Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
615281 | 5n14 RC | 34094 | cing | 1-original | 8 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 HA PRO 62 HA PRO 62 -10.702 -6.574 -3.642
2 HB2 PRO 62 HB2 PRO 62 -12.057 -5.372 -1.373
3 HB3 PRO 62 HB3 PRO 62 -11.878 -4.766 -3.039
4 HG2 PRO 62 HG2 PRO 62 -14.124 -6.411 -1.838
5 HG3 PRO 62 HG3 PRO 62 -14.229 -5.092 -3.047
6 HD2 PRO 62 HD2 PRO 62 -14.429 -7.599 -3.920
7 HD3 PRO 62 HD3 PRO 62 -13.294 -6.513 -4.763
8 H PHE 63 H PHE 63 -9.319 -5.876 -1.743
9 HA PHE 63 HA PHE 63 -9.553 -7.499 0.711
10 HB2 PHE 63 HB2 PHE 63 -7.875 -8.542 -1.018
11 HB3 PHE 63 HB3 PHE 63 -6.839 -7.190 -0.598
12 HD1 PHE 63 HD1 PHE 63 -8.460 -10.302 0.579
13 HD2 PHE 63 HD2 PHE 63 -5.795 -7.088 1.669
14 HE1 PHE 63 HE1 PHE 63 -7.664 -11.616 2.525
15 HE2 PHE 63 HE2 PHE 63 -5.035 -8.399 3.643
16 HZ PHE 63 HZ PHE 63 -5.930 -10.673 4.045
17 H ALA 64 H ALA 64 -8.471 -6.413 2.561
18 HA ALA 64 HA ALA 64 -8.287 -3.478 2.076
19 HB1 ALA 64 HB1 ALA 64 -9.007 -5.000 4.589
20 HB2 ALA 64 HB2 ALA 64 -8.909 -3.230 4.430
21 HB3 ALA 64 HB3 ALA 64 -10.129 -4.137 3.510
22 H CYS 65 H CYS 65 -6.708 -2.225 2.984
23 HA CYS 65 HA CYS 65 -4.150 -3.495 3.726
24 HB2 CYS 65 HB2 CYS 65 -5.097 -0.630 3.618
25 HB3 CYS 65 HB3 CYS 65 -3.412 -1.143 3.907
26 H ASP 66 H ASP 66 -3.384 -3.589 5.763
27 HA ASP 66 HA ASP 66 -4.735 -2.758 8.172
28 HB2 ASP 66 HB2 ASP 66 -3.024 -4.508 8.092
29 HB3 ASP 66 HB3 ASP 66 -1.836 -3.379 7.469
30 H ILE 67 H ILE 67 -1.786 -1.448 6.712
31 HA ILE 67 HA ILE 67 -1.650 0.889 8.118
32 HB ILE 67 HB ILE 67 -0.622 0.224 5.345
33 HG12 ILE 67 2HG1 ILE 67 0.183 -1.342 7.029
34 HG13 ILE 67 3HG1 ILE 67 1.486 -0.335 6.441
35 HG21 ILE 67 HG21 ILE 67 0.269 2.523 7.113
36 HG22 ILE 67 HG22 ILE 67 1.167 1.918 5.699
37 HG23 ILE 67 HG23 ILE 67 -0.440 2.622 5.495
38 HD11 ILE 67 1HD1 ILE 67 1.351 1.047 8.522
39 HD12 ILE 67 2HD1 ILE 67 0.072 -0.032 9.129
40 HD13 ILE 67 3HD1 ILE 67 1.701 -0.655 8.838
41 H CYS 68 H CYS 68 -3.706 0.561 5.278
42 HA CYS 68 HA CYS 68 -4.226 3.509 5.300
43 HB2 CYS 68 HB2 CYS 68 -4.979 1.341 3.315
44 HB3 CYS 68 HB3 CYS 68 -5.759 2.907 3.366
45 H GLY 69 H GLY 69 -5.608 0.478 6.505
46 HA2 GLY 69 HA2 GLY 69 -7.709 -0.138 7.145
47 HA3 GLY 69 HA3 GLY 69 -7.975 1.561 7.554
48 H ARG 70 H ARG 70 -7.409 0.328 4.260
49 HA ARG 70 HA ARG 70 -10.195 1.001 3.432
50 HB2 ARG 70 HB2 ARG 70 -7.648 2.079 2.150
51 HB3 ARG 70 HB3 ARG 70 -9.243 2.222 1.432
52 HG2 ARG 70 HG2 ARG 70 -8.354 3.504 4.039
53 HG3 ARG 70 HG3 ARG 70 -8.541 4.316 2.482
54 HD2 ARG 70 HD2 ARG 70 -10.953 3.852 2.525
55 HD3 ARG 70 HD3 ARG 70 -10.782 2.962 4.012
56 HE ARG 70 HE ARG 70 -9.969 5.833 3.935
57 HH11 ARG 70 1HH1 ARG 70 -11.121 7.254 5.310
58 HH12 ARG 70 2HH1 ARG 70 -12.639 6.698 5.980
59 HH21 ARG 70 1HH2 ARG 70 -12.243 3.476 5.236
60 HH22 ARG 70 2HH2 ARG 70 -13.242 4.725 5.941
61 H LYS 71 H LYS 71 -10.883 0.160 1.441
62 HA LYS 71 HA LYS 71 -9.771 -2.491 0.782
63 HB2 LYS 71 HB2 LYS 71 -12.237 -0.981 -0.189
64 HB3 LYS 71 HB3 LYS 71 -11.765 -2.597 -0.742
65 HG2 LYS 71 HG2 LYS 71 -11.969 -3.501 1.533
66 HG3 LYS 71 HG3 LYS 71 -12.424 -1.885 2.136
67 HD2 LYS 71 HD2 LYS 71 -14.384 -1.862 0.626
68 HD3 LYS 71 HD3 LYS 71 -13.953 -3.465 0.007
69 HE2 LYS 71 HE2 LYS 71 -14.338 -4.489 2.156
70 HE3 LYS 71 HE3 LYS 71 -14.462 -2.916 2.966
71 HZ1 LYS 71 HZ1 LYS 71 -16.516 -2.495 1.859
72 HZ2 LYS 71 HZ2 LYS 71 -16.397 -3.814 0.892
73 HZ3 LYS 71 HZ3 LYS 71 -16.624 -4.014 2.484
74 H PHE 72 H PHE 72 -8.771 -3.077 -0.970
75 HA PHE 72 HA PHE 72 -8.778 -1.437 -3.450
76 HB2 PHE 72 HB2 PHE 72 -6.333 -2.414 -1.927
77 HB3 PHE 72 HB3 PHE 72 -6.282 -1.936 -3.617
78 HD1 PHE 72 HD1 PHE 72 -6.725 0.397 -4.323
79 HD2 PHE 72 HD2 PHE 72 -6.427 -0.688 -0.152
80 HE1 PHE 72 HE1 PHE 72 -6.422 2.782 -3.723
81 HE2 PHE 72 HE2 PHE 72 -6.114 1.714 0.434
82 HZ PHE 72 HZ PHE 72 -6.117 3.442 -1.349
83 H ALA 73 H ALA 73 -7.820 -2.691 -5.275
84 HA ALA 73 HA ALA 73 -8.717 -5.475 -5.338
85 HB1 ALA 73 HB1 ALA 73 -9.121 -3.945 -7.213
86 HB2 ALA 73 HB2 ALA 73 -7.375 -3.729 -7.447
87 HB3 ALA 73 HB3 ALA 73 -8.139 -5.316 -7.715
88 H ARG 74 H ARG 74 -6.136 -5.511 -7.314
89 HA ARG 74 HA ARG 74 -4.397 -6.977 -5.360
90 HB2 ARG 74 HB2 ARG 74 -6.116 -8.423 -6.619
91 HB3 ARG 74 HB3 ARG 74 -5.188 -8.080 -8.088
92 HG2 ARG 74 HG2 ARG 74 -3.152 -9.064 -6.954
93 HG3 ARG 74 HG3 ARG 74 -4.166 -9.395 -5.536
94 HD2 ARG 74 HD2 ARG 74 -5.705 -10.718 -7.116
95 HD3 ARG 74 HD3 ARG 74 -4.387 -10.611 -8.312
96 HE ARG 74 HE ARG 74 -3.692 -11.600 -5.610
97 HH11 ARG 74 1HH1 ARG 74 -3.963 -14.876 -6.138
98 HH12 ARG 74 2HH1 ARG 74 -3.458 -13.588 -5.074
99 HH21 ARG 74 1HH2 ARG 74 -4.472 -12.757 -8.828
100 HH22 ARG 74 2HH2 ARG 74 -4.371 -14.412 -8.277
101 H SER 75 H SER 75 -4.603 -5.890 -8.726
102 HA SER 75 HA SER 75 -3.187 -4.680 -10.034
103 HB2 SER 75 HB2 SER 75 -3.179 -3.099 -7.455
104 HB3 SER 75 HB3 SER 75 -2.889 -2.470 -9.092
105 HG SER 75 HG SER 75 -4.990 -2.178 -8.964
106 H1 OUD 76 H OUD 76 -1.456 -6.308 -10.228
107 HA OUD 76 HA OUD 76 1.144 -5.276 -9.204
108 HB3 OUD 76 HB3 OUD 76 0.839 -7.739 -9.341
109 HB2 OUD 76 HB2 OUD 76 0.572 -7.616 -11.077
110 HM3 OUD 76 HM3 OUD 76 1.953 -4.850 -11.513
111 HM2 OUD 76 HM2 OUD 76 0.369 -5.297 -12.161
112 HN2 OUD 76 HN2 OUD 76 -0.496 -3.252 -11.471
113 H OUE 77 H OUE 77 -0.710 -1.423 -10.243
114 HA OUE 77 HA OUE 77 1.573 -0.762 -8.441
115 HB3 OUE 77 HB3 OUE 77 1.898 0.409 -10.595
116 HB2 OUE 77 HB2 OUE 77 0.288 1.075 -10.511
117 HG3 OUE 77 HG3 OUE 77 1.001 2.380 -8.429
118 HG2 OUE 77 HG2 OUE 77 2.620 1.709 -8.618
119 HM2 OUE 77 HM2 OUE 77 -1.233 0.428 -8.506
120 HM3 OUE 77 HM3 OUE 77 -0.004 0.697 -7.265
121 HN2 OUE 77 HN2 OUE 77 -1.222 -1.974 -7.816
122 H1 OUK 78 H OUK 78 -1.353 -3.400 -6.220
123 HA OUK 78 HA OUK 78 0.576 -2.987 -3.989
124 HB2 OUK 78 HB2 OUK 78 -0.168 -5.132 -3.043
125 HB3 OUK 78 HB3 OUK 78 -1.314 -5.354 -4.343
126 HG2 OUK 78 HG2 OUK 78 -2.534 -3.239 -3.511
127 HG3 OUK 78 HG3 OUK 78 -1.468 -3.276 -2.104
128 HD2 OUK 78 HD2 OUK 78 -2.293 -5.645 -1.620
129 HD3 OUK 78 HD3 OUK 78 -3.328 -5.538 -3.035
130 HE2 OUK 78 HE2 OUK 78 -4.840 -5.043 -1.327
131 HE3 OUK 78 HE3 OUK 78 -4.382 -3.423 -1.878
132 HZ3 OUK 78 HZ3 OUK 78 -3.428 -4.817 0.587
133 HZ1 OUK 78 HZ1 OUK 78 -4.405 -3.456 0.519
134 HZ2 OUK 78 HZ2 OUK 78 -2.815 -3.383 0.071
135 HM3 OUK 78 HM3 OUK 78 1.666 -5.059 -4.736
136 HM2 OUK 78 HM2 OUK 78 0.427 -5.309 -5.971
137 HN2 OUK 78 HN2 OUK 78 1.285 -3.514 -7.246
138 H OUR 79 H OUR 79 2.918 -2.262 -7.977
139 HA OUR 79 HA OUR 79 5.307 -1.963 -6.204
140 HB3 OUR 79 HB3 OUR 79 5.177 -1.732 -9.259
141 HB2 OUR 79 HB2 OUR 79 6.536 -1.239 -8.274
142 HG3 OUR 79 HG3 OUR 79 7.098 -3.363 -9.175
143 HG2 OUR 79 HG2 OUR 79 6.857 -3.577 -7.455
144 HD3 OUR 79 HD3 OUR 79 5.951 -5.456 -8.853
145 HD2 OUR 79 HD2 OUR 79 4.719 -4.720 -7.828
146 HE OUR 79 HE OUR 79 3.584 -4.003 -9.629
147 HH12 OUR 79 2HH1 OUR 79 6.227 -4.986 -12.558
148 HH11 OUR 79 1HH1 OUR 79 6.042 -5.961 -11.160
149 HH22 OUR 79 2HH2 OUR 79 4.847 -3.012 -12.783
150 HM2 OUR 79 HM2 OUR 79 4.262 0.204 -8.048
151 HM3 OUR 79 HM3 OUR 79 5.346 0.360 -6.658
152 HN2 OUR 79 HN2 OUR 79 2.407 -0.196 -6.541
153 HH21 OUR 79 1HH2 OUR 79 3.638 -2.712 -11.627
154 H OUH 80 H OUH 80 1.236 1.248 -5.473
155 HA OUH 80 HA OUH 80 2.292 2.031 -2.833
156 HB2 OUH 80 HB2 OUH 80 -0.128 2.572 -4.370
157 HB3 OUH 80 HB3 OUH 80 0.492 3.387 -2.964
158 HD2 OUH 80 HD2 OUH 80 -0.388 2.377 -0.489
159 HD1 OUH 80 HD1 OUH 80 -2.253 0.893 -3.975
160 HE1 OUH 80 HE1 OUH 80 -3.630 0.271 -1.869
161 HM2 OUH 80 HM2 OUH 80 0.415 -0.356 -3.169
162 HM3 OUH 80 HM3 OUH 80 1.064 0.287 -1.659
163 HN2 OUH 80 HN2 OUH 80 2.710 -1.012 -3.771
164 H1 OUK 81 H OUK 81 4.379 -2.219 -3.097
165 HA OUK 81 HA OUK 81 5.432 -1.549 -0.384
166 HB2 OUK 81 HB2 OUK 81 6.879 -3.630 -0.627
167 HB3 OUK 81 HB3 OUK 81 5.899 -4.096 -2.013
168 HG2 OUK 81 HG2 OUK 81 3.843 -4.040 -0.475
169 HG3 OUK 81 HG3 OUK 81 4.930 -3.705 0.872
170 HD2 OUK 81 HD2 OUK 81 6.146 -5.898 0.349
171 HD3 OUK 81 HD3 OUK 81 4.971 -6.190 -0.929
172 HE2 OUK 81 HE2 OUK 81 4.218 -7.442 1.002
173 HE3 OUK 81 HE3 OUK 81 3.115 -6.062 0.822
174 HZ3 OUK 81 HZ3 OUK 81 4.380 -4.959 2.657
175 HZ1 OUK 81 HZ1 OUK 81 5.318 -6.317 2.809
176 HZ2 OUK 81 HZ2 OUK 81 3.683 -6.404 3.125
177 HM3 OUK 81 HM3 OUK 81 7.632 -1.398 -1.411
178 HM2 OUK 81 HM2 OUK 81 7.000 -1.972 -2.964
179 HN2 OUK 81 HN2 OUK 81 6.117 0.117 -3.421
180 H OUI 82 H OUI 82 5.648 2.242 -3.156
181 HA OUI 82 HA OUI 82 6.239 3.455 -0.498
182 HB OUI 82 HB OUI 82 6.246 5.612 -1.542
183 3HG1 OUI 82 3HG1 OUI 82 5.615 4.226 -4.209
184 2HG1 OUI 82 2HG1 OUI 82 4.547 5.309 -3.326
185 1HG2 OUI 82 1HG2 OUI 82 8.014 3.785 -3.248
186 2HG2 OUI 82 2HG2 OUI 82 8.336 4.142 -1.544
187 3HG2 OUI 82 3HG2 OUI 82 8.350 5.448 -2.728
188 2HD1 OUI 82 2HD1 OUI 82 7.174 6.113 -4.652
189 3HD1 OUI 82 3HD1 OUI 82 6.221 7.178 -3.593
190 1HD1 OUI 82 1HD1 OUI 82 5.534 6.581 -5.111
191 HM2 OUI 82 HM2 OUI 82 3.654 3.804 -2.087
192 HM3 OUI 82 HM3 OUI 82 4.084 4.667 -0.596
193 HN2 OUI 82 HN2 OUI 82 3.680 1.725 -0.861
194 H OUH 83 H OUH 83 3.799 0.514 0.910
195 HA OUH 83 HA OUH 83 3.060 1.793 3.478
196 HB2 OUH 83 HB2 OUH 83 3.109 -0.494 4.388
197 HB3 OUH 83 HB3 OUH 83 3.625 -1.125 2.835
198 HD2 OUH 83 HD2 OUH 83 0.956 1.612 2.472
199 HD1 OUH 83 HD1 OUH 83 1.135 -2.564 3.032
200 HE1 OUH 83 HE1 OUH 83 -1.246 -1.836 2.315
201 HM2 OUH 83 HM2 OUH 83 5.155 0.760 4.533
202 HM3 OUH 83 HM3 OUH 83 5.310 2.268 3.639
203 HN2 OUH 83 HN2 OUH 83 5.990 0.570 1.719
204 H ARG 84 H ARG 84 8.122 0.608 1.117
205 HA ARG 84 HA ARG 84 10.169 0.071 3.175
206 HB2 ARG 84 HB2 ARG 84 10.113 -0.796 0.752
207 HB3 ARG 84 HB3 ARG 84 10.545 0.837 0.237
208 HG2 ARG 84 HG2 ARG 84 12.640 0.614 1.723
209 HG3 ARG 84 HG3 ARG 84 12.174 -1.083 1.952
210 HD2 ARG 84 HD2 ARG 84 12.252 -1.373 -0.540
211 HD3 ARG 84 HD3 ARG 84 12.818 0.281 -0.697
212 HE ARG 84 HE ARG 84 14.248 -2.005 0.642
213 HH11 ARG 84 1HH1 ARG 84 16.309 1.322 -0.058
214 HH12 ARG 84 2HH1 ARG 84 14.612 1.301 -0.514
215 HH21 ARG 84 1HH2 ARG 84 17.300 -0.602 0.695
216 HH22 ARG 84 2HH2 ARG 84 16.214 -1.948 1.056
217 H LYS 85 H LYS 85 9.017 2.915 1.474
218 HA LYS 85 HA LYS 85 10.746 4.787 2.876
219 HB2 LYS 85 HB2 LYS 85 12.281 3.905 1.084
220 HB3 LYS 85 HB3 LYS 85 11.095 4.377 -0.143
221 HG2 LYS 85 HG2 LYS 85 11.405 6.713 0.355
222 HG3 LYS 85 HG3 LYS 85 12.316 6.348 1.829
223 HD2 LYS 85 HD2 LYS 85 14.199 5.552 0.483
224 HD3 LYS 85 HD3 LYS 85 13.229 5.689 -1.012
225 HE2 LYS 85 HE2 LYS 85 14.680 7.614 -0.866
226 HE3 LYS 85 HE3 LYS 85 13.010 8.128 -0.659
227 HZ1 LYS 85 HZ1 LYS 85 13.399 8.246 1.754
228 HZ2 LYS 85 HZ2 LYS 85 15.001 7.786 1.542
229 HZ3 LYS 85 HZ3 LYS 85 14.437 9.193 0.959
230 H ASP 86 H ASP 86 10.212 6.981 2.304
231 HA ASP 86 HA ASP 86 8.066 7.491 0.433
232 HB2 ASP 86 HB2 ASP 86 7.157 7.278 2.912
233 HB3 ASP 86 HB3 ASP 86 7.906 8.850 3.135
234 H1 HOH 201 H1 HOH 98 -4.497 -3.556 11.113
235 H2 HOH 201 H2 HOH 98 -4.961 -3.732 12.543
236 H1 HOH 202 H1 HOH 76 0.348 -3.887 9.991
237 H2 HOH 202 H2 HOH 76 1.064 -5.159 10.399
238 H1 HOH 203 H1 HOH 193 3.863 8.792 1.237
239 H2 HOH 203 H2 HOH 193 3.110 10.102 1.171
240 H1 HOH 204 H1 HOH 195 5.653 10.904 2.698
241 H2 HOH 204 H2 HOH 195 5.512 12.361 3.086
242 H1 HOH 205 H1 HOH 41 3.604 -9.413 -13.437
243 H2 HOH 205 H2 HOH 41 3.645 -8.060 -12.756
244 H1 HOH 206 H1 HOH 184 4.312 2.064 -10.873
245 H2 HOH 206 H2 HOH 184 5.156 1.748 -12.093
246 H1 HOH 207 H1 HOH 196 6.305 11.963 -0.780
247 H2 HOH 207 H2 HOH 196 6.866 11.162 0.380
248 H1 HOH 208 H1 HOH 192 4.314 8.066 4.748
249 H2 HOH 208 H2 HOH 192 4.736 7.385 3.467
250 H1 HOH 209 H1 HOH 198 -6.009 5.471 7.588
251 H2 HOH 209 H2 HOH 198 -6.966 4.765 6.658
252 H1 HOH 210 H1 HOH 160 0.041 4.863 -9.959
253 H2 HOH 210 H2 HOH 160 -0.209 6.130 -9.169
254 H1 HOH 211 H1 HOH 142 -9.728 3.789 7.880
255 H2 HOH 211 H2 HOH 142 -10.297 2.625 7.098
256 H1 HOH 212 H1 HOH 123 13.163 2.957 3.232
257 H2 HOH 212 H2 HOH 123 13.617 4.236 3.901
258 H1 HOH 213 H1 HOH 68 -0.397 -4.625 1.645
259 H2 HOH 213 H2 HOH 68 -1.745 -5.221 1.994
260 H1 HOH 214 H1 HOH 100 4.716 -7.721 -10.535
261 H2 HOH 214 H2 HOH 100 5.222 -8.285 -11.845
262 H1 HOH 215 H1 HOH 92 -3.817 4.201 7.570
263 H2 HOH 215 H2 HOH 92 -3.600 5.577 8.161
264 H1 HOH 216 H1 HOH 137 -17.608 -3.856 -1.458
265 H2 HOH 216 H2 HOH 137 -17.983 -4.962 -0.490
266 H1 HOH 217 H1 HOH 15 -18.100 -5.948 2.262
267 H2 HOH 217 H2 HOH 15 -18.544 -4.734 3.047
268 H1 HOH 218 H1 HOH 22 -10.872 -10.429 -1.327
269 H2 HOH 218 H2 HOH 22 -10.673 -11.916 -1.552
270 H1 HOH 219 H1 HOH 175 0.467 4.691 2.001
271 H2 HOH 219 H2 HOH 175 1.965 4.855 1.842
272 H1 HOH 220 H1 HOH 74 -10.961 -10.540 -3.553
273 H2 HOH 220 H2 HOH 74 -10.732 -10.726 -5.038
274 H1 HOH 221 H1 HOH 63 6.313 -3.700 4.498
275 H2 HOH 221 H2 HOH 63 4.875 -3.676 4.972
276 H1 HOH 222 H1 HOH 103 14.864 -3.499 2.415
277 H2 HOH 222 H2 HOH 103 15.322 -4.376 1.265
278 H1 HOH 223 H1 HOH 134 -15.113 5.467 7.186
279 H2 HOH 223 H2 HOH 134 -14.920 6.812 6.517
280 H1 HOH 224 H1 HOH 112 19.528 -1.566 1.153
281 H2 HOH 224 H2 HOH 112 19.972 -0.336 0.393
282 H1 HOH 225 H1 HOH 61 6.274 -6.606 4.963
283 H2 HOH 225 H2 HOH 61 7.082 -6.870 3.709
284 H1 HOH 226 H1 HOH 25 -3.004 -11.496 -9.879
285 H2 HOH 226 H2 HOH 25 -3.289 -12.085 -11.243
286 H1 HOH 227 H1 HOH 75 -3.396 -11.364 -3.265
287 H2 HOH 227 H2 HOH 75 -2.132 -11.981 -3.829
288 H1 HOH 228 H1 HOH 139 -16.286 -0.613 2.856
289 H2 HOH 228 H2 HOH 139 -17.774 -0.358 2.713
290 H1 HOH 229 H1 HOH 28 -5.428 -16.519 -4.877
291 H2 HOH 229 H2 HOH 28 -5.196 -17.041 -6.280
292 H1 HOH 230 H1 HOH 119 16.964 7.801 3.363
293 H2 HOH 230 H2 HOH 119 16.566 6.467 2.765
294 H1 HOH 231 H1 HOH 31 -4.880 -16.758 -8.461
295 H2 HOH 231 H2 HOH 31 -3.427 -16.717 -8.888
296 H1 HOH 232 H1 HOH 172 -1.706 3.706 -9.715
297 H2 HOH 232 H2 HOH 172 -0.653 2.787 -10.281
298 H1 HOH 233 H1 HOH 148 -9.995 9.759 6.152
299 H2 HOH 233 H2 HOH 148 -9.797 8.431 6.849
300 H1 HOH 234 H1 HOH 177 -9.456 -1.470 -6.723
301 H2 HOH 234 H2 HOH 177 -8.120 -0.959 -7.221
302 H1 HOH 235 H1 HOH 141 -12.643 -1.005 -3.373
303 H2 HOH 235 H2 HOH 141 -11.194 -1.070 -2.939
304 H1 HOH 236 H1 HOH 2 -14.110 -10.423 -1.246
305 H2 HOH 236 H2 HOH 2 -12.835 -10.626 -2.037
306 H1 HOH 237 H1 HOH 183 3.844 0.084 -11.904
307 H2 HOH 237 H2 HOH 183 4.314 -0.779 -13.057
308 H1 HOH 238 H1 HOH 37 -3.635 -15.992 -4.185
309 H2 HOH 238 H2 HOH 37 -2.635 -16.078 -3.050
310 H1 HOH 239 H1 HOH 147 -12.246 9.018 6.452
311 H2 HOH 239 H2 HOH 147 -13.424 9.464 7.296
312 H1 HOH 240 H1 HOH 106 8.532 -6.695 -10.400
313 H2 HOH 240 H2 HOH 106 8.661 -5.544 -11.377
314 H1 HOH 241 H1 HOH 30 -2.277 -9.120 -9.423
315 H2 HOH 241 H2 HOH 30 -3.419 -8.425 -10.140
316 H1 HOH 242 H1 HOH 82 8.377 -1.467 5.242
317 H2 HOH 242 H2 HOH 82 8.968 -2.711 4.620
318 H1 HOH 243 H1 HOH 168 -1.637 -0.856 -12.489
319 H2 HOH 243 H2 HOH 168 -2.318 -2.173 -12.169
320 H1 HOH 244 H1 HOH 173 -4.845 -0.090 -9.955
321 H2 HOH 244 H2 HOH 173 -6.229 0.506 -10.057
322 H1 HOH 245 H1 HOH 79 3.737 -8.184 -6.212
323 H2 HOH 245 H2 HOH 79 2.868 -8.041 -7.444
324 H1 HOH 246 H1 HOH 69 2.324 -4.909 5.247
325 H2 HOH 246 H2 HOH 69 1.700 -6.285 5.230
326 H1 HOH 247 H1 HOH 166 -11.353 -7.639 -6.637
327 H2 HOH 247 H2 HOH 166 -9.900 -7.299 -6.387
328 H1 HOH 248 H1 HOH 162 -3.567 1.834 -5.659
329 H2 HOH 248 H2 HOH 162 -3.294 0.755 -6.681
330 H1 HOH 249 H1 HOH 150 -2.564 -4.701 -12.474
331 H2 HOH 249 H2 HOH 150 -1.680 -4.117 -13.555
332 H1 HOH 250 H1 HOH 46 5.292 -9.773 2.685
333 H2 HOH 250 H2 HOH 46 5.327 -8.597 3.639
334 H1 HOH 251 H1 HOH 52 1.411 -5.409 3.075
335 H2 HOH 251 H2 HOH 52 1.087 -6.200 1.822
336 H1 HOH 252 H1 HOH 99 9.982 0.520 6.327
337 H2 HOH 252 H2 HOH 99 10.266 -0.786 7.036
338 H1 HOH 253 H1 HOH 96 9.654 2.544 7.633
339 H2 HOH 253 H2 HOH 96 8.404 2.437 6.790
340 H1 HOH 254 H1 HOH 126 -14.689 9.288 3.798
341 H2 HOH 254 H2 HOH 126 -13.762 8.715 4.848
342 H1 HOH 255 H1 HOH 181 -0.406 3.901 3.667
343 H2 HOH 255 H2 HOH 181 -1.662 3.609 2.872
344 H1 HOH 256 H1 HOH 55 -1.467 -8.322 -3.357
345 H2 HOH 256 H2 HOH 55 -2.139 -7.652 -4.536
346 H1 HOH 257 H1 HOH 3 -14.581 -10.076 -3.572
347 H2 HOH 257 H2 HOH 3 -15.797 -9.477 -4.252
348 H1 HOH 258 H1 HOH 93 -0.290 -3.718 12.630
349 H2 HOH 258 H2 HOH 93 1.071 -3.823 11.980
350 H1 HOH 259 H1 HOH 133 -12.492 7.772 1.561
351 H2 HOH 259 H2 HOH 133 -13.296 7.486 2.812
352 H1 HOH 260 H1 HOH 199 6.488 -5.771 -15.830
353 H2 HOH 260 H2 HOH 199 6.037 -6.810 -14.827
354 H1 HOH 261 H1 HOH 35 -1.211 -10.970 -9.911
355 H2 HOH 261 H2 HOH 35 -0.987 -10.722 -8.430
356 H1 HOH 262 H1 HOH 197 10.510 12.411 3.110
357 H2 HOH 262 H2 HOH 197 10.840 12.246 1.644
358 H1 HOH 263 H1 HOH 151 -4.191 -5.795 -12.577
359 H2 HOH 263 H2 HOH 151 -3.924 -7.004 -11.704
360 H1 HOH 264 H1 HOH 53 -3.509 -6.417 3.028
361 H2 HOH 264 H2 HOH 53 -2.681 -7.613 2.607
362 H1 HOH 265 H1 HOH 178 -6.985 -1.625 -10.269
363 H2 HOH 265 H2 HOH 178 -8.125 -1.678 -11.262
364 H1 HOH 266 H1 HOH 50 9.031 -6.105 2.553
365 H2 HOH 266 H2 HOH 50 8.034 -5.031 2.195
366 H1 HOH 267 H1 HOH 190 4.156 10.466 5.928
367 H2 HOH 267 H2 HOH 190 4.951 10.322 4.649
368 H1 HOH 268 H1 HOH 9 -15.543 -7.004 4.560
369 H2 HOH 268 H2 HOH 9 -16.264 -6.106 3.576
370 H1 HOH 269 H1 HOH 127 -19.998 -2.998 1.736
371 H2 HOH 269 H2 HOH 127 -20.619 -3.418 3.051
372 H1 HOH 270 H1 HOH 140 -14.332 0.093 2.931
373 H2 HOH 270 H2 HOH 140 -14.072 -0.672 4.215
374 H1 HOH 271 H1 HOH 27 -5.157 -15.529 -10.298
375 H2 HOH 271 H2 HOH 27 -5.451 -15.782 -11.761
376 H1 HOH 272 H1 HOH 191 -1.763 7.243 8.740
377 H2 HOH 272 H2 HOH 191 -1.314 5.802 8.658
378 H1 HOH 273 H1 HOH 81 6.016 -0.318 6.520
379 H2 HOH 273 H2 HOH 81 5.174 0.057 7.721
380 H1 HOH 274 H1 HOH 155 0.459 -4.772 -14.331
381 H2 HOH 274 H2 HOH 155 -0.264 -4.097 -15.477
382 H1 HOH 275 H1 HOH 17 -15.042 1.833 7.195
383 H2 HOH 275 H2 HOH 17 -13.733 2.076 7.917
384 H1 HOH 276 H1 HOH 152 -7.161 -5.005 -11.128
385 H2 HOH 276 H2 HOH 152 -7.883 -3.915 -10.367
386 H1 HOH 277 H1 HOH 12 -12.731 3.407 9.896
387 H2 HOH 277 H2 HOH 12 -12.074 3.208 8.546
388 H1 HOH 278 H1 HOH 116 10.405 -1.110 -3.018
389 H2 HOH 278 H2 HOH 116 9.910 0.247 -2.564
390 H1 HOH 279 H1 HOH 187 5.487 4.525 -7.474
391 H2 HOH 279 H2 HOH 187 5.854 4.564 -8.944
392 H1 HOH 280 H1 HOH 91 7.723 6.692 6.139
393 H2 HOH 280 H2 HOH 91 8.514 6.500 4.863
394 H1 HOH 281 H1 HOH 89 1.199 5.200 8.565
395 H2 HOH 281 H2 HOH 89 0.316 4.097 9.111
396 H1 HOH 282 H1 HOH 136 -12.775 5.462 1.382
397 H2 HOH 282 H2 HOH 136 -13.802 4.384 1.106
398 H1 HOH 283 H1 HOH 88 6.308 4.120 6.646
399 H2 HOH 283 H2 HOH 88 7.727 4.550 6.343
400 H1 HOH 284 H1 HOH 71 -4.513 -14.384 -2.637
401 H2 HOH 284 H2 HOH 71 -5.484 -13.220 -2.653
402 H1 HOH 285 H1 HOH 57 -6.883 -11.280 -2.567
403 H2 HOH 285 H2 HOH 57 -5.490 -10.977 -3.073
404 H1 HOH 286 H1 HOH 146 -8.045 6.853 7.404
405 H2 HOH 286 H2 HOH 146 -8.196 7.919 8.469
406 H1 HOH 287 H1 HOH 122 17.909 4.205 -0.457
407 H2 HOH 287 H2 HOH 122 17.171 5.447 -0.003
408 H1 HOH 288 H1 HOH 182 1.941 2.082 -13.695
409 H2 HOH 288 H2 HOH 182 2.598 0.717 -13.642
410 H1 HOH 289 H1 HOH 180 -2.813 0.008 -10.689
411 H2 HOH 289 H2 HOH 180 -2.740 1.378 -10.042
412 H1 HOH 290 H1 HOH 66 1.452 -8.358 0.442
413 H2 HOH 290 H2 HOH 66 0.083 -7.766 0.705
414 H1 HOH 291 H1 HOH 194 4.920 12.110 -2.797
415 H2 HOH 291 H2 HOH 194 4.128 11.304 -1.790
416 H1 HOH 292 H1 HOH 111 11.729 -1.046 5.244
417 H2 HOH 292 H2 HOH 111 13.212 -0.845 5.012
418 H1 HOH 293 H1 HOH 83 9.268 -3.443 0.912
419 H2 HOH 293 H2 HOH 83 9.026 -3.033 2.350
420 H1 HOH 294 H1 HOH 154 -5.736 -8.518 -10.679
421 H2 HOH 294 H2 HOH 154 -4.908 -9.193 -11.753
422 H1 HOH 295 H1 HOH 5 -13.260 -0.045 7.564
423 H2 HOH 295 H2 HOH 5 -12.254 -0.316 8.661
424 H1 HOH 296 H1 HOH 110 8.260 -9.295 -10.855
425 H2 HOH 296 H2 HOH 110 7.155 -8.284 -10.634
426 H1 HOH 297 H1 HOH 179 -11.223 -2.972 -7.306
427 H2 HOH 297 H2 HOH 179 -11.445 -1.812 -8.253
428 H1 HOH 298 H1 HOH 14 -19.155 -7.493 0.853
429 H2 HOH 298 H2 HOH 14 -17.915 -7.046 0.103
430 H1 HOH 299 H1 HOH 167 -5.363 5.849 2.760
431 H2 HOH 299 H2 HOH 167 -4.955 4.454 2.336
432 H1 HOH 300 H1 HOH 39 -8.598 -15.469 -9.332
433 H2 HOH 300 H2 HOH 39 -7.171 -15.606 -9.819
434 H1 HOH 301 H1 HOH 42 3.295 -9.075 4.530
435 H2 HOH 301 H2 HOH 42 2.590 -9.124 5.871
436 H1 HOH 302 H1 HOH 48 -2.250 -8.391 -0.106
437 H2 HOH 302 H2 HOH 48 -1.922 -7.216 0.787
438 H1 HOH 303 H1 HOH 47 5.443 -6.585 -5.717
439 H2 HOH 303 H2 HOH 47 6.053 -7.728 -6.499
440 H1 HOH 304 H1 HOH 34 -6.189 -15.620 -3.019
441 H2 HOH 304 H2 HOH 34 -7.334 -15.597 -4.008
442 H1 HOH 305 H1 HOH 102 11.598 -3.306 -0.294
443 H2 HOH 305 H2 HOH 102 10.361 -3.991 -0.823
444 H1 HOH 306 H1 HOH 32 -12.894 -9.346 -7.301
445 H2 HOH 306 H2 HOH 32 -11.835 -9.092 -8.353
446 H1 HOH 307 H1 HOH 161 4.885 7.484 -9.362
447 H2 HOH 307 H2 HOH 161 3.867 6.401 -9.629
448 H1 HOH 308 H1 HOH 13 -12.570 -4.255 4.151
449 H2 HOH 308 H2 HOH 13 -12.400 -3.379 5.377
450 H1 HOH 309 H1 HOH 40 -1.647 -8.369 -13.392
451 H2 HOH 309 H2 HOH 40 -1.947 -8.150 -11.923
452 H1 HOH 310 H1 HOH 143 -11.692 1.993 -4.929
453 H2 HOH 310 H2 HOH 143 -11.323 0.743 -5.699
454 H1 HOH 311 H1 HOH 73 -6.587 -6.079 8.690
455 H2 HOH 311 H2 HOH 73 -5.703 -5.681 7.526
456 H1 HOH 312 H1 HOH 10 -7.646 -5.382 10.814
457 H2 HOH 312 H2 HOH 10 -6.282 -4.756 10.621
458 H1 HOH 313 H1 HOH 125 -14.999 0.825 -0.066
459 H2 HOH 313 H2 HOH 125 -15.786 0.307 1.119
460 H1 HOH 314 H1 HOH 174 1.507 6.576 0.570
461 H2 HOH 314 H2 HOH 174 2.110 7.907 0.167
462 H1 HOH 315 H1 HOH 33 -7.353 -13.215 -4.269
463 H2 HOH 315 H2 HOH 33 -7.786 -13.819 -5.588
464 H1 HOH 316 H1 HOH 118 14.290 0.737 6.366
465 H2 HOH 316 H2 HOH 118 15.187 0.801 5.147
466 H1 HOH 317 H1 HOH 107 15.033 -3.115 4.652
467 H2 HOH 317 H2 HOH 107 13.591 -2.796 4.319
468 H1 HOH 318 H1 HOH 60 0.023 -10.899 -4.261
469 H2 HOH 318 H2 HOH 60 0.257 -12.359 -3.945
470 H1 HOH 319 H1 HOH 157 -0.419 5.051 -5.521
471 H2 HOH 319 H2 HOH 157 -1.754 5.279 -6.195
472 H1 HOH 320 H1 HOH 59 10.755 -3.853 3.378
473 H2 HOH 320 H2 HOH 59 11.211 -2.546 3.995
474 H1 HOH 321 H1 HOH 8 -7.805 -6.822 6.932
475 H2 HOH 321 H2 HOH 8 -9.032 -5.955 6.753
476 H1 HOH 322 H1 HOH 188 -11.297 -5.344 -6.595
477 H2 HOH 322 H2 HOH 188 -12.595 -5.089 -7.329
478 H1 HOH 323 H1 HOH 120 16.768 4.515 1.854
479 H2 HOH 323 H2 HOH 120 15.571 4.268 2.753
480 H1 HOH 324 H1 HOH 7 -12.270 -6.745 3.470
481 H2 HOH 324 H2 HOH 7 -13.669 -6.161 3.433
482 H1 HOH 325 H1 HOH 29 -6.701 -18.360 -7.555
483 H2 HOH 325 H2 HOH 29 -6.883 -16.955 -8.094
484 H1 HOH 326 H1 HOH 54 -3.579 -9.211 -2.954
485 H2 HOH 326 H2 HOH 54 -3.941 -9.687 -1.561
486 H1 HOH 327 H1 HOH 78 3.541 -2.462 9.119
487 H2 HOH 327 H2 HOH 78 2.445 -3.511 9.108
488 H1 HOH 328 H1 HOH 189 6.028 8.646 6.319
489 H2 HOH 328 H2 HOH 189 5.738 7.257 5.803
490 H1 HOH 329 H1 HOH 138 -14.824 -5.486 -6.387
491 H2 HOH 329 H2 HOH 138 -14.639 -4.368 -5.377
492 H1 HOH 330 H1 HOH 65 4.282 -1.798 6.192
493 H2 HOH 330 H2 HOH 65 3.585 -2.938 6.905
494 H1 HOH 331 H1 HOH 21 -8.999 -3.769 7.748
495 H2 HOH 331 H2 HOH 21 -10.383 -3.926 7.150
496 H1 HOH 332 H1 HOH 38 1.266 -10.342 -7.717
497 H2 HOH 332 H2 HOH 38 0.418 -10.240 -6.469
498 H1 HOH 333 H1 HOH 4 -14.266 -10.364 -5.936
499 H2 HOH 333 H2 HOH 4 -14.347 -11.438 -7.002
500 H1 HOH 334 H1 HOH 117 15.324 2.613 4.001
501 H2 HOH 334 H2 HOH 117 16.797 2.695 4.344
502 H1 HOH 335 H1 HOH 145 -11.088 3.312 -1.184
503 H2 HOH 335 H2 HOH 145 -11.726 4.382 -0.321
504 H1 HOH 336 H1 HOH 26 -7.755 -13.495 -12.453
505 H2 HOH 336 H2 HOH 26 -6.936 -13.940 -11.260
506 H1 HOH 337 H1 HOH 94 4.156 1.350 6.460
507 H2 HOH 337 H2 HOH 94 3.497 2.393 7.340
508 H1 HOH 338 H1 HOH 135 -15.949 4.338 9.018
509 H2 HOH 338 H2 HOH 135 -17.223 4.635 8.257
510 H1 HOH 339 H1 HOH 153 -8.725 -6.215 -9.795
511 H2 HOH 339 H2 HOH 153 -10.128 -6.764 -9.932
512 H1 HOH 340 H1 HOH 163 2.527 9.368 -2.325
513 H2 HOH 340 H2 HOH 163 2.961 9.679 -0.907
514 H1 HOH 341 H1 HOH 124 -14.466 -6.495 -8.407
515 H2 HOH 341 H2 HOH 124 -13.351 -7.195 -7.657
516 H1 HOH 342 H1 HOH 144 -13.379 0.444 -4.400
517 H2 HOH 342 H2 HOH 144 -14.514 -0.524 -4.659
518 H1 HOH 343 H1 HOH 24 -7.974 -8.169 -9.724
519 H2 HOH 343 H2 HOH 24 -7.737 -9.624 -10.082
520 H1 HOH 344 H1 HOH 84 -9.210 -13.801 -1.225
521 H2 HOH 344 H2 HOH 84 -9.848 -13.388 0.085
522 H1 HOH 345 H1 HOH 171 1.237 6.257 -4.636
523 H2 HOH 345 H2 HOH 171 1.659 6.653 -6.038
524 H1 HOH 346 H1 HOH 132 -12.619 -3.581 -5.633
525 H2 HOH 346 H2 HOH 132 -12.739 -2.765 -4.361
526 H1 HOH 347 H1 HOH 56 -2.116 -7.388 7.684
527 H2 HOH 347 H2 HOH 56 -3.217 -7.966 6.823
528 H1 HOH 348 H1 HOH 62 1.911 -10.611 2.301
529 H2 HOH 348 H2 HOH 62 3.336 -10.100 2.246
530 H1 HOH 349 H1 HOH 149 -4.292 -3.910 -13.312
531 H2 HOH 349 H2 HOH 149 -5.498 -4.110 -14.205
532 H1 HOH 350 H1 HOH 1 -18.025 -8.684 -4.388
533 H2 HOH 350 H2 HOH 1 -17.198 -7.478 -3.989
534 H1 HOH 351 H1 HOH 185 -10.560 4.188 -4.220
535 H2 HOH 351 H2 HOH 185 -10.180 3.243 -5.341
536 H1 HOH 352 H1 HOH 97 4.493 5.514 5.406
537 H2 HOH 352 H2 HOH 97 4.250 4.084 5.857
538 H1 HOH 353 H1 HOH 113 11.400 -1.885 -4.653
539 H2 HOH 353 H2 HOH 113 10.170 -2.481 -5.306
540 H1 HOH 354 H1 HOH 115 9.004 -5.297 -8.858
541 H2 HOH 354 H2 HOH 115 9.818 -5.948 -7.760
542 H1 HOH 355 H1 HOH 129 -17.330 -4.841 -3.451
543 H2 HOH 355 H2 HOH 129 -16.363 -5.507 -4.408
544 H1 HOH 356 H1 HOH 104 16.021 -6.724 1.355
545 H2 HOH 356 H2 HOH 104 15.848 -6.330 -0.096
546 H1 HOH 357 H1 HOH 16 -16.979 -6.590 -2.054
547 H2 HOH 357 H2 HOH 16 -17.115 -8.088 -1.942
548 H1 HOH 358 H1 HOH 164 -0.002 6.502 -0.626
549 H2 HOH 358 H2 HOH 164 -1.466 6.867 -0.752
550 H1 HOH 359 H1 HOH 109 10.016 -3.314 -3.167
551 H2 HOH 359 H2 HOH 109 9.088 -4.499 -2.985
552 H1 HOH 360 H1 HOH 121 16.737 -2.014 6.368
553 H2 HOH 360 H2 HOH 121 15.572 -1.291 5.727
554 H1 HOH 361 H1 HOH 77 1.669 -9.065 -5.372
555 H2 HOH 361 H2 HOH 77 0.805 -8.904 -4.135
556 H1 HOH 362 H1 HOH 105 20.068 3.977 -1.779
557 H2 HOH 362 H2 HOH 105 18.929 4.655 -2.507
558 H1 HOH 363 H1 HOH 128 -18.254 0.048 -2.312
559 H2 HOH 363 H2 HOH 128 -16.766 -0.114 -2.093
560 H1 HOH 364 H1 HOH 130 -18.476 -3.011 -3.843
561 H2 HOH 364 H2 HOH 130 -17.703 -2.263 -2.777
562 H1 HOH 365 H1 HOH 170 0.352 6.279 -2.624
563 H2 HOH 365 H2 HOH 170 1.649 6.777 -2.025
564 H1 HOH 366 H1 HOH 11 -11.032 -8.649 6.506
565 H2 HOH 366 H2 HOH 11 -9.792 -7.984 5.947
566 H1 HOH 367 H1 HOH 44 -5.390 -7.868 7.468
567 H2 HOH 367 H2 HOH 44 -5.301 -9.379 7.525
568 H1 HOH 368 H1 HOH 64 6.343 -11.750 1.844
569 H2 HOH 368 H2 HOH 64 7.241 -10.616 1.395
570 H1 HOH 369 H1 HOH 85 0.789 2.133 11.305
571 H2 HOH 369 H2 HOH 85 0.741 3.645 11.358
572 H1 HOH 370 H1 HOH 43 0.671 -8.770 2.554
573 H2 HOH 370 H2 HOH 43 0.970 -9.224 3.971
574 H1 HOH 371 H1 HOH 72 2.277 -9.998 0.026
575 H2 HOH 371 H2 HOH 72 2.826 -9.709 -1.356
576 H1 HOH 372 H1 HOH 156 -1.472 -7.515 -15.725
577 H2 HOH 372 H2 HOH 156 -1.126 -6.390 -14.771
578 H1 HOH 373 H1 HOH 6 -12.563 -3.686 7.824
579 H2 HOH 373 H2 HOH 6 -12.217 -2.292 7.342
580 H1 HOH 374 H1 HOH 67 -0.533 -8.064 -1.533
581 H2 HOH 374 H2 HOH 67 0.716 -8.869 -1.828
582 H1 HOH 375 H1 HOH 36 -9.518 -11.155 -10.928
583 H2 HOH 375 H2 HOH 36 -8.188 -11.853 -10.773
584 H1 HOH 376 H1 HOH 49 -3.240 -9.578 1.118
585 H2 HOH 376 H2 HOH 49 -4.661 -9.397 0.632
586 H1 HOH 377 H1 HOH 45 -1.383 -9.420 2.944
587 H2 HOH 377 H2 HOH 45 -2.715 -10.032 3.327
588 H1 HOH 378 H1 HOH 23 -1.194 -10.339 -12.029
589 H2 HOH 378 H2 HOH 23 -0.106 -11.382 -12.185
590 H1 HOH 379 H1 HOH 95 6.086 1.742 9.194
591 H2 HOH 379 H2 HOH 95 4.572 1.762 9.244
592 H1 HOH 380 H1 HOH 101 12.469 -0.079 -5.392
593 H2 HOH 380 H2 HOH 101 13.631 -1.032 -5.574
594 H1 HOH 381 H1 HOH 131 -14.867 0.576 -2.527
595 H2 HOH 381 H2 HOH 131 -15.295 1.953 -2.064
596 H1 HOH 382 H1 HOH 80 6.471 -9.108 -3.244
597 H2 HOH 382 H2 HOH 80 5.541 -8.190 -4.011
598 H1 HOH 383 H1 HOH 108 11.879 -5.768 2.233
599 H2 HOH 383 H2 HOH 108 10.974 -4.907 1.373
600 H1 HOH 384 H1 HOH 176 -8.428 2.068 -6.830
601 H2 HOH 384 H2 HOH 176 -8.228 3.497 -6.371
602 H1 HOH 385 H1 HOH 87 4.717 -0.400 9.833
603 H2 HOH 385 H2 HOH 87 4.453 -1.235 11.068
604 H1 HOH 386 H1 HOH 186 3.417 8.561 -6.452
605 H2 HOH 386 H2 HOH 186 3.207 7.608 -7.611
606 H1 HOH 387 H1 HOH 20 -9.535 -10.116 5.368
607 H2 HOH 387 H2 HOH 20 -8.185 -10.118 4.685
608 H1 HOH 388 H1 HOH 114 9.467 -2.135 -7.750
609 H2 HOH 388 H2 HOH 114 9.489 -3.566 -7.255
610 H1 HOH 389 H1 HOH 158 -10.674 6.357 -3.184
611 H2 HOH 389 H2 HOH 158 -10.359 5.146 -2.330
612 H1 HOH 390 H1 HOH 86 2.529 2.781 9.786
613 H2 HOH 390 H2 HOH 86 3.228 3.828 8.943
614 H1 HOH 391 H1 HOH 18 -10.688 -14.422 2.214
615 H2 HOH 391 H2 HOH 18 -9.184 -14.244 2.176
616 H1 HOH 392 H1 HOH 90 3.268 6.334 8.623
617 H2 HOH 392 H2 HOH 90 3.568 5.313 7.548
618 H1 HOH 393 H1 HOH 159 -6.297 5.172 -6.611
619 H2 HOH 393 H2 HOH 159 -7.081 4.996 -5.328
620 H1 HOH 394 H1 HOH 70 -2.299 -11.891 4.631
621 H2 HOH 394 H2 HOH 70 -3.758 -11.675 4.964
622 H1 HOH 395 H1 HOH 165 -7.078 6.284 -3.153
623 H2 HOH 395 H2 HOH 165 -8.379 5.639 -3.589
624 H1 HOH 396 H1 HOH 169 5.367 10.851 -6.859
625 H2 HOH 396 H2 HOH 169 5.854 10.121 -5.626
626 H1 HOH 397 H1 HOH 51 -4.779 -12.884 6.978
627 H2 HOH 397 H2 HOH 51 -5.724 -12.683 5.813
628 H1 HOH 398 H1 HOH 19 -7.923 -12.219 5.345
629 H2 HOH 398 H2 HOH 19 -7.679 -13.510 4.589
630 H1 HOH 399 H1 HOH 58 -7.503 -15.502 3.371
631 H2 HOH 399 H2 HOH 58 -6.868 -14.379 2.581
Start of MODEL 2
1 HA PRO 62 HA PRO 62 -10.708 -6.579 -3.642
2 HB2 PRO 62 HB2 PRO 62 -12.063 -5.377 -1.373
3 HB3 PRO 62 HB3 PRO 62 -11.883 -4.770 -3.040
4 HG2 PRO 62 HG2 PRO 62 -14.130 -6.414 -1.837
5 HG3 PRO 62 HG3 PRO 62 -14.234 -5.095 -3.046
6 HD2 PRO 62 HD2 PRO 62 -14.436 -7.602 -3.920
7 HD3 PRO 62 HD3 PRO 62 -13.299 -6.516 -4.762
8 H PHE 63 H PHE 63 -9.326 -5.880 -1.742
9 HA PHE 63 HA PHE 63 -9.560 -7.504 0.711
10 HB2 PHE 63 HB2 PHE 63 -7.881 -8.545 -1.016
11 HB3 PHE 63 HB3 PHE 63 -6.846 -7.194 -0.598
12 HD1 PHE 63 HD1 PHE 63 -8.465 -10.305 0.580
13 HD2 PHE 63 HD2 PHE 63 -5.800 -7.093 1.668
14 HE1 PHE 63 HE1 PHE 63 -7.669 -11.620 2.525
15 HE2 PHE 63 HE2 PHE 63 -5.038 -8.401 3.642
16 HZ PHE 63 HZ PHE 63 -5.934 -10.677 4.045
17 H ALA 64 H ALA 64 -8.475 -6.418 2.561
18 HA ALA 64 HA ALA 64 -8.295 -3.482 2.077
19 HB1 ALA 64 HB1 ALA 64 -9.009 -5.006 4.590
20 HB2 ALA 64 HB2 ALA 64 -8.912 -3.235 4.431
21 HB3 ALA 64 HB3 ALA 64 -10.134 -4.143 3.513
22 H CYS 65 H CYS 65 -6.715 -2.227 2.986
23 HA CYS 65 HA CYS 65 -4.155 -3.494 3.726
24 HB2 CYS 65 HB2 CYS 65 -5.106 -0.632 3.616
25 HB3 CYS 65 HB3 CYS 65 -3.420 -1.142 3.907
26 H ASP 66 H ASP 66 -3.389 -3.588 5.762
27 HA ASP 66 HA ASP 66 -4.738 -2.761 8.173
28 HB2 ASP 66 HB2 ASP 66 -3.025 -4.512 8.088
29 HB3 ASP 66 HB3 ASP 66 -1.839 -3.379 7.467
30 H ILE 67 H ILE 67 -1.790 -1.447 6.712
31 HA ILE 67 HA ILE 67 -1.657 0.889 8.119
32 HB ILE 67 HB ILE 67 -0.630 0.232 5.342
33 HG12 ILE 67 2HG1 ILE 67 0.178 -1.340 7.019
34 HG13 ILE 67 3HG1 ILE 67 1.479 -0.329 6.434
35 HG21 ILE 67 HG21 ILE 67 0.261 2.525 7.118
36 HG22 ILE 67 HG22 ILE 67 1.157 1.925 5.701
37 HG23 ILE 67 HG23 ILE 67 -0.451 2.628 5.502
38 HD11 ILE 67 1HD1 ILE 67 1.341 1.043 8.523
39 HD12 ILE 67 2HD1 ILE 67 0.067 -0.043 9.126
40 HD13 ILE 67 3HD1 ILE 67 1.696 -0.660 8.830
41 H CYS 68 H CYS 68 -3.710 0.562 5.275
42 HA CYS 68 HA CYS 68 -4.234 3.508 5.301
43 HB2 CYS 68 HB2 CYS 68 -4.986 1.339 3.317
44 HB3 CYS 68 HB3 CYS 68 -5.766 2.905 3.367
45 H GLY 69 H GLY 69 -5.613 0.476 6.505
46 HA2 GLY 69 HA2 GLY 69 -7.714 -0.141 7.146
47 HA3 GLY 69 HA3 GLY 69 -7.981 1.558 7.554
48 H ARG 70 H ARG 70 -7.414 0.325 4.260
49 HA ARG 70 HA ARG 70 -10.202 0.998 3.433
50 HB2 ARG 70 HB2 ARG 70 -7.656 2.076 2.151
51 HB3 ARG 70 HB3 ARG 70 -9.252 2.218 1.432
52 HG2 ARG 70 HG2 ARG 70 -8.360 3.501 4.039
53 HG3 ARG 70 HG3 ARG 70 -8.548 4.312 2.480
54 HD2 ARG 70 HD2 ARG 70 -10.959 3.851 2.526
55 HD3 ARG 70 HD3 ARG 70 -10.788 2.958 4.015
56 HE ARG 70 HE ARG 70 -9.976 5.830 3.937
57 HH11 ARG 70 1HH1 ARG 70 -11.127 7.254 5.311
58 HH12 ARG 70 2HH1 ARG 70 -12.644 6.695 5.980
59 HH21 ARG 70 1HH2 ARG 70 -12.250 3.473 5.236
60 HH22 ARG 70 2HH2 ARG 70 -13.247 4.725 5.938
61 H LYS 71 H LYS 71 -10.891 0.157 1.441
62 HA LYS 71 HA LYS 71 -9.779 -2.495 0.783
63 HB2 LYS 71 HB2 LYS 71 -12.244 -0.986 -0.187
64 HB3 LYS 71 HB3 LYS 71 -11.772 -2.601 -0.740
65 HG2 LYS 71 HG2 LYS 71 -11.976 -3.503 1.534
66 HG3 LYS 71 HG3 LYS 71 -12.432 -1.889 2.138
67 HD2 LYS 71 HD2 LYS 71 -14.391 -1.865 0.628
68 HD3 LYS 71 HD3 LYS 71 -13.961 -3.469 0.011
69 HE2 LYS 71 HE2 LYS 71 -14.345 -4.494 2.158
70 HE3 LYS 71 HE3 LYS 71 -14.470 -2.922 2.967
71 HZ1 LYS 71 HZ1 LYS 71 -16.527 -2.500 1.862
72 HZ2 LYS 71 HZ2 LYS 71 -16.405 -3.818 0.894
73 HZ3 LYS 71 HZ3 LYS 71 -16.630 -4.019 2.489
74 H PHE 72 H PHE 72 -8.778 -3.081 -0.970
75 HA PHE 72 HA PHE 72 -8.788 -1.440 -3.449
76 HB2 PHE 72 HB2 PHE 72 -6.341 -2.416 -1.927
77 HB3 PHE 72 HB3 PHE 72 -6.292 -1.939 -3.616
78 HD1 PHE 72 HD1 PHE 72 -6.738 0.394 -4.324
79 HD2 PHE 72 HD2 PHE 72 -6.437 -0.689 -0.152
80 HE1 PHE 72 HE1 PHE 72 -6.437 2.779 -3.723
81 HE2 PHE 72 HE2 PHE 72 -6.125 1.712 0.433
82 HZ PHE 72 HZ PHE 72 -6.130 3.441 -1.350
83 H ALA 73 H ALA 73 -7.828 -2.697 -5.274
84 HA ALA 73 HA ALA 73 -8.724 -5.481 -5.337
85 HB1 ALA 73 HB1 ALA 73 -9.127 -3.950 -7.212
86 HB2 ALA 73 HB2 ALA 73 -7.382 -3.733 -7.446
87 HB3 ALA 73 HB3 ALA 73 -8.144 -5.321 -7.714
88 H ARG 74 H ARG 74 -6.140 -5.511 -7.312
89 HA ARG 74 HA ARG 74 -4.402 -6.979 -5.359
90 HB2 ARG 74 HB2 ARG 74 -6.120 -8.424 -6.619
91 HB3 ARG 74 HB3 ARG 74 -5.192 -8.080 -8.088
92 HG2 ARG 74 HG2 ARG 74 -3.155 -9.065 -6.953
93 HG3 ARG 74 HG3 ARG 74 -4.169 -9.395 -5.536
94 HD2 ARG 74 HD2 ARG 74 -5.708 -10.719 -7.117
95 HD3 ARG 74 HD3 ARG 74 -4.392 -10.611 -8.312
96 HE ARG 74 HE ARG 74 -3.695 -11.602 -5.612
97 HH11 ARG 74 1HH1 ARG 74 -3.967 -14.877 -6.138
98 HH12 ARG 74 2HH1 ARG 74 -3.462 -13.590 -5.076
99 HH21 ARG 74 1HH2 ARG 74 -4.477 -12.760 -8.830
100 HH22 ARG 74 2HH2 ARG 74 -4.375 -14.413 -8.277
101 H SER 75 H SER 75 -4.607 -5.889 -8.723
102 HA SER 75 HA SER 75 -3.192 -4.675 -10.030
103 HB2 SER 75 HB2 SER 75 -3.183 -3.098 -7.448
104 HB3 SER 75 HB3 SER 75 -2.892 -2.467 -9.085
105 HG SER 75 HG SER 75 -4.995 -2.176 -8.961
106 H1 OUD 76 H OUD 76 -1.461 -6.308 -10.220
107 HA OUD 76 HA OUD 76 1.139 -5.276 -9.198
108 HB3 OUD 76 HB3 OUD 76 0.828 -7.741 -9.337
109 HB2 OUD 76 HB2 OUD 76 0.568 -7.617 -11.072
110 HM3 OUD 76 HM3 OUD 76 1.947 -4.853 -11.510
111 HM2 OUD 76 HM2 OUD 76 0.362 -5.299 -12.157
112 HN2 OUD 76 HN2 OUD 76 -0.500 -3.252 -11.463
113 H OUE 77 H OUE 77 -0.707 -1.421 -10.239
114 HA OUE 77 HA OUE 77 1.582 -0.763 -8.443
115 HB3 OUE 77 HB3 OUE 77 1.900 0.413 -10.595
116 HB2 OUE 77 HB2 OUE 77 0.289 1.077 -10.507
117 HG3 OUE 77 HG3 OUE 77 1.004 2.379 -8.422
118 HG2 OUE 77 HG2 OUE 77 2.625 1.711 -8.617
119 HM2 OUE 77 HM2 OUE 77 -1.223 0.429 -8.497
120 HM3 OUE 77 HM3 OUE 77 0.009 0.695 -7.260
121 HN2 OUE 77 HN2 OUE 77 -1.209 -1.975 -7.812
122 H1 OUK 78 H OUK 78 -1.350 -3.397 -6.217
123 HA OUK 78 HA OUK 78 0.578 -2.988 -3.985
124 HB2 OUK 78 HB2 OUK 78 -0.169 -5.133 -3.040
125 HB3 OUK 78 HB3 OUK 78 -1.313 -5.353 -4.343
126 HG2 OUK 78 HG2 OUK 78 -2.533 -3.237 -3.506
127 HG3 OUK 78 HG3 OUK 78 -1.466 -3.278 -2.100
128 HD2 OUK 78 HD2 OUK 78 -2.293 -5.646 -1.618
129 HD3 OUK 78 HD3 OUK 78 -3.328 -5.538 -3.032
130 HE2 OUK 78 HE2 OUK 78 -4.840 -5.042 -1.326
131 HE3 OUK 78 HE3 OUK 78 -4.376 -3.421 -1.870
132 HZ3 OUK 78 HZ3 OUK 78 -3.432 -4.828 0.595
133 HZ1 OUK 78 HZ1 OUK 78 -4.397 -3.459 0.526
134 HZ2 OUK 78 HZ2 OUK 78 -2.807 -3.395 0.081
135 HM3 OUK 78 HM3 OUK 78 1.668 -5.058 -4.734
136 HM2 OUK 78 HM2 OUK 78 0.427 -5.309 -5.968
137 HN2 OUK 78 HN2 OUK 78 1.281 -3.513 -7.243
138 H OUR 79 H OUR 79 2.918 -2.275 -7.986
139 HA OUR 79 HA OUR 79 5.310 -1.973 -6.219
140 HB3 OUR 79 HB3 OUR 79 5.181 -1.752 -9.275
141 HB2 OUR 79 HB2 OUR 79 6.541 -1.263 -8.290
142 HG3 OUR 79 HG3 OUR 79 7.096 -3.391 -9.185
143 HG2 OUR 79 HG2 OUR 79 6.849 -3.601 -7.466
144 HD3 OUR 79 HD3 OUR 79 5.937 -5.479 -8.867
145 HD2 OUR 79 HD2 OUR 79 4.709 -4.738 -7.842
146 HE OUR 79 HE OUR 79 3.574 -4.026 -9.643
147 HH12 OUR 79 2HH1 OUR 79 6.223 -4.988 -12.574
148 HH11 OUR 79 1HH1 OUR 79 6.048 -5.963 -11.174
149 HH22 OUR 79 2HH2 OUR 79 4.841 -3.014 -12.790
150 HM2 OUR 79 HM2 OUR 79 4.260 0.182 -8.075
151 HM3 OUR 79 HM3 OUR 79 5.351 0.349 -6.692
152 HN2 OUR 79 HN2 OUR 79 2.413 -0.204 -6.554
153 HH21 OUR 79 1HH2 OUR 79 3.632 -2.721 -11.634
154 H OUH 80 H OUH 80 1.249 1.242 -5.482
155 HA OUH 80 HA OUH 80 2.346 2.057 -2.867
156 HB2 OUH 80 HB2 OUH 80 -0.063 2.660 -4.378
157 HB3 OUH 80 HB3 OUH 80 0.564 3.433 -2.951
158 HD2 OUH 80 HD2 OUH 80 -0.365 2.397 -0.409
159 HD1 OUH 80 HD1 OUH 80 -2.248 0.936 -3.929
160 HE1 OUH 80 HE1 OUH 80 -3.660 0.256 -1.879
161 HM2 OUH 80 HM2 OUH 80 0.429 -0.305 -3.157
162 HM3 OUH 80 HM3 OUH 80 1.098 0.348 -1.660
163 HN2 OUH 80 HN2 OUH 80 2.722 -0.984 -3.770
164 H1 OUK 81 H OUK 81 4.375 -2.208 -3.092
165 HA OUK 81 HA OUK 81 5.431 -1.547 -0.380
166 HB2 OUK 81 HB2 OUK 81 6.876 -3.629 -0.633
167 HB3 OUK 81 HB3 OUK 81 5.897 -4.087 -2.021
168 HG2 OUK 81 HG2 OUK 81 3.839 -4.038 -0.486
169 HG3 OUK 81 HG3 OUK 81 4.926 -3.711 0.865
170 HD2 OUK 81 HD2 OUK 81 6.142 -5.901 0.329
171 HD3 OUK 81 HD3 OUK 81 4.969 -6.185 -0.953
172 HE2 OUK 81 HE2 OUK 81 4.219 -7.451 0.973
173 HE3 OUK 81 HE3 OUK 81 3.111 -6.074 0.797
174 HZ3 OUK 81 HZ3 OUK 81 4.355 -4.974 2.642
175 HZ1 OUK 81 HZ1 OUK 81 5.320 -6.315 2.782
176 HZ2 OUK 81 HZ2 OUK 81 3.690 -6.437 3.103
177 HM3 OUK 81 HM3 OUK 81 7.630 -1.391 -1.409
178 HM2 OUK 81 HM2 OUK 81 6.999 -1.965 -2.962
179 HN2 OUK 81 HN2 OUK 81 6.111 0.123 -3.418
180 H OUI 82 H OUI 82 5.632 2.244 -3.154
181 HA OUI 82 HA OUI 82 6.234 3.462 -0.499
182 HB OUI 82 HB OUI 82 6.241 5.615 -1.548
183 3HG1 OUI 82 3HG1 OUI 82 5.606 4.225 -4.212
184 2HG1 OUI 82 2HG1 OUI 82 4.539 5.311 -3.329
185 1HG2 OUI 82 1HG2 OUI 82 8.005 3.783 -3.251
186 2HG2 OUI 82 2HG2 OUI 82 8.329 4.144 -1.549
187 3HG2 OUI 82 3HG2 OUI 82 8.343 5.445 -2.737
188 2HD1 OUI 82 2HD1 OUI 82 7.166 6.111 -4.660
189 3HD1 OUI 82 3HD1 OUI 82 6.214 7.177 -3.603
190 1HD1 OUI 82 1HD1 OUI 82 5.526 6.580 -5.119
191 HM2 OUI 82 HM2 OUI 82 3.645 3.817 -2.082
192 HM3 OUI 82 HM3 OUI 82 4.082 4.676 -0.592
193 HN2 OUI 82 HN2 OUI 82 3.672 1.736 -0.854
194 H OUH 83 H OUH 83 3.829 0.529 0.915
195 HA OUH 83 HA OUH 83 3.125 1.810 3.493
196 HB2 OUH 83 HB2 OUH 83 3.177 -0.470 4.409
197 HB3 OUH 83 HB3 OUH 83 3.683 -1.112 2.857
198 HD2 OUH 83 HD2 OUH 83 0.951 1.682 2.446
199 HD1 OUH 83 HD1 OUH 83 1.100 -2.519 3.048
200 HE1 OUH 83 HE1 OUH 83 -1.287 -1.853 2.330
201 HM2 OUH 83 HM2 OUH 83 5.233 0.827 4.523
202 HM3 OUH 83 HM3 OUH 83 5.411 2.275 3.538
203 HN2 OUH 83 HN2 OUH 83 6.024 0.525 1.685
204 H ARG 84 H ARG 84 8.141 0.631 1.111
205 HA ARG 84 HA ARG 84 10.189 0.063 3.172
206 HB2 ARG 84 HB2 ARG 84 10.139 -0.791 0.745
207 HB3 ARG 84 HB3 ARG 84 10.561 0.846 0.238
208 HG2 ARG 84 HG2 ARG 84 12.657 0.631 1.719
209 HG3 ARG 84 HG3 ARG 84 12.197 -1.068 1.952
210 HD2 ARG 84 HD2 ARG 84 12.274 -1.358 -0.543
211 HD3 ARG 84 HD3 ARG 84 12.841 0.295 -0.698
212 HE ARG 84 HE ARG 84 14.266 -1.996 0.637
213 HH11 ARG 84 1HH1 ARG 84 16.334 1.331 -0.050
214 HH12 ARG 84 2HH1 ARG 84 14.638 1.314 -0.509
215 HH21 ARG 84 1HH2 ARG 84 17.320 -0.599 0.697
216 HH22 ARG 84 2HH2 ARG 84 16.231 -1.943 1.057
217 H LYS 85 H LYS 85 9.004 2.903 1.497
218 HA LYS 85 HA LYS 85 10.734 4.786 2.883
219 HB2 LYS 85 HB2 LYS 85 12.266 3.900 1.089
220 HB3 LYS 85 HB3 LYS 85 11.077 4.367 -0.137
221 HG2 LYS 85 HG2 LYS 85 11.386 6.704 0.355
222 HG3 LYS 85 HG3 LYS 85 12.300 6.345 1.830
223 HD2 LYS 85 HD2 LYS 85 14.183 5.549 0.486
224 HD3 LYS 85 HD3 LYS 85 13.212 5.681 -1.011
225 HE2 LYS 85 HE2 LYS 85 14.661 7.610 -0.866
226 HE3 LYS 85 HE3 LYS 85 12.992 8.122 -0.660
227 HZ1 LYS 85 HZ1 LYS 85 13.383 8.242 1.754
228 HZ2 LYS 85 HZ2 LYS 85 14.985 7.783 1.541
229 HZ3 LYS 85 HZ3 LYS 85 14.421 9.188 0.958
230 H ASP 86 H ASP 86 10.198 6.972 2.313
231 HA ASP 86 HA ASP 86 8.059 7.485 0.435
232 HB2 ASP 86 HB2 ASP 86 7.145 7.283 2.912
233 HB3 ASP 86 HB3 ASP 86 7.898 8.853 3.132
234 H1 HOH 201 H1 HOH 98 -4.497 -3.556 11.113
235 H2 HOH 201 H2 HOH 98 -4.961 -3.732 12.543
236 H1 HOH 202 H1 HOH 76 0.348 -3.887 9.991
237 H2 HOH 202 H2 HOH 76 1.064 -5.159 10.399
238 H1 HOH 203 H1 HOH 193 3.863 8.792 1.237
239 H2 HOH 203 H2 HOH 193 3.110 10.102 1.171
240 H1 HOH 204 H1 HOH 195 5.653 10.904 2.698
241 H2 HOH 204 H2 HOH 195 5.512 12.361 3.086
242 H1 HOH 205 H1 HOH 184 4.312 2.064 -10.873
243 H2 HOH 205 H2 HOH 184 5.156 1.748 -12.093
244 H1 HOH 206 H1 HOH 41 3.604 -9.413 -13.437
245 H2 HOH 206 H2 HOH 41 3.645 -8.060 -12.756
246 H1 HOH 207 H1 HOH 196 6.305 11.963 -0.780
247 H2 HOH 207 H2 HOH 196 6.866 11.162 0.380
248 H1 HOH 208 H1 HOH 198 -6.009 5.471 7.588
249 H2 HOH 208 H2 HOH 198 -6.966 4.765 6.658
250 H1 HOH 209 H1 HOH 192 4.314 8.066 4.748
251 H2 HOH 209 H2 HOH 192 4.736 7.385 3.467
252 H1 HOH 210 H1 HOH 160 0.041 4.863 -9.959
253 H2 HOH 210 H2 HOH 160 -0.209 6.130 -9.169
254 H1 HOH 211 H1 HOH 142 -9.728 3.789 7.880
255 H2 HOH 211 H2 HOH 142 -10.297 2.625 7.098
256 H1 HOH 212 H1 HOH 123 13.163 2.957 3.232
257 H2 HOH 212 H2 HOH 123 13.617 4.236 3.901
258 H1 HOH 213 H1 HOH 68 -0.397 -4.625 1.645
259 H2 HOH 213 H2 HOH 68 -1.745 -5.221 1.994
260 H1 HOH 214 H1 HOH 92 -3.817 4.201 7.570
261 H2 HOH 214 H2 HOH 92 -3.600 5.577 8.161
262 H1 HOH 215 H1 HOH 100 4.716 -7.721 -10.535
263 H2 HOH 215 H2 HOH 100 5.222 -8.285 -11.845
264 H1 HOH 216 H1 HOH 15 -18.100 -5.948 2.262
265 H2 HOH 216 H2 HOH 15 -18.544 -4.734 3.047
266 H1 HOH 217 H1 HOH 175 0.467 4.691 2.001
267 H2 HOH 217 H2 HOH 175 1.965 4.855 1.842
268 H1 HOH 218 H1 HOH 137 -17.608 -3.856 -1.458
269 H2 HOH 218 H2 HOH 137 -17.983 -4.962 -0.490
270 H1 HOH 219 H1 HOH 22 -10.872 -10.429 -1.327
271 H2 HOH 219 H2 HOH 22 -10.673 -11.916 -1.552
272 H1 HOH 220 H1 HOH 74 -10.961 -10.540 -3.553
273 H2 HOH 220 H2 HOH 74 -10.732 -10.726 -5.038
274 H1 HOH 221 H1 HOH 112 19.528 -1.566 1.153
275 H2 HOH 221 H2 HOH 112 19.972 -0.336 0.393
276 H1 HOH 222 H1 HOH 134 -15.113 5.467 7.186
277 H2 HOH 222 H2 HOH 134 -14.920 6.812 6.517
278 H1 HOH 223 H1 HOH 103 14.864 -3.499 2.415
279 H2 HOH 223 H2 HOH 103 15.322 -4.376 1.265
280 H1 HOH 224 H1 HOH 61 6.274 -6.606 4.963
281 H2 HOH 224 H2 HOH 61 7.082 -6.870 3.709
282 H1 HOH 225 H1 HOH 25 -3.004 -11.496 -9.879
283 H2 HOH 225 H2 HOH 25 -3.289 -12.085 -11.243
284 H1 HOH 226 H1 HOH 75 -3.396 -11.364 -3.265
285 H2 HOH 226 H2 HOH 75 -2.132 -11.981 -3.829
286 H1 HOH 227 H1 HOH 139 -16.286 -0.613 2.856
287 H2 HOH 227 H2 HOH 139 -17.774 -0.358 2.713
288 H1 HOH 228 H1 HOH 63 6.313 -3.700 4.498
289 H2 HOH 228 H2 HOH 63 4.875 -3.676 4.972
290 H1 HOH 229 H1 HOH 28 -5.428 -16.519 -4.877
291 H2 HOH 229 H2 HOH 28 -5.196 -17.041 -6.280
292 H1 HOH 230 H1 HOH 119 16.964 7.801 3.363
293 H2 HOH 230 H2 HOH 119 16.566 6.467 2.765
294 H1 HOH 231 H1 HOH 172 -1.706 3.706 -9.715
295 H2 HOH 231 H2 HOH 172 -0.653 2.787 -10.281
296 H1 HOH 232 H1 HOH 31 -4.880 -16.758 -8.461
297 H2 HOH 232 H2 HOH 31 -3.427 -16.717 -8.888
298 H1 HOH 233 H1 HOH 148 -9.995 9.759 6.152
299 H2 HOH 233 H2 HOH 148 -9.797 8.431 6.849
300 H1 HOH 234 H1 HOH 177 -9.456 -1.470 -6.723
301 H2 HOH 234 H2 HOH 177 -8.120 -0.959 -7.221
302 H1 HOH 235 H1 HOH 141 -12.643 -1.005 -3.373
303 H2 HOH 235 H2 HOH 141 -11.194 -1.070 -2.939
304 H1 HOH 236 H1 HOH 2 -14.110 -10.423 -1.246
305 H2 HOH 236 H2 HOH 2 -12.835 -10.626 -2.037
306 H1 HOH 237 H1 HOH 183 3.844 0.084 -11.904
307 H2 HOH 237 H2 HOH 183 4.314 -0.779 -13.057
308 H1 HOH 238 H1 HOH 37 -3.635 -15.992 -4.185
309 H2 HOH 238 H2 HOH 37 -2.635 -16.078 -3.050
310 H1 HOH 239 H1 HOH 147 -12.246 9.018 6.452
311 H2 HOH 239 H2 HOH 147 -13.424 9.464 7.296
312 H1 HOH 240 H1 HOH 106 8.532 -6.695 -10.400
313 H2 HOH 240 H2 HOH 106 8.661 -5.544 -11.377
314 H1 HOH 241 H1 HOH 30 -2.277 -9.120 -9.423
315 H2 HOH 241 H2 HOH 30 -3.419 -8.425 -10.140
316 H1 HOH 242 H1 HOH 168 -1.637 -0.856 -12.489
317 H2 HOH 242 H2 HOH 168 -2.318 -2.173 -12.169
318 H1 HOH 243 H1 HOH 79 3.737 -8.184 -6.212
319 H2 HOH 243 H2 HOH 79 2.868 -8.041 -7.444
320 H1 HOH 244 H1 HOH 173 -4.845 -0.090 -9.955
321 H2 HOH 244 H2 HOH 173 -6.229 0.506 -10.057
322 H1 HOH 245 H1 HOH 69 2.324 -4.909 5.247
323 H2 HOH 245 H2 HOH 69 1.700 -6.285 5.230
324 H1 HOH 246 H1 HOH 166 -11.353 -7.639 -6.637
325 H2 HOH 246 H2 HOH 166 -9.900 -7.299 -6.387
326 H1 HOH 247 H1 HOH 82 8.377 -1.467 5.242
327 H2 HOH 247 H2 HOH 82 8.968 -2.711 4.620
328 H1 HOH 248 H1 HOH 46 5.292 -9.773 2.685
329 H2 HOH 248 H2 HOH 46 5.327 -8.597 3.639
330 H1 HOH 249 H1 HOH 150 -2.564 -4.701 -12.474
331 H2 HOH 249 H2 HOH 150 -1.680 -4.117 -13.555
332 H1 HOH 250 H1 HOH 162 -3.567 1.834 -5.659
333 H2 HOH 250 H2 HOH 162 -3.294 0.755 -6.681
334 H1 HOH 251 H1 HOH 96 9.654 2.544 7.633
335 H2 HOH 251 H2 HOH 96 8.404 2.437 6.790
336 H1 HOH 252 H1 HOH 52 1.411 -5.409 3.075
337 H2 HOH 252 H2 HOH 52 1.087 -6.200 1.822
338 H1 HOH 253 H1 HOH 126 -14.689 9.288 3.798
339 H2 HOH 253 H2 HOH 126 -13.762 8.715 4.848
340 H1 HOH 254 H1 HOH 99 9.982 0.520 6.327
341 H2 HOH 254 H2 HOH 99 10.266 -0.786 7.036
342 H1 HOH 255 H1 HOH 181 -0.406 3.901 3.667
343 H2 HOH 255 H2 HOH 181 -1.662 3.609 2.872
344 H1 HOH 256 H1 HOH 55 -1.467 -8.322 -3.357
345 H2 HOH 256 H2 HOH 55 -2.139 -7.652 -4.536
346 H1 HOH 257 H1 HOH 3 -14.581 -10.076 -3.572
347 H2 HOH 257 H2 HOH 3 -15.797 -9.477 -4.252
348 H1 HOH 258 H1 HOH 93 -0.290 -3.718 12.630
349 H2 HOH 258 H2 HOH 93 1.071 -3.823 11.980
350 H1 HOH 259 H1 HOH 133 -12.492 7.772 1.561
351 H2 HOH 259 H2 HOH 133 -13.296 7.486 2.812
352 H1 HOH 260 H1 HOH 199 6.488 -5.771 -15.830
353 H2 HOH 260 H2 HOH 199 6.037 -6.810 -14.827
354 H1 HOH 261 H1 HOH 35 -1.211 -10.970 -9.911
355 H2 HOH 261 H2 HOH 35 -0.987 -10.722 -8.430
356 H1 HOH 262 H1 HOH 151 -4.191 -5.795 -12.577
357 H2 HOH 262 H2 HOH 151 -3.924 -7.004 -11.704
358 H1 HOH 263 H1 HOH 197 10.510 12.411 3.110
359 H2 HOH 263 H2 HOH 197 10.840 12.246 1.644
360 H1 HOH 264 H1 HOH 178 -6.985 -1.625 -10.269
361 H2 HOH 264 H2 HOH 178 -8.125 -1.678 -11.262
362 H1 HOH 265 H1 HOH 53 -3.509 -6.417 3.028
363 H2 HOH 265 H2 HOH 53 -2.681 -7.613 2.607
364 H1 HOH 266 H1 HOH 9 -15.543 -7.004 4.560
365 H2 HOH 266 H2 HOH 9 -16.264 -6.106 3.576
366 H1 HOH 267 H1 HOH 50 9.031 -6.105 2.553
367 H2 HOH 267 H2 HOH 50 8.034 -5.031 2.195
368 H1 HOH 268 H1 HOH 190 4.156 10.466 5.928
369 H2 HOH 268 H2 HOH 190 4.951 10.322 4.649
370 H1 HOH 269 H1 HOH 127 -19.998 -2.998 1.736
371 H2 HOH 269 H2 HOH 127 -20.619 -3.418 3.051
372 H1 HOH 270 H1 HOH 140 -14.332 0.093 2.931
373 H2 HOH 270 H2 HOH 140 -14.072 -0.672 4.215
374 H1 HOH 271 H1 HOH 27 -5.157 -15.529 -10.298
375 H2 HOH 271 H2 HOH 27 -5.451 -15.782 -11.761
376 H1 HOH 272 H1 HOH 191 -1.763 7.243 8.740
377 H2 HOH 272 H2 HOH 191 -1.314 5.802 8.658
378 H1 HOH 273 H1 HOH 155 0.459 -4.772 -14.331
379 H2 HOH 273 H2 HOH 155 -0.264 -4.097 -15.477
380 H1 HOH 274 H1 HOH 81 6.016 -0.318 6.520
381 H2 HOH 274 H2 HOH 81 5.174 0.057 7.721
382 H1 HOH 275 H1 HOH 17 -15.042 1.833 7.195
383 H2 HOH 275 H2 HOH 17 -13.733 2.076 7.917
384 H1 HOH 276 H1 HOH 88 6.308 4.120 6.646
385 H2 HOH 276 H2 HOH 88 7.727 4.550 6.343
386 H1 HOH 277 H1 HOH 152 -7.161 -5.005 -11.128
387 H2 HOH 277 H2 HOH 152 -7.883 -3.915 -10.367
388 H1 HOH 278 H1 HOH 12 -12.731 3.407 9.896
389 H2 HOH 278 H2 HOH 12 -12.074 3.208 8.546
390 H1 HOH 279 H1 HOH 116 10.405 -1.110 -3.018
391 H2 HOH 279 H2 HOH 116 9.910 0.247 -2.564
392 H1 HOH 280 H1 HOH 91 7.723 6.692 6.139
393 H2 HOH 280 H2 HOH 91 8.514 6.500 4.863
394 H1 HOH 281 H1 HOH 187 5.487 4.525 -7.474
395 H2 HOH 281 H2 HOH 187 5.854 4.564 -8.944
396 H1 HOH 282 H1 HOH 136 -12.775 5.462 1.382
397 H2 HOH 282 H2 HOH 136 -13.802 4.384 1.106
398 H1 HOH 283 H1 HOH 89 1.199 5.200 8.565
399 H2 HOH 283 H2 HOH 89 0.316 4.097 9.111
400 H1 HOH 284 H1 HOH 71 -4.513 -14.384 -2.637
401 H2 HOH 284 H2 HOH 71 -5.484 -13.220 -2.653
402 H1 HOH 285 H1 HOH 122 17.909 4.205 -0.457
403 H2 HOH 285 H2 HOH 122 17.171 5.447 -0.003
404 H1 HOH 286 H1 HOH 182 1.941 2.082 -13.695
405 H2 HOH 286 H2 HOH 182 2.598 0.717 -13.642
406 H1 HOH 287 H1 HOH 57 -6.883 -11.280 -2.567
407 H2 HOH 287 H2 HOH 57 -5.490 -10.977 -3.073
408 H1 HOH 288 H1 HOH 146 -8.045 6.853 7.404
409 H2 HOH 288 H2 HOH 146 -8.196 7.919 8.469
410 H1 HOH 289 H1 HOH 66 1.452 -8.358 0.442
411 H2 HOH 289 H2 HOH 66 0.083 -7.766 0.705
412 H1 HOH 290 H1 HOH 180 -2.813 0.008 -10.689
413 H2 HOH 290 H2 HOH 180 -2.740 1.378 -10.042
414 H1 HOH 291 H1 HOH 194 4.920 12.110 -2.797
415 H2 HOH 291 H2 HOH 194 4.128 11.304 -1.790
416 H1 HOH 292 H1 HOH 111 11.729 -1.046 5.244
417 H2 HOH 292 H2 HOH 111 13.212 -0.845 5.012
418 H1 HOH 293 H1 HOH 83 9.268 -3.443 0.912
419 H2 HOH 293 H2 HOH 83 9.026 -3.033 2.350
420 H1 HOH 294 H1 HOH 5 -13.260 -0.045 7.564
421 H2 HOH 294 H2 HOH 5 -12.254 -0.316 8.661
422 H1 HOH 295 H1 HOH 154 -5.736 -8.518 -10.679
423 H2 HOH 295 H2 HOH 154 -4.908 -9.193 -11.753
424 H1 HOH 296 H1 HOH 110 8.260 -9.295 -10.855
425 H2 HOH 296 H2 HOH 110 7.155 -8.284 -10.634
426 H1 HOH 297 H1 HOH 14 -19.155 -7.493 0.853
427 H2 HOH 297 H2 HOH 14 -17.915 -7.046 0.103
428 H1 HOH 298 H1 HOH 179 -11.223 -2.972 -7.306
429 H2 HOH 298 H2 HOH 179 -11.445 -1.812 -8.253
430 H1 HOH 299 H1 HOH 167 -5.363 5.849 2.760
431 H2 HOH 299 H2 HOH 167 -4.955 4.454 2.336
432 H1 HOH 300 H1 HOH 39 -8.598 -15.469 -9.332
433 H2 HOH 300 H2 HOH 39 -7.171 -15.606 -9.819
434 H1 HOH 301 H1 HOH 42 3.295 -9.075 4.530
435 H2 HOH 301 H2 HOH 42 2.590 -9.124 5.871
436 H1 HOH 302 H1 HOH 48 -2.250 -8.391 -0.106
437 H2 HOH 302 H2 HOH 48 -1.922 -7.216 0.787
438 H1 HOH 303 H1 HOH 47 5.443 -6.585 -5.717
439 H2 HOH 303 H2 HOH 47 6.053 -7.728 -6.499
440 H1 HOH 304 H1 HOH 34 -6.189 -15.620 -3.019
441 H2 HOH 304 H2 HOH 34 -7.334 -15.597 -4.008
442 H1 HOH 305 H1 HOH 32 -12.894 -9.346 -7.301
443 H2 HOH 305 H2 HOH 32 -11.835 -9.092 -8.353
444 H1 HOH 306 H1 HOH 161 4.885 7.484 -9.362
445 H2 HOH 306 H2 HOH 161 3.867 6.401 -9.629
446 H1 HOH 307 H1 HOH 13 -12.570 -4.255 4.151
447 H2 HOH 307 H2 HOH 13 -12.400 -3.379 5.377
448 H1 HOH 308 H1 HOH 102 11.598 -3.306 -0.294
449 H2 HOH 308 H2 HOH 102 10.361 -3.991 -0.823
450 H1 HOH 309 H1 HOH 40 -1.647 -8.369 -13.392
451 H2 HOH 309 H2 HOH 40 -1.947 -8.150 -11.923
452 H1 HOH 310 H1 HOH 143 -11.692 1.993 -4.929
453 H2 HOH 310 H2 HOH 143 -11.323 0.743 -5.699
454 H1 HOH 311 H1 HOH 73 -6.587 -6.079 8.690
455 H2 HOH 311 H2 HOH 73 -5.703 -5.681 7.526
456 H1 HOH 312 H1 HOH 10 -7.646 -5.382 10.814
457 H2 HOH 312 H2 HOH 10 -6.282 -4.756 10.621
458 H1 HOH 313 H1 HOH 174 1.507 6.576 0.570
459 H2 HOH 313 H2 HOH 174 2.110 7.907 0.167
460 H1 HOH 314 H1 HOH 125 -14.999 0.825 -0.066
461 H2 HOH 314 H2 HOH 125 -15.786 0.307 1.119
462 H1 HOH 315 H1 HOH 33 -7.353 -13.215 -4.269
463 H2 HOH 315 H2 HOH 33 -7.786 -13.819 -5.588
464 H1 HOH 316 H1 HOH 157 -0.419 5.051 -5.521
465 H2 HOH 316 H2 HOH 157 -1.754 5.279 -6.195
466 H1 HOH 317 H1 HOH 118 14.290 0.737 6.366
467 H2 HOH 317 H2 HOH 118 15.187 0.801 5.147
468 H1 HOH 318 H1 HOH 59 10.755 -3.853 3.378
469 H2 HOH 318 H2 HOH 59 11.211 -2.546 3.995
470 H1 HOH 319 H1 HOH 107 15.033 -3.115 4.652
471 H2 HOH 319 H2 HOH 107 13.591 -2.796 4.319
472 H1 HOH 320 H1 HOH 60 0.023 -10.899 -4.261
473 H2 HOH 320 H2 HOH 60 0.257 -12.359 -3.945
474 H1 HOH 321 H1 HOH 188 -11.297 -5.344 -6.595
475 H2 HOH 321 H2 HOH 188 -12.595 -5.089 -7.329
476 H1 HOH 322 H1 HOH 8 -7.805 -6.822 6.932
477 H2 HOH 322 H2 HOH 8 -9.032 -5.955 6.753
478 H1 HOH 323 H1 HOH 120 16.768 4.515 1.854
479 H2 HOH 323 H2 HOH 120 15.571 4.268 2.753
480 H1 HOH 324 H1 HOH 29 -6.701 -18.360 -7.555
481 H2 HOH 324 H2 HOH 29 -6.883 -16.955 -8.094
482 H1 HOH 325 H1 HOH 7 -12.270 -6.745 3.470
483 H2 HOH 325 H2 HOH 7 -13.669 -6.161 3.433
484 H1 HOH 326 H1 HOH 54 -3.579 -9.211 -2.954
485 H2 HOH 326 H2 HOH 54 -3.941 -9.687 -1.561
486 H1 HOH 327 H1 HOH 78 3.541 -2.462 9.119
487 H2 HOH 327 H2 HOH 78 2.445 -3.511 9.108
488 H1 HOH 328 H1 HOH 189 6.028 8.646 6.319
489 H2 HOH 328 H2 HOH 189 5.738 7.257 5.803
490 H1 HOH 329 H1 HOH 138 -14.824 -5.486 -6.387
491 H2 HOH 329 H2 HOH 138 -14.639 -4.368 -5.377
492 H1 HOH 330 H1 HOH 65 4.282 -1.798 6.192
493 H2 HOH 330 H2 HOH 65 3.585 -2.938 6.905
494 H1 HOH 331 H1 HOH 21 -8.999 -3.769 7.748
495 H2 HOH 331 H2 HOH 21 -10.383 -3.926 7.150
496 H1 HOH 332 H1 HOH 38 1.266 -10.342 -7.717
497 H2 HOH 332 H2 HOH 38 0.418 -10.240 -6.469
498 H1 HOH 333 H1 HOH 4 -14.266 -10.364 -5.936
499 H2 HOH 333 H2 HOH 4 -14.347 -11.438 -7.002
500 H1 HOH 334 H1 HOH 117 15.324 2.613 4.001
501 H2 HOH 334 H2 HOH 117 16.797 2.695 4.344
502 H1 HOH 335 H1 HOH 145 -11.088 3.312 -1.184
503 H2 HOH 335 H2 HOH 145 -11.726 4.382 -0.321
504 H1 HOH 336 H1 HOH 26 -7.755 -13.495 -12.453
505 H2 HOH 336 H2 HOH 26 -6.936 -13.940 -11.260
506 H1 HOH 337 H1 HOH 135 -15.949 4.338 9.018
507 H2 HOH 337 H2 HOH 135 -17.223 4.635 8.257
508 H1 HOH 338 H1 HOH 153 -8.725 -6.215 -9.795
509 H2 HOH 338 H2 HOH 153 -10.128 -6.764 -9.932
510 H1 HOH 339 H1 HOH 163 2.527 9.368 -2.325
511 H2 HOH 339 H2 HOH 163 2.961 9.679 -0.907
512 H1 HOH 340 H1 HOH 124 -14.466 -6.495 -8.407
513 H2 HOH 340 H2 HOH 124 -13.351 -7.195 -7.657
514 H1 HOH 341 H1 HOH 144 -13.379 0.444 -4.400
515 H2 HOH 341 H2 HOH 144 -14.514 -0.524 -4.659
516 H1 HOH 342 H1 HOH 24 -7.974 -8.169 -9.724
517 H2 HOH 342 H2 HOH 24 -7.737 -9.624 -10.082
518 H1 HOH 343 H1 HOH 94 4.156 1.350 6.460
519 H2 HOH 343 H2 HOH 94 3.497 2.393 7.340
520 H1 HOH 344 H1 HOH 84 -9.210 -13.801 -1.225
521 H2 HOH 344 H2 HOH 84 -9.848 -13.388 0.085
522 H1 HOH 345 H1 HOH 171 1.237 6.257 -4.636
523 H2 HOH 345 H2 HOH 171 1.659 6.653 -6.038
524 H1 HOH 346 H1 HOH 132 -12.619 -3.581 -5.633
525 H2 HOH 346 H2 HOH 132 -12.739 -2.765 -4.361
526 H1 HOH 347 H1 HOH 62 1.911 -10.611 2.301
527 H2 HOH 347 H2 HOH 62 3.336 -10.100 2.246
528 H1 HOH 348 H1 HOH 56 -2.116 -7.388 7.684
529 H2 HOH 348 H2 HOH 56 -3.217 -7.966 6.823
530 H1 HOH 349 H1 HOH 1 -18.025 -8.684 -4.388
531 H2 HOH 349 H2 HOH 1 -17.198 -7.478 -3.989
532 H1 HOH 350 H1 HOH 185 -10.560 4.188 -4.220
533 H2 HOH 350 H2 HOH 185 -10.180 3.243 -5.341
534 H1 HOH 351 H1 HOH 149 -4.292 -3.910 -13.312
535 H2 HOH 351 H2 HOH 149 -5.498 -4.110 -14.205
536 H1 HOH 352 H1 HOH 97 4.493 5.514 5.406
537 H2 HOH 352 H2 HOH 97 4.250 4.084 5.857
538 H1 HOH 353 H1 HOH 113 11.400 -1.885 -4.653
539 H2 HOH 353 H2 HOH 113 10.170 -2.481 -5.306
540 H1 HOH 354 H1 HOH 115 9.004 -5.297 -8.858
541 H2 HOH 354 H2 HOH 115 9.818 -5.948 -7.760
542 H1 HOH 355 H1 HOH 129 -17.330 -4.841 -3.451
543 H2 HOH 355 H2 HOH 129 -16.363 -5.507 -4.408
544 H1 HOH 356 H1 HOH 16 -16.979 -6.590 -2.054
545 H2 HOH 356 H2 HOH 16 -17.115 -8.088 -1.942
546 H1 HOH 357 H1 HOH 104 16.021 -6.724 1.355
547 H2 HOH 357 H2 HOH 104 15.848 -6.330 -0.096
548 H1 HOH 358 H1 HOH 164 -0.002 6.502 -0.626
549 H2 HOH 358 H2 HOH 164 -1.466 6.867 -0.752
550 H1 HOH 359 H1 HOH 121 16.737 -2.014 6.368
551 H2 HOH 359 H2 HOH 121 15.572 -1.291 5.727
552 H1 HOH 360 H1 HOH 109 10.016 -3.314 -3.167
553 H2 HOH 360 H2 HOH 109 9.088 -4.499 -2.985
554 H1 HOH 361 H1 HOH 77 1.669 -9.065 -5.372
555 H2 HOH 361 H2 HOH 77 0.805 -8.904 -4.135
556 H1 HOH 362 H1 HOH 105 20.068 3.977 -1.779
557 H2 HOH 362 H2 HOH 105 18.929 4.655 -2.507
558 H1 HOH 363 H1 HOH 170 0.352 6.279 -2.624
559 H2 HOH 363 H2 HOH 170 1.649 6.777 -2.025
560 H1 HOH 364 H1 HOH 128 -18.254 0.048 -2.312
561 H2 HOH 364 H2 HOH 128 -16.766 -0.114 -2.093
562 H1 HOH 365 H1 HOH 130 -18.476 -3.011 -3.843
563 H2 HOH 365 H2 HOH 130 -17.703 -2.263 -2.777
564 H1 HOH 366 H1 HOH 11 -11.032 -8.649 6.506
565 H2 HOH 366 H2 HOH 11 -9.792 -7.984 5.947
566 H1 HOH 367 H1 HOH 64 6.343 -11.750 1.844
567 H2 HOH 367 H2 HOH 64 7.241 -10.616 1.395
568 H1 HOH 368 H1 HOH 44 -5.390 -7.868 7.468
569 H2 HOH 368 H2 HOH 44 -5.301 -9.379 7.525
570 H1 HOH 369 H1 HOH 72 2.277 -9.998 0.026
571 H2 HOH 369 H2 HOH 72 2.826 -9.709 -1.356
572 H1 HOH 370 H1 HOH 85 0.789 2.133 11.305
573 H2 HOH 370 H2 HOH 85 0.741 3.645 11.358
574 H1 HOH 371 H1 HOH 43 0.671 -8.770 2.554
575 H2 HOH 371 H2 HOH 43 0.970 -9.224 3.971
576 H1 HOH 372 H1 HOH 156 -1.472 -7.515 -15.725
577 H2 HOH 372 H2 HOH 156 -1.126 -6.390 -14.771
578 H1 HOH 373 H1 HOH 6 -12.563 -3.686 7.824
579 H2 HOH 373 H2 HOH 6 -12.217 -2.292 7.342
580 H1 HOH 374 H1 HOH 67 -0.533 -8.064 -1.533
581 H2 HOH 374 H2 HOH 67 0.716 -8.869 -1.828
582 H1 HOH 375 H1 HOH 36 -9.518 -11.155 -10.928
583 H2 HOH 375 H2 HOH 36 -8.188 -11.853 -10.773
584 H1 HOH 376 H1 HOH 49 -3.240 -9.578 1.118
585 H2 HOH 376 H2 HOH 49 -4.661 -9.397 0.632
586 H1 HOH 377 H1 HOH 45 -1.383 -9.420 2.944
587 H2 HOH 377 H2 HOH 45 -2.715 -10.032 3.327
588 H1 HOH 378 H1 HOH 23 -1.194 -10.339 -12.029
589 H2 HOH 378 H2 HOH 23 -0.106 -11.382 -12.185
590 H1 HOH 379 H1 HOH 95 6.086 1.742 9.194
591 H2 HOH 379 H2 HOH 95 4.572 1.762 9.244
592 H1 HOH 380 H1 HOH 101 12.469 -0.079 -5.392
593 H2 HOH 380 H2 HOH 101 13.631 -1.032 -5.574
594 H1 HOH 381 H1 HOH 131 -14.867 0.576 -2.527
595 H2 HOH 381 H2 HOH 131 -15.295 1.953 -2.064
596 H1 HOH 382 H1 HOH 80 6.471 -9.108 -3.244
597 H2 HOH 382 H2 HOH 80 5.541 -8.190 -4.011
598 H1 HOH 383 H1 HOH 108 11.879 -5.768 2.233
599 H2 HOH 383 H2 HOH 108 10.974 -4.907 1.373
600 H1 HOH 384 H1 HOH 176 -8.428 2.068 -6.830
601 H2 HOH 384 H2 HOH 176 -8.228 3.497 -6.371
602 H1 HOH 385 H1 HOH 87 4.717 -0.400 9.833
603 H2 HOH 385 H2 HOH 87 4.453 -1.235 11.068
604 H1 HOH 386 H1 HOH 186 3.417 8.561 -6.452
605 H2 HOH 386 H2 HOH 186 3.207 7.608 -7.611
606 H1 HOH 387 H1 HOH 20 -9.535 -10.116 5.368
607 H2 HOH 387 H2 HOH 20 -8.185 -10.118 4.685
608 H1 HOH 388 H1 HOH 114 9.467 -2.135 -7.750
609 H2 HOH 388 H2 HOH 114 9.489 -3.566 -7.255
610 H1 HOH 389 H1 HOH 158 -10.674 6.357 -3.184
611 H2 HOH 389 H2 HOH 158 -10.359 5.146 -2.330
612 H1 HOH 390 H1 HOH 86 2.529 2.781 9.786
613 H2 HOH 390 H2 HOH 86 3.228 3.828 8.943
614 H1 HOH 391 H1 HOH 18 -10.688 -14.422 2.214
615 H2 HOH 391 H2 HOH 18 -9.184 -14.244 2.176
616 H1 HOH 392 H1 HOH 90 3.268 6.334 8.623
617 H2 HOH 392 H2 HOH 90 3.568 5.313 7.548
618 H1 HOH 393 H1 HOH 159 -6.297 5.172 -6.611
619 H2 HOH 393 H2 HOH 159 -7.081 4.996 -5.328
620 H1 HOH 394 H1 HOH 70 -2.299 -11.891 4.631
621 H2 HOH 394 H2 HOH 70 -3.758 -11.675 4.964
622 H1 HOH 395 H1 HOH 165 -7.078 6.284 -3.153
623 H2 HOH 395 H2 HOH 165 -8.379 5.639 -3.589
624 H1 HOH 396 H1 HOH 169 5.367 10.851 -6.859
625 H2 HOH 396 H2 HOH 169 5.854 10.121 -5.626
626 H1 HOH 397 H1 HOH 51 -4.779 -12.884 6.978
627 H2 HOH 397 H2 HOH 51 -5.724 -12.683 5.813
628 H1 HOH 398 H1 HOH 19 -7.923 -12.219 5.345
629 H2 HOH 398 H2 HOH 19 -7.679 -13.510 4.589
630 H1 HOH 399 H1 HOH 58 -7.503 -15.502 3.371
631 H2 HOH 399 H2 HOH 58 -6.868 -14.379 2.581
Start of MODEL 3
1 HA PRO 62 HA PRO 62 -10.447 -8.280 -3.285
2 HB2 PRO 62 HB2 PRO 62 -11.325 -5.965 -2.101
3 HB3 PRO 62 HB3 PRO 62 -12.166 -6.718 -3.485
4 HG2 PRO 62 HG2 PRO 62 -12.807 -7.030 -0.515
5 HG3 PRO 62 HG3 PRO 62 -13.932 -6.614 -1.850
6 HD2 PRO 62 HD2 PRO 62 -13.752 -9.172 -1.031
7 HD3 PRO 62 HD3 PRO 62 -13.824 -8.787 -2.764
8 H PHE 63 H PHE 63 -8.661 -7.010 -2.452
9 HA PHE 63 HA PHE 63 -7.660 -7.926 0.182
10 HB2 PHE 63 HB2 PHE 63 -6.476 -6.442 -2.186
11 HB3 PHE 63 HB3 PHE 63 -5.643 -6.508 -0.644
12 HD1 PHE 63 HD1 PHE 63 -6.801 -8.581 -3.505
13 HD2 PHE 63 HD2 PHE 63 -4.670 -8.552 0.245
14 HE1 PHE 63 HE1 PHE 63 -5.939 -10.857 -3.975
15 HE2 PHE 63 HE2 PHE 63 -3.823 -10.834 -0.229
16 HZ PHE 63 HZ PHE 63 -4.462 -11.988 -2.332
17 H ALA 64 H ALA 64 -6.405 -6.033 1.396
18 HA ALA 64 HA ALA 64 -7.716 -3.426 1.224
19 HB1 ALA 64 HB1 ALA 64 -7.717 -5.040 3.817
20 HB2 ALA 64 HB2 ALA 64 -8.236 -3.351 3.647
21 HB3 ALA 64 HB3 ALA 64 -9.156 -4.642 2.841
22 H CYS 65 H CYS 65 -6.585 -1.767 2.391
23 HA CYS 65 HA CYS 65 -3.663 -2.110 2.529
24 HB2 CYS 65 HB2 CYS 65 -5.656 0.143 2.894
25 HB3 CYS 65 HB3 CYS 65 -4.013 0.269 3.551
26 H ASP 66 H ASP 66 -2.774 -2.940 4.172
27 HA ASP 66 HA ASP 66 -3.702 -3.378 6.775
28 HB2 ASP 66 HB2 ASP 66 -1.636 -4.155 5.291
29 HB3 ASP 66 HB3 ASP 66 -0.802 -2.813 6.036
30 H ILE 67 H ILE 67 -2.150 -0.530 5.415
31 HA ILE 67 HA ILE 67 -1.925 0.809 8.049
32 HB ILE 67 HB ILE 67 -0.778 1.479 5.319
33 HG12 ILE 67 2HG1 ILE 67 0.221 -0.584 6.044
34 HG13 ILE 67 3HG1 ILE 67 1.387 0.709 6.202
35 HG21 ILE 67 HG21 ILE 67 -0.872 3.516 6.614
36 HG22 ILE 67 HG22 ILE 67 -0.177 2.706 8.034
37 HG23 ILE 67 HG23 ILE 67 0.798 2.958 6.568
38 HD11 ILE 67 1HD1 ILE 67 1.528 -0.839 8.089
39 HD12 ILE 67 2HD1 ILE 67 1.039 0.765 8.658
40 HD13 ILE 67 3HD1 ILE 67 -0.161 -0.540 8.518
41 H CYS 68 H CYS 68 -3.422 1.435 4.853
42 HA CYS 68 HA CYS 68 -4.629 3.927 5.788
43 HB2 CYS 68 HB2 CYS 68 -4.812 2.349 3.204
44 HB3 CYS 68 HB3 CYS 68 -5.784 3.774 3.534
45 H GLY 69 H GLY 69 -5.537 0.642 6.169
46 HA2 GLY 69 HA2 GLY 69 -7.423 -0.434 6.847
47 HA3 GLY 69 HA3 GLY 69 -8.150 1.129 7.219
48 H ARG 70 H ARG 70 -7.411 1.344 4.036
49 HA ARG 70 HA ARG 70 -10.179 1.079 3.237
50 HB2 ARG 70 HB2 ARG 70 -8.607 2.943 2.584
51 HB3 ARG 70 HB3 ARG 70 -7.758 1.806 1.521
52 HG2 ARG 70 HG2 ARG 70 -9.889 1.405 0.304
53 HG3 ARG 70 HG3 ARG 70 -10.723 2.525 1.397
54 HD2 ARG 70 HD2 ARG 70 -8.972 4.260 0.579
55 HD3 ARG 70 HD3 ARG 70 -8.647 3.126 -0.742
56 HE ARG 70 HE ARG 70 -10.722 4.986 -0.614
57 HH11 ARG 70 1HH1 ARG 70 -12.413 5.063 -1.920
58 HH12 ARG 70 2HH1 ARG 70 -12.910 3.637 -2.800
59 HH21 ARG 70 1HH2 ARG 70 -10.780 1.463 -1.362
60 HH22 ARG 70 2HH2 ARG 70 -12.338 1.687 -2.111
61 H LYS 71 H LYS 71 -11.158 -0.420 1.921
62 HA LYS 71 HA LYS 71 -9.656 -2.793 1.055
63 HB2 LYS 71 HB2 LYS 71 -11.720 -3.822 0.561
64 HB3 LYS 71 HB3 LYS 71 -11.763 -3.068 2.143
65 HG2 LYS 71 HG2 LYS 71 -12.912 -1.046 0.754
66 HG3 LYS 71 HG3 LYS 71 -13.250 -2.363 -0.372
67 HD2 LYS 71 HD2 LYS 71 -15.154 -2.340 1.032
68 HD3 LYS 71 HD3 LYS 71 -14.176 -3.643 1.728
69 HE2 LYS 71 HE2 LYS 71 -13.216 -1.903 3.343
70 HE3 LYS 71 HE3 LYS 71 -14.355 -0.729 2.655
71 HZ1 LYS 71 HZ1 LYS 71 -14.959 -3.115 4.275
72 HZ2 LYS 71 HZ2 LYS 71 -15.362 -1.562 4.546
73 HZ3 LYS 71 HZ3 LYS 71 -16.127 -2.436 3.336
74 H PHE 72 H PHE 72 -9.644 -3.692 -1.022
75 HA PHE 72 HA PHE 72 -9.356 -1.800 -3.287
76 HB2 PHE 72 HB2 PHE 72 -7.191 -2.760 -1.453
77 HB3 PHE 72 HB3 PHE 72 -6.841 -2.970 -3.146
78 HD1 PHE 72 HD1 PHE 72 -6.594 -1.079 -4.696
79 HD2 PHE 72 HD2 PHE 72 -7.323 -0.471 -0.485
80 HE1 PHE 72 HE1 PHE 72 -5.875 1.287 -4.906
81 HE2 PHE 72 HE2 PHE 72 -6.590 1.880 -0.699
82 HZ PHE 72 HZ PHE 72 -5.888 2.773 -2.925
83 H ALA 73 H ALA 73 -8.692 -2.841 -5.270
84 HA ALA 73 HA ALA 73 -9.672 -5.435 -5.776
85 HB1 ALA 73 HB1 ALA 73 -9.596 -3.653 -7.418
86 HB2 ALA 73 HB2 ALA 73 -7.829 -3.648 -7.419
87 HB3 ALA 73 HB3 ALA 73 -8.719 -5.068 -8.027
88 H ARG 74 H ARG 74 -6.363 -4.907 -6.840
89 HA ARG 74 HA ARG 74 -5.047 -6.852 -5.220
90 HB2 ARG 74 HB2 ARG 74 -6.360 -8.551 -6.352
91 HB3 ARG 74 HB3 ARG 74 -6.020 -7.847 -7.935
92 HG2 ARG 74 HG2 ARG 74 -4.756 -9.910 -7.524
93 HG3 ARG 74 HG3 ARG 74 -3.710 -8.546 -7.842
94 HD2 ARG 74 HD2 ARG 74 -4.051 -8.756 -4.967
95 HD3 ARG 74 HD3 ARG 74 -3.740 -10.368 -5.610
96 HE ARG 74 HE ARG 74 -1.960 -8.139 -6.467
97 HH11 ARG 74 1HH1 ARG 74 0.292 -8.651 -6.288
98 HH12 ARG 74 2HH1 ARG 74 0.738 -9.613 -4.907
99 HH21 ARG 74 1HH2 ARG 74 -0.527 -10.762 -3.888
100 HH22 ARG 74 2HH2 ARG 74 -2.240 -10.844 -4.189
101 H SER 75 H SER 75 -5.142 -5.333 -8.425
102 HA SER 75 HA SER 75 -3.741 -3.749 -9.294
103 HB2 SER 75 HB2 SER 75 -3.356 -3.263 -6.327
104 HB3 SER 75 HB3 SER 75 -3.283 -2.049 -7.631
105 HG SER 75 HG SER 75 -5.420 -2.264 -7.964
106 H1 OUD 76 H OUD 76 -2.233 -5.974 -9.635
107 HA OUD 76 HA OUD 76 0.310 -5.728 -8.202
108 HB3 OUD 76 HB3 OUD 76 -0.953 -7.914 -8.642
109 HB2 OUD 76 HB2 OUD 76 -0.439 -7.799 -10.317
110 HM3 OUD 76 HM3 OUD 76 1.753 -5.590 -10.134
111 HM2 OUD 76 HM2 OUD 76 0.382 -5.713 -11.251
112 HN2 OUD 76 HN2 OUD 76 -0.086 -3.475 -10.996
113 H OUE 77 H OUE 77 -0.117 -1.542 -10.148
114 HA OUE 77 HA OUE 77 1.892 -0.897 -8.043
115 HB3 OUE 77 HB3 OUE 77 2.707 0.066 -10.095
116 HB2 OUE 77 HB2 OUE 77 1.152 0.769 -10.501
117 HG3 OUE 77 HG3 OUE 77 1.316 2.390 -8.678
118 HG2 OUE 77 HG2 OUE 77 2.729 1.584 -8.008
119 HM2 OUE 77 HM2 OUE 77 -0.757 0.486 -8.636
120 HM3 OUE 77 HM3 OUE 77 0.357 0.874 -7.315
121 HN2 OUE 77 HN2 OUE 77 -1.103 -1.709 -7.573
122 H1 OUK 78 H OUK 78 -1.489 -2.817 -5.904
123 HA OUK 78 HA OUK 78 0.409 -2.591 -3.624
124 HB2 OUK 78 HB2 OUK 78 -0.687 -4.804 -2.924
125 HB3 OUK 78 HB3 OUK 78 -1.904 -4.530 -4.165
126 HG2 OUK 78 HG2 OUK 78 -2.442 -2.294 -2.952
127 HG3 OUK 78 HG3 OUK 78 -1.344 -2.835 -1.678
128 HD2 OUK 78 HD2 OUK 78 -2.796 -5.032 -1.640
129 HD3 OUK 78 HD3 OUK 78 -3.978 -4.126 -2.580
130 HE2 OUK 78 HE2 OUK 78 -2.902 -3.408 0.209
131 HE3 OUK 78 HE3 OUK 78 -4.501 -4.074 -0.150
132 HZ3 OUK 78 HZ3 OUK 78 -4.527 -1.697 0.339
133 HZ1 OUK 78 HZ1 OUK 78 -5.077 -1.972 -1.226
134 HZ2 OUK 78 HZ2 OUK 78 -3.538 -1.376 -0.937
135 HM3 OUK 78 HM3 OUK 78 1.271 -4.796 -4.313
136 HM2 OUK 78 HM2 OUK 78 0.120 -4.871 -5.650
137 HN2 OUK 78 HN2 OUK 78 1.335 -3.252 -6.835
138 H OUR 79 H OUR 79 3.137 -2.188 -7.404
139 HA OUR 79 HA OUR 79 5.273 -1.886 -5.333
140 HB3 OUR 79 HB3 OUR 79 5.657 -1.754 -8.374
141 HB2 OUR 79 HB2 OUR 79 6.878 -1.555 -7.139
142 HG3 OUR 79 HG3 OUR 79 7.259 -3.734 -7.826
143 HG2 OUR 79 HG2 OUR 79 6.306 -3.990 -6.368
144 HD3 OUR 79 HD3 OUR 79 4.259 -4.315 -7.783
145 HD2 OUR 79 HD2 OUR 79 5.186 -3.925 -9.237
146 HE OUR 79 HE OUR 79 6.544 -5.890 -8.826
147 HH12 OUR 79 2HH1 OUR 79 4.014 -8.239 -9.717
148 HH11 OUR 79 1HH1 OUR 79 5.675 -7.829 -9.998
149 HH22 OUR 79 2HH2 OUR 79 2.889 -7.446 -7.840
150 HM2 OUR 79 HM2 OUR 79 4.548 0.184 -7.446
151 HM3 OUR 79 HM3 OUR 79 5.632 0.377 -6.059
152 HN2 OUR 79 HN2 OUR 79 2.711 -0.144 -5.762
153 HH21 OUR 79 1HH2 OUR 79 3.586 -6.195 -6.860
154 H OUH 80 H OUH 80 1.425 1.535 -5.327
155 HA OUH 80 HA OUH 80 2.692 2.751 -2.940
156 HB2 OUH 80 HB2 OUH 80 0.705 3.986 -4.608
157 HB3 OUH 80 HB3 OUH 80 1.469 4.579 -3.160
158 HD2 OUH 80 HD2 OUH 80 0.136 4.229 -0.690
159 HD1 OUH 80 HD1 OUH 80 -1.997 3.201 -4.217
160 HE1 OUH 80 HE1 OUH 80 -3.646 3.359 -2.239
161 HM2 OUH 80 HM2 OUH 80 0.152 1.081 -3.065
162 HM3 OUH 80 HM3 OUH 80 0.999 1.643 -1.609
163 HN2 OUH 80 HN2 OUH 80 2.121 -0.291 -3.577
164 H1 OUK 81 H OUK 81 3.568 -1.687 -2.922
165 HA OUK 81 HA OUK 81 4.895 -1.003 -0.362
166 HB2 OUK 81 HB2 OUK 81 5.990 -3.204 -0.315
167 HB3 OUK 81 HB3 OUK 81 5.075 -3.737 -1.722
168 HG2 OUK 81 HG2 OUK 81 2.958 -3.619 -0.463
169 HG3 OUK 81 HG3 OUK 81 3.765 -2.866 0.914
170 HD2 OUK 81 HD2 OUK 81 5.119 -4.899 1.295
171 HD3 OUK 81 HD3 OUK 81 4.438 -5.669 -0.141
172 HE2 OUK 81 HE2 OUK 81 2.180 -5.688 0.885
173 HE3 OUK 81 HE3 OUK 81 2.795 -4.807 2.307
174 HZ3 OUK 81 HZ3 OUK 81 3.646 -7.542 1.519
175 HZ1 OUK 81 HZ1 OUK 81 2.528 -7.171 2.715
176 HZ2 OUK 81 HZ2 OUK 81 4.126 -6.692 2.892
177 HM3 OUK 81 HM3 OUK 81 7.003 -1.410 -1.626
178 HM2 OUK 81 HM2 OUK 81 6.061 -1.807 -3.072
179 HN2 OUK 81 HN2 OUK 81 5.652 0.459 -3.430
180 H OUI 82 H OUI 82 6.008 2.612 -3.171
181 HA OUI 82 HA OUI 82 6.659 3.467 -0.382
182 HB OUI 82 HB OUI 82 7.353 5.612 -1.164
183 3HG1 OUI 82 3HG1 OUI 82 6.997 4.641 -4.050
184 2HG1 OUI 82 2HG1 OUI 82 5.981 5.825 -3.243
185 1HG2 OUI 82 1HG2 OUI 82 9.011 3.713 -0.958
186 2HG2 OUI 82 2HG2 OUI 82 9.542 4.987 -2.046
187 3HG2 OUI 82 3HG2 OUI 82 8.910 3.471 -2.707
188 2HD1 OUI 82 2HD1 OUI 82 7.982 7.319 -2.902
189 3HD1 OUI 82 3HD1 OUI 82 7.549 7.053 -4.596
190 1HD1 OUI 82 1HD1 OUI 82 8.938 6.212 -3.900
191 HM2 OUI 82 HM2 OUI 82 4.533 4.607 -2.248
192 HM3 OUI 82 HM3 OUI 82 4.928 5.187 -0.615
193 HN2 OUI 82 HN2 OUI 82 4.178 2.368 -1.032
194 H OUH 83 H OUH 83 4.100 1.494 0.829
195 HA OUH 83 HA OUH 83 3.268 3.202 3.110
196 HB2 OUH 83 HB2 OUH 83 2.951 1.198 4.471
197 HB3 OUH 83 HB3 OUH 83 3.396 0.156 3.133
198 HD2 OUH 83 HD2 OUH 83 0.857 3.266 2.767
199 HD1 OUH 83 HD1 OUH 83 0.937 -0.978 2.578
200 HE1 OUH 83 HE1 OUH 83 -1.362 -0.132 1.765
201 HM2 OUH 83 HM2 OUH 83 5.234 2.142 4.295
202 HM3 OUH 83 HM3 OUH 83 5.636 3.228 2.962
203 HN2 OUH 83 HN2 OUH 83 5.805 1.102 1.573
204 H ARG 84 H ARG 84 7.667 0.192 1.113
205 HA ARG 84 HA ARG 84 9.242 -0.997 3.322
206 HB2 ARG 84 HB2 ARG 84 8.893 -2.135 1.112
207 HB3 ARG 84 HB3 ARG 84 9.874 -0.874 0.336
208 HG2 ARG 84 HG2 ARG 84 11.826 -1.508 1.670
209 HG3 ARG 84 HG3 ARG 84 10.840 -2.613 2.640
210 HD2 ARG 84 HD2 ARG 84 10.397 -3.959 0.570
211 HD3 ARG 84 HD3 ARG 84 11.541 -2.906 -0.308
212 HE ARG 84 HE ARG 84 13.071 -3.664 1.761
213 HH11 ARG 84 1HH1 ARG 84 14.293 -5.504 2.074
214 HH12 ARG 84 2HH1 ARG 84 13.970 -6.895 1.082
215 HH21 ARG 84 1HH2 ARG 84 11.255 -5.660 -0.534
216 HH22 ARG 84 2HH2 ARG 84 12.407 -6.972 -0.288
217 H LYS 85 H LYS 85 9.343 1.826 1.344
218 HA LYS 85 HA LYS 85 10.811 3.148 3.425
219 HB2 LYS 85 HB2 LYS 85 11.885 3.343 0.567
220 HB3 LYS 85 HB3 LYS 85 12.207 4.530 1.839
221 HG2 LYS 85 HG2 LYS 85 13.134 2.644 3.263
222 HG3 LYS 85 HG3 LYS 85 13.015 1.587 1.856
223 HD2 LYS 85 HD2 LYS 85 15.260 2.363 2.066
224 HD3 LYS 85 HD3 LYS 85 14.581 3.121 0.618
225 HE2 LYS 85 HE2 LYS 85 14.264 5.210 1.864
226 HE3 LYS 85 HE3 LYS 85 14.696 4.438 3.396
227 HZ1 LYS 85 HZ1 LYS 85 16.909 4.033 2.517
228 HZ2 LYS 85 HZ2 LYS 85 16.537 4.724 1.071
229 HZ3 LYS 85 HZ3 LYS 85 16.574 5.656 2.391
230 H ASP 86 H ASP 86 10.714 5.660 2.637
231 HA ASP 86 HA ASP 86 7.822 6.090 2.093
232 HB2 ASP 86 HB2 ASP 86 9.388 7.246 3.995
233 HB3 ASP 86 HB3 ASP 86 9.657 8.374 2.705
234 H1 HOH 201 H1 HOH 170 5.896 9.336 0.220
235 H2 HOH 201 H2 HOH 170 6.725 8.160 -0.251
236 H1 HOH 202 H1 HOH 84 2.162 -5.544 8.635
237 H2 HOH 202 H2 HOH 84 1.181 -5.192 7.537
238 H1 HOH 203 H1 HOH 174 7.421 11.113 5.976
239 H2 HOH 203 H2 HOH 174 7.954 10.357 4.775
240 H1 HOH 204 H1 HOH 175 7.645 11.877 1.812
241 H2 HOH 204 H2 HOH 175 7.515 10.416 2.187
242 H1 HOH 205 H1 HOH 77 7.393 6.705 5.359
243 H2 HOH 205 H2 HOH 77 8.396 7.139 6.403
244 H1 HOH 206 H1 HOH 80 -2.985 -6.005 10.663
245 H2 HOH 206 H2 HOH 80 -2.141 -5.343 9.592
246 H1 HOH 207 H1 HOH 110 11.737 1.077 4.998
247 H2 HOH 207 H2 HOH 110 11.120 1.715 6.223
248 H1 HOH 208 H1 HOH 163 4.100 -0.151 -11.960
249 H2 HOH 208 H2 HOH 163 4.221 1.309 -11.572
250 H1 HOH 209 H1 HOH 82 -2.431 -6.520 7.867
251 H2 HOH 209 H2 HOH 82 -2.086 -7.727 8.714
252 H1 HOH 210 H1 HOH 186 8.813 9.172 -0.601
253 H2 HOH 210 H2 HOH 186 8.410 10.525 -0.056
254 H1 HOH 211 H1 HOH 87 -4.666 4.866 9.426
255 H2 HOH 211 H2 HOH 87 -4.379 4.023 8.203
256 H1 HOH 212 H1 HOH 155 5.597 1.529 -10.126
257 H2 HOH 212 H2 HOH 155 5.148 2.602 -9.164
258 H1 HOH 213 H1 HOH 182 5.283 6.834 4.161
259 H2 HOH 213 H2 HOH 182 4.108 7.299 3.334
260 H1 HOH 214 H1 HOH 34 2.260 -10.819 -7.997
261 H2 HOH 214 H2 HOH 34 2.516 -9.756 -9.039
262 H1 HOH 215 H1 HOH 89 -3.425 0.177 10.787
263 H2 HOH 215 H2 HOH 89 -3.865 -0.626 9.584
264 H1 HOH 216 H1 HOH 149 -4.798 -1.146 -9.903
265 H2 HOH 216 H2 HOH 149 -5.774 -2.291 -10.092
266 H1 HOH 217 H1 HOH 156 4.477 6.362 -9.842
267 H2 HOH 217 H2 HOH 156 3.565 5.154 -9.757
268 H1 HOH 218 H1 HOH 21 -11.025 -8.341 1.447
269 H2 HOH 218 H2 HOH 21 -12.202 -7.843 2.264
270 H1 HOH 219 H1 HOH 56 -0.742 -6.385 5.874
271 H2 HOH 219 H2 HOH 56 -1.677 -7.523 6.211
272 H1 HOH 220 H1 HOH 132 -8.466 4.289 4.921
273 H2 HOH 220 H2 HOH 132 -8.316 5.768 4.631
274 H1 HOH 221 H1 HOH 164 -0.670 4.971 1.274
275 H2 HOH 221 H2 HOH 164 -1.768 4.780 2.304
276 H1 HOH 222 H1 HOH 23 -12.999 -0.261 6.280
277 H2 HOH 222 H2 HOH 23 -11.488 -0.112 6.225
278 H1 HOH 223 H1 HOH 120 -11.903 3.412 -4.715
279 H2 HOH 223 H2 HOH 120 -13.203 3.353 -5.491
280 H1 HOH 224 H1 HOH 16 -14.343 -4.956 5.755
281 H2 HOH 224 H2 HOH 16 -13.638 -3.619 5.810
282 H1 HOH 225 H1 HOH 197 17.132 5.832 -1.077
283 H2 HOH 225 H2 HOH 197 18.129 4.845 -0.504
284 H1 HOH 226 H1 HOH 4 -13.121 -10.833 -4.563
285 H2 HOH 226 H2 HOH 4 -11.739 -11.225 -5.048
286 H1 HOH 227 H1 HOH 9 -12.990 -11.675 0.004
287 H2 HOH 227 H2 HOH 9 -11.557 -11.522 0.480
288 H1 HOH 228 H1 HOH 107 18.292 2.852 4.357
289 H2 HOH 228 H2 HOH 107 17.816 1.812 3.367
290 H1 HOH 229 H1 HOH 53 3.732 -9.552 0.536
291 H2 HOH 229 H2 HOH 53 4.426 -8.857 -0.618
292 H1 HOH 230 H1 HOH 31 3.054 -6.164 -3.308
293 H2 HOH 230 H2 HOH 31 3.984 -5.214 -4.030
294 H1 HOH 231 H1 HOH 27 -14.460 0.827 4.976
295 H2 HOH 231 H2 HOH 27 -15.588 0.221 5.790
296 H1 HOH 232 H1 HOH 7 -18.141 -3.826 3.084
297 H2 HOH 232 H2 HOH 7 -17.893 -3.122 1.765
298 H1 HOH 233 H1 HOH 133 -13.214 7.226 -1.426
299 H2 HOH 233 H2 HOH 133 -11.913 6.985 -0.682
300 H1 HOH 234 H1 HOH 85 5.617 -5.843 4.101
301 H2 HOH 234 H2 HOH 85 4.915 -5.045 5.184
302 H1 HOH 235 H1 HOH 91 14.051 -8.728 0.503
303 H2 HOH 235 H2 HOH 91 13.984 -9.034 -0.978
304 H1 HOH 236 H1 HOH 42 2.187 -10.778 -3.218
305 H2 HOH 236 H2 HOH 42 1.618 -11.952 -3.986
306 H1 HOH 237 H1 HOH 172 -4.451 3.860 1.461
307 H2 HOH 237 H2 HOH 172 -4.889 3.146 0.195
308 H1 HOH 238 H1 HOH 165 2.831 7.022 -1.257
309 H2 HOH 238 H2 HOH 165 2.670 5.971 -0.178
310 H1 HOH 239 H1 HOH 99 9.632 -5.206 -2.502
311 H2 HOH 239 H2 HOH 99 9.506 -6.650 -2.063
312 H1 HOH 240 H1 HOH 44 -1.867 -13.104 -4.435
313 H2 HOH 240 H2 HOH 44 -3.256 -13.437 -3.930
314 H1 HOH 241 H1 HOH 96 9.042 -5.834 -8.957
315 H2 HOH 241 H2 HOH 96 8.433 -6.988 -9.735
316 H1 HOH 242 H1 HOH 72 8.712 2.572 6.678
317 H2 HOH 242 H2 HOH 72 8.678 1.570 5.544
318 H1 HOH 243 H1 HOH 58 1.186 -6.608 4.056
319 H2 HOH 243 H2 HOH 58 -0.021 -7.517 4.079
320 H1 HOH 244 H1 HOH 134 -11.078 6.372 1.656
321 H2 HOH 244 H2 HOH 134 -9.921 6.742 0.751
322 H1 HOH 245 H1 HOH 108 15.952 -6.137 4.115
323 H2 HOH 245 H2 HOH 108 16.485 -6.054 2.697
324 H1 HOH 246 H1 HOH 123 -14.705 1.482 -1.309
325 H2 HOH 246 H2 HOH 123 -14.736 1.368 -2.819
326 H1 HOH 247 H1 HOH 97 7.435 -8.308 -11.306
327 H2 HOH 247 H2 HOH 97 7.510 -9.607 -10.532
328 H1 HOH 248 H1 HOH 162 4.213 -2.351 -11.861
329 H2 HOH 248 H2 HOH 162 2.917 -2.294 -11.081
330 H1 HOH 249 H1 HOH 111 15.353 -7.960 2.434
331 H2 HOH 249 H2 HOH 111 15.472 -9.466 2.346
332 H1 HOH 250 H1 HOH 137 -0.436 -1.114 -12.383
333 H2 HOH 250 H2 HOH 137 -0.523 0.332 -11.948
334 H1 HOH 251 H1 HOH 28 -7.487 3.915 8.068
335 H2 HOH 251 H2 HOH 28 -7.863 3.208 9.349
336 H1 HOH 252 H1 HOH 104 14.848 -2.732 -0.137
337 H2 HOH 252 H2 HOH 104 15.567 -2.444 1.167
338 H1 HOH 253 H1 HOH 74 3.063 -5.344 4.802
339 H2 HOH 253 H2 HOH 74 1.941 -5.386 5.817
340 H1 HOH 254 H1 HOH 45 -1.875 -12.687 -6.635
341 H2 HOH 254 H2 HOH 45 -0.770 -13.721 -6.640
342 H1 HOH 255 H1 HOH 153 -3.396 4.241 -5.950
343 H2 HOH 255 H2 HOH 153 -4.217 3.072 -6.456
344 H1 HOH 256 H1 HOH 32 4.598 -10.684 -8.685
345 H2 HOH 256 H2 HOH 32 5.694 -11.704 -8.906
346 H1 HOH 257 H1 HOH 93 7.608 -8.744 -8.421
347 H2 HOH 257 H2 HOH 93 6.577 -9.611 -7.735
348 H1 HOH 258 H1 HOH 116 13.657 -1.640 4.396
349 H2 HOH 258 H2 HOH 116 12.972 -2.966 4.137
350 H1 HOH 259 H1 HOH 75 6.915 -6.660 2.106
351 H2 HOH 259 H2 HOH 75 6.535 -8.007 2.685
352 H1 HOH 260 H1 HOH 188 -9.520 7.009 -3.003
353 H2 HOH 260 H2 HOH 188 -10.961 6.692 -2.666
354 H1 HOH 261 H1 HOH 5 -9.665 -11.204 2.066
355 H2 HOH 261 H2 HOH 5 -10.797 -10.200 2.073
356 H1 HOH 262 H1 HOH 86 -5.169 -2.710 10.573
357 H2 HOH 262 H2 HOH 86 -4.312 -3.383 9.524
358 H1 HOH 263 H1 HOH 159 -2.904 -7.484 -11.222
359 H2 HOH 263 H2 HOH 159 -4.318 -7.777 -10.758
360 H1 HOH 264 H1 HOH 157 -10.343 4.936 -4.153
361 H2 HOH 264 H2 HOH 157 -9.413 4.211 -5.100
362 H1 HOH 265 H1 HOH 17 -11.677 -2.452 5.667
363 H2 HOH 265 H2 HOH 17 -11.540 -3.860 5.121
364 H1 HOH 266 H1 HOH 147 0.922 -1.165 -13.876
365 H2 HOH 266 H2 HOH 147 1.801 -1.938 -12.911
366 H1 HOH 267 H1 HOH 112 16.476 -4.351 1.084
367 H2 HOH 267 H2 HOH 112 17.895 -4.854 0.925
368 H1 HOH 268 H1 HOH 142 -2.128 -5.687 -12.982
369 H2 HOH 268 H2 HOH 142 -1.312 -6.922 -12.665
370 H1 HOH 269 H1 HOH 25 -15.728 -3.060 6.749
371 H2 HOH 269 H2 HOH 25 -15.835 -1.963 7.785
372 H1 HOH 270 H1 HOH 131 -14.993 5.920 -0.223
373 H2 HOH 270 H2 HOH 131 -14.235 5.304 0.933
374 H1 HOH 271 H1 HOH 187 9.958 10.636 5.215
375 H2 HOH 271 H2 HOH 187 10.502 10.361 3.831
376 H1 HOH 272 H1 HOH 57 -0.309 -7.793 0.573
377 H2 HOH 272 H2 HOH 57 0.240 -7.120 1.816
378 H1 HOH 273 H1 HOH 140 -5.324 -4.101 -11.591
379 H2 HOH 273 H2 HOH 140 -6.673 -4.510 -11.039
380 H1 HOH 274 H1 HOH 127 -12.762 -3.004 -4.276
381 H2 HOH 274 H2 HOH 127 -13.296 -3.776 -3.089
382 H1 HOH 275 H1 HOH 15 -11.293 -12.466 -1.652
383 H2 HOH 275 H2 HOH 15 -11.476 -12.286 -3.147
384 H1 HOH 276 H1 HOH 26 -10.810 -2.090 9.057
385 H2 HOH 276 H2 HOH 26 -11.312 -1.686 7.687
386 H1 HOH 277 H1 HOH 118 11.934 6.170 4.566
387 H2 HOH 277 H2 HOH 118 13.006 7.234 4.527
388 H1 HOH 278 H1 HOH 117 13.192 0.151 5.844
389 H2 HOH 278 H2 HOH 117 14.447 -0.398 6.490
390 H1 HOH 279 H1 HOH 113 10.171 -5.172 4.391
391 H2 HOH 279 H2 HOH 113 10.510 -3.779 4.882
392 H1 HOH 280 H1 HOH 22 -9.668 3.277 7.474
393 H2 HOH 280 H2 HOH 22 -11.085 2.950 7.885
394 H1 HOH 281 H1 HOH 115 13.871 -2.445 -2.064
395 H2 HOH 281 H2 HOH 115 13.179 -1.152 -1.678
396 H1 HOH 282 H1 HOH 178 0.151 7.044 -3.634
397 H2 HOH 282 H2 HOH 178 -0.611 7.049 -2.324
398 H1 HOH 283 H1 HOH 169 3.106 6.706 -8.156
399 H2 HOH 283 H2 HOH 169 2.668 5.747 -7.072
400 H1 HOH 284 H1 HOH 37 -4.009 -12.491 -7.764
401 H2 HOH 284 H2 HOH 37 -3.032 -11.607 -8.510
402 H1 HOH 285 H1 HOH 70 -1.014 1.340 10.930
403 H2 HOH 285 H2 HOH 70 -1.140 -0.132 11.268
404 H1 HOH 286 H1 HOH 189 6.743 2.764 -7.874
405 H2 HOH 286 H2 HOH 189 6.438 3.952 -6.988
406 H1 HOH 287 H1 HOH 179 -0.368 8.135 -0.214
407 H2 HOH 287 H2 HOH 179 0.548 6.983 -0.572
408 H1 HOH 288 H1 HOH 185 6.427 9.434 -1.888
409 H2 HOH 288 H2 HOH 185 7.662 10.152 -2.373
410 H1 HOH 289 H1 HOH 66 2.942 5.512 4.262
411 H2 HOH 289 H2 HOH 66 1.738 5.456 5.179
412 H1 HOH 290 H1 HOH 145 -9.366 0.040 -7.233
413 H2 HOH 290 H2 HOH 145 -10.394 -0.274 -6.170
414 H1 HOH 291 H1 HOH 101 20.538 4.363 -0.012
415 H2 HOH 291 H2 HOH 101 19.996 5.293 1.053
416 H1 HOH 292 H1 HOH 152 0.790 -7.486 -13.927
417 H2 HOH 292 H2 HOH 152 0.899 -7.763 -12.443
418 H1 HOH 293 H1 HOH 105 12.875 -6.709 5.445
419 H2 HOH 293 H2 HOH 105 12.426 -5.330 5.014
420 H1 HOH 294 H1 HOH 71 -5.350 -6.378 11.484
421 H2 HOH 294 H2 HOH 71 -4.982 -5.272 10.517
422 H1 HOH 295 H1 HOH 83 9.801 -1.893 6.189
423 H2 HOH 295 H2 HOH 83 8.576 -2.359 5.436
424 H1 HOH 296 H1 HOH 24 -17.367 -0.733 6.582
425 H2 HOH 296 H2 HOH 24 -18.028 0.629 6.550
426 H1 HOH 297 H1 HOH 184 -7.490 7.985 5.144
427 H2 HOH 297 H2 HOH 184 -6.521 6.873 5.487
428 H1 HOH 298 H1 HOH 154 -1.903 6.232 -6.702
429 H2 HOH 298 H2 HOH 154 -2.860 6.272 -5.528
430 H1 HOH 299 H1 HOH 41 -0.204 -11.780 -11.512
431 H2 HOH 299 H2 HOH 41 0.185 -10.634 -10.604
432 H1 HOH 300 H1 HOH 196 7.032 -6.711 -12.846
433 H2 HOH 300 H2 HOH 196 6.950 -7.906 -13.773
434 H1 HOH 301 H1 HOH 46 6.720 -9.294 0.763
435 H2 HOH 301 H2 HOH 46 5.897 -10.264 1.587
436 H1 HOH 302 H1 HOH 1 -13.901 -9.416 -5.669
437 H2 HOH 302 H2 HOH 1 -15.290 -10.022 -5.632
438 H1 HOH 303 H1 HOH 176 -5.234 5.978 7.288
439 H2 HOH 303 H2 HOH 176 -4.319 6.678 6.305
440 H1 HOH 304 H1 HOH 121 -16.431 2.210 0.357
441 H2 HOH 304 H2 HOH 121 -15.519 3.373 0.009
442 H1 HOH 305 H1 HOH 171 -2.395 6.902 -3.666
443 H2 HOH 305 H2 HOH 171 -3.491 7.942 -3.761
444 H1 HOH 306 H1 HOH 54 -7.319 -11.430 2.440
445 H2 HOH 306 H2 HOH 54 -7.474 -9.941 2.658
446 H1 HOH 307 H1 HOH 167 -7.496 6.480 1.480
447 H2 HOH 307 H2 HOH 167 -7.774 7.723 0.666
448 H1 HOH 308 H1 HOH 195 6.409 -2.096 -11.564
449 H2 HOH 308 H2 HOH 195 6.438 -3.601 -11.751
450 H1 HOH 309 H1 HOH 40 2.536 -10.932 1.583
451 H2 HOH 309 H2 HOH 40 3.741 -11.634 2.176
452 H1 HOH 310 H1 HOH 55 -0.569 -5.307 0.662
453 H2 HOH 310 H2 HOH 55 -0.824 -4.310 1.770
454 H1 HOH 311 H1 HOH 193 8.480 -4.620 -12.282
455 H2 HOH 311 H2 HOH 193 7.859 -5.303 -11.082
456 H1 HOH 312 H1 HOH 10 -16.750 -6.616 2.037
457 H2 HOH 312 H2 HOH 10 -16.516 -5.125 2.154
458 H1 HOH 313 H1 HOH 73 10.518 -0.432 8.045
459 H2 HOH 313 H2 HOH 73 9.597 0.236 7.049
460 H1 HOH 314 H1 HOH 136 -2.512 -0.662 -11.035
461 H2 HOH 314 H2 HOH 136 -3.143 0.345 -10.100
462 H1 HOH 315 H1 HOH 76 6.795 3.988 7.418
463 H2 HOH 315 H2 HOH 76 7.850 4.732 6.629
464 H1 HOH 316 H1 HOH 130 -11.391 4.202 4.344
465 H2 HOH 316 H2 HOH 130 -11.310 3.272 5.538
466 H1 HOH 317 H1 HOH 166 -6.514 6.447 3.358
467 H2 HOH 317 H2 HOH 166 -5.276 5.706 2.900
468 H1 HOH 318 H1 HOH 177 -4.808 5.874 -3.981
469 H2 HOH 318 H2 HOH 177 -4.914 4.506 -4.623
470 H1 HOH 319 H1 HOH 29 -9.765 -3.522 7.404
471 H2 HOH 319 H2 HOH 29 -8.370 -4.106 7.381
472 H1 HOH 320 H1 HOH 148 -6.678 -6.845 -11.272
473 H2 HOH 320 H2 HOH 148 -6.212 -8.140 -11.903
474 H1 HOH 321 H1 HOH 129 -15.203 8.409 -1.129
475 H2 HOH 321 H2 HOH 129 -15.690 7.202 -1.902
476 H1 HOH 322 H1 HOH 51 7.491 -8.224 -5.921
477 H2 HOH 322 H2 HOH 51 8.010 -6.925 -5.337
478 H1 HOH 323 H1 HOH 114 20.632 7.117 2.414
479 H2 HOH 323 H2 HOH 114 20.862 5.896 3.277
480 H1 HOH 324 H1 HOH 6 -15.529 -10.736 -0.514
481 H2 HOH 324 H2 HOH 6 -16.910 -10.723 -1.135
482 H1 HOH 325 H1 HOH 141 -2.279 2.741 -9.733
483 H2 HOH 325 H2 HOH 141 -3.487 2.297 -8.936
484 H1 HOH 326 H1 HOH 79 -1.115 -4.664 11.456
485 H2 HOH 326 H2 HOH 79 -1.024 -4.306 12.925
486 H1 HOH 327 H1 HOH 100 11.211 -5.151 -4.626
487 H2 HOH 327 H2 HOH 100 12.258 -6.245 -4.626
488 H1 HOH 328 H1 HOH 2 -14.376 -6.459 2.114
489 H2 HOH 328 H2 HOH 2 -13.485 -6.523 3.338
490 H1 HOH 329 H1 HOH 3 -16.170 -9.001 -2.393
491 H2 HOH 329 H2 HOH 3 -15.626 -8.848 -3.799
492 H1 HOH 330 H1 HOH 151 1.983 6.507 -10.592
493 H2 HOH 330 H2 HOH 151 1.451 6.150 -11.961
494 H1 HOH 331 H1 HOH 60 8.157 -5.919 -0.024
495 H2 HOH 331 H2 HOH 60 7.296 -7.164 -0.005
496 H1 HOH 332 H1 HOH 48 -3.174 -9.697 -10.174
497 H2 HOH 332 H2 HOH 48 -2.257 -10.893 -10.336
498 H1 HOH 333 H1 HOH 30 -2.346 -13.128 -1.879
499 H2 HOH 333 H2 HOH 30 -1.383 -13.758 -0.896
500 H1 HOH 334 H1 HOH 52 -3.712 -8.196 6.946
501 H2 HOH 334 H2 HOH 52 -5.208 -8.423 6.969
502 H1 HOH 335 H1 HOH 103 14.833 -1.390 2.830
503 H2 HOH 335 H2 HOH 103 15.175 -0.465 1.675
504 H1 HOH 336 H1 HOH 95 13.233 -4.141 -3.717
505 H2 HOH 336 H2 HOH 95 14.622 -3.607 -4.005
506 H1 HOH 337 H1 HOH 92 9.425 -1.919 -4.436
507 H2 HOH 337 H2 HOH 92 8.662 -1.722 -5.727
508 H1 HOH 338 H1 HOH 90 9.743 -8.930 -3.074
509 H2 HOH 338 H2 HOH 90 8.586 -8.107 -3.606
510 H1 HOH 339 H1 HOH 135 -11.346 6.667 4.021
511 H2 HOH 339 H2 HOH 135 -10.266 5.656 3.698
512 H1 HOH 340 H1 HOH 50 -1.484 -9.806 0.933
513 H2 HOH 340 H2 HOH 50 -1.532 -9.636 -0.571
514 H1 HOH 341 H1 HOH 8 -10.508 -8.215 3.693
515 H2 HOH 341 H2 HOH 8 -9.599 -8.776 4.766
516 H1 HOH 342 H1 HOH 12 -20.290 -4.577 4.202
517 H2 HOH 342 H2 HOH 12 -19.168 -3.998 5.038
518 H1 HOH 343 H1 HOH 67 0.995 -1.480 11.645
519 H2 HOH 343 H2 HOH 67 -0.239 -2.354 11.749
520 H1 HOH 344 H1 HOH 109 12.519 1.113 -2.504
521 H2 HOH 344 H2 HOH 109 12.005 0.799 -1.116
522 H1 HOH 345 H1 HOH 128 -14.622 2.995 3.797
523 H2 HOH 345 H2 HOH 128 -13.256 2.614 4.334
524 H1 HOH 346 H1 HOH 173 4.637 7.965 -1.574
525 H2 HOH 346 H2 HOH 173 4.382 8.166 -3.052
526 H1 HOH 347 H1 HOH 19 -11.896 -10.068 -6.787
527 H2 HOH 347 H2 HOH 19 -12.101 -8.626 -7.201
528 H1 HOH 348 H1 HOH 11 -14.325 -11.259 1.534
529 H2 HOH 348 H2 HOH 11 -15.113 -12.477 1.100
530 H1 HOH 349 H1 HOH 160 -11.464 -6.528 -8.132
531 H2 HOH 349 H2 HOH 160 -10.732 -7.541 -8.983
532 H1 HOH 350 H1 HOH 13 -12.453 -6.048 5.194
533 H2 HOH 350 H2 HOH 13 -13.366 -7.163 5.660
534 H1 HOH 351 H1 HOH 94 10.037 -3.986 -7.995
535 H2 HOH 351 H2 HOH 94 11.172 -4.978 -7.853
536 H1 HOH 352 H1 HOH 14 -19.004 -4.021 7.511
537 H2 HOH 352 H2 HOH 14 -17.886 -3.235 6.856
538 H1 HOH 353 H1 HOH 198 10.697 -0.089 -4.452
539 H2 HOH 353 H2 HOH 198 11.108 -0.436 -3.039
540 H1 HOH 354 H1 HOH 36 0.393 -10.263 1.037
541 H2 HOH 354 H2 HOH 36 0.125 -11.113 2.258
542 H1 HOH 355 H1 HOH 78 1.234 2.422 10.790
543 H2 HOH 355 H2 HOH 78 0.169 3.452 11.104
544 H1 HOH 356 H1 HOH 20 -12.906 -9.813 2.771
545 H2 HOH 356 H2 HOH 20 -12.532 -11.270 2.933
546 H1 HOH 357 H1 HOH 139 -10.768 -1.721 -8.047
547 H2 HOH 357 H2 HOH 139 -11.348 -1.575 -9.437
548 H1 HOH 358 H1 HOH 63 -7.431 -11.272 -8.094
549 H2 HOH 358 H2 HOH 63 -8.008 -10.074 -7.370
550 H1 HOH 359 H1 HOH 161 -12.828 -4.748 -8.278
551 H2 HOH 359 H2 HOH 161 -11.621 -3.898 -8.615
552 H1 HOH 360 H1 HOH 59 -4.970 -14.934 -4.704
553 H2 HOH 360 H2 HOH 59 -5.420 -13.515 -4.983
554 H1 HOH 361 H1 HOH 102 17.000 -0.287 2.952
555 H2 HOH 361 H2 HOH 102 18.347 -0.577 3.579
556 H1 HOH 362 H1 HOH 81 3.748 -4.706 7.149
557 H2 HOH 362 H2 HOH 81 5.041 -4.039 7.569
558 H1 HOH 363 H1 HOH 191 7.672 0.012 -12.507
559 H2 HOH 363 H2 HOH 191 6.326 -0.086 -11.818
560 H1 HOH 364 H1 HOH 146 1.154 1.090 -15.056
561 H2 HOH 364 H2 HOH 146 -0.306 0.720 -14.916
562 H1 HOH 365 H1 HOH 106 15.394 0.750 -0.565
563 H2 HOH 365 H2 HOH 106 14.514 -0.476 -0.437
564 H1 HOH 366 H1 HOH 64 6.291 -8.059 -3.846
565 H2 HOH 366 H2 HOH 64 5.007 -7.421 -3.354
566 H1 HOH 367 H1 HOH 98 9.162 -4.091 -5.017
567 H2 HOH 367 H2 HOH 98 9.669 -5.058 -6.068
568 H1 HOH 368 H1 HOH 124 -20.194 -0.821 2.021
569 H2 HOH 368 H2 HOH 124 -19.902 -0.760 0.537
570 H1 HOH 369 H1 HOH 62 -10.878 -12.404 -6.857
571 H2 HOH 369 H2 HOH 62 -9.813 -11.329 -6.826
572 H1 HOH 370 H1 HOH 183 4.575 7.382 -6.820
573 H2 HOH 370 H2 HOH 183 5.343 8.232 -5.829
574 H1 HOH 371 H1 HOH 158 -8.249 -5.418 -12.481
575 H2 HOH 371 H2 HOH 158 -8.805 -5.794 -11.125
576 H1 HOH 372 H1 HOH 180 2.290 7.223 -4.982
577 H2 HOH 372 H2 HOH 180 2.592 7.293 -3.499
578 H1 HOH 373 H1 HOH 39 6.490 -8.511 -1.679
579 H2 HOH 373 H2 HOH 39 7.958 -8.702 -1.372
580 H1 HOH 374 H1 HOH 122 -18.345 2.145 1.917
581 H2 HOH 374 H2 HOH 122 -18.264 0.761 1.310
582 H1 HOH 375 H1 HOH 194 9.056 0.741 -6.447
583 H2 HOH 375 H2 HOH 194 8.604 -0.004 -7.684
584 H1 HOH 376 H1 HOH 125 -15.341 -1.971 -2.147
585 H2 HOH 376 H2 HOH 125 -15.164 -0.589 -1.552
586 H1 HOH 377 H1 HOH 138 -5.789 3.042 -8.164
587 H2 HOH 377 H2 HOH 138 -5.378 1.585 -8.175
588 H1 HOH 378 H1 HOH 190 7.784 -0.143 -10.090
589 H2 HOH 378 H2 HOH 190 7.244 0.905 -9.142
590 H1 HOH 379 H1 HOH 88 7.996 -6.532 3.924
591 H2 HOH 379 H2 HOH 88 8.570 -6.643 5.321
592 H1 HOH 380 H1 HOH 18 -10.181 -5.126 5.905
593 H2 HOH 380 H2 HOH 18 -10.411 -6.338 5.021
594 H1 HOH 381 H1 HOH 47 -3.662 -9.004 4.837
595 H2 HOH 381 H2 HOH 47 -2.378 -8.357 4.367
596 H1 HOH 382 H1 HOH 61 -8.113 -13.790 -2.819
597 H2 HOH 382 H2 HOH 61 -9.390 -13.082 -3.216
598 H1 HOH 383 H1 HOH 126 -15.558 -4.612 -2.930
599 H2 HOH 383 H2 HOH 126 -15.333 -3.899 -1.613
600 H1 HOH 384 H1 HOH 192 9.865 -1.823 -9.126
601 H2 HOH 384 H2 HOH 192 9.759 -1.655 -7.627
602 H1 HOH 385 H1 HOH 150 -7.005 4.771 -4.997
603 H2 HOH 385 H2 HOH 150 -7.726 5.580 -6.052
604 H1 HOH 386 H1 HOH 43 -5.203 -11.071 -9.605
605 H2 HOH 386 H2 HOH 43 -6.223 -12.129 -9.963
606 H1 HOH 387 H1 HOH 168 4.544 10.055 -4.633
607 H2 HOH 387 H2 HOH 168 5.713 9.454 -3.881
608 H1 HOH 388 H1 HOH 144 -8.674 2.467 -7.007
609 H2 HOH 388 H2 HOH 144 -8.892 2.120 -8.463
610 H1 HOH 389 H1 HOH 199 13.034 3.422 -2.746
611 H2 HOH 389 H2 HOH 199 12.567 2.956 -4.108
612 H1 HOH 390 H1 HOH 143 -10.931 -5.469 -9.907
613 H2 HOH 390 H2 HOH 143 -11.186 -6.140 -11.239
614 H1 HOH 391 H1 HOH 181 1.774 7.058 6.896
615 H2 HOH 391 H2 HOH 181 0.613 6.214 7.376
616 H1 HOH 392 H1 HOH 35 -7.465 -12.942 -4.886
617 H2 HOH 392 H2 HOH 35 -7.347 -12.222 -6.214
618 H1 HOH 393 H1 HOH 119 -17.585 -5.788 -3.841
619 H2 HOH 393 H2 HOH 119 -16.501 -6.688 -3.282
620 H1 HOH 394 H1 HOH 38 -5.569 -12.619 3.577
621 H2 HOH 394 H2 HOH 38 -5.058 -12.549 2.154
622 H1 HOH 395 H1 HOH 33 -2.519 -10.222 2.931
623 H2 HOH 395 H2 HOH 33 -2.697 -11.526 2.177
624 H1 HOH 396 H1 HOH 68 3.705 -0.170 9.194
625 H2 HOH 396 H2 HOH 68 5.126 0.114 9.634
626 H1 HOH 397 H1 HOH 49 -3.421 -14.077 1.678
627 H2 HOH 397 H2 HOH 49 -3.112 -13.085 0.578
628 H1 HOH 398 H1 HOH 65 3.311 -0.796 11.246
629 H2 HOH 398 H2 HOH 65 3.148 -1.303 12.663
630 H1 HOH 399 H1 HOH 69 3.686 2.849 11.409
631 H2 HOH 399 H2 HOH 69 3.400 1.607 10.592
Start of MODEL 4
1 HA PRO 62 HA PRO 62 -9.107 -7.440 -3.770
2 HB2 PRO 62 HB2 PRO 62 -11.018 -6.656 -2.081
3 HB3 PRO 62 HB3 PRO 62 -11.460 -7.244 -3.712
4 HG2 PRO 62 HG2 PRO 62 -11.626 -8.730 -1.079
5 HG3 PRO 62 HG3 PRO 62 -12.764 -8.766 -2.461
6 HD2 PRO 62 HD2 PRO 62 -10.611 -10.571 -1.899
7 HD3 PRO 62 HD3 PRO 62 -11.589 -10.529 -3.387
8 H PHE 63 H PHE 63 -8.349 -5.997 -2.021
9 HA PHE 63 HA PHE 63 -7.406 -7.391 0.454
10 HB2 PHE 63 HB2 PHE 63 -5.658 -5.793 -1.446
11 HB3 PHE 63 HB3 PHE 63 -5.162 -6.507 0.085
12 HD1 PHE 63 HD1 PHE 63 -5.412 -7.016 -3.455
13 HD2 PHE 63 HD2 PHE 63 -5.310 -9.082 0.331
14 HE1 PHE 63 HE1 PHE 63 -4.643 -9.083 -4.597
15 HE2 PHE 63 HE2 PHE 63 -4.557 -11.139 -0.819
16 HZ PHE 63 HZ PHE 63 -4.219 -11.148 -3.282
17 H ALA 64 H ALA 64 -8.206 -6.261 2.098
18 HA ALA 64 HA ALA 64 -8.218 -3.312 2.191
19 HB1 ALA 64 HB1 ALA 64 -8.864 -5.433 4.263
20 HB2 ALA 64 HB2 ALA 64 -9.025 -3.674 4.493
21 HB3 ALA 64 HB3 ALA 64 -10.031 -4.508 3.290
22 H CYS 65 H CYS 65 -7.001 -2.084 3.667
23 HA CYS 65 HA CYS 65 -4.216 -3.071 3.966
24 HB2 CYS 65 HB2 CYS 65 -5.431 -0.287 4.010
25 HB3 CYS 65 HB3 CYS 65 -3.690 -0.668 4.110
26 H ASP 66 H ASP 66 -3.595 -3.753 5.889
27 HA ASP 66 HA ASP 66 -4.580 -2.832 8.414
28 HB2 ASP 66 HB2 ASP 66 -3.049 -4.920 7.531
29 HB3 ASP 66 HB3 ASP 66 -1.770 -3.878 8.146
30 H ILE 67 H ILE 67 -3.147 -0.991 6.237
31 HA ILE 67 HA ILE 67 -1.473 0.654 8.104
32 HB ILE 67 HB ILE 67 -1.227 0.480 5.084
33 HG12 ILE 67 2HG1 ILE 67 -0.488 -1.660 5.966
34 HG13 ILE 67 3HG1 ILE 67 0.857 -0.729 5.348
35 HG21 ILE 67 HG21 ILE 67 -0.490 2.637 5.887
36 HG22 ILE 67 HG22 ILE 67 0.481 1.892 7.170
37 HG23 ILE 67 HG23 ILE 67 0.938 1.688 5.469
38 HD11 ILE 67 1HD1 ILE 67 1.558 -0.153 7.658
39 HD12 ILE 67 2HD1 ILE 67 0.176 -1.077 8.297
40 HD13 ILE 67 3HD1 ILE 67 1.460 -1.903 7.406
41 H CYS 68 H CYS 68 -3.762 0.805 5.360
42 HA CYS 68 HA CYS 68 -4.297 3.660 5.882
43 HB2 CYS 68 HB2 CYS 68 -4.980 1.871 3.512
44 HB3 CYS 68 HB3 CYS 68 -5.184 3.628 3.610
45 H GLY 69 H GLY 69 -5.881 0.633 6.432
46 HA2 GLY 69 HA2 GLY 69 -7.993 -0.030 6.952
47 HA3 GLY 69 HA3 GLY 69 -8.409 1.659 7.224
48 H ARG 70 H ARG 70 -7.644 2.102 4.249
49 HA ARG 70 HA ARG 70 -10.166 1.653 2.914
50 HB2 ARG 70 HB2 ARG 70 -7.378 2.432 1.975
51 HB3 ARG 70 HB3 ARG 70 -8.717 2.210 0.837
52 HG2 ARG 70 HG2 ARG 70 -10.038 3.916 2.065
53 HG3 ARG 70 HG3 ARG 70 -8.638 4.203 3.128
54 HD2 ARG 70 HD2 ARG 70 -7.276 4.938 1.276
55 HD3 ARG 70 HD3 ARG 70 -8.490 4.438 0.102
56 HE ARG 70 HE ARG 70 -8.856 6.668 2.091
57 HH11 ARG 70 1HH1 ARG 70 -10.487 6.814 -1.563
58 HH12 ARG 70 2HH1 ARG 70 -9.892 5.273 -0.962
59 HH21 ARG 70 1HH2 ARG 70 -10.435 8.574 -0.316
60 HH22 ARG 70 2HH2 ARG 70 -9.663 8.579 1.252
61 H LYS 71 H LYS 71 -10.319 0.510 0.796
62 HA LYS 71 HA LYS 71 -8.967 -2.134 0.808
63 HB2 LYS 71 HB2 LYS 71 -11.085 -3.308 0.582
64 HB3 LYS 71 HB3 LYS 71 -11.016 -2.374 2.073
65 HG2 LYS 71 HG2 LYS 71 -12.319 -0.525 0.675
66 HG3 LYS 71 HG3 LYS 71 -12.645 -1.851 -0.426
67 HD2 LYS 71 HD2 LYS 71 -14.509 -1.868 1.004
68 HD3 LYS 71 HD3 LYS 71 -13.484 -3.135 1.699
69 HE2 LYS 71 HE2 LYS 71 -12.532 -1.246 3.227
70 HE3 LYS 71 HE3 LYS 71 -13.863 -0.248 2.627
71 HZ1 LYS 71 HZ1 LYS 71 -14.593 -1.293 4.633
72 HZ2 LYS 71 HZ2 LYS 71 -15.359 -2.106 3.434
73 HZ3 LYS 71 HZ3 LYS 71 -14.049 -2.759 4.195
74 H PHE 72 H PHE 72 -8.330 -2.938 -0.990
75 HA PHE 72 HA PHE 72 -8.928 -1.432 -3.501
76 HB2 PHE 72 HB2 PHE 72 -6.271 -2.475 -2.451
77 HB3 PHE 72 HB3 PHE 72 -6.515 -1.658 -3.987
78 HD1 PHE 72 HD1 PHE 72 -6.831 0.764 -4.116
79 HD2 PHE 72 HD2 PHE 72 -6.446 -1.201 -0.294
80 HE1 PHE 72 HE1 PHE 72 -6.500 2.961 -3.017
81 HE2 PHE 72 HE2 PHE 72 -6.127 0.984 0.799
82 HZ PHE 72 HZ PHE 72 -6.140 3.090 -0.565
83 H ALA 73 H ALA 73 -8.419 -2.500 -5.478
84 HA ALA 73 HA ALA 73 -9.613 -5.011 -5.749
85 HB1 ALA 73 HB1 ALA 73 -9.713 -3.307 -7.453
86 HB2 ALA 73 HB2 ALA 73 -7.952 -3.312 -7.658
87 HB3 ALA 73 HB3 ALA 73 -8.909 -4.724 -8.146
88 H ARG 74 H ARG 74 -6.419 -4.645 -7.223
89 HA ARG 74 HA ARG 74 -5.254 -6.973 -5.866
90 HB2 ARG 74 HB2 ARG 74 -6.841 -8.098 -7.325
91 HB3 ARG 74 HB3 ARG 74 -6.242 -7.233 -8.739
92 HG2 ARG 74 HG2 ARG 74 -4.170 -8.423 -8.734
93 HG3 ARG 74 HG3 ARG 74 -4.433 -9.036 -7.085
94 HD2 ARG 74 HD2 ARG 74 -6.269 -10.442 -7.806
95 HD3 ARG 74 HD3 ARG 74 -6.291 -9.687 -9.405
96 HE ARG 74 HE ARG 74 -4.402 -10.901 -10.080
97 HH11 ARG 74 1HH1 ARG 74 -3.379 -13.908 -8.795
98 HH12 ARG 74 2HH1 ARG 74 -3.414 -12.825 -10.176
99 HH21 ARG 74 1HH2 ARG 74 -3.770 -13.032 -6.833
100 HH22 ARG 74 2HH2 ARG 74 -4.590 -11.490 -6.691
101 H SER 75 H SER 75 -5.048 -5.159 -8.924
102 HA SER 75 HA SER 75 -3.383 -3.853 -9.803
103 HB2 SER 75 HB2 SER 75 -3.343 -3.034 -6.887
104 HB3 SER 75 HB3 SER 75 -2.720 -2.070 -8.242
105 HG SER 75 HG SER 75 -4.685 -1.703 -8.946
106 H1 OUD 76 H OUD 76 -2.034 -5.768 -10.284
107 HA OUD 76 HA OUD 76 0.491 -5.928 -8.725
108 HB3 OUD 76 HB3 OUD 76 -0.716 -7.982 -9.484
109 HB2 OUD 76 HB2 OUD 76 -0.491 -7.502 -11.145
110 HM3 OUD 76 HM3 OUD 76 1.908 -5.273 -10.513
111 HM2 OUD 76 HM2 OUD 76 0.629 -5.447 -11.715
112 HN2 OUD 76 HN2 OUD 76 -0.401 -3.426 -10.952
113 H OUE 77 H OUE 77 -0.620 -1.690 -9.757
114 HA OUE 77 HA OUE 77 1.696 -0.858 -8.084
115 HB3 OUE 77 HB3 OUE 77 1.725 0.532 -10.114
116 HB2 OUE 77 HB2 OUE 77 0.025 0.902 -9.905
117 HG3 OUE 77 HG3 OUE 77 0.674 2.050 -7.642
118 HG2 OUE 77 HG2 OUE 77 2.347 1.832 -8.145
119 HM2 OUE 77 HM2 OUE 77 -1.226 -0.005 -7.816
120 HM3 OUE 77 HM3 OUE 77 0.092 0.339 -6.675
121 HN2 OUE 77 HN2 OUE 77 -0.579 -2.466 -7.236
122 H1 OUK 78 H OUK 78 -1.456 -3.656 -5.680
123 HA OUK 78 HA OUK 78 0.493 -2.985 -3.567
124 HB2 OUK 78 HB2 OUK 78 -0.238 -5.172 -2.431
125 HB3 OUK 78 HB3 OUK 78 -1.663 -5.161 -3.466
126 HG2 OUK 78 HG2 OUK 78 -2.142 -2.775 -2.508
127 HG3 OUK 78 HG3 OUK 78 -0.858 -3.095 -1.347
128 HD2 OUK 78 HD2 OUK 78 -2.169 -5.155 -0.574
129 HD3 OUK 78 HD3 OUK 78 -3.452 -4.697 -1.700
130 HE2 OUK 78 HE2 OUK 78 -3.595 -2.431 -0.521
131 HE3 OUK 78 HE3 OUK 78 -2.429 -3.048 0.675
132 HZ3 OUK 78 HZ3 OUK 78 -4.089 -4.696 1.339
133 HZ1 OUK 78 HZ1 OUK 78 -5.198 -4.044 0.259
134 HZ2 OUK 78 HZ2 OUK 78 -4.623 -3.124 1.525
135 HM3 OUK 78 HM3 OUK 78 1.482 -5.170 -4.186
136 HM2 OUK 78 HM2 OUK 78 0.158 -5.456 -5.327
137 HN2 OUK 78 HN2 OUK 78 1.009 -3.818 -6.786
138 H OUR 79 H OUR 79 2.699 -2.718 -7.736
139 HA OUR 79 HA OUR 79 5.075 -2.081 -6.044
140 HB3 OUR 79 HB3 OUR 79 4.669 -1.609 -9.043
141 HB2 OUR 79 HB2 OUR 79 6.123 -1.253 -8.123
142 HG3 OUR 79 HG3 OUR 79 6.461 -3.660 -7.646
143 HG2 OUR 79 HG2 OUR 79 4.974 -4.067 -8.518
144 HD3 OUR 79 HD3 OUR 79 5.873 -3.127 -10.612
145 HD2 OUR 79 HD2 OUR 79 7.329 -2.574 -9.768
146 HE OUR 79 HE OUR 79 6.521 -5.431 -9.868
147 HH12 OUR 79 2HH1 OUR 79 10.356 -4.254 -10.515
148 HH11 OUR 79 1HH1 OUR 79 9.193 -3.036 -10.200
149 HH22 OUR 79 2HH2 OUR 79 8.072 -6.971 -10.442
150 HM2 OUR 79 HM2 OUR 79 3.678 0.031 -7.727
151 HM3 OUR 79 HM3 OUR 79 4.931 0.247 -6.505
152 HN2 OUR 79 HN2 OUR 79 2.128 -0.596 -5.921
153 HH21 OUR 79 1HH2 OUR 79 9.690 -6.533 -10.811
154 H OUH 80 H OUH 80 0.886 0.810 -4.935
155 HA OUH 80 HA OUH 80 2.368 2.326 -2.866
156 HB2 OUH 80 HB2 OUH 80 0.124 3.205 -4.066
157 HB3 OUH 80 HB3 OUH 80 0.607 3.597 -2.443
158 HD2 OUH 80 HD2 OUH 80 -0.569 2.460 -0.415
159 HD1 OUH 80 HD1 OUH 80 -2.336 1.755 -4.147
160 HE1 OUH 80 HE1 OUH 80 -4.029 1.270 -2.239
161 HM2 OUH 80 HM2 OUH 80 0.366 0.138 -2.180
162 HM3 OUH 80 HM3 OUH 80 1.545 0.938 -1.121
163 HN2 OUH 80 HN2 OUH 80 2.376 -0.745 -3.430
164 H1 OUK 81 H OUK 81 4.103 -1.976 -3.236
165 HA OUK 81 HA OUK 81 5.592 -1.755 -0.660
166 HB2 OUK 81 HB2 OUK 81 6.730 -3.879 -1.176
167 HB3 OUK 81 HB3 OUK 81 5.777 -4.080 -2.643
168 HG2 OUK 81 HG2 OUK 81 3.685 -4.274 -1.285
169 HG3 OUK 81 HG3 OUK 81 4.610 -3.999 0.190
170 HD2 OUK 81 HD2 OUK 81 5.976 -6.055 -0.307
171 HD3 OUK 81 HD3 OUK 81 5.002 -6.344 -1.752
172 HE2 OUK 81 HE2 OUK 81 2.978 -6.709 -0.392
173 HE3 OUK 81 HE3 OUK 81 3.826 -6.181 1.077
174 HZ3 OUK 81 HZ3 OUK 81 4.441 -8.666 -0.449
175 HZ1 OUK 81 HZ1 OUK 81 3.644 -8.570 1.022
176 HZ2 OUK 81 HZ2 OUK 81 5.245 -8.121 0.922
177 HM3 OUK 81 HM3 OUK 81 7.626 -1.590 -1.931
178 HM2 OUK 81 HM2 OUK 81 6.812 -2.058 -3.431
179 HN2 OUK 81 HN2 OUK 81 5.947 0.077 -3.698
180 H OUI 82 H OUI 82 6.039 2.206 -3.506
181 HA OUI 82 HA OUI 82 6.820 3.362 -0.877
182 HB OUI 82 HB OUI 82 6.932 5.557 -2.055
183 3HG1 OUI 82 3HG1 OUI 82 6.828 3.911 -4.654
184 2HG1 OUI 82 2HG1 OUI 82 5.550 4.967 -4.084
185 1HG2 OUI 82 1HG2 OUI 82 8.938 4.146 -1.519
186 2HG2 OUI 82 2HG2 OUI 82 9.207 5.216 -2.887
187 3HG2 OUI 82 3HG2 OUI 82 8.904 3.489 -3.160
188 2HD1 OUI 82 2HD1 OUI 82 8.347 5.866 -4.928
189 3HD1 OUI 82 3HD1 OUI 82 7.118 6.925 -4.201
190 1HD1 OUI 82 1HD1 OUI 82 6.819 6.156 -5.764
191 HM2 OUI 82 HM2 OUI 82 4.360 4.074 -2.536
192 HM3 OUI 82 HM3 OUI 82 4.845 4.785 -0.986
193 HN2 OUI 82 HN2 OUI 82 4.383 1.871 -1.207
194 H OUH 83 H OUH 83 3.809 0.895 0.533
195 HA OUH 83 HA OUH 83 3.012 2.485 2.912
196 HB2 OUH 83 HB2 OUH 83 2.658 0.384 4.062
197 HB3 OUH 83 HB3 OUH 83 3.388 -0.534 2.763
198 HD2 OUH 83 HD2 OUH 83 0.514 2.185 2.430
199 HD1 OUH 83 HD1 OUH 83 1.419 -1.860 1.618
200 HE1 OUH 83 HE1 OUH 83 -0.858 -1.203 0.578
201 HM2 OUH 83 HM2 OUH 83 4.961 1.431 4.130
202 HM3 OUH 83 HM3 OUH 83 5.407 2.622 2.902
203 HN2 OUH 83 HN2 OUH 83 5.694 0.499 1.411
204 H ARG 84 H ARG 84 7.738 -0.074 0.991
205 HA ARG 84 HA ARG 84 9.777 -0.545 3.046
206 HB2 ARG 84 HB2 ARG 84 9.896 -1.400 0.698
207 HB3 ARG 84 HB3 ARG 84 9.983 0.264 0.100
208 HG2 ARG 84 HG2 ARG 84 12.153 0.569 1.304
209 HG3 ARG 84 HG3 ARG 84 12.040 -1.101 1.892
210 HD2 ARG 84 HD2 ARG 84 12.078 -1.886 -0.480
211 HD3 ARG 84 HD3 ARG 84 12.187 -0.207 -1.021
212 HE ARG 84 HE ARG 84 14.361 0.012 -0.027
213 HH11 ARG 84 1HH1 ARG 84 16.392 -0.912 0.351
214 HH12 ARG 84 2HH1 ARG 84 16.518 -2.648 0.492
215 HH21 ARG 84 1HH2 ARG 84 14.976 -3.900 0.017
216 HH22 ARG 84 2HH2 ARG 84 13.375 -3.313 -0.428
217 H LYS 85 H LYS 85 8.348 2.250 1.618
218 HA LYS 85 HA LYS 85 10.020 4.205 2.992
219 HB2 LYS 85 HB2 LYS 85 10.422 3.462 0.105
220 HB3 LYS 85 HB3 LYS 85 10.193 5.175 0.383
221 HG2 LYS 85 HG2 LYS 85 12.019 4.907 2.252
222 HG3 LYS 85 HG3 LYS 85 12.372 3.375 1.427
223 HD2 LYS 85 HD2 LYS 85 13.829 4.961 0.495
224 HD3 LYS 85 HD3 LYS 85 12.586 4.733 -0.735
225 HE2 LYS 85 HE2 LYS 85 11.461 6.829 -0.043
226 HE3 LYS 85 HE3 LYS 85 12.587 7.015 1.305
227 HZ1 LYS 85 HZ1 LYS 85 13.286 8.387 -0.508
228 HZ2 LYS 85 HZ2 LYS 85 14.396 7.215 -0.324
229 HZ3 LYS 85 HZ3 LYS 85 13.342 7.109 -1.570
230 H ASP 86 H ASP 86 9.443 6.373 2.297
231 HA ASP 86 HA ASP 86 6.809 6.882 1.136
232 HB2 ASP 86 HB2 ASP 86 6.687 6.560 3.681
233 HB3 ASP 86 HB3 ASP 86 7.719 7.960 3.837
234 H1 HOH 201 H1 HOH 156 -1.584 4.258 0.656
235 H2 HOH 201 H2 HOH 156 -2.446 3.855 1.842
236 H1 HOH 202 H1 HOH 85 0.052 -5.498 11.522
237 H2 HOH 202 H2 HOH 85 -0.929 -5.723 10.392
238 H1 HOH 203 H1 HOH 46 -3.141 -6.889 9.255
239 H2 HOH 203 H2 HOH 46 -3.531 -8.345 9.401
240 H1 HOH 204 H1 HOH 90 -5.479 -4.417 11.070
241 H2 HOH 204 H2 HOH 90 -5.732 -4.290 12.559
242 H1 HOH 205 H1 HOH 188 3.530 7.471 2.767
243 H2 HOH 205 H2 HOH 188 3.092 7.667 4.198
244 H1 HOH 206 H1 HOH 177 3.663 3.245 -9.910
245 H2 HOH 206 H2 HOH 177 4.190 2.399 -11.047
246 H1 HOH 207 H1 HOH 65 -5.405 -5.511 9.038
247 H2 HOH 207 H2 HOH 65 -5.289 -6.860 8.365
248 H1 HOH 208 H1 HOH 184 4.664 11.438 4.263
249 H2 HOH 208 H2 HOH 184 5.404 10.198 4.714
250 H1 HOH 209 H1 HOH 186 3.654 9.231 1.528
251 H2 HOH 209 H2 HOH 186 2.251 8.942 2.014
252 H1 HOH 210 H1 HOH 36 3.145 -10.524 -12.875
253 H2 HOH 210 H2 HOH 36 2.706 -9.592 -11.764
254 H1 HOH 211 H1 HOH 34 -0.753 -9.296 -13.105
255 H2 HOH 211 H2 HOH 34 0.043 -9.527 -11.838
256 H1 HOH 212 H1 HOH 51 1.819 -7.150 -6.490
257 H2 HOH 212 H2 HOH 51 1.981 -8.110 -7.646
258 H1 HOH 213 H1 HOH 79 -1.218 -0.749 10.270
259 H2 HOH 213 H2 HOH 79 -1.191 -0.004 11.588
260 H1 HOH 214 H1 HOH 171 -2.248 2.941 -11.098
261 H2 HOH 214 H2 HOH 171 -1.283 2.632 -9.980
262 H1 HOH 215 H1 HOH 151 -1.325 6.095 -8.740
263 H2 HOH 215 H2 HOH 151 -1.078 4.605 -8.719
264 H1 HOH 216 H1 HOH 183 5.579 7.326 5.480
265 H2 HOH 216 H2 HOH 183 5.914 7.488 6.945
266 H1 HOH 217 H1 HOH 35 1.537 -10.652 -8.204
267 H2 HOH 217 H2 HOH 35 0.969 -10.113 -9.496
268 H1 HOH 218 H1 HOH 92 3.582 -7.835 -10.232
269 H2 HOH 218 H2 HOH 92 4.309 -8.586 -11.328
270 H1 HOH 219 H1 HOH 123 -8.404 4.412 5.598
271 H2 HOH 219 H2 HOH 123 -9.754 4.389 6.284
272 H1 HOH 220 H1 HOH 185 -2.390 5.836 8.039
273 H2 HOH 220 H2 HOH 185 -2.936 4.427 7.942
274 H1 HOH 221 H1 HOH 117 12.622 2.349 3.561
275 H2 HOH 221 H2 HOH 117 13.094 3.484 4.446
276 H1 HOH 222 H1 HOH 47 -7.770 -10.653 -1.637
277 H2 HOH 222 H2 HOH 47 -7.017 -11.876 -2.113
278 H1 HOH 223 H1 HOH 45 -2.793 -6.832 2.520
279 H2 HOH 223 H2 HOH 45 -4.022 -6.037 2.910
280 H1 HOH 224 H1 HOH 198 13.827 7.151 -3.878
281 H2 HOH 224 H2 HOH 198 14.448 5.815 -3.536
282 H1 HOH 225 H1 HOH 25 -12.130 -9.078 -5.552
283 H2 HOH 225 H2 HOH 25 -11.700 -10.250 -6.404
284 H1 HOH 226 H1 HOH 84 -4.464 2.964 8.627
285 H2 HOH 226 H2 HOH 84 -4.897 4.402 8.797
286 H1 HOH 227 H1 HOH 122 -10.925 8.631 -3.154
287 H2 HOH 227 H2 HOH 122 -12.118 7.733 -3.405
288 H1 HOH 228 H1 HOH 13 -13.027 -4.473 5.817
289 H2 HOH 228 H2 HOH 13 -11.898 -3.491 5.608
290 H1 HOH 229 H1 HOH 105 18.494 -0.769 0.046
291 H2 HOH 229 H2 HOH 105 18.585 0.742 0.015
292 H1 HOH 230 H1 HOH 102 17.254 -5.235 0.290
293 H2 HOH 230 H2 HOH 102 17.201 -4.555 -1.063
294 H1 HOH 231 H1 HOH 39 4.931 -10.100 2.708
295 H2 HOH 231 H2 HOH 39 4.157 -8.944 3.317
296 H1 HOH 232 H1 HOH 139 -10.798 2.893 -1.809
297 H2 HOH 232 H2 HOH 139 -11.473 3.677 -0.701
298 H1 HOH 233 H1 HOH 22 -1.655 -13.416 -6.164
299 H2 HOH 233 H2 HOH 22 -2.004 -14.712 -5.459
300 H1 HOH 234 H1 HOH 190 -9.348 9.973 3.317
301 H2 HOH 234 H2 HOH 190 -10.576 10.296 2.490
302 H1 HOH 235 H1 HOH 140 -9.249 6.220 4.475
303 H2 HOH 235 H2 HOH 140 -8.379 7.454 4.578
304 H1 HOH 236 H1 HOH 33 -5.101 -12.132 -11.857
305 H2 HOH 236 H2 HOH 33 -3.641 -12.323 -12.224
306 H1 HOH 237 H1 HOH 77 7.040 -6.465 1.912
307 H2 HOH 237 H2 HOH 77 7.439 -7.891 2.231
308 H1 HOH 238 H1 HOH 6 -16.645 -3.687 2.997
309 H2 HOH 238 H2 HOH 6 -17.314 -2.559 3.759
310 H1 HOH 239 H1 HOH 181 -10.503 10.944 -0.602
311 H2 HOH 239 H2 HOH 181 -10.968 10.388 -1.934
312 H1 HOH 240 H1 HOH 24 -4.284 -16.290 -8.135
313 H2 HOH 240 H2 HOH 24 -3.171 -16.463 -9.145
314 H1 HOH 241 H1 HOH 75 5.872 -7.522 -8.121
315 H2 HOH 241 H2 HOH 75 5.729 -7.525 -9.628
316 H1 HOH 242 H1 HOH 99 12.196 -5.190 -11.026
317 H2 HOH 242 H2 HOH 99 11.744 -6.599 -10.688
318 H1 HOH 243 H1 HOH 161 1.737 5.555 -7.070
319 H2 HOH 243 H2 HOH 161 1.255 4.261 -7.693
320 H1 HOH 244 H1 HOH 135 -12.421 -3.397 -2.527
321 H2 HOH 244 H2 HOH 135 -11.538 -2.179 -2.707
322 H1 HOH 245 H1 HOH 15 -17.240 -1.052 5.466
323 H2 HOH 245 H2 HOH 15 -17.270 -2.314 6.304
324 H1 HOH 246 H1 HOH 64 2.270 -10.781 0.308
325 H2 HOH 246 H2 HOH 64 3.184 -10.580 -0.885
326 H1 HOH 247 H1 HOH 176 2.166 -2.650 -12.081
327 H2 HOH 247 H2 HOH 176 3.158 -2.756 -13.217
328 H1 HOH 248 H1 HOH 21 -2.048 -14.267 -12.610
329 H2 HOH 248 H2 HOH 21 -1.783 -13.212 -11.554
330 H1 HOH 249 H1 HOH 95 15.156 2.741 -0.930
331 H2 HOH 249 H2 HOH 95 13.855 2.218 -1.505
332 H1 HOH 250 H1 HOH 163 0.310 5.132 1.238
333 H2 HOH 250 H2 HOH 163 0.765 5.188 -0.203
334 H1 HOH 251 H1 HOH 112 11.181 -8.929 -11.670
335 H2 HOH 251 H2 HOH 112 10.972 -8.770 -10.180
336 H1 HOH 252 H1 HOH 91 9.162 0.675 6.630
337 H2 HOH 252 H2 HOH 91 10.198 0.825 5.539
338 H1 HOH 253 H1 HOH 67 -0.959 -10.134 -8.530
339 H2 HOH 253 H2 HOH 67 -2.030 -9.984 -7.469
340 H1 HOH 254 H1 HOH 175 -3.025 -0.554 -10.298
341 H2 HOH 254 H2 HOH 175 -3.057 0.906 -9.891
342 H1 HOH 255 H1 HOH 103 15.499 0.652 -1.940
343 H2 HOH 255 H2 HOH 103 16.809 -0.085 -1.767
344 H1 HOH 256 H1 HOH 159 -1.536 -1.231 -11.897
345 H2 HOH 256 H2 HOH 159 -2.270 -2.535 -11.673
346 H1 HOH 257 H1 HOH 58 -1.856 -9.857 -5.119
347 H2 HOH 257 H2 HOH 58 -1.769 -11.161 -5.881
348 H1 HOH 258 H1 HOH 42 -0.696 -6.671 8.312
349 H2 HOH 258 H2 HOH 42 -1.933 -7.272 7.682
350 H1 HOH 259 H1 HOH 109 19.900 -2.725 0.871
351 H2 HOH 259 H2 HOH 109 18.655 -2.350 1.649
352 H1 HOH 260 H1 HOH 143 -4.473 -6.380 -11.790
353 H2 HOH 260 H2 HOH 143 -3.387 -7.433 -11.719
354 H1 HOH 261 H1 HOH 63 4.073 -6.076 3.394
355 H2 HOH 261 H2 HOH 63 5.270 -6.958 3.099
356 H1 HOH 262 H1 HOH 142 -2.569 -4.986 -12.257
357 H2 HOH 262 H2 HOH 142 -1.483 -4.181 -12.948
358 H1 HOH 263 H1 HOH 191 9.215 -5.526 -13.850
359 H2 HOH 263 H2 HOH 191 8.726 -6.834 -14.438
360 H1 HOH 264 H1 HOH 98 14.370 -1.274 -2.932
361 H2 HOH 264 H2 HOH 98 14.317 -2.748 -3.270
362 H1 HOH 265 H1 HOH 8 -15.710 -5.788 3.715
363 H2 HOH 265 H2 HOH 8 -15.017 -5.300 2.461
364 H1 HOH 266 H1 HOH 193 8.455 -0.149 -9.456
365 H2 HOH 266 H2 HOH 193 9.465 -0.821 -8.547
366 H1 HOH 267 H1 HOH 73 9.196 -1.353 5.372
367 H2 HOH 267 H2 HOH 73 7.963 -2.148 4.988
368 H1 HOH 268 H1 HOH 114 11.193 -5.888 -8.656
369 H2 HOH 268 H2 HOH 114 11.352 -5.997 -7.151
370 H1 HOH 269 H1 HOH 113 7.673 -6.481 -7.819
371 H2 HOH 269 H2 HOH 113 9.033 -6.039 -7.317
372 H1 HOH 270 H1 HOH 127 -13.066 7.600 0.823
373 H2 HOH 270 H2 HOH 127 -12.679 6.919 2.117
374 H1 HOH 271 H1 HOH 70 7.210 -8.113 -2.146
375 H2 HOH 271 H2 HOH 70 5.962 -8.634 -2.829
376 H1 HOH 272 H1 HOH 48 5.258 -11.715 -1.305
377 H2 HOH 272 H2 HOH 48 5.430 -10.305 -1.825
378 H1 HOH 273 H1 HOH 196 11.837 -2.777 -11.796
379 H2 HOH 273 H2 HOH 196 13.224 -3.298 -12.110
380 H1 HOH 274 H1 HOH 148 0.762 -3.604 -13.579
381 H2 HOH 274 H2 HOH 148 0.166 -4.043 -14.899
382 H1 HOH 275 H1 HOH 20 -7.423 -12.620 -10.944
383 H2 HOH 275 H2 HOH 20 -6.482 -13.786 -11.175
384 H1 HOH 276 H1 HOH 19 -0.783 -11.350 -11.430
385 H2 HOH 276 H2 HOH 19 -0.194 -11.800 -10.109
386 H1 HOH 277 H1 HOH 166 1.580 6.110 2.883
387 H2 HOH 277 H2 HOH 166 0.390 5.569 3.645
388 H1 HOH 278 H1 HOH 66 5.812 -1.681 5.681
389 H2 HOH 278 H2 HOH 66 5.545 -3.141 5.385
390 H1 HOH 279 H1 HOH 108 17.118 -3.019 3.312
391 H2 HOH 279 H2 HOH 108 18.163 -2.189 4.027
392 H1 HOH 280 H1 HOH 124 -14.055 9.494 -0.316
393 H2 HOH 280 H2 HOH 124 -12.550 9.665 -0.258
394 H1 HOH 281 H1 HOH 189 9.390 11.984 3.605
395 H2 HOH 281 H2 HOH 189 9.923 11.667 2.222
396 H1 HOH 282 H1 HOH 154 -4.286 1.616 -7.062
397 H2 HOH 282 H2 HOH 154 -4.773 0.231 -7.420
398 H1 HOH 283 H1 HOH 147 -6.326 -9.817 -12.338
399 H2 HOH 283 H2 HOH 147 -4.834 -9.938 -12.128
400 H1 HOH 284 H1 HOH 164 -6.791 8.385 -1.506
401 H2 HOH 284 H2 HOH 164 -6.640 7.180 -2.412
402 H1 HOH 285 H1 HOH 74 5.359 -5.422 -5.792
403 H2 HOH 285 H2 HOH 74 6.641 -6.163 -6.118
404 H1 HOH 286 H1 HOH 126 -12.017 -3.738 -6.084
405 H2 HOH 286 H2 HOH 126 -11.772 -3.076 -4.743
406 H1 HOH 287 H1 HOH 40 4.905 -3.349 2.554
407 H2 HOH 287 H2 HOH 40 5.986 -2.606 3.311
408 H1 HOH 288 H1 HOH 11 -7.368 -5.465 9.359
409 H2 HOH 288 H2 HOH 11 -7.550 -4.737 10.673
410 H1 HOH 289 H1 HOH 172 3.942 5.614 -6.851
411 H2 HOH 289 H2 HOH 172 3.271 4.323 -6.441
412 H1 HOH 290 H1 HOH 179 2.211 7.743 -7.834
413 H2 HOH 290 H2 HOH 179 3.314 6.881 -8.413
414 H1 HOH 291 H1 HOH 173 -9.119 11.089 1.015
415 H2 HOH 291 H2 HOH 173 -8.870 12.523 0.600
416 H1 HOH 292 H1 HOH 29 -5.164 -13.964 -4.383
417 H2 HOH 292 H2 HOH 29 -3.662 -13.872 -4.571
418 H1 HOH 293 H1 HOH 129 -12.853 5.133 0.515
419 H2 HOH 293 H2 HOH 129 -13.826 4.338 -0.327
420 H1 HOH 294 H1 HOH 155 -1.750 5.716 -3.776
421 H2 HOH 294 H2 HOH 155 -3.156 5.390 -3.312
422 H1 HOH 295 H1 HOH 119 -12.685 2.848 1.134
423 H2 HOH 295 H2 HOH 119 -13.491 1.576 1.290
424 H1 HOH 296 H1 HOH 162 -5.182 0.227 -10.285
425 H2 HOH 296 H2 HOH 162 -6.046 0.914 -11.321
426 H1 HOH 297 H1 HOH 26 -7.529 -14.061 -4.343
427 H2 HOH 297 H2 HOH 26 -7.267 -14.015 -5.834
428 H1 HOH 298 H1 HOH 23 -5.207 -15.562 -10.193
429 H2 HOH 298 H2 HOH 23 -5.646 -15.921 -11.597
430 H1 HOH 299 H1 HOH 87 8.174 2.217 8.411
431 H2 HOH 299 H2 HOH 87 8.113 2.922 7.076
432 H1 HOH 300 H1 HOH 54 6.759 -11.692 2.493
433 H2 HOH 300 H2 HOH 54 6.866 -10.811 1.265
434 H1 HOH 301 H1 HOH 101 15.439 -4.488 4.348
435 H2 HOH 301 H2 HOH 101 14.877 -3.168 3.865
436 H1 HOH 302 H1 HOH 72 5.185 0.282 6.963
437 H2 HOH 302 H2 HOH 72 4.717 -0.961 7.685
438 H1 HOH 303 H1 HOH 100 16.370 -4.149 -3.216
439 H2 HOH 303 H2 HOH 100 15.655 -3.978 -4.541
440 H1 HOH 304 H1 HOH 131 -12.928 11.057 2.861
441 H2 HOH 304 H2 HOH 131 -12.725 10.058 1.742
442 H1 HOH 305 H1 HOH 136 -9.863 3.677 8.452
443 H2 HOH 305 H2 HOH 136 -10.749 2.587 7.892
444 H1 HOH 306 H1 HOH 165 -7.438 -0.421 -9.829
445 H2 HOH 306 H2 HOH 165 -8.650 -0.117 -8.977
446 H1 HOH 307 H1 HOH 174 -8.012 -2.447 -10.140
447 H2 HOH 307 H2 HOH 174 -7.194 -2.738 -11.380
448 H1 HOH 308 H1 HOH 31 -0.112 -12.036 -7.450
449 H2 HOH 308 H2 HOH 31 0.108 -11.585 -6.021
450 H1 HOH 309 H1 HOH 153 5.374 7.398 -9.270
451 H2 HOH 309 H2 HOH 153 4.825 6.399 -10.267
452 H1 HOH 310 H1 HOH 115 14.633 0.613 5.772
453 H2 HOH 310 H2 HOH 115 14.105 1.177 4.471
454 H1 HOH 311 H1 HOH 128 -12.339 2.967 4.602
455 H2 HOH 311 H2 HOH 128 -12.993 2.364 3.375
456 H1 HOH 312 H1 HOH 180 5.415 3.280 -8.773
457 H2 HOH 312 H2 HOH 180 5.449 3.907 -7.395
458 H1 HOH 313 H1 HOH 137 -12.514 1.733 -4.592
459 H2 HOH 313 H2 HOH 137 -12.296 0.504 -5.449
460 H1 HOH 314 H1 HOH 16 -8.049 -1.799 9.198
461 H2 HOH 314 H2 HOH 16 -8.398 -3.272 9.254
462 H1 HOH 315 H1 HOH 76 7.319 -9.966 -0.904
463 H2 HOH 315 H2 HOH 76 8.491 -10.886 -0.633
464 H1 HOH 316 H1 HOH 10 -7.204 -6.212 7.191
465 H2 HOH 316 H2 HOH 10 -8.591 -5.688 6.870
466 H1 HOH 317 H1 HOH 138 -13.610 -0.630 -4.073
467 H2 HOH 317 H2 HOH 138 -13.727 -2.075 -4.508
468 H1 HOH 318 H1 HOH 52 1.852 -11.966 2.593
469 H2 HOH 318 H2 HOH 52 2.883 -10.903 2.269
470 H1 HOH 319 H1 HOH 38 -8.373 -12.976 -7.788
471 H2 HOH 319 H2 HOH 38 -8.292 -14.484 -7.883
472 H1 HOH 320 H1 HOH 97 14.162 -5.250 -3.297
473 H2 HOH 320 H2 HOH 97 14.001 -6.683 -2.839
474 H1 HOH 321 H1 HOH 132 -16.787 1.134 5.587
475 H2 HOH 321 H2 HOH 132 -18.300 1.208 5.634
476 H1 HOH 322 H1 HOH 121 -14.851 0.756 -0.388
477 H2 HOH 322 H2 HOH 121 -15.873 1.076 0.680
478 H1 HOH 323 H1 HOH 55 0.787 -9.298 0.041
479 H2 HOH 323 H2 HOH 55 -0.704 -9.266 0.306
480 H1 HOH 324 H1 HOH 182 -11.531 -5.672 -7.523
481 H2 HOH 324 H2 HOH 182 -12.635 -6.100 -6.580
482 H1 HOH 325 H1 HOH 28 -9.410 -13.990 -2.414
483 H2 HOH 325 H2 HOH 28 -8.569 -12.821 -2.886
484 H1 HOH 326 H1 HOH 152 -4.858 6.070 -1.401
485 H2 HOH 326 H2 HOH 152 -5.112 5.794 -2.866
486 H1 HOH 327 H1 HOH 170 -8.328 11.260 -1.356
487 H2 HOH 327 H2 HOH 170 -7.295 11.589 -2.415
488 H1 HOH 328 H1 HOH 157 -11.518 -1.341 -6.343
489 H2 HOH 328 H2 HOH 157 -11.657 -0.560 -7.634
490 H1 HOH 329 H1 HOH 118 -14.485 -8.976 -4.520
491 H2 HOH 329 H2 HOH 118 -14.129 -9.116 -5.983
492 H1 HOH 330 H1 HOH 89 10.640 5.791 7.006
493 H2 HOH 330 H2 HOH 89 10.479 6.451 5.655
494 H1 HOH 331 H1 HOH 50 2.546 -4.617 2.979
495 H2 HOH 331 H2 HOH 50 3.532 -4.205 4.059
496 H1 HOH 332 H1 HOH 107 12.667 -2.126 4.669
497 H2 HOH 332 H2 HOH 107 13.894 -1.263 4.464
498 H1 HOH 333 H1 HOH 144 -7.725 -6.122 -11.137
499 H2 HOH 333 H2 HOH 144 -8.238 -4.778 -10.663
500 H1 HOH 334 H1 HOH 134 -14.611 2.238 5.151
501 H2 HOH 334 H2 HOH 134 -15.186 2.612 6.502
502 H1 HOH 335 H1 HOH 96 18.573 -3.488 -2.601
503 H2 HOH 335 H2 HOH 96 18.692 -4.931 -3.040
504 H1 HOH 336 H1 HOH 27 -9.427 -11.380 -10.472
505 H2 HOH 336 H2 HOH 27 -9.692 -12.833 -10.145
506 H1 HOH 337 H1 HOH 145 -6.458 -6.554 -13.027
507 H2 HOH 337 H2 HOH 145 -6.042 -7.655 -12.073
508 H1 HOH 338 H1 HOH 158 -9.388 10.450 -3.216
509 H2 HOH 338 H2 HOH 158 -10.279 10.682 -4.420
510 H1 HOH 339 H1 HOH 41 4.179 -8.613 -4.590
511 H2 HOH 339 H2 HOH 41 5.272 -7.571 -4.703
512 H1 HOH 340 H1 HOH 197 12.677 3.323 -3.230
513 H2 HOH 340 H2 HOH 197 11.575 2.496 -2.606
514 H1 HOH 341 H1 HOH 125 -14.658 -0.289 -2.566
515 H2 HOH 341 H2 HOH 125 -14.693 1.209 -2.768
516 H1 HOH 342 H1 HOH 187 7.052 11.869 4.477
517 H2 HOH 342 H2 HOH 187 7.659 13.199 4.865
518 H1 HOH 343 H1 HOH 130 -14.351 -2.922 -2.356
519 H2 HOH 343 H2 HOH 130 -14.829 -4.077 -1.500
520 H1 HOH 344 H1 HOH 44 0.661 -5.593 3.718
521 H2 HOH 344 H2 HOH 44 0.643 -6.269 2.364
522 H1 HOH 345 H1 HOH 82 7.158 5.373 6.366
523 H2 HOH 345 H2 HOH 82 8.610 4.938 6.348
524 H1 HOH 346 H1 HOH 86 1.135 -0.723 10.772
525 H2 HOH 346 H2 HOH 86 2.190 0.341 10.570
526 H1 HOH 347 H1 HOH 18 -12.425 -11.583 -0.191
527 H2 HOH 347 H2 HOH 18 -11.402 -12.487 0.469
528 H1 HOH 348 H1 HOH 149 -2.968 4.961 -7.236
529 H2 HOH 348 H2 HOH 149 -3.169 5.016 -5.734
530 H1 HOH 349 H1 HOH 56 0.286 -8.857 -2.094
531 H2 HOH 349 H2 HOH 56 1.506 -9.747 -2.032
532 H1 HOH 350 H1 HOH 68 1.140 -9.382 -5.761
533 H2 HOH 350 H2 HOH 68 0.807 -9.850 -4.358
534 H1 HOH 351 H1 HOH 146 -9.886 -6.281 -9.294
535 H2 HOH 351 H2 HOH 146 -11.306 -6.186 -9.802
536 H1 HOH 352 H1 HOH 78 8.247 -4.634 2.578
537 H2 HOH 352 H2 HOH 78 6.955 -4.116 1.978
538 H1 HOH 353 H1 HOH 7 -13.510 -5.496 0.374
539 H2 HOH 353 H2 HOH 7 -15.014 -5.643 0.385
540 H1 HOH 354 H1 HOH 5 -12.093 -13.437 -5.059
541 H2 HOH 354 H2 HOH 5 -13.116 -13.287 -3.952
542 H1 HOH 355 H1 HOH 104 10.298 -5.518 2.659
543 H2 HOH 355 H2 HOH 104 11.577 -6.263 2.333
544 H1 HOH 356 H1 HOH 116 16.276 4.357 3.446
545 H2 HOH 356 H2 HOH 116 14.908 3.857 3.034
546 H1 HOH 357 H1 HOH 133 -18.529 -2.456 0.132
547 H2 HOH 357 H2 HOH 133 -17.559 -2.850 1.227
548 H1 HOH 358 H1 HOH 167 -6.370 5.907 -4.738
549 H2 HOH 358 H2 HOH 167 -5.639 7.227 -4.634
550 H1 HOH 359 H1 HOH 88 4.989 5.185 6.637
551 H2 HOH 359 H2 HOH 88 5.801 3.931 6.872
552 H1 HOH 360 H1 HOH 37 -9.918 -14.022 -4.587
553 H2 HOH 360 H2 HOH 37 -9.859 -14.067 -6.100
554 H1 HOH 361 H1 HOH 178 -11.536 4.199 -4.714
555 H2 HOH 361 H2 HOH 178 -11.054 2.853 -5.214
556 H1 HOH 362 H1 HOH 43 9.734 -6.180 0.474
557 H2 HOH 362 H2 HOH 43 8.384 -5.513 0.385
558 H1 HOH 363 H1 HOH 60 0.684 -5.151 5.942
559 H2 HOH 363 H2 HOH 60 -0.331 -6.271 5.950
560 H1 HOH 364 H1 HOH 49 9.411 -5.057 4.731
561 H2 HOH 364 H2 HOH 49 9.360 -3.666 4.149
562 H1 HOH 365 H1 HOH 4 -13.112 -11.883 -6.143
563 H2 HOH 365 H2 HOH 4 -13.663 -11.842 -7.553
564 H1 HOH 366 H1 HOH 62 -5.282 -13.499 -2.471
565 H2 HOH 366 H2 HOH 62 -6.452 -14.271 -1.901
566 H1 HOH 367 H1 HOH 32 -8.655 -16.339 -9.466
567 H2 HOH 367 H2 HOH 32 -7.422 -15.531 -9.816
568 H1 HOH 368 H1 HOH 14 -13.257 -9.686 0.898
569 H2 HOH 368 H2 HOH 14 -14.129 -9.696 -0.337
570 H1 HOH 369 H1 HOH 93 10.885 -10.936 -13.087
571 H2 HOH 369 H2 HOH 93 12.360 -10.675 -12.862
572 H1 HOH 370 H1 HOH 168 -10.278 1.131 -6.539
573 H2 HOH 370 H2 HOH 168 -9.106 2.075 -6.346
574 H1 HOH 371 H1 HOH 17 -9.626 -3.672 7.819
575 H2 HOH 371 H2 HOH 17 -9.720 -5.015 8.503
576 H1 HOH 372 H1 HOH 9 -12.858 -7.992 2.771
577 H2 HOH 372 H2 HOH 9 -13.532 -7.402 1.549
578 H1 HOH 373 H1 HOH 110 12.163 -1.840 -4.252
579 H2 HOH 373 H2 HOH 110 10.996 -2.656 -4.778
580 H1 HOH 374 H1 HOH 30 -0.370 -16.202 -4.390
581 H2 HOH 374 H2 HOH 30 -1.755 -16.573 -3.905
582 H1 HOH 375 H1 HOH 194 7.145 1.903 -8.635
583 H2 HOH 375 H2 HOH 194 6.408 1.331 -9.824
584 H1 HOH 376 H1 HOH 80 1.110 2.277 10.452
585 H2 HOH 376 H2 HOH 80 2.354 2.644 9.669
586 H1 HOH 377 H1 HOH 169 -6.550 1.730 -6.492
587 H2 HOH 377 H2 HOH 169 -7.034 3.121 -6.137
588 H1 HOH 378 H1 HOH 111 9.421 -4.446 -5.554
589 H2 HOH 378 H2 HOH 111 9.796 -4.748 -4.119
590 H1 HOH 379 H1 HOH 61 -4.540 -11.785 1.652
591 H2 HOH 379 H2 HOH 61 -4.670 -11.031 2.959
592 H1 HOH 380 H1 HOH 2 -12.628 -13.369 -1.561
593 H2 HOH 380 H2 HOH 2 -13.266 -14.706 -1.877
594 H1 HOH 381 H1 HOH 83 2.500 4.811 8.542
595 H2 HOH 381 H2 HOH 83 3.513 3.865 7.935
596 H1 HOH 382 H1 HOH 120 -16.773 -4.206 -0.348
597 H2 HOH 382 H2 HOH 120 -16.853 -5.412 -1.260
598 H1 HOH 383 H1 HOH 94 12.743 -5.855 -4.838
599 H2 HOH 383 H2 HOH 94 11.594 -5.037 -5.394
600 H1 HOH 384 H1 HOH 1 -14.607 -11.491 -1.031
601 H2 HOH 384 H2 HOH 1 -14.486 -12.540 -2.117
602 H1 HOH 385 H1 HOH 59 -3.851 -13.310 0.380
603 H2 HOH 385 H2 HOH 59 -5.289 -13.332 -0.096
604 H1 HOH 386 H1 HOH 150 -5.293 4.753 -6.284
605 H2 HOH 386 H2 HOH 150 -6.537 5.106 -7.073
606 H1 HOH 387 H1 HOH 192 7.488 6.247 -8.732
607 H2 HOH 387 H2 HOH 192 7.266 4.771 -8.451
608 H1 HOH 388 H1 HOH 3 -15.460 -10.571 -3.005
609 H2 HOH 388 H2 HOH 3 -16.556 -10.131 -3.955
610 H1 HOH 389 H1 HOH 12 -16.151 -8.533 -0.740
611 H2 HOH 389 H2 HOH 12 -15.431 -8.897 -2.022
612 H1 HOH 390 H1 HOH 106 10.468 -6.198 -2.703
613 H2 HOH 390 H2 HOH 106 9.275 -5.854 -1.836
614 H1 HOH 391 H1 HOH 53 4.501 -5.354 5.932
615 H2 HOH 391 H2 HOH 53 3.913 -4.149 6.634
616 H1 HOH 392 H1 HOH 69 3.703 -3.043 8.579
617 H2 HOH 392 H2 HOH 69 2.819 -4.224 8.913
618 H1 HOH 393 H1 HOH 199 6.734 8.409 -7.771
619 H2 HOH 393 H2 HOH 199 7.285 8.669 -9.157
620 H1 HOH 394 H1 HOH 81 4.858 -1.434 10.011
621 H2 HOH 394 H2 HOH 81 3.388 -1.233 9.705
622 H1 HOH 395 H1 HOH 160 5.557 9.574 -6.061
623 H2 HOH 395 H2 HOH 160 6.997 9.445 -5.609
624 H1 HOH 396 H1 HOH 71 -2.009 -11.386 0.283
625 H2 HOH 396 H2 HOH 71 -2.724 -10.467 1.249
626 H1 HOH 397 H1 HOH 141 -11.268 -5.123 -12.377
627 H2 HOH 397 H2 HOH 141 -10.193 -5.688 -11.469
628 H1 HOH 398 H1 HOH 57 -1.504 -13.694 0.037
629 H2 HOH 398 H2 HOH 57 -2.091 -13.297 -1.301
630 H1 HOH 399 H1 HOH 195 10.435 6.617 -8.011
631 H2 HOH 399 H2 HOH 195 9.548 5.405 -8.185
Start of MODEL 5
1 HA PRO 62 HA PRO 62 -10.459 -7.581 -3.976
2 HB2 PRO 62 HB2 PRO 62 -11.737 -5.554 -2.668
3 HB3 PRO 62 HB3 PRO 62 -12.225 -6.032 -4.319
4 HG2 PRO 62 HG2 PRO 62 -13.429 -7.043 -1.686
5 HG3 PRO 62 HG3 PRO 62 -14.294 -6.249 -3.038
6 HD2 PRO 62 HD2 PRO 62 -14.210 -8.908 -2.964
7 HD3 PRO 62 HD3 PRO 62 -13.863 -8.089 -4.504
8 H PHE 63 H PHE 63 -9.466 -6.131 -2.137
9 HA PHE 63 HA PHE 63 -9.365 -7.633 0.452
10 HB2 PHE 63 HB2 PHE 63 -6.966 -6.644 -1.126
11 HB3 PHE 63 HB3 PHE 63 -6.951 -7.637 0.329
12 HD1 PHE 63 HD1 PHE 63 -6.468 -7.787 -3.121
13 HD2 PHE 63 HD2 PHE 63 -8.517 -9.895 0.039
14 HE1 PHE 63 HE1 PHE 63 -6.488 -9.840 -4.502
15 HE2 PHE 63 HE2 PHE 63 -8.564 -11.936 -1.364
16 HZ PHE 63 HZ PHE 63 -7.532 -11.922 -3.634
17 H ALA 64 H ALA 64 -7.409 -6.139 1.677
18 HA ALA 64 HA ALA 64 -8.001 -3.271 1.395
19 HB1 ALA 64 HB1 ALA 64 -8.305 -4.771 4.043
20 HB2 ALA 64 HB2 ALA 64 -8.407 -3.008 3.819
21 HB3 ALA 64 HB3 ALA 64 -9.633 -4.067 3.092
22 H CYS 65 H CYS 65 -6.460 -1.947 2.643
23 HA CYS 65 HA CYS 65 -3.770 -3.204 3.030
24 HB2 CYS 65 HB2 CYS 65 -4.674 -0.347 3.457
25 HB3 CYS 65 HB3 CYS 65 -3.008 -0.939 3.387
26 H ASP 66 H ASP 66 -3.031 -3.634 5.091
27 HA ASP 66 HA ASP 66 -4.517 -3.061 7.518
28 HB2 ASP 66 HB2 ASP 66 -1.525 -3.485 7.080
29 HB3 ASP 66 HB3 ASP 66 -2.352 -3.444 8.663
30 H ILE 67 H ILE 67 -1.777 -1.446 5.962
31 HA ILE 67 HA ILE 67 -1.614 0.681 7.783
32 HB ILE 67 HB ILE 67 -0.444 0.348 5.000
33 HG12 ILE 67 2HG1 ILE 67 0.209 -1.488 6.470
34 HG13 ILE 67 3HG1 ILE 67 1.572 -0.454 6.107
35 HG21 ILE 67 HG21 ILE 67 -0.176 2.686 5.526
36 HG22 ILE 67 HG22 ILE 67 0.378 2.318 7.169
37 HG23 ILE 67 HG23 ILE 67 1.385 1.895 5.776
38 HD11 ILE 67 1HD1 ILE 67 0.039 -0.458 8.745
39 HD12 ILE 67 2HD1 ILE 67 1.620 -1.183 8.435
40 HD13 ILE 67 3HD1 ILE 67 1.440 0.572 8.355
41 H CYS 68 H CYS 68 -3.731 0.551 5.015
42 HA CYS 68 HA CYS 68 -4.419 3.428 5.499
43 HB2 CYS 68 HB2 CYS 68 -5.120 1.605 3.158
44 HB3 CYS 68 HB3 CYS 68 -5.938 3.116 3.505
45 H GLY 69 H GLY 69 -5.366 0.246 6.368
46 HA2 GLY 69 HA2 GLY 69 -7.228 -0.713 7.259
47 HA3 GLY 69 HA3 GLY 69 -7.899 0.909 7.490
48 H ARG 70 H ARG 70 -7.375 0.922 4.335
49 HA ARG 70 HA ARG 70 -10.279 0.542 3.856
50 HB2 ARG 70 HB2 ARG 70 -8.188 2.498 2.859
51 HB3 ARG 70 HB3 ARG 70 -9.780 2.364 2.099
52 HG2 ARG 70 HG2 ARG 70 -10.928 2.879 4.145
53 HG3 ARG 70 HG3 ARG 70 -9.457 2.775 5.101
54 HD2 ARG 70 HD2 ARG 70 -8.558 4.774 3.963
55 HD3 ARG 70 HD3 ARG 70 -10.047 4.880 2.991
56 HE ARG 70 HE ARG 70 -10.064 4.948 6.005
57 HH11 ARG 70 1HH1 ARG 70 -12.100 7.674 4.006
58 HH12 ARG 70 2HH1 ARG 70 -10.850 6.802 3.147
59 HH21 ARG 70 1HH2 ARG 70 -11.550 6.104 6.968
60 HH22 ARG 70 2HH2 ARG 70 -12.499 7.303 6.074
61 H LYS 71 H LYS 71 -11.166 0.050 1.855
62 HA LYS 71 HA LYS 71 -9.973 -2.450 0.977
63 HB2 LYS 71 HB2 LYS 71 -12.621 -1.166 0.217
64 HB3 LYS 71 HB3 LYS 71 -12.089 -2.786 -0.266
65 HG2 LYS 71 HG2 LYS 71 -11.838 -3.368 2.197
66 HG3 LYS 71 HG3 LYS 71 -12.553 -1.802 2.582
67 HD2 LYS 71 HD2 LYS 71 -14.306 -3.384 2.743
68 HD3 LYS 71 HD3 LYS 71 -14.600 -2.493 1.241
69 HE2 LYS 71 HE2 LYS 71 -13.508 -4.380 -0.028
70 HE3 LYS 71 HE3 LYS 71 -13.263 -5.236 1.504
71 HZ1 LYS 71 HZ1 LYS 71 -15.253 -6.077 0.454
72 HZ2 LYS 71 HZ2 LYS 71 -15.751 -5.216 1.758
73 HZ3 LYS 71 HZ3 LYS 71 -15.896 -4.602 0.260
74 H PHE 72 H PHE 72 -9.379 -3.172 -1.027
75 HA PHE 72 HA PHE 72 -9.353 -1.372 -3.346
76 HB2 PHE 72 HB2 PHE 72 -7.253 -1.051 -1.707
77 HB3 PHE 72 HB3 PHE 72 -6.673 -2.481 -2.540
78 HD1 PHE 72 HD1 PHE 72 -5.177 -1.949 -4.323
79 HD2 PHE 72 HD2 PHE 72 -8.382 0.785 -3.375
80 HE1 PHE 72 HE1 PHE 72 -4.333 -0.346 -6.016
81 HE2 PHE 72 HE2 PHE 72 -7.567 2.341 -5.136
82 HZ PHE 72 HZ PHE 72 -5.544 1.773 -6.454
83 H ALA 73 H ALA 73 -8.448 -2.450 -5.323
84 HA ALA 73 HA ALA 73 -9.757 -4.966 -5.601
85 HB1 ALA 73 HB1 ALA 73 -9.817 -3.273 -7.329
86 HB2 ALA 73 HB2 ALA 73 -8.063 -3.378 -7.562
87 HB3 ALA 73 HB3 ALA 73 -9.104 -4.759 -7.975
88 H ARG 74 H ARG 74 -6.473 -4.536 -6.895
89 HA ARG 74 HA ARG 74 -5.293 -6.795 -5.436
90 HB2 ARG 74 HB2 ARG 74 -6.604 -8.047 -7.096
91 HB3 ARG 74 HB3 ARG 74 -5.948 -7.052 -8.401
92 HG2 ARG 74 HG2 ARG 74 -3.639 -7.940 -7.839
93 HG3 ARG 74 HG3 ARG 74 -4.392 -9.028 -6.663
94 HD2 ARG 74 HD2 ARG 74 -5.572 -10.198 -8.408
95 HD3 ARG 74 HD3 ARG 74 -5.245 -8.907 -9.572
96 HE ARG 74 HE ARG 74 -3.099 -10.677 -8.427
97 HH11 ARG 74 1HH1 ARG 74 -4.585 -9.296 -11.323
98 HH12 ARG 74 2HH1 ARG 74 -3.318 -9.950 -12.327
99 HH21 ARG 74 1HH2 ARG 74 -1.904 -11.290 -11.590
100 HH22 ARG 74 2HH2 ARG 74 -1.471 -11.338 -9.888
101 H SER 75 H SER 75 -4.960 -4.864 -8.434
102 HA SER 75 HA SER 75 -3.184 -3.784 -9.368
103 HB2 SER 75 HB2 SER 75 -2.996 -2.926 -6.473
104 HB3 SER 75 HB3 SER 75 -2.316 -2.040 -7.861
105 HG SER 75 HG SER 75 -4.231 -1.496 -8.525
106 H1 OUD 76 H OUD 76 -2.044 -6.061 -9.652
107 HA OUD 76 HA OUD 76 0.432 -6.215 -8.021
108 HB3 OUD 76 HB3 OUD 76 -1.049 -8.240 -8.523
109 HB2 OUD 76 HB2 OUD 76 -0.476 -8.164 -10.180
110 HM3 OUD 76 HM3 OUD 76 1.962 -5.993 -9.779
111 HM2 OUD 76 HM2 OUD 76 0.752 -6.326 -11.014
112 HN2 OUD 76 HN2 OUD 76 -0.117 -4.104 -10.794
113 H OUE 77 H OUE 77 -0.202 -2.051 -10.107
114 HA OUE 77 HA OUE 77 2.268 -0.933 -8.865
115 HB3 OUE 77 HB3 OUE 77 1.593 0.098 -10.983
116 HB2 OUE 77 HB2 OUE 77 -0.045 0.320 -10.409
117 HG3 OUE 77 HG3 OUE 77 1.153 2.450 -10.401
118 HG2 OUE 77 HG2 OUE 77 0.677 2.022 -8.777
119 HM2 OUE 77 HM2 OUE 77 -0.539 -0.182 -7.926
120 HM3 OUE 77 HM3 OUE 77 1.011 0.337 -7.234
121 HN2 OUE 77 HN2 OUE 77 0.455 -2.536 -7.240
122 H1 OUK 78 H OUK 78 -0.964 -3.418 -5.774
123 HA OUK 78 HA OUK 78 0.627 -2.849 -3.345
124 HB2 OUK 78 HB2 OUK 78 -0.442 -5.027 -2.482
125 HB3 OUK 78 HB3 OUK 78 -1.526 -4.969 -3.860
126 HG2 OUK 78 HG2 OUK 78 -2.190 -2.564 -2.925
127 HG3 OUK 78 HG3 OUK 78 -1.424 -3.132 -1.442
128 HD2 OUK 78 HD2 OUK 78 -2.986 -5.231 -1.640
129 HD3 OUK 78 HD3 OUK 78 -3.784 -4.385 -2.956
130 HE2 OUK 78 HE2 OUK 78 -5.123 -3.844 -1.052
131 HE3 OUK 78 HE3 OUK 78 -4.099 -2.408 -1.256
132 HZ3 OUK 78 HZ3 OUK 78 -2.617 -3.585 0.496
133 HZ1 OUK 78 HZ1 OUK 78 -3.978 -4.489 0.836
134 HZ2 OUK 78 HZ2 OUK 78 -4.030 -2.825 0.978
135 HM3 OUK 78 HM3 OUK 78 1.708 -4.992 -3.767
136 HM2 OUK 78 HM2 OUK 78 0.548 -5.391 -5.037
137 HN2 OUK 78 HN2 OUK 78 1.604 -3.972 -6.547
138 H OUR 79 H OUR 79 3.358 -3.019 -7.397
139 HA OUR 79 HA OUR 79 5.470 -2.042 -5.518
140 HB3 OUR 79 HB3 OUR 79 5.595 -2.329 -8.563
141 HB2 OUR 79 HB2 OUR 79 6.865 -1.663 -7.539
142 HG3 OUR 79 HG3 OUR 79 7.080 -3.894 -6.372
143 HG2 OUR 79 HG2 OUR 79 5.842 -4.559 -7.452
144 HD3 OUR 79 HD3 OUR 79 7.272 -3.900 -9.432
145 HD2 OUR 79 HD2 OUR 79 8.540 -3.382 -8.313
146 HE OUR 79 HE OUR 79 9.011 -5.543 -7.718
147 HH12 OUR 79 2HH1 OUR 79 6.895 -7.140 -10.812
148 HH11 OUR 79 1HH1 OUR 79 6.844 -5.438 -10.607
149 HH22 OUR 79 2HH2 OUR 79 9.607 -7.561 -8.600
150 HM2 OUR 79 HM2 OUR 79 4.173 -0.466 -7.799
151 HM3 OUR 79 HM3 OUR 79 5.396 0.118 -6.664
152 HN2 OUR 79 HN2 OUR 79 2.551 -0.514 -6.061
153 HH21 OUR 79 1HH2 OUR 79 8.838 -8.158 -10.004
154 H OUH 80 H OUH 80 1.435 1.054 -5.097
155 HA OUH 80 HA OUH 80 3.068 2.294 -2.952
156 HB2 OUH 80 HB2 OUH 80 0.911 3.510 -4.164
157 HB3 OUH 80 HB3 OUH 80 1.599 3.902 -2.613
158 HD2 OUH 80 HD2 OUH 80 0.358 2.977 -0.365
159 HD1 OUH 80 HD1 OUH 80 -1.653 2.389 -4.026
160 HE1 OUH 80 HE1 OUH 80 -3.280 2.092 -2.020
161 HM2 OUH 80 HM2 OUH 80 0.724 0.386 -2.542
162 HM3 OUH 80 HM3 OUH 80 1.781 1.078 -1.296
163 HN2 OUH 80 HN2 OUH 80 2.845 -0.673 -3.451
164 H1 OUK 81 H OUK 81 4.464 -1.969 -2.932
165 HA OUK 81 HA OUK 81 5.823 -1.136 -0.430
166 HB2 OUK 81 HB2 OUK 81 7.083 -3.295 -0.397
167 HB3 OUK 81 HB3 OUK 81 6.056 -3.913 -1.691
168 HG2 OUK 81 HG2 OUK 81 4.037 -3.638 -0.203
169 HG3 OUK 81 HG3 OUK 81 5.072 -3.014 1.082
170 HD2 OUK 81 HD2 OUK 81 6.295 -5.198 1.157
171 HD3 OUK 81 HD3 OUK 81 5.311 -5.792 -0.189
172 HE2 OUK 81 HE2 OUK 81 3.236 -5.511 1.206
173 HE3 OUK 81 HE3 OUK 81 4.247 -4.994 2.579
174 HZ3 OUK 81 HZ3 OUK 81 3.588 -7.281 2.748
175 HZ1 OUK 81 HZ1 OUK 81 5.258 -7.188 2.587
176 HZ2 OUK 81 HZ2 OUK 81 4.312 -7.664 1.278
177 HM3 OUK 81 HM3 OUK 81 7.899 -1.364 -1.766
178 HM2 OUK 81 HM2 OUK 81 6.957 -1.955 -3.146
179 HN2 OUK 81 HN2 OUK 81 6.140 0.197 -3.551
180 H OUI 82 H OUI 82 5.841 2.369 -3.249
181 HA OUI 82 HA OUI 82 6.761 3.454 -0.623
182 HB OUI 82 HB OUI 82 6.969 5.678 -1.583
183 3HG1 OUI 82 3HG1 OUI 82 6.560 4.369 -4.334
184 2HG1 OUI 82 2HG1 OUI 82 5.422 5.451 -3.547
185 1HG2 OUI 82 1HG2 OUI 82 8.740 3.726 -3.139
186 2HG2 OUI 82 2HG2 OUI 82 8.910 4.026 -1.407
187 3HG2 OUI 82 3HG2 OUI 82 9.162 5.346 -2.552
188 2HD1 OUI 82 2HD1 OUI 82 8.219 6.222 -4.513
189 3HD1 OUI 82 3HD1 OUI 82 7.154 7.286 -3.571
190 1HD1 OUI 82 1HD1 OUI 82 6.666 6.734 -5.179
191 HM2 OUI 82 HM2 OUI 82 4.265 4.214 -2.199
192 HM3 OUI 82 HM3 OUI 82 4.795 4.897 -0.646
193 HN2 OUI 82 HN2 OUI 82 4.245 1.999 -1.012
194 H OUH 83 H OUH 83 3.790 0.878 0.670
195 HA OUH 83 HA OUH 83 3.039 2.174 3.210
196 HB2 OUH 83 HB2 OUH 83 2.849 -0.112 4.090
197 HB3 OUH 83 HB3 OUH 83 3.478 -0.778 2.599
198 HD2 OUH 83 HD2 OUH 83 0.768 2.063 2.584
199 HD1 OUH 83 HD1 OUH 83 1.151 -2.077 1.910
200 HE1 OUH 83 HE1 OUH 83 -1.182 -1.246 1.159
201 HM2 OUH 83 HM2 OUH 83 5.043 0.908 4.308
202 HM3 OUH 83 HM3 OUH 83 5.284 2.476 3.543
203 HN2 OUH 83 HN2 OUH 83 5.882 0.791 1.513
204 H ARG 84 H ARG 84 8.055 0.867 0.859
205 HA ARG 84 HA ARG 84 10.087 0.142 2.877
206 HB2 ARG 84 HB2 ARG 84 9.998 -0.581 0.376
207 HB3 ARG 84 HB3 ARG 84 10.541 1.050 0.001
208 HG2 ARG 84 HG2 ARG 84 12.565 0.634 1.508
209 HG3 ARG 84 HG3 ARG 84 11.988 -1.021 1.725
210 HD2 ARG 84 HD2 ARG 84 13.711 -0.997 0.036
211 HD3 ARG 84 HD3 ARG 84 12.172 -1.365 -0.741
212 HE ARG 84 HE ARG 84 12.176 0.767 -1.807
213 HH11 ARG 84 1HH1 ARG 84 15.421 2.321 -0.182
214 HH12 ARG 84 2HH1 ARG 84 14.887 0.791 0.495
215 HH21 ARG 84 1HH2 ARG 84 13.037 2.541 -2.576
216 HH22 ARG 84 2HH2 ARG 84 14.516 3.213 -1.850
217 H LYS 85 H LYS 85 9.038 3.039 1.265
218 HA LYS 85 HA LYS 85 10.769 4.743 2.950
219 HB2 LYS 85 HB2 LYS 85 10.400 5.062 -0.063
220 HB3 LYS 85 HB3 LYS 85 10.770 6.397 1.009
221 HG2 LYS 85 HG2 LYS 85 12.860 5.147 1.747
222 HG3 LYS 85 HG3 LYS 85 12.516 3.965 0.480
223 HD2 LYS 85 HD2 LYS 85 14.135 5.634 -0.331
224 HD3 LYS 85 HD3 LYS 85 12.629 5.751 -1.236
225 HE2 LYS 85 HE2 LYS 85 13.419 7.985 -0.786
226 HE3 LYS 85 HE3 LYS 85 11.964 7.720 0.160
227 HZ1 LYS 85 HZ1 LYS 85 13.593 8.756 1.538
228 HZ2 LYS 85 HZ2 LYS 85 13.508 7.212 2.086
229 HZ3 LYS 85 HZ3 LYS 85 14.759 7.701 1.114
230 H ASP 86 H ASP 86 9.809 6.602 3.563
231 HA ASP 86 HA ASP 86 6.999 7.225 2.916
232 HB2 ASP 86 HB2 ASP 86 7.145 5.311 4.591
233 HB3 ASP 86 HB3 ASP 86 7.944 6.425 5.695
234 H1 HOH 201 H1 HOH 177 7.188 11.584 1.393
235 H2 HOH 201 H2 HOH 177 8.106 10.510 1.934
236 H1 HOH 202 H1 HOH 174 4.510 8.394 3.711
237 H2 HOH 202 H2 HOH 174 3.009 8.349 3.545
238 H1 HOH 203 H1 HOH 170 5.186 6.529 9.291
239 H2 HOH 203 H2 HOH 170 5.439 5.887 7.943
240 H1 HOH 204 H1 HOH 145 -0.850 3.926 1.495
241 H2 HOH 204 H2 HOH 145 -2.120 3.582 2.247
242 H1 HOH 205 H1 HOH 171 4.798 8.691 6.374
243 H2 HOH 205 H2 HOH 171 5.135 10.115 6.760
244 H1 HOH 206 H1 HOH 164 3.967 0.109 -10.713
245 H2 HOH 206 H2 HOH 164 5.194 -0.359 -11.467
246 H1 HOH 207 H1 HOH 51 0.277 -7.604 6.483
247 H2 HOH 207 H2 HOH 51 -0.711 -6.573 5.997
248 H1 HOH 208 H1 HOH 158 -3.324 -0.941 -10.316
249 H2 HOH 208 H2 HOH 158 -3.998 0.410 -10.190
250 H1 HOH 209 H1 HOH 28 3.224 -9.637 -9.727
251 H2 HOH 209 H2 HOH 28 4.212 -10.464 -8.933
252 H1 HOH 210 H1 HOH 53 -5.994 -7.402 8.544
253 H2 HOH 210 H2 HOH 53 -5.405 -6.288 7.708
254 H1 HOH 211 H1 HOH 59 -3.968 -5.792 10.950
255 H2 HOH 211 H2 HOH 59 -4.405 -5.721 9.503
256 H1 HOH 212 H1 HOH 178 9.575 10.312 5.057
257 H2 HOH 212 H2 HOH 178 10.209 11.472 4.317
258 H1 HOH 213 H1 HOH 46 2.819 -8.615 -6.964
259 H2 HOH 213 H2 HOH 46 3.828 -7.517 -6.704
260 H1 HOH 214 H1 HOH 114 -10.983 0.126 6.685
261 H2 HOH 214 H2 HOH 114 -11.982 -0.138 7.793
262 H1 HOH 215 H1 HOH 149 3.384 5.036 -9.622
263 H2 HOH 215 H2 HOH 149 4.039 3.805 -9.039
264 H1 HOH 216 H1 HOH 80 4.330 4.716 6.594
265 H2 HOH 216 H2 HOH 80 4.731 3.447 7.316
266 H1 HOH 217 H1 HOH 172 -2.088 4.395 9.221
267 H2 HOH 217 H2 HOH 172 -2.199 3.054 8.535
268 H1 HOH 218 H1 HOH 152 1.909 5.402 -7.592
269 H2 HOH 218 H2 HOH 152 1.838 3.987 -8.127
270 H1 HOH 219 H1 HOH 36 -1.054 -7.209 7.994
271 H2 HOH 219 H2 HOH 36 -0.198 -7.578 9.190
272 H1 HOH 220 H1 HOH 116 -11.431 -0.009 -2.573
273 H2 HOH 220 H2 HOH 116 -11.531 -0.270 -4.063
274 H1 HOH 221 H1 HOH 9 -9.908 -3.500 6.091
275 H2 HOH 221 H2 HOH 9 -10.394 -2.118 5.714
276 H1 HOH 222 H1 HOH 17 0.510 -10.662 -9.118
277 H2 HOH 222 H2 HOH 17 0.510 -11.758 -8.077
278 H1 HOH 223 H1 HOH 77 -5.301 -0.059 9.053
279 H2 HOH 223 H2 HOH 77 -5.445 1.078 10.040
280 H1 HOH 224 H1 HOH 50 -1.735 -6.788 -5.488
281 H2 HOH 224 H2 HOH 50 -0.545 -7.670 -5.820
282 H1 HOH 225 H1 HOH 49 -0.554 -4.799 1.982
283 H2 HOH 225 H2 HOH 49 -1.309 -5.434 0.833
284 H1 HOH 226 H1 HOH 11 -17.321 -5.892 3.656
285 H2 HOH 226 H2 HOH 11 -18.081 -4.916 2.784
286 H1 HOH 227 H1 HOH 197 16.135 4.618 0.429
287 H2 HOH 227 H2 HOH 197 16.815 4.349 -0.899
288 H1 HOH 228 H1 HOH 161 -9.409 8.356 2.549
289 H2 HOH 228 H2 HOH 161 -8.507 7.447 1.739
290 H1 HOH 229 H1 HOH 90 15.070 -0.985 2.448
291 H2 HOH 229 H2 HOH 90 15.278 0.477 2.785
292 H1 HOH 230 H1 HOH 19 -10.686 -11.297 -5.425
293 H2 HOH 230 H2 HOH 19 -10.131 -10.029 -6.035
294 H1 HOH 231 H1 HOH 57 7.698 0.001 5.678
295 H2 HOH 231 H2 HOH 57 8.067 -0.376 7.097
296 H1 HOH 232 H1 HOH 63 7.567 -6.336 3.495
297 H2 HOH 232 H2 HOH 63 6.863 -7.198 4.524
298 H1 HOH 233 H1 HOH 40 2.364 -5.822 4.479
299 H2 HOH 233 H2 HOH 40 1.437 -7.011 4.395
300 H1 HOH 234 H1 HOH 199 10.572 2.477 -3.410
301 H2 HOH 234 H2 HOH 199 11.126 1.112 -3.757
302 H1 HOH 235 H1 HOH 81 5.540 -9.021 -10.655
303 H2 HOH 235 H2 HOH 81 5.890 -9.461 -12.058
304 H1 HOH 236 H1 HOH 175 -2.602 4.791 7.097
305 H2 HOH 236 H2 HOH 175 -2.072 6.208 7.075
306 H1 HOH 237 H1 HOH 21 -2.930 -12.993 -7.542
307 H2 HOH 237 H2 HOH 21 -1.666 -12.202 -7.276
308 H1 HOH 238 H1 HOH 123 -10.403 3.979 8.179
309 H2 HOH 238 H2 HOH 123 -9.664 5.221 8.623
310 H1 HOH 239 H1 HOH 2 -13.064 -10.813 -1.076
311 H2 HOH 239 H2 HOH 2 -12.421 -11.873 -1.939
312 H1 HOH 240 H1 HOH 121 -13.094 9.437 4.462
313 H2 HOH 240 H2 HOH 121 -14.156 9.195 5.518
314 H1 HOH 241 H1 HOH 110 -17.176 -5.301 -1.593
315 H2 HOH 241 H2 HOH 110 -18.515 -5.637 -0.970
316 H1 HOH 242 H1 HOH 27 -3.726 -12.216 -12.893
317 H2 HOH 242 H2 HOH 27 -2.664 -12.836 -13.779
318 H1 HOH 243 H1 HOH 194 7.138 -3.336 -11.644
319 H2 HOH 243 H2 HOH 194 5.840 -3.704 -12.330
320 H1 HOH 244 H1 HOH 24 2.476 -11.639 -6.823
321 H2 HOH 244 H2 HOH 24 1.361 -10.624 -6.697
322 H1 HOH 245 H1 HOH 41 2.790 -8.572 0.214
323 H2 HOH 245 H2 HOH 41 2.448 -7.971 -1.133
324 H1 HOH 246 H1 HOH 154 -6.220 -1.152 -8.389
325 H2 HOH 246 H2 HOH 154 -7.293 -0.477 -9.216
326 H1 HOH 247 H1 HOH 137 -1.892 -10.074 -14.106
327 H2 HOH 247 H2 HOH 137 -1.327 -8.679 -13.932
328 H1 HOH 248 H1 HOH 95 11.348 -6.287 -7.652
329 H2 HOH 248 H2 HOH 95 11.044 -7.077 -6.397
330 H1 HOH 249 H1 HOH 155 -6.509 -2.967 -9.487
331 H2 HOH 249 H2 HOH 155 -5.434 -3.600 -10.347
332 H1 HOH 250 H1 HOH 101 -12.733 1.557 3.286
333 H2 HOH 250 H2 HOH 101 -13.143 2.077 1.925
334 H1 HOH 251 H1 HOH 180 7.369 -5.775 -13.017
335 H2 HOH 251 H2 HOH 180 7.027 -7.249 -13.100
336 H1 HOH 252 H1 HOH 48 3.340 -9.737 2.237
337 H2 HOH 252 H2 HOH 48 1.829 -9.782 2.143
338 H1 HOH 253 H1 HOH 126 -3.784 -8.577 -13.960
339 H2 HOH 253 H2 HOH 126 -5.079 -8.932 -14.663
340 H1 HOH 254 H1 HOH 120 -13.956 7.175 7.820
341 H2 HOH 254 H2 HOH 120 -15.460 7.105 7.666
342 H1 HOH 255 H1 HOH 94 11.386 -9.848 -10.080
343 H2 HOH 255 H2 HOH 94 11.158 -9.875 -8.583
344 H1 HOH 256 H1 HOH 34 5.221 -10.834 3.046
345 H2 HOH 256 H2 HOH 34 5.081 -9.684 4.020
346 H1 HOH 257 H1 HOH 109 -11.326 9.857 3.014
347 H2 HOH 257 H2 HOH 109 -12.490 10.290 2.145
348 H1 HOH 258 H1 HOH 143 -0.786 5.949 -1.267
349 H2 HOH 258 H2 HOH 143 -2.045 5.191 -0.902
350 H1 HOH 259 H1 HOH 44 6.528 -9.163 0.346
351 H2 HOH 259 H2 HOH 44 7.370 -7.918 0.529
352 H1 HOH 260 H1 HOH 136 1.571 -4.912 -12.479
353 H2 HOH 260 H2 HOH 136 1.842 -4.676 -13.947
354 H1 HOH 261 H1 HOH 122 -11.920 8.439 8.686
355 H2 HOH 261 H2 HOH 122 -12.816 7.845 9.751
356 H1 HOH 262 H1 HOH 140 -3.933 5.502 -0.362
357 H2 HOH 262 H2 HOH 140 -4.849 4.486 -1.011
358 H1 HOH 263 H1 HOH 10 -12.275 -9.889 1.081
359 H2 HOH 263 H2 HOH 10 -13.271 -10.986 1.387
360 H1 HOH 264 H1 HOH 189 11.521 -5.692 -9.826
361 H2 HOH 264 H2 HOH 189 10.599 -5.798 -11.024
362 H1 HOH 265 H1 HOH 147 -10.328 -0.353 -6.302
363 H2 HOH 265 H2 HOH 147 -11.157 -1.504 -5.764
364 H1 HOH 266 H1 HOH 135 -5.823 -12.365 -11.425
365 H2 HOH 266 H2 HOH 135 -6.004 -13.033 -12.770
366 H1 HOH 267 H1 HOH 12 -16.630 -7.237 -0.858
367 H2 HOH 267 H2 HOH 12 -16.269 -8.570 -1.483
368 H1 HOH 268 H1 HOH 124 -11.589 9.530 5.869
369 H2 HOH 268 H2 HOH 124 -10.491 9.584 6.911
370 H1 HOH 269 H1 HOH 148 -2.312 -1.466 -11.861
371 H2 HOH 269 H2 HOH 148 -2.819 -2.869 -11.583
372 H1 HOH 270 H1 HOH 181 10.775 -7.274 -13.016
373 H2 HOH 270 H2 HOH 181 9.363 -6.919 -12.602
374 H1 HOH 271 H1 HOH 179 -8.927 10.537 3.540
375 H2 HOH 271 H2 HOH 179 -9.871 9.774 4.444
376 H1 HOH 272 H1 HOH 107 -15.253 3.930 6.560
377 H2 HOH 272 H2 HOH 107 -14.399 5.164 6.374
378 H1 HOH 273 H1 HOH 74 7.727 4.763 6.567
379 H2 HOH 273 H2 HOH 74 9.132 4.602 7.104
380 H1 HOH 274 H1 HOH 3 -14.327 -11.205 -3.250
381 H2 HOH 274 H2 HOH 3 -15.756 -10.705 -3.347
382 H1 HOH 275 H1 HOH 129 -1.390 -6.526 -13.144
383 H2 HOH 275 H2 HOH 129 -0.712 -5.185 -12.976
384 H1 HOH 276 H1 HOH 173 5.188 10.900 2.466
385 H2 HOH 276 H2 HOH 173 5.384 12.312 2.974
386 H1 HOH 277 H1 HOH 25 4.093 -10.152 -6.900
387 H2 HOH 277 H2 HOH 25 5.066 -11.316 -6.930
388 H1 HOH 278 H1 HOH 98 14.103 1.845 4.223
389 H2 HOH 278 H2 HOH 98 15.393 1.713 5.002
390 H1 HOH 279 H1 HOH 71 5.961 3.981 8.838
391 H2 HOH 279 H2 HOH 71 7.036 3.312 8.006
392 H1 HOH 280 H1 HOH 33 -1.741 -7.140 -0.898
393 H2 HOH 280 H2 HOH 33 -2.030 -7.712 0.472
394 H1 HOH 281 H1 HOH 64 9.539 -2.699 4.049
395 H2 HOH 281 H2 HOH 64 8.145 -2.263 4.452
396 H1 HOH 282 H1 HOH 104 -15.989 -4.685 -3.627
397 H2 HOH 282 H2 HOH 104 -16.331 -3.473 -2.777
398 H1 HOH 283 H1 HOH 85 13.458 -6.985 -9.165
399 H2 HOH 283 H2 HOH 85 12.169 -7.779 -9.107
400 H1 HOH 284 H1 HOH 83 13.824 -2.059 -2.793
401 H2 HOH 284 H2 HOH 83 14.694 -3.279 -2.999
402 H1 HOH 285 H1 HOH 4 -12.911 -8.744 3.212
403 H2 HOH 285 H2 HOH 4 -11.491 -8.226 3.130
404 H1 HOH 286 H1 HOH 176 4.527 8.519 8.588
405 H2 HOH 286 H2 HOH 176 4.390 8.932 10.039
406 H1 HOH 287 H1 HOH 115 -12.897 -2.643 -5.290
407 H2 HOH 287 H2 HOH 115 -12.737 -3.418 -6.583
408 H1 HOH 288 H1 HOH 127 -2.996 -4.925 -12.138
409 H2 HOH 288 H2 HOH 127 -4.474 -5.214 -11.967
410 H1 HOH 289 H1 HOH 108 -12.351 3.525 0.435
411 H2 HOH 289 H2 HOH 108 -11.390 2.398 0.732
412 H1 HOH 290 H1 HOH 99 -12.955 -7.780 -7.285
413 H2 HOH 290 H2 HOH 99 -14.271 -8.170 -6.649
414 H1 HOH 291 H1 HOH 113 -9.689 1.757 9.075
415 H2 HOH 291 H2 HOH 113 -10.843 1.758 8.092
416 H1 HOH 292 H1 HOH 167 3.520 7.272 -6.936
417 H2 HOH 292 H2 HOH 167 4.000 5.836 -6.911
418 H1 HOH 293 H1 HOH 75 -3.494 2.665 10.153
419 H2 HOH 293 H2 HOH 75 -4.503 3.034 11.217
420 H1 HOH 294 H1 HOH 52 8.907 -2.331 0.622
421 H2 HOH 294 H2 HOH 52 9.066 -2.839 2.040
422 H1 HOH 295 H1 HOH 13 -8.842 -0.583 9.878
423 H2 HOH 295 H2 HOH 13 -7.777 0.491 9.804
424 H1 HOH 296 H1 HOH 163 2.408 0.258 -13.937
425 H2 HOH 296 H2 HOH 163 3.433 0.145 -12.825
426 H1 HOH 297 H1 HOH 125 -10.200 10.098 9.201
427 H2 HOH 297 H2 HOH 125 -9.483 8.816 8.836
428 H1 HOH 298 H1 HOH 22 -7.649 -11.367 -10.345
429 H2 HOH 298 H2 HOH 22 -7.389 -12.453 -9.323
430 H1 HOH 299 H1 HOH 7 -7.027 -5.503 8.979
431 H2 HOH 299 H2 HOH 7 -6.782 -5.169 10.431
432 H1 HOH 300 H1 HOH 16 -11.544 -12.054 -0.127
433 H2 HOH 300 H2 HOH 16 -10.434 -13.082 -0.189
434 H1 HOH 301 H1 HOH 100 -15.390 -10.283 -6.892
435 H2 HOH 301 H2 HOH 100 -14.966 -10.161 -5.445
436 H1 HOH 302 H1 HOH 132 -6.253 -5.980 -13.178
437 H2 HOH 302 H2 HOH 132 -5.391 -7.201 -12.931
438 H1 HOH 303 H1 HOH 196 4.697 1.574 -13.677
439 H2 HOH 303 H2 HOH 196 5.251 2.882 -13.150
440 H1 HOH 304 H1 HOH 169 4.526 -2.252 -13.657
441 H2 HOH 304 H2 HOH 169 4.188 -2.166 -12.184
442 H1 HOH 305 H1 HOH 131 -6.972 -6.302 -11.099
443 H2 HOH 305 H2 HOH 131 -7.134 -5.203 -10.071
444 H1 HOH 306 H1 HOH 193 10.359 -0.527 -5.486
445 H2 HOH 306 H2 HOH 193 10.980 -1.125 -4.240
446 H1 HOH 307 H1 HOH 91 12.083 -3.148 -2.994
447 H2 HOH 307 H2 HOH 91 10.973 -3.341 -4.005
448 H1 HOH 308 H1 HOH 93 10.338 -5.198 -5.553
449 H2 HOH 308 H2 HOH 93 9.473 -5.119 -4.310
450 H1 HOH 309 H1 HOH 18 -4.479 -14.122 -9.250
451 H2 HOH 309 H2 HOH 18 -4.087 -15.250 -8.321
452 H1 HOH 310 H1 HOH 26 -5.004 -12.135 -5.424
453 H2 HOH 310 H2 HOH 26 -3.636 -11.590 -5.777
454 H1 HOH 311 H1 HOH 82 9.998 -10.685 -6.647
455 H2 HOH 311 H2 HOH 82 10.990 -11.764 -7.033
456 H1 HOH 312 H1 HOH 198 18.014 1.994 -4.524
457 H2 HOH 312 H2 HOH 198 17.003 3.114 -4.376
458 H1 HOH 313 H1 HOH 43 -2.410 -8.602 -2.619
459 H2 HOH 313 H2 HOH 43 -1.488 -7.664 -3.369
460 H1 HOH 314 H1 HOH 29 4.200 -11.758 -12.397
461 H2 HOH 314 H2 HOH 29 4.313 -10.607 -11.419
462 H1 HOH 315 H1 HOH 54 -0.565 -6.045 11.267
463 H2 HOH 315 H2 HOH 54 0.849 -6.570 11.144
464 H1 HOH 316 H1 HOH 185 16.312 5.158 -4.745
465 H2 HOH 316 H2 HOH 185 15.497 4.595 -5.892
466 H1 HOH 317 H1 HOH 138 -9.589 5.088 -1.098
467 H2 HOH 317 H2 HOH 138 -10.136 3.704 -0.823
468 H1 HOH 318 H1 HOH 112 -12.831 1.591 5.749
469 H2 HOH 318 H2 HOH 112 -13.607 2.819 5.319
470 H1 HOH 319 H1 HOH 62 -5.651 -8.332 4.760
471 H2 HOH 319 H2 HOH 62 -7.145 -8.504 4.601
472 H1 HOH 320 H1 HOH 14 -7.404 -2.120 9.838
473 H2 HOH 320 H2 HOH 14 -8.273 -3.359 9.813
474 H1 HOH 321 H1 HOH 6 -11.036 -6.470 4.865
475 H2 HOH 321 H2 HOH 6 -9.772 -6.945 5.550
476 H1 HOH 322 H1 HOH 186 7.420 -1.135 -11.399
477 H2 HOH 322 H2 HOH 186 8.286 -1.170 -10.159
478 H1 HOH 323 H1 HOH 192 10.964 9.554 -1.769
479 H2 HOH 323 H2 HOH 192 11.442 9.715 -3.196
480 H1 HOH 324 H1 HOH 55 1.460 -5.036 6.222
481 H2 HOH 324 H2 HOH 55 2.648 -4.108 6.371
482 H1 HOH 325 H1 HOH 45 5.046 -8.997 6.275
483 H2 HOH 325 H2 HOH 45 6.263 -9.895 6.220
484 H1 HOH 326 H1 HOH 144 3.604 8.609 -0.020
485 H2 HOH 326 H2 HOH 144 3.214 8.373 1.424
486 H1 HOH 327 H1 HOH 72 0.967 2.889 9.922
487 H2 HOH 327 H2 HOH 72 -0.535 2.730 10.053
488 H1 HOH 328 H1 HOH 190 7.518 -0.193 -13.338
489 H2 HOH 328 H2 HOH 190 6.418 0.733 -12.870
490 H1 HOH 329 H1 HOH 39 9.732 -7.896 1.389
491 H2 HOH 329 H2 HOH 39 8.859 -6.757 1.872
492 H1 HOH 330 H1 HOH 92 13.791 -3.495 -0.715
493 H2 HOH 330 H2 HOH 92 14.804 -3.750 0.379
494 H1 HOH 331 H1 HOH 134 -8.590 -7.332 -9.573
495 H2 HOH 331 H2 HOH 134 -10.095 -7.202 -9.614
496 H1 HOH 332 H1 HOH 106 -14.087 0.476 -2.950
497 H2 HOH 332 H2 HOH 106 -14.353 0.717 -1.478
498 H1 HOH 333 H1 HOH 73 2.911 4.583 9.573
499 H2 HOH 333 H2 HOH 73 2.857 3.741 8.318
500 H1 HOH 334 H1 HOH 191 18.785 4.273 -1.499
501 H2 HOH 334 H2 HOH 191 18.008 3.814 -2.718
502 H1 HOH 335 H1 HOH 183 10.153 -1.706 -7.688
503 H2 HOH 335 H2 HOH 183 9.471 -0.357 -7.620
504 H1 HOH 336 H1 HOH 89 8.179 -9.730 -5.170
505 H2 HOH 336 H2 HOH 89 9.252 -10.483 -4.414
506 H1 HOH 337 H1 HOH 32 -6.774 -13.198 -6.959
507 H2 HOH 337 H2 HOH 32 -5.340 -13.682 -7.051
508 H1 HOH 338 H1 HOH 56 6.065 -1.278 6.941
509 H2 HOH 338 H2 HOH 56 5.201 -0.691 8.039
510 H1 HOH 339 H1 HOH 37 6.252 -7.741 -1.557
511 H2 HOH 339 H2 HOH 37 5.102 -7.232 -2.398
512 H1 HOH 340 H1 HOH 102 -20.167 -3.776 2.045
513 H2 HOH 340 H2 HOH 102 -20.355 -4.419 3.401
514 H1 HOH 341 H1 HOH 142 5.475 7.333 -8.077
515 H2 HOH 341 H2 HOH 142 5.360 5.957 -8.707
516 H1 HOH 342 H1 HOH 117 -13.254 -1.499 -3.555
517 H2 HOH 342 H2 HOH 117 -14.671 -2.027 -3.472
518 H1 HOH 343 H1 HOH 133 0.572 -6.802 -13.807
519 H2 HOH 343 H2 HOH 133 0.929 -8.231 -14.152
520 H1 HOH 344 H1 HOH 166 -9.594 4.033 -3.116
521 H2 HOH 344 H2 HOH 166 -10.033 2.976 -4.107
522 H1 HOH 345 H1 HOH 150 -1.696 0.637 -12.737
523 H2 HOH 345 H2 HOH 150 -3.130 0.629 -13.220
524 H1 HOH 346 H1 HOH 103 -17.334 -1.375 -2.628
525 H2 HOH 346 H2 HOH 103 -15.912 -0.934 -2.368
526 H1 HOH 347 H1 HOH 195 14.679 8.610 -3.480
527 H2 HOH 347 H2 HOH 195 16.027 7.918 -3.445
528 H1 HOH 348 H1 HOH 105 -14.602 3.776 1.958
529 H2 HOH 348 H2 HOH 105 -14.344 4.214 0.531
530 H1 HOH 349 H1 HOH 60 8.329 -5.497 -2.414
531 H2 HOH 349 H2 HOH 60 7.409 -6.382 -3.224
532 H1 HOH 350 H1 HOH 111 -15.184 -6.099 -5.617
533 H2 HOH 350 H2 HOH 111 -14.910 -4.625 -5.792
534 H1 HOH 351 H1 HOH 35 6.540 -8.339 -3.955
535 H2 HOH 351 H2 HOH 35 5.957 -8.875 -5.246
536 H1 HOH 352 H1 HOH 15 -7.854 -6.493 7.160
537 H2 HOH 352 H2 HOH 15 -9.062 -5.950 7.890
538 H1 HOH 353 H1 HOH 76 -1.262 -4.806 13.190
539 H2 HOH 353 H2 HOH 76 -1.495 -3.769 12.113
540 H1 HOH 354 H1 HOH 65 10.024 -5.252 2.848
541 H2 HOH 354 H2 HOH 65 8.783 -4.559 3.366
542 H1 HOH 355 H1 HOH 31 -9.848 -12.930 -4.330
543 H2 HOH 355 H2 HOH 31 -9.322 -13.761 -5.474
544 H1 HOH 356 H1 HOH 69 -2.647 -1.517 12.455
545 H2 HOH 356 H2 HOH 69 -1.178 -1.258 12.194
546 H1 HOH 357 H1 HOH 156 -3.215 7.967 0.772
547 H2 HOH 357 H2 HOH 156 -2.473 6.761 0.245
548 H1 HOH 358 H1 HOH 1 -18.041 -9.946 -2.702
549 H2 HOH 358 H2 HOH 1 -17.380 -9.065 -3.739
550 H1 HOH 359 H1 HOH 96 12.009 -2.818 4.721
551 H2 HOH 359 H2 HOH 96 11.543 -3.491 3.446
552 H1 HOH 360 H1 HOH 159 0.186 1.148 -13.720
553 H2 HOH 360 H2 HOH 159 0.243 2.335 -12.781
554 H1 HOH 361 H1 HOH 86 16.929 -2.371 0.607
555 H2 HOH 361 H2 HOH 86 17.364 -3.808 0.796
556 H1 HOH 362 H1 HOH 97 14.009 -3.085 2.245
557 H2 HOH 362 H2 HOH 97 15.518 -2.986 2.261
558 H1 HOH 363 H1 HOH 42 -3.798 -10.492 -3.646
559 H2 HOH 363 H2 HOH 42 -3.971 -10.255 -2.158
560 H1 HOH 364 H1 HOH 130 -9.630 -10.233 -11.196
561 H2 HOH 364 H2 HOH 130 -9.076 -9.411 -10.052
562 H1 HOH 365 H1 HOH 87 20.635 3.336 -0.102
563 H2 HOH 365 H2 HOH 87 19.284 2.966 0.470
564 H1 HOH 366 H1 HOH 146 -6.718 3.990 0.074
565 H2 HOH 366 H2 HOH 146 -7.502 4.049 -1.220
566 H1 HOH 367 H1 HOH 8 -12.764 -5.167 5.942
567 H2 HOH 367 H2 HOH 8 -11.706 -4.349 5.232
568 H1 HOH 368 H1 HOH 66 7.488 -11.233 -6.121
569 H2 HOH 368 H2 HOH 66 7.128 -12.384 -7.035
570 H1 HOH 369 H1 HOH 139 -1.659 5.297 -8.561
571 H2 HOH 369 H2 HOH 139 -0.207 5.720 -8.456
572 H1 HOH 370 H1 HOH 61 -5.976 -9.607 2.661
573 H2 HOH 370 H2 HOH 61 -5.107 -10.827 2.443
574 H1 HOH 371 H1 HOH 157 -6.396 3.004 -8.709
575 H2 HOH 371 H2 HOH 157 -5.390 3.977 -9.288
576 H1 HOH 372 H1 HOH 182 7.289 5.548 -7.781
577 H2 HOH 372 H2 HOH 182 7.393 4.423 -6.773
578 H1 HOH 373 H1 HOH 187 17.881 6.904 -4.077
579 H2 HOH 373 H2 HOH 187 17.400 5.872 -3.076
580 H1 HOH 374 H1 HOH 5 -13.768 -8.903 5.359
581 H2 HOH 374 H2 HOH 5 -14.875 -9.645 4.644
582 H1 HOH 375 H1 HOH 128 -10.540 -4.729 -11.011
583 H2 HOH 375 H2 HOH 128 -9.352 -5.519 -10.504
584 H1 HOH 376 H1 HOH 58 -9.202 -14.475 1.315
585 H2 HOH 376 H2 HOH 58 -8.428 -13.177 1.222
586 H1 HOH 377 H1 HOH 151 1.228 0.273 -15.796
587 H2 HOH 377 H2 HOH 151 0.249 -0.684 -15.150
588 H1 HOH 378 H1 HOH 184 9.994 1.489 -8.711
589 H2 HOH 378 H2 HOH 184 8.534 1.495 -9.102
590 H1 HOH 379 H1 HOH 118 -15.418 6.020 -0.687
591 H2 HOH 379 H2 HOH 118 -14.095 5.684 -1.339
592 H1 HOH 380 H1 HOH 79 5.715 1.481 8.956
593 H2 HOH 380 H2 HOH 79 4.603 0.826 9.750
594 H1 HOH 381 H1 HOH 30 -8.901 -12.788 -7.135
595 H2 HOH 381 H2 HOH 30 -8.773 -13.929 -8.118
596 H1 HOH 382 H1 HOH 67 -0.028 0.875 11.335
597 H2 HOH 382 H2 HOH 67 -0.112 0.863 12.845
598 H1 HOH 383 H1 HOH 119 -13.748 -4.636 -8.345
599 H2 HOH 383 H2 HOH 119 -13.625 -5.668 -7.243
600 H1 HOH 384 H1 HOH 153 -2.164 3.119 -8.951
601 H2 HOH 384 H2 HOH 153 -3.622 3.448 -8.716
602 H1 HOH 385 H1 HOH 84 12.343 -4.310 1.198
603 H2 HOH 385 H2 HOH 84 10.901 -3.891 1.420
604 H1 HOH 386 H1 HOH 47 4.053 -2.672 7.496
605 H2 HOH 386 H2 HOH 47 3.328 -3.298 8.669
606 H1 HOH 387 H1 HOH 88 14.376 -2.870 5.934
607 H2 HOH 387 H2 HOH 88 14.179 -2.737 4.439
608 H1 HOH 388 H1 HOH 38 -5.211 -10.412 0.233
609 H2 HOH 388 H2 HOH 38 -5.875 -10.442 -1.127
610 H1 HOH 389 H1 HOH 23 -9.907 -14.394 -2.294
611 H2 HOH 389 H2 HOH 23 -8.449 -14.215 -1.933
612 H1 HOH 390 H1 HOH 188 10.690 5.986 -7.063
613 H2 HOH 390 H2 HOH 188 9.608 4.929 -7.016
614 H1 HOH 391 H1 HOH 168 4.113 9.498 -7.873
615 H2 HOH 391 H2 HOH 168 4.897 9.233 -6.607
616 H1 HOH 392 H1 HOH 160 5.854 11.469 -2.426
617 H2 HOH 392 H2 HOH 160 6.880 10.358 -2.391
618 H1 HOH 393 H1 HOH 68 2.257 1.192 10.722
619 H2 HOH 393 H2 HOH 68 3.049 2.328 10.116
620 H1 HOH 394 H1 HOH 162 -8.811 3.773 -7.585
621 H2 HOH 394 H2 HOH 162 -9.193 3.245 -8.949
622 H1 HOH 395 H1 HOH 70 4.150 -2.077 10.439
623 H2 HOH 395 H2 HOH 70 2.812 -2.476 11.024
624 H1 HOH 396 H1 HOH 78 1.121 -1.074 12.107
625 H2 HOH 396 H2 HOH 78 1.990 -1.652 13.204
626 H1 HOH 397 H1 HOH 165 -9.521 5.928 -6.422
627 H2 HOH 397 H2 HOH 165 -9.648 4.648 -5.622
628 H1 HOH 398 H1 HOH 20 -8.191 -15.042 -4.364
629 H2 HOH 398 H2 HOH 20 -7.184 -14.663 -5.433
630 H1 HOH 399 H1 HOH 141 -5.050 6.542 -9.939
631 H2 HOH 399 H2 HOH 141 -4.005 5.604 -9.373
Start of MODEL 6
1 HA PRO 62 HA PRO 62 -11.041 -7.280 -4.047
2 HB2 PRO 62 HB2 PRO 62 -12.741 -6.035 -1.860
3 HB3 PRO 62 HB3 PRO 62 -11.847 -5.225 -3.187
4 HG2 PRO 62 HG2 PRO 62 -14.480 -5.668 -3.522
5 HG3 PRO 62 HG3 PRO 62 -13.353 -6.121 -4.845
6 HD2 PRO 62 HD2 PRO 62 -14.546 -7.896 -2.706
7 HD3 PRO 62 HD3 PRO 62 -14.488 -8.183 -4.461
8 H PHE 63 H PHE 63 -9.738 -5.986 -2.149
9 HA PHE 63 HA PHE 63 -9.397 -7.714 0.241
10 HB2 PHE 63 HB2 PHE 63 -7.507 -7.605 -1.912
11 HB3 PHE 63 HB3 PHE 63 -6.818 -6.672 -0.603
12 HD1 PHE 63 HD1 PHE 63 -7.983 -10.002 -1.688
13 HD2 PHE 63 HD2 PHE 63 -6.356 -7.745 1.617
14 HE1 PHE 63 HE1 PHE 63 -7.590 -12.104 -0.436
15 HE2 PHE 63 HE2 PHE 63 -6.069 -9.827 2.894
16 HZ PHE 63 HZ PHE 63 -6.673 -12.026 1.873
17 H ALA 64 H ALA 64 -7.724 -6.446 1.768
18 HA ALA 64 HA ALA 64 -8.110 -3.536 1.653
19 HB1 ALA 64 HB1 ALA 64 -8.951 -3.438 3.971
20 HB2 ALA 64 HB2 ALA 64 -10.065 -4.358 2.938
21 HB3 ALA 64 HB3 ALA 64 -8.973 -5.215 4.051
22 H CYS 65 H CYS 65 -6.775 -2.382 3.180
23 HA CYS 65 HA CYS 65 -4.142 -3.673 3.663
24 HB2 CYS 65 HB2 CYS 65 -5.052 -0.773 3.792
25 HB3 CYS 65 HB3 CYS 65 -3.375 -1.357 3.889
26 H ASP 66 H ASP 66 -3.096 -3.544 5.735
27 HA ASP 66 HA ASP 66 -4.763 -3.096 8.133
28 HB2 ASP 66 HB2 ASP 66 -2.724 -3.539 9.384
29 HB3 ASP 66 HB3 ASP 66 -3.042 -4.829 8.233
30 H ILE 67 H ILE 67 -1.864 -1.616 6.646
31 HA ILE 67 HA ILE 67 -1.556 0.499 8.389
32 HB ILE 67 HB ILE 67 -0.840 0.280 5.447
33 HG12 ILE 67 2HG1 ILE 67 0.200 -1.400 6.908
34 HG13 ILE 67 3HG1 ILE 67 1.366 -0.325 6.169
35 HG21 ILE 67 HG21 ILE 67 -0.761 2.641 5.847
36 HG22 ILE 67 HG22 ILE 67 0.052 2.422 7.411
37 HG23 ILE 67 HG23 ILE 67 0.899 2.047 5.892
38 HD11 ILE 67 1HD1 ILE 67 1.604 0.911 8.323
39 HD12 ILE 67 2HD1 ILE 67 0.429 -0.202 9.074
40 HD13 ILE 67 3HD1 ILE 67 1.981 -0.809 8.470
41 H CYS 68 H CYS 68 -2.991 0.967 5.164
42 HA CYS 68 HA CYS 68 -4.016 3.510 5.705
43 HB2 CYS 68 HB2 CYS 68 -4.774 1.528 3.516
44 HB3 CYS 68 HB3 CYS 68 -4.865 3.304 3.436
45 H GLY 69 H GLY 69 -5.377 0.545 6.629
46 HA2 GLY 69 HA2 GLY 69 -7.399 -0.325 7.155
47 HA3 GLY 69 HA3 GLY 69 -7.969 1.326 7.392
48 H ARG 70 H ARG 70 -7.149 1.288 4.253
49 HA ARG 70 HA ARG 70 -9.934 1.305 3.409
50 HB2 ARG 70 HB2 ARG 70 -7.274 2.015 2.127
51 HB3 ARG 70 HB3 ARG 70 -8.773 2.015 1.182
52 HG2 ARG 70 HG2 ARG 70 -9.810 3.647 2.569
53 HG3 ARG 70 HG3 ARG 70 -8.575 3.518 3.817
54 HD2 ARG 70 HD2 ARG 70 -6.892 4.490 2.289
55 HD3 ARG 70 HD3 ARG 70 -8.107 4.585 1.008
56 HE ARG 70 HE ARG 70 -9.140 6.389 2.076
57 HH11 ARG 70 1HH1 ARG 70 -6.942 6.540 5.388
58 HH12 ARG 70 2HH1 ARG 70 -6.804 5.097 4.411
59 HH21 ARG 70 1HH2 ARG 70 -9.264 8.067 3.411
60 HH22 ARG 70 2HH2 ARG 70 -8.183 8.200 4.787
61 H LYS 71 H LYS 71 -10.842 0.320 1.608
62 HA LYS 71 HA LYS 71 -10.014 -2.464 1.061
63 HB2 LYS 71 HB2 LYS 71 -12.302 -0.850 -0.122
64 HB3 LYS 71 HB3 LYS 71 -12.051 -2.597 -0.250
65 HG2 LYS 71 HG2 LYS 71 -12.274 -2.732 2.286
66 HG3 LYS 71 HG3 LYS 71 -12.679 -1.009 2.285
67 HD2 LYS 71 HD2 LYS 71 -14.742 -2.114 2.397
68 HD3 LYS 71 HD3 LYS 71 -14.614 -1.565 0.716
69 HE2 LYS 71 HE2 LYS 71 -13.809 -3.872 0.079
70 HE3 LYS 71 HE3 LYS 71 -13.993 -4.356 1.775
71 HZ1 LYS 71 HZ1 LYS 71 -16.165 -3.584 -0.098
72 HZ2 LYS 71 HZ2 LYS 71 -15.969 -5.010 0.678
73 HZ3 LYS 71 HZ3 LYS 71 -16.394 -3.702 1.532
74 H PHE 72 H PHE 72 -9.557 -3.229 -1.087
75 HA PHE 72 HA PHE 72 -8.816 -1.275 -3.152
76 HB2 PHE 72 HB2 PHE 72 -6.934 -1.659 -1.244
77 HB3 PHE 72 HB3 PHE 72 -6.570 -3.060 -2.229
78 HD1 PHE 72 HD1 PHE 72 -5.199 -2.752 -4.220
79 HD2 PHE 72 HD2 PHE 72 -7.073 0.651 -2.339
80 HE1 PHE 72 HE1 PHE 72 -3.982 -1.233 -5.752
81 HE2 PHE 72 HE2 PHE 72 -5.819 2.173 -3.864
82 HZ PHE 72 HZ PHE 72 -4.287 1.227 -5.575
83 H ALA 73 H ALA 73 -7.807 -2.273 -5.017
84 HA ALA 73 HA ALA 73 -8.858 -4.902 -5.820
85 HB1 ALA 73 HB1 ALA 73 -8.753 -2.886 -7.334
86 HB2 ALA 73 HB2 ALA 73 -6.978 -2.962 -7.243
87 HB3 ALA 73 HB3 ALA 73 -7.909 -4.294 -7.963
88 H ARG 74 H ARG 74 -6.587 -5.736 -7.322
89 HA ARG 74 HA ARG 74 -4.777 -6.762 -5.170
90 HB2 ARG 74 HB2 ARG 74 -5.944 -8.479 -6.301
91 HB3 ARG 74 HB3 ARG 74 -5.617 -7.799 -7.893
92 HG2 ARG 74 HG2 ARG 74 -3.295 -8.449 -7.797
93 HG3 ARG 74 HG3 ARG 74 -3.433 -8.945 -6.086
94 HD2 ARG 74 HD2 ARG 74 -4.927 -10.738 -6.608
95 HD3 ARG 74 HD3 ARG 74 -5.266 -10.086 -8.217
96 HE ARG 74 HE ARG 74 -3.626 -11.388 -9.041
97 HH11 ARG 74 1HH1 ARG 74 -2.461 -13.061 -9.033
98 HH12 ARG 74 2HH1 ARG 74 -1.447 -13.453 -7.653
99 HH21 ARG 74 1HH2 ARG 74 -2.053 -10.725 -5.948
100 HH22 ARG 74 2HH2 ARG 74 -1.779 -12.440 -5.767
101 H SER 75 H SER 75 -4.446 -5.787 -8.603
102 HA SER 75 HA SER 75 -2.758 -4.682 -9.700
103 HB2 SER 75 HB2 SER 75 -3.011 -3.041 -7.163
104 HB3 SER 75 HB3 SER 75 -2.112 -2.518 -8.602
105 HG SER 75 HG SER 75 -3.854 -2.423 -9.771
106 H1 OUD 76 H OUD 76 -1.314 -6.652 -9.499
107 HA OUD 76 HA OUD 76 1.038 -6.158 -7.785
108 HB3 OUD 76 HB3 OUD 76 -0.087 -8.482 -8.376
109 HB2 OUD 76 HB2 OUD 76 0.917 -8.407 -9.808
110 HM3 OUD 76 HM3 OUD 76 2.618 -5.706 -9.427
111 HM2 OUD 76 HM2 OUD 76 1.679 -6.468 -10.711
112 HN2 OUD 76 HN2 OUD 76 0.243 -4.532 -10.813
113 H OUE 77 H OUE 77 -0.460 -2.605 -10.237
114 HA OUE 77 HA OUE 77 1.628 -0.641 -9.474
115 HB3 OUE 77 HB3 OUE 77 0.393 -0.280 -11.594
116 HB2 OUE 77 HB2 OUE 77 -1.138 -0.359 -10.741
117 HG3 OUE 77 HG3 OUE 77 -0.678 1.948 -11.204
118 HG2 OUE 77 HG2 OUE 77 -0.535 1.753 -9.473
119 HM2 OUE 77 HM2 OUE 77 -1.150 -0.447 -8.249
120 HM3 OUE 77 HM3 OUE 77 0.318 0.460 -7.829
121 HN2 OUE 77 HN2 OUE 77 0.479 -2.409 -7.426
122 H1 OUK 78 H OUK 78 -0.840 -3.445 -5.887
123 HA OUK 78 HA OUK 78 0.822 -2.340 -3.705
124 HB2 OUK 78 HB2 OUK 78 0.342 -4.472 -2.471
125 HB3 OUK 78 HB3 OUK 78 -0.783 -4.956 -3.734
126 HG2 OUK 78 HG2 OUK 78 -2.259 -2.987 -3.173
127 HG3 OUK 78 HG3 OUK 78 -1.118 -2.524 -1.904
128 HD2 OUK 78 HD2 OUK 78 -1.474 -4.809 -0.848
129 HD3 OUK 78 HD3 OUK 78 -2.713 -5.154 -2.050
130 HE2 OUK 78 HE2 OUK 78 -4.159 -3.373 -1.205
131 HE3 OUK 78 HE3 OUK 78 -2.848 -2.719 -0.202
132 HZ3 OUK 78 HZ3 OUK 78 -4.254 -5.286 0.306
133 HZ1 OUK 78 HZ1 OUK 78 -4.395 -3.838 1.185
134 HZ2 OUK 78 HZ2 OUK 78 -2.972 -4.706 1.176
135 HM3 OUK 78 HM3 OUK 78 2.236 -4.326 -4.036
136 HM2 OUK 78 HM2 OUK 78 1.093 -4.990 -5.208
137 HN2 OUK 78 HN2 OUK 78 1.814 -3.500 -6.842
138 H OUR 79 H OUR 79 3.360 -2.334 -7.853
139 HA OUR 79 HA OUR 79 5.357 -0.910 -6.165
140 HB3 OUR 79 HB3 OUR 79 5.415 -1.194 -9.213
141 HB2 OUR 79 HB2 OUR 79 6.647 -0.473 -8.184
142 HG3 OUR 79 HG3 OUR 79 7.085 -2.762 -7.147
143 HG2 OUR 79 HG2 OUR 79 5.881 -3.424 -8.265
144 HD3 OUR 79 HD3 OUR 79 7.290 -2.325 -10.169
145 HD2 OUR 79 HD2 OUR 79 8.575 -2.149 -8.956
146 HE OUR 79 HE OUR 79 7.557 -4.528 -10.303
147 HH12 OUR 79 2HH1 OUR 79 8.124 -6.762 -9.077
148 HH11 OUR 79 1HH1 OUR 79 9.844 -6.723 -9.010
149 HH22 OUR 79 2HH2 OUR 79 10.131 -3.343 -8.065
150 HM2 OUR 79 HM2 OUR 79 3.743 0.289 -8.459
151 HM3 OUR 79 HM3 OUR 79 4.841 1.145 -7.371
152 HN2 OUR 79 HN2 OUR 79 2.073 0.482 -6.957
153 HH21 OUR 79 1HH2 OUR 79 10.895 -4.906 -8.150
154 H OUH 80 H OUH 80 1.053 1.189 -5.182
155 HA OUH 80 HA OUH 80 2.724 2.482 -3.095
156 HB2 OUH 80 HB2 OUH 80 0.477 3.580 -4.049
157 HB3 OUH 80 HB3 OUH 80 1.028 3.779 -2.410
158 HD2 OUH 80 HD2 OUH 80 -0.419 2.784 -0.338
159 HD1 OUH 80 HD1 OUH 80 -1.596 1.367 -4.163
160 HE1 OUH 80 HE1 OUH 80 -3.254 0.476 -2.396
161 HM2 OUH 80 HM2 OUH 80 0.714 0.225 -2.645
162 HM3 OUH 80 HM3 OUH 80 1.614 1.095 -1.381
163 HN2 OUH 80 HN2 OUH 80 3.137 -0.274 -3.501
164 H1 OUK 81 H OUK 81 4.503 -1.825 -2.852
165 HA OUK 81 HA OUK 81 5.808 -0.768 -0.445
166 HB2 OUK 81 HB2 OUK 81 7.156 -2.932 -0.243
167 HB3 OUK 81 HB3 OUK 81 5.977 -3.693 -1.303
168 HG2 OUK 81 HG2 OUK 81 4.159 -3.043 0.395
169 HG3 OUK 81 HG3 OUK 81 5.437 -2.450 1.457
170 HD2 OUK 81 HD2 OUK 81 6.447 -4.786 1.453
171 HD3 OUK 81 HD3 OUK 81 5.150 -5.302 0.382
172 HE2 OUK 81 HE2 OUK 81 4.473 -6.017 2.544
173 HE3 OUK 81 HE3 OUK 81 3.473 -4.594 2.218
174 HZ3 OUK 81 HZ3 OUK 81 4.822 -3.334 3.766
175 HZ1 OUK 81 HZ1 OUK 81 5.927 -4.578 3.913
176 HZ2 OUK 81 HZ2 OUK 81 4.368 -4.748 4.491
177 HM3 OUK 81 HM3 OUK 81 7.886 -1.191 -1.770
178 HM2 OUK 81 HM2 OUK 81 6.906 -1.909 -3.060
179 HN2 OUK 81 HN2 OUK 81 6.138 0.224 -3.676
180 H OUI 82 H OUI 82 6.017 2.434 -3.640
181 HA OUI 82 HA OUI 82 6.699 3.656 -1.016
182 HB OUI 82 HB OUI 82 6.541 5.878 -2.060
183 3HG1 OUI 82 3HG1 OUI 82 6.624 4.403 -4.752
184 2HG1 OUI 82 2HG1 OUI 82 5.233 5.262 -4.113
185 1HG2 OUI 82 1HG2 OUI 82 8.766 4.149 -3.254
186 2HG2 OUI 82 2HG2 OUI 82 8.713 4.724 -1.578
187 3HG2 OUI 82 3HG2 OUI 82 8.835 5.884 -2.890
188 2HD1 OUI 82 2HD1 OUI 82 7.901 6.526 -4.916
189 3HD1 OUI 82 3HD1 OUI 82 6.610 7.396 -4.063
190 1HD1 OUI 82 1HD1 OUI 82 6.326 6.738 -5.681
191 HM2 OUI 82 HM2 OUI 82 4.155 4.046 -2.616
192 HM3 OUI 82 HM3 OUI 82 4.575 4.851 -1.087
193 HN2 OUI 82 HN2 OUI 82 4.753 1.977 -0.940
194 H OUH 83 H OUH 83 3.699 1.001 0.590
195 HA OUH 83 HA OUH 83 2.838 2.815 2.771
196 HB2 OUH 83 HB2 OUH 83 2.978 0.893 4.249
197 HB3 OUH 83 HB3 OUH 83 3.747 -0.089 3.017
198 HD2 OUH 83 HD2 OUH 83 0.464 2.111 2.268
199 HD1 OUH 83 HD1 OUH 83 1.728 -1.937 2.613
200 HE1 OUH 83 HE1 OUH 83 -0.662 -1.868 1.638
201 HM2 OUH 83 HM2 OUH 83 5.056 2.258 3.909
202 HM3 OUH 83 HM3 OUH 83 5.150 3.359 2.526
203 HN2 OUH 83 HN2 OUH 83 5.800 1.383 1.146
204 H ARG 84 H ARG 84 7.448 0.407 0.834
205 HA ARG 84 HA ARG 84 9.307 -0.507 2.972
206 HB2 ARG 84 HB2 ARG 84 8.959 -1.761 0.845
207 HB3 ARG 84 HB3 ARG 84 9.518 -0.353 -0.068
208 HG2 ARG 84 HG2 ARG 84 11.767 -0.568 0.930
209 HG3 ARG 84 HG3 ARG 84 11.206 -1.954 1.903
210 HD2 ARG 84 HD2 ARG 84 10.740 -3.233 -0.120
211 HD3 ARG 84 HD3 ARG 84 11.077 -1.817 -1.135
212 HE ARG 84 HE ARG 84 13.229 -2.856 0.648
213 HH11 ARG 84 1HH1 ARG 84 15.172 -3.887 -1.997
214 HH12 ARG 84 2HH1 ARG 84 15.084 -3.630 -0.277
215 HH21 ARG 84 1HH2 ARG 84 13.402 -3.535 -3.283
216 HH22 ARG 84 2HH2 ARG 84 12.018 -2.684 -2.651
217 H LYS 85 H LYS 85 8.681 2.258 1.077
218 HA LYS 85 HA LYS 85 10.274 3.869 2.830
219 HB2 LYS 85 HB2 LYS 85 11.911 3.992 1.114
220 HB3 LYS 85 HB3 LYS 85 10.701 3.889 -0.177
221 HG2 LYS 85 HG2 LYS 85 9.988 6.140 0.156
222 HG3 LYS 85 HG3 LYS 85 10.941 6.313 1.645
223 HD2 LYS 85 HD2 LYS 85 12.992 6.373 0.414
224 HD3 LYS 85 HD3 LYS 85 12.206 5.826 -1.083
225 HE2 LYS 85 HE2 LYS 85 12.677 8.276 -1.069
226 HE3 LYS 85 HE3 LYS 85 10.978 7.883 -1.322
227 HZ1 LYS 85 HZ1 LYS 85 12.081 8.679 1.325
228 HZ2 LYS 85 HZ2 LYS 85 11.397 9.730 0.267
229 HZ3 LYS 85 HZ3 LYS 85 10.491 8.535 0.919
230 H ASP 86 H ASP 86 9.220 6.061 2.872
231 HA ASP 86 HA ASP 86 6.589 6.195 1.556
232 HB2 ASP 86 HB2 ASP 86 6.181 5.934 3.927
233 HB3 ASP 86 HB3 ASP 86 7.400 7.168 4.288
234 H1 HOH 201 H1 HOH 185 9.457 9.658 2.376
235 H2 HOH 201 H2 HOH 185 9.096 11.112 2.612
236 H1 HOH 202 H1 HOH 161 2.200 8.676 2.193
237 H2 HOH 202 H2 HOH 161 2.858 7.722 3.165
238 H1 HOH 203 H1 HOH 160 6.366 10.286 2.622
239 H2 HOH 203 H2 HOH 160 6.831 9.958 1.219
240 H1 HOH 204 H1 HOH 166 7.037 9.415 4.915
241 H2 HOH 204 H2 HOH 166 7.036 9.812 6.376
242 H1 HOH 205 H1 HOH 34 4.332 -8.973 -7.539
243 H2 HOH 205 H2 HOH 34 5.058 -10.231 -7.113
244 H1 HOH 206 H1 HOH 14 -10.742 0.779 6.695
245 H2 HOH 206 H2 HOH 14 -11.860 0.507 7.680
246 H1 HOH 207 H1 HOH 145 1.557 1.661 -14.323
247 H2 HOH 207 H2 HOH 145 1.020 2.028 -12.957
248 H1 HOH 208 H1 HOH 153 4.830 9.120 -0.873
249 H2 HOH 208 H2 HOH 153 6.238 8.577 -0.769
250 H1 HOH 209 H1 HOH 122 -2.914 -1.914 -12.131
251 H2 HOH 209 H2 HOH 122 -3.695 -1.084 -11.134
252 H1 HOH 210 H1 HOH 77 -5.835 -0.653 9.128
253 H2 HOH 210 H2 HOH 77 -6.488 -0.294 10.444
254 H1 HOH 211 H1 HOH 162 -9.921 1.550 -1.093
255 H2 HOH 211 H2 HOH 162 -9.738 2.903 -1.751
256 H1 HOH 212 H1 HOH 165 3.290 7.313 5.243
257 H2 HOH 212 H2 HOH 165 1.897 7.767 4.877
258 H1 HOH 213 H1 HOH 103 12.388 -0.672 4.826
259 H2 HOH 213 H2 HOH 103 12.108 0.096 3.553
260 H1 HOH 214 H1 HOH 15 -8.239 -2.574 8.019
261 H2 HOH 214 H2 HOH 15 -7.569 -2.852 6.692
262 H1 HOH 215 H1 HOH 35 0.094 -9.100 -6.277
263 H2 HOH 215 H2 HOH 35 -0.003 -9.778 -4.931
264 H1 HOH 216 H1 HOH 80 0.164 -5.713 7.738
265 H2 HOH 216 H2 HOH 80 -0.439 -5.378 6.398
266 H1 HOH 217 H1 HOH 136 -5.645 -3.102 -9.708
267 H2 HOH 217 H2 HOH 136 -6.017 -2.962 -11.168
268 H1 HOH 218 H1 HOH 68 2.313 -3.400 7.985
269 H2 HOH 218 H2 HOH 68 0.995 -3.523 7.257
270 H1 HOH 219 H1 HOH 23 4.374 -8.667 -5.425
271 H2 HOH 219 H2 HOH 23 2.890 -8.388 -5.367
272 H1 HOH 220 H1 HOH 89 13.138 -5.269 -5.046
273 H2 HOH 220 H2 HOH 89 14.622 -4.955 -4.979
274 H1 HOH 221 H1 HOH 13 -10.471 -9.994 0.015
275 H2 HOH 221 H2 HOH 13 -11.553 -10.190 1.054
276 H1 HOH 222 H1 HOH 48 -1.512 -6.625 1.292
277 H2 HOH 222 H2 HOH 48 -0.612 -5.631 1.994
278 H1 HOH 223 H1 HOH 43 -4.007 -12.856 -11.116
279 H2 HOH 223 H2 HOH 43 -2.833 -11.902 -11.250
280 H1 HOH 224 H1 HOH 140 0.484 3.885 -10.809
281 H2 HOH 224 H2 HOH 140 0.467 5.209 -11.538
282 H1 HOH 225 H1 HOH 55 -10.616 -10.000 -6.157
283 H2 HOH 225 H2 HOH 55 -10.745 -10.436 -4.713
284 H1 HOH 226 H1 HOH 4 -17.270 -7.273 1.164
285 H2 HOH 226 H2 HOH 4 -16.527 -6.666 2.336
286 H1 HOH 227 H1 HOH 62 4.478 -1.811 6.233
287 H2 HOH 227 H2 HOH 62 3.329 -2.786 6.110
288 H1 HOH 228 H1 HOH 150 -6.135 9.813 5.366
289 H2 HOH 228 H2 HOH 150 -6.867 8.871 6.301
290 H1 HOH 229 H1 HOH 113 -17.299 -4.669 -2.365
291 H2 HOH 229 H2 HOH 113 -17.271 -3.214 -1.937
292 H1 HOH 230 H1 HOH 8 -17.085 -4.776 3.516
293 H2 HOH 230 H2 HOH 8 -18.139 -3.701 3.678
294 H1 HOH 231 H1 HOH 41 -4.299 -7.878 -0.608
295 H2 HOH 231 H2 HOH 41 -3.001 -7.578 0.111
296 H1 HOH 232 H1 HOH 29 0.923 -12.856 -7.253
297 H2 HOH 232 H2 HOH 29 0.444 -14.217 -7.720
298 H1 HOH 233 H1 HOH 79 8.223 -3.302 4.639
299 H2 HOH 233 H2 HOH 79 8.458 -4.307 3.527
300 H1 HOH 234 H1 HOH 63 9.877 1.042 6.006
301 H2 HOH 234 H2 HOH 63 8.731 0.675 5.090
302 H1 HOH 235 H1 HOH 39 -1.123 -14.631 -5.381
303 H2 HOH 235 H2 HOH 39 -2.606 -14.936 -5.480
304 H1 HOH 236 H1 HOH 182 11.862 12.350 -0.507
305 H2 HOH 236 H2 HOH 182 10.847 11.272 -0.824
306 H1 HOH 237 H1 HOH 102 13.465 -2.136 3.000
307 H2 HOH 237 H2 HOH 102 14.834 -2.649 2.599
308 H1 HOH 238 H1 HOH 97 17.296 -3.639 -2.558
309 H2 HOH 238 H2 HOH 97 17.050 -5.044 -2.041
310 H1 HOH 239 H1 HOH 176 10.396 -0.967 -7.445
311 H2 HOH 239 H2 HOH 176 10.344 -1.551 -6.047
312 H1 HOH 240 H1 HOH 175 7.600 -3.938 -12.610
313 H2 HOH 240 H2 HOH 175 7.094 -5.329 -12.932
314 H1 HOH 241 H1 HOH 139 3.067 1.200 -11.725
315 H2 HOH 241 H2 HOH 139 3.255 0.259 -10.567
316 H1 HOH 242 H1 HOH 167 -7.716 6.782 7.437
317 H2 HOH 242 H2 HOH 167 -6.282 7.003 7.881
318 H1 HOH 243 H1 HOH 25 1.883 -10.572 -7.654
319 H2 HOH 243 H2 HOH 25 2.283 -11.405 -8.847
320 H1 HOH 244 H1 HOH 85 12.391 -6.946 -9.999
321 H2 HOH 244 H2 HOH 85 12.080 -7.514 -8.627
322 H1 HOH 245 H1 HOH 118 -12.231 2.535 1.433
323 H2 HOH 245 H2 HOH 118 -11.468 2.107 0.193
324 H1 HOH 246 H1 HOH 7 -14.588 -10.458 -1.331
325 H2 HOH 246 H2 HOH 7 -13.454 -9.966 -0.455
326 H1 HOH 247 H1 HOH 69 1.844 -4.106 5.356
327 H2 HOH 247 H2 HOH 69 2.689 -5.351 5.205
328 H1 HOH 248 H1 HOH 120 -11.557 8.681 1.803
329 H2 HOH 248 H2 HOH 120 -10.052 8.573 1.680
330 H1 HOH 249 H1 HOH 144 3.083 -3.529 -11.511
331 H2 HOH 249 H2 HOH 144 2.817 -4.221 -12.830
332 H1 HOH 250 H1 HOH 76 3.888 -6.085 6.985
333 H2 HOH 250 H2 HOH 76 5.056 -6.154 6.021
334 H1 HOH 251 H1 HOH 187 13.877 8.898 2.181
335 H2 HOH 251 H2 HOH 187 13.186 9.083 3.517
336 H1 HOH 252 H1 HOH 61 2.449 -2.572 10.330
337 H2 HOH 252 H2 HOH 61 1.393 -3.521 9.794
338 H1 HOH 253 H1 HOH 45 6.614 -8.336 -7.064
339 H2 HOH 253 H2 HOH 45 6.999 -6.912 -6.719
340 H1 HOH 254 H1 HOH 64 7.282 -6.721 5.204
341 H2 HOH 254 H2 HOH 64 7.239 -5.217 5.370
342 H1 HOH 255 H1 HOH 16 -12.977 -1.654 5.696
343 H2 HOH 255 H2 HOH 16 -11.559 -1.149 5.499
344 H1 HOH 256 H1 HOH 179 14.227 10.732 0.765
345 H2 HOH 256 H2 HOH 179 14.606 9.557 -0.110
346 H1 HOH 257 H1 HOH 169 -7.914 9.636 1.548
347 H2 HOH 257 H2 HOH 169 -7.916 8.426 0.632
348 H1 HOH 258 H1 HOH 134 -7.609 -6.043 -9.508
349 H2 HOH 258 H2 HOH 134 -6.567 -5.013 -9.894
350 H1 HOH 259 H1 HOH 82 -2.150 1.917 9.940
351 H2 HOH 259 H2 HOH 82 -1.501 2.440 11.203
352 H1 HOH 260 H1 HOH 152 3.858 10.222 2.665
353 H2 HOH 260 H2 HOH 152 4.659 10.614 1.446
354 H1 HOH 261 H1 HOH 107 -17.690 -0.562 1.071
355 H2 HOH 261 H2 HOH 107 -18.517 -1.805 0.826
356 H1 HOH 262 H1 HOH 129 -5.315 -6.849 -10.209
357 H2 HOH 262 H2 HOH 129 -4.995 -8.279 -10.586
358 H1 HOH 263 H1 HOH 40 -0.396 -15.319 -9.964
359 H2 HOH 263 H2 HOH 40 -0.352 -16.319 -8.829
360 H1 HOH 264 H1 HOH 1 -14.105 -11.012 -5.517
361 H2 HOH 264 H2 HOH 1 -15.578 -10.796 -5.243
362 H1 HOH 265 H1 HOH 121 -8.834 5.129 6.548
363 H2 HOH 265 H2 HOH 121 -9.543 4.940 7.872
364 H1 HOH 266 H1 HOH 158 -6.576 6.923 -0.994
365 H2 HOH 266 H2 HOH 158 -6.106 6.924 0.449
366 H1 HOH 267 H1 HOH 75 -3.913 -8.056 4.260
367 H2 HOH 267 H2 HOH 75 -4.988 -7.008 4.472
368 H1 HOH 268 H1 HOH 108 -14.204 -2.288 -2.000
369 H2 HOH 268 H2 HOH 108 -14.315 -3.306 -3.114
370 H1 HOH 269 H1 HOH 170 9.338 9.112 5.363
371 H2 HOH 269 H2 HOH 170 10.159 9.632 4.204
372 H1 HOH 270 H1 HOH 99 17.569 -6.662 -0.262
373 H2 HOH 270 H2 HOH 99 17.258 -5.293 0.307
374 H1 HOH 271 H1 HOH 49 -9.391 -11.983 -3.388
375 H2 HOH 271 H2 HOH 49 -10.797 -11.862 -2.839
376 H1 HOH 272 H1 HOH 116 -11.600 6.515 4.695
377 H2 HOH 272 H2 HOH 116 -11.471 6.924 3.241
378 H1 HOH 273 H1 HOH 147 -8.257 11.546 3.331
379 H2 HOH 273 H2 HOH 147 -7.580 10.411 4.071
380 H1 HOH 274 H1 HOH 115 -10.483 6.711 6.727
381 H2 HOH 274 H2 HOH 115 -11.569 7.744 6.952
382 H1 HOH 275 H1 HOH 2 -13.606 -9.703 1.991
383 H2 HOH 275 H2 HOH 2 -12.948 -8.496 1.357
384 H1 HOH 276 H1 HOH 128 -3.771 1.330 -10.658
385 H2 HOH 276 H2 HOH 128 -4.860 0.540 -9.959
386 H1 HOH 277 H1 HOH 178 8.898 10.802 -2.110
387 H2 HOH 277 H2 HOH 178 8.423 10.837 -0.673
388 H1 HOH 278 H1 HOH 131 -10.925 -1.115 -6.075
389 H2 HOH 278 H2 HOH 131 -10.120 0.003 -5.447
390 H1 HOH 279 H1 HOH 183 8.826 -0.818 -4.664
391 H2 HOH 279 H2 HOH 183 10.087 -0.099 -4.235
392 H1 HOH 280 H1 HOH 94 17.538 -1.587 -2.940
393 H2 HOH 280 H2 HOH 94 18.604 -1.569 -1.863
394 H1 HOH 281 H1 HOH 159 -4.065 5.907 1.607
395 H2 HOH 281 H2 HOH 159 -4.708 7.159 2.160
396 H1 HOH 282 H1 HOH 33 -7.188 -11.115 -10.791
397 H2 HOH 282 H2 HOH 33 -6.134 -12.192 -10.646
398 H1 HOH 283 H1 HOH 198 12.160 7.283 3.687
399 H2 HOH 283 H2 HOH 198 10.943 7.468 4.568
400 H1 HOH 284 H1 HOH 104 12.484 4.080 4.619
401 H2 HOH 284 H2 HOH 104 11.489 5.195 4.848
402 H1 HOH 285 H1 HOH 86 9.531 -8.917 -5.356
403 H2 HOH 285 H2 HOH 86 9.001 -8.105 -6.517
404 H1 HOH 286 H1 HOH 117 -12.722 3.483 5.489
405 H2 HOH 286 H2 HOH 117 -12.029 2.173 5.800
406 H1 HOH 287 H1 HOH 59 6.338 -5.607 -5.108
407 H2 HOH 287 H2 HOH 59 5.401 -5.017 -6.142
408 H1 HOH 288 H1 HOH 5 -12.552 -11.707 -1.572
409 H2 HOH 288 H2 HOH 5 -12.644 -13.201 -1.805
410 H1 HOH 289 H1 HOH 106 -17.217 -1.337 -1.157
411 H2 HOH 289 H2 HOH 106 -16.019 -1.042 -2.039
412 H1 HOH 290 H1 HOH 67 6.107 -7.866 1.683
413 H2 HOH 290 H2 HOH 67 5.085 -8.513 2.593
414 H1 HOH 291 H1 HOH 52 -3.924 -16.864 -6.088
415 H2 HOH 291 H2 HOH 52 -4.678 -15.701 -6.699
416 H1 HOH 292 H1 HOH 142 -2.222 -7.290 -12.522
417 H2 HOH 292 H2 HOH 142 -3.080 -7.732 -11.357
418 H1 HOH 293 H1 HOH 56 -6.798 -12.354 -8.628
419 H2 HOH 293 H2 HOH 56 -6.995 -12.382 -7.123
420 H1 HOH 294 H1 HOH 91 11.124 -6.807 -5.661
421 H2 HOH 294 H2 HOH 91 12.440 -7.076 -6.355
422 H1 HOH 295 H1 HOH 28 -4.644 -12.780 -3.185
423 H2 HOH 295 H2 HOH 28 -4.667 -13.648 -4.423
424 H1 HOH 296 H1 HOH 125 -6.904 1.287 -8.730
425 H2 HOH 296 H2 HOH 125 -6.782 -0.222 -8.765
426 H1 HOH 297 H1 HOH 92 14.705 1.089 2.220
427 H2 HOH 297 H2 HOH 92 14.163 -0.048 3.061
428 H1 HOH 298 H1 HOH 100 17.759 -4.672 2.550
429 H2 HOH 298 H2 HOH 100 17.018 -3.504 1.936
430 H1 HOH 299 H1 HOH 171 10.599 -2.711 -13.059
431 H2 HOH 299 H2 HOH 171 9.257 -2.237 -12.544
432 H1 HOH 300 H1 HOH 146 4.559 -2.297 -12.479
433 H2 HOH 300 H2 HOH 146 4.657 -0.822 -12.144
434 H1 HOH 301 H1 HOH 199 9.379 1.400 -5.571
435 H2 HOH 301 H2 HOH 199 9.175 0.996 -7.019
436 H1 HOH 302 H1 HOH 174 10.943 -1.377 -11.004
437 H2 HOH 302 H2 HOH 174 12.273 -1.313 -10.280
438 H1 HOH 303 H1 HOH 9 -15.414 -6.223 4.401
439 H2 HOH 303 H2 HOH 9 -16.721 -6.858 4.824
440 H1 HOH 304 H1 HOH 188 14.710 10.082 -2.431
441 H2 HOH 304 H2 HOH 188 14.418 8.597 -2.386
442 H1 HOH 305 H1 HOH 157 -3.073 8.384 3.333
443 H2 HOH 305 H2 HOH 157 -4.299 9.244 3.568
444 H1 HOH 306 H1 HOH 12 -12.599 -6.261 2.607
445 H2 HOH 306 H2 HOH 12 -11.754 -7.507 2.719
446 H1 HOH 307 H1 HOH 74 10.796 3.143 6.028
447 H2 HOH 307 H2 HOH 74 10.126 3.121 7.385
448 H1 HOH 308 H1 HOH 193 10.096 2.487 -3.753
449 H2 HOH 308 H2 HOH 193 11.409 1.817 -4.102
450 H1 HOH 309 H1 HOH 173 7.624 -1.800 -14.098
451 H2 HOH 309 H2 HOH 173 6.767 -2.004 -12.866
452 H1 HOH 310 H1 HOH 132 -10.468 -0.995 -8.213
453 H2 HOH 310 H2 HOH 132 -11.020 -2.404 -8.284
454 H1 HOH 311 H1 HOH 65 9.102 -2.453 6.731
455 H2 HOH 311 H2 HOH 65 9.227 -1.412 5.640
456 H1 HOH 312 H1 HOH 17 -10.664 2.679 7.970
457 H2 HOH 312 H2 HOH 17 -9.957 3.001 9.270
458 H1 HOH 313 H1 HOH 138 -2.217 2.362 -13.776
459 H2 HOH 313 H2 HOH 138 -0.948 1.538 -13.749
460 H1 HOH 314 H1 HOH 123 -1.050 -1.329 -13.861
461 H2 HOH 314 H2 HOH 123 -2.041 -0.265 -13.442
462 H1 HOH 315 H1 HOH 164 -1.010 6.231 -4.112
463 H2 HOH 315 H2 HOH 164 -1.480 6.510 -2.701
464 H1 HOH 316 H1 HOH 124 -2.142 -9.738 -12.063
465 H2 HOH 316 H2 HOH 124 -1.217 -10.758 -12.691
466 H1 HOH 317 H1 HOH 60 7.167 -5.907 -2.725
467 H2 HOH 317 H2 HOH 60 5.863 -6.599 -3.067
468 H1 HOH 318 H1 HOH 126 -9.699 -6.999 -9.878
469 H2 HOH 318 H2 HOH 126 -10.142 -6.216 -8.660
470 H1 HOH 319 H1 HOH 21 -6.252 -11.956 -5.083
471 H2 HOH 319 H2 HOH 21 -7.750 -11.848 -4.924
472 H1 HOH 320 H1 HOH 18 -9.872 -3.815 6.606
473 H2 HOH 320 H2 HOH 18 -11.262 -3.345 6.236
474 H1 HOH 321 H1 HOH 78 -1.179 -8.016 4.522
475 H2 HOH 321 H2 HOH 78 -0.281 -7.162 5.398
476 H1 HOH 322 H1 HOH 71 1.428 -5.435 3.350
477 H2 HOH 322 H2 HOH 71 0.469 -6.606 3.367
478 H1 HOH 323 H1 HOH 90 11.358 -8.734 -6.966
479 H2 HOH 323 H2 HOH 90 12.553 -9.613 -7.276
480 H1 HOH 324 H1 HOH 93 16.012 -1.060 2.395
481 H2 HOH 324 H2 HOH 93 17.443 -1.449 2.698
482 H1 HOH 325 H1 HOH 88 11.465 -7.668 -0.747
483 H2 HOH 325 H2 HOH 88 11.519 -6.575 -1.792
484 H1 HOH 326 H1 HOH 119 -12.197 4.704 2.865
485 H2 HOH 326 H2 HOH 119 -12.407 3.316 3.433
486 H1 HOH 327 H1 HOH 11 -10.540 -7.699 4.979
487 H2 HOH 327 H2 HOH 11 -10.465 -8.843 3.985
488 H1 HOH 328 H1 HOH 50 -2.919 -9.690 3.157
489 H2 HOH 328 H2 HOH 50 -2.203 -8.588 2.405
490 H1 HOH 329 H1 HOH 51 -1.551 -9.265 0.282
491 H2 HOH 329 H2 HOH 51 -0.449 -8.404 0.867
492 H1 HOH 330 H1 HOH 155 -3.327 5.522 -4.013
493 H2 HOH 330 H2 HOH 155 -3.941 5.117 -5.335
494 H1 HOH 331 H1 HOH 110 -13.966 0.265 -1.395
495 H2 HOH 331 H2 HOH 110 -13.957 -0.334 -2.786
496 H1 HOH 332 H1 HOH 3 -10.192 -12.208 0.659
497 H2 HOH 332 H2 HOH 3 -10.713 -13.078 -0.462
498 H1 HOH 333 H1 HOH 83 7.349 -7.814 3.461
499 H2 HOH 333 H2 HOH 83 8.435 -8.589 4.176
500 H1 HOH 334 H1 HOH 192 8.610 3.150 -6.398
501 H2 HOH 334 H2 HOH 192 8.232 4.493 -6.990
502 H1 HOH 335 H1 HOH 148 -1.790 5.724 2.375
503 H2 HOH 335 H2 HOH 148 -2.490 4.403 2.622
504 H1 HOH 336 H1 HOH 87 17.054 -5.897 -5.527
505 H2 HOH 336 H2 HOH 87 16.535 -5.041 -4.389
506 H1 HOH 337 H1 HOH 177 14.170 -2.575 -9.462
507 H2 HOH 337 H2 HOH 177 14.614 -1.978 -10.781
508 H1 HOH 338 H1 HOH 196 7.900 9.363 -3.630
509 H2 HOH 338 H2 HOH 196 8.985 10.096 -4.395
510 H1 HOH 339 H1 HOH 180 14.808 6.781 -2.749
511 H2 HOH 339 H2 HOH 180 13.539 6.205 -3.342
512 H1 HOH 340 H1 HOH 149 -4.515 11.649 4.240
513 H2 HOH 340 H2 HOH 149 -5.709 10.975 3.597
514 H1 HOH 341 H1 HOH 168 3.631 5.147 -7.938
515 H2 HOH 341 H2 HOH 168 4.023 6.408 -7.193
516 H1 HOH 342 H1 HOH 38 -5.740 -13.887 -12.528
517 H2 HOH 342 H2 HOH 38 -5.747 -14.328 -11.079
518 H1 HOH 343 H1 HOH 101 9.054 -6.410 3.160
519 H2 HOH 343 H2 HOH 101 10.387 -5.719 2.973
520 H1 HOH 344 H1 HOH 70 0.019 -9.040 7.990
521 H2 HOH 344 H2 HOH 70 -0.458 -7.752 7.351
522 H1 HOH 345 H1 HOH 98 16.956 -1.573 -5.141
523 H2 HOH 345 H2 HOH 98 16.744 -0.107 -4.829
524 H1 HOH 346 H1 HOH 26 -7.085 -15.793 -6.975
525 H2 HOH 346 H2 HOH 26 -6.478 -14.561 -7.611
526 H1 HOH 347 H1 HOH 172 9.785 1.272 -8.994
527 H2 HOH 347 H2 HOH 172 10.595 -0.002 -9.103
528 H1 HOH 348 H1 HOH 73 1.745 -0.573 11.665
529 H2 HOH 348 H2 HOH 73 3.000 -0.260 10.883
530 H1 HOH 349 H1 HOH 154 -0.305 6.513 4.182
531 H2 HOH 349 H2 HOH 154 0.306 7.134 2.946
532 H1 HOH 350 H1 HOH 141 -2.266 4.190 -6.742
533 H2 HOH 350 H2 HOH 141 -2.940 5.038 -7.794
534 H1 HOH 351 H1 HOH 111 -19.156 -4.985 -1.495
535 H2 HOH 351 H2 HOH 111 -20.623 -5.341 -1.634
536 H1 HOH 352 H1 HOH 6 -9.664 -10.441 2.504
537 H2 HOH 352 H2 HOH 6 -8.815 -10.685 3.737
538 H1 HOH 353 H1 HOH 112 -18.504 -6.007 -3.085
539 H2 HOH 353 H2 HOH 112 -17.988 -6.338 -4.469
540 H1 HOH 354 H1 HOH 53 7.170 -7.121 -0.102
541 H2 HOH 354 H2 HOH 53 6.007 -7.720 -0.872
542 H1 HOH 355 H1 HOH 109 -12.395 -0.531 -4.578
543 H2 HOH 355 H2 HOH 109 -13.489 0.461 -4.907
544 H1 HOH 356 H1 HOH 114 -14.368 -4.272 -6.269
545 H2 HOH 356 H2 HOH 114 -15.035 -4.980 -7.431
546 H1 HOH 357 H1 HOH 30 -6.302 -16.686 -10.356
547 H2 HOH 357 H2 HOH 30 -6.068 -15.704 -9.226
548 H1 HOH 358 H1 HOH 81 -7.787 -7.305 8.926
549 H2 HOH 358 H2 HOH 81 -7.180 -6.204 8.084
550 H1 HOH 359 H1 HOH 20 -10.189 -5.863 6.378
551 H2 HOH 359 H2 HOH 20 -9.206 -6.886 6.911
552 H1 HOH 360 H1 HOH 96 15.738 2.339 -2.519
553 H2 HOH 360 H2 HOH 96 15.967 0.843 -2.573
554 H1 HOH 361 H1 HOH 143 -12.586 -5.621 -7.470
555 H2 HOH 361 H2 HOH 143 -11.568 -4.877 -8.308
556 H1 HOH 362 H1 HOH 133 -1.456 5.004 -9.867
557 H2 HOH 362 H2 HOH 133 -2.465 6.127 -9.944
558 H1 HOH 363 H1 HOH 10 -12.017 -5.051 5.112
559 H2 HOH 363 H2 HOH 10 -12.076 -6.484 4.626
560 H1 HOH 364 H1 HOH 127 -10.049 -4.348 -9.631
561 H2 HOH 364 H2 HOH 127 -10.990 -3.470 -10.428
562 H1 HOH 365 H1 HOH 84 8.900 -5.837 0.931
563 H2 HOH 365 H2 HOH 84 9.471 -6.344 -0.378
564 H1 HOH 366 H1 HOH 57 -7.019 -13.052 -3.366
565 H2 HOH 366 H2 HOH 57 -8.228 -13.840 -2.905
566 H1 HOH 367 H1 HOH 19 -15.385 -0.844 5.718
567 H2 HOH 367 H2 HOH 19 -15.087 -2.265 6.144
568 H1 HOH 368 H1 HOH 130 -9.083 0.950 -8.767
569 H2 HOH 368 H2 HOH 130 -9.308 0.120 -10.011
570 H1 HOH 369 H1 HOH 184 13.863 1.854 -3.700
571 H2 HOH 369 H2 HOH 184 13.421 1.844 -5.148
572 H1 HOH 370 H1 HOH 47 4.216 -8.294 -1.762
573 H2 HOH 370 H2 HOH 47 4.454 -8.043 -3.236
574 H1 HOH 371 H1 HOH 95 14.818 6.590 2.861
575 H2 HOH 371 H2 HOH 95 15.693 5.713 3.730
576 H1 HOH 372 H1 HOH 27 3.769 -9.492 0.891
577 H2 HOH 372 H2 HOH 27 3.874 -10.489 2.027
578 H1 HOH 373 H1 HOH 197 6.954 5.211 -8.992
579 H2 HOH 373 H2 HOH 197 6.095 5.234 -7.747
580 H1 HOH 374 H1 HOH 190 12.744 7.699 -4.393
581 H2 HOH 374 H2 HOH 190 11.717 6.977 -5.243
582 H1 HOH 375 H1 HOH 186 16.488 6.226 -0.874
583 H2 HOH 375 H2 HOH 186 16.402 7.557 -1.592
584 H1 HOH 376 H1 HOH 46 -4.448 -10.573 6.001
585 H2 HOH 376 H2 HOH 46 -5.161 -9.558 5.139
586 H1 HOH 377 H1 HOH 44 -2.196 -11.409 -0.031
587 H2 HOH 377 H2 HOH 44 -1.192 -11.294 -1.155
588 H1 HOH 378 H1 HOH 156 -5.382 5.933 -3.250
589 H2 HOH 378 H2 HOH 156 -5.975 7.316 -3.099
590 H1 HOH 379 H1 HOH 37 1.242 -7.381 1.697
591 H2 HOH 379 H2 HOH 37 1.968 -8.710 1.746
592 H1 HOH 380 H1 HOH 163 4.892 9.132 -3.709
593 H2 HOH 380 H2 HOH 163 5.346 10.054 -4.821
594 H1 HOH 381 H1 HOH 105 -14.277 -2.129 -4.996
595 H2 HOH 381 H2 HOH 105 -15.691 -2.651 -4.856
596 H1 HOH 382 H1 HOH 195 12.178 4.933 -4.579
597 H2 HOH 382 H2 HOH 195 12.925 3.811 -3.885
598 H1 HOH 383 H1 HOH 36 2.443 -9.642 -1.435
599 H2 HOH 383 H2 HOH 36 2.261 -8.710 -0.255
600 H1 HOH 384 H1 HOH 42 -4.165 -11.216 3.874
601 H2 HOH 384 H2 HOH 42 -4.594 -11.232 2.423
602 H1 HOH 385 H1 HOH 72 -2.296 -9.402 7.210
603 H2 HOH 385 H2 HOH 72 -3.546 -8.707 6.715
604 H1 HOH 386 H1 HOH 191 10.358 4.912 -6.015
605 H2 HOH 386 H2 HOH 191 11.428 5.541 -6.881
606 H1 HOH 387 H1 HOH 189 10.298 9.813 -6.577
607 H2 HOH 387 H2 HOH 189 10.785 9.027 -5.377
608 H1 HOH 388 H1 HOH 194 17.787 5.281 0.962
609 H2 HOH 388 H2 HOH 194 16.330 5.448 1.341
610 H1 HOH 389 H1 HOH 151 2.683 8.518 -6.705
611 H2 HOH 389 H2 HOH 151 3.870 8.278 -5.798
612 H1 HOH 390 H1 HOH 135 -8.255 2.936 -7.571
613 H2 HOH 390 H2 HOH 135 -8.141 3.178 -9.062
614 H1 HOH 391 H1 HOH 66 4.237 2.180 8.919
615 H2 HOH 391 H2 HOH 66 4.567 2.378 10.382
616 H1 HOH 392 H1 HOH 54 -7.898 -11.771 5.538
617 H2 HOH 392 H2 HOH 54 -6.636 -11.268 4.869
618 H1 HOH 393 H1 HOH 137 -7.387 4.359 -5.856
619 H2 HOH 393 H2 HOH 137 -8.850 4.729 -5.971
620 H1 HOH 394 H1 HOH 22 -8.747 -14.167 0.492
621 H2 HOH 394 H2 HOH 22 -7.854 -15.061 1.333
622 H1 HOH 395 H1 HOH 58 -8.236 -15.147 -1.220
623 H2 HOH 395 H2 HOH 58 -8.734 -16.256 -2.125
624 H1 HOH 396 H1 HOH 24 -3.101 -12.351 1.627
625 H2 HOH 396 H2 HOH 24 -3.790 -13.407 0.788
626 H1 HOH 397 H1 HOH 181 16.293 4.572 -2.223
627 H2 HOH 397 H2 HOH 181 16.528 4.025 -0.833
628 H1 HOH 398 H1 HOH 31 -5.512 -14.813 1.841
629 H2 HOH 398 H2 HOH 31 -6.063 -14.335 0.519
630 H1 HOH 399 H1 HOH 32 -6.928 -16.676 3.011
631 H2 HOH 399 H2 HOH 32 -7.210 -15.393 3.762
Start of MODEL 7
1 HA PRO 62 HA PRO 62 -9.959 -6.454 -4.312
2 HB2 PRO 62 HB2 PRO 62 -12.120 -6.292 -2.278
3 HB3 PRO 62 HB3 PRO 62 -11.599 -5.070 -3.478
4 HG2 PRO 62 HG2 PRO 62 -13.970 -6.418 -3.751
5 HG3 PRO 62 HG3 PRO 62 -12.949 -6.055 -5.186
6 HD2 PRO 62 HD2 PRO 62 -12.948 -8.571 -3.488
7 HD3 PRO 62 HD3 PRO 62 -13.192 -8.459 -5.251
8 H PHE 63 H PHE 63 -9.221 -5.720 -2.105
9 HA PHE 63 HA PHE 63 -9.326 -7.623 0.086
10 HB2 PHE 63 HB2 PHE 63 -7.323 -8.268 -1.495
11 HB3 PHE 63 HB3 PHE 63 -6.533 -6.857 -0.816
12 HD1 PHE 63 HD1 PHE 63 -8.371 -10.002 0.139
13 HD2 PHE 63 HD2 PHE 63 -5.311 -7.167 1.241
14 HE1 PHE 63 HE1 PHE 63 -7.780 -11.397 2.102
15 HE2 PHE 63 HE2 PHE 63 -4.758 -8.543 3.234
16 HZ PHE 63 HZ PHE 63 -5.974 -10.670 3.651
17 H ALA 64 H ALA 64 -7.286 -6.383 1.701
18 HA ALA 64 HA ALA 64 -7.931 -3.485 1.705
19 HB1 ALA 64 HB1 ALA 64 -8.341 -5.331 4.107
20 HB2 ALA 64 HB2 ALA 64 -8.526 -3.558 4.096
21 HB3 ALA 64 HB3 ALA 64 -9.629 -4.571 3.136
22 H CYS 65 H CYS 65 -6.629 -2.275 3.318
23 HA CYS 65 HA CYS 65 -3.863 -3.363 3.735
24 HB2 CYS 65 HB2 CYS 65 -4.802 -0.477 3.727
25 HB3 CYS 65 HB3 CYS 65 -3.126 -1.059 3.737
26 H ASP 66 H ASP 66 -3.280 -3.664 5.837
27 HA ASP 66 HA ASP 66 -4.795 -2.713 8.086
28 HB2 ASP 66 HB2 ASP 66 -1.924 -3.670 7.853
29 HB3 ASP 66 HB3 ASP 66 -2.758 -3.366 9.384
30 H ILE 67 H ILE 67 -1.998 -1.337 6.383
31 HA ILE 67 HA ILE 67 -1.517 0.770 8.242
32 HB ILE 67 HB ILE 67 -0.750 0.471 5.324
33 HG12 ILE 67 2HG1 ILE 67 0.248 -1.209 6.819
34 HG13 ILE 67 3HG1 ILE 67 1.449 -0.134 6.133
35 HG21 ILE 67 HG21 ILE 67 0.136 2.640 7.264
36 HG22 ILE 67 HG22 ILE 67 0.999 2.240 5.769
37 HG23 ILE 67 HG23 ILE 67 -0.663 2.845 5.694
38 HD11 ILE 67 1HD1 ILE 67 1.598 1.101 8.292
39 HD12 ILE 67 2HD1 ILE 67 0.388 -0.000 8.993
40 HD13 ILE 67 3HD1 ILE 67 1.960 -0.620 8.470
41 H CYS 68 H CYS 68 -3.703 0.719 5.447
42 HA CYS 68 HA CYS 68 -4.454 3.558 5.896
43 HB2 CYS 68 HB2 CYS 68 -5.159 1.559 3.712
44 HB3 CYS 68 HB3 CYS 68 -5.887 3.143 3.870
45 H GLY 69 H GLY 69 -5.620 0.353 6.707
46 HA2 GLY 69 HA2 GLY 69 -7.497 -0.386 7.786
47 HA3 GLY 69 HA3 GLY 69 -8.031 1.281 8.027
48 H ARG 70 H ARG 70 -7.369 0.336 4.747
49 HA ARG 70 HA ARG 70 -10.265 0.204 4.064
50 HB2 ARG 70 HB2 ARG 70 -8.382 2.462 3.248
51 HB3 ARG 70 HB3 ARG 70 -9.906 2.116 2.419
52 HG2 ARG 70 HG2 ARG 70 -11.036 2.235 4.726
53 HG3 ARG 70 HG3 ARG 70 -9.537 2.990 5.297
54 HD2 ARG 70 HD2 ARG 70 -9.829 4.804 3.637
55 HD3 ARG 70 HD3 ARG 70 -11.255 3.982 2.984
56 HE ARG 70 HE ARG 70 -12.488 4.428 4.974
57 HH11 ARG 70 1HH1 ARG 70 -13.010 5.757 6.678
58 HH12 ARG 70 2HH1 ARG 70 -11.663 6.368 7.633
59 HH21 ARG 70 1HH2 ARG 70 -9.228 5.618 5.428
60 HH22 ARG 70 2HH2 ARG 70 -9.737 6.717 6.688
61 H LYS 71 H LYS 71 -10.557 0.316 1.658
62 HA LYS 71 HA LYS 71 -9.779 -2.382 0.940
63 HB2 LYS 71 HB2 LYS 71 -11.600 -0.279 -0.300
64 HB3 LYS 71 HB3 LYS 71 -11.390 -1.892 -0.993
65 HG2 LYS 71 HG2 LYS 71 -12.311 -2.974 0.911
66 HG3 LYS 71 HG3 LYS 71 -12.247 -1.512 1.911
67 HD2 LYS 71 HD2 LYS 71 -14.531 -1.960 1.236
68 HD3 LYS 71 HD3 LYS 71 -13.961 -0.447 0.510
69 HE2 LYS 71 HE2 LYS 71 -13.448 -1.776 -1.614
70 HE3 LYS 71 HE3 LYS 71 -14.224 -3.175 -0.837
71 HZ1 LYS 71 HZ1 LYS 71 -15.473 -0.558 -1.459
72 HZ2 LYS 71 HZ2 LYS 71 -15.808 -2.013 -2.185
73 HZ3 LYS 71 HZ3 LYS 71 -16.231 -1.760 -0.602
74 H PHE 72 H PHE 72 -9.000 -3.127 -1.054
75 HA PHE 72 HA PHE 72 -8.250 -1.214 -3.123
76 HB2 PHE 72 HB2 PHE 72 -6.218 -1.671 -1.450
77 HB3 PHE 72 HB3 PHE 72 -6.062 -3.152 -2.382
78 HD1 PHE 72 HD1 PHE 72 -4.565 -3.007 -4.261
79 HD2 PHE 72 HD2 PHE 72 -6.619 0.544 -2.893
80 HE1 PHE 72 HE1 PHE 72 -3.321 -1.628 -5.897
81 HE2 PHE 72 HE2 PHE 72 -5.390 1.890 -4.573
82 HZ PHE 72 HZ PHE 72 -3.738 0.806 -6.082
83 H ALA 73 H ALA 73 -7.478 -2.400 -5.165
84 HA ALA 73 HA ALA 73 -9.466 -4.468 -5.709
85 HB1 ALA 73 HB1 ALA 73 -9.176 -2.622 -7.250
86 HB2 ALA 73 HB2 ALA 73 -7.468 -3.033 -7.505
87 HB3 ALA 73 HB3 ALA 73 -8.747 -4.143 -8.051
88 H ARG 74 H ARG 74 -6.261 -4.621 -7.157
89 HA ARG 74 HA ARG 74 -5.298 -6.851 -5.572
90 HB2 ARG 74 HB2 ARG 74 -6.760 -8.155 -7.038
91 HB3 ARG 74 HB3 ARG 74 -6.090 -7.373 -8.475
92 HG2 ARG 74 HG2 ARG 74 -3.849 -8.362 -7.944
93 HG3 ARG 74 HG3 ARG 74 -4.551 -9.150 -6.521
94 HD2 ARG 74 HD2 ARG 74 -6.026 -10.490 -7.975
95 HD3 ARG 74 HD3 ARG 74 -5.446 -9.615 -9.399
96 HE ARG 74 HE ARG 74 -3.298 -10.617 -9.213
97 HH11 ARG 74 1HH1 ARG 74 -5.493 -12.245 -7.010
98 HH12 ARG 74 2HH1 ARG 74 -4.161 -13.046 -6.198
99 HH21 ARG 74 1HH2 ARG 74 -1.765 -12.018 -8.349
100 HH22 ARG 74 2HH2 ARG 74 -2.250 -13.029 -7.000
101 H SER 75 H SER 75 -4.801 -5.731 -8.895
102 HA SER 75 HA SER 75 -3.261 -4.436 -9.911
103 HB2 SER 75 HB2 SER 75 -2.849 -3.165 -7.224
104 HB3 SER 75 HB3 SER 75 -2.698 -2.412 -8.820
105 HG SER 75 HG SER 75 -4.924 -2.633 -9.109
106 H1 OUD 76 H OUD 76 -1.770 -5.931 -10.545
107 HA OUD 76 HA OUD 76 0.738 -6.161 -8.923
108 HB3 OUD 76 HB3 OUD 76 -0.477 -8.290 -9.291
109 HB2 OUD 76 HB2 OUD 76 -0.414 -8.037 -11.024
110 HM3 OUD 76 HM3 OUD 76 2.073 -5.878 -10.892
111 HM2 OUD 76 HM2 OUD 76 0.667 -5.987 -11.965
112 HN2 OUD 76 HN2 OUD 76 0.395 -3.722 -11.764
113 H OUE 77 H OUE 77 0.365 -1.729 -10.784
114 HA OUE 77 HA OUE 77 2.082 -1.286 -8.477
115 HB3 OUE 77 HB3 OUE 77 0.589 0.470 -10.473
116 HB2 OUE 77 HB2 OUE 77 1.178 1.164 -8.979
117 HG3 OUE 77 HG3 OUE 77 2.809 1.514 -10.757
118 HG2 OUE 77 HG2 OUE 77 3.488 0.583 -9.457
119 HM2 OUE 77 HM2 OUE 77 -0.891 -0.598 -8.321
120 HM3 OUE 77 HM3 OUE 77 0.350 -0.016 -7.199
121 HN2 OUE 77 HN2 OUE 77 -0.099 -2.941 -7.525
122 H1 OUK 78 H OUK 78 -1.236 -3.988 -5.902
123 HA OUK 78 HA OUK 78 0.415 -3.200 -3.565
124 HB2 OUK 78 HB2 OUK 78 -0.415 -5.415 -2.544
125 HB3 OUK 78 HB3 OUK 78 -1.639 -5.461 -3.802
126 HG2 OUK 78 HG2 OUK 78 -2.459 -3.169 -2.937
127 HG3 OUK 78 HG3 OUK 78 -1.329 -3.354 -1.606
128 HD2 OUK 78 HD2 OUK 78 -2.511 -5.608 -1.070
129 HD3 OUK 78 HD3 OUK 78 -3.699 -5.155 -2.284
130 HE2 OUK 78 HE2 OUK 78 -4.799 -4.228 -0.465
131 HE3 OUK 78 HE3 OUK 78 -3.737 -2.853 -0.812
132 HZ3 OUK 78 HZ3 OUK 78 -3.568 -3.150 1.439
133 HZ1 OUK 78 HZ1 OUK 78 -2.203 -4.019 0.938
134 HZ2 OUK 78 HZ2 OUK 78 -3.607 -4.806 1.388
135 HM3 OUK 78 HM3 OUK 78 1.614 -5.295 -3.939
136 HM2 OUK 78 HM2 OUK 78 0.458 -5.783 -5.188
137 HN2 OUK 78 HN2 OUK 78 1.410 -4.306 -6.721
138 H OUR 79 H OUR 79 2.982 -3.150 -7.574
139 HA OUR 79 HA OUR 79 5.432 -2.607 -6.025
140 HB3 OUR 79 HB3 OUR 79 4.676 -2.211 -8.967
141 HB2 OUR 79 HB2 OUR 79 6.261 -1.837 -8.310
142 HG3 OUR 79 HG3 OUR 79 6.693 -4.194 -7.807
143 HG2 OUR 79 HG2 OUR 79 5.040 -4.651 -8.230
144 HD3 OUR 79 HD3 OUR 79 5.364 -3.976 -10.564
145 HD2 OUR 79 HD2 OUR 79 6.977 -3.332 -10.197
146 HE OUR 79 HE OUR 79 7.202 -5.883 -9.366
147 HH12 OUR 79 2HH1 OUR 79 5.535 -5.413 -12.467
148 HH11 OUR 79 1HH1 OUR 79 6.884 -5.775 -13.439
149 HH22 OUR 79 2HH2 OUR 79 8.993 -6.723 -10.746
150 HM2 OUR 79 HM2 OUR 79 4.205 -0.325 -7.607
151 HM3 OUR 79 HM3 OUR 79 5.478 -0.259 -6.382
152 HN2 OUR 79 HN2 OUR 79 2.801 -1.106 -5.527
153 HH21 OUR 79 1HH2 OUR 79 8.787 -6.738 -12.439
154 H OUH 80 H OUH 80 1.144 0.351 -5.288
155 HA OUH 80 HA OUH 80 2.398 2.239 -3.388
156 HB2 OUH 80 HB2 OUH 80 0.011 2.766 -4.754
157 HB3 OUH 80 HB3 OUH 80 0.644 3.576 -3.345
158 HD2 OUH 80 HD2 OUH 80 -0.399 3.022 -0.935
159 HD1 OUH 80 HD1 OUH 80 -2.095 0.944 -4.198
160 HE1 OUH 80 HE1 OUH 80 -3.533 0.636 -2.060
161 HM2 OUH 80 HM2 OUH 80 0.454 -0.011 -2.724
162 HM3 OUH 80 HM3 OUH 80 1.370 1.003 -1.592
163 HN2 OUH 80 HN2 OUH 80 2.702 -0.814 -3.548
164 H1 OUK 81 H OUK 81 4.157 -2.150 -2.813
165 HA OUK 81 HA OUK 81 5.575 -1.189 -0.380
166 HB2 OUK 81 HB2 OUK 81 6.875 -3.327 -0.416
167 HB3 OUK 81 HB3 OUK 81 5.851 -3.929 -1.717
168 HG2 OUK 81 HG2 OUK 81 3.839 -3.729 -0.162
169 HG3 OUK 81 HG3 OUK 81 4.935 -3.221 1.127
170 HD2 OUK 81 HD2 OUK 81 6.174 -5.419 0.885
171 HD3 OUK 81 HD3 OUK 81 5.061 -5.881 -0.400
172 HE2 OUK 81 HE2 OUK 81 4.226 -6.973 1.554
173 HE3 OUK 81 HE3 OUK 81 3.140 -5.591 1.316
174 HZ3 OUK 81 HZ3 OUK 81 4.461 -4.433 3.094
175 HZ1 OUK 81 HZ1 OUK 81 5.323 -5.842 3.335
176 HZ2 OUK 81 HZ2 OUK 81 3.670 -5.813 3.600
177 HM3 OUK 81 HM3 OUK 81 7.618 -1.286 -1.710
178 HM2 OUK 81 HM2 OUK 81 6.762 -2.049 -3.059
179 HN2 OUK 81 HN2 OUK 81 5.829 -0.006 -3.683
180 H OUI 82 H OUI 82 5.597 2.174 -3.737
181 HA OUI 82 HA OUI 82 6.253 3.617 -1.199
182 HB OUI 82 HB OUI 82 6.371 5.696 -2.514
183 3HG1 OUI 82 3HG1 OUI 82 6.388 3.913 -5.015
184 2HG1 OUI 82 2HG1 OUI 82 5.041 4.929 -4.532
185 1HG2 OUI 82 1HG2 OUI 82 8.411 3.610 -3.445
186 2HG2 OUI 82 2HG2 OUI 82 8.402 4.363 -1.842
187 3HG2 OUI 82 3HG2 OUI 82 8.670 5.353 -3.269
188 2HD1 OUI 82 2HD1 OUI 82 7.821 5.943 -5.315
189 3HD1 OUI 82 3HD1 OUI 82 6.509 6.966 -4.700
190 1HD1 OUI 82 1HD1 OUI 82 6.320 6.104 -6.235
191 HM2 OUI 82 HM2 OUI 82 3.816 3.996 -2.993
192 HM3 OUI 82 HM3 OUI 82 4.237 4.986 -1.582
193 HN2 OUI 82 HN2 OUI 82 3.900 2.053 -1.340
194 H OUH 83 H OUH 83 3.413 1.329 0.558
195 HA OUH 83 HA OUH 83 2.696 3.190 2.742
196 HB2 OUH 83 HB2 OUH 83 2.741 1.262 4.218
197 HB3 OUH 83 HB3 OUH 83 3.391 0.235 2.957
198 HD2 OUH 83 HD2 OUH 83 0.345 2.662 2.340
199 HD1 OUH 83 HD1 OUH 83 1.296 -1.441 2.689
200 HE1 OUH 83 HE1 OUH 83 -1.113 -1.125 1.795
201 HM2 OUH 83 HM2 OUH 83 4.873 2.485 3.893
202 HM3 OUH 83 HM3 OUH 83 5.008 3.621 2.549
203 HN2 OUH 83 HN2 OUH 83 5.747 1.840 1.108
204 H ARG 84 H ARG 84 7.745 1.223 0.863
205 HA ARG 84 HA ARG 84 9.214 0.046 3.162
206 HB2 ARG 84 HB2 ARG 84 9.393 -1.003 0.982
207 HB3 ARG 84 HB3 ARG 84 9.955 0.509 0.238
208 HG2 ARG 84 HG2 ARG 84 12.051 0.393 1.429
209 HG3 ARG 84 HG3 ARG 84 11.470 -0.890 2.486
210 HD2 ARG 84 HD2 ARG 84 13.029 -1.728 0.777
211 HD3 ARG 84 HD3 ARG 84 11.408 -2.498 0.677
212 HE ARG 84 HE ARG 84 10.954 -0.978 -1.234
213 HH11 ARG 84 1HH1 ARG 84 13.234 -1.097 -3.776
214 HH12 ARG 84 2HH1 ARG 84 11.596 -0.671 -3.370
215 HH21 ARG 84 1HH2 ARG 84 14.566 -1.988 -2.405
216 HH22 ARG 84 2HH2 ARG 84 14.238 -2.071 -0.687
217 H LYS 85 H LYS 85 9.358 3.048 1.244
218 HA LYS 85 HA LYS 85 10.507 4.454 3.478
219 HB2 LYS 85 HB2 LYS 85 12.506 3.357 2.090
220 HB3 LYS 85 HB3 LYS 85 12.191 4.689 0.971
221 HG2 LYS 85 HG2 LYS 85 12.552 6.315 2.858
222 HG3 LYS 85 HG3 LYS 85 12.742 4.952 3.949
223 HD2 LYS 85 HD2 LYS 85 14.931 5.766 3.480
224 HD3 LYS 85 HD3 LYS 85 14.755 4.223 2.652
225 HE2 LYS 85 HE2 LYS 85 15.914 5.760 1.214
226 HE3 LYS 85 HE3 LYS 85 14.326 5.411 0.510
227 HZ1 LYS 85 HZ1 LYS 85 13.547 7.537 1.292
228 HZ2 LYS 85 HZ2 LYS 85 14.959 7.849 2.101
229 HZ3 LYS 85 HZ3 LYS 85 14.946 7.789 0.489
230 H ASP 86 H ASP 86 10.556 6.657 3.217
231 HA ASP 86 HA ASP 86 8.818 8.139 1.416
232 HB2 ASP 86 HB2 ASP 86 9.179 9.049 3.575
233 HB3 ASP 86 HB3 ASP 86 10.891 8.665 3.556
234 H1 HOH 201 H1 HOH 39 -1.208 -6.518 8.187
235 H2 HOH 201 H2 HOH 39 -0.359 -7.703 8.591
236 H1 HOH 202 H1 HOH 20 -6.128 -4.892 8.437
237 H2 HOH 202 H2 HOH 20 -7.608 -4.928 8.106
238 H1 HOH 203 H1 HOH 181 7.495 12.723 0.920
239 H2 HOH 203 H2 HOH 181 8.632 11.752 1.162
240 H1 HOH 204 H1 HOH 45 -2.527 -7.481 9.243
241 H2 HOH 204 H2 HOH 45 -2.762 -8.317 10.484
242 H1 HOH 205 H1 HOH 171 0.981 -0.379 -12.840
243 H2 HOH 205 H2 HOH 171 0.701 0.423 -14.094
244 H1 HOH 206 H1 HOH 194 5.941 -0.718 -11.363
245 H2 HOH 206 H2 HOH 194 6.679 0.532 -11.790
246 H1 HOH 207 H1 HOH 179 8.169 11.209 3.560
247 H2 HOH 207 H2 HOH 179 7.542 12.293 4.406
248 H1 HOH 208 H1 HOH 182 9.591 14.277 3.116
249 H2 HOH 208 H2 HOH 182 9.293 12.792 3.138
250 H1 HOH 209 H1 HOH 146 -4.795 -2.117 -11.322
251 H2 HOH 209 H2 HOH 146 -5.425 -3.473 -11.065
252 H1 HOH 210 H1 HOH 133 -9.135 1.559 -0.755
253 H2 HOH 210 H2 HOH 133 -9.828 2.638 -1.558
254 H1 HOH 211 H1 HOH 33 3.797 -10.458 -10.830
255 H2 HOH 211 H2 HOH 33 3.314 -9.796 -9.562
256 H1 HOH 212 H1 HOH 81 -3.806 0.702 9.947
257 H2 HOH 212 H2 HOH 81 -4.762 1.739 10.495
258 H1 HOH 213 H1 HOH 150 0.347 -10.707 -12.776
259 H2 HOH 213 H2 HOH 150 0.676 -9.911 -11.531
260 H1 HOH 214 H1 HOH 79 -3.894 3.774 8.547
261 H2 HOH 214 H2 HOH 79 -3.907 4.310 9.962
262 H1 HOH 215 H1 HOH 130 -10.722 1.781 7.295
263 H2 HOH 215 H2 HOH 130 -11.984 2.487 7.757
264 H1 HOH 216 H1 HOH 151 3.527 -8.094 -11.595
265 H2 HOH 216 H2 HOH 151 4.143 -7.239 -12.685
266 H1 HOH 217 H1 HOH 183 -5.937 4.911 8.594
267 H2 HOH 217 H2 HOH 183 -6.976 4.517 7.563
268 H1 HOH 218 H1 HOH 41 1.471 -6.102 4.674
269 H2 HOH 218 H2 HOH 41 1.459 -7.135 3.562
270 H1 HOH 219 H1 HOH 35 -0.306 -5.958 0.861
271 H2 HOH 219 H2 HOH 35 -1.368 -6.568 1.748
272 H1 HOH 220 H1 HOH 29 -2.975 -15.136 -5.807
273 H2 HOH 220 H2 HOH 29 -2.169 -14.139 -4.992
274 H1 HOH 221 H1 HOH 120 -14.701 1.994 -1.238
275 H2 HOH 221 H2 HOH 120 -13.855 1.059 -2.078
276 H1 HOH 222 H1 HOH 56 4.464 -3.551 5.924
277 H2 HOH 222 H2 HOH 56 5.768 -4.311 5.835
278 H1 HOH 223 H1 HOH 85 -1.649 2.892 9.194
279 H2 HOH 223 H2 HOH 85 -2.284 2.236 10.399
280 H1 HOH 224 H1 HOH 138 -8.770 9.341 7.021
281 H2 HOH 224 H2 HOH 138 -8.668 8.143 7.942
282 H1 HOH 225 H1 HOH 137 -10.447 5.535 9.497
283 H2 HOH 225 H2 HOH 137 -9.754 6.873 9.326
284 H1 HOH 226 H1 HOH 23 -7.470 -13.149 -8.690
285 H2 HOH 226 H2 HOH 23 -6.681 -13.996 -7.711
286 H1 HOH 227 H1 HOH 99 15.653 -3.422 -0.160
287 H2 HOH 227 H2 HOH 99 16.321 -2.649 0.959
288 H1 HOH 228 H1 HOH 126 -18.119 -1.411 0.625
289 H2 HOH 228 H2 HOH 126 -17.049 -1.477 1.700
290 H1 HOH 229 H1 HOH 123 -14.980 -2.791 -4.173
291 H2 HOH 229 H2 HOH 123 -16.491 -2.861 -4.270
292 H1 HOH 230 H1 HOH 145 -10.414 -6.780 -7.897
293 H2 HOH 230 H2 HOH 145 -11.628 -7.632 -7.578
294 H1 HOH 231 H1 HOH 149 -1.594 -10.211 -11.233
295 H2 HOH 231 H2 HOH 149 -2.952 -9.593 -11.506
296 H1 HOH 232 H1 HOH 22 -0.220 -11.608 -10.389
297 H2 HOH 232 H2 HOH 22 0.475 -11.493 -9.052
298 H1 HOH 233 H1 HOH 158 0.730 5.182 0.397
299 H2 HOH 233 H2 HOH 158 -0.465 5.966 0.897
300 H1 HOH 234 H1 HOH 36 0.714 -2.634 -1.062
301 H2 HOH 234 H2 HOH 36 1.306 -1.535 -0.209
302 H1 HOH 235 H1 HOH 70 7.586 -5.736 3.705
303 H2 HOH 235 H2 HOH 70 7.336 -6.752 4.803
304 H1 HOH 236 H1 HOH 127 -13.627 2.195 5.285
305 H2 HOH 236 H2 HOH 127 -13.889 3.015 6.532
306 H1 HOH 237 H1 HOH 37 6.076 -2.719 4.261
307 H2 HOH 237 H2 HOH 37 6.713 -1.478 3.667
308 H1 HOH 238 H1 HOH 4 -11.856 -11.705 -4.107
309 H2 HOH 238 H2 HOH 4 -12.623 -10.964 -5.182
310 H1 HOH 239 H1 HOH 186 10.813 -6.393 -14.312
311 H2 HOH 239 H2 HOH 186 10.096 -5.343 -13.482
312 H1 HOH 240 H1 HOH 86 11.795 4.210 6.134
313 H2 HOH 240 H2 HOH 86 11.039 3.148 5.361
314 H1 HOH 241 H1 HOH 148 4.373 -6.200 -14.825
315 H2 HOH 241 H2 HOH 148 3.215 -5.454 -14.196
316 H1 HOH 242 H1 HOH 101 11.196 -8.070 -9.482
317 H2 HOH 242 H2 HOH 101 9.716 -8.153 -9.171
318 H1 HOH 243 H1 HOH 185 8.001 -4.552 -15.714
319 H2 HOH 243 H2 HOH 185 8.509 -5.764 -14.963
320 H1 HOH 244 H1 HOH 24 -0.501 -15.351 -9.552
321 H2 HOH 244 H2 HOH 24 -0.790 -13.930 -9.121
322 H1 HOH 245 H1 HOH 93 16.771 -4.657 -2.004
323 H2 HOH 245 H2 HOH 93 15.274 -4.853 -1.874
324 H1 HOH 246 H1 HOH 96 10.030 -4.035 -1.907
325 H2 HOH 246 H2 HOH 96 9.368 -4.162 -0.551
326 H1 HOH 247 H1 HOH 113 -14.619 7.825 4.716
327 H2 HOH 247 H2 HOH 113 -14.830 7.649 6.204
328 H1 HOH 248 H1 HOH 198 10.409 -4.282 -11.450
329 H2 HOH 248 H2 HOH 198 9.869 -3.173 -12.330
330 H1 HOH 249 H1 HOH 193 10.804 -4.442 -8.974
331 H2 HOH 249 H2 HOH 193 10.593 -5.794 -9.625
332 H1 HOH 250 H1 HOH 155 2.098 3.120 -6.292
333 H2 HOH 250 H2 HOH 155 1.675 4.491 -5.810
334 H1 HOH 251 H1 HOH 87 5.611 -9.606 -10.096
335 H2 HOH 251 H2 HOH 87 5.797 -8.466 -11.073
336 H1 HOH 252 H1 HOH 128 -13.508 -0.333 5.193
337 H2 HOH 252 H2 HOH 128 -12.257 0.331 5.727
338 H1 HOH 253 H1 HOH 141 -4.910 -5.188 -12.475
339 H2 HOH 253 H2 HOH 141 -5.515 -6.055 -11.392
340 H1 HOH 254 H1 HOH 176 2.260 1.863 -15.688
341 H2 HOH 254 H2 HOH 176 2.725 0.782 -14.735
342 H1 HOH 255 H1 HOH 30 2.853 -10.061 -5.605
343 H2 HOH 255 H2 HOH 30 2.641 -10.713 -6.956
344 H1 HOH 256 H1 HOH 32 -3.472 -11.649 -11.427
345 H2 HOH 256 H2 HOH 32 -3.923 -13.042 -11.813
346 H1 HOH 257 H1 HOH 53 -0.659 -4.888 5.181
347 H2 HOH 257 H2 HOH 53 -0.798 -4.872 3.673
348 H1 HOH 258 H1 HOH 68 6.796 -7.718 -6.696
349 H2 HOH 258 H2 HOH 68 7.901 -7.916 -7.711
350 H1 HOH 259 H1 HOH 117 -15.017 5.672 4.371
351 H2 HOH 259 H2 HOH 117 -14.718 4.191 4.471
352 H1 HOH 260 H1 HOH 31 -6.431 -16.417 -7.510
353 H2 HOH 260 H2 HOH 31 -5.042 -15.836 -7.365
354 H1 HOH 261 H1 HOH 124 -17.292 -3.569 0.453
355 H2 HOH 261 H2 HOH 124 -17.975 -4.919 0.532
356 H1 HOH 262 H1 HOH 111 -13.303 -9.636 -7.037
357 H2 HOH 262 H2 HOH 111 -13.575 -8.970 -8.368
358 H1 HOH 263 H1 HOH 161 -6.918 3.726 1.120
359 H2 HOH 263 H2 HOH 161 -7.849 2.886 0.270
360 H1 HOH 264 H1 HOH 97 8.445 -10.178 -8.690
361 H2 HOH 264 H2 HOH 97 7.671 -9.125 -9.458
362 H1 HOH 265 H1 HOH 90 14.865 -2.293 -5.169
363 H2 HOH 265 H2 HOH 90 15.180 -3.377 -6.176
364 H1 HOH 266 H1 HOH 199 8.408 8.202 -2.695
365 H2 HOH 266 H2 HOH 199 8.375 9.712 -2.776
366 H1 HOH 267 H1 HOH 156 1.199 7.122 -2.000
367 H2 HOH 267 H2 HOH 156 0.147 6.157 -1.486
368 H1 HOH 268 H1 HOH 153 -3.407 3.790 -6.003
369 H2 HOH 268 H2 HOH 153 -3.203 4.556 -4.712
370 H1 HOH 269 H1 HOH 42 -2.399 -6.206 4.593
371 H2 HOH 269 H2 HOH 42 -3.150 -7.239 5.405
372 H1 HOH 270 H1 HOH 197 14.836 5.961 -2.055
373 H2 HOH 270 H2 HOH 197 15.606 4.657 -1.990
374 H1 HOH 271 H1 HOH 25 -0.529 -12.572 -4.422
375 H2 HOH 271 H2 HOH 25 0.117 -13.887 -4.047
376 H1 HOH 272 H1 HOH 139 -1.035 -2.578 -14.632
377 H2 HOH 272 H2 HOH 139 -0.749 -1.536 -13.572
378 H1 HOH 273 H1 HOH 16 -14.683 3.146 8.449
379 H2 HOH 273 H2 HOH 16 -13.358 2.821 9.101
380 H1 HOH 274 H1 HOH 2 -13.205 -10.257 0.189
381 H2 HOH 274 H2 HOH 2 -12.509 -11.290 -0.670
382 H1 HOH 275 H1 HOH 195 13.428 2.417 -2.622
383 H2 HOH 275 H2 HOH 195 13.903 3.452 -1.627
384 H1 HOH 276 H1 HOH 184 5.462 -6.567 -17.153
385 H2 HOH 276 H2 HOH 184 6.191 -5.975 -15.964
386 H1 HOH 277 H1 HOH 6 -11.824 -4.996 1.779
387 H2 HOH 277 H2 HOH 6 -13.323 -5.007 1.980
388 H1 HOH 278 H1 HOH 34 -10.447 -11.285 -5.990
389 H2 HOH 278 H2 HOH 34 -9.240 -12.053 -6.489
390 H1 HOH 279 H1 HOH 102 13.330 -4.284 -4.867
391 H2 HOH 279 H2 HOH 102 11.858 -4.603 -4.693
392 H1 HOH 280 H1 HOH 172 -10.529 3.452 -3.813
393 H2 HOH 280 H2 HOH 172 -9.593 2.310 -4.148
394 H1 HOH 281 H1 HOH 48 7.301 -7.407 2.457
395 H2 HOH 281 H2 HOH 48 7.724 -8.619 1.651
396 H1 HOH 282 H1 HOH 136 -7.541 6.543 8.896
397 H2 HOH 282 H2 HOH 136 -7.392 7.503 10.057
398 H1 HOH 283 H1 HOH 110 -15.074 -11.071 -5.870
399 H2 HOH 283 H2 HOH 110 -14.463 -10.329 -4.699
400 H1 HOH 284 H1 HOH 190 13.968 3.359 -4.585
401 H2 HOH 284 H2 HOH 190 12.495 3.155 -4.862
402 H1 HOH 285 H1 HOH 112 -15.494 -4.848 0.546
403 H2 HOH 285 H2 HOH 112 -14.435 -5.930 0.499
404 H1 HOH 286 H1 HOH 142 -9.255 -5.832 -10.003
405 H2 HOH 286 H2 HOH 142 -8.986 -7.287 -9.678
406 H1 HOH 287 H1 HOH 168 -6.557 -0.083 -7.038
407 H2 HOH 287 H2 HOH 168 -7.562 0.111 -8.151
408 H1 HOH 288 H1 HOH 135 -14.114 9.196 7.950
409 H2 HOH 288 H2 HOH 135 -15.603 9.407 7.784
410 H1 HOH 289 H1 HOH 144 -6.797 -8.122 -10.934
411 H2 HOH 289 H2 HOH 144 -5.531 -8.410 -11.721
412 H1 HOH 290 H1 HOH 26 -2.704 -17.309 -7.080
413 H2 HOH 290 H2 HOH 26 -2.403 -16.022 -7.821
414 H1 HOH 291 H1 HOH 131 -12.882 -1.321 -5.132
415 H2 HOH 291 H2 HOH 131 -13.340 -2.673 -5.646
416 H1 HOH 292 H1 HOH 71 9.399 -4.114 3.227
417 H2 HOH 292 H2 HOH 71 7.967 -3.613 3.232
418 H1 HOH 293 H1 HOH 122 -19.127 0.552 -0.126
419 H2 HOH 293 H2 HOH 122 -20.274 -0.434 -0.071
420 H1 HOH 294 H1 HOH 55 1.344 -4.835 6.725
421 H2 HOH 294 H2 HOH 55 0.373 -5.994 6.828
422 H1 HOH 295 H1 HOH 65 7.304 1.954 7.664
423 H2 HOH 295 H2 HOH 65 8.246 0.790 7.875
424 H1 HOH 296 H1 HOH 129 -9.381 3.255 10.141
425 H2 HOH 296 H2 HOH 129 -10.293 3.455 8.947
426 H1 HOH 297 H1 HOH 114 -16.739 -5.185 -1.465
427 H2 HOH 297 H2 HOH 114 -16.206 -4.815 -2.835
428 H1 HOH 298 H1 HOH 178 6.837 8.597 3.754
429 H2 HOH 298 H2 HOH 178 6.865 9.799 4.671
430 H1 HOH 299 H1 HOH 132 -11.632 1.469 -2.968
431 H2 HOH 299 H2 HOH 132 -12.186 0.241 -3.657
432 H1 HOH 300 H1 HOH 88 13.601 -5.579 -3.122
433 H2 HOH 300 H2 HOH 88 13.818 -6.882 -2.385
434 H1 HOH 301 H1 HOH 3 -14.119 -10.397 -2.193
435 H2 HOH 301 H2 HOH 3 -15.281 -9.492 -2.549
436 H1 HOH 302 H1 HOH 100 9.909 -3.465 -5.749
437 H2 HOH 302 H2 HOH 100 9.478 -4.665 -4.941
438 H1 HOH 303 H1 HOH 89 15.535 1.829 0.714
439 H2 HOH 303 H2 HOH 89 15.058 1.947 -0.722
440 H1 HOH 304 H1 HOH 28 -3.491 -13.361 -3.245
441 H2 HOH 304 H2 HOH 28 -3.241 -12.815 -1.853
442 H1 HOH 305 H1 HOH 60 0.882 -11.003 -5.139
443 H2 HOH 305 H2 HOH 60 0.370 -10.218 -3.950
444 H1 HOH 306 H1 HOH 165 1.399 5.892 -3.745
445 H2 HOH 306 H2 HOH 165 2.333 6.340 -4.854
446 H1 HOH 307 H1 HOH 191 8.036 -0.942 -9.655
447 H2 HOH 307 H2 HOH 191 9.197 -1.704 -10.248
448 H1 HOH 308 H1 HOH 116 -17.557 -1.163 -5.135
449 H2 HOH 308 H2 HOH 116 -18.668 -2.156 -5.412
450 H1 HOH 309 H1 HOH 140 -4.635 -9.555 -13.694
451 H2 HOH 309 H2 HOH 140 -4.668 -10.524 -12.531
452 H1 HOH 310 H1 HOH 9 -9.937 -5.651 6.940
453 H2 HOH 310 H2 HOH 9 -8.944 -6.644 7.505
454 H1 HOH 311 H1 HOH 157 2.742 8.792 -2.441
455 H2 HOH 311 H2 HOH 157 3.174 8.516 -1.018
456 H1 HOH 312 H1 HOH 147 -3.224 -0.608 -12.344
457 H2 HOH 312 H2 HOH 147 -2.816 -1.973 -12.851
458 H1 HOH 313 H1 HOH 49 3.169 -7.831 -5.640
459 H2 HOH 313 H2 HOH 49 4.298 -8.113 -4.672
460 H1 HOH 314 H1 HOH 21 -11.442 -13.088 0.456
461 H2 HOH 314 H2 HOH 21 -10.360 -12.685 -0.523
462 H1 HOH 315 H1 HOH 17 -8.356 1.078 10.782
463 H2 HOH 315 H2 HOH 17 -7.631 2.261 11.391
464 H1 HOH 316 H1 HOH 159 -10.851 -0.525 -6.086
465 H2 HOH 316 H2 HOH 159 -10.890 0.732 -5.250
466 H1 HOH 317 H1 HOH 173 5.695 3.713 -9.206
467 H2 HOH 317 H2 HOH 173 5.488 2.226 -9.401
468 H1 HOH 318 H1 HOH 180 7.770 7.901 5.758
469 H2 HOH 318 H2 HOH 180 8.718 7.984 6.935
470 H1 HOH 319 H1 HOH 10 -7.124 -3.505 10.094
471 H2 HOH 319 H2 HOH 10 -6.455 -3.408 11.448
472 H1 HOH 320 H1 HOH 160 -5.427 6.052 3.279
473 H2 HOH 320 H2 HOH 160 -4.979 4.668 2.864
474 H1 HOH 321 H1 HOH 189 8.593 2.838 -7.289
475 H2 HOH 321 H2 HOH 189 7.313 2.278 -7.878
476 H1 HOH 322 H1 HOH 152 -9.986 -10.284 -8.061
477 H2 HOH 322 H2 HOH 152 -11.217 -9.556 -8.552
478 H1 HOH 323 H1 HOH 115 -17.545 1.288 -5.439
479 H2 HOH 323 H2 HOH 115 -16.190 0.776 -5.005
480 H1 HOH 324 H1 HOH 125 -16.286 0.404 3.132
481 H2 HOH 324 H2 HOH 125 -17.011 -0.651 3.937
482 H1 HOH 325 H1 HOH 103 15.002 -1.833 2.050
483 H2 HOH 325 H2 HOH 103 16.146 -1.530 2.992
484 H1 HOH 326 H1 HOH 167 -1.767 3.593 -7.930
485 H2 HOH 326 H2 HOH 167 -3.266 3.516 -8.134
486 H1 HOH 327 H1 HOH 40 -2.678 -8.521 1.785
487 H2 HOH 327 H2 HOH 40 -2.276 -7.944 3.132
488 H1 HOH 328 H1 HOH 5 -11.949 -12.769 -2.041
489 H2 HOH 328 H2 HOH 5 -13.301 -13.090 -2.640
490 H1 HOH 329 H1 HOH 51 0.942 -9.496 2.499
491 H2 HOH 329 H2 HOH 51 -0.146 -8.443 2.535
492 H1 HOH 330 H1 HOH 78 8.291 5.500 6.710
493 H2 HOH 330 H2 HOH 78 9.222 4.313 6.565
494 H1 HOH 331 H1 HOH 106 19.509 5.208 1.937
495 H2 HOH 331 H2 HOH 106 18.155 5.829 2.213
496 H1 HOH 332 H1 HOH 196 8.290 -1.205 -12.015
497 H2 HOH 332 H2 HOH 196 9.565 -0.906 -12.780
498 H1 HOH 333 H1 HOH 12 -12.600 3.150 11.581
499 H2 HOH 333 H2 HOH 12 -11.728 3.509 10.395
500 H1 HOH 334 H1 HOH 66 7.532 -4.468 -5.717
501 H2 HOH 334 H2 HOH 66 7.742 -5.940 -6.010
502 H1 HOH 335 H1 HOH 121 -15.806 4.619 9.744
503 H2 HOH 335 H2 HOH 121 -16.924 4.305 8.773
504 H1 HOH 336 H1 HOH 91 11.737 -3.221 3.657
505 H2 HOH 336 H2 HOH 91 11.651 -4.429 2.751
506 H1 HOH 337 H1 HOH 98 15.226 0.498 2.749
507 H2 HOH 337 H2 HOH 98 16.461 1.372 2.714
508 H1 HOH 338 H1 HOH 38 6.504 -7.842 -3.727
509 H2 HOH 338 H2 HOH 38 6.454 -6.593 -4.579
510 H1 HOH 339 H1 HOH 108 13.340 5.840 6.121
511 H2 HOH 339 H2 HOH 108 14.089 5.039 7.163
512 H1 HOH 340 H1 HOH 64 6.009 -0.251 8.049
513 H2 HOH 340 H2 HOH 64 5.070 -0.840 9.086
514 H1 HOH 341 H1 HOH 188 8.921 -2.218 -7.790
515 H2 HOH 341 H2 HOH 188 8.702 -1.665 -6.396
516 H1 HOH 342 H1 HOH 7 -11.172 -8.188 3.807
517 H2 HOH 342 H2 HOH 7 -9.898 -8.708 3.177
518 H1 HOH 343 H1 HOH 27 -8.682 -13.771 0.341
519 H2 HOH 343 H2 HOH 27 -7.855 -13.405 -0.874
520 H1 HOH 344 H1 HOH 164 -1.312 0.500 -12.813
521 H2 HOH 344 H2 HOH 164 -2.167 1.739 -12.969
522 H1 HOH 345 H1 HOH 52 0.119 -7.708 -0.350
523 H2 HOH 345 H2 HOH 52 1.042 -7.739 0.852
524 H1 HOH 346 H1 HOH 94 13.398 -2.372 5.238
525 H2 HOH 346 H2 HOH 94 13.874 -1.989 3.854
526 H1 HOH 347 H1 HOH 76 1.392 3.877 9.509
527 H2 HOH 347 H2 HOH 76 0.284 3.327 10.383
528 H1 HOH 348 H1 HOH 169 -8.100 1.372 -6.068
529 H2 HOH 348 H2 HOH 169 -7.789 2.753 -5.524
530 H1 HOH 349 H1 HOH 8 -11.683 -6.193 5.286
531 H2 HOH 349 H2 HOH 8 -12.009 -6.079 3.807
532 H1 HOH 350 H1 HOH 47 8.763 -5.035 1.456
533 H2 HOH 350 H2 HOH 47 8.417 -6.300 0.697
534 H1 HOH 351 H1 HOH 19 -7.824 -1.378 10.988
535 H2 HOH 351 H2 HOH 19 -9.008 -0.953 11.827
536 H1 HOH 352 H1 HOH 11 -14.892 -8.077 -0.377
537 H2 HOH 352 H2 HOH 11 -13.909 -8.301 0.756
538 H1 HOH 353 H1 HOH 134 -12.367 -4.498 -7.243
539 H2 HOH 353 H2 HOH 134 -13.850 -4.382 -6.957
540 H1 HOH 354 H1 HOH 119 -19.304 2.890 -0.813
541 H2 HOH 354 H2 HOH 119 -18.115 2.719 0.109
542 H1 HOH 355 H1 HOH 14 -12.225 -9.355 2.265
543 H2 HOH 355 H2 HOH 14 -13.608 -9.890 2.568
544 H1 HOH 356 H1 HOH 50 4.316 -2.215 7.587
545 H2 HOH 356 H2 HOH 50 3.508 -3.270 8.310
546 H1 HOH 357 H1 HOH 92 17.908 -1.108 1.435
547 H2 HOH 357 H2 HOH 92 18.631 -2.304 2.021
548 H1 HOH 358 H1 HOH 82 2.946 4.603 7.972
549 H2 HOH 358 H2 HOH 82 1.748 5.477 7.661
550 H1 HOH 359 H1 HOH 73 -0.627 1.593 11.356
551 H2 HOH 359 H2 HOH 73 -0.604 1.536 12.869
552 H1 HOH 360 H1 HOH 67 -4.773 -11.387 -2.250
553 H2 HOH 360 H2 HOH 67 -6.090 -10.644 -2.334
554 H1 HOH 361 H1 HOH 166 2.871 6.549 -7.322
555 H2 HOH 361 H2 HOH 166 2.289 5.192 -7.662
556 H1 HOH 362 H1 HOH 107 15.372 2.621 4.187
557 H2 HOH 362 H2 HOH 107 14.956 3.543 5.315
558 H1 HOH 363 H1 HOH 143 -8.710 -9.279 -11.286
559 H2 HOH 363 H2 HOH 143 -9.048 -9.195 -9.815
560 H1 HOH 364 H1 HOH 61 1.998 -8.721 -3.735
561 H2 HOH 364 H2 HOH 61 1.479 -8.314 -2.372
562 H1 HOH 365 H1 HOH 95 17.293 0.900 0.355
563 H2 HOH 365 H2 HOH 95 18.721 1.160 0.787
564 H1 HOH 366 H1 HOH 104 18.632 7.606 5.985
565 H2 HOH 366 H2 HOH 104 18.134 6.409 5.199
566 H1 HOH 367 H1 HOH 44 -2.041 -9.034 -0.682
567 H2 HOH 367 H2 HOH 44 -1.033 -9.027 -1.814
568 H1 HOH 368 H1 HOH 118 -15.462 4.323 2.221
569 H2 HOH 368 H2 HOH 118 -15.546 5.061 0.904
570 H1 HOH 369 H1 HOH 105 18.253 4.587 3.927
571 H2 HOH 369 H2 HOH 105 17.265 4.130 4.981
572 H1 HOH 370 H1 HOH 43 -4.174 -9.963 -0.748
573 H2 HOH 370 H2 HOH 43 -4.320 -9.866 0.754
574 H1 HOH 371 H1 HOH 163 4.046 5.367 -9.063
575 H2 HOH 371 H2 HOH 163 4.555 5.574 -10.474
576 H1 HOH 372 H1 HOH 109 -16.023 -5.295 -6.526
577 H2 HOH 372 H2 HOH 109 -15.821 -5.331 -8.025
578 H1 HOH 373 H1 HOH 174 3.551 8.369 -6.100
579 H2 HOH 373 H2 HOH 174 4.295 7.173 -5.548
580 H1 HOH 374 H1 HOH 1 -17.171 -8.470 -1.569
581 H2 HOH 374 H2 HOH 1 -16.287 -7.317 -1.999
582 H1 HOH 375 H1 HOH 154 -5.584 3.950 -5.497
583 H2 HOH 375 H2 HOH 154 -6.690 4.966 -5.679
584 H1 HOH 376 H1 HOH 13 -12.424 -5.712 7.452
585 H2 HOH 376 H2 HOH 13 -11.732 -4.400 7.155
586 H1 HOH 377 H1 HOH 192 11.430 5.256 -5.452
587 H2 HOH 377 H2 HOH 192 10.693 4.275 -6.337
588 H1 HOH 378 H1 HOH 177 5.391 7.707 5.825
589 H2 HOH 378 H2 HOH 177 6.390 6.921 6.643
590 H1 HOH 379 H1 HOH 187 9.423 4.794 -8.387
591 H2 HOH 379 H2 HOH 187 8.486 5.104 -7.242
592 H1 HOH 380 H1 HOH 80 -0.205 -2.806 13.100
593 H2 HOH 380 H2 HOH 80 -1.486 -2.124 13.533
594 H1 HOH 381 H1 HOH 57 1.280 -2.525 11.074
595 H2 HOH 381 H2 HOH 57 1.568 -1.573 12.216
596 H1 HOH 382 H1 HOH 162 7.583 10.399 -5.714
597 H2 HOH 382 H2 HOH 162 7.196 9.391 -4.655
598 H1 HOH 383 H1 HOH 59 1.886 -4.048 12.374
599 H2 HOH 383 H2 HOH 59 2.080 -5.491 12.789
600 H1 HOH 384 H1 HOH 84 4.842 5.716 7.447
601 H2 HOH 384 H2 HOH 84 5.511 4.459 7.963
602 H1 HOH 385 H1 HOH 170 -5.474 4.039 -8.879
603 H2 HOH 385 H2 HOH 170 -4.760 3.644 -10.154
604 H1 HOH 386 H1 HOH 69 -7.173 -10.310 6.513
605 H2 HOH 386 H2 HOH 69 -7.284 -11.633 5.788
606 H1 HOH 387 H1 HOH 62 3.850 -2.686 10.473
607 H2 HOH 387 H2 HOH 62 3.155 -4.003 10.761
608 H1 HOH 388 H1 HOH 58 -2.746 -11.371 -0.176
609 H2 HOH 388 H2 HOH 58 -1.430 -12.084 0.039
610 H1 HOH 389 H1 HOH 83 1.265 0.351 12.081
611 H2 HOH 389 H2 HOH 83 2.666 0.905 12.232
612 H1 HOH 390 H1 HOH 15 -9.177 -11.087 4.969
613 H2 HOH 390 H2 HOH 15 -10.313 -10.536 4.130
614 H1 HOH 391 H1 HOH 72 -8.876 -15.733 1.883
615 H2 HOH 391 H2 HOH 72 -9.439 -14.411 2.361
616 H1 HOH 392 H1 HOH 63 -1.417 -11.520 2.229
617 H2 HOH 392 H2 HOH 63 -1.257 -10.045 1.931
618 H1 HOH 393 H1 HOH 74 2.373 2.850 11.576
619 H2 HOH 393 H2 HOH 74 3.781 3.251 11.952
620 H1 HOH 394 H1 HOH 75 5.095 -0.267 11.334
621 H2 HOH 394 H2 HOH 75 3.613 -0.523 11.183
622 H1 HOH 395 H1 HOH 18 -11.231 -14.039 4.126
623 H2 HOH 395 H2 HOH 18 -10.277 -12.907 3.811
624 H1 HOH 396 H1 HOH 77 2.975 4.749 10.596
625 H2 HOH 396 H2 HOH 77 4.245 4.948 9.795
626 H1 HOH 397 H1 HOH 54 -3.207 -13.151 3.164
627 H2 HOH 397 H2 HOH 54 -3.000 -12.960 1.676
628 H1 HOH 398 H1 HOH 175 4.425 10.567 -7.156
629 H2 HOH 398 H2 HOH 175 5.304 9.784 -6.202
630 H1 HOH 399 H1 HOH 46 -6.262 -13.861 6.240
631 H2 HOH 399 H2 HOH 46 -7.243 -13.828 5.089
Start of MODEL 8
1 HA PRO 62 HA PRO 62 -10.307 -7.013 -4.077
2 HB2 PRO 62 HB2 PRO 62 -12.367 -6.567 -2.042
3 HB3 PRO 62 HB3 PRO 62 -12.120 -5.694 -3.575
4 HG2 PRO 62 HG2 PRO 62 -14.302 -7.358 -3.117
5 HG3 PRO 62 HG3 PRO 62 -13.590 -7.101 -4.740
6 HD2 PRO 62 HD2 PRO 62 -13.013 -9.330 -2.770
7 HD3 PRO 62 HD3 PRO 62 -13.403 -9.478 -4.498
8 H PHE 63 H PHE 63 -9.425 -5.988 -2.119
9 HA PHE 63 HA PHE 63 -9.038 -7.710 0.254
10 HB2 PHE 63 HB2 PHE 63 -7.359 -8.307 -1.550
11 HB3 PHE 63 HB3 PHE 63 -6.755 -6.663 -1.468
12 HD1 PHE 63 HD1 PHE 63 -7.640 -9.386 1.032
13 HD2 PHE 63 HD2 PHE 63 -4.673 -6.611 -0.400
14 HE1 PHE 63 HE1 PHE 63 -6.067 -10.146 2.787
15 HE2 PHE 63 HE2 PHE 63 -3.101 -7.379 1.366
16 HZ PHE 63 HZ PHE 63 -3.810 -9.147 2.968
17 H ALA 64 H ALA 64 -7.231 -6.297 1.679
18 HA ALA 64 HA ALA 64 -8.064 -3.438 1.637
19 HB1 ALA 64 HB1 ALA 64 -8.099 -5.234 4.099
20 HB2 ALA 64 HB2 ALA 64 -8.425 -3.484 4.066
21 HB3 ALA 64 HB3 ALA 64 -9.527 -4.604 3.250
22 H CYS 65 H CYS 65 -6.653 -2.033 2.880
23 HA CYS 65 HA CYS 65 -3.798 -2.898 2.914
24 HB2 CYS 65 HB2 CYS 65 -5.263 -0.270 3.168
25 HB3 CYS 65 HB3 CYS 65 -3.543 -0.440 3.609
26 H ASP 66 H ASP 66 -2.880 -3.585 4.699
27 HA ASP 66 HA ASP 66 -4.016 -3.568 7.271
28 HB2 ASP 66 HB2 ASP 66 -1.910 -4.779 6.049
29 HB3 ASP 66 HB3 ASP 66 -1.015 -3.541 6.911
30 H ILE 67 H ILE 67 -2.227 -1.099 5.664
31 HA ILE 67 HA ILE 67 -1.576 0.451 8.094
32 HB ILE 67 HB ILE 67 -0.926 0.814 5.142
33 HG12 ILE 67 2HG1 ILE 67 0.164 -1.174 6.022
34 HG13 ILE 67 3HG1 ILE 67 1.335 0.080 5.693
35 HG21 ILE 67 HG21 ILE 67 0.100 2.405 7.520
36 HG22 ILE 67 HG22 ILE 67 0.809 2.445 5.893
37 HG23 ILE 67 HG23 ILE 67 -0.843 3.005 6.149
38 HD11 ILE 67 1HD1 ILE 67 0.284 -0.607 8.478
39 HD12 ILE 67 2HD1 ILE 67 1.815 -1.135 7.789
40 HD13 ILE 67 3HD1 ILE 67 1.540 0.591 8.083
41 H CYS 68 H CYS 68 -3.349 1.063 5.044
42 HA CYS 68 HA CYS 68 -4.507 3.525 6.005
43 HB2 CYS 68 HB2 CYS 68 -4.969 1.744 3.580
44 HB3 CYS 68 HB3 CYS 68 -5.834 3.241 3.854
45 H GLY 69 H GLY 69 -5.498 0.142 6.201
46 HA2 GLY 69 HA2 GLY 69 -7.413 -0.915 6.897
47 HA3 GLY 69 HA3 GLY 69 -8.068 0.622 7.454
48 H ARG 70 H ARG 70 -7.239 1.159 4.315
49 HA ARG 70 HA ARG 70 -10.040 1.251 3.507
50 HB2 ARG 70 HB2 ARG 70 -7.496 2.147 2.084
51 HB3 ARG 70 HB3 ARG 70 -9.142 2.472 1.516
52 HG2 ARG 70 HG2 ARG 70 -9.654 3.724 3.563
53 HG3 ARG 70 HG3 ARG 70 -8.095 3.329 4.248
54 HD2 ARG 70 HD2 ARG 70 -6.980 4.600 2.373
55 HD3 ARG 70 HD3 ARG 70 -8.588 5.116 1.863
56 HE ARG 70 HE ARG 70 -8.901 6.277 3.917
57 HH11 ARG 70 1HH1 ARG 70 -5.509 5.102 3.812
58 HH12 ARG 70 2HH1 ARG 70 -5.158 5.981 5.249
59 HH21 ARG 70 1HH2 ARG 70 -8.197 7.443 5.635
60 HH22 ARG 70 2HH2 ARG 70 -6.621 7.163 6.287
61 H LYS 71 H LYS 71 -11.028 0.355 1.745
62 HA LYS 71 HA LYS 71 -10.217 -2.368 1.016
63 HB2 LYS 71 HB2 LYS 71 -12.525 -0.592 0.139
64 HB3 LYS 71 HB3 LYS 71 -12.344 -2.287 -0.319
65 HG2 LYS 71 HG2 LYS 71 -12.595 -3.024 1.968
66 HG3 LYS 71 HG3 LYS 71 -12.507 -1.374 2.588
67 HD2 LYS 71 HD2 LYS 71 -14.797 -2.190 2.602
68 HD3 LYS 71 HD3 LYS 71 -14.627 -0.783 1.558
69 HE2 LYS 71 HE2 LYS 71 -14.816 -2.056 -0.431
70 HE3 LYS 71 HE3 LYS 71 -14.491 -3.588 0.411
71 HZ1 LYS 71 HZ1 LYS 71 -16.599 -3.400 1.524
72 HZ2 LYS 71 HZ2 LYS 71 -16.924 -1.938 0.839
73 HZ3 LYS 71 HZ3 LYS 71 -16.883 -3.285 -0.081
74 H PHE 72 H PHE 72 -9.733 -3.153 -1.038
75 HA PHE 72 HA PHE 72 -9.556 -1.328 -3.345
76 HB2 PHE 72 HB2 PHE 72 -7.407 -1.193 -1.872
77 HB3 PHE 72 HB3 PHE 72 -7.082 -2.835 -2.414
78 HD1 PHE 72 HD1 PHE 72 -5.677 -3.027 -4.347
79 HD2 PHE 72 HD2 PHE 72 -8.053 0.537 -3.792
80 HE1 PHE 72 HE1 PHE 72 -4.658 -2.016 -6.367
81 HE2 PHE 72 HE2 PHE 72 -7.025 1.530 -5.823
82 HZ PHE 72 HZ PHE 72 -5.320 0.253 -7.105
83 H ALA 73 H ALA 73 -8.795 -2.511 -5.312
84 HA ALA 73 HA ALA 73 -9.736 -5.230 -5.670
85 HB1 ALA 73 HB1 ALA 73 -9.809 -3.626 -7.481
86 HB2 ALA 73 HB2 ALA 73 -8.064 -3.332 -7.377
87 HB3 ALA 73 HB3 ALA 73 -8.673 -4.904 -7.926
88 H ARG 74 H ARG 74 -6.614 -4.776 -6.986
89 HA ARG 74 HA ARG 74 -5.035 -5.811 -4.758
90 HB2 ARG 74 HB2 ARG 74 -5.832 -7.932 -5.504
91 HB3 ARG 74 HB3 ARG 74 -5.609 -7.517 -7.197
92 HG2 ARG 74 HG2 ARG 74 -3.131 -7.508 -6.862
93 HG3 ARG 74 HG3 ARG 74 -3.367 -7.961 -5.163
94 HD2 ARG 74 HD2 ARG 74 -4.377 -10.096 -5.851
95 HD3 ARG 74 HD3 ARG 74 -4.417 -9.551 -7.535
96 HE ARG 74 HE ARG 74 -2.487 -10.733 -7.622
97 HH11 ARG 74 1HH1 ARG 74 -2.814 -11.686 -5.072
98 HH12 ARG 74 2HH1 ARG 74 -1.151 -11.733 -4.568
99 HH21 ARG 74 1HH2 ARG 74 -0.146 -9.540 -7.032
100 HH22 ARG 74 2HH2 ARG 74 0.318 -10.766 -5.925
101 H SER 75 H SER 75 -4.626 -5.836 -8.268
102 HA SER 75 HA SER 75 -3.304 -4.824 -9.730
103 HB2 SER 75 HB2 SER 75 -2.839 -2.602 -7.730
104 HB3 SER 75 HB3 SER 75 -2.337 -2.615 -9.427
105 HG SER 75 HG SER 75 -4.332 -1.570 -9.217
106 H1 OUD 76 H OUD 76 -1.249 -4.932 -10.441
107 HA OUD 76 HA OUD 76 0.863 -5.842 -8.580
108 HB3 OUD 76 HB3 OUD 76 -0.813 -7.729 -9.299
109 HB2 OUD 76 HB2 OUD 76 -0.040 -7.651 -10.870
110 HM3 OUD 76 HM3 OUD 76 2.403 -5.696 -10.368
111 HM2 OUD 76 HM2 OUD 76 1.141 -5.792 -11.603
112 HN2 OUD 76 HN2 OUD 76 1.000 -3.530 -11.613
113 H OUE 77 H OUE 77 0.708 -1.484 -10.725
114 HA OUE 77 HA OUE 77 2.120 -0.930 -8.289
115 HB3 OUE 77 HB3 OUE 77 0.336 1.138 -9.588
116 HB2 OUE 77 HB2 OUE 77 1.822 1.336 -8.695
117 HG3 OUE 77 HG3 OUE 77 2.435 1.807 -10.917
118 HG2 OUE 77 HG2 OUE 77 3.050 0.189 -10.681
119 HM2 OUE 77 HM2 OUE 77 -0.904 -0.498 -8.267
120 HM3 OUE 77 HM3 OUE 77 0.234 0.112 -7.056
121 HN2 OUE 77 HN2 OUE 77 0.011 -2.815 -7.569
122 H1 OUK 78 H OUK 78 -1.075 -4.002 -5.945
123 HA OUK 78 HA OUK 78 0.415 -3.172 -3.490
124 HB2 OUK 78 HB2 OUK 78 -0.561 -5.276 -2.460
125 HB3 OUK 78 HB3 OUK 78 -1.578 -5.460 -3.887
126 HG2 OUK 78 HG2 OUK 78 -2.562 -3.123 -3.335
127 HG3 OUK 78 HG3 OUK 78 -1.661 -3.197 -1.822
128 HD2 OUK 78 HD2 OUK 78 -2.873 -5.429 -1.345
129 HD3 OUK 78 HD3 OUK 78 -3.821 -5.144 -2.798
130 HE2 OUK 78 HE2 OUK 78 -5.236 -4.283 -1.097
131 HE3 OUK 78 HE3 OUK 78 -4.421 -2.823 -1.694
132 HZ3 OUK 78 HZ3 OUK 78 -4.361 -2.696 0.634
133 HZ1 OUK 78 HZ1 OUK 78 -2.828 -3.182 0.253
134 HZ2 OUK 78 HZ2 OUK 78 -3.936 -4.292 0.851
135 HM3 OUK 78 HM3 OUK 78 1.602 -5.299 -3.673
136 HM2 OUK 78 HM2 OUK 78 0.588 -5.799 -5.035
137 HN2 OUK 78 HN2 OUK 78 1.688 -4.302 -6.466
138 H OUR 79 H OUR 79 3.293 -3.099 -7.146
139 HA OUR 79 HA OUR 79 5.271 -2.085 -5.143
140 HB3 OUR 79 HB3 OUR 79 5.657 -2.573 -8.148
141 HB2 OUR 79 HB2 OUR 79 6.850 -1.838 -7.074
142 HG3 OUR 79 HG3 OUR 79 7.054 -3.932 -5.780
143 HG2 OUR 79 HG2 OUR 79 5.779 -4.699 -6.725
144 HD3 OUR 79 HD3 OUR 79 7.097 -4.545 -8.793
145 HD2 OUR 79 HD2 OUR 79 8.378 -3.628 -7.940
146 HE OUR 79 HE OUR 79 7.921 -6.075 -6.576
147 HH12 OUR 79 2HH1 OUR 79 11.157 -7.025 -7.968
148 HH11 OUR 79 1HH1 OUR 79 10.495 -6.545 -6.455
149 HH22 OUR 79 2HH2 OUR 79 8.255 -6.605 -9.892
150 HM2 OUR 79 HM2 OUR 79 4.291 -0.625 -7.643
151 HM3 OUR 79 HM3 OUR 79 5.295 0.022 -6.336
152 HN2 OUR 79 HN2 OUR 79 2.379 -0.605 -6.214
153 HH21 OUR 79 1HH2 OUR 79 9.969 -6.772 -9.945
154 H OUH 80 H OUH 80 1.147 0.789 -5.168
155 HA OUH 80 HA OUH 80 2.444 2.096 -2.828
156 HB2 OUH 80 HB2 OUH 80 0.249 3.030 -4.437
157 HB3 OUH 80 HB3 OUH 80 1.010 3.775 -3.059
158 HD2 OUH 80 HD2 OUH 80 -0.294 3.720 -0.727
159 HD1 OUH 80 HD1 OUH 80 -2.048 1.437 -3.810
160 HE1 OUH 80 HE1 OUH 80 -3.614 1.545 -1.750
161 HM2 OUH 80 HM2 OUH 80 0.093 0.153 -2.770
162 HM3 OUH 80 HM3 OUH 80 0.914 0.877 -1.376
163 HN2 OUH 80 HN2 OUH 80 2.005 -1.168 -3.235
164 H1 OUK 81 H OUK 81 3.770 -2.302 -2.628
165 HA OUK 81 HA OUK 81 5.046 -1.530 -0.039
166 HB2 OUK 81 HB2 OUK 81 6.122 -3.749 -0.075
167 HB3 OUK 81 HB3 OUK 81 5.380 -4.118 -1.625
168 HG2 OUK 81 HG2 OUK 81 3.088 -3.970 -0.523
169 HG3 OUK 81 HG3 OUK 81 3.890 -3.720 1.030
170 HD2 OUK 81 HD2 OUK 81 5.027 -5.938 0.789
171 HD3 OUK 81 HD3 OUK 81 4.336 -6.134 -0.811
172 HE2 OUK 81 HE2 OUK 81 2.955 -7.462 0.563
173 HE3 OUK 81 HE3 OUK 81 1.993 -5.994 0.321
174 HZ3 OUK 81 HZ3 OUK 81 2.608 -5.314 2.560
175 HZ1 OUK 81 HZ1 OUK 81 3.613 -6.641 2.735
176 HZ2 OUK 81 HZ2 OUK 81 1.963 -6.852 2.605
177 HM3 OUK 81 HM3 OUK 81 7.223 -1.624 -1.083
178 HM2 OUK 81 HM2 OUK 81 6.550 -2.264 -2.587
179 HN2 OUK 81 HN2 OUK 81 5.628 -0.133 -3.118
180 H OUI 82 H OUI 82 5.712 2.048 -3.144
181 HA OUI 82 HA OUI 82 6.735 3.363 -0.681
182 HB OUI 82 HB OUI 82 7.555 5.252 -1.896
183 3HG1 OUI 82 3HG1 OUI 82 6.636 3.883 -4.483
184 2HG1 OUI 82 2HG1 OUI 82 6.038 5.396 -3.810
185 1HG2 OUI 82 1HG2 OUI 82 8.751 2.808 -3.295
186 2HG2 OUI 82 2HG2 OUI 82 8.992 3.144 -1.577
187 3HG2 OUI 82 3HG2 OUI 82 9.568 4.294 -2.784
188 2HD1 OUI 82 2HD1 OUI 82 8.821 4.946 -4.977
189 3HD1 OUI 82 3HD1 OUI 82 8.336 6.415 -4.103
190 1HD1 OUI 82 1HD1 OUI 82 7.526 5.960 -5.609
191 HM2 OUI 82 HM2 OUI 82 4.584 4.376 -2.590
192 HM3 OUI 82 HM3 OUI 82 5.077 5.098 -1.047
193 HN2 OUI 82 HN2 OUI 82 4.024 2.338 -1.203
194 H OUH 83 H OUH 83 3.886 1.489 0.668
195 HA OUH 83 HA OUH 83 3.067 3.113 3.011
196 HB2 OUH 83 HB2 OUH 83 3.026 0.993 4.232
197 HB3 OUH 83 HB3 OUH 83 3.711 0.134 2.869
198 HD2 OUH 83 HD2 OUH 83 0.841 2.728 2.327
199 HD1 OUH 83 HD1 OUH 83 1.498 -1.438 2.415
200 HE1 OUH 83 HE1 OUH 83 -0.842 -0.888 1.431
201 HM2 OUH 83 HM2 OUH 83 5.136 2.305 4.220
202 HM3 OUH 83 HM3 OUH 83 5.404 3.532 2.976
203 HN2 OUH 83 HN2 OUH 83 5.987 1.499 1.490
204 H ARG 84 H ARG 84 8.031 0.812 1.136
205 HA ARG 84 HA ARG 84 9.861 0.400 3.433
206 HB2 ARG 84 HB2 ARG 84 9.702 -1.182 1.508
207 HB3 ARG 84 HB3 ARG 84 10.335 0.072 0.432
208 HG2 ARG 84 HG2 ARG 84 12.478 0.075 1.605
209 HG3 ARG 84 HG3 ARG 84 11.800 -0.914 2.901
210 HD2 ARG 84 HD2 ARG 84 13.078 -2.412 1.678
211 HD3 ARG 84 HD3 ARG 84 11.445 -2.751 1.154
212 HE ARG 84 HE ARG 84 11.911 -1.444 -0.922
213 HH11 ARG 84 1HH1 ARG 84 15.002 -1.601 -2.427
214 HH12 ARG 84 2HH1 ARG 84 13.326 -1.221 -2.657
215 HH21 ARG 84 1HH2 ARG 84 15.789 -2.273 -0.548
216 HH22 ARG 84 2HH2 ARG 84 14.744 -2.610 0.811
217 H LYS 85 H LYS 85 9.096 2.916 1.319
218 HA LYS 85 HA LYS 85 11.116 4.780 2.329
219 HB2 LYS 85 HB2 LYS 85 10.710 4.184 -0.645
220 HB3 LYS 85 HB3 LYS 85 11.505 5.619 -0.039
221 HG2 LYS 85 HG2 LYS 85 13.370 4.380 0.798
222 HG3 LYS 85 HG3 LYS 85 12.568 2.830 0.502
223 HD2 LYS 85 HD2 LYS 85 14.280 3.387 -1.218
224 HD3 LYS 85 HD3 LYS 85 12.678 3.061 -1.858
225 HE2 LYS 85 HE2 LYS 85 13.799 4.902 -3.031
226 HE3 LYS 85 HE3 LYS 85 12.270 5.407 -2.314
227 HZ1 LYS 85 HZ1 LYS 85 13.387 6.617 -0.677
228 HZ2 LYS 85 HZ2 LYS 85 14.859 5.859 -0.948
229 HZ3 LYS 85 HZ3 LYS 85 14.232 6.931 -2.026
230 H ASP 86 H ASP 86 10.497 6.954 1.594
231 HA ASP 86 HA ASP 86 8.363 7.136 -0.298
232 HB2 ASP 86 HB2 ASP 86 7.113 7.612 1.790
233 HB3 ASP 86 HB3 ASP 86 8.211 8.948 2.143
234 H1 HOH 201 H1 HOH 194 12.766 9.378 -2.299
235 H2 HOH 201 H2 HOH 194 11.883 8.277 -1.750
236 H1 HOH 202 H1 HOH 184 9.286 12.076 -1.544
237 H2 HOH 202 H2 HOH 184 9.968 10.822 -1.033
238 H1 HOH 203 H1 HOH 71 1.727 -6.303 8.902
239 H2 HOH 203 H2 HOH 71 0.592 -5.667 8.132
240 H1 HOH 204 H1 HOH 168 -2.137 3.813 2.358
241 H2 HOH 204 H2 HOH 168 -1.027 4.229 1.410
242 H1 HOH 205 H1 HOH 189 10.136 10.561 1.560
243 H2 HOH 205 H2 HOH 189 9.784 11.961 2.020
244 H1 HOH 206 H1 HOH 72 -5.795 -4.434 9.310
245 H2 HOH 206 H2 HOH 72 -4.726 -5.201 8.559
246 H1 HOH 207 H1 HOH 56 -3.748 -6.787 11.046
247 H2 HOH 207 H2 HOH 56 -3.080 -5.776 10.136
248 H1 HOH 208 H1 HOH 126 -0.533 -2.073 -13.024
249 H2 HOH 208 H2 HOH 126 -0.807 -0.740 -12.356
250 H1 HOH 209 H1 HOH 165 5.583 7.859 -1.593
251 H2 HOH 209 H2 HOH 165 4.116 8.185 -1.732
252 H1 HOH 210 H1 HOH 146 1.477 -9.726 -12.313
253 H2 HOH 210 H2 HOH 146 2.069 -8.620 -11.468
254 H1 HOH 211 H1 HOH 144 -0.802 3.217 -12.602
255 H2 HOH 211 H2 HOH 144 -0.078 2.251 -11.694
256 H1 HOH 212 H1 HOH 15 -11.451 -0.393 7.885
257 H2 HOH 212 H2 HOH 15 -11.067 -0.686 6.449
258 H1 HOH 213 H1 HOH 129 -3.896 0.753 -10.033
259 H2 HOH 213 H2 HOH 129 -5.287 0.489 -9.490
260 H1 HOH 214 H1 HOH 76 -3.342 -0.841 11.480
261 H2 HOH 214 H2 HOH 76 -3.732 -0.898 10.017
262 H1 HOH 215 H1 HOH 24 2.321 -11.342 -7.811
263 H2 HOH 215 H2 HOH 24 2.407 -10.113 -8.688
264 H1 HOH 216 H1 HOH 108 -11.252 0.958 -1.857
265 H2 HOH 216 H2 HOH 108 -11.799 1.909 -2.903
266 H1 HOH 217 H1 HOH 179 3.062 0.902 -13.308
267 H2 HOH 217 H2 HOH 179 3.324 2.260 -13.928
268 H1 HOH 218 H1 HOH 6 -12.594 -10.036 0.166
269 H2 HOH 218 H2 HOH 6 -11.163 -9.726 -0.221
270 H1 HOH 219 H1 HOH 47 4.033 -8.701 -9.703
271 H2 HOH 219 H2 HOH 47 4.505 -10.050 -9.215
272 H1 HOH 220 H1 HOH 157 4.883 9.536 -0.596
273 H2 HOH 220 H2 HOH 157 3.867 10.158 0.328
274 H1 HOH 221 H1 HOH 138 0.628 0.267 -14.013
275 H2 HOH 221 H2 HOH 138 -0.769 -0.110 -14.455
276 H1 HOH 222 H1 HOH 67 -3.233 -7.206 7.613
277 H2 HOH 222 H2 HOH 67 -1.750 -7.458 7.702
278 H1 HOH 223 H1 HOH 153 -11.298 -9.325 -7.117
279 H2 HOH 223 H2 HOH 153 -9.934 -9.774 -6.614
280 H1 HOH 224 H1 HOH 110 -19.766 -3.691 0.517
281 H2 HOH 224 H2 HOH 110 -19.378 -3.589 -0.943
282 H1 HOH 225 H1 HOH 23 -4.721 -13.388 -5.073
283 H2 HOH 225 H2 HOH 23 -4.672 -12.532 -3.826
284 H1 HOH 226 H1 HOH 27 2.107 -12.804 -5.929
285 H2 HOH 226 H2 HOH 27 0.668 -13.019 -6.349
286 H1 HOH 227 H1 HOH 185 15.601 8.625 -2.854
287 H2 HOH 227 H2 HOH 185 15.933 7.631 -3.949
288 H1 HOH 228 H1 HOH 60 7.719 2.681 5.773
289 H2 HOH 228 H2 HOH 60 8.334 3.869 6.481
290 H1 HOH 229 H1 HOH 181 12.604 0.378 -4.334
291 H2 HOH 229 H2 HOH 181 11.446 -0.600 -4.271
292 H1 HOH 230 H1 HOH 32 -0.576 -14.103 -3.216
293 H2 HOH 230 H2 HOH 32 -0.520 -13.877 -4.713
294 H1 HOH 231 H1 HOH 74 -3.158 5.140 8.747
295 H2 HOH 231 H2 HOH 74 -3.999 3.999 8.225
296 H1 HOH 232 H1 HOH 44 1.241 -7.010 4.714
297 H2 HOH 232 H2 HOH 44 0.241 -8.121 4.451
298 H1 HOH 233 H1 HOH 106 -18.451 0.025 2.249
299 H2 HOH 233 H2 HOH 106 -18.048 -1.357 2.719
300 H1 HOH 234 H1 HOH 134 -9.631 -0.505 -6.830
301 H2 HOH 234 H2 HOH 134 -10.821 -1.346 -6.409
302 H1 HOH 235 H1 HOH 63 2.114 -3.303 3.597
303 H2 HOH 235 H2 HOH 63 1.450 -4.500 4.245
304 H1 HOH 236 H1 HOH 1 -16.267 -5.546 3.130
305 H2 HOH 236 H2 HOH 1 -15.416 -4.351 3.507
306 H1 HOH 237 H1 HOH 59 6.035 -7.402 2.509
307 H2 HOH 237 H2 HOH 59 5.062 -8.342 3.193
308 H1 HOH 238 H1 HOH 130 -4.170 -7.491 -10.388
309 H2 HOH 238 H2 HOH 130 -5.585 -7.654 -9.862
310 H1 HOH 239 H1 HOH 87 6.300 -7.041 -11.381
311 H2 HOH 239 H2 HOH 87 6.046 -8.078 -10.304
312 H1 HOH 240 H1 HOH 92 17.109 -1.222 -2.448
313 H2 HOH 240 H2 HOH 92 18.003 -1.120 -1.229
314 H1 HOH 241 H1 HOH 172 -5.758 7.553 8.225
315 H2 HOH 241 H2 HOH 172 -5.415 6.081 8.360
316 H1 HOH 242 H1 HOH 93 16.657 5.493 0.631
317 H2 HOH 242 H2 HOH 93 16.882 4.163 -0.060
318 H1 HOH 243 H1 HOH 182 12.649 -6.164 -10.124
319 H2 HOH 243 H2 HOH 182 12.357 -7.551 -10.651
320 H1 HOH 244 H1 HOH 36 7.313 -8.285 -6.460
321 H2 HOH 244 H2 HOH 36 6.191 -7.725 -5.608
322 H1 HOH 245 H1 HOH 159 -5.697 10.165 7.081
323 H2 HOH 245 H2 HOH 159 -6.997 9.467 6.746
324 H1 HOH 246 H1 HOH 120 -11.200 7.311 3.388
325 H2 HOH 246 H2 HOH 120 -10.886 6.857 4.799
326 H1 HOH 247 H1 HOH 96 16.486 -1.106 -4.696
327 H2 HOH 247 H2 HOH 96 16.117 0.235 -4.094
328 H1 HOH 248 H1 HOH 123 -9.457 9.131 6.232
329 H2 HOH 248 H2 HOH 123 -9.022 10.512 5.796
330 H1 HOH 249 H1 HOH 140 1.213 -3.711 -14.079
331 H2 HOH 249 H2 HOH 140 1.413 -2.283 -13.606
332 H1 HOH 250 H1 HOH 105 -17.143 0.144 0.111
333 H2 HOH 250 H2 HOH 105 -15.944 0.321 -0.800
334 H1 HOH 251 H1 HOH 112 -17.128 -5.062 -2.044
335 H2 HOH 251 H2 HOH 112 -16.167 -5.604 -1.008
336 H1 HOH 252 H1 HOH 34 -3.352 -11.792 -10.199
337 H2 HOH 252 H2 HOH 34 -1.970 -11.381 -9.743
338 H1 HOH 253 H1 HOH 125 -5.231 -2.134 -11.290
339 H2 HOH 253 H2 HOH 125 -4.820 -2.890 -12.535
340 H1 HOH 254 H1 HOH 131 -2.566 -4.665 -12.785
341 H2 HOH 254 H2 HOH 131 -1.162 -5.232 -12.841
342 H1 HOH 255 H1 HOH 122 -7.921 6.721 8.238
343 H2 HOH 255 H2 HOH 122 -9.044 6.531 9.235
344 H1 HOH 256 H1 HOH 21 3.401 -7.427 -3.522
345 H2 HOH 256 H2 HOH 21 3.969 -6.092 -3.961
346 H1 HOH 257 H1 HOH 186 16.507 5.940 -3.079
347 H2 HOH 257 H2 HOH 186 16.659 4.956 -1.938
348 H1 HOH 258 H1 HOH 163 -7.107 7.927 0.260
349 H2 HOH 258 H2 HOH 163 -6.131 7.542 1.350
350 H1 HOH 259 H1 HOH 89 12.474 -5.319 -4.741
351 H2 HOH 259 H2 HOH 89 12.528 -6.772 -5.158
352 H1 HOH 260 H1 HOH 73 5.182 -5.874 4.040
353 H2 HOH 260 H2 HOH 73 5.715 -4.479 4.300
354 H1 HOH 261 H1 HOH 90 13.989 1.340 3.117
355 H2 HOH 261 H2 HOH 90 13.992 0.381 4.286
356 H1 HOH 262 H1 HOH 3 -13.307 -12.177 -3.206
357 H2 HOH 262 H2 HOH 3 -12.640 -12.581 -4.505
358 H1 HOH 263 H1 HOH 58 3.212 -5.463 5.495
359 H2 HOH 263 H2 HOH 58 2.045 -5.703 6.434
360 H1 HOH 264 H1 HOH 118 -13.472 1.229 2.465
361 H2 HOH 264 H2 HOH 118 -12.789 2.556 2.211
362 H1 HOH 265 H1 HOH 57 9.216 1.392 6.495
363 H2 HOH 265 H2 HOH 57 9.576 0.440 7.612
364 H1 HOH 266 H1 HOH 166 -4.308 4.296 -2.434
365 H2 HOH 266 H2 HOH 166 -5.495 3.492 -2.919
366 H1 HOH 267 H1 HOH 121 -9.961 7.243 7.102
367 H2 HOH 267 H2 HOH 121 -11.371 7.756 6.900
368 H1 HOH 268 H1 HOH 97 15.948 -5.159 0.884
369 H2 HOH 268 H2 HOH 97 17.237 -4.451 1.250
370 H1 HOH 269 H1 HOH 17 -7.769 2.582 8.934
371 H2 HOH 269 H2 HOH 17 -7.607 1.624 10.097
372 H1 HOH 270 H1 HOH 162 -2.249 5.599 -2.914
373 H2 HOH 270 H2 HOH 162 -2.933 5.235 -4.215
374 H1 HOH 271 H1 HOH 85 8.203 -9.771 -8.244
375 H2 HOH 271 H2 HOH 85 6.857 -9.170 -8.604
376 H1 HOH 272 H1 HOH 95 14.371 -6.074 0.039
377 H2 HOH 272 H2 HOH 95 13.553 -6.112 1.312
378 H1 HOH 273 H1 HOH 70 8.999 -0.867 5.629
379 H2 HOH 273 H2 HOH 70 9.698 -2.199 5.477
380 H1 HOH 274 H1 HOH 174 6.719 8.888 -3.301
381 H2 HOH 274 H2 HOH 174 7.996 9.297 -4.008
382 H1 HOH 275 H1 HOH 33 -1.463 -14.129 -6.824
383 H2 HOH 275 H2 HOH 33 -0.341 -15.139 -6.927
384 H1 HOH 276 H1 HOH 40 -1.068 -5.148 2.194
385 H2 HOH 276 H2 HOH 40 0.094 -4.178 2.177
386 H1 HOH 277 H1 HOH 55 -1.235 5.531 10.178
387 H2 HOH 277 H2 HOH 55 -1.056 4.153 9.578
388 H1 HOH 278 H1 HOH 81 14.075 -6.614 -6.297
389 H2 HOH 278 H2 HOH 81 14.413 -8.091 -6.368
390 H1 HOH 279 H1 HOH 187 12.780 11.328 -0.703
391 H2 HOH 279 H2 HOH 187 11.814 11.320 -1.866
392 H1 HOH 280 H1 HOH 16 -9.927 -2.952 8.178
393 H2 HOH 280 H2 HOH 16 -11.052 -2.606 7.231
394 H1 HOH 281 H1 HOH 101 13.248 0.295 6.561
395 H2 HOH 281 H2 HOH 101 12.003 0.369 5.705
396 H1 HOH 282 H1 HOH 68 3.786 -2.060 5.025
397 H2 HOH 282 H2 HOH 68 4.111 -3.371 4.338
398 H1 HOH 283 H1 HOH 8 -17.752 -3.321 4.039
399 H2 HOH 283 H2 HOH 8 -18.885 -2.575 4.715
400 H1 HOH 284 H1 HOH 5 -9.028 -11.805 1.501
401 H2 HOH 284 H2 HOH 5 -10.248 -11.409 0.694
402 H1 HOH 285 H1 HOH 158 -2.059 6.695 3.251
403 H2 HOH 285 H2 HOH 158 -3.027 5.556 2.988
404 H1 HOH 286 H1 HOH 128 -6.640 -3.921 -11.348
405 H2 HOH 286 H2 HOH 128 -6.278 -5.012 -10.365
406 H1 HOH 287 H1 HOH 164 -3.859 7.409 1.983
407 H2 HOH 287 H2 HOH 164 -4.079 8.904 1.917
408 H1 HOH 288 H1 HOH 62 0.739 2.490 10.167
409 H2 HOH 288 H2 HOH 62 -0.655 1.980 10.465
410 H1 HOH 289 H1 HOH 113 -13.764 -9.233 -8.181
411 H2 HOH 289 H2 HOH 113 -13.069 -8.147 -7.386
412 H1 HOH 290 H1 HOH 124 -11.468 2.999 -0.821
413 H2 HOH 290 H2 HOH 124 -11.930 2.574 0.556
414 H1 HOH 291 H1 HOH 13 -9.712 1.145 9.255
415 H2 HOH 291 H2 HOH 13 -11.078 0.960 9.874
416 H1 HOH 292 H1 HOH 28 -3.700 -14.441 -8.003
417 H2 HOH 292 H2 HOH 28 -2.902 -13.193 -8.321
418 H1 HOH 293 H1 HOH 98 18.307 -3.479 3.089
419 H2 HOH 293 H2 HOH 98 17.300 -2.414 2.705
420 H1 HOH 294 H1 HOH 102 11.638 5.398 5.032
421 H2 HOH 294 H2 HOH 102 11.099 6.812 5.112
422 H1 HOH 295 H1 HOH 41 -7.127 -6.537 6.421
423 H2 HOH 295 H2 HOH 41 -5.930 -6.240 7.298
424 H1 HOH 296 H1 HOH 79 13.117 -1.868 -5.181
425 H2 HOH 296 H2 HOH 79 13.012 -2.224 -6.648
426 H1 HOH 297 H1 HOH 94 17.771 -3.367 -1.807
427 H2 HOH 297 H2 HOH 94 17.650 -4.655 -1.020
428 H1 HOH 298 H1 HOH 48 -8.022 -10.793 -6.832
429 H2 HOH 298 H2 HOH 48 -8.318 -11.143 -5.386
430 H1 HOH 299 H1 HOH 127 -9.991 -6.866 -8.715
431 H2 HOH 299 H2 HOH 127 -9.620 -7.958 -7.730
432 H1 HOH 300 H1 HOH 31 2.488 -9.431 -3.774
433 H2 HOH 300 H2 HOH 31 1.171 -8.748 -3.476
434 H1 HOH 301 H1 HOH 14 -8.488 -1.638 9.955
435 H2 HOH 301 H2 HOH 14 -9.668 -1.002 9.252
436 H1 HOH 302 H1 HOH 25 4.315 -10.277 2.116
437 H2 HOH 302 H2 HOH 25 4.535 -10.751 3.536
438 H1 HOH 303 H1 HOH 42 -0.811 -6.754 3.599
439 H2 HOH 303 H2 HOH 42 -2.299 -6.744 3.884
440 H1 HOH 304 H1 HOH 115 -12.780 -2.824 -6.673
441 H2 HOH 304 H2 HOH 115 -12.886 -1.789 -7.771
442 H1 HOH 305 H1 HOH 155 -13.166 -5.567 -6.847
443 H2 HOH 305 H2 HOH 155 -12.290 -6.173 -7.926
444 H1 HOH 306 H1 HOH 193 10.560 8.669 -4.626
445 H2 HOH 306 H2 HOH 193 11.786 8.101 -3.941
446 H1 HOH 307 H1 HOH 91 15.965 -0.352 3.303
447 H2 HOH 307 H2 HOH 91 17.376 -0.242 3.836
448 H1 HOH 308 H1 HOH 7 -14.989 -10.185 -0.871
449 H2 HOH 308 H2 HOH 7 -14.751 -9.504 0.458
450 H1 HOH 309 H1 HOH 188 9.583 -0.477 -5.525
451 H2 HOH 309 H2 HOH 188 8.988 -0.180 -4.165
452 H1 HOH 310 H1 HOH 167 0.071 6.446 -2.999
453 H2 HOH 310 H2 HOH 167 -0.595 7.062 -1.789
454 H1 HOH 311 H1 HOH 38 2.761 -9.174 -1.465
455 H2 HOH 311 H2 HOH 38 4.203 -9.273 -1.021
456 H1 HOH 312 H1 HOH 151 -2.822 -6.922 -12.040
457 H2 HOH 312 H2 HOH 151 -3.331 -8.138 -12.788
458 H1 HOH 313 H1 HOH 154 1.723 -5.369 -15.765
459 H2 HOH 313 H2 HOH 154 2.352 -5.897 -14.493
460 H1 HOH 314 H1 HOH 84 15.512 -5.829 -2.867
461 H2 HOH 314 H2 HOH 84 16.631 -4.857 -3.171
462 H1 HOH 315 H1 HOH 43 -1.663 -8.555 5.989
463 H2 HOH 315 H2 HOH 43 -1.486 -9.770 5.102
464 H1 HOH 316 H1 HOH 104 -18.584 -0.209 -3.186
465 H2 HOH 316 H2 HOH 104 -17.848 -0.750 -1.979
466 H1 HOH 317 H1 HOH 19 -6.637 -11.401 -3.646
467 H2 HOH 317 H2 HOH 19 -7.950 -11.851 -3.046
468 H1 HOH 318 H1 HOH 51 -0.386 -1.882 13.206
469 H2 HOH 318 H2 HOH 51 -1.217 -2.870 12.416
470 H1 HOH 319 H1 HOH 149 -11.808 3.542 -4.628
471 H2 HOH 319 H2 HOH 149 -10.339 3.205 -4.481
472 H1 HOH 320 H1 HOH 176 6.610 0.572 -14.256
473 H2 HOH 320 H2 HOH 176 5.308 0.755 -13.504
474 H1 HOH 321 H1 HOH 171 6.483 6.872 3.839
475 H2 HOH 321 H2 HOH 171 6.884 6.054 5.050
476 H1 HOH 322 H1 HOH 117 -12.592 3.381 4.443
477 H2 HOH 322 H2 HOH 117 -12.398 2.883 5.861
478 H1 HOH 323 H1 HOH 137 -3.273 -2.976 -14.318
479 H2 HOH 323 H2 HOH 137 -2.587 -2.493 -13.057
480 H1 HOH 324 H1 HOH 169 0.186 5.691 6.890
481 H2 HOH 324 H2 HOH 169 -1.089 5.509 7.690
482 H1 HOH 325 H1 HOH 191 15.052 4.094 -5.367
483 H2 HOH 325 H2 HOH 191 15.785 3.921 -4.053
484 H1 HOH 326 H1 HOH 152 2.761 -7.835 -13.414
485 H2 HOH 326 H2 HOH 152 3.693 -8.034 -14.592
486 H1 HOH 327 H1 HOH 192 15.591 11.106 -2.969
487 H2 HOH 327 H2 HOH 192 14.324 10.625 -2.294
488 H1 HOH 328 H1 HOH 69 7.571 -2.575 4.412
489 H2 HOH 328 H2 HOH 69 6.221 -2.240 3.814
490 H1 HOH 329 H1 HOH 136 0.628 0.151 -16.446
491 H2 HOH 329 H2 HOH 136 1.987 0.429 -17.048
492 H1 HOH 330 H1 HOH 178 6.155 -0.566 -11.953
493 H2 HOH 330 H2 HOH 178 5.056 -1.365 -11.288
494 H1 HOH 331 H1 HOH 119 -11.690 5.023 3.082
495 H2 HOH 331 H2 HOH 119 -11.757 4.237 1.787
496 H1 HOH 332 H1 HOH 78 10.416 -10.903 -8.926
497 H2 HOH 332 H2 HOH 78 9.199 -11.796 -9.029
498 H1 HOH 333 H1 HOH 64 -2.159 -5.012 12.040
499 H2 HOH 333 H2 HOH 64 -1.593 -5.169 13.434
500 H1 HOH 334 H1 HOH 66 -5.513 0.397 10.884
501 H2 HOH 334 H2 HOH 66 -6.079 1.338 11.922
502 H1 HOH 335 H1 HOH 141 -7.632 0.936 -8.795
503 H2 HOH 335 H2 HOH 141 -7.235 1.806 -9.969
504 H1 HOH 336 H1 HOH 12 -10.958 -9.811 2.133
505 H2 HOH 336 H2 HOH 12 -10.908 -9.094 3.467
506 H1 HOH 337 H1 HOH 109 -13.954 1.347 0.197
507 H2 HOH 337 H2 HOH 109 -13.660 1.205 -1.281
508 H1 HOH 338 H1 HOH 196 13.762 2.465 -4.615
509 H2 HOH 338 H2 HOH 196 12.295 2.830 -4.718
510 H1 HOH 339 H1 HOH 49 -8.445 -12.385 -0.718
511 H2 HOH 339 H2 HOH 49 -8.287 -13.727 -1.397
512 H1 HOH 340 H1 HOH 170 4.424 6.261 4.795
513 H2 HOH 340 H2 HOH 170 3.227 6.754 4.012
514 H1 HOH 341 H1 HOH 195 10.789 4.899 -4.546
515 H2 HOH 341 H2 HOH 195 11.854 5.095 -5.601
516 H1 HOH 342 H1 HOH 156 2.643 4.373 -15.185
517 H2 HOH 342 H2 HOH 156 2.107 4.502 -13.774
518 H1 HOH 343 H1 HOH 26 -4.794 -12.184 -1.492
519 H2 HOH 343 H2 HOH 26 -6.210 -12.590 -1.847
520 H1 HOH 344 H1 HOH 11 -13.381 -4.459 4.900
521 H2 HOH 344 H2 HOH 11 -14.129 -3.167 5.138
522 H1 HOH 345 H1 HOH 61 9.212 5.681 5.571
523 H2 HOH 345 H2 HOH 61 8.422 6.347 6.676
524 H1 HOH 346 H1 HOH 30 -6.995 -9.505 -8.793
525 H2 HOH 346 H2 HOH 30 -6.997 -11.007 -8.972
526 H1 HOH 347 H1 HOH 175 9.078 10.590 4.982
527 H2 HOH 347 H2 HOH 175 10.133 10.528 3.898
528 H1 HOH 348 H1 HOH 147 -2.318 6.322 -6.298
529 H2 HOH 348 H2 HOH 147 -2.164 4.857 -6.639
530 H1 HOH 349 H1 HOH 45 7.530 -6.314 1.504
531 H2 HOH 349 H2 HOH 45 7.805 -7.452 0.541
532 H1 HOH 350 H1 HOH 116 -14.870 0.368 4.537
533 H2 HOH 350 H2 HOH 116 -13.772 1.400 4.390
534 H1 HOH 351 H1 HOH 86 16.128 -7.627 -1.383
535 H2 HOH 351 H2 HOH 86 16.273 -6.266 -0.735
536 H1 HOH 352 H1 HOH 37 -4.059 -8.902 6.582
537 H2 HOH 352 H2 HOH 37 -5.408 -8.298 6.249
538 H1 HOH 353 H1 HOH 103 -15.520 -4.097 -3.033
539 H2 HOH 353 H2 HOH 103 -15.690 -2.763 -3.729
540 H1 HOH 354 H1 HOH 183 4.687 -6.635 -13.133
541 H2 HOH 354 H2 HOH 183 5.648 -5.467 -13.215
542 H1 HOH 355 H1 HOH 83 14.281 -4.080 -5.944
543 H2 HOH 355 H2 HOH 83 15.126 -5.017 -5.102
544 H1 HOH 356 H1 HOH 150 -7.450 -7.469 -10.842
545 H2 HOH 356 H2 HOH 150 -7.962 -7.760 -9.446
546 H1 HOH 357 H1 HOH 107 -20.800 -2.953 -2.965
547 H2 HOH 357 H2 HOH 107 -19.407 -2.434 -2.666
548 H1 HOH 358 H1 HOH 198 16.830 7.334 -6.289
549 H2 HOH 358 H2 HOH 198 15.642 6.449 -5.971
550 H1 HOH 359 H1 HOH 145 1.769 5.642 -11.773
551 H2 HOH 359 H2 HOH 145 0.753 4.561 -12.095
552 H1 HOH 360 H1 HOH 100 13.110 -1.616 4.921
553 H2 HOH 360 H2 HOH 100 13.957 -2.871 4.880
554 H1 HOH 361 H1 HOH 161 -1.109 6.597 5.390
555 H2 HOH 361 H2 HOH 161 -0.511 7.847 4.783
556 H1 HOH 362 H1 HOH 135 3.792 4.050 -12.835
557 H2 HOH 362 H2 HOH 135 4.528 3.081 -11.936
558 H1 HOH 363 H1 HOH 139 -0.402 4.035 -10.097
559 H2 HOH 363 H2 HOH 139 -0.594 5.527 -9.944
560 H1 HOH 364 H1 HOH 111 -19.101 -4.732 -2.772
561 H2 HOH 364 H2 HOH 111 -19.149 -6.180 -3.209
562 H1 HOH 365 H1 HOH 65 2.797 -4.353 8.074
563 H2 HOH 365 H2 HOH 65 4.292 -4.491 8.269
564 H1 HOH 366 H1 HOH 18 -9.198 -4.603 7.225
565 H2 HOH 366 H2 HOH 18 -7.838 -5.028 7.741
566 H1 HOH 367 H1 HOH 54 4.092 -0.876 7.326
567 H2 HOH 367 H2 HOH 54 3.994 -2.376 7.131
568 H1 HOH 368 H1 HOH 80 8.606 -9.386 -3.565
569 H2 HOH 368 H2 HOH 80 7.769 -8.242 -4.101
570 H1 HOH 369 H1 HOH 9 -11.460 -4.410 6.334
571 H2 HOH 369 H2 HOH 9 -11.532 -5.838 5.837
572 H1 HOH 370 H1 HOH 114 -14.343 -3.927 -5.298
573 H2 HOH 370 H2 HOH 114 -14.893 -4.199 -6.681
574 H1 HOH 371 H1 HOH 177 6.960 -0.501 -9.825
575 H2 HOH 371 H2 HOH 177 7.235 0.934 -9.434
576 H1 HOH 372 H1 HOH 77 7.459 -4.041 2.680
577 H2 HOH 372 H2 HOH 77 8.803 -4.550 2.205
578 H1 HOH 373 H1 HOH 4 -14.410 -13.480 -1.371
579 H2 HOH 373 H2 HOH 4 -15.181 -12.235 -1.750
580 H1 HOH 374 H1 HOH 133 -9.800 1.482 -7.588
581 H2 HOH 374 H2 HOH 133 -10.135 0.734 -8.862
582 H1 HOH 375 H1 HOH 197 14.496 4.812 -7.530
583 H2 HOH 375 H2 HOH 197 13.696 5.759 -6.660
584 H1 HOH 376 H1 HOH 35 -2.201 -11.574 1.211
585 H2 HOH 376 H2 HOH 35 -0.977 -11.096 0.460
586 H1 HOH 377 H1 HOH 99 18.457 2.356 0.713
587 H2 HOH 377 H2 HOH 99 18.813 2.952 -0.632
588 H1 HOH 378 H1 HOH 82 12.123 -7.477 -1.982
589 H2 HOH 378 H2 HOH 82 11.390 -6.620 -2.989
590 H1 HOH 379 H1 HOH 143 -8.436 4.444 -4.030
591 H2 HOH 379 H2 HOH 143 -8.476 4.638 -5.530
592 H1 HOH 380 H1 HOH 180 9.752 0.668 -7.468
593 H2 HOH 380 H2 HOH 180 8.561 -0.196 -7.826
594 H1 HOH 381 H1 HOH 160 2.379 5.857 -8.880
595 H2 HOH 381 H2 HOH 160 1.124 5.312 -8.234
596 H1 HOH 382 H1 HOH 132 -11.797 -6.346 -10.177
597 H2 HOH 382 H2 HOH 132 -10.773 -5.293 -9.810
598 H1 HOH 383 H1 HOH 50 6.452 -8.872 -2.369
599 H2 HOH 383 H2 HOH 50 5.188 -8.097 -2.672
600 H1 HOH 384 H1 HOH 190 11.852 7.085 -6.017
601 H2 HOH 384 H2 HOH 190 11.643 6.832 -7.495
602 H1 HOH 385 H1 HOH 142 -8.755 -4.527 -10.739
603 H2 HOH 385 H2 HOH 142 -9.800 -3.755 -11.515
604 H1 HOH 386 H1 HOH 39 -7.846 -11.277 3.937
605 H2 HOH 386 H2 HOH 39 -9.138 -10.837 3.272
606 H1 HOH 387 H1 HOH 10 -9.674 -6.555 6.600
607 H2 HOH 387 H2 HOH 10 -10.366 -7.848 6.980
608 H1 HOH 388 H1 HOH 53 3.042 2.275 10.840
609 H2 HOH 388 H2 HOH 53 2.915 1.212 9.770
610 H1 HOH 389 H1 HOH 2 -17.323 -11.305 -0.964
611 H2 HOH 389 H2 HOH 2 -16.886 -10.893 -2.352
612 H1 HOH 390 H1 HOH 199 5.784 8.008 -6.743
613 H2 HOH 390 H2 HOH 199 6.874 8.624 -5.889
614 H1 HOH 391 H1 HOH 173 3.399 6.439 -7.090
615 H2 HOH 391 H2 HOH 173 4.055 6.816 -5.777
616 H1 HOH 392 H1 HOH 75 2.381 5.857 6.151
617 H2 HOH 392 H2 HOH 75 2.567 5.862 7.653
618 H1 HOH 393 H1 HOH 148 3.787 6.606 -10.406
619 H2 HOH 393 H2 HOH 148 3.549 5.198 -10.911
620 H1 HOH 394 H1 HOH 52 3.952 -0.912 9.789
621 H2 HOH 394 H2 HOH 52 5.129 -0.042 9.400
622 H1 HOH 395 H1 HOH 88 9.755 -7.203 -1.225
623 H2 HOH 395 H2 HOH 88 8.483 -7.877 -1.688
624 H1 HOH 396 H1 HOH 46 -6.809 -11.393 6.127
625 H2 HOH 396 H2 HOH 46 -5.966 -10.311 5.485
626 H1 HOH 397 H1 HOH 20 -7.627 -13.047 2.818
627 H2 HOH 397 H2 HOH 20 -7.692 -14.558 2.736
628 H1 HOH 398 H1 HOH 22 -3.301 -12.328 3.096
629 H2 HOH 398 H2 HOH 22 -2.018 -13.124 3.200
630 H1 HOH 399 H1 HOH 29 -5.412 -12.031 4.291
631 H2 HOH 399 H2 HOH 29 -5.512 -13.151 3.277
Start of MODEL 9
1 HA PRO 62 HA PRO 62 -10.004 -7.650 -4.003
2 HB2 PRO 62 HB2 PRO 62 -11.863 -5.753 -2.554
3 HB3 PRO 62 HB3 PRO 62 -10.704 -5.412 -3.879
4 HG2 PRO 62 HG2 PRO 62 -13.311 -5.692 -4.490
5 HG3 PRO 62 HG3 PRO 62 -12.098 -6.566 -5.492
6 HD2 PRO 62 HD2 PRO 62 -13.716 -7.613 -3.143
7 HD3 PRO 62 HD3 PRO 62 -13.520 -8.360 -4.750
8 H PHE 63 H PHE 63 -8.844 -6.088 -2.303
9 HA PHE 63 HA PHE 63 -8.777 -7.484 0.336
10 HB2 PHE 63 HB2 PHE 63 -6.959 -8.088 -1.282
11 HB3 PHE 63 HB3 PHE 63 -6.443 -6.411 -1.279
12 HD1 PHE 63 HD1 PHE 63 -7.496 -8.407 1.776
13 HD2 PHE 63 HD2 PHE 63 -4.213 -6.877 -0.568
14 HE1 PHE 63 HE1 PHE 63 -5.929 -8.979 3.590
15 HE2 PHE 63 HE2 PHE 63 -2.641 -7.460 1.274
16 HZ PHE 63 HZ PHE 63 -3.512 -8.508 3.354
17 H ALA 64 H ALA 64 -7.179 -5.937 1.811
18 HA ALA 64 HA ALA 64 -7.804 -3.099 1.570
19 HB1 ALA 64 HB1 ALA 64 -8.825 -4.720 3.948
20 HB2 ALA 64 HB2 ALA 64 -8.889 -2.954 3.782
21 HB3 ALA 64 HB3 ALA 64 -9.848 -3.974 2.690
22 H CYS 65 H CYS 65 -6.679 -1.856 3.332
23 HA CYS 65 HA CYS 65 -3.984 -3.036 3.667
24 HB2 CYS 65 HB2 CYS 65 -5.100 -0.227 3.756
25 HB3 CYS 65 HB3 CYS 65 -3.400 -0.632 4.130
26 H ASP 66 H ASP 66 -3.250 -3.747 5.417
27 HA ASP 66 HA ASP 66 -3.964 -3.473 8.091
28 HB2 ASP 66 HB2 ASP 66 -1.906 -4.566 6.568
29 HB3 ASP 66 HB3 ASP 66 -1.051 -3.285 7.383
30 H ILE 67 H ILE 67 -1.990 -1.299 6.114
31 HA ILE 67 HA ILE 67 -1.358 0.495 8.313
32 HB ILE 67 HB ILE 67 -0.667 0.539 5.356
33 HG12 ILE 67 2HG1 ILE 67 0.235 -1.466 6.368
34 HG13 ILE 67 3HG1 ILE 67 1.524 -0.348 6.008
35 HG21 ILE 67 HG21 ILE 67 0.507 2.200 7.610
36 HG22 ILE 67 HG22 ILE 67 1.255 2.011 6.013
37 HG23 ILE 67 HG23 ILE 67 -0.326 2.778 6.155
38 HD11 ILE 67 1HD1 ILE 67 0.357 -0.850 8.782
39 HD12 ILE 67 2HD1 ILE 67 1.900 -1.441 8.153
40 HD13 ILE 67 3HD1 ILE 67 1.668 0.296 8.408
41 H CYS 68 H CYS 68 -3.712 0.642 5.722
42 HA CYS 68 HA CYS 68 -4.252 3.528 6.328
43 HB2 CYS 68 HB2 CYS 68 -4.609 2.012 3.751
44 HB3 CYS 68 HB3 CYS 68 -4.985 3.721 4.004
45 H GLY 69 H GLY 69 -5.618 0.410 6.575
46 HA2 GLY 69 HA2 GLY 69 -7.677 -0.374 7.124
47 HA3 GLY 69 HA3 GLY 69 -8.256 1.287 7.202
48 H ARG 70 H ARG 70 -7.868 2.057 4.514
49 HA ARG 70 HA ARG 70 -10.320 1.134 3.382
50 HB2 ARG 70 HB2 ARG 70 -8.073 2.791 2.149
51 HB3 ARG 70 HB3 ARG 70 -9.635 2.492 1.378
52 HG2 ARG 70 HG2 ARG 70 -10.736 3.441 3.498
53 HG3 ARG 70 HG3 ARG 70 -9.118 4.022 3.949
54 HD2 ARG 70 HD2 ARG 70 -8.989 5.247 1.778
55 HD3 ARG 70 HD3 ARG 70 -10.614 4.646 1.364
56 HE ARG 70 HE ARG 70 -10.613 6.027 3.905
57 HH11 ARG 70 1HH1 ARG 70 -11.689 9.058 2.716
58 HH12 ARG 70 2HH1 ARG 70 -11.301 8.100 4.124
59 HH21 ARG 70 1HH2 ARG 70 -10.620 6.694 0.444
60 HH22 ARG 70 2HH2 ARG 70 -11.133 8.364 0.711
61 H LYS 71 H LYS 71 -10.684 0.411 1.190
62 HA LYS 71 HA LYS 71 -9.600 -2.223 0.767
63 HB2 LYS 71 HB2 LYS 71 -11.343 -0.550 -1.085
64 HB3 LYS 71 HB3 LYS 71 -11.055 -2.294 -1.201
65 HG2 LYS 71 HG2 LYS 71 -12.021 -2.526 1.142
66 HG3 LYS 71 HG3 LYS 71 -12.498 -0.819 1.023
67 HD2 LYS 71 HD2 LYS 71 -13.786 -1.394 -1.070
68 HD3 LYS 71 HD3 LYS 71 -13.402 -3.105 -0.768
69 HE2 LYS 71 HE2 LYS 71 -14.439 -2.820 1.545
70 HE3 LYS 71 HE3 LYS 71 -14.971 -1.213 1.048
71 HZ1 LYS 71 HZ1 LYS 71 -16.222 -2.316 -0.781
72 HZ2 LYS 71 HZ2 LYS 71 -15.755 -3.785 -0.225
73 HZ3 LYS 71 HZ3 LYS 71 -16.727 -2.823 0.688
74 H PHE 72 H PHE 72 -8.753 -3.056 -1.226
75 HA PHE 72 HA PHE 72 -7.948 -1.216 -3.297
76 HB2 PHE 72 HB2 PHE 72 -5.907 -1.598 -1.593
77 HB3 PHE 72 HB3 PHE 72 -5.703 -3.070 -2.538
78 HD1 PHE 72 HD1 PHE 72 -4.475 -2.906 -4.632
79 HD2 PHE 72 HD2 PHE 72 -6.206 0.634 -2.859
80 HE1 PHE 72 HE1 PHE 72 -3.362 -1.481 -6.338
81 HE2 PHE 72 HE2 PHE 72 -5.086 2.034 -4.569
82 HZ PHE 72 HZ PHE 72 -3.661 0.969 -6.315
83 H ALA 73 H ALA 73 -7.531 -2.297 -5.348
84 HA ALA 73 HA ALA 73 -9.464 -4.330 -5.733
85 HB1 ALA 73 HB1 ALA 73 -9.050 -2.579 -7.358
86 HB2 ALA 73 HB2 ALA 73 -7.407 -3.168 -7.652
87 HB3 ALA 73 HB3 ALA 73 -8.804 -4.165 -8.113
88 H ARG 74 H ARG 74 -6.195 -4.758 -7.060
89 HA ARG 74 HA ARG 74 -5.469 -6.941 -5.363
90 HB2 ARG 74 HB2 ARG 74 -6.965 -8.279 -6.791
91 HB3 ARG 74 HB3 ARG 74 -6.108 -7.747 -8.248
92 HG2 ARG 74 HG2 ARG 74 -4.033 -8.832 -7.459
93 HG3 ARG 74 HG3 ARG 74 -4.803 -9.208 -5.911
94 HD2 ARG 74 HD2 ARG 74 -6.471 -10.618 -7.184
95 HD3 ARG 74 HD3 ARG 74 -5.469 -10.349 -8.637
96 HE ARG 74 HE ARG 74 -3.887 -11.286 -6.399
97 HH11 ARG 74 1HH1 ARG 74 -3.857 -14.607 -7.283
98 HH12 ARG 74 2HH1 ARG 74 -3.318 -13.393 -6.146
99 HH21 ARG 74 1HH2 ARG 74 -5.979 -12.444 -8.947
100 HH22 ARG 74 2HH2 ARG 74 -5.283 -14.056 -8.906
101 H SER 75 H SER 75 -4.855 -6.100 -8.726
102 HA SER 75 HA SER 75 -3.202 -5.048 -9.838
103 HB2 SER 75 HB2 SER 75 -3.096 -3.426 -7.295
104 HB3 SER 75 HB3 SER 75 -2.781 -2.871 -8.952
105 HG SER 75 HG SER 75 -4.851 -2.314 -8.667
106 H1 OUD 76 H OUD 76 -1.587 -6.700 -10.053
107 HA OUD 76 HA OUD 76 0.964 -5.877 -8.705
108 HB3 OUD 76 HB3 OUD 76 0.670 -8.318 -8.635
109 HB2 OUD 76 HB2 OUD 76 0.428 -8.369 -10.377
110 HM3 OUD 76 HM3 OUD 76 1.984 -5.588 -10.900
111 HM2 OUD 76 HM2 OUD 76 0.513 -6.149 -11.705
112 HN2 OUD 76 HN2 OUD 76 -0.534 -4.103 -11.264
113 H OUE 77 H OUE 77 -0.854 -2.129 -10.387
114 HA OUE 77 HA OUE 77 1.476 -0.952 -8.951
115 HB3 OUE 77 HB3 OUE 77 0.604 0.022 -11.236
116 HB2 OUE 77 HB2 OUE 77 -0.760 0.609 -10.312
117 HG3 OUE 77 HG3 OUE 77 0.903 2.379 -10.452
118 HG2 OUE 77 HG2 OUE 77 0.827 1.846 -8.788
119 HM2 OUE 77 HM2 OUE 77 -1.415 -0.296 -8.278
120 HM3 OUE 77 HM3 OUE 77 0.040 0.146 -7.377
121 HN2 OUE 77 HN2 OUE 77 -0.676 -2.730 -7.699
122 H1 OUK 78 H OUK 78 -1.429 -3.789 -5.913
123 HA OUK 78 HA OUK 78 0.458 -3.146 -3.709
124 HB2 OUK 78 HB2 OUK 78 -0.396 -5.217 -2.572
125 HB3 OUK 78 HB3 OUK 78 -1.701 -5.325 -3.750
126 HG2 OUK 78 HG2 OUK 78 -2.601 -3.127 -2.982
127 HG3 OUK 78 HG3 OUK 78 -1.225 -2.928 -1.891
128 HD2 OUK 78 HD2 OUK 78 -1.912 -5.006 -0.652
129 HD3 OUK 78 HD3 OUK 78 -3.313 -5.171 -1.717
130 HE2 OUK 78 HE2 OUK 78 -4.445 -3.331 -0.755
131 HE3 OUK 78 HE3 OUK 78 -2.929 -2.525 -0.302
132 HZ3 OUK 78 HZ3 OUK 78 -4.228 -4.743 1.203
133 HZ1 OUK 78 HZ1 OUK 78 -3.999 -3.148 1.646
134 HZ2 OUK 78 HZ2 OUK 78 -2.692 -4.172 1.519
135 HM3 OUK 78 HM3 OUK 78 1.441 -5.346 -4.157
136 HM2 OUK 78 HM2 OUK 78 0.184 -5.698 -5.361
137 HN2 OUK 78 HN2 OUK 78 1.138 -4.190 -6.870
138 H OUR 79 H OUR 79 2.634 -2.828 -7.702
139 HA OUR 79 HA OUR 79 5.037 -2.249 -5.998
140 HB3 OUR 79 HB3 OUR 79 4.707 -2.163 -9.028
141 HB2 OUR 79 HB2 OUR 79 6.180 -1.737 -8.176
142 HG3 OUR 79 HG3 OUR 79 6.616 -4.009 -7.509
143 HG2 OUR 79 HG2 OUR 79 4.963 -4.529 -7.845
144 HD3 OUR 79 HD3 OUR 79 5.251 -4.034 -10.241
145 HD2 OUR 79 HD2 OUR 79 6.946 -3.602 -9.964
146 HE OUR 79 HE OUR 79 7.404 -5.815 -9.314
147 HH12 OUR 79 2HH1 OUR 79 7.997 -5.798 -11.727
148 HH11 OUR 79 1HH1 OUR 79 6.830 -6.145 -12.826
149 HH22 OUR 79 2HH2 OUR 79 4.285 -6.872 -10.452
150 HM2 OUR 79 HM2 OUR 79 3.695 -0.269 -7.891
151 HM3 OUR 79 HM3 OUR 79 5.014 0.048 -6.749
152 HN2 OUR 79 HN2 OUR 79 2.236 -0.695 -5.980
153 HH21 OUR 79 1HH2 OUR 79 4.698 -7.076 -12.013
154 H OUH 80 H OUH 80 1.005 0.961 -5.529
155 HA OUH 80 HA OUH 80 2.166 2.254 -3.126
156 HB2 OUH 80 HB2 OUH 80 -0.345 2.623 -4.641
157 HB3 OUH 80 HB3 OUH 80 0.492 3.717 -3.578
158 HD2 OUH 80 HD2 OUH 80 0.041 3.149 -0.776
159 HD1 OUH 80 HD1 OUH 80 -2.557 1.459 -3.645
160 HE1 OUH 80 HE1 OUH 80 -3.584 1.307 -1.268
161 HM2 OUH 80 HM2 OUH 80 0.100 0.014 -3.055
162 HM3 OUH 80 HM3 OUH 80 0.942 0.754 -1.692
163 HN2 OUH 80 HN2 OUH 80 2.267 -0.924 -3.758
164 H1 OUK 81 H OUK 81 4.066 -1.963 -3.208
165 HA OUK 81 HA OUK 81 5.205 -1.336 -0.517
166 HB2 OUK 81 HB2 OUK 81 6.570 -3.378 -0.696
167 HB3 OUK 81 HB3 OUK 81 5.876 -3.745 -2.272
168 HG2 OUK 81 HG2 OUK 81 3.600 -4.001 -1.190
169 HG3 OUK 81 HG3 OUK 81 4.340 -3.705 0.387
170 HD2 OUK 81 HD2 OUK 81 5.779 -5.720 0.100
171 HD3 OUK 81 HD3 OUK 81 5.190 -5.926 -1.544
172 HE2 OUK 81 HE2 OUK 81 3.913 -7.508 -0.378
173 HE3 OUK 81 HE3 OUK 81 2.802 -6.142 -0.518
174 HZ3 OUK 81 HZ3 OUK 81 3.314 -5.608 1.819
175 HZ1 OUK 81 HZ1 OUK 81 4.345 -6.922 1.916
176 HZ2 OUK 81 HZ2 OUK 81 2.724 -7.172 1.637
177 HM3 OUK 81 HM3 OUK 81 7.370 -1.079 -1.563
178 HM2 OUK 81 HM2 OUK 81 6.768 -1.691 -3.110
179 HN2 OUK 81 HN2 OUK 81 5.724 0.356 -3.571
180 H OUI 82 H OUI 82 5.321 2.482 -3.353
181 HA OUI 82 HA OUI 82 5.847 3.674 -0.658
182 HB OUI 82 HB OUI 82 5.870 5.874 -1.673
183 3HG1 OUI 82 3HG1 OUI 82 5.692 4.482 -4.403
184 2HG1 OUI 82 2HG1 OUI 82 4.434 5.469 -3.675
185 1HG2 OUI 82 1HG2 OUI 82 7.913 4.063 -3.064
186 2HG2 OUI 82 2HG2 OUI 82 7.987 4.527 -1.355
187 3HG2 OUI 82 3HG2 OUI 82 8.124 5.759 -2.604
188 2HD1 OUI 82 2HD1 OUI 82 7.169 6.462 -4.599
189 3HD1 OUI 82 3HD1 OUI 82 6.022 7.445 -3.660
190 1HD1 OUI 82 1HD1 OUI 82 5.584 6.855 -5.265
191 HM2 OUI 82 HM2 OUI 82 3.392 4.008 -2.435
192 HM3 OUI 82 HM3 OUI 82 3.709 4.926 -0.954
193 HN2 OUI 82 HN2 OUI 82 3.376 1.964 -1.112
194 H OUH 83 H OUH 83 3.604 0.863 0.772
195 HA OUH 83 HA OUH 83 3.145 2.341 3.303
196 HB2 OUH 83 HB2 OUH 83 3.202 0.136 4.379
197 HB3 OUH 83 HB3 OUH 83 3.671 -0.623 2.873
198 HD2 OUH 83 HD2 OUH 83 0.882 2.075 2.859
199 HD1 OUH 83 HD1 OUH 83 1.355 -2.112 2.672
200 HE1 OUH 83 HE1 OUH 83 -1.060 -1.422 2.002
201 HM2 OUH 83 HM2 OUH 83 5.315 1.388 4.234
202 HM3 OUH 83 HM3 OUH 83 5.458 2.734 3.087
203 HN2 OUH 83 HN2 OUH 83 5.882 0.968 1.347
204 H ARG 84 H ARG 84 7.900 1.126 0.704
205 HA ARG 84 HA ARG 84 9.978 -0.146 2.322
206 HB2 ARG 84 HB2 ARG 84 10.040 -0.320 -0.072
207 HB3 ARG 84 HB3 ARG 84 10.089 1.436 -0.289
208 HG2 ARG 84 HG2 ARG 84 12.326 1.597 0.476
209 HG3 ARG 84 HG3 ARG 84 12.243 0.056 1.337
210 HD2 ARG 84 HD2 ARG 84 13.650 -0.230 -0.553
211 HD3 ARG 84 HD3 ARG 84 12.173 -1.189 -0.743
212 HE ARG 84 HE ARG 84 12.064 1.430 -2.094
213 HH11 ARG 84 1HH1 ARG 84 13.468 -1.797 -2.465
214 HH12 ARG 84 2HH1 ARG 84 13.632 -1.540 -4.187
215 HH21 ARG 84 1HH2 ARG 84 12.210 1.543 -4.245
216 HH22 ARG 84 2HH2 ARG 84 12.856 0.212 -5.177
217 H LYS 85 H LYS 85 9.027 3.180 1.807
218 HA LYS 85 HA LYS 85 10.207 3.969 4.327
219 HB2 LYS 85 HB2 LYS 85 12.185 4.440 3.026
220 HB3 LYS 85 HB3 LYS 85 11.242 5.255 1.750
221 HG2 LYS 85 HG2 LYS 85 10.723 7.109 3.144
222 HG3 LYS 85 HG3 LYS 85 11.239 6.254 4.603
223 HD2 LYS 85 HD2 LYS 85 13.567 6.488 4.018
224 HD3 LYS 85 HD3 LYS 85 13.145 7.104 2.401
225 HE2 LYS 85 HE2 LYS 85 13.813 8.910 4.008
226 HE3 LYS 85 HE3 LYS 85 12.207 9.118 3.299
227 HZ1 LYS 85 HZ1 LYS 85 11.189 8.381 5.328
228 HZ2 LYS 85 HZ2 LYS 85 12.667 8.002 6.000
229 HZ3 LYS 85 HZ3 LYS 85 12.232 9.570 5.693
230 H ASP 86 H ASP 86 9.251 5.709 5.187
231 HA ASP 86 HA ASP 86 7.096 7.193 3.702
232 HB2 ASP 86 HB2 ASP 86 6.222 5.918 5.595
233 HB3 ASP 86 HB3 ASP 86 7.402 6.679 6.694
234 H1 HOH 201 H1 HOH 158 -0.582 3.748 1.373
235 H2 HOH 201 H2 HOH 158 -1.504 3.427 2.536
236 H1 HOH 202 H1 HOH 57 -5.580 -5.437 9.582
237 H2 HOH 202 H2 HOH 57 -4.316 -5.935 8.910
238 H1 HOH 203 H1 HOH 42 -3.505 -8.394 9.498
239 H2 HOH 203 H2 HOH 42 -2.735 -7.240 8.890
240 H1 HOH 204 H1 HOH 191 3.688 10.027 7.972
241 H2 HOH 204 H2 HOH 191 4.120 8.580 8.079
242 H1 HOH 205 H1 HOH 190 6.293 9.924 2.643
243 H2 HOH 205 H2 HOH 190 5.362 9.354 3.691
244 H1 HOH 206 H1 HOH 84 9.945 8.377 7.199
245 H2 HOH 206 H2 HOH 84 10.832 7.288 7.763
246 H1 HOH 207 H1 HOH 194 8.489 7.021 1.411
247 H2 HOH 207 H2 HOH 194 8.702 8.309 2.177
248 H1 HOH 208 H1 HOH 83 4.729 6.125 7.684
249 H2 HOH 208 H2 HOH 83 3.959 4.971 7.080
250 H1 HOH 209 H1 HOH 37 -0.413 -6.786 8.282
251 H2 HOH 209 H2 HOH 37 -1.134 -8.109 8.178
252 H1 HOH 210 H1 HOH 189 3.806 8.393 4.952
253 H2 HOH 210 H2 HOH 189 2.557 8.193 5.782
254 H1 HOH 211 H1 HOH 59 0.399 -4.806 10.111
255 H2 HOH 211 H2 HOH 59 0.356 -5.038 11.605
256 H1 HOH 212 H1 HOH 151 2.820 -7.996 -12.396
257 H2 HOH 212 H2 HOH 151 3.763 -7.986 -13.586
258 H1 HOH 213 H1 HOH 187 -2.546 5.735 8.285
259 H2 HOH 213 H2 HOH 187 -2.853 4.252 8.312
260 H1 HOH 214 H1 HOH 47 2.887 -7.662 -7.259
261 H2 HOH 214 H2 HOH 47 2.662 -6.506 -6.311
262 H1 HOH 215 H1 HOH 115 -8.145 4.095 6.387
263 H2 HOH 215 H2 HOH 115 -9.353 3.995 7.295
264 H1 HOH 216 H1 HOH 30 3.152 -11.405 -10.195
265 H2 HOH 216 H2 HOH 30 2.400 -10.120 -10.474
266 H1 HOH 217 H1 HOH 10 -12.157 -0.190 5.791
267 H2 HOH 217 H2 HOH 10 -11.035 -0.922 5.085
268 H1 HOH 218 H1 HOH 181 5.116 1.605 -9.390
269 H2 HOH 218 H2 HOH 181 4.913 0.331 -10.164
270 H1 HOH 219 H1 HOH 71 -4.799 -2.279 11.163
271 H2 HOH 219 H2 HOH 71 -4.759 -1.577 9.826
272 H1 HOH 220 H1 HOH 186 3.358 10.787 5.559
273 H2 HOH 220 H2 HOH 186 4.665 10.112 5.921
274 H1 HOH 221 H1 HOH 78 -1.525 2.811 9.257
275 H2 HOH 221 H2 HOH 78 -1.466 3.980 10.213
276 H1 HOH 222 H1 HOH 180 1.755 0.975 -13.196
277 H2 HOH 222 H2 HOH 180 2.833 1.104 -12.138
278 H1 HOH 223 H1 HOH 51 -0.800 -4.896 3.089
279 H2 HOH 223 H2 HOH 51 -1.931 -5.883 3.292
280 H1 HOH 224 H1 HOH 89 15.601 -1.252 -5.603
281 H2 HOH 224 H2 HOH 89 14.338 -1.020 -6.411
282 H1 HOH 225 H1 HOH 3 -12.042 -11.572 -5.443
283 H2 HOH 225 H2 HOH 3 -13.073 -10.481 -5.641
284 H1 HOH 226 H1 HOH 138 -9.627 7.795 6.014
285 H2 HOH 226 H2 HOH 138 -10.633 8.928 6.083
286 H1 HOH 227 H1 HOH 26 -3.421 -13.325 -3.517
287 H2 HOH 227 H2 HOH 26 -2.254 -12.517 -4.048
288 H1 HOH 228 H1 HOH 23 -3.627 -17.282 -7.265
289 H2 HOH 228 H2 HOH 23 -3.464 -16.515 -8.561
290 H1 HOH 229 H1 HOH 53 0.662 -5.032 7.225
291 H2 HOH 229 H2 HOH 53 0.403 -6.424 6.697
292 H1 HOH 230 H1 HOH 117 -16.816 -3.020 -3.018
293 H2 HOH 230 H2 HOH 117 -18.022 -2.150 -2.726
294 H1 HOH 231 H1 HOH 22 -4.772 -15.944 -10.178
295 H2 HOH 231 H2 HOH 22 -5.811 -15.136 -10.927
296 H1 HOH 232 H1 HOH 108 14.981 7.320 6.487
297 H2 HOH 232 H2 HOH 108 14.093 7.598 7.684
298 H1 HOH 233 H1 HOH 1 -13.520 -9.914 -0.731
299 H2 HOH 233 H2 HOH 1 -12.755 -11.009 -1.446
300 H1 HOH 234 H1 HOH 184 -10.331 10.654 0.273
301 H2 HOH 234 H2 HOH 184 -11.075 10.249 -0.986
302 H1 HOH 235 H1 HOH 173 1.781 5.172 0.797
303 H2 HOH 235 H2 HOH 173 1.009 6.393 0.345
304 H1 HOH 236 H1 HOH 25 -7.982 -10.688 -9.586
305 H2 HOH 236 H2 HOH 25 -8.335 -11.896 -8.734
306 H1 HOH 237 H1 HOH 153 -11.070 5.873 -1.719
307 H2 HOH 237 H2 HOH 153 -10.753 4.619 -0.930
308 H1 HOH 238 H1 HOH 46 3.934 -3.413 2.910
309 H2 HOH 238 H2 HOH 46 3.758 -4.756 3.586
310 H1 HOH 239 H1 HOH 49 2.229 -9.552 1.103
311 H2 HOH 239 H2 HOH 49 0.892 -9.130 1.684
312 H1 HOH 240 H1 HOH 114 -19.230 -2.365 1.496
313 H2 HOH 240 H2 HOH 114 -18.261 -3.182 2.325
314 H1 HOH 241 H1 HOH 116 -16.913 -5.381 -1.101
315 H2 HOH 241 H2 HOH 116 -15.977 -5.148 -2.270
316 H1 HOH 242 H1 HOH 60 -1.882 -10.587 -6.464
317 H2 HOH 242 H2 HOH 60 -1.851 -10.678 -4.951
318 H1 HOH 243 H1 HOH 122 -12.205 11.581 2.397
319 H2 HOH 243 H2 HOH 122 -12.157 10.560 1.278
320 H1 HOH 244 H1 HOH 56 4.183 -6.542 4.966
321 H2 HOH 244 H2 HOH 56 5.511 -6.271 4.280
322 H1 HOH 245 H1 HOH 34 4.270 -9.667 2.164
323 H2 HOH 245 H2 HOH 34 4.375 -9.238 3.614
324 H1 HOH 246 H1 HOH 156 -4.319 2.715 1.867
325 H2 HOH 246 H2 HOH 156 -4.765 1.353 1.369
326 H1 HOH 247 H1 HOH 93 12.544 -1.390 4.523
327 H2 HOH 247 H2 HOH 93 11.992 -0.231 3.722
328 H1 HOH 248 H1 HOH 123 -10.555 5.037 6.117
329 H2 HOH 248 H2 HOH 123 -11.322 6.331 5.937
330 H1 HOH 249 H1 HOH 92 15.936 -3.530 -1.869
331 H2 HOH 249 H2 HOH 92 15.021 -3.721 -3.061
332 H1 HOH 250 H1 HOH 136 -13.278 10.361 3.829
333 H2 HOH 250 H2 HOH 136 -14.164 9.735 4.890
334 H1 HOH 251 H1 HOH 7 -11.135 -8.219 2.770
335 H2 HOH 251 H2 HOH 7 -10.927 -8.636 1.327
336 H1 HOH 252 H1 HOH 193 -8.814 10.202 3.770
337 H2 HOH 252 H2 HOH 193 -9.962 10.859 4.511
338 H1 HOH 253 H1 HOH 107 11.195 5.005 7.082
339 H2 HOH 253 H2 HOH 107 12.509 5.767 7.133
340 H1 HOH 254 H1 HOH 48 -3.386 -7.479 -4.160
341 H2 HOH 254 H2 HOH 48 -4.398 -8.313 -3.402
342 H1 HOH 255 H1 HOH 124 -18.594 -4.244 0.111
343 H2 HOH 255 H2 HOH 124 -19.375 -5.255 -0.702
344 H1 HOH 256 H1 HOH 45 6.051 -8.329 1.932
345 H2 HOH 256 H2 HOH 45 7.100 -7.236 1.915
346 H1 HOH 257 H1 HOH 35 5.533 -2.494 3.981
347 H2 HOH 257 H2 HOH 35 5.902 -1.667 2.767
348 H1 HOH 258 H1 HOH 199 6.151 -8.235 -14.541
349 H2 HOH 258 H2 HOH 199 5.522 -9.426 -13.855
350 H1 HOH 259 H1 HOH 81 -2.364 -2.822 11.881
351 H2 HOH 259 H2 HOH 81 -3.160 -1.683 12.481
352 H1 HOH 260 H1 HOH 96 6.896 -9.183 -9.400
353 H2 HOH 260 H2 HOH 96 7.912 -9.196 -10.520
354 H1 HOH 261 H1 HOH 141 -2.424 -7.076 -12.784
355 H2 HOH 261 H2 HOH 141 -1.988 -5.630 -12.688
356 H1 HOH 262 H1 HOH 172 -5.344 0.986 -8.875
357 H2 HOH 262 H2 HOH 172 -5.423 -0.183 -9.838
358 H1 HOH 263 H1 HOH 24 -0.881 -11.699 -8.633
359 H2 HOH 263 H2 HOH 24 -0.607 -12.140 -7.208
360 H1 HOH 264 H1 HOH 28 -8.229 -16.190 -8.435
361 H2 HOH 264 H2 HOH 28 -7.121 -15.410 -9.111
362 H1 HOH 265 H1 HOH 162 -7.199 7.622 2.727
363 H2 HOH 265 H2 HOH 162 -6.970 6.548 3.770
364 H1 HOH 266 H1 HOH 111 -12.906 1.288 2.166
365 H2 HOH 266 H2 HOH 111 -13.391 2.463 1.339
366 H1 HOH 267 H1 HOH 19 -7.690 -12.843 -10.549
367 H2 HOH 267 H2 HOH 19 -8.126 -14.293 -10.567
368 H1 HOH 268 H1 HOH 87 8.568 -8.480 -14.271
369 H2 HOH 268 H2 HOH 87 9.990 -8.854 -13.909
370 H1 HOH 269 H1 HOH 29 -3.426 -11.993 -11.955
371 H2 HOH 269 H2 HOH 29 -3.023 -13.415 -11.620
372 H1 HOH 270 H1 HOH 101 10.278 -7.323 -8.963
373 H2 HOH 270 H2 HOH 101 8.849 -7.792 -8.791
374 H1 HOH 271 H1 HOH 185 4.490 -1.950 -12.976
375 H2 HOH 271 H2 HOH 185 4.108 -2.368 -11.575
376 H1 HOH 272 H1 HOH 85 9.163 3.714 7.164
377 H2 HOH 272 H2 HOH 85 10.275 2.686 7.137
378 H1 HOH 273 H1 HOH 88 14.831 2.913 -0.421
379 H2 HOH 273 H2 HOH 88 14.755 2.415 -1.849
380 H1 HOH 274 H1 HOH 82 -5.396 1.035 10.307
381 H2 HOH 274 H2 HOH 82 -5.592 2.535 10.213
382 H1 HOH 275 H1 HOH 126 -16.674 -0.422 3.807
383 H2 HOH 275 H2 HOH 126 -16.711 -1.925 3.629
384 H1 HOH 276 H1 HOH 164 2.603 6.009 -9.184
385 H2 HOH 276 H2 HOH 164 3.430 4.926 -9.844
386 H1 HOH 277 H1 HOH 77 6.455 4.200 7.878
387 H2 HOH 277 H2 HOH 77 7.410 4.967 6.993
388 H1 HOH 278 H1 HOH 5 -12.667 -4.955 1.978
389 H2 HOH 278 H2 HOH 5 -13.667 -5.711 1.129
390 H1 HOH 279 H1 HOH 132 -14.107 6.764 -0.271
391 H2 HOH 279 H2 HOH 132 -13.399 5.840 -1.236
392 H1 HOH 280 H1 HOH 39 1.584 -4.393 3.604
393 H2 HOH 280 H2 HOH 39 0.801 -4.960 4.774
394 H1 HOH 281 H1 HOH 9 -14.665 -6.506 -0.596
395 H2 HOH 281 H2 HOH 9 -14.044 -7.714 0.082
396 H1 HOH 282 H1 HOH 137 -11.877 10.551 5.604
397 H2 HOH 282 H2 HOH 137 -11.147 11.314 6.691
398 H1 HOH 283 H1 HOH 50 0.277 -8.169 -1.592
399 H2 HOH 283 H2 HOH 50 1.245 -8.139 -0.427
400 H1 HOH 284 H1 HOH 58 5.626 -1.631 6.216
401 H2 HOH 284 H2 HOH 58 5.364 -3.115 6.323
402 H1 HOH 285 H1 HOH 68 -6.504 -9.434 -4.335
403 H2 HOH 285 H2 HOH 68 -6.255 -9.662 -2.859
404 H1 HOH 286 H1 HOH 105 12.109 8.528 8.765
405 H2 HOH 286 H2 HOH 105 12.892 8.435 10.057
406 H1 HOH 287 H1 HOH 80 -4.135 4.428 9.950
407 H2 HOH 287 H2 HOH 80 -4.837 4.661 11.271
408 H1 HOH 288 H1 HOH 129 -12.539 1.906 6.338
409 H2 HOH 288 H2 HOH 129 -12.919 1.313 7.680
410 H1 HOH 289 H1 HOH 11 -12.947 -9.269 1.386
411 H2 HOH 289 H2 HOH 11 -14.288 -9.957 1.541
412 H1 HOH 290 H1 HOH 120 -14.808 -0.285 -3.377
413 H2 HOH 290 H2 HOH 120 -16.081 -0.764 -2.709
414 H1 HOH 291 H1 HOH 198 9.793 -3.439 -14.251
415 H2 HOH 291 H2 HOH 198 8.403 -3.344 -13.654
416 H1 HOH 292 H1 HOH 98 14.096 -3.333 -0.593
417 H2 HOH 292 H2 HOH 98 14.435 -2.532 0.647
418 H1 HOH 293 H1 HOH 64 6.045 -8.768 -0.174
419 H2 HOH 293 H2 HOH 64 5.625 -8.906 -1.625
420 H1 HOH 294 H1 HOH 188 3.700 9.365 2.321
421 H2 HOH 294 H2 HOH 188 2.587 8.746 3.136
422 H1 HOH 295 H1 HOH 2 -14.622 -10.359 -2.821
423 H2 HOH 295 H2 HOH 2 -16.038 -10.877 -2.964
424 H1 HOH 296 H1 HOH 31 -10.129 -13.440 -7.542
425 H2 HOH 296 H2 HOH 31 -8.758 -13.841 -8.044
426 H1 HOH 297 H1 HOH 16 -11.195 -12.170 -0.081
427 H2 HOH 297 H2 HOH 16 -11.631 -13.184 -1.116
428 H1 HOH 298 H1 HOH 128 -9.682 2.257 8.747
429 H2 HOH 298 H2 HOH 128 -10.817 2.035 7.766
430 H1 HOH 299 H1 HOH 139 -4.318 -5.632 -12.127
431 H2 HOH 299 H2 HOH 139 -5.722 -6.013 -11.701
432 H1 HOH 300 H1 HOH 13 -8.626 0.294 9.919
433 H2 HOH 300 H2 HOH 13 -7.763 1.534 9.847
434 H1 HOH 301 H1 HOH 67 6.134 -5.647 -5.618
435 H2 HOH 301 H2 HOH 67 7.588 -6.059 -5.522
436 H1 HOH 302 H1 HOH 147 -4.687 0.089 -12.110
437 H2 HOH 302 H2 HOH 147 -5.334 -1.284 -12.073
438 H1 HOH 303 H1 HOH 133 -11.771 2.704 0.263
439 H2 HOH 303 H2 HOH 133 -12.202 2.692 -1.189
440 H1 HOH 304 H1 HOH 44 3.789 -11.546 0.542
441 H2 HOH 304 H2 HOH 44 4.295 -10.170 0.161
442 H1 HOH 305 H1 HOH 112 -12.811 7.346 -2.506
443 H2 HOH 305 H2 HOH 112 -12.585 6.327 -3.606
444 H1 HOH 306 H1 HOH 169 -2.151 3.449 -7.611
445 H2 HOH 306 H2 HOH 169 -0.964 3.156 -6.716
446 H1 HOH 307 H1 HOH 97 14.935 0.188 2.766
447 H2 HOH 307 H2 HOH 97 15.971 1.000 2.016
448 H1 HOH 308 H1 HOH 195 -7.290 7.240 6.830
449 H2 HOH 308 H2 HOH 195 -8.333 6.220 6.423
450 H1 HOH 309 H1 HOH 109 -15.523 -10.379 -6.521
451 H2 HOH 309 H2 HOH 109 -15.045 -10.199 -5.095
452 H1 HOH 310 H1 HOH 197 7.666 -8.369 -16.554
453 H2 HOH 310 H2 HOH 197 7.589 -7.067 -15.785
454 H1 HOH 311 H1 HOH 32 5.261 -12.811 -9.950
455 H2 HOH 311 H2 HOH 32 4.744 -12.114 -8.710
456 H1 HOH 312 H1 HOH 134 -12.679 9.477 -2.251
457 H2 HOH 312 H2 HOH 134 -14.132 9.463 -1.825
458 H1 HOH 313 H1 HOH 125 -16.451 -4.741 -4.692
459 H2 HOH 313 H2 HOH 125 -15.317 -3.871 -4.189
460 H1 HOH 314 H1 HOH 70 9.836 -3.673 2.213
461 H2 HOH 314 H2 HOH 70 8.559 -3.104 2.794
462 H1 HOH 315 H1 HOH 106 15.233 2.618 3.465
463 H2 HOH 315 H2 HOH 106 14.396 3.370 4.479
464 H1 HOH 316 H1 HOH 8 -10.536 -6.471 4.634
465 H2 HOH 316 H2 HOH 8 -10.020 -7.893 4.615
466 H1 HOH 317 H1 HOH 148 -5.364 -12.132 -12.244
467 H2 HOH 317 H2 HOH 148 -6.865 -12.319 -12.289
468 H1 HOH 318 H1 HOH 127 -14.542 -0.446 3.304
469 H2 HOH 318 H2 HOH 127 -13.135 -0.331 3.859
470 H1 HOH 319 H1 HOH 165 1.154 7.043 -2.080
471 H2 HOH 319 H2 HOH 165 0.979 5.650 -1.521
472 H1 HOH 320 H1 HOH 4 -16.906 -4.009 3.889
473 H2 HOH 320 H2 HOH 4 -18.117 -3.648 4.726
474 H1 HOH 321 H1 HOH 144 1.365 -7.206 -13.863
475 H2 HOH 321 H2 HOH 144 0.857 -6.321 -14.980
476 H1 HOH 322 H1 HOH 21 0.864 -12.332 -5.534
477 H2 HOH 322 H2 HOH 21 0.348 -13.756 -5.481
478 H1 HOH 323 H1 HOH 6 -15.076 -5.385 4.521
479 H2 HOH 323 H2 HOH 6 -14.858 -4.968 3.082
480 H1 HOH 324 H1 HOH 196 7.407 -4.748 -16.716
481 H2 HOH 324 H2 HOH 196 8.182 -4.874 -15.420
482 H1 HOH 325 H1 HOH 143 -6.474 -8.085 -11.960
483 H2 HOH 325 H2 HOH 143 -7.310 -8.016 -10.700
484 H1 HOH 326 H1 HOH 176 -6.342 9.778 2.731
485 H2 HOH 326 H2 HOH 176 -7.539 9.898 1.811
486 H1 HOH 327 H1 HOH 18 -2.391 -15.716 -10.395
487 H2 HOH 327 H2 HOH 18 -2.706 -17.126 -10.851
488 H1 HOH 328 H1 HOH 75 -3.000 0.430 13.868
489 H2 HOH 328 H2 HOH 75 -1.980 0.293 12.755
490 H1 HOH 329 H1 HOH 61 1.443 -8.072 -5.143
491 H2 HOH 329 H2 HOH 61 1.569 -8.135 -3.635
492 H1 HOH 330 H1 HOH 121 -12.428 4.011 5.519
493 H2 HOH 330 H2 HOH 121 -13.010 3.260 4.341
494 H1 HOH 331 H1 HOH 66 5.834 0.459 7.649
495 H2 HOH 331 H2 HOH 66 5.076 -0.685 8.286
496 H1 HOH 332 H1 HOH 69 7.928 -5.320 2.890
497 H2 HOH 332 H2 HOH 69 8.204 -6.348 3.967
498 H1 HOH 333 H1 HOH 167 1.138 5.864 -4.180
499 H2 HOH 333 H2 HOH 167 1.910 6.452 -5.343
500 H1 HOH 334 H1 HOH 102 9.286 -6.179 -7.039
501 H2 HOH 334 H2 HOH 102 9.958 -6.103 -5.685
502 H1 HOH 335 H1 HOH 103 17.356 7.745 6.128
503 H2 HOH 335 H2 HOH 103 16.785 6.694 5.196
504 H1 HOH 336 H1 HOH 160 -10.930 -0.200 -6.862
505 H2 HOH 336 H2 HOH 160 -10.289 0.539 -5.709
506 H1 HOH 337 H1 HOH 100 17.455 0.286 -5.725
507 H2 HOH 337 H2 HOH 100 18.026 -0.942 -5.051
508 H1 HOH 338 H1 HOH 177 -9.346 11.421 2.086
509 H2 HOH 338 H2 HOH 177 -8.877 12.544 1.183
510 H1 HOH 339 H1 HOH 146 -5.901 -2.958 -13.845
511 H2 HOH 339 H2 HOH 146 -5.544 -3.599 -12.520
512 H1 HOH 340 H1 HOH 43 -6.941 -11.490 -1.000
513 H2 HOH 340 H2 HOH 43 -5.738 -10.626 -1.319
514 H1 HOH 341 H1 HOH 145 -10.344 -6.703 -9.611
515 H2 HOH 341 H2 HOH 145 -11.514 -7.433 -8.979
516 H1 HOH 342 H1 HOH 157 1.848 8.856 -0.562
517 H2 HOH 342 H2 HOH 157 1.944 8.311 0.843
518 H1 HOH 343 H1 HOH 86 9.586 0.529 7.945
519 H2 HOH 343 H2 HOH 86 10.817 0.933 8.725
520 H1 HOH 344 H1 HOH 20 -0.324 -14.887 -11.044
521 H2 HOH 344 H2 HOH 20 -0.931 -13.628 -10.466
522 H1 HOH 345 H1 HOH 73 -1.027 1.895 11.386
523 H2 HOH 345 H2 HOH 73 0.218 1.276 11.978
524 H1 HOH 346 H1 HOH 113 -16.549 9.119 4.881
525 H2 HOH 346 H2 HOH 113 -15.710 8.094 5.614
526 H1 HOH 347 H1 HOH 17 -0.644 -11.308 -10.897
527 H2 HOH 347 H2 HOH 17 0.683 -11.738 -10.307
528 H1 HOH 348 H1 HOH 79 3.137 5.336 10.573
529 H2 HOH 348 H2 HOH 79 3.638 4.719 9.284
530 H1 HOH 349 H1 HOH 168 0.859 0.476 -15.085
531 H2 HOH 349 H2 HOH 168 -0.040 -0.546 -14.420
532 H1 HOH 350 H1 HOH 99 9.391 -3.858 -6.029
533 H2 HOH 350 H2 HOH 99 9.404 -2.953 -4.815
534 H1 HOH 351 H1 HOH 170 1.875 6.956 -7.461
535 H2 HOH 351 H2 HOH 170 0.982 5.762 -7.219
536 H1 HOH 352 H1 HOH 62 3.477 -3.481 11.746
537 H2 HOH 352 H2 HOH 62 2.283 -3.608 10.826
538 H1 HOH 353 H1 HOH 152 -4.103 4.677 -6.935
539 H2 HOH 353 H2 HOH 152 -3.667 3.473 -6.131
540 H1 HOH 354 H1 HOH 161 -10.542 9.926 -3.260
541 H2 HOH 354 H2 HOH 161 -11.283 11.245 -3.244
542 H1 HOH 355 H1 HOH 174 -7.206 0.160 -8.476
543 H2 HOH 355 H2 HOH 174 -8.443 0.426 -9.306
544 H1 HOH 356 H1 HOH 175 -8.569 1.165 -6.810
545 H2 HOH 356 H2 HOH 175 -8.201 2.277 -5.848
546 H1 HOH 357 H1 HOH 15 -7.118 -1.523 10.239
547 H2 HOH 357 H2 HOH 15 -8.364 -1.884 11.020
548 H1 HOH 358 H1 HOH 159 -7.377 5.648 -1.481
549 H2 HOH 358 H2 HOH 159 -8.823 5.431 -1.870
550 H1 HOH 359 H1 HOH 38 2.415 -6.482 6.328
551 H2 HOH 359 H2 HOH 38 3.025 -7.670 7.042
552 H1 HOH 360 H1 HOH 90 11.708 -2.378 2.419
553 H2 HOH 360 H2 HOH 90 12.224 -3.111 1.198
554 H1 HOH 361 H1 HOH 150 -1.673 -8.823 -14.651
555 H2 HOH 361 H2 HOH 150 -0.807 -7.854 -13.877
556 H1 HOH 362 H1 HOH 63 4.653 -8.978 -4.015
557 H2 HOH 362 H2 HOH 63 3.668 -8.724 -5.138
558 H1 HOH 363 H1 HOH 74 0.697 2.691 10.387
559 H2 HOH 363 H2 HOH 74 2.163 3.049 10.514
560 H1 HOH 364 H1 HOH 41 -1.956 -8.440 -2.865
561 H2 HOH 364 H2 HOH 41 -0.528 -8.605 -3.343
562 H1 HOH 365 H1 HOH 52 -1.057 -10.622 -2.954
563 H2 HOH 365 H2 HOH 52 -0.073 -11.491 -3.710
564 H1 HOH 366 H1 HOH 140 -9.861 -4.684 -11.169
565 H2 HOH 366 H2 HOH 140 -8.700 -5.578 -10.794
566 H1 HOH 367 H1 HOH 72 10.058 8.001 9.660
567 H2 HOH 367 H2 HOH 72 8.983 7.926 10.723
568 H1 HOH 368 H1 HOH 91 16.243 -0.788 0.790
569 H2 HOH 368 H2 HOH 91 16.527 -1.958 1.709
570 H1 HOH 369 H1 HOH 130 -13.634 -2.104 -4.624
571 H2 HOH 369 H2 HOH 130 -13.777 -3.176 -5.688
572 H1 HOH 370 H1 HOH 94 16.330 1.352 -0.136
573 H2 HOH 370 H2 HOH 94 17.755 1.182 0.352
574 H1 HOH 371 H1 HOH 119 -14.476 1.233 -1.943
575 H2 HOH 371 H2 HOH 119 -14.205 2.331 -0.935
576 H1 HOH 372 H1 HOH 36 7.085 -8.025 -2.847
577 H2 HOH 372 H2 HOH 36 6.228 -7.397 -3.924
578 H1 HOH 373 H1 HOH 65 -0.774 -9.630 3.386
579 H2 HOH 373 H2 HOH 65 -1.061 -10.562 2.229
580 H1 HOH 374 H1 HOH 95 10.373 -3.665 -0.049
581 H2 HOH 374 H2 HOH 95 8.961 -4.046 0.335
582 H1 HOH 375 H1 HOH 149 -2.496 -9.633 -12.816
583 H2 HOH 375 H2 HOH 149 -3.928 -10.127 -12.784
584 H1 HOH 376 H1 HOH 192 9.085 14.241 4.412
585 H2 HOH 376 H2 HOH 192 10.060 13.750 3.364
586 H1 HOH 377 H1 HOH 155 5.729 7.682 -8.294
587 H2 HOH 377 H2 HOH 155 4.646 6.673 -8.635
588 H1 HOH 378 H1 HOH 142 -9.131 -9.415 -10.915
589 H2 HOH 378 H2 HOH 142 -9.307 -8.594 -9.656
590 H1 HOH 379 H1 HOH 118 -15.515 3.668 0.893
591 H2 HOH 379 H2 HOH 118 -14.330 4.286 0.181
592 H1 HOH 380 H1 HOH 179 -0.765 1.537 -13.633
593 H2 HOH 380 H2 HOH 179 -0.778 2.931 -13.044
594 H1 HOH 381 H1 HOH 110 -13.603 -8.218 -8.133
595 H2 HOH 381 H2 HOH 110 -13.841 -7.591 -9.490
596 H1 HOH 382 H1 HOH 33 -1.195 -9.031 5.756
597 H2 HOH 382 H2 HOH 33 -2.114 -10.165 5.352
598 H1 HOH 383 H1 HOH 131 -12.899 0.281 -3.609
599 H2 HOH 383 H2 HOH 131 -12.338 -0.325 -4.876
600 H1 HOH 384 H1 HOH 12 -10.917 -10.686 4.877
601 H2 HOH 384 H2 HOH 12 -10.597 -10.010 3.561
602 H1 HOH 385 H1 HOH 154 -6.148 3.797 -5.804
603 H2 HOH 385 H2 HOH 154 -7.295 4.206 -4.903
604 H1 HOH 386 H1 HOH 40 -3.568 -9.682 -1.565
605 H2 HOH 386 H2 HOH 40 -3.928 -9.818 -0.102
606 H1 HOH 387 H1 HOH 27 2.520 -10.920 -4.360
607 H2 HOH 387 H2 HOH 27 1.235 -10.150 -4.560
608 H1 HOH 388 H1 HOH 104 17.878 4.687 4.119
609 H2 HOH 388 H2 HOH 104 16.365 4.674 4.180
610 H1 HOH 389 H1 HOH 135 -13.511 -3.033 -8.103
611 H2 HOH 389 H2 HOH 135 -13.363 -4.519 -7.856
612 H1 HOH 390 H1 HOH 166 -2.987 1.575 -13.068
613 H2 HOH 390 H2 HOH 166 -4.291 1.884 -13.772
614 H1 HOH 391 H1 HOH 178 -5.335 3.120 -7.808
615 H2 HOH 391 H2 HOH 178 -6.387 3.249 -8.888
616 H1 HOH 392 H1 HOH 55 -2.849 -12.267 6.400
617 H2 HOH 392 H2 HOH 55 -3.286 -11.034 7.163
618 H1 HOH 393 H1 HOH 182 3.137 8.632 -6.328
619 H2 HOH 393 H2 HOH 182 3.834 7.335 -6.678
620 H1 HOH 394 H1 HOH 76 3.712 -0.270 10.234
621 H2 HOH 394 H2 HOH 76 3.878 -1.770 10.114
622 H1 HOH 395 H1 HOH 171 -2.810 4.767 -9.677
623 H2 HOH 395 H2 HOH 171 -3.828 3.783 -9.136
624 H1 HOH 396 H1 HOH 14 -8.486 -10.813 4.832
625 H2 HOH 396 H2 HOH 14 -7.851 -11.384 6.083
626 H1 HOH 397 H1 HOH 54 -5.982 -11.466 4.505
627 H2 HOH 397 H2 HOH 54 -4.516 -11.462 4.890
628 H1 HOH 398 H1 HOH 183 3.573 10.316 -7.936
629 H2 HOH 398 H2 HOH 183 3.109 11.141 -6.755
630 H1 HOH 399 H1 HOH 163 4.804 10.423 -5.676
631 H2 HOH 399 H2 HOH 163 6.207 10.106 -5.195
Start of MODEL 10
1 HA PRO 62 HA PRO 62 -10.339 -7.406 -4.038
2 HB2 PRO 62 HB2 PRO 62 -10.957 -5.009 -2.703
3 HB3 PRO 62 HB3 PRO 62 -11.326 -5.395 -4.406
4 HG2 PRO 62 HG2 PRO 62 -13.143 -5.719 -1.988
5 HG3 PRO 62 HG3 PRO 62 -13.517 -4.967 -3.565
6 HD2 PRO 62 HD2 PRO 62 -14.263 -7.493 -3.208
7 HD3 PRO 62 HD3 PRO 62 -13.389 -7.076 -4.707
8 H PHE 63 H PHE 63 -8.717 -6.151 -2.561
9 HA PHE 63 HA PHE 63 -8.471 -7.661 0.006
10 HB2 PHE 63 HB2 PHE 63 -6.713 -7.543 -2.081
11 HB3 PHE 63 HB3 PHE 63 -6.145 -6.182 -1.137
12 HD1 PHE 63 HD1 PHE 63 -7.177 -9.794 -0.838
13 HD2 PHE 63 HD2 PHE 63 -4.600 -6.669 0.655
14 HE1 PHE 63 HE1 PHE 63 -5.981 -11.446 0.574
15 HE2 PHE 63 HE2 PHE 63 -3.410 -8.336 2.062
16 HZ PHE 63 HZ PHE 63 -4.099 -10.719 2.017
17 H ALA 64 H ALA 64 -6.982 -6.258 1.616
18 HA ALA 64 HA ALA 64 -7.718 -3.386 1.591
19 HB1 ALA 64 HB1 ALA 64 -8.228 -5.220 3.971
20 HB2 ALA 64 HB2 ALA 64 -8.452 -3.453 3.929
21 HB3 ALA 64 HB3 ALA 64 -9.476 -4.498 2.925
22 H CYS 65 H CYS 65 -6.457 -2.066 3.025
23 HA CYS 65 HA CYS 65 -3.621 -2.921 3.143
24 HB2 CYS 65 HB2 CYS 65 -5.096 -0.311 3.572
25 HB3 CYS 65 HB3 CYS 65 -3.331 -0.480 3.641
26 H ASP 66 H ASP 66 -2.595 -3.460 4.986
27 HA ASP 66 HA ASP 66 -3.816 -3.260 7.552
28 HB2 ASP 66 HB2 ASP 66 -1.928 -4.800 6.652
29 HB3 ASP 66 HB3 ASP 66 -0.835 -3.505 7.029
30 H ILE 67 H ILE 67 -1.641 -1.076 5.856
31 HA ILE 67 HA ILE 67 -1.361 0.761 8.098
32 HB ILE 67 HB ILE 67 -0.528 0.895 5.192
33 HG12 ILE 67 2HG1 ILE 67 0.730 -0.737 6.525
34 HG13 ILE 67 3HG1 ILE 67 1.731 0.613 6.019
35 HG21 ILE 67 HG21 ILE 67 -0.024 2.961 7.368
36 HG22 ILE 67 HG22 ILE 67 0.892 2.867 5.854
37 HG23 ILE 67 HG23 ILE 67 -0.840 3.205 5.812
38 HD11 ILE 67 1HD1 ILE 67 0.627 0.219 8.832
39 HD12 ILE 67 2HD1 ILE 67 2.286 -0.057 8.290
40 HD13 ILE 67 3HD1 ILE 67 1.633 1.585 8.290
41 H CYS 68 H CYS 68 -2.983 1.251 4.874
42 HA CYS 68 HA CYS 68 -4.230 3.643 5.718
43 HB2 CYS 68 HB2 CYS 68 -4.962 1.729 3.450
44 HB3 CYS 68 HB3 CYS 68 -5.643 3.324 3.692
45 H GLY 69 H GLY 69 -5.299 0.282 6.147
46 HA2 GLY 69 HA2 GLY 69 -7.256 -0.671 6.895
47 HA3 GLY 69 HA3 GLY 69 -7.843 0.931 7.362
48 H ARG 70 H ARG 70 -7.227 1.657 4.357
49 HA ARG 70 HA ARG 70 -9.898 1.339 3.322
50 HB2 ARG 70 HB2 ARG 70 -7.272 2.321 2.141
51 HB3 ARG 70 HB3 ARG 70 -8.678 2.106 1.116
52 HG2 ARG 70 HG2 ARG 70 -8.462 4.417 1.796
53 HG3 ARG 70 HG3 ARG 70 -9.980 3.730 2.396
54 HD2 ARG 70 HD2 ARG 70 -9.126 3.589 4.648
55 HD3 ARG 70 HD3 ARG 70 -7.483 3.927 4.082
56 HE ARG 70 HE ARG 70 -9.243 6.107 3.410
57 HH11 ARG 70 1HH1 ARG 70 -9.016 8.009 4.459
58 HH12 ARG 70 2HH1 ARG 70 -8.457 8.059 6.125
59 HH21 ARG 70 1HH2 ARG 70 -7.387 4.781 6.147
60 HH22 ARG 70 2HH2 ARG 70 -7.285 6.404 6.869
61 H LYS 71 H LYS 71 -10.598 0.288 1.452
62 HA LYS 71 HA LYS 71 -9.480 -2.360 0.807
63 HB2 LYS 71 HB2 LYS 71 -11.727 -0.700 -0.394
64 HB3 LYS 71 HB3 LYS 71 -11.223 -2.263 -1.051
65 HG2 LYS 71 HG2 LYS 71 -11.721 -3.389 1.073
66 HG3 LYS 71 HG3 LYS 71 -12.188 -1.836 1.805
67 HD2 LYS 71 HD2 LYS 71 -13.932 -1.564 0.050
68 HD3 LYS 71 HD3 LYS 71 -13.548 -3.183 -0.581
69 HE2 LYS 71 HE2 LYS 71 -14.234 -4.230 1.506
70 HE3 LYS 71 HE3 LYS 71 -14.254 -2.666 2.324
71 HZ1 LYS 71 HZ1 LYS 71 -16.046 -2.078 0.583
72 HZ2 LYS 71 HZ2 LYS 71 -16.262 -3.707 0.441
73 HZ3 LYS 71 HZ3 LYS 71 -16.444 -2.990 1.901
74 H PHE 72 H PHE 72 -8.692 -2.995 -1.195
75 HA PHE 72 HA PHE 72 -8.512 -1.136 -3.392
76 HB2 PHE 72 HB2 PHE 72 -6.306 -0.885 -1.955
77 HB3 PHE 72 HB3 PHE 72 -5.879 -2.430 -2.686
78 HD1 PHE 72 HD1 PHE 72 -4.600 -2.307 -4.699
79 HD2 PHE 72 HD2 PHE 72 -7.269 0.929 -3.659
80 HE1 PHE 72 HE1 PHE 72 -3.798 -0.998 -6.648
81 HE2 PHE 72 HE2 PHE 72 -6.492 2.196 -5.651
82 HZ PHE 72 HZ PHE 72 -4.750 1.237 -7.134
83 H ALA 73 H ALA 73 -7.845 -2.316 -5.461
84 HA ALA 73 HA ALA 73 -9.574 -4.539 -5.529
85 HB1 ALA 73 HB1 ALA 73 -9.460 -2.960 -7.324
86 HB2 ALA 73 HB2 ALA 73 -7.782 -3.399 -7.684
87 HB3 ALA 73 HB3 ALA 73 -9.085 -4.577 -7.944
88 H ARG 74 H ARG 74 -6.280 -4.857 -6.916
89 HA ARG 74 HA ARG 74 -5.612 -7.240 -5.407
90 HB2 ARG 74 HB2 ARG 74 -7.360 -8.048 -7.122
91 HB3 ARG 74 HB3 ARG 74 -6.181 -7.727 -8.375
92 HG2 ARG 74 HG2 ARG 74 -5.862 -9.637 -6.020
93 HG3 ARG 74 HG3 ARG 74 -6.280 -10.078 -7.661
94 HD2 ARG 74 HD2 ARG 74 -4.028 -9.048 -8.358
95 HD3 ARG 74 HD3 ARG 74 -3.612 -9.077 -6.623
96 HE ARG 74 HE ARG 74 -4.294 -11.601 -6.847
97 HH11 ARG 74 1HH1 ARG 74 -2.620 -9.853 -9.335
98 HH12 ARG 74 2HH1 ARG 74 -1.879 -11.302 -9.955
99 HH21 ARG 74 1HH2 ARG 74 -3.247 -13.411 -7.674
100 HH22 ARG 74 2HH2 ARG 74 -2.046 -13.194 -8.913
101 H SER 75 H SER 75 -4.948 -6.145 -8.728
102 HA SER 75 HA SER 75 -3.441 -4.717 -9.561
103 HB2 SER 75 HB2 SER 75 -3.405 -3.544 -6.788
104 HB3 SER 75 HB3 SER 75 -3.357 -2.698 -8.344
105 HG SER 75 HG SER 75 -5.531 -3.216 -8.651
106 H1 OUD 76 H OUD 76 -1.777 -6.715 -9.534
107 HA OUD 76 HA OUD 76 0.775 -5.708 -8.355
108 HB3 OUD 76 HB3 OUD 76 0.494 -8.167 -8.346
109 HB2 OUD 76 HB2 OUD 76 0.288 -8.172 -10.094
110 HM3 OUD 76 HM3 OUD 76 1.770 -5.390 -10.559
111 HM2 OUD 76 HM2 OUD 76 0.290 -5.944 -11.355
112 HN2 OUD 76 HN2 OUD 76 -0.758 -3.899 -10.859
113 H OUE 77 H OUE 77 -0.914 -1.803 -10.134
114 HA OUE 77 HA OUE 77 1.575 -0.633 -8.985
115 HB3 OUE 77 HB3 OUE 77 0.327 0.307 -11.134
116 HB2 OUE 77 HB2 OUE 77 -0.788 0.994 -9.976
117 HG3 OUE 77 HG3 OUE 77 0.812 2.710 -10.352
118 HG2 OUE 77 HG2 OUE 77 1.318 2.042 -8.814
119 HM2 OUE 77 HM2 OUE 77 -1.240 -0.047 -7.943
120 HM3 OUE 77 HM3 OUE 77 0.286 0.542 -7.269
121 HN2 OUE 77 HN2 OUE 77 -0.016 -2.358 -7.369
122 H1 OUK 78 H OUK 78 -1.477 -3.439 -6.047
123 HA OUK 78 HA OUK 78 0.119 -2.882 -3.631
124 HB2 OUK 78 HB2 OUK 78 -0.884 -5.073 -2.716
125 HB3 OUK 78 HB3 OUK 78 -2.078 -4.990 -4.002
126 HG2 OUK 78 HG2 OUK 78 -2.727 -2.649 -3.031
127 HG3 OUK 78 HG3 OUK 78 -1.708 -3.070 -1.655
128 HD2 OUK 78 HD2 OUK 78 -3.137 -5.247 -1.441
129 HD3 OUK 78 HD3 OUK 78 -4.181 -4.568 -2.686
130 HE2 OUK 78 HE2 OUK 78 -5.281 -3.901 -0.686
131 HE3 OUK 78 HE3 OUK 78 -4.337 -2.458 -1.105
132 HZ3 OUK 78 HZ3 OUK 78 -3.891 -4.386 1.079
133 HZ1 OUK 78 HZ1 OUK 78 -3.983 -2.721 1.120
134 HZ2 OUK 78 HZ2 OUK 78 -2.610 -3.486 0.506
135 HM3 OUK 78 HM3 OUK 78 1.137 -5.063 -4.091
136 HM2 OUK 78 HM2 OUK 78 -0.055 -5.406 -5.352
137 HN2 OUK 78 HN2 OUK 78 1.011 -3.968 -6.833
138 H OUR 79 H OUR 79 2.740 -2.922 -7.657
139 HA OUR 79 HA OUR 79 4.807 -1.974 -5.719
140 HB3 OUR 79 HB3 OUR 79 5.243 -2.521 -8.694
141 HB2 OUR 79 HB2 OUR 79 6.445 -1.947 -7.541
142 HG3 OUR 79 HG3 OUR 79 6.273 -4.119 -6.281
143 HG2 OUR 79 HG2 OUR 79 5.056 -4.676 -7.429
144 HD3 OUR 79 HD3 OUR 79 6.827 -4.230 -9.296
145 HD2 OUR 79 HD2 OUR 79 8.003 -4.088 -7.979
146 HE OUR 79 HE OUR 79 7.918 -6.339 -7.625
147 HH12 OUR 79 2HH1 OUR 79 5.966 -8.897 -9.119
148 HH11 OUR 79 1HH1 OUR 79 7.179 -8.583 -7.936
149 HH22 OUR 79 2HH2 OUR 79 4.441 -7.017 -9.566
150 HM2 OUR 79 HM2 OUR 79 3.829 -0.606 -8.266
151 HM3 OUR 79 HM3 OUR 79 4.955 0.059 -7.072
152 HN2 OUR 79 HN2 OUR 79 2.048 -0.054 -6.935
153 HH21 OUR 79 1HH2 OUR 79 5.259 -5.541 -9.934
154 H OUH 80 H OUH 80 0.985 0.697 -5.152
155 HA OUH 80 HA OUH 80 2.680 1.838 -3.003
156 HB2 OUH 80 HB2 OUH 80 0.547 3.094 -4.154
157 HB3 OUH 80 HB3 OUH 80 1.195 3.423 -2.574
158 HD2 OUH 80 HD2 OUH 80 -0.387 3.203 -0.522
159 HD1 OUH 80 HD1 OUH 80 -1.775 1.230 -3.988
160 HE1 OUH 80 HE1 OUH 80 -3.557 1.135 -2.093
161 HM2 OUH 80 HM2 OUH 80 0.360 -0.092 -2.546
162 HM3 OUH 80 HM3 OUH 80 1.356 0.680 -1.293
163 HN2 OUH 80 HN2 OUH 80 2.566 -1.083 -3.361
164 H1 OUK 81 H OUK 81 4.070 -2.473 -2.706
165 HA OUK 81 HA OUK 81 5.293 -1.728 -0.096
166 HB2 OUK 81 HB2 OUK 81 6.685 -3.779 -0.223
167 HB3 OUK 81 HB3 OUK 81 5.851 -4.277 -1.693
168 HG2 OUK 81 HG2 OUK 81 3.684 -4.409 -0.396
169 HG3 OUK 81 HG3 OUK 81 4.555 -3.956 1.071
170 HD2 OUK 81 HD2 OUK 81 5.967 -6.035 0.850
171 HD3 OUK 81 HD3 OUK 81 5.155 -6.420 -0.661
172 HE2 OUK 81 HE2 OUK 81 4.123 -7.785 1.042
173 HE3 OUK 81 HE3 OUK 81 2.943 -6.550 0.577
174 HZ3 OUK 81 HZ3 OUK 81 3.591 -5.355 2.677
175 HZ1 OUK 81 HZ1 OUK 81 4.550 -6.658 3.080
176 HZ2 OUK 81 HZ2 OUK 81 2.897 -6.864 2.916
177 HM3 OUK 81 HM3 OUK 81 7.398 -1.515 -1.264
178 HM2 OUK 81 HM2 OUK 81 6.733 -2.248 -2.732
179 HN2 OUK 81 HN2 OUK 81 5.605 -0.257 -3.268
180 H OUI 82 H OUI 82 5.441 1.917 -3.326
181 HA OUI 82 HA OUI 82 6.252 3.383 -0.848
182 HB OUI 82 HB OUI 82 6.242 5.436 -2.247
183 3HG1 OUI 82 3HG1 OUI 82 6.077 3.539 -4.659
184 2HG1 OUI 82 2HG1 OUI 82 4.790 4.613 -4.138
185 1HG2 OUI 82 1HG2 OUI 82 8.235 3.327 -3.228
186 2HG2 OUI 82 2HG2 OUI 82 8.330 4.149 -1.660
187 3HG2 OUI 82 3HG2 OUI 82 8.490 5.078 -3.147
188 2HD1 OUI 82 2HD1 OUI 82 7.521 5.490 -5.181
189 3HD1 OUI 82 3HD1 OUI 82 6.305 6.589 -4.505
190 1HD1 OUI 82 1HD1 OUI 82 5.951 5.671 -5.973
191 HM2 OUI 82 HM2 OUI 82 3.713 3.880 -2.454
192 HM3 OUI 82 HM3 OUI 82 4.237 4.726 -0.992
193 HN2 OUI 82 HN2 OUI 82 3.610 1.809 -1.130
194 H OUH 83 H OUH 83 3.511 0.738 0.726
195 HA OUH 83 HA OUH 83 2.880 2.200 3.207
196 HB2 OUH 83 HB2 OUH 83 2.952 -0.088 4.231
197 HB3 OUH 83 HB3 OUH 83 3.411 -0.757 2.686
198 HD2 OUH 83 HD2 OUH 83 0.778 2.021 2.342
199 HD1 OUH 83 HD1 OUH 83 0.933 -2.165 2.900
200 HE1 OUH 83 HE1 OUH 83 -1.429 -1.415 2.112
201 HM2 OUH 83 HM2 OUH 83 4.937 1.254 4.361
202 HM3 OUH 83 HM3 OUH 83 5.176 2.629 3.275
203 HN2 OUH 83 HN2 OUH 83 5.760 0.775 1.557
204 H ARG 84 H ARG 84 7.878 0.813 0.978
205 HA ARG 84 HA ARG 84 9.937 0.192 2.955
206 HB2 ARG 84 HB2 ARG 84 10.072 -0.379 0.531
207 HB3 ARG 84 HB3 ARG 84 10.228 1.346 0.143
208 HG2 ARG 84 HG2 ARG 84 12.337 1.488 1.382
209 HG3 ARG 84 HG3 ARG 84 12.110 -0.152 2.011
210 HD2 ARG 84 HD2 ARG 84 12.180 -0.974 -0.388
211 HD3 ARG 84 HD3 ARG 84 12.674 0.664 -0.867
212 HE ARG 84 HE ARG 84 14.585 0.357 0.822
213 HH11 ARG 84 1HH1 ARG 84 16.137 -0.926 1.409
214 HH12 ARG 84 2HH1 ARG 84 16.431 -2.476 0.641
215 HH21 ARG 84 1HH2 ARG 84 13.578 -2.219 -1.304
216 HH22 ARG 84 2HH2 ARG 84 14.895 -3.255 -0.796
217 H LYS 85 H LYS 85 8.520 3.145 1.814
218 HA LYS 85 HA LYS 85 9.789 4.528 4.063
219 HB2 LYS 85 HB2 LYS 85 11.208 5.342 2.315
220 HB3 LYS 85 HB3 LYS 85 9.826 5.746 1.268
221 HG2 LYS 85 HG2 LYS 85 9.078 7.439 2.821
222 HG3 LYS 85 HG3 LYS 85 10.264 6.938 4.035
223 HD2 LYS 85 HD2 LYS 85 12.075 7.866 2.726
224 HD3 LYS 85 HD3 LYS 85 10.989 8.122 1.337
225 HE2 LYS 85 HE2 LYS 85 11.397 10.229 2.645
226 HE3 LYS 85 HE3 LYS 85 9.704 9.763 2.477
227 HZ1 LYS 85 HZ1 LYS 85 9.632 9.009 4.709
228 HZ2 LYS 85 HZ2 LYS 85 11.254 9.142 4.923
229 HZ3 LYS 85 HZ3 LYS 85 10.296 10.483 4.739
230 H ASP 86 H ASP 86 8.621 5.857 5.106
231 HA ASP 86 HA ASP 86 5.883 6.631 4.281
232 HB2 ASP 86 HB2 ASP 86 6.159 4.819 6.122
233 HB3 ASP 86 HB3 ASP 86 6.731 6.097 7.149
234 H1 HOH 201 H1 HOH 66 -2.188 -3.879 12.274
235 H2 HOH 201 H2 HOH 66 -2.811 -4.463 11.019
236 H1 HOH 202 H1 HOH 180 1.769 0.907 -14.398
237 H2 HOH 202 H2 HOH 180 1.617 1.195 -12.920
238 H1 HOH 203 H1 HOH 167 -4.278 2.746 1.525
239 H2 HOH 203 H2 HOH 167 -4.852 2.318 0.187
240 H1 HOH 204 H1 HOH 91 5.165 4.418 8.403
241 H2 HOH 204 H2 HOH 91 6.661 4.318 8.597
242 H1 HOH 205 H1 HOH 93 2.370 5.674 9.806
243 H2 HOH 205 H2 HOH 93 2.911 5.032 8.549
244 H1 HOH 206 H1 HOH 43 -0.254 -6.413 7.846
245 H2 HOH 206 H2 HOH 43 -0.782 -7.793 7.540
246 H1 HOH 207 H1 HOH 72 0.625 -5.531 9.625
247 H2 HOH 207 H2 HOH 72 1.498 -5.433 10.859
248 H1 HOH 208 H1 HOH 51 -4.470 -4.704 9.181
249 H2 HOH 208 H2 HOH 51 -5.427 -4.190 8.124
250 H1 HOH 209 H1 HOH 55 3.044 -7.424 -6.787
251 H2 HOH 209 H2 HOH 55 3.018 -6.233 -5.853
252 H1 HOH 210 H1 HOH 194 5.115 1.657 -9.198
253 H2 HOH 210 H2 HOH 194 6.408 1.457 -9.958
254 H1 HOH 211 H1 HOH 155 3.803 -6.698 -12.992
255 H2 HOH 211 H2 HOH 155 3.336 -6.651 -11.553
256 H1 HOH 212 H1 HOH 188 -6.709 -1.916 -10.061
257 H2 HOH 212 H2 HOH 188 -5.810 -2.916 -10.770
258 H1 HOH 213 H1 HOH 33 4.539 -10.314 -10.092
259 H2 HOH 213 H2 HOH 33 4.039 -8.987 -10.623
260 H1 HOH 214 H1 HOH 99 -2.343 2.601 9.338
261 H2 HOH 214 H2 HOH 99 -2.601 1.838 10.616
262 H1 HOH 215 H1 HOH 8 -11.946 -7.827 2.118
263 H2 HOH 215 H2 HOH 8 -11.256 -8.232 0.828
264 H1 HOH 216 H1 HOH 95 -4.210 -0.162 11.142
265 H2 HOH 216 H2 HOH 95 -3.693 0.240 9.779
266 H1 HOH 217 H1 HOH 140 -18.658 -4.109 0.735
267 H2 HOH 217 H2 HOH 140 -18.133 -5.521 0.907
268 H1 HOH 218 H1 HOH 38 -0.696 -5.268 0.167
269 H2 HOH 218 H2 HOH 38 -0.594 -4.960 1.644
270 H1 HOH 219 H1 HOH 123 13.391 -1.127 -3.277
271 H2 HOH 219 H2 HOH 123 12.053 -1.791 -3.539
272 H1 HOH 220 H1 HOH 109 16.082 -4.815 -2.284
273 H2 HOH 220 H2 HOH 109 16.237 -5.372 -0.883
274 H1 HOH 221 H1 HOH 26 -3.601 -15.903 -6.600
275 H2 HOH 221 H2 HOH 26 -3.578 -15.567 -8.076
276 H1 HOH 222 H1 HOH 193 5.900 6.199 1.428
277 H2 HOH 222 H2 HOH 193 5.904 7.145 0.240
278 H1 HOH 223 H1 HOH 4 -11.817 -11.142 -4.443
279 H2 HOH 223 H2 HOH 4 -12.449 -10.330 -5.557
280 H1 HOH 224 H1 HOH 32 -2.475 -11.270 -12.341
281 H2 HOH 224 H2 HOH 32 -3.350 -12.189 -11.516
282 H1 HOH 225 H1 HOH 70 -3.929 -2.835 11.503
283 H2 HOH 225 H2 HOH 70 -3.741 -2.009 10.247
284 H1 HOH 226 H1 HOH 82 6.293 -5.299 3.668
285 H2 HOH 226 H2 HOH 82 7.235 -6.277 2.995
286 H1 HOH 227 H1 HOH 153 -9.559 9.896 7.969
287 H2 HOH 227 H2 HOH 153 -8.979 8.520 8.222
288 H1 HOH 228 H1 HOH 122 15.470 1.133 3.220
289 H2 HOH 228 H2 HOH 122 16.821 0.812 2.616
290 H1 HOH 229 H1 HOH 192 -9.795 9.164 2.290
291 H2 HOH 229 H2 HOH 192 -8.469 8.482 2.546
292 H1 HOH 230 H1 HOH 41 7.903 -2.343 5.109
293 H2 HOH 230 H2 HOH 41 7.359 -1.337 4.117
294 H1 HOH 231 H1 HOH 6 -15.859 -3.761 3.944
295 H2 HOH 231 H2 HOH 6 -17.304 -3.581 4.351
296 H1 HOH 232 H1 HOH 49 -2.008 -6.979 9.136
297 H2 HOH 232 H2 HOH 49 -3.259 -7.824 9.023
298 H1 HOH 233 H1 HOH 22 -0.338 -14.173 -10.547
299 H2 HOH 233 H2 HOH 22 -1.570 -13.482 -11.097
300 H1 HOH 234 H1 HOH 114 17.455 -4.195 1.417
301 H2 HOH 234 H2 HOH 114 18.322 -3.753 0.251
302 H1 HOH 235 H1 HOH 132 -17.191 -0.580 -1.276
303 H2 HOH 235 H2 HOH 132 -15.735 -0.173 -1.177
304 H1 HOH 236 H1 HOH 36 -6.684 -12.338 -6.383
305 H2 HOH 236 H2 HOH 36 -5.772 -13.402 -5.808
306 H1 HOH 237 H1 HOH 40 5.548 -8.613 3.947
307 H2 HOH 237 H2 HOH 40 4.457 -8.749 4.988
308 H1 HOH 238 H1 HOH 85 6.997 -9.549 -6.062
309 H2 HOH 238 H2 HOH 85 7.956 -10.560 -6.666
310 H1 HOH 239 H1 HOH 2 -13.267 -10.577 -1.166
311 H2 HOH 239 H2 HOH 2 -13.095 -11.178 -2.546
312 H1 HOH 240 H1 HOH 58 1.792 -8.753 1.772
313 H2 HOH 240 H2 HOH 58 0.456 -8.555 2.455
314 H1 HOH 241 H1 HOH 159 -6.411 -6.556 -10.951
315 H2 HOH 241 H2 HOH 159 -5.174 -7.426 -10.840
316 H1 HOH 242 H1 HOH 46 2.261 -5.368 4.700
317 H2 HOH 242 H2 HOH 46 0.806 -5.775 4.775
318 H1 HOH 243 H1 HOH 67 3.397 -6.166 6.363
319 H2 HOH 243 H2 HOH 67 4.665 -5.832 5.604
320 H1 HOH 244 H1 HOH 107 15.095 3.122 0.435
321 H2 HOH 244 H2 HOH 107 14.717 2.488 -0.886
322 H1 HOH 245 H1 HOH 185 2.593 6.851 2.081
323 H2 HOH 245 H2 HOH 185 3.584 6.679 0.951
324 H1 HOH 246 H1 HOH 163 1.753 -4.002 -12.458
325 H2 HOH 246 H2 HOH 163 1.960 -3.181 -13.711
326 H1 HOH 247 H1 HOH 10 -14.661 -7.902 -0.242
327 H2 HOH 247 H2 HOH 10 -13.243 -8.056 0.273
328 H1 HOH 248 H1 HOH 142 -14.620 -0.568 3.835
329 H2 HOH 248 H2 HOH 142 -15.866 -1.419 3.678
330 H1 HOH 249 H1 HOH 116 16.823 1.432 -0.186
331 H2 HOH 249 H2 HOH 116 17.950 1.019 0.739
332 H1 HOH 250 H1 HOH 152 -10.207 4.738 8.094
333 H2 HOH 250 H2 HOH 152 -9.645 6.124 8.339
334 H1 HOH 251 H1 HOH 157 -1.560 -5.174 -13.172
335 H2 HOH 251 H2 HOH 157 -1.624 -3.668 -13.034
336 H1 HOH 252 H1 HOH 151 -7.851 6.719 9.918
337 H2 HOH 252 H2 HOH 151 -7.346 7.425 8.675
338 H1 HOH 253 H1 HOH 100 11.443 3.731 5.413
339 H2 HOH 253 H2 HOH 100 12.167 5.061 5.415
340 H1 HOH 254 H1 HOH 199 6.030 11.735 5.166
341 H2 HOH 254 H2 HOH 199 4.911 11.349 4.219
342 H1 HOH 255 H1 HOH 53 5.897 -3.131 3.940
343 H2 HOH 255 H2 HOH 53 4.650 -3.458 4.732
344 H1 HOH 256 H1 HOH 162 -5.062 -10.009 -10.818
345 H2 HOH 256 H2 HOH 162 -4.043 -9.276 -11.666
346 H1 HOH 257 H1 HOH 74 5.906 -8.250 -4.750
347 H2 HOH 257 H2 HOH 74 4.644 -8.180 -5.587
348 H1 HOH 258 H1 HOH 24 0.696 -12.434 -6.068
349 H2 HOH 258 H2 HOH 24 -0.682 -12.949 -5.726
350 H1 HOH 259 H1 HOH 21 -5.779 -11.967 -10.482
351 H2 HOH 259 H2 HOH 21 -5.039 -13.233 -10.859
352 H1 HOH 260 H1 HOH 104 7.856 -11.891 -8.424
353 H2 HOH 260 H2 HOH 104 7.398 -11.337 -9.762
354 H1 HOH 261 H1 HOH 149 -10.311 2.446 -1.002
355 H2 HOH 261 H2 HOH 149 -10.973 3.608 -0.288
356 H1 HOH 262 H1 HOH 134 -15.178 -3.035 -3.232
357 H2 HOH 262 H2 HOH 134 -15.885 -2.428 -2.037
358 H1 HOH 263 H1 HOH 3 -14.751 -9.966 -3.298
359 H2 HOH 263 H2 HOH 3 -15.996 -9.204 -3.716
360 H1 HOH 264 H1 HOH 113 15.924 -5.852 2.466
361 H2 HOH 264 H2 HOH 113 15.357 -4.449 2.500
362 H1 HOH 265 H1 HOH 187 -6.188 9.001 3.266
363 H2 HOH 265 H2 HOH 187 -6.323 9.624 1.894
364 H1 HOH 266 H1 HOH 69 -4.866 -7.231 10.551
365 H2 HOH 266 H2 HOH 69 -5.231 -6.553 9.249
366 H1 HOH 267 H1 HOH 129 -12.595 2.459 3.527
367 H2 HOH 267 H2 HOH 129 -13.121 1.679 2.335
368 H1 HOH 268 H1 HOH 20 -2.308 -15.435 -9.944
369 H2 HOH 268 H2 HOH 20 -2.473 -16.940 -9.910
370 H1 HOH 269 H1 HOH 115 13.916 -3.015 4.563
371 H2 HOH 269 H2 HOH 115 15.189 -2.702 3.806
372 H1 HOH 270 H1 HOH 145 -12.411 2.350 6.037
373 H2 HOH 270 H2 HOH 145 -12.290 2.082 7.523
374 H1 HOH 271 H1 HOH 147 -10.674 1.660 -3.883
375 H2 HOH 271 H2 HOH 147 -10.820 0.405 -4.716
376 H1 HOH 272 H1 HOH 174 -9.286 0.163 -6.610
377 H2 HOH 272 H2 HOH 174 -10.606 -0.517 -6.902
378 H1 HOH 273 H1 HOH 103 6.485 -10.177 -11.304
379 H2 HOH 273 H2 HOH 103 7.385 -10.848 -12.322
380 H1 HOH 274 H1 HOH 119 17.538 -2.003 3.831
381 H2 HOH 274 H2 HOH 119 17.075 -2.050 5.271
382 H1 HOH 275 H1 HOH 131 -19.576 -2.280 2.249
383 H2 HOH 275 H2 HOH 131 -20.581 -2.960 1.346
384 H1 HOH 276 H1 HOH 136 -11.184 6.997 2.176
385 H2 HOH 276 H2 HOH 136 -12.606 6.762 2.638
386 H1 HOH 277 H1 HOH 13 -12.303 -10.100 0.866
387 H2 HOH 277 H2 HOH 13 -13.087 -11.353 1.201
388 H1 HOH 278 H1 HOH 7 -15.358 -5.636 4.138
389 H2 HOH 278 H2 HOH 7 -14.045 -5.181 4.751
390 H1 HOH 279 H1 HOH 177 0.832 6.091 -1.501
391 H2 HOH 279 H2 HOH 177 2.167 6.212 -0.793
392 H1 HOH 280 H1 HOH 143 -12.497 0.332 4.059
393 H2 HOH 280 H2 HOH 143 -12.779 0.047 5.517
394 H1 HOH 281 H1 HOH 111 18.296 -0.429 -1.104
395 H2 HOH 281 H2 HOH 111 19.464 -0.468 -2.066
396 H1 HOH 282 H1 HOH 80 -4.824 -6.597 13.057
397 H2 HOH 282 H2 HOH 80 -4.104 -5.668 12.103
398 H1 HOH 283 H1 HOH 190 -0.078 2.334 -13.326
399 H2 HOH 283 H2 HOH 190 0.145 3.750 -12.843
400 H1 HOH 284 H1 HOH 139 -11.452 5.717 6.609
401 H2 HOH 284 H2 HOH 139 -12.540 6.669 6.165
402 H1 HOH 285 H1 HOH 144 -9.445 2.587 8.979
403 H2 HOH 285 H2 HOH 144 -10.213 2.280 7.709
404 H1 HOH 286 H1 HOH 120 18.754 -2.370 2.235
405 H2 HOH 286 H2 HOH 120 19.953 -2.173 3.138
406 H1 HOH 287 H1 HOH 79 9.314 -1.534 6.969
407 H2 HOH 287 H2 HOH 79 8.357 -2.632 7.376
408 H1 HOH 288 H1 HOH 31 4.384 -10.171 -6.137
409 H2 HOH 288 H2 HOH 31 3.914 -11.025 -7.297
410 H1 HOH 289 H1 HOH 92 0.419 4.704 9.288
411 H2 HOH 289 H2 HOH 92 -0.794 3.926 9.767
412 H1 HOH 290 H1 HOH 45 2.460 -6.448 8.610
413 H2 HOH 290 H2 HOH 45 1.635 -7.099 7.521
414 H1 HOH 291 H1 HOH 27 -7.724 -10.615 -9.945
415 H2 HOH 291 H2 HOH 27 -7.543 -11.648 -8.852
416 H1 HOH 292 H1 HOH 173 -5.650 4.369 -0.529
417 H2 HOH 292 H2 HOH 173 -6.718 3.543 -1.209
418 H1 HOH 293 H1 HOH 112 12.660 -2.988 2.925
419 H2 HOH 293 H2 HOH 112 12.073 -2.747 1.551
420 H1 HOH 294 H1 HOH 164 -2.067 -9.146 -12.894
421 H2 HOH 294 H2 HOH 164 -3.128 -9.521 -13.909
422 H1 HOH 295 H1 HOH 154 -3.725 -4.139 -12.136
423 H2 HOH 295 H2 HOH 154 -4.841 -4.896 -11.444
424 H1 HOH 296 H1 HOH 68 2.764 -10.355 1.401
425 H2 HOH 296 H2 HOH 68 3.430 -10.053 0.073
426 H1 HOH 297 H1 HOH 165 0.272 -8.486 -12.405
427 H2 HOH 297 H2 HOH 165 -0.418 -7.480 -13.302
428 H1 HOH 298 H1 HOH 35 5.396 -11.721 -8.873
429 H2 HOH 298 H2 HOH 35 4.154 -12.576 -9.034
430 H1 HOH 299 H1 HOH 160 0.520 -5.254 -13.843
431 H2 HOH 299 H2 HOH 160 0.025 -6.000 -15.064
432 H1 HOH 300 H1 HOH 25 -4.426 -15.412 -10.320
433 H2 HOH 300 H2 HOH 25 -5.718 -15.650 -11.072
434 H1 HOH 301 H1 HOH 117 18.816 -0.077 2.664
435 H2 HOH 301 H2 HOH 117 19.349 1.334 2.811
436 H1 HOH 302 H1 HOH 106 14.609 -5.057 -3.946
437 H2 HOH 302 H2 HOH 106 13.845 -5.137 -2.645
438 H1 HOH 303 H1 HOH 77 6.050 0.383 7.092
439 H2 HOH 303 H2 HOH 77 5.187 0.269 8.327
440 H1 HOH 304 H1 HOH 195 -8.956 3.368 -3.365
441 H2 HOH 304 H2 HOH 195 -9.207 3.484 -4.852
442 H1 HOH 305 H1 HOH 108 18.666 -2.745 -1.552
443 H2 HOH 305 H2 HOH 108 19.434 -3.984 -1.961
444 H1 HOH 306 H1 HOH 133 -17.508 -5.282 -1.278
445 H2 HOH 306 H2 HOH 133 -16.489 -4.814 -2.296
446 H1 HOH 307 H1 HOH 98 11.433 5.908 7.355
447 H2 HOH 307 H2 HOH 98 10.891 6.854 8.409
448 H1 HOH 308 H1 HOH 94 -0.190 -2.214 12.390
449 H2 HOH 308 H2 HOH 94 -0.757 -2.687 13.710
450 H1 HOH 309 H1 HOH 87 8.759 7.545 9.015
451 H2 HOH 309 H2 HOH 87 9.278 7.179 10.389
452 H1 HOH 310 H1 HOH 81 -5.175 -11.284 -4.012
453 H2 HOH 310 H2 HOH 81 -6.324 -10.369 -3.656
454 H1 HOH 311 H1 HOH 130 -15.378 1.446 1.110
455 H2 HOH 311 H2 HOH 130 -14.855 0.431 2.104
456 H1 HOH 312 H1 HOH 128 -14.711 -10.669 -6.988
457 H2 HOH 312 H2 HOH 128 -14.548 -10.162 -5.570
458 H1 HOH 313 H1 HOH 19 -11.316 -11.885 -0.406
459 H2 HOH 313 H2 HOH 19 -10.153 -12.857 -0.353
460 H1 HOH 314 H1 HOH 186 -6.463 0.229 -9.812
461 H2 HOH 314 H2 HOH 186 -7.942 0.382 -10.097
462 H1 HOH 315 H1 HOH 61 -1.116 -11.643 -3.221
463 H2 HOH 315 H2 HOH 61 -0.275 -11.414 -4.460
464 H1 HOH 316 H1 HOH 127 14.107 6.423 4.194
465 H2 HOH 316 H2 HOH 127 12.932 6.946 4.992
466 H1 HOH 317 H1 HOH 171 -1.218 7.269 -1.273
467 H2 HOH 317 H2 HOH 171 -0.693 6.464 -0.103
468 H1 HOH 318 H1 HOH 86 -6.068 -2.404 10.696
469 H2 HOH 318 H2 HOH 86 -6.461 -3.705 10.035
470 H1 HOH 319 H1 HOH 161 -9.035 -6.036 -10.002
471 H2 HOH 319 H2 HOH 161 -10.345 -6.432 -9.351
472 H1 HOH 320 H1 HOH 5 -11.523 -12.509 -2.488
473 H2 HOH 320 H2 HOH 5 -12.352 -13.376 -3.413
474 H1 HOH 321 H1 HOH 168 -8.386 5.361 -2.150
475 H2 HOH 321 H2 HOH 168 -8.879 4.071 -1.527
476 H1 HOH 322 H1 HOH 16 -8.690 0.658 10.241
477 H2 HOH 322 H2 HOH 16 -7.645 1.738 10.417
478 H1 HOH 323 H1 HOH 23 1.857 -15.272 -7.397
479 H2 HOH 323 H2 HOH 23 0.791 -14.199 -7.465
480 H1 HOH 324 H1 HOH 156 -8.558 -4.259 -11.585
481 H2 HOH 324 H2 HOH 156 -7.666 -4.067 -10.380
482 H1 HOH 325 H1 HOH 89 1.893 2.235 10.976
483 H2 HOH 325 H2 HOH 89 2.557 3.329 10.162
484 H1 HOH 326 H1 HOH 197 3.228 12.173 7.414
485 H2 HOH 326 H2 HOH 197 4.389 11.672 6.584
486 H1 HOH 327 H1 HOH 56 2.337 -10.853 3.816
487 H2 HOH 327 H2 HOH 56 3.644 -10.188 3.437
488 H1 HOH 328 H1 HOH 59 0.626 -8.159 -1.348
489 H2 HOH 328 H2 HOH 59 1.845 -8.663 -0.600
490 H1 HOH 329 H1 HOH 34 -8.980 -11.470 -6.932
491 H2 HOH 329 H2 HOH 34 -8.877 -12.874 -7.488
492 H1 HOH 330 H1 HOH 191 7.670 7.931 -1.437
493 H2 HOH 330 H2 HOH 191 6.326 8.363 -1.978
494 H1 HOH 331 H1 HOH 198 -2.392 6.921 9.957
495 H2 HOH 331 H2 HOH 198 -1.727 5.991 8.966
496 H1 HOH 332 H1 HOH 14 -17.409 -6.534 3.285
497 H2 HOH 332 H2 HOH 14 -17.557 -6.747 4.777
498 H1 HOH 333 H1 HOH 179 1.962 5.669 -3.408
499 H2 HOH 333 H2 HOH 179 2.408 6.476 -4.611
500 H1 HOH 334 H1 HOH 166 -2.955 5.232 -6.622
501 H2 HOH 334 H2 HOH 166 -2.556 5.211 -5.163
502 H1 HOH 335 H1 HOH 97 5.422 2.238 9.373
503 H2 HOH 335 H2 HOH 97 4.154 1.768 10.056
504 H1 HOH 336 H1 HOH 172 0.912 6.643 1.266
505 H2 HOH 336 H2 HOH 172 -0.086 6.649 2.404
506 H1 HOH 337 H1 HOH 105 16.727 -3.941 -4.370
507 H2 HOH 337 H2 HOH 105 16.932 -5.413 -4.656
508 H1 HOH 338 H1 HOH 9 -11.978 -6.343 4.091
509 H2 HOH 338 H2 HOH 9 -13.083 -5.943 3.142
510 H1 HOH 339 H1 HOH 12 -18.792 -7.784 1.737
511 H2 HOH 339 H2 HOH 12 -17.463 -7.468 1.081
512 H1 HOH 340 H1 HOH 37 1.468 -8.879 4.330
513 H2 HOH 340 H2 HOH 37 1.230 -9.065 5.815
514 H1 HOH 341 H1 HOH 101 9.890 0.520 8.041
515 H2 HOH 341 H2 HOH 101 10.956 -0.409 8.578
516 H1 HOH 342 H1 HOH 73 2.210 -8.066 -4.544
517 H2 HOH 342 H2 HOH 73 1.835 -8.234 -3.083
518 H1 HOH 343 H1 HOH 54 3.716 -8.054 7.138
519 H2 HOH 343 H2 HOH 54 4.739 -9.126 7.456
520 H1 HOH 344 H1 HOH 141 -15.608 -5.199 -6.083
521 H2 HOH 344 H2 HOH 141 -14.722 -4.173 -5.410
522 H1 HOH 345 H1 HOH 83 10.076 -3.427 2.777
523 H2 HOH 345 H2 HOH 83 8.653 -3.245 3.272
524 H1 HOH 346 H1 HOH 18 -7.561 -5.024 8.539
525 H2 HOH 346 H2 HOH 18 -8.240 -3.729 8.928
526 H1 HOH 347 H1 HOH 148 -12.551 -0.096 -3.375
527 H2 HOH 347 H2 HOH 148 -13.810 0.102 -2.556
528 H1 HOH 348 H1 HOH 137 -12.659 4.368 5.144
529 H2 HOH 348 H2 HOH 137 -14.024 3.725 5.034
530 H1 HOH 349 H1 HOH 102 9.456 -13.057 -7.029
531 H2 HOH 349 H2 HOH 102 9.933 -11.625 -7.165
532 H1 HOH 350 H1 HOH 138 -12.176 4.803 1.275
533 H2 HOH 350 H2 HOH 138 -12.214 3.320 1.590
534 H1 HOH 351 H1 HOH 121 9.314 -9.061 -5.607
535 H2 HOH 351 H2 HOH 121 9.833 -8.039 -4.616
536 H1 HOH 352 H1 HOH 30 2.223 -11.040 -5.581
537 H2 HOH 352 H2 HOH 30 1.422 -10.125 -4.678
538 H1 HOH 353 H1 HOH 44 9.478 -6.790 2.346
539 H2 HOH 353 H2 HOH 44 8.928 -5.385 2.205
540 H1 HOH 354 H1 HOH 1 -18.107 -8.182 -3.603
541 H2 HOH 354 H2 HOH 1 -17.235 -7.176 -2.879
542 H1 HOH 355 H1 HOH 42 6.818 -8.241 -2.732
543 H2 HOH 355 H2 HOH 42 7.253 -6.795 -2.833
544 H1 HOH 356 H1 HOH 135 -14.930 2.078 -2.066
545 H2 HOH 356 H2 HOH 135 -14.187 1.607 -0.832
546 H1 HOH 357 H1 HOH 15 -16.554 -7.024 -0.892
547 H2 HOH 357 H2 HOH 15 -16.767 -8.512 -1.052
548 H1 HOH 358 H1 HOH 48 -1.904 -8.827 -1.918
549 H2 HOH 358 H2 HOH 48 -0.803 -8.634 -2.943
550 H1 HOH 359 H1 HOH 57 4.815 -1.740 6.900
551 H2 HOH 359 H2 HOH 57 4.024 -2.886 7.492
552 H1 HOH 360 H1 HOH 88 -0.488 1.902 11.047
553 H2 HOH 360 H2 HOH 88 0.017 2.079 12.463
554 H1 HOH 361 H1 HOH 184 -5.184 2.116 -9.424
555 H2 HOH 361 H2 HOH 184 -4.400 1.511 -10.568
556 H1 HOH 362 H1 HOH 29 -2.859 -13.369 -3.685
557 H2 HOH 362 H2 HOH 29 -2.770 -12.761 -2.303
558 H1 HOH 363 H1 HOH 96 0.800 -0.037 11.831
559 H2 HOH 363 H2 HOH 96 1.979 -0.988 11.843
560 H1 HOH 364 H1 HOH 150 -13.065 -3.030 -8.054
561 H2 HOH 364 H2 HOH 150 -13.450 -3.938 -6.906
562 H1 HOH 365 H1 HOH 124 10.692 -1.795 -5.804
563 H2 HOH 365 H2 HOH 124 11.092 -2.987 -4.958
564 H1 HOH 366 H1 HOH 125 12.688 -8.637 -9.356
565 H2 HOH 366 H2 HOH 125 11.417 -9.287 -9.858
566 H1 HOH 367 H1 HOH 47 -4.166 -9.909 -2.418
567 H2 HOH 367 H2 HOH 47 -4.031 -9.608 -0.940
568 H1 HOH 368 H1 HOH 52 4.818 -11.408 -1.259
569 H2 HOH 368 H2 HOH 52 5.659 -10.159 -1.105
570 H1 HOH 369 H1 HOH 17 -8.057 -1.655 10.583
571 H2 HOH 369 H2 HOH 17 -9.229 -1.431 11.515
572 H1 HOH 370 H1 HOH 126 11.619 -5.331 -5.752
573 H2 HOH 370 H2 HOH 126 12.231 -4.846 -4.455
574 H1 HOH 371 H1 HOH 181 2.271 6.974 -6.649
575 H2 HOH 371 H2 HOH 181 1.996 5.487 -6.684
576 H1 HOH 372 H1 HOH 110 11.053 -9.963 -6.197
577 H2 HOH 372 H2 HOH 110 11.556 -10.008 -7.626
578 H1 HOH 373 H1 HOH 158 -9.158 -9.281 -11.127
579 H2 HOH 373 H2 HOH 158 -8.950 -8.388 -9.923
580 H1 HOH 374 H1 HOH 28 -8.080 -13.253 -0.876
581 H2 HOH 374 H2 HOH 28 -8.639 -12.694 -2.164
582 H1 HOH 375 H1 HOH 176 3.617 6.688 -8.146
583 H2 HOH 375 H2 HOH 176 4.461 6.697 -9.402
584 H1 HOH 376 H1 HOH 169 -5.020 4.850 -5.538
585 H2 HOH 376 H2 HOH 169 -6.011 4.755 -4.399
586 H1 HOH 377 H1 HOH 118 8.973 -5.387 -1.539
587 H2 HOH 377 H2 HOH 118 8.432 -6.101 -0.318
588 H1 HOH 378 H1 HOH 178 -2.125 2.942 -12.392
589 H2 HOH 378 H2 HOH 178 -3.444 2.506 -12.989
590 H1 HOH 379 H1 HOH 146 -13.843 -1.832 -4.094
591 H2 HOH 379 H2 HOH 146 -13.661 -2.493 -5.444
592 H1 HOH 380 H1 HOH 84 -8.770 -14.500 0.968
593 H2 HOH 380 H2 HOH 84 -8.583 -13.056 1.377
594 H1 HOH 381 H1 HOH 11 -12.627 -6.034 6.687
595 H2 HOH 381 H2 HOH 11 -12.050 -4.757 6.118
596 H1 HOH 382 H1 HOH 39 -0.445 -9.945 4.228
597 H2 HOH 382 H2 HOH 39 -1.901 -10.369 4.200
598 H1 HOH 383 H1 HOH 78 -8.544 -12.148 3.613
599 H2 HOH 383 H2 HOH 78 -7.145 -12.025 3.058
600 H1 HOH 384 H1 HOH 182 -1.239 5.557 -8.369
601 H2 HOH 384 H2 HOH 182 -2.579 5.186 -8.970
602 H1 HOH 385 H1 HOH 75 7.856 -9.284 -0.909
603 H2 HOH 385 H2 HOH 75 7.913 -10.106 -2.179
604 H1 HOH 386 H1 HOH 71 -2.353 -10.923 -1.545
605 H2 HOH 386 H2 HOH 71 -1.264 -11.346 -0.582
606 H1 HOH 387 H1 HOH 76 -1.286 -11.943 1.354
607 H2 HOH 387 H2 HOH 76 -1.122 -10.589 2.013
608 H1 HOH 388 H1 HOH 189 -5.248 4.086 -7.764
609 H2 HOH 388 H2 HOH 189 -4.575 4.131 -9.121
610 H1 HOH 389 H1 HOH 196 2.759 8.875 -4.884
611 H2 HOH 389 H2 HOH 196 3.836 8.206 -5.710
612 H1 HOH 390 H1 HOH 63 -5.545 -12.759 4.139
613 H2 HOH 390 H2 HOH 63 -4.872 -11.424 4.371
614 H1 HOH 391 H1 HOH 183 -3.695 5.581 -11.086
615 H2 HOH 391 H2 HOH 183 -3.326 4.117 -10.986
616 H1 HOH 392 H1 HOH 175 5.783 8.937 -4.552
617 H2 HOH 392 H2 HOH 175 7.168 9.248 -4.027
618 H1 HOH 393 H1 HOH 65 -4.634 -13.650 -1.648
619 H2 HOH 393 H2 HOH 65 -6.109 -13.444 -1.372
620 H1 HOH 394 H1 HOH 64 -2.975 -12.189 5.491
621 H2 HOH 394 H2 HOH 64 -3.258 -10.853 6.142
622 H1 HOH 395 H1 HOH 90 4.634 -0.018 10.686
623 H2 HOH 395 H2 HOH 90 5.110 -0.624 11.987
624 H1 HOH 396 H1 HOH 170 6.298 8.793 -6.693
625 H2 HOH 396 H2 HOH 170 5.088 8.062 -7.239
626 H1 HOH 397 H1 HOH 60 -1.143 -14.418 0.507
627 H2 HOH 397 H2 HOH 60 -1.796 -13.257 -0.212
628 H1 HOH 398 H1 HOH 62 -3.387 -14.078 1.350
629 H2 HOH 398 H2 HOH 62 -4.755 -14.111 0.701
630 H1 HOH 399 H1 HOH 50 -4.856 -14.413 3.131
631 H2 HOH 399 H2 HOH 50 -5.330 -15.379 4.198