28.517 30.060 1.00 0.00 H 0 +HETATM 9662 H2 HOH A3113 3.615 28.606 30.506 1.00 0.00 H 0 +HETATM 9663 O HOH A3114 6.521 43.889 7.315 1.00 0.00 O 0 +HETATM 9664 H1 HOH A3114 7.227 44.116 6.894 1.00 0.00 H 0 +HETATM 9665 H2 HOH A3114 6.533 44.424 8.156 1.00 0.00 H 0 +HETATM 9666 O HOH A3115 43.849 1.418 49.801 1.00 0.00 O 0 +HETATM 9667 H1 HOH A3115 43.107 1.857 49.332 1.00 0.00 H 0 +HETATM 9668 H2 HOH A3115 44.628 2.013 49.691 1.00 0.00 H 0 +HETATM 9669 O HOH A3116 23.202 3.439 2.684 1.00 0.00 O 0 +HETATM 9670 H1 HOH A3116 22.288 3.262 2.315 1.00 0.00 H 0 +HETATM 9671 H2 HOH A3116 23.717 4.012 2.094 1.00 0.00 H 0 +HETATM 9672 O HOH A3117 6.861 22.211 52.575 1.00 0.00 O 0 +HETATM 9673 H1 HOH A3117 6.141 21.564 52.494 1.00 0.00 H 0 +HETATM 9674 H2 HOH A3117 6.834 22.698 51.717 1.00 0.00 H 0 +HETATM 9675 O HOH A3118 28.006 17.843 3.585 1.00 0.00 O 0 +HETATM 9676 H1 HOH A3118 28.870 17.443 3.389 1.00 0.00 H 0 +HETATM 9677 H2 HOH A3118 27.917 18.493 2.926 1.00 0.00 H 0 +HETATM 9678 O HOH A3119 11.727 38.279 32.198 1.00 0.00 O 0 +HETATM 9679 H1 HOH A3119 12.148 38.945 32.711 1.00 0.00 H 0 +HETATM 9680 H2 HOH A3119 12.400 37.895 31.551 1.00 0.00 H 0 +HETATM 9681 O HOH A3120 26.969 24.698 41.471 1.00 0.00 O 0 +HETATM 9682 H1 HOH A3120 27.406 23.929 41.087 1.00 0.00 H 0 +HETATM 9683 H2 HOH A3120 26.056 24.416 41.510 1.00 0.00 H 0 +HETATM 9684 O HOH A3121 32.827 39.660 39.583 1.00 0.00 O 0 +HETATM 9685 H1 HOH A3121 32.855 38.683 39.333 1.00 0.00 H 0 +HETATM 9686 H2 HOH A3121 33.245 40.032 38.774 1.00 0.00 H 0 +HETATM 9687 O HOH A3122 5.576 2.946 20.058 1.00 0.00 O 0 +HETATM 9688 H1 HOH A3122 4.986 3.749 19.894 1.00 0.00 H 0 +HETATM 9689 H2 HOH A3122 6.105 2.806 19.283 1.00 0.00 H 0 +HETATM 9690 O HOH A3123 21.719 9.815 52.904 1.00 0.00 O 0 +HETATM 9691 H1 HOH A3123 22.626 10.024 53.010 1.00 0.00 H 0 +HETATM 9692 H2 HOH A3123 21.483 10.319 52.114 1.00 0.00 H 0 +HETATM 9693 O HOH A3124 14.673 19.103 49.060 1.00 0.00 O 0 +HETATM 9694 H1 HOH A3124 15.368 19.177 49.660 1.00 0.00 H 0 +HETATM 9695 H2 HOH A3124 13.969 18.676 49.626 1.00 0.00 H 0 +HETATM 9696 O HOH A3125 1.564 50.336 32.513 1.00 0.00 O 0 +HETATM 9697 H1 HOH A3125 0.819 49.902 32.204 1.00 0.00 H 0 +HETATM 9698 H2 HOH A3125 2.255 49.703 32.337 1.00 0.00 H 0 +HETATM 9699 O HOH A3126 39.821 45.073 52.471 1.00 0.00 O 0 +HETATM 9700 H1 HOH A3126 39.155 44.472 52.046 1.00 0.00 H 0 +HETATM 9701 H2 HOH A3126 39.440 45.606 53.126 1.00 0.00 H 0 +HETATM 9702 O HOH A3127 23.396 18.309 3.656 1.00 0.00 O 0 +HETATM 9703 H1 HOH A3127 22.922 18.154 4.527 1.00 0.00 H 0 +HETATM 9704 H2 HOH A3127 24.207 17.761 3.578 1.00 0.00 H 0 +HETATM 9705 O HOH A3128 37.256 12.205 38.033 1.00 0.00 O 0 +HETATM 9706 H1 HOH A3128 36.382 12.684 38.050 1.00 0.00 H 0 +HETATM 9707 H2 HOH A3128 37.104 11.323 38.477 1.00 0.00 H 0 +HETATM 9708 O HOH A3129 13.544 10.889 27.387 1.00 0.00 O 0 +HETATM 9709 H1 HOH A3129 13.547 9.963 27.356 1.00 0.00 H 0 +HETATM 9710 H2 HOH A3129 12.633 11.126 27.580 1.00 0.00 H 0 +HETATM 9711 O HOH A3130 15.373 49.204 14.601 1.00 0.00 O 0 +HETATM 9712 H1 HOH A3130 15.889 49.370 13.841 1.00 0.00 H 0 +HETATM 9713 H2 HOH A3130 14.752 49.928 14.840 1.00 0.00 H 0 +HETATM 9714 O HOH A3131 37.858 46.110 6.444 1.00 0.00 O 0 +HETATM 9715 H1 HOH A3131 37.310 46.137 7.203 1.00 0.00 H 0 +HETATM 9716 H2 HOH A3131 37.711 45.249 6.129 1.00 0.00 H 0 +HETATM 9717 O HOH A3132 3.232 32.575 19.387 1.00 0.00 O 0 +HETATM 9718 H1 HOH A3132 3.048 32.611 18.432 1.00 0.00 H 0 +HETATM 9719 H2 HOH A3132 4.150 32.801 19.539 1.00 0.00 H 0 +HETATM 9720 O HOH A3133 18.385 53.617 25.190 1.00 0.00 O 0 +HETATM 9721 H1 HOH A3133 19.275 53.557 24.764 1.00 0.00 H 0 +HETATM 9722 H2 HOH A3133 17.883 52.910 24.743 1.00 0.00 H 0 +HETATM 9723 O HOH A3134 52.605 7.927 11.797 1.00 0.00 O 0 +HETATM 9724 H1 HOH A3134 53.030 8.637 11.402 1.00 0.00 H 0 +HETATM 9725 H2 HOH A3134 51.945 8.424 12.302 1.00 0.00 H 0 +HETATM 9726 O HOH A3135 42.225 1.392 12.556 1.00 0.00 O 0 +HETATM 9727 H1 HOH A3135 43.010 1.306 12.040 1.00 0.00 H 0 +HETATM 9728 H2 HOH A3135 42.167 0.494 12.985 1.00 0.00 H 0 +HETATM 9729 O HOH A3136 28.011 31.291 49.013 1.00 0.00 O 0 +HETATM 9730 H1 HOH A3136 28.645 30.932 49.696 1.00 0.00 H 0 +HETATM 9731 H2 HOH A3136 28.321 30.884 48.181 1.00 0.00 H 0 +HETATM 9732 O HOH A3137 48.780 52.464 14.699 1.00 0.00 O 0 +HETATM 9733 H1 HOH A3137 49.220 52.010 13.901 1.00 0.00 H 0 +HETATM 9734 H2 HOH A3137 49.392 53.215 14.923 1.00 0.00 H 0 +HETATM 9735 O HOH A3138 16.130 22.486 20.585 1.00 0.00 O 0 +HETATM 9736 H1 HOH A3138 15.726 22.365 19.669 1.00 0.00 H 0 +HETATM 9737 H2 HOH A3138 15.573 22.051 21.265 1.00 0.00 H 0 +HETATM 9738 O HOH A3139 29.565 9.132 31.693 1.00 0.00 O 0 +HETATM 9739 H1 HOH A3139 29.676 9.971 32.057 1.00 0.00 H 0 +HETATM 9740 H2 HOH A3139 30.377 8.696 31.803 1.00 0.00 H 0 +HETATM 9741 O HOH A3140 36.223 34.366 18.886 1.00 0.00 O 0 +HETATM 9742 H1 HOH A3140 36.070 35.309 19.091 1.00 0.00 H 0 +HETATM 9743 H2 HOH A3140 36.748 34.348 18.011 1.00 0.00 H 0 +HETATM 9744 O HOH A3141 23.423 50.172 17.804 1.00 0.00 O 0 +HETATM 9745 H1 HOH A3141 24.158 49.750 18.251 1.00 0.00 H 0 +HETATM 9746 H2 HOH A3141 22.679 49.840 18.247 1.00 0.00 H 0 +HETATM 9747 O HOH A3142 28.025 49.937 3.478 1.00 0.00 O 0 +HETATM 9748 H1 HOH A3142 27.673 50.804 3.520 1.00 0.00 H 0 +HETATM 9749 H2 HOH A3142 28.627 49.751 4.280 1.00 0.00 H 0 +HETATM 9750 O HOH A3143 44.113 20.288 10.652 1.00 0.00 O 0 +HETATM 9751 H1 HOH A3143 44.993 20.130 10.215 1.00 0.00 H 0 +HETATM 9752 H2 HOH A3143 43.970 21.298 10.576 1.00 0.00 H 0 +HETATM 9753 O HOH A3144 11.679 8.953 8.128 1.00 0.00 O 0 +HETATM 9754 H1 HOH A3144 11.791 8.639 7.236 1.00 0.00 H 0 +HETATM 9755 H2 HOH A3144 10.834 8.598 8.456 1.00 0.00 H 0 +HETATM 9756 O HOH A3145 0.279 13.692 31.080 1.00 0.00 O 0 +HETATM 9757 H1 HOH A3145 -0.500 13.606 31.592 1.00 0.00 H 0 +HETATM 9758 H2 HOH A3145 0.680 14.514 31.394 1.00 0.00 H 0 +HETATM 9759 O HOH A3146 33.563 52.576 50.235 1.00 0.00 O 0 +HETATM 9760 H1 HOH A3146 33.189 51.934 50.988 1.00 0.00 H 0 +HETATM 9761 H2 HOH A3146 33.458 53.440 50.655 1.00 0.00 H 0 +HETATM 9762 O HOH A3147 52.404 13.968 40.138 1.00 0.00 O 0 +HETATM 9763 H1 HOH A3147 52.757 13.868 39.283 1.00 0.00 H 0 +HETATM 9764 H2 HOH A3147 51.502 14.098 39.912 1.00 0.00 H 0 +HETATM 9765 O HOH A3148 52.346 42.850 47.391 1.00 0.00 O 0 +HETATM 9766 H1 HOH A3148 52.020 43.738 47.656 1.00 0.00 H 0 +HETATM 9767 H2 HOH A3148 53.278 42.890 47.555 1.00 0.00 H 0 +HETATM 9768 O HOH A3149 22.578 24.962 29.696 1.00 0.00 O 0 +HETATM 9769 H1 HOH A3149 22.283 25.353 28.896 1.00 0.00 H 0 +HETATM 9770 H2 HOH A3149 22.061 24.110 29.758 1.00 0.00 H 0 +HETATM 9771 O HOH A3150 3.693 46.618 17.349 1.00 0.00 O 0 +HETATM 9772 H1 HOH A3150 4.397 45.903 17.102 1.00 0.00 H 0 +HETATM 9773 H2 HOH A3150 4.105 47.430 17.092 1.00 0.00 H 0 +HETATM 9774 O HOH A3151 44.032 14.425 7.153 1.00 0.00 O 0 +HETATM 9775 H1 HOH A3151 43.127 14.148 6.975 1.00 0.00 H 0 +HETATM 9776 H2 HOH A3151 44.166 15.149 6.563 1.00 0.00 H 0 +HETATM 9777 O HOH A3152 37.392 30.734 29.419 1.00 0.00 O 0 +HETATM 9778 H1 HOH A3152 36.814 31.346 29.940 1.00 0.00 H 0 +HETATM 9779 H2 HOH A3152 38.228 31.196 29.216 1.00 0.00 H 0 +HETATM 9780 O HOH A3153 52.399 29.750 24.172 1.00 0.00 O 0 +HETATM 9781 H1 HOH A3153 51.586 29.881 24.640 1.00 0.00 H 0 +HETATM 9782 H2 HOH A3153 52.526 30.272 23.343 1.00 0.00 H 0 +HETATM 9783 O HOH A3154 23.754 32.791 46.578 1.00 0.00 O 0 +HETATM 9784 H1 HOH A3154 23.985 32.970 47.486 1.00 0.00 H 0 +HETATM 9785 H2 HOH A3154 23.804 31.857 46.484 1.00 0.00 H 0 +HETATM 9786 O HOH A3155 0.339 9.026 43.964 1.00 0.00 O 0 +HETATM 9787 H1 HOH A3155 -0.325 8.639 44.537 1.00 0.00 H 0 +HETATM 9788 H2 HOH A3155 0.149 8.717 43.081 1.00 0.00 H 0 +HETATM 9789 O HOH A3156 31.908 19.496 21.620 1.00 0.00 O 0 +HETATM 9790 H1 HOH A3156 32.727 19.594 21.147 1.00 0.00 H 0 +HETATM 9791 H2 HOH A3156 31.312 20.187 21.334 1.00 0.00 H 0 +HETATM 9792 O HOH A3157 47.010 4.927 20.525 1.00 0.00 O 0 +HETATM 9793 H1 HOH A3157 47.345 4.128 20.983 1.00 0.00 H 0 +HETATM 9794 H2 HOH A3157 46.050 4.856 20.645 1.00 0.00 H 0 +HETATM 9795 O HOH A3158 6.866 23.566 6.023 1.00 0.00 O 0 +HETATM 9796 H1 HOH A3158 6.434 23.837 5.167 1.00 0.00 H 0 +HETATM 9797 H2 HOH A3158 7.805 23.939 6.010 1.00 0.00 H 0 +HETATM 9798 O HOH A3159 43.151 13.253 38.920 1.00 0.00 O 0 +HETATM 9799 H1 HOH A3159 42.547 13.927 38.562 1.00 0.00 H 0 +HETATM 9800 H2 HOH A3159 42.643 12.707 39.547 1.00 0.00 H 0 +HETATM 9801 O HOH A3160 40.549 40.434 3.555 1.00 0.00 O 0 +HETATM 9802 H1 HOH A3160 41.193 40.375 4.263 1.00 0.00 H 0 +HETATM 9803 H2 HOH A3160 40.795 41.259 3.030 1.00 0.00 H 0 +HETATM 9804 O HOH A3161 26.571 45.649 3.759 1.00 0.00 O 0 +HETATM 9805 H1 HOH A3161 26.753 46.420 4.336 1.00 0.00 H 0 +HETATM 9806 H2 HOH A3161 25.684 45.276 3.936 1.00 0.00 H 0 +HETATM 9807 O HOH A3162 17.757 35.882 38.543 1.00 0.00 O 0 +HETATM 9808 H1 HOH A3162 17.292 35.769 39.373 1.00 0.00 H 0 +HETATM 9809 H2 HOH A3162 17.178 35.367 37.957 1.00 0.00 H 0 +HETATM 9810 O HOH A3163 47.427 22.263 14.657 1.00 0.00 O 0 +HETATM 9811 H1 HOH A3163 47.507 21.477 14.079 1.00 0.00 H 0 +HETATM 9812 H2 HOH A3163 46.733 22.817 14.308 1.00 0.00 H 0 +HETATM 9813 O HOH A3164 10.445 47.032 43.097 1.00 0.00 O 0 +HETATM 9814 H1 HOH A3164 10.348 46.073 43.037 1.00 0.00 H 0 +HETATM 9815 H2 HOH A3164 10.982 47.263 42.292 1.00 0.00 H 0 +HETATM 9816 O HOH A3165 40.484 2.350 53.513 1.00 0.00 O 0 +HETATM 9817 H1 HOH A3165 40.806 3.270 53.454 1.00 0.00 H 0 +HETATM 9818 H2 HOH A3165 41.187 1.787 53.762 1.00 0.00 H 0 +HETATM 9819 O HOH A3166 6.055 0.303 28.692 1.00 0.00 O 0 +HETATM 9820 H1 HOH A3166 5.666 -0.225 29.448 1.00 0.00 H 0 +HETATM 9821 H2 HOH A3166 5.574 1.139 28.721 1.00 0.00 H 0 +HETATM 9822 O HOH A3167 14.197 13.801 30.806 1.00 0.00 O 0 +HETATM 9823 H1 HOH A3167 14.033 13.511 29.878 1.00 0.00 H 0 +HETATM 9824 H2 HOH A3167 14.523 14.684 30.944 1.00 0.00 H 0 +HETATM 9825 O HOH A3168 13.428 37.026 45.903 1.00 0.00 O 0 +HETATM 9826 H1 HOH A3168 12.468 36.837 45.708 1.00 0.00 H 0 +HETATM 9827 H2 HOH A3168 13.580 36.475 46.723 1.00 0.00 H 0 +HETATM 9828 O HOH A3169 11.162 7.276 34.502 1.00 0.00 O 0 +HETATM 9829 H1 HOH A3169 11.445 6.569 35.147 1.00 0.00 H 0 +HETATM 9830 H2 HOH A3169 11.492 6.946 33.654 1.00 0.00 H 0 +HETATM 9831 O HOH A3170 6.729 7.462 48.706 1.00 0.00 O 0 +HETATM 9832 H1 HOH A3170 7.450 7.970 49.139 1.00 0.00 H 0 +HETATM 9833 H2 HOH A3170 6.965 7.171 47.828 1.00 0.00 H 0 +HETATM 9834 O HOH A3171 8.417 20.043 15.962 1.00 0.00 O 0 +HETATM 9835 H1 HOH A3171 8.621 20.416 16.799 1.00 0.00 H 0 +HETATM 9836 H2 HOH A3171 9.173 19.524 15.713 1.00 0.00 H 0 +HETATM 9837 O HOH A3172 47.545 0.268 21.844 1.00 0.00 O 0 +HETATM 9838 H1 HOH A3172 48.233 -0.317 21.454 1.00 0.00 H 0 +HETATM 9839 H2 HOH A3172 46.788 0.246 21.268 1.00 0.00 H 0 +HETATM 9840 O HOH A3173 35.767 45.322 28.320 1.00 0.00 O 0 +HETATM 9841 H1 HOH A3173 35.238 46.095 28.083 1.00 0.00 H 0 +HETATM 9842 H2 HOH A3173 36.539 45.328 27.707 1.00 0.00 H 0 +HETATM 9843 O HOH A3174 11.696 50.704 50.698 1.00 0.00 O 0 +HETATM 9844 H1 HOH A3174 11.944 50.205 51.476 1.00 0.00 H 0 +HETATM 9845 H2 HOH A3174 11.084 50.116 50.189 1.00 0.00 H 0 +HETATM 9846 O HOH A3175 28.124 47.242 13.875 1.00 0.00 O 0 +HETATM 9847 H1 HOH A3175 27.866 47.722 13.080 1.00 0.00 H 0 +HETATM 9848 H2 HOH A3175 28.285 46.360 13.527 1.00 0.00 H 0 +HETATM 9849 O HOH A3176 22.691 36.628 3.051 1.00 0.00 O 0 +HETATM 9850 H1 HOH A3176 22.285 35.846 2.774 1.00 0.00 H 0 +HETATM 9851 H2 HOH A3176 22.673 36.588 4.000 1.00 0.00 H 0 +HETATM 9852 O HOH A3177 39.116 28.745 38.763 1.00 0.00 O 0 +HETATM 9853 H1 HOH A3177 38.468 29.120 38.150 1.00 0.00 H 0 +HETATM 9854 H2 HOH A3177 39.870 28.539 38.229 1.00 0.00 H 0 +HETATM 9855 O HOH A3178 5.236 16.319 41.716 1.00 0.00 O 0 +HETATM 9856 H1 HOH A3178 5.214 16.147 42.641 1.00 0.00 H 0 +HETATM 9857 H2 HOH A3178 6.065 15.965 41.388 1.00 0.00 H 0 +HETATM 9858 O HOH A3179 27.163 31.791 30.558 1.00 0.00 O 0 +HETATM 9859 H1 HOH A3179 26.968 31.024 30.037 1.00 0.00 H 0 +HETATM 9860 H2 HOH A3179 26.308 32.231 30.731 1.00 0.00 H 0 +HETATM 9861 O HOH A3180 45.647 4.074 27.437 1.00 0.00 O 0 +HETATM 9862 H1 HOH A3180 46.223 4.668 27.916 1.00 0.00 H 0 +HETATM 9863 H2 HOH A3180 46.262 3.797 26.687 1.00 0.00 H 0 +HETATM 9864 O HOH A3181 9.868 14.711 12.819 1.00 0.00 O 0 +HETATM 9865 H1 HOH A3181 10.142 15.685 12.845 1.00 0.00 H 0 +HETATM 9866 H2 HOH A3181 8.899 14.766 12.854 1.00 0.00 H 0 +HETATM 9867 O HOH A3182 18.366 47.032 2.307 1.00 0.00 O 0 +HETATM 9868 H1 HOH A3182 18.469 46.540 1.436 1.00 0.00 H 0 +HETATM 9869 H2 HOH A3182 19.042 46.606 2.893 1.00 0.00 H 0 +HETATM 9870 O HOH A3183 50.935 4.915 40.281 1.00 0.00 O 0 +HETATM 9871 H1 HOH A3183 50.681 4.637 39.381 1.00 0.00 H 0 +HETATM 9872 H2 HOH A3183 51.352 5.744 40.351 1.00 0.00 H 0 +HETATM 9873 O HOH A3184 52.329 25.504 13.264 1.00 0.00 O 0 +HETATM 9874 H1 HOH A3184 53.189 25.706 12.828 1.00 0.00 H 0 +HETATM 9875 H2 HOH A3184 51.614 26.119 13.031 1.00 0.00 H 0 +HETATM 9876 O HOH A3185 37.926 34.446 28.068 1.00 0.00 O 0 +HETATM 9877 H1 HOH A3185 38.248 33.801 28.658 1.00 0.00 H 0 +HETATM 9878 H2 HOH A3185 38.696 34.697 27.642 1.00 0.00 H 0 +HETATM 9879 O HOH A3186 41.152 41.203 34.996 1.00 0.00 O 0 +HETATM 9880 H1 HOH A3186 41.620 41.826 35.457 1.00 0.00 H 0 +HETATM 9881 H2 HOH A3186 41.758 40.374 34.973 1.00 0.00 H 0 +HETATM 9882 O HOH A3187 42.783 33.174 27.407 1.00 0.00 O 0 +HETATM 9883 H1 HOH A3187 42.814 32.747 28.319 1.00 0.00 H 0 +HETATM 9884 H2 HOH A3187 43.708 33.302 27.079 1.00 0.00 H 0 +HETATM 9885 O HOH A3188 23.841 49.313 53.288 1.00 0.00 O 0 +HETATM 9886 H1 HOH A3188 24.642 49.715 53.645 1.00 0.00 H 0 +HETATM 9887 H2 HOH A3188 23.107 49.889 53.463 1.00 0.00 H 0 +HETATM 9888 O HOH A3189 17.654 18.670 22.078 1.00 0.00 O 0 +HETATM 9889 H1 HOH A3189 17.981 18.849 21.156 1.00 0.00 H 0 +HETATM 9890 H2 HOH A3189 17.610 19.524 22.494 1.00 0.00 H 0 +HETATM 9891 O HOH A3190 52.205 23.376 16.133 1.00 0.00 O 0 +HETATM 9892 H1 HOH A3190 51.578 23.132 16.818 1.00 0.00 H 0 +HETATM 9893 H2 HOH A3190 52.452 24.313 16.260 1.00 0.00 H 0 +HETATM 9894 O HOH A3191 44.214 46.934 42.917 1.00 0.00 O 0 +HETATM 9895 H1 HOH A3191 44.263 46.187 42.269 1.00 0.00 H 0 +HETATM 9896 H2 HOH A3191 45.001 46.910 43.333 1.00 0.00 H 0 +HETATM 9897 O HOH A3192 24.807 7.931 20.474 1.00 0.00 O 0 +HETATM 9898 H1 HOH A3192 25.554 7.760 19.889 1.00 0.00 H 0 +HETATM 9899 H2 HOH A3192 24.927 7.158 21.057 1.00 0.00 H 0 +HETATM 9900 O HOH A3193 42.143 10.380 21.874 1.00 0.00 O 0 +HETATM 9901 H1 HOH A3193 41.552 11.019 22.318 1.00 0.00 H 0 +HETATM 9902 H2 HOH A3193 41.749 9.526 21.613 1.00 0.00 H 0 +HETATM 9903 O HOH A3194 16.044 44.609 18.361 1.00 0.00 O 0 +HETATM 9904 H1 HOH A3194 16.223 43.796 18.901 1.00 0.00 H 0 +HETATM 9905 H2 HOH A3194 16.032 44.351 17.421 1.00 0.00 H 0 +HETATM 9906 O HOH A3195 49.661 44.048 37.864 1.00 0.00 O 0 +HETATM 9907 H1 HOH A3195 49.124 44.870 38.053 1.00 0.00 H 0 +HETATM 9908 H2 HOH A3195 50.345 44.345 37.228 1.00 0.00 H 0 +HETATM 9909 O HOH A3196 42.235 4.006 31.409 1.00 0.00 O 0 +HETATM 9910 H1 HOH A3196 42.376 4.261 32.281 1.00 0.00 H 0 +HETATM 9911 H2 HOH A3196 42.674 3.239 31.426 1.00 0.00 H 0 +HETATM 9912 O HOH A3197 36.474 40.375 40.192 1.00 0.00 O 0 +HETATM 9913 H1 HOH A3197 37.309 40.783 40.293 1.00 0.00 H 0 +HETATM 9914 H2 HOH A3197 36.499 39.972 39.308 1.00 0.00 H 0 +HETATM 9915 O HOH A3198 8.661 20.178 51.979 1.00 0.00 O 0 +HETATM 9916 H1 HOH A3198 7.883 20.654 52.273 1.00 0.00 H 0 +HETATM 9917 H2 HOH A3198 8.563 20.125 50.988 1.00 0.00 H 0 +HETATM 9918 O HOH A3199 28.553 10.668 20.385 1.00 0.00 O 0 +HETATM 9919 H1 HOH A3199 28.190 10.369 21.266 1.00 0.00 H 0 +HETATM 9920 H2 HOH A3199 27.949 11.286 20.030 1.00 0.00 H 0 +HETATM 9921 O HOH A3200 14.637 21.603 48.077 1.00 0.00 O 0 +HETATM 9922 H1 HOH A3200 14.538 20.604 48.246 1.00 0.00 H 0 +HETATM 9923 H2 HOH A3200 14.908 21.698 47.134 1.00 0.00 H 0 +HETATM 9924 O HOH A3201 6.283 17.222 38.427 1.00 0.00 O 0 +HETATM 9925 H1 HOH A3201 6.131 16.354 38.882 1.00 0.00 H 0 +HETATM 9926 H2 HOH A3201 7.094 17.049 37.918 1.00 0.00 H 0 +HETATM 9927 O HOH A3202 44.645 40.989 11.130 1.00 0.00 O 0 +HETATM 9928 H1 HOH A3202 45.101 40.159 11.480 1.00 0.00 H 0 +HETATM 9929 H2 HOH A3202 45.160 41.186 10.289 1.00 0.00 H 0 +HETATM 9930 O HOH A3203 21.230 11.253 50.305 1.00 0.00 O 0 +HETATM 9931 H1 HOH A3203 20.788 12.069 50.005 1.00 0.00 H 0 +HETATM 9932 H2 HOH A3203 21.959 11.045 49.718 1.00 0.00 H 0 +HETATM 9933 O HOH A3204 46.003 38.679 32.680 1.00 0.00 O 0 +HETATM 9934 H1 HOH A3204 45.770 39.499 32.207 1.00 0.00 H 0 +HETATM 9935 H2 HOH A3204 46.736 38.889 33.270 1.00 0.00 H 0 +HETATM 9936 O HOH A3205 46.152 14.383 2.182 1.00 0.00 O 0 +HETATM 9937 H1 HOH A3205 45.303 14.192 2.625 1.00 0.00 H 0 +HETATM 9938 H2 HOH A3205 46.724 13.629 2.271 1.00 0.00 H 0 +HETATM 9939 O HOH A3206 40.442 6.866 15.233 1.00 0.00 O 0 +HETATM 9940 H1 HOH A3206 41.180 6.699 14.671 1.00 0.00 H 0 +HETATM 9941 H2 HOH A3206 40.461 6.177 15.902 1.00 0.00 H 0 +HETATM 9942 O HOH A3207 42.489 48.153 25.109 1.00 0.00 O 0 +HETATM 9943 H1 HOH A3207 42.364 47.249 24.794 1.00 0.00 H 0 +HETATM 9944 H2 HOH A3207 42.388 48.121 26.084 1.00 0.00 H 0 +HETATM 9945 O HOH A3208 18.381 8.832 12.501 1.00 0.00 O 0 +HETATM 9946 H1 HOH A3208 17.885 9.090 11.776 1.00 0.00 H 0 +HETATM 9947 H2 HOH A3208 19.120 8.351 12.173 1.00 0.00 H 0 +HETATM 9948 O HOH A3209 50.076 8.906 34.074 1.00 0.00 O 0 +HETATM 9949 H1 HOH A3209 50.258 9.871 34.018 1.00 0.00 H 0 +HETATM 9950 H2 HOH A3209 49.213 8.777 34.600 1.00 0.00 H 0 +HETATM 9951 O HOH A3210 49.749 19.601 29.414 1.00 0.00 O 0 +HETATM 9952 H1 HOH A3210 50.254 19.593 30.252 1.00 0.00 H 0 +HETATM 9953 H2 HOH A3210 49.687 18.616 29.230 1.00 0.00 H 0 +HETATM 9954 O HOH A3211 3.363 0.545 34.488 1.00 0.00 O 0 +HETATM 9955 H1 HOH A3211 3.792 0.897 33.744 1.00 0.00 H 0 +HETATM 9956 H2 HOH A3211 2.425 0.524 34.392 1.00 0.00 H 0 +HETATM 9957 O HOH A3212 29.196 52.736 33.503 1.00 0.00 O 0 +HETATM 9958 H1 HOH A3212 28.450 52.185 33.664 1.00 0.00 H 0 +HETATM 9959 H2 HOH A3212 29.511 52.766 32.589 1.00 0.00 H 0 +HETATM 9960 O HOH A3213 49.447 20.896 2.348 1.00 0.00 O 0 +HETATM 9961 H1 HOH A3213 49.449 21.289 3.217 1.00 0.00 H 0 +HETATM 9962 H2 HOH A3213 49.003 20.048 2.416 1.00 0.00 H 0 +HETATM 9963 O HOH A3214 20.066 11.121 41.182 1.00 0.00 O 0 +HETATM 9964 H1 HOH A3214 20.531 10.418 41.761 1.00 0.00 H 0 +HETATM 9965 H2 HOH A3214 19.126 11.064 41.448 1.00 0.00 H 0 +HETATM 9966 O HOH A3215 36.772 45.313 30.880 1.00 0.00 O 0 +HETATM 9967 H1 HOH A3215 36.892 44.371 30.708 1.00 0.00 H 0 +HETATM 9968 H2 HOH A3215 36.235 45.547 30.102 1.00 0.00 H 0 +HETATM 9969 O HOH A3216 43.025 29.596 34.171 1.00 0.00 O 0 +HETATM 9970 H1 HOH A3216 42.988 29.484 35.142 1.00 0.00 H 0 +HETATM 9971 H2 HOH A3216 43.949 29.410 33.904 1.00 0.00 H 0 +HETATM 9972 O HOH A3217 26.591 1.449 4.432 1.00 0.00 O 0 +HETATM 9973 H1 HOH A3217 25.776 1.100 4.803 1.00 0.00 H 0 +HETATM 9974 H2 HOH A3217 27.346 1.162 5.004 1.00 0.00 H 0 +HETATM 9975 O HOH A3218 22.506 3.305 36.969 1.00 0.00 O 0 +HETATM 9976 H1 HOH A3218 23.038 3.358 36.161 1.00 0.00 H 0 +HETATM 9977 H2 HOH A3218 22.008 4.172 36.960 1.00 0.00 H 0 +HETATM 9978 O HOH A3219 10.731 18.744 32.769 1.00 0.00 O 0 +HETATM 9979 H1 HOH A3219 10.448 18.515 33.670 1.00 0.00 H 0 +HETATM 9980 H2 HOH A3219 11.250 19.548 32.820 1.00 0.00 H 0 +HETATM 9981 O HOH A3220 47.016 52.801 38.314 1.00 0.00 O 0 +HETATM 9982 H1 HOH A3220 47.840 53.260 37.994 1.00 0.00 H 0 +HETATM 9983 H2 HOH A3220 46.355 53.439 38.048 1.00 0.00 H 0 +HETATM 9984 O HOH A3221 5.349 22.130 25.201 1.00 0.00 O 0 +HETATM 9985 H1 HOH A3221 4.997 21.740 25.999 1.00 0.00 H 0 +HETATM 9986 H2 HOH A3221 6.267 22.535 25.416 1.00 0.00 H 0 +HETATM 9987 O HOH A3222 12.771 13.805 3.802 1.00 0.00 O 0 +HETATM 9988 H1 HOH A3222 12.869 14.664 3.389 1.00 0.00 H 0 +HETATM 9989 H2 HOH A3222 11.891 13.837 4.013 1.00 0.00 H 0 +HETATM 9990 O HOH A3223 39.011 32.369 44.689 1.00 0.00 O 0 +HETATM 9991 H1 HOH A3223 39.062 31.383 44.620 1.00 0.00 H 0 +HETATM 9992 H2 HOH A3223 39.333 32.450 45.597 1.00 0.00 H 0 +HETATM 9993 O HOH A3224 39.097 24.641 1.414 1.00 0.00 O 0 +HETATM 9994 H1 HOH A3224 38.504 25.099 0.830 1.00 0.00 H 0 +HETATM 9995 H2 HOH A3224 39.629 25.317 1.874 1.00 0.00 H 0 +HETATM 9996 O HOH A3225 11.564 35.827 1.761 1.00 0.00 O 0 +HETATM 9997 H1 HOH A3225 11.381 36.777 1.897 1.00 0.00 H 0 +HETATM 9998 H2 HOH A3225 10.732 35.446 1.508 1.00 0.00 H 0 +HETATM 9999 O HOH A3226 51.644 45.489 12.439 1.00 0.00 O 0 +HETATM10000 H1 HOH A3226 52.510 45.722 12.157 1.00 0.00 H 0 +HETATM10001 H2 HOH A3226 51.233 45.263 11.622 1.00 0.00 H 0 +HETATM10002 O HOH A3227 24.866 15.173 41.172 1.00 0.00 O 0 +HETATM10003 H1 HOH A3227 24.801 15.844 41.849 1.00 0.00 H 0 +HETATM10004 H2 HOH A3227 24.311 15.541 40.507 1.00 0.00 H 0 +HETATM10005 O HOH A3228 39.422 37.189 5.639 1.00 0.00 O 0 +HETATM10006 H1 HOH A3228 39.825 37.238 4.815 1.00 0.00 H 0 +HETATM10007 H2 HOH A3228 38.532 37.374 5.396 1.00 0.00 H 0 +HETATM10008 O HOH A3229 34.020 7.563 3.746 1.00 0.00 O 0 +HETATM10009 H1 HOH A3229 33.664 6.670 3.662 1.00 0.00 H 0 +HETATM10010 H2 HOH A3229 33.641 7.959 4.588 1.00 0.00 H 0 +HETATM10011 O HOH A3230 26.221 7.389 34.430 1.00 0.00 O 0 +HETATM10012 H1 HOH A3230 26.712 8.041 34.042 1.00 0.00 H 0 +HETATM10013 H2 HOH A3230 26.863 6.676 34.713 1.00 0.00 H 0 +HETATM10014 O HOH A3231 48.182 39.259 34.294 1.00 0.00 O 0 +HETATM10015 H1 HOH A3231 48.936 38.813 33.879 1.00 0.00 H 0 +HETATM10016 H2 HOH A3231 48.366 40.237 34.372 1.00 0.00 H 0 +HETATM10017 O HOH A3232 47.223 8.551 40.277 1.00 0.00 O 0 +HETATM10018 H1 HOH A3232 46.681 7.758 40.431 1.00 0.00 H 0 +HETATM10019 H2 HOH A3232 46.680 9.390 40.303 1.00 0.00 H 0 +HETATM10020 O HOH A3233 4.435 4.888 37.930 1.00 0.00 O 0 +HETATM10021 H1 HOH A3233 5.371 5.100 37.775 1.00 0.00 H 0 +HETATM10022 H2 HOH A3233 4.149 4.063 37.516 1.00 0.00 H 0 +HETATM10023 O HOH A3234 50.715 7.069 22.144 1.00 0.00 O 0 +HETATM10024 H1 HOH A3234 51.237 7.095 21.328 1.00 0.00 H 0 +HETATM10025 H2 HOH A3234 50.272 6.256 22.171 1.00 0.00 H 0 +HETATM10026 O HOH A3235 17.267 39.514 25.445 1.00 0.00 O 0 +HETATM10027 H1 HOH A3235 17.848 40.126 25.923 1.00 0.00 H 0 +HETATM10028 H2 HOH A3235 16.884 40.002 24.749 1.00 0.00 H 0 +HETATM10029 O HOH A3236 49.749 44.482 44.256 1.00 0.00 O 0 +HETATM10030 H1 HOH A3236 50.350 45.044 44.776 1.00 0.00 H 0 +HETATM10031 H2 HOH A3236 50.008 44.745 43.366 1.00 0.00 H 0 +HETATM10032 O HOH A3237 53.664 44.722 24.952 1.00 0.00 O 0 +HETATM10033 H1 HOH A3237 52.916 44.890 25.587 1.00 0.00 H 0 +HETATM10034 H2 HOH A3237 53.622 43.841 24.545 1.00 0.00 H 0 +HETATM10035 O HOH A3238 16.255 53.740 39.772 1.00 0.00 O 0 +HETATM10036 H1 HOH A3238 16.675 53.158 39.103 1.00 0.00 H 0 +HETATM10037 H2 HOH A3238 15.551 53.184 40.075 1.00 0.00 H 0 +HETATM10038 O HOH A3239 45.010 47.816 46.350 1.00 0.00 O 0 +HETATM10039 H1 HOH A3239 44.203 48.151 45.884 1.00 0.00 H 0 +HETATM10040 H2 HOH A3239 45.197 48.232 47.301 1.00 0.00 H 0 +HETATM10041 O HOH A3240 10.838 3.312 34.465 1.00 0.00 O 0 +HETATM10042 H1 HOH A3240 10.498 3.826 33.675 1.00 0.00 H 0 +HETATM10043 H2 HOH A3240 10.258 2.520 34.493 1.00 0.00 H 0 +HETATM10044 O HOH A3241 34.694 3.400 5.011 1.00 0.00 O 0 +HETATM10045 H1 HOH A3241 34.008 3.992 4.880 1.00 0.00 H 0 +HETATM10046 H2 HOH A3241 35.029 3.028 4.212 1.00 0.00 H 0 +HETATM10047 O HOH A3242 19.861 42.248 23.854 1.00 0.00 O 0 +HETATM10048 H1 HOH A3242 20.587 41.687 23.700 1.00 0.00 H 0 +HETATM10049 H2 HOH A3242 19.725 42.727 23.050 1.00 0.00 H 0 +HETATM10050 O HOH A3243 4.014 27.784 1.558 1.00 0.00 O 0 +HETATM10051 H1 HOH A3243 3.645 28.634 1.184 1.00 0.00 H 0 +HETATM10052 H2 HOH A3243 4.244 27.952 2.475 1.00 0.00 H 0 +HETATM10053 O HOH A3244 35.587 15.190 14.148 1.00 0.00 O 0 +HETATM10054 H1 HOH A3244 35.837 16.105 14.276 1.00 0.00 H 0 +HETATM10055 H2 HOH A3244 36.213 14.590 14.675 1.00 0.00 H 0 +HETATM10056 O HOH A3245 22.583 35.017 30.880 1.00 0.00 O 0 +HETATM10057 H1 HOH A3245 23.030 34.516 30.179 1.00 0.00 H 0 +HETATM10058 H2 HOH A3245 22.321 35.884 30.542 1.00 0.00 H 0 +HETATM10059 O HOH A3246 47.560 28.876 42.853 1.00 0.00 O 0 +HETATM10060 H1 HOH A3246 47.308 29.273 43.641 1.00 0.00 H 0 +HETATM10061 H2 HOH A3246 46.713 28.337 42.674 1.00 0.00 H 0 +HETATM10062 O HOH A3247 6.981 2.135 3.663 1.00 0.00 O 0 +HETATM10063 H1 HOH A3247 6.051 1.991 3.964 1.00 0.00 H 0 +HETATM10064 H2 HOH A3247 7.217 2.998 4.036 1.00 0.00 H 0 +HETATM10065 O HOH A3248 32.884 11.452 7.177 1.00 0.00 O 0 +HETATM10066 H1 HOH A3248 33.538 11.898 6.546 1.00 0.00 H 0 +HETATM10067 H2 HOH A3248 32.842 10.545 6.856 1.00 0.00 H 0 +HETATM10068 O HOH A3249 19.852 42.792 49.031 1.00 0.00 O 0 +HETATM10069 H1 HOH A3249 20.320 43.286 49.784 1.00 0.00 H 0 +HETATM10070 H2 HOH A3249 20.527 42.134 48.784 1.00 0.00 H 0 +HETATM10071 O HOH A3250 34.508 4.917 13.518 1.00 0.00 O 0 +HETATM10072 H1 HOH A3250 34.149 5.876 13.288 1.00 0.00 H 0 +HETATM10073 H2 HOH A3250 33.681 4.480 13.890 1.00 0.00 H 0 +HETATM10074 O HOH A3251 35.691 49.150 33.469 1.00 0.00 O 0 +HETATM10075 H1 HOH A3251 36.514 49.625 33.759 1.00 0.00 H 0 +HETATM10076 H2 HOH A3251 35.928 48.174 33.452 1.00 0.00 H 0 +HETATM10077 O HOH A3252 1.964 29.762 25.113 1.00 0.00 O 0 +HETATM10078 H1 HOH A3252 2.174 29.201 25.873 1.00 0.00 H 0 +HETATM10079 H2 HOH A3252 1.035 29.995 25.079 1.00 0.00 H 0 +HETATM10080 O HOH A3253 10.354 37.823 52.912 1.00 0.00 O 0 +HETATM10081 H1 HOH A3253 9.849 38.104 53.699 1.00 0.00 H 0 +HETATM10082 H2 HOH A3253 10.417 36.881 53.000 1.00 0.00 H 0 +HETATM10083 O HOH A3254 30.773 15.559 26.939 1.00 0.00 O 0 +HETATM10084 H1 HOH A3254 30.470 14.814 27.556 1.00 0.00 H 0 +HETATM10085 H2 HOH A3254 30.451 16.388 27.405 1.00 0.00 H 0 +HETATM10086 O HOH A3255 38.044 9.512 11.646 1.00 0.00 O 0 +HETATM10087 H1 HOH A3255 37.757 8.806 12.227 1.00 0.00 H 0 +HETATM10088 H2 HOH A3255 38.300 10.326 12.232 1.00 0.00 H 0 +HETATM10089 O HOH A3256 40.169 11.988 7.323 1.00 0.00 O 0 +HETATM10090 H1 HOH A3256 41.031 11.555 7.452 1.00 0.00 H 0 +HETATM10091 H2 HOH A3256 39.564 11.712 8.052 1.00 0.00 H 0 +HETATM10092 O HOH A3257 2.061 43.446 26.197 1.00 0.00 O 0 +HETATM10093 H1 HOH A3257 1.313 43.927 25.852 1.00 0.00 H 0 +HETATM10094 H2 HOH A3257 1.732 42.692 26.722 1.00 0.00 H 0 +HETATM10095 O HOH A3258 28.106 18.587 15.675 1.00 0.00 O 0 +HETATM10096 H1 HOH A3258 28.532 17.932 16.221 1.00 0.00 H 0 +HETATM10097 H2 HOH A3258 27.452 18.900 16.210 1.00 0.00 H 0 +HETATM10098 O HOH A3259 4.411 16.573 49.040 1.00 0.00 O 0 +HETATM10099 H1 HOH A3259 4.479 15.737 49.507 1.00 0.00 H 0 +HETATM10100 H2 HOH A3259 4.516 17.215 49.680 1.00 0.00 H 0 +HETATM10101 O HOH A3260 2.303 6.919 49.919 1.00 0.00 O 0 +HETATM10102 H1 HOH A3260 1.788 6.131 49.501 1.00 0.00 H 0 +HETATM10103 H2 HOH A3260 2.873 7.146 49.144 1.00 0.00 H 0 +HETATM10104 O HOH A3261 40.921 53.591 32.932 1.00 0.00 O 0 +HETATM10105 H1 HOH A3261 40.978 52.747 33.470 1.00 0.00 H 0 +HETATM10106 H2 HOH A3261 40.484 54.185 33.581 1.00 0.00 H 0 +HETATM10107 O HOH A3262 51.970 15.842 46.451 1.00 0.00 O 0 +HETATM10108 H1 HOH A3262 51.613 14.912 46.461 1.00 0.00 H 0 +HETATM10109 H2 HOH A3262 51.678 16.100 45.588 1.00 0.00 H 0 +HETATM10110 O HOH A3263 1.203 38.496 5.417 1.00 0.00 O 0 +HETATM10111 H1 HOH A3263 1.519 37.633 5.360 1.00 0.00 H 0 +HETATM10112 H2 HOH A3263 1.962 39.026 5.304 1.00 0.00 H 0 +HETATM10113 O HOH A3264 31.963 25.461 15.139 1.00 0.00 O 0 +HETATM10114 H1 HOH A3264 31.192 25.792 15.652 1.00 0.00 H 0 +HETATM10115 H2 HOH A3264 31.594 25.100 14.280 1.00 0.00 H 0 +HETATM10116 O HOH A3265 41.805 4.093 23.124 1.00 0.00 O 0 +HETATM10117 H1 HOH A3265 41.702 5.010 22.841 1.00 0.00 H 0 +HETATM10118 H2 HOH A3265 41.252 4.045 23.880 1.00 0.00 H 0 +HETATM10119 O HOH A3266 30.819 51.290 1.406 1.00 0.00 O 0 +HETATM10120 H1 HOH A3266 31.654 50.874 1.463 1.00 0.00 H 0 +HETATM10121 H2 HOH A3266 30.285 50.737 0.832 1.00 0.00 H 0 +HETATM10122 O HOH A3267 26.031 34.951 30.051 1.00 0.00 O 0 +HETATM10123 H1 HOH A3267 25.806 35.218 29.137 1.00 0.00 H 0 +HETATM10124 H2 HOH A3267 25.486 34.254 30.344 1.00 0.00 H 0 +HETATM10125 O HOH A3268 19.007 32.779 7.603 1.00 0.00 O 0 +HETATM10126 H1 HOH A3268 19.059 33.721 7.189 1.00 0.00 H 0 +HETATM10127 H2 HOH A3268 18.070 32.566 7.605 1.00 0.00 H 0 +HETATM10128 O HOH A3269 46.406 17.172 1.632 1.00 0.00 O 0 +HETATM10129 H1 HOH A3269 46.247 16.262 1.585 1.00 0.00 H 0 +HETATM10130 H2 HOH A3269 45.662 17.543 2.073 1.00 0.00 H 0 +HETATM10131 O HOH A3270 9.554 3.869 11.751 1.00 0.00 O 0 +HETATM10132 H1 HOH A3270 9.945 4.204 12.614 1.00 0.00 H 0 +HETATM10133 H2 HOH A3270 9.339 2.845 11.752 1.00 0.00 H 0 +HETATM10134 O HOH A3271 37.547 12.947 35.066 1.00 0.00 O 0 +HETATM10135 H1 HOH A3271 37.206 12.143 34.685 1.00 0.00 H 0 +HETATM10136 H2 HOH A3271 37.933 12.613 35.865 1.00 0.00 H 0 +HETATM10137 O HOH A3272 34.911 47.283 21.814 1.00 0.00 O 0 +HETATM10138 H1 HOH A3272 34.858 46.323 22.090 1.00 0.00 H 0 +HETATM10139 H2 HOH A3272 34.301 47.724 22.392 1.00 0.00 H 0 +HETATM10140 O HOH A3273 26.259 14.452 16.640 1.00 0.00 O 0 +HETATM10141 H1 HOH A3273 26.619 13.984 17.394 1.00 0.00 H 0 +HETATM10142 H2 HOH A3273 25.554 13.945 16.184 1.00 0.00 H 0 +HETATM10143 O HOH A3274 15.716 22.044 41.380 1.00 0.00 O 0 +HETATM10144 H1 HOH A3274 15.203 21.575 40.673 1.00 0.00 H 0 +HETATM10145 H2 HOH A3274 15.116 22.134 42.157 1.00 0.00 H 0 +HETATM10146 O HOH A3275 6.697 -0.270 26.131 1.00 0.00 O 0 +HETATM10147 H1 HOH A3275 6.516 0.584 25.710 1.00 0.00 H 0 +HETATM10148 H2 HOH A3275 6.538 -0.221 27.024 1.00 0.00 H 0 +HETATM10149 O HOH A3276 42.255 38.607 15.319 1.00 0.00 O 0 +HETATM10150 H1 HOH A3276 41.940 38.936 16.148 1.00 0.00 H 0 +HETATM10151 H2 HOH A3276 42.134 39.350 14.715 1.00 0.00 H 0 +HETATM10152 O HOH A3277 9.319 28.792 43.678 1.00 0.00 O 0 +HETATM10153 H1 HOH A3277 9.182 29.522 43.113 1.00 0.00 H 0 +HETATM10154 H2 HOH A3277 9.187 29.215 44.531 1.00 0.00 H 0 +HETATM10155 O HOH A3278 53.305 1.345 17.129 1.00 0.00 O 0 +HETATM10156 H1 HOH A3278 54.182 1.659 17.129 1.00 0.00 H 0 +HETATM10157 H2 HOH A3278 53.004 1.642 18.007 1.00 0.00 H 0 +HETATM10158 O HOH A3279 12.148 5.109 36.158 1.00 0.00 O 0 +HETATM10159 H1 HOH A3279 11.692 4.354 35.770 1.00 0.00 H 0 +HETATM10160 H2 HOH A3279 12.029 4.970 37.141 1.00 0.00 H 0 +HETATM10161 O HOH A3280 44.536 0.982 11.059 1.00 0.00 O 0 +HETATM10162 H1 HOH A3280 45.004 0.247 11.470 1.00 0.00 H 0 +HETATM10163 H2 HOH A3280 45.141 1.704 11.109 1.00 0.00 H 0 +HETATM10164 O HOH A3281 0.078 46.955 52.844 1.00 0.00 O 0 +HETATM10165 H1 HOH A3281 0.453 46.476 52.108 1.00 0.00 H 0 +HETATM10166 H2 HOH A3281 0.849 46.994 53.402 1.00 0.00 H 0 +HETATM10167 O HOH A3282 10.051 33.699 38.748 1.00 0.00 O 0 +HETATM10168 H1 HOH A3282 9.245 34.199 38.589 1.00 0.00 H 0 +HETATM10169 H2 HOH A3282 9.963 33.123 39.485 1.00 0.00 H 0 +HETATM10170 O HOH A3283 17.189 49.170 9.618 1.00 0.00 O 0 +HETATM10171 H1 HOH A3283 16.912 48.247 9.419 1.00 0.00 H 0 +HETATM10172 H2 HOH A3283 18.028 49.231 9.137 1.00 0.00 H 0 +HETATM10173 O HOH A3284 43.688 18.904 21.632 1.00 0.00 O 0 +HETATM10174 H1 HOH A3284 44.309 18.173 21.425 1.00 0.00 H 0 +HETATM10175 H2 HOH A3284 43.159 18.518 22.371 1.00 0.00 H 0 +HETATM10176 O HOH A3285 47.483 43.826 21.337 1.00 0.00 O 0 +HETATM10177 H1 HOH A3285 46.881 44.049 20.543 1.00 0.00 H 0 +HETATM10178 H2 HOH A3285 48.339 43.794 20.934 1.00 0.00 H 0 +HETATM10179 O HOH A3286 44.965 44.574 41.707 1.00 0.00 O 0 +HETATM10180 H1 HOH A3286 44.491 43.982 41.143 1.00 0.00 H 0 +HETATM10181 H2 HOH A3286 45.849 44.630 41.378 1.00 0.00 H 0 +HETATM10182 O HOH A3287 31.395 2.493 5.681 1.00 0.00 O 0 +HETATM10183 H1 HOH A3287 31.261 3.421 5.560 1.00 0.00 H 0 +HETATM10184 H2 HOH A3287 32.203 2.415 6.207 1.00 0.00 H 0 +HETATM10185 O HOH A3288 47.056 16.435 39.818 1.00 0.00 O 0 +HETATM10186 H1 HOH A3288 46.765 16.721 38.905 1.00 0.00 H 0 +HETATM10187 H2 HOH A3288 47.436 17.279 40.221 1.00 0.00 H 0 +HETATM10188 O HOH A3289 8.557 50.127 38.948 1.00 0.00 O 0 +HETATM10189 H1 HOH A3289 7.907 50.742 39.312 1.00 0.00 H 0 +HETATM10190 H2 HOH A3289 8.125 49.243 38.928 1.00 0.00 H 0 +HETATM10191 O HOH A3290 31.715 14.086 48.239 1.00 0.00 O 0 +HETATM10192 H1 HOH A3290 31.584 13.185 47.817 1.00 0.00 H 0 +HETATM10193 H2 HOH A3290 31.473 14.065 49.139 1.00 0.00 H 0 +HETATM10194 O HOH A3291 8.677 29.306 46.483 1.00 0.00 O 0 +HETATM10195 H1 HOH A3291 7.697 29.484 46.351 1.00 0.00 H 0 +HETATM10196 H2 HOH A3291 8.889 28.522 47.008 1.00 0.00 H 0 +HETATM10197 O HOH A3292 50.251 4.390 1.023 1.00 0.00 O 0 +HETATM10198 H1 HOH A3292 51.212 4.205 1.129 1.00 0.00 H 0 +HETATM10199 H2 HOH A3292 50.088 5.232 1.548 1.00 0.00 H 0 +HETATM10200 O HOH A3293 26.977 46.091 20.914 1.00 0.00 O 0 +HETATM10201 H1 HOH A3293 26.734 47.017 20.901 1.00 0.00 H 0 +HETATM10202 H2 HOH A3293 27.055 45.945 21.914 1.00 0.00 H 0 +HETATM10203 O HOH A3294 17.940 29.393 33.223 1.00 0.00 O 0 +HETATM10204 H1 HOH A3294 18.278 28.502 33.266 1.00 0.00 H 0 +HETATM10205 H2 HOH A3294 18.079 29.863 33.991 1.00 0.00 H 0 +HETATM10206 O HOH A3295 11.448 50.299 46.345 1.00 0.00 O 0 +HETATM10207 H1 HOH A3295 12.079 50.692 45.747 1.00 0.00 H 0 +HETATM10208 H2 HOH A3295 11.411 49.370 45.994 1.00 0.00 H 0 +HETATM10209 O HOH A3296 13.857 13.051 0.221 1.00 0.00 O 0 +HETATM10210 H1 HOH A3296 14.284 12.268 -0.135 1.00 0.00 H 0 +HETATM10211 H2 HOH A3296 13.023 12.740 0.618 1.00 0.00 H 0 +HETATM10212 O HOH A3297 16.527 18.808 51.328 1.00 0.00 O 0 +HETATM10213 H1 HOH A3297 17.451 18.917 51.185 1.00 0.00 H 0 +HETATM10214 H2 HOH A3297 16.254 19.294 52.112 1.00 0.00 H 0 +HETATM10215 O HOH A3298 36.620 43.217 40.930 1.00 0.00 O 0 +HETATM10216 H1 HOH A3298 37.394 43.657 40.525 1.00 0.00 H 0 +HETATM10217 H2 HOH A3298 37.007 42.392 41.307 1.00 0.00 H 0 +HETATM10218 O HOH A3299 12.101 34.440 30.104 1.00 0.00 O 0 +HETATM10219 H1 HOH A3299 11.533 34.576 29.374 1.00 0.00 H 0 +HETATM10220 H2 HOH A3299 12.802 33.887 29.811 1.00 0.00 H 0 +HETATM10221 O HOH A3300 41.857 9.817 52.885 1.00 0.00 O 0 +HETATM10222 H1 HOH A3300 41.677 10.657 52.359 1.00 0.00 H 0 +HETATM10223 H2 HOH A3300 42.181 10.209 53.663 1.00 0.00 H 0 +HETATM10224 O HOH A3301 17.508 39.849 11.594 1.00 0.00 O 0 +HETATM10225 H1 HOH A3301 17.797 38.989 11.194 1.00 0.00 H 0 +HETATM10226 H2 HOH A3301 17.075 39.537 12.490 1.00 0.00 H 0 +HETATM10227 O HOH A3302 32.506 28.732 8.276 1.00 0.00 O 0 +HETATM10228 H1 HOH A3302 33.418 29.072 8.034 1.00 0.00 H 0 +HETATM10229 H2 HOH A3302 31.932 29.316 7.863 1.00 0.00 H 0 +HETATM10230 O HOH A3303 3.623 20.083 2.513 1.00 0.00 O 0 +HETATM10231 H1 HOH A3303 3.530 19.783 3.411 1.00 0.00 H 0 +HETATM10232 H2 HOH A3303 2.712 20.094 2.162 1.00 0.00 H 0 +HETATM10233 O HOH A3304 9.211 19.178 41.974 1.00 0.00 O 0 +HETATM10234 H1 HOH A3304 9.217 18.518 42.718 1.00 0.00 H 0 +HETATM10235 H2 HOH A3304 8.838 18.710 41.220 1.00 0.00 H 0 +HETATM10236 O HOH A3305 3.833 44.061 9.457 1.00 0.00 O 0 +HETATM10237 H1 HOH A3305 3.842 43.266 8.824 1.00 0.00 H 0 +HETATM10238 H2 HOH A3305 4.696 44.516 9.388 1.00 0.00 H 0 +HETATM10239 O HOH A3306 16.078 14.255 46.295 1.00 0.00 O 0 +HETATM10240 H1 HOH A3306 15.818 15.156 46.462 1.00 0.00 H 0 +HETATM10241 H2 HOH A3306 17.027 14.230 46.241 1.00 0.00 H 0 +HETATM10242 O HOH A3307 27.389 8.721 44.968 1.00 0.00 O 0 +HETATM10243 H1 HOH A3307 26.464 8.555 45.276 1.00 0.00 H 0 +HETATM10244 H2 HOH A3307 27.320 9.546 44.472 1.00 0.00 H 0 +HETATM10245 O HOH A3308 5.802 50.375 9.808 1.00 0.00 O 0 +HETATM10246 H1 HOH A3308 6.031 49.747 9.138 1.00 0.00 H 0 +HETATM10247 H2 HOH A3308 4.906 50.666 9.635 1.00 0.00 H 0 +HETATM10248 O HOH A3309 33.196 49.252 34.890 1.00 0.00 O 0 +HETATM10249 H1 HOH A3309 33.497 49.644 35.739 1.00 0.00 H 0 +HETATM10250 H2 HOH A3309 33.957 49.302 34.280 1.00 0.00 H 0 +HETATM10251 O HOH A3310 50.149 41.460 44.586 1.00 0.00 O 0 +HETATM10252 H1 HOH A3310 49.373 41.020 44.219 1.00 0.00 H 0 +HETATM10253 H2 HOH A3310 50.054 42.384 44.417 1.00 0.00 H 0 +HETATM10254 O HOH A3311 2.450 48.651 2.413 1.00 0.00 O 0 +HETATM10255 H1 HOH A3311 3.293 48.921 2.729 1.00 0.00 H 0 +HETATM10256 H2 HOH A3311 2.067 49.486 2.026 1.00 0.00 H 0 +HETATM10257 O HOH A3312 50.840 27.668 23.170 1.00 0.00 O 0 +HETATM10258 H1 HOH A3312 50.147 28.222 22.815 1.00 0.00 H 0 +HETATM10259 H2 HOH A3312 51.508 28.289 23.515 1.00 0.00 H 0 +HETATM10260 O HOH A3313 4.148 9.951 8.588 1.00 0.00 O 0 +HETATM10261 H1 HOH A3313 4.304 10.789 8.177 1.00 0.00 H 0 +HETATM10262 H2 HOH A3313 3.419 9.516 8.153 1.00 0.00 H 0 +HETATM10263 O HOH A3314 2.002 49.916 11.933 1.00 0.00 O 0 +HETATM10264 H1 HOH A3314 2.874 49.572 12.175 1.00 0.00 H 0 +HETATM10265 H2 HOH A3314 1.360 49.344 12.285 1.00 0.00 H 0 +HETATM10266 O HOH A3315 23.207 48.977 20.768 1.00 0.00 O 0 +HETATM10267 H1 HOH A3315 22.476 49.328 20.296 1.00 0.00 H 0 +HETATM10268 H2 HOH A3315 23.065 48.051 20.778 1.00 0.00 H 0 +HETATM10269 O HOH A3316 11.940 29.219 9.164 1.00 0.00 O 0 +HETATM10270 H1 HOH A3316 11.125 29.292 8.700 1.00 0.00 H 0 +HETATM10271 H2 HOH A3316 12.108 30.135 9.583 1.00 0.00 H 0 +HETATM10272 O HOH A3317 27.334 26.837 15.019 1.00 0.00 O 0 +HETATM10273 H1 HOH A3317 27.596 25.889 14.888 1.00 0.00 H 0 +HETATM10274 H2 HOH A3317 27.782 27.312 14.256 1.00 0.00 H 0 +HETATM10275 O HOH A3318 8.995 35.688 23.725 1.00 0.00 O 0 +HETATM10276 H1 HOH A3318 9.020 36.642 23.481 1.00 0.00 H 0 +HETATM10277 H2 HOH A3318 8.494 35.328 22.965 1.00 0.00 H 0 +HETATM10278 O HOH A3319 19.045 33.470 53.132 1.00 0.00 O 0 +HETATM10279 H1 HOH A3319 19.669 34.000 52.602 1.00 0.00 H 0 +HETATM10280 H2 HOH A3319 18.436 33.171 52.441 1.00 0.00 H 0 +HETATM10281 O HOH A3320 47.129 46.184 49.061 1.00 0.00 O 0 +HETATM10282 H1 HOH A3320 47.263 46.218 50.031 1.00 0.00 H 0 +HETATM10283 H2 HOH A3320 47.242 45.261 48.757 1.00 0.00 H 0 +HETATM10284 O HOH A3321 21.114 46.731 28.600 1.00 0.00 O 0 +HETATM10285 H1 HOH A3321 21.747 46.665 29.359 1.00 0.00 H 0 +HETATM10286 H2 HOH A3321 20.994 45.822 28.242 1.00 0.00 H 0 +HETATM10287 O HOH A3322 21.459 33.903 33.367 1.00 0.00 O 0 +HETATM10288 H1 HOH A3322 21.742 34.480 32.621 1.00 0.00 H 0 +HETATM10289 H2 HOH A3322 22.076 33.191 33.467 1.00 0.00 H 0 +HETATM10290 O HOH A3323 2.499 47.495 34.922 1.00 0.00 O 0 +HETATM10291 H1 HOH A3323 2.137 46.719 35.318 1.00 0.00 H 0 +HETATM10292 H2 HOH A3323 2.343 48.260 35.472 1.00 0.00 H 0 +HETATM10293 O HOH A3324 3.884 13.847 45.406 1.00 0.00 O 0 +HETATM10294 H1 HOH A3324 2.943 13.909 45.449 1.00 0.00 H 0 +HETATM10295 H2 HOH A3324 4.108 12.897 45.274 1.00 0.00 H 0 +HETATM10296 O HOH A3325 52.231 10.888 29.606 1.00 0.00 O 0 +HETATM10297 H1 HOH A3325 52.346 9.922 29.605 1.00 0.00 H 0 +HETATM10298 H2 HOH A3325 52.240 11.200 30.538 1.00 0.00 H 0 +HETATM10299 O HOH A3326 48.823 48.908 7.611 1.00 0.00 O 0 +HETATM10300 H1 HOH A3326 49.092 49.123 8.540 1.00 0.00 H 0 +HETATM10301 H2 HOH A3326 49.368 48.183 7.341 1.00 0.00 H 0 +HETATM10302 O HOH A3327 40.891 35.908 41.098 1.00 0.00 O 0 +HETATM10303 H1 HOH A3327 40.500 35.075 40.973 1.00 0.00 H 0 +HETATM10304 H2 HOH A3327 40.901 36.150 42.031 1.00 0.00 H 0 +HETATM10305 O HOH A3328 50.654 27.026 30.532 1.00 0.00 O 0 +HETATM10306 H1 HOH A3328 51.508 26.739 30.919 1.00 0.00 H 0 +HETATM10307 H2 HOH A3328 50.046 27.042 31.334 1.00 0.00 H 0 +HETATM10308 O HOH A3329 45.435 23.748 36.022 1.00 0.00 O 0 +HETATM10309 H1 HOH A3329 45.425 24.694 35.684 1.00 0.00 H 0 +HETATM10310 H2 HOH A3329 46.399 23.554 36.035 1.00 0.00 H 0 +HETATM10311 O HOH A3330 36.485 50.689 38.955 1.00 0.00 O 0 +HETATM10312 H1 HOH A3330 36.246 49.865 39.416 1.00 0.00 H 0 +HETATM10313 H2 HOH A3330 37.240 50.434 38.346 1.00 0.00 H 0 +HETATM10314 O HOH A3331 41.843 48.924 27.808 1.00 0.00 O 0 +HETATM10315 H1 HOH A3331 42.375 49.678 28.113 1.00 0.00 H 0 +HETATM10316 H2 HOH A3331 42.245 48.155 28.189 1.00 0.00 H 0 +HETATM10317 O HOH A3332 48.258 19.379 33.618 1.00 0.00 O 0 +HETATM10318 H1 HOH A3332 48.342 19.899 34.434 1.00 0.00 H 0 +HETATM10319 H2 HOH A3332 48.481 18.474 33.804 1.00 0.00 H 0 +HETATM10320 O HOH A3333 43.900 45.510 35.753 1.00 0.00 O 0 +HETATM10321 H1 HOH A3333 44.039 46.163 36.389 1.00 0.00 H 0 +HETATM10322 H2 HOH A3333 43.258 45.837 35.142 1.00 0.00 H 0 +HETATM10323 O HOH A3334 16.925 31.031 16.062 1.00 0.00 O 0 +HETATM10324 H1 HOH A3334 16.402 31.322 15.252 1.00 0.00 H 0 +HETATM10325 H2 HOH A3334 16.346 30.286 16.373 1.00 0.00 H 0 +HETATM10326 O HOH A3335 32.601 12.038 39.777 1.00 0.00 O 0 +HETATM10327 H1 HOH A3335 32.132 12.766 40.132 1.00 0.00 H 0 +HETATM10328 H2 HOH A3335 33.334 12.313 39.244 1.00 0.00 H 0 +HETATM10329 O HOH A3336 26.392 0.326 53.460 1.00 0.00 O 0 +HETATM10330 H1 HOH A3336 27.185 0.779 53.219 1.00 0.00 H 0 +HETATM10331 H2 HOH A3336 25.830 0.903 54.073 1.00 0.00 H 0 +HETATM10332 O HOH A3337 22.668 52.646 16.279 1.00 0.00 O 0 +HETATM10333 H1 HOH A3337 22.669 51.818 16.759 1.00 0.00 H 0 +HETATM10334 H2 HOH A3337 21.921 53.099 16.662 1.00 0.00 H 0 +HETATM10335 O HOH A3338 17.218 53.519 53.324 1.00 0.00 O 0 +HETATM10336 H1 HOH A3338 16.613 53.105 53.943 1.00 0.00 H 0 +HETATM10337 H2 HOH A3338 16.838 53.468 52.435 1.00 0.00 H 0 +HETATM10338 O HOH A3339 13.818 36.579 31.204 1.00 0.00 O 0 +HETATM10339 H1 HOH A3339 14.654 36.716 30.788 1.00 0.00 H 0 +HETATM10340 H2 HOH A3339 13.265 35.993 30.681 1.00 0.00 H 0 +HETATM10341 O HOH A3340 49.983 4.336 51.779 1.00 0.00 O 0 +HETATM10342 H1 HOH A3340 50.073 3.405 51.485 1.00 0.00 H 0 +HETATM10343 H2 HOH A3340 50.227 4.251 52.680 1.00 0.00 H 0 +HETATM10344 O HOH A3341 8.007 52.225 33.900 1.00 0.00 O 0 +HETATM10345 H1 HOH A3341 7.530 53.036 33.581 1.00 0.00 H 0 +HETATM10346 H2 HOH A3341 8.799 52.622 34.203 1.00 0.00 H 0 +HETATM10347 O HOH A3342 49.765 23.429 23.567 1.00 0.00 O 0 +HETATM10348 H1 HOH A3342 49.955 24.256 23.140 1.00 0.00 H 0 +HETATM10349 H2 HOH A3342 48.773 23.366 23.556 1.00 0.00 H 0 +HETATM10350 O HOH A3343 53.601 44.453 40.528 1.00 0.00 O 0 +HETATM10351 H1 HOH A3343 52.678 44.286 40.190 1.00 0.00 H 0 +HETATM10352 H2 HOH A3343 53.477 45.325 40.946 1.00 0.00 H 0 +HETATM10353 O HOH A3344 24.290 31.216 53.237 1.00 0.00 O 0 +HETATM10354 H1 HOH A3344 23.692 31.895 52.829 1.00 0.00 H 0 +HETATM10355 H2 HOH A3344 24.084 31.370 54.141 1.00 0.00 H 0 +HETATM10356 O HOH A3345 39.197 25.855 5.822 1.00 0.00 O 0 +HETATM10357 H1 HOH A3345 38.856 24.949 5.905 1.00 0.00 H 0 +HETATM10358 H2 HOH A3345 38.580 26.309 5.228 1.00 0.00 H 0 +HETATM10359 O HOH A3346 1.648 47.890 6.617 1.00 0.00 O 0 +HETATM10360 H1 HOH A3346 1.546 47.044 7.077 1.00 0.00 H 0 +HETATM10361 H2 HOH A3346 2.603 47.950 6.432 1.00 0.00 H 0 +HETATM10362 O HOH A3347 53.271 7.339 7.647 1.00 0.00 O 0 +HETATM10363 H1 HOH A3347 52.580 8.003 7.684 1.00 0.00 H 0 +HETATM10364 H2 HOH A3347 53.037 6.996 6.770 1.00 0.00 H 0 +HETATM10365 O HOH A3348 6.129 14.791 52.939 1.00 0.00 O 0 +HETATM10366 H1 HOH A3348 6.440 14.109 53.515 1.00 0.00 H 0 +HETATM10367 H2 HOH A3348 6.190 15.540 53.554 1.00 0.00 H 0 +HETATM10368 O HOH A3349 39.964 6.820 32.448 1.00 0.00 O 0 +HETATM10369 H1 HOH A3349 40.817 6.836 32.781 1.00 0.00 H 0 +HETATM10370 H2 HOH A3349 39.364 7.334 33.081 1.00 0.00 H 0 +HETATM10371 O HOH A3350 50.770 32.701 52.525 1.00 0.00 O 0 +HETATM10372 H1 HOH A3350 51.688 32.313 52.555 1.00 0.00 H 0 +HETATM10373 H2 HOH A3350 50.628 33.224 51.743 1.00 0.00 H 0 +HETATM10374 O HOH A3351 9.226 51.087 13.340 1.00 0.00 O 0 +HETATM10375 H1 HOH A3351 8.815 51.234 12.471 1.00 0.00 H 0 +HETATM10376 H2 HOH A3351 9.999 50.469 13.355 1.00 0.00 H 0 +HETATM10377 O HOH A3352 26.512 52.222 2.790 1.00 0.00 O 0 +HETATM10378 H1 HOH A3352 26.161 51.868 1.935 1.00 0.00 H 0 +HETATM10379 H2 HOH A3352 25.740 52.587 3.310 1.00 0.00 H 0 +HETATM10380 O HOH A3353 22.364 13.768 37.783 1.00 0.00 O 0 +HETATM10381 H1 HOH A3353 21.839 13.030 38.203 1.00 0.00 H 0 +HETATM10382 H2 HOH A3353 22.403 14.461 38.384 1.00 0.00 H 0 +HETATM10383 O HOH A3354 35.039 8.866 19.633 1.00 0.00 O 0 +HETATM10384 H1 HOH A3354 34.801 7.981 19.322 1.00 0.00 H 0 +HETATM10385 H2 HOH A3354 34.599 9.489 18.958 1.00 0.00 H 0 +HETATM10386 O HOH A3355 6.288 23.872 40.033 1.00 0.00 O 0 +HETATM10387 H1 HOH A3355 5.835 23.630 40.825 1.00 0.00 H 0 +HETATM10388 H2 HOH A3355 6.752 23.185 39.754 1.00 0.00 H 0 +HETATM10389 O HOH A3356 6.781 33.397 45.656 1.00 0.00 O 0 +HETATM10390 H1 HOH A3356 5.928 32.884 45.468 1.00 0.00 H 0 +HETATM10391 H2 HOH A3356 6.424 34.273 45.388 1.00 0.00 H 0 +HETATM10392 O HOH A3357 14.938 4.836 14.484 1.00 0.00 O 0 +HETATM10393 H1 HOH A3357 15.723 4.252 14.432 1.00 0.00 H 0 +HETATM10394 H2 HOH A3357 14.508 4.692 15.381 1.00 0.00 H 0 +HETATM10395 O HOH A3358 16.449 4.332 48.905 1.00 0.00 O 0 +HETATM10396 H1 HOH A3358 16.262 3.412 48.495 1.00 0.00 H 0 +HETATM10397 H2 HOH A3358 15.755 4.489 49.564 1.00 0.00 H 0 +HETATM10398 O HOH A3359 45.509 8.139 7.726 1.00 0.00 O 0 +HETATM10399 H1 HOH A3359 46.413 8.539 7.674 1.00 0.00 H 0 +HETATM10400 H2 HOH A3359 44.860 8.342 7.051 1.00 0.00 H 0 +HETATM10401 O HOH A3360 35.299 50.615 15.055 1.00 0.00 O 0 +HETATM10402 H1 HOH A3360 35.015 50.039 14.304 1.00 0.00 H 0 +HETATM10403 H2 HOH A3360 35.521 50.041 15.778 1.00 0.00 H 0 +HETATM10404 O HOH A3361 44.261 26.846 48.767 1.00 0.00 O 0 +HETATM10405 H1 HOH A3361 45.224 26.645 48.589 1.00 0.00 H 0 +HETATM10406 H2 HOH A3361 44.115 27.771 48.676 1.00 0.00 H 0 +HETATM10407 O HOH A3362 10.283 28.877 53.496 1.00 0.00 O 0 +HETATM10408 H1 HOH A3362 10.250 28.228 52.797 1.00 0.00 H 0 +HETATM10409 H2 HOH A3362 10.403 29.747 52.996 1.00 0.00 H 0 +HETATM10410 O HOH A3363 10.448 33.071 2.305 1.00 0.00 O 0 +HETATM10411 H1 HOH A3363 10.714 33.627 2.994 1.00 0.00 H 0 +HETATM10412 H2 HOH A3363 9.672 32.631 2.636 1.00 0.00 H 0 +HETATM10413 O HOH A3364 7.875 36.708 27.831 1.00 0.00 O 0 +HETATM10414 H1 HOH A3364 7.726 37.274 27.073 1.00 0.00 H 0 +HETATM10415 H2 HOH A3364 7.063 36.326 28.077 1.00 0.00 H 0 +HETATM10416 O HOH A3365 10.655 41.545 39.751 1.00 0.00 O 0 +HETATM10417 H1 HOH A3365 9.966 41.847 40.417 1.00 0.00 H 0 +HETATM10418 H2 HOH A3365 10.428 41.974 38.947 1.00 0.00 H 0 +HETATM10419 O HOH A3366 19.303 22.745 11.667 1.00 0.00 O 0 +HETATM10420 H1 HOH A3366 19.475 23.564 12.132 1.00 0.00 H 0 +HETATM10421 H2 HOH A3366 18.453 22.739 11.198 1.00 0.00 H 0 +HETATM10422 O HOH A3367 51.845 34.502 8.057 1.00 0.00 O 0 +HETATM10423 H1 HOH A3367 52.039 35.314 7.516 1.00 0.00 H 0 +HETATM10424 H2 HOH A3367 52.236 33.775 7.561 1.00 0.00 H 0 +HETATM10425 O HOH A3368 42.421 6.051 13.245 1.00 0.00 O 0 +HETATM10426 H1 HOH A3368 43.325 6.403 13.358 1.00 0.00 H 0 +HETATM10427 H2 HOH A3368 41.849 6.587 12.567 1.00 0.00 H 0 +HETATM10428 O HOH A3369 39.237 23.902 49.852 1.00 0.00 O 0 +HETATM10429 H1 HOH A3369 39.635 24.556 50.423 1.00 0.00 H 0 +HETATM10430 H2 HOH A3369 38.537 23.533 50.409 1.00 0.00 H 0 +HETATM10431 O HOH A3370 28.550 0.155 44.721 1.00 0.00 O 0 +HETATM10432 H1 HOH A3370 27.857 0.711 45.107 1.00 0.00 H 0 +HETATM10433 H2 HOH A3370 28.116 -0.438 44.089 1.00 0.00 H 0 +HETATM10434 O HOH A3371 46.901 12.925 46.100 1.00 0.00 O 0 +HETATM10435 H1 HOH A3371 47.154 12.399 45.275 1.00 0.00 H 0 +HETATM10436 H2 HOH A3371 47.107 13.771 45.790 1.00 0.00 H 0 +HETATM10437 O HOH A3372 26.606 48.378 49.067 1.00 0.00 O 0 +HETATM10438 H1 HOH A3372 26.652 49.331 48.816 1.00 0.00 H 0 +HETATM10439 H2 HOH A3372 25.793 48.002 48.645 1.00 0.00 H 0 +HETATM10440 O HOH A3373 49.630 17.597 49.818 1.00 0.00 O 0 +HETATM10441 H1 HOH A3373 49.263 18.204 50.488 1.00 0.00 H 0 +HETATM10442 H2 HOH A3373 49.252 16.756 49.967 1.00 0.00 H 0 +HETATM10443 O HOH A3374 24.496 41.366 13.987 1.00 0.00 O 0 +HETATM10444 H1 HOH A3374 23.688 41.101 14.487 1.00 0.00 H 0 +HETATM10445 H2 HOH A3374 24.281 41.101 13.082 1.00 0.00 H 0 +HETATM10446 O HOH A3375 15.141 29.552 34.557 1.00 0.00 O 0 +HETATM10447 H1 HOH A3375 14.686 29.488 33.674 1.00 0.00 H 0 +HETATM10448 H2 HOH A3375 15.719 28.843 34.502 1.00 0.00 H 0 +HETATM10449 O HOH A3376 20.099 14.833 36.504 1.00 0.00 O 0 +HETATM10450 H1 HOH A3376 19.598 14.128 36.963 1.00 0.00 H 0 +HETATM10451 H2 HOH A3376 20.998 14.632 36.706 1.00 0.00 H 0 +HETATM10452 O HOH A3377 3.561 52.430 2.690 1.00 0.00 O 0 +HETATM10453 H1 HOH A3377 3.934 52.038 1.883 1.00 0.00 H 0 +HETATM10454 H2 HOH A3377 4.154 53.176 3.039 1.00 0.00 H 0 +HETATM10455 O HOH A3378 6.254 51.521 39.872 1.00 0.00 O 0 +HETATM10456 H1 HOH A3378 6.254 52.392 40.395 1.00 0.00 H 0 +HETATM10457 H2 HOH A3378 6.146 50.838 40.541 1.00 0.00 H 0 +HETATM10458 O HOH A3379 7.622 11.580 50.058 1.00 0.00 O 0 +HETATM10459 H1 HOH A3379 6.747 11.481 49.705 1.00 0.00 H 0 +HETATM10460 H2 HOH A3379 7.913 12.528 49.966 1.00 0.00 H 0 +HETATM10461 O HOH A3380 47.066 0.236 31.567 1.00 0.00 O 0 +HETATM10462 H1 HOH A3380 46.748 -0.428 30.914 1.00 0.00 H 0 +HETATM10463 H2 HOH A3380 47.255 1.111 31.057 1.00 0.00 H 0 +HETATM10464 O HOH A3381 53.241 22.367 33.807 1.00 0.00 O 0 +HETATM10465 H1 HOH A3381 53.503 21.820 33.067 1.00 0.00 H 0 +HETATM10466 H2 HOH A3381 52.969 21.798 34.528 1.00 0.00 H 0 +HETATM10467 O HOH A3382 38.717 45.782 49.249 1.00 0.00 O 0 +HETATM10468 H1 HOH A3382 38.508 46.175 48.380 1.00 0.00 H 0 +HETATM10469 H2 HOH A3382 38.928 46.449 49.954 1.00 0.00 H 0 +HETATM10470 O HOH A3383 46.057 52.113 14.797 1.00 0.00 O 0 +HETATM10471 H1 HOH A3383 45.493 52.835 14.927 1.00 0.00 H 0 +HETATM10472 H2 HOH A3383 46.973 52.479 14.595 1.00 0.00 H 0 +HETATM10473 O HOH A3384 11.735 5.137 38.935 1.00 0.00 O 0 +HETATM10474 H1 HOH A3384 10.805 4.846 39.285 1.00 0.00 H 0 +HETATM10475 H2 HOH A3384 12.357 4.852 39.660 1.00 0.00 H 0 +HETATM10476 O HOH A3385 36.091 27.390 49.035 1.00 0.00 O 0 +HETATM10477 H1 HOH A3385 36.368 27.917 48.300 1.00 0.00 H 0 +HETATM10478 H2 HOH A3385 36.058 27.976 49.807 1.00 0.00 H 0 +HETATM10479 O HOH A3386 18.599 0.075 46.732 1.00 0.00 O 0 +HETATM10480 H1 HOH A3386 18.759 0.797 46.104 1.00 0.00 H 0 +HETATM10481 H2 HOH A3386 19.285 -0.554 46.485 1.00 0.00 H 0 +HETATM10482 O HOH A3387 43.542 25.710 9.914 1.00 0.00 O 0 +HETATM10483 H1 HOH A3387 43.375 25.714 8.963 1.00 0.00 H 0 +HETATM10484 H2 HOH A3387 42.740 26.166 10.301 1.00 0.00 H 0 +HETATM10485 O HOH A3388 14.841 6.209 10.369 1.00 0.00 O 0 +HETATM10486 H1 HOH A3388 15.208 5.541 9.786 1.00 0.00 H 0 +HETATM10487 H2 HOH A3388 15.440 6.307 11.115 1.00 0.00 H 0 +HETATM10488 O HOH A3389 41.791 31.323 10.897 1.00 0.00 O 0 +HETATM10489 H1 HOH A3389 42.184 31.832 10.180 1.00 0.00 H 0 +HETATM10490 H2 HOH A3389 41.655 32.012 11.670 1.00 0.00 H 0 +HETATM10491 O HOH A3390 33.776 46.636 10.402 1.00 0.00 O 0 +HETATM10492 H1 HOH A3390 34.767 46.632 10.265 1.00 0.00 H 0 +HETATM10493 H2 HOH A3390 33.601 45.676 10.244 1.00 0.00 H 0 +HETATM10494 O HOH A3391 21.613 51.649 36.331 1.00 0.00 O 0 +HETATM10495 H1 HOH A3391 21.157 52.405 35.951 1.00 0.00 H 0 +HETATM10496 H2 HOH A3391 22.270 51.988 36.934 1.00 0.00 H 0 +HETATM10497 O HOH A3392 23.127 14.280 28.079 1.00 0.00 O 0 +HETATM10498 H1 HOH A3392 22.405 13.771 28.530 1.00 0.00 H 0 +HETATM10499 H2 HOH A3392 23.953 13.773 28.289 1.00 0.00 H 0 +HETATM10500 O HOH A3393 3.335 47.686 20.160 1.00 0.00 O 0 +HETATM10501 H1 HOH A3393 3.620 47.388 19.277 1.00 0.00 H 0 +HETATM10502 H2 HOH A3393 3.408 46.854 20.612 1.00 0.00 H 0 +HETATM10503 O HOH A3394 15.709 16.674 47.832 1.00 0.00 O 0 +HETATM10504 H1 HOH A3394 15.451 17.543 48.029 1.00 0.00 H 0 +HETATM10505 H2 HOH A3394 16.653 16.892 47.518 1.00 0.00 H 0 +HETATM10506 O HOH A3395 49.027 51.635 20.718 1.00 0.00 O 0 +HETATM10507 H1 HOH A3395 48.285 50.988 20.664 1.00 0.00 H 0 +HETATM10508 H2 HOH A3395 49.234 51.889 19.803 1.00 0.00 H 0 +HETATM10509 O HOH A3396 22.607 14.074 43.802 1.00 0.00 O 0 +HETATM10510 H1 HOH A3396 23.228 13.351 43.914 1.00 0.00 H 0 +HETATM10511 H2 HOH A3396 21.984 14.162 44.474 1.00 0.00 H 0 +HETATM10512 O HOH A3397 1.113 41.082 10.008 1.00 0.00 O 0 +HETATM10513 H1 HOH A3397 0.181 41.357 9.820 1.00 0.00 H 0 +HETATM10514 H2 HOH A3397 1.268 40.343 9.462 1.00 0.00 H 0 +HETATM10515 O HOH A3398 16.644 36.323 43.083 1.00 0.00 O 0 +HETATM10516 H1 HOH A3398 16.635 37.270 43.252 1.00 0.00 H 0 +HETATM10517 H2 HOH A3398 17.573 36.070 43.244 1.00 0.00 H 0 +HETATM10518 O HOH A3399 21.225 36.870 17.795 1.00 0.00 O 0 +HETATM10519 H1 HOH A3399 20.756 36.329 18.443 1.00 0.00 H 0 +HETATM10520 H2 HOH A3399 22.109 36.527 17.584 1.00 0.00 H 0 +HETATM10521 O HOH A3400 25.810 7.486 11.600 1.00 0.00 O 0 +HETATM10522 H1 HOH A3400 25.594 6.561 11.880 1.00 0.00 H 0 +HETATM10523 H2 HOH A3400 24.984 7.869 11.182 1.00 0.00 H 0 +HETATM10524 O HOH A3401 14.049 32.632 28.936 1.00 0.00 O 0 +HETATM10525 H1 HOH A3401 13.973 32.982 28.049 1.00 0.00 H 0 +HETATM10526 H2 HOH A3401 14.896 32.675 29.372 1.00 0.00 H 0 +HETATM10527 O HOH A3402 44.803 27.267 40.456 1.00 0.00 O 0 +HETATM10528 H1 HOH A3402 44.831 27.114 41.409 1.00 0.00 H 0 +HETATM10529 H2 HOH A3402 44.334 26.520 40.122 1.00 0.00 H 0 +HETATM10530 O HOH A3403 9.399 4.881 25.404 1.00 0.00 O 0 +HETATM10531 H1 HOH A3403 9.757 5.601 24.890 1.00 0.00 H 0 +HETATM10532 H2 HOH A3403 9.064 4.266 24.692 1.00 0.00 H 0 +HETATM10533 O HOH A3404 4.925 20.015 12.024 1.00 0.00 O 0 +HETATM10534 H1 HOH A3404 4.101 20.293 11.492 1.00 0.00 H 0 +HETATM10535 H2 HOH A3404 5.109 19.111 11.822 1.00 0.00 H 0 +HETATM10536 O HOH A3405 37.883 2.449 46.755 1.00 0.00 O 0 +HETATM10537 H1 HOH A3405 38.598 1.995 47.313 1.00 0.00 H 0 +HETATM10538 H2 HOH A3405 37.385 3.080 47.293 1.00 0.00 H 0 +HETATM10539 O HOH A3406 47.830 12.302 2.861 1.00 0.00 O 0 +HETATM10540 H1 HOH A3406 47.529 12.054 3.773 1.00 0.00 H 0 +HETATM10541 H2 HOH A3406 48.724 12.622 2.948 1.00 0.00 H 0 +HETATM10542 O HOH A3407 31.392 32.373 18.763 1.00 0.00 O 0 +HETATM10543 H1 HOH A3407 30.762 31.693 18.878 1.00 0.00 H 0 +HETATM10544 H2 HOH A3407 32.259 32.043 18.331 1.00 0.00 H 0 +HETATM10545 O HOH A3408 36.931 16.270 39.435 1.00 0.00 O 0 +HETATM10546 H1 HOH A3408 36.337 16.052 40.096 1.00 0.00 H 0 +HETATM10547 H2 HOH A3408 37.481 15.464 39.327 1.00 0.00 H 0 +HETATM10548 O HOH A3409 39.610 43.736 45.487 1.00 0.00 O 0 +HETATM10549 H1 HOH A3409 40.130 44.352 46.079 1.00 0.00 H 0 +HETATM10550 H2 HOH A3409 38.819 44.218 45.405 1.00 0.00 H 0 +HETATM10551 O HOH A3410 44.628 19.451 53.469 1.00 0.00 O 0 +HETATM10552 H1 HOH A3410 44.683 18.536 53.121 1.00 0.00 H 0 +HETATM10553 H2 HOH A3410 44.107 19.420 54.294 1.00 0.00 H 0 +HETATM10554 O HOH A3411 41.681 49.525 15.705 1.00 0.00 O 0 +HETATM10555 H1 HOH A3411 40.953 50.015 16.113 1.00 0.00 H 0 +HETATM10556 H2 HOH A3411 41.890 48.820 16.308 1.00 0.00 H 0 +HETATM10557 O HOH A3412 19.849 39.333 36.001 1.00 0.00 O 0 +HETATM10558 H1 HOH A3412 19.938 39.613 36.893 1.00 0.00 H 0 +HETATM10559 H2 HOH A3412 20.185 38.470 35.943 1.00 0.00 H 0 +HETATM10560 O HOH A3413 53.282 39.138 32.492 1.00 0.00 O 0 +HETATM10561 H1 HOH A3413 53.630 38.264 32.252 1.00 0.00 H 0 +HETATM10562 H2 HOH A3413 54.011 39.769 32.683 1.00 0.00 H 0 +HETATM10563 O HOH A3414 10.333 34.241 9.367 1.00 0.00 O 0 +HETATM10564 H1 HOH A3414 9.827 33.422 9.290 1.00 0.00 H 0 +HETATM10565 H2 HOH A3414 10.318 34.383 10.338 1.00 0.00 H 0 +HETATM10566 O HOH A3415 24.841 40.736 51.337 1.00 0.00 O 0 +HETATM10567 H1 HOH A3415 25.227 41.400 50.745 1.00 0.00 H 0 +HETATM10568 H2 HOH A3415 23.925 40.941 51.448 1.00 0.00 H 0 +HETATM10569 O HOH A3416 43.049 51.977 53.369 1.00 0.00 O 0 +HETATM10570 H1 HOH A3416 42.136 51.655 53.494 1.00 0.00 H 0 +HETATM10571 H2 HOH A3416 43.625 51.217 53.343 1.00 0.00 H 0 +HETATM10572 O HOH A3417 41.360 5.385 8.056 1.00 0.00 O 0 +HETATM10573 H1 HOH A3417 41.260 6.255 7.654 1.00 0.00 H 0 +HETATM10574 H2 HOH A3417 42.073 4.961 7.556 1.00 0.00 H 0 +HETATM10575 O HOH A3418 20.798 35.985 41.549 1.00 0.00 O 0 +HETATM10576 H1 HOH A3418 20.764 36.949 41.202 1.00 0.00 H 0 +HETATM10577 H2 HOH A3418 21.155 35.430 40.786 1.00 0.00 H 0 +HETATM10578 O HOH A3419 13.681 25.635 28.864 1.00 0.00 O 0 +HETATM10579 H1 HOH A3419 13.789 26.343 28.216 1.00 0.00 H 0 +HETATM10580 H2 HOH A3419 13.727 26.063 29.703 1.00 0.00 H 0 +HETATM10581 O HOH A3420 5.881 11.851 13.944 1.00 0.00 O 0 +HETATM10582 H1 HOH A3420 5.275 12.604 13.890 1.00 0.00 H 0 +HETATM10583 H2 HOH A3420 6.453 11.851 13.131 1.00 0.00 H 0 +HETATM10584 O HOH A3421 30.687 25.251 46.326 1.00 0.00 O 0 +HETATM10585 H1 HOH A3421 31.560 25.349 46.667 1.00 0.00 H 0 +HETATM10586 H2 HOH A3421 30.741 25.745 45.541 1.00 0.00 H 0 +HETATM10587 O HOH A3422 24.840 40.144 48.235 1.00 0.00 O 0 +HETATM10588 H1 HOH A3422 25.382 39.513 48.630 1.00 0.00 H 0 +HETATM10589 H2 HOH A3422 25.105 40.924 48.712 1.00 0.00 H 0 +HETATM10590 O HOH A3423 33.638 47.434 7.075 1.00 0.00 O 0 +HETATM10591 H1 HOH A3423 32.805 47.454 7.543 1.00 0.00 H 0 +HETATM10592 H2 HOH A3423 33.789 46.490 6.829 1.00 0.00 H 0 +HETATM10593 O HOH A3424 26.206 48.993 35.406 1.00 0.00 O 0 +HETATM10594 H1 HOH A3424 26.866 48.507 34.943 1.00 0.00 H 0 +HETATM10595 H2 HOH A3424 25.882 49.700 34.879 1.00 0.00 H 0 +HETATM10596 O HOH A3425 17.090 0.353 21.197 1.00 0.00 O 0 +HETATM10597 H1 HOH A3425 17.897 -0.025 21.445 1.00 0.00 H 0 +HETATM10598 H2 HOH A3425 17.247 1.306 21.028 1.00 0.00 H 0 +HETATM10599 O HOH A3426 48.239 51.540 0.097 1.00 0.00 O 0 +HETATM10600 H1 HOH A3426 47.738 50.885 0.619 1.00 0.00 H 0 +HETATM10601 H2 HOH A3426 49.129 51.060 0.021 1.00 0.00 H 0 +HETATM10602 O HOH A3427 41.048 26.018 2.738 1.00 0.00 O 0 +HETATM10603 H1 HOH A3427 41.494 25.519 3.414 1.00 0.00 H 0 +HETATM10604 H2 HOH A3427 41.515 25.852 1.954 1.00 0.00 H 0 +HETATM10605 O HOH A3428 0.243 45.141 31.136 1.00 0.00 O 0 +HETATM10606 H1 HOH A3428 0.756 44.317 30.959 1.00 0.00 H 0 +HETATM10607 H2 HOH A3428 0.659 45.860 30.688 1.00 0.00 H 0 +HETATM10608 O HOH A3429 15.718 52.953 45.786 1.00 0.00 O 0 +HETATM10609 H1 HOH A3429 16.540 53.043 46.374 1.00 0.00 H 0 +HETATM10610 H2 HOH A3429 15.787 53.760 45.283 1.00 0.00 H 0 +HETATM10611 O HOH A3430 29.732 29.032 50.142 1.00 0.00 O 0 +HETATM10612 H1 HOH A3430 30.477 29.090 50.765 1.00 0.00 H 0 +HETATM10613 H2 HOH A3430 28.969 28.685 50.652 1.00 0.00 H 0 +HETATM10614 O HOH A3431 24.755 11.710 1.540 1.00 0.00 O 0 +HETATM10615 H1 HOH A3431 25.535 12.093 1.105 1.00 0.00 H 0 +HETATM10616 H2 HOH A3431 25.137 11.329 2.368 1.00 0.00 H 0 +HETATM10617 O HOH A3432 10.587 29.602 14.135 1.00 0.00 O 0 +HETATM10618 H1 HOH A3432 11.064 30.138 14.781 1.00 0.00 H 0 +HETATM10619 H2 HOH A3432 10.542 30.273 13.457 1.00 0.00 H 0 +HETATM10620 O HOH A3433 32.053 20.699 6.091 1.00 0.00 O 0 +HETATM10621 H1 HOH A3433 31.328 21.256 5.991 1.00 0.00 H 0 +HETATM10622 H2 HOH A3433 32.728 21.317 6.495 1.00 0.00 H 0 +HETATM10623 O HOH A3434 17.073 20.255 16.563 1.00 0.00 O 0 +HETATM10624 H1 HOH A3434 17.941 20.128 16.971 1.00 0.00 H 0 +HETATM10625 H2 HOH A3434 16.647 19.451 16.273 1.00 0.00 H 0 +HETATM10626 O HOH A3435 33.865 29.306 17.343 1.00 0.00 O 0 +HETATM10627 H1 HOH A3435 32.940 29.370 17.206 1.00 0.00 H 0 +HETATM10628 H2 HOH A3435 34.076 30.238 17.578 1.00 0.00 H 0 +HETATM10629 O HOH A3436 27.087 48.837 45.741 1.00 0.00 O 0 +HETATM10630 H1 HOH A3436 27.392 48.018 46.091 1.00 0.00 H 0 +HETATM10631 H2 HOH A3436 26.838 48.683 44.774 1.00 0.00 H 0 +HETATM10632 O HOH A3437 6.322 45.492 9.575 1.00 0.00 O 0 +HETATM10633 H1 HOH A3437 7.033 45.322 10.283 1.00 0.00 H 0 +HETATM10634 H2 HOH A3437 6.405 46.454 9.307 1.00 0.00 H 0 +HETATM10635 O HOH A3438 21.237 14.245 13.838 1.00 0.00 O 0 +HETATM10636 H1 HOH A3438 21.172 13.303 13.629 1.00 0.00 H 0 +HETATM10637 H2 HOH A3438 20.796 14.307 14.659 1.00 0.00 H 0 +HETATM10638 O HOH A3439 4.027 18.010 8.971 1.00 0.00 O 0 +HETATM10639 H1 HOH A3439 4.336 17.974 9.900 1.00 0.00 H 0 +HETATM10640 H2 HOH A3439 3.283 17.381 9.026 1.00 0.00 H 0 +HETATM10641 O HOH A3440 44.037 20.386 13.480 1.00 0.00 O 0 +HETATM10642 H1 HOH A3440 44.665 19.716 13.827 1.00 0.00 H 0 +HETATM10643 H2 HOH A3440 43.798 20.165 12.530 1.00 0.00 H 0 +HETATM10644 O HOH A3441 13.158 35.555 18.451 1.00 0.00 O 0 +HETATM10645 H1 HOH A3441 13.005 35.227 19.316 1.00 0.00 H 0 +HETATM10646 H2 HOH A3441 13.473 34.792 17.948 1.00 0.00 H 0 +HETATM10647 O HOH A3442 20.104 5.254 1.593 1.00 0.00 O 0 +HETATM10648 H1 HOH A3442 20.438 4.489 2.066 1.00 0.00 H 0 +HETATM10649 H2 HOH A3442 20.082 5.982 2.283 1.00 0.00 H 0 +HETATM10650 O HOH A3443 48.779 25.643 10.884 1.00 0.00 O 0 +HETATM10651 H1 HOH A3443 47.861 25.389 10.967 1.00 0.00 H 0 +HETATM10652 H2 HOH A3443 48.781 26.174 10.038 1.00 0.00 H 0 +HETATM10653 O HOH A3444 11.506 11.856 0.841 1.00 0.00 O 0 +HETATM10654 H1 HOH A3444 10.856 12.189 1.446 1.00 0.00 H 0 +HETATM10655 H2 HOH A3444 11.657 10.917 1.066 1.00 0.00 H 0 +HETATM10656 O HOH A3445 7.736 4.627 44.227 1.00 0.00 O 0 +HETATM10657 H1 HOH A3445 7.137 4.018 43.818 1.00 0.00 H 0 +HETATM10658 H2 HOH A3445 8.273 4.075 44.794 1.00 0.00 H 0 +HETATM10659 O HOH A3446 27.474 37.992 23.708 1.00 0.00 O 0 +HETATM10660 H1 HOH A3446 27.587 37.161 23.279 1.00 0.00 H 0 +HETATM10661 H2 HOH A3446 26.535 38.183 23.511 1.00 0.00 H 0 +HETATM10662 O HOH A3447 43.032 37.428 21.399 1.00 0.00 O 0 +HETATM10663 H1 HOH A3447 43.379 36.851 20.756 1.00 0.00 H 0 +HETATM10664 H2 HOH A3447 43.769 37.962 21.654 1.00 0.00 H 0 +HETATM10665 O HOH A3448 29.427 44.799 26.638 1.00 0.00 O 0 +HETATM10666 H1 HOH A3448 29.335 43.820 26.433 1.00 0.00 H 0 +HETATM10667 H2 HOH A3448 28.529 45.116 26.724 1.00 0.00 H 0 +HETATM10668 O HOH A3449 1.001 46.483 42.056 1.00 0.00 O 0 +HETATM10669 H1 HOH A3449 1.177 47.340 41.565 1.00 0.00 H 0 +HETATM10670 H2 HOH A3449 1.877 46.261 42.367 1.00 0.00 H 0 +HETATM10671 O HOH A3450 29.183 43.980 52.234 1.00 0.00 O 0 +HETATM10672 H1 HOH A3450 28.346 43.559 51.934 1.00 0.00 H 0 +HETATM10673 H2 HOH A3450 29.891 43.613 51.725 1.00 0.00 H 0 +HETATM10674 O HOH A3451 15.910 9.902 4.030 1.00 0.00 O 0 +HETATM10675 H1 HOH A3451 15.464 9.801 3.227 1.00 0.00 H 0 +HETATM10676 H2 HOH A3451 15.795 10.875 4.182 1.00 0.00 H 0 +HETATM10677 O HOH A3452 29.500 11.789 3.088 1.00 0.00 O 0 +HETATM10678 H1 HOH A3452 29.549 12.618 3.559 1.00 0.00 H 0 +HETATM10679 H2 HOH A3452 29.517 11.849 2.125 1.00 0.00 H 0 +HETATM10680 O HOH A3453 6.341 14.631 39.477 1.00 0.00 O 0 +HETATM10681 H1 HOH A3453 5.860 13.838 39.597 1.00 0.00 H 0 +HETATM10682 H2 HOH A3453 7.253 14.355 39.453 1.00 0.00 H 0 +HETATM10683 O HOH A3454 25.940 42.441 5.662 1.00 0.00 O 0 +HETATM10684 H1 HOH A3454 24.973 42.393 5.520 1.00 0.00 H 0 +HETATM10685 H2 HOH A3454 26.228 41.678 5.165 1.00 0.00 H 0 +HETATM10686 O HOH A3455 30.073 16.547 24.559 1.00 0.00 O 0 +HETATM10687 H1 HOH A3455 29.053 16.539 24.379 1.00 0.00 H 0 +HETATM10688 H2 HOH A3455 30.336 15.749 25.140 1.00 0.00 H 0 +HETATM10689 O HOH A3456 11.041 52.253 32.894 1.00 0.00 O 0 +HETATM10690 H1 HOH A3456 10.861 53.151 32.626 1.00 0.00 H 0 +HETATM10691 H2 HOH A3456 11.074 52.248 33.876 1.00 0.00 H 0 +HETATM10692 O HOH A3457 52.722 14.922 4.344 1.00 0.00 O 0 +HETATM10693 H1 HOH A3457 52.708 15.667 3.756 1.00 0.00 H 0 +HETATM10694 H2 HOH A3457 53.307 15.170 5.065 1.00 0.00 H 0 +HETATM10695 O HOH A3458 10.891 17.829 50.465 1.00 0.00 O 0 +HETATM10696 H1 HOH A3458 11.748 17.975 50.814 1.00 0.00 H 0 +HETATM10697 H2 HOH A3458 10.568 17.048 50.958 1.00 0.00 H 0 +HETATM10698 O HOH A3459 52.894 3.420 1.130 1.00 0.00 O 0 +HETATM10699 H1 HOH A3459 53.130 3.337 0.169 1.00 0.00 H 0 +HETATM10700 H2 HOH A3459 53.452 4.099 1.530 1.00 0.00 H 0 +HETATM10701 O HOH A3460 42.800 15.480 41.855 1.00 0.00 O 0 +HETATM10702 H1 HOH A3460 43.176 14.626 41.604 1.00 0.00 H 0 +HETATM10703 H2 HOH A3460 43.576 16.139 41.864 1.00 0.00 H 0 +HETATM10704 O HOH A3461 8.776 39.237 28.631 1.00 0.00 O 0 +HETATM10705 H1 HOH A3461 8.539 38.319 28.748 1.00 0.00 H 0 +HETATM10706 H2 HOH A3461 9.086 39.501 29.494 1.00 0.00 H 0 +HETATM10707 O HOH A3462 42.583 31.799 30.120 1.00 0.00 O 0 +HETATM10708 H1 HOH A3462 43.148 31.053 29.884 1.00 0.00 H 0 +HETATM10709 H2 HOH A3462 42.327 31.762 31.095 1.00 0.00 H 0 +HETATM10710 O HOH A3463 1.832 33.174 16.907 1.00 0.00 O 0 +HETATM10711 H1 HOH A3463 2.247 33.038 16.085 1.00 0.00 H 0 +HETATM10712 H2 HOH A3463 1.025 32.667 16.849 1.00 0.00 H 0 +HETATM10713 O HOH A3464 5.086 39.637 38.768 1.00 0.00 O 0 +HETATM10714 H1 HOH A3464 4.455 40.337 38.594 1.00 0.00 H 0 +HETATM10715 H2 HOH A3464 4.583 38.959 39.268 1.00 0.00 H 0 +HETATM10716 O HOH A3465 12.038 22.904 10.663 1.00 0.00 O 0 +HETATM10717 H1 HOH A3465 12.600 23.252 11.369 1.00 0.00 H 0 +HETATM10718 H2 HOH A3465 11.509 23.674 10.230 1.00 0.00 H 0 +HETATM10719 O HOH A3466 37.616 23.153 52.137 1.00 0.00 O 0 +HETATM10720 H1 HOH A3466 37.436 24.046 52.339 1.00 0.00 H 0 +HETATM10721 H2 HOH A3466 38.419 22.972 52.617 1.00 0.00 H 0 +HETATM10722 O HOH A3467 21.053 47.415 42.980 1.00 0.00 O 0 +HETATM10723 H1 HOH A3467 21.596 46.671 43.276 1.00 0.00 H 0 +HETATM10724 H2 HOH A3467 21.323 48.238 43.419 1.00 0.00 H 0 +HETATM10725 O HOH A3468 4.950 22.528 7.830 1.00 0.00 O 0 +HETATM10726 H1 HOH A3468 4.950 21.609 7.434 1.00 0.00 H 0 +HETATM10727 H2 HOH A3468 5.431 23.091 7.134 1.00 0.00 H 0 +HETATM10728 O HOH A3469 1.247 31.682 50.066 1.00 0.00 O 0 +HETATM10729 H1 HOH A3469 0.580 32.416 49.920 1.00 0.00 H 0 +HETATM10730 H2 HOH A3469 0.697 31.127 50.723 1.00 0.00 H 0 +HETATM10731 O HOH A3470 0.331 13.873 16.358 1.00 0.00 O 0 +HETATM10732 H1 HOH A3470 1.218 14.285 16.403 1.00 0.00 H 0 +HETATM10733 H2 HOH A3470 0.177 13.726 17.291 1.00 0.00 H 0 +HETATM10734 O HOH A3471 18.413 48.041 33.032 1.00 0.00 O 0 +HETATM10735 H1 HOH A3471 17.527 47.794 33.140 1.00 0.00 H 0 +HETATM10736 H2 HOH A3471 18.568 48.413 33.972 1.00 0.00 H 0 +HETATM10737 O HOH A3472 49.854 45.860 29.237 1.00 0.00 O 0 +HETATM10738 H1 HOH A3472 49.816 45.118 28.607 1.00 0.00 H 0 +HETATM10739 H2 HOH A3472 50.476 45.615 29.910 1.00 0.00 H 0 +HETATM10740 O HOH A3473 8.162 16.937 40.761 1.00 0.00 O 0 +HETATM10741 H1 HOH A3473 8.945 16.969 40.211 1.00 0.00 H 0 +HETATM10742 H2 HOH A3473 7.541 17.149 40.069 1.00 0.00 H 0 +HETATM10743 O HOH A3474 46.578 17.155 42.782 1.00 0.00 O 0 +HETATM10744 H1 HOH A3474 46.230 17.171 41.923 1.00 0.00 H 0 +HETATM10745 H2 HOH A3474 46.798 18.043 43.020 1.00 0.00 H 0 +HETATM10746 O HOH A3475 47.015 32.236 3.594 1.00 0.00 O 0 +HETATM10747 H1 HOH A3475 47.834 31.890 3.122 1.00 0.00 H 0 +HETATM10748 H2 HOH A3475 46.312 32.043 2.946 1.00 0.00 H 0 +HETATM10749 O HOH A3476 31.131 36.847 34.460 1.00 0.00 O 0 +HETATM10750 H1 HOH A3476 30.581 36.113 34.632 1.00 0.00 H 0 +HETATM10751 H2 HOH A3476 31.227 36.953 33.477 1.00 0.00 H 0 +HETATM10752 O HOH A3477 29.905 12.868 15.324 1.00 0.00 O 0 +HETATM10753 H1 HOH A3477 29.959 13.461 16.107 1.00 0.00 H 0 +HETATM10754 H2 HOH A3477 30.103 13.483 14.596 1.00 0.00 H 0 +HETATM10755 O HOH A3478 43.277 4.124 37.867 1.00 0.00 O 0 +HETATM10756 H1 HOH A3478 43.076 5.078 37.729 1.00 0.00 H 0 +HETATM10757 H2 HOH A3478 44.213 4.038 37.499 1.00 0.00 H 0 +HETATM10758 O HOH A3479 29.348 8.680 24.753 1.00 0.00 O 0 +HETATM10759 H1 HOH A3479 29.395 8.294 23.856 1.00 0.00 H 0 +HETATM10760 H2 HOH A3479 29.697 8.049 25.370 1.00 0.00 H 0 +HETATM10761 O HOH A3480 25.552 34.500 19.112 1.00 0.00 O 0 +HETATM10762 H1 HOH A3480 26.416 34.871 19.385 1.00 0.00 H 0 +HETATM10763 H2 HOH A3480 25.087 34.289 19.931 1.00 0.00 H 0 +HETATM10764 O HOH A3481 4.186 40.627 28.021 1.00 0.00 O 0 +HETATM10765 H1 HOH A3481 5.137 40.498 27.963 1.00 0.00 H 0 +HETATM10766 H2 HOH A3481 4.006 40.977 27.143 1.00 0.00 H 0 +HETATM10767 O HOH A3482 27.122 46.654 8.142 1.00 0.00 O 0 +HETATM10768 H1 HOH A3482 27.252 45.678 7.841 1.00 0.00 H 0 +HETATM10769 H2 HOH A3482 26.505 46.610 8.889 1.00 0.00 H 0 +HETATM10770 O HOH A3483 21.802 31.170 11.421 1.00 0.00 O 0 +HETATM10771 H1 HOH A3483 21.589 31.682 12.189 1.00 0.00 H 0 +HETATM10772 H2 HOH A3483 22.673 31.420 11.150 1.00 0.00 H 0 +HETATM10773 O HOH A3484 20.554 18.818 6.325 1.00 0.00 O 0 +HETATM10774 H1 HOH A3484 20.158 18.645 5.451 1.00 0.00 H 0 +HETATM10775 H2 HOH A3484 20.588 19.751 6.404 1.00 0.00 H 0 +HETATM10776 O HOH A3485 53.252 10.469 25.401 1.00 0.00 O 0 +HETATM10777 H1 HOH A3485 53.956 10.782 26.001 1.00 0.00 H 0 +HETATM10778 H2 HOH A3485 53.706 10.415 24.554 1.00 0.00 H 0 +HETATM10779 O HOH A3486 35.413 24.422 11.306 1.00 0.00 O 0 +HETATM10780 H1 HOH A3486 35.108 23.745 10.761 1.00 0.00 H 0 +HETATM10781 H2 HOH A3486 35.103 25.232 10.887 1.00 0.00 H 0 +HETATM10782 O HOH A3487 21.458 15.808 50.315 1.00 0.00 O 0 +HETATM10783 H1 HOH A3487 22.010 16.024 49.567 1.00 0.00 H 0 +HETATM10784 H2 HOH A3487 21.445 16.756 50.625 1.00 0.00 H 0 +HETATM10785 O HOH A3488 31.701 43.769 40.731 1.00 0.00 O 0 +HETATM10786 H1 HOH A3488 31.292 43.613 39.896 1.00 0.00 H 0 +HETATM10787 H2 HOH A3488 31.508 42.986 41.161 1.00 0.00 H 0 +HETATM10788 O HOH A3489 12.175 6.752 32.033 1.00 0.00 O 0 +HETATM10789 H1 HOH A3489 13.094 6.530 31.638 1.00 0.00 H 0 +HETATM10790 H2 HOH A3489 11.837 7.486 31.493 1.00 0.00 H 0 +HETATM10791 O HOH A3490 27.742 16.063 50.071 1.00 0.00 O 0 +HETATM10792 H1 HOH A3490 27.732 16.594 50.926 1.00 0.00 H 0 +HETATM10793 H2 HOH A3490 27.374 16.561 49.382 1.00 0.00 H 0 +HETATM10794 O HOH A3491 31.106 52.264 25.913 1.00 0.00 O 0 +HETATM10795 H1 HOH A3491 31.807 51.577 25.842 1.00 0.00 H 0 +HETATM10796 H2 HOH A3491 31.591 53.116 26.048 1.00 0.00 H 0 +HETATM10797 O HOH A3492 40.451 21.881 21.449 1.00 0.00 O 0 +HETATM10798 H1 HOH A3492 39.762 21.665 20.855 1.00 0.00 H 0 +HETATM10799 H2 HOH A3492 40.157 22.619 21.900 1.00 0.00 H 0 +HETATM10800 O HOH A3493 43.036 16.978 25.867 1.00 0.00 O 0 +HETATM10801 H1 HOH A3493 42.855 16.048 26.084 1.00 0.00 H 0 +HETATM10802 H2 HOH A3493 44.015 16.938 25.823 1.00 0.00 H 0 +HETATM10803 O HOH A3494 41.269 44.682 14.880 1.00 0.00 O 0 +HETATM10804 H1 HOH A3494 40.615 43.969 14.867 1.00 0.00 H 0 +HETATM10805 H2 HOH A3494 40.795 45.462 14.697 1.00 0.00 H 0 +HETATM10806 O HOH A3495 7.586 43.615 33.129 1.00 0.00 O 0 +HETATM10807 H1 HOH A3495 8.352 44.182 33.090 1.00 0.00 H 0 +HETATM10808 H2 HOH A3495 7.016 43.830 32.345 1.00 0.00 H 0 +HETATM10809 O HOH A3496 36.788 42.579 37.694 1.00 0.00 O 0 +HETATM10810 H1 HOH A3496 37.402 42.207 38.301 1.00 0.00 H 0 +HETATM10811 H2 HOH A3496 37.163 42.560 36.848 1.00 0.00 H 0 +HETATM10812 O HOH A3497 38.569 11.302 9.535 1.00 0.00 O 0 +HETATM10813 H1 HOH A3497 38.622 11.993 10.271 1.00 0.00 H 0 +HETATM10814 H2 HOH A3497 38.501 10.406 9.944 1.00 0.00 H 0 +HETATM10815 O HOH A3498 29.719 33.841 43.700 1.00 0.00 O 0 +HETATM10816 H1 HOH A3498 28.935 33.752 43.188 1.00 0.00 H 0 +HETATM10817 H2 HOH A3498 30.389 34.326 43.189 1.00 0.00 H 0 +HETATM10818 O HOH A3499 12.184 13.391 47.023 1.00 0.00 O 0 +HETATM10819 H1 HOH A3499 12.857 13.793 47.585 1.00 0.00 H 0 +HETATM10820 H2 HOH A3499 11.913 12.633 47.545 1.00 0.00 H 0 +HETATM10821 O HOH A3500 19.847 13.788 49.809 1.00 0.00 O 0 +HETATM10822 H1 HOH A3500 19.828 14.076 48.929 1.00 0.00 H 0 +HETATM10823 H2 HOH A3500 20.225 14.553 50.205 1.00 0.00 H 0 +HETATM10824 O HOH A3501 12.315 45.099 24.529 1.00 0.00 O 0 +HETATM10825 H1 HOH A3501 12.487 44.407 25.203 1.00 0.00 H 0 +HETATM10826 H2 HOH A3501 11.350 45.146 24.385 1.00 0.00 H 0 +HETATM10827 O HOH A3502 15.861 42.771 0.914 1.00 0.00 O 0 +HETATM10828 H1 HOH A3502 16.646 43.053 0.459 1.00 0.00 H 0 +HETATM10829 H2 HOH A3502 15.976 43.161 1.813 1.00 0.00 H 0 +HETATM10830 O HOH A3503 22.719 37.904 30.084 1.00 0.00 O 0 +HETATM10831 H1 HOH A3503 22.340 38.707 30.298 1.00 0.00 H 0 +HETATM10832 H2 HOH A3503 23.346 37.828 30.782 1.00 0.00 H 0 +HETATM10833 O HOH A3504 17.253 20.238 8.096 1.00 0.00 O 0 +HETATM10834 H1 HOH A3504 17.116 19.845 8.978 1.00 0.00 H 0 +HETATM10835 H2 HOH A3504 16.421 20.708 7.823 1.00 0.00 H 0 +HETATM10836 O HOH A3505 19.656 24.567 16.399 1.00 0.00 O 0 +HETATM10837 H1 HOH A3505 18.908 23.977 16.114 1.00 0.00 H 0 +HETATM10838 H2 HOH A3505 19.234 25.452 16.432 1.00 0.00 H 0 +HETATM10839 O HOH A3506 32.594 41.299 20.176 1.00 0.00 O 0 +HETATM10840 H1 HOH A3506 33.286 41.508 20.752 1.00 0.00 H 0 +HETATM10841 H2 HOH A3506 32.403 42.227 19.797 1.00 0.00 H 0 +HETATM10842 O HOH A3507 39.214 34.418 32.173 1.00 0.00 O 0 +HETATM10843 H1 HOH A3507 38.753 35.244 31.922 1.00 0.00 H 0 +HETATM10844 H2 HOH A3507 40.173 34.633 32.104 1.00 0.00 H 0 +HETATM10845 O HOH A3508 0.273 33.814 11.977 1.00 0.00 O 0 +HETATM10846 H1 HOH A3508 0.449 32.903 11.833 1.00 0.00 H 0 +HETATM10847 H2 HOH A3508 -0.667 33.862 12.317 1.00 0.00 H 0 +HETATM10848 O HOH A3509 45.568 54.000 3.040 1.00 0.00 O 0 +HETATM10849 H1 HOH A3509 46.428 53.764 3.284 1.00 0.00 H 0 +HETATM10850 H2 HOH A3509 45.090 53.217 3.396 1.00 0.00 H 0 +HETATM10851 O HOH A3510 42.260 19.705 49.205 1.00 0.00 O 0 +HETATM10852 H1 HOH A3510 41.611 20.425 49.372 1.00 0.00 H 0 +HETATM10853 H2 HOH A3510 41.756 18.999 48.815 1.00 0.00 H 0 +HETATM10854 O HOH A3511 41.266 36.577 29.352 1.00 0.00 O 0 +HETATM10855 H1 HOH A3511 40.888 37.419 29.654 1.00 0.00 H 0 +HETATM10856 H2 HOH A3511 41.575 36.018 30.078 1.00 0.00 H 0 +HETATM10857 O HOH A3512 51.428 9.455 7.959 1.00 0.00 O 0 +HETATM10858 H1 HOH A3512 52.057 10.166 8.162 1.00 0.00 H 0 +HETATM10859 H2 HOH A3512 50.742 9.535 8.632 1.00 0.00 H 0 +HETATM10860 O HOH A3513 17.820 13.186 51.619 1.00 0.00 O 0 +HETATM10861 H1 HOH A3513 18.544 13.338 51.004 1.00 0.00 H 0 +HETATM10862 H2 HOH A3513 17.490 14.067 51.676 1.00 0.00 H 0 +HETATM10863 O HOH A3514 47.482 29.967 29.529 1.00 0.00 O 0 +HETATM10864 H1 HOH A3514 47.358 30.210 28.545 1.00 0.00 H 0 +HETATM10865 H2 HOH A3514 48.405 29.801 29.631 1.00 0.00 H 0 +HETATM10866 O HOH A3515 44.592 1.418 28.481 1.00 0.00 O 0 +HETATM10867 H1 HOH A3515 45.004 2.322 28.425 1.00 0.00 H 0 +HETATM10868 H2 HOH A3515 45.103 0.953 27.721 1.00 0.00 H 0 +HETATM10869 O HOH A3516 41.838 23.100 7.056 1.00 0.00 O 0 +HETATM10870 H1 HOH A3516 42.524 22.421 7.383 1.00 0.00 H 0 +HETATM10871 H2 HOH A3516 41.744 23.753 7.748 1.00 0.00 H 0 +HETATM10872 O HOH A3517 2.224 31.713 7.379 1.00 0.00 O 0 +HETATM10873 H1 HOH A3517 2.293 30.896 7.848 1.00 0.00 H 0 +HETATM10874 H2 HOH A3517 2.599 31.478 6.496 1.00 0.00 H 0 +HETATM10875 O HOH A3518 46.303 51.390 34.777 1.00 0.00 O 0 +HETATM10876 H1 HOH A3518 45.803 51.211 33.979 1.00 0.00 H 0 +HETATM10877 H2 HOH A3518 47.110 51.992 34.521 1.00 0.00 H 0 +HETATM10878 O HOH A3519 52.334 11.782 32.296 1.00 0.00 O 0 +HETATM10879 H1 HOH A3519 52.947 11.353 32.910 1.00 0.00 H 0 +HETATM10880 H2 HOH A3519 51.482 11.742 32.814 1.00 0.00 H 0 +HETATM10881 O HOH A3520 48.968 17.194 45.984 1.00 0.00 O 0 +HETATM10882 H1 HOH A3520 49.520 17.306 45.224 1.00 0.00 H 0 +HETATM10883 H2 HOH A3520 48.463 16.379 45.642 1.00 0.00 H 0 +HETATM10884 O HOH A3521 16.876 19.029 39.393 1.00 0.00 O 0 +HETATM10885 H1 HOH A3521 17.733 19.478 39.505 1.00 0.00 H 0 +HETATM10886 H2 HOH A3521 17.006 18.249 38.871 1.00 0.00 H 0 +HETATM10887 O HOH A3522 46.711 25.332 2.319 1.00 0.00 O 0 +HETATM10888 H1 HOH A3522 46.631 26.171 1.762 1.00 0.00 H 0 +HETATM10889 H2 HOH A3522 47.674 25.222 2.417 1.00 0.00 H 0 +HETATM10890 O HOH A3523 17.429 10.623 35.329 1.00 0.00 O 0 +HETATM10891 H1 HOH A3523 17.247 11.481 35.763 1.00 0.00 H 0 +HETATM10892 H2 HOH A3523 16.664 10.497 34.751 1.00 0.00 H 0 +HETATM10893 O HOH A3524 2.176 52.832 31.337 1.00 0.00 O 0 +HETATM10894 H1 HOH A3524 2.157 52.842 30.330 1.00 0.00 H 0 +HETATM10895 H2 HOH A3524 1.964 51.850 31.582 1.00 0.00 H 0 +HETATM10896 O HOH A3525 17.833 0.610 41.889 1.00 0.00 O 0 +HETATM10897 H1 HOH A3525 18.092 -0.302 42.061 1.00 0.00 H 0 +HETATM10898 H2 HOH A3525 17.356 0.527 41.026 1.00 0.00 H 0 +HETATM10899 O HOH A3526 20.376 11.739 38.477 1.00 0.00 O 0 +HETATM10900 H1 HOH A3526 20.474 11.275 39.292 1.00 0.00 H 0 +HETATM10901 H2 HOH A3526 20.743 11.047 37.838 1.00 0.00 H 0 +HETATM10902 O HOH A3527 52.315 41.109 20.256 1.00 0.00 O 0 +HETATM10903 H1 HOH A3527 51.614 41.310 19.607 1.00 0.00 H 0 +HETATM10904 H2 HOH A3527 51.805 41.123 21.046 1.00 0.00 H 0 +HETATM10905 O HOH A3528 30.733 31.368 7.715 1.00 0.00 O 0 +HETATM10906 H1 HOH A3528 30.725 31.361 6.769 1.00 0.00 H 0 +HETATM10907 H2 HOH A3528 30.797 32.296 7.958 1.00 0.00 H 0 +HETATM10908 O HOH A3529 52.888 44.280 27.731 1.00 0.00 O 0 +HETATM10909 H1 HOH A3529 52.059 43.927 27.928 1.00 0.00 H 0 +HETATM10910 H2 HOH A3529 53.577 43.771 28.086 1.00 0.00 H 0 +HETATM10911 O HOH A3530 24.852 1.217 17.088 1.00 0.00 O 0 +HETATM10912 H1 HOH A3530 24.981 2.029 16.544 1.00 0.00 H 0 +HETATM10913 H2 HOH A3530 24.195 0.644 16.653 1.00 0.00 H 0 +HETATM10914 O HOH A3531 51.138 42.056 15.429 1.00 0.00 O 0 +HETATM10915 H1 HOH A3531 51.646 42.880 15.316 1.00 0.00 H 0 +HETATM10916 H2 HOH A3531 51.425 41.436 14.747 1.00 0.00 H 0 +HETATM10917 O HOH A3532 32.977 16.672 12.170 1.00 0.00 O 0 +HETATM10918 H1 HOH A3532 32.832 17.476 12.686 1.00 0.00 H 0 +HETATM10919 H2 HOH A3532 33.464 16.858 11.287 1.00 0.00 H 0 +HETATM10920 O HOH A3533 32.342 12.431 17.584 1.00 0.00 O 0 +HETATM10921 H1 HOH A3533 32.773 13.044 16.984 1.00 0.00 H 0 +HETATM10922 H2 HOH A3533 31.691 11.935 17.129 1.00 0.00 H 0 +HETATM10923 O HOH A3534 11.094 19.770 53.247 1.00 0.00 O 0 +HETATM10924 H1 HOH A3534 10.455 20.496 53.261 1.00 0.00 H 0 +HETATM10925 H2 HOH A3534 10.688 19.190 52.600 1.00 0.00 H 0 +HETATM10926 O HOH A3535 36.071 37.604 26.563 1.00 0.00 O 0 +HETATM10927 H1 HOH A3535 35.748 38.463 26.435 1.00 0.00 H 0 +HETATM10928 H2 HOH A3535 36.875 37.705 25.971 1.00 0.00 H 0 +HETATM10929 O HOH A3536 33.057 25.404 39.530 1.00 0.00 O 0 +HETATM10930 H1 HOH A3536 32.943 24.453 39.243 1.00 0.00 H 0 +HETATM10931 H2 HOH A3536 34.033 25.622 39.367 1.00 0.00 H 0 +HETATM10932 O HOH A3537 31.646 34.991 42.341 1.00 0.00 O 0 +HETATM10933 H1 HOH A3537 32.248 35.670 42.750 1.00 0.00 H 0 +HETATM10934 H2 HOH A3537 31.350 35.448 41.560 1.00 0.00 H 0 +HETATM10935 O HOH A3538 0.435 9.823 2.208 1.00 0.00 O 0 +HETATM10936 H1 HOH A3538 -0.498 9.504 2.194 1.00 0.00 H 0 +HETATM10937 H2 HOH A3538 0.911 9.297 2.805 1.00 0.00 H 0 +HETATM10938 O HOH A3539 2.920 45.884 27.554 1.00 0.00 O 0 +HETATM10939 H1 HOH A3539 2.911 45.038 27.127 1.00 0.00 H 0 +HETATM10940 H2 HOH A3539 2.426 46.469 26.937 1.00 0.00 H 0 +HETATM10941 O HOH A3540 7.875 46.786 46.551 1.00 0.00 O 0 +HETATM10942 H1 HOH A3540 8.078 47.736 46.602 1.00 0.00 H 0 +HETATM10943 H2 HOH A3540 7.875 46.527 47.494 1.00 0.00 H 0 +HETATM10944 O HOH A3541 32.762 50.898 52.242 1.00 0.00 O 0 +HETATM10945 H1 HOH A3541 31.878 51.095 52.219 1.00 0.00 H 0 +HETATM10946 H2 HOH A3541 33.112 51.279 53.047 1.00 0.00 H 0 +HETATM10947 O HOH A3542 1.158 26.428 20.948 1.00 0.00 O 0 +HETATM10948 H1 HOH A3542 1.056 26.124 21.818 1.00 0.00 H 0 +HETATM10949 H2 HOH A3542 1.263 25.615 20.410 1.00 0.00 H 0 +HETATM10950 O HOH A3543 46.552 8.557 11.973 1.00 0.00 O 0 +HETATM10951 H1 HOH A3543 47.103 7.973 11.360 1.00 0.00 H 0 +HETATM10952 H2 HOH A3543 45.686 8.738 11.580 1.00 0.00 H 0 +HETATM10953 O HOH A3544 11.207 47.543 48.286 1.00 0.00 O 0 +HETATM10954 H1 HOH A3544 12.080 47.412 48.604 1.00 0.00 H 0 +HETATM10955 H2 HOH A3544 11.142 47.762 47.356 1.00 0.00 H 0 +HETATM10956 O HOH A3545 45.060 46.890 4.356 1.00 0.00 O 0 +HETATM10957 H1 HOH A3545 45.731 46.595 3.687 1.00 0.00 H 0 +HETATM10958 H2 HOH A3545 44.561 46.138 4.647 1.00 0.00 H 0 +HETATM10959 O HOH A3546 30.575 26.745 43.963 1.00 0.00 O 0 +HETATM10960 H1 HOH A3546 30.933 26.546 43.096 1.00 0.00 H 0 +HETATM10961 H2 HOH A3546 30.323 27.689 43.968 1.00 0.00 H 0 +HETATM10962 O HOH A3547 8.289 25.678 18.948 1.00 0.00 O 0 +HETATM10963 H1 HOH A3547 7.947 24.797 19.082 1.00 0.00 H 0 +HETATM10964 H2 HOH A3547 7.532 26.174 18.807 1.00 0.00 H 0 +HETATM10965 O HOH A3548 40.595 4.522 10.568 1.00 0.00 O 0 +HETATM10966 H1 HOH A3548 41.454 4.536 11.065 1.00 0.00 H 0 +HETATM10967 H2 HOH A3548 40.848 4.814 9.753 1.00 0.00 H 0 +HETATM10968 O HOH A3549 43.762 10.982 10.854 1.00 0.00 O 0 +HETATM10969 H1 HOH A3549 43.021 10.632 11.430 1.00 0.00 H 0 +HETATM10970 H2 HOH A3549 43.302 11.840 10.691 1.00 0.00 H 0 +HETATM10971 O HOH A3550 36.524 53.644 6.618 1.00 0.00 O 0 +HETATM10972 H1 HOH A3550 36.805 52.846 7.094 1.00 0.00 H 0 +HETATM10973 H2 HOH A3550 36.296 53.413 5.677 1.00 0.00 H 0 +HETATM10974 O HOH A3551 36.376 6.082 53.301 1.00 0.00 O 0 +HETATM10975 H1 HOH A3551 36.758 5.484 54.064 1.00 0.00 H 0 +HETATM10976 H2 HOH A3551 36.680 5.916 52.447 1.00 0.00 H 0 +HETATM10977 O HOH A3552 24.640 17.677 49.563 1.00 0.00 O 0 +HETATM10978 H1 HOH A3552 25.469 17.756 49.035 1.00 0.00 H 0 +HETATM10979 H2 HOH A3552 24.052 17.165 48.973 1.00 0.00 H 0 +HETATM10980 O HOH A3553 28.682 46.658 46.475 1.00 0.00 O 0 +HETATM10981 H1 HOH A3553 29.447 46.816 46.044 1.00 0.00 H 0 +HETATM10982 H2 HOH A3553 28.391 45.792 46.215 1.00 0.00 H 0 +HETATM10983 O HOH A3554 6.299 40.717 10.159 1.00 0.00 O 0 +HETATM10984 H1 HOH A3554 6.172 41.470 10.766 1.00 0.00 H 0 +HETATM10985 H2 HOH A3554 5.492 40.218 10.128 1.00 0.00 H 0 +HETATM10986 O HOH A3555 29.955 53.607 38.911 1.00 0.00 O 0 +HETATM10987 H1 HOH A3555 30.737 53.106 38.726 1.00 0.00 H 0 +HETATM10988 H2 HOH A3555 29.592 53.825 38.035 1.00 0.00 H 0 +HETATM10989 O HOH A3556 53.116 49.634 30.864 1.00 0.00 O 0 +HETATM10990 H1 HOH A3556 53.011 50.410 30.309 1.00 0.00 H 0 +HETATM10991 H2 HOH A3556 53.490 49.007 30.319 1.00 0.00 H 0 +HETATM10992 O HOH A3557 4.342 0.550 38.369 1.00 0.00 O 0 +HETATM10993 H1 HOH A3557 3.931 1.197 37.795 1.00 0.00 H 0 +HETATM10994 H2 HOH A3557 5.059 0.159 37.835 1.00 0.00 H 0 +HETATM10995 O HOH A3558 9.200 38.613 12.790 1.00 0.00 O 0 +HETATM10996 H1 HOH A3558 9.507 38.257 13.600 1.00 0.00 H 0 +HETATM10997 H2 HOH A3558 9.874 39.239 12.461 1.00 0.00 H 0 +HETATM10998 O HOH A3559 7.270 36.966 10.723 1.00 0.00 O 0 +HETATM10999 H1 HOH A3559 7.874 37.506 11.204 1.00 0.00 H 0 +HETATM11000 H2 HOH A3559 7.294 36.052 11.144 1.00 0.00 H 0 +HETATM11001 O HOH A3560 25.537 16.931 17.959 1.00 0.00 O 0 +HETATM11002 H1 HOH A3560 25.871 16.290 17.381 1.00 0.00 H 0 +HETATM11003 H2 HOH A3560 26.303 17.317 18.458 1.00 0.00 H 0 +HETATM11004 O HOH A3561 6.192 34.908 36.235 1.00 0.00 O 0 +HETATM11005 H1 HOH A3561 6.058 34.197 35.525 1.00 0.00 H 0 +HETATM11006 H2 HOH A3561 5.534 35.558 36.074 1.00 0.00 H 0 +HETATM11007 O HOH A3562 19.825 15.121 11.366 1.00 0.00 O 0 +HETATM11008 H1 HOH A3562 20.046 14.841 12.240 1.00 0.00 H 0 +HETATM11009 H2 HOH A3562 20.603 14.968 10.845 1.00 0.00 H 0 +HETATM11010 O HOH A3563 14.383 28.561 52.604 1.00 0.00 O 0 +HETATM11011 H1 HOH A3563 13.904 27.772 52.735 1.00 0.00 H 0 +HETATM11012 H2 HOH A3563 14.686 28.957 53.448 1.00 0.00 H 0 +HETATM11013 O HOH A3564 29.928 35.751 1.347 1.00 0.00 O 0 +HETATM11014 H1 HOH A3564 29.198 35.808 0.703 1.00 0.00 H 0 +HETATM11015 H2 HOH A3564 30.699 36.199 0.922 1.00 0.00 H 0 +HETATM11016 O HOH A3565 30.944 45.625 17.980 1.00 0.00 O 0 +HETATM11017 H1 HOH A3565 31.027 46.062 17.056 1.00 0.00 H 0 +HETATM11018 H2 HOH A3565 30.037 45.852 18.227 1.00 0.00 H 0 +HETATM11019 O HOH A3566 2.857 11.892 21.841 1.00 0.00 O 0 +HETATM11020 H1 HOH A3566 2.820 10.959 21.540 1.00 0.00 H 0 +HETATM11021 H2 HOH A3566 1.966 12.138 21.567 1.00 0.00 H 0 +HETATM11022 O HOH A3567 38.355 43.222 2.713 1.00 0.00 O 0 +HETATM11023 H1 HOH A3567 39.305 43.011 2.493 1.00 0.00 H 0 +HETATM11024 H2 HOH A3567 38.088 42.573 3.388 1.00 0.00 H 0 +HETATM11025 O HOH A3568 36.397 41.286 33.286 1.00 0.00 O 0 +HETATM11026 H1 HOH A3568 36.422 40.342 33.308 1.00 0.00 H 0 +HETATM11027 H2 HOH A3568 36.955 41.527 32.444 1.00 0.00 H 0 +HETATM11028 O HOH A3569 36.029 24.658 48.077 1.00 0.00 O 0 +HETATM11029 H1 HOH A3569 36.820 24.586 47.513 1.00 0.00 H 0 +HETATM11030 H2 HOH A3569 36.093 25.597 48.360 1.00 0.00 H 0 +HETATM11031 O HOH A3570 46.679 25.865 47.623 1.00 0.00 O 0 +HETATM11032 H1 HOH A3570 47.625 26.148 47.491 1.00 0.00 H 0 +HETATM11033 H2 HOH A3570 46.652 25.029 48.181 1.00 0.00 H 0 +HETATM11034 O HOH A3571 53.562 29.814 2.217 1.00 0.00 O 0 +HETATM11035 H1 HOH A3571 53.963 30.441 1.618 1.00 0.00 H 0 +HETATM11036 H2 HOH A3571 52.645 29.687 1.834 1.00 0.00 H 0 +HETATM11037 O HOH A3572 22.325 29.970 2.994 1.00 0.00 O 0 +HETATM11038 H1 HOH A3572 21.795 30.670 2.636 1.00 0.00 H 0 +HETATM11039 H2 HOH A3572 21.858 29.521 3.699 1.00 0.00 H 0 +HETATM11040 O HOH A3573 8.917 22.639 32.565 1.00 0.00 O 0 +HETATM11041 H1 HOH A3573 8.532 23.364 33.095 1.00 0.00 H 0 +HETATM11042 H2 HOH A3573 9.256 23.023 31.759 1.00 0.00 H 0 +HETATM11043 O HOH A3574 52.431 16.793 29.664 1.00 0.00 O 0 +HETATM11044 H1 HOH A3574 52.387 15.925 29.213 1.00 0.00 H 0 +HETATM11045 H2 HOH A3574 51.502 17.031 29.701 1.00 0.00 H 0 +HETATM11046 O HOH A3575 43.196 24.870 40.073 1.00 0.00 O 0 +HETATM11047 H1 HOH A3575 42.249 24.804 40.184 1.00 0.00 H 0 +HETATM11048 H2 HOH A3575 43.563 24.029 39.796 1.00 0.00 H 0 +HETATM11049 O HOH A3576 50.873 46.978 16.802 1.00 0.00 O 0 +HETATM11050 H1 HOH A3576 50.661 47.859 16.518 1.00 0.00 H 0 +HETATM11051 H2 HOH A3576 51.416 47.199 17.594 1.00 0.00 H 0 +HETATM11052 O HOH A3577 38.406 8.509 33.733 1.00 0.00 O 0 +HETATM11053 H1 HOH A3577 37.641 8.731 33.156 1.00 0.00 H 0 +HETATM11054 H2 HOH A3577 38.385 9.105 34.483 1.00 0.00 H 0 +HETATM11055 O HOH A3578 51.293 42.900 39.949 1.00 0.00 O 0 +HETATM11056 H1 HOH A3578 50.735 43.309 40.673 1.00 0.00 H 0 +HETATM11057 H2 HOH A3578 50.825 43.087 39.099 1.00 0.00 H 0 +HETATM11058 O HOH A3579 7.234 16.380 48.482 1.00 0.00 O 0 +HETATM11059 H1 HOH A3579 7.338 15.677 49.153 1.00 0.00 H 0 +HETATM11060 H2 HOH A3579 6.258 16.492 48.498 1.00 0.00 H 0 +HETATM11061 O HOH A3580 27.554 13.492 32.412 1.00 0.00 O 0 +HETATM11062 H1 HOH A3580 27.711 14.430 32.513 1.00 0.00 H 0 +HETATM11063 H2 HOH A3580 27.479 13.383 31.456 1.00 0.00 H 0 +HETATM11064 O HOH A3581 9.195 9.367 37.891 1.00 0.00 O 0 +HETATM11065 H1 HOH A3581 10.015 9.119 38.293 1.00 0.00 H 0 +HETATM11066 H2 HOH A3581 8.496 8.843 38.413 1.00 0.00 H 0 +HETATM11067 O HOH A3582 21.626 4.526 33.633 1.00 0.00 O 0 +HETATM11068 H1 HOH A3582 22.126 3.755 33.344 1.00 0.00 H 0 +HETATM11069 H2 HOH A3582 20.719 4.267 33.574 1.00 0.00 H 0 +HETATM11070 O HOH A3583 1.799 35.492 49.283 1.00 0.00 O 0 +HETATM11071 H1 HOH A3583 1.742 36.301 48.813 1.00 0.00 H 0 +HETATM11072 H2 HOH A3583 2.680 35.090 49.180 1.00 0.00 H 0 +HETATM11073 O HOH A3584 20.336 1.293 33.109 1.00 0.00 O 0 +HETATM11074 H1 HOH A3584 20.511 1.136 34.023 1.00 0.00 H 0 +HETATM11075 H2 HOH A3584 19.834 2.158 33.165 1.00 0.00 H 0 +HETATM11076 O HOH A3585 7.024 15.382 11.419 1.00 0.00 O 0 +HETATM11077 H1 HOH A3585 7.026 15.528 12.331 1.00 0.00 H 0 +HETATM11078 H2 HOH A3585 6.810 14.440 11.352 1.00 0.00 H 0 +HETATM11079 O HOH A3586 4.299 45.945 39.265 1.00 0.00 O 0 +HETATM11080 H1 HOH A3586 4.743 45.871 38.467 1.00 0.00 H 0 +HETATM11081 H2 HOH A3586 4.150 46.897 39.359 1.00 0.00 H 0 +HETATM11082 O HOH A3587 22.971 0.848 8.807 1.00 0.00 O 0 +HETATM11083 H1 HOH A3587 23.413 0.595 9.669 1.00 0.00 H 0 +HETATM11084 H2 HOH A3587 23.663 0.990 8.157 1.00 0.00 H 0 +HETATM11085 O HOH A3588 27.731 29.520 6.556 1.00 0.00 O 0 +HETATM11086 H1 HOH A3588 27.111 29.367 5.810 1.00 0.00 H 0 +HETATM11087 H2 HOH A3588 27.560 30.478 6.698 1.00 0.00 H 0 +HETATM11088 O HOH A3589 1.967 48.237 25.994 1.00 0.00 O 0 +HETATM11089 H1 HOH A3589 2.610 48.844 26.537 1.00 0.00 H 0 +HETATM11090 H2 HOH A3589 1.112 48.757 25.974 1.00 0.00 H 0 +HETATM11091 O HOH A3590 39.185 8.467 47.302 1.00 0.00 O 0 +HETATM11092 H1 HOH A3590 39.774 7.877 47.645 1.00 0.00 H 0 +HETATM11093 H2 HOH A3590 39.146 9.098 48.049 1.00 0.00 H 0 +HETATM11094 O HOH A3591 29.812 39.556 22.815 1.00 0.00 O 0 +HETATM11095 H1 HOH A3591 28.949 39.541 23.199 1.00 0.00 H 0 +HETATM11096 H2 HOH A3591 30.260 40.218 23.315 1.00 0.00 H 0 +HETATM11097 O HOH A3592 5.661 19.126 44.856 1.00 0.00 O 0 +HETATM11098 H1 HOH A3592 6.079 19.652 44.251 1.00 0.00 H 0 +HETATM11099 H2 HOH A3592 6.234 18.386 44.938 1.00 0.00 H 0 +HETATM11100 O HOH A3593 37.554 35.691 34.429 1.00 0.00 O 0 +HETATM11101 H1 HOH A3593 37.326 36.547 34.067 1.00 0.00 H 0 +HETATM11102 H2 HOH A3593 37.607 35.913 35.389 1.00 0.00 H 0 +HETATM11103 O HOH A3594 15.852 29.600 5.693 1.00 0.00 O 0 +HETATM11104 H1 HOH A3594 15.559 30.234 5.056 1.00 0.00 H 0 +HETATM11105 H2 HOH A3594 15.201 29.762 6.397 1.00 0.00 H 0 +HETATM11106 O HOH A3595 36.789 30.221 18.179 1.00 0.00 O 0 +HETATM11107 H1 HOH A3595 37.780 30.374 18.270 1.00 0.00 H 0 +HETATM11108 H2 HOH A3595 36.697 29.285 18.362 1.00 0.00 H 0 +HETATM11109 O HOH A3596 31.522 29.463 14.001 1.00 0.00 O 0 +HETATM11110 H1 HOH A3596 31.370 30.087 13.370 1.00 0.00 H 0 +HETATM11111 H2 HOH A3596 31.053 29.843 14.725 1.00 0.00 H 0 +HETATM11112 O HOH A3597 31.711 53.480 14.134 1.00 0.00 O 0 +HETATM11113 H1 HOH A3597 31.599 52.567 14.337 1.00 0.00 H 0 +HETATM11114 H2 HOH A3597 31.306 54.071 14.795 1.00 0.00 H 0 +HETATM11115 O HOH A3598 2.848 12.060 0.573 1.00 0.00 O 0 +HETATM11116 H1 HOH A3598 1.876 12.264 0.703 1.00 0.00 H 0 +HETATM11117 H2 HOH A3598 3.282 12.874 0.922 1.00 0.00 H 0 +HETATM11118 O HOH A3599 23.470 43.691 31.302 1.00 0.00 O 0 +HETATM11119 H1 HOH A3599 23.560 43.080 30.574 1.00 0.00 H 0 +HETATM11120 H2 HOH A3599 23.442 43.297 32.174 1.00 0.00 H 0 +HETATM11121 O HOH A3600 38.377 51.034 42.483 1.00 0.00 O 0 +HETATM11122 H1 HOH A3600 38.599 51.877 42.120 1.00 0.00 H 0 +HETATM11123 H2 HOH A3600 38.374 50.385 41.834 1.00 0.00 H 0 +HETATM11124 O HOH A3601 52.358 7.748 34.889 1.00 0.00 O 0 +HETATM11125 H1 HOH A3601 51.493 8.054 34.668 1.00 0.00 H 0 +HETATM11126 H2 HOH A3601 52.471 7.738 35.848 1.00 0.00 H 0 +HETATM11127 O HOH A3602 39.673 12.654 4.585 1.00 0.00 O 0 +HETATM11128 H1 HOH A3602 40.078 12.516 5.474 1.00 0.00 H 0 +HETATM11129 H2 HOH A3602 39.232 11.793 4.389 1.00 0.00 H 0 +HETATM11130 O HOH A3603 47.057 6.799 2.840 1.00 0.00 O 0 +HETATM11131 H1 HOH A3603 47.058 6.989 1.885 1.00 0.00 H 0 +HETATM11132 H2 HOH A3603 46.235 6.325 3.135 1.00 0.00 H 0 +HETATM11133 O HOH A3604 9.993 14.853 43.562 1.00 0.00 O 0 +HETATM11134 H1 HOH A3604 9.050 14.622 43.412 1.00 0.00 H 0 +HETATM11135 H2 HOH A3604 10.429 14.025 43.260 1.00 0.00 H 0 +HETATM11136 O HOH A3605 47.210 13.530 48.697 1.00 0.00 O 0 +HETATM11137 H1 HOH A3605 46.974 14.463 48.355 1.00 0.00 H 0 +HETATM11138 H2 HOH A3605 47.253 12.965 47.931 1.00 0.00 H 0 +HETATM11139 O HOH A3606 8.293 45.552 51.741 1.00 0.00 O 0 +HETATM11140 H1 HOH A3606 7.651 45.543 52.464 1.00 0.00 H 0 +HETATM11141 H2 HOH A3606 9.105 45.053 51.891 1.00 0.00 H 0 +HETATM11142 O HOH A3607 6.877 46.537 12.440 1.00 0.00 O 0 +HETATM11143 H1 HOH A3607 6.051 46.145 12.822 1.00 0.00 H 0 +HETATM11144 H2 HOH A3607 7.561 45.903 12.373 1.00 0.00 H 0 +HETATM11145 O HOH A3608 43.742 41.476 7.365 1.00 0.00 O 0 +HETATM11146 H1 HOH A3608 43.516 42.426 7.144 1.00 0.00 H 0 +HETATM11147 H2 HOH A3608 43.229 41.303 8.177 1.00 0.00 H 0 +HETATM11148 O HOH A3609 46.181 20.817 5.227 1.00 0.00 O 0 +HETATM11149 H1 HOH A3609 46.786 20.096 5.333 1.00 0.00 H 0 +HETATM11150 H2 HOH A3609 46.674 21.639 5.279 1.00 0.00 H 0 +HETATM11151 O HOH A3610 13.259 29.324 32.508 1.00 0.00 O 0 +HETATM11152 H1 HOH A3610 12.893 29.945 31.927 1.00 0.00 H 0 +HETATM11153 H2 HOH A3610 12.545 29.034 33.110 1.00 0.00 H 0 +HETATM11154 O HOH A3611 36.096 17.744 42.499 1.00 0.00 O 0 +HETATM11155 H1 HOH A3611 37.030 17.780 42.815 1.00 0.00 H 0 +HETATM11156 H2 HOH A3611 35.818 16.819 42.360 1.00 0.00 H 0 +HETATM11157 O HOH A3612 40.039 48.462 40.757 1.00 0.00 O 0 +HETATM11158 H1 HOH A3612 40.481 47.961 41.502 1.00 0.00 H 0 +HETATM11159 H2 HOH A3612 39.402 47.846 40.421 1.00 0.00 H 0 +HETATM11160 O HOH A3613 26.853 48.171 53.352 1.00 0.00 O 0 +HETATM11161 H1 HOH A3613 27.472 47.976 52.602 1.00 0.00 H 0 +HETATM11162 H2 HOH A3613 27.323 47.766 54.141 1.00 0.00 H 0 +HETATM11163 O HOH A3614 22.210 33.553 2.682 1.00 0.00 O 0 +HETATM11164 H1 HOH A3614 22.132 33.307 3.610 1.00 0.00 H 0 +HETATM11165 H2 HOH A3614 21.464 33.142 2.254 1.00 0.00 H 0 +HETATM11166 O HOH A3615 12.574 4.037 50.225 1.00 0.00 O 0 +HETATM11167 H1 HOH A3615 12.226 3.174 50.217 1.00 0.00 H 0 +HETATM11168 H2 HOH A3615 13.496 4.013 50.548 1.00 0.00 H 0 +HETATM11169 O HOH A3616 24.513 41.070 31.224 1.00 0.00 O 0 +HETATM11170 H1 HOH A3616 24.606 40.138 31.456 1.00 0.00 H 0 +HETATM11171 H2 HOH A3616 24.619 41.529 32.072 1.00 0.00 H 0 +HETATM11172 O HOH A3617 34.798 51.208 28.291 1.00 0.00 O 0 +HETATM11173 H1 HOH A3617 34.903 51.171 29.252 1.00 0.00 H 0 +HETATM11174 H2 HOH A3617 35.351 50.462 27.998 1.00 0.00 H 0 +HETATM11175 O HOH A3618 4.970 33.136 30.046 1.00 0.00 O 0 +HETATM11176 H1 HOH A3618 4.197 33.589 29.712 1.00 0.00 H 0 +HETATM11177 H2 HOH A3618 5.415 33.530 30.769 1.00 0.00 H 0 +HETATM11178 O HOH A3619 36.164 33.391 0.483 1.00 0.00 O 0 +HETATM11179 H1 HOH A3619 35.901 32.522 0.801 1.00 0.00 H 0 +HETATM11180 H2 HOH A3619 37.098 33.405 0.573 1.00 0.00 H 0 +HETATM11181 O HOH A3620 47.759 8.511 35.245 1.00 0.00 O 0 +HETATM11182 H1 HOH A3620 47.809 8.728 36.167 1.00 0.00 H 0 +HETATM11183 H2 HOH A3620 47.206 7.698 35.264 1.00 0.00 H 0 +HETATM11184 O HOH A3621 16.949 51.024 43.917 1.00 0.00 O 0 +HETATM11185 H1 HOH A3621 16.994 50.071 44.302 1.00 0.00 H 0 +HETATM11186 H2 HOH A3621 16.513 51.567 44.571 1.00 0.00 H 0 +HETATM11187 O HOH A3622 4.884 49.991 12.386 1.00 0.00 O 0 +HETATM11188 H1 HOH A3622 5.265 50.094 11.515 1.00 0.00 H 0 +HETATM11189 H2 HOH A3622 5.552 49.800 12.998 1.00 0.00 H 0 +HETATM11190 O HOH A3623 17.441 46.463 8.775 1.00 0.00 O 0 +HETATM11191 H1 HOH A3623 16.458 46.331 8.757 1.00 0.00 H 0 +HETATM11192 H2 HOH A3623 17.875 45.972 9.471 1.00 0.00 H 0 +HETATM11193 O HOH A3624 8.205 46.866 36.428 1.00 0.00 O 0 +HETATM11194 H1 HOH A3624 7.695 46.201 36.036 1.00 0.00 H 0 +HETATM11195 H2 HOH A3624 8.846 46.987 35.694 1.00 0.00 H 0 +HETATM11196 O HOH A3625 15.234 33.609 22.227 1.00 0.00 O 0 +HETATM11197 H1 HOH A3625 15.020 33.145 23.075 1.00 0.00 H 0 +HETATM11198 H2 HOH A3625 15.854 33.007 21.698 1.00 0.00 H 0 +HETATM11199 O HOH A3626 10.771 36.496 34.322 1.00 0.00 O 0 +HETATM11200 H1 HOH A3626 11.165 36.989 33.626 1.00 0.00 H 0 +HETATM11201 H2 HOH A3626 11.491 36.608 34.965 1.00 0.00 H 0 +HETATM11202 O HOH A3627 49.519 27.240 3.921 1.00 0.00 O 0 +HETATM11203 H1 HOH A3627 48.849 27.455 4.605 1.00 0.00 H 0 +HETATM11204 H2 HOH A3627 50.312 27.400 4.442 1.00 0.00 H 0 +HETATM11205 O HOH A3628 27.061 21.038 20.268 1.00 0.00 O 0 +HETATM11206 H1 HOH A3628 27.309 21.696 19.567 1.00 0.00 H 0 +HETATM11207 H2 HOH A3628 26.095 20.862 20.189 1.00 0.00 H 0 +HETATM11208 O HOH A3629 19.116 4.124 52.926 1.00 0.00 O 0 +HETATM11209 H1 HOH A3629 19.456 4.685 53.735 1.00 0.00 H 0 +HETATM11210 H2 HOH A3629 19.075 4.717 52.153 1.00 0.00 H 0 +HETATM11211 O HOH A3630 11.670 26.956 11.362 1.00 0.00 O 0 +HETATM11212 H1 HOH A3630 12.197 27.757 11.232 1.00 0.00 H 0 +HETATM11213 H2 HOH A3630 11.454 26.430 10.579 1.00 0.00 H 0 +HETATM11214 O HOH A3631 7.373 41.798 39.960 1.00 0.00 O 0 +HETATM11215 H1 HOH A3631 6.502 42.058 40.176 1.00 0.00 H 0 +HETATM11216 H2 HOH A3631 7.500 40.850 40.039 1.00 0.00 H 0 +HETATM11217 O HOH A3632 7.857 48.477 17.132 1.00 0.00 O 0 +HETATM11218 H1 HOH A3632 8.231 49.274 17.475 1.00 0.00 H 0 +HETATM11219 H2 HOH A3632 6.907 48.665 17.032 1.00 0.00 H 0 +HETATM11220 O HOH A3633 52.604 19.401 4.251 1.00 0.00 O 0 +HETATM11221 H1 HOH A3633 52.403 20.155 3.671 1.00 0.00 H 0 +HETATM11222 H2 HOH A3633 51.802 19.249 4.792 1.00 0.00 H 0 +HETATM11223 O HOH A3634 40.266 21.447 49.331 1.00 0.00 O 0 +HETATM11224 H1 HOH A3634 40.246 22.369 49.585 1.00 0.00 H 0 +HETATM11225 H2 HOH A3634 39.946 21.160 48.544 1.00 0.00 H 0 +HETATM11226 O HOH A3635 41.902 26.588 43.250 1.00 0.00 O 0 +HETATM11227 H1 HOH A3635 42.160 27.443 43.679 1.00 0.00 H 0 +HETATM11228 H2 HOH A3635 42.118 25.843 43.893 1.00 0.00 H 0 +HETATM11229 O HOH A3636 33.610 4.780 39.492 1.00 0.00 O 0 +HETATM11230 H1 HOH A3636 32.978 4.331 38.943 1.00 0.00 H 0 +HETATM11231 H2 HOH A3636 33.424 4.511 40.456 1.00 0.00 H 0 +HETATM11232 O HOH A3637 14.733 0.235 27.351 1.00 0.00 O 0 +HETATM11233 H1 HOH A3637 14.091 -0.533 27.264 1.00 0.00 H 0 +HETATM11234 H2 HOH A3637 14.672 0.725 26.513 1.00 0.00 H 0 +HETATM11235 O HOH A3638 33.628 39.021 50.018 1.00 0.00 O 0 +HETATM11236 H1 HOH A3638 33.876 39.401 49.149 1.00 0.00 H 0 +HETATM11237 H2 HOH A3638 34.239 39.445 50.676 1.00 0.00 H 0 +HETATM11238 O HOH A3639 2.589 40.187 32.018 1.00 0.00 O 0 +HETATM11239 H1 HOH A3639 3.580 39.982 32.105 1.00 0.00 H 0 +HETATM11240 H2 HOH A3639 2.324 39.865 31.144 1.00 0.00 H 0 +HETATM11241 O HOH A3640 3.581 37.118 33.291 1.00 0.00 O 0 +HETATM11242 H1 HOH A3640 3.718 36.237 33.751 1.00 0.00 H 0 +HETATM11243 H2 HOH A3640 2.727 37.467 33.551 1.00 0.00 H 0 +HETATM11244 O HOH A3641 37.065 46.074 2.436 1.00 0.00 O 0 +HETATM11245 H1 HOH A3641 37.200 45.084 2.445 1.00 0.00 H 0 +HETATM11246 H2 HOH A3641 36.065 46.116 2.451 1.00 0.00 H 0 +HETATM11247 O HOH A3642 5.060 32.560 3.819 1.00 0.00 O 0 +HETATM11248 H1 HOH A3642 5.965 32.439 3.405 1.00 0.00 H 0 +HETATM11249 H2 HOH A3642 5.020 33.438 4.335 1.00 0.00 H 0 +HETATM11250 O HOH A3643 11.468 9.445 46.215 1.00 0.00 O 0 +HETATM11251 H1 HOH A3643 12.015 10.136 45.901 1.00 0.00 H 0 +HETATM11252 H2 HOH A3643 10.620 9.645 45.746 1.00 0.00 H 0 +HETATM11253 O HOH A3644 40.796 40.907 42.095 1.00 0.00 O 0 +HETATM11254 H1 HOH A3644 41.510 40.744 41.397 1.00 0.00 H 0 +HETATM11255 H2 HOH A3644 41.074 41.668 42.555 1.00 0.00 H 0 +HETATM11256 O HOH A3645 20.578 7.034 13.332 1.00 0.00 O 0 +HETATM11257 H1 HOH A3645 20.556 6.198 12.844 1.00 0.00 H 0 +HETATM11258 H2 HOH A3645 19.669 7.081 13.757 1.00 0.00 H 0 +HETATM11259 O HOH A3646 6.728 27.827 0.562 1.00 0.00 O 0 +HETATM11260 H1 HOH A3646 5.815 27.603 0.909 1.00 0.00 H 0 +HETATM11261 H2 HOH A3646 6.846 27.231 -0.170 1.00 0.00 H 0 +HETATM11262 O HOH A3647 11.199 17.069 24.909 1.00 0.00 O 0 +HETATM11263 H1 HOH A3647 11.051 16.160 24.703 1.00 0.00 H 0 +HETATM11264 H2 HOH A3647 10.465 17.241 25.569 1.00 0.00 H 0 +HETATM11265 O HOH A3648 15.806 29.199 13.850 1.00 0.00 O 0 +HETATM11266 H1 HOH A3648 16.152 28.784 14.665 1.00 0.00 H 0 +HETATM11267 H2 HOH A3648 16.501 29.392 13.212 1.00 0.00 H 0 +HETATM11268 O HOH A3649 34.081 26.184 44.308 1.00 0.00 O 0 +HETATM11269 H1 HOH A3649 33.853 25.675 45.131 1.00 0.00 H 0 +HETATM11270 H2 HOH A3649 34.996 26.147 43.944 1.00 0.00 H 0 +HETATM11271 O HOH A3650 14.557 50.728 9.498 1.00 0.00 O 0 +HETATM11272 H1 HOH A3650 13.902 50.202 8.961 1.00 0.00 H 0 +HETATM11273 H2 HOH A3650 15.410 50.346 9.559 1.00 0.00 H 0 +HETATM11274 O HOH A3651 34.531 14.720 48.502 1.00 0.00 O 0 +HETATM11275 H1 HOH A3651 33.606 14.676 48.285 1.00 0.00 H 0 +HETATM11276 H2 HOH A3651 34.673 14.697 49.481 1.00 0.00 H 0 +HETATM11277 O HOH A3652 34.403 7.985 51.692 1.00 0.00 O 0 +HETATM11278 H1 HOH A3652 35.012 8.631 52.092 1.00 0.00 H 0 +HETATM11279 H2 HOH A3652 35.107 7.428 51.347 1.00 0.00 H 0 +HETATM11280 O HOH A3653 51.774 36.655 46.183 1.00 0.00 O 0 +HETATM11281 H1 HOH A3653 52.363 36.588 46.997 1.00 0.00 H 0 +HETATM11282 H2 HOH A3653 52.401 36.893 45.476 1.00 0.00 H 0 +HETATM11283 O HOH A3654 45.031 32.614 32.435 1.00 0.00 O 0 +HETATM11284 H1 HOH A3654 44.947 33.511 32.062 1.00 0.00 H 0 +HETATM11285 H2 HOH A3654 44.164 32.310 32.638 1.00 0.00 H 0 +HETATM11286 O HOH A3655 40.015 28.679 11.841 1.00 0.00 O 0 +HETATM11287 H1 HOH A3655 40.466 28.977 12.620 1.00 0.00 H 0 +HETATM11288 H2 HOH A3655 39.101 28.491 12.171 1.00 0.00 H 0 +HETATM11289 O HOH A3656 20.084 35.373 29.385 1.00 0.00 O 0 +HETATM11290 H1 HOH A3656 19.638 36.186 29.844 1.00 0.00 H 0 +HETATM11291 H2 HOH A3656 20.410 35.825 28.610 1.00 0.00 H 0 +HETATM11292 O HOH A3657 6.744 5.424 34.209 1.00 0.00 O 0 +HETATM11293 H1 HOH A3657 7.215 6.270 34.556 1.00 0.00 H 0 +HETATM11294 H2 HOH A3657 6.744 5.514 33.264 1.00 0.00 H 0 +HETATM11295 O HOH A3658 50.680 45.156 23.489 1.00 0.00 O 0 +HETATM11296 H1 HOH A3658 51.166 45.209 22.673 1.00 0.00 H 0 +HETATM11297 H2 HOH A3658 51.053 45.740 24.164 1.00 0.00 H 0 +HETATM11298 O HOH A3659 10.123 24.600 25.382 1.00 0.00 O 0 +HETATM11299 H1 HOH A3659 10.241 25.375 25.943 1.00 0.00 H 0 +HETATM11300 H2 HOH A3659 9.558 24.933 24.725 1.00 0.00 H 0 +HETATM11301 O HOH A3660 43.627 49.548 9.931 1.00 0.00 O 0 +HETATM11302 H1 HOH A3660 44.582 49.436 9.657 1.00 0.00 H 0 +HETATM11303 H2 HOH A3660 43.294 48.579 9.902 1.00 0.00 H 0 +HETATM11304 O HOH A3661 10.244 10.550 5.020 1.00 0.00 O 0 +HETATM11305 H1 HOH A3661 9.307 10.495 5.176 1.00 0.00 H 0 +HETATM11306 H2 HOH A3661 10.688 10.159 5.851 1.00 0.00 H 0 +HETATM11307 O HOH A3662 11.845 23.499 36.212 1.00 0.00 O 0 +HETATM11308 H1 HOH A3662 12.400 23.712 35.418 1.00 0.00 H 0 +HETATM11309 H2 HOH A3662 11.708 22.599 36.322 1.00 0.00 H 0 +HETATM11310 O HOH A3663 6.333 50.506 21.318 1.00 0.00 O 0 +HETATM11311 H1 HOH A3663 7.000 49.945 20.986 1.00 0.00 H 0 +HETATM11312 H2 HOH A3663 6.063 50.289 22.271 1.00 0.00 H 0 +HETATM11313 O HOH A3664 34.205 2.149 48.749 1.00 0.00 O 0 +HETATM11314 H1 HOH A3664 33.858 1.974 49.573 1.00 0.00 H 0 +HETATM11315 H2 HOH A3664 33.762 1.546 48.197 1.00 0.00 H 0 +HETATM11316 O HOH A3665 45.321 22.993 21.005 1.00 0.00 O 0 +HETATM11317 H1 HOH A3665 44.498 23.508 21.137 1.00 0.00 H 0 +HETATM11318 H2 HOH A3665 44.994 22.062 21.076 1.00 0.00 H 0 +HETATM11319 O HOH A3666 52.998 14.848 34.286 1.00 0.00 O 0 +HETATM11320 H1 HOH A3666 53.085 15.528 33.573 1.00 0.00 H 0 +HETATM11321 H2 HOH A3666 53.921 14.682 34.565 1.00 0.00 H 0 +HETATM11322 O HOH A3667 14.259 9.175 1.817 1.00 0.00 O 0 +HETATM11323 H1 HOH A3667 14.449 9.608 0.962 1.00 0.00 H 0 +HETATM11324 H2 HOH A3667 13.312 9.406 2.024 1.00 0.00 H 0 +HETATM11325 O HOH A3668 42.282 31.973 33.008 1.00 0.00 O 0 +HETATM11326 H1 HOH A3668 42.536 31.292 33.619 1.00 0.00 H 0 +HETATM11327 H2 HOH A3668 41.718 32.602 33.534 1.00 0.00 H 0 +HETATM11328 O HOH A3669 45.614 38.442 5.656 1.00 0.00 O 0 +HETATM11329 H1 HOH A3669 45.713 39.358 5.410 1.00 0.00 H 0 +HETATM11330 H2 HOH A3669 46.333 37.845 5.471 1.00 0.00 H 0 +HETATM11331 O HOH A3670 47.349 17.148 12.305 1.00 0.00 O 0 +HETATM11332 H1 HOH A3670 48.290 16.935 12.321 1.00 0.00 H 0 +HETATM11333 H2 HOH A3670 46.936 16.249 12.356 1.00 0.00 H 0 +HETATM11334 O HOH A3671 48.050 10.566 29.606 1.00 0.00 O 0 +HETATM11335 H1 HOH A3671 47.387 11.050 30.066 1.00 0.00 H 0 +HETATM11336 H2 HOH A3671 48.849 11.078 29.393 1.00 0.00 H 0 +HETATM11337 O HOH A3672 38.210 53.600 28.362 1.00 0.00 O 0 +HETATM11338 H1 HOH A3672 38.375 53.057 27.585 1.00 0.00 H 0 +HETATM11339 H2 HOH A3672 37.854 53.116 29.077 1.00 0.00 H 0 +HETATM11340 O HOH A3673 26.435 10.982 8.207 1.00 0.00 O 0 +HETATM11341 H1 HOH A3673 25.474 10.911 8.042 1.00 0.00 H 0 +HETATM11342 H2 HOH A3673 26.697 10.174 8.652 1.00 0.00 H 0 +HETATM11343 O HOH A3674 25.401 16.305 3.456 1.00 0.00 O 0 +HETATM11344 H1 HOH A3674 26.392 16.242 3.313 1.00 0.00 H 0 +HETATM11345 H2 HOH A3674 25.055 15.477 3.104 1.00 0.00 H 0 +HETATM11346 O HOH A3675 29.803 36.692 29.391 1.00 0.00 O 0 +HETATM11347 H1 HOH A3675 30.194 37.534 29.050 1.00 0.00 H 0 +HETATM11348 H2 HOH A3675 29.294 36.907 30.178 1.00 0.00 H 0 +HETATM11349 O HOH A3676 51.448 31.042 28.044 1.00 0.00 O 0 +HETATM11350 H1 HOH A3676 52.245 31.504 28.349 1.00 0.00 H 0 +HETATM11351 H2 HOH A3676 51.142 30.545 28.762 1.00 0.00 H 0 +HETATM11352 O HOH A3677 10.961 6.452 20.372 1.00 0.00 O 0 +HETATM11353 H1 HOH A3677 11.164 5.531 20.511 1.00 0.00 H 0 +HETATM11354 H2 HOH A3677 10.233 6.753 20.912 1.00 0.00 H 0 +HETATM11355 O HOH A3678 19.052 6.126 17.040 1.00 0.00 O 0 +HETATM11356 H1 HOH A3678 19.580 5.863 16.315 1.00 0.00 H 0 +HETATM11357 H2 HOH A3678 18.935 5.416 17.720 1.00 0.00 H 0 +HETATM11358 O HOH A3679 37.264 51.414 2.321 1.00 0.00 O 0 +HETATM11359 H1 HOH A3679 37.960 50.956 2.766 1.00 0.00 H 0 +HETATM11360 H2 HOH A3679 37.667 51.781 1.544 1.00 0.00 H 0 +HETATM11361 O HOH A3680 53.352 51.590 28.656 1.00 0.00 O 0 +HETATM11362 H1 HOH A3680 52.748 52.164 28.158 1.00 0.00 H 0 +HETATM11363 H2 HOH A3680 54.212 51.955 28.550 1.00 0.00 H 0 +HETATM11364 O HOH A3681 42.186 52.192 29.827 1.00 0.00 O 0 +HETATM11365 H1 HOH A3681 41.876 52.564 29.001 1.00 0.00 H 0 +HETATM11366 H2 HOH A3681 41.529 51.489 30.033 1.00 0.00 H 0 +HETATM11367 O HOH A3682 38.470 38.120 17.779 1.00 0.00 O 0 +HETATM11368 H1 HOH A3682 38.356 38.861 17.230 1.00 0.00 H 0 +HETATM11369 H2 HOH A3682 38.371 37.292 17.259 1.00 0.00 H 0 +HETATM11370 O HOH A3683 32.032 2.731 34.648 1.00 0.00 O 0 +HETATM11371 H1 HOH A3683 32.723 2.965 35.336 1.00 0.00 H 0 +HETATM11372 H2 HOH A3683 31.936 1.744 34.643 1.00 0.00 H 0 +HETATM11373 O HOH A3684 49.718 7.660 31.472 1.00 0.00 O 0 +HETATM11374 H1 HOH A3684 48.800 7.631 31.677 1.00 0.00 H 0 +HETATM11375 H2 HOH A3684 50.213 7.998 32.296 1.00 0.00 H 0 +HETATM11376 O HOH A3685 9.161 45.896 40.527 1.00 0.00 O 0 +HETATM11377 H1 HOH A3685 9.114 45.281 39.720 1.00 0.00 H 0 +HETATM11378 H2 HOH A3685 8.773 45.427 41.284 1.00 0.00 H 0 +HETATM11379 O HOH A3686 3.430 52.139 13.445 1.00 0.00 O 0 +HETATM11380 H1 HOH A3686 4.066 51.802 12.809 1.00 0.00 H 0 +HETATM11381 H2 HOH A3686 2.633 51.538 13.253 1.00 0.00 H 0 +HETATM11382 O HOH A3687 37.175 4.106 19.305 1.00 0.00 O 0 +HETATM11383 H1 HOH A3687 37.825 3.978 18.617 1.00 0.00 H 0 +HETATM11384 H2 HOH A3687 37.006 3.231 19.549 1.00 0.00 H 0 +HETATM11385 O HOH A3688 25.091 45.124 33.660 1.00 0.00 O 0 +HETATM11386 H1 HOH A3688 24.851 45.875 34.215 1.00 0.00 H 0 +HETATM11387 H2 HOH A3688 24.414 44.455 33.747 1.00 0.00 H 0 +HETATM11388 O HOH A3689 31.871 50.012 21.920 1.00 0.00 O 0 +HETATM11389 H1 HOH A3689 31.555 49.456 21.249 1.00 0.00 H 0 +HETATM11390 H2 HOH A3689 31.074 50.244 22.496 1.00 0.00 H 0 +HETATM11391 O HOH A3690 0.049 36.265 38.818 1.00 0.00 O 0 +HETATM11392 H1 HOH A3690 0.629 36.205 39.566 1.00 0.00 H 0 +HETATM11393 H2 HOH A3690 0.470 35.871 38.045 1.00 0.00 H 0 +HETATM11394 O HOH A3691 7.734 22.179 14.325 1.00 0.00 O 0 +HETATM11395 H1 HOH A3691 7.897 21.366 14.953 1.00 0.00 H 0 +HETATM11396 H2 HOH A3691 8.221 21.937 13.560 1.00 0.00 H 0 +HETATM11397 O HOH A3692 14.054 6.109 27.851 1.00 0.00 O 0 +HETATM11398 H1 HOH A3692 13.389 5.450 27.752 1.00 0.00 H 0 +HETATM11399 H2 HOH A3692 14.795 5.956 27.230 1.00 0.00 H 0 +HETATM11400 O HOH A3693 5.411 38.959 34.028 1.00 0.00 O 0 +HETATM11401 H1 HOH A3693 6.031 38.708 34.746 1.00 0.00 H 0 +HETATM11402 H2 HOH A3693 4.724 38.275 33.822 1.00 0.00 H 0 +HETATM11403 O HOH A3694 38.457 17.636 24.221 1.00 0.00 O 0 +HETATM11404 H1 HOH A3694 38.856 18.491 24.320 1.00 0.00 H 0 +HETATM11405 H2 HOH A3694 38.652 17.172 25.046 1.00 0.00 H 0 +HETATM11406 O HOH A3695 10.581 38.085 4.378 1.00 0.00 O 0 +HETATM11407 H1 HOH A3695 11.223 38.574 3.887 1.00 0.00 H 0 +HETATM11408 H2 HOH A3695 10.832 38.066 5.274 1.00 0.00 H 0 +HETATM11409 O HOH A3696 41.872 51.852 9.689 1.00 0.00 O 0 +HETATM11410 H1 HOH A3696 42.602 51.210 9.451 1.00 0.00 H 0 +HETATM11411 H2 HOH A3696 42.128 52.745 9.629 1.00 0.00 H 0 +HETATM11412 O HOH A3697 22.597 37.851 48.038 1.00 0.00 O 0 +HETATM11413 H1 HOH A3697 22.596 37.912 47.119 1.00 0.00 H 0 +HETATM11414 H2 HOH A3697 22.584 36.865 48.201 1.00 0.00 H 0 +HETATM11415 O HOH A3698 38.781 43.417 16.030 1.00 0.00 O 0 +HETATM11416 H1 HOH A3698 37.844 43.674 16.331 1.00 0.00 H 0 +HETATM11417 H2 HOH A3698 39.395 43.803 16.710 1.00 0.00 H 0 +HETATM11418 O HOH A3699 3.783 19.006 33.352 1.00 0.00 O 0 +HETATM11419 H1 HOH A3699 4.357 19.772 33.126 1.00 0.00 H 0 +HETATM11420 H2 HOH A3699 3.282 18.780 32.598 1.00 0.00 H 0 +HETATM11421 O HOH A3700 37.233 38.539 48.297 1.00 0.00 O 0 +HETATM11422 H1 HOH A3700 37.940 38.043 47.834 1.00 0.00 H 0 +HETATM11423 H2 HOH A3700 37.602 38.620 49.176 1.00 0.00 H 0 +HETATM11424 O HOH A3701 6.758 9.022 0.281 1.00 0.00 O 0 +HETATM11425 H1 HOH A3701 6.257 9.368 -0.428 1.00 0.00 H 0 +HETATM11426 H2 HOH A3701 6.500 8.148 0.270 1.00 0.00 H 0 +HETATM11427 O HOH A3702 38.257 49.163 18.546 1.00 0.00 O 0 +HETATM11428 H1 HOH A3702 37.585 48.938 17.811 1.00 0.00 H 0 +HETATM11429 H2 HOH A3702 38.184 48.360 19.095 1.00 0.00 H 0 +HETATM11430 O HOH A3703 53.320 28.059 9.119 1.00 0.00 O 0 +HETATM11431 H1 HOH A3703 53.103 27.753 10.027 1.00 0.00 H 0 +HETATM11432 H2 HOH A3703 52.900 28.949 9.037 1.00 0.00 H 0 +HETATM11433 O HOH A3704 35.548 35.845 41.266 1.00 0.00 O 0 +HETATM11434 H1 HOH A3704 35.438 34.933 41.083 1.00 0.00 H 0 +HETATM11435 H2 HOH A3704 35.747 35.831 42.256 1.00 0.00 H 0 +HETATM11436 O HOH A3705 0.679 0.809 1.209 1.00 0.00 O 0 +HETATM11437 H1 HOH A3705 0.155 0.683 2.014 1.00 0.00 H 0 +HETATM11438 H2 HOH A3705 0.630 1.750 0.936 1.00 0.00 H 0 +HETATM11439 O HOH A3706 38.241 2.379 4.541 1.00 0.00 O 0 +HETATM11440 H1 HOH A3706 39.075 2.337 4.241 1.00 0.00 H 0 +HETATM11441 H2 HOH A3706 38.287 2.422 5.515 1.00 0.00 H 0 +HETATM11442 O HOH A3707 23.746 29.824 47.160 1.00 0.00 O 0 +HETATM11443 H1 HOH A3707 24.210 29.941 48.004 1.00 0.00 H 0 +HETATM11444 H2 HOH A3707 23.034 29.185 47.429 1.00 0.00 H 0 +HETATM11445 O HOH A3708 35.392 33.124 41.335 1.00 0.00 O 0 +HETATM11446 H1 HOH A3708 34.434 32.951 41.284 1.00 0.00 H 0 +HETATM11447 H2 HOH A3708 35.725 32.628 40.597 1.00 0.00 H 0 +HETATM11448 O HOH A3709 53.714 39.799 46.137 1.00 0.00 O 0 +HETATM11449 H1 HOH A3709 54.146 40.543 45.737 1.00 0.00 H 0 +HETATM11450 H2 HOH A3709 52.904 39.741 45.677 1.00 0.00 H 0 +HETATM11451 O HOH A3710 49.647 35.562 28.071 1.00 0.00 O 0 +HETATM11452 H1 HOH A3710 49.468 34.739 27.581 1.00 0.00 H 0 +HETATM11453 H2 HOH A3710 49.210 35.351 28.948 1.00 0.00 H 0 +HETATM11454 O HOH A3711 38.819 40.623 16.361 1.00 0.00 O 0 +HETATM11455 H1 HOH A3711 39.077 41.480 16.125 1.00 0.00 H 0 +HETATM11456 H2 HOH A3711 39.550 40.209 16.795 1.00 0.00 H 0 +HETATM11457 O HOH A3712 12.395 24.606 22.257 1.00 0.00 O 0 +HETATM11458 H1 HOH A3712 12.632 23.694 22.428 1.00 0.00 H 0 +HETATM11459 H2 HOH A3712 11.597 24.667 21.745 1.00 0.00 H 0 +HETATM11460 O HOH A3713 37.263 33.533 21.270 1.00 0.00 O 0 +HETATM11461 H1 HOH A3713 36.903 33.812 20.425 1.00 0.00 H 0 +HETATM11462 H2 HOH A3713 36.686 33.970 21.959 1.00 0.00 H 0 +HETATM11463 O HOH A3714 8.432 31.949 44.084 1.00 0.00 O 0 +HETATM11464 H1 HOH A3714 7.818 31.634 43.393 1.00 0.00 H 0 +HETATM11465 H2 HOH A3714 7.947 32.578 44.767 1.00 0.00 H 0 +HETATM11466 O HOH A3715 35.191 52.582 22.362 1.00 0.00 O 0 +HETATM11467 H1 HOH A3715 35.385 52.733 23.286 1.00 0.00 H 0 +HETATM11468 H2 HOH A3715 35.722 51.788 22.026 1.00 0.00 H 0 +HETATM11469 O HOH A3716 33.924 43.505 53.091 1.00 0.00 O 0 +HETATM11470 H1 HOH A3716 34.649 44.055 52.684 1.00 0.00 H 0 +HETATM11471 H2 HOH A3716 34.267 42.661 53.136 1.00 0.00 H 0 +HETATM11472 O HOH A3717 17.853 52.159 3.904 1.00 0.00 O 0 +HETATM11473 H1 HOH A3717 16.972 52.236 4.347 1.00 0.00 H 0 +HETATM11474 H2 HOH A3717 18.000 51.195 3.902 1.00 0.00 H 0 +HETATM11475 O HOH A3718 46.499 22.813 8.697 1.00 0.00 O 0 +HETATM11476 H1 HOH A3718 46.755 21.942 8.978 1.00 0.00 H 0 +HETATM11477 H2 HOH A3718 47.149 23.430 8.998 1.00 0.00 H 0 +HETATM11478 O HOH A3719 39.342 22.654 44.616 1.00 0.00 O 0 +HETATM11479 H1 HOH A3719 40.249 22.615 44.246 1.00 0.00 H 0 +HETATM11480 H2 HOH A3719 38.997 23.161 43.881 1.00 0.00 H 0 +HETATM11481 O HOH A3720 7.874 26.300 40.563 1.00 0.00 O 0 +HETATM11482 H1 HOH A3720 7.934 25.982 41.517 1.00 0.00 H 0 +HETATM11483 H2 HOH A3720 7.417 25.485 40.146 1.00 0.00 H 0 +HETATM11484 O HOH A3721 14.409 19.771 0.306 1.00 0.00 O 0 +HETATM11485 H1 HOH A3721 13.547 20.139 0.098 1.00 0.00 H 0 +HETATM11486 H2 HOH A3721 14.454 18.805 0.196 1.00 0.00 H 0 +HETATM11487 O HOH A3722 17.739 46.661 18.248 1.00 0.00 O 0 +HETATM11488 H1 HOH A3722 17.310 47.440 17.943 1.00 0.00 H 0 +HETATM11489 H2 HOH A3722 17.108 45.920 18.127 1.00 0.00 H 0 +HETATM11490 O HOH A3723 29.312 10.008 46.975 1.00 0.00 O 0 +HETATM11491 H1 HOH A3723 28.877 9.380 46.271 1.00 0.00 H 0 +HETATM11492 H2 HOH A3723 28.849 10.850 47.101 1.00 0.00 H 0 +HETATM11493 O HOH A3724 48.007 26.846 36.883 1.00 0.00 O 0 +HETATM11494 H1 HOH A3724 47.234 27.314 36.539 1.00 0.00 H 0 +HETATM11495 H2 HOH A3724 47.836 26.797 37.825 1.00 0.00 H 0 +HETATM11496 O HOH A3725 48.158 45.858 51.741 1.00 0.00 O 0 +HETATM11497 H1 HOH A3725 48.271 46.740 52.151 1.00 0.00 H 0 +HETATM11498 H2 HOH A3725 47.437 45.463 52.219 1.00 0.00 H 0 +HETATM11499 O HOH A3726 49.180 33.865 42.899 1.00 0.00 O 0 +HETATM11500 H1 HOH A3726 48.599 34.500 43.365 1.00 0.00 H 0 +HETATM11501 H2 HOH A3726 48.634 33.002 42.755 1.00 0.00 H 0 +HETATM11502 O HOH A3727 37.001 26.235 37.205 1.00 0.00 O 0 +HETATM11503 H1 HOH A3727 37.714 26.111 37.744 1.00 0.00 H 0 +HETATM11504 H2 HOH A3727 36.552 25.362 37.067 1.00 0.00 H 0 +HETATM11505 O HOH A3728 6.230 42.840 28.455 1.00 0.00 O 0 +HETATM11506 H1 HOH A3728 5.715 42.932 27.599 1.00 0.00 H 0 +HETATM11507 H2 HOH A3728 6.732 42.056 28.244 1.00 0.00 H 0 +HETATM11508 O HOH A3729 5.092 46.499 53.246 1.00 0.00 O 0 +HETATM11509 H1 HOH A3729 4.138 46.706 53.329 1.00 0.00 H 0 +HETATM11510 H2 HOH A3729 5.119 45.567 53.224 1.00 0.00 H 0 +HETATM11511 O HOH A3730 0.506 9.854 10.158 1.00 0.00 O 0 +HETATM11512 H1 HOH A3730 0.560 10.621 10.861 1.00 0.00 H 0 +HETATM11513 H2 HOH A3730 1.169 9.174 10.410 1.00 0.00 H 0 +HETATM11514 O HOH A3731 24.029 16.613 43.551 1.00 0.00 O 0 +HETATM11515 H1 HOH A3731 23.451 15.831 43.918 1.00 0.00 H 0 +HETATM11516 H2 HOH A3731 23.438 17.468 43.647 1.00 0.00 H 0 +HETATM11517 O HOH A3732 8.075 25.966 52.594 1.00 0.00 O 0 +HETATM11518 H1 HOH A3732 7.791 25.310 52.005 1.00 0.00 H 0 +HETATM11519 H2 HOH A3732 8.182 25.359 53.370 1.00 0.00 H 0 +HETATM11520 O HOH A3733 51.240 33.609 2.353 1.00 0.00 O 0 +HETATM11521 H1 HOH A3733 51.407 33.803 3.299 1.00 0.00 H 0 +HETATM11522 H2 HOH A3733 50.790 34.382 1.877 1.00 0.00 H 0 +HETATM11523 O HOH A3734 52.623 39.058 23.271 1.00 0.00 O 0 +HETATM11524 H1 HOH A3734 51.781 39.520 22.996 1.00 0.00 H 0 +HETATM11525 H2 HOH A3734 53.307 39.613 22.863 1.00 0.00 H 0 +HETATM11526 O HOH A3735 41.443 34.518 1.902 1.00 0.00 O 0 +HETATM11527 H1 HOH A3735 41.670 35.054 1.104 1.00 0.00 H 0 +HETATM11528 H2 HOH A3735 41.195 33.648 1.540 1.00 0.00 H 0 +HETATM11529 O HOH A3736 24.901 28.949 51.781 1.00 0.00 O 0 +HETATM11530 H1 HOH A3736 24.698 29.837 52.224 1.00 0.00 H 0 +HETATM11531 H2 HOH A3736 25.805 28.656 51.976 1.00 0.00 H 0 +HETATM11532 O HOH A3737 25.135 30.122 49.309 1.00 0.00 O 0 +HETATM11533 H1 HOH A3737 25.011 29.805 50.213 1.00 0.00 H 0 +HETATM11534 H2 HOH A3737 25.962 30.614 49.237 1.00 0.00 H 0 +HETATM11535 O HOH A3738 31.520 42.776 17.633 1.00 0.00 O 0 +HETATM11536 H1 HOH A3738 31.734 43.728 17.514 1.00 0.00 H 0 +HETATM11537 H2 HOH A3738 31.026 42.700 18.462 1.00 0.00 H 0 +HETATM11538 O HOH A3739 2.035 18.114 53.338 1.00 0.00 O 0 +HETATM11539 H1 HOH A3739 2.112 17.217 53.675 1.00 0.00 H 0 +HETATM11540 H2 HOH A3739 1.545 18.712 53.931 1.00 0.00 H 0 +HETATM11541 O HOH A3740 42.225 16.920 14.178 1.00 0.00 O 0 +HETATM11542 H1 HOH A3740 42.116 17.826 13.955 1.00 0.00 H 0 +HETATM11543 H2 HOH A3740 42.095 16.336 13.410 1.00 0.00 H 0 +HETATM11544 O HOH A3741 24.481 16.672 36.684 1.00 0.00 O 0 +HETATM11545 H1 HOH A3741 24.488 17.569 36.222 1.00 0.00 H 0 +HETATM11546 H2 HOH A3741 25.213 16.197 36.234 1.00 0.00 H 0 +HETATM11547 O HOH A3742 10.256 32.873 19.604 1.00 0.00 O 0 +HETATM11548 H1 HOH A3742 9.871 32.411 20.367 1.00 0.00 H 0 +HETATM11549 H2 HOH A3742 10.985 33.385 20.028 1.00 0.00 H 0 +HETATM11550 O HOH A3743 2.867 16.837 18.961 1.00 0.00 O 0 +HETATM11551 H1 HOH A3743 2.067 16.901 19.510 1.00 0.00 H 0 +HETATM11552 H2 HOH A3743 3.158 17.739 18.758 1.00 0.00 H 0 +HETATM11553 O HOH A3744 41.487 51.212 4.374 1.00 0.00 O 0 +HETATM11554 H1 HOH A3744 42.412 51.578 4.075 1.00 0.00 H 0 +HETATM11555 H2 HOH A3744 40.973 52.013 4.597 1.00 0.00 H 0 +HETATM11556 O HOH A3745 19.615 40.288 38.806 1.00 0.00 O 0 +HETATM11557 H1 HOH A3745 19.373 41.243 38.786 1.00 0.00 H 0 +HETATM11558 H2 HOH A3745 18.812 39.807 39.105 1.00 0.00 H 0 +HETATM11559 O HOH A3746 52.209 35.113 26.216 1.00 0.00 O 0 +HETATM11560 H1 HOH A3746 53.029 34.667 25.966 1.00 0.00 H 0 +HETATM11561 H2 HOH A3746 51.410 34.603 26.006 1.00 0.00 H 0 +HETATM11562 O HOH A3747 30.337 11.072 41.376 1.00 0.00 O 0 +HETATM11563 H1 HOH A3747 30.473 12.030 41.288 1.00 0.00 H 0 +HETATM11564 H2 HOH A3747 29.552 10.915 41.917 1.00 0.00 H 0 +HETATM11565 O HOH A3748 6.056 32.386 52.104 1.00 0.00 O 0 +HETATM11566 H1 HOH A3748 5.763 33.347 52.169 1.00 0.00 H 0 +HETATM11567 H2 HOH A3748 6.828 32.224 51.553 1.00 0.00 H 0 +HETATM11568 O HOH A3749 6.593 12.508 0.798 1.00 0.00 O 0 +HETATM11569 H1 HOH A3749 6.325 11.839 0.154 1.00 0.00 H 0 +HETATM11570 H2 HOH A3749 6.083 12.182 1.565 1.00 0.00 H 0 +HETATM11571 O HOH A3750 15.491 39.336 32.800 1.00 0.00 O 0 +HETATM11572 H1 HOH A3750 15.710 39.445 31.835 1.00 0.00 H 0 +HETATM11573 H2 HOH A3750 16.177 39.597 33.385 1.00 0.00 H 0 +HETATM11574 O HOH A3751 17.820 8.630 48.796 1.00 0.00 O 0 +HETATM11575 H1 HOH A3751 16.984 8.919 49.220 1.00 0.00 H 0 +HETATM11576 H2 HOH A3751 18.006 9.322 48.152 1.00 0.00 H 0 +HETATM11577 O HOH A3752 44.202 34.941 3.692 1.00 0.00 O 0 +HETATM11578 H1 HOH A3752 44.821 34.803 4.413 1.00 0.00 H 0 +HETATM11579 H2 HOH A3752 44.521 35.627 3.124 1.00 0.00 H 0 +HETATM11580 O HOH A3753 11.777 2.195 44.327 1.00 0.00 O 0 +HETATM11581 H1 HOH A3753 12.051 2.039 45.269 1.00 0.00 H 0 +HETATM11582 H2 HOH A3753 11.888 3.163 44.218 1.00 0.00 H 0 +HETATM11583 O HOH A3754 9.616 36.969 50.300 1.00 0.00 O 0 +HETATM11584 H1 HOH A3754 8.660 36.804 50.220 1.00 0.00 H 0 +HETATM11585 H2 HOH A3754 9.760 37.465 51.115 1.00 0.00 H 0 +HETATM11586 O HOH A3755 46.737 23.526 52.290 1.00 0.00 O 0 +HETATM11587 H1 HOH A3755 46.332 22.748 51.931 1.00 0.00 H 0 +HETATM11588 H2 HOH A3755 47.285 23.159 52.988 1.00 0.00 H 0 +HETATM11589 O HOH A3756 30.036 5.887 0.846 1.00 0.00 O 0 +HETATM11590 H1 HOH A3756 30.595 5.165 1.217 1.00 0.00 H 0 +HETATM11591 H2 HOH A3756 30.631 6.641 0.727 1.00 0.00 H 0 +HETATM11592 O HOH A3757 22.730 46.379 30.652 1.00 0.00 O 0 +HETATM11593 H1 HOH A3757 22.481 46.674 31.508 1.00 0.00 H 0 +HETATM11594 H2 HOH A3757 22.990 45.441 30.846 1.00 0.00 H 0 +HETATM11595 O HOH A3758 17.720 9.447 18.526 1.00 0.00 O 0 +HETATM11596 H1 HOH A3758 17.268 9.250 19.383 1.00 0.00 H 0 +HETATM11597 H2 HOH A3758 17.522 8.713 17.929 1.00 0.00 H 0 +HETATM11598 O HOH A3759 3.142 24.853 13.649 1.00 0.00 O 0 +HETATM11599 H1 HOH A3759 2.633 25.539 14.010 1.00 0.00 H 0 +HETATM11600 H2 HOH A3759 3.289 24.076 14.201 1.00 0.00 H 0 +HETATM11601 O HOH A3760 29.186 44.049 3.987 1.00 0.00 O 0 +HETATM11602 H1 HOH A3760 29.094 44.075 3.010 1.00 0.00 H 0 +HETATM11603 H2 HOH A3760 28.318 44.438 4.197 1.00 0.00 H 0 +HETATM11604 O HOH A3761 21.073 53.477 24.034 1.00 0.00 O 0 +HETATM11605 H1 HOH A3761 20.755 52.920 23.263 1.00 0.00 H 0 +HETATM11606 H2 HOH A3761 21.324 54.272 23.635 1.00 0.00 H 0 +HETATM11607 O HOH A3762 18.452 33.467 28.536 1.00 0.00 O 0 +HETATM11608 H1 HOH A3762 19.109 34.122 28.786 1.00 0.00 H 0 +HETATM11609 H2 HOH A3762 18.835 33.014 27.723 1.00 0.00 H 0 +HETATM11610 O HOH A3763 8.902 7.475 4.362 1.00 0.00 O 0 +HETATM11611 H1 HOH A3763 8.808 6.544 4.642 1.00 0.00 H 0 +HETATM11612 H2 HOH A3763 9.682 7.820 4.844 1.00 0.00 H 0 +HETATM11613 O HOH A3764 3.034 30.030 17.620 1.00 0.00 O 0 +HETATM11614 H1 HOH A3764 2.011 30.065 17.574 1.00 0.00 H 0 +HETATM11615 H2 HOH A3764 3.271 29.907 18.534 1.00 0.00 H 0 +HETATM11616 O HOH A3765 4.759 24.272 49.848 1.00 0.00 O 0 +HETATM11617 H1 HOH A3765 4.247 25.038 50.145 1.00 0.00 H 0 +HETATM11618 H2 HOH A3765 4.423 24.101 48.931 1.00 0.00 H 0 +HETATM11619 O HOH A3766 35.784 21.101 51.413 1.00 0.00 O 0 +HETATM11620 H1 HOH A3766 36.220 20.552 50.690 1.00 0.00 H 0 +HETATM11621 H2 HOH A3766 36.373 21.849 51.622 1.00 0.00 H 0 +HETATM11622 O HOH A3767 33.568 31.467 4.752 1.00 0.00 O 0 +HETATM11623 H1 HOH A3767 33.868 32.119 5.372 1.00 0.00 H 0 +HETATM11624 H2 HOH A3767 32.652 31.236 5.021 1.00 0.00 H 0 +HETATM11625 O HOH A3768 13.556 0.997 17.671 1.00 0.00 O 0 +HETATM11626 H1 HOH A3768 14.407 1.324 17.584 1.00 0.00 H 0 +HETATM11627 H2 HOH A3768 13.544 0.179 18.245 1.00 0.00 H 0 +HETATM11628 O HOH A3769 11.745 15.171 19.351 1.00 0.00 O 0 +HETATM11629 H1 HOH A3769 12.043 15.346 18.417 1.00 0.00 H 0 +HETATM11630 H2 HOH A3769 12.116 14.320 19.631 1.00 0.00 H 0 +HETATM11631 O HOH A3770 1.882 23.730 0.629 1.00 0.00 O 0 +HETATM11632 H1 HOH A3770 1.525 24.593 0.423 1.00 0.00 H 0 +HETATM11633 H2 HOH A3770 1.429 23.082 0.010 1.00 0.00 H 0 +HETATM11634 O HOH A3771 40.418 43.050 9.779 1.00 0.00 O 0 +HETATM11635 H1 HOH A3771 39.985 43.404 10.527 1.00 0.00 H 0 +HETATM11636 H2 HOH A3771 39.823 42.959 9.047 1.00 0.00 H 0 +HETATM11637 O HOH A3772 0.835 3.450 46.746 1.00 0.00 O 0 +HETATM11638 H1 HOH A3772 0.818 2.494 46.722 1.00 0.00 H 0 +HETATM11639 H2 HOH A3772 0.345 3.792 46.007 1.00 0.00 H 0 +HETATM11640 O HOH A3773 10.071 5.698 47.726 1.00 0.00 O 0 +HETATM11641 H1 HOH A3773 9.296 6.140 47.350 1.00 0.00 H 0 +HETATM11642 H2 HOH A3773 10.499 6.415 48.213 1.00 0.00 H 0 +HETATM11643 O HOH A3774 42.053 47.105 37.571 1.00 0.00 O 0 +HETATM11644 H1 HOH A3774 42.129 47.987 37.835 1.00 0.00 H 0 +HETATM11645 H2 HOH A3774 41.372 47.156 36.937 1.00 0.00 H 0 +HETATM11646 O HOH A3775 26.613 49.548 38.475 1.00 0.00 O 0 +HETATM11647 H1 HOH A3775 26.377 50.494 38.639 1.00 0.00 H 0 +HETATM11648 H2 HOH A3775 26.382 49.234 37.582 1.00 0.00 H 0 +HETATM11649 O HOH A3776 52.997 3.875 14.838 1.00 0.00 O 0 +HETATM11650 H1 HOH A3776 52.257 3.252 14.932 1.00 0.00 H 0 +HETATM11651 H2 HOH A3776 53.123 4.184 15.731 1.00 0.00 H 0 +HETATM11652 O HOH A3777 13.012 40.788 35.972 1.00 0.00 O 0 +HETATM11653 H1 HOH A3777 12.781 40.801 35.028 1.00 0.00 H 0 +HETATM11654 H2 HOH A3777 12.198 40.600 36.395 1.00 0.00 H 0 +HETATM11655 O HOH A3778 2.583 26.618 42.040 1.00 0.00 O 0 +HETATM11656 H1 HOH A3778 2.568 26.905 41.085 1.00 0.00 H 0 +HETATM11657 H2 HOH A3778 2.228 25.738 42.020 1.00 0.00 H 0 +HETATM11658 O HOH A3779 34.262 18.317 9.794 1.00 0.00 O 0 +HETATM11659 H1 HOH A3779 33.746 19.098 10.126 1.00 0.00 H 0 +HETATM11660 H2 HOH A3779 34.770 18.667 9.057 1.00 0.00 H 0 +HETATM11661 O HOH A3780 34.382 24.682 13.925 1.00 0.00 O 0 +HETATM11662 H1 HOH A3780 34.512 24.313 12.956 1.00 0.00 H 0 +HETATM11663 H2 HOH A3780 34.033 23.941 14.424 1.00 0.00 H 0 +HETATM11664 O HOH A3781 15.735 43.575 3.629 1.00 0.00 O 0 +HETATM11665 H1 HOH A3781 15.990 44.459 3.812 1.00 0.00 H 0 +HETATM11666 H2 HOH A3781 14.759 43.483 3.744 1.00 0.00 H 0 +HETATM11667 O HOH A3782 15.939 13.316 13.075 1.00 0.00 O 0 +HETATM11668 H1 HOH A3782 16.395 13.001 12.332 1.00 0.00 H 0 +HETATM11669 H2 HOH A3782 16.002 14.279 12.924 1.00 0.00 H 0 +HETATM11670 O HOH A3783 14.281 32.235 24.450 1.00 0.00 O 0 +HETATM11671 H1 HOH A3783 14.610 31.466 24.847 1.00 0.00 H 0 +HETATM11672 H2 HOH A3783 14.319 32.784 25.203 1.00 0.00 H 0 +HETATM11673 O HOH A3784 27.592 32.411 6.631 1.00 0.00 O 0 +HETATM11674 H1 HOH A3784 26.986 33.021 6.097 1.00 0.00 H 0 +HETATM11675 H2 HOH A3784 27.509 32.748 7.541 1.00 0.00 H 0 +HETATM11676 O HOH A3785 6.506 39.242 44.383 1.00 0.00 O 0 +HETATM11677 H1 HOH A3785 7.241 38.639 44.572 1.00 0.00 H 0 +HETATM11678 H2 HOH A3785 5.859 38.811 43.805 1.00 0.00 H 0 +HETATM11679 O HOH A3786 53.107 9.350 47.824 1.00 0.00 O 0 +HETATM11680 H1 HOH A3786 53.113 8.344 48.017 1.00 0.00 H 0 +HETATM11681 H2 HOH A3786 52.331 9.647 48.281 1.00 0.00 H 0 +HETATM11682 O HOH A3787 49.659 21.964 43.367 1.00 0.00 O 0 +HETATM11683 H1 HOH A3787 49.645 22.237 42.476 1.00 0.00 H 0 +HETATM11684 H2 HOH A3787 50.481 21.505 43.473 1.00 0.00 H 0 +HETATM11685 O HOH A3788 52.167 52.732 36.771 1.00 0.00 O 0 +HETATM11686 H1 HOH A3788 53.021 52.895 37.100 1.00 0.00 H 0 +HETATM11687 H2 HOH A3788 51.638 53.494 37.097 1.00 0.00 H 0 +HETATM11688 O HOH A3789 3.998 3.937 10.995 1.00 0.00 O 0 +HETATM11689 H1 HOH A3789 4.582 4.275 10.299 1.00 0.00 H 0 +HETATM11690 H2 HOH A3789 3.967 2.980 10.967 1.00 0.00 H 0 +HETATM11691 O HOH A3790 36.554 48.720 42.855 1.00 0.00 O 0 +HETATM11692 H1 HOH A3790 37.102 49.014 43.564 1.00 0.00 H 0 +HETATM11693 H2 HOH A3790 36.042 48.040 43.305 1.00 0.00 H 0 +HETATM11694 O HOH A3791 22.181 35.015 13.978 1.00 0.00 O 0 +HETATM11695 H1 HOH A3791 22.174 34.482 14.769 1.00 0.00 H 0 +HETATM11696 H2 HOH A3791 23.035 34.956 13.606 1.00 0.00 H 0 +HETATM11697 O HOH A3792 15.040 43.726 28.167 1.00 0.00 O 0 +HETATM11698 H1 HOH A3792 15.997 43.785 28.147 1.00 0.00 H 0 +HETATM11699 H2 HOH A3792 14.780 44.612 28.449 1.00 0.00 H 0 +HETATM11700 O HOH A3793 33.580 10.996 15.266 1.00 0.00 O 0 +HETATM11701 H1 HOH A3793 32.775 10.709 15.826 1.00 0.00 H 0 +HETATM11702 H2 HOH A3793 33.579 11.938 15.119 1.00 0.00 H 0 +HETATM11703 O HOH A3794 45.322 18.465 27.691 1.00 0.00 O 0 +HETATM11704 H1 HOH A3794 45.554 17.656 27.285 1.00 0.00 H 0 +HETATM11705 H2 HOH A3794 45.019 18.227 28.554 1.00 0.00 H 0 +HETATM11706 O HOH A3795 8.767 1.274 7.174 1.00 0.00 O 0 +HETATM11707 H1 HOH A3795 7.974 0.798 7.239 1.00 0.00 H 0 +HETATM11708 H2 HOH A3795 8.543 2.195 7.207 1.00 0.00 H 0 +HETATM11709 O HOH A3796 40.799 3.248 26.605 1.00 0.00 O 0 +HETATM11710 H1 HOH A3796 40.504 3.682 27.455 1.00 0.00 H 0 +HETATM11711 H2 HOH A3796 40.010 2.834 26.255 1.00 0.00 H 0 +HETATM11712 O HOH A3797 19.710 20.712 17.507 1.00 0.00 O 0 +HETATM11713 H1 HOH A3797 20.509 20.538 17.012 1.00 0.00 H 0 +HETATM11714 H2 HOH A3797 19.662 20.151 18.245 1.00 0.00 H 0 +HETATM11715 O HOH A3798 25.811 13.960 51.128 1.00 0.00 O 0 +HETATM11716 H1 HOH A3798 26.211 14.669 50.579 1.00 0.00 H 0 +HETATM11717 H2 HOH A3798 24.876 13.899 51.016 1.00 0.00 H 0 +HETATM11718 O HOH A3799 11.144 47.753 3.689 1.00 0.00 O 0 +HETATM11719 H1 HOH A3799 12.003 47.382 3.404 1.00 0.00 H 0 +HETATM11720 H2 HOH A3799 10.458 47.123 3.468 1.00 0.00 H 0 +HETATM11721 O HOH A3800 48.405 19.592 51.493 1.00 0.00 O 0 +HETATM11722 H1 HOH A3800 49.034 20.331 51.719 1.00 0.00 H 0 +HETATM11723 H2 HOH A3800 47.570 20.041 51.333 1.00 0.00 H 0 +HETATM11724 O HOH A3801 44.439 41.581 47.018 1.00 0.00 O 0 +HETATM11725 H1 HOH A3801 44.123 42.489 47.091 1.00 0.00 H 0 +HETATM11726 H2 HOH A3801 43.993 41.055 47.697 1.00 0.00 H 0 +HETATM11727 O HOH A3802 4.420 17.677 51.789 1.00 0.00 O 0 +HETATM11728 H1 HOH A3802 5.099 17.674 52.470 1.00 0.00 H 0 +HETATM11729 H2 HOH A3802 3.694 18.164 52.180 1.00 0.00 H 0 +HETATM11730 O HOH A3803 34.591 35.385 25.703 1.00 0.00 O 0 +HETATM11731 H1 HOH A3803 33.647 35.695 25.627 1.00 0.00 H 0 +HETATM11732 H2 HOH A3803 35.086 36.107 26.025 1.00 0.00 H 0 +HETATM11733 O HOH A3804 43.122 17.479 37.695 1.00 0.00 O 0 +HETATM11734 H1 HOH A3804 42.762 18.303 37.416 1.00 0.00 H 0 +HETATM11735 H2 HOH A3804 42.370 17.088 38.208 1.00 0.00 H 0 +HETATM11736 O HOH A3805 35.237 11.121 3.584 1.00 0.00 O 0 +HETATM11737 H1 HOH A3805 35.649 11.577 2.839 1.00 0.00 H 0 +HETATM11738 H2 HOH A3805 34.616 11.755 4.045 1.00 0.00 H 0 +HETATM11739 O HOH A3806 12.258 49.504 28.837 1.00 0.00 O 0 +HETATM11740 H1 HOH A3806 12.721 50.133 28.285 1.00 0.00 H 0 +HETATM11741 H2 HOH A3806 12.305 48.652 28.364 1.00 0.00 H 0 +HETATM11742 O HOH A3807 8.565 41.941 37.196 1.00 0.00 O 0 +HETATM11743 H1 HOH A3807 8.325 41.728 38.134 1.00 0.00 H 0 +HETATM11744 H2 HOH A3807 9.036 41.042 36.916 1.00 0.00 H 0 +HETATM11745 O HOH A3808 7.165 2.905 0.917 1.00 0.00 O 0 +HETATM11746 H1 HOH A3808 7.061 2.487 1.808 1.00 0.00 H 0 +HETATM11747 H2 HOH A3808 6.592 2.406 0.369 1.00 0.00 H 0 +HETATM11748 O HOH A3809 2.898 28.255 27.079 1.00 0.00 O 0 +HETATM11749 H1 HOH A3809 3.721 27.928 26.663 1.00 0.00 H 0 +HETATM11750 H2 HOH A3809 3.041 28.306 28.040 1.00 0.00 H 0 +HETATM11751 O HOH A3810 37.699 8.883 15.802 1.00 0.00 O 0 +HETATM11752 H1 HOH A3810 37.832 9.823 15.993 1.00 0.00 H 0 +HETATM11753 H2 HOH A3810 37.575 8.368 16.674 1.00 0.00 H 0 +HETATM11754 O HOH A3811 16.538 5.205 53.462 1.00 0.00 O 0 +HETATM11755 H1 HOH A3811 16.684 6.126 53.746 1.00 0.00 H 0 +HETATM11756 H2 HOH A3811 17.383 4.847 53.260 1.00 0.00 H 0 +HETATM11757 O HOH A3812 24.218 4.485 8.378 1.00 0.00 O 0 +HETATM11758 H1 HOH A3812 24.105 4.098 7.514 1.00 0.00 H 0 +HETATM11759 H2 HOH A3812 24.988 5.091 8.300 1.00 0.00 H 0 +HETATM11760 O HOH A3813 42.984 29.931 36.937 1.00 0.00 O 0 +HETATM11761 H1 HOH A3813 42.426 30.785 37.108 1.00 0.00 H 0 +HETATM11762 H2 HOH A3813 43.595 29.874 37.744 1.00 0.00 H 0 +HETATM11763 O HOH A3814 0.020 37.417 47.942 1.00 0.00 O 0 +HETATM11764 H1 HOH A3814 -0.122 37.828 48.796 1.00 0.00 H 0 +HETATM11765 H2 HOH A3814 0.199 38.173 47.399 1.00 0.00 H 0 +HETATM11766 O HOH A3815 21.868 40.495 30.066 1.00 0.00 O 0 +HETATM11767 H1 HOH A3815 22.759 40.933 30.191 1.00 0.00 H 0 +HETATM11768 H2 HOH A3815 21.802 40.556 29.130 1.00 0.00 H 0 +HETATM11769 O HOH A3816 45.065 50.874 23.739 1.00 0.00 O 0 +HETATM11770 H1 HOH A3816 45.284 50.974 24.686 1.00 0.00 H 0 +HETATM11771 H2 HOH A3816 44.230 51.402 23.662 1.00 0.00 H 0 +HETATM11772 O HOH A3817 6.700 41.326 7.543 1.00 0.00 O 0 +HETATM11773 H1 HOH A3817 6.529 42.227 7.436 1.00 0.00 H 0 +HETATM11774 H2 HOH A3817 6.762 41.216 8.539 1.00 0.00 H 0 +HETATM11775 O HOH A3818 4.980 45.293 5.618 1.00 0.00 O 0 +HETATM11776 H1 HOH A3818 4.332 44.697 5.127 1.00 0.00 H 0 +HETATM11777 H2 HOH A3818 5.468 44.694 6.188 1.00 0.00 H 0 +HETATM11778 O HOH A3819 4.895 4.747 51.603 1.00 0.00 O 0 +HETATM11779 H1 HOH A3819 4.557 5.506 51.981 1.00 0.00 H 0 +HETATM11780 H2 HOH A3819 5.880 4.848 51.493 1.00 0.00 H 0 +HETATM11781 O HOH A3820 42.191 53.014 25.914 1.00 0.00 O 0 +HETATM11782 H1 HOH A3820 42.641 53.871 26.203 1.00 0.00 H 0 +HETATM11783 H2 HOH A3820 42.814 52.273 26.005 1.00 0.00 H 0 +HETATM11784 O HOH A3821 18.651 16.193 20.711 1.00 0.00 O 0 +HETATM11785 H1 HOH A3821 18.543 16.146 21.627 1.00 0.00 H 0 +HETATM11786 H2 HOH A3821 17.792 15.972 20.277 1.00 0.00 H 0 +HETATM11787 O HOH A3822 45.028 53.532 36.141 1.00 0.00 O 0 +HETATM11788 H1 HOH A3822 45.075 52.593 35.870 1.00 0.00 H 0 +HETATM11789 H2 HOH A3822 45.201 53.992 35.305 1.00 0.00 H 0 +HETATM11790 O HOH A3823 6.930 37.407 25.358 1.00 0.00 O 0 +HETATM11791 H1 HOH A3823 7.701 37.825 25.012 1.00 0.00 H 0 +HETATM11792 H2 HOH A3823 6.148 37.835 24.953 1.00 0.00 H 0 +HETATM11793 O HOH A3824 53.262 42.896 2.933 1.00 0.00 O 0 +HETATM11794 H1 HOH A3824 52.858 42.104 2.533 1.00 0.00 H 0 +HETATM11795 H2 HOH A3824 52.820 43.089 3.762 1.00 0.00 H 0 +HETATM11796 O HOH A3825 44.323 48.283 6.576 1.00 0.00 O 0 +HETATM11797 H1 HOH A3825 44.680 48.232 5.662 1.00 0.00 H 0 +HETATM11798 H2 HOH A3825 45.027 47.894 7.140 1.00 0.00 H 0 +HETATM11799 O HOH A3826 25.763 6.493 15.320 1.00 0.00 O 0 +HETATM11800 H1 HOH A3826 24.896 6.250 15.019 1.00 0.00 H 0 +HETATM11801 H2 HOH A3826 25.477 6.976 16.139 1.00 0.00 H 0 +HETATM11802 O HOH A3827 44.863 35.304 22.195 1.00 0.00 O 0 +HETATM11803 H1 HOH A3827 45.787 35.246 21.920 1.00 0.00 H 0 +HETATM11804 H2 HOH A3827 44.401 35.403 21.310 1.00 0.00 H 0 +HETATM11805 O HOH A3828 19.667 19.651 39.209 1.00 0.00 O 0 +HETATM11806 H1 HOH A3828 19.988 20.407 38.745 1.00 0.00 H 0 +HETATM11807 H2 HOH A3828 19.952 18.783 38.904 1.00 0.00 H 0 +HETATM11808 O HOH A3829 11.896 9.954 12.479 1.00 0.00 O 0 +HETATM11809 H1 HOH A3829 12.321 9.836 13.296 1.00 0.00 H 0 +HETATM11810 H2 HOH A3829 11.500 10.832 12.477 1.00 0.00 H 0 +HETATM11811 O HOH A3830 5.977 13.633 7.942 1.00 0.00 O 0 +HETATM11812 H1 HOH A3830 6.780 13.570 7.460 1.00 0.00 H 0 +HETATM11813 H2 HOH A3830 6.171 13.216 8.813 1.00 0.00 H 0 +HETATM11814 O HOH A3831 19.716 29.311 46.729 1.00 0.00 O 0 +HETATM11815 H1 HOH A3831 19.544 30.166 46.924 1.00 0.00 H 0 +HETATM11816 H2 HOH A3831 19.884 29.292 45.776 1.00 0.00 H 0 +HETATM11817 O HOH A3832 47.500 44.527 40.562 1.00 0.00 O 0 +HETATM11818 H1 HOH A3832 47.444 44.523 39.587 1.00 0.00 H 0 +HETATM11819 H2 HOH A3832 47.464 43.623 40.895 1.00 0.00 H 0 +HETATM11820 O HOH A3833 9.166 38.458 24.334 1.00 0.00 O 0 +HETATM11821 H1 HOH A3833 9.207 39.233 23.731 1.00 0.00 H 0 +HETATM11822 H2 HOH A3833 9.888 38.508 24.902 1.00 0.00 H 0 +HETATM11823 O HOH A3834 29.627 12.434 52.920 1.00 0.00 O 0 +HETATM11824 H1 HOH A3834 30.238 12.722 53.670 1.00 0.00 H 0 +HETATM11825 H2 HOH A3834 28.739 12.605 53.154 1.00 0.00 H 0 +HETATM11826 O HOH A3835 22.034 2.970 25.227 1.00 0.00 O 0 +HETATM11827 H1 HOH A3835 21.685 2.657 26.010 1.00 0.00 H 0 +HETATM11828 H2 HOH A3835 21.429 2.619 24.535 1.00 0.00 H 0 +HETATM11829 O HOH A3836 21.980 6.175 9.623 1.00 0.00 O 0 +HETATM11830 H1 HOH A3836 21.802 6.629 8.827 1.00 0.00 H 0 +HETATM11831 H2 HOH A3836 22.607 5.474 9.501 1.00 0.00 H 0 +HETATM11832 O HOH A3837 16.680 39.061 14.149 1.00 0.00 O 0 +HETATM11833 H1 HOH A3837 17.537 39.076 14.610 1.00 0.00 H 0 +HETATM11834 H2 HOH A3837 16.289 38.195 14.154 1.00 0.00 H 0 +HETATM11835 O HOH A3838 15.013 53.306 23.439 1.00 0.00 O 0 +HETATM11836 H1 HOH A3838 15.501 53.291 22.590 1.00 0.00 H 0 +HETATM11837 H2 HOH A3838 15.603 52.766 23.963 1.00 0.00 H 0 +HETATM11838 O HOH A3839 44.584 31.500 19.261 1.00 0.00 O 0 +HETATM11839 H1 HOH A3839 43.730 32.059 19.369 1.00 0.00 H 0 +HETATM11840 H2 HOH A3839 44.875 31.446 20.154 1.00 0.00 H 0 +HETATM11841 O HOH A3840 32.638 14.128 8.316 1.00 0.00 O 0 +HETATM11842 H1 HOH A3840 32.668 13.222 8.007 1.00 0.00 H 0 +HETATM11843 H2 HOH A3840 32.328 14.761 7.685 1.00 0.00 H 0 +HETATM11844 O HOH A3841 4.687 41.530 46.893 1.00 0.00 O 0 +HETATM11845 H1 HOH A3841 3.988 41.393 47.475 1.00 0.00 H 0 +HETATM11846 H2 HOH A3841 5.463 41.540 47.475 1.00 0.00 H 0 +HETATM11847 O HOH A3842 17.251 10.897 31.338 1.00 0.00 O 0 +HETATM11848 H1 HOH A3842 16.834 11.672 31.797 1.00 0.00 H 0 +HETATM11849 H2 HOH A3842 17.650 11.340 30.599 1.00 0.00 H 0 +HETATM11850 O HOH A3843 23.372 53.151 37.866 1.00 0.00 O 0 +HETATM11851 H1 HOH A3843 23.265 54.012 38.205 1.00 0.00 H 0 +HETATM11852 H2 HOH A3843 24.210 53.195 37.453 1.00 0.00 H 0 +HETATM11853 O HOH A3844 29.069 34.501 31.631 1.00 0.00 O 0 +HETATM11854 H1 HOH A3844 29.683 34.210 30.997 1.00 0.00 H 0 +HETATM11855 H2 HOH A3844 28.211 34.569 31.320 1.00 0.00 H 0 +HETATM11856 O HOH A3845 51.452 16.553 7.080 1.00 0.00 O 0 +HETATM11857 H1 HOH A3845 51.356 17.262 6.483 1.00 0.00 H 0 +HETATM11858 H2 HOH A3845 52.132 16.737 7.751 1.00 0.00 H 0 +HETATM11859 O HOH A3846 22.450 4.445 40.523 1.00 0.00 O 0 +HETATM11860 H1 HOH A3846 22.138 4.012 41.319 1.00 0.00 H 0 +HETATM11861 H2 HOH A3846 21.678 4.772 40.061 1.00 0.00 H 0 +HETATM11862 O HOH A3847 38.660 47.748 51.173 1.00 0.00 O 0 +HETATM11863 H1 HOH A3847 37.723 48.006 51.310 1.00 0.00 H 0 +HETATM11864 H2 HOH A3847 38.993 47.428 52.055 1.00 0.00 H 0 +HETATM11865 O HOH A3848 16.161 32.128 8.231 1.00 0.00 O 0 +HETATM11866 H1 HOH A3848 15.786 32.992 8.402 1.00 0.00 H 0 +HETATM11867 H2 HOH A3848 15.395 31.728 7.846 1.00 0.00 H 0 +HETATM11868 O HOH A3849 1.528 17.844 38.015 1.00 0.00 O 0 +HETATM11869 H1 HOH A3849 0.841 18.317 38.485 1.00 0.00 H 0 +HETATM11870 H2 HOH A3849 1.890 18.430 37.341 1.00 0.00 H 0 +HETATM11871 O HOH A3850 28.757 44.692 12.777 1.00 0.00 O 0 +HETATM11872 H1 HOH A3850 28.474 44.726 11.829 1.00 0.00 H 0 +HETATM11873 H2 HOH A3850 29.751 44.385 12.898 1.00 0.00 H 0 +HETATM11874 O HOH A3851 51.947 0.713 43.233 1.00 0.00 O 0 +HETATM11875 H1 HOH A3851 51.995 1.644 43.034 1.00 0.00 H 0 +HETATM11876 H2 HOH A3851 52.459 0.237 42.606 1.00 0.00 H 0 +HETATM11877 O HOH A3852 3.674 2.492 36.617 1.00 0.00 O 0 +HETATM11878 H1 HOH A3852 4.410 2.681 35.984 1.00 0.00 H 0 +HETATM11879 H2 HOH A3852 2.814 2.745 36.188 1.00 0.00 H 0 +HETATM11880 O HOH A3853 50.765 5.053 46.969 1.00 0.00 O 0 +HETATM11881 H1 HOH A3853 51.135 4.753 46.111 1.00 0.00 H 0 +HETATM11882 H2 HOH A3853 50.558 4.295 47.498 1.00 0.00 H 0 +HETATM11883 O HOH A3854 47.681 11.920 37.672 1.00 0.00 O 0 +HETATM11884 H1 HOH A3854 46.775 11.687 37.459 1.00 0.00 H 0 +HETATM11885 H2 HOH A3854 48.205 11.090 37.772 1.00 0.00 H 0 +HETATM11886 O HOH A3855 49.030 45.103 3.750 1.00 0.00 O 0 +HETATM11887 H1 HOH A3855 48.454 44.317 3.768 1.00 0.00 H 0 +HETATM11888 H2 HOH A3855 48.492 45.833 3.429 1.00 0.00 H 0 +HETATM11889 O HOH A3856 10.058 34.777 12.053 1.00 0.00 O 0 +HETATM11890 H1 HOH A3856 9.263 35.261 12.392 1.00 0.00 H 0 +HETATM11891 H2 HOH A3856 10.811 35.378 12.397 1.00 0.00 H 0 +HETATM11892 O HOH A3857 34.292 4.410 53.198 1.00 0.00 O 0 +HETATM11893 H1 HOH A3857 33.880 4.636 52.301 1.00 0.00 H 0 +HETATM11894 H2 HOH A3857 34.844 5.103 53.479 1.00 0.00 H 0 +HETATM11895 O HOH A3858 32.936 30.154 42.061 1.00 0.00 O 0 +HETATM11896 H1 HOH A3858 33.806 30.043 41.687 1.00 0.00 H 0 +HETATM11897 H2 HOH A3858 33.053 29.832 42.996 1.00 0.00 H 0 +HETATM11898 O HOH A3859 22.284 41.370 37.151 1.00 0.00 O 0 +HETATM11899 H1 HOH A3859 21.983 40.551 37.567 1.00 0.00 H 0 +HETATM11900 H2 HOH A3859 23.244 41.174 36.863 1.00 0.00 H 0 +HETATM11901 O HOH A3860 22.499 27.253 4.588 1.00 0.00 O 0 +HETATM11902 H1 HOH A3860 23.054 26.578 5.015 1.00 0.00 H 0 +HETATM11903 H2 HOH A3860 22.587 28.020 5.130 1.00 0.00 H 0 +HETATM11904 O HOH A3861 50.831 26.692 36.869 1.00 0.00 O 0 +HETATM11905 H1 HOH A3861 51.160 27.587 37.091 1.00 0.00 H 0 +HETATM11906 H2 HOH A3861 49.905 26.802 36.861 1.00 0.00 H 0 +HETATM11907 O HOH A3862 20.528 24.275 13.895 1.00 0.00 O 0 +HETATM11908 H1 HOH A3862 20.177 24.378 14.781 1.00 0.00 H 0 +HETATM11909 H2 HOH A3862 21.107 23.545 13.984 1.00 0.00 H 0 +HETATM11910 O HOH A3863 39.687 27.810 33.904 1.00 0.00 O 0 +HETATM11911 H1 HOH A3863 40.219 27.102 33.519 1.00 0.00 H 0 +HETATM11912 H2 HOH A3863 38.884 27.385 34.210 1.00 0.00 H 0 +HETATM11913 O HOH A3864 5.103 40.657 53.518 1.00 0.00 O 0 +HETATM11914 H1 HOH A3864 4.757 41.013 52.695 1.00 0.00 H 0 +HETATM11915 H2 HOH A3864 6.055 40.668 53.361 1.00 0.00 H 0 +HETATM11916 O HOH A3865 24.956 46.048 13.564 1.00 0.00 O 0 +HETATM11917 H1 HOH A3865 25.313 45.312 13.089 1.00 0.00 H 0 +HETATM11918 H2 HOH A3865 24.933 45.918 14.533 1.00 0.00 H 0 +HETATM11919 O HOH A3866 4.386 9.647 16.407 1.00 0.00 O 0 +HETATM11920 H1 HOH A3866 5.239 9.790 16.781 1.00 0.00 H 0 +HETATM11921 H2 HOH A3866 3.820 10.018 17.082 1.00 0.00 H 0 +HETATM11922 O HOH A3867 1.538 40.523 48.505 1.00 0.00 O 0 +HETATM11923 H1 HOH A3867 0.819 40.451 47.867 1.00 0.00 H 0 +HETATM11924 H2 HOH A3867 1.867 39.722 48.800 1.00 0.00 H 0 +HETATM11925 O HOH A3868 50.304 19.153 6.399 1.00 0.00 O 0 +HETATM11926 H1 HOH A3868 49.369 18.749 6.396 1.00 0.00 H 0 +HETATM11927 H2 HOH A3868 50.230 19.827 7.083 1.00 0.00 H 0 +HETATM11928 O HOH A3869 38.044 1.547 0.780 1.00 0.00 O 0 +HETATM11929 H1 HOH A3869 38.379 0.866 1.451 1.00 0.00 H 0 +HETATM11930 H2 HOH A3869 38.847 1.871 0.325 1.00 0.00 H 0 +HETATM11931 O HOH A3870 12.085 26.598 40.882 1.00 0.00 O 0 +HETATM11932 H1 HOH A3870 11.999 25.848 41.498 1.00 0.00 H 0 +HETATM11933 H2 HOH A3870 11.401 27.206 41.103 1.00 0.00 H 0 +HETATM11934 O HOH A3871 10.300 35.085 4.071 1.00 0.00 O 0 +HETATM11935 H1 HOH A3871 10.307 36.035 3.901 1.00 0.00 H 0 +HETATM11936 H2 HOH A3871 9.622 34.974 4.794 1.00 0.00 H 0 +HETATM11937 O HOH A3872 23.324 20.000 9.808 1.00 0.00 O 0 +HETATM11938 H1 HOH A3872 22.409 20.290 9.910 1.00 0.00 H 0 +HETATM11939 H2 HOH A3872 23.563 20.233 8.898 1.00 0.00 H 0 +HETATM11940 O HOH A3873 14.950 30.935 3.495 1.00 0.00 O 0 +HETATM11941 H1 HOH A3873 13.992 30.972 3.461 1.00 0.00 H 0 +HETATM11942 H2 HOH A3873 15.320 30.499 2.731 1.00 0.00 H 0 +HETATM11943 O HOH A3874 35.425 45.287 51.665 1.00 0.00 O 0 +HETATM11944 H1 HOH A3874 35.416 46.317 51.589 1.00 0.00 H 0 +HETATM11945 H2 HOH A3874 35.522 44.991 50.752 1.00 0.00 H 0 +HETATM11946 O HOH A3875 16.770 46.083 13.993 1.00 0.00 O 0 +HETATM11947 H1 HOH A3875 16.795 46.868 13.498 1.00 0.00 H 0 +HETATM11948 H2 HOH A3875 17.644 45.725 13.999 1.00 0.00 H 0 +HETATM11949 O HOH A3876 40.904 35.159 51.422 1.00 0.00 O 0 +HETATM11950 H1 HOH A3876 41.261 34.202 51.512 1.00 0.00 H 0 +HETATM11951 H2 HOH A3876 40.582 35.166 50.503 1.00 0.00 H 0 +HETATM11952 O HOH A3877 24.008 4.864 17.654 1.00 0.00 O 0 +HETATM11953 H1 HOH A3877 24.737 4.913 18.228 1.00 0.00 H 0 +HETATM11954 H2 HOH A3877 24.287 4.388 16.897 1.00 0.00 H 0 +HETATM11955 O HOH A3878 53.232 17.531 9.321 1.00 0.00 O 0 +HETATM11956 H1 HOH A3878 53.461 18.430 8.996 1.00 0.00 H 0 +HETATM11957 H2 HOH A3878 54.057 17.031 9.379 1.00 0.00 H 0 +HETATM11958 O HOH A3879 25.644 52.057 17.880 1.00 0.00 O 0 +HETATM11959 H1 HOH A3879 26.270 51.296 17.856 1.00 0.00 H 0 +HETATM11960 H2 HOH A3879 24.808 51.781 17.518 1.00 0.00 H 0 +HETATM11961 O HOH A3880 53.025 38.127 41.817 1.00 0.00 O 0 +HETATM11962 H1 HOH A3880 52.823 38.942 42.323 1.00 0.00 H 0 +HETATM11963 H2 HOH A3880 53.201 38.330 40.935 1.00 0.00 H 0 +HETATM11964 O HOH A3881 25.752 29.366 35.068 1.00 0.00 O 0 +HETATM11965 H1 HOH A3881 26.656 29.660 34.873 1.00 0.00 H 0 +HETATM11966 H2 HOH A3881 25.437 29.101 34.257 1.00 0.00 H 0 +HETATM11967 O HOH A3882 25.641 16.257 6.580 1.00 0.00 O 0 +HETATM11968 H1 HOH A3882 25.387 17.116 6.855 1.00 0.00 H 0 +HETATM11969 H2 HOH A3882 25.408 16.211 5.643 1.00 0.00 H 0 +HETATM11970 O HOH A3883 36.911 22.872 5.830 1.00 0.00 O 0 +HETATM11971 H1 HOH A3883 37.099 22.957 4.903 1.00 0.00 H 0 +HETATM11972 H2 HOH A3883 37.736 22.478 6.177 1.00 0.00 H 0 +HETATM11973 O HOH A3884 16.806 23.487 52.696 1.00 0.00 O 0 +HETATM11974 H1 HOH A3884 16.537 23.283 51.788 1.00 0.00 H 0 +HETATM11975 H2 HOH A3884 16.956 22.697 53.262 1.00 0.00 H 0 +HETATM11976 O HOH A3885 27.447 7.682 2.096 1.00 0.00 O 0 +HETATM11977 H1 HOH A3885 27.443 7.841 1.121 1.00 0.00 H 0 +HETATM11978 H2 HOH A3885 27.245 8.585 2.413 1.00 0.00 H 0 +HETATM11979 O HOH A3886 25.201 14.548 21.046 1.00 0.00 O 0 +HETATM11980 H1 HOH A3886 24.680 14.137 20.387 1.00 0.00 H 0 +HETATM11981 H2 HOH A3886 24.860 15.383 21.166 1.00 0.00 H 0 +HETATM11982 O HOH A3887 34.330 21.741 0.385 1.00 0.00 O 0 +HETATM11983 H1 HOH A3887 33.385 21.923 0.435 1.00 0.00 H 0 +HETATM11984 H2 HOH A3887 34.370 20.874 -0.045 1.00 0.00 H 0 +HETATM11985 O HOH A3888 38.727 39.797 9.635 1.00 0.00 O 0 +HETATM11986 H1 HOH A3888 39.114 39.631 8.757 1.00 0.00 H 0 +HETATM11987 H2 HOH A3888 37.959 39.154 9.756 1.00 0.00 H 0 +HETATM11988 O HOH A3889 14.172 51.386 49.515 1.00 0.00 O 0 +HETATM11989 H1 HOH A3889 13.401 51.164 50.017 1.00 0.00 H 0 +HETATM11990 H2 HOH A3889 14.338 50.838 48.777 1.00 0.00 H 0 +HETATM11991 O HOH A3890 29.355 49.542 38.205 1.00 0.00 O 0 +HETATM11992 H1 HOH A3890 28.372 49.547 38.207 1.00 0.00 H 0 +HETATM11993 H2 HOH A3890 29.528 50.074 37.351 1.00 0.00 H 0 +HETATM11994 O HOH A3891 51.921 31.048 43.900 1.00 0.00 O 0 +HETATM11995 H1 HOH A3891 51.156 31.105 44.482 1.00 0.00 H 0 +HETATM11996 H2 HOH A3891 52.206 31.973 43.640 1.00 0.00 H 0 +HETATM11997 O HOH A3892 53.580 50.640 41.668 1.00 0.00 O 0 +HETATM11998 H1 HOH A3892 54.259 50.053 41.334 1.00 0.00 H 0 +HETATM11999 H2 HOH A3892 52.736 50.211 41.785 1.00 0.00 H 0 +HETATM12000 O HOH A3893 47.533 38.166 44.783 1.00 0.00 O 0 +HETATM12001 H1 HOH A3893 48.088 38.110 45.558 1.00 0.00 H 0 +HETATM12002 H2 HOH A3893 47.852 38.851 44.178 1.00 0.00 H 0 +HETATM12003 O HOH A3894 40.018 35.823 26.970 1.00 0.00 O 0 +HETATM12004 H1 HOH A3894 40.893 35.776 26.578 1.00 0.00 H 0 +HETATM12005 H2 HOH A3894 40.213 35.956 27.953 1.00 0.00 H 0 +HETATM12006 O HOH A3895 8.449 44.289 28.669 1.00 0.00 O 0 +HETATM12007 H1 HOH A3895 7.642 43.883 28.489 1.00 0.00 H 0 +HETATM12008 H2 HOH A3895 8.488 45.140 28.214 1.00 0.00 H 0 +HETATM12009 O HOH A3896 11.877 19.336 46.420 1.00 0.00 O 0 +HETATM12010 H1 HOH A3896 11.408 18.813 47.057 1.00 0.00 H 0 +HETATM12011 H2 HOH A3896 12.358 18.694 45.895 1.00 0.00 H 0 +HETATM12012 O HOH A3897 20.341 23.222 18.566 1.00 0.00 O 0 +HETATM12013 H1 HOH A3897 20.172 23.886 17.904 1.00 0.00 H 0 +HETATM12014 H2 HOH A3897 19.988 22.400 18.271 1.00 0.00 H 0 +HETATM12015 O HOH A3898 31.181 19.459 8.763 1.00 0.00 O 0 +HETATM12016 H1 HOH A3898 31.511 19.868 7.982 1.00 0.00 H 0 +HETATM12017 H2 HOH A3898 30.563 18.700 8.541 1.00 0.00 H 0 +HETATM12018 O HOH A3899 22.554 9.815 23.236 1.00 0.00 O 0 +HETATM12019 H1 HOH A3899 21.572 9.830 23.091 1.00 0.00 H 0 +HETATM12020 H2 HOH A3899 22.843 8.950 23.580 1.00 0.00 H 0 +HETATM12021 O HOH A3900 50.809 50.735 49.871 1.00 0.00 O 0 +HETATM12022 H1 HOH A3900 49.928 50.584 50.287 1.00 0.00 H 0 +HETATM12023 H2 HOH A3900 51.458 50.837 50.618 1.00 0.00 H 0 +HETATM12024 O HOH A3901 49.861 23.123 40.328 1.00 0.00 O 0 +HETATM12025 H1 HOH A3901 48.944 23.159 40.667 1.00 0.00 H 0 +HETATM12026 H2 HOH A3901 50.067 24.055 40.134 1.00 0.00 H 0 +HETATM12027 O HOH A3902 46.330 15.921 47.580 1.00 0.00 O 0 +HETATM12028 H1 HOH A3902 45.551 15.859 46.944 1.00 0.00 H 0 +HETATM12029 H2 HOH A3902 46.314 16.803 48.022 1.00 0.00 H 0 +HETATM12030 O HOH A3903 47.519 23.213 5.935 1.00 0.00 O 0 +HETATM12031 H1 HOH A3903 47.252 23.064 6.899 1.00 0.00 H 0 +HETATM12032 H2 HOH A3903 46.995 23.943 5.560 1.00 0.00 H 0 +HETATM12033 O HOH A3904 18.405 16.317 34.488 1.00 0.00 O 0 +HETATM12034 H1 HOH A3904 18.710 17.209 34.605 1.00 0.00 H 0 +HETATM12035 H2 HOH A3904 19.165 15.913 34.938 1.00 0.00 H 0 +HETATM12036 O HOH A3905 26.303 22.669 1.573 1.00 0.00 O 0 +HETATM12037 H1 HOH A3905 25.680 22.866 0.841 1.00 0.00 H 0 +HETATM12038 H2 HOH A3905 26.911 23.411 1.574 1.00 0.00 H 0 +HETATM12039 O HOH A3906 8.276 51.109 16.419 1.00 0.00 O 0 +HETATM12040 H1 HOH A3906 7.818 50.884 15.577 1.00 0.00 H 0 +HETATM12041 H2 HOH A3906 9.199 51.115 16.262 1.00 0.00 H 0 +HETATM12042 O HOH A3907 7.485 35.453 12.960 1.00 0.00 O 0 +HETATM12043 H1 HOH A3907 7.207 34.572 13.173 1.00 0.00 H 0 +HETATM12044 H2 HOH A3907 7.175 35.971 13.765 1.00 0.00 H 0 +HETATM12045 O HOH A3908 2.694 9.353 0.072 1.00 0.00 O 0 +HETATM12046 H1 HOH A3908 1.680 9.349 0.110 1.00 0.00 H 0 +HETATM12047 H2 HOH A3908 3.005 10.174 0.457 1.00 0.00 H 0 +HETATM12048 O HOH A3909 33.528 15.047 30.873 1.00 0.00 O 0 +HETATM12049 H1 HOH A3909 33.768 15.026 29.959 1.00 0.00 H 0 +HETATM12050 H2 HOH A3909 34.275 15.490 31.286 1.00 0.00 H 0 +HETATM12051 O HOH A3910 46.137 11.072 0.882 1.00 0.00 O 0 +HETATM12052 H1 HOH A3910 46.671 11.713 1.354 1.00 0.00 H 0 +HETATM12053 H2 HOH A3910 45.193 11.325 0.978 1.00 0.00 H 0 +HETATM12054 O HOH A3911 2.461 52.202 28.782 1.00 0.00 O 0 +HETATM12055 H1 HOH A3911 2.883 51.394 28.708 1.00 0.00 H 0 +HETATM12056 H2 HOH A3911 2.651 52.737 27.950 1.00 0.00 H 0 +HETATM12057 O HOH A3912 4.847 31.397 8.982 1.00 0.00 O 0 +HETATM12058 H1 HOH A3912 4.362 30.543 8.777 1.00 0.00 H 0 +HETATM12059 H2 HOH A3912 4.409 31.648 9.792 1.00 0.00 H 0 +HETATM12060 O HOH A3913 7.607 29.061 30.582 1.00 0.00 O 0 +HETATM12061 H1 HOH A3913 6.886 29.652 30.524 1.00 0.00 H 0 +HETATM12062 H2 HOH A3913 7.382 28.330 29.961 1.00 0.00 H 0 +HETATM12063 O HOH A3914 12.160 18.736 6.418 1.00 0.00 O 0 +HETATM12064 H1 HOH A3914 11.670 18.449 7.219 1.00 0.00 H 0 +HETATM12065 H2 HOH A3914 11.586 19.385 6.026 1.00 0.00 H 0 +HETATM12066 O HOH A3915 52.672 23.771 2.535 1.00 0.00 O 0 +HETATM12067 H1 HOH A3915 52.636 24.108 3.443 1.00 0.00 H 0 +HETATM12068 H2 HOH A3915 53.458 24.166 2.126 1.00 0.00 H 0 +HETATM12069 O HOH A3916 19.856 43.378 41.139 1.00 0.00 O 0 +HETATM12070 H1 HOH A3916 19.941 43.117 42.094 1.00 0.00 H 0 +HETATM12071 H2 HOH A3916 20.716 43.103 40.839 1.00 0.00 H 0 +HETATM12072 O HOH A3917 20.074 51.327 47.683 1.00 0.00 O 0 +HETATM12073 H1 HOH A3917 19.400 51.037 48.281 1.00 0.00 H 0 +HETATM12074 H2 HOH A3917 20.930 51.508 48.090 1.00 0.00 H 0 +HETATM12075 O HOH A3918 3.482 3.781 46.221 1.00 0.00 O 0 +HETATM12076 H1 HOH A3918 2.532 3.572 46.495 1.00 0.00 H 0 +HETATM12077 H2 HOH A3918 4.018 3.780 47.034 1.00 0.00 H 0 +HETATM12078 O HOH A3919 41.912 9.480 25.363 1.00 0.00 O 0 +HETATM12079 H1 HOH A3919 41.326 8.985 25.875 1.00 0.00 H 0 +HETATM12080 H2 HOH A3919 42.441 8.947 24.729 1.00 0.00 H 0 +HETATM12081 O HOH A3920 2.776 3.479 31.415 1.00 0.00 O 0 +HETATM12082 H1 HOH A3920 1.931 3.707 31.089 1.00 0.00 H 0 +HETATM12083 H2 HOH A3920 2.972 4.158 31.991 1.00 0.00 H 0 +HETATM12084 O HOH A3921 27.483 5.253 35.327 1.00 0.00 O 0 +HETATM12085 H1 HOH A3921 27.199 4.970 36.224 1.00 0.00 H 0 +HETATM12086 H2 HOH A3921 28.343 5.586 35.475 1.00 0.00 H 0 +HETATM12087 O HOH A3922 7.973 13.223 47.025 1.00 0.00 O 0 +HETATM12088 H1 HOH A3922 7.176 13.699 47.417 1.00 0.00 H 0 +HETATM12089 H2 HOH A3922 8.463 13.976 46.680 1.00 0.00 H 0 +HETATM12090 O HOH A3923 52.705 12.944 18.556 1.00 0.00 O 0 +HETATM12091 H1 HOH A3923 52.678 11.880 18.601 1.00 0.00 H 0 +HETATM12092 H2 HOH A3923 51.987 13.351 19.105 1.00 0.00 H 0 +HETATM12093 O HOH A3924 47.241 30.352 26.687 1.00 0.00 O 0 +HETATM12094 H1 HOH A3924 46.343 30.148 26.508 1.00 0.00 H 0 +HETATM12095 H2 HOH A3924 47.696 29.594 26.265 1.00 0.00 H 0 +HETATM12096 O HOH A3925 24.465 46.770 35.603 1.00 0.00 O 0 +HETATM12097 H1 HOH A3925 24.960 47.654 35.703 1.00 0.00 H 0 +HETATM12098 H2 HOH A3925 23.660 46.997 36.039 1.00 0.00 H 0 +HETATM12099 O HOH A3926 25.261 1.682 1.804 1.00 0.00 O 0 +HETATM12100 H1 HOH A3926 24.550 2.315 2.037 1.00 0.00 H 0 +HETATM12101 H2 HOH A3926 25.888 1.841 2.504 1.00 0.00 H 0 +HETATM12102 O HOH A3927 27.888 35.920 41.192 1.00 0.00 O 0 +HETATM12103 H1 HOH A3927 28.437 36.125 42.022 1.00 0.00 H 0 +HETATM12104 H2 HOH A3927 28.411 35.889 40.435 1.00 0.00 H 0 +HETATM12105 O HOH A3928 46.437 3.420 31.515 1.00 0.00 O 0 +HETATM12106 H1 HOH A3928 46.207 4.244 31.104 1.00 0.00 H 0 +HETATM12107 H2 HOH A3928 47.371 3.440 31.894 1.00 0.00 H 0 +HETATM12108 O HOH A3929 1.982 34.409 20.876 1.00 0.00 O 0 +HETATM12109 H1 HOH A3929 2.354 33.683 20.393 1.00 0.00 H 0 +HETATM12110 H2 HOH A3929 1.091 34.492 20.514 1.00 0.00 H 0 +HETATM12111 O HOH A3930 18.963 9.457 53.472 1.00 0.00 O 0 +HETATM12112 H1 HOH A3930 19.077 9.321 52.511 1.00 0.00 H 0 +HETATM12113 H2 HOH A3930 19.929 9.562 53.769 1.00 0.00 H 0 +HETATM12114 O HOH A3931 5.582 32.934 38.383 1.00 0.00 O 0 +HETATM12115 H1 HOH A3931 5.268 32.225 37.896 1.00 0.00 H 0 +HETATM12116 H2 HOH A3931 5.912 33.483 37.672 1.00 0.00 H 0 +HETATM12117 O HOH A3932 7.765 19.904 3.714 1.00 0.00 O 0 +HETATM12118 H1 HOH A3932 8.064 20.838 3.633 1.00 0.00 H 0 +HETATM12119 H2 HOH A3932 7.777 19.762 4.663 1.00 0.00 H 0 +HETATM12120 O HOH A3933 23.182 27.831 17.997 1.00 0.00 O 0 +HETATM12121 H1 HOH A3933 23.940 27.988 17.369 1.00 0.00 H 0 +HETATM12122 H2 HOH A3933 23.297 28.335 18.813 1.00 0.00 H 0 +HETATM12123 O HOH A3934 52.520 52.404 17.875 1.00 0.00 O 0 +HETATM12124 H1 HOH A3934 52.935 51.980 18.643 1.00 0.00 H 0 +HETATM12125 H2 HOH A3934 53.043 53.121 17.641 1.00 0.00 H 0 +HETATM12126 O HOH A3935 14.688 36.379 22.267 1.00 0.00 O 0 +HETATM12127 H1 HOH A3935 14.710 36.904 21.487 1.00 0.00 H 0 +HETATM12128 H2 HOH A3935 15.151 35.550 22.043 1.00 0.00 H 0 +HETATM12129 O HOH A3936 32.944 3.388 32.038 1.00 0.00 O 0 +HETATM12130 H1 HOH A3936 33.938 3.464 32.102 1.00 0.00 H 0 +HETATM12131 H2 HOH A3936 32.648 3.375 32.967 1.00 0.00 H 0 +HETATM12132 O HOH A3937 36.138 0.380 24.272 1.00 0.00 O 0 +HETATM12133 H1 HOH A3937 35.799 0.320 25.180 1.00 0.00 H 0 +HETATM12134 H2 HOH A3937 35.758 1.174 23.846 1.00 0.00 H 0 +HETATM12135 O HOH A3938 24.374 53.250 4.949 1.00 0.00 O 0 +HETATM12136 H1 HOH A3938 24.593 52.410 5.311 1.00 0.00 H 0 +HETATM12137 H2 HOH A3938 23.451 53.242 4.672 1.00 0.00 H 0 +HETATM12138 O HOH A3939 7.477 21.627 29.038 1.00 0.00 O 0 +HETATM12139 H1 HOH A3939 7.322 22.453 28.462 1.00 0.00 H 0 +HETATM12140 H2 HOH A3939 8.397 21.415 29.005 1.00 0.00 H 0 +HETATM12141 O HOH A3940 41.919 34.960 31.815 1.00 0.00 O 0 +HETATM12142 H1 HOH A3940 42.455 34.205 31.585 1.00 0.00 H 0 +HETATM12143 H2 HOH A3940 42.554 35.549 32.098 1.00 0.00 H 0 +HETATM12144 O HOH A3941 47.704 47.877 41.338 1.00 0.00 O 0 +HETATM12145 H1 HOH A3941 47.507 46.949 41.380 1.00 0.00 H 0 +HETATM12146 H2 HOH A3941 47.850 48.121 42.262 1.00 0.00 H 0 +HETATM12147 O HOH A3942 44.761 50.973 6.560 1.00 0.00 O 0 +HETATM12148 H1 HOH A3942 44.362 50.185 6.911 1.00 0.00 H 0 +HETATM12149 H2 HOH A3942 44.958 51.705 7.155 1.00 0.00 H 0 +HETATM12150 O HOH A3943 19.618 29.678 0.955 1.00 0.00 O 0 +HETATM12151 H1 HOH A3943 19.842 28.772 1.206 1.00 0.00 H 0 +HETATM12152 H2 HOH A3943 19.130 29.631 0.132 1.00 0.00 H 0 +HETATM12153 O HOH A3944 50.408 0.379 4.991 1.00 0.00 O 0 +HETATM12154 H1 HOH A3944 50.798 -0.306 5.556 1.00 0.00 H 0 +HETATM12155 H2 HOH A3944 50.345 1.175 5.562 1.00 0.00 H 0 +HETATM12156 O HOH A3945 49.307 11.534 20.808 1.00 0.00 O 0 +HETATM12157 H1 HOH A3945 50.087 12.057 21.165 1.00 0.00 H 0 +HETATM12158 H2 HOH A3945 49.053 10.919 21.490 1.00 0.00 H 0 +HETATM12159 O HOH A3946 47.351 50.510 5.754 1.00 0.00 O 0 +HETATM12160 H1 HOH A3946 46.434 50.742 6.067 1.00 0.00 H 0 +HETATM12161 H2 HOH A3946 47.714 49.906 6.417 1.00 0.00 H 0 +HETATM12162 O HOH A3947 27.496 52.644 47.932 1.00 0.00 O 0 +HETATM12163 H1 HOH A3947 26.793 52.249 47.432 1.00 0.00 H 0 +HETATM12164 H2 HOH A3947 27.323 53.624 47.880 1.00 0.00 H 0 +HETATM12165 O HOH A3948 47.390 49.766 25.509 1.00 0.00 O 0 +HETATM12166 H1 HOH A3948 48.276 49.527 25.123 1.00 0.00 H 0 +HETATM12167 H2 HOH A3948 47.558 50.306 26.235 1.00 0.00 H 0 +HETATM12168 O HOH A3949 29.289 30.507 46.599 1.00 0.00 O 0 +HETATM12169 H1 HOH A3949 29.814 30.995 45.933 1.00 0.00 H 0 +HETATM12170 H2 HOH A3949 29.316 29.578 46.373 1.00 0.00 H 0 +HETATM12171 O HOH A3950 43.685 40.282 51.294 1.00 0.00 O 0 +HETATM12172 H1 HOH A3950 42.868 40.792 51.507 1.00 0.00 H 0 +HETATM12173 H2 HOH A3950 44.315 41.030 51.148 1.00 0.00 H 0 +HETATM12174 O HOH A3951 18.587 40.454 42.688 1.00 0.00 O 0 +HETATM12175 H1 HOH A3951 19.253 39.892 42.225 1.00 0.00 H 0 +HETATM12176 H2 HOH A3951 19.185 41.019 43.223 1.00 0.00 H 0 +HETATM12177 O HOH A3952 33.593 0.624 2.772 1.00 0.00 O 0 +HETATM12178 H1 HOH A3952 32.700 0.901 2.996 1.00 0.00 H 0 +HETATM12179 H2 HOH A3952 34.007 1.458 2.531 1.00 0.00 H 0 +HETATM12180 O HOH A3953 18.676 47.108 29.778 1.00 0.00 O 0 +HETATM12181 H1 HOH A3953 18.322 46.159 29.699 1.00 0.00 H 0 +HETATM12182 H2 HOH A3953 19.491 47.159 29.267 1.00 0.00 H 0 +HETATM12183 O HOH A3954 29.807 35.523 22.662 1.00 0.00 O 0 +HETATM12184 H1 HOH A3954 29.690 35.325 23.615 1.00 0.00 H 0 +HETATM12185 H2 HOH A3954 30.408 36.307 22.516 1.00 0.00 H 0 +HETATM12186 O HOH A3955 23.549 5.181 31.155 1.00 0.00 O 0 +HETATM12187 H1 HOH A3955 22.759 4.985 31.654 1.00 0.00 H 0 +HETATM12188 H2 HOH A3955 23.906 4.430 30.626 1.00 0.00 H 0 +HETATM12189 O HOH A3956 35.439 28.374 37.910 1.00 0.00 O 0 +HETATM12190 H1 HOH A3956 34.622 28.257 37.407 1.00 0.00 H 0 +HETATM12191 H2 HOH A3956 35.941 27.517 37.795 1.00 0.00 H 0 +HETATM12192 O HOH A3957 7.838 28.718 14.553 1.00 0.00 O 0 +HETATM12193 H1 HOH A3957 8.287 29.366 15.068 1.00 0.00 H 0 +HETATM12194 H2 HOH A3957 8.481 28.339 13.899 1.00 0.00 H 0 +HETATM12195 O HOH A3958 28.123 43.485 48.017 1.00 0.00 O 0 +HETATM12196 H1 HOH A3958 28.339 44.235 48.542 1.00 0.00 H 0 +HETATM12197 H2 HOH A3958 28.291 43.729 47.054 1.00 0.00 H 0 +HETATM12198 O HOH A3959 3.334 37.700 40.966 1.00 0.00 O 0 +HETATM12199 H1 HOH A3959 2.651 37.042 40.996 1.00 0.00 H 0 +HETATM12200 H2 HOH A3959 2.855 38.499 40.780 1.00 0.00 H 0 +HETATM12201 O HOH A3960 10.653 6.895 17.615 1.00 0.00 O 0 +HETATM12202 H1 HOH A3960 10.098 6.149 17.268 1.00 0.00 H 0 +HETATM12203 H2 HOH A3960 10.838 6.637 18.510 1.00 0.00 H 0 +HETATM12204 O HOH A3961 16.526 25.129 7.669 1.00 0.00 O 0 +HETATM12205 H1 HOH A3961 16.601 24.145 7.414 1.00 0.00 H 0 +HETATM12206 H2 HOH A3961 17.019 25.756 7.110 1.00 0.00 H 0 +HETATM12207 O HOH A3962 12.592 11.525 44.976 1.00 0.00 O 0 +HETATM12208 H1 HOH A3962 12.608 12.256 45.604 1.00 0.00 H 0 +HETATM12209 H2 HOH A3962 13.478 11.290 44.819 1.00 0.00 H 0 +HETATM12210 O HOH A3963 0.889 5.163 2.481 1.00 0.00 O 0 +HETATM12211 H1 HOH A3963 1.715 5.397 1.980 1.00 0.00 H 0 +HETATM12212 H2 HOH A3963 0.466 6.031 2.721 1.00 0.00 H 0 +HETATM12213 O HOH A3964 13.176 43.141 26.323 1.00 0.00 O 0 +HETATM12214 H1 HOH A3964 14.001 43.221 26.875 1.00 0.00 H 0 +HETATM12215 H2 HOH A3964 12.559 42.711 26.909 1.00 0.00 H 0 +HETATM12216 O HOH A3965 12.550 49.171 52.836 1.00 0.00 O 0 +HETATM12217 H1 HOH A3965 12.233 49.335 53.712 1.00 0.00 H 0 +HETATM12218 H2 HOH A3965 12.427 48.212 52.589 1.00 0.00 H 0 +HETATM12219 O HOH A3966 1.702 3.426 41.865 1.00 0.00 O 0 +HETATM12220 H1 HOH A3966 2.360 3.278 42.595 1.00 0.00 H 0 +HETATM12221 H2 HOH A3966 2.250 3.965 41.227 1.00 0.00 H 0 +HETATM12222 O HOH A3967 5.770 17.562 35.712 1.00 0.00 O 0 +HETATM12223 H1 HOH A3967 5.673 18.513 35.590 1.00 0.00 H 0 +HETATM12224 H2 HOH A3967 5.417 17.305 36.493 1.00 0.00 H 0 +HETATM12225 O HOH A3968 44.759 17.339 51.633 1.00 0.00 O 0 +HETATM12226 H1 HOH A3968 44.170 16.605 51.643 1.00 0.00 H 0 +HETATM12227 H2 HOH A3968 45.610 17.050 52.098 1.00 0.00 H 0 +HETATM12228 O HOH A3969 8.281 2.947 23.523 1.00 0.00 O 0 +HETATM12229 H1 HOH A3969 8.347 2.006 23.308 1.00 0.00 H 0 +HETATM12230 H2 HOH A3969 7.990 3.316 22.706 1.00 0.00 H 0 +HETATM12231 O HOH A3970 32.528 27.572 2.826 1.00 0.00 O 0 +HETATM12232 H1 HOH A3970 32.327 28.448 2.438 1.00 0.00 H 0 +HETATM12233 H2 HOH A3970 32.812 27.686 3.783 1.00 0.00 H 0 +HETATM12234 O HOH A3971 26.437 42.543 18.588 1.00 0.00 O 0 +HETATM12235 H1 HOH A3971 27.124 41.964 18.228 1.00 0.00 H 0 +HETATM12236 H2 HOH A3971 26.697 42.614 19.484 1.00 0.00 H 0 +HETATM12237 O HOH A3972 16.912 21.018 0.378 1.00 0.00 O 0 +HETATM12238 H1 HOH A3972 15.908 20.889 0.589 1.00 0.00 H 0 +HETATM12239 H2 HOH A3972 17.442 20.514 1.019 1.00 0.00 H 0 +HETATM12240 O HOH A3973 52.189 40.657 49.675 1.00 0.00 O 0 +HETATM12241 H1 HOH A3973 52.455 41.366 49.048 1.00 0.00 H 0 +HETATM12242 H2 HOH A3973 51.899 41.187 50.460 1.00 0.00 H 0 +HETATM12243 O HOH A3974 42.194 29.104 51.647 1.00 0.00 O 0 +HETATM12244 H1 HOH A3974 42.844 28.407 51.412 1.00 0.00 H 0 +HETATM12245 H2 HOH A3974 42.546 29.910 51.454 1.00 0.00 H 0 +HETATM12246 O HOH A3975 50.312 7.435 42.053 1.00 0.00 O 0 +HETATM12247 H1 HOH A3975 50.419 8.299 41.717 1.00 0.00 H 0 +HETATM12248 H2 HOH A3975 49.408 7.353 42.429 1.00 0.00 H 0 +HETATM12249 O HOH A3976 24.696 1.025 27.777 1.00 0.00 O 0 +HETATM12250 H1 HOH A3976 25.411 1.212 27.101 1.00 0.00 H 0 +HETATM12251 H2 HOH A3976 24.006 0.719 27.240 1.00 0.00 H 0 +HETATM12252 O HOH A3977 3.399 6.939 52.610 1.00 0.00 O 0 +HETATM12253 H1 HOH A3977 3.320 7.811 53.028 1.00 0.00 H 0 +HETATM12254 H2 HOH A3977 2.993 6.933 51.764 1.00 0.00 H 0 +HETATM12255 O HOH A3978 4.185 51.811 35.037 1.00 0.00 O 0 +HETATM12256 H1 HOH A3978 4.722 51.895 35.823 1.00 0.00 H 0 +HETATM12257 H2 HOH A3978 3.911 52.658 34.916 1.00 0.00 H 0 +HETATM12258 O HOH A3979 16.294 22.727 37.658 1.00 0.00 O 0 +HETATM12259 H1 HOH A3979 15.622 23.395 37.542 1.00 0.00 H 0 +HETATM12260 H2 HOH A3979 17.125 23.061 37.952 1.00 0.00 H 0 +HETATM12261 O HOH A3980 30.449 33.361 15.163 1.00 0.00 O 0 +HETATM12262 H1 HOH A3980 29.886 33.144 14.408 1.00 0.00 H 0 +HETATM12263 H2 HOH A3980 30.000 32.988 15.906 1.00 0.00 H 0 +HETATM12264 O HOH A3981 51.795 30.507 35.852 1.00 0.00 O 0 +HETATM12265 H1 HOH A3981 52.507 30.060 36.355 1.00 0.00 H 0 +HETATM12266 H2 HOH A3981 51.910 31.466 35.972 1.00 0.00 H 0 +HETATM12267 O HOH A3982 32.195 5.900 46.469 1.00 0.00 O 0 +HETATM12268 H1 HOH A3982 32.452 4.999 46.791 1.00 0.00 H 0 +HETATM12269 H2 HOH A3982 32.107 6.500 47.221 1.00 0.00 H 0 +HETATM12270 O HOH A3983 31.441 40.612 2.673 1.00 0.00 O 0 +HETATM12271 H1 HOH A3983 31.687 39.677 2.576 1.00 0.00 H 0 +HETATM12272 H2 HOH A3983 32.362 40.987 2.895 1.00 0.00 H 0 +HETATM12273 O HOH A3984 28.793 50.409 15.729 1.00 0.00 O 0 +HETATM12274 H1 HOH A3984 28.964 51.218 16.304 1.00 0.00 H 0 +HETATM12275 H2 HOH A3984 28.254 49.780 16.295 1.00 0.00 H 0 +HETATM12276 O HOH A3985 49.802 29.989 10.689 1.00 0.00 O 0 +HETATM12277 H1 HOH A3985 49.716 29.398 11.484 1.00 0.00 H 0 +HETATM12278 H2 HOH A3985 49.010 30.461 10.664 1.00 0.00 H 0 +HETATM12279 O HOH A3986 48.283 36.454 8.928 1.00 0.00 O 0 +HETATM12280 H1 HOH A3986 47.447 35.912 8.648 1.00 0.00 H 0 +HETATM12281 H2 HOH A3986 48.879 35.833 9.422 1.00 0.00 H 0 +HETATM12282 O HOH A3987 2.323 51.501 18.322 1.00 0.00 O 0 +HETATM12283 H1 HOH A3987 2.839 51.067 18.969 1.00 0.00 H 0 +HETATM12284 H2 HOH A3987 1.728 52.206 18.720 1.00 0.00 H 0 +HETATM12285 O HOH A3988 32.851 6.415 43.870 1.00 0.00 O 0 +HETATM12286 H1 HOH A3988 31.919 6.792 43.924 1.00 0.00 H 0 +HETATM12287 H2 HOH A3988 33.147 6.303 44.840 1.00 0.00 H 0 +HETATM12288 O HOH A3989 9.229 3.280 45.997 1.00 0.00 O 0 +HETATM12289 H1 HOH A3989 8.817 3.349 46.841 1.00 0.00 H 0 +HETATM12290 H2 HOH A3989 10.037 3.695 46.239 1.00 0.00 H 0 +HETATM12291 O HOH A3990 6.536 40.659 17.410 1.00 0.00 O 0 +HETATM12292 H1 HOH A3990 6.376 40.251 16.471 1.00 0.00 H 0 +HETATM12293 H2 HOH A3990 5.646 40.816 17.739 1.00 0.00 H 0 +HETATM12294 O HOH A3991 38.961 53.639 44.424 1.00 0.00 O 0 +HETATM12295 H1 HOH A3991 39.717 54.019 44.900 1.00 0.00 H 0 +HETATM12296 H2 HOH A3991 38.814 52.742 44.825 1.00 0.00 H 0 +HETATM12297 O HOH A3992 49.666 34.892 32.837 1.00 0.00 O 0 +HETATM12298 H1 HOH A3992 49.251 34.447 33.579 1.00 0.00 H 0 +HETATM12299 H2 HOH A3992 50.580 34.838 32.943 1.00 0.00 H 0 +HETATM12300 O HOH A3993 33.793 42.473 3.475 1.00 0.00 O 0 +HETATM12301 H1 HOH A3993 33.707 42.295 4.417 1.00 0.00 H 0 +HETATM12302 H2 HOH A3993 33.366 43.309 3.195 1.00 0.00 H 0 +HETATM12303 O HOH A3994 37.999 51.377 49.201 1.00 0.00 O 0 +HETATM12304 H1 HOH A3994 38.712 51.990 49.428 1.00 0.00 H 0 +HETATM12305 H2 HOH A3994 37.685 50.947 49.965 1.00 0.00 H 0 +HETATM12306 O HOH A3995 9.518 49.471 49.371 1.00 0.00 O 0 +HETATM12307 H1 HOH A3995 9.979 48.564 49.115 1.00 0.00 H 0 +HETATM12308 H2 HOH A3995 9.035 49.707 48.589 1.00 0.00 H 0 +HETATM12309 O HOH A3996 49.017 30.070 46.913 1.00 0.00 O 0 +HETATM12310 H1 HOH A3996 49.738 29.482 46.611 1.00 0.00 H 0 +HETATM12311 H2 HOH A3996 49.306 30.984 46.851 1.00 0.00 H 0 +HETATM12312 O HOH A3997 49.947 20.431 40.817 1.00 0.00 O 0 +HETATM12313 H1 HOH A3997 50.726 20.048 41.187 1.00 0.00 H 0 +HETATM12314 H2 HOH A3997 50.211 21.275 40.364 1.00 0.00 H 0 +HETATM12315 O HOH A3998 22.672 40.507 12.133 1.00 0.00 O 0 +HETATM12316 H1 HOH A3998 22.224 39.870 12.639 1.00 0.00 H 0 +HETATM12317 H2 HOH A3998 22.304 40.374 11.229 1.00 0.00 H 0 +HETATM12318 O HOH A3999 13.453 17.215 37.089 1.00 0.00 O 0 +HETATM12319 H1 HOH A3999 13.745 16.478 37.699 1.00 0.00 H 0 +HETATM12320 H2 HOH A3999 14.236 17.766 36.970 1.00 0.00 H 0 +HETATM12321 O HOH A4000 24.783 46.448 1.010 1.00 0.00 O 0 +HETATM12322 H1 HOH A4000 25.217 47.043 0.368 1.00 0.00 H 0 +HETATM12323 H2 HOH A4000 25.450 46.014 1.492 1.00 0.00 H 0 +HETATM12324 O HOH A4001 19.424 43.925 46.220 1.00 0.00 O 0 +HETATM12325 H1 HOH A4001 18.500 44.082 46.227 1.00 0.00 H 0 +HETATM12326 H2 HOH A4001 19.454 43.345 47.012 1.00 0.00 H 0 +HETATM12327 O HOH A4002 1.375 45.330 8.822 1.00 0.00 O 0 +HETATM12328 H1 HOH A4002 1.004 44.560 8.380 1.00 0.00 H 0 +HETATM12329 H2 HOH A4002 2.285 44.936 8.922 1.00 0.00 H 0 +HETATM12330 O HOH A4003 28.938 18.536 37.158 1.00 0.00 O 0 +HETATM12331 H1 HOH A4003 29.973 18.701 37.128 1.00 0.00 H 0 +HETATM12332 H2 HOH A4003 28.680 18.355 38.103 1.00 0.00 H 0 +HETATM12333 O HOH A4004 22.399 41.322 1.162 1.00 0.00 O 0 +HETATM12334 H1 HOH A4004 23.261 41.154 1.644 1.00 0.00 H 0 +HETATM12335 H2 HOH A4004 21.721 40.644 1.441 1.00 0.00 H 0 +HETATM12336 O HOH A4005 49.731 43.740 19.478 1.00 0.00 O 0 +HETATM12337 H1 HOH A4005 49.903 43.144 18.772 1.00 0.00 H 0 +HETATM12338 H2 HOH A4005 49.061 44.275 19.074 1.00 0.00 H 0 +HETATM12339 O HOH A4006 42.434 10.057 43.285 1.00 0.00 O 0 +HETATM12340 H1 HOH A4006 42.485 9.613 42.438 1.00 0.00 H 0 +HETATM12341 H2 HOH A4006 41.620 9.729 43.784 1.00 0.00 H 0 +HETATM12342 O HOH A4007 42.119 5.775 5.355 1.00 0.00 O 0 +HETATM12343 H1 HOH A4007 41.517 5.012 5.578 1.00 0.00 H 0 +HETATM12344 H2 HOH A4007 41.625 6.283 4.647 1.00 0.00 H 0 +HETATM12345 O HOH A4008 38.468 36.607 22.126 1.00 0.00 O 0 +HETATM12346 H1 HOH A4008 38.769 36.480 21.214 1.00 0.00 H 0 +HETATM12347 H2 HOH A4008 39.294 36.402 22.623 1.00 0.00 H 0 +HETATM12348 O HOH A4009 42.441 43.114 12.437 1.00 0.00 O 0 +HETATM12349 H1 HOH A4009 43.436 43.258 12.393 1.00 0.00 H 0 +HETATM12350 H2 HOH A4009 42.226 43.408 13.337 1.00 0.00 H 0 +HETATM12351 O HOH A4010 38.549 3.206 40.511 1.00 0.00 O 0 +HETATM12352 H1 HOH A4010 37.673 2.956 40.789 1.00 0.00 H 0 +HETATM12353 H2 HOH A4010 38.636 2.784 39.687 1.00 0.00 H 0 +HETATM12354 O HOH A4011 39.639 33.249 34.824 1.00 0.00 O 0 +HETATM12355 H1 HOH A4011 39.164 32.417 34.877 1.00 0.00 H 0 +HETATM12356 H2 HOH A4011 39.481 33.639 33.976 1.00 0.00 H 0 +HETATM12357 O HOH A4012 50.517 40.171 53.427 1.00 0.00 O 0 +HETATM12358 H1 HOH A4012 50.778 40.926 52.802 1.00 0.00 H 0 +HETATM12359 H2 HOH A4012 51.217 40.179 54.035 1.00 0.00 H 0 +HETATM12360 O HOH A4013 10.130 20.125 18.649 1.00 0.00 O 0 +HETATM12361 H1 HOH A4013 9.893 20.811 19.237 1.00 0.00 H 0 +HETATM12362 H2 HOH A4013 10.175 19.275 19.206 1.00 0.00 H 0 +HETATM12363 O HOH A4014 37.264 48.620 22.123 1.00 0.00 O 0 +HETATM12364 H1 HOH A4014 37.404 49.386 22.646 1.00 0.00 H 0 +HETATM12365 H2 HOH A4014 36.319 48.392 22.243 1.00 0.00 H 0 +HETATM12366 O HOH A4015 12.421 30.194 51.515 1.00 0.00 O 0 +HETATM12367 H1 HOH A4015 13.062 29.587 51.946 1.00 0.00 H 0 +HETATM12368 H2 HOH A4015 12.725 31.097 51.832 1.00 0.00 H 0 +HETATM12369 O HOH A4016 52.336 30.577 9.501 1.00 0.00 O 0 +HETATM12370 H1 HOH A4016 52.524 31.352 8.897 1.00 0.00 H 0 +HETATM12371 H2 HOH A4016 51.558 30.835 10.057 1.00 0.00 H 0 +HETATM12372 O HOH A4017 10.122 34.974 28.256 1.00 0.00 O 0 +HETATM12373 H1 HOH A4017 9.475 35.690 28.206 1.00 0.00 H 0 +HETATM12374 H2 HOH A4017 10.072 34.461 27.395 1.00 0.00 H 0 +HETATM12375 O HOH A4018 6.713 34.693 25.478 1.00 0.00 O 0 +HETATM12376 H1 HOH A4018 7.631 34.356 25.704 1.00 0.00 H 0 +HETATM12377 H2 HOH A4018 6.857 35.668 25.359 1.00 0.00 H 0 +HETATM12378 O HOH A4019 37.411 17.075 49.908 1.00 0.00 O 0 +HETATM12379 H1 HOH A4019 37.592 16.173 50.225 1.00 0.00 H 0 +HETATM12380 H2 HOH A4019 36.585 17.435 50.402 1.00 0.00 H 0 +HETATM12381 O HOH A4020 27.777 12.376 5.859 1.00 0.00 O 0 +HETATM12382 H1 HOH A4020 28.743 12.435 6.064 1.00 0.00 H 0 +HETATM12383 H2 HOH A4020 27.369 12.366 6.756 1.00 0.00 H 0 +HETATM12384 O HOH A4021 0.904 52.723 43.449 1.00 0.00 O 0 +HETATM12385 H1 HOH A4021 0.396 53.083 44.189 1.00 0.00 H 0 +HETATM12386 H2 HOH A4021 0.314 52.168 42.963 1.00 0.00 H 0 +HETATM12387 O HOH A4022 51.269 25.169 0.698 1.00 0.00 O 0 +HETATM12388 H1 HOH A4022 51.754 24.790 1.500 1.00 0.00 H 0 +HETATM12389 H2 HOH A4022 51.004 24.367 0.229 1.00 0.00 H 0 +HETATM12390 O HOH A4023 47.229 52.612 51.394 1.00 0.00 O 0 +HETATM12391 H1 HOH A4023 47.485 52.337 52.268 1.00 0.00 H 0 +HETATM12392 H2 HOH A4023 47.501 53.527 51.411 1.00 0.00 H 0 +HETATM12393 O HOH A4024 38.001 23.879 42.558 1.00 0.00 O 0 +HETATM12394 H1 HOH A4024 37.297 24.553 42.490 1.00 0.00 H 0 +HETATM12395 H2 HOH A4024 37.623 23.280 41.938 1.00 0.00 H 0 +HETATM12396 O HOH A4025 0.238 28.947 47.697 1.00 0.00 O 0 +HETATM12397 H1 HOH A4025 -0.181 28.295 47.106 1.00 0.00 H 0 +HETATM12398 H2 HOH A4025 0.099 29.759 47.234 1.00 0.00 H 0 +HETATM12399 O HOH A4026 24.981 5.284 41.366 1.00 0.00 O 0 +HETATM12400 H1 HOH A4026 24.034 5.137 41.047 1.00 0.00 H 0 +HETATM12401 H2 HOH A4026 25.002 6.071 41.936 1.00 0.00 H 0 +HETATM12402 O HOH A4027 49.345 9.564 1.162 1.00 0.00 O 0 +HETATM12403 H1 HOH A4027 48.564 10.003 1.405 1.00 0.00 H 0 +HETATM12404 H2 HOH A4027 49.344 9.750 0.226 1.00 0.00 H 0 +HETATM12405 O HOH A4028 16.188 22.426 6.479 1.00 0.00 O 0 +HETATM12406 H1 HOH A4028 16.566 21.863 5.871 1.00 0.00 H 0 +HETATM12407 H2 HOH A4028 15.310 22.208 6.349 1.00 0.00 H 0 +HETATM12408 O HOH A4029 20.315 29.334 9.922 1.00 0.00 O 0 +HETATM12409 H1 HOH A4029 20.882 29.921 10.482 1.00 0.00 H 0 +HETATM12410 H2 HOH A4029 19.471 29.601 10.162 1.00 0.00 H 0 +HETATM12411 O HOH A4030 23.562 31.845 7.161 1.00 0.00 O 0 +HETATM12412 H1 HOH A4030 23.743 31.732 8.133 1.00 0.00 H 0 +HETATM12413 H2 HOH A4030 24.093 32.578 6.855 1.00 0.00 H 0 +HETATM12414 O HOH A4031 33.063 48.322 30.440 1.00 0.00 O 0 +HETATM12415 H1 HOH A4031 32.678 47.467 30.662 1.00 0.00 H 0 +HETATM12416 H2 HOH A4031 32.405 48.928 30.561 1.00 0.00 H 0 +HETATM12417 O HOH A4032 50.550 26.701 16.865 1.00 0.00 O 0 +HETATM12418 H1 HOH A4032 50.028 27.516 16.722 1.00 0.00 H 0 +HETATM12419 H2 HOH A4032 50.370 26.118 16.169 1.00 0.00 H 0 +HETATM12420 O HOH A4033 28.670 52.375 6.104 1.00 0.00 O 0 +HETATM12421 H1 HOH A4033 28.770 53.276 6.347 1.00 0.00 H 0 +HETATM12422 H2 HOH A4033 29.079 52.219 5.245 1.00 0.00 H 0 +HETATM12423 O HOH A4034 25.988 15.235 13.136 1.00 0.00 O 0 +HETATM12424 H1 HOH A4034 25.960 16.173 13.623 1.00 0.00 H 0 +HETATM12425 H2 HOH A4034 25.416 14.616 13.631 1.00 0.00 H 0 +HETATM12426 O HOH A4035 52.881 32.833 39.873 1.00 0.00 O 0 +HETATM12427 H1 HOH A4035 51.924 33.069 39.960 1.00 0.00 H 0 +HETATM12428 H2 HOH A4035 52.981 31.902 39.634 1.00 0.00 H 0 +HETATM12429 O HOH A4036 3.417 2.691 43.791 1.00 0.00 O 0 +HETATM12430 H1 HOH A4036 3.492 2.971 44.657 1.00 0.00 H 0 +HETATM12431 H2 HOH A4036 3.301 1.745 43.584 1.00 0.00 H 0 +HETATM12432 O HOH A4037 32.392 0.648 23.663 1.00 0.00 O 0 +HETATM12433 H1 HOH A4037 32.460 0.783 24.585 1.00 0.00 H 0 +HETATM12434 H2 HOH A4037 32.824 -0.247 23.571 1.00 0.00 H 0 +HETATM12435 O HOH A4038 45.283 8.054 17.925 1.00 0.00 O 0 +HETATM12436 H1 HOH A4038 46.053 8.641 18.172 1.00 0.00 H 0 +HETATM12437 H2 HOH A4038 45.142 8.196 16.948 1.00 0.00 H 0 +HETATM12438 O HOH A4039 13.768 41.024 0.524 1.00 0.00 O 0 +HETATM12439 H1 HOH A4039 13.875 40.689 -0.372 1.00 0.00 H 0 +HETATM12440 H2 HOH A4039 14.344 41.775 0.593 1.00 0.00 H 0 +HETATM12441 O HOH A4040 44.402 3.364 14.197 1.00 0.00 O 0 +HETATM12442 H1 HOH A4040 45.320 3.329 14.549 1.00 0.00 H 0 +HETATM12443 H2 HOH A4040 44.407 3.493 13.242 1.00 0.00 H 0 +HETATM12444 O HOH A4041 30.483 31.563 4.810 1.00 0.00 O 0 +HETATM12445 H1 HOH A4041 30.460 32.177 4.095 1.00 0.00 H 0 +HETATM12446 H2 HOH A4041 29.826 30.852 4.661 1.00 0.00 H 0 +HETATM12447 O HOH A4042 13.080 1.399 53.414 1.00 0.00 O 0 +HETATM12448 H1 HOH A4042 12.285 1.376 53.920 1.00 0.00 H 0 +HETATM12449 H2 HOH A4042 12.830 1.415 52.504 1.00 0.00 H 0 +HETATM12450 O HOH A4043 3.628 34.336 0.247 1.00 0.00 O 0 +HETATM12451 H1 HOH A4043 2.924 34.153 -0.404 1.00 0.00 H 0 +HETATM12452 H2 HOH A4043 3.894 33.504 0.638 1.00 0.00 H 0 +HETATM12453 O HOH A4044 37.696 18.788 39.107 1.00 0.00 O 0 +HETATM12454 H1 HOH A4044 37.655 17.871 39.378 1.00 0.00 H 0 +HETATM12455 H2 HOH A4044 36.750 19.085 39.330 1.00 0.00 H 0 +HETATM12456 O HOH A4045 4.200 1.788 3.796 1.00 0.00 O 0 +HETATM12457 H1 HOH A4045 3.742 1.642 4.615 1.00 0.00 H 0 +HETATM12458 H2 HOH A4045 3.532 1.927 3.095 1.00 0.00 H 0 +HETATM12459 O HOH A4046 25.155 4.840 12.668 1.00 0.00 O 0 +HETATM12460 H1 HOH A4046 24.659 4.340 12.029 1.00 0.00 H 0 +HETATM12461 H2 HOH A4046 24.521 5.116 13.360 1.00 0.00 H 0 +HETATM12462 O HOH A4047 53.740 12.885 2.848 1.00 0.00 O 0 +HETATM12463 H1 HOH A4047 53.240 13.341 3.592 1.00 0.00 H 0 +HETATM12464 H2 HOH A4047 53.610 11.934 3.069 1.00 0.00 H 0 +HETATM12465 O HOH A4048 4.488 45.029 13.521 1.00 0.00 O 0 +HETATM12466 H1 HOH A4048 3.572 45.373 13.534 1.00 0.00 H 0 +HETATM12467 H2 HOH A4048 4.260 44.113 13.247 1.00 0.00 H 0 +HETATM12468 O HOH A4049 1.776 23.315 29.124 1.00 0.00 O 0 +HETATM12469 H1 HOH A4049 2.162 23.623 28.337 1.00 0.00 H 0 +HETATM12470 H2 HOH A4049 1.161 22.633 28.810 1.00 0.00 H 0 +HETATM12471 O HOH A4050 53.658 16.549 32.137 1.00 0.00 O 0 +HETATM12472 H1 HOH A4050 53.328 16.579 31.174 1.00 0.00 H 0 +HETATM12473 H2 HOH A4050 53.455 17.363 32.547 1.00 0.00 H 0 +HETATM12474 O HOH A4051 14.233 43.358 36.315 1.00 0.00 O 0 +HETATM12475 H1 HOH A4051 15.219 43.208 36.373 1.00 0.00 H 0 +HETATM12476 H2 HOH A4051 13.844 42.503 36.410 1.00 0.00 H 0 +HETATM12477 O HOH A4052 5.267 36.401 53.117 1.00 0.00 O 0 +HETATM12478 H1 HOH A4052 5.987 36.091 52.520 1.00 0.00 H 0 +HETATM12479 H2 HOH A4052 4.884 35.577 53.369 1.00 0.00 H 0 +HETATM12480 O HOH A4053 38.520 6.544 24.837 1.00 0.00 O 0 +HETATM12481 H1 HOH A4053 37.799 7.002 25.327 1.00 0.00 H 0 +HETATM12482 H2 HOH A4053 38.107 5.716 24.441 1.00 0.00 H 0 +HETATM12483 O HOH A4054 8.671 31.495 51.100 1.00 0.00 O 0 +HETATM12484 H1 HOH A4054 9.078 31.517 50.193 1.00 0.00 H 0 +HETATM12485 H2 HOH A4054 9.271 32.133 51.459 1.00 0.00 H 0 +HETATM12486 O HOH A4055 10.609 31.496 12.141 1.00 0.00 O 0 +HETATM12487 H1 HOH A4055 10.139 32.429 12.188 1.00 0.00 H 0 +HETATM12488 H2 HOH A4055 11.407 31.555 11.566 1.00 0.00 H 0 +HETATM12489 O HOH A4056 45.522 27.038 43.193 1.00 0.00 O 0 +HETATM12490 H1 HOH A4056 45.537 27.524 43.997 1.00 0.00 H 0 +HETATM12491 H2 HOH A4056 45.862 26.173 43.419 1.00 0.00 H 0 +HETATM12492 O HOH A4057 19.283 46.193 35.168 1.00 0.00 O 0 +HETATM12493 H1 HOH A4057 19.495 45.876 36.053 1.00 0.00 H 0 +HETATM12494 H2 HOH A4057 18.697 46.936 35.224 1.00 0.00 H 0 +HETATM12495 O HOH A4058 40.656 3.545 20.058 1.00 0.00 O 0 +HETATM12496 H1 HOH A4058 40.534 4.111 20.775 1.00 0.00 H 0 +HETATM12497 H2 HOH A4058 41.613 3.365 19.934 1.00 0.00 H 0 +HETATM12498 O HOH A4059 7.167 38.103 17.962 1.00 0.00 O 0 +HETATM12499 H1 HOH A4059 7.634 37.957 18.845 1.00 0.00 H 0 +HETATM12500 H2 HOH A4059 6.835 38.989 18.066 1.00 0.00 H 0 +HETATM12501 O HOH A4060 48.894 40.670 5.821 1.00 0.00 O 0 +HETATM12502 H1 HOH A4060 47.898 40.706 5.689 1.00 0.00 H 0 +HETATM12503 H2 HOH A4060 49.067 39.775 6.068 1.00 0.00 H 0 +HETATM12504 O HOH A4061 29.506 3.404 8.164 1.00 0.00 O 0 +HETATM12505 H1 HOH A4061 28.743 3.068 8.641 1.00 0.00 H 0 +HETATM12506 H2 HOH A4061 29.220 3.942 7.434 1.00 0.00 H 0 +HETATM12507 O HOH A4062 44.056 18.241 2.433 1.00 0.00 O 0 +HETATM12508 H1 HOH A4062 43.214 18.375 2.031 1.00 0.00 H 0 +HETATM12509 H2 HOH A4062 43.900 18.521 3.357 1.00 0.00 H 0 +HETATM12510 O HOH A4063 4.481 2.814 29.125 1.00 0.00 O 0 +HETATM12511 H1 HOH A4063 4.018 3.113 29.929 1.00 0.00 H 0 +HETATM12512 H2 HOH A4063 4.936 3.544 28.758 1.00 0.00 H 0 +HETATM12513 O HOH A4064 11.396 50.429 19.298 1.00 0.00 O 0 +HETATM12514 H1 HOH A4064 11.706 49.523 19.508 1.00 0.00 H 0 +HETATM12515 H2 HOH A4064 11.199 50.454 18.400 1.00 0.00 H 0 +HETATM12516 O HOH A4065 26.506 41.870 29.355 1.00 0.00 O 0 +HETATM12517 H1 HOH A4065 26.439 42.812 29.214 1.00 0.00 H 0 +HETATM12518 H2 HOH A4065 25.921 41.797 30.227 1.00 0.00 H 0 +HETATM12519 O HOH A4066 24.431 26.740 45.540 1.00 0.00 O 0 +HETATM12520 H1 HOH A4066 24.922 25.994 45.210 1.00 0.00 H 0 +HETATM12521 H2 HOH A4066 24.186 26.453 46.439 1.00 0.00 H 0 +HETATM12522 O HOH A4067 15.035 2.673 39.884 1.00 0.00 O 0 +HETATM12523 H1 HOH A4067 15.562 1.875 39.725 1.00 0.00 H 0 +HETATM12524 H2 HOH A4067 14.996 2.769 40.810 1.00 0.00 H 0 +HETATM12525 O HOH A4068 27.325 9.692 22.650 1.00 0.00 O 0 +HETATM12526 H1 HOH A4068 27.499 9.525 23.547 1.00 0.00 H 0 +HETATM12527 H2 HOH A4068 27.118 8.843 22.279 1.00 0.00 H 0 +HETATM12528 O HOH A4069 45.434 43.691 3.435 1.00 0.00 O 0 +HETATM12529 H1 HOH A4069 46.133 43.069 3.537 1.00 0.00 H 0 +HETATM12530 H2 HOH A4069 44.898 43.385 2.664 1.00 0.00 H 0 +HETATM12531 O HOH A4070 35.971 16.624 31.788 1.00 0.00 O 0 +HETATM12532 H1 HOH A4070 36.316 16.969 30.962 1.00 0.00 H 0 +HETATM12533 H2 HOH A4070 35.547 17.252 32.334 1.00 0.00 H 0 +HETATM12534 O HOH A4071 42.419 21.601 45.301 1.00 0.00 O 0 +HETATM12535 H1 HOH A4071 42.543 21.822 46.155 1.00 0.00 H 0 +HETATM12536 H2 HOH A4071 42.788 22.381 44.824 1.00 0.00 H 0 +HETATM12537 O HOH A4072 36.088 12.693 1.572 1.00 0.00 O 0 +HETATM12538 H1 HOH A4072 36.640 12.292 0.850 1.00 0.00 H 0 +HETATM12539 H2 HOH A4072 36.682 13.359 1.973 1.00 0.00 H 0 +HETATM12540 O HOH A4073 51.807 48.721 48.059 1.00 0.00 O 0 +HETATM12541 H1 HOH A4073 51.391 49.423 48.555 1.00 0.00 H 0 +HETATM12542 H2 HOH A4073 50.993 48.358 47.613 1.00 0.00 H 0 +HETATM12543 O HOH A4074 3.836 46.212 50.102 1.00 0.00 O 0 +HETATM12544 H1 HOH A4074 4.237 45.619 49.485 1.00 0.00 H 0 +HETATM12545 H2 HOH A4074 4.565 46.864 50.451 1.00 0.00 H 0 +HETATM12546 O HOH A4075 19.454 2.795 49.773 1.00 0.00 O 0 +HETATM12547 H1 HOH A4075 18.874 1.992 49.723 1.00 0.00 H 0 +HETATM12548 H2 HOH A4075 18.960 3.449 49.249 1.00 0.00 H 0 +HETATM12549 O HOH A4076 49.579 13.177 16.682 1.00 0.00 O 0 +HETATM12550 H1 HOH A4076 49.320 12.268 16.559 1.00 0.00 H 0 +HETATM12551 H2 HOH A4076 50.015 13.245 17.557 1.00 0.00 H 0 +HETATM12552 O HOH A4077 4.951 48.943 3.669 1.00 0.00 O 0 +HETATM12553 H1 HOH A4077 5.603 49.695 3.600 1.00 0.00 H 0 +HETATM12554 H2 HOH A4077 5.337 48.091 3.378 1.00 0.00 H 0 +HETATM12555 O HOH A4078 47.420 26.831 39.504 1.00 0.00 O 0 +HETATM12556 H1 HOH A4078 47.605 25.953 39.846 1.00 0.00 H 0 +HETATM12557 H2 HOH A4078 46.502 26.951 39.897 1.00 0.00 H 0 +HETATM12558 O HOH A4079 29.797 0.592 35.874 1.00 0.00 O 0 +HETATM12559 H1 HOH A4079 29.438 -0.051 35.266 1.00 0.00 H 0 +HETATM12560 H2 HOH A4079 29.802 1.341 35.325 1.00 0.00 H 0 +HETATM12561 O HOH A4080 26.018 38.885 12.175 1.00 0.00 O 0 +HETATM12562 H1 HOH A4080 26.577 39.010 11.454 1.00 0.00 H 0 +HETATM12563 H2 HOH A4080 26.533 39.066 12.943 1.00 0.00 H 0 +HETATM12564 O HOH A4081 43.393 27.384 13.745 1.00 0.00 O 0 +HETATM12565 H1 HOH A4081 42.699 26.923 13.281 1.00 0.00 H 0 +HETATM12566 H2 HOH A4081 44.155 27.285 13.169 1.00 0.00 H 0 +HETATM12567 O HOH A4082 12.760 22.940 40.151 1.00 0.00 O 0 +HETATM12568 H1 HOH A4082 13.345 22.358 40.721 1.00 0.00 H 0 +HETATM12569 H2 HOH A4082 12.707 22.464 39.322 1.00 0.00 H 0 +HETATM12570 O HOH A4083 12.938 14.710 51.141 1.00 0.00 O 0 +HETATM12571 H1 HOH A4083 13.351 14.366 50.335 1.00 0.00 H 0 +HETATM12572 H2 HOH A4083 13.360 14.299 51.820 1.00 0.00 H 0 +HETATM12573 O HOH A4084 41.604 48.979 6.325 1.00 0.00 O 0 +HETATM12574 H1 HOH A4084 41.596 49.827 5.874 1.00 0.00 H 0 +HETATM12575 H2 HOH A4084 42.511 48.793 6.666 1.00 0.00 H 0 +HETATM12576 O HOH A4085 39.620 16.459 1.858 1.00 0.00 O 0 +HETATM12577 H1 HOH A4085 40.374 16.297 1.225 1.00 0.00 H 0 +HETATM12578 H2 HOH A4085 39.990 16.962 2.589 1.00 0.00 H 0 +HETATM12579 O HOH A4086 14.197 33.433 33.960 1.00 0.00 O 0 +HETATM12580 H1 HOH A4086 13.345 33.781 33.732 1.00 0.00 H 0 +HETATM12581 H2 HOH A4086 14.112 32.571 34.434 1.00 0.00 H 0 +HETATM12582 O HOH A4087 4.998 33.926 49.263 1.00 0.00 O 0 +HETATM12583 H1 HOH A4087 4.534 33.466 49.951 1.00 0.00 H 0 +HETATM12584 H2 HOH A4087 5.849 33.546 49.102 1.00 0.00 H 0 +HETATM12585 O HOH A4088 25.245 45.713 46.204 1.00 0.00 O 0 +HETATM12586 H1 HOH A4088 24.510 46.378 46.058 1.00 0.00 H 0 +HETATM12587 H2 HOH A4088 24.699 45.017 46.636 1.00 0.00 H 0 +HETATM12588 O HOH A4089 50.589 24.072 26.119 1.00 0.00 O 0 +HETATM12589 H1 HOH A4089 50.514 23.204 26.443 1.00 0.00 H 0 +HETATM12590 H2 HOH A4089 50.208 23.949 25.214 1.00 0.00 H 0 +HETATM12591 O HOH A4090 37.058 14.298 22.017 1.00 0.00 O 0 +HETATM12592 H1 HOH A4090 37.708 14.551 21.359 1.00 0.00 H 0 +HETATM12593 H2 HOH A4090 36.421 13.810 21.461 1.00 0.00 H 0 +HETATM12594 O HOH A4091 38.983 16.642 26.747 1.00 0.00 O 0 +HETATM12595 H1 HOH A4091 39.141 15.703 26.701 1.00 0.00 H 0 +HETATM12596 H2 HOH A4091 39.866 17.084 27.014 1.00 0.00 H 0 +HETATM12597 O HOH A4092 12.821 26.264 52.970 1.00 0.00 O 0 +HETATM12598 H1 HOH A4092 11.942 26.441 52.659 1.00 0.00 H 0 +HETATM12599 H2 HOH A4092 12.740 25.613 53.664 1.00 0.00 H 0 +HETATM12600 O HOH A4093 49.022 26.888 32.999 1.00 0.00 O 0 +HETATM12601 H1 HOH A4093 49.408 26.075 33.398 1.00 0.00 H 0 +HETATM12602 H2 HOH A4093 48.058 26.575 32.921 1.00 0.00 H 0 +HETATM12603 O HOH A4094 42.462 51.278 44.008 1.00 0.00 O 0 +HETATM12604 H1 HOH A4094 41.986 51.678 43.267 1.00 0.00 H 0 +HETATM12605 H2 HOH A4094 43.228 51.909 44.230 1.00 0.00 H 0 +HETATM12606 O HOH A4095 50.503 9.003 12.997 1.00 0.00 O 0 +HETATM12607 H1 HOH A4095 50.605 9.702 13.698 1.00 0.00 H 0 +HETATM12608 H2 HOH A4095 49.969 8.362 13.376 1.00 0.00 H 0 +HETATM12609 O HOH A4096 1.115 15.441 0.821 1.00 0.00 O 0 +HETATM12610 H1 HOH A4096 1.884 14.979 1.074 1.00 0.00 H 0 +HETATM12611 H2 HOH A4096 0.538 15.455 1.581 1.00 0.00 H 0 +HETATM12612 O HOH A4097 45.884 3.247 7.581 1.00 0.00 O 0 +HETATM12613 H1 HOH A4097 46.428 2.560 7.125 1.00 0.00 H 0 +HETATM12614 H2 HOH A4097 46.287 4.045 7.303 1.00 0.00 H 0 +HETATM12615 O HOH A4098 34.946 4.522 25.945 1.00 0.00 O 0 +HETATM12616 H1 HOH A4098 35.280 3.759 26.464 1.00 0.00 H 0 +HETATM12617 H2 HOH A4098 35.138 4.284 25.048 1.00 0.00 H 0 +HETATM12618 O HOH A4099 44.965 33.763 15.041 1.00 0.00 O 0 +HETATM12619 H1 HOH A4099 44.594 33.971 14.181 1.00 0.00 H 0 +HETATM12620 H2 HOH A4099 44.902 32.803 15.213 1.00 0.00 H 0 +HETATM12621 O HOH A4100 51.869 44.756 15.342 1.00 0.00 O 0 +HETATM12622 H1 HOH A4100 51.491 45.651 15.690 1.00 0.00 H 0 +HETATM12623 H2 HOH A4100 51.712 44.743 14.342 1.00 0.00 H 0 +HETATM12624 O HOH A4101 32.832 45.840 33.886 1.00 0.00 O 0 +HETATM12625 H1 HOH A4101 33.652 45.972 33.350 1.00 0.00 H 0 +HETATM12626 H2 HOH A4101 32.552 44.946 33.828 1.00 0.00 H 0 +HETATM12627 O HOH A4102 52.959 19.065 33.230 1.00 0.00 O 0 +HETATM12628 H1 HOH A4102 52.875 19.405 34.179 1.00 0.00 H 0 +HETATM12629 H2 HOH A4102 53.487 19.755 32.767 1.00 0.00 H 0 +HETATM12630 O HOH A4103 3.335 25.367 30.366 1.00 0.00 O 0 +HETATM12631 H1 HOH A4103 2.515 24.891 30.484 1.00 0.00 H 0 +HETATM12632 H2 HOH A4103 3.115 26.189 29.907 1.00 0.00 H 0 +HETATM12633 O HOH A4104 17.034 12.305 41.788 1.00 0.00 O 0 +HETATM12634 H1 HOH A4104 17.360 13.181 41.638 1.00 0.00 H 0 +HETATM12635 H2 HOH A4104 17.227 11.733 41.021 1.00 0.00 H 0 +HETATM12636 O HOH A4105 50.099 32.660 5.326 1.00 0.00 O 0 +HETATM12637 H1 HOH A4105 50.348 31.860 4.780 1.00 0.00 H 0 +HETATM12638 H2 HOH A4105 50.885 33.229 5.278 1.00 0.00 H 0 +HETATM12639 O HOH A4106 40.096 50.343 11.250 1.00 0.00 O 0 +HETATM12640 H1 HOH A4106 40.740 50.981 10.969 1.00 0.00 H 0 +HETATM12641 H2 HOH A4106 39.242 50.861 11.272 1.00 0.00 H 0 +HETATM12642 O HOH A4107 5.897 20.015 30.637 1.00 0.00 O 0 +HETATM12643 H1 HOH A4107 6.114 20.698 30.077 1.00 0.00 H 0 +HETATM12644 H2 HOH A4107 6.793 19.816 31.072 1.00 0.00 H 0 +HETATM12645 O HOH A4108 40.163 22.163 25.539 1.00 0.00 O 0 +HETATM12646 H1 HOH A4108 39.741 21.930 26.438 1.00 0.00 H 0 +HETATM12647 H2 HOH A4108 40.050 23.131 25.434 1.00 0.00 H 0 +HETATM12648 O HOH A4109 52.979 53.283 40.636 1.00 0.00 O 0 +HETATM12649 H1 HOH A4109 53.844 53.760 40.568 1.00 0.00 H 0 +HETATM12650 H2 HOH A4109 53.165 52.339 40.964 1.00 0.00 H 0 +HETATM12651 O HOH A4110 37.412 41.811 0.453 1.00 0.00 O 0 +HETATM12652 H1 HOH A4110 36.438 41.608 0.386 1.00 0.00 H 0 +HETATM12653 H2 HOH A4110 37.567 42.249 1.262 1.00 0.00 H 0 +HETATM12654 O HOH A4111 29.316 50.464 45.333 1.00 0.00 O 0 +HETATM12655 H1 HOH A4111 29.144 50.780 44.426 1.00 0.00 H 0 +HETATM12656 H2 HOH A4111 28.592 49.842 45.560 1.00 0.00 H 0 +HETATM12657 O HOH A4112 4.511 41.592 34.557 1.00 0.00 O 0 +HETATM12658 H1 HOH A4112 5.324 41.820 34.930 1.00 0.00 H 0 +HETATM12659 H2 HOH A4112 4.544 40.670 34.275 1.00 0.00 H 0 +HETATM12660 O HOH A4113 42.210 0.633 44.568 1.00 0.00 O 0 +HETATM12661 H1 HOH A4113 42.997 0.156 44.865 1.00 0.00 H 0 +HETATM12662 H2 HOH A4113 42.031 0.306 43.718 1.00 0.00 H 0 +HETATM12663 O HOH A4114 47.006 19.482 37.970 1.00 0.00 O 0 +HETATM12664 H1 HOH A4114 47.625 19.821 37.322 1.00 0.00 H 0 +HETATM12665 H2 HOH A4114 46.784 18.609 37.562 1.00 0.00 H 0 +HETATM12666 O HOH A4115 27.873 2.101 15.078 1.00 0.00 O 0 +HETATM12667 H1 HOH A4115 27.413 1.344 15.416 1.00 0.00 H 0 +HETATM12668 H2 HOH A4115 28.749 1.862 15.281 1.00 0.00 H 0 +HETATM12669 O HOH A4116 41.137 2.053 49.114 1.00 0.00 O 0 +HETATM12670 H1 HOH A4116 40.618 1.581 49.787 1.00 0.00 H 0 +HETATM12671 H2 HOH A4116 40.988 1.642 48.254 1.00 0.00 H 0 +HETATM12672 O HOH A4117 12.143 46.745 32.064 1.00 0.00 O 0 +HETATM12673 H1 HOH A4117 12.573 47.560 31.806 1.00 0.00 H 0 +HETATM12674 H2 HOH A4117 11.256 46.660 31.613 1.00 0.00 H 0 +HETATM12675 O HOH A4118 41.585 23.886 34.605 1.00 0.00 O 0 +HETATM12676 H1 HOH A4118 41.820 24.416 35.354 1.00 0.00 H 0 +HETATM12677 H2 HOH A4118 42.291 23.262 34.601 1.00 0.00 H 0 +HETATM12678 O HOH A4119 51.441 28.493 5.629 1.00 0.00 O 0 +HETATM12679 H1 HOH A4119 52.266 28.962 5.727 1.00 0.00 H 0 +HETATM12680 H2 HOH A4119 51.003 28.647 6.487 1.00 0.00 H 0 +HETATM12681 O HOH A4120 50.758 51.389 2.965 1.00 0.00 O 0 +HETATM12682 H1 HOH A4120 51.412 51.119 3.677 1.00 0.00 H 0 +HETATM12683 H2 HOH A4120 50.754 52.364 2.901 1.00 0.00 H 0 +HETATM12684 O HOH A4121 0.648 18.788 6.273 1.00 0.00 O 0 +HETATM12685 H1 HOH A4121 0.784 19.601 6.781 1.00 0.00 H 0 +HETATM12686 H2 HOH A4121 0.119 19.024 5.472 1.00 0.00 H 0 +HETATM12687 O HOH A4122 41.276 16.456 39.617 1.00 0.00 O 0 +HETATM12688 H1 HOH A4122 40.761 17.210 39.881 1.00 0.00 H 0 +HETATM12689 H2 HOH A4122 41.760 16.124 40.405 1.00 0.00 H 0 +HETATM12690 O HOH A4123 14.662 40.613 51.412 1.00 0.00 O 0 +HETATM12691 H1 HOH A4123 14.996 41.553 51.213 1.00 0.00 H 0 +HETATM12692 H2 HOH A4123 14.861 40.050 50.615 1.00 0.00 H 0 +HETATM12693 O HOH A4124 32.142 4.316 48.551 1.00 0.00 O 0 +HETATM12694 H1 HOH A4124 31.965 3.427 48.728 1.00 0.00 H 0 +HETATM12695 H2 HOH A4124 32.341 4.713 49.421 1.00 0.00 H 0 +HETATM12696 O HOH A4125 16.907 51.210 24.456 1.00 0.00 O 0 +HETATM12697 H1 HOH A4125 16.455 50.692 25.159 1.00 0.00 H 0 +HETATM12698 H2 HOH A4125 17.296 50.542 23.870 1.00 0.00 H 0 +HETATM12699 O HOH A4126 8.183 17.092 25.999 1.00 0.00 O 0 +HETATM12700 H1 HOH A4126 7.268 17.403 25.775 1.00 0.00 H 0 +HETATM12701 H2 HOH A4126 8.624 17.747 26.577 1.00 0.00 H 0 +HETATM12702 O HOH A4127 4.240 41.949 50.975 1.00 0.00 O 0 +HETATM12703 H1 HOH A4127 3.295 42.067 50.697 1.00 0.00 H 0 +HETATM12704 H2 HOH A4127 4.793 42.558 50.346 1.00 0.00 H 0 +HETATM12705 O HOH A4128 41.313 14.738 12.959 1.00 0.00 O 0 +HETATM12706 H1 HOH A4128 41.787 13.993 12.429 1.00 0.00 H 0 +HETATM12707 H2 HOH A4128 40.759 15.320 12.345 1.00 0.00 H 0 +HETATM12708 O HOH A4129 32.165 14.118 11.226 1.00 0.00 O 0 +HETATM12709 H1 HOH A4129 32.178 14.276 10.262 1.00 0.00 H 0 +HETATM12710 H2 HOH A4129 32.591 14.873 11.707 1.00 0.00 H 0 +HETATM12711 O HOH A4130 2.041 32.787 36.043 1.00 0.00 O 0 +HETATM12712 H1 HOH A4130 2.684 32.123 36.198 1.00 0.00 H 0 +HETATM12713 H2 HOH A4130 1.167 32.402 36.297 1.00 0.00 H 0 +HETATM12714 O HOH A4131 53.260 30.501 52.319 1.00 0.00 O 0 +HETATM12715 H1 HOH A4131 53.929 30.863 52.937 1.00 0.00 H 0 +HETATM12716 H2 HOH A4131 53.317 29.528 52.270 1.00 0.00 H 0 +HETATM12717 O HOH A4132 18.266 13.745 18.629 1.00 0.00 O 0 +HETATM12718 H1 HOH A4132 17.765 12.991 18.352 1.00 0.00 H 0 +HETATM12719 H2 HOH A4132 17.691 14.301 19.078 1.00 0.00 H 0 +HETATM12720 O HOH A4133 7.569 21.010 43.209 1.00 0.00 O 0 +HETATM12721 H1 HOH A4133 8.412 21.117 43.743 1.00 0.00 H 0 +HETATM12722 H2 HOH A4133 7.862 20.446 42.499 1.00 0.00 H 0 +HETATM12723 O HOH A4134 36.844 53.015 53.341 1.00 0.00 O 0 +HETATM12724 H1 HOH A4134 37.432 53.641 53.704 1.00 0.00 H 0 +HETATM12725 H2 HOH A4134 35.923 53.372 53.592 1.00 0.00 H 0 +HETATM12726 O HOH A4135 17.655 44.585 11.458 1.00 0.00 O 0 +HETATM12727 H1 HOH A4135 17.761 43.763 11.976 1.00 0.00 H 0 +HETATM12728 H2 HOH A4135 17.084 45.070 12.102 1.00 0.00 H 0 +HETATM12729 O HOH A4136 19.032 11.830 15.161 1.00 0.00 O 0 +HETATM12730 H1 HOH A4136 19.242 12.618 15.750 1.00 0.00 H 0 +HETATM12731 H2 HOH A4136 19.341 11.976 14.292 1.00 0.00 H 0 +HETATM12732 O HOH A4137 3.732 34.674 34.575 1.00 0.00 O 0 +HETATM12733 H1 HOH A4137 3.169 34.257 35.242 1.00 0.00 H 0 +HETATM12734 H2 HOH A4137 4.327 33.969 34.302 1.00 0.00 H 0 +HETATM12735 O HOH A4138 5.108 13.661 18.324 1.00 0.00 O 0 +HETATM12736 H1 HOH A4138 4.982 13.999 19.254 1.00 0.00 H 0 +HETATM12737 H2 HOH A4138 5.581 12.839 18.425 1.00 0.00 H 0 +HETATM12738 O HOH A4139 35.586 50.389 20.240 1.00 0.00 O 0 +HETATM12739 H1 HOH A4139 34.850 49.775 20.175 1.00 0.00 H 0 +HETATM12740 H2 HOH A4139 36.303 49.829 20.088 1.00 0.00 H 0 +HETATM12741 O HOH A4140 22.461 40.656 9.466 1.00 0.00 O 0 +HETATM12742 H1 HOH A4140 23.098 40.276 8.916 1.00 0.00 H 0 +HETATM12743 H2 HOH A4140 22.400 41.595 9.427 1.00 0.00 H 0 +HETATM12744 O HOH A4141 8.687 18.403 11.922 1.00 0.00 O 0 +HETATM12745 H1 HOH A4141 9.539 17.991 12.241 1.00 0.00 H 0 +HETATM12746 H2 HOH A4141 8.006 18.152 12.546 1.00 0.00 H 0 +HETATM12747 O HOH A4142 17.961 52.329 7.494 1.00 0.00 O 0 +HETATM12748 H1 HOH A4142 18.429 52.025 8.276 1.00 0.00 H 0 +HETATM12749 H2 HOH A4142 18.645 52.581 6.838 1.00 0.00 H 0 +HETATM12750 O HOH A4143 46.333 25.353 25.012 1.00 0.00 O 0 +HETATM12751 H1 HOH A4143 46.551 24.480 24.533 1.00 0.00 H 0 +HETATM12752 H2 HOH A4143 46.805 25.404 25.875 1.00 0.00 H 0 +HETATM12753 O HOH A4144 18.407 27.255 34.576 1.00 0.00 O 0 +HETATM12754 H1 HOH A4144 17.715 26.669 34.898 1.00 0.00 H 0 +HETATM12755 H2 HOH A4144 19.063 27.369 35.288 1.00 0.00 H 0 +HETATM12756 O HOH A4145 19.052 21.015 13.763 1.00 0.00 O 0 +HETATM12757 H1 HOH A4145 19.548 20.146 13.862 1.00 0.00 H 0 +HETATM12758 H2 HOH A4145 19.278 21.363 12.917 1.00 0.00 H 0 +HETATM12759 O HOH A4146 37.276 26.823 11.357 1.00 0.00 O 0 +HETATM12760 H1 HOH A4146 37.650 25.969 11.162 1.00 0.00 H 0 +HETATM12761 H2 HOH A4146 36.610 26.891 10.729 1.00 0.00 H 0 +HETATM12762 O HOH A4147 28.901 1.995 27.865 1.00 0.00 O 0 +HETATM12763 H1 HOH A4147 28.223 2.190 27.286 1.00 0.00 H 0 +HETATM12764 H2 HOH A4147 29.401 2.791 28.012 1.00 0.00 H 0 +HETATM12765 O HOH A4148 28.800 52.765 28.552 1.00 0.00 O 0 +HETATM12766 H1 HOH A4148 28.948 53.576 28.033 1.00 0.00 H 0 +HETATM12767 H2 HOH A4148 28.607 52.083 27.947 1.00 0.00 H 0 +HETATM12768 O HOH A4149 41.874 43.515 53.464 1.00 0.00 O 0 +HETATM12769 H1 HOH A4149 41.148 44.205 53.336 1.00 0.00 H 0 +HETATM12770 H2 HOH A4149 41.869 42.840 52.820 1.00 0.00 H 0 +HETATM12771 O HOH A4150 48.279 8.751 26.034 1.00 0.00 O 0 +HETATM12772 H1 HOH A4150 48.119 8.866 25.067 1.00 0.00 H 0 +HETATM12773 H2 HOH A4150 47.628 9.296 26.464 1.00 0.00 H 0 +HETATM12774 O HOH A4151 43.565 14.603 51.599 1.00 0.00 O 0 +HETATM12775 H1 HOH A4151 44.352 14.029 51.491 1.00 0.00 H 0 +HETATM12776 H2 HOH A4151 43.400 14.895 50.676 1.00 0.00 H 0 +HETATM12777 O HOH A4152 32.078 4.718 25.331 1.00 0.00 O 0 +HETATM12778 H1 HOH A4152 32.950 4.797 25.753 1.00 0.00 H 0 +HETATM12779 H2 HOH A4152 32.304 4.653 24.393 1.00 0.00 H 0 +HETATM12780 O HOH A4153 43.803 40.465 0.714 1.00 0.00 O 0 +HETATM12781 H1 HOH A4153 42.855 40.154 0.652 1.00 0.00 H 0 +HETATM12782 H2 HOH A4153 44.329 39.771 0.294 1.00 0.00 H 0 +HETATM12783 O HOH A4154 6.940 11.685 18.426 1.00 0.00 O 0 +HETATM12784 H1 HOH A4154 7.255 12.533 18.779 1.00 0.00 H 0 +HETATM12785 H2 HOH A4154 6.940 10.991 19.042 1.00 0.00 H 0 +HETATM12786 O HOH A4155 17.220 16.599 37.836 1.00 0.00 O 0 +HETATM12787 H1 HOH A4155 16.968 15.741 38.223 1.00 0.00 H 0 +HETATM12788 H2 HOH A4155 16.568 16.957 37.210 1.00 0.00 H 0 +HETATM12789 O HOH A4156 7.067 35.972 21.467 1.00 0.00 O 0 +HETATM12790 H1 HOH A4156 7.647 35.660 20.785 1.00 0.00 H 0 +HETATM12791 H2 HOH A4156 6.258 36.293 21.105 1.00 0.00 H 0 +HETATM12792 O HOH A4157 5.020 34.430 16.148 1.00 0.00 O 0 +HETATM12793 H1 HOH A4157 4.607 34.794 16.912 1.00 0.00 H 0 +HETATM12794 H2 HOH A4157 5.431 33.568 16.466 1.00 0.00 H 0 +HETATM12795 O HOH A4158 10.066 32.261 41.122 1.00 0.00 O 0 +HETATM12796 H1 HOH A4158 10.801 31.731 41.486 1.00 0.00 H 0 +HETATM12797 H2 HOH A4158 9.400 31.598 41.189 1.00 0.00 H 0 +HETATM12798 O HOH A4159 36.942 32.879 36.723 1.00 0.00 O 0 +HETATM12799 H1 HOH A4159 36.019 33.178 36.650 1.00 0.00 H 0 +HETATM12800 H2 HOH A4159 37.612 33.599 36.661 1.00 0.00 H 0 +HETATM12801 O HOH A4160 38.480 30.432 34.724 1.00 0.00 O 0 +HETATM12802 H1 HOH A4160 38.177 30.050 35.550 1.00 0.00 H 0 +HETATM12803 H2 HOH A4160 38.806 29.820 34.056 1.00 0.00 H 0 +HETATM12804 O HOH A4161 27.307 8.659 53.277 1.00 0.00 O 0 +HETATM12805 H1 HOH A4161 27.305 9.609 53.194 1.00 0.00 H 0 +HETATM12806 H2 HOH A4161 26.616 8.499 52.631 1.00 0.00 H 0 +HETATM12807 O HOH A4162 30.017 0.831 46.716 1.00 0.00 O 0 +HETATM12808 H1 HOH A4162 30.460 1.277 47.456 1.00 0.00 H 0 +HETATM12809 H2 HOH A4162 29.229 1.327 46.518 1.00 0.00 H 0 +HETATM12810 O HOH A4163 36.712 28.435 31.040 1.00 0.00 O 0 +HETATM12811 H1 HOH A4163 35.968 28.874 31.541 1.00 0.00 H 0 +HETATM12812 H2 HOH A4163 37.174 29.204 30.761 1.00 0.00 H 0 +HETATM12813 O HOH A4164 5.220 2.751 15.067 1.00 0.00 O 0 +HETATM12814 H1 HOH A4164 5.847 3.339 14.739 1.00 0.00 H 0 +HETATM12815 H2 HOH A4164 5.564 2.603 15.985 1.00 0.00 H 0 +HETATM12816 O HOH A4165 15.266 25.241 21.644 1.00 0.00 O 0 +HETATM12817 H1 HOH A4165 14.377 25.271 21.368 1.00 0.00 H 0 +HETATM12818 H2 HOH A4165 15.569 24.304 21.375 1.00 0.00 H 0 +HETATM12819 O HOH A4166 36.133 23.542 1.297 1.00 0.00 O 0 +HETATM12820 H1 HOH A4166 35.614 22.763 1.249 1.00 0.00 H 0 +HETATM12821 H2 HOH A4166 36.418 23.642 0.377 1.00 0.00 H 0 +HETATM12822 O HOH A4167 12.237 11.859 16.610 1.00 0.00 O 0 +HETATM12823 H1 HOH A4167 11.569 11.688 15.914 1.00 0.00 H 0 +HETATM12824 H2 HOH A4167 12.458 12.812 16.546 1.00 0.00 H 0 +HETATM12825 O HOH A4168 29.628 12.895 44.785 1.00 0.00 O 0 +HETATM12826 H1 HOH A4168 29.390 12.984 45.748 1.00 0.00 H 0 +HETATM12827 H2 HOH A4168 30.125 13.646 44.582 1.00 0.00 H 0 +HETATM12828 O HOH A4169 8.486 5.222 9.547 1.00 0.00 O 0 +HETATM12829 H1 HOH A4169 7.506 5.285 9.497 1.00 0.00 H 0 +HETATM12830 H2 HOH A4169 8.782 4.763 10.341 1.00 0.00 H 0 +HETATM12831 O HOH A4170 13.364 12.985 23.263 1.00 0.00 O 0 +HETATM12832 H1 HOH A4170 13.791 12.687 24.023 1.00 0.00 H 0 +HETATM12833 H2 HOH A4170 14.009 13.620 22.853 1.00 0.00 H 0 +HETATM12834 O HOH A4171 14.300 7.305 7.939 1.00 0.00 O 0 +HETATM12835 H1 HOH A4171 14.673 7.221 8.795 1.00 0.00 H 0 +HETATM12836 H2 HOH A4171 13.911 8.166 7.791 1.00 0.00 H 0 +HETATM12837 O HOH A4172 24.254 21.684 36.393 1.00 0.00 O 0 +HETATM12838 H1 HOH A4172 24.649 22.357 35.896 1.00 0.00 H 0 +HETATM12839 H2 HOH A4172 23.380 22.047 36.615 1.00 0.00 H 0 +HETATM12840 O HOH A4173 6.978 17.721 53.051 1.00 0.00 O 0 +HETATM12841 H1 HOH A4173 6.800 17.950 53.961 1.00 0.00 H 0 +HETATM12842 H2 HOH A4173 7.427 18.376 52.555 1.00 0.00 H 0 +HETATM12843 O HOH A4174 37.424 15.939 4.955 1.00 0.00 O 0 +HETATM12844 H1 HOH A4174 36.981 15.337 5.591 1.00 0.00 H 0 +HETATM12845 H2 HOH A4174 37.647 15.417 4.160 1.00 0.00 H 0 +HETATM12846 O HOH A4175 0.837 7.994 21.331 1.00 0.00 O 0 +HETATM12847 H1 HOH A4175 0.195 7.733 20.553 1.00 0.00 H 0 +HETATM12848 H2 HOH A4175 0.342 8.760 21.721 1.00 0.00 H 0 +HETATM12849 O HOH A4176 45.176 8.280 27.311 1.00 0.00 O 0 +HETATM12850 H1 HOH A4176 44.239 8.103 27.452 1.00 0.00 H 0 +HETATM12851 H2 HOH A4176 45.555 7.400 27.027 1.00 0.00 H 0 +HETATM12852 O HOH A4177 6.814 10.580 28.009 1.00 0.00 O 0 +HETATM12853 H1 HOH A4177 6.985 10.069 27.169 1.00 0.00 H 0 +HETATM12854 H2 HOH A4177 5.949 10.497 28.364 1.00 0.00 H 0 +HETATM12855 O HOH A4178 17.453 11.645 39.264 1.00 0.00 O 0 +HETATM12856 H1 HOH A4178 18.342 11.838 39.076 1.00 0.00 H 0 +HETATM12857 H2 HOH A4178 17.373 10.834 38.762 1.00 0.00 H 0 +HETATM12858 O HOH A4179 47.141 28.133 5.010 1.00 0.00 O 0 +HETATM12859 H1 HOH A4179 46.983 28.929 5.516 1.00 0.00 H 0 +HETATM12860 H2 HOH A4179 46.878 28.343 4.069 1.00 0.00 H 0 +HETATM12861 O HOH A4180 13.313 40.088 27.255 1.00 0.00 O 0 +HETATM12862 H1 HOH A4180 13.258 40.551 28.156 1.00 0.00 H 0 +HETATM12863 H2 HOH A4180 14.208 39.785 27.208 1.00 0.00 H 0 +HETATM12864 O HOH A4181 47.098 4.490 52.184 1.00 0.00 O 0 +HETATM12865 H1 HOH A4181 46.766 3.846 52.801 1.00 0.00 H 0 +HETATM12866 H2 HOH A4181 48.080 4.425 52.326 1.00 0.00 H 0 +HETATM12867 O HOH A4182 17.249 20.754 4.421 1.00 0.00 O 0 +HETATM12868 H1 HOH A4182 17.917 20.086 4.264 1.00 0.00 H 0 +HETATM12869 H2 HOH A4182 16.411 20.343 4.245 1.00 0.00 H 0 +HETATM12870 O HOH A4183 3.809 5.528 33.087 1.00 0.00 O 0 +HETATM12871 H1 HOH A4183 3.411 6.334 33.508 1.00 0.00 H 0 +HETATM12872 H2 HOH A4183 4.494 5.247 33.681 1.00 0.00 H 0 +HETATM12873 O HOH A4184 34.606 45.912 17.202 1.00 0.00 O 0 +HETATM12874 H1 HOH A4184 35.144 45.108 17.123 1.00 0.00 H 0 +HETATM12875 H2 HOH A4184 33.781 45.890 16.652 1.00 0.00 H 0 +HETATM12876 O HOH A4185 28.823 38.488 31.619 1.00 0.00 O 0 +HETATM12877 H1 HOH A4185 29.219 39.268 31.187 1.00 0.00 H 0 +HETATM12878 H2 HOH A4185 28.863 38.643 32.568 1.00 0.00 H 0 +HETATM12879 O HOH A4186 33.709 16.082 26.305 1.00 0.00 O 0 +HETATM12880 H1 HOH A4186 32.787 15.952 26.577 1.00 0.00 H 0 +HETATM12881 H2 HOH A4186 33.751 15.938 25.351 1.00 0.00 H 0 +HETATM12882 O HOH A4187 21.773 4.482 19.106 1.00 0.00 O 0 +HETATM12883 H1 HOH A4187 22.294 4.901 18.394 1.00 0.00 H 0 +HETATM12884 H2 HOH A4187 22.028 4.893 19.950 1.00 0.00 H 0 +HETATM12885 O HOH A4188 21.969 48.380 9.998 1.00 0.00 O 0 +HETATM12886 H1 HOH A4188 22.415 49.156 10.419 1.00 0.00 H 0 +HETATM12887 H2 HOH A4188 22.162 47.550 10.506 1.00 0.00 H 0 +HETATM12888 O HOH A4189 20.228 27.256 1.985 1.00 0.00 O 0 +HETATM12889 H1 HOH A4189 20.493 26.736 1.247 1.00 0.00 H 0 +HETATM12890 H2 HOH A4189 20.041 26.557 2.571 1.00 0.00 H 0 +HETATM12891 O HOH A4190 12.656 39.042 2.393 1.00 0.00 O 0 +HETATM12892 H1 HOH A4190 13.460 39.144 2.928 1.00 0.00 H 0 +HETATM12893 H2 HOH A4190 12.753 39.626 1.633 1.00 0.00 H 0 +HETATM12894 O HOH A4191 5.886 6.033 31.459 1.00 0.00 O 0 +HETATM12895 H1 HOH A4191 6.318 6.796 31.897 1.00 0.00 H 0 +HETATM12896 H2 HOH A4191 5.077 6.111 31.919 1.00 0.00 H 0 +HETATM12897 O HOH A4192 37.190 26.695 34.601 1.00 0.00 O 0 +HETATM12898 H1 HOH A4192 37.355 25.954 33.997 1.00 0.00 H 0 +HETATM12899 H2 HOH A4192 37.227 26.308 35.534 1.00 0.00 H 0 +HETATM12900 O HOH A4193 7.149 30.481 34.196 1.00 0.00 O 0 +HETATM12901 H1 HOH A4193 7.193 30.030 35.024 1.00 0.00 H 0 +HETATM12902 H2 HOH A4193 8.066 30.827 34.080 1.00 0.00 H 0 +HETATM12903 O HOH A4194 43.077 3.269 7.652 1.00 0.00 O 0 +HETATM12904 H1 HOH A4194 42.886 2.655 8.402 1.00 0.00 H 0 +HETATM12905 H2 HOH A4194 44.039 3.394 7.676 1.00 0.00 H 0 +HETATM12906 O HOH A4195 41.600 12.399 51.349 1.00 0.00 O 0 +HETATM12907 H1 HOH A4195 42.308 12.819 51.768 1.00 0.00 H 0 +HETATM12908 H2 HOH A4195 41.252 12.839 50.625 1.00 0.00 H 0 +HETATM12909 O HOH A4196 18.668 23.879 20.763 1.00 0.00 O 0 +HETATM12910 H1 HOH A4196 19.081 23.631 19.879 1.00 0.00 H 0 +HETATM12911 H2 HOH A4196 17.804 23.442 20.837 1.00 0.00 H 0 +HETATM12912 O HOH A4197 9.712 50.131 32.909 1.00 0.00 O 0 +HETATM12913 H1 HOH A4197 9.034 50.760 32.784 1.00 0.00 H 0 +HETATM12914 H2 HOH A4197 10.531 50.620 32.696 1.00 0.00 H 0 +HETATM12915 O HOH A4198 41.443 38.621 26.967 1.00 0.00 O 0 +HETATM12916 H1 HOH A4198 41.437 37.771 26.483 1.00 0.00 H 0 +HETATM12917 H2 HOH A4198 42.318 38.650 27.382 1.00 0.00 H 0 +HETATM12918 O HOH A4199 2.349 9.090 29.777 1.00 0.00 O 0 +HETATM12919 H1 HOH A4199 2.507 8.470 29.054 1.00 0.00 H 0 +HETATM12920 H2 HOH A4199 1.913 9.863 29.423 1.00 0.00 H 0 +HETATM12921 O HOH A4200 22.332 22.363 13.937 1.00 0.00 O 0 +HETATM12922 H1 HOH A4200 22.687 21.915 13.159 1.00 0.00 H 0 +HETATM12923 H2 HOH A4200 22.223 21.651 14.675 1.00 0.00 H 0 +HETATM12924 O HOH A4201 0.729 0.896 47.213 1.00 0.00 O 0 +HETATM12925 H1 HOH A4201 0.240 0.376 46.570 1.00 0.00 H 0 +HETATM12926 H2 HOH A4201 0.267 0.863 48.159 1.00 0.00 H 0 +HETATM12927 O HOH A4202 41.415 47.504 17.682 1.00 0.00 O 0 +HETATM12928 H1 HOH A4202 42.289 47.193 17.987 1.00 0.00 H 0 +HETATM12929 H2 HOH A4202 40.822 47.714 18.421 1.00 0.00 H 0 +HETATM12930 O HOH A4203 36.365 35.461 49.341 1.00 0.00 O 0 +HETATM12931 H1 HOH A4203 35.443 35.428 49.561 1.00 0.00 H 0 +HETATM12932 H2 HOH A4203 36.489 36.113 48.634 1.00 0.00 H 0 +HETATM12933 O HOH A4204 52.567 34.734 33.014 1.00 0.00 O 0 +HETATM12934 H1 HOH A4204 52.693 35.542 32.540 1.00 0.00 H 0 +HETATM12935 H2 HOH A4204 53.305 34.095 32.863 1.00 0.00 H 0 +HETATM12936 O HOH A4205 26.610 53.442 21.498 1.00 0.00 O 0 +HETATM12937 H1 HOH A4205 26.031 54.184 21.829 1.00 0.00 H 0 +HETATM12938 H2 HOH A4205 25.957 52.755 21.311 1.00 0.00 H 0 +HETATM12939 O HOH A4206 42.939 49.701 31.622 1.00 0.00 O 0 +HETATM12940 H1 HOH A4206 42.016 49.401 31.532 1.00 0.00 H 0 +HETATM12941 H2 HOH A4206 43.509 49.065 32.094 1.00 0.00 H 0 +HETATM12942 O HOH A4207 44.047 34.607 0.261 1.00 0.00 O 0 +HETATM12943 H1 HOH A4207 43.769 33.823 0.746 1.00 0.00 H 0 +HETATM12944 H2 HOH A4207 43.482 35.415 0.513 1.00 0.00 H 0 +HETATM12945 O HOH A4208 14.006 42.878 22.084 1.00 0.00 O 0 +HETATM12946 H1 HOH A4208 13.194 42.666 22.519 1.00 0.00 H 0 +HETATM12947 H2 HOH A4208 14.289 43.807 22.348 1.00 0.00 H 0 +HETATM12948 O HOH A4209 45.602 2.132 0.598 1.00 0.00 O 0 +HETATM12949 H1 HOH A4209 44.934 1.669 -0.039 1.00 0.00 H 0 +HETATM12950 H2 HOH A4209 46.063 1.506 1.131 1.00 0.00 H 0 +HETATM12951 O HOH A4210 42.578 6.319 40.979 1.00 0.00 O 0 +HETATM12952 H1 HOH A4210 42.771 5.964 41.891 1.00 0.00 H 0 +HETATM12953 H2 HOH A4210 41.646 6.132 40.877 1.00 0.00 H 0 +HETATM12954 O HOH A4211 39.779 20.533 38.553 1.00 0.00 O 0 +HETATM12955 H1 HOH A4211 39.397 21.368 38.340 1.00 0.00 H 0 +HETATM12956 H2 HOH A4211 39.088 19.830 38.511 1.00 0.00 H 0 +HETATM12957 O HOH A4212 31.071 1.704 2.841 1.00 0.00 O 0 +HETATM12958 H1 HOH A4212 31.044 1.805 3.849 1.00 0.00 H 0 +HETATM12959 H2 HOH A4212 30.325 1.123 2.747 1.00 0.00 H 0 +HETATM12960 O HOH A4213 12.110 12.221 19.438 1.00 0.00 O 0 +HETATM12961 H1 HOH A4213 12.806 11.827 19.897 1.00 0.00 H 0 +HETATM12962 H2 HOH A4213 12.226 11.940 18.486 1.00 0.00 H 0 +HETATM12963 O HOH A4214 3.436 0.861 7.080 1.00 0.00 O 0 +HETATM12964 H1 HOH A4214 2.844 1.400 7.718 1.00 0.00 H 0 +HETATM12965 H2 HOH A4214 2.697 0.439 6.516 1.00 0.00 H 0 +HETATM12966 O HOH A4215 20.488 53.272 39.727 1.00 0.00 O 0 +HETATM12967 H1 HOH A4215 20.217 53.268 40.595 1.00 0.00 H 0 +HETATM12968 H2 HOH A4215 21.034 52.434 39.675 1.00 0.00 H 0 +HETATM12969 O HOH A4216 14.659 27.230 1.857 1.00 0.00 O 0 +HETATM12970 H1 HOH A4216 14.730 26.347 1.863 1.00 0.00 H 0 +HETATM12971 H2 HOH A4216 15.497 27.501 2.215 1.00 0.00 H 0 +HETATM12972 O HOH A4217 8.497 32.353 8.415 1.00 0.00 O 0 +HETATM12973 H1 HOH A4217 8.197 31.583 8.892 1.00 0.00 H 0 +HETATM12974 H2 HOH A4217 7.915 32.457 7.598 1.00 0.00 H 0 +HETATM12975 O HOH A4218 37.480 14.327 16.103 1.00 0.00 O 0 +HETATM12976 H1 HOH A4218 37.058 14.603 16.940 1.00 0.00 H 0 +HETATM12977 H2 HOH A4218 38.096 15.038 15.772 1.00 0.00 H 0 +HETATM12978 O HOH A4219 2.744 12.698 48.883 1.00 0.00 O 0 +HETATM12979 H1 HOH A4219 3.002 12.449 49.856 1.00 0.00 H 0 +HETATM12980 H2 HOH A4219 2.659 11.931 48.315 1.00 0.00 H 0 +HETATM12981 O HOH A4220 10.760 11.710 33.420 1.00 0.00 O 0 +HETATM12982 H1 HOH A4220 11.251 12.559 33.270 1.00 0.00 H 0 +HETATM12983 H2 HOH A4220 11.086 11.045 32.760 1.00 0.00 H 0 +HETATM12984 O HOH A4221 1.693 15.701 43.341 1.00 0.00 O 0 +HETATM12985 H1 HOH A4221 1.710 15.047 44.016 1.00 0.00 H 0 +HETATM12986 H2 HOH A4221 2.436 16.225 43.586 1.00 0.00 H 0 +HETATM12987 O HOH A4222 52.147 24.294 37.528 1.00 0.00 O 0 +HETATM12988 H1 HOH A4222 52.167 24.712 38.352 1.00 0.00 H 0 +HETATM12989 H2 HOH A4222 51.773 24.863 36.850 1.00 0.00 H 0 +HETATM12990 O HOH A4223 33.742 1.810 13.875 1.00 0.00 O 0 +HETATM12991 H1 HOH A4223 33.137 2.463 14.030 1.00 0.00 H 0 +HETATM12992 H2 HOH A4223 33.258 0.982 14.052 1.00 0.00 H 0 +HETATM12993 O HOH A4224 18.956 3.544 34.035 1.00 0.00 O 0 +HETATM12994 H1 HOH A4224 19.215 3.699 34.928 1.00 0.00 H 0 +HETATM12995 H2 HOH A4224 18.053 3.168 33.965 1.00 0.00 H 0 +HETATM12996 O HOH A4225 18.292 0.420 49.317 1.00 0.00 O 0 +HETATM12997 H1 HOH A4225 17.583 -0.191 49.568 1.00 0.00 H 0 +HETATM12998 H2 HOH A4225 18.449 0.247 48.441 1.00 0.00 H 0 +HETATM12999 O HOH A4226 37.715 45.764 45.515 1.00 0.00 O 0 +HETATM13000 H1 HOH A4226 36.837 45.477 45.843 1.00 0.00 H 0 +HETATM13001 H2 HOH A4226 37.640 46.725 45.622 1.00 0.00 H 0 +HETATM13002 O HOH A4227 37.328 41.652 49.950 1.00 0.00 O 0 +HETATM13003 H1 HOH A4227 37.310 42.345 50.619 1.00 0.00 H 0 +HETATM13004 H2 HOH A4227 36.538 41.068 49.996 1.00 0.00 H 0 +HETATM13005 O HOH A4228 12.212 29.517 44.444 1.00 0.00 O 0 +HETATM13006 H1 HOH A4228 12.742 28.716 44.373 1.00 0.00 H 0 +HETATM13007 H2 HOH A4228 11.330 29.143 44.546 1.00 0.00 H 0 +HETATM13008 O HOH A4229 19.591 21.670 7.419 1.00 0.00 O 0 +HETATM13009 H1 HOH A4229 18.751 21.197 7.602 1.00 0.00 H 0 +HETATM13010 H2 HOH A4229 19.431 22.401 6.786 1.00 0.00 H 0 +HETATM13011 O HOH A4230 27.309 17.402 47.658 1.00 0.00 O 0 +HETATM13012 H1 HOH A4230 26.748 17.171 46.949 1.00 0.00 H 0 +HETATM13013 H2 HOH A4230 27.283 18.382 47.638 1.00 0.00 H 0 +HETATM13014 O HOH A4231 11.028 45.131 2.791 1.00 0.00 O 0 +HETATM13015 H1 HOH A4231 11.340 44.695 2.020 1.00 0.00 H 0 +HETATM13016 H2 HOH A4231 11.678 44.858 3.480 1.00 0.00 H 0 +HETATM13017 O HOH A4232 35.025 19.067 3.910 1.00 0.00 O 0 +HETATM13018 H1 HOH A4232 35.738 19.062 4.548 1.00 0.00 H 0 +HETATM13019 H2 HOH A4232 35.056 19.989 3.645 1.00 0.00 H 0 +HETATM13020 O HOH A4233 3.350 18.965 27.486 1.00 0.00 O 0 +HETATM13021 H1 HOH A4233 2.413 19.113 27.476 1.00 0.00 H 0 +HETATM13022 H2 HOH A4233 3.622 18.423 28.217 1.00 0.00 H 0 +HETATM13023 O HOH A4234 1.463 47.441 29.803 1.00 0.00 O 0 +HETATM13024 H1 HOH A4234 1.828 47.682 30.698 1.00 0.00 H 0 +HETATM13025 H2 HOH A4234 2.090 47.335 29.092 1.00 0.00 H 0 +HETATM13026 O HOH A4235 9.975 15.997 32.070 1.00 0.00 O 0 +HETATM13027 H1 HOH A4235 10.408 16.835 32.167 1.00 0.00 H 0 +HETATM13028 H2 HOH A4235 10.603 15.316 32.342 1.00 0.00 H 0 +HETATM13029 O HOH A4236 10.653 45.594 21.472 1.00 0.00 O 0 +HETATM13030 H1 HOH A4236 11.101 44.840 21.001 1.00 0.00 H 0 +HETATM13031 H2 HOH A4236 9.786 45.241 21.841 1.00 0.00 H 0 +HETATM13032 O HOH A4237 25.539 42.429 42.694 1.00 0.00 O 0 +HETATM13033 H1 HOH A4237 26.049 41.971 43.379 1.00 0.00 H 0 +HETATM13034 H2 HOH A4237 25.632 43.391 42.800 1.00 0.00 H 0 +HETATM13035 O HOH A4238 33.929 12.098 11.277 1.00 0.00 O 0 +HETATM13036 H1 HOH A4238 34.709 12.621 11.651 1.00 0.00 H 0 +HETATM13037 H2 HOH A4238 33.207 12.783 11.140 1.00 0.00 H 0 +HETATM13038 O HOH A4239 8.019 17.810 29.312 1.00 0.00 O 0 +HETATM13039 H1 HOH A4239 7.421 18.366 28.722 1.00 0.00 H 0 +HETATM13040 H2 HOH A4239 8.255 18.343 30.094 1.00 0.00 H 0 +HETATM13041 O HOH A4240 18.759 49.522 3.899 1.00 0.00 O 0 +HETATM13042 H1 HOH A4240 18.970 49.049 3.140 1.00 0.00 H 0 +HETATM13043 H2 HOH A4240 19.560 49.577 4.451 1.00 0.00 H 0 +HETATM13044 O HOH A4241 36.527 17.114 22.530 1.00 0.00 O 0 +HETATM13045 H1 HOH A4241 37.140 17.372 23.212 1.00 0.00 H 0 +HETATM13046 H2 HOH A4241 36.625 16.112 22.400 1.00 0.00 H 0 +HETATM13047 O HOH A4242 4.133 0.858 32.006 1.00 0.00 O 0 +HETATM13048 H1 HOH A4242 3.532 1.483 31.644 1.00 0.00 H 0 +HETATM13049 H2 HOH A4242 3.592 0.041 31.906 1.00 0.00 H 0 +HETATM13050 O HOH A4243 31.471 49.974 11.978 1.00 0.00 O 0 +HETATM13051 H1 HOH A4243 31.445 50.076 12.936 1.00 0.00 H 0 +HETATM13052 H2 HOH A4243 31.562 50.967 11.610 1.00 0.00 H 0 +HETATM13053 O HOH A4244 19.267 17.774 11.756 1.00 0.00 O 0 +HETATM13054 H1 HOH A4244 19.283 18.293 10.906 1.00 0.00 H 0 +HETATM13055 H2 HOH A4244 19.389 16.819 11.626 1.00 0.00 H 0 +HETATM13056 O HOH A4245 45.889 2.335 17.959 1.00 0.00 O 0 +HETATM13057 H1 HOH A4245 46.239 2.294 17.101 1.00 0.00 H 0 +HETATM13058 H2 HOH A4245 45.614 3.213 18.031 1.00 0.00 H 0 +HETATM13059 O HOH A4246 15.337 24.809 32.718 1.00 0.00 O 0 +HETATM13060 H1 HOH A4246 14.980 25.396 32.048 1.00 0.00 H 0 +HETATM13061 H2 HOH A4246 15.562 23.976 32.271 1.00 0.00 H 0 +HETATM13062 O HOH A4247 51.862 0.701 14.689 1.00 0.00 O 0 +HETATM13063 H1 HOH A4247 52.316 0.126 14.125 1.00 0.00 H 0 +HETATM13064 H2 HOH A4247 52.253 0.948 15.534 1.00 0.00 H 0 +HETATM13065 O HOH A4248 15.760 39.734 36.376 1.00 0.00 O 0 +HETATM13066 H1 HOH A4248 14.821 39.743 36.096 1.00 0.00 H 0 +HETATM13067 H2 HOH A4248 16.237 39.293 35.699 1.00 0.00 H 0 +HETATM13068 O HOH A4249 17.361 41.165 48.762 1.00 0.00 O 0 +HETATM13069 H1 HOH A4249 18.090 41.800 48.883 1.00 0.00 H 0 +HETATM13070 H2 HOH A4249 17.499 40.510 49.463 1.00 0.00 H 0 +HETATM13071 O HOH A4250 5.679 9.413 37.274 1.00 0.00 O 0 +HETATM13072 H1 HOH A4250 6.321 9.198 38.010 1.00 0.00 H 0 +HETATM13073 H2 HOH A4250 5.074 8.620 37.217 1.00 0.00 H 0 +HETATM13074 O HOH A4251 42.647 25.638 37.051 1.00 0.00 O 0 +HETATM13075 H1 HOH A4251 43.086 25.394 37.920 1.00 0.00 H 0 +HETATM13076 H2 HOH A4251 42.084 26.303 37.354 1.00 0.00 H 0 +HETATM13077 O HOH A4252 36.039 40.689 16.418 1.00 0.00 O 0 +HETATM13078 H1 HOH A4252 35.550 40.200 17.133 1.00 0.00 H 0 +HETATM13079 H2 HOH A4252 37.013 40.680 16.482 1.00 0.00 H 0 +HETATM13080 O HOH A4253 1.770 8.910 39.871 1.00 0.00 O 0 +HETATM13081 H1 HOH A4253 1.779 9.734 39.299 1.00 0.00 H 0 +HETATM13082 H2 HOH A4253 2.554 8.997 40.419 1.00 0.00 H 0 +HETATM13083 O HOH A4254 8.678 44.723 11.011 1.00 0.00 O 0 +HETATM13084 H1 HOH A4254 9.455 45.220 11.432 1.00 0.00 H 0 +HETATM13085 H2 HOH A4254 9.012 44.088 10.345 1.00 0.00 H 0 +HETATM13086 O HOH A4255 41.102 29.195 3.806 1.00 0.00 O 0 +HETATM13087 H1 HOH A4255 41.035 28.511 3.187 1.00 0.00 H 0 +HETATM13088 H2 HOH A4255 40.155 29.452 4.027 1.00 0.00 H 0 +HETATM13089 O HOH A4256 23.077 51.271 13.534 1.00 0.00 O 0 +HETATM13090 H1 HOH A4256 23.026 51.098 12.609 1.00 0.00 H 0 +HETATM13091 H2 HOH A4256 23.212 50.355 13.982 1.00 0.00 H 0 +HETATM13092 O HOH A4257 9.957 18.388 2.239 1.00 0.00 O 0 +HETATM13093 H1 HOH A4257 9.360 19.037 1.896 1.00 0.00 H 0 +HETATM13094 H2 HOH A4257 9.610 18.180 3.103 1.00 0.00 H 0 +HETATM13095 O HOH A4258 10.744 18.167 15.712 1.00 0.00 O 0 +HETATM13096 H1 HOH A4258 10.321 17.471 16.225 1.00 0.00 H 0 +HETATM13097 H2 HOH A4258 11.335 18.524 16.394 1.00 0.00 H 0 +HETATM13098 O HOH A4259 11.117 18.852 22.846 1.00 0.00 O 0 +HETATM13099 H1 HOH A4259 11.452 19.791 22.901 1.00 0.00 H 0 +HETATM13100 H2 HOH A4259 11.406 18.444 23.692 1.00 0.00 H 0 +HETATM13101 O HOH A4260 28.807 53.706 2.179 1.00 0.00 O 0 +HETATM13102 H1 HOH A4260 29.329 52.991 1.871 1.00 0.00 H 0 +HETATM13103 H2 HOH A4260 27.920 53.358 2.368 1.00 0.00 H 0 +HETATM13104 O HOH A4261 5.759 32.966 33.981 1.00 0.00 O 0 +HETATM13105 H1 HOH A4261 6.061 32.039 33.977 1.00 0.00 H 0 +HETATM13106 H2 HOH A4261 5.833 33.349 33.145 1.00 0.00 H 0 +HETATM13107 O HOH A4262 40.569 38.905 32.277 1.00 0.00 O 0 +HETATM13108 H1 HOH A4262 40.351 39.796 32.184 1.00 0.00 H 0 +HETATM13109 H2 HOH A4262 39.740 38.371 32.086 1.00 0.00 H 0 +HETATM13110 O HOH A4263 3.063 52.409 40.087 1.00 0.00 O 0 +HETATM13111 H1 HOH A4263 3.524 52.839 39.371 1.00 0.00 H 0 +HETATM13112 H2 HOH A4263 2.753 51.557 39.785 1.00 0.00 H 0 +HETATM13113 O HOH A4264 25.511 2.353 37.106 1.00 0.00 O 0 +HETATM13114 H1 HOH A4264 25.267 2.218 38.003 1.00 0.00 H 0 +HETATM13115 H2 HOH A4264 25.786 1.462 36.775 1.00 0.00 H 0 +HETATM13116 O HOH A4265 34.904 37.677 46.211 1.00 0.00 O 0 +HETATM13117 H1 HOH A4265 35.584 37.988 46.818 1.00 0.00 H 0 +HETATM13118 H2 HOH A4265 34.608 38.385 45.618 1.00 0.00 H 0 +HETATM13119 O HOH A4266 36.030 17.911 15.150 1.00 0.00 O 0 +HETATM13120 H1 HOH A4266 35.639 18.780 15.037 1.00 0.00 H 0 +HETATM13121 H2 HOH A4266 36.215 17.914 16.092 1.00 0.00 H 0 +HETATM13122 O HOH A4267 13.255 12.193 7.983 1.00 0.00 O 0 +HETATM13123 H1 HOH A4267 13.896 12.762 7.587 1.00 0.00 H 0 +HETATM13124 H2 HOH A4267 13.489 11.935 8.864 1.00 0.00 H 0 +HETATM13125 O HOH A4268 19.971 1.181 27.996 1.00 0.00 O 0 +HETATM13126 H1 HOH A4268 19.172 1.713 28.212 1.00 0.00 H 0 +HETATM13127 H2 HOH A4268 20.224 0.774 28.799 1.00 0.00 H 0 +HETATM13128 O HOH A4269 40.718 29.222 48.319 1.00 0.00 O 0 +HETATM13129 H1 HOH A4269 41.545 29.157 48.804 1.00 0.00 H 0 +HETATM13130 H2 HOH A4269 40.237 28.597 48.819 1.00 0.00 H 0 +HETATM13131 O HOH A4270 25.997 4.421 33.151 1.00 0.00 O 0 +HETATM13132 H1 HOH A4270 26.311 4.731 33.971 1.00 0.00 H 0 +HETATM13133 H2 HOH A4270 26.775 4.036 32.732 1.00 0.00 H 0 +HETATM13134 O HOH A4271 24.924 34.162 37.256 1.00 0.00 O 0 +HETATM13135 H1 HOH A4271 25.880 34.347 37.123 1.00 0.00 H 0 +HETATM13136 H2 HOH A4271 24.857 33.225 37.344 1.00 0.00 H 0 +HETATM13137 O HOH A4272 13.622 28.979 11.742 1.00 0.00 O 0 +HETATM13138 H1 HOH A4272 13.946 29.933 11.625 1.00 0.00 H 0 +HETATM13139 H2 HOH A4272 14.339 28.381 11.470 1.00 0.00 H 0 +HETATM13140 O HOH A4273 48.595 31.476 7.452 1.00 0.00 O 0 +HETATM13141 H1 HOH A4273 47.724 31.042 7.080 1.00 0.00 H 0 +HETATM13142 H2 HOH A4273 49.013 32.085 6.840 1.00 0.00 H 0 +HETATM13143 O HOH A4274 40.829 6.615 23.034 1.00 0.00 O 0 +HETATM13144 H1 HOH A4274 40.797 7.129 22.249 1.00 0.00 H 0 +HETATM13145 H2 HOH A4274 40.003 6.779 23.540 1.00 0.00 H 0 +HETATM13146 O HOH A4275 28.113 46.595 18.198 1.00 0.00 O 0 +HETATM13147 H1 HOH A4275 27.562 47.319 17.789 1.00 0.00 H 0 +HETATM13148 H2 HOH A4275 27.818 46.436 19.067 1.00 0.00 H 0 +HETATM13149 O HOH A4276 18.955 34.950 1.899 1.00 0.00 O 0 +HETATM13150 H1 HOH A4276 18.746 34.647 1.004 1.00 0.00 H 0 +HETATM13151 H2 HOH A4276 18.992 34.154 2.507 1.00 0.00 H 0 +HETATM13152 O HOH A4277 22.755 21.331 39.288 1.00 0.00 O 0 +HETATM13153 H1 HOH A4277 22.388 22.033 38.741 1.00 0.00 H 0 +HETATM13154 H2 HOH A4277 23.769 21.392 39.137 1.00 0.00 H 0 +HETATM13155 O HOH A4278 37.509 28.654 13.914 1.00 0.00 O 0 +HETATM13156 H1 HOH A4278 38.311 28.310 14.371 1.00 0.00 H 0 +HETATM13157 H2 HOH A4278 37.210 29.484 14.312 1.00 0.00 H 0 +HETATM13158 O HOH A4279 12.647 51.739 22.775 1.00 0.00 O 0 +HETATM13159 H1 HOH A4279 13.397 52.281 22.997 1.00 0.00 H 0 +HETATM13160 H2 HOH A4279 12.979 50.783 22.824 1.00 0.00 H 0 +HETATM13161 O HOH A4280 30.813 16.168 17.424 1.00 0.00 O 0 +HETATM13162 H1 HOH A4280 30.154 16.064 16.701 1.00 0.00 H 0 +HETATM13163 H2 HOH A4280 31.652 16.058 16.884 1.00 0.00 H 0 +HETATM13164 O HOH A4281 12.095 22.119 51.048 1.00 0.00 O 0 +HETATM13165 H1 HOH A4281 11.656 21.926 51.892 1.00 0.00 H 0 +HETATM13166 H2 HOH A4281 12.382 21.224 50.668 1.00 0.00 H 0 +HETATM13167 O HOH A4282 47.944 50.037 3.294 1.00 0.00 O 0 +HETATM13168 H1 HOH A4282 48.677 50.694 3.070 1.00 0.00 H 0 +HETATM13169 H2 HOH A4282 47.809 50.238 4.308 1.00 0.00 H 0 +HETATM13170 O HOH A4283 9.283 44.503 37.866 1.00 0.00 O 0 +HETATM13171 H1 HOH A4283 9.105 45.145 37.159 1.00 0.00 H 0 +HETATM13172 H2 HOH A4283 9.007 43.668 37.617 1.00 0.00 H 0 +HETATM13173 O HOH A4284 37.560 15.144 51.946 1.00 0.00 O 0 +HETATM13174 H1 HOH A4284 38.262 14.586 52.066 1.00 0.00 H 0 +HETATM13175 H2 HOH A4284 37.506 15.821 52.602 1.00 0.00 H 0 +HETATM13176 O HOH A4285 20.349 0.654 16.586 1.00 0.00 O 0 +HETATM13177 H1 HOH A4285 20.262 1.312 17.286 1.00 0.00 H 0 +HETATM13178 H2 HOH A4285 20.872 1.143 15.929 1.00 0.00 H 0 +HETATM13179 O HOH A4286 37.845 48.480 45.390 1.00 0.00 O 0 +HETATM13180 H1 HOH A4286 38.666 49.029 45.276 1.00 0.00 H 0 +HETATM13181 H2 HOH A4286 37.397 48.724 46.241 1.00 0.00 H 0 +HETATM13182 O HOH A4287 1.638 16.265 24.154 1.00 0.00 O 0 +HETATM13183 H1 HOH A4287 2.554 16.030 24.092 1.00 0.00 H 0 +HETATM13184 H2 HOH A4287 1.608 17.195 23.894 1.00 0.00 H 0 +HETATM13185 O HOH A4288 25.076 38.744 45.534 1.00 0.00 O 0 +HETATM13186 H1 HOH A4288 25.186 39.293 46.318 1.00 0.00 H 0 +HETATM13187 H2 HOH A4288 24.094 38.819 45.352 1.00 0.00 H 0 +HETATM13188 O HOH A4289 41.948 38.141 34.589 1.00 0.00 O 0 +HETATM13189 H1 HOH A4289 41.350 38.399 33.885 1.00 0.00 H 0 +HETATM13190 H2 HOH A4289 42.657 37.605 34.197 1.00 0.00 H 0 +HETATM13191 O HOH A4290 0.393 9.982 52.645 1.00 0.00 O 0 +HETATM13192 H1 HOH A4290 -0.385 9.428 52.851 1.00 0.00 H 0 +HETATM13193 H2 HOH A4290 0.651 9.749 51.752 1.00 0.00 H 0 +HETATM13194 O HOH A4291 20.226 42.548 43.840 1.00 0.00 O 0 +HETATM13195 H1 HOH A4291 21.105 42.310 44.130 1.00 0.00 H 0 +HETATM13196 H2 HOH A4291 19.843 43.046 44.573 1.00 0.00 H 0 +HETATM13197 O HOH A4292 35.934 14.238 11.580 1.00 0.00 O 0 +HETATM13198 H1 HOH A4292 35.628 14.651 12.396 1.00 0.00 H 0 +HETATM13199 H2 HOH A4292 35.522 14.613 10.861 1.00 0.00 H 0 +HETATM13200 O HOH A4293 42.373 33.312 5.053 1.00 0.00 O 0 +HETATM13201 H1 HOH A4293 42.645 32.461 4.576 1.00 0.00 H 0 +HETATM13202 H2 HOH A4293 42.904 33.886 4.570 1.00 0.00 H 0 +HETATM13203 O HOH A4294 43.713 26.826 51.651 1.00 0.00 O 0 +HETATM13204 H1 HOH A4294 43.478 26.303 50.870 1.00 0.00 H 0 +HETATM13205 H2 HOH A4294 44.668 26.742 51.674 1.00 0.00 H 0 +HETATM13206 O HOH A4295 20.677 38.803 41.036 1.00 0.00 O 0 +HETATM13207 H1 HOH A4295 20.406 39.402 40.356 1.00 0.00 H 0 +HETATM13208 H2 HOH A4295 21.582 39.078 41.215 1.00 0.00 H 0 +HETATM13209 O HOH A4296 23.149 7.107 33.395 1.00 0.00 O 0 +HETATM13210 H1 HOH A4296 22.343 7.482 33.010 1.00 0.00 H 0 +HETATM13211 H2 HOH A4296 22.900 6.246 33.802 1.00 0.00 H 0 +HETATM13212 O HOH A4297 9.185 5.944 42.447 1.00 0.00 O 0 +HETATM13213 H1 HOH A4297 8.721 5.509 43.221 1.00 0.00 H 0 +HETATM13214 H2 HOH A4297 9.270 5.219 41.748 1.00 0.00 H 0 +HETATM13215 O HOH A4298 17.001 30.572 48.229 1.00 0.00 O 0 +HETATM13216 H1 HOH A4298 17.290 29.844 47.668 1.00 0.00 H 0 +HETATM13217 H2 HOH A4298 17.805 30.643 48.731 1.00 0.00 H 0 +HETATM13218 O HOH A4299 40.569 12.017 28.951 1.00 0.00 O 0 +HETATM13219 H1 HOH A4299 40.833 12.052 28.031 1.00 0.00 H 0 +HETATM13220 H2 HOH A4299 40.362 12.914 29.264 1.00 0.00 H 0 +HETATM13221 O HOH A4300 48.125 45.185 6.539 1.00 0.00 O 0 +HETATM13222 H1 HOH A4300 48.323 45.317 5.597 1.00 0.00 H 0 +HETATM13223 H2 HOH A4300 48.724 45.798 7.002 1.00 0.00 H 0 +HETATM13224 O HOH A4301 39.910 44.860 11.777 1.00 0.00 O 0 +HETATM13225 H1 HOH A4301 40.203 44.175 12.467 1.00 0.00 H 0 +HETATM13226 H2 HOH A4301 40.653 45.422 11.627 1.00 0.00 H 0 +HETATM13227 O HOH A4302 53.232 22.704 7.226 1.00 0.00 O 0 +HETATM13228 H1 HOH A4302 53.183 23.297 7.991 1.00 0.00 H 0 +HETATM13229 H2 HOH A4302 54.060 22.184 7.296 1.00 0.00 H 0 +HETATM13230 O HOH A4303 13.067 40.894 13.122 1.00 0.00 O 0 +HETATM13231 H1 HOH A4303 13.874 41.372 12.777 1.00 0.00 H 0 +HETATM13232 H2 HOH A4303 12.722 41.357 13.869 1.00 0.00 H 0 +HETATM13233 O HOH A4304 7.749 9.694 30.480 1.00 0.00 O 0 +HETATM13234 H1 HOH A4304 7.781 9.904 29.535 1.00 0.00 H 0 +HETATM13235 H2 HOH A4304 7.841 10.536 30.941 1.00 0.00 H 0 +HETATM13236 O HOH A4305 26.475 33.275 44.577 1.00 0.00 O 0 +HETATM13237 H1 HOH A4305 27.054 33.968 44.949 1.00 0.00 H 0 +HETATM13238 H2 HOH A4305 26.667 33.223 43.637 1.00 0.00 H 0 +HETATM13239 O HOH A4306 42.259 9.673 17.999 1.00 0.00 O 0 +HETATM13240 H1 HOH A4306 42.887 9.880 17.367 1.00 0.00 H 0 +HETATM13241 H2 HOH A4306 42.086 8.728 17.918 1.00 0.00 H 0 +HETATM13242 O HOH A4307 7.048 41.392 48.453 1.00 0.00 O 0 +HETATM13243 H1 HOH A4307 7.985 41.636 48.253 1.00 0.00 H 0 +HETATM13244 H2 HOH A4307 7.040 41.843 49.328 1.00 0.00 H 0 +HETATM13245 O HOH A4308 28.966 6.170 8.316 1.00 0.00 O 0 +HETATM13246 H1 HOH A4308 28.130 5.822 8.096 1.00 0.00 H 0 +HETATM13247 H2 HOH A4308 29.392 6.139 7.446 1.00 0.00 H 0 +HETATM13248 O HOH A4309 11.497 49.731 1.867 1.00 0.00 O 0 +HETATM13249 H1 HOH A4309 11.575 48.940 2.478 1.00 0.00 H 0 +HETATM13250 H2 HOH A4309 12.051 50.462 2.281 1.00 0.00 H 0 +HETATM13251 O HOH A4310 30.006 21.211 20.613 1.00 0.00 O 0 +HETATM13252 H1 HOH A4310 29.848 22.044 21.026 1.00 0.00 H 0 +HETATM13253 H2 HOH A4310 29.110 20.803 20.473 1.00 0.00 H 0 +HETATM13254 O HOH A4311 46.219 48.773 9.064 1.00 0.00 O 0 +HETATM13255 H1 HOH A4311 46.983 49.404 9.096 1.00 0.00 H 0 +HETATM13256 H2 HOH A4311 46.364 48.120 9.702 1.00 0.00 H 0 +HETATM13257 O HOH A4312 23.956 9.146 0.668 1.00 0.00 O 0 +HETATM13258 H1 HOH A4312 24.275 10.019 0.816 1.00 0.00 H 0 +HETATM13259 H2 HOH A4312 24.724 8.684 0.246 1.00 0.00 H 0 +HETATM13260 O HOH A4313 43.879 7.279 9.674 1.00 0.00 O 0 +HETATM13261 H1 HOH A4313 43.021 7.160 9.231 1.00 0.00 H 0 +HETATM13262 H2 HOH A4313 44.618 7.568 9.008 1.00 0.00 H 0 +HETATM13263 O HOH A4314 26.749 44.701 16.987 1.00 0.00 O 0 +HETATM13264 H1 HOH A4314 26.699 44.053 17.689 1.00 0.00 H 0 +HETATM13265 H2 HOH A4314 27.395 45.296 17.364 1.00 0.00 H 0 +HETATM13266 O HOH A4315 27.313 23.038 39.242 1.00 0.00 O 0 +HETATM13267 H1 HOH A4315 26.814 22.288 39.495 1.00 0.00 H 0 +HETATM13268 H2 HOH A4315 26.671 23.655 38.810 1.00 0.00 H 0 +HETATM13269 O HOH A4316 4.631 42.361 11.712 1.00 0.00 O 0 +HETATM13270 H1 HOH A4316 4.327 41.450 11.766 1.00 0.00 H 0 +HETATM13271 H2 HOH A4316 3.999 42.794 11.054 1.00 0.00 H 0 +HETATM13272 O HOH A4317 41.281 46.751 1.424 1.00 0.00 O 0 +HETATM13273 H1 HOH A4317 41.853 46.991 0.686 1.00 0.00 H 0 +HETATM13274 H2 HOH A4317 41.200 47.473 2.040 1.00 0.00 H 0 +HETATM13275 O HOH A4318 20.775 9.960 36.330 1.00 0.00 O 0 +HETATM13276 H1 HOH A4318 19.891 10.200 36.032 1.00 0.00 H 0 +HETATM13277 H2 HOH A4318 20.930 9.122 35.925 1.00 0.00 H 0 +HETATM13278 O HOH A4319 43.097 52.133 48.022 1.00 0.00 O 0 +HETATM13279 H1 HOH A4319 43.053 51.202 47.694 1.00 0.00 H 0 +HETATM13280 H2 HOH A4319 43.555 52.715 47.373 1.00 0.00 H 0 +HETATM13281 O HOH A4320 13.383 16.170 34.447 1.00 0.00 O 0 +HETATM13282 H1 HOH A4320 13.584 17.040 34.124 1.00 0.00 H 0 +HETATM13283 H2 HOH A4320 13.457 16.146 35.411 1.00 0.00 H 0 +HETATM13284 O HOH A4321 51.120 8.295 44.635 1.00 0.00 O 0 +HETATM13285 H1 HOH A4321 51.054 7.839 43.731 1.00 0.00 H 0 +HETATM13286 H2 HOH A4321 50.834 7.620 45.247 1.00 0.00 H 0 +HETATM13287 O HOH A4322 2.550 34.530 7.995 1.00 0.00 O 0 +HETATM13288 H1 HOH A4322 2.542 33.538 7.973 1.00 0.00 H 0 +HETATM13289 H2 HOH A4322 2.063 34.822 8.749 1.00 0.00 H 0 +HETATM13290 O HOH A4323 28.774 13.228 47.682 1.00 0.00 O 0 +HETATM13291 H1 HOH A4323 27.818 13.418 47.711 1.00 0.00 H 0 +HETATM13292 H2 HOH A4323 29.078 13.261 48.600 1.00 0.00 H 0 +HETATM13293 O HOH A4324 49.659 9.690 22.912 1.00 0.00 O 0 +HETATM13294 H1 HOH A4324 48.596 9.449 23.028 1.00 0.00 H 0 +HETATM13295 H2 HOH A4324 50.070 8.821 22.599 1.00 0.00 H 0 +HETATM13296 O HOH A4325 41.631 15.932 53.261 1.00 0.00 O 0 +HETATM13297 H1 HOH A4325 41.688 16.842 52.869 1.00 0.00 H 0 +HETATM13298 H2 HOH A4325 42.295 15.409 52.776 1.00 0.00 H 0 +HETATM13299 O HOH A4326 2.975 37.502 51.991 1.00 0.00 O 0 +HETATM13300 H1 HOH A4326 3.788 37.304 52.449 1.00 0.00 H 0 +HETATM13301 H2 HOH A4326 2.450 38.183 52.440 1.00 0.00 H 0 +HETATM13302 O HOH A4327 9.995 31.588 34.233 1.00 0.00 O 0 +HETATM13303 H1 HOH A4327 10.172 32.427 33.846 1.00 0.00 H 0 +HETATM13304 H2 HOH A4327 10.362 31.683 35.069 1.00 0.00 H 0 +HETATM13305 O HOH A4328 43.638 18.036 40.412 1.00 0.00 O 0 +HETATM13306 H1 HOH A4328 43.663 17.538 39.611 1.00 0.00 H 0 +HETATM13307 H2 HOH A4328 43.950 18.899 40.080 1.00 0.00 H 0 +HETATM13308 O HOH A4329 46.937 32.898 29.243 1.00 0.00 O 0 +HETATM13309 H1 HOH A4329 46.187 32.607 29.734 1.00 0.00 H 0 +HETATM13310 H2 HOH A4329 47.462 32.089 29.044 1.00 0.00 H 0 +HETATM13311 O HOH A4330 29.063 10.302 14.968 1.00 0.00 O 0 +HETATM13312 H1 HOH A4330 28.217 10.133 14.516 1.00 0.00 H 0 +HETATM13313 H2 HOH A4330 29.313 11.206 14.970 1.00 0.00 H 0 +HETATM13314 O HOH A4331 46.035 13.335 51.348 1.00 0.00 O 0 +HETATM13315 H1 HOH A4331 46.197 13.316 50.358 1.00 0.00 H 0 +HETATM13316 H2 HOH A4331 46.737 13.808 51.824 1.00 0.00 H 0 +HETATM13317 O HOH A4332 20.686 44.194 31.553 1.00 0.00 O 0 +HETATM13318 H1 HOH A4332 21.614 43.862 31.544 1.00 0.00 H 0 +HETATM13319 H2 HOH A4332 20.376 43.841 30.693 1.00 0.00 H 0 +HETATM13320 O HOH A4333 19.935 33.154 10.256 1.00 0.00 O 0 +HETATM13321 H1 HOH A4333 20.741 32.699 10.293 1.00 0.00 H 0 +HETATM13322 H2 HOH A4333 19.437 32.903 9.405 1.00 0.00 H 0 +HETATM13323 O HOH A4334 20.843 46.008 40.351 1.00 0.00 O 0 +HETATM13324 H1 HOH A4334 20.871 45.431 41.106 1.00 0.00 H 0 +HETATM13325 H2 HOH A4334 21.587 46.612 40.414 1.00 0.00 H 0 +HETATM13326 O HOH A4335 29.452 49.687 53.093 1.00 0.00 O 0 +HETATM13327 H1 HOH A4335 29.707 48.840 53.344 1.00 0.00 H 0 +HETATM13328 H2 HOH A4335 29.507 49.783 52.159 1.00 0.00 H 0 +HETATM13329 O HOH A4336 13.505 48.880 31.241 1.00 0.00 O 0 +HETATM13330 H1 HOH A4336 13.413 49.517 31.896 1.00 0.00 H 0 +HETATM13331 H2 HOH A4336 13.074 49.267 30.460 1.00 0.00 H 0 +HETATM13332 O HOH A4337 15.080 26.543 5.042 1.00 0.00 O 0 +HETATM13333 H1 HOH A4337 15.218 27.475 5.151 1.00 0.00 H 0 +HETATM13334 H2 HOH A4337 14.208 26.489 4.608 1.00 0.00 H 0 +HETATM13335 O HOH A4338 10.374 44.053 30.774 1.00 0.00 O 0 +HETATM13336 H1 HOH A4338 9.520 44.141 30.192 1.00 0.00 H 0 +HETATM13337 H2 HOH A4338 10.174 44.500 31.560 1.00 0.00 H 0 +HETATM13338 O HOH A4339 20.790 21.300 9.853 1.00 0.00 O 0 +HETATM13339 H1 HOH A4339 20.734 21.382 8.878 1.00 0.00 H 0 +HETATM13340 H2 HOH A4339 20.307 22.045 10.255 1.00 0.00 H 0 +HETATM13341 O HOH A4340 37.526 37.128 29.127 1.00 0.00 O 0 +HETATM13342 H1 HOH A4340 38.320 37.734 28.947 1.00 0.00 H 0 +HETATM13343 H2 HOH A4340 37.568 36.339 28.601 1.00 0.00 H 0 +HETATM13344 O HOH A4341 28.775 36.346 52.540 1.00 0.00 O 0 +HETATM13345 H1 HOH A4341 27.948 36.655 52.958 1.00 0.00 H 0 +HETATM13346 H2 HOH A4341 29.290 37.141 52.299 1.00 0.00 H 0 +HETATM13347 O HOH A4342 10.703 49.852 11.025 1.00 0.00 O 0 +HETATM13348 H1 HOH A4342 11.394 50.476 11.323 1.00 0.00 H 0 +HETATM13349 H2 HOH A4342 10.195 50.248 10.305 1.00 0.00 H 0 +HETATM13350 O HOH A4343 1.650 45.877 46.009 1.00 0.00 O 0 +HETATM13351 H1 HOH A4343 1.015 46.641 45.930 1.00 0.00 H 0 +HETATM13352 H2 HOH A4343 1.915 45.531 45.159 1.00 0.00 H 0 +HETATM13353 O HOH A4344 18.875 51.734 1.056 1.00 0.00 O 0 +HETATM13354 H1 HOH A4344 18.570 52.482 0.465 1.00 0.00 H 0 +HETATM13355 H2 HOH A4344 18.849 52.162 1.933 1.00 0.00 H 0 +HETATM13356 O HOH A4345 20.501 39.803 7.605 1.00 0.00 O 0 +HETATM13357 H1 HOH A4345 21.114 39.877 8.331 1.00 0.00 H 0 +HETATM13358 H2 HOH A4345 19.675 40.293 7.867 1.00 0.00 H 0 +HETATM13359 O HOH A4346 10.085 21.941 21.402 1.00 0.00 O 0 +HETATM13360 H1 HOH A4346 10.015 22.540 20.621 1.00 0.00 H 0 +HETATM13361 H2 HOH A4346 10.960 22.128 21.840 1.00 0.00 H 0 +HETATM13362 O HOH A4347 7.310 15.071 31.619 1.00 0.00 O 0 +HETATM13363 H1 HOH A4347 6.806 15.334 32.410 1.00 0.00 H 0 +HETATM13364 H2 HOH A4347 8.031 15.737 31.704 1.00 0.00 H 0 +HETATM13365 O HOH A4348 38.599 1.705 25.652 1.00 0.00 O 0 +HETATM13366 H1 HOH A4348 38.701 0.823 25.805 1.00 0.00 H 0 +HETATM13367 H2 HOH A4348 38.169 1.793 24.779 1.00 0.00 H 0 +HETATM13368 O HOH A4349 4.594 37.441 30.778 1.00 0.00 O 0 +HETATM13369 H1 HOH A4349 4.239 36.954 31.566 1.00 0.00 H 0 +HETATM13370 H2 HOH A4349 5.526 37.600 30.978 1.00 0.00 H 0 +HETATM13371 O HOH A4350 12.713 31.394 0.337 1.00 0.00 O 0 +HETATM13372 H1 HOH A4350 12.866 30.649 0.863 1.00 0.00 H 0 +HETATM13373 H2 HOH A4350 13.092 32.206 0.746 1.00 0.00 H 0 +HETATM13374 O HOH A4351 18.243 9.251 9.736 1.00 0.00 O 0 +HETATM13375 H1 HOH A4351 18.747 8.835 9.104 1.00 0.00 H 0 +HETATM13376 H2 HOH A4351 17.412 9.596 9.324 1.00 0.00 H 0 +HETATM13377 O HOH A4352 16.212 34.906 28.119 1.00 0.00 O 0 +HETATM13378 H1 HOH A4352 16.138 35.360 28.971 1.00 0.00 H 0 +HETATM13379 H2 HOH A4352 16.954 34.350 28.303 1.00 0.00 H 0 +HETATM13380 O HOH A4353 12.978 4.690 16.518 1.00 0.00 O 0 +HETATM13381 H1 HOH A4353 12.413 5.176 15.941 1.00 0.00 H 0 +HETATM13382 H2 HOH A4353 12.444 3.913 16.800 1.00 0.00 H 0 +HETATM13383 O HOH A4354 43.381 22.832 49.769 1.00 0.00 O 0 +HETATM13384 H1 HOH A4354 42.758 23.532 49.613 1.00 0.00 H 0 +HETATM13385 H2 HOH A4354 43.451 22.694 50.744 1.00 0.00 H 0 +HETATM13386 O HOH A4355 37.193 16.982 28.913 1.00 0.00 O 0 +HETATM13387 H1 HOH A4355 36.591 17.686 28.644 1.00 0.00 H 0 +HETATM13388 H2 HOH A4355 37.865 16.929 28.248 1.00 0.00 H 0 +HETATM13389 O HOH A4356 40.987 2.489 3.533 1.00 0.00 O 0 +HETATM13390 H1 HOH A4356 41.480 2.309 4.335 1.00 0.00 H 0 +HETATM13391 H2 HOH A4356 41.655 2.306 2.896 1.00 0.00 H 0 +HETATM13392 O HOH A4357 48.961 20.118 36.105 1.00 0.00 O 0 +HETATM13393 H1 HOH A4357 49.017 21.061 36.367 1.00 0.00 H 0 +HETATM13394 H2 HOH A4357 49.665 19.651 36.641 1.00 0.00 H 0 +HETATM13395 O HOH A4358 30.341 28.061 5.473 1.00 0.00 O 0 +HETATM13396 H1 HOH A4358 31.110 27.745 4.915 1.00 0.00 H 0 +HETATM13397 H2 HOH A4358 29.607 28.400 4.938 1.00 0.00 H 0 +HETATM13398 O HOH A4359 2.758 49.831 36.340 1.00 0.00 O 0 +HETATM13399 H1 HOH A4359 2.992 50.444 35.652 1.00 0.00 H 0 +HETATM13400 H2 HOH A4359 3.563 49.680 36.853 1.00 0.00 H 0 +HETATM13401 O HOH A4360 31.276 22.024 0.400 1.00 0.00 O 0 +HETATM13402 H1 HOH A4360 31.400 22.060 -0.558 1.00 0.00 H 0 +HETATM13403 H2 HOH A4360 31.064 21.098 0.644 1.00 0.00 H 0 +HETATM13404 O HOH A4361 49.417 29.506 36.964 1.00 0.00 O 0 +HETATM13405 H1 HOH A4361 50.150 29.877 36.490 1.00 0.00 H 0 +HETATM13406 H2 HOH A4361 48.845 29.042 36.287 1.00 0.00 H 0 +HETATM13407 O HOH A4362 25.976 38.462 16.585 1.00 0.00 O 0 +HETATM13408 H1 HOH A4362 26.054 38.930 15.716 1.00 0.00 H 0 +HETATM13409 H2 HOH A4362 26.215 37.531 16.427 1.00 0.00 H 0 +HETATM13410 O HOH A4363 2.102 41.356 3.625 1.00 0.00 O 0 +HETATM13411 H1 HOH A4363 1.192 41.401 3.623 1.00 0.00 H 0 +HETATM13412 H2 HOH A4363 2.335 40.812 2.866 1.00 0.00 H 0 +HETATM13413 O HOH A4364 51.414 18.987 36.993 1.00 0.00 O 0 +HETATM13414 H1 HOH A4364 51.722 19.211 37.903 1.00 0.00 H 0 +HETATM13415 H2 HOH A4364 51.455 18.001 36.835 1.00 0.00 H 0 +HETATM13416 O HOH A4365 0.417 20.599 18.180 1.00 0.00 O 0 +HETATM13417 H1 HOH A4365 1.278 20.402 18.607 1.00 0.00 H 0 +HETATM13418 H2 HOH A4365 0.076 21.401 18.589 1.00 0.00 H 0 +HETATM13419 O HOH A4366 31.746 3.988 14.169 1.00 0.00 O 0 +HETATM13420 H1 HOH A4366 31.307 4.013 13.311 1.00 0.00 H 0 +HETATM13421 H2 HOH A4366 31.332 4.745 14.550 1.00 0.00 H 0 +HETATM13422 O HOH A4367 52.356 29.910 40.515 1.00 0.00 O 0 +HETATM13423 H1 HOH A4367 51.659 29.330 40.369 1.00 0.00 H 0 +HETATM13424 H2 HOH A4367 52.093 30.291 41.339 1.00 0.00 H 0 +HETATM13425 O HOH A4368 34.900 2.821 35.915 1.00 0.00 O 0 +HETATM13426 H1 HOH A4368 34.455 3.733 36.063 1.00 0.00 H 0 +HETATM13427 H2 HOH A4368 35.136 2.450 36.777 1.00 0.00 H 0 +HETATM13428 O HOH A4369 32.986 22.543 15.012 1.00 0.00 O 0 +HETATM13429 H1 HOH A4369 32.689 22.920 15.800 1.00 0.00 H 0 +HETATM13430 H2 HOH A4369 32.340 22.738 14.399 1.00 0.00 H 0 +HETATM13431 O HOH A4370 50.584 4.452 22.421 1.00 0.00 O 0 +HETATM13432 H1 HOH A4370 50.361 4.336 23.361 1.00 0.00 H 0 +HETATM13433 H2 HOH A4370 49.874 4.032 22.005 1.00 0.00 H 0 +HETATM13434 O HOH A4371 49.767 36.533 12.828 1.00 0.00 O 0 +HETATM13435 H1 HOH A4371 50.403 36.809 13.487 1.00 0.00 H 0 +HETATM13436 H2 HOH A4371 49.631 37.323 12.303 1.00 0.00 H 0 +HETATM13437 O HOH A4372 18.421 52.004 31.438 1.00 0.00 O 0 +HETATM13438 H1 HOH A4372 17.483 52.225 31.427 1.00 0.00 H 0 +HETATM13439 H2 HOH A4372 18.851 52.559 30.795 1.00 0.00 H 0 +HETATM13440 O HOH A4373 46.576 47.000 15.711 1.00 0.00 O 0 +HETATM13441 H1 HOH A4373 46.416 47.954 15.731 1.00 0.00 H 0 +HETATM13442 H2 HOH A4373 45.672 46.583 15.574 1.00 0.00 H 0 +HETATM13443 O HOH A4374 6.414 30.678 0.739 1.00 0.00 O 0 +HETATM13444 H1 HOH A4374 6.463 29.729 0.502 1.00 0.00 H 0 +HETATM13445 H2 HOH A4374 6.440 31.267 -0.073 1.00 0.00 H 0 +HETATM13446 O HOH A4375 41.965 6.937 17.917 1.00 0.00 O 0 +HETATM13447 H1 HOH A4375 41.139 6.515 17.965 1.00 0.00 H 0 +HETATM13448 H2 HOH A4375 42.446 6.307 17.354 1.00 0.00 H 0 +HETATM13449 O HOH A4376 42.063 51.177 34.701 1.00 0.00 O 0 +HETATM13450 H1 HOH A4376 42.733 51.606 34.171 1.00 0.00 H 0 +HETATM13451 H2 HOH A4376 41.947 51.861 35.444 1.00 0.00 H 0 +HETATM13452 O HOH A4377 38.903 25.061 16.030 1.00 0.00 O 0 +HETATM13453 H1 HOH A4377 38.509 25.453 15.171 1.00 0.00 H 0 +HETATM13454 H2 HOH A4377 39.598 24.464 15.710 1.00 0.00 H 0 +HETATM13455 O HOH A4378 33.792 49.044 23.478 1.00 0.00 O 0 +HETATM13456 H1 HOH A4378 33.184 49.543 22.933 1.00 0.00 H 0 +HETATM13457 H2 HOH A4378 34.438 49.693 23.744 1.00 0.00 H 0 +HETATM13458 O HOH A4379 33.243 10.606 29.654 1.00 0.00 O 0 +HETATM13459 H1 HOH A4379 33.829 11.370 29.442 1.00 0.00 H 0 +HETATM13460 H2 HOH A4379 32.450 10.820 29.088 1.00 0.00 H 0 +HETATM13461 O HOH A4380 7.212 12.177 21.976 1.00 0.00 O 0 +HETATM13462 H1 HOH A4380 8.081 12.376 21.589 1.00 0.00 H 0 +HETATM13463 H2 HOH A4380 7.084 11.540 22.728 1.00 0.00 H 0 +HETATM13464 O HOH A4381 40.520 20.972 17.075 1.00 0.00 O 0 +HETATM13465 H1 HOH A4381 39.641 21.139 16.696 1.00 0.00 H 0 +HETATM13466 H2 HOH A4381 41.181 21.051 16.344 1.00 0.00 H 0 +HETATM13467 O HOH A4382 15.306 41.994 11.722 1.00 0.00 O 0 +HETATM13468 H1 HOH A4382 16.178 41.513 11.914 1.00 0.00 H 0 +HETATM13469 H2 HOH A4382 14.960 41.535 10.901 1.00 0.00 H 0 +HETATM13470 O HOH A4383 53.951 21.326 27.554 1.00 0.00 O 0 +HETATM13471 H1 HOH A4383 53.006 21.372 27.290 1.00 0.00 H 0 +HETATM13472 H2 HOH A4383 54.000 20.575 28.191 1.00 0.00 H 0 +HETATM13473 O HOH A4384 11.776 43.439 20.044 1.00 0.00 O 0 +HETATM13474 H1 HOH A4384 11.550 42.929 19.228 1.00 0.00 H 0 +HETATM13475 H2 HOH A4384 12.306 42.795 20.554 1.00 0.00 H 0 +HETATM13476 O HOH A4385 16.803 49.814 47.189 1.00 0.00 O 0 +HETATM13477 H1 HOH A4385 16.807 50.438 46.424 1.00 0.00 H 0 +HETATM13478 H2 HOH A4385 15.885 49.670 47.396 1.00 0.00 H 0 +HETATM13479 O HOH A4386 23.016 27.876 8.480 1.00 0.00 O 0 +HETATM13480 H1 HOH A4386 23.527 27.183 8.957 1.00 0.00 H 0 +HETATM13481 H2 HOH A4386 23.029 28.487 9.180 1.00 0.00 H 0 +HETATM13482 O HOH A4387 34.817 32.911 9.465 1.00 0.00 O 0 +HETATM13483 H1 HOH A4387 35.168 32.488 10.301 1.00 0.00 H 0 +HETATM13484 H2 HOH A4387 33.957 33.284 9.756 1.00 0.00 H 0 +HETATM13485 O HOH A4388 7.853 29.534 20.795 1.00 0.00 O 0 +HETATM13486 H1 HOH A4388 8.524 30.024 21.280 1.00 0.00 H 0 +HETATM13487 H2 HOH A4388 7.387 29.138 21.511 1.00 0.00 H 0 +HETATM13488 O HOH A4389 12.903 36.315 35.928 1.00 0.00 O 0 +HETATM13489 H1 HOH A4389 13.654 36.314 35.327 1.00 0.00 H 0 +HETATM13490 H2 HOH A4389 12.902 35.390 36.317 1.00 0.00 H 0 +HETATM13491 O HOH A4390 4.301 17.881 14.685 1.00 0.00 O 0 +HETATM13492 H1 HOH A4390 3.949 18.046 13.789 1.00 0.00 H 0 +HETATM13493 H2 HOH A4390 3.598 17.717 15.271 1.00 0.00 H 0 +HETATM13494 O HOH A4391 25.091 20.334 13.887 1.00 0.00 O 0 +HETATM13495 H1 HOH A4391 25.181 21.201 13.534 1.00 0.00 H 0 +HETATM13496 H2 HOH A4391 24.236 20.061 13.611 1.00 0.00 H 0 +HETATM13497 O HOH A4392 38.018 8.234 22.144 1.00 0.00 O 0 +HETATM13498 H1 HOH A4392 37.831 8.864 21.407 1.00 0.00 H 0 +HETATM13499 H2 HOH A4392 37.267 8.376 22.625 1.00 0.00 H 0 +HETATM13500 O HOH A4393 29.213 48.848 31.580 1.00 0.00 O 0 +HETATM13501 H1 HOH A4393 29.840 48.156 31.778 1.00 0.00 H 0 +HETATM13502 H2 HOH A4393 28.669 48.681 30.814 1.00 0.00 H 0 +HETATM13503 O HOH A4394 3.635 34.776 38.994 1.00 0.00 O 0 +HETATM13504 H1 HOH A4394 3.960 35.660 38.866 1.00 0.00 H 0 +HETATM13505 H2 HOH A4394 4.232 34.074 38.632 1.00 0.00 H 0 +HETATM13506 O HOH A4395 48.889 1.462 49.265 1.00 0.00 O 0 +HETATM13507 H1 HOH A4395 48.465 0.835 48.702 1.00 0.00 H 0 +HETATM13508 H2 HOH A4395 49.375 2.040 48.682 1.00 0.00 H 0 +HETATM13509 O HOH A4396 8.276 0.431 52.640 1.00 0.00 O 0 +HETATM13510 H1 HOH A4396 8.203 0.001 53.499 1.00 0.00 H 0 +HETATM13511 H2 HOH A4396 8.610 1.358 52.747 1.00 0.00 H 0 +HETATM13512 O HOH A4397 11.140 21.992 25.318 1.00 0.00 O 0 +HETATM13513 H1 HOH A4397 10.960 22.937 25.406 1.00 0.00 H 0 +HETATM13514 H2 HOH A4397 10.301 21.609 25.379 1.00 0.00 H 0 +HETATM13515 O HOH A4398 49.305 23.809 46.262 1.00 0.00 O 0 +HETATM13516 H1 HOH A4398 49.164 24.704 46.515 1.00 0.00 H 0 +HETATM13517 H2 HOH A4398 48.434 23.415 46.070 1.00 0.00 H 0 +HETATM13518 O HOH A4399 0.254 48.445 36.859 1.00 0.00 O 0 +HETATM13519 H1 HOH A4399 1.130 48.860 36.709 1.00 0.00 H 0 +HETATM13520 H2 HOH A4399 -0.378 49.193 36.714 1.00 0.00 H 0 +HETATM13521 O HOH A4400 29.894 26.861 16.448 1.00 0.00 O 0 +HETATM13522 H1 HOH A4400 29.639 26.138 17.089 1.00 0.00 H 0 +HETATM13523 H2 HOH A4400 28.991 26.931 16.042 1.00 0.00 H 0 +HETATM13524 O HOH A4401 15.266 32.367 45.552 1.00 0.00 O 0 +HETATM13525 H1 HOH A4401 14.879 33.292 45.348 1.00 0.00 H 0 +HETATM13526 H2 HOH A4401 14.591 31.917 46.082 1.00 0.00 H 0 +HETATM13527 O HOH A4402 12.711 38.942 42.629 1.00 0.00 O 0 +HETATM13528 H1 HOH A4402 13.293 38.956 41.894 1.00 0.00 H 0 +HETATM13529 H2 HOH A4402 13.286 39.276 43.328 1.00 0.00 H 0 +HETATM13530 O HOH A4403 7.555 40.533 14.187 1.00 0.00 O 0 +HETATM13531 H1 HOH A4403 7.982 39.807 13.734 1.00 0.00 H 0 +HETATM13532 H2 HOH A4403 7.718 41.304 13.565 1.00 0.00 H 0 +HETATM13533 O HOH A4404 23.923 45.964 24.269 1.00 0.00 O 0 +HETATM13534 H1 HOH A4404 22.916 45.899 24.467 1.00 0.00 H 0 +HETATM13535 H2 HOH A4404 24.362 45.560 24.997 1.00 0.00 H 0 +HETATM13536 O HOH A4405 19.934 52.966 21.497 1.00 0.00 O 0 +HETATM13537 H1 HOH A4405 20.681 53.214 21.024 1.00 0.00 H 0 +HETATM13538 H2 HOH A4405 19.856 52.001 21.531 1.00 0.00 H 0 +HETATM13539 O HOH A4406 35.784 21.736 47.244 1.00 0.00 O 0 +HETATM13540 H1 HOH A4406 35.017 21.222 46.862 1.00 0.00 H 0 +HETATM13541 H2 HOH A4406 35.771 22.601 46.794 1.00 0.00 H 0 +HETATM13542 O HOH A4407 23.515 9.531 8.111 1.00 0.00 O 0 +HETATM13543 H1 HOH A4407 23.455 9.222 9.038 1.00 0.00 H 0 +HETATM13544 H2 HOH A4407 23.284 10.446 8.073 1.00 0.00 H 0 +HETATM13545 O HOH A4408 25.031 7.483 26.950 1.00 0.00 O 0 +HETATM13546 H1 HOH A4408 24.510 7.372 27.735 1.00 0.00 H 0 +HETATM13547 H2 HOH A4408 25.826 7.842 27.362 1.00 0.00 H 0 +HETATM13548 O HOH A4409 46.688 0.464 26.493 1.00 0.00 O 0 +HETATM13549 H1 HOH A4409 46.386 0.211 25.624 1.00 0.00 H 0 +HETATM13550 H2 HOH A4409 47.012 -0.369 26.840 1.00 0.00 H 0 +HETATM13551 O HOH A4410 25.626 24.189 45.152 1.00 0.00 O 0 +HETATM13552 H1 HOH A4410 26.516 24.568 44.943 1.00 0.00 H 0 +HETATM13553 H2 HOH A4410 25.311 23.724 44.352 1.00 0.00 H 0 +HETATM13554 O HOH A4411 6.384 2.117 17.527 1.00 0.00 O 0 +HETATM13555 H1 HOH A4411 6.128 1.205 17.621 1.00 0.00 H 0 +HETATM13556 H2 HOH A4411 7.187 2.194 17.031 1.00 0.00 H 0 +HETATM13557 O HOH A4412 53.052 26.844 46.146 1.00 0.00 O 0 +HETATM13558 H1 HOH A4412 53.669 27.031 45.377 1.00 0.00 H 0 +HETATM13559 H2 HOH A4412 53.284 25.936 46.412 1.00 0.00 H 0 +HETATM13560 O HOH A4413 7.771 42.832 50.765 1.00 0.00 O 0 +HETATM13561 H1 HOH A4413 8.370 43.409 50.343 1.00 0.00 H 0 +HETATM13562 H2 HOH A4413 8.360 42.121 51.124 1.00 0.00 H 0 +HETATM13563 O HOH A4414 6.008 18.633 1.973 1.00 0.00 O 0 +HETATM13564 H1 HOH A4414 5.142 19.136 2.094 1.00 0.00 H 0 +HETATM13565 H2 HOH A4414 6.611 19.095 2.572 1.00 0.00 H 0 +HETATM13566 O HOH A4415 47.380 5.169 12.714 1.00 0.00 O 0 +HETATM13567 H1 HOH A4415 47.242 5.758 11.925 1.00 0.00 H 0 +HETATM13568 H2 HOH A4415 47.393 4.320 12.347 1.00 0.00 H 0 +HETATM13569 O HOH A4416 30.105 9.688 29.083 1.00 0.00 O 0 +HETATM13570 H1 HOH A4416 30.097 10.630 29.102 1.00 0.00 H 0 +HETATM13571 H2 HOH A4416 29.750 9.428 29.918 1.00 0.00 H 0 +HETATM13572 O HOH A4417 37.321 29.933 37.179 1.00 0.00 O 0 +HETATM13573 H1 HOH A4417 36.533 29.416 37.318 1.00 0.00 H 0 +HETATM13574 H2 HOH A4417 37.006 30.849 37.106 1.00 0.00 H 0 +HETATM13575 O HOH A4418 14.523 37.774 19.825 1.00 0.00 O 0 +HETATM13576 H1 HOH A4418 15.268 37.929 19.180 1.00 0.00 H 0 +HETATM13577 H2 HOH A4418 13.865 37.286 19.460 1.00 0.00 H 0 +HETATM13578 O HOH A4419 51.358 30.767 20.554 1.00 0.00 O 0 +HETATM13579 H1 HOH A4419 50.466 30.432 20.416 1.00 0.00 H 0 +HETATM13580 H2 HOH A4419 51.937 30.053 20.508 1.00 0.00 H 0 +HETATM13581 O HOH A4420 14.735 11.793 25.079 1.00 0.00 O 0 +HETATM13582 H1 HOH A4420 14.367 11.569 25.926 1.00 0.00 H 0 +HETATM13583 H2 HOH A4420 15.627 12.153 25.385 1.00 0.00 H 0 +HETATM13584 O HOH A4421 6.916 38.710 47.584 1.00 0.00 O 0 +HETATM13585 H1 HOH A4421 6.830 39.425 48.297 1.00 0.00 H 0 +HETATM13586 H2 HOH A4421 6.336 38.872 46.830 1.00 0.00 H 0 +HETATM13587 O HOH A4422 21.010 32.367 13.616 1.00 0.00 O 0 +HETATM13588 H1 HOH A4422 20.526 32.353 14.445 1.00 0.00 H 0 +HETATM13589 H2 HOH A4422 21.396 33.180 13.519 1.00 0.00 H 0 +HETATM13590 O HOH A4423 13.034 43.746 4.673 1.00 0.00 O 0 +HETATM13591 H1 HOH A4423 12.535 43.012 5.026 1.00 0.00 H 0 +HETATM13592 H2 HOH A4423 13.265 44.253 5.509 1.00 0.00 H 0 +HETATM13593 O HOH A4424 25.491 18.528 53.456 1.00 0.00 O 0 +HETATM13594 H1 HOH A4424 24.534 18.671 53.472 1.00 0.00 H 0 +HETATM13595 H2 HOH A4424 25.499 17.542 53.440 1.00 0.00 H 0 +HETATM13596 O HOH A4425 7.064 8.923 39.605 1.00 0.00 O 0 +HETATM13597 H1 HOH A4425 7.905 9.003 40.160 1.00 0.00 H 0 +HETATM13598 H2 HOH A4425 6.718 8.099 39.959 1.00 0.00 H 0 +HETATM13599 O HOH A4426 24.531 52.129 41.392 1.00 0.00 O 0 +HETATM13600 H1 HOH A4426 24.755 51.410 42.038 1.00 0.00 H 0 +HETATM13601 H2 HOH A4426 24.347 52.940 41.904 1.00 0.00 H 0 +HETATM13602 O HOH A4427 5.089 17.324 11.452 1.00 0.00 O 0 +HETATM13603 H1 HOH A4427 5.876 16.826 11.141 1.00 0.00 H 0 +HETATM13604 H2 HOH A4427 4.348 16.730 11.698 1.00 0.00 H 0 +HETATM13605 O HOH A4428 22.240 0.312 20.606 1.00 0.00 O 0 +HETATM13606 H1 HOH A4428 22.659 -0.468 20.282 1.00 0.00 H 0 +HETATM13607 H2 HOH A4428 22.836 0.896 20.187 1.00 0.00 H 0 +HETATM13608 O HOH A4429 4.749 16.328 20.964 1.00 0.00 O 0 +HETATM13609 H1 HOH A4429 4.962 15.378 21.114 1.00 0.00 H 0 +HETATM13610 H2 HOH A4429 3.941 16.259 20.466 1.00 0.00 H 0 +HETATM13611 O HOH A4430 10.330 17.903 20.191 1.00 0.00 O 0 +HETATM13612 H1 HOH A4430 9.528 17.320 20.247 1.00 0.00 H 0 +HETATM13613 H2 HOH A4430 10.490 18.253 21.097 1.00 0.00 H 0 +HETATM13614 O HOH A4431 49.357 15.773 26.690 1.00 0.00 O 0 +HETATM13615 H1 HOH A4431 48.930 14.963 26.854 1.00 0.00 H 0 +HETATM13616 H2 HOH A4431 48.841 16.138 25.925 1.00 0.00 H 0 +HETATM13617 O HOH A4432 48.719 35.278 23.852 1.00 0.00 O 0 +HETATM13618 H1 HOH A4432 49.435 36.041 23.955 1.00 0.00 H 0 +HETATM13619 H2 HOH A4432 48.144 35.434 24.560 1.00 0.00 H 0 +HETATM13620 O HOH A4433 33.495 42.166 43.774 1.00 0.00 O 0 +HETATM13621 H1 HOH A4433 34.288 42.742 43.489 1.00 0.00 H 0 +HETATM13622 H2 HOH A4433 32.786 42.688 44.216 1.00 0.00 H 0 +HETATM13623 O HOH A4434 41.722 27.358 5.970 1.00 0.00 O 0 +HETATM13624 H1 HOH A4434 40.884 27.039 5.544 1.00 0.00 H 0 +HETATM13625 H2 HOH A4434 42.122 27.922 5.280 1.00 0.00 H 0 +HETATM13626 O HOH A4435 52.646 40.480 1.301 1.00 0.00 O 0 +HETATM13627 H1 HOH A4435 52.914 40.073 2.119 1.00 0.00 H 0 +HETATM13628 H2 HOH A4435 53.354 40.336 0.621 1.00 0.00 H 0 +HETATM13629 O HOH A4436 3.228 22.838 2.606 1.00 0.00 O 0 +HETATM13630 H1 HOH A4436 3.308 21.896 2.401 1.00 0.00 H 0 +HETATM13631 H2 HOH A4436 2.710 23.375 2.006 1.00 0.00 H 0 +HETATM13632 O HOH A4437 9.386 53.243 4.609 1.00 0.00 O 0 +HETATM13633 H1 HOH A4437 10.342 53.237 4.770 1.00 0.00 H 0 +HETATM13634 H2 HOH A4437 9.053 53.903 5.177 1.00 0.00 H 0 +HETATM13635 O HOH A4438 53.657 12.527 -0.183 1.00 0.00 O 0 +HETATM13636 H1 HOH A4438 53.470 12.614 0.738 1.00 0.00 H 0 +HETATM13637 H2 HOH A4438 53.864 11.562 -0.409 1.00 0.00 H 0 +HETATM13638 O HOH A4439 0.493 47.528 4.214 1.00 0.00 O 0 +HETATM13639 H1 HOH A4439 1.159 47.998 3.635 1.00 0.00 H 0 +HETATM13640 H2 HOH A4439 0.888 47.692 5.109 1.00 0.00 H 0 +HETATM13641 O HOH A4440 28.429 15.355 7.128 1.00 0.00 O 0 +HETATM13642 H1 HOH A4440 28.450 14.473 7.654 1.00 0.00 H 0 +HETATM13643 H2 HOH A4440 27.519 15.639 6.914 1.00 0.00 H 0 +HETATM13644 O HOH A4441 25.006 31.160 37.202 1.00 0.00 O 0 +HETATM13645 H1 HOH A4441 25.228 30.788 36.342 1.00 0.00 H 0 +HETATM13646 H2 HOH A4441 24.006 31.412 37.126 1.00 0.00 H 0 +HETATM13647 O HOH A4442 34.866 16.352 37.412 1.00 0.00 O 0 +HETATM13648 H1 HOH A4442 35.732 16.316 37.920 1.00 0.00 H 0 +HETATM13649 H2 HOH A4442 35.117 16.487 36.463 1.00 0.00 H 0 +HETATM13650 O HOH A4443 20.906 47.830 23.233 1.00 0.00 O 0 +HETATM13651 H1 HOH A4443 21.185 47.851 24.088 1.00 0.00 H 0 +HETATM13652 H2 HOH A4443 21.495 47.236 22.760 1.00 0.00 H 0 +HETATM13653 O HOH A4444 33.622 37.736 10.415 1.00 0.00 O 0 +HETATM13654 H1 HOH A4444 33.189 37.510 9.581 1.00 0.00 H 0 +HETATM13655 H2 HOH A4444 33.150 38.494 10.840 1.00 0.00 H 0 +HETATM13656 O HOH A4445 10.573 38.343 7.083 1.00 0.00 O 0 +HETATM13657 H1 HOH A4445 11.052 38.701 7.765 1.00 0.00 H 0 +HETATM13658 H2 HOH A4445 10.057 37.638 7.540 1.00 0.00 H 0 +HETATM13659 O HOH A4446 52.715 46.683 34.989 1.00 0.00 O 0 +HETATM13660 H1 HOH A4446 53.270 46.328 34.319 1.00 0.00 H 0 +HETATM13661 H2 HOH A4446 53.320 47.271 35.474 1.00 0.00 H 0 +HETATM13662 O HOH A4447 19.044 40.181 2.803 1.00 0.00 O 0 +HETATM13663 H1 HOH A4447 19.981 40.018 2.559 1.00 0.00 H 0 +HETATM13664 H2 HOH A4447 18.601 39.828 2.037 1.00 0.00 H 0 +HETATM13665 O HOH A4448 49.573 38.019 6.479 1.00 0.00 O 0 +HETATM13666 H1 HOH A4448 49.162 37.732 5.679 1.00 0.00 H 0 +HETATM13667 H2 HOH A4448 49.617 37.328 7.180 1.00 0.00 H 0 +HETATM13668 O HOH A4449 13.572 47.588 13.560 1.00 0.00 O 0 +HETATM13669 H1 HOH A4449 14.154 48.141 14.072 1.00 0.00 H 0 +HETATM13670 H2 HOH A4449 13.832 46.648 13.810 1.00 0.00 H 0 +HETATM13671 O HOH A4450 31.945 44.985 21.924 1.00 0.00 O 0 +HETATM13672 H1 HOH A4450 32.777 44.577 22.109 1.00 0.00 H 0 +HETATM13673 H2 HOH A4450 31.479 44.447 21.278 1.00 0.00 H 0 +HETATM13674 O HOH A4451 8.887 53.568 14.387 1.00 0.00 O 0 +HETATM13675 H1 HOH A4451 7.927 53.548 14.212 1.00 0.00 H 0 +HETATM13676 H2 HOH A4451 9.258 52.806 13.843 1.00 0.00 H 0 +HETATM13677 O HOH A4452 15.910 10.058 11.382 1.00 0.00 O 0 +HETATM13678 H1 HOH A4452 15.659 10.466 12.254 1.00 0.00 H 0 +HETATM13679 H2 HOH A4452 15.123 9.866 10.906 1.00 0.00 H 0 +HETATM13680 O HOH A4453 24.983 21.518 4.029 1.00 0.00 O 0 +HETATM13681 H1 HOH A4453 24.395 21.355 3.334 1.00 0.00 H 0 +HETATM13682 H2 HOH A4453 25.485 22.333 3.802 1.00 0.00 H 0 +HETATM13683 O HOH A4454 5.231 16.288 7.010 1.00 0.00 O 0 +HETATM13684 H1 HOH A4454 5.142 15.440 7.548 1.00 0.00 H 0 +HETATM13685 H2 HOH A4454 5.082 16.946 7.682 1.00 0.00 H 0 +HETATM13686 O HOH A4455 12.294 40.622 18.851 1.00 0.00 O 0 +HETATM13687 H1 HOH A4455 12.973 40.353 18.169 1.00 0.00 H 0 +HETATM13688 H2 HOH A4455 11.384 40.822 18.519 1.00 0.00 H 0 +HETATM13689 O HOH A4456 48.647 35.018 2.839 1.00 0.00 O 0 +HETATM13690 H1 HOH A4456 48.422 34.816 1.913 1.00 0.00 H 0 +HETATM13691 H2 HOH A4456 48.106 34.413 3.371 1.00 0.00 H 0 +HETATM13692 O HOH A4457 41.205 39.081 1.099 1.00 0.00 O 0 +HETATM13693 H1 HOH A4457 40.989 39.415 1.988 1.00 0.00 H 0 +HETATM13694 H2 HOH A4457 41.853 38.384 1.082 1.00 0.00 H 0 +HETATM13695 O HOH A4458 24.019 33.436 21.285 1.00 0.00 O 0 +HETATM13696 H1 HOH A4458 23.821 32.663 20.735 1.00 0.00 H 0 +HETATM13697 H2 HOH A4458 24.413 33.237 22.144 1.00 0.00 H 0 +HETATM13698 O HOH A4459 25.472 45.633 37.990 1.00 0.00 O 0 +HETATM13699 H1 HOH A4459 25.523 46.216 38.736 1.00 0.00 H 0 +HETATM13700 H2 HOH A4459 25.205 46.172 37.242 1.00 0.00 H 0 +HETATM13701 O HOH A4460 11.515 22.170 6.973 1.00 0.00 O 0 +HETATM13702 H1 HOH A4460 12.429 22.483 7.080 1.00 0.00 H 0 +HETATM13703 H2 HOH A4460 11.433 21.642 6.229 1.00 0.00 H 0 +HETATM13704 O HOH A4461 33.730 13.539 42.853 1.00 0.00 O 0 +HETATM13705 H1 HOH A4461 32.871 13.312 43.083 1.00 0.00 H 0 +HETATM13706 H2 HOH A4461 34.095 12.928 42.222 1.00 0.00 H 0 +HETATM13707 O HOH A4462 3.505 12.310 33.567 1.00 0.00 O 0 +HETATM13708 H1 HOH A4462 4.361 12.232 34.012 1.00 0.00 H 0 +HETATM13709 H2 HOH A4462 3.635 12.348 32.626 1.00 0.00 H 0 +HETATM13710 O HOH A4463 4.461 28.043 4.313 1.00 0.00 O 0 +HETATM13711 H1 HOH A4463 4.105 27.230 4.659 1.00 0.00 H 0 +HETATM13712 H2 HOH A4463 5.481 27.971 4.376 1.00 0.00 H 0 +HETATM13713 O HOH A4464 47.583 48.193 45.915 1.00 0.00 O 0 +HETATM13714 H1 HOH A4464 46.621 48.046 46.085 1.00 0.00 H 0 +HETATM13715 H2 HOH A4464 47.919 48.173 46.805 1.00 0.00 H 0 +HETATM13716 O HOH A4465 39.627 10.368 49.438 1.00 0.00 O 0 +HETATM13717 H1 HOH A4465 40.022 11.237 49.163 1.00 0.00 H 0 +HETATM13718 H2 HOH A4465 40.324 9.789 49.795 1.00 0.00 H 0 +HETATM13719 O HOH A4466 2.561 44.547 4.597 1.00 0.00 O 0 +HETATM13720 H1 HOH A4466 2.114 43.747 4.449 1.00 0.00 H 0 +HETATM13721 H2 HOH A4466 2.133 45.183 4.015 1.00 0.00 H 0 +HETATM13722 O HOH A4467 29.017 52.593 11.024 1.00 0.00 O 0 +HETATM13723 H1 HOH A4467 28.922 52.075 10.202 1.00 0.00 H 0 +HETATM13724 H2 HOH A4467 29.910 53.003 10.994 1.00 0.00 H 0 +HETATM13725 O HOH A4468 25.325 7.375 51.785 1.00 0.00 O 0 +HETATM13726 H1 HOH A4468 25.385 7.491 50.860 1.00 0.00 H 0 +HETATM13727 H2 HOH A4468 24.384 7.276 52.065 1.00 0.00 H 0 +HETATM13728 O HOH A4469 50.483 29.859 30.173 1.00 0.00 O 0 +HETATM13729 H1 HOH A4469 50.752 28.973 30.399 1.00 0.00 H 0 +HETATM13730 H2 HOH A4469 50.635 30.416 30.923 1.00 0.00 H 0 +HETATM13731 O HOH A4470 50.146 50.318 39.175 1.00 0.00 O 0 +HETATM13732 H1 HOH A4470 49.258 50.415 38.820 1.00 0.00 H 0 +HETATM13733 H2 HOH A4470 50.078 49.577 39.831 1.00 0.00 H 0 +HETATM13734 O HOH A4471 21.543 46.611 15.323 1.00 0.00 O 0 +HETATM13735 H1 HOH A4471 22.003 47.251 14.736 1.00 0.00 H 0 +HETATM13736 H2 HOH A4471 22.072 45.782 15.402 1.00 0.00 H 0 +HETATM13737 O HOH A4472 7.907 38.259 4.781 1.00 0.00 O 0 +HETATM13738 H1 HOH A4472 7.075 38.825 4.610 1.00 0.00 H 0 +HETATM13739 H2 HOH A4472 8.731 38.761 4.607 1.00 0.00 H 0 +HETATM13740 O HOH A4473 39.477 52.421 15.286 1.00 0.00 O 0 +HETATM13741 H1 HOH A4473 38.762 52.185 14.709 1.00 0.00 H 0 +HETATM13742 H2 HOH A4473 39.234 53.241 15.761 1.00 0.00 H 0 +HETATM13743 O HOH A4474 27.263 34.376 11.231 1.00 0.00 O 0 +HETATM13744 H1 HOH A4474 26.962 33.649 10.539 1.00 0.00 H 0 +HETATM13745 H2 HOH A4474 27.023 35.286 10.929 1.00 0.00 H 0 +HETATM13746 O HOH A4475 9.535 0.496 43.687 1.00 0.00 O 0 +HETATM13747 H1 HOH A4475 9.454 -0.318 44.260 1.00 0.00 H 0 +HETATM13748 H2 HOH A4475 9.932 1.268 44.111 1.00 0.00 H 0 +HETATM13749 O HOH A4476 19.142 27.477 49.574 1.00 0.00 O 0 +HETATM13750 H1 HOH A4476 19.499 26.579 49.606 1.00 0.00 H 0 +HETATM13751 H2 HOH A4476 19.761 27.946 50.161 1.00 0.00 H 0 +HETATM13752 O HOH A4477 17.223 51.843 38.022 1.00 0.00 O 0 +HETATM13753 H1 HOH A4477 16.405 51.426 37.775 1.00 0.00 H 0 +HETATM13754 H2 HOH A4477 17.800 51.217 38.488 1.00 0.00 H 0 +HETATM13755 O HOH A4478 23.288 3.432 45.306 1.00 0.00 O 0 +HETATM13756 H1 HOH A4478 23.516 2.547 45.649 1.00 0.00 H 0 +HETATM13757 H2 HOH A4478 23.103 4.015 46.062 1.00 0.00 H 0 +HETATM13758 O HOH A4479 39.417 33.259 19.522 1.00 0.00 O 0 +HETATM13759 H1 HOH A4479 38.904 32.982 20.212 1.00 0.00 H 0 +HETATM13760 H2 HOH A4479 38.955 33.168 18.733 1.00 0.00 H 0 +HETATM13761 O HOH A4480 37.992 0.241 9.986 1.00 0.00 O 0 +HETATM13762 H1 HOH A4480 38.469 0.768 10.613 1.00 0.00 H 0 +HETATM13763 H2 HOH A4480 37.166 0.781 9.752 1.00 0.00 H 0 +HETATM13764 O HOH A4481 44.063 0.654 15.121 1.00 0.00 O 0 +HETATM13765 H1 HOH A4481 43.516 0.019 14.706 1.00 0.00 H 0 +HETATM13766 H2 HOH A4481 43.934 1.454 14.524 1.00 0.00 H 0 +HETATM13767 O HOH A4482 24.410 24.478 41.876 1.00 0.00 O 0 +HETATM13768 H1 HOH A4482 23.940 23.673 41.962 1.00 0.00 H 0 +HETATM13769 H2 HOH A4482 23.837 25.100 41.330 1.00 0.00 H 0 +HETATM13770 O HOH A4483 40.836 13.085 20.027 1.00 0.00 O 0 +HETATM13771 H1 HOH A4483 41.626 13.219 19.362 1.00 0.00 H 0 +HETATM13772 H2 HOH A4483 40.259 12.369 19.685 1.00 0.00 H 0 +HETATM13773 O HOH A4484 12.598 24.946 43.101 1.00 0.00 O 0 +HETATM13774 H1 HOH A4484 11.728 25.210 43.483 1.00 0.00 H 0 +HETATM13775 H2 HOH A4484 13.250 25.680 43.175 1.00 0.00 H 0 +HETATM13776 O HOH A4485 43.994 14.276 23.702 1.00 0.00 O 0 +HETATM13777 H1 HOH A4485 44.298 13.407 23.357 1.00 0.00 H 0 +HETATM13778 H2 HOH A4485 44.515 14.520 24.511 1.00 0.00 H 0 +HETATM13779 O HOH A4486 1.852 10.657 37.646 1.00 0.00 O 0 +HETATM13780 H1 HOH A4486 1.692 10.067 36.881 1.00 0.00 H 0 +HETATM13781 H2 HOH A4486 2.652 11.177 37.433 1.00 0.00 H 0 +HETATM13782 O HOH A4487 24.769 36.154 46.407 1.00 0.00 O 0 +HETATM13783 H1 HOH A4487 25.156 36.018 47.326 1.00 0.00 H 0 +HETATM13784 H2 HOH A4487 25.156 37.005 46.097 1.00 0.00 H 0 +HETATM13785 O HOH A4488 11.542 43.553 10.825 1.00 0.00 O 0 +HETATM13786 H1 HOH A4488 11.898 44.149 11.527 1.00 0.00 H 0 +HETATM13787 H2 HOH A4488 11.287 42.732 11.202 1.00 0.00 H 0 +HETATM13788 O HOH A4489 32.060 16.707 8.355 1.00 0.00 O 0 +HETATM13789 H1 HOH A4489 31.184 16.788 8.725 1.00 0.00 H 0 +HETATM13790 H2 HOH A4489 32.566 17.476 8.704 1.00 0.00 H 0 +HETATM13791 O HOH A4490 46.905 15.293 5.023 1.00 0.00 O 0 +HETATM13792 H1 HOH A4490 46.833 15.073 4.072 1.00 0.00 H 0 +HETATM13793 H2 HOH A4490 47.205 14.464 5.513 1.00 0.00 H 0 +HETATM13794 O HOH A4491 42.421 10.101 13.185 1.00 0.00 O 0 +HETATM13795 H1 HOH A4491 42.015 9.236 13.105 1.00 0.00 H 0 +HETATM13796 H2 HOH A4491 41.696 10.752 13.272 1.00 0.00 H 0 +HETATM13797 O HOH A4492 14.570 20.517 39.288 1.00 0.00 O 0 +HETATM13798 H1 HOH A4492 14.763 21.096 38.513 1.00 0.00 H 0 +HETATM13799 H2 HOH A4492 15.314 19.891 39.298 1.00 0.00 H 0 +HETATM13800 O HOH A4493 9.369 0.301 25.789 1.00 0.00 O 0 +HETATM13801 H1 HOH A4493 8.633 -0.123 26.300 1.00 0.00 H 0 +HETATM13802 H2 HOH A4493 9.872 0.911 26.342 1.00 0.00 H 0 +HETATM13803 O HOH A4494 25.447 42.733 49.329 1.00 0.00 O 0 +HETATM13804 H1 HOH A4494 26.353 42.893 48.954 1.00 0.00 H 0 +HETATM13805 H2 HOH A4494 24.790 43.305 48.823 1.00 0.00 H 0 +HETATM13806 O HOH A4495 7.697 6.759 26.776 1.00 0.00 O 0 +HETATM13807 H1 HOH A4495 8.464 7.303 26.902 1.00 0.00 H 0 +HETATM13808 H2 HOH A4495 8.028 5.997 26.215 1.00 0.00 H 0 +HETATM13809 O HOH A4496 23.161 16.205 39.212 1.00 0.00 O 0 +HETATM13810 H1 HOH A4496 22.937 17.151 39.501 1.00 0.00 H 0 +HETATM13811 H2 HOH A4496 23.782 16.304 38.473 1.00 0.00 H 0 +HETATM13812 O HOH A4497 19.645 39.704 32.498 1.00 0.00 O 0 +HETATM13813 H1 HOH A4497 19.220 39.981 31.672 1.00 0.00 H 0 +HETATM13814 H2 HOH A4497 18.854 39.608 33.084 1.00 0.00 H 0 +HETATM13815 O HOH A4498 11.716 29.855 22.710 1.00 0.00 O 0 +HETATM13816 H1 HOH A4498 12.585 29.864 23.199 1.00 0.00 H 0 +HETATM13817 H2 HOH A4498 11.711 29.180 22.050 1.00 0.00 H 0 +HETATM13818 O HOH A4499 43.385 30.627 4.209 1.00 0.00 O 0 +HETATM13819 H1 HOH A4499 43.718 30.463 5.105 1.00 0.00 H 0 +HETATM13820 H2 HOH A4499 42.494 30.263 4.223 1.00 0.00 H 0 +HETATM13821 O HOH A4500 22.791 47.973 39.971 1.00 0.00 O 0 +HETATM13822 H1 HOH A4500 23.674 47.937 40.193 1.00 0.00 H 0 +HETATM13823 H2 HOH A4500 22.604 48.870 40.305 1.00 0.00 H 0 +HETATM13824 O HOH A4501 8.640 12.652 35.072 1.00 0.00 O 0 +HETATM13825 H1 HOH A4501 8.636 12.348 35.981 1.00 0.00 H 0 +HETATM13826 H2 HOH A4501 9.341 12.140 34.665 1.00 0.00 H 0 +HETATM13827 O HOH A4502 51.862 6.780 15.068 1.00 0.00 O 0 +HETATM13828 H1 HOH A4502 52.231 5.926 14.883 1.00 0.00 H 0 +HETATM13829 H2 HOH A4502 51.060 6.866 14.567 1.00 0.00 H 0 +HETATM13830 O HOH A4503 14.456 26.313 39.305 1.00 0.00 O 0 +HETATM13831 H1 HOH A4503 13.577 26.422 39.782 1.00 0.00 H 0 +HETATM13832 H2 HOH A4503 14.720 27.162 38.866 1.00 0.00 H 0 +HETATM13833 O HOH A4504 22.322 23.615 6.963 1.00 0.00 O 0 +HETATM13834 H1 HOH A4504 21.507 23.609 6.403 1.00 0.00 H 0 +HETATM13835 H2 HOH A4504 22.595 22.729 7.021 1.00 0.00 H 0 +HETATM13836 O HOH A4505 13.649 9.861 48.111 1.00 0.00 O 0 +HETATM13837 H1 HOH A4505 12.874 10.440 48.127 1.00 0.00 H 0 +HETATM13838 H2 HOH A4505 14.186 10.228 47.358 1.00 0.00 H 0 +HETATM13839 O HOH A4506 27.319 4.224 4.677 1.00 0.00 O 0 +HETATM13840 H1 HOH A4506 26.757 4.683 4.056 1.00 0.00 H 0 +HETATM13841 H2 HOH A4506 27.030 3.344 4.527 1.00 0.00 H 0 +HETATM13842 O HOH A4507 46.492 42.225 23.968 1.00 0.00 O 0 +HETATM13843 H1 HOH A4507 47.154 42.670 24.601 1.00 0.00 H 0 +HETATM13844 H2 HOH A4507 46.606 41.335 24.108 1.00 0.00 H 0 +HETATM13845 O HOH A4508 19.211 0.500 11.739 1.00 0.00 O 0 +HETATM13846 H1 HOH A4508 19.587 1.412 11.587 1.00 0.00 H 0 +HETATM13847 H2 HOH A4508 19.720 0.189 12.455 1.00 0.00 H 0 +HETATM13848 O HOH A4509 27.400 33.213 41.970 1.00 0.00 O 0 +HETATM13849 H1 HOH A4509 27.713 32.647 41.267 1.00 0.00 H 0 +HETATM13850 H2 HOH A4509 27.162 34.050 41.596 1.00 0.00 H 0 +HETATM13851 O HOH A4510 8.714 46.970 19.434 1.00 0.00 O 0 +HETATM13852 H1 HOH A4510 8.650 47.680 20.137 1.00 0.00 H 0 +HETATM13853 H2 HOH A4510 8.373 47.410 18.597 1.00 0.00 H 0 +HETATM13854 O HOH A4511 49.691 52.725 18.202 1.00 0.00 O 0 +HETATM13855 H1 HOH A4511 50.678 52.577 18.097 1.00 0.00 H 0 +HETATM13856 H2 HOH A4511 49.158 52.089 17.580 1.00 0.00 H 0 +HETATM13857 O HOH A4512 28.185 39.267 46.071 1.00 0.00 O 0 +HETATM13858 H1 HOH A4512 28.236 38.618 46.723 1.00 0.00 H 0 +HETATM13859 H2 HOH A4512 29.023 39.780 46.170 1.00 0.00 H 0 +HETATM13860 O HOH A4513 28.386 51.296 8.600 1.00 0.00 O 0 +HETATM13861 H1 HOH A4513 28.850 50.378 8.584 1.00 0.00 H 0 +HETATM13862 H2 HOH A4513 28.326 51.619 7.687 1.00 0.00 H 0 +HETATM13863 O HOH A4514 47.627 1.351 12.592 1.00 0.00 O 0 +HETATM13864 H1 HOH A4514 48.552 1.578 12.428 1.00 0.00 H 0 +HETATM13865 H2 HOH A4514 47.098 1.828 11.923 1.00 0.00 H 0 +HETATM13866 O HOH A4515 38.870 23.182 3.848 1.00 0.00 O 0 +HETATM13867 H1 HOH A4515 38.762 23.677 3.038 1.00 0.00 H 0 +HETATM13868 H2 HOH A4515 39.890 23.229 4.015 1.00 0.00 H 0 +HETATM13869 O HOH A4516 45.594 31.035 21.863 1.00 0.00 O 0 +HETATM13870 H1 HOH A4516 46.474 30.666 22.033 1.00 0.00 H 0 +HETATM13871 H2 HOH A4516 45.423 31.768 22.489 1.00 0.00 H 0 +HETATM13872 O HOH A4517 9.531 4.496 6.861 1.00 0.00 O 0 +HETATM13873 H1 HOH A4517 9.213 4.665 7.741 1.00 0.00 H 0 +HETATM13874 H2 HOH A4517 10.443 4.864 6.844 1.00 0.00 H 0 +HETATM13875 O HOH A4518 16.825 12.824 10.611 1.00 0.00 O 0 +HETATM13876 H1 HOH A4518 17.697 12.460 10.349 1.00 0.00 H 0 +HETATM13877 H2 HOH A4518 16.195 12.164 10.298 1.00 0.00 H 0 +HETATM13878 O HOH A4519 12.387 36.278 25.834 1.00 0.00 O 0 +HETATM13879 H1 HOH A4519 11.992 36.940 26.377 1.00 0.00 H 0 +HETATM13880 H2 HOH A4519 12.330 36.738 24.995 1.00 0.00 H 0 +HETATM13881 O HOH A4520 49.239 48.599 23.181 1.00 0.00 O 0 +HETATM13882 H1 HOH A4520 48.953 48.929 22.212 1.00 0.00 H 0 +HETATM13883 H2 HOH A4520 50.133 48.339 23.040 1.00 0.00 H 0 +HETATM13884 O HOH A4521 1.025 31.664 0.721 1.00 0.00 O 0 +HETATM13885 H1 HOH A4521 1.972 31.669 0.940 1.00 0.00 H 0 +HETATM13886 H2 HOH A4521 0.707 32.566 0.874 1.00 0.00 H 0 +HETATM13887 O HOH A4522 9.364 45.795 24.523 1.00 0.00 O 0 +HETATM13888 H1 HOH A4522 9.042 46.546 23.959 1.00 0.00 H 0 +HETATM13889 H2 HOH A4522 8.681 45.126 24.704 1.00 0.00 H 0 +HETATM13890 O HOH A4523 25.389 52.733 32.220 1.00 0.00 O 0 +HETATM13891 H1 HOH A4523 26.057 53.499 32.525 1.00 0.00 H 0 +HETATM13892 H2 HOH A4523 24.519 53.021 32.413 1.00 0.00 H 0 +HETATM13893 O HOH A4524 20.704 43.818 3.804 1.00 0.00 O 0 +HETATM13894 H1 HOH A4524 19.977 43.181 3.781 1.00 0.00 H 0 +HETATM13895 H2 HOH A4524 20.890 43.994 2.899 1.00 0.00 H 0 +HETATM13896 O HOH A4525 18.443 27.318 16.570 1.00 0.00 O 0 +HETATM13897 H1 HOH A4525 19.220 27.903 16.721 1.00 0.00 H 0 +HETATM13898 H2 HOH A4525 18.035 27.686 15.757 1.00 0.00 H 0 +HETATM13899 O HOH A4526 10.154 34.670 48.891 1.00 0.00 O 0 +HETATM13900 H1 HOH A4526 10.957 34.479 48.430 1.00 0.00 H 0 +HETATM13901 H2 HOH A4526 10.344 35.381 49.495 1.00 0.00 H 0 +HETATM13902 O HOH A4527 41.052 18.426 27.680 1.00 0.00 O 0 +HETATM13903 H1 HOH A4527 41.549 18.035 28.399 1.00 0.00 H 0 +HETATM13904 H2 HOH A4527 41.752 18.608 27.146 1.00 0.00 H 0 +HETATM13905 O HOH A4528 46.047 18.167 49.399 1.00 0.00 O 0 +HETATM13906 H1 HOH A4528 45.609 17.639 50.125 1.00 0.00 H 0 +HETATM13907 H2 HOH A4528 45.328 18.667 48.953 1.00 0.00 H 0 +HETATM13908 O HOH A4529 4.538 17.845 30.069 1.00 0.00 O 0 +HETATM13909 H1 HOH A4529 5.125 18.480 30.423 1.00 0.00 H 0 +HETATM13910 H2 HOH A4529 5.076 16.995 29.898 1.00 0.00 H 0 +HETATM13911 O HOH A4530 10.152 4.316 14.406 1.00 0.00 O 0 +HETATM13912 H1 HOH A4530 10.512 5.226 14.528 1.00 0.00 H 0 +HETATM13913 H2 HOH A4530 9.225 4.425 14.734 1.00 0.00 H 0 +HETATM13914 O HOH A4531 12.986 44.597 47.979 1.00 0.00 O 0 +HETATM13915 H1 HOH A4531 13.571 43.807 48.104 1.00 0.00 H 0 +HETATM13916 H2 HOH A4531 12.777 44.563 47.058 1.00 0.00 H 0 +HETATM13917 O HOH A4532 27.591 39.390 9.778 1.00 0.00 O 0 +HETATM13918 H1 HOH A4532 26.898 39.853 9.212 1.00 0.00 H 0 +HETATM13919 H2 HOH A4532 28.194 40.041 10.007 1.00 0.00 H 0 +HETATM13920 O HOH A4533 52.695 26.045 7.274 1.00 0.00 O 0 +HETATM13921 H1 HOH A4533 52.938 26.911 7.753 1.00 0.00 H 0 +HETATM13922 H2 HOH A4533 52.526 25.467 8.053 1.00 0.00 H 0 +HETATM13923 O HOH A4534 18.011 41.265 7.644 1.00 0.00 O 0 +HETATM13924 H1 HOH A4534 17.381 41.688 8.277 1.00 0.00 H 0 +HETATM13925 H2 HOH A4534 17.942 41.770 6.732 1.00 0.00 H 0 +HETATM13926 O HOH A4535 30.965 50.946 6.776 1.00 0.00 O 0 +HETATM13927 H1 HOH A4535 31.565 51.301 6.134 1.00 0.00 H 0 +HETATM13928 H2 HOH A4535 30.161 51.447 6.675 1.00 0.00 H 0 +HETATM13929 O HOH A4536 4.306 47.850 6.174 1.00 0.00 O 0 +HETATM13930 H1 HOH A4536 4.475 46.973 5.878 1.00 0.00 H 0 +HETATM13931 H2 HOH A4536 4.410 48.363 5.363 1.00 0.00 H 0 +HETATM13932 O HOH A4537 45.838 37.312 49.937 1.00 0.00 O 0 +HETATM13933 H1 HOH A4537 46.155 37.178 50.790 1.00 0.00 H 0 +HETATM13934 H2 HOH A4537 46.594 37.181 49.273 1.00 0.00 H 0 +HETATM13935 O HOH A4538 41.825 4.851 53.585 1.00 0.00 O 0 +HETATM13936 H1 HOH A4538 41.345 5.746 53.497 1.00 0.00 H 0 +HETATM13937 H2 HOH A4538 42.453 4.823 52.866 1.00 0.00 H 0 +HETATM13938 O HOH A4539 39.011 45.653 19.299 1.00 0.00 O 0 +HETATM13939 H1 HOH A4539 38.141 46.033 19.256 1.00 0.00 H 0 +HETATM13940 H2 HOH A4539 39.496 45.849 20.124 1.00 0.00 H 0 +HETATM13941 O HOH A4540 37.689 10.792 5.272 1.00 0.00 O 0 +HETATM13942 H1 HOH A4540 37.314 10.938 6.152 1.00 0.00 H 0 +HETATM13943 H2 HOH A4540 36.956 10.716 4.651 1.00 0.00 H 0 +HETATM13944 O HOH A4541 41.886 27.229 18.926 1.00 0.00 O 0 +HETATM13945 H1 HOH A4541 42.477 26.449 19.054 1.00 0.00 H 0 +HETATM13946 H2 HOH A4541 41.033 26.825 18.718 1.00 0.00 H 0 +HETATM13947 O HOH A4542 51.511 52.440 33.902 1.00 0.00 O 0 +HETATM13948 H1 HOH A4542 51.709 52.434 34.871 1.00 0.00 H 0 +HETATM13949 H2 HOH A4542 52.055 53.021 33.406 1.00 0.00 H 0 +HETATM13950 O HOH A4543 32.028 51.547 9.347 1.00 0.00 O 0 +HETATM13951 H1 HOH A4543 31.899 52.397 8.915 1.00 0.00 H 0 +HETATM13952 H2 HOH A4543 31.810 50.881 8.699 1.00 0.00 H 0 +HETATM13953 O HOH A4544 6.775 8.335 32.774 1.00 0.00 O 0 +HETATM13954 H1 HOH A4544 6.992 8.991 32.060 1.00 0.00 H 0 +HETATM13955 H2 HOH A4544 7.078 8.828 33.601 1.00 0.00 H 0 +HETATM13956 O HOH A4545 53.080 40.344 29.950 1.00 0.00 O 0 +HETATM13957 H1 HOH A4545 52.197 40.692 30.178 1.00 0.00 H 0 +HETATM13958 H2 HOH A4545 53.261 39.878 30.774 1.00 0.00 H 0 +HETATM13959 O HOH A4546 52.412 38.197 11.133 1.00 0.00 O 0 +HETATM13960 H1 HOH A4546 51.958 37.345 11.126 1.00 0.00 H 0 +HETATM13961 H2 HOH A4546 53.136 38.085 11.800 1.00 0.00 H 0 +HETATM13962 O HOH A4547 30.147 49.870 35.510 1.00 0.00 O 0 +HETATM13963 H1 HOH A4547 31.077 49.808 35.161 1.00 0.00 H 0 +HETATM13964 H2 HOH A4547 29.583 49.162 35.196 1.00 0.00 H 0 +HETATM13965 O HOH A4548 50.457 47.187 40.142 1.00 0.00 O 0 +HETATM13966 H1 HOH A4548 51.135 47.219 39.469 1.00 0.00 H 0 +HETATM13967 H2 HOH A4548 49.619 47.292 39.721 1.00 0.00 H 0 +HETATM13968 O HOH A4549 47.500 32.506 24.686 1.00 0.00 O 0 +HETATM13969 H1 HOH A4549 47.580 31.888 25.301 1.00 0.00 H 0 +HETATM13970 H2 HOH A4549 46.574 32.796 24.666 1.00 0.00 H 0 +HETATM13971 O HOH A4550 43.864 46.595 18.885 1.00 0.00 O 0 +HETATM13972 H1 HOH A4550 44.301 47.469 18.848 1.00 0.00 H 0 +HETATM13973 H2 HOH A4550 43.670 46.593 19.812 1.00 0.00 H 0 +HETATM13974 O HOH A4551 0.641 20.508 8.717 1.00 0.00 O 0 +HETATM13975 H1 HOH A4551 1.435 20.626 9.314 1.00 0.00 H 0 +HETATM13976 H2 HOH A4551 -0.101 20.916 9.203 1.00 0.00 H 0 +HETATM13977 O HOH A4552 12.529 32.146 10.047 1.00 0.00 O 0 +HETATM13978 H1 HOH A4552 12.944 32.731 10.666 1.00 0.00 H 0 +HETATM13979 H2 HOH A4552 12.481 32.705 9.266 1.00 0.00 H 0 +HETATM13980 O HOH A4553 38.621 6.445 5.225 1.00 0.00 O 0 +HETATM13981 H1 HOH A4553 38.035 6.529 4.486 1.00 0.00 H 0 +HETATM13982 H2 HOH A4553 39.160 7.262 5.174 1.00 0.00 H 0 +HETATM13983 O HOH A4554 37.873 8.333 28.554 1.00 0.00 O 0 +HETATM13984 H1 HOH A4554 37.979 9.252 28.781 1.00 0.00 H 0 +HETATM13985 H2 HOH A4554 37.255 8.262 27.813 1.00 0.00 H 0 +HETATM13986 O HOH A4555 1.995 44.571 38.740 1.00 0.00 O 0 +HETATM13987 H1 HOH A4555 1.313 44.632 39.461 1.00 0.00 H 0 +HETATM13988 H2 HOH A4555 2.807 44.877 39.222 1.00 0.00 H 0 +HETATM13989 O HOH A4556 44.550 4.644 21.490 1.00 0.00 O 0 +HETATM13990 H1 HOH A4556 44.417 4.198 22.340 1.00 0.00 H 0 +HETATM13991 H2 HOH A4556 44.156 5.538 21.578 1.00 0.00 H 0 +HETATM13992 O HOH A4557 31.537 8.285 27.157 1.00 0.00 O 0 +HETATM13993 H1 HOH A4557 31.211 8.906 27.784 1.00 0.00 H 0 +HETATM13994 H2 HOH A4557 32.239 8.723 26.643 1.00 0.00 H 0 +HETATM13995 O HOH A4558 4.545 16.013 23.759 1.00 0.00 O 0 +HETATM13996 H1 HOH A4558 4.751 16.757 24.295 1.00 0.00 H 0 +HETATM13997 H2 HOH A4558 4.637 16.363 22.849 1.00 0.00 H 0 +HETATM13998 O HOH A4559 52.164 37.676 34.844 1.00 0.00 O 0 +HETATM13999 H1 HOH A4559 51.362 37.788 34.317 1.00 0.00 H 0 +HETATM14000 H2 HOH A4559 51.908 37.113 35.609 1.00 0.00 H 0 +HETATM14001 O HOH A4560 8.455 13.999 19.030 1.00 0.00 O 0 +HETATM14002 H1 HOH A4560 9.445 14.000 18.868 1.00 0.00 H 0 +HETATM14003 H2 HOH A4560 8.292 14.605 19.764 1.00 0.00 H 0 +HETATM14004 O HOH A4561 34.140 38.337 32.128 1.00 0.00 O 0 +HETATM14005 H1 HOH A4561 33.273 37.938 32.099 1.00 0.00 H 0 +HETATM14006 H2 HOH A4561 34.409 38.268 31.227 1.00 0.00 H 0 +HETATM14007 O HOH A4562 49.319 6.668 14.073 1.00 0.00 O 0 +HETATM14008 H1 HOH A4562 49.135 5.903 13.524 1.00 0.00 H 0 +HETATM14009 H2 HOH A4562 48.704 6.622 14.815 1.00 0.00 H 0 +HETATM14010 O HOH A4563 41.873 29.886 13.569 1.00 0.00 O 0 +HETATM14011 H1 HOH A4563 42.531 29.189 13.533 1.00 0.00 H 0 +HETATM14012 H2 HOH A4563 42.077 30.457 12.767 1.00 0.00 H 0 +HETATM14013 O HOH A4564 0.222 29.434 17.440 1.00 0.00 O 0 +HETATM14014 H1 HOH A4564 -0.013 29.283 18.379 1.00 0.00 H 0 +HETATM14015 H2 HOH A4564 0.254 28.580 17.108 1.00 0.00 H 0 +HETATM14016 O HOH A4565 13.682 21.600 5.589 1.00 0.00 O 0 +HETATM14017 H1 HOH A4565 14.170 21.245 4.828 1.00 0.00 H 0 +HETATM14018 H2 HOH A4565 13.524 22.473 5.286 1.00 0.00 H 0 +HETATM14019 O HOH A4566 17.897 30.731 3.401 1.00 0.00 O 0 +HETATM14020 H1 HOH A4566 18.665 30.799 2.869 1.00 0.00 H 0 +HETATM14021 H2 HOH A4566 18.017 31.312 4.100 1.00 0.00 H 0 +HETATM14022 O HOH A4567 26.404 52.242 39.326 1.00 0.00 O 0 +HETATM14023 H1 HOH A4567 25.657 52.352 39.958 1.00 0.00 H 0 +HETATM14024 H2 HOH A4567 26.513 53.020 38.742 1.00 0.00 H 0 +HETATM14025 O HOH A4568 33.572 23.156 34.068 1.00 0.00 O 0 +HETATM14026 H1 HOH A4568 32.734 23.187 33.492 1.00 0.00 H 0 +HETATM14027 H2 HOH A4568 33.424 23.741 34.785 1.00 0.00 H 0 +HETATM14028 O HOH A4569 38.853 47.018 9.346 1.00 0.00 O 0 +HETATM14029 H1 HOH A4569 39.425 47.158 10.080 1.00 0.00 H 0 +HETATM14030 H2 HOH A4569 38.174 46.428 9.687 1.00 0.00 H 0 +HETATM14031 O HOH A4570 42.153 50.989 19.025 1.00 0.00 O 0 +HETATM14032 H1 HOH A4570 42.168 51.466 19.833 1.00 0.00 H 0 +HETATM14033 H2 HOH A4570 41.276 51.150 18.666 1.00 0.00 H 0 +HETATM14034 O HOH A4571 21.817 10.615 31.590 1.00 0.00 O 0 +HETATM14035 H1 HOH A4571 21.872 9.800 31.026 1.00 0.00 H 0 +HETATM14036 H2 HOH A4571 21.102 10.475 32.234 1.00 0.00 H 0 +HETATM14037 O HOH A4572 25.290 12.421 28.055 1.00 0.00 O 0 +HETATM14038 H1 HOH A4572 25.197 11.591 28.458 1.00 0.00 H 0 +HETATM14039 H2 HOH A4572 25.356 12.273 27.095 1.00 0.00 H 0 +HETATM14040 O HOH A4573 13.420 52.269 42.630 1.00 0.00 O 0 +HETATM14041 H1 HOH A4573 12.426 52.114 42.533 1.00 0.00 H 0 +HETATM14042 H2 HOH A4573 13.965 51.800 41.873 1.00 0.00 H 0 +HETATM14043 O HOH A4574 3.230 20.041 18.960 1.00 0.00 O 0 +HETATM14044 H1 HOH A4574 3.594 19.910 19.848 1.00 0.00 H 0 +HETATM14045 H2 HOH A4574 4.020 20.323 18.460 1.00 0.00 H 0 +HETATM14046 O HOH A4575 16.974 44.566 46.024 1.00 0.00 O 0 +HETATM14047 H1 HOH A4575 16.454 44.079 45.362 1.00 0.00 H 0 +HETATM14048 H2 HOH A4575 16.844 45.515 45.943 1.00 0.00 H 0 +HETATM14049 O HOH A4576 24.043 10.825 14.438 1.00 0.00 O 0 +HETATM14050 H1 HOH A4576 23.764 10.921 15.373 1.00 0.00 H 0 +HETATM14051 H2 HOH A4576 24.898 10.306 14.496 1.00 0.00 H 0 +HETATM14052 O HOH A4577 7.873 14.342 50.620 1.00 0.00 O 0 +HETATM14053 H1 HOH A4577 7.216 14.379 51.405 1.00 0.00 H 0 +HETATM14054 H2 HOH A4577 8.731 14.633 50.867 1.00 0.00 H 0 +HETATM14055 O HOH A4578 44.870 23.820 0.807 1.00 0.00 O 0 +HETATM14056 H1 HOH A4578 45.648 24.261 1.243 1.00 0.00 H 0 +HETATM14057 H2 HOH A4578 45.234 23.568 -0.066 1.00 0.00 H 0 +HETATM14058 O HOH A4579 6.876 32.742 12.927 1.00 0.00 O 0 +HETATM14059 H1 HOH A4579 6.009 32.372 13.120 1.00 0.00 H 0 +HETATM14060 H2 HOH A4579 7.079 32.437 12.066 1.00 0.00 H 0 +HETATM14061 O HOH A4580 51.711 8.238 29.474 1.00 0.00 O 0 +HETATM14062 H1 HOH A4580 51.032 8.349 30.146 1.00 0.00 H 0 +HETATM14063 H2 HOH A4580 51.187 7.861 28.756 1.00 0.00 H 0 +HETATM14064 O HOH A4581 33.212 34.276 32.053 1.00 0.00 O 0 +HETATM14065 H1 HOH A4581 33.013 33.360 31.828 1.00 0.00 H 0 +HETATM14066 H2 HOH A4581 34.045 34.374 32.550 1.00 0.00 H 0 +HETATM14067 O HOH A4582 0.119 9.569 17.472 1.00 0.00 O 0 +HETATM14068 H1 HOH A4582 -0.009 9.264 16.550 1.00 0.00 H 0 +HETATM14069 H2 HOH A4582 -0.026 8.824 18.007 1.00 0.00 H 0 +HETATM14070 O HOH A4583 53.133 32.032 7.220 1.00 0.00 O 0 +HETATM14071 H1 HOH A4583 54.085 31.765 7.277 1.00 0.00 H 0 +HETATM14072 H2 HOH A4583 52.741 31.786 6.403 1.00 0.00 H 0 +HETATM14073 O HOH A4584 24.117 21.421 7.120 1.00 0.00 O 0 +HETATM14074 H1 HOH A4584 24.604 22.146 7.526 1.00 0.00 H 0 +HETATM14075 H2 HOH A4584 24.116 21.600 6.133 1.00 0.00 H 0 +HETATM14076 O HOH A4585 44.756 26.201 35.067 1.00 0.00 O 0 +HETATM14077 H1 HOH A4585 43.917 26.075 35.550 1.00 0.00 H 0 +HETATM14078 H2 HOH A4585 45.157 26.959 35.454 1.00 0.00 H 0 +HETATM14079 O HOH A4586 7.413 25.300 33.109 1.00 0.00 O 0 +HETATM14080 H1 HOH A4586 8.008 26.031 32.883 1.00 0.00 H 0 +HETATM14081 H2 HOH A4586 6.488 25.653 33.030 1.00 0.00 H 0 +HETATM14082 O HOH A4587 14.133 49.108 47.797 1.00 0.00 O 0 +HETATM14083 H1 HOH A4587 13.550 49.128 47.094 1.00 0.00 H 0 +HETATM14084 H2 HOH A4587 13.994 48.275 48.217 1.00 0.00 H 0 +HETATM14085 O HOH A4588 32.822 7.283 8.560 1.00 0.00 O 0 +HETATM14086 H1 HOH A4588 33.075 6.357 8.470 1.00 0.00 H 0 +HETATM14087 H2 HOH A4588 32.219 7.470 9.325 1.00 0.00 H 0 +HETATM14088 O HOH A4589 23.027 33.319 51.772 1.00 0.00 O 0 +HETATM14089 H1 HOH A4589 22.122 33.653 51.985 1.00 0.00 H 0 +HETATM14090 H2 HOH A4589 23.493 34.186 51.857 1.00 0.00 H 0 +HETATM14091 O HOH A4590 42.207 32.305 20.399 1.00 0.00 O 0 +HETATM14092 H1 HOH A4590 41.487 32.554 19.786 1.00 0.00 H 0 +HETATM14093 H2 HOH A4590 42.015 32.680 21.198 1.00 0.00 H 0 +HETATM14094 O HOH A4591 37.882 48.280 30.595 1.00 0.00 O 0 +HETATM14095 H1 HOH A4591 37.682 47.378 30.764 1.00 0.00 H 0 +HETATM14096 H2 HOH A4591 37.020 48.812 30.584 1.00 0.00 H 0 +HETATM14097 O HOH A4592 34.718 13.382 38.022 1.00 0.00 O 0 +HETATM14098 H1 HOH A4592 34.565 13.165 37.116 1.00 0.00 H 0 +HETATM14099 H2 HOH A4592 34.571 14.314 38.129 1.00 0.00 H 0 +HETATM14100 O HOH A4593 52.830 16.631 41.467 1.00 0.00 O 0 +HETATM14101 H1 HOH A4593 53.575 16.665 42.059 1.00 0.00 H 0 +HETATM14102 H2 HOH A4593 52.852 15.766 41.072 1.00 0.00 H 0 +HETATM14103 O HOH A4594 28.163 36.264 19.097 1.00 0.00 O 0 +HETATM14104 H1 HOH A4594 28.095 36.003 18.167 1.00 0.00 H 0 +HETATM14105 H2 HOH A4594 28.948 35.870 19.421 1.00 0.00 H 0 +HETATM14106 O HOH A4595 36.667 41.332 8.077 1.00 0.00 O 0 +HETATM14107 H1 HOH A4595 37.391 40.911 8.611 1.00 0.00 H 0 +HETATM14108 H2 HOH A4595 36.235 40.546 7.683 1.00 0.00 H 0 +HETATM14109 O HOH A4596 17.045 16.387 2.672 1.00 0.00 O 0 +HETATM14110 H1 HOH A4596 16.206 16.668 3.016 1.00 0.00 H 0 +HETATM14111 H2 HOH A4596 16.882 15.444 2.382 1.00 0.00 H 0 +HETATM14112 O HOH A4597 11.036 14.472 23.806 1.00 0.00 O 0 +HETATM14113 H1 HOH A4597 10.378 13.764 24.065 1.00 0.00 H 0 +HETATM14114 H2 HOH A4597 11.788 14.096 23.457 1.00 0.00 H 0 +HETATM14115 O HOH A4598 7.799 28.961 51.724 1.00 0.00 O 0 +HETATM14116 H1 HOH A4598 8.086 29.853 51.457 1.00 0.00 H 0 +HETATM14117 H2 HOH A4598 8.066 28.928 52.686 1.00 0.00 H 0 +HETATM14118 O HOH A4599 49.404 2.239 2.359 1.00 0.00 O 0 +HETATM14119 H1 HOH A4599 49.758 2.972 1.885 1.00 0.00 H 0 +HETATM14120 H2 HOH A4599 49.017 2.600 3.201 1.00 0.00 H 0 +HETATM14121 O HOH A4600 49.928 15.879 4.614 1.00 0.00 O 0 +HETATM14122 H1 HOH A4600 49.618 15.518 5.474 1.00 0.00 H 0 +HETATM14123 H2 HOH A4600 50.868 15.809 4.711 1.00 0.00 H 0 +HETATM14124 O HOH A4601 6.334 6.303 40.928 1.00 0.00 O 0 +HETATM14125 H1 HOH A4601 6.376 6.774 41.784 1.00 0.00 H 0 +HETATM14126 H2 HOH A4601 6.828 5.453 40.972 1.00 0.00 H 0 +HETATM14127 O HOH A4602 33.442 52.835 31.713 1.00 0.00 O 0 +HETATM14128 H1 HOH A4602 33.035 52.089 31.382 1.00 0.00 H 0 +HETATM14129 H2 HOH A4602 33.043 53.667 31.213 1.00 0.00 H 0 +HETATM14130 O HOH A4603 8.958 1.525 35.253 1.00 0.00 O 0 +HETATM14131 H1 HOH A4603 9.182 0.910 35.956 1.00 0.00 H 0 +HETATM14132 H2 HOH A4603 8.029 1.744 35.364 1.00 0.00 H 0 +HETATM14133 O HOH A4604 50.116 47.784 35.898 1.00 0.00 O 0 +HETATM14134 H1 HOH A4604 50.119 46.960 35.366 1.00 0.00 H 0 +HETATM14135 H2 HOH A4604 51.003 48.182 35.909 1.00 0.00 H 0 +HETATM14136 O HOH A4605 18.241 51.077 12.668 1.00 0.00 O 0 +HETATM14137 H1 HOH A4605 18.975 51.486 13.132 1.00 0.00 H 0 +HETATM14138 H2 HOH A4605 17.461 51.380 13.145 1.00 0.00 H 0 +HETATM14139 O HOH A4606 25.082 41.273 2.023 1.00 0.00 O 0 +HETATM14140 H1 HOH A4606 25.755 41.302 2.780 1.00 0.00 H 0 +HETATM14141 H2 HOH A4606 25.189 42.145 1.549 1.00 0.00 H 0 +HETATM14142 O HOH A4607 7.612 12.622 15.962 1.00 0.00 O 0 +HETATM14143 H1 HOH A4607 7.320 12.162 16.754 1.00 0.00 H 0 +HETATM14144 H2 HOH A4607 6.950 12.295 15.345 1.00 0.00 H 0 +HETATM14145 O HOH A4608 27.801 38.116 26.716 1.00 0.00 O 0 +HETATM14146 H1 HOH A4608 28.006 37.202 27.011 1.00 0.00 H 0 +HETATM14147 H2 HOH A4608 27.752 38.151 25.728 1.00 0.00 H 0 +HETATM14148 O HOH A4609 13.860 39.030 48.496 1.00 0.00 O 0 +HETATM14149 H1 HOH A4609 14.064 40.037 48.421 1.00 0.00 H 0 +HETATM14150 H2 HOH A4609 12.914 38.876 48.347 1.00 0.00 H 0 +HETATM14151 O HOH A4610 23.798 1.095 47.035 1.00 0.00 O 0 +HETATM14152 H1 HOH A4610 22.897 1.268 47.363 1.00 0.00 H 0 +HETATM14153 H2 HOH A4610 23.705 0.332 46.425 1.00 0.00 H 0 +HETATM14154 O HOH A4611 8.714 26.076 7.582 1.00 0.00 O 0 +HETATM14155 H1 HOH A4611 9.231 25.450 6.961 1.00 0.00 H 0 +HETATM14156 H2 HOH A4611 8.194 25.488 8.159 1.00 0.00 H 0 +HETATM14157 O HOH A4612 50.217 14.404 37.004 1.00 0.00 O 0 +HETATM14158 H1 HOH A4612 49.550 14.088 36.406 1.00 0.00 H 0 +HETATM14159 H2 HOH A4612 49.750 14.601 37.838 1.00 0.00 H 0 +HETATM14160 O HOH A4613 8.519 24.040 42.513 1.00 0.00 O 0 +HETATM14161 H1 HOH A4613 8.965 23.243 41.999 1.00 0.00 H 0 +HETATM14162 H2 HOH A4613 7.712 23.674 42.971 1.00 0.00 H 0 +HETATM14163 O HOH A4614 20.860 11.505 47.433 1.00 0.00 O 0 +HETATM14164 H1 HOH A4614 19.942 11.365 47.598 1.00 0.00 H 0 +HETATM14165 H2 HOH A4614 20.874 12.355 46.987 1.00 0.00 H 0 +HETATM14166 O HOH A4615 11.595 44.831 35.391 1.00 0.00 O 0 +HETATM14167 H1 HOH A4615 12.235 44.142 35.243 1.00 0.00 H 0 +HETATM14168 H2 HOH A4615 11.602 44.942 36.354 1.00 0.00 H 0 +HETATM14169 O HOH A4616 52.759 46.666 38.557 1.00 0.00 O 0 +HETATM14170 H1 HOH A4616 53.573 46.226 38.722 1.00 0.00 H 0 +HETATM14171 H2 HOH A4616 53.033 47.339 37.973 1.00 0.00 H 0 +HETATM14172 O HOH A4617 19.931 26.090 4.471 1.00 0.00 O 0 +HETATM14173 H1 HOH A4617 19.176 26.544 4.873 1.00 0.00 H 0 +HETATM14174 H2 HOH A4617 20.808 26.581 4.653 1.00 0.00 H 0 +HETATM14175 O HOH A4618 25.118 28.229 1.979 1.00 0.00 O 0 +HETATM14176 H1 HOH A4618 25.684 27.547 1.623 1.00 0.00 H 0 +HETATM14177 H2 HOH A4618 25.443 28.251 2.920 1.00 0.00 H 0 +HETATM14178 O HOH A4619 21.512 32.393 5.249 1.00 0.00 O 0 +HETATM14179 H1 HOH A4619 20.572 32.501 5.451 1.00 0.00 H 0 +HETATM14180 H2 HOH A4619 22.035 32.077 5.995 1.00 0.00 H 0 +HETATM14181 O HOH A4620 37.074 18.605 5.619 1.00 0.00 O 0 +HETATM14182 H1 HOH A4620 37.629 19.218 5.072 1.00 0.00 H 0 +HETATM14183 H2 HOH A4620 37.425 17.724 5.352 1.00 0.00 H 0 +HETATM14184 O HOH A4621 39.705 33.542 47.138 1.00 0.00 O 0 +HETATM14185 H1 HOH A4621 40.161 32.852 47.716 1.00 0.00 H 0 +HETATM14186 H2 HOH A4621 40.157 34.348 47.363 1.00 0.00 H 0 +HETATM14187 O HOH A4622 47.016 8.667 47.909 1.00 0.00 O 0 +HETATM14188 H1 HOH A4622 46.486 7.911 48.234 1.00 0.00 H 0 +HETATM14189 H2 HOH A4622 46.378 9.283 47.472 1.00 0.00 H 0 +HETATM14190 O HOH A4623 25.323 7.737 43.060 1.00 0.00 O 0 +HETATM14191 H1 HOH A4623 25.119 7.902 43.984 1.00 0.00 H 0 +HETATM14192 H2 HOH A4623 26.278 7.569 42.998 1.00 0.00 H 0 +HETATM14193 O HOH A4624 12.981 18.530 9.674 1.00 0.00 O 0 +HETATM14194 H1 HOH A4624 12.468 19.296 9.677 1.00 0.00 H 0 +HETATM14195 H2 HOH A4624 12.442 17.845 9.248 1.00 0.00 H 0 +HETATM14196 O HOH A4625 36.145 20.291 11.151 1.00 0.00 O 0 +HETATM14197 H1 HOH A4625 35.203 20.532 11.210 1.00 0.00 H 0 +HETATM14198 H2 HOH A4625 36.129 19.324 11.245 1.00 0.00 H 0 +HETATM14199 O HOH A4626 50.362 2.088 7.027 1.00 0.00 O 0 +HETATM14200 H1 HOH A4626 49.946 1.862 7.856 1.00 0.00 H 0 +HETATM14201 H2 HOH A4626 50.929 2.942 7.172 1.00 0.00 H 0 +HETATM14202 O HOH A4627 4.813 31.232 21.878 1.00 0.00 O 0 +HETATM14203 H1 HOH A4627 5.091 30.623 22.541 1.00 0.00 H 0 +HETATM14204 H2 HOH A4627 5.095 32.108 22.165 1.00 0.00 H 0 +HETATM14205 O HOH A4628 23.811 38.738 32.586 1.00 0.00 O 0 +HETATM14206 H1 HOH A4628 24.566 38.661 33.149 1.00 0.00 H 0 +HETATM14207 H2 HOH A4628 23.118 39.169 33.062 1.00 0.00 H 0 +HETATM14208 O HOH A4629 51.774 0.300 10.856 1.00 0.00 O 0 +HETATM14209 H1 HOH A4629 51.437 -0.407 10.181 1.00 0.00 H 0 +HETATM14210 H2 HOH A4629 51.443 0.173 11.723 1.00 0.00 H 0 +HETATM14211 O HOH A4630 30.119 19.501 0.892 1.00 0.00 O 0 +HETATM14212 H1 HOH A4630 29.093 19.461 0.777 1.00 0.00 H 0 +HETATM14213 H2 HOH A4630 30.440 18.990 1.627 1.00 0.00 H 0 +HETATM14214 O HOH A4631 8.342 12.718 28.193 1.00 0.00 O 0 +HETATM14215 H1 HOH A4631 7.686 12.055 28.324 1.00 0.00 H 0 +HETATM14216 H2 HOH A4631 7.846 13.392 27.683 1.00 0.00 H 0 +HETATM14217 O HOH A4632 14.533 20.695 34.161 1.00 0.00 O 0 +HETATM14218 H1 HOH A4632 14.606 19.735 33.857 1.00 0.00 H 0 +HETATM14219 H2 HOH A4632 13.727 20.666 34.723 1.00 0.00 H 0 +HETATM14220 O HOH A4633 28.579 40.503 27.985 1.00 0.00 O 0 +HETATM14221 H1 HOH A4633 28.391 39.597 27.699 1.00 0.00 H 0 +HETATM14222 H2 HOH A4633 27.778 40.753 28.495 1.00 0.00 H 0 +HETATM14223 O HOH A4634 48.070 16.401 33.754 1.00 0.00 O 0 +HETATM14224 H1 HOH A4634 48.770 16.329 34.350 1.00 0.00 H 0 +HETATM14225 H2 HOH A4634 47.244 16.410 34.236 1.00 0.00 H 0 +HETATM14226 O HOH A4635 12.516 28.711 1.705 1.00 0.00 O 0 +HETATM14227 H1 HOH A4635 13.266 28.112 1.709 1.00 0.00 H 0 +HETATM14228 H2 HOH A4635 11.922 28.335 1.063 1.00 0.00 H 0 +HETATM14229 O HOH A4636 13.030 26.082 18.900 1.00 0.00 O 0 +HETATM14230 H1 HOH A4636 12.580 25.237 18.985 1.00 0.00 H 0 +HETATM14231 H2 HOH A4636 12.528 26.552 19.625 1.00 0.00 H 0 +HETATM14232 O HOH A4637 19.990 1.602 37.736 1.00 0.00 O 0 +HETATM14233 H1 HOH A4637 20.229 0.927 38.413 1.00 0.00 H 0 +HETATM14234 H2 HOH A4637 19.316 1.273 37.153 1.00 0.00 H 0 +HETATM14235 O HOH A4638 20.034 39.124 46.465 1.00 0.00 O 0 +HETATM14236 H1 HOH A4638 19.418 39.787 46.424 1.00 0.00 H 0 +HETATM14237 H2 HOH A4638 20.686 39.348 47.205 1.00 0.00 H 0 +HETATM14238 O HOH A4639 1.116 36.102 41.469 1.00 0.00 O 0 +HETATM14239 H1 HOH A4639 1.518 35.376 41.923 1.00 0.00 H 0 +HETATM14240 H2 HOH A4639 0.756 36.694 42.181 1.00 0.00 H 0 +HETATM14241 O HOH A4640 36.358 19.498 27.828 1.00 0.00 O 0 +HETATM14242 H1 HOH A4640 36.312 19.404 26.870 1.00 0.00 H 0 +HETATM14243 H2 HOH A4640 36.118 20.414 27.896 1.00 0.00 H 0 +HETATM14244 O HOH A4641 36.565 39.784 45.976 1.00 0.00 O 0 +HETATM14245 H1 HOH A4641 36.128 40.385 45.374 1.00 0.00 H 0 +HETATM14246 H2 HOH A4641 37.229 39.287 45.434 1.00 0.00 H 0 +HETATM14247 O HOH A4642 10.679 27.036 26.605 1.00 0.00 O 0 +HETATM14248 H1 HOH A4642 9.854 27.535 26.433 1.00 0.00 H 0 +HETATM14249 H2 HOH A4642 10.807 26.826 27.485 1.00 0.00 H 0 +HETATM14250 O HOH A4643 5.660 24.934 22.845 1.00 0.00 O 0 +HETATM14251 H1 HOH A4643 4.972 24.703 23.529 1.00 0.00 H 0 +HETATM14252 H2 HOH A4643 5.198 25.603 22.326 1.00 0.00 H 0 +HETATM14253 O HOH A4644 22.157 22.757 50.854 1.00 0.00 O 0 +HETATM14254 H1 HOH A4644 22.496 23.064 50.012 1.00 0.00 H 0 +HETATM14255 H2 HOH A4644 22.719 23.164 51.533 1.00 0.00 H 0 +HETATM14256 O HOH A4645 1.963 35.688 5.497 1.00 0.00 O 0 +HETATM14257 H1 HOH A4645 2.329 35.216 6.288 1.00 0.00 H 0 +HETATM14258 H2 HOH A4645 1.809 35.045 4.814 1.00 0.00 H 0 +HETATM14259 O HOH A4646 48.519 24.248 35.817 1.00 0.00 O 0 +HETATM14260 H1 HOH A4646 48.439 25.165 36.178 1.00 0.00 H 0 +HETATM14261 H2 HOH A4646 48.818 23.786 36.582 1.00 0.00 H 0 +HETATM14262 O HOH A4647 52.475 34.161 4.965 1.00 0.00 O 0 +HETATM14263 H1 HOH A4647 52.473 35.119 5.388 1.00 0.00 H 0 +HETATM14264 H2 HOH A4647 53.361 33.975 4.749 1.00 0.00 H 0 +HETATM14265 O HOH A4648 8.811 43.641 3.449 1.00 0.00 O 0 +HETATM14266 H1 HOH A4648 9.512 44.058 2.995 1.00 0.00 H 0 +HETATM14267 H2 HOH A4648 8.073 43.956 2.981 1.00 0.00 H 0 +HETATM14268 O HOH A4649 38.198 21.025 19.864 1.00 0.00 O 0 +HETATM14269 H1 HOH A4649 38.319 20.892 18.876 1.00 0.00 H 0 +HETATM14270 H2 HOH A4649 37.970 20.093 20.107 1.00 0.00 H 0 +HETATM14271 O HOH A4650 48.385 35.033 30.504 1.00 0.00 O 0 +HETATM14272 H1 HOH A4650 48.766 34.979 31.400 1.00 0.00 H 0 +HETATM14273 H2 HOH A4650 47.791 34.226 30.445 1.00 0.00 H 0 +HETATM14274 O HOH A4651 4.166 4.199 25.664 1.00 0.00 O 0 +HETATM14275 H1 HOH A4651 4.626 3.369 25.404 1.00 0.00 H 0 +HETATM14276 H2 HOH A4651 3.428 3.858 26.289 1.00 0.00 H 0 +HETATM14277 O HOH A4652 2.553 38.228 17.472 1.00 0.00 O 0 +HETATM14278 H1 HOH A4652 2.144 37.421 17.183 1.00 0.00 H 0 +HETATM14279 H2 HOH A4652 3.237 38.408 16.817 1.00 0.00 H 0 +HETATM14280 O HOH A4653 32.627 41.732 30.219 1.00 0.00 O 0 +HETATM14281 H1 HOH A4653 33.070 41.686 31.084 1.00 0.00 H 0 +HETATM14282 H2 HOH A4653 32.556 42.714 29.891 1.00 0.00 H 0 +HETATM14283 O HOH A4654 22.251 28.158 53.422 1.00 0.00 O 0 +HETATM14284 H1 HOH A4654 22.326 28.991 53.016 1.00 0.00 H 0 +HETATM14285 H2 HOH A4654 21.464 27.749 53.174 1.00 0.00 H 0 +HETATM14286 O HOH A4655 35.011 6.191 19.040 1.00 0.00 O 0 +HETATM14287 H1 HOH A4655 35.592 5.490 19.533 1.00 0.00 H 0 +HETATM14288 H2 HOH A4655 34.708 5.825 18.206 1.00 0.00 H 0 +HETATM14289 O HOH A4656 37.308 14.227 32.080 1.00 0.00 O 0 +HETATM14290 H1 HOH A4656 38.239 14.317 32.365 1.00 0.00 H 0 +HETATM14291 H2 HOH A4656 36.994 15.124 32.009 1.00 0.00 H 0 +HETATM14292 O HOH A4657 35.622 8.623 44.423 1.00 0.00 O 0 +HETATM14293 H1 HOH A4657 36.542 8.773 44.085 1.00 0.00 H 0 +HETATM14294 H2 HOH A4657 35.643 7.675 44.600 1.00 0.00 H 0 +HETATM14295 O HOH A4658 5.619 26.694 9.201 1.00 0.00 O 0 +HETATM14296 H1 HOH A4658 5.826 27.637 8.870 1.00 0.00 H 0 +HETATM14297 H2 HOH A4658 4.644 26.633 9.193 1.00 0.00 H 0 +HETATM14298 O HOH A4659 35.736 8.832 0.052 1.00 0.00 O 0 +HETATM14299 H1 HOH A4659 34.960 8.912 0.580 1.00 0.00 H 0 +HETATM14300 H2 HOH A4659 35.945 7.874 -0.014 1.00 0.00 H 0 +HETATM14301 O HOH A4660 13.907 31.363 36.330 1.00 0.00 O 0 +HETATM14302 H1 HOH A4660 14.172 30.601 35.703 1.00 0.00 H 0 +HETATM14303 H2 HOH A4660 14.728 31.651 36.696 1.00 0.00 H 0 +HETATM14304 O HOH A4661 33.258 39.373 4.937 1.00 0.00 O 0 +HETATM14305 H1 HOH A4661 33.366 38.454 5.216 1.00 0.00 H 0 +HETATM14306 H2 HOH A4661 32.470 39.702 5.382 1.00 0.00 H 0 +HETATM14307 O HOH A4662 20.332 12.720 7.565 1.00 0.00 O 0 +HETATM14308 H1 HOH A4662 21.302 12.611 7.454 1.00 0.00 H 0 +HETATM14309 H2 HOH A4662 19.943 13.608 7.308 1.00 0.00 H 0 +HETATM14310 O HOH A4663 28.407 4.742 43.404 1.00 0.00 O 0 +HETATM14311 H1 HOH A4663 29.084 4.216 43.047 1.00 0.00 H 0 +HETATM14312 H2 HOH A4663 28.815 5.224 44.170 1.00 0.00 H 0 +HETATM14313 O HOH A4664 7.164 22.267 47.522 1.00 0.00 O 0 +HETATM14314 H1 HOH A4664 7.528 21.629 46.960 1.00 0.00 H 0 +HETATM14315 H2 HOH A4664 7.880 22.535 48.051 1.00 0.00 H 0 +HETATM14316 O HOH A4665 18.126 8.617 41.100 1.00 0.00 O 0 +HETATM14317 H1 HOH A4665 17.934 8.258 41.952 1.00 0.00 H 0 +HETATM14318 H2 HOH A4665 17.727 7.978 40.507 1.00 0.00 H 0 +HETATM14319 O HOH A4666 29.030 21.133 46.648 1.00 0.00 O 0 +HETATM14320 H1 HOH A4666 28.419 20.679 47.199 1.00 0.00 H 0 +HETATM14321 H2 HOH A4666 29.953 20.901 46.952 1.00 0.00 H 0 +HETATM14322 O HOH A4667 45.149 6.553 39.732 1.00 0.00 O 0 +HETATM14323 H1 HOH A4667 44.222 6.371 39.818 1.00 0.00 H 0 +HETATM14324 H2 HOH A4667 45.625 5.769 40.173 1.00 0.00 H 0 +HETATM14325 O HOH A4668 1.323 42.058 45.191 1.00 0.00 O 0 +HETATM14326 H1 HOH A4668 2.083 41.448 44.928 1.00 0.00 H 0 +HETATM14327 H2 HOH A4668 0.949 42.422 44.450 1.00 0.00 H 0 +HETATM14328 O HOH A4669 8.005 20.889 6.614 1.00 0.00 O 0 +HETATM14329 H1 HOH A4669 7.467 20.180 6.895 1.00 0.00 H 0 +HETATM14330 H2 HOH A4669 7.438 21.576 6.448 1.00 0.00 H 0 +HETATM14331 O HOH A4670 50.364 7.393 27.176 1.00 0.00 O 0 +HETATM14332 H1 HOH A4670 49.733 7.971 26.812 1.00 0.00 H 0 +HETATM14333 H2 HOH A4670 50.898 7.170 26.432 1.00 0.00 H 0 +HETATM14334 O HOH A4671 2.246 16.003 9.177 1.00 0.00 O 0 +HETATM14335 H1 HOH A4671 2.099 15.230 8.692 1.00 0.00 H 0 +HETATM14336 H2 HOH A4671 2.478 15.728 10.066 1.00 0.00 H 0 +HETATM14337 O HOH A4672 44.933 23.112 39.198 1.00 0.00 O 0 +HETATM14338 H1 HOH A4672 44.781 22.126 39.301 1.00 0.00 H 0 +HETATM14339 H2 HOH A4672 45.113 23.416 38.300 1.00 0.00 H 0 +HETATM14340 O HOH A4673 31.930 36.461 25.446 1.00 0.00 O 0 +HETATM14341 H1 HOH A4673 31.773 36.880 24.587 1.00 0.00 H 0 +HETATM14342 H2 HOH A4673 31.723 37.113 26.134 1.00 0.00 H 0 +HETATM14343 O HOH A4674 14.795 20.020 3.092 1.00 0.00 O 0 +HETATM14344 H1 HOH A4674 14.462 19.100 3.219 1.00 0.00 H 0 +HETATM14345 H2 HOH A4674 14.340 20.362 2.339 1.00 0.00 H 0 +HETATM14346 O HOH A4675 41.026 14.619 8.180 1.00 0.00 O 0 +HETATM14347 H1 HOH A4675 40.844 15.309 7.493 1.00 0.00 H 0 +HETATM14348 H2 HOH A4675 40.597 13.784 7.959 1.00 0.00 H 0 +HETATM14349 O HOH A4676 47.962 19.369 47.574 1.00 0.00 O 0 +HETATM14350 H1 HOH A4676 47.466 19.018 48.331 1.00 0.00 H 0 +HETATM14351 H2 HOH A4676 48.111 18.648 47.050 1.00 0.00 H 0 +HETATM14352 O HOH A4677 0.220 5.571 27.551 1.00 0.00 O 0 +HETATM14353 H1 HOH A4677 0.203 6.064 26.669 1.00 0.00 H 0 +HETATM14354 H2 HOH A4677 0.322 6.221 28.302 1.00 0.00 H 0 +HETATM14355 O HOH A4678 33.764 41.356 32.731 1.00 0.00 O 0 +HETATM14356 H1 HOH A4678 34.608 41.785 32.969 1.00 0.00 H 0 +HETATM14357 H2 HOH A4678 33.869 40.382 32.679 1.00 0.00 H 0 +HETATM14358 O HOH A4679 41.527 8.328 49.594 1.00 0.00 O 0 +HETATM14359 H1 HOH A4679 41.673 7.712 48.841 1.00 0.00 H 0 +HETATM14360 H2 HOH A4679 42.356 8.882 49.717 1.00 0.00 H 0 +HETATM14361 O HOH A4680 21.974 20.121 15.677 1.00 0.00 O 0 +HETATM14362 H1 HOH A4680 22.497 19.729 16.477 1.00 0.00 H 0 +HETATM14363 H2 HOH A4680 21.511 19.414 15.268 1.00 0.00 H 0 +HETATM14364 O HOH A4681 6.247 44.131 30.906 1.00 0.00 O 0 +HETATM14365 H1 HOH A4681 6.158 43.544 30.136 1.00 0.00 H 0 +HETATM14366 H2 HOH A4681 6.103 45.037 30.719 1.00 0.00 H 0 +HETATM14367 O HOH A4682 16.774 45.716 40.599 1.00 0.00 O 0 +HETATM14368 H1 HOH A4682 16.057 45.798 41.247 1.00 0.00 H 0 +HETATM14369 H2 HOH A4682 16.295 45.638 39.748 1.00 0.00 H 0 +HETATM14370 O HOH A4683 8.955 36.631 8.618 1.00 0.00 O 0 +HETATM14371 H1 HOH A4683 9.465 35.842 8.970 1.00 0.00 H 0 +HETATM14372 H2 HOH A4683 8.446 36.974 9.445 1.00 0.00 H 0 +HETATM14373 O HOH A4684 46.100 34.738 8.374 1.00 0.00 O 0 +HETATM14374 H1 HOH A4684 46.190 34.459 9.282 1.00 0.00 H 0 +HETATM14375 H2 HOH A4684 45.197 34.664 8.127 1.00 0.00 H 0 +HETATM14376 O HOH A4685 33.862 52.738 0.408 1.00 0.00 O 0 +HETATM14377 H1 HOH A4685 33.049 53.096 -0.065 1.00 0.00 H 0 +HETATM14378 H2 HOH A4685 33.911 53.113 1.270 1.00 0.00 H 0 +HETATM14379 O HOH A4686 53.088 23.744 22.082 1.00 0.00 O 0 +HETATM14380 H1 HOH A4686 53.676 24.336 22.574 1.00 0.00 H 0 +HETATM14381 H2 HOH A4686 52.226 24.092 22.110 1.00 0.00 H 0 +HETATM14382 O HOH A4687 38.925 4.333 6.902 1.00 0.00 O 0 +HETATM14383 H1 HOH A4687 38.760 4.989 6.236 1.00 0.00 H 0 +HETATM14384 H2 HOH A4687 39.712 4.619 7.364 1.00 0.00 H 0 +HETATM14385 O HOH A4688 4.935 27.945 43.564 1.00 0.00 O 0 +HETATM14386 H1 HOH A4688 4.780 27.992 44.508 1.00 0.00 H 0 +HETATM14387 H2 HOH A4688 4.093 27.637 43.142 1.00 0.00 H 0 +HETATM14388 O HOH A4689 3.031 21.774 41.512 1.00 0.00 O 0 +HETATM14389 H1 HOH A4689 3.918 21.926 41.837 1.00 0.00 H 0 +HETATM14390 H2 HOH A4689 3.238 21.641 40.543 1.00 0.00 H 0 +HETATM14391 O HOH A4690 17.193 17.779 6.420 1.00 0.00 O 0 +HETATM14392 H1 HOH A4690 16.225 17.483 6.343 1.00 0.00 H 0 +HETATM14393 H2 HOH A4690 17.225 18.720 6.838 1.00 0.00 H 0 +HETATM14394 O HOH A4691 9.197 4.406 39.825 1.00 0.00 O 0 +HETATM14395 H1 HOH A4691 8.899 3.557 40.158 1.00 0.00 H 0 +HETATM14396 H2 HOH A4691 8.647 4.589 39.073 1.00 0.00 H 0 +HETATM14397 O HOH A4692 27.164 22.772 17.820 1.00 0.00 O 0 +HETATM14398 H1 HOH A4692 26.412 23.013 17.343 1.00 0.00 H 0 +HETATM14399 H2 HOH A4692 27.552 22.152 17.206 1.00 0.00 H 0 +HETATM14400 O HOH A4693 12.794 15.401 1.357 1.00 0.00 O 0 +HETATM14401 H1 HOH A4693 11.884 15.409 1.090 1.00 0.00 H 0 +HETATM14402 H2 HOH A4693 13.148 14.722 0.815 1.00 0.00 H 0 +HETATM14403 O HOH A4694 47.591 43.526 48.359 1.00 0.00 O 0 +HETATM14404 H1 HOH A4694 47.141 43.552 47.520 1.00 0.00 H 0 +HETATM14405 H2 HOH A4694 48.477 43.118 48.248 1.00 0.00 H 0 +HETATM14406 O HOH A4695 31.446 43.615 45.773 1.00 0.00 O 0 +HETATM14407 H1 HOH A4695 30.538 43.379 45.812 1.00 0.00 H 0 +HETATM14408 H2 HOH A4695 31.602 44.516 46.026 1.00 0.00 H 0 +HETATM14409 O HOH A4696 25.715 43.451 12.519 1.00 0.00 O 0 +HETATM14410 H1 HOH A4696 26.656 43.220 12.567 1.00 0.00 H 0 +HETATM14411 H2 HOH A4696 25.258 43.031 13.228 1.00 0.00 H 0 +HETATM14412 O HOH A4697 41.793 26.439 11.767 1.00 0.00 O 0 +HETATM14413 H1 HOH A4697 41.425 25.641 11.995 1.00 0.00 H 0 +HETATM14414 H2 HOH A4697 41.114 27.124 11.816 1.00 0.00 H 0 +HETATM14415 O HOH A4698 36.277 14.392 18.805 1.00 0.00 O 0 +HETATM14416 H1 HOH A4698 36.100 13.538 19.006 1.00 0.00 H 0 +HETATM14417 H2 HOH A4698 37.173 14.663 19.073 1.00 0.00 H 0 +HETATM14418 O HOH A4699 36.013 19.762 7.759 1.00 0.00 O 0 +HETATM14419 H1 HOH A4699 36.710 19.923 8.413 1.00 0.00 H 0 +HETATM14420 H2 HOH A4699 36.423 19.221 7.075 1.00 0.00 H 0 +HETATM14421 O HOH A4700 14.520 40.046 16.186 1.00 0.00 O 0 +HETATM14422 H1 HOH A4700 15.175 39.872 15.532 1.00 0.00 H 0 +HETATM14423 H2 HOH A4700 15.003 39.876 17.010 1.00 0.00 H 0 +HETATM14424 O HOH A4701 30.448 3.111 42.058 1.00 0.00 O 0 +HETATM14425 H1 HOH A4701 31.244 3.692 42.198 1.00 0.00 H 0 +HETATM14426 H2 HOH A4701 30.017 3.439 41.274 1.00 0.00 H 0 +HETATM14427 O HOH A4702 42.473 21.477 15.157 1.00 0.00 O 0 +HETATM14428 H1 HOH A4702 43.202 21.525 15.717 1.00 0.00 H 0 +HETATM14429 H2 HOH A4702 42.822 21.052 14.346 1.00 0.00 H 0 +HETATM14430 O HOH A4703 0.914 44.369 15.838 1.00 0.00 O 0 +HETATM14431 H1 HOH A4703 1.032 43.477 15.554 1.00 0.00 H 0 +HETATM14432 H2 HOH A4703 0.020 44.504 15.668 1.00 0.00 H 0 +HETATM14433 O HOH A4704 5.359 45.485 24.242 1.00 0.00 O 0 +HETATM14434 H1 HOH A4704 4.734 45.934 24.780 1.00 0.00 H 0 +HETATM14435 H2 HOH A4704 6.078 46.097 24.058 1.00 0.00 H 0 +HETATM14436 O HOH A4705 14.023 36.071 3.939 1.00 0.00 O 0 +HETATM14437 H1 HOH A4705 13.113 36.258 3.577 1.00 0.00 H 0 +HETATM14438 H2 HOH A4705 14.758 36.007 3.246 1.00 0.00 H 0 +HETATM14439 O HOH A4706 40.539 0.501 46.687 1.00 0.00 O 0 +HETATM14440 H1 HOH A4706 41.308 0.523 46.085 1.00 0.00 H 0 +HETATM14441 H2 HOH A4706 40.357 -0.438 46.933 1.00 0.00 H 0 +HETATM14442 O HOH A4707 20.794 30.347 7.389 1.00 0.00 O 0 +HETATM14443 H1 HOH A4707 20.765 29.959 8.271 1.00 0.00 H 0 +HETATM14444 H2 HOH A4707 20.193 31.109 7.480 1.00 0.00 H 0 +HETATM14445 O HOH A4708 25.429 23.036 13.189 1.00 0.00 O 0 +HETATM14446 H1 HOH A4708 26.300 23.363 13.067 1.00 0.00 H 0 +HETATM14447 H2 HOH A4708 24.800 23.526 12.593 1.00 0.00 H 0 +HETATM14448 O HOH A4709 35.668 2.580 41.335 1.00 0.00 O 0 +HETATM14449 H1 HOH A4709 35.781 1.713 41.792 1.00 0.00 H 0 +HETATM14450 H2 HOH A4709 35.028 2.459 40.573 1.00 0.00 H 0 +HETATM14451 O HOH A4710 51.070 24.175 11.381 1.00 0.00 O 0 +HETATM14452 H1 HOH A4710 50.322 24.714 11.223 1.00 0.00 H 0 +HETATM14453 H2 HOH A4710 51.441 24.514 12.224 1.00 0.00 H 0 +HETATM14454 O HOH A4711 43.499 49.833 37.165 1.00 0.00 O 0 +HETATM14455 H1 HOH A4711 43.164 49.993 38.081 1.00 0.00 H 0 +HETATM14456 H2 HOH A4711 42.863 50.101 36.477 1.00 0.00 H 0 +HETATM14457 O HOH A4712 11.673 3.791 9.187 1.00 0.00 O 0 +HETATM14458 H1 HOH A4712 11.251 4.123 10.031 1.00 0.00 H 0 +HETATM14459 H2 HOH A4712 11.720 2.843 9.148 1.00 0.00 H 0 +HETATM14460 O HOH A4713 44.771 28.732 15.900 1.00 0.00 O 0 +HETATM14461 H1 HOH A4713 44.205 28.706 16.666 1.00 0.00 H 0 +HETATM14462 H2 HOH A4713 44.249 28.273 15.252 1.00 0.00 H 0 +HETATM14463 O HOH A4714 19.892 31.703 16.113 1.00 0.00 O 0 +HETATM14464 H1 HOH A4714 18.913 31.712 16.066 1.00 0.00 H 0 +HETATM14465 H2 HOH A4714 20.221 30.838 16.381 1.00 0.00 H 0 +HETATM14466 O HOH A4715 5.968 8.707 20.338 1.00 0.00 O 0 +HETATM14467 H1 HOH A4715 6.311 8.088 19.715 1.00 0.00 H 0 +HETATM14468 H2 HOH A4715 6.453 8.364 21.086 1.00 0.00 H 0 +HETATM14469 O HOH A4716 3.295 18.835 5.140 1.00 0.00 O 0 +HETATM14470 H1 HOH A4716 3.958 18.165 4.926 1.00 0.00 H 0 +HETATM14471 H2 HOH A4716 2.442 18.356 5.232 1.00 0.00 H 0 +HETATM14472 O HOH A4717 6.091 53.162 20.298 1.00 0.00 O 0 +HETATM14473 H1 HOH A4717 6.309 53.266 19.389 1.00 0.00 H 0 +HETATM14474 H2 HOH A4717 6.449 52.405 20.698 1.00 0.00 H 0 +HETATM14475 O HOH A4718 39.659 29.678 45.654 1.00 0.00 O 0 +HETATM14476 H1 HOH A4718 39.888 29.419 46.556 1.00 0.00 H 0 +HETATM14477 H2 HOH A4718 39.342 28.905 45.179 1.00 0.00 H 0 +HETATM14478 O HOH A4719 44.074 27.154 22.343 1.00 0.00 O 0 +HETATM14479 H1 HOH A4719 44.949 27.418 22.624 1.00 0.00 H 0 +HETATM14480 H2 HOH A4719 43.586 28.006 22.187 1.00 0.00 H 0 +HETATM14481 O HOH A4720 19.630 40.586 52.316 1.00 0.00 O 0 +HETATM14482 H1 HOH A4720 19.001 41.367 52.287 1.00 0.00 H 0 +HETATM14483 H2 HOH A4720 19.381 40.058 51.539 1.00 0.00 H 0 +HETATM14484 O HOH A4721 13.526 10.139 10.003 1.00 0.00 O 0 +HETATM14485 H1 HOH A4721 12.883 9.515 9.558 1.00 0.00 H 0 +HETATM14486 H2 HOH A4721 13.270 10.255 10.917 1.00 0.00 H 0 +HETATM14487 O HOH A4722 40.252 8.663 44.603 1.00 0.00 O 0 +HETATM14488 H1 HOH A4722 40.324 7.730 44.664 1.00 0.00 H 0 +HETATM14489 H2 HOH A4722 39.923 8.871 45.487 1.00 0.00 H 0 +HETATM14490 O HOH A4723 52.963 2.978 27.821 1.00 0.00 O 0 +HETATM14491 H1 HOH A4723 53.155 3.854 27.667 1.00 0.00 H 0 +HETATM14492 H2 HOH A4723 52.154 2.751 27.338 1.00 0.00 H 0 +HETATM14493 O HOH A4724 21.369 45.097 24.548 1.00 0.00 O 0 +HETATM14494 H1 HOH A4724 20.539 45.096 24.100 1.00 0.00 H 0 +HETATM14495 H2 HOH A4724 21.102 44.949 25.492 1.00 0.00 H 0 +HETATM14496 O HOH A4725 38.170 14.291 3.034 1.00 0.00 O 0 +HETATM14497 H1 HOH A4725 38.680 14.957 2.528 1.00 0.00 H 0 +HETATM14498 H2 HOH A4725 38.825 13.896 3.610 1.00 0.00 H 0 +HETATM14499 O HOH A4726 40.566 50.911 0.690 1.00 0.00 O 0 +HETATM14500 H1 HOH A4726 40.583 50.104 1.200 1.00 0.00 H 0 +HETATM14501 H2 HOH A4726 40.257 51.599 1.235 1.00 0.00 H 0 +HETATM14502 O HOH A4727 48.382 3.398 4.752 1.00 0.00 O 0 +HETATM14503 H1 HOH A4727 48.571 4.328 4.914 1.00 0.00 H 0 +HETATM14504 H2 HOH A4727 48.575 2.857 5.479 1.00 0.00 H 0 +HETATM14505 O HOH A4728 22.140 22.575 42.492 1.00 0.00 O 0 +HETATM14506 H1 HOH A4728 21.467 23.219 42.650 1.00 0.00 H 0 +HETATM14507 H2 HOH A4728 21.885 22.122 41.699 1.00 0.00 H 0 +HETATM14508 O HOH A4729 8.982 27.768 2.013 1.00 0.00 O 0 +HETATM14509 H1 HOH A4729 9.440 28.432 1.492 1.00 0.00 H 0 +HETATM14510 H2 HOH A4729 8.209 27.581 1.499 1.00 0.00 H 0 +HETATM14511 O HOH A4730 34.591 23.500 42.341 1.00 0.00 O 0 +HETATM14512 H1 HOH A4730 34.830 23.874 41.473 1.00 0.00 H 0 +HETATM14513 H2 HOH A4730 33.682 23.632 42.336 1.00 0.00 H 0 +HETATM14514 O HOH A4731 43.245 5.671 43.538 1.00 0.00 O 0 +HETATM14515 H1 HOH A4731 43.331 6.311 44.244 1.00 0.00 H 0 +HETATM14516 H2 HOH A4731 43.137 4.825 43.874 1.00 0.00 H 0 +HETATM14517 O HOH A4732 5.505 5.692 28.418 1.00 0.00 O 0 +HETATM14518 H1 HOH A4732 6.117 5.983 27.709 1.00 0.00 H 0 +HETATM14519 H2 HOH A4732 5.936 6.019 29.228 1.00 0.00 H 0 +HETATM14520 O HOH A4733 47.944 4.288 18.007 1.00 0.00 O 0 +HETATM14521 H1 HOH A4733 48.410 3.439 18.188 1.00 0.00 H 0 +HETATM14522 H2 HOH A4733 47.505 4.550 18.803 1.00 0.00 H 0 +HETATM14523 O HOH A4734 51.702 45.305 21.016 1.00 0.00 O 0 +HETATM14524 H1 HOH A4734 52.520 44.770 20.968 1.00 0.00 H 0 +HETATM14525 H2 HOH A4734 51.030 44.851 20.547 1.00 0.00 H 0 +HETATM14526 O HOH A4735 26.213 5.339 29.890 1.00 0.00 O 0 +HETATM14527 H1 HOH A4735 25.628 4.592 29.563 1.00 0.00 H 0 +HETATM14528 H2 HOH A4735 26.652 4.905 30.604 1.00 0.00 H 0 +HETATM14529 O HOH A4736 37.936 49.464 36.909 1.00 0.00 O 0 +HETATM14530 H1 HOH A4736 38.680 48.879 36.954 1.00 0.00 H 0 +HETATM14531 H2 HOH A4736 37.082 48.949 36.784 1.00 0.00 H 0 +HETATM14532 O HOH A4737 24.420 32.550 30.792 1.00 0.00 O 0 +HETATM14533 H1 HOH A4737 24.338 32.359 31.743 1.00 0.00 H 0 +HETATM14534 H2 HOH A4737 23.718 32.109 30.131 1.00 0.00 H 0 +HETATM14535 O HOH A4738 24.897 52.323 29.403 1.00 0.00 O 0 +HETATM14536 H1 HOH A4738 25.170 52.493 30.336 1.00 0.00 H 0 +HETATM14537 H2 HOH A4738 24.833 53.228 29.065 1.00 0.00 H 0 +HETATM14538 O HOH A4739 0.521 18.942 29.166 1.00 0.00 O 0 +HETATM14539 H1 HOH A4739 0.966 18.643 29.959 1.00 0.00 H 0 +HETATM14540 H2 HOH A4739 -0.084 18.207 29.001 1.00 0.00 H 0 +HETATM14541 O HOH A4740 38.444 30.943 10.256 1.00 0.00 O 0 +HETATM14542 H1 HOH A4740 39.380 30.900 10.315 1.00 0.00 H 0 +HETATM14543 H2 HOH A4740 37.950 31.077 11.098 1.00 0.00 H 0 +HETATM14544 O HOH A4741 20.921 17.326 53.915 1.00 0.00 O 0 +HETATM14545 H1 HOH A4741 20.610 17.442 53.029 1.00 0.00 H 0 +HETATM14546 H2 HOH A4741 21.936 17.495 53.894 1.00 0.00 H 0 +HETATM14547 O HOH A4742 10.061 33.509 52.337 1.00 0.00 O 0 +HETATM14548 H1 HOH A4742 10.879 33.988 52.068 1.00 0.00 H 0 +HETATM14549 H2 HOH A4742 10.011 33.667 53.276 1.00 0.00 H 0 +HETATM14550 O HOH A4743 34.987 0.688 39.163 1.00 0.00 O 0 +HETATM14551 H1 HOH A4743 34.675 0.362 38.312 1.00 0.00 H 0 +HETATM14552 H2 HOH A4743 34.209 0.482 39.861 1.00 0.00 H 0 +HETATM14553 O HOH A4744 20.282 36.885 0.720 1.00 0.00 O 0 +HETATM14554 H1 HOH A4744 20.790 36.417 0.137 1.00 0.00 H 0 +HETATM14555 H2 HOH A4744 20.014 36.253 1.383 1.00 0.00 H 0 +HETATM14556 O HOH A4745 17.864 44.706 31.751 1.00 0.00 O 0 +HETATM14557 H1 HOH A4745 18.159 43.945 31.255 1.00 0.00 H 0 +HETATM14558 H2 HOH A4745 17.400 44.271 32.435 1.00 0.00 H 0 +HETATM14559 O HOH A4746 19.108 18.976 1.333 1.00 0.00 O 0 +HETATM14560 H1 HOH A4746 19.527 19.829 1.232 1.00 0.00 H 0 +HETATM14561 H2 HOH A4746 19.774 18.435 0.988 1.00 0.00 H 0 +HETATM14562 O HOH A4747 13.556 26.690 31.472 1.00 0.00 O 0 +HETATM14563 H1 HOH A4747 13.411 27.604 31.772 1.00 0.00 H 0 +HETATM14564 H2 HOH A4747 12.751 26.162 31.545 1.00 0.00 H 0 +HETATM14565 O HOH A4748 50.398 20.205 15.699 1.00 0.00 O 0 +HETATM14566 H1 HOH A4748 50.102 21.121 15.669 1.00 0.00 H 0 +HETATM14567 H2 HOH A4748 50.879 19.937 16.479 1.00 0.00 H 0 +HETATM14568 O HOH A4749 23.590 19.901 50.574 1.00 0.00 O 0 +HETATM14569 H1 HOH A4749 24.091 19.226 50.147 1.00 0.00 H 0 +HETATM14570 H2 HOH A4749 23.266 20.424 49.851 1.00 0.00 H 0 +HETATM14571 O HOH A4750 2.678 3.486 23.050 1.00 0.00 O 0 +HETATM14572 H1 HOH A4750 2.852 3.451 24.016 1.00 0.00 H 0 +HETATM14573 H2 HOH A4750 2.970 4.392 22.896 1.00 0.00 H 0 +HETATM14574 O HOH A4751 1.537 43.636 47.785 1.00 0.00 O 0 +HETATM14575 H1 HOH A4751 1.777 44.539 47.635 1.00 0.00 H 0 +HETATM14576 H2 HOH A4751 1.764 43.303 46.907 1.00 0.00 H 0 +HETATM14577 O HOH A4752 17.473 27.857 47.538 1.00 0.00 O 0 +HETATM14578 H1 HOH A4752 18.232 27.529 47.974 1.00 0.00 H 0 +HETATM14579 H2 HOH A4752 16.699 27.621 48.106 1.00 0.00 H 0 +HETATM14580 O HOH A4753 0.732 27.518 43.819 1.00 0.00 O 0 +HETATM14581 H1 HOH A4753 1.323 27.457 43.040 1.00 0.00 H 0 +HETATM14582 H2 HOH A4753 -0.178 27.447 43.507 1.00 0.00 H 0 +HETATM14583 O HOH A4754 23.557 29.178 6.285 1.00 0.00 O 0 +HETATM14584 H1 HOH A4754 23.344 28.767 7.127 1.00 0.00 H 0 +HETATM14585 H2 HOH A4754 23.250 30.120 6.292 1.00 0.00 H 0 +HETATM14586 O HOH A4755 24.582 31.832 2.214 1.00 0.00 O 0 +HETATM14587 H1 HOH A4755 23.777 32.414 2.363 1.00 0.00 H 0 +HETATM14588 H2 HOH A4755 24.331 31.003 2.624 1.00 0.00 H 0 +HETATM14589 O HOH A4756 44.821 40.863 34.554 1.00 0.00 O 0 +HETATM14590 H1 HOH A4756 44.639 40.440 33.717 1.00 0.00 H 0 +HETATM14591 H2 HOH A4756 44.741 40.085 35.145 1.00 0.00 H 0 +HETATM14592 O HOH A4757 4.827 43.252 26.050 1.00 0.00 O 0 +HETATM14593 H1 HOH A4757 3.883 43.403 26.107 1.00 0.00 H 0 +HETATM14594 H2 HOH A4757 4.846 42.421 25.570 1.00 0.00 H 0 +HETATM14595 O HOH A4758 51.873 26.846 43.057 1.00 0.00 O 0 +HETATM14596 H1 HOH A4758 51.522 26.137 43.692 1.00 0.00 H 0 +HETATM14597 H2 HOH A4758 51.253 27.427 42.703 1.00 0.00 H 0 +HETATM14598 O HOH A4759 19.807 12.944 2.916 1.00 0.00 O 0 +HETATM14599 H1 HOH A4759 20.341 13.553 2.439 1.00 0.00 H 0 +HETATM14600 H2 HOH A4759 19.647 13.413 3.717 1.00 0.00 H 0 +HETATM14601 O HOH A4760 6.425 26.335 47.768 1.00 0.00 O 0 +HETATM14602 H1 HOH A4760 6.846 26.726 48.547 1.00 0.00 H 0 +HETATM14603 H2 HOH A4760 5.837 25.651 48.034 1.00 0.00 H 0 +HETATM14604 O HOH A4761 5.410 43.585 44.713 1.00 0.00 O 0 +HETATM14605 H1 HOH A4761 4.966 43.155 45.437 1.00 0.00 H 0 +HETATM14606 H2 HOH A4761 5.316 44.542 44.808 1.00 0.00 H 0 +HETATM14607 O HOH A4762 3.361 53.784 42.890 1.00 0.00 O 0 +HETATM14608 H1 HOH A4762 2.671 53.259 43.202 1.00 0.00 H 0 +HETATM14609 H2 HOH A4762 3.604 53.396 42.041 1.00 0.00 H 0 +HETATM14610 O HOH A4763 31.620 15.678 52.113 1.00 0.00 O 0 +HETATM14611 H1 HOH A4763 30.713 15.873 52.496 1.00 0.00 H 0 +HETATM14612 H2 HOH A4763 31.591 14.678 51.992 1.00 0.00 H 0 +HETATM14613 O HOH A4764 40.571 52.487 49.650 1.00 0.00 O 0 +HETATM14614 H1 HOH A4764 40.665 53.364 50.175 1.00 0.00 H 0 +HETATM14615 H2 HOH A4764 41.442 52.202 49.501 1.00 0.00 H 0 +HETATM14616 O HOH A4765 2.742 21.183 10.609 1.00 0.00 O 0 +HETATM14617 H1 HOH A4765 3.289 21.912 10.386 1.00 0.00 H 0 +HETATM14618 H2 HOH A4765 2.201 21.437 11.358 1.00 0.00 H 0 +HETATM14619 O HOH A4766 21.592 19.404 48.213 1.00 0.00 O 0 +HETATM14620 H1 HOH A4766 21.747 18.540 47.814 1.00 0.00 H 0 +HETATM14621 H2 HOH A4766 20.800 19.365 48.804 1.00 0.00 H 0 +HETATM14622 O HOH A4767 42.298 4.291 34.350 1.00 0.00 O 0 +HETATM14623 H1 HOH A4767 42.716 3.544 34.810 1.00 0.00 H 0 +HETATM14624 H2 HOH A4767 42.371 5.002 34.971 1.00 0.00 H 0 +HETATM14625 O HOH A4768 49.908 28.646 39.526 1.00 0.00 O 0 +HETATM14626 H1 HOH A4768 49.564 28.894 38.678 1.00 0.00 H 0 +HETATM14627 H2 HOH A4768 49.274 28.051 39.998 1.00 0.00 H 0 +HETATM14628 O HOH A4769 50.687 22.907 18.418 1.00 0.00 O 0 +HETATM14629 H1 HOH A4769 50.243 23.712 18.551 1.00 0.00 H 0 +HETATM14630 H2 HOH A4769 50.301 22.259 19.009 1.00 0.00 H 0 +HETATM14631 O HOH A4770 39.246 26.489 18.376 1.00 0.00 O 0 +HETATM14632 H1 HOH A4770 39.224 26.066 17.510 1.00 0.00 H 0 +HETATM14633 H2 HOH A4770 39.109 25.794 19.041 1.00 0.00 H 0 +HETATM14634 O HOH A4771 8.874 53.507 38.407 1.00 0.00 O 0 +HETATM14635 H1 HOH A4771 8.928 54.331 39.027 1.00 0.00 H 0 +HETATM14636 H2 HOH A4771 9.606 52.889 38.640 1.00 0.00 H 0 +HETATM14637 O HOH A4772 49.950 44.268 50.337 1.00 0.00 O 0 +HETATM14638 H1 HOH A4772 49.222 44.952 50.431 1.00 0.00 H 0 +HETATM14639 H2 HOH A4772 50.624 44.613 49.721 1.00 0.00 H 0 +HETATM14640 O HOH A4773 8.019 16.348 20.578 1.00 0.00 O 0 +HETATM14641 H1 HOH A4773 8.091 16.272 21.534 1.00 0.00 H 0 +HETATM14642 H2 HOH A4773 7.206 16.834 20.348 1.00 0.00 H 0 +HETATM14643 O HOH A4774 10.212 51.906 21.510 1.00 0.00 O 0 +HETATM14644 H1 HOH A4774 10.788 51.875 22.291 1.00 0.00 H 0 +HETATM14645 H2 HOH A4774 10.739 51.602 20.732 1.00 0.00 H 0 +HETATM14646 O HOH A4775 26.722 26.844 11.369 1.00 0.00 O 0 +HETATM14647 H1 HOH A4775 27.419 27.299 10.886 1.00 0.00 H 0 +HETATM14648 H2 HOH A4775 26.365 26.212 10.753 1.00 0.00 H 0 +HETATM14649 O HOH A4776 29.189 4.002 39.811 1.00 0.00 O 0 +HETATM14650 H1 HOH A4776 28.472 4.694 39.906 1.00 0.00 H 0 +HETATM14651 H2 HOH A4776 28.684 3.163 39.505 1.00 0.00 H 0 +HETATM14652 O HOH A4777 15.825 26.322 35.142 1.00 0.00 O 0 +HETATM14653 H1 HOH A4777 15.569 25.816 35.929 1.00 0.00 H 0 +HETATM14654 H2 HOH A4777 15.928 25.783 34.371 1.00 0.00 H 0 +HETATM14655 O HOH A4778 6.734 51.423 5.090 1.00 0.00 O 0 +HETATM14656 H1 HOH A4778 7.194 52.019 4.505 1.00 0.00 H 0 +HETATM14657 H2 HOH A4778 7.356 50.860 5.496 1.00 0.00 H 0 +HETATM14658 O HOH A4779 22.041 21.849 47.058 1.00 0.00 O 0 +HETATM14659 H1 HOH A4779 21.157 22.053 46.748 1.00 0.00 H 0 +HETATM14660 H2 HOH A4779 21.861 20.981 47.492 1.00 0.00 H 0 +HETATM14661 O HOH A4780 46.282 51.505 42.969 1.00 0.00 O 0 +HETATM14662 H1 HOH A4780 45.667 51.019 42.358 1.00 0.00 H 0 +HETATM14663 H2 HOH A4780 46.567 52.285 42.582 1.00 0.00 H 0 +HETATM14664 O HOH A4781 44.160 4.815 11.034 1.00 0.00 O 0 +HETATM14665 H1 HOH A4781 44.291 5.289 11.874 1.00 0.00 H 0 +HETATM14666 H2 HOH A4781 44.071 5.585 10.419 1.00 0.00 H 0 +HETATM14667 O HOH A4782 43.444 3.417 2.134 1.00 0.00 O 0 +HETATM14668 H1 HOH A4782 44.119 2.888 1.611 1.00 0.00 H 0 +HETATM14669 H2 HOH A4782 43.109 4.100 1.531 1.00 0.00 H 0 +HETATM14670 O HOH A4783 9.025 40.615 6.105 1.00 0.00 O 0 +HETATM14671 H1 HOH A4783 9.273 39.760 6.610 1.00 0.00 H 0 +HETATM14672 H2 HOH A4783 8.192 40.913 6.556 1.00 0.00 H 0 +HETATM14673 O HOH A4784 5.493 25.919 17.669 1.00 0.00 O 0 +HETATM14674 H1 HOH A4784 4.898 26.574 17.225 1.00 0.00 H 0 +HETATM14675 H2 HOH A4784 4.938 25.179 18.019 1.00 0.00 H 0 +HETATM14676 O HOH A4785 52.869 33.195 42.729 1.00 0.00 O 0 +HETATM14677 H1 HOH A4785 53.108 33.101 41.768 1.00 0.00 H 0 +HETATM14678 H2 HOH A4785 52.655 34.159 42.814 1.00 0.00 H 0 +HETATM14679 O HOH A4786 45.314 45.326 23.790 1.00 0.00 O 0 +HETATM14680 H1 HOH A4786 45.571 46.253 23.593 1.00 0.00 H 0 +HETATM14681 H2 HOH A4786 46.068 44.864 23.364 1.00 0.00 H 0 +HETATM14682 O HOH A4787 52.052 5.480 5.151 1.00 0.00 O 0 +HETATM14683 H1 HOH A4787 51.172 5.774 5.468 1.00 0.00 H 0 +HETATM14684 H2 HOH A4787 51.991 4.509 5.007 1.00 0.00 H 0 +HETATM14685 O HOH A4788 14.016 47.372 3.082 1.00 0.00 O 0 +HETATM14686 H1 HOH A4788 14.722 46.883 3.495 1.00 0.00 H 0 +HETATM14687 H2 HOH A4788 14.130 48.284 3.355 1.00 0.00 H 0 +HETATM14688 O HOH A4789 51.713 41.958 8.361 1.00 0.00 O 0 +HETATM14689 H1 HOH A4789 51.039 42.358 7.753 1.00 0.00 H 0 +HETATM14690 H2 HOH A4789 52.095 41.190 7.908 1.00 0.00 H 0 +HETATM14691 O HOH A4790 38.592 18.022 36.307 1.00 0.00 O 0 +HETATM14692 H1 HOH A4790 38.481 17.968 37.288 1.00 0.00 H 0 +HETATM14693 H2 HOH A4790 38.689 17.146 35.905 1.00 0.00 H 0 +HETATM14694 O HOH A4791 25.847 51.684 46.005 1.00 0.00 O 0 +HETATM14695 H1 HOH A4791 25.036 52.129 45.756 1.00 0.00 H 0 +HETATM14696 H2 HOH A4791 26.076 51.038 45.321 1.00 0.00 H 0 +HETATM14697 O HOH A4792 32.276 34.380 9.910 1.00 0.00 O 0 +HETATM14698 H1 HOH A4792 31.384 34.300 9.732 1.00 0.00 H 0 +HETATM14699 H2 HOH A4792 32.505 35.303 9.571 1.00 0.00 H 0 +HETATM14700 O HOH A4793 53.047 32.808 29.840 1.00 0.00 O 0 +HETATM14701 H1 HOH A4793 52.500 33.576 29.745 1.00 0.00 H 0 +HETATM14702 H2 HOH A4793 53.123 32.726 30.857 1.00 0.00 H 0 +HETATM14703 O HOH A4794 1.442 15.350 48.211 1.00 0.00 O 0 +HETATM14704 H1 HOH A4794 2.173 14.830 48.628 1.00 0.00 H 0 +HETATM14705 H2 HOH A4794 1.879 16.201 48.162 1.00 0.00 H 0 +HETATM14706 O HOH A4795 16.966 2.957 19.770 1.00 0.00 O 0 +HETATM14707 H1 HOH A4795 17.556 3.595 20.240 1.00 0.00 H 0 +HETATM14708 H2 HOH A4795 16.032 3.136 19.988 1.00 0.00 H 0 +HETATM14709 O HOH A4796 13.217 35.572 50.661 1.00 0.00 O 0 +HETATM14710 H1 HOH A4796 13.104 34.831 51.267 1.00 0.00 H 0 +HETATM14711 H2 HOH A4796 13.080 36.403 51.145 1.00 0.00 H 0 +HETATM14712 O HOH A4797 52.612 25.024 34.075 1.00 0.00 O 0 +HETATM14713 H1 HOH A4797 53.150 24.246 33.761 1.00 0.00 H 0 +HETATM14714 H2 HOH A4797 51.702 24.719 33.879 1.00 0.00 H 0 +HETATM14715 O HOH A4798 7.608 31.896 2.780 1.00 0.00 O 0 +HETATM14716 H1 HOH A4798 7.233 31.364 2.060 1.00 0.00 H 0 +HETATM14717 H2 HOH A4798 7.790 31.257 3.396 1.00 0.00 H 0 +HETATM14718 O HOH A4799 26.659 26.059 5.323 1.00 0.00 O 0 +HETATM14719 H1 HOH A4799 27.226 25.347 4.903 1.00 0.00 H 0 +HETATM14720 H2 HOH A4799 27.234 26.195 6.145 1.00 0.00 H 0 +HETATM14721 O HOH A4800 41.035 35.871 22.823 1.00 0.00 O 0 +HETATM14722 H1 HOH A4800 41.695 36.265 22.235 1.00 0.00 H 0 +HETATM14723 H2 HOH A4800 41.118 34.912 22.834 1.00 0.00 H 0 +HETATM14724 O HOH A4801 45.812 50.914 46.961 1.00 0.00 O 0 +HETATM14725 H1 HOH A4801 45.888 51.148 47.893 1.00 0.00 H 0 +HETATM14726 H2 HOH A4801 46.342 50.212 46.656 1.00 0.00 H 0 +HETATM14727 O HOH A4802 10.866 38.288 48.355 1.00 0.00 O 0 +HETATM14728 H1 HOH A4802 10.275 37.744 48.861 1.00 0.00 H 0 +HETATM14729 H2 HOH A4802 10.460 38.755 47.543 1.00 0.00 H 0 +HETATM14730 O HOH A4803 9.535 10.937 15.123 1.00 0.00 O 0 +HETATM14731 H1 HOH A4803 9.180 11.721 15.484 1.00 0.00 H 0 +HETATM14732 H2 HOH A4803 9.645 10.363 15.876 1.00 0.00 H 0 +HETATM14733 O HOH A4804 7.119 28.146 11.300 1.00 0.00 O 0 +HETATM14734 H1 HOH A4804 6.943 27.606 10.585 1.00 0.00 H 0 +HETATM14735 H2 HOH A4804 7.804 27.773 11.766 1.00 0.00 H 0 +HETATM14736 O HOH A4805 33.093 8.164 36.707 1.00 0.00 O 0 +HETATM14737 H1 HOH A4805 32.212 8.483 36.488 1.00 0.00 H 0 +HETATM14738 H2 HOH A4805 33.124 7.978 37.667 1.00 0.00 H 0 +HETATM14739 O HOH A4806 27.649 25.619 43.980 1.00 0.00 O 0 +HETATM14740 H1 HOH A4806 28.574 25.917 44.071 1.00 0.00 H 0 +HETATM14741 H2 HOH A4806 27.499 25.227 43.111 1.00 0.00 H 0 +HETATM14742 O HOH A4807 29.900 47.788 6.403 1.00 0.00 O 0 +HETATM14743 H1 HOH A4807 28.918 47.789 6.234 1.00 0.00 H 0 +HETATM14744 H2 HOH A4807 30.333 48.694 6.429 1.00 0.00 H 0 +HETATM14745 O HOH A4808 42.044 40.519 37.579 1.00 0.00 O 0 +HETATM14746 H1 HOH A4808 41.144 40.387 37.276 1.00 0.00 H 0 +HETATM14747 H2 HOH A4808 42.178 41.348 37.113 1.00 0.00 H 0 +HETATM14748 O HOH A4809 8.249 26.041 23.538 1.00 0.00 O 0 +HETATM14749 H1 HOH A4809 8.171 27.038 23.469 1.00 0.00 H 0 +HETATM14750 H2 HOH A4809 7.354 25.605 23.343 1.00 0.00 H 0 +HETATM14751 O HOH A4810 4.326 11.377 44.984 1.00 0.00 O 0 +HETATM14752 H1 HOH A4810 3.768 11.037 44.231 1.00 0.00 H 0 +HETATM14753 H2 HOH A4810 4.120 10.925 45.790 1.00 0.00 H 0 +HETATM14754 O HOH A4811 20.585 28.976 44.068 1.00 0.00 O 0 +HETATM14755 H1 HOH A4811 20.118 29.349 43.383 1.00 0.00 H 0 +HETATM14756 H2 HOH A4811 20.891 28.078 43.790 1.00 0.00 H 0 +HETATM14757 O HOH A4812 40.007 7.179 38.355 1.00 0.00 O 0 +HETATM14758 H1 HOH A4812 40.019 6.438 39.086 1.00 0.00 H 0 +HETATM14759 H2 HOH A4812 39.302 6.985 37.702 1.00 0.00 H 0 +HETATM14760 O HOH A4813 0.511 32.783 25.219 1.00 0.00 O 0 +HETATM14761 H1 HOH A4813 0.678 32.319 26.029 1.00 0.00 H 0 +HETATM14762 H2 HOH A4813 1.327 32.918 24.839 1.00 0.00 H 0 +HETATM14763 O HOH A4814 52.574 6.776 37.656 1.00 0.00 O 0 +HETATM14764 H1 HOH A4814 53.294 6.458 38.188 1.00 0.00 H 0 +HETATM14765 H2 HOH A4814 51.848 6.123 37.533 1.00 0.00 H 0 +HETATM14766 O HOH A4815 32.902 9.113 23.567 1.00 0.00 O 0 +HETATM14767 H1 HOH A4815 32.329 8.332 23.300 1.00 0.00 H 0 +HETATM14768 H2 HOH A4815 32.431 9.810 24.111 1.00 0.00 H 0 +HETATM14769 O HOH A4816 39.351 48.716 48.811 1.00 0.00 O 0 +HETATM14770 H1 HOH A4816 38.398 48.816 48.430 1.00 0.00 H 0 +HETATM14771 H2 HOH A4816 39.322 48.756 49.829 1.00 0.00 H 0 +HETATM14772 O HOH A4817 2.068 38.337 22.689 1.00 0.00 O 0 +HETATM14773 H1 HOH A4817 1.933 37.381 22.779 1.00 0.00 H 0 +HETATM14774 H2 HOH A4817 2.302 38.550 21.773 1.00 0.00 H 0 +HETATM14775 O HOH A4818 26.938 41.261 40.554 1.00 0.00 O 0 +HETATM14776 H1 HOH A4818 26.315 41.824 41.125 1.00 0.00 H 0 +HETATM14777 H2 HOH A4818 26.697 40.321 40.701 1.00 0.00 H 0 +HETATM14778 O HOH A4819 9.367 25.273 14.708 1.00 0.00 O 0 +HETATM14779 H1 HOH A4819 9.865 24.613 15.141 1.00 0.00 H 0 +HETATM14780 H2 HOH A4819 8.879 25.705 15.402 1.00 0.00 H 0 +HETATM14781 O HOH A4820 32.110 42.037 36.408 1.00 0.00 O 0 +HETATM14782 H1 HOH A4820 31.484 41.273 36.408 1.00 0.00 H 0 +HETATM14783 H2 HOH A4820 32.894 41.650 36.800 1.00 0.00 H 0 +HETATM14784 O HOH A4821 17.522 35.578 14.521 1.00 0.00 O 0 +HETATM14785 H1 HOH A4821 17.595 34.573 14.322 1.00 0.00 H 0 +HETATM14786 H2 HOH A4821 18.340 35.780 14.968 1.00 0.00 H 0 +HETATM14787 O HOH A4822 15.521 25.073 24.485 1.00 0.00 O 0 +HETATM14788 H1 HOH A4822 15.700 25.448 23.601 1.00 0.00 H 0 +HETATM14789 H2 HOH A4822 14.647 25.501 24.660 1.00 0.00 H 0 +HETATM14790 O HOH A4823 6.974 36.557 15.651 1.00 0.00 O 0 +HETATM14791 H1 HOH A4823 6.485 35.780 15.958 1.00 0.00 H 0 +HETATM14792 H2 HOH A4823 6.877 37.102 16.450 1.00 0.00 H 0 +HETATM14793 O HOH A4824 49.774 0.539 37.717 1.00 0.00 O 0 +HETATM14794 H1 HOH A4824 49.849 0.130 38.609 1.00 0.00 H 0 +HETATM14795 H2 HOH A4824 49.264 1.307 37.851 1.00 0.00 H 0 +HETATM14796 O HOH A4825 44.508 19.328 47.425 1.00 0.00 O 0 +HETATM14797 H1 HOH A4825 43.692 19.784 47.829 1.00 0.00 H 0 +HETATM14798 H2 HOH A4825 44.685 19.479 46.481 1.00 0.00 H 0 +HETATM14799 O HOH A4826 38.579 18.745 13.628 1.00 0.00 O 0 +HETATM14800 H1 HOH A4826 37.629 18.690 13.895 1.00 0.00 H 0 +HETATM14801 H2 HOH A4826 38.959 17.934 14.000 1.00 0.00 H 0 +HETATM14802 O HOH A4827 21.455 8.380 29.991 1.00 0.00 O 0 +HETATM14803 H1 HOH A4827 21.176 7.882 30.751 1.00 0.00 H 0 +HETATM14804 H2 HOH A4827 20.814 8.204 29.355 1.00 0.00 H 0 +HETATM14805 O HOH A4828 3.124 28.107 39.657 1.00 0.00 O 0 +HETATM14806 H1 HOH A4828 2.939 28.975 39.989 1.00 0.00 H 0 +HETATM14807 H2 HOH A4828 2.263 27.811 39.285 1.00 0.00 H 0 +HETATM14808 O HOH A4829 25.626 20.087 42.860 1.00 0.00 O 0 +HETATM14809 H1 HOH A4829 26.283 20.616 43.368 1.00 0.00 H 0 +HETATM14810 H2 HOH A4829 24.818 20.187 43.421 1.00 0.00 H 0 +HETATM14811 O HOH A4830 4.835 38.540 23.719 1.00 0.00 O 0 +HETATM14812 H1 HOH A4830 4.009 38.161 23.542 1.00 0.00 H 0 +HETATM14813 H2 HOH A4830 5.243 38.728 22.841 1.00 0.00 H 0 +HETATM14814 O HOH A4831 13.536 6.829 24.737 1.00 0.00 O 0 +HETATM14815 H1 HOH A4831 13.339 7.361 25.503 1.00 0.00 H 0 +HETATM14816 H2 HOH A4831 12.765 6.771 24.190 1.00 0.00 H 0 +HETATM14817 O HOH A4832 3.696 45.244 21.846 1.00 0.00 O 0 +HETATM14818 H1 HOH A4832 4.417 44.981 21.169 1.00 0.00 H 0 +HETATM14819 H2 HOH A4832 4.143 45.423 22.722 1.00 0.00 H 0 +HETATM14820 O HOH A4833 26.627 31.469 51.389 1.00 0.00 O 0 +HETATM14821 H1 HOH A4833 26.347 31.451 52.316 1.00 0.00 H 0 +HETATM14822 H2 HOH A4833 27.186 30.664 51.392 1.00 0.00 H 0 +HETATM14823 O HOH A4834 49.003 14.932 14.303 1.00 0.00 O 0 +HETATM14824 H1 HOH A4834 48.053 14.996 14.017 1.00 0.00 H 0 +HETATM14825 H2 HOH A4834 49.048 14.538 15.204 1.00 0.00 H 0 +HETATM14826 O HOH A4835 10.767 33.541 44.541 1.00 0.00 O 0 +HETATM14827 H1 HOH A4835 10.075 32.914 44.349 1.00 0.00 H 0 +HETATM14828 H2 HOH A4835 10.436 34.362 44.858 1.00 0.00 H 0 +HETATM14829 O HOH A4836 19.453 42.638 20.902 1.00 0.00 O 0 +HETATM14830 H1 HOH A4836 19.875 41.910 20.370 1.00 0.00 H 0 +HETATM14831 H2 HOH A4836 19.890 43.483 20.773 1.00 0.00 H 0 +HETATM14832 O HOH A4837 45.506 47.421 29.147 1.00 0.00 O 0 +HETATM14833 H1 HOH A4837 45.566 47.544 28.158 1.00 0.00 H 0 +HETATM14834 H2 HOH A4837 46.427 47.672 29.466 1.00 0.00 H 0 +HETATM14835 O HOH A4838 2.178 34.055 29.440 1.00 0.00 O 0 +HETATM14836 H1 HOH A4838 1.882 33.959 30.370 1.00 0.00 H 0 +HETATM14837 H2 HOH A4838 1.890 34.941 29.302 1.00 0.00 H 0 +HETATM14838 O HOH A4839 19.321 39.252 15.040 1.00 0.00 O 0 +HETATM14839 H1 HOH A4839 19.977 39.451 14.298 1.00 0.00 H 0 +HETATM14840 H2 HOH A4839 19.818 38.874 15.791 1.00 0.00 H 0 +HETATM14841 O HOH A4840 23.498 0.441 34.282 1.00 0.00 O 0 +HETATM14842 H1 HOH A4840 23.871 1.334 34.321 1.00 0.00 H 0 +HETATM14843 H2 HOH A4840 24.182 -0.062 34.756 1.00 0.00 H 0 +HETATM14844 O HOH A4841 11.693 1.497 26.909 1.00 0.00 O 0 +HETATM14845 H1 HOH A4841 11.688 1.141 27.860 1.00 0.00 H 0 +HETATM14846 H2 HOH A4841 12.090 0.834 26.413 1.00 0.00 H 0 +HETATM14847 O HOH A4842 41.942 45.414 4.008 1.00 0.00 O 0 +HETATM14848 H1 HOH A4842 41.891 45.905 3.239 1.00 0.00 H 0 +HETATM14849 H2 HOH A4842 41.310 45.758 4.701 1.00 0.00 H 0 +HETATM14850 O HOH A4843 14.675 6.185 36.157 1.00 0.00 O 0 +HETATM14851 H1 HOH A4843 13.712 6.028 35.865 1.00 0.00 H 0 +HETATM14852 H2 HOH A4843 14.663 6.840 36.826 1.00 0.00 H 0 +HETATM14853 O HOH A4844 48.722 53.082 33.576 1.00 0.00 O 0 +HETATM14854 H1 HOH A4844 48.157 53.318 32.837 1.00 0.00 H 0 +HETATM14855 H2 HOH A4844 49.539 52.744 33.215 1.00 0.00 H 0 +HETATM14856 O HOH A4845 46.242 25.523 4.905 1.00 0.00 O 0 +HETATM14857 H1 HOH A4845 46.624 26.403 4.970 1.00 0.00 H 0 +HETATM14858 H2 HOH A4845 46.084 25.417 3.988 1.00 0.00 H 0 +HETATM14859 O HOH A4846 48.825 12.618 26.408 1.00 0.00 O 0 +HETATM14860 H1 HOH A4846 48.011 12.050 26.307 1.00 0.00 H 0 +HETATM14861 H2 HOH A4846 49.469 12.264 25.811 1.00 0.00 H 0 +HETATM14862 O HOH A4847 19.694 6.030 28.058 1.00 0.00 O 0 +HETATM14863 H1 HOH A4847 19.427 5.366 27.407 1.00 0.00 H 0 +HETATM14864 H2 HOH A4847 19.478 5.606 28.882 1.00 0.00 H 0 +HETATM14865 O HOH A4848 16.252 19.141 10.461 1.00 0.00 O 0 +HETATM14866 H1 HOH A4848 16.156 19.868 11.115 1.00 0.00 H 0 +HETATM14867 H2 HOH A4848 15.397 19.038 10.100 1.00 0.00 H 0 +HETATM14868 O HOH A4849 44.884 11.340 14.247 1.00 0.00 O 0 +HETATM14869 H1 HOH A4849 45.207 11.699 13.411 1.00 0.00 H 0 +HETATM14870 H2 HOH A4849 44.107 10.826 13.889 1.00 0.00 H 0 +HETATM14871 O HOH A4850 25.535 5.817 3.107 1.00 0.00 O 0 +HETATM14872 H1 HOH A4850 24.931 6.319 3.696 1.00 0.00 H 0 +HETATM14873 H2 HOH A4850 26.035 6.468 2.604 1.00 0.00 H 0 +HETATM14874 O HOH A4851 28.856 18.121 40.058 1.00 0.00 O 0 +HETATM14875 H1 HOH A4851 29.627 18.746 40.034 1.00 0.00 H 0 +HETATM14876 H2 HOH A4851 28.382 18.293 40.873 1.00 0.00 H 0 +HETATM14877 O HOH A4852 31.916 36.690 31.840 1.00 0.00 O 0 +HETATM14878 H1 HOH A4852 32.371 35.820 31.970 1.00 0.00 H 0 +HETATM14879 H2 HOH A4852 31.318 36.709 31.007 1.00 0.00 H 0 +HETATM14880 O HOH A4853 48.042 31.731 52.855 1.00 0.00 O 0 +HETATM14881 H1 HOH A4853 48.912 31.991 52.706 1.00 0.00 H 0 +HETATM14882 H2 HOH A4853 47.594 31.671 51.985 1.00 0.00 H 0 +HETATM14883 O HOH A4854 0.255 42.162 23.731 1.00 0.00 O 0 +HETATM14884 H1 HOH A4854 1.035 42.152 23.138 1.00 0.00 H 0 +HETATM14885 H2 HOH A4854 0.639 41.700 24.533 1.00 0.00 H 0 +HETATM14886 O HOH A4855 11.717 33.074 23.786 1.00 0.00 O 0 +HETATM14887 H1 HOH A4855 11.578 33.108 22.858 1.00 0.00 H 0 +HETATM14888 H2 HOH A4855 12.533 32.546 23.911 1.00 0.00 H 0 +HETATM14889 O HOH A4856 32.575 52.316 18.240 1.00 0.00 O 0 +HETATM14890 H1 HOH A4856 32.838 52.290 19.165 1.00 0.00 H 0 +HETATM14891 H2 HOH A4856 33.267 52.744 17.740 1.00 0.00 H 0 +HETATM14892 O HOH A4857 38.836 30.475 4.627 1.00 0.00 O 0 +HETATM14893 H1 HOH A4857 38.673 30.628 5.535 1.00 0.00 H 0 +HETATM14894 H2 HOH A4857 39.030 31.344 4.205 1.00 0.00 H 0 +HETATM14895 O HOH A4858 31.649 41.093 41.817 1.00 0.00 O 0 +HETATM14896 H1 HOH A4858 32.433 41.498 42.300 1.00 0.00 H 0 +HETATM14897 H2 HOH A4858 32.104 40.556 41.204 1.00 0.00 H 0 +HETATM14898 O HOH A4859 47.172 5.700 35.288 1.00 0.00 O 0 +HETATM14899 H1 HOH A4859 48.019 5.279 35.379 1.00 0.00 H 0 +HETATM14900 H2 HOH A4859 46.592 5.105 34.866 1.00 0.00 H 0 +HETATM14901 O HOH A4860 44.108 52.109 32.565 1.00 0.00 O 0 +HETATM14902 H1 HOH A4860 43.606 51.401 32.213 1.00 0.00 H 0 +HETATM14903 H2 HOH A4860 44.705 52.459 31.891 1.00 0.00 H 0 +HETATM14904 O HOH A4861 47.954 40.155 29.878 1.00 0.00 O 0 +HETATM14905 H1 HOH A4861 48.135 40.572 29.087 1.00 0.00 H 0 +HETATM14906 H2 HOH A4861 47.485 40.765 30.410 1.00 0.00 H 0 +HETATM14907 O HOH A4862 40.618 18.085 3.755 1.00 0.00 O 0 +HETATM14908 H1 HOH A4862 39.980 18.853 3.807 1.00 0.00 H 0 +HETATM14909 H2 HOH A4862 41.432 18.576 3.710 1.00 0.00 H 0 +HETATM14910 O HOH A4863 45.388 37.796 25.207 1.00 0.00 O 0 +HETATM14911 H1 HOH A4863 45.591 38.177 24.309 1.00 0.00 H 0 +HETATM14912 H2 HOH A4863 45.202 38.567 25.791 1.00 0.00 H 0 +HETATM14913 O HOH A4864 37.832 45.960 26.619 1.00 0.00 O 0 +HETATM14914 H1 HOH A4864 38.186 46.851 26.925 1.00 0.00 H 0 +HETATM14915 H2 HOH A4864 37.665 46.028 25.692 1.00 0.00 H 0 +HETATM14916 O HOH A4865 50.338 12.116 43.064 1.00 0.00 O 0 +HETATM14917 H1 HOH A4865 50.654 11.504 42.410 1.00 0.00 H 0 +HETATM14918 H2 HOH A4865 50.677 11.704 43.885 1.00 0.00 H 0 +HETATM14919 O HOH A4866 32.274 33.521 53.248 1.00 0.00 O 0 +HETATM14920 H1 HOH A4866 32.346 32.589 53.380 1.00 0.00 H 0 +HETATM14921 H2 HOH A4866 31.448 33.755 52.729 1.00 0.00 H 0 +HETATM14922 O HOH A4867 29.454 33.410 51.721 1.00 0.00 O 0 +HETATM14923 H1 HOH A4867 29.129 34.251 52.099 1.00 0.00 H 0 +HETATM14924 H2 HOH A4867 28.726 33.167 51.128 1.00 0.00 H 0 +HETATM14925 O HOH A4868 1.224 36.470 28.634 1.00 0.00 O 0 +HETATM14926 H1 HOH A4868 0.539 36.754 28.021 1.00 0.00 H 0 +HETATM14927 H2 HOH A4868 1.550 37.298 28.915 1.00 0.00 H 0 +HETATM14928 O HOH A4869 20.244 10.133 17.103 1.00 0.00 O 0 +HETATM14929 H1 HOH A4869 19.539 9.966 17.715 1.00 0.00 H 0 +HETATM14930 H2 HOH A4869 19.893 10.373 16.171 1.00 0.00 H 0 +HETATM14931 O HOH A4870 52.375 3.349 42.286 1.00 0.00 O 0 +HETATM14932 H1 HOH A4870 51.959 3.680 41.473 1.00 0.00 H 0 +HETATM14933 H2 HOH A4870 53.336 3.316 41.962 1.00 0.00 H 0 +HETATM14934 O HOH A4871 14.950 33.509 0.515 1.00 0.00 O 0 +HETATM14935 H1 HOH A4871 15.579 34.107 1.067 1.00 0.00 H 0 +HETATM14936 H2 HOH A4871 15.213 33.635 -0.444 1.00 0.00 H 0 +HETATM14937 O HOH A4872 35.777 32.762 30.654 1.00 0.00 O 0 +HETATM14938 H1 HOH A4872 35.799 33.745 30.617 1.00 0.00 H 0 +HETATM14939 H2 HOH A4872 34.898 32.539 31.037 1.00 0.00 H 0 +HETATM14940 O HOH A4873 4.575 38.321 10.711 1.00 0.00 O 0 +HETATM14941 H1 HOH A4873 4.259 38.238 11.621 1.00 0.00 H 0 +HETATM14942 H2 HOH A4873 5.494 38.075 10.734 1.00 0.00 H 0 +HETATM14943 O HOH A4874 1.058 26.726 11.676 1.00 0.00 O 0 +HETATM14944 H1 HOH A4874 1.563 25.965 11.362 1.00 0.00 H 0 +HETATM14945 H2 HOH A4874 1.730 27.384 11.735 1.00 0.00 H 0 +HETATM14946 O HOH A4875 5.503 20.991 17.154 1.00 0.00 O 0 +HETATM14947 H1 HOH A4875 5.561 20.933 16.209 1.00 0.00 H 0 +HETATM14948 H2 HOH A4875 6.196 21.688 17.359 1.00 0.00 H 0 +HETATM14949 O HOH A4876 47.792 17.913 6.203 1.00 0.00 O 0 +HETATM14950 H1 HOH A4876 47.159 17.851 6.991 1.00 0.00 H 0 +HETATM14951 H2 HOH A4876 47.700 17.077 5.760 1.00 0.00 H 0 +HETATM14952 O HOH A4877 50.674 40.914 10.896 1.00 0.00 O 0 +HETATM14953 H1 HOH A4877 49.991 41.612 10.940 1.00 0.00 H 0 +HETATM14954 H2 HOH A4877 51.005 40.941 9.938 1.00 0.00 H 0 +HETATM14955 O HOH A4878 17.068 44.339 34.145 1.00 0.00 O 0 +HETATM14956 H1 HOH A4878 17.879 44.706 34.545 1.00 0.00 H 0 +HETATM14957 H2 HOH A4878 16.953 43.510 34.633 1.00 0.00 H 0 +HETATM14958 O HOH A4879 22.957 11.098 17.004 1.00 0.00 O 0 +HETATM14959 H1 HOH A4879 22.049 10.893 17.389 1.00 0.00 H 0 +HETATM14960 H2 HOH A4879 23.469 11.409 17.722 1.00 0.00 H 0 +HETATM14961 O HOH A4880 51.993 18.970 11.722 1.00 0.00 O 0 +HETATM14962 H1 HOH A4880 52.487 19.099 12.512 1.00 0.00 H 0 +HETATM14963 H2 HOH A4880 52.542 18.685 10.950 1.00 0.00 H 0 +HETATM14964 O HOH A4881 16.846 28.246 44.522 1.00 0.00 O 0 +HETATM14965 H1 HOH A4881 17.102 28.316 45.406 1.00 0.00 H 0 +HETATM14966 H2 HOH A4881 16.936 29.178 44.286 1.00 0.00 H 0 +HETATM14967 O HOH A4882 16.182 14.050 1.663 1.00 0.00 O 0 +HETATM14968 H1 HOH A4882 16.762 13.423 1.180 1.00 0.00 H 0 +HETATM14969 H2 HOH A4882 15.263 13.755 1.474 1.00 0.00 H 0 +HETATM14970 O HOH A4883 15.289 14.870 17.055 1.00 0.00 O 0 +HETATM14971 H1 HOH A4883 15.687 15.050 17.911 1.00 0.00 H 0 +HETATM14972 H2 HOH A4883 15.473 13.937 16.963 1.00 0.00 H 0 +HETATM14973 O HOH A4884 40.218 19.167 7.105 1.00 0.00 O 0 +HETATM14974 H1 HOH A4884 39.985 18.294 6.864 1.00 0.00 H 0 +HETATM14975 H2 HOH A4884 41.178 19.205 7.137 1.00 0.00 H 0 +HETATM14976 O HOH A4885 50.169 14.222 2.284 1.00 0.00 O 0 +HETATM14977 H1 HOH A4885 50.607 13.436 2.624 1.00 0.00 H 0 +HETATM14978 H2 HOH A4885 49.793 14.766 2.986 1.00 0.00 H 0 +HETATM14979 O HOH A4886 28.375 32.478 16.786 1.00 0.00 O 0 +HETATM14980 H1 HOH A4886 28.708 31.945 17.561 1.00 0.00 H 0 +HETATM14981 H2 HOH A4886 27.689 31.893 16.447 1.00 0.00 H 0 +HETATM14982 O HOH A4887 25.404 35.692 15.214 1.00 0.00 O 0 +HETATM14983 H1 HOH A4887 26.332 35.658 15.328 1.00 0.00 H 0 +HETATM14984 H2 HOH A4887 25.370 36.090 14.348 1.00 0.00 H 0 +HETATM14985 O HOH A4888 3.005 42.647 22.655 1.00 0.00 O 0 +HETATM14986 H1 HOH A4888 3.301 43.451 22.274 1.00 0.00 H 0 +HETATM14987 H2 HOH A4888 3.689 42.281 23.297 1.00 0.00 H 0 +HETATM14988 O HOH A4889 26.074 10.838 51.229 1.00 0.00 O 0 +HETATM14989 H1 HOH A4889 26.212 11.793 51.134 1.00 0.00 H 0 +HETATM14990 H2 HOH A4889 26.810 10.393 50.763 1.00 0.00 H 0 +HETATM14991 O HOH A4890 43.436 28.384 8.619 1.00 0.00 O 0 +HETATM14992 H1 HOH A4890 43.844 27.591 8.152 1.00 0.00 H 0 +HETATM14993 H2 HOH A4890 44.098 28.754 9.215 1.00 0.00 H 0 +HETATM14994 O HOH A4891 20.994 37.082 7.531 1.00 0.00 O 0 +HETATM14995 H1 HOH A4891 20.587 37.985 7.487 1.00 0.00 H 0 +HETATM14996 H2 HOH A4891 21.740 37.075 6.853 1.00 0.00 H 0 +HETATM14997 O HOH A4892 9.863 40.996 52.070 1.00 0.00 O 0 +HETATM14998 H1 HOH A4892 10.517 40.557 51.575 1.00 0.00 H 0 +HETATM14999 H2 HOH A4892 10.292 41.236 52.820 1.00 0.00 H 0 +HETATM15000 O HOH A4893 0.794 12.260 11.652 1.00 0.00 O 0 +HETATM15001 H1 HOH A4893 0.451 13.186 11.469 1.00 0.00 H 0 +HETATM15002 H2 HOH A4893 0.732 12.025 12.534 1.00 0.00 H 0 +HETATM15003 O HOH A4894 45.014 36.013 41.990 1.00 0.00 O 0 +HETATM15004 H1 HOH A4894 45.907 35.930 42.400 1.00 0.00 H 0 +HETATM15005 H2 HOH A4894 45.003 36.888 41.707 1.00 0.00 H 0 +HETATM15006 O HOH A4895 15.870 38.010 50.395 1.00 0.00 O 0 +HETATM15007 H1 HOH A4895 15.263 38.127 49.624 1.00 0.00 H 0 +HETATM15008 H2 HOH A4895 15.429 37.644 51.183 1.00 0.00 H 0 +HETATM15009 O HOH A4896 50.909 34.307 50.310 1.00 0.00 O 0 +HETATM15010 H1 HOH A4896 51.462 33.960 49.671 1.00 0.00 H 0 +HETATM15011 H2 HOH A4896 51.347 35.123 50.680 1.00 0.00 H 0 +HETATM15012 O HOH A4897 49.451 49.020 10.258 1.00 0.00 O 0 +HETATM15013 H1 HOH A4897 50.285 48.518 10.046 1.00 0.00 H 0 +HETATM15014 H2 HOH A4897 48.891 48.479 10.815 1.00 0.00 H 0 +HETATM15015 O HOH A4898 38.659 37.528 25.459 1.00 0.00 O 0 +HETATM15016 H1 HOH A4898 38.970 36.935 26.137 1.00 0.00 H 0 +HETATM15017 H2 HOH A4898 38.825 38.395 25.705 1.00 0.00 H 0 +HETATM15018 O HOH A4899 43.990 11.305 26.317 1.00 0.00 O 0 +HETATM15019 H1 HOH A4899 43.313 10.586 26.215 1.00 0.00 H 0 +HETATM15020 H2 HOH A4899 44.071 11.687 25.423 1.00 0.00 H 0 +HETATM15021 O HOH A4900 15.211 10.187 22.886 1.00 0.00 O 0 +HETATM15022 H1 HOH A4900 14.650 9.420 22.683 1.00 0.00 H 0 +HETATM15023 H2 HOH A4900 14.673 10.764 23.498 1.00 0.00 H 0 +HETATM15024 O HOH A4901 49.993 1.567 51.689 1.00 0.00 O 0 +HETATM15025 H1 HOH A4901 49.441 1.279 52.462 1.00 0.00 H 0 +HETATM15026 H2 HOH A4901 49.472 1.213 50.944 1.00 0.00 H 0 +HETATM15027 O HOH A4902 45.264 45.301 10.300 1.00 0.00 O 0 +HETATM15028 H1 HOH A4902 45.423 44.581 10.945 1.00 0.00 H 0 +HETATM15029 H2 HOH A4902 45.512 44.849 9.452 1.00 0.00 H 0 +HETATM15030 O HOH A4903 29.625 34.365 9.024 1.00 0.00 O 0 +HETATM15031 H1 HOH A4903 29.278 33.664 9.582 1.00 0.00 H 0 +HETATM15032 H2 HOH A4903 29.478 35.265 9.363 1.00 0.00 H 0 +HETATM15033 O HOH A4904 27.088 2.109 8.372 1.00 0.00 O 0 +HETATM15034 H1 HOH A4904 26.341 1.972 7.830 1.00 0.00 H 0 +HETATM15035 H2 HOH A4904 26.937 1.551 9.135 1.00 0.00 H 0 +HETATM15036 O HOH A4905 12.058 44.358 38.256 1.00 0.00 O 0 +HETATM15037 H1 HOH A4905 11.048 44.187 38.141 1.00 0.00 H 0 +HETATM15038 H2 HOH A4905 12.679 43.922 37.674 1.00 0.00 H 0 +HETATM15039 O HOH A4906 48.604 32.177 22.272 1.00 0.00 O 0 +HETATM15040 H1 HOH A4906 49.391 32.668 22.237 1.00 0.00 H 0 +HETATM15041 H2 HOH A4906 48.255 32.337 23.174 1.00 0.00 H 0 +HETATM15042 O HOH A4907 18.675 1.422 6.626 1.00 0.00 O 0 +HETATM15043 H1 HOH A4907 19.470 1.572 7.146 1.00 0.00 H 0 +HETATM15044 H2 HOH A4907 18.796 1.867 5.815 1.00 0.00 H 0 +HETATM15045 O HOH A4908 1.167 11.192 28.176 1.00 0.00 O 0 +HETATM15046 H1 HOH A4908 1.456 12.024 28.505 1.00 0.00 H 0 +HETATM15047 H2 HOH A4908 0.205 11.251 28.457 1.00 0.00 H 0 +HETATM15048 O HOH A4909 22.250 33.399 16.245 1.00 0.00 O 0 +HETATM15049 H1 HOH A4909 22.671 33.991 16.848 1.00 0.00 H 0 +HETATM15050 H2 HOH A4909 21.348 33.139 16.550 1.00 0.00 H 0 +HETATM15051 O HOH A4910 49.758 2.024 45.564 1.00 0.00 O 0 +HETATM15052 H1 HOH A4910 49.437 2.741 46.055 1.00 0.00 H 0 +HETATM15053 H2 HOH A4910 50.716 2.137 45.543 1.00 0.00 H 0 +HETATM15054 O HOH A4911 53.171 31.927 22.611 1.00 0.00 O 0 +HETATM15055 H1 HOH A4911 53.659 32.344 23.318 1.00 0.00 H 0 +HETATM15056 H2 HOH A4911 53.898 31.612 21.992 1.00 0.00 H 0 +HETATM15057 O HOH A4912 1.133 45.876 18.058 1.00 0.00 O 0 +HETATM15058 H1 HOH A4912 1.081 45.191 17.390 1.00 0.00 H 0 +HETATM15059 H2 HOH A4912 2.033 46.249 17.856 1.00 0.00 H 0 +HETATM15060 O HOH A4913 5.435 27.922 25.672 1.00 0.00 O 0 +HETATM15061 H1 HOH A4913 6.159 28.309 26.235 1.00 0.00 H 0 +HETATM15062 H2 HOH A4913 5.421 26.934 25.872 1.00 0.00 H 0 +HETATM15063 O HOH A4914 12.250 53.204 15.729 1.00 0.00 O 0 +HETATM15064 H1 HOH A4914 11.816 53.886 15.282 1.00 0.00 H 0 +HETATM15065 H2 HOH A4914 12.832 53.595 16.405 1.00 0.00 H 0 +HETATM15066 O HOH A4915 7.974 35.744 38.233 1.00 0.00 O 0 +HETATM15067 H1 HOH A4915 7.316 35.612 38.934 1.00 0.00 H 0 +HETATM15068 H2 HOH A4915 7.465 35.598 37.458 1.00 0.00 H 0 +HETATM15069 O HOH A4916 20.020 50.052 21.810 1.00 0.00 O 0 +HETATM15070 H1 HOH A4916 20.432 49.645 21.025 1.00 0.00 H 0 +HETATM15071 H2 HOH A4916 20.183 49.417 22.544 1.00 0.00 H 0 +HETATM15072 O HOH A4917 16.547 14.001 38.681 1.00 0.00 O 0 +HETATM15073 H1 HOH A4917 16.850 13.100 39.007 1.00 0.00 H 0 +HETATM15074 H2 HOH A4917 15.639 13.987 38.819 1.00 0.00 H 0 +HETATM15075 O HOH A4918 20.312 29.475 4.780 1.00 0.00 O 0 +HETATM15076 H1 HOH A4918 19.413 29.668 4.518 1.00 0.00 H 0 +HETATM15077 H2 HOH A4918 20.440 29.514 5.802 1.00 0.00 H 0 +HETATM15078 O HOH A4919 26.821 20.087 48.117 1.00 0.00 O 0 +HETATM15079 H1 HOH A4919 26.942 20.422 49.000 1.00 0.00 H 0 +HETATM15080 H2 HOH A4919 26.026 20.562 47.829 1.00 0.00 H 0 +HETATM15081 O HOH A4920 50.972 36.426 18.355 1.00 0.00 O 0 +HETATM15082 H1 HOH A4920 50.018 36.378 18.643 1.00 0.00 H 0 +HETATM15083 H2 HOH A4920 51.364 35.626 18.033 1.00 0.00 H 0 +HETATM15084 O HOH A4921 50.644 15.139 23.254 1.00 0.00 O 0 +HETATM15085 H1 HOH A4921 51.213 15.606 23.949 1.00 0.00 H 0 +HETATM15086 H2 HOH A4921 50.650 15.761 22.527 1.00 0.00 H 0 +HETATM15087 O HOH A4922 1.416 30.529 37.941 1.00 0.00 O 0 +HETATM15088 H1 HOH A4922 1.653 30.396 38.852 1.00 0.00 H 0 +HETATM15089 H2 HOH A4922 0.729 29.881 37.631 1.00 0.00 H 0 +HETATM15090 O HOH A4923 31.619 28.107 48.327 1.00 0.00 O 0 +HETATM15091 H1 HOH A4923 30.629 28.211 48.587 1.00 0.00 H 0 +HETATM15092 H2 HOH A4923 32.113 28.929 48.340 1.00 0.00 H 0 +HETATM15093 O HOH A4924 10.431 27.349 48.263 1.00 0.00 O 0 +HETATM15094 H1 HOH A4924 11.170 27.970 48.600 1.00 0.00 H 0 +HETATM15095 H2 HOH A4924 10.912 26.608 47.858 1.00 0.00 H 0 +HETATM15096 O HOH A4925 21.058 50.457 53.211 1.00 0.00 O 0 +HETATM15097 H1 HOH A4925 21.295 51.349 52.879 1.00 0.00 H 0 +HETATM15098 H2 HOH A4925 20.339 50.520 53.847 1.00 0.00 H 0 +HETATM15099 O HOH A4926 27.801 27.850 33.044 1.00 0.00 O 0 +HETATM15100 H1 HOH A4926 26.884 27.837 33.227 1.00 0.00 H 0 +HETATM15101 H2 HOH A4926 27.951 28.774 32.706 1.00 0.00 H 0 +HETATM15102 O HOH A4927 37.537 41.619 42.958 1.00 0.00 O 0 +HETATM15103 H1 HOH A4927 37.920 40.752 43.234 1.00 0.00 H 0 +HETATM15104 H2 HOH A4927 37.183 41.990 43.773 1.00 0.00 H 0 +HETATM15105 O HOH A4928 7.651 19.462 49.517 1.00 0.00 O 0 +HETATM15106 H1 HOH A4928 7.808 18.499 49.306 1.00 0.00 H 0 +HETATM15107 H2 HOH A4928 7.941 19.821 48.689 1.00 0.00 H 0 +HETATM15108 O HOH A4929 47.588 15.131 44.507 1.00 0.00 O 0 +HETATM15109 H1 HOH A4929 48.288 14.686 44.106 1.00 0.00 H 0 +HETATM15110 H2 HOH A4929 47.107 15.637 43.844 1.00 0.00 H 0 +HETATM15111 O HOH A4930 14.585 10.393 53.010 1.00 0.00 O 0 +HETATM15112 H1 HOH A4930 15.137 10.374 52.220 1.00 0.00 H 0 +HETATM15113 H2 HOH A4930 13.724 9.945 52.867 1.00 0.00 H 0 +HETATM15114 O HOH A4931 38.871 32.013 51.255 1.00 0.00 O 0 +HETATM15115 H1 HOH A4931 38.938 31.323 51.972 1.00 0.00 H 0 +HETATM15116 H2 HOH A4931 37.940 32.043 50.996 1.00 0.00 H 0 +HETATM15117 O HOH A4932 14.321 44.834 11.327 1.00 0.00 O 0 +HETATM15118 H1 HOH A4932 14.365 45.020 12.291 1.00 0.00 H 0 +HETATM15119 H2 HOH A4932 14.559 43.899 11.437 1.00 0.00 H 0 +HETATM15120 O HOH A4933 21.149 21.673 37.038 1.00 0.00 O 0 +HETATM15121 H1 HOH A4933 20.804 20.888 36.640 1.00 0.00 H 0 +HETATM15122 H2 HOH A4933 20.382 22.244 37.098 1.00 0.00 H 0 +ENDMDL From d524f1ccee28e0be2cd7d5f2b9748dda2f14bcae Mon Sep 17 00:00:00 2001 From: Minou Emmad Date: Fri, 31 Oct 2025 17:17:28 -0500 Subject: [PATCH 03/18] Add PhMinimizeTest --- .../algorithms/commands/PhMinimizeTest.java | 78 +++++++++++++++++++ 1 file changed, 78 insertions(+) create mode 100644 modules/algorithms/src/test/java/ffx/algorithms/commands/PhMinimizeTest.java diff --git a/modules/algorithms/src/test/java/ffx/algorithms/commands/PhMinimizeTest.java b/modules/algorithms/src/test/java/ffx/algorithms/commands/PhMinimizeTest.java new file mode 100644 index 0000000000..5d9f2058a8 --- /dev/null +++ b/modules/algorithms/src/test/java/ffx/algorithms/commands/PhMinimizeTest.java @@ -0,0 +1,78 @@ +// ****************************************************************************** +// +// Title: Force Field X. +// Description: Force Field X - Software for Molecular Biophysics. +// Copyright: Copyright (c) Michael J. Schnieders 2001-2025. +// +// This file is part of Force Field X. +// +// Force Field X is free software; you can redistribute it and/or modify it +// under the terms of the GNU General Public License version 3 as published by +// the Free Software Foundation. +// +// Force Field X is distributed in the hope that it will be useful, but WITHOUT +// ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS +// FOR A PARTICULAR PURPOSE. See the GNU General Public License for more +// details. +// +// You should have received a copy of the GNU General Public License along with +// Force Field X; if not, write to the Free Software Foundation, Inc., 59 Temple +// Place, Suite 330, Boston, MA 02111-1307 USA +// +// Linking this library statically or dynamically with other modules is making a +// combined work based on this library. Thus, the terms and conditions of the +// GNU General Public License cover the whole combination. +// +// As a special exception, the copyright holders of this library give you +// permission to link this library with independent modules to produce an +// executable, regardless of the license terms of these independent modules, and +// to copy and distribute the resulting executable under terms of your choice, +// provided that you also meet, for each linked independent module, the terms +// and conditions of the license of that module. An independent module is a +// module which is not derived from or based on this library. If you modify this +// library, you may extend this exception to your version of the library, but +// you are not obligated to do so. If you do not wish to do so, delete this +// exception statement from your version. +// +// ****************************************************************************** +package ffx.algorithms.commands; + +import ffx.algorithms.misc.AlgorithmsTest; +import org.junit.Assert; +import org.junit.Test; + +public class PhMinimizeTest extends AlgorithmsTest { + + /** Tests basic PhMinimize functionality with HP36 protein. */ + @Test + public void testPhMinimizeHP36() { + // Set-up the input arguments for the script. + String[] args = {"--pH", "7.4", getResourcePath("hp36_1vii_solv.pdb")}; + binding.setVariable("args", args); + binding.setVariable("baseDir", registerTemporaryDirectory().toFile()); + + // Evaluate the script. + PhMinimize phMinimize = new PhMinimize(binding).run(); + algorithmsScript = phMinimize; + + // Get the final energy from the ForceFieldEnergy + double actualTotalEnergy = phMinimize.getForceFieldEnergy().getTotalEnergy(); + + // Expected energy from the reference output + double expectedTotalEnergy = -45861.68866773; + + // Use same tolerance pattern as MinimizeTest + Assert.assertEquals(expectedTotalEnergy, actualTotalEnergy, 1.0); + } + + @Test + public void testPhMinimizeHelp() { + // Set-up the input arguments for the script. + String[] args = {"-h"}; + binding.setVariable("args", args); + + // Evaluate the script. + PhMinimize phMinimize = new PhMinimize(binding).run(); + algorithmsScript = phMinimize; + } +} From 78ce05e97bcf82ab5f4329ba009aa715df262d7b Mon Sep 17 00:00:00 2001 From: Minou Emmad Date: Fri, 31 Oct 2025 17:18:21 -0500 Subject: [PATCH 04/18] fixed hp36_1vii_solv.key --- modules/algorithms/src/test/resources/hp36_1vii_solv.key | 4 ---- 1 file changed, 4 deletions(-) diff --git a/modules/algorithms/src/test/resources/hp36_1vii_solv.key b/modules/algorithms/src/test/resources/hp36_1vii_solv.key index 5a99be13ff..2b04494934 100644 --- a/modules/algorithms/src/test/resources/hp36_1vii_solv.key +++ b/modules/algorithms/src/test/resources/hp36_1vii_solv.key @@ -1,10 +1,6 @@ forcefield amoeba-bio-2018-cphmd esv.friction 0.5 -pH.Windows 1.00 1.50 2.00 2.50 3.00 3.50 4.00 4.50 5.00 5.50 6.00 6.50 -esv.special.residues 44 45 46 72 -esv.special.residues.pka 3.1 4.0 3.5 4.4 -guess.titration.state true ASH.titration.bias.magnitude 4.0 ASH.tautomer.bias.magnitude 2.0 From 3738f908efa069d3ca69c9ed26083363f5aa3832 Mon Sep 17 00:00:00 2001 From: acthiel212 Date: Thu, 13 Nov 2025 13:52:35 -0600 Subject: [PATCH 05/18] Added support for selection of chain IDs to RB estimator --- .../commands/test/RaoBlackwellEstimator.java | 10 +++++++--- 1 file changed, 7 insertions(+), 3 deletions(-) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/RaoBlackwellEstimator.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/RaoBlackwellEstimator.java index ddf5259333..bdc952aaa7 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/RaoBlackwellEstimator.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/RaoBlackwellEstimator.java @@ -91,6 +91,10 @@ public class RaoBlackwellEstimator extends AlgorithmsCommand { description = "Specified residues are set to discrete state when doing analysis.") private double discreteState = 0.0; + @Option(names = {"--chain", "--ch"}, paramLabel = " ", defaultValue = "A", + description = "Single character chain name (default is \'A\').") + private Character chain = 'A'; + @Option(names = {"--bootstrapIter"}, paramLabel = "100000", defaultValue = "100000", description = "Number of bootstrap iterations. Set -1 for no bootstrapping.") private int bootstrapIter; @@ -184,7 +188,7 @@ public RaoBlackwellEstimator run() { } else if (esvSystem.getSpecialResidueList().size() == 1) { int specialResidueNumber = esvSystem.getSpecialResidueList().get(0).intValue(); for (Residue residue : esvSystem.getTitratingResidueList()) { - if (residue.getResidueNumber() == specialResidueNumber) { + if (residue.getResidueNumber() == specialResidueNumber && residue.getChainID() == chain) { specialResidue = residue; } } @@ -250,7 +254,7 @@ public RaoBlackwellEstimator run() { } int index=0; for (Residue residue : esvSystem.getTitratingResidueList()) { - if (ArrayUtils.contains(dsResidueNums, residue.getResidueNumber())) { + if (ArrayUtils.contains(dsResidueNums, residue.getResidueNumber()) && residue.getChainID() == chain) { dsResidues[index] = residue; index++; } @@ -261,7 +265,7 @@ public RaoBlackwellEstimator run() { if(specifiedResidues != null){ for (int i = 0; i < esvSystem.getTitratingResidueList().size(); i++) { Residue residue = esvSystem.getTitratingResidueList().get(i); - if (ArrayUtils.contains(specifiedResidues, residue.getResidueNumber())) { + if (ArrayUtils.contains(specifiedResidues, residue.getResidueNumber()) && residue.getChainID() == chain) { onlyResidues.add(residue); onlyResidueIndices.add(i); } From 6d61a25a3fc65ca62076c957fa0032cdb965fda1 Mon Sep 17 00:00:00 2001 From: acthiel212 Date: Wed, 3 Dec 2025 14:33:01 -0600 Subject: [PATCH 06/18] Updated RBE so that the option to select discrete state residues could be left empty without error --- .../ffx/algorithms/commands/test/RaoBlackwellEstimator.java | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/RaoBlackwellEstimator.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/RaoBlackwellEstimator.java index bdc952aaa7..157b0d062e 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/RaoBlackwellEstimator.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/RaoBlackwellEstimator.java @@ -243,9 +243,9 @@ public RaoBlackwellEstimator run() { } } - int[] dsResidueNums = null; + int[] dsResidueNums; Residue[] dsResidues = null; - if(discreteStateResidues != ""){ + if(discreteStateResidues != null && !discreteStateResidues.isEmpty()){ String[] discreteStateResiduesString = discreteStateResidues.split(","); dsResidueNums = new int[discreteStateResiduesString.length]; dsResidues = new Residue[dsResidueNums.length]; From c838538625ab02c17c3443adb581eacafb729e22 Mon Sep 17 00:00:00 2001 From: minouemmad Date: Wed, 11 Feb 2026 15:04:55 -0600 Subject: [PATCH 07/18] Start of adding Boresch restraints to FFX --- .../commands/test/FindRestraints.java | 351 +++++++++++++++++- 1 file changed, 349 insertions(+), 2 deletions(-) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java index 3b03d7a80f..c4a4efdba7 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java @@ -50,6 +50,10 @@ import java.util.Arrays; import java.util.List; +import java.util.*; +import static java.lang.Math.*; +import org.apache.commons.math3.linear.Array2DRowRealMatrix; +import org.apache.commons.math3.linear.EigenDecomposition; import static java.lang.String.format; /** @@ -60,7 +64,8 @@ *
* ffxc test.FindRestraints [options] <filename> */ -@Command(description = " Find guest atoms to restrain near host molecule.", name = "test.FindRestraints") +@Command(description = "Find guest atoms for COM or Boresch restraints.", + name = "test.FindRestraints") public class FindRestraints extends AlgorithmsCommand { /** @@ -84,6 +89,39 @@ public class FindRestraints extends AlgorithmsCommand { description = "Cutoff to use when selecting guest atoms near host COM") private double distanceCutoff; + // ------------------------ + // Boresch Options + // ------------------------ + + @Option(names = {"--boresch"}, defaultValue = "false", + description = "Use Boresch anchor selection instead of COM-based selection.") + private boolean boresch; + + // From GHOAT paper, H1, H2, H3 are explicitly defined by the user + @Option(names = {"--H1"}, paramLabel = "int", + description = "Host anchor H1 atom index.") + private Integer H1Index; + + @Option(names = {"--H2"}, paramLabel = "int", + description = "Host anchor H2 atom index.") + private Integer H2Index; + + @Option(names = {"--H3"}, paramLabel = "int", + description = "Host anchor H3 atom index.") + private Integer H3Index; + + @Option(names = {"--l1Range"}, defaultValue = "3.5", + description = "Cylinder diameter/height for G1 search.") + private double l1Range; + + @Option(names = {"--minAdis"}, defaultValue = "1.5", + description = "Minimum distance between guest anchors.") + private double minAdis; + + @Option(names = {"--maxAdis"}, defaultValue = "5.0", + description = "Maximum distance between guest anchors.") + private double maxAdis; + /** * One or more filenames. */ @@ -142,13 +180,39 @@ public FindRestraints run() { logger.info(helpString()); return this; } + Molecule host = null; + Molecule guest = null; + + for (Molecule mol : activeAssembly.getMoleculeArray()) { + if (mol.getName().contains(hostName)) host = mol; + if (mol.getName().contains(guestName)) guest = mol; + } + if (host == null || guest == null) { + logger.severe("Host or Guest molecule not found."); + return this; + } + + if (boresch) { + runBoreschMode(host, guest); + } else { + runCOMMode(); + } + + return this; + } + + // ================================================================ + // ==================== COM MODE ================================= + // ================================================================ + private void runCOMMode() { Molecule[] molArr = activeAssembly.getMoleculeArray(); List restrainHostList = new ArrayList<>(); List restrainList = new ArrayList<>(); double[] COM = new double[3]; double[] subCOM = new double[3]; + int[] restrainHostIndices = new int[]{11, 16, 17, 20, 23, 26, 31, 32, 39, 40, 51, 63, 64, 70, 71, 82, 94, 95, 101, 102, 113, 125, 126, 132, 133, 144, 156, 157, 163, 164, 175, 187, 188, 191, 198}; for (Molecule molecule : molArr) { logger.info(format(" Molecule name: " + molecule.getName())); @@ -191,7 +255,290 @@ public FindRestraints run() { .toArray(); logger.info(format(" Restrain list indices: " + Arrays.toString(restrainIndices))); - return this; + } + + // ================================================================ + // ==================== BORESCH MODE ============================== + // ================================================================ + + /** + * Calculate rotation matrix to align host to Z-axis + */ + private double[][] getAlignmentRotationMatrix(Atom[] hostAtoms, double[] com) { + // Compute inertia tensor + double[][] I = new double[3][3]; + + for (Atom atom : hostAtoms) { + double m = atom.getMass(); + double[] r = atom.getXYZ().get(); + // Use coordinates relative to COM + double rx = r[0] - com[0]; + double ry = r[1] - com[1]; + double rz = r[2] - com[2]; + + I[0][0] += m * (ry*ry + rz*rz); + I[1][1] += m * (rx*rx + rz*rz); + I[2][2] += m * (rx*rx + ry*ry); + + I[0][1] -= m * rx*ry; + I[0][2] -= m * rx*rz; + I[1][2] -= m * ry*rz; + } + + I[1][0] = I[0][1]; + I[2][0] = I[0][2]; + I[2][1] = I[1][2]; + + // Diagonalize inertia tensor + EigenDecomposition ed = new EigenDecomposition(new Array2DRowRealMatrix(I)); + return ed.getV().getData(); + } + + /** + * Apply translation and rotation transformation to atoms + */ + private void applyTransformation(Atom[] atoms, double[] com, double[][] rotationMatrix) { + for (Atom atom : atoms) { + double[] r = atom.getXYZ().get(); + + // Translate to origin + double tx = r[0] - com[0]; + double ty = r[1] - com[1]; + double tz = r[2] - com[2]; + + // Rotate + double[] rotated = new double[3]; + for (int i = 0; i < 3; i++) { + rotated[i] = rotationMatrix[i][0]*tx + + rotationMatrix[i][1]*ty + + rotationMatrix[i][2]*tz; + } + + atom.setXYZ(rotated); // Set the new coordinates + } + } + + private void runBoreschMode(Molecule host, Molecule guest) { + + if (H1Index == null || H2Index == null || H3Index == null) { + logger.severe("Boresch mode requires --H1 --H2 --H3 indices."); + return; + } + + Atom H1 = findAtomByIndex(host, H1Index); + Atom H2 = findAtomByIndex(host, H2Index); + Atom H3 = findAtomByIndex(host, H3Index); + + if (H1 == null || H2 == null || H3 == null) { + logger.severe("Could not locate host anchor atoms."); + return; + } + + // Calculate principal axis from HOST ONLY + Atom[] hostAtoms = host.getAtomList().toArray(new Atom[0]); + double[] com = getCOM(hostAtoms); + double[][] rotationMatrix = getAlignmentRotationMatrix(hostAtoms, com); + + // Apply transformation to ALL atoms (host + guest) + Atom[] guestAtoms = guest.getAtomList().toArray(new Atom[0]); + applyTransformation(hostAtoms, com, rotationMatrix); + applyTransformation(guestAtoms, com, rotationMatrix); + + + Atom G1 = selectG1(guest); + if (G1 == null) return; + + Atom G2 = selectG2(guest, G1); + if (G2 == null) return; + + Atom G3 = selectG3(guest, G1, G2); + if (G3 == null) return; + + // Calculate all geometric parameters + double r = distance(H1.getXYZ().get(), G1.getXYZ().get()); + double thetaA = angle(H2, H1, G1); + double thetaB = angle(H1, G1, G2); + double phiA = dihedral(H3, H2, H1, G1); + double phiB = dihedral(H2, H1, G1, G2); + double phiC = dihedral(H1, G1, G2, G3); + + logger.info(format("Distance H1-G1 (r): %.3f Å", r)); + logger.info(format("Angle H2-H1-G1 (θA): %.2f°", thetaA)); + logger.info(format("Angle H1-G1-G2 (θB): %.2f°", thetaB)); + logger.info(format("Dihedral H3-H2-H1-G1 (φA): %.2f°", phiA)); + logger.info(format("Dihedral H2-H1-G1-G2 (φB): %.2f°", phiB)); + logger.info(format("Dihedral H1-G1-G2-G3 (φC): %.2f°", phiC)); + + // Validate geometry (warn about near-degenerate angles) + if (thetaA < 20.0 || thetaA > 160.0) { + logger.warning(format("Angle θA = %.2f° is near-degenerate.", thetaA)); + } + if (thetaB < 20.0 || thetaB > 160.0) { + logger.warning(format("Angle θB = %.2f° is near-degenerate.", thetaB)); + } + } + + /** + * Calculate dihedral angle between four atoms + */ + private static double dihedral(Atom a, Atom b, Atom c, Atom d) { + double[] v1 = subtract(a.getXYZ().get(), b.getXYZ().get()); + double[] v2 = subtract(c.getXYZ().get(), b.getXYZ().get()); + double[] v3 = subtract(d.getXYZ().get(), c.getXYZ().get()); + + double[] n1 = cross(v1, v2); + double[] n2 = cross(v2, v3); + + double[] m1 = cross(n1, v2); + + double x = dot(n1, n2); + double y = dot(m1, n2); + + return toDegrees(atan2(y, x)); + } + + private static double[] cross(double[] a, double[] b) { + return new double[]{ + a[1]*b[2] - a[2]*b[1], + a[2]*b[0] - a[0]*b[2], + a[0]*b[1] - a[1]*b[0] + }; + } + + private static double dot(double[] a, double[] b) { + return a[0]*b[0] + a[1]*b[1] + a[2]*b[2]; + } + + + // ================================================================ + // ==================== GUEST SELECTION =========================== + // ================================================================ + + private Atom selectG1(Molecule guest) { + double radius = l1Range / 2.0; + double radius2 = radius * radius; + double halfHeight = l1Range / 2.0; + + // MISSING: You need to declare these variables + Atom G1 = null; + double bestR2 = Double.MAX_VALUE; + + // MISSING: You need to iterate through guest atoms + for (Atom atom : guest.getAtomList()) { + if (!atom.isHeavy()) continue; + + double[] xyz = atom.getXYZ().get(); + double r2 = xyz[0]*xyz[0] + xyz[1]*xyz[1]; + + if (Math.abs(xyz[2]) <= halfHeight && r2 <= radius2) { + if (r2 < bestR2) { + bestR2 = r2; + G1 = atom; + } + } + } + + if (G1 == null) { + logger.severe("anch1 error: No valid G1 anchor found."); + return null; + } + + return G1; + } + + private Atom selectG2(Molecule guest, Atom G1) { + + Atom best = null; + double bestProj = Double.MAX_VALUE; + + double[] g1 = G1.getXYZ().get(); + + for (Atom atom : guest.getAtomList()) { + if (atom == G1 || !atom.isHeavy()) continue; + + double d = distance(g1, atom.getXYZ().get()); + if (d < minAdis || d > maxAdis) continue; + + double[] diff = subtract(atom.getXYZ().get(), g1); + double proj2 = diff[0] * diff[0] + diff[1] * diff[1]; + + if (proj2 < bestProj) { + best = atom; + bestProj = proj2; + } + } + if (best == null) { + logger.severe("anch2 error: Could not identify valid G2 anchor."); + } + + return best; + } + + private Atom selectG3(Molecule guest, Atom G1, Atom G2) { + Atom best = null; + double bestAngleDiff = Double.MAX_VALUE; + + for (Atom atom : guest.getAtomList()) { + if (atom == G1 || atom == G2 || !atom.isHeavy()) continue; + + // Check distance from G2 (as in GHOAT) + double d = distance(G2.getXYZ().get(), atom.getXYZ().get()); + if (d < minAdis || d > maxAdis) continue; + + // ADD: Also check distance from G1 to avoid clustering + double d_g1 = distance(G1.getXYZ().get(), atom.getXYZ().get()); + if (d_g1 < minAdis) continue; + + double ang = angle(G1, G2, atom); + + // Reject Degenerate Angles for G3 + if (ang < 20.0 || ang > 160.0) continue; + + double diff = abs(ang - 90.0); + + if (diff < bestAngleDiff) { + bestAngleDiff = diff; + best = atom; + } + } + + if (best == null) { + logger.severe("anch3 error: Could not identify valid G3 anchor."); + } + + return best; + } + + // ================================================================ + // ==================== GEOMETRY HELPERS ========================== + // ================================================================ + + private static double distance(double[] a, double[] b) { + return sqrt(pow(a[0] - b[0], 2) + + pow(a[1] - b[1], 2) + + pow(a[2] - b[2], 2)); + } + + private static double[] subtract(double[] a, double[] b) { + return new double[]{a[0] - b[0], a[1] - b[1], a[2] - b[2]}; + } + + private static double angle(Atom a, Atom b, Atom c) { + double[] v1 = subtract(a.getXYZ().get(), b.getXYZ().get()); + double[] v2 = subtract(c.getXYZ().get(), b.getXYZ().get()); + + double dot = v1[0]*v2[0] + v1[1]*v2[1] + v1[2]*v2[2]; + double mag1 = sqrt(v1[0]*v1[0] + v1[1]*v1[1] + v1[2]*v1[2]); + double mag2 = sqrt(v2[0]*v2[0] + v2[1]*v2[1] + v2[2]*v2[2]); + + return toDegrees(acos(dot / (mag1 * mag2))); + } + + private static Atom findAtomByIndex(Molecule mol, int index) { + for (Atom atom : mol.getAtomList()) { + if (atom.getIndex() == index) return atom; + } + return null; } /** From 90deb7bc926bd26161be466c311d48393410665e Mon Sep 17 00:00:00 2001 From: minouemmad Date: Fri, 13 Feb 2026 14:36:21 -0600 Subject: [PATCH 08/18] removed build error --- .../algorithms/commands/PhMinimizeTest.java | 78 ------------------- 1 file changed, 78 deletions(-) delete mode 100644 modules/algorithms/src/test/java/ffx/algorithms/commands/PhMinimizeTest.java diff --git a/modules/algorithms/src/test/java/ffx/algorithms/commands/PhMinimizeTest.java b/modules/algorithms/src/test/java/ffx/algorithms/commands/PhMinimizeTest.java deleted file mode 100644 index 5d9f2058a8..0000000000 --- a/modules/algorithms/src/test/java/ffx/algorithms/commands/PhMinimizeTest.java +++ /dev/null @@ -1,78 +0,0 @@ -// ****************************************************************************** -// -// Title: Force Field X. -// Description: Force Field X - Software for Molecular Biophysics. -// Copyright: Copyright (c) Michael J. Schnieders 2001-2025. -// -// This file is part of Force Field X. -// -// Force Field X is free software; you can redistribute it and/or modify it -// under the terms of the GNU General Public License version 3 as published by -// the Free Software Foundation. -// -// Force Field X is distributed in the hope that it will be useful, but WITHOUT -// ANY WARRANTY; without even the implied warranty of MERCHANTABILITY or FITNESS -// FOR A PARTICULAR PURPOSE. See the GNU General Public License for more -// details. -// -// You should have received a copy of the GNU General Public License along with -// Force Field X; if not, write to the Free Software Foundation, Inc., 59 Temple -// Place, Suite 330, Boston, MA 02111-1307 USA -// -// Linking this library statically or dynamically with other modules is making a -// combined work based on this library. Thus, the terms and conditions of the -// GNU General Public License cover the whole combination. -// -// As a special exception, the copyright holders of this library give you -// permission to link this library with independent modules to produce an -// executable, regardless of the license terms of these independent modules, and -// to copy and distribute the resulting executable under terms of your choice, -// provided that you also meet, for each linked independent module, the terms -// and conditions of the license of that module. An independent module is a -// module which is not derived from or based on this library. If you modify this -// library, you may extend this exception to your version of the library, but -// you are not obligated to do so. If you do not wish to do so, delete this -// exception statement from your version. -// -// ****************************************************************************** -package ffx.algorithms.commands; - -import ffx.algorithms.misc.AlgorithmsTest; -import org.junit.Assert; -import org.junit.Test; - -public class PhMinimizeTest extends AlgorithmsTest { - - /** Tests basic PhMinimize functionality with HP36 protein. */ - @Test - public void testPhMinimizeHP36() { - // Set-up the input arguments for the script. - String[] args = {"--pH", "7.4", getResourcePath("hp36_1vii_solv.pdb")}; - binding.setVariable("args", args); - binding.setVariable("baseDir", registerTemporaryDirectory().toFile()); - - // Evaluate the script. - PhMinimize phMinimize = new PhMinimize(binding).run(); - algorithmsScript = phMinimize; - - // Get the final energy from the ForceFieldEnergy - double actualTotalEnergy = phMinimize.getForceFieldEnergy().getTotalEnergy(); - - // Expected energy from the reference output - double expectedTotalEnergy = -45861.68866773; - - // Use same tolerance pattern as MinimizeTest - Assert.assertEquals(expectedTotalEnergy, actualTotalEnergy, 1.0); - } - - @Test - public void testPhMinimizeHelp() { - // Set-up the input arguments for the script. - String[] args = {"-h"}; - binding.setVariable("args", args); - - // Evaluate the script. - PhMinimize phMinimize = new PhMinimize(binding).run(); - algorithmsScript = phMinimize; - } -} From c08bff8ac06f9b83edd5f6eca158780388f63a1d Mon Sep 17 00:00:00 2001 From: minouemmad Date: Fri, 13 Feb 2026 14:48:33 -0600 Subject: [PATCH 09/18] updated the alignment and made the transform temporary, so anchor selection happens in a consistent frame and geometry is computed in original coordinates --- .../commands/test/FindRestraints.java | 136 ++++++++++++------ 1 file changed, 94 insertions(+), 42 deletions(-) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java index 83a112e04e..a22d076a7a 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java @@ -261,28 +261,30 @@ private void runCOMMode() { // ==================== BORESCH MODE ============================== // ================================================================ - /** - * Calculate rotation matrix to align host to Z-axis - */ - private double[][] getAlignmentRotationMatrix(Atom[] hostAtoms, double[] com) { + /** + * Calculate rotation matrix to align host to Z-axis. + * + * The returned matrix has rows = {x̂, ŷ, ẑ} so that r' = R * r. + */ + private double[][] getAlignmentRotationMatrix(Atom[] hostAtoms, double[] com) { // Compute inertia tensor double[][] I = new double[3][3]; for (Atom atom : hostAtoms) { - double m = atom.getMass(); - double[] r = atom.getXYZ().get(); - // Use coordinates relative to COM - double rx = r[0] - com[0]; - double ry = r[1] - com[1]; - double rz = r[2] - com[2]; - - I[0][0] += m * (ry*ry + rz*rz); - I[1][1] += m * (rx*rx + rz*rz); - I[2][2] += m * (rx*rx + ry*ry); - - I[0][1] -= m * rx*ry; - I[0][2] -= m * rx*rz; - I[1][2] -= m * ry*rz; + double m = atom.getMass(); + double[] r = atom.getXYZ().get(); + // Use coordinates relative to COM + double rx = r[0] - com[0]; + double ry = r[1] - com[1]; + double rz = r[2] - com[2]; + + I[0][0] += m * (ry * ry + rz * rz); + I[1][1] += m * (rx * rx + rz * rz); + I[2][2] += m * (rx * rx + ry * ry); + + I[0][1] -= m * rx * ry; + I[0][2] -= m * rx * rz; + I[1][2] -= m * ry * rz; } I[1][0] = I[0][1]; @@ -291,32 +293,69 @@ private double[][] getAlignmentRotationMatrix(Atom[] hostAtoms, double[] com) { // Diagonalize inertia tensor EigenDecomposition ed = new EigenDecomposition(new Array2DRowRealMatrix(I)); - return ed.getV().getData(); - } + double[] evals = ed.getRealEigenvalues(); + double[][] evecs = ed.getV().getData(); // columns are eigenvectors + + int zIndex = 0; + int xIndex = 0; + for (int i = 1; i < 3; i++) { + if (evals[i] > evals[zIndex]) { + zIndex = i; + } + if (evals[i] < evals[xIndex]) { + xIndex = i; + } + } + int yIndex = 3 - zIndex - xIndex; + + double[] zHat = normalize(new double[]{evecs[0][zIndex], evecs[1][zIndex], evecs[2][zIndex]}); + double[] xHat = normalize(new double[]{evecs[0][xIndex], evecs[1][xIndex], evecs[2][xIndex]}); + double[] yHat = normalize(cross(zHat, xHat)); + xHat = normalize(cross(yHat, zHat)); + + return new double[][]{xHat, yHat, zHat}; + } /** * Apply translation and rotation transformation to atoms */ - private void applyTransformation(Atom[] atoms, double[] com, double[][] rotationMatrix) { + private void applyTransformation(Atom[] atoms, double[] com, double[][] rotationMatrix) { for (Atom atom : atoms) { - double[] r = atom.getXYZ().get(); - - // Translate to origin - double tx = r[0] - com[0]; - double ty = r[1] - com[1]; - double tz = r[2] - com[2]; - - // Rotate - double[] rotated = new double[3]; - for (int i = 0; i < 3; i++) { - rotated[i] = rotationMatrix[i][0]*tx + - rotationMatrix[i][1]*ty + - rotationMatrix[i][2]*tz; - } - - atom.setXYZ(rotated); // Set the new coordinates + double[] r = atom.getXYZ().get(); + + // Translate to origin + double tx = r[0] - com[0]; + double ty = r[1] - com[1]; + double tz = r[2] - com[2]; + + // Rotate: r' = R * r + double[] rotated = new double[3]; + for (int i = 0; i < 3; i++) { + rotated[i] = rotationMatrix[i][0] * tx + + rotationMatrix[i][1] * ty + + rotationMatrix[i][2] * tz; + } + + atom.setXYZ(rotated); } - } + } + + private static double[][] captureCoordinates(Atom[] atoms) { + double[][] coords = new double[atoms.length][3]; + for (int i = 0; i < atoms.length; i++) { + double[] r = atoms[i].getXYZ().get(); + coords[i][0] = r[0]; + coords[i][1] = r[1]; + coords[i][2] = r[2]; + } + return coords; + } + + private static void restoreCoordinates(Atom[] atoms, double[][] coords) { + for (int i = 0; i < atoms.length; i++) { + atoms[i].setXYZ(coords[i]); + } + } private void runBoreschMode(Molecule host, Molecule guest) { @@ -336,15 +375,16 @@ private void runBoreschMode(Molecule host, Molecule guest) { // Calculate principal axis from HOST ONLY Atom[] hostAtoms = host.getAtomList().toArray(new Atom[0]); + Atom[] guestAtoms = guest.getAtomList().toArray(new Atom[0]); double[] com = getCOM(hostAtoms); double[][] rotationMatrix = getAlignmentRotationMatrix(hostAtoms, com); - - // Apply transformation to ALL atoms (host + guest) - Atom[] guestAtoms = guest.getAtomList().toArray(new Atom[0]); + + // Temporarily align to select anchors in a consistent frame + double[][] hostCoords = captureCoordinates(hostAtoms); + double[][] guestCoords = captureCoordinates(guestAtoms); applyTransformation(hostAtoms, com, rotationMatrix); applyTransformation(guestAtoms, com, rotationMatrix); - Atom G1 = selectG1(guest); if (G1 == null) return; @@ -354,6 +394,10 @@ private void runBoreschMode(Molecule host, Molecule guest) { Atom G3 = selectG3(guest, G1, G2); if (G3 == null) return; + // Restore original coordinates for geometry evaluation + restoreCoordinates(hostAtoms, hostCoords); + restoreCoordinates(guestAtoms, guestCoords); + // Calculate all geometric parameters double r = distance(H1.getXYZ().get(), G1.getXYZ().get()); double thetaA = angle(H2, H1, G1); @@ -523,6 +567,14 @@ private static double[] subtract(double[] a, double[] b) { return new double[]{a[0] - b[0], a[1] - b[1], a[2] - b[2]}; } + private static double[] normalize(double[] v) { + double norm = sqrt(v[0] * v[0] + v[1] * v[1] + v[2] * v[2]); + if (norm == 0.0) { + return new double[]{0.0, 0.0, 0.0}; + } + return new double[]{v[0] / norm, v[1] / norm, v[2] / norm}; + } + private static double angle(Atom a, Atom b, Atom c) { double[] v1 = subtract(a.getXYZ().get(), b.getXYZ().get()); double[] v2 = subtract(c.getXYZ().get(), b.getXYZ().get()); From daf78e987f5117ab80bbfe622b06e10b92e67a14 Mon Sep 17 00:00:00 2001 From: minouemmad Date: Fri, 13 Feb 2026 15:01:16 -0600 Subject: [PATCH 10/18] added support to resolve AMBER mask syntax for host anchors and used the bCD H1/H2/H3 listed in GHOAT's hosts-library as defaults --- .../commands/test/FindRestraints.java | 58 ++++++++++++++++++- 1 file changed, 57 insertions(+), 1 deletion(-) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java index a22d076a7a..b156175093 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java @@ -110,6 +110,18 @@ public class FindRestraints extends AlgorithmsCommand { description = "Host anchor H3 atom index.") private Integer H3Index; + @Option(names = {"--H1Mask"}, paramLabel = ":res@atom", + description = "Host anchor H1 selection mask (e.g., :1@C4).") + private String H1Mask; + + @Option(names = {"--H2Mask"}, paramLabel = ":res@atom", + description = "Host anchor H2 selection mask (e.g., :3@C4).") + private String H2Mask; + + @Option(names = {"--H3Mask"}, paramLabel = ":res@atom", + description = "Host anchor H3 selection mask (e.g., :6@C4).") + private String H3Mask; + @Option(names = {"--l1Range"}, defaultValue = "3.5", description = "Cylinder diameter/height for G1 search.") private double l1Range; @@ -359,8 +371,18 @@ private static void restoreCoordinates(Atom[] atoms, double[][] coords) { private void runBoreschMode(Molecule host, Molecule guest) { + if (H1Index == null && H1Mask != null) { + H1Index = resolveHostAnchorMask(host, H1Mask); + } + if (H2Index == null && H2Mask != null) { + H2Index = resolveHostAnchorMask(host, H2Mask); + } + if (H3Index == null && H3Mask != null) { + H3Index = resolveHostAnchorMask(host, H3Mask); + } + if (H1Index == null || H2Index == null || H3Index == null) { - logger.severe("Boresch mode requires --H1 --H2 --H3 indices."); + logger.severe("Boresch mode requires --H1/--H2/--H3 indices or --H1Mask/--H2Mask/--H3Mask."); return; } @@ -593,6 +615,40 @@ private static Atom findAtomByIndex(Molecule mol, int index) { return null; } + private Integer resolveHostAnchorMask(Molecule host, String mask) { + if (mask == null) { + return null; + } + String trimmed = mask.trim(); + if (trimmed.startsWith(":")) { + trimmed = trimmed.substring(1); + } + String[] parts = trimmed.split("@", 2); + if (parts.length != 2) { + logger.severe(format("Invalid mask '%s' (expected :res@atom).", mask)); + return null; + } + String resPart = parts[0].trim(); + String atomPart = parts[1].trim(); + int resNum; + try { + resNum = Integer.parseInt(resPart.replaceAll("[^0-9-]", "")); + } catch (NumberFormatException e) { + logger.severe(format("Invalid residue number in mask '%s'.", mask)); + return null; + } + + for (Atom atom : host.getAtomList()) { + if (atom.getResidueNumber() == resNum && atom.getName().equalsIgnoreCase(atomPart)) { + logger.info(format("Resolved %s -> host atom index %d", mask, atom.getIndex())); + return atom.getIndex(); + } + } + + logger.severe(format("Mask '%s' did not match any host atom.", mask)); + return null; + } + /** * Gets the center of mass of a set of atoms. * From 6f4dbdbd58cd22f93a0a83165c83e9112e1e746b Mon Sep 17 00:00:00 2001 From: minouemmad Date: Fri, 13 Feb 2026 16:00:29 -0600 Subject: [PATCH 11/18] :1@C4 means 1st C4 atom in the host (I think) --- .../commands/test/FindRestraints.java | 25 ++++++++++++------- 1 file changed, 16 insertions(+), 9 deletions(-) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java index b156175093..beb13f4c29 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java @@ -625,27 +625,34 @@ private Integer resolveHostAnchorMask(Molecule host, String mask) { } String[] parts = trimmed.split("@", 2); if (parts.length != 2) { - logger.severe(format("Invalid mask '%s' (expected :res@atom).", mask)); + logger.severe(format("Invalid mask '%s' (expected :N@atom for Nth occurrence).", mask)); return null; } - String resPart = parts[0].trim(); + String occurrencePart = parts[0].trim(); String atomPart = parts[1].trim(); - int resNum; + int occurrence; try { - resNum = Integer.parseInt(resPart.replaceAll("[^0-9-]", "")); + occurrence = Integer.parseInt(occurrencePart.replaceAll("[^0-9-]", "")); } catch (NumberFormatException e) { - logger.severe(format("Invalid residue number in mask '%s'.", mask)); + logger.severe(format("Invalid occurrence number in mask '%s'.", mask)); return null; } + // Find the Nth occurrence of the atom name + int count = 0; for (Atom atom : host.getAtomList()) { - if (atom.getResidueNumber() == resNum && atom.getName().equalsIgnoreCase(atomPart)) { - logger.info(format("Resolved %s -> host atom index %d", mask, atom.getIndex())); - return atom.getIndex(); + if (atom.getName().equalsIgnoreCase(atomPart)) { + count++; + if (count == occurrence) { + logger.info(format("Resolved %s -> host atom index %d (residue %d)", + mask, atom.getIndex(), atom.getResidueNumber())); + return atom.getIndex(); + } } } - logger.severe(format("Mask '%s' did not match any host atom.", mask)); + logger.severe(format("Mask '%s' did not match any host atom (found %d atoms named %s).", + mask, count, atomPart)); return null; } From 2c6a11e26f65dfe2adf389d989eb0d50888d9e61 Mon Sep 17 00:00:00 2001 From: minouemmad Date: Fri, 13 Feb 2026 16:09:19 -0600 Subject: [PATCH 12/18] fixed atom naming to match C4, C40, C41, C42... --- .../ffx/algorithms/commands/test/FindRestraints.java | 10 +++++----- 1 file changed, 5 insertions(+), 5 deletions(-) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java index beb13f4c29..6613edac1e 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java @@ -638,20 +638,20 @@ private Integer resolveHostAnchorMask(Molecule host, String mask) { return null; } - // Find the Nth occurrence of the atom name + // Find the Nth occurrence of atoms whose name starts with atomPart int count = 0; for (Atom atom : host.getAtomList()) { - if (atom.getName().equalsIgnoreCase(atomPart)) { + if (atom.getName().toUpperCase().startsWith(atomPart.toUpperCase())) { count++; if (count == occurrence) { - logger.info(format("Resolved %s -> host atom index %d (residue %d)", - mask, atom.getIndex(), atom.getResidueNumber())); + logger.info(format("Resolved %s -> host atom '%s' index %d (residue %d)", + mask, atom.getName(), atom.getIndex(), atom.getResidueNumber())); return atom.getIndex(); } } } - logger.severe(format("Mask '%s' did not match any host atom (found %d atoms named %s).", + logger.severe(format("Mask '%s' did not match any host atom (found %d atoms starting with %s).", mask, count, atomPart)); return null; } From d86e235bde1fc0b793165d46001b8cdf5b030471 Mon Sep 17 00:00:00 2001 From: minouemmad Date: Fri, 13 Feb 2026 16:22:15 -0600 Subject: [PATCH 13/18] logging for guest anchors --- .../ffx/algorithms/commands/test/FindRestraints.java | 12 ++++++++++++ 1 file changed, 12 insertions(+) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java index 6613edac1e..df1a5aa315 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java @@ -420,6 +420,17 @@ private void runBoreschMode(Molecule host, Molecule guest) { restoreCoordinates(hostAtoms, hostCoords); restoreCoordinates(guestAtoms, guestCoords); + // Log selected atoms + logger.info(format("\n=== Selected Boresch Anchors ===")); + logger.info(format("Host anchors:")); + logger.info(format(" H1: %s (index %d, residue %d)", H1.getName(), H1.getIndex(), H1.getResidueNumber())); + logger.info(format(" H2: %s (index %d, residue %d)", H2.getName(), H2.getIndex(), H2.getResidueNumber())); + logger.info(format(" H3: %s (index %d, residue %d)", H3.getName(), H3.getIndex(), H3.getResidueNumber())); + logger.info(format("Guest anchors:")); + logger.info(format(" G1: %s (index %d, residue %d)", G1.getName(), G1.getIndex(), G1.getResidueNumber())); + logger.info(format(" G2: %s (index %d, residue %d)", G2.getName(), G2.getIndex(), G2.getResidueNumber())); + logger.info(format(" G3: %s (index %d, residue %d)", G3.getName(), G3.getIndex(), G3.getResidueNumber())); + // Calculate all geometric parameters double r = distance(H1.getXYZ().get(), G1.getXYZ().get()); double thetaA = angle(H2, H1, G1); @@ -428,6 +439,7 @@ private void runBoreschMode(Molecule host, Molecule guest) { double phiB = dihedral(H2, H1, G1, G2); double phiC = dihedral(H1, G1, G2, G3); + logger.info(format("\n=== Boresch Restraint Parameters ===")); logger.info(format("Distance H1-G1 (r): %.3f Å", r)); logger.info(format("Angle H2-H1-G1 (θA): %.2f°", thetaA)); logger.info(format("Angle H1-G1-G2 (θB): %.2f°", thetaB)); From 41ec29eb98608ccc0ce065ded8a98f4988323ab9 Mon Sep 17 00:00:00 2001 From: minouemmad Date: Fri, 13 Feb 2026 17:11:59 -0600 Subject: [PATCH 14/18] got rid of masking logic --- .../commands/test/FindRestraints.java | 64 +------------------ 1 file changed, 1 insertion(+), 63 deletions(-) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java index df1a5aa315..0cc45172c6 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java @@ -110,17 +110,6 @@ public class FindRestraints extends AlgorithmsCommand { description = "Host anchor H3 atom index.") private Integer H3Index; - @Option(names = {"--H1Mask"}, paramLabel = ":res@atom", - description = "Host anchor H1 selection mask (e.g., :1@C4).") - private String H1Mask; - - @Option(names = {"--H2Mask"}, paramLabel = ":res@atom", - description = "Host anchor H2 selection mask (e.g., :3@C4).") - private String H2Mask; - - @Option(names = {"--H3Mask"}, paramLabel = ":res@atom", - description = "Host anchor H3 selection mask (e.g., :6@C4).") - private String H3Mask; @Option(names = {"--l1Range"}, defaultValue = "3.5", description = "Cylinder diameter/height for G1 search.") @@ -371,18 +360,8 @@ private static void restoreCoordinates(Atom[] atoms, double[][] coords) { private void runBoreschMode(Molecule host, Molecule guest) { - if (H1Index == null && H1Mask != null) { - H1Index = resolveHostAnchorMask(host, H1Mask); - } - if (H2Index == null && H2Mask != null) { - H2Index = resolveHostAnchorMask(host, H2Mask); - } - if (H3Index == null && H3Mask != null) { - H3Index = resolveHostAnchorMask(host, H3Mask); - } - if (H1Index == null || H2Index == null || H3Index == null) { - logger.severe("Boresch mode requires --H1/--H2/--H3 indices or --H1Mask/--H2Mask/--H3Mask."); + logger.severe("Boresch mode requires --H1 --H2 --H3 indices."); return; } @@ -627,47 +606,6 @@ private static Atom findAtomByIndex(Molecule mol, int index) { return null; } - private Integer resolveHostAnchorMask(Molecule host, String mask) { - if (mask == null) { - return null; - } - String trimmed = mask.trim(); - if (trimmed.startsWith(":")) { - trimmed = trimmed.substring(1); - } - String[] parts = trimmed.split("@", 2); - if (parts.length != 2) { - logger.severe(format("Invalid mask '%s' (expected :N@atom for Nth occurrence).", mask)); - return null; - } - String occurrencePart = parts[0].trim(); - String atomPart = parts[1].trim(); - int occurrence; - try { - occurrence = Integer.parseInt(occurrencePart.replaceAll("[^0-9-]", "")); - } catch (NumberFormatException e) { - logger.severe(format("Invalid occurrence number in mask '%s'.", mask)); - return null; - } - - // Find the Nth occurrence of atoms whose name starts with atomPart - int count = 0; - for (Atom atom : host.getAtomList()) { - if (atom.getName().toUpperCase().startsWith(atomPart.toUpperCase())) { - count++; - if (count == occurrence) { - logger.info(format("Resolved %s -> host atom '%s' index %d (residue %d)", - mask, atom.getName(), atom.getIndex(), atom.getResidueNumber())); - return atom.getIndex(); - } - } - } - - logger.severe(format("Mask '%s' did not match any host atom (found %d atoms starting with %s).", - mask, count, atomPart)); - return null; - } - /** * Gets the center of mass of a set of atoms. * From 6c1315bba87e3ddca775ab1517bfd92f08e49e0d Mon Sep 17 00:00:00 2001 From: minouemmad Date: Fri, 13 Feb 2026 17:27:39 -0600 Subject: [PATCH 15/18] added connectivity checks --- .../commands/test/FindRestraints.java | 100 ++++++++++++++++-- 1 file changed, 89 insertions(+), 11 deletions(-) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java index 0cc45172c6..55260d1570 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java @@ -391,10 +391,22 @@ private void runBoreschMode(Molecule host, Molecule guest) { Atom G2 = selectG2(guest, G1); if (G2 == null) return; + + // Check G1-G2 bonding + if (!areBonded(G1, G2)) { + logger.warning(String.format("Warning: G1 (%s) and G2 (%s) are not bonded", + G1.getName(), G2.getName())); + } Atom G3 = selectG3(guest, G1, G2); if (G3 == null) return; + // Check G2-G3 bonding + if (!areBonded(G2, G3)) { + logger.warning(String.format("Warning: G2 (%s) and G3 (%s) are not bonded", + G2.getName(), G3.getName())); + } + // Restore original coordinates for geometry evaluation restoreCoordinates(hostAtoms, hostCoords); restoreCoordinates(guestAtoms, guestCoords); @@ -410,6 +422,14 @@ private void runBoreschMode(Molecule host, Molecule guest) { logger.info(format(" G2: %s (index %d, residue %d)", G2.getName(), G2.getIndex(), G2.getResidueNumber())); logger.info(format(" G3: %s (index %d, residue %d)", G3.getName(), G3.getIndex(), G3.getResidueNumber())); + // Check triangle connectivity + logger.info(format("\n=== Connectivity Check ===")); + logger.info(format("G1-G2 bond: %s", areBonded(G1, G2) ? "YES" : "NO")); + logger.info(format("G2-G3 bond: %s", areBonded(G2, G3) ? "YES" : "NO")); + if (areBonded(G1, G3)) { + logger.info(format("G1-G3 bond: YES (unusual for dihedral definition)")); + } + // Calculate all geometric parameters double r = distance(H1.getXYZ().get(), G1.getXYZ().get()); double thetaA = angle(H2, H1, G1); @@ -434,7 +454,42 @@ private void runBoreschMode(Molecule host, Molecule guest) { logger.warning(format("Angle θB = %.2f° is near-degenerate.", thetaB)); } } - + + /** + * Check if two atoms are bonded based on PDB CONNECT records. + * Assumes the MolecularAssembly has already parsed CONNECT info. + */ + private boolean areBonded(Atom a, Atom b) { + // FFX typically stores bonding info in the Molecule + // This is one approach - depends on FFX's internal structure + return a.isBondedTo(b); + + // Alternative: If FFX doesn't expose this directly, + // you might need to access the bonding array: + // return activeAssembly.getBonds().areBonded(a, b); + } + + /** + * Check if atoms form a connected path G1-G2-G3. + */ + private boolean isConnectedPath(Molecule guest, Atom g1, Atom g2, Atom g3) { + if (!areBonded(g1, g2)) { + logger.warning(String.format("G1 (%s) and G2 (%s) are not bonded", + g1.getName(), g2.getName())); + return false; + } + + if (!areBonded(g2, g3)) { + logger.warning(String.format("G2 (%s) and G3 (%s) are not bonded", + g2.getName(), g3.getName())); + return false; + } + + // Optional: Check if G1-G3 are bonded? Usually not for a proper dihedral + // but you might want to warn if they're too close + + return true; + /** * Calculate dihedral angle between four atoms */ @@ -535,34 +590,57 @@ private Atom selectG3(Molecule guest, Atom G1, Atom G2) { Atom best = null; double bestAngleDiff = Double.MAX_VALUE; + // First pass: Look for atoms bonded to G2 + List bondedCandidates = new ArrayList<>(); + List allCandidates = new ArrayList<>(); + for (Atom atom : guest.getAtomList()) { if (atom == G1 || atom == G2 || !atom.isHeavy()) continue; - // Check distance from G2 (as in GHOAT) + // Check distance from G2 double d = distance(G2.getXYZ().get(), atom.getXYZ().get()); if (d < minAdis || d > maxAdis) continue; - // ADD: Also check distance from G1 to avoid clustering + // Check distance from G1 double d_g1 = distance(G1.getXYZ().get(), atom.getXYZ().get()); if (d_g1 < minAdis) continue; + // Check if bonded to G2 (from CONNECT records) + if (areBonded(G2, atom)) { + bondedCandidates.add(atom); + } + allCandidates.add(atom); + } + // Prefer bonded atoms, fall back to all candidates + List candidates = bondedCandidates.isEmpty() ? allCandidates : bondedCandidates; + if (candidates.isEmpty()) { + logger.warning("No valid G3 candidates found"); + return null; + } + + // Find atom with angle closest to 90° + for (Atom atom : candidates) { double ang = angle(G1, G2, atom); - - // Reject Degenerate Angles for G3 + + // Reject degenerate angles if (ang < 20.0 || ang > 160.0) continue; - - double diff = abs(ang - 90.0); - + + double diff = Math.abs(ang - 90.0); + if (diff < bestAngleDiff) { bestAngleDiff = diff; best = atom; } } - + if (best == null) { - logger.severe("anch3 error: Could not identify valid G3 anchor."); + logger.warning("No G3 candidate with acceptable angle found"); + } else { + String source = bondedCandidates.contains(best) ? "bonded" : "non-bonded"; + logger.info(String.format("Selected G3: %s (index %d, %s to G2)", + best.getName(), best.getIndex(), source)); } - + return best; } From da8de7ea4848111facd178eab497a25537d8dfef Mon Sep 17 00:00:00 2001 From: minouemmad Date: Fri, 13 Feb 2026 17:29:50 -0600 Subject: [PATCH 16/18] fixed missing closing brace --- .../main/java/ffx/algorithms/commands/test/FindRestraints.java | 1 + 1 file changed, 1 insertion(+) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java index 55260d1570..6a88c296cb 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java @@ -489,6 +489,7 @@ private boolean isConnectedPath(Molecule guest, Atom g1, Atom g2, Atom g3) { // but you might want to warn if they're too close return true; + } /** * Calculate dihedral angle between four atoms From d1e8eadeb9dfaf123ff88a192f82c1c72b817783 Mon Sep 17 00:00:00 2001 From: minouemmad Date: Fri, 13 Feb 2026 17:34:07 -0600 Subject: [PATCH 17/18] use Atom.getBond(...) --- .../ffx/algorithms/commands/test/FindRestraints.java | 9 ++------- 1 file changed, 2 insertions(+), 7 deletions(-) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java index 6a88c296cb..561add8721 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java @@ -460,13 +460,8 @@ private void runBoreschMode(Molecule host, Molecule guest) { * Assumes the MolecularAssembly has already parsed CONNECT info. */ private boolean areBonded(Atom a, Atom b) { - // FFX typically stores bonding info in the Molecule - // This is one approach - depends on FFX's internal structure - return a.isBondedTo(b); - - // Alternative: If FFX doesn't expose this directly, - // you might need to access the bonding array: - // return activeAssembly.getBonds().areBonded(a, b); + // Use the Atom bond list populated during PDB/CONNECT parsing. + return a.getBond(b) != null; } /** From 82db8797741ea7e146817c25a91451e88e2438e3 Mon Sep 17 00:00:00 2001 From: minouemmad Date: Mon, 16 Feb 2026 14:21:33 -0600 Subject: [PATCH 18/18] removed bonding requirements, added com calculation for non-hydrogen atoms only, updated coord system origin --- .../commands/test/FindRestraints.java | 103 +++++++----------- 1 file changed, 40 insertions(+), 63 deletions(-) diff --git a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java index 561add8721..e842e00865 100644 --- a/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java +++ b/modules/algorithms/src/main/java/ffx/algorithms/commands/test/FindRestraints.java @@ -374,10 +374,14 @@ private void runBoreschMode(Molecule host, Molecule guest) { return; } - // Calculate principal axis from HOST ONLY + // Calculate principal axis from HOST non-hydrogen atoms ONLY Atom[] hostAtoms = host.getAtomList().toArray(new Atom[0]); Atom[] guestAtoms = guest.getAtomList().toArray(new Atom[0]); - double[] com = getCOM(hostAtoms); + + // Use COM of non-hydrogen host atoms as the origin + double[] com = getCOMNonHydrogen(hostAtoms); + logger.info(format("Host COM (non-H): (%.3f, %.3f, %.3f)", com[0], com[1], com[2])); + double[][] rotationMatrix = getAlignmentRotationMatrix(hostAtoms, com); // Temporarily align to select anchors in a consistent frame @@ -391,22 +395,10 @@ private void runBoreschMode(Molecule host, Molecule guest) { Atom G2 = selectG2(guest, G1); if (G2 == null) return; - - // Check G1-G2 bonding - if (!areBonded(G1, G2)) { - logger.warning(String.format("Warning: G1 (%s) and G2 (%s) are not bonded", - G1.getName(), G2.getName())); - } Atom G3 = selectG3(guest, G1, G2); if (G3 == null) return; - // Check G2-G3 bonding - if (!areBonded(G2, G3)) { - logger.warning(String.format("Warning: G2 (%s) and G3 (%s) are not bonded", - G2.getName(), G3.getName())); - } - // Restore original coordinates for geometry evaluation restoreCoordinates(hostAtoms, hostCoords); restoreCoordinates(guestAtoms, guestCoords); @@ -422,13 +414,7 @@ private void runBoreschMode(Molecule host, Molecule guest) { logger.info(format(" G2: %s (index %d, residue %d)", G2.getName(), G2.getIndex(), G2.getResidueNumber())); logger.info(format(" G3: %s (index %d, residue %d)", G3.getName(), G3.getIndex(), G3.getResidueNumber())); - // Check triangle connectivity - logger.info(format("\n=== Connectivity Check ===")); - logger.info(format("G1-G2 bond: %s", areBonded(G1, G2) ? "YES" : "NO")); - logger.info(format("G2-G3 bond: %s", areBonded(G2, G3) ? "YES" : "NO")); - if (areBonded(G1, G3)) { - logger.info(format("G1-G3 bond: YES (unusual for dihedral definition)")); - } + // Note: G1, G2, G3 are geometric anchor atoms and do not require bonding constraints // Calculate all geometric parameters double r = distance(H1.getXYZ().get(), G1.getXYZ().get()); @@ -455,36 +441,7 @@ private void runBoreschMode(Molecule host, Molecule guest) { } } - /** - * Check if two atoms are bonded based on PDB CONNECT records. - * Assumes the MolecularAssembly has already parsed CONNECT info. - */ - private boolean areBonded(Atom a, Atom b) { - // Use the Atom bond list populated during PDB/CONNECT parsing. - return a.getBond(b) != null; - } - /** - * Check if atoms form a connected path G1-G2-G3. - */ - private boolean isConnectedPath(Molecule guest, Atom g1, Atom g2, Atom g3) { - if (!areBonded(g1, g2)) { - logger.warning(String.format("G1 (%s) and G2 (%s) are not bonded", - g1.getName(), g2.getName())); - return false; - } - - if (!areBonded(g2, g3)) { - logger.warning(String.format("G2 (%s) and G3 (%s) are not bonded", - g2.getName(), g3.getName())); - return false; - } - - // Optional: Check if G1-G3 are bonded? Usually not for a proper dihedral - // but you might want to warn if they're too close - - return true; - } /** * Calculate dihedral angle between four atoms @@ -586,9 +543,7 @@ private Atom selectG3(Molecule guest, Atom G1, Atom G2) { Atom best = null; double bestAngleDiff = Double.MAX_VALUE; - // First pass: Look for atoms bonded to G2 - List bondedCandidates = new ArrayList<>(); - List allCandidates = new ArrayList<>(); + List candidates = new ArrayList<>(); for (Atom atom : guest.getAtomList()) { if (atom == G1 || atom == G2 || !atom.isHeavy()) continue; @@ -601,14 +556,9 @@ private Atom selectG3(Molecule guest, Atom G1, Atom G2) { double d_g1 = distance(G1.getXYZ().get(), atom.getXYZ().get()); if (d_g1 < minAdis) continue; - // Check if bonded to G2 (from CONNECT records) - if (areBonded(G2, atom)) { - bondedCandidates.add(atom); - } - allCandidates.add(atom); + candidates.add(atom); } - // Prefer bonded atoms, fall back to all candidates - List candidates = bondedCandidates.isEmpty() ? allCandidates : bondedCandidates; + if (candidates.isEmpty()) { logger.warning("No valid G3 candidates found"); return null; @@ -632,9 +582,8 @@ private Atom selectG3(Molecule guest, Atom G1, Atom G2) { if (best == null) { logger.warning("No G3 candidate with acceptable angle found"); } else { - String source = bondedCandidates.contains(best) ? "bonded" : "non-bonded"; - logger.info(String.format("Selected G3: %s (index %d, %s to G2)", - best.getName(), best.getIndex(), source)); + logger.info(String.format("Selected G3: %s (index %d)", + best.getName(), best.getIndex())); } return best; @@ -705,6 +654,34 @@ private static double[] getCOM(Atom[] atoms) { return COM; } + /** + * Gets the center of mass of non-hydrogen atoms in a set. + * + * @param atoms Array of atoms + * @return x,y,z coordinates of center of mass (non-hydrogen only) + */ + private static double[] getCOMNonHydrogen(Atom[] atoms) { + double[] COM = new double[3]; + double totalMass = 0.0; + for (Atom s : atoms) { + if (!s.isHeavy()) continue; // Skip hydrogen atoms + double[] pos = s.getXYZ().get(); + COM[0] += pos[0] * s.getMass(); + COM[1] += pos[1] * s.getMass(); + COM[2] += pos[2] * s.getMass(); + totalMass += s.getMass(); + } + if (totalMass == 0.0) { + return new double[]{0.0, 0.0, 0.0}; + } + totalMass = 1 / totalMass; + COM[0] *= totalMass; + COM[1] *= totalMass; + COM[2] *= totalMass; + + return COM; + } + /** * Checks if an int array contains a specific value. *