Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
12984 | 1tv0 RC | 6264 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 1H GLY 1 -10.972 11.346 -3.694
2 2H GLY 1 2H GLY 1 -11.014 9.693 -4.050
3 3H GLY 1 3H GLY 1 -9.556 10.544 -4.159
4 1HA GLY 1 1HA GLY 1 -9.545 10.927 -1.784
5 2HA GLY 1 2HA GLY 1 -11.084 10.090 -1.654
6 H LEU 2 H LEU 2 -10.778 7.886 -3.169
7 HA LEU 2 HA LEU 2 -8.986 6.304 -1.561
8 1HB LEU 2 1HB LEU 2 -10.754 5.521 -3.881
9 2HB LEU 2 2HB LEU 2 -9.910 4.402 -2.829
10 HG LEU 2 HG LEU 2 -12.044 6.325 -1.899
11 1HD1 LEU 2 1HD1 LEU 2 -12.964 4.656 -3.431
12 2HD1 LEU 2 2HD1 LEU 2 -13.507 4.379 -1.776
13 3HD1 LEU 2 3HD1 LEU 2 -12.238 3.370 -2.469
14 1HD2 LEU 2 1HD2 LEU 2 -12.028 4.976 0.135
15 2HD2 LEU 2 2HD2 LEU 2 -10.441 5.685 -0.165
16 3HD2 LEU 2 3HD2 LEU 2 -10.727 3.982 -0.524
17 H LEU 3 H LEU 3 -6.981 7.273 -2.246
18 HA LEU 3 HA LEU 3 -6.136 6.616 -4.977
19 1HB LEU 3 1HB LEU 3 -4.790 8.334 -2.889
20 2HB LEU 3 2HB LEU 3 -4.229 8.100 -4.534
21 HG LEU 3 HG LEU 3 -6.852 9.399 -3.785
22 1HD1 LEU 3 1HD1 LEU 3 -4.961 10.759 -3.071
23 2HD1 LEU 3 2HD1 LEU 3 -5.780 11.493 -4.450
24 3HD1 LEU 3 3HD1 LEU 3 -4.255 10.640 -4.682
25 1HD2 LEU 3 1HD2 LEU 3 -6.891 10.090 -6.136
26 2HD2 LEU 3 2HD2 LEU 3 -6.903 8.334 -5.973
27 3HD2 LEU 3 3HD2 LEU 3 -5.418 9.166 -6.429
28 H CYS 4 H CYS 4 -6.382 4.369 -3.561
29 HA CYS 4 HA CYS 4 -3.754 3.704 -2.454
30 1HB CYS 4 1HB CYS 4 -6.128 1.862 -2.519
31 2HB CYS 4 2HB CYS 4 -4.770 1.868 -1.400
32 H TYR 5 H TYR 5 -2.676 1.743 -3.127
33 HA TYR 5 HA TYR 5 -3.467 0.613 -5.697
34 1HB TYR 5 1HB TYR 5 -0.755 1.879 -5.238
35 2HB TYR 5 2HB TYR 5 -1.219 0.953 -6.660
36 HD1 TYR 5 1HD TYR 5 -1.244 4.182 -5.076
37 HD2 TYR 5 2HD TYR 5 -3.039 1.860 -8.157
38 HE1 TYR 5 1HE TYR 5 -2.056 6.242 -6.147
39 HE2 TYR 5 2HE TYR 5 -3.857 3.913 -9.235
40 HH TYR 5 HH TYR 5 -4.376 6.236 -8.622
41 H CYS 6 H CYS 6 -2.560 -1.427 -6.129
42 HA CYS 6 HA CYS 6 -1.732 -2.880 -3.775
43 1HB CYS 6 1HB CYS 6 -2.179 -3.766 -6.634
44 2HB CYS 6 2HB CYS 6 -1.779 -4.853 -5.310
45 H ARG 7 H ARG 7 0.285 -3.392 -3.221
46 HA ARG 7 HA ARG 7 2.410 -3.064 -5.237
47 1HB ARG 7 1HB ARG 7 2.419 -2.315 -2.315
48 2HB ARG 7 2HB ARG 7 3.886 -2.427 -3.276
49 1HG ARG 7 1HG ARG 7 1.566 -0.618 -3.916
50 2HG ARG 7 2HG ARG 7 3.008 -0.125 -3.027
51 1HD ARG 7 1HD ARG 7 4.406 -0.600 -4.923
52 2HD ARG 7 2HD ARG 7 3.044 -1.291 -5.804
53 HE ARG 7 HE ARG 7 2.902 1.519 -5.005
54 1HH1 ARG 7 1HH1 ARG 7 3.274 -0.887 -7.489
55 2HH1 ARG 7 2HH1 ARG 7 2.984 0.221 -8.791
56 1HH2 ARG 7 1HH2 ARG 7 2.515 2.990 -6.705
57 2HH2 ARG 7 2HH2 ARG 7 2.552 2.428 -8.344
58 H LYS 8 H LYS 8 4.442 -4.257 -4.642
59 HA LYS 8 HA LYS 8 3.788 -6.835 -3.371
60 1HB LYS 8 1HB LYS 8 3.975 -7.153 -5.764
61 2HB LYS 8 2HB LYS 8 5.513 -6.303 -5.796
62 1HG LYS 8 1HG LYS 8 6.508 -8.089 -4.431
63 2HG LYS 8 2HG LYS 8 4.967 -8.950 -4.463
64 1HD LYS 8 1HD LYS 8 5.101 -9.243 -6.831
65 2HD LYS 8 2HD LYS 8 6.496 -8.168 -6.941
66 1HE LYS 8 1HE LYS 8 6.439 -10.814 -5.491
67 2HE LYS 8 2HE LYS 8 7.121 -10.546 -7.095
68 1HZ LYS 8 1HZ LYS 8 8.707 -9.002 -6.125
69 2HZ LYS 8 2HZ LYS 8 8.833 -10.523 -5.394
70 3HZ LYS 8 3HZ LYS 8 8.053 -9.258 -4.585
71 H GLY 9 H GLY 9 4.914 -7.164 -1.580
72 1HA GLY 9 1HA GLY 9 6.808 -7.410 -0.251
73 2HA GLY 9 2HA GLY 9 7.755 -6.615 -1.500
74 H HIS 10 H HIS 10 7.040 -4.197 -1.788
75 HA HIS 10 HA HIS 10 6.265 -2.906 0.679
76 1HB HIS 10 1HB HIS 10 8.354 -1.529 0.773
77 2HB HIS 10 2HB HIS 10 8.598 -3.229 1.162
78 HD1 HIS 10 1HD HIS 10 8.246 -2.610 -2.425
79 HD2 HIS 10 2HD HIS 10 11.332 -2.689 0.355
80 HE1 HIS 10 1HE HIS 10 10.358 -2.771 -3.772
81 HE2 HIS 10 2HE HIS 10 12.209 -2.911 -2.069
82 H CYS 11 H CYS 11 6.524 -0.417 0.380
83 HA CYS 11 HA CYS 11 5.913 0.300 -2.409
84 1HB CYS 11 1HB CYS 11 3.833 0.123 -1.049
85 2HB CYS 11 2HB CYS 11 4.470 1.357 0.031
86 H LYS 12 H LYS 12 6.057 2.702 -2.767
87 HA LYS 12 HA LYS 12 8.581 3.632 -1.776
88 1HB LYS 12 1HB LYS 12 8.189 5.581 -3.235
89 2HB LYS 12 2HB LYS 12 7.966 4.060 -4.087
90 1HG LYS 12 1HG LYS 12 5.582 4.283 -3.986
91 2HG LYS 12 2HG LYS 12 5.718 5.705 -2.950
92 1HD LYS 12 1HD LYS 12 5.257 6.463 -5.168
93 2HD LYS 12 2HD LYS 12 6.944 6.842 -4.812
94 1HE LYS 12 1HE LYS 12 6.758 5.955 -7.054
95 2HE LYS 12 2HE LYS 12 7.630 4.814 -6.032
96 1HZ LYS 12 1HZ LYS 12 6.010 3.699 -7.435
97 2HZ LYS 12 2HZ LYS 12 4.759 4.621 -6.770
98 3HZ LYS 12 3HZ LYS 12 5.605 3.521 -5.802
99 H ARG 13 H ARG 13 5.222 4.315 -1.134
100 HA ARG 13 HA ARG 13 5.793 5.512 1.355
101 1HB ARG 13 1HB ARG 13 5.090 7.802 0.910
102 2HB ARG 13 2HB ARG 13 6.501 7.394 -0.050
103 1HG ARG 13 1HG ARG 13 4.943 6.935 -1.963
104 2HG ARG 13 2HG ARG 13 3.654 7.626 -0.979
105 1HD ARG 13 1HD ARG 13 6.179 9.012 -1.869
106 2HD ARG 13 2HD ARG 13 4.551 9.306 -2.477
107 HE ARG 13 HE ARG 13 4.313 9.777 0.173
108 1HH1 ARG 13 1HH1 ARG 13 6.506 10.939 -2.272
109 2HH1 ARG 13 2HH1 ARG 13 6.755 12.471 -1.503
110 1HH2 ARG 13 1HH2 ARG 13 4.635 11.787 1.193
111 2HH2 ARG 13 2HH2 ARG 13 5.693 12.951 0.469
112 H GLY 14 H GLY 14 4.114 4.998 2.585
113 1HA GLY 14 1HA GLY 14 1.760 5.266 3.090
114 2HA GLY 14 2HA GLY 14 1.422 5.044 1.380
115 H GLU 15 H GLU 15 3.758 3.011 2.937
116 HA GLU 15 HA GLU 15 2.520 0.625 2.174
117 1HB GLU 15 1HB GLU 15 4.595 1.197 4.292
118 2HB GLU 15 2HB GLU 15 4.091 -0.430 3.855
119 1HG GLU 15 1HG GLU 15 4.957 -0.228 1.683
120 2HG GLU 15 2HG GLU 15 5.180 1.514 1.844
121 H ARG 16 H ARG 16 0.663 -0.196 2.883
122 HA ARG 16 HA ARG 16 0.112 -0.185 5.758
123 1HB ARG 16 1HB ARG 16 -1.870 0.681 3.646
124 2HB ARG 16 2HB ARG 16 -2.253 0.419 5.342
125 1HG ARG 16 1HG ARG 16 -0.776 2.231 5.984
126 2HG ARG 16 2HG ARG 16 -0.305 2.467 4.300
127 1HD ARG 16 1HD ARG 16 -1.971 4.111 4.973
128 2HD ARG 16 2HD ARG 16 -2.615 3.035 3.733
129 HE ARG 16 HE ARG 16 -3.217 2.224 6.431
130 1HH1 ARG 16 1HH1 ARG 16 -4.234 4.136 3.700
131 2HH1 ARG 16 2HH1 ARG 16 -5.898 4.164 4.177
132 1HH2 ARG 16 1HH2 ARG 16 -5.405 2.255 7.065
133 2HH2 ARG 16 2HH2 ARG 16 -6.565 3.094 6.090
134 H VAL 17 H VAL 17 -1.809 -1.636 6.265
135 HA VAL 17 HA VAL 17 -2.014 -3.866 4.367
136 HB VAL 17 HB VAL 17 -1.747 -4.398 7.313
137 1HG1 VAL 17 1HG1 VAL 17 -2.691 -6.159 5.909
138 2HG1 VAL 17 2HG1 VAL 17 -1.118 -6.630 6.551
139 3HG1 VAL 17 3HG1 VAL 17 -1.264 -6.105 4.874
140 1HG2 VAL 17 1HG2 VAL 17 0.626 -4.925 6.949
141 2HG2 VAL 17 2HG2 VAL 17 0.280 -3.217 6.685
142 3HG2 VAL 17 3HG2 VAL 17 0.504 -4.294 5.306
143 H ARG 18 H ARG 18 -3.932 -1.935 4.617
144 HA ARG 18 HA ARG 18 -5.946 -2.583 6.524
145 1HB ARG 18 1HB ARG 18 -5.757 -0.373 5.375
146 2HB ARG 18 2HB ARG 18 -6.268 -1.146 3.880
147 1HG ARG 18 1HG ARG 18 -8.380 -1.808 5.044
148 2HG ARG 18 2HG ARG 18 -7.867 -0.809 6.405
149 1HD ARG 18 1HD ARG 18 -9.354 0.483 5.047
150 2HD ARG 18 2HD ARG 18 -7.725 1.126 4.845
151 HE ARG 18 HE ARG 18 -7.962 -0.628 2.796
152 1HH1 ARG 18 1HH1 ARG 18 -9.921 2.029 3.916
153 2HH1 ARG 18 2HH1 ARG 18 -10.518 2.421 2.338
154 1HH2 ARG 18 1HH2 ARG 18 -8.746 -0.121 0.717
155 2HH2 ARG 18 2HH2 ARG 18 -9.852 1.197 0.519
156 H GLY 19 H GLY 19 -5.778 -3.078 3.006
157 1HA GLY 19 1HA GLY 19 -7.390 -5.526 3.358
158 2HA GLY 19 2HA GLY 19 -7.734 -4.381 2.068
159 H THR 20 H THR 20 -5.524 -6.808 3.244
160 HA THR 20 HA THR 20 -3.404 -6.705 1.557
161 HB THR 20 HB THR 20 -3.201 -9.131 1.726
162 HG1 THR 20 1HG THR 20 -5.291 -9.787 3.202
163 1HG2 THR 20 1HG2 THR 20 -2.613 -7.767 3.679
164 2HG2 THR 20 2HG2 THR 20 -3.245 -9.341 4.161
165 3HG2 THR 20 3HG2 THR 20 -4.267 -7.910 4.275
166 H CYS 21 H CYS 21 -3.140 -6.637 -0.552
167 HA CYS 21 HA CYS 21 -5.326 -7.265 -2.339
168 1HB CYS 21 1HB CYS 21 -3.769 -5.258 -2.557
169 2HB CYS 21 2HB CYS 21 -2.542 -6.392 -3.111
170 H GLY 22 H GLY 22 -3.504 -9.275 -0.799
171 1HA GLY 22 1HA GLY 22 -3.796 -11.498 -2.317
172 2HA GLY 22 2HA GLY 22 -2.301 -10.806 -2.931
173 H ILE 23 H ILE 23 -1.236 -12.731 -2.196
174 HA ILE 23 HA ILE 23 -1.084 -13.146 0.685
175 HB ILE 23 HB ILE 23 0.299 -14.666 -1.531
176 1HG1 ILE 23 1HG1 ILE 23 -2.195 -15.408 0.014
177 2HG1 ILE 23 2HG1 ILE 23 -2.202 -14.749 -1.619
178 1HG2 ILE 23 1HG2 ILE 23 -0.104 -15.329 1.384
179 2HG2 ILE 23 2HG2 ILE 23 1.419 -14.886 0.616
180 3HG2 ILE 23 3HG2 ILE 23 0.619 -16.396 0.181
181 1HD1 ILE 23 1HD1 ILE 23 -0.959 -17.353 -0.765
182 2HD1 ILE 23 2HD1 ILE 23 -0.948 -16.694 -2.400
183 3HD1 ILE 23 3HD1 ILE 23 -2.474 -17.155 -1.646
184 H ARG 24 H ARG 24 1.304 -12.848 -1.952
185 HA ARG 24 HA ARG 24 3.304 -11.916 -0.059
186 1HB ARG 24 1HB ARG 24 4.860 -12.074 -1.931
187 2HB ARG 24 2HB ARG 24 3.929 -13.558 -1.781
188 1HG ARG 24 1HG ARG 24 2.411 -12.657 -3.576
189 2HG ARG 24 2HG ARG 24 3.595 -11.369 -3.813
190 1HD ARG 24 1HD ARG 24 4.163 -14.323 -4.035
191 2HD ARG 24 2HD ARG 24 3.888 -13.237 -5.396
192 HE ARG 24 HE ARG 24 5.965 -12.188 -3.852
193 1HH1 ARG 24 1HH1 ARG 24 5.307 -14.951 -5.869
194 2HH1 ARG 24 2HH1 ARG 24 6.960 -15.159 -6.344
195 1HH2 ARG 24 1HH2 ARG 24 8.144 -12.455 -4.474
196 2HH2 ARG 24 2HH2 ARG 24 8.572 -13.744 -5.548
197 H PHE 25 H PHE 25 0.835 -10.385 -1.190
198 HA PHE 25 HA PHE 25 2.311 -7.963 -1.993
199 1HB PHE 25 1HB PHE 25 -0.561 -8.684 -2.617
200 2HB PHE 25 2HB PHE 25 0.283 -7.234 -3.151
201 HD1 PHE 25 1HD PHE 25 -0.164 -10.812 -3.653
202 HD2 PHE 25 2HD PHE 25 1.978 -7.351 -4.889
203 HE1 PHE 25 1HE PHE 25 0.584 -12.002 -5.672
204 HE2 PHE 25 2HE PHE 25 2.731 -8.533 -6.911
205 HZ PHE 25 HZ PHE 25 2.033 -10.863 -7.304
206 H LEU 26 H LEU 26 0.867 -5.942 -1.538
207 HA LEU 26 HA LEU 26 -0.589 -6.090 0.971
208 1HB LEU 26 1HB LEU 26 0.769 -4.379 2.059
209 2HB LEU 26 2HB LEU 26 1.710 -5.819 1.725
210 HG LEU 26 HG LEU 26 1.784 -3.463 -0.131
211 1HD1 LEU 26 1HD1 LEU 26 3.749 -2.653 1.073
212 2HD1 LEU 26 2HD1 LEU 26 3.499 -3.886 2.311
213 3HD1 LEU 26 3HD1 LEU 26 2.306 -2.606 2.087
214 1HD2 LEU 26 1HD2 LEU 26 3.722 -5.687 0.494
215 2HD2 LEU 26 2HD2 LEU 26 4.010 -4.372 -0.645
216 3HD2 LEU 26 3HD2 LEU 26 2.728 -5.542 -0.956
217 H TYR 27 H TYR 27 -1.007 -3.536 1.586
218 HA TYR 27 HA TYR 27 -1.976 -2.346 -0.929
219 1HB TYR 27 1HB TYR 27 -3.491 -3.225 1.212
220 2HB TYR 27 2HB TYR 27 -3.389 -1.487 1.469
221 HD1 TYR 27 1HD TYR 27 -4.924 -0.110 0.379
222 HD2 TYR 27 2HD TYR 27 -4.097 -3.963 -1.224
223 HE1 TYR 27 1HE TYR 27 -6.665 0.225 -1.320
224 HE2 TYR 27 2HE TYR 27 -5.836 -3.635 -2.927
225 HH TYR 27 HH TYR 27 -7.219 -0.639 -3.591
226 H CYS 28 H CYS 28 -1.168 -0.446 -1.437
227 HA CYS 28 HA CYS 28 0.095 1.161 0.686
228 1HB CYS 28 1HB CYS 28 1.725 0.347 -0.927
229 2HB CYS 28 2HB CYS 28 0.769 0.988 -2.259
230 H CYS 29 H CYS 29 -1.228 2.767 1.249
231 HA CYS 29 HA CYS 29 -2.463 4.349 -0.902
232 1HB CYS 29 1HB CYS 29 -4.025 2.791 0.476
233 2HB CYS 29 2HB CYS 29 -3.821 3.988 1.751
234 HA PRO 30 HA PRO 30 0.133 7.301 1.420
235 1HB PRO 30 1HB PRO 30 -0.169 9.300 -0.441
236 2HB PRO 30 2HB PRO 30 1.066 8.039 -0.529
237 1HG PRO 30 1HG PRO 30 -1.580 8.205 -1.917
238 2HG PRO 30 2HG PRO 30 -0.009 7.680 -2.556
239 1HD PRO 30 1HD PRO 30 -1.899 5.913 -1.845
240 2HD PRO 30 2HD PRO 30 -0.174 5.583 -1.581
241 H ARG 31 H ARG 31 -0.254 9.589 2.111
242 HA ARG 31 HA ARG 31 -3.094 9.934 2.768
243 1HB ARG 31 1HB ARG 31 -1.266 9.758 4.565
244 2HB ARG 31 2HB ARG 31 -0.790 11.375 4.066
245 1HG ARG 31 1HG ARG 31 -3.080 12.161 4.580
246 2HG ARG 31 2HG ARG 31 -3.457 10.547 5.190
247 1HD ARG 31 1HD ARG 31 -1.372 12.447 6.253
248 2HD ARG 31 2HD ARG 31 -2.885 11.990 7.036
249 HE ARG 31 HE ARG 31 -1.562 9.630 6.647
250 1HH1 ARG 31 1HH1 ARG 31 -0.843 12.638 8.251
251 2HH1 ARG 31 2HH1 ARG 31 0.196 11.910 9.429
252 1HH2 ARG 31 1HH2 ARG 31 -0.195 8.663 8.192
253 2HH2 ARG 31 2HH2 ARG 31 0.568 9.649 9.394
254 H ARG 32 H ARG 32 -1.324 10.853 0.348
255 HA ARG 32 HA ARG 32 -2.749 13.298 -0.082
256 1HB ARG 32 1HB ARG 32 -0.922 14.155 1.303
257 2HB ARG 32 2HB ARG 32 0.257 13.420 0.226
258 1HG ARG 32 1HG ARG 32 -0.447 14.885 -1.579
259 2HG ARG 32 2HG ARG 32 -1.680 15.598 -0.536
260 1HD ARG 32 1HD ARG 32 0.029 16.454 0.952
261 2HD ARG 32 2HD ARG 32 1.289 15.663 0.004
262 HE ARG 32 HE ARG 32 0.092 17.248 -1.816
263 1HH1 ARG 32 1HH1 ARG 32 1.334 17.862 1.384
264 2HH1 ARG 32 2HH1 ARG 32 1.754 19.507 1.043
265 1HH2 ARG 32 1HH2 ARG 32 0.645 19.411 -2.271
266 2HH2 ARG 32 2HH2 ARG 32 1.361 20.388 -1.033
Start of MODEL 2
1 1H GLY 1 1H GLY 1 -12.713 10.600 -2.626
2 2H GLY 1 2H GLY 1 -14.059 9.597 -2.832
3 3H GLY 1 3H GLY 1 -12.844 9.633 -4.008
4 1HA GLY 1 1HA GLY 1 -12.511 8.657 -1.224
5 2HA GLY 1 2HA GLY 1 -12.707 7.630 -2.636
6 H LEU 2 H LEU 2 -10.569 6.991 -1.375
7 HA LEU 2 HA LEU 2 -8.312 8.559 -2.385
8 1HB LEU 2 1HB LEU 2 -8.465 6.316 -0.373
9 2HB LEU 2 2HB LEU 2 -6.956 7.003 -0.936
10 HG LEU 2 HG LEU 2 -7.469 7.952 1.201
11 1HD1 LEU 2 1HD1 LEU 2 -8.120 9.999 -0.912
12 2HD1 LEU 2 2HD1 LEU 2 -6.496 9.455 -0.491
13 3HD1 LEU 2 3HD1 LEU 2 -7.477 10.308 0.700
14 1HD2 LEU 2 1HD2 LEU 2 -9.514 9.162 1.671
15 2HD2 LEU 2 2HD2 LEU 2 -9.883 7.506 1.193
16 3HD2 LEU 2 3HD2 LEU 2 -10.113 8.826 0.047
17 H LEU 3 H LEU 3 -6.727 7.694 -3.700
18 HA LEU 3 HA LEU 3 -7.478 5.200 -5.071
19 1HB LEU 3 1HB LEU 3 -5.836 7.527 -6.075
20 2HB LEU 3 2HB LEU 3 -6.184 6.069 -6.986
21 HG LEU 3 HG LEU 3 -8.256 8.051 -6.037
22 1HD1 LEU 3 1HD1 LEU 3 -7.087 7.590 -8.777
23 2HD1 LEU 3 2HD1 LEU 3 -6.843 9.012 -7.761
24 3HD1 LEU 3 3HD1 LEU 3 -8.445 8.652 -8.406
25 1HD2 LEU 3 1HD2 LEU 3 -9.138 5.789 -6.206
26 2HD2 LEU 3 2HD2 LEU 3 -8.483 5.641 -7.837
27 3HD2 LEU 3 3HD2 LEU 3 -9.770 6.800 -7.505
28 H CYS 4 H CYS 4 -6.387 3.861 -3.565
29 HA CYS 4 HA CYS 4 -3.581 4.212 -3.057
30 1HB CYS 4 1HB CYS 4 -5.252 1.745 -2.549
31 2HB CYS 4 2HB CYS 4 -3.726 2.179 -1.784
32 H TYR 5 H TYR 5 -2.329 1.896 -3.322
33 HA TYR 5 HA TYR 5 -2.746 0.892 -6.033
34 1HB TYR 5 1HB TYR 5 -0.105 2.033 -5.093
35 2HB TYR 5 2HB TYR 5 -0.390 1.236 -6.637
36 HD1 TYR 5 1HD TYR 5 -0.602 4.323 -4.787
37 HD2 TYR 5 2HD TYR 5 -1.907 2.332 -8.311
38 HE1 TYR 5 1HE TYR 5 -1.213 6.490 -5.776
39 HE2 TYR 5 2HE TYR 5 -2.520 4.492 -9.312
40 HH TYR 5 HH TYR 5 -3.127 6.774 -8.541
41 H CYS 6 H CYS 6 -2.307 -1.219 -6.243
42 HA CYS 6 HA CYS 6 -1.456 -2.691 -3.897
43 1HB CYS 6 1HB CYS 6 -3.290 -3.667 -5.033
44 2HB CYS 6 2HB CYS 6 -2.517 -3.488 -6.603
45 H ARG 7 H ARG 7 0.525 -3.524 -3.561
46 HA ARG 7 HA ARG 7 2.360 -3.705 -5.852
47 1HB ARG 7 1HB ARG 7 2.955 -2.474 -3.162
48 2HB ARG 7 2HB ARG 7 4.198 -2.915 -4.326
49 1HG ARG 7 1HG ARG 7 3.059 -1.393 -5.966
50 2HG ARG 7 2HG ARG 7 2.047 -0.838 -4.632
51 1HD ARG 7 1HD ARG 7 4.044 -0.136 -3.409
52 2HD ARG 7 2HD ARG 7 5.059 -0.704 -4.733
53 HE ARG 7 HE ARG 7 3.062 1.392 -5.219
54 1HH1 ARG 7 1HH1 ARG 7 6.386 0.350 -5.088
55 2HH1 ARG 7 2HH1 ARG 7 6.991 1.754 -5.902
56 1HH2 ARG 7 1HH2 ARG 7 3.852 3.242 -6.291
57 2HH2 ARG 7 2HH2 ARG 7 5.553 3.398 -6.582
58 H LYS 8 H LYS 8 4.482 -4.848 -5.046
59 HA LYS 8 HA LYS 8 3.693 -7.193 -3.445
60 1HB LYS 8 1HB LYS 8 3.822 -7.826 -5.783
61 2HB LYS 8 2HB LYS 8 5.412 -7.092 -5.930
62 1HG LYS 8 1HG LYS 8 6.191 -8.759 -4.188
63 2HG LYS 8 2HG LYS 8 4.649 -9.580 -4.434
64 1HD LYS 8 1HD LYS 8 6.594 -8.956 -6.652
65 2HD LYS 8 2HD LYS 8 6.552 -10.493 -5.786
66 1HE LYS 8 1HE LYS 8 4.240 -9.304 -7.314
67 2HE LYS 8 2HE LYS 8 5.323 -10.550 -7.932
68 1HZ LYS 8 1HZ LYS 8 3.280 -11.500 -7.060
69 2HZ LYS 8 2HZ LYS 8 3.574 -10.810 -5.544
70 3HZ LYS 8 3HZ LYS 8 4.609 -12.007 -6.142
71 H GLY 9 H GLY 9 4.697 -6.842 -1.537
72 1HA GLY 9 1HA GLY 9 6.762 -7.302 -0.354
73 2HA GLY 9 2HA GLY 9 7.622 -6.470 -1.640
74 H HIS 10 H HIS 10 8.194 -4.426 -1.290
75 HA HIS 10 HA HIS 10 6.838 -2.975 0.889
76 1HB HIS 10 1HB HIS 10 9.267 -3.746 1.249
77 2HB HIS 10 2HB HIS 10 9.700 -2.508 0.075
78 HD1 HIS 10 1HD HIS 10 8.138 -2.882 3.489
79 HD2 HIS 10 2HD HIS 10 9.807 0.053 1.066
80 HE1 HIS 10 1HE HIS 10 8.356 -0.847 4.951
81 HE2 HIS 10 2HE HIS 10 9.431 0.897 3.483
82 H CYS 11 H CYS 11 5.953 -1.078 0.392
83 HA CYS 11 HA CYS 11 6.100 -0.096 -2.311
84 1HB CYS 11 1HB CYS 11 3.983 -0.098 -1.013
85 2HB CYS 11 2HB CYS 11 4.683 1.080 0.090
86 H LYS 12 H LYS 12 6.284 2.384 -2.577
87 HA LYS 12 HA LYS 12 8.912 3.123 -1.719
88 1HB LYS 12 1HB LYS 12 8.548 5.151 -3.047
89 2HB LYS 12 2HB LYS 12 8.108 3.708 -3.951
90 1HG LYS 12 1HG LYS 12 5.755 4.122 -3.509
91 2HG LYS 12 2HG LYS 12 6.174 5.541 -2.547
92 1HD LYS 12 1HD LYS 12 7.232 6.530 -4.563
93 2HD LYS 12 2HD LYS 12 6.661 5.146 -5.498
94 1HE LYS 12 1HE LYS 12 4.350 5.718 -4.923
95 2HE LYS 12 2HE LYS 12 4.925 7.101 -3.992
96 1HZ LYS 12 1HZ LYS 12 5.236 6.706 -6.918
97 2HZ LYS 12 2HZ LYS 12 5.873 8.006 -6.045
98 3HZ LYS 12 3HZ LYS 12 4.198 7.806 -6.160
99 H ARG 13 H ARG 13 5.629 4.183 -0.945
100 HA ARG 13 HA ARG 13 6.405 5.083 1.635
101 1HB ARG 13 1HB ARG 13 6.067 7.449 1.396
102 2HB ARG 13 2HB ARG 13 7.277 6.947 0.227
103 1HG ARG 13 1HG ARG 13 5.433 6.865 -1.483
104 2HG ARG 13 2HG ARG 13 4.400 7.649 -0.285
105 1HD ARG 13 1HD ARG 13 6.964 8.729 -1.449
106 2HD ARG 13 2HD ARG 13 5.331 9.309 -1.774
107 HE ARG 13 HE ARG 13 5.550 9.582 0.905
108 1HH1 ARG 13 1HH1 ARG 13 7.552 10.594 -1.761
109 2HH1 ARG 13 2HH1 ARG 13 8.151 11.999 -0.945
110 1HH2 ARG 13 1HH2 ARG 13 6.335 11.429 1.987
111 2HH2 ARG 13 2HH2 ARG 13 7.460 12.475 1.185
112 H GLY 14 H GLY 14 4.651 5.418 2.977
113 1HA GLY 14 1HA GLY 14 2.436 5.535 3.629
114 2HA GLY 14 2HA GLY 14 1.998 5.811 1.950
115 H GLU 15 H GLU 15 3.520 3.122 3.739
116 HA GLU 15 HA GLU 15 2.010 1.201 2.196
117 1HB GLU 15 1HB GLU 15 3.756 0.618 4.586
118 2HB GLU 15 2HB GLU 15 3.302 -0.479 3.289
119 1HG GLU 15 1HG GLU 15 5.468 0.036 2.741
120 2HG GLU 15 2HG GLU 15 4.567 1.202 1.772
121 H ARG 16 H ARG 16 0.690 -0.478 3.213
122 HA ARG 16 HA ARG 16 -0.261 -0.161 5.879
123 1HB ARG 16 1HB ARG 16 -1.366 1.733 4.502
124 2HB ARG 16 2HB ARG 16 -2.340 0.449 3.798
125 1HG ARG 16 1HG ARG 16 -3.601 1.367 5.568
126 2HG ARG 16 2HG ARG 16 -2.996 -0.191 6.139
127 1HD ARG 16 1HD ARG 16 -2.761 1.499 7.869
128 2HD ARG 16 2HD ARG 16 -1.177 0.956 7.315
129 HE ARG 16 HE ARG 16 -2.170 3.324 5.997
130 1HH1 ARG 16 1HH1 ARG 16 -0.322 2.056 8.666
131 2HH1 ARG 16 2HH1 ARG 16 0.581 3.516 8.900
132 1HH2 ARG 16 1HH2 ARG 16 -0.987 5.246 6.299
133 2HH2 ARG 16 2HH2 ARG 16 0.203 5.329 7.555
134 H VAL 17 H VAL 17 -1.857 -1.740 6.469
135 HA VAL 17 HA VAL 17 -2.220 -3.894 4.502
136 HB VAL 17 HB VAL 17 -1.705 -4.477 7.409
137 1HG1 VAL 17 1HG1 VAL 17 -1.457 -6.150 4.911
138 2HG1 VAL 17 2HG1 VAL 17 -2.771 -6.227 6.084
139 3HG1 VAL 17 3HG1 VAL 17 -1.138 -6.698 6.557
140 1HG2 VAL 17 1HG2 VAL 17 0.344 -4.334 5.199
141 2HG2 VAL 17 2HG2 VAL 17 0.627 -4.994 6.809
142 3HG2 VAL 17 3HG2 VAL 17 0.252 -3.282 6.611
143 H ARG 18 H ARG 18 -4.108 -1.965 4.991
144 HA ARG 18 HA ARG 18 -6.028 -3.016 6.903
145 1HB ARG 18 1HB ARG 18 -5.763 -0.586 6.698
146 2HB ARG 18 2HB ARG 18 -6.204 -0.671 4.999
147 1HG ARG 18 1HG ARG 18 -8.066 0.117 6.325
148 2HG ARG 18 2HG ARG 18 -8.436 -1.458 5.621
149 1HD ARG 18 1HD ARG 18 -9.173 -1.334 7.944
150 2HD ARG 18 2HD ARG 18 -7.904 -2.541 7.742
151 HE ARG 18 HE ARG 18 -6.865 0.002 8.519
152 1HH1 ARG 18 1HH1 ARG 18 -8.394 -2.894 9.706
153 2HH1 ARG 18 2HH1 ARG 18 -7.756 -2.730 11.308
154 1HH2 ARG 18 1HH2 ARG 18 -6.019 0.227 10.626
155 2HH2 ARG 18 2HH2 ARG 18 -6.404 -0.957 11.830
156 H GLY 19 H GLY 19 -5.348 -3.072 3.526
157 1HA GLY 19 1HA GLY 19 -7.606 -4.900 3.114
158 2HA GLY 19 2HA GLY 19 -7.435 -3.518 2.038
159 H THR 20 H THR 20 -5.632 -6.299 3.299
160 HA THR 20 HA THR 20 -3.462 -6.391 1.689
161 HB THR 20 HB THR 20 -3.788 -8.080 3.370
162 HG1 THR 20 1HG THR 20 -3.666 -9.185 0.746
163 1HG2 THR 20 1HG2 THR 20 -5.991 -9.187 1.624
164 2HG2 THR 20 2HG2 THR 20 -6.224 -8.334 3.149
165 3HG2 THR 20 3HG2 THR 20 -5.400 -9.893 3.128
166 H CYS 21 H CYS 21 -2.988 -6.649 -0.379
167 HA CYS 21 HA CYS 21 -5.126 -6.821 -2.310
168 1HB CYS 21 1HB CYS 21 -3.316 -5.237 -2.675
169 2HB CYS 21 2HB CYS 21 -2.134 -6.540 -2.643
170 H GLY 22 H GLY 22 -2.713 -8.921 -0.959
171 1HA GLY 22 1HA GLY 22 -3.912 -11.233 -2.088
172 2HA GLY 22 2HA GLY 22 -2.435 -10.834 -2.953
173 H ILE 23 H ILE 23 -1.693 -12.930 -2.196
174 HA ILE 23 HA ILE 23 -1.346 -13.517 0.548
175 HB ILE 23 HB ILE 23 0.332 -14.584 -1.723
176 1HG1 ILE 23 1HG1 ILE 23 -2.284 -15.681 -0.664
177 2HG1 ILE 23 2HG1 ILE 23 -2.119 -14.786 -2.172
178 1HG2 ILE 23 1HG2 ILE 23 1.162 -15.073 0.525
179 2HG2 ILE 23 2HG2 ILE 23 0.592 -16.535 -0.282
180 3HG2 ILE 23 3HG2 ILE 23 -0.403 -15.764 0.954
181 1HD1 ILE 23 1HD1 ILE 23 -0.860 -17.440 -1.522
182 2HD1 ILE 23 2HD1 ILE 23 -0.612 -16.534 -3.014
183 3HD1 ILE 23 3HD1 ILE 23 -2.215 -17.151 -2.614
184 H ARG 24 H ARG 24 1.147 -12.695 -1.870
185 HA ARG 24 HA ARG 24 2.861 -11.727 0.300
186 1HB ARG 24 1HB ARG 24 4.678 -11.836 -1.341
187 2HB ARG 24 2HB ARG 24 3.841 -13.376 -1.214
188 1HG ARG 24 1HG ARG 24 2.545 -12.757 -3.252
189 2HG ARG 24 2HG ARG 24 3.578 -11.334 -3.407
190 1HD ARG 24 1HD ARG 24 4.393 -13.116 -4.833
191 2HD ARG 24 2HD ARG 24 5.546 -12.801 -3.536
192 HE ARG 24 HE ARG 24 4.337 -14.793 -2.431
193 1HH1 ARG 24 1HH1 ARG 24 4.945 -14.432 -5.845
194 2HH1 ARG 24 2HH1 ARG 24 5.021 -16.137 -6.142
195 1HH2 ARG 24 1HH2 ARG 24 4.438 -17.039 -2.815
196 2HH2 ARG 24 2HH2 ARG 24 4.732 -17.618 -4.421
197 H PHE 25 H PHE 25 0.522 -10.371 -1.281
198 HA PHE 25 HA PHE 25 1.945 -7.977 -2.190
199 1HB PHE 25 1HB PHE 25 -0.973 -8.731 -2.451
200 2HB PHE 25 2HB PHE 25 -0.223 -7.296 -3.142
201 HD1 PHE 25 1HD PHE 25 -0.497 -10.946 -3.357
202 HD2 PHE 25 2HD PHE 25 1.128 -7.429 -5.114
203 HE1 PHE 25 1HE PHE 25 0.051 -12.221 -5.388
204 HE2 PHE 25 2HE PHE 25 1.678 -8.696 -7.151
205 HZ PHE 25 HZ PHE 25 1.140 -11.095 -7.290
206 H LEU 26 H LEU 26 0.695 -5.869 -1.696
207 HA LEU 26 HA LEU 26 -0.599 -5.813 0.892
208 1HB LEU 26 1HB LEU 26 0.952 -4.428 2.006
209 2HB LEU 26 2HB LEU 26 1.880 -5.758 1.344
210 HG LEU 26 HG LEU 26 1.692 -3.051 0.026
211 1HD1 LEU 26 1HD1 LEU 26 3.870 -4.119 1.817
212 2HD1 LEU 26 2HD1 LEU 26 2.711 -2.863 2.252
213 3HD1 LEU 26 3HD1 LEU 26 3.877 -2.577 0.961
214 1HD2 LEU 26 1HD2 LEU 26 3.704 -3.829 -1.162
215 2HD2 LEU 26 2HD2 LEU 26 2.298 -4.844 -1.486
216 3HD2 LEU 26 3HD2 LEU 26 3.546 -5.397 -0.369
217 H TYR 27 H TYR 27 -1.041 -3.419 1.507
218 HA TYR 27 HA TYR 27 -1.961 -2.095 -0.951
219 1HB TYR 27 1HB TYR 27 -3.397 -2.897 1.274
220 2HB TYR 27 2HB TYR 27 -3.176 -1.171 1.535
221 HD1 TYR 27 1HD TYR 27 -3.989 -3.429 -1.331
222 HD2 TYR 27 2HD TYR 27 -4.895 0.159 0.768
223 HE1 TYR 27 1HE TYR 27 -5.816 -2.970 -2.913
224 HE2 TYR 27 2HE TYR 27 -6.724 0.627 -0.806
225 HH TYR 27 HH TYR 27 -7.904 -1.688 -2.995
226 H CYS 28 H CYS 28 -1.155 -0.187 -1.477
227 HA CYS 28 HA CYS 28 0.219 1.387 0.603
228 1HB CYS 28 1HB CYS 28 1.853 0.331 -0.890
229 2HB CYS 28 2HB CYS 28 1.047 1.036 -2.287
230 H CYS 29 H CYS 29 -1.060 3.082 0.989
231 HA CYS 29 HA CYS 29 -2.471 4.344 -1.255
232 1HB CYS 29 1HB CYS 29 -2.864 4.729 1.720
233 2HB CYS 29 2HB CYS 29 -3.851 5.433 0.445
234 HA PRO 30 HA PRO 30 0.026 7.966 -1.459
235 1HB PRO 30 1HB PRO 30 -2.452 9.573 -1.136
236 2HB PRO 30 2HB PRO 30 -1.238 9.620 -2.418
237 1HG PRO 30 1HG PRO 30 -3.626 8.502 -2.826
238 2HG PRO 30 2HG PRO 30 -2.154 7.811 -3.534
239 1HD PRO 30 1HD PRO 30 -3.748 6.879 -1.190
240 2HD PRO 30 2HD PRO 30 -2.887 5.935 -2.420
241 H ARG 31 H ARG 31 -0.075 10.376 -0.381
242 HA ARG 31 HA ARG 31 0.674 9.987 2.303
243 1HB ARG 31 1HB ARG 31 -0.015 12.562 0.872
244 2HB ARG 31 2HB ARG 31 0.831 12.445 2.409
245 1HG ARG 31 1HG ARG 31 1.836 11.295 -0.185
246 2HG ARG 31 2HG ARG 31 2.322 12.855 0.482
247 1HD ARG 31 1HD ARG 31 2.680 10.187 1.846
248 2HD ARG 31 2HD ARG 31 3.941 11.059 0.976
249 HE ARG 31 HE ARG 31 3.033 12.841 2.835
250 1HH1 ARG 31 1HH1 ARG 31 4.324 9.605 2.946
251 2HH1 ARG 31 2HH1 ARG 31 5.038 9.805 4.511
252 1HH2 ARG 31 1HH2 ARG 31 3.971 13.114 4.896
253 2HH2 ARG 31 2HH2 ARG 31 4.839 11.800 5.619
254 H ARG 32 H ARG 32 -1.824 12.329 1.360
255 HA ARG 32 HA ARG 32 -3.678 11.149 3.283
256 1HB ARG 32 1HB ARG 32 -2.748 14.023 3.384
257 2HB ARG 32 2HB ARG 32 -4.122 13.393 4.282
258 1HG ARG 32 1HG ARG 32 -2.681 11.914 5.531
259 2HG ARG 32 2HG ARG 32 -1.288 12.418 4.571
260 1HD ARG 32 1HD ARG 32 -1.484 14.679 5.425
261 2HD ARG 32 2HD ARG 32 -2.933 14.236 6.326
262 HE ARG 32 HE ARG 32 -1.300 12.577 7.455
263 1HH1 ARG 32 1HH1 ARG 32 -0.522 15.803 6.383
264 2HH1 ARG 32 2HH1 ARG 32 0.712 16.038 7.576
265 1HH2 ARG 32 1HH2 ARG 32 0.322 12.881 9.025
266 2HH2 ARG 32 2HH2 ARG 32 1.192 14.378 9.077
Start of MODEL 3
1 1H GLY 1 1H GLY 1 -8.580 11.267 -6.175
2 2H GLY 1 2H GLY 1 -8.762 11.234 -4.494
3 3H GLY 1 3H GLY 1 -8.619 9.786 -5.357
4 1HA GLY 1 1HA GLY 1 -6.359 10.341 -5.991
5 2HA GLY 1 2HA GLY 1 -6.505 11.859 -5.117
6 H LEU 2 H LEU 2 -8.226 9.603 -3.435
7 HA LEU 2 HA LEU 2 -5.939 9.058 -1.664
8 1HB LEU 2 1HB LEU 2 -7.885 8.673 0.033
9 2HB LEU 2 2HB LEU 2 -7.349 10.298 -0.347
10 HG LEU 2 HG LEU 2 -9.241 10.454 -1.993
11 1HD1 LEU 2 1HD1 LEU 2 -9.626 8.078 -2.336
12 2HD1 LEU 2 2HD1 LEU 2 -11.090 8.870 -1.755
13 3HD1 LEU 2 3HD1 LEU 2 -10.115 7.899 -0.651
14 1HD2 LEU 2 1HD2 LEU 2 -10.934 10.861 -0.292
15 2HD2 LEU 2 2HD2 LEU 2 -9.359 11.449 0.240
16 3HD2 LEU 2 3HD2 LEU 2 -9.997 9.935 0.881
17 H LEU 3 H LEU 3 -6.747 7.467 -3.979
18 HA LEU 3 HA LEU 3 -7.867 5.043 -2.812
19 1HB LEU 3 1HB LEU 3 -6.972 5.606 -5.641
20 2HB LEU 3 2HB LEU 3 -7.827 4.174 -5.101
21 HG LEU 3 HG LEU 3 -8.935 6.982 -5.066
22 1HD1 LEU 3 1HD1 LEU 3 -9.555 4.644 -6.866
23 2HD1 LEU 3 2HD1 LEU 3 -8.688 6.110 -7.328
24 3HD1 LEU 3 3HD1 LEU 3 -10.388 6.199 -6.865
25 1HD2 LEU 3 1HD2 LEU 3 -9.848 5.625 -3.267
26 2HD2 LEU 3 2HD2 LEU 3 -10.225 4.336 -4.409
27 3HD2 LEU 3 3HD2 LEU 3 -11.061 5.884 -4.520
28 H CYS 4 H CYS 4 -6.740 3.224 -2.372
29 HA CYS 4 HA CYS 4 -3.876 3.420 -2.230
30 1HB CYS 4 1HB CYS 4 -5.323 0.854 -1.726
31 2HB CYS 4 2HB CYS 4 -3.949 1.551 -0.876
32 H TYR 5 H TYR 5 -2.600 1.357 -2.896
33 HA TYR 5 HA TYR 5 -3.509 0.313 -5.476
34 1HB TYR 5 1HB TYR 5 -0.800 1.593 -5.047
35 2HB TYR 5 2HB TYR 5 -1.332 0.783 -6.516
36 HD1 TYR 5 1HD TYR 5 -1.297 3.863 -4.665
37 HD2 TYR 5 2HD TYR 5 -3.252 1.787 -7.822
38 HE1 TYR 5 1HE TYR 5 -2.196 5.993 -5.502
39 HE2 TYR 5 2HE TYR 5 -4.156 3.912 -8.668
40 HH TYR 5 HH TYR 5 -4.661 6.159 -7.832
41 H CYS 6 H CYS 6 -2.825 -1.737 -5.928
42 HA CYS 6 HA CYS 6 -1.740 -3.255 -3.737
43 1HB CYS 6 1HB CYS 6 -2.423 -4.136 -6.551
44 2HB CYS 6 2HB CYS 6 -2.095 -5.199 -5.186
45 H ARG 7 H ARG 7 0.353 -3.603 -3.376
46 HA ARG 7 HA ARG 7 2.177 -3.818 -5.654
47 1HB ARG 7 1HB ARG 7 2.571 -1.935 -3.324
48 2HB ARG 7 2HB ARG 7 3.847 -2.380 -4.449
49 1HG ARG 7 1HG ARG 7 2.492 -1.447 -6.294
50 2HG ARG 7 2HG ARG 7 1.298 -0.919 -5.106
51 1HD ARG 7 1HD ARG 7 2.977 0.473 -4.020
52 2HD ARG 7 2HD ARG 7 4.195 -0.078 -5.169
53 HE ARG 7 HE ARG 7 2.093 1.857 -5.642
54 1HH1 ARG 7 1HH1 ARG 7 4.486 -0.256 -7.036
55 2HH1 ARG 7 2HH1 ARG 7 4.573 0.615 -8.529
56 1HH2 ARG 7 1HH2 ARG 7 2.202 3.010 -7.608
57 2HH2 ARG 7 2HH2 ARG 7 3.275 2.470 -8.855
58 H LYS 8 H LYS 8 4.482 -4.361 -4.720
59 HA LYS 8 HA LYS 8 4.307 -6.092 -2.379
60 1HB LYS 8 1HB LYS 8 3.759 -7.607 -4.174
61 2HB LYS 8 2HB LYS 8 5.122 -7.043 -5.129
62 1HG LYS 8 1HG LYS 8 5.517 -9.238 -4.100
63 2HG LYS 8 2HG LYS 8 6.678 -8.021 -3.569
64 1HD LYS 8 1HD LYS 8 5.369 -7.709 -1.504
65 2HD LYS 8 2HD LYS 8 4.255 -8.969 -2.037
66 1HE LYS 8 1HE LYS 8 6.029 -10.608 -1.992
67 2HE LYS 8 2HE LYS 8 7.211 -9.362 -1.593
68 1HZ LYS 8 1HZ LYS 8 6.105 -9.006 0.506
69 2HZ LYS 8 2HZ LYS 8 6.512 -10.641 0.353
70 3HZ LYS 8 3HZ LYS 8 4.914 -10.143 0.120
71 H GLY 9 H GLY 9 6.029 -5.822 -1.128
72 1HA GLY 9 1HA GLY 9 8.462 -5.890 -0.920
73 2HA GLY 9 2HA GLY 9 8.547 -4.927 -2.387
74 H HIS 10 H HIS 10 8.072 -2.706 -2.299
75 HA HIS 10 HA HIS 10 7.477 -1.500 0.260
76 1HB HIS 10 1HB HIS 10 9.500 0.005 0.112
77 2HB HIS 10 2HB HIS 10 9.835 -1.672 0.536
78 HD1 HIS 10 1HD HIS 10 10.166 -3.107 -1.971
79 HD2 HIS 10 2HD HIS 10 11.414 0.837 -1.594
80 HE1 HIS 10 1HE HIS 10 11.853 -2.764 -3.790
81 HE2 HIS 10 2HE HIS 10 12.534 -0.345 -3.606
82 H CYS 11 H CYS 11 5.892 -0.154 -0.255
83 HA CYS 11 HA CYS 11 5.595 0.958 -2.870
84 1HB CYS 11 1HB CYS 11 3.683 0.344 -1.386
85 2HB CYS 11 2HB CYS 11 4.113 1.690 -0.337
86 H LYS 12 H LYS 12 5.039 3.419 -2.979
87 HA LYS 12 HA LYS 12 7.449 4.819 -2.368
88 1HB LYS 12 1HB LYS 12 6.379 6.728 -3.463
89 2HB LYS 12 2HB LYS 12 6.208 5.269 -4.427
90 1HG LYS 12 1HG LYS 12 3.910 5.006 -3.550
91 2HG LYS 12 2HG LYS 12 4.098 6.538 -2.694
92 1HD LYS 12 1HD LYS 12 2.954 7.048 -4.698
93 2HD LYS 12 2HD LYS 12 4.619 7.578 -4.941
94 1HE LYS 12 1HE LYS 12 3.843 6.441 -6.920
95 2HE LYS 12 2HE LYS 12 5.080 5.463 -6.132
96 1HZ LYS 12 1HZ LYS 12 3.202 4.122 -6.857
97 2HZ LYS 12 2HZ LYS 12 2.148 5.039 -5.904
98 3HZ LYS 12 3HZ LYS 12 3.344 4.092 -5.172
99 H ARG 13 H ARG 13 4.170 4.828 -1.088
100 HA ARG 13 HA ARG 13 4.973 5.712 1.458
101 1HB ARG 13 1HB ARG 13 3.967 7.952 1.477
102 2HB ARG 13 2HB ARG 13 5.310 7.859 0.353
103 1HG ARG 13 1HG ARG 13 3.570 7.467 -1.455
104 2HG ARG 13 2HG ARG 13 2.377 7.970 -0.259
105 1HD ARG 13 1HD ARG 13 3.099 9.815 -1.720
106 2HD ARG 13 2HD ARG 13 3.462 10.113 -0.021
107 HE ARG 13 HE ARG 13 5.748 9.014 -0.980
108 1HH1 ARG 13 1HH1 ARG 13 3.765 11.696 -1.993
109 2HH1 ARG 13 2HH1 ARG 13 5.093 12.599 -2.640
110 1HH2 ARG 13 1HH2 ARG 13 7.501 10.198 -1.826
111 2HH2 ARG 13 2HH2 ARG 13 7.217 11.749 -2.543
112 H GLY 14 H GLY 14 3.557 4.756 2.749
113 1HA GLY 14 1HA GLY 14 1.240 4.784 3.567
114 2HA GLY 14 2HA GLY 14 0.732 4.662 1.891
115 H GLU 15 H GLU 15 3.445 2.800 2.979
116 HA GLU 15 HA GLU 15 2.322 0.355 2.165
117 1HB GLU 15 1HB GLU 15 4.690 0.984 3.929
118 2HB GLU 15 2HB GLU 15 4.262 -0.651 3.448
119 1HG GLU 15 1HG GLU 15 4.660 -0.187 1.172
120 2HG GLU 15 2HG GLU 15 4.804 1.544 1.473
121 H ARG 16 H ARG 16 0.543 -0.449 3.096
122 HA ARG 16 HA ARG 16 0.611 -0.950 5.980
123 1HB ARG 16 1HB ARG 16 -1.793 0.199 4.552
124 2HB ARG 16 2HB ARG 16 -1.704 -0.232 6.253
125 1HG ARG 16 1HG ARG 16 -0.043 1.504 6.625
126 2HG ARG 16 2HG ARG 16 -0.085 1.924 4.911
127 1HD ARG 16 1HD ARG 16 -1.445 3.482 6.148
128 2HD ARG 16 2HD ARG 16 -2.482 2.473 5.142
129 HE ARG 16 HE ARG 16 -2.329 1.270 7.644
130 1HH1 ARG 16 1HH1 ARG 16 -3.523 4.231 6.245
131 2HH1 ARG 16 2HH1 ARG 16 -4.782 4.428 7.418
132 1HH2 ARG 16 1HH2 ARG 16 -3.982 1.522 9.192
133 2HH2 ARG 16 2HH2 ARG 16 -5.040 2.890 9.095
134 H VAL 17 H VAL 17 -1.322 -2.407 6.589
135 HA VAL 17 HA VAL 17 -1.938 -4.301 4.434
136 HB VAL 17 HB VAL 17 -1.179 -5.278 7.180
137 1HG1 VAL 17 1HG1 VAL 17 -2.484 -6.802 5.816
138 2HG1 VAL 17 2HG1 VAL 17 -0.834 -7.400 5.987
139 3HG1 VAL 17 3HG1 VAL 17 -1.338 -6.625 4.486
140 1HG2 VAL 17 1HG2 VAL 17 1.036 -5.848 6.292
141 2HG2 VAL 17 2HG2 VAL 17 0.767 -4.106 6.304
142 3HG2 VAL 17 3HG2 VAL 17 0.647 -5.005 4.792
143 H ARG 18 H ARG 18 -3.693 -2.407 5.262
144 HA ARG 18 HA ARG 18 -5.418 -3.440 7.335
145 1HB ARG 18 1HB ARG 18 -5.130 -1.005 6.953
146 2HB ARG 18 2HB ARG 18 -5.883 -1.182 5.376
147 1HG ARG 18 1HG ARG 18 -7.966 -1.840 6.394
148 2HG ARG 18 2HG ARG 18 -7.224 -1.818 7.996
149 1HD ARG 18 1HD ARG 18 -8.526 0.205 7.614
150 2HD ARG 18 2HD ARG 18 -6.810 0.582 7.771
151 HE ARG 18 HE ARG 18 -7.402 0.248 5.055
152 1HH1 ARG 18 1HH1 ARG 18 -8.094 2.432 7.679
153 2HH1 ARG 18 2HH1 ARG 18 -8.304 3.809 6.650
154 1HH2 ARG 18 1HH2 ARG 18 -7.678 2.058 3.689
155 2HH2 ARG 18 2HH2 ARG 18 -8.067 3.596 4.383
156 H GLY 19 H GLY 19 -5.008 -3.843 3.983
157 1HA GLY 19 1HA GLY 19 -7.240 -5.679 3.867
158 2HA GLY 19 2HA GLY 19 -7.411 -4.262 2.839
159 H THR 20 H THR 20 -5.488 -7.132 3.474
160 HA THR 20 HA THR 20 -3.520 -6.982 1.584
161 HB THR 20 HB THR 20 -3.601 -8.862 3.077
162 HG1 THR 20 1HG THR 20 -3.263 -9.106 0.439
163 1HG2 THR 20 1HG2 THR 20 -6.020 -9.115 3.266
164 2HG2 THR 20 2HG2 THR 20 -5.271 -10.653 2.833
165 3HG2 THR 20 3HG2 THR 20 -6.103 -9.698 1.604
166 H CYS 21 H CYS 21 -3.310 -7.260 -0.575
167 HA CYS 21 HA CYS 21 -5.782 -7.241 -2.135
168 1HB CYS 21 1HB CYS 21 -4.039 -5.466 -2.459
169 2HB CYS 21 2HB CYS 21 -2.959 -6.712 -3.074
170 H GLY 22 H GLY 22 -3.333 -9.379 -1.209
171 1HA GLY 22 1HA GLY 22 -4.399 -11.463 -2.868
172 2HA GLY 22 2HA GLY 22 -2.794 -10.962 -3.379
173 H ILE 23 H ILE 23 -1.435 -12.512 -2.760
174 HA ILE 23 HA ILE 23 -1.808 -13.828 -0.180
175 HB ILE 23 HB ILE 23 0.195 -14.444 -2.357
176 1HG1 ILE 23 1HG1 ILE 23 -2.413 -15.831 -1.695
177 2HG1 ILE 23 2HG1 ILE 23 -2.173 -14.746 -3.059
178 1HG2 ILE 23 1HG2 ILE 23 -0.635 -16.019 0.079
179 2HG2 ILE 23 2HG2 ILE 23 0.914 -15.214 -0.165
180 3HG2 ILE 23 3HG2 ILE 23 0.463 -16.582 -1.181
181 1HD1 ILE 23 1HD1 ILE 23 -2.077 -17.053 -3.770
182 2HD1 ILE 23 2HD1 ILE 23 -0.783 -17.377 -2.616
183 3HD1 ILE 23 3HD1 ILE 23 -0.502 -16.286 -3.973
184 H ARG 24 H ARG 24 1.104 -12.758 -1.934
185 HA ARG 24 HA ARG 24 2.314 -12.028 0.625
186 1HB ARG 24 1HB ARG 24 4.425 -11.956 -0.603
187 2HB ARG 24 2HB ARG 24 3.601 -13.486 -0.870
188 1HG ARG 24 1HG ARG 24 2.722 -12.494 -3.019
189 2HG ARG 24 2HG ARG 24 3.857 -11.168 -2.761
190 1HD ARG 24 1HD ARG 24 4.506 -14.090 -3.103
191 2HD ARG 24 2HD ARG 24 4.875 -12.777 -4.221
192 HE ARG 24 HE ARG 24 6.054 -12.282 -1.699
193 1HH1 ARG 24 1HH1 ARG 24 6.398 -14.275 -4.539
194 2HH1 ARG 24 2HH1 ARG 24 8.106 -14.485 -4.341
195 1HH2 ARG 24 1HH2 ARG 24 8.302 -12.559 -1.431
196 2HH2 ARG 24 2HH2 ARG 24 9.186 -13.513 -2.574
197 H PHE 25 H PHE 25 0.697 -10.581 -1.944
198 HA PHE 25 HA PHE 25 2.093 -8.096 -2.044
199 1HB PHE 25 1HB PHE 25 -0.605 -9.018 -2.998
200 2HB PHE 25 2HB PHE 25 -0.135 -7.325 -3.105
201 HD1 PHE 25 1HD PHE 25 0.897 -10.742 -4.123
202 HD2 PHE 25 2HD PHE 25 1.150 -6.563 -4.885
203 HE1 PHE 25 1HE PHE 25 2.067 -11.202 -6.238
204 HE2 PHE 25 2HE PHE 25 2.320 -7.015 -7.000
205 HZ PHE 25 HZ PHE 25 2.780 -9.337 -7.680
206 H LEU 26 H LEU 26 1.159 -6.020 -1.394
207 HA LEU 26 HA LEU 26 -0.529 -6.206 1.003
208 1HB LEU 26 1HB LEU 26 0.822 -4.523 2.119
209 2HB LEU 26 2HB LEU 26 1.787 -5.931 1.728
210 HG LEU 26 HG LEU 26 1.800 -3.591 -0.127
211 1HD1 LEU 26 1HD1 LEU 26 3.437 -3.806 2.395
212 2HD1 LEU 26 2HD1 LEU 26 2.159 -2.631 2.089
213 3HD1 LEU 26 3HD1 LEU 26 3.637 -2.595 1.129
214 1HD2 LEU 26 1HD2 LEU 26 4.069 -4.365 -0.560
215 2HD2 LEU 26 2HD2 LEU 26 2.911 -5.676 -0.781
216 3HD2 LEU 26 3HD2 LEU 26 3.894 -5.607 0.680
217 H TYR 27 H TYR 27 -1.136 -3.828 1.680
218 HA TYR 27 HA TYR 27 -2.176 -2.558 -0.761
219 1HB TYR 27 1HB TYR 27 -3.521 -3.496 1.476
220 2HB TYR 27 2HB TYR 27 -3.453 -1.757 1.734
221 HD1 TYR 27 1HD TYR 27 -3.992 -3.973 -1.232
222 HD2 TYR 27 2HD TYR 27 -5.393 -0.698 1.095
223 HE1 TYR 27 1HE TYR 27 -5.875 -3.681 -2.786
224 HE2 TYR 27 2HE TYR 27 -7.280 -0.398 -0.453
225 HH TYR 27 HH TYR 27 -7.839 -0.925 -2.799
226 H CYS 28 H CYS 28 -1.569 -0.554 -1.248
227 HA CYS 28 HA CYS 28 -0.111 0.980 0.802
228 1HB CYS 28 1HB CYS 28 1.395 0.347 -0.958
229 2HB CYS 28 2HB CYS 28 0.266 0.890 -2.194
230 H CYS 29 H CYS 29 -1.677 2.289 1.614
231 HA CYS 29 HA CYS 29 -3.361 3.788 -0.248
232 1HB CYS 29 1HB CYS 29 -3.479 3.622 2.770
233 2HB CYS 29 2HB CYS 29 -4.635 4.456 1.738
234 HA PRO 30 HA PRO 30 -0.491 7.205 0.299
235 1HB PRO 30 1HB PRO 30 -1.719 8.950 -1.355
236 2HB PRO 30 2HB PRO 30 -0.760 7.593 -1.957
237 1HG PRO 30 1HG PRO 30 -3.732 7.830 -1.671
238 2HG PRO 30 2HG PRO 30 -2.789 7.173 -3.022
239 1HD PRO 30 1HD PRO 30 -3.973 5.599 -1.155
240 2HD PRO 30 2HD PRO 30 -2.464 5.149 -1.976
241 H ARG 31 H ARG 31 -0.436 8.822 1.743
242 HA ARG 31 HA ARG 31 -2.745 9.404 3.320
243 1HB ARG 31 1HB ARG 31 -0.499 9.330 4.303
244 2HB ARG 31 2HB ARG 31 -0.006 10.690 3.306
245 1HG ARG 31 1HG ARG 31 -0.449 11.485 5.511
246 2HG ARG 31 2HG ARG 31 -1.722 12.078 4.443
247 1HD ARG 31 1HD ARG 31 -3.202 10.293 5.213
248 2HD ARG 31 2HD ARG 31 -1.928 9.683 6.267
249 HE ARG 31 HE ARG 31 -2.506 12.418 6.799
250 1HH1 ARG 31 1HH1 ARG 31 -3.650 9.171 7.343
251 2HH1 ARG 31 2HH1 ARG 31 -4.480 9.572 8.809
252 1HH2 ARG 31 1HH2 ARG 31 -3.596 12.953 8.729
253 2HH2 ARG 31 2HH2 ARG 31 -4.452 11.721 9.594
254 H ARG 32 H ARG 32 -1.250 10.827 0.556
255 HA ARG 32 HA ARG 32 -2.358 13.444 0.866
256 1HB ARG 32 1HB ARG 32 -0.334 12.997 -0.487
257 2HB ARG 32 2HB ARG 32 -1.313 12.081 -1.624
258 1HG ARG 32 1HG ARG 32 -2.571 14.081 -2.187
259 2HG ARG 32 2HG ARG 32 -1.644 15.011 -1.007
260 1HD ARG 32 1HD ARG 32 0.412 14.513 -2.263
261 2HD ARG 32 2HD ARG 32 -0.543 13.635 -3.455
262 HE ARG 32 HE ARG 32 -1.697 16.072 -3.448
263 1HH1 ARG 32 1HH1 ARG 32 1.614 15.024 -3.724
264 2HH1 ARG 32 2HH1 ARG 32 2.090 16.359 -4.721
265 1HH2 ARG 32 1HH2 ARG 32 -1.079 17.835 -4.765
266 2HH2 ARG 32 2HH2 ARG 32 0.560 17.954 -5.313
Start of MODEL 4
1 1H GLY 1 1H GLY 1 -7.931 14.382 -3.994
2 2H GLY 1 2H GLY 1 -8.344 13.857 -2.442
3 3H GLY 1 3H GLY 1 -9.515 14.569 -3.432
4 1HA GLY 1 1HA GLY 1 -9.852 12.200 -3.392
5 2HA GLY 1 2HA GLY 1 -9.352 12.724 -4.993
6 H LEU 2 H LEU 2 -8.956 10.331 -2.871
7 HA LEU 2 HA LEU 2 -6.240 9.748 -3.836
8 1HB LEU 2 1HB LEU 2 -5.583 8.846 -1.738
9 2HB LEU 2 2HB LEU 2 -6.239 10.442 -1.434
10 HG LEU 2 HG LEU 2 -7.823 7.904 -1.038
11 1HD1 LEU 2 1HD1 LEU 2 -6.267 9.506 0.989
12 2HD1 LEU 2 2HD1 LEU 2 -5.895 7.871 0.443
13 3HD1 LEU 2 3HD1 LEU 2 -7.371 8.182 1.355
14 1HD2 LEU 2 1HD2 LEU 2 -8.246 10.754 -0.143
15 2HD2 LEU 2 2HD2 LEU 2 -9.229 9.379 0.361
16 3HD2 LEU 2 3HD2 LEU 2 -9.199 9.867 -1.333
17 H LEU 3 H LEU 3 -5.728 7.490 -4.007
18 HA LEU 3 HA LEU 3 -7.950 5.612 -3.846
19 1HB LEU 3 1HB LEU 3 -8.116 6.511 -6.104
20 2HB LEU 3 2HB LEU 3 -6.423 6.158 -6.393
21 HG LEU 3 HG LEU 3 -6.916 3.739 -6.170
22 1HD1 LEU 3 1HD1 LEU 3 -9.259 3.004 -6.234
23 2HD1 LEU 3 2HD1 LEU 3 -9.777 4.676 -6.014
24 3HD1 LEU 3 3HD1 LEU 3 -8.868 3.859 -4.742
25 1HD2 LEU 3 1HD2 LEU 3 -8.071 3.510 -8.314
26 2HD2 LEU 3 2HD2 LEU 3 -6.856 4.786 -8.368
27 3HD2 LEU 3 3HD2 LEU 3 -8.564 5.201 -8.229
28 H CYS 4 H CYS 4 -7.122 4.076 -2.595
29 HA CYS 4 HA CYS 4 -4.393 3.543 -2.244
30 1HB CYS 4 1HB CYS 4 -6.659 1.605 -1.752
31 2HB CYS 4 2HB CYS 4 -5.084 1.625 -0.964
32 H TYR 5 H TYR 5 -3.010 2.034 -3.103
33 HA TYR 5 HA TYR 5 -4.022 0.472 -5.389
34 1HB TYR 5 1HB TYR 5 -1.340 1.852 -5.143
35 2HB TYR 5 2HB TYR 5 -1.822 0.802 -6.472
36 HD1 TYR 5 1HD TYR 5 -1.544 4.126 -5.454
37 HD2 TYR 5 2HD TYR 5 -4.119 1.529 -7.628
38 HE1 TYR 5 1HE TYR 5 -2.486 6.063 -6.639
39 HE2 TYR 5 2HE TYR 5 -5.068 3.459 -8.820
40 HH TYR 5 HH TYR 5 -5.318 5.871 -8.515
41 H CYS 6 H CYS 6 -2.796 -1.451 -5.901
42 HA CYS 6 HA CYS 6 -1.914 -2.835 -3.491
43 1HB CYS 6 1HB CYS 6 -3.394 -4.168 -4.717
44 2HB CYS 6 2HB CYS 6 -2.709 -3.681 -6.263
45 H ARG 7 H ARG 7 0.142 -3.417 -3.070
46 HA ARG 7 HA ARG 7 2.146 -3.047 -5.192
47 1HB ARG 7 1HB ARG 7 2.292 -2.052 -2.348
48 2HB ARG 7 2HB ARG 7 3.694 -2.162 -3.402
49 1HG ARG 7 1HG ARG 7 1.230 -0.524 -3.962
50 2HG ARG 7 2HG ARG 7 2.745 0.100 -3.305
51 1HD ARG 7 1HD ARG 7 3.922 -0.561 -5.320
52 2HD ARG 7 2HD ARG 7 2.451 -1.284 -5.968
53 HE ARG 7 HE ARG 7 2.513 1.586 -5.362
54 1HH1 ARG 7 1HH1 ARG 7 2.255 -1.022 -7.656
55 2HH1 ARG 7 2HH1 ARG 7 1.735 -0.001 -8.956
56 1HH2 ARG 7 1HH2 ARG 7 1.826 2.941 -7.066
57 2HH2 ARG 7 2HH2 ARG 7 1.490 2.251 -8.620
58 H LYS 8 H LYS 8 4.042 -4.312 -5.002
59 HA LYS 8 HA LYS 8 3.665 -6.709 -3.336
60 1HB LYS 8 1HB LYS 8 3.637 -7.089 -5.778
61 2HB LYS 8 2HB LYS 8 5.251 -6.401 -5.892
62 1HG LYS 8 1HG LYS 8 6.116 -8.205 -4.481
63 2HG LYS 8 2HG LYS 8 4.496 -8.898 -4.386
64 1HD LYS 8 1HD LYS 8 4.486 -9.201 -6.816
65 2HD LYS 8 2HD LYS 8 6.107 -8.508 -6.909
66 1HE LYS 8 1HE LYS 8 6.212 -10.934 -6.984
67 2HE LYS 8 2HE LYS 8 6.956 -10.329 -5.505
68 1HZ LYS 8 1HZ LYS 8 4.938 -10.873 -4.303
69 2HZ LYS 8 2HZ LYS 8 5.544 -12.247 -5.082
70 3HZ LYS 8 3HZ LYS 8 4.207 -11.433 -5.722
71 H GLY 9 H GLY 9 4.897 -6.696 -1.577
72 1HA GLY 9 1HA GLY 9 6.986 -6.911 -0.504
73 2HA GLY 9 2HA GLY 9 7.742 -6.096 -1.864
74 H HIS 10 H HIS 10 7.372 -3.761 -2.069
75 HA HIS 10 HA HIS 10 6.606 -2.429 0.413
76 1HB HIS 10 1HB HIS 10 8.697 -0.954 0.113
77 2HB HIS 10 2HB HIS 10 8.906 -2.556 0.814
78 HD1 HIS 10 1HD HIS 10 9.453 -4.439 -1.210
79 HD2 HIS 10 2HD HIS 10 10.532 -0.472 -1.807
80 HE1 HIS 10 1HE HIS 10 11.197 -4.484 -3.007
81 HE2 HIS 10 2HE HIS 10 11.784 -2.067 -3.414
82 H CYS 11 H CYS 11 5.879 -0.330 0.178
83 HA CYS 11 HA CYS 11 5.304 0.472 -2.586
84 1HB CYS 11 1HB CYS 11 3.382 0.159 -1.039
85 2HB CYS 11 2HB CYS 11 4.029 1.435 -0.016
86 H LYS 12 H LYS 12 5.207 2.864 -2.959
87 HA LYS 12 HA LYS 12 7.722 4.031 -2.196
88 1HB LYS 12 1HB LYS 12 6.993 5.904 -3.676
89 2HB LYS 12 2HB LYS 12 6.987 4.332 -4.465
90 1HG LYS 12 1HG LYS 12 4.610 4.177 -4.291
91 2HG LYS 12 2HG LYS 12 4.540 5.629 -3.292
92 1HD LYS 12 1HD LYS 12 5.394 6.952 -5.173
93 2HD LYS 12 2HD LYS 12 5.437 5.496 -6.170
94 1HE LYS 12 1HE LYS 12 3.031 5.255 -5.964
95 2HE LYS 12 2HE LYS 12 2.962 6.652 -4.892
96 1HZ LYS 12 1HZ LYS 12 3.755 8.037 -6.706
97 2HZ LYS 12 2HZ LYS 12 2.332 7.236 -7.148
98 3HZ LYS 12 3HZ LYS 12 3.823 6.695 -7.735
99 H ARG 13 H ARG 13 4.404 4.340 -1.246
100 HA ARG 13 HA ARG 13 5.047 5.788 1.084
101 1HB ARG 13 1HB ARG 13 3.926 7.918 0.552
102 2HB ARG 13 2HB ARG 13 5.362 7.662 -0.422
103 1HG ARG 13 1HG ARG 13 3.860 6.837 -2.250
104 2HG ARG 13 2HG ARG 13 2.494 7.375 -1.274
105 1HD ARG 13 1HD ARG 13 4.759 9.175 -2.106
106 2HD ARG 13 2HD ARG 13 3.270 8.994 -3.032
107 HE ARG 13 HE ARG 13 2.960 9.743 -0.244
108 1HH1 ARG 13 1HH1 ARG 13 3.154 10.780 -3.565
109 2HH1 ARG 13 2HH1 ARG 13 2.372 12.297 -3.272
110 1HH2 ARG 13 1HH2 ARG 13 1.929 11.740 0.152
111 2HH2 ARG 13 2HH2 ARG 13 1.679 12.845 -1.159
112 H GLY 14 H GLY 14 3.644 4.917 2.454
113 1HA GLY 14 1HA GLY 14 1.357 4.932 3.272
114 2HA GLY 14 2HA GLY 14 0.824 4.714 1.613
115 H GLU 15 H GLU 15 3.507 2.930 2.978
116 HA GLU 15 HA GLU 15 2.457 0.428 2.227
117 1HB GLU 15 1HB GLU 15 4.657 1.149 4.171
118 2HB GLU 15 2HB GLU 15 4.296 -0.496 3.668
119 1HG GLU 15 1HG GLU 15 4.936 -0.074 1.454
120 2HG GLU 15 2HG GLU 15 4.969 1.670 1.707
121 H ARG 16 H ARG 16 0.611 -0.351 3.081
122 HA ARG 16 HA ARG 16 0.502 -0.662 5.988
123 1HB ARG 16 1HB ARG 16 -1.734 0.515 4.330
124 2HB ARG 16 2HB ARG 16 -1.886 0.022 6.011
125 1HG ARG 16 1HG ARG 16 -0.164 1.678 6.621
126 2HG ARG 16 2HG ARG 16 -0.107 2.203 4.938
127 1HD ARG 16 1HD ARG 16 -1.522 3.704 6.172
128 2HD ARG 16 2HD ARG 16 -2.523 2.749 5.078
129 HE ARG 16 HE ARG 16 -2.497 1.420 7.511
130 1HH1 ARG 16 1HH1 ARG 16 -3.559 4.498 6.265
131 2HH1 ARG 16 2HH1 ARG 16 -4.843 4.665 7.416
132 1HH2 ARG 16 1HH2 ARG 16 -4.184 1.634 9.029
133 2HH2 ARG 16 2HH2 ARG 16 -5.196 3.038 8.988
134 H VAL 17 H VAL 17 -1.482 -2.039 6.583
135 HA VAL 17 HA VAL 17 -1.980 -4.094 4.543
136 HB VAL 17 HB VAL 17 -1.465 -4.821 7.421
137 1HG1 VAL 17 1HG1 VAL 17 -1.452 -6.428 4.869
138 2HG1 VAL 17 2HG1 VAL 17 -2.720 -6.430 6.096
139 3HG1 VAL 17 3HG1 VAL 17 -1.118 -7.057 6.482
140 1HG2 VAL 17 1HG2 VAL 17 0.534 -4.823 5.161
141 2HG2 VAL 17 2HG2 VAL 17 0.791 -5.523 6.760
142 3HG2 VAL 17 3HG2 VAL 17 0.570 -3.782 6.584
143 H ARG 18 H ARG 18 -3.812 -2.222 4.897
144 HA ARG 18 HA ARG 18 -5.657 -2.649 7.014
145 1HB ARG 18 1HB ARG 18 -7.214 -1.312 5.626
146 2HB ARG 18 2HB ARG 18 -5.641 -0.545 5.798
147 1HG ARG 18 1HG ARG 18 -5.038 -1.508 3.561
148 2HG ARG 18 2HG ARG 18 -6.727 -1.995 3.400
149 1HD ARG 18 1HD ARG 18 -5.702 0.818 3.769
150 2HD ARG 18 2HD ARG 18 -6.333 0.125 2.275
151 HE ARG 18 HE ARG 18 -8.422 -0.201 3.862
152 1HH1 ARG 18 1HH1 ARG 18 -6.306 2.546 3.520
153 2HH1 ARG 18 2HH1 ARG 18 -7.532 3.703 3.919
154 1HH2 ARG 18 1HH2 ARG 18 -10.044 1.315 4.388
155 2HH2 ARG 18 2HH2 ARG 18 -9.658 3.004 4.411
156 H GLY 19 H GLY 19 -5.009 -4.165 4.027
157 1HA GLY 19 1HA GLY 19 -7.038 -6.184 4.569
158 2HA GLY 19 2HA GLY 19 -7.140 -5.352 3.021
159 H THR 20 H THR 20 -6.076 -6.231 1.380
160 HA THR 20 HA THR 20 -3.470 -7.205 1.465
161 HB THR 20 HB THR 20 -4.187 -9.070 2.759
162 HG1 THR 20 1HG THR 20 -3.850 -10.803 1.189
163 1HG2 THR 20 1HG2 THR 20 -6.007 -10.570 2.042
164 2HG2 THR 20 2HG2 THR 20 -6.361 -9.478 0.702
165 3HG2 THR 20 3HG2 THR 20 -6.586 -8.935 2.364
166 H CYS 21 H CYS 21 -2.864 -8.379 -0.551
167 HA CYS 21 HA CYS 21 -4.750 -7.881 -2.749
168 1HB CYS 21 1HB CYS 21 -3.164 -6.025 -2.690
169 2HB CYS 21 2HB CYS 21 -1.815 -7.153 -2.707
170 H GLY 22 H GLY 22 -2.621 -9.965 -1.180
171 1HA GLY 22 1HA GLY 22 -3.177 -12.181 -2.753
172 2HA GLY 22 2HA GLY 22 -1.678 -11.505 -3.372
173 H ILE 23 H ILE 23 -0.418 -13.249 -2.763
174 HA ILE 23 HA ILE 23 -0.431 -14.432 -0.201
175 HB ILE 23 HB ILE 23 1.910 -14.335 -2.103
176 1HG1 ILE 23 1HG1 ILE 23 -0.121 -15.066 -3.285
177 2HG1 ILE 23 2HG1 ILE 23 1.022 -16.391 -3.096
178 1HG2 ILE 23 1HG2 ILE 23 1.117 -16.318 0.025
179 2HG2 ILE 23 2HG2 ILE 23 2.466 -15.184 0.094
180 3HG2 ILE 23 3HG2 ILE 23 2.479 -16.499 -1.082
181 1HD1 ILE 23 1HD1 ILE 23 -1.397 -15.936 -1.365
182 2HD1 ILE 23 2HD1 ILE 23 -0.287 -17.304 -1.285
183 3HD1 ILE 23 3HD1 ILE 23 -1.299 -17.073 -2.710
184 H ARG 24 H ARG 24 2.363 -12.690 -1.529
185 HA ARG 24 HA ARG 24 2.945 -11.682 1.153
186 1HB ARG 24 1HB ARG 24 5.158 -11.100 0.205
187 2HB ARG 24 2HB ARG 24 4.774 -12.808 0.033
188 1HG ARG 24 1HG ARG 24 4.062 -12.339 -2.308
189 2HG ARG 24 2HG ARG 24 4.657 -10.691 -2.101
190 1HD ARG 24 1HD ARG 24 6.290 -13.213 -1.839
191 2HD ARG 24 2HD ARG 24 6.311 -12.108 -3.212
192 HE ARG 24 HE ARG 24 6.943 -10.867 -0.690
193 1HH1 ARG 24 1HH1 ARG 24 8.197 -12.565 -3.463
194 2HH1 ARG 24 2HH1 ARG 24 9.809 -11.964 -3.264
195 1HH2 ARG 24 1HH2 ARG 24 9.066 -10.072 -0.418
196 2HH2 ARG 24 2HH2 ARG 24 10.303 -10.549 -1.533
197 H PHE 25 H PHE 25 1.291 -10.683 -1.498
198 HA PHE 25 HA PHE 25 2.166 -8.017 -1.843
199 1HB PHE 25 1HB PHE 25 -0.530 -9.282 -2.376
200 2HB PHE 25 2HB PHE 25 -0.061 -7.672 -2.910
201 HD1 PHE 25 1HD PHE 25 1.137 -7.363 -4.893
202 HD2 PHE 25 2HD PHE 25 0.765 -11.266 -3.239
203 HE1 PHE 25 1HE PHE 25 2.090 -8.321 -6.948
204 HE2 PHE 25 2HE PHE 25 1.719 -12.232 -5.291
205 HZ PHE 25 HZ PHE 25 2.384 -10.756 -7.149
206 H LEU 26 H LEU 26 1.119 -6.068 -1.175
207 HA LEU 26 HA LEU 26 -0.541 -6.291 1.233
208 1HB LEU 26 1HB LEU 26 0.734 -4.380 2.216
209 2HB LEU 26 2HB LEU 26 1.623 -5.886 2.129
210 HG LEU 26 HG LEU 26 1.939 -3.808 -0.007
211 1HD1 LEU 26 1HD1 LEU 26 3.835 -2.890 1.245
212 2HD1 LEU 26 2HD1 LEU 26 3.412 -3.910 2.620
213 3HD1 LEU 26 3HD1 LEU 26 2.308 -2.641 2.092
214 1HD2 LEU 26 1HD2 LEU 26 2.885 -5.989 -0.458
215 2HD2 LEU 26 2HD2 LEU 26 3.721 -5.979 1.095
216 3HD2 LEU 26 3HD2 LEU 26 4.182 -4.832 -0.163
217 H TYR 27 H TYR 27 -1.214 -3.885 1.866
218 HA TYR 27 HA TYR 27 -2.245 -2.734 -0.638
219 1HB TYR 27 1HB TYR 27 -3.686 -3.738 1.471
220 2HB TYR 27 2HB TYR 27 -3.684 -2.008 1.805
221 HD1 TYR 27 1HD TYR 27 -4.299 -4.430 -0.951
222 HD2 TYR 27 2HD TYR 27 -5.246 -0.649 0.749
223 HE1 TYR 27 1HE TYR 27 -6.061 -4.116 -2.643
224 HE2 TYR 27 2HE TYR 27 -7.009 -0.323 -0.932
225 HH TYR 27 HH TYR 27 -8.151 -2.822 -2.909
226 H CYS 28 H CYS 28 -1.511 -0.841 -1.185
227 HA CYS 28 HA CYS 28 -0.375 0.915 0.882
228 1HB CYS 28 1HB CYS 28 1.216 0.202 -0.854
229 2HB CYS 28 2HB CYS 28 0.154 0.851 -2.098
230 H CYS 29 H CYS 29 -0.746 3.211 0.680
231 HA CYS 29 HA CYS 29 -2.748 4.179 -1.130
232 1HB CYS 29 1HB CYS 29 -3.927 2.932 0.849
233 2HB CYS 29 2HB CYS 29 -3.532 4.389 1.753
234 HA PRO 30 HA PRO 30 -0.219 7.776 -0.424
235 1HB PRO 30 1HB PRO 30 -2.617 9.238 -1.392
236 2HB PRO 30 2HB PRO 30 -0.952 9.292 -1.979
237 1HG PRO 30 1HG PRO 30 -2.845 8.017 -3.357
238 2HG PRO 30 2HG PRO 30 -1.197 7.369 -3.250
239 1HD PRO 30 1HD PRO 30 -3.672 6.507 -1.812
240 2HD PRO 30 2HD PRO 30 -2.349 5.524 -2.472
241 H ARG 31 H ARG 31 0.091 8.662 1.504
242 HA ARG 31 HA ARG 31 -2.109 9.040 3.341
243 1HB ARG 31 1HB ARG 31 0.864 9.498 3.617
244 2HB ARG 31 2HB ARG 31 -0.294 9.755 4.916
245 1HG ARG 31 1HG ARG 31 -0.900 7.409 4.879
246 2HG ARG 31 2HG ARG 31 0.190 7.131 3.518
247 1HD ARG 31 1HD ARG 31 1.186 6.439 5.653
248 2HD ARG 31 2HD ARG 31 2.098 7.738 4.886
249 HE ARG 31 HE ARG 31 0.186 8.743 6.743
250 1HH1 ARG 31 1HH1 ARG 31 3.331 7.261 6.501
251 2HH1 ARG 31 2HH1 ARG 31 3.907 7.941 7.986
252 1HH2 ARG 31 1HH2 ARG 31 0.938 9.644 8.697
253 2HH2 ARG 31 2HH2 ARG 31 2.546 9.297 9.233
254 H ARG 32 H ARG 32 -2.097 10.707 0.983
255 HA ARG 32 HA ARG 32 -2.562 13.231 2.238
256 1HB ARG 32 1HB ARG 32 -0.125 13.372 1.977
257 2HB ARG 32 2HB ARG 32 -0.282 13.034 0.258
258 1HG ARG 32 1HG ARG 32 0.069 15.387 0.583
259 2HG ARG 32 2HG ARG 32 -1.574 15.121 -0.001
260 1HD ARG 32 1HD ARG 32 -1.641 16.755 1.755
261 2HD ARG 32 2HD ARG 32 -2.371 15.263 2.348
262 HE ARG 32 HE ARG 32 0.414 15.459 2.978
263 1HH1 ARG 32 1HH1 ARG 32 -2.789 16.418 3.968
264 2HH1 ARG 32 2HH1 ARG 32 -2.343 16.655 5.625
265 1HH2 ARG 32 1HH2 ARG 32 1.007 15.773 5.156
266 2HH2 ARG 32 2HH2 ARG 32 -0.186 16.293 6.299
Start of MODEL 5
1 1H GLY 1 1H GLY 1 -11.206 10.387 -5.483
2 2H GLY 1 2H GLY 1 -10.785 10.810 -7.066
3 3H GLY 1 3H GLY 1 -11.562 11.934 -6.068
4 1HA GLY 1 1HA GLY 1 -9.204 12.437 -6.259
5 2HA GLY 1 2HA GLY 1 -9.661 12.042 -4.610
6 H LEU 2 H LEU 2 -7.757 11.258 -3.863
7 HA LEU 2 HA LEU 2 -6.445 9.111 -5.368
8 1HB LEU 2 1HB LEU 2 -5.520 10.783 -3.032
9 2HB LEU 2 2HB LEU 2 -4.605 9.439 -3.686
10 HG LEU 2 HG LEU 2 -4.654 10.694 -5.916
11 1HD1 LEU 2 1HD1 LEU 2 -6.404 12.284 -5.413
12 2HD1 LEU 2 2HD1 LEU 2 -4.892 13.138 -5.721
13 3HD1 LEU 2 3HD1 LEU 2 -5.466 12.932 -4.066
14 1HD2 LEU 2 1HD2 LEU 2 -2.740 12.080 -5.274
15 2HD2 LEU 2 2HD2 LEU 2 -2.655 10.477 -4.543
16 3HD2 LEU 2 3HD2 LEU 2 -3.156 11.863 -3.574
17 H LEU 3 H LEU 3 -7.037 7.109 -4.874
18 HA LEU 3 HA LEU 3 -7.862 6.523 -2.112
19 1HB LEU 3 1HB LEU 3 -8.497 5.070 -4.681
20 2HB LEU 3 2HB LEU 3 -8.981 4.526 -3.086
21 HG LEU 3 HG LEU 3 -9.858 7.116 -4.370
22 1HD1 LEU 3 1HD1 LEU 3 -11.346 4.526 -3.967
23 2HD1 LEU 3 2HD1 LEU 3 -10.806 5.188 -5.510
24 3HD1 LEU 3 3HD1 LEU 3 -12.040 6.030 -4.574
25 1HD2 LEU 3 1HD2 LEU 3 -10.726 5.771 -1.814
26 2HD2 LEU 3 2HD2 LEU 3 -11.446 7.223 -2.510
27 3HD2 LEU 3 3HD2 LEU 3 -9.778 7.253 -1.940
28 H CYS 4 H CYS 4 -7.449 4.132 -1.526
29 HA CYS 4 HA CYS 4 -4.661 3.735 -1.442
30 1HB CYS 4 1HB CYS 4 -6.839 1.715 -0.873
31 2HB CYS 4 2HB CYS 4 -5.172 1.640 -0.313
32 H TYR 5 H TYR 5 -3.458 1.872 -2.239
33 HA TYR 5 HA TYR 5 -4.548 0.718 -4.711
34 1HB TYR 5 1HB TYR 5 -1.758 1.849 -4.413
35 2HB TYR 5 2HB TYR 5 -2.404 1.054 -5.844
36 HD1 TYR 5 1HD TYR 5 -4.664 2.152 -6.750
37 HD2 TYR 5 2HD TYR 5 -1.752 4.153 -4.379
38 HE1 TYR 5 1HE TYR 5 -5.477 4.316 -7.588
39 HE2 TYR 5 2HE TYR 5 -2.558 6.323 -5.209
40 HH TYR 5 HH TYR 5 -5.479 6.666 -6.920
41 H CYS 6 H CYS 6 -2.738 -0.941 -5.543
42 HA CYS 6 HA CYS 6 -1.981 -2.618 -3.237
43 1HB CYS 6 1HB CYS 6 -3.682 -3.909 -4.064
44 2HB CYS 6 2HB CYS 6 -3.522 -3.270 -5.695
45 H ARG 7 H ARG 7 0.076 -3.261 -3.178
46 HA ARG 7 HA ARG 7 1.639 -3.298 -5.660
47 1HB ARG 7 1HB ARG 7 2.406 -1.879 -3.109
48 2HB ARG 7 2HB ARG 7 3.556 -2.265 -4.381
49 1HG ARG 7 1HG ARG 7 2.157 -0.937 -5.957
50 2HG ARG 7 2HG ARG 7 1.169 -0.446 -4.580
51 1HD ARG 7 1HD ARG 7 3.066 0.610 -3.536
52 2HD ARG 7 2HD ARG 7 4.142 0.008 -4.797
53 HE ARG 7 HE ARG 7 1.967 1.701 -5.697
54 1HH1 ARG 7 1HH1 ARG 7 5.306 1.495 -4.719
55 2HH1 ARG 7 2HH1 ARG 7 5.760 2.970 -5.504
56 1HH2 ARG 7 1HH2 ARG 7 2.558 3.645 -6.732
57 2HH2 ARG 7 2HH2 ARG 7 4.198 4.194 -6.646
58 H LYS 8 H LYS 8 4.042 -4.091 -4.838
59 HA LYS 8 HA LYS 8 3.589 -6.431 -3.115
60 1HB LYS 8 1HB LYS 8 3.545 -6.966 -5.605
61 2HB LYS 8 2HB LYS 8 5.250 -6.544 -5.628
62 1HG LYS 8 1HG LYS 8 5.642 -8.287 -3.898
63 2HG LYS 8 2HG LYS 8 3.953 -8.766 -4.069
64 1HD LYS 8 1HD LYS 8 4.916 -10.233 -5.533
65 2HD LYS 8 2HD LYS 8 4.619 -8.881 -6.627
66 1HE LYS 8 1HE LYS 8 7.211 -9.511 -5.220
67 2HE LYS 8 2HE LYS 8 6.868 -9.750 -6.933
68 1HZ LYS 8 1HZ LYS 8 8.120 -7.726 -6.573
69 2HZ LYS 8 2HZ LYS 8 6.935 -7.137 -5.521
70 3HZ LYS 8 3HZ LYS 8 6.578 -7.355 -7.161
71 H GLY 9 H GLY 9 4.969 -6.473 -1.482
72 1HA GLY 9 1HA GLY 9 6.949 -6.352 -0.310
73 2HA GLY 9 2HA GLY 9 7.774 -6.041 -1.828
74 H HIS 10 H HIS 10 8.023 -3.904 -2.550
75 HA HIS 10 HA HIS 10 7.971 -1.960 -0.372
76 1HB HIS 10 1HB HIS 10 10.026 -2.480 -1.851
77 2HB HIS 10 2HB HIS 10 9.212 -1.510 -3.075
78 HD1 HIS 10 1HD HIS 10 10.448 -1.171 0.496
79 HD2 HIS 10 2HD HIS 10 9.673 1.162 -2.853
80 HE1 HIS 10 1HE HIS 10 11.247 1.140 1.088
81 HE2 HIS 10 2HE HIS 10 10.697 2.551 -0.926
82 H CYS 11 H CYS 11 7.271 0.231 -0.750
83 HA CYS 11 HA CYS 11 5.330 0.552 -2.930
84 1HB CYS 11 1HB CYS 11 4.858 0.935 0.013
85 2HB CYS 11 2HB CYS 11 3.907 1.818 -1.174
86 H LYS 12 H LYS 12 4.432 3.027 -2.553
87 HA LYS 12 HA LYS 12 6.817 4.633 -2.961
88 1HB LYS 12 1HB LYS 12 5.179 6.396 -3.653
89 2HB LYS 12 2HB LYS 12 5.100 4.918 -4.602
90 1HG LYS 12 1HG LYS 12 3.142 4.200 -3.350
91 2HG LYS 12 2HG LYS 12 3.232 5.658 -2.357
92 1HD LYS 12 1HD LYS 12 2.865 7.039 -4.329
93 2HD LYS 12 2HD LYS 12 2.826 5.598 -5.346
94 1HE LYS 12 1HE LYS 12 0.846 4.806 -4.189
95 2HE LYS 12 2HE LYS 12 0.904 6.190 -3.099
96 1HZ LYS 12 1HZ LYS 12 0.547 7.647 -4.999
97 2HZ LYS 12 2HZ LYS 12 -0.713 6.526 -4.853
98 3HZ LYS 12 3HZ LYS 12 0.477 6.311 -6.035
99 H ARG 13 H ARG 13 3.951 4.643 -0.862
100 HA ARG 13 HA ARG 13 5.371 5.638 1.361
101 1HB ARG 13 1HB ARG 13 4.426 7.881 1.524
102 2HB ARG 13 2HB ARG 13 5.374 7.717 0.055
103 1HG ARG 13 1HG ARG 13 3.069 7.147 -1.027
104 2HG ARG 13 2HG ARG 13 2.428 7.985 0.387
105 1HD ARG 13 1HD ARG 13 4.364 9.087 -1.643
106 2HD ARG 13 2HD ARG 13 2.671 9.539 -1.448
107 HE ARG 13 HE ARG 13 3.948 9.998 0.983
108 1HH1 ARG 13 1HH1 ARG 13 4.047 11.188 -2.291
109 2HH1 ARG 13 2HH1 ARG 13 4.568 12.775 -1.835
110 1HH2 ARG 13 1HH2 ARG 13 4.631 12.089 1.592
111 2HH2 ARG 13 2HH2 ARG 13 4.899 13.287 0.371
112 H GLY 14 H GLY 14 4.274 5.150 3.169
113 1HA GLY 14 1HA GLY 14 2.490 4.732 4.580
114 2HA GLY 14 2HA GLY 14 1.403 5.256 3.304
115 H GLU 15 H GLU 15 3.360 2.537 4.439
116 HA GLU 15 HA GLU 15 1.823 0.710 2.750
117 1HB GLU 15 1HB GLU 15 4.134 0.060 4.581
118 2HB GLU 15 2HB GLU 15 3.460 -0.964 3.321
119 1HG GLU 15 1HG GLU 15 4.144 0.852 1.693
120 2HG GLU 15 2HG GLU 15 5.066 1.543 3.025
121 H ARG 16 H ARG 16 0.355 -0.714 3.523
122 HA ARG 16 HA ARG 16 0.111 -1.107 6.407
123 1HB ARG 16 1HB ARG 16 -2.109 -0.064 4.644
124 2HB ARG 16 2HB ARG 16 -2.357 -0.691 6.267
125 1HG ARG 16 1HG ARG 16 -0.423 1.538 5.802
126 2HG ARG 16 2HG ARG 16 -2.155 1.862 5.887
127 1HD ARG 16 1HD ARG 16 -1.218 2.179 8.069
128 2HD ARG 16 2HD ARG 16 -2.202 0.717 8.093
129 HE ARG 16 HE ARG 16 0.378 -0.100 7.545
130 1HH1 ARG 16 1HH1 ARG 16 -1.266 1.577 10.121
131 2HH1 ARG 16 2HH1 ARG 16 -0.198 0.997 11.354
132 1HH2 ARG 16 1HH2 ARG 16 1.788 -0.869 9.164
133 2HH2 ARG 16 2HH2 ARG 16 1.539 -0.394 10.809
134 H VAL 17 H VAL 17 -1.551 -2.792 6.927
135 HA VAL 17 HA VAL 17 -1.845 -4.762 4.762
136 HB VAL 17 HB VAL 17 -1.192 -5.571 7.592
137 1HG1 VAL 17 1HG1 VAL 17 -2.268 -7.261 6.214
138 2HG1 VAL 17 2HG1 VAL 17 -0.589 -7.698 6.530
139 3HG1 VAL 17 3HG1 VAL 17 -1.049 -7.038 4.960
140 1HG2 VAL 17 1HG2 VAL 17 1.116 -5.947 6.869
141 2HG2 VAL 17 2HG2 VAL 17 0.678 -4.242 6.759
142 3HG2 VAL 17 3HG2 VAL 17 0.743 -5.232 5.301
143 H ARG 18 H ARG 18 -3.875 -3.079 5.357
144 HA ARG 18 HA ARG 18 -5.643 -4.359 7.280
145 1HB ARG 18 1HB ARG 18 -5.501 -1.867 7.068
146 2HB ARG 18 2HB ARG 18 -6.207 -2.009 5.465
147 1HG ARG 18 1HG ARG 18 -8.228 -2.971 6.423
148 2HG ARG 18 2HG ARG 18 -7.519 -2.871 8.035
149 1HD ARG 18 1HD ARG 18 -8.042 -0.520 6.219
150 2HD ARG 18 2HD ARG 18 -9.082 -1.021 7.552
151 HE ARG 18 HE ARG 18 -6.332 -0.486 8.270
152 1HH1 ARG 18 1HH1 ARG 18 -9.558 0.790 7.947
153 2HH1 ARG 18 2HH1 ARG 18 -9.293 2.093 9.056
154 1HH2 ARG 18 1HH2 ARG 18 -5.973 1.227 9.732
155 2HH2 ARG 18 2HH2 ARG 18 -7.254 2.342 10.071
156 H GLY 19 H GLY 19 -5.123 -4.137 3.859
157 1HA GLY 19 1HA GLY 19 -7.196 -6.173 3.446
158 2HA GLY 19 2HA GLY 19 -7.239 -4.717 2.460
159 H THR 20 H THR 20 -5.218 -7.479 3.344
160 HA THR 20 HA THR 20 -3.097 -7.230 1.661
161 HB THR 20 HB THR 20 -2.942 -9.672 1.582
162 HG1 THR 20 1HG THR 20 -5.643 -9.468 2.041
163 1HG2 THR 20 1HG2 THR 20 -2.937 -10.101 3.997
164 2HG2 THR 20 2HG2 THR 20 -3.892 -8.642 4.257
165 3HG2 THR 20 3HG2 THR 20 -2.250 -8.521 3.625
166 H CYS 21 H CYS 21 -2.672 -7.372 -0.446
167 HA CYS 21 HA CYS 21 -4.916 -7.495 -2.282
168 1HB CYS 21 1HB CYS 21 -3.282 -5.697 -2.524
169 2HB CYS 21 2HB CYS 21 -1.992 -6.875 -2.735
170 H GLY 22 H GLY 22 -2.374 -9.520 -1.170
171 1HA GLY 22 1HA GLY 22 -3.343 -11.723 -2.730
172 2HA GLY 22 2HA GLY 22 -1.774 -11.160 -3.284
173 H ILE 23 H ILE 23 -0.805 -13.137 -2.711
174 HA ILE 23 HA ILE 23 -0.909 -14.095 -0.003
175 HB ILE 23 HB ILE 23 0.955 -14.900 -2.243
176 1HG1 ILE 23 1HG1 ILE 23 -1.594 -16.225 -1.288
177 2HG1 ILE 23 2HG1 ILE 23 -1.470 -15.230 -2.736
178 1HG2 ILE 23 1HG2 ILE 23 1.823 -15.497 -0.048
179 2HG2 ILE 23 2HG2 ILE 23 1.300 -16.937 -0.921
180 3HG2 ILE 23 3HG2 ILE 23 0.292 -16.271 0.362
181 1HD1 ILE 23 1HD1 ILE 23 -1.414 -17.574 -3.307
182 2HD1 ILE 23 2HD1 ILE 23 -0.040 -17.828 -2.232
183 3HD1 ILE 23 3HD1 ILE 23 0.141 -16.825 -3.671
184 H ARG 24 H ARG 24 1.595 -12.586 -2.036
185 HA ARG 24 HA ARG 24 3.089 -11.946 0.418
186 1HB ARG 24 1HB ARG 24 5.072 -11.719 -1.084
187 2HB ARG 24 2HB ARG 24 4.405 -13.345 -1.019
188 1HG ARG 24 1HG ARG 24 3.245 -12.933 -3.147
189 2HG ARG 24 2HG ARG 24 3.984 -11.332 -3.218
190 1HD ARG 24 1HD ARG 24 6.188 -12.306 -3.315
191 2HD ARG 24 2HD ARG 24 5.521 -13.922 -3.085
192 HE ARG 24 HE ARG 24 4.611 -12.447 -5.423
193 1HH1 ARG 24 1HH1 ARG 24 6.725 -14.877 -4.095
194 2HH1 ARG 24 2HH1 ARG 24 7.026 -15.634 -5.622
195 1HH2 ARG 24 1HH2 ARG 24 5.002 -13.437 -7.439
196 2HH2 ARG 24 2HH2 ARG 24 6.048 -14.815 -7.525
197 H PHE 25 H PHE 25 0.989 -10.592 -1.638
198 HA PHE 25 HA PHE 25 2.306 -8.070 -2.118
199 1HB PHE 25 1HB PHE 25 -0.582 -8.901 -2.478
200 2HB PHE 25 2HB PHE 25 0.108 -7.377 -3.026
201 HD1 PHE 25 1HD PHE 25 0.218 -11.040 -3.489
202 HD2 PHE 25 2HD PHE 25 1.274 -7.230 -5.064
203 HE1 PHE 25 1HE PHE 25 0.847 -12.099 -5.618
204 HE2 PHE 25 2HE PHE 25 1.904 -8.283 -7.197
205 HZ PHE 25 HZ PHE 25 1.691 -10.721 -7.476
206 H LEU 26 H LEU 26 0.710 -6.085 -1.548
207 HA LEU 26 HA LEU 26 -0.453 -6.284 1.080
208 1HB LEU 26 1HB LEU 26 0.984 -4.720 2.190
209 2HB LEU 26 2HB LEU 26 1.956 -6.044 1.582
210 HG LEU 26 HG LEU 26 1.708 -3.423 0.121
211 1HD1 LEU 26 1HD1 LEU 26 2.588 -2.962 2.337
212 2HD1 LEU 26 2HD1 LEU 26 3.858 -2.810 1.125
213 3HD1 LEU 26 3HD1 LEU 26 3.783 -4.244 2.148
214 1HD2 LEU 26 1HD2 LEU 26 3.659 -5.716 -0.017
215 2HD2 LEU 26 2HD2 LEU 26 3.870 -4.177 -0.851
216 3HD2 LEU 26 3HD2 LEU 26 2.508 -5.220 -1.257
217 H TYR 27 H TYR 27 -1.050 -3.965 1.862
218 HA TYR 27 HA TYR 27 -2.096 -2.536 -0.491
219 1HB TYR 27 1HB TYR 27 -3.518 -3.737 1.549
220 2HB TYR 27 2HB TYR 27 -3.492 -2.042 2.025
221 HD1 TYR 27 1HD TYR 27 -5.321 -0.820 1.343
222 HD2 TYR 27 2HD TYR 27 -3.932 -3.988 -1.132
223 HE1 TYR 27 1HE TYR 27 -7.117 -0.342 -0.264
224 HE2 TYR 27 2HE TYR 27 -5.725 -3.517 -2.749
225 HH TYR 27 HH TYR 27 -7.586 -0.691 -2.665
226 H CYS 28 H CYS 28 -1.383 -0.547 -0.791
227 HA CYS 28 HA CYS 28 -0.366 0.947 1.537
228 1HB CYS 28 1HB CYS 28 0.785 0.880 -1.259
229 2HB CYS 28 2HB CYS 28 1.319 1.969 0.018
230 H CYS 29 H CYS 29 -1.267 2.865 1.860
231 HA CYS 29 HA CYS 29 -2.867 4.026 -0.322
232 1HB CYS 29 1HB CYS 29 -3.866 3.147 1.994
233 2HB CYS 29 2HB CYS 29 -3.406 4.767 2.508
234 HA PRO 30 HA PRO 30 0.092 7.394 0.094
235 1HB PRO 30 1HB PRO 30 -0.879 8.948 -1.891
236 2HB PRO 30 2HB PRO 30 0.075 7.496 -2.210
237 1HG PRO 30 1HG PRO 30 -2.895 7.868 -2.294
238 2HG PRO 30 2HG PRO 30 -1.844 6.997 -3.426
239 1HD PRO 30 1HD PRO 30 -3.308 5.749 -1.503
240 2HD PRO 30 2HD PRO 30 -1.760 5.121 -2.100
241 H ARG 31 H ARG 31 -0.089 8.803 1.720
242 HA ARG 31 HA ARG 31 -2.648 9.935 2.437
243 1HB ARG 31 1HB ARG 31 0.090 10.379 3.639
244 2HB ARG 31 2HB ARG 31 -1.430 10.930 4.329
245 1HG ARG 31 1HG ARG 31 -2.155 8.596 4.561
246 2HG ARG 31 2HG ARG 31 -0.601 8.065 3.911
247 1HD ARG 31 1HD ARG 31 0.555 9.129 5.772
248 2HD ARG 31 2HD ARG 31 -0.981 9.711 6.410
249 HE ARG 31 HE ARG 31 -1.144 6.935 6.169
250 1HH1 ARG 31 1HH1 ARG 31 0.619 9.321 7.996
251 2HH1 ARG 31 2HH1 ARG 31 0.822 8.300 9.380
252 1HH2 ARG 31 1HH2 ARG 31 -0.877 5.582 7.989
253 2HH2 ARG 31 2HH2 ARG 31 -0.027 6.176 9.376
254 H ARG 32 H ARG 32 -0.195 10.782 0.321
255 HA ARG 32 HA ARG 32 -1.128 13.571 0.293
256 1HB ARG 32 1HB ARG 32 1.722 12.651 -0.131
257 2HB ARG 32 2HB ARG 32 1.147 14.303 -0.305
258 1HG ARG 32 1HG ARG 32 1.034 12.725 2.257
259 2HG ARG 32 2HG ARG 32 2.313 13.863 1.833
260 1HD ARG 32 1HD ARG 32 -0.614 14.559 2.038
261 2HD ARG 32 2HD ARG 32 0.577 14.838 3.308
262 HE ARG 32 HE ARG 32 1.549 16.054 1.016
263 1HH1 ARG 32 1HH1 ARG 32 -1.218 16.361 3.115
264 2HH1 ARG 32 2HH1 ARG 32 -1.400 18.060 2.835
265 1HH2 ARG 32 1HH2 ARG 32 1.316 18.289 0.645
266 2HH2 ARG 32 2HH2 ARG 32 0.038 19.156 1.431
Start of MODEL 6
1 1H GLY 1 1H GLY 1 -4.223 9.696 -6.149
2 2H GLY 1 2H GLY 1 -4.426 9.172 -7.745
3 3H GLY 1 3H GLY 1 -4.806 8.138 -6.462
4 1HA GLY 1 1HA GLY 1 -6.210 10.666 -7.139
5 2HA GLY 1 2HA GLY 1 -6.816 9.045 -7.442
6 H LEU 2 H LEU 2 -8.561 8.939 -6.144
7 HA LEU 2 HA LEU 2 -8.217 9.660 -3.313
8 1HB LEU 2 1HB LEU 2 -10.782 9.236 -4.848
9 2HB LEU 2 2HB LEU 2 -10.642 9.803 -3.195
10 HG LEU 2 HG LEU 2 -9.684 11.291 -5.643
11 1HD1 LEU 2 1HD1 LEU 2 -11.512 12.843 -5.122
12 2HD1 LEU 2 2HD1 LEU 2 -12.048 11.765 -3.832
13 3HD1 LEU 2 3HD1 LEU 2 -12.107 11.229 -5.512
14 1HD2 LEU 2 1HD2 LEU 2 -9.307 13.152 -4.099
15 2HD2 LEU 2 2HD2 LEU 2 -8.303 11.760 -3.689
16 3HD2 LEU 2 3HD2 LEU 2 -9.748 12.116 -2.741
17 H LEU 3 H LEU 3 -7.451 7.125 -4.765
18 HA LEU 3 HA LEU 3 -8.753 5.286 -2.884
19 1HB LEU 3 1HB LEU 3 -8.269 4.699 -5.808
20 2HB LEU 3 2HB LEU 3 -8.893 3.564 -4.626
21 HG LEU 3 HG LEU 3 -10.301 6.109 -5.431
22 1HD1 LEU 3 1HD1 LEU 3 -10.122 4.545 -7.312
23 2HD1 LEU 3 2HD1 LEU 3 -11.782 4.699 -6.736
24 3HD1 LEU 3 3HD1 LEU 3 -10.832 3.275 -6.313
25 1HD2 LEU 3 1HD2 LEU 3 -11.228 3.710 -3.855
26 2HD2 LEU 3 2HD2 LEU 3 -12.221 5.095 -4.312
27 3HD2 LEU 3 3HD2 LEU 3 -10.871 5.307 -3.197
28 H CYS 4 H CYS 4 -7.505 3.349 -2.450
29 HA CYS 4 HA CYS 4 -4.658 3.910 -2.475
30 1HB CYS 4 1HB CYS 4 -6.056 1.517 -1.273
31 2HB CYS 4 2HB CYS 4 -4.440 2.108 -0.907
32 H TYR 5 H TYR 5 -3.123 2.130 -2.972
33 HA TYR 5 HA TYR 5 -4.074 0.320 -5.079
34 1HB TYR 5 1HB TYR 5 -1.520 1.923 -5.308
35 2HB TYR 5 2HB TYR 5 -2.231 0.868 -6.525
36 HD1 TYR 5 1HD TYR 5 -4.558 1.543 -7.431
37 HD2 TYR 5 2HD TYR 5 -1.982 4.201 -5.335
38 HE1 TYR 5 1HE TYR 5 -5.760 3.458 -8.397
39 HE2 TYR 5 2HE TYR 5 -3.178 6.125 -6.292
40 HH TYR 5 HH TYR 5 -4.579 6.642 -8.233
41 H CYS 6 H CYS 6 -3.366 -1.710 -4.791
42 HA CYS 6 HA CYS 6 -1.439 -2.201 -2.679
43 1HB CYS 6 1HB CYS 6 -2.045 -4.549 -2.913
44 2HB CYS 6 2HB CYS 6 -3.484 -3.550 -2.766
45 H ARG 7 H ARG 7 0.633 -2.586 -2.982
46 HA ARG 7 HA ARG 7 1.556 -3.208 -5.712
47 1HB ARG 7 1HB ARG 7 2.949 -1.684 -3.505
48 2HB ARG 7 2HB ARG 7 3.695 -2.119 -5.038
49 1HG ARG 7 1HG ARG 7 1.938 -0.793 -6.194
50 2HG ARG 7 2HG ARG 7 1.359 -0.268 -4.611
51 1HD ARG 7 1HD ARG 7 3.675 0.589 -4.161
52 2HD ARG 7 2HD ARG 7 4.058 0.247 -5.846
53 HE ARG 7 HE ARG 7 1.798 2.006 -5.262
54 1HH1 ARG 7 1HH1 ARG 7 5.061 1.600 -6.417
55 2HH1 ARG 7 2HH1 ARG 7 5.118 3.154 -7.182
56 1HH2 ARG 7 1HH2 ARG 7 1.866 4.050 -6.267
57 2HH2 ARG 7 2HH2 ARG 7 3.305 4.546 -7.095
58 H LYS 8 H LYS 8 4.015 -4.052 -5.436
59 HA LYS 8 HA LYS 8 3.817 -6.392 -3.659
60 1HB LYS 8 1HB LYS 8 3.836 -6.965 -6.039
61 2HB LYS 8 2HB LYS 8 5.335 -6.071 -6.256
62 1HG LYS 8 1HG LYS 8 6.424 -7.643 -4.659
63 2HG LYS 8 2HG LYS 8 4.933 -8.586 -4.652
64 1HD LYS 8 1HD LYS 8 6.545 -7.950 -7.122
65 2HD LYS 8 2HD LYS 8 6.662 -9.457 -6.212
66 1HE LYS 8 1HE LYS 8 4.289 -9.893 -6.644
67 2HE LYS 8 2HE LYS 8 4.182 -8.389 -7.559
68 1HZ LYS 8 1HZ LYS 8 4.447 -10.307 -9.009
69 2HZ LYS 8 2HZ LYS 8 5.906 -10.707 -8.253
70 3HZ LYS 8 3HZ LYS 8 5.778 -9.270 -9.136
71 H GLY 9 H GLY 9 5.290 -6.650 -2.105
72 1HA GLY 9 1HA GLY 9 7.337 -6.518 -1.014
73 2HA GLY 9 2HA GLY 9 7.965 -5.584 -2.362
74 H HIS 10 H HIS 10 8.004 -3.388 -2.245
75 HA HIS 10 HA HIS 10 6.838 -2.166 0.160
76 1HB HIS 10 1HB HIS 10 8.847 -0.566 0.021
77 2HB HIS 10 2HB HIS 10 9.130 -2.187 0.652
78 HD1 HIS 10 1HD HIS 10 9.957 -3.933 -1.338
79 HD2 HIS 10 2HD HIS 10 10.626 0.128 -1.893
80 HE1 HIS 10 1HE HIS 10 11.739 -3.783 -3.091
81 HE2 HIS 10 2HE HIS 10 12.058 -1.316 -3.492
82 H CYS 11 H CYS 11 6.104 -0.025 -0.027
83 HA CYS 11 HA CYS 11 5.608 0.816 -2.802
84 1HB CYS 11 1HB CYS 11 3.616 0.284 -1.399
85 2HB CYS 11 2HB CYS 11 4.076 1.587 -0.311
86 H LYS 12 H LYS 12 5.225 3.285 -2.953
87 HA LYS 12 HA LYS 12 7.659 4.553 -2.139
88 1HB LYS 12 1HB LYS 12 6.760 6.525 -3.327
89 2HB LYS 12 2HB LYS 12 6.718 5.066 -4.307
90 1HG LYS 12 1HG LYS 12 4.328 4.809 -3.779
91 2HG LYS 12 2HG LYS 12 4.391 6.314 -2.860
92 1HD LYS 12 1HD LYS 12 5.066 7.515 -4.891
93 2HD LYS 12 2HD LYS 12 4.982 6.008 -5.805
94 1HE LYS 12 1HE LYS 12 2.588 5.833 -5.242
95 2HE LYS 12 2HE LYS 12 2.691 7.378 -4.397
96 1HZ LYS 12 1HZ LYS 12 1.819 7.672 -6.617
97 2HZ LYS 12 2HZ LYS 12 3.184 6.938 -7.293
98 3HZ LYS 12 3HZ LYS 12 3.332 8.421 -6.494
99 H ARG 13 H ARG 13 4.309 4.672 -1.085
100 HA ARG 13 HA ARG 13 5.020 5.724 1.444
101 1HB ARG 13 1HB ARG 13 3.972 7.912 1.308
102 2HB ARG 13 2HB ARG 13 5.272 7.792 0.136
103 1HG ARG 13 1HG ARG 13 3.518 7.242 -1.585
104 2HG ARG 13 2HG ARG 13 2.313 7.686 -0.376
105 1HD ARG 13 1HD ARG 13 4.527 9.493 -1.335
106 2HD ARG 13 2HD ARG 13 2.878 9.519 -1.956
107 HE ARG 13 HE ARG 13 3.213 9.896 0.912
108 1HH1 ARG 13 1HH1 ARG 13 2.666 11.312 -2.225
109 2HH1 ARG 13 2HH1 ARG 13 2.067 12.807 -1.590
110 1HH2 ARG 13 1HH2 ARG 13 2.426 11.867 1.757
111 2HH2 ARG 13 2HH2 ARG 13 1.930 13.123 0.672
112 H GLY 14 H GLY 14 3.537 5.060 2.867
113 1HA GLY 14 1HA GLY 14 1.268 4.910 3.637
114 2HA GLY 14 2HA GLY 14 0.753 4.751 1.966
115 H GLU 15 H GLU 15 3.493 2.943 3.078
116 HA GLU 15 HA GLU 15 2.390 0.470 2.313
117 1HB GLU 15 1HB GLU 15 4.770 1.138 4.047
118 2HB GLU 15 2HB GLU 15 4.370 -0.495 3.536
119 1HG GLU 15 1HG GLU 15 4.771 -0.004 1.280
120 2HG GLU 15 2HG GLU 15 4.810 1.733 1.579
121 H ARG 16 H ARG 16 0.640 -0.346 3.285
122 HA ARG 16 HA ARG 16 0.785 -0.868 6.155
123 1HB ARG 16 1HB ARG 16 -1.603 0.416 4.815
124 2HB ARG 16 2HB ARG 16 -1.561 -0.159 6.476
125 1HG ARG 16 1HG ARG 16 0.291 1.461 6.906
126 2HG ARG 16 2HG ARG 16 0.016 2.111 5.290
127 1HD ARG 16 1HD ARG 16 -2.038 1.979 7.494
128 2HD ARG 16 2HD ARG 16 -1.125 3.416 7.037
129 HE ARG 16 HE ARG 16 -2.592 2.240 4.863
130 1HH1 ARG 16 1HH1 ARG 16 -2.741 4.443 7.560
131 2HH1 ARG 16 2HH1 ARG 16 -4.062 5.354 6.909
132 1HH2 ARG 16 1HH2 ARG 16 -4.331 3.437 3.999
133 2HH2 ARG 16 2HH2 ARG 16 -4.966 4.782 4.886
134 H VAL 17 H VAL 17 -1.072 -2.357 6.831
135 HA VAL 17 HA VAL 17 -1.820 -4.170 4.651
136 HB VAL 17 HB VAL 17 0.205 -5.027 5.823
137 1HG1 VAL 17 1HG1 VAL 17 -0.009 -5.938 8.079
138 2HG1 VAL 17 2HG1 VAL 17 -1.641 -5.283 8.190
139 3HG1 VAL 17 3HG1 VAL 17 -0.262 -4.193 8.056
140 1HG2 VAL 17 1HG2 VAL 17 -1.356 -6.536 4.673
141 2HG2 VAL 17 2HG2 VAL 17 -2.249 -6.743 6.180
142 3HG2 VAL 17 3HG2 VAL 17 -0.584 -7.307 6.059
143 H ARG 18 H ARG 18 -3.478 -2.264 5.750
144 HA ARG 18 HA ARG 18 -5.128 -3.428 7.806
145 1HB ARG 18 1HB ARG 18 -4.845 -0.971 7.555
146 2HB ARG 18 2HB ARG 18 -5.687 -1.054 6.014
147 1HG ARG 18 1HG ARG 18 -7.696 -1.855 7.155
148 2HG ARG 18 2HG ARG 18 -6.849 -1.767 8.701
149 1HD ARG 18 1HD ARG 18 -8.246 0.195 8.386
150 2HD ARG 18 2HD ARG 18 -6.542 0.646 8.381
151 HE ARG 18 HE ARG 18 -7.543 0.174 5.750
152 1HH1 ARG 18 1HH1 ARG 18 -7.395 2.529 8.317
153 2HH1 ARG 18 2HH1 ARG 18 -7.574 3.886 7.255
154 1HH2 ARG 18 1HH2 ARG 18 -7.782 1.954 4.348
155 2HH2 ARG 18 2HH2 ARG 18 -7.796 3.558 5.001
156 H GLY 19 H GLY 19 -4.922 -3.544 4.397
157 1HA GLY 19 1HA GLY 19 -7.202 -5.356 4.293
158 2HA GLY 19 2HA GLY 19 -7.311 -3.911 3.296
159 H THR 20 H THR 20 -5.467 -6.847 3.884
160 HA THR 20 HA THR 20 -3.508 -6.754 2.002
161 HB THR 20 HB THR 20 -3.633 -9.196 1.830
162 HG1 THR 20 1HG THR 20 -5.402 -10.285 2.405
163 1HG2 THR 20 1HG2 THR 20 -3.455 -9.718 4.231
164 2HG2 THR 20 2HG2 THR 20 -4.168 -8.150 4.612
165 3HG2 THR 20 3HG2 THR 20 -2.599 -8.234 3.812
166 H CYS 21 H CYS 21 -3.261 -7.447 -0.138
167 HA CYS 21 HA CYS 21 -5.713 -7.271 -1.766
168 1HB CYS 21 1HB CYS 21 -4.144 -5.348 -1.967
169 2HB CYS 21 2HB CYS 21 -2.903 -6.457 -2.532
170 H GLY 22 H GLY 22 -3.006 -9.154 -0.910
171 1HA GLY 22 1HA GLY 22 -3.871 -11.349 -2.516
172 2HA GLY 22 2HA GLY 22 -2.403 -10.628 -3.158
173 H ILE 23 H ILE 23 -1.084 -12.377 -2.741
174 HA ILE 23 HA ILE 23 -0.932 -13.461 -0.053
175 HB ILE 23 HB ILE 23 0.740 -14.121 -2.481
176 1HG1 ILE 23 1HG1 ILE 23 -1.635 -14.624 -2.847
177 2HG1 ILE 23 2HG1 ILE 23 -0.696 -16.104 -2.694
178 1HG2 ILE 23 1HG2 ILE 23 1.309 -16.168 -1.243
179 2HG2 ILE 23 2HG2 ILE 23 0.420 -15.556 0.152
180 3HG2 ILE 23 3HG2 ILE 23 1.860 -14.711 -0.416
181 1HD1 ILE 23 1HD1 ILE 23 -2.416 -14.867 -0.558
182 2HD1 ILE 23 2HD1 ILE 23 -1.459 -16.337 -0.381
183 3HD1 ILE 23 3HD1 ILE 23 -2.803 -16.292 -1.521
184 H ARG 24 H ARG 24 1.603 -12.331 -2.298
185 HA ARG 24 HA ARG 24 3.158 -11.416 0.002
186 1HB ARG 24 1HB ARG 24 5.015 -11.203 -1.613
187 2HB ARG 24 2HB ARG 24 4.336 -12.825 -1.581
188 1HG ARG 24 1HG ARG 24 3.114 -12.388 -3.624
189 2HG ARG 24 2HG ARG 24 3.700 -10.724 -3.642
190 1HD ARG 24 1HD ARG 24 5.414 -13.198 -3.825
191 2HD ARG 24 2HD ARG 24 4.968 -12.156 -5.174
192 HE ARG 24 HE ARG 24 6.215 -10.365 -3.963
193 1HH1 ARG 24 1HH1 ARG 24 6.938 -13.729 -3.399
194 2HH1 ARG 24 2HH1 ARG 24 8.574 -13.427 -2.914
195 1HH2 ARG 24 1HH2 ARG 24 8.367 -9.963 -3.327
196 2HH2 ARG 24 2HH2 ARG 24 9.384 -11.289 -2.870
197 H PHE 25 H PHE 25 0.801 -10.108 -1.676
198 HA PHE 25 HA PHE 25 2.067 -7.543 -2.260
199 1HB PHE 25 1HB PHE 25 -0.805 -8.405 -2.662
200 2HB PHE 25 2HB PHE 25 -0.069 -6.925 -3.267
201 HD1 PHE 25 1HD PHE 25 -0.236 -10.571 -3.641
202 HD2 PHE 25 2HD PHE 25 1.326 -6.936 -5.210
203 HE1 PHE 25 1HE PHE 25 0.404 -11.743 -5.708
204 HE2 PHE 25 2HE PHE 25 1.968 -8.101 -7.280
205 HZ PHE 25 HZ PHE 25 1.507 -10.508 -7.531
206 H LEU 26 H LEU 26 1.235 -5.565 -1.393
207 HA LEU 26 HA LEU 26 -0.291 -5.846 1.098
208 1HB LEU 26 1HB LEU 26 1.181 -4.539 2.354
209 2HB LEU 26 2HB LEU 26 2.226 -5.630 1.469
210 HG LEU 26 HG LEU 26 1.684 -2.776 0.645
211 1HD1 LEU 26 1HD1 LEU 26 2.834 -2.875 2.804
212 2HD1 LEU 26 2HD1 LEU 26 3.888 -2.265 1.529
213 3HD1 LEU 26 3HD1 LEU 26 4.062 -3.926 2.098
214 1HD2 LEU 26 1HD2 LEU 26 3.808 -3.189 -0.672
215 2HD2 LEU 26 2HD2 LEU 26 2.358 -4.009 -1.251
216 3HD2 LEU 26 3HD2 LEU 26 3.571 -4.904 -0.334
217 H TYR 27 H TYR 27 -1.138 -3.729 1.884
218 HA TYR 27 HA TYR 27 -2.210 -2.305 -0.422
219 1HB TYR 27 1HB TYR 27 -3.380 -3.253 1.891
220 2HB TYR 27 2HB TYR 27 -3.253 -1.523 2.188
221 HD1 TYR 27 1HD TYR 27 -4.094 -3.703 -0.721
222 HD2 TYR 27 2HD TYR 27 -5.165 -0.346 1.662
223 HE1 TYR 27 1HE TYR 27 -6.069 -3.331 -2.142
224 HE2 TYR 27 2HE TYR 27 -7.144 0.035 0.249
225 HH TYR 27 HH TYR 27 -7.873 -0.491 -2.079
226 H CYS 28 H CYS 28 -1.531 -0.389 -1.012
227 HA CYS 28 HA CYS 28 -0.097 1.271 0.953
228 1HB CYS 28 1HB CYS 28 1.540 0.513 -0.584
229 2HB CYS 28 2HB CYS 28 0.482 0.783 -1.964
230 H CYS 29 H CYS 29 -1.408 2.899 1.496
231 HA CYS 29 HA CYS 29 -3.182 4.051 -0.521
232 1HB CYS 29 1HB CYS 29 -3.042 4.430 2.474
233 2HB CYS 29 2HB CYS 29 -4.152 5.299 1.424
234 HA PRO 30 HA PRO 30 -0.279 7.438 -0.899
235 1HB PRO 30 1HB PRO 30 -1.526 8.804 -2.835
236 2HB PRO 30 2HB PRO 30 -0.740 7.254 -3.160
237 1HG PRO 30 1HG PRO 30 -3.639 7.863 -2.762
238 2HG PRO 30 2HG PRO 30 -2.873 6.764 -3.923
239 1HD PRO 30 1HD PRO 30 -4.030 5.974 -1.544
240 2HD PRO 30 2HD PRO 30 -2.794 5.050 -2.418
241 H ARG 31 H ARG 31 -1.980 7.586 1.331
242 HA ARG 31 HA ARG 31 -3.039 10.328 1.206
243 1HB ARG 31 1HB ARG 31 -3.620 8.136 3.207
244 2HB ARG 31 2HB ARG 31 -4.332 9.742 3.218
245 1HG ARG 31 1HG ARG 31 -5.376 9.285 1.047
246 2HG ARG 31 2HG ARG 31 -4.677 7.664 1.065
247 1HD ARG 31 1HD ARG 31 -6.964 7.539 1.797
248 2HD ARG 31 2HD ARG 31 -5.904 7.207 3.166
249 HE ARG 31 HE ARG 31 -6.650 9.961 3.012
250 1HH1 ARG 31 1HH1 ARG 31 -7.709 6.810 4.062
251 2HH1 ARG 31 2HH1 ARG 31 -8.791 7.434 5.262
252 1HH2 ARG 31 1HH2 ARG 31 -8.071 10.788 4.590
253 2HH2 ARG 31 2HH2 ARG 31 -8.998 9.693 5.561
254 H ARG 32 H ARG 32 -0.692 8.267 2.694
255 HA ARG 32 HA ARG 32 0.262 10.550 4.287
256 1HB ARG 32 1HB ARG 32 1.143 8.809 5.914
257 2HB ARG 32 2HB ARG 32 -0.597 9.056 5.902
258 1HG ARG 32 1HG ARG 32 -0.883 7.052 4.542
259 2HG ARG 32 2HG ARG 32 0.865 6.809 4.527
260 1HD ARG 32 1HD ARG 32 -0.864 6.854 6.997
261 2HD ARG 32 2HD ARG 32 -0.283 5.396 6.195
262 HE ARG 32 HE ARG 32 1.966 6.875 6.731
263 1HH1 ARG 32 1HH1 ARG 32 -0.645 5.526 8.601
264 2HH1 ARG 32 2HH1 ARG 32 0.320 5.294 10.021
265 1HH2 ARG 32 1HH2 ARG 32 3.245 6.573 8.595
266 2HH2 ARG 32 2HH2 ARG 32 2.530 5.890 10.017
Start of MODEL 7
1 1H GLY 1 1H GLY 1 -10.050 13.270 -3.416
2 2H GLY 1 2H GLY 1 -8.445 13.014 -3.886
3 3H GLY 1 3H GLY 1 -8.946 12.599 -2.324
4 1HA GLY 1 1HA GLY 1 -10.419 10.900 -3.213
5 2HA GLY 1 2HA GLY 1 -9.895 11.330 -4.834
6 H LEU 2 H LEU 2 -9.005 9.784 -1.838
7 HA LEU 2 HA LEU 2 -6.338 9.141 -2.520
8 1HB LEU 2 1HB LEU 2 -6.353 7.663 -0.660
9 2HB LEU 2 2HB LEU 2 -7.301 9.069 -0.216
10 HG LEU 2 HG LEU 2 -8.531 6.478 -1.155
11 1HD1 LEU 2 1HD1 LEU 2 -7.282 6.055 0.882
12 2HD1 LEU 2 2HD1 LEU 2 -9.016 6.042 1.211
13 3HD1 LEU 2 3HD1 LEU 2 -8.044 7.444 1.660
14 1HD2 LEU 2 1HD2 LEU 2 -9.670 8.887 0.260
15 2HD2 LEU 2 2HD2 LEU 2 -10.550 7.400 -0.094
16 3HD2 LEU 2 3HD2 LEU 2 -9.968 8.416 -1.414
17 H LEU 3 H LEU 3 -5.442 7.382 -3.502
18 HA LEU 3 HA LEU 3 -7.263 5.348 -4.590
19 1HB LEU 3 1HB LEU 3 -5.051 6.706 -6.133
20 2HB LEU 3 2HB LEU 3 -6.068 5.407 -6.726
21 HG LEU 3 HG LEU 3 -7.077 8.147 -5.955
22 1HD1 LEU 3 1HD1 LEU 3 -5.621 8.263 -7.907
23 2HD1 LEU 3 2HD1 LEU 3 -7.305 8.534 -8.353
24 3HD1 LEU 3 3HD1 LEU 3 -6.547 6.977 -8.683
25 1HD2 LEU 3 1HD2 LEU 3 -8.416 5.834 -7.355
26 2HD2 LEU 3 2HD2 LEU 3 -9.119 7.434 -7.111
27 3HD2 LEU 3 3HD2 LEU 3 -8.760 6.406 -5.723
28 H CYS 4 H CYS 4 -6.639 3.523 -3.614
29 HA CYS 4 HA CYS 4 -3.899 3.094 -2.825
30 1HB CYS 4 1HB CYS 4 -6.148 1.089 -2.705
31 2HB CYS 4 2HB CYS 4 -4.688 1.137 -1.725
32 H TYR 5 H TYR 5 -2.560 1.389 -3.534
33 HA TYR 5 HA TYR 5 -3.331 0.096 -6.055
34 1HB TYR 5 1HB TYR 5 -0.738 1.549 -5.506
35 2HB TYR 5 2HB TYR 5 -0.995 0.485 -6.884
36 HD1 TYR 5 1HD TYR 5 -2.468 1.151 -8.713
37 HD2 TYR 5 2HD TYR 5 -1.751 3.745 -5.418
38 HE1 TYR 5 1HE TYR 5 -3.389 3.031 -10.001
39 HE2 TYR 5 2HE TYR 5 -2.672 5.633 -6.698
40 HH TYR 5 HH TYR 5 -3.027 6.264 -9.051
41 H CYS 6 H CYS 6 -2.323 -1.903 -6.472
42 HA CYS 6 HA CYS 6 -1.519 -3.312 -4.073
43 1HB CYS 6 1HB CYS 6 -1.914 -4.312 -6.901
44 2HB CYS 6 2HB CYS 6 -1.629 -5.327 -5.492
45 H ARG 7 H ARG 7 0.513 -3.540 -3.465
46 HA ARG 7 HA ARG 7 2.615 -3.737 -5.502
47 1HB ARG 7 1HB ARG 7 2.591 -1.888 -3.119
48 2HB ARG 7 2HB ARG 7 4.074 -2.342 -3.947
49 1HG ARG 7 1HG ARG 7 3.268 -1.348 -6.002
50 2HG ARG 7 2HG ARG 7 1.725 -0.964 -5.235
51 1HD ARG 7 1HD ARG 7 2.805 0.549 -3.707
52 2HD ARG 7 2HD ARG 7 4.395 0.077 -4.300
53 HE ARG 7 HE ARG 7 3.939 1.242 -6.326
54 1HH1 ARG 7 1HH1 ARG 7 1.530 1.683 -3.844
55 2HH1 ARG 7 2HH1 ARG 7 0.892 3.133 -4.543
56 1HH2 ARG 7 1HH2 ARG 7 3.102 3.152 -7.250
57 2HH2 ARG 7 2HH2 ARG 7 1.784 3.967 -6.477
58 H LYS 8 H LYS 8 3.932 -5.412 -5.159
59 HA LYS 8 HA LYS 8 3.648 -6.931 -2.697
60 1HB LYS 8 1HB LYS 8 3.563 -8.107 -4.851
61 2HB LYS 8 2HB LYS 8 5.189 -7.551 -5.223
62 1HG LYS 8 1HG LYS 8 6.108 -8.857 -3.433
63 2HG LYS 8 2HG LYS 8 4.495 -9.301 -2.873
64 1HD LYS 8 1HD LYS 8 5.464 -11.137 -4.114
65 2HD LYS 8 2HD LYS 8 4.104 -10.464 -5.016
66 1HE LYS 8 1HE LYS 8 5.999 -10.947 -6.482
67 2HE LYS 8 2HE LYS 8 5.646 -9.220 -6.434
68 1HZ LYS 8 1HZ LYS 8 7.460 -8.939 -4.853
69 2HZ LYS 8 2HZ LYS 8 8.015 -9.623 -6.296
70 3HZ LYS 8 3HZ LYS 8 7.805 -10.594 -4.927
71 H GLY 9 H GLY 9 5.140 -7.108 -1.131
72 1HA GLY 9 1HA GLY 9 7.334 -7.120 -0.249
73 2HA GLY 9 2HA GLY 9 7.873 -6.188 -1.636
74 H HIS 10 H HIS 10 7.618 -3.944 -1.645
75 HA HIS 10 HA HIS 10 6.544 -2.669 0.748
76 1HB HIS 10 1HB HIS 10 9.401 -2.902 0.112
77 2HB HIS 10 2HB HIS 10 8.874 -1.252 0.428
78 HD1 HIS 10 1HD HIS 10 9.272 -4.591 2.081
79 HD2 HIS 10 2HD HIS 10 8.193 -0.702 3.072
80 HE1 HIS 10 1HE HIS 10 9.249 -4.522 4.595
81 HE2 HIS 10 2HE HIS 10 8.675 -2.135 5.171
82 H CYS 11 H CYS 11 5.823 -0.589 0.423
83 HA CYS 11 HA CYS 11 5.822 0.312 -2.367
84 1HB CYS 11 1HB CYS 11 3.608 0.043 -1.428
85 2HB CYS 11 2HB CYS 11 4.029 1.049 -0.046
86 H LYS 12 H LYS 12 6.008 2.629 -2.791
87 HA LYS 12 HA LYS 12 7.800 3.951 -0.857
88 1HB LYS 12 1HB LYS 12 8.855 5.060 -2.789
89 2HB LYS 12 2HB LYS 12 8.992 3.307 -2.882
90 1HG LYS 12 1HG LYS 12 7.050 3.293 -4.425
91 2HG LYS 12 2HG LYS 12 7.079 5.059 -4.410
92 1HD LYS 12 1HD LYS 12 9.331 5.053 -5.323
93 2HD LYS 12 2HD LYS 12 9.371 3.291 -5.269
94 1HE LYS 12 1HE LYS 12 8.904 4.066 -7.524
95 2HE LYS 12 2HE LYS 12 7.513 3.207 -6.864
96 1HZ LYS 12 1HZ LYS 12 7.827 6.156 -7.030
97 2HZ LYS 12 2HZ LYS 12 6.506 5.356 -6.342
98 3HZ LYS 12 3HZ LYS 12 6.817 5.204 -7.997
99 H ARG 13 H ARG 13 4.862 4.104 -1.052
100 HA ARG 13 HA ARG 13 4.651 6.995 -1.095
101 1HB ARG 13 1HB ARG 13 4.074 5.772 -3.427
102 2HB ARG 13 2HB ARG 13 2.509 5.643 -2.636
103 1HG ARG 13 1HG ARG 13 2.514 7.619 -3.962
104 2HG ARG 13 2HG ARG 13 2.565 8.101 -2.265
105 1HD ARG 13 1HD ARG 13 4.944 8.505 -2.413
106 2HD ARG 13 2HD ARG 13 4.973 7.907 -4.071
107 HE ARG 13 HE ARG 13 3.226 9.921 -4.258
108 1HH1 ARG 13 1HH1 ARG 13 6.371 9.737 -2.770
109 2HH1 ARG 13 2HH1 ARG 13 6.733 11.410 -3.028
110 1HH2 ARG 13 1HH2 ARG 13 3.694 12.124 -4.604
111 2HH2 ARG 13 2HH2 ARG 13 5.211 12.768 -4.072
112 H GLY 14 H GLY 14 4.547 5.385 1.097
113 1HA GLY 14 1HA GLY 14 3.184 5.470 3.008
114 2HA GLY 14 2HA GLY 14 1.801 5.811 1.981
115 H GLU 15 H GLU 15 4.010 3.254 3.015
116 HA GLU 15 HA GLU 15 2.545 1.119 1.858
117 1HB GLU 15 1HB GLU 15 4.359 0.940 4.265
118 2HB GLU 15 2HB GLU 15 3.954 -0.342 3.132
119 1HG GLU 15 1HG GLU 15 6.080 0.256 2.480
120 2HG GLU 15 2HG GLU 15 5.071 1.179 1.368
121 H ARG 16 H ARG 16 1.198 -0.422 2.887
122 HA ARG 16 HA ARG 16 0.259 0.044 5.568
123 1HB ARG 16 1HB ARG 16 -0.977 1.665 3.950
124 2HB ARG 16 2HB ARG 16 -1.841 0.223 3.431
125 1HG ARG 16 1HG ARG 16 -3.190 1.231 5.068
126 2HG ARG 16 2HG ARG 16 -2.423 -0.148 5.860
127 1HD ARG 16 1HD ARG 16 -2.307 1.702 7.363
128 2HD ARG 16 2HD ARG 16 -0.685 1.422 6.732
129 HE ARG 16 HE ARG 16 -2.306 3.437 5.390
130 1HH1 ARG 16 1HH1 ARG 16 0.266 2.698 7.625
131 2HH1 ARG 16 2HH1 ARG 16 0.938 4.293 7.577
132 1HH2 ARG 16 1HH2 ARG 16 -1.429 5.539 5.326
133 2HH2 ARG 16 2HH2 ARG 16 -0.027 5.909 6.274
134 H VAL 17 H VAL 17 -1.216 -1.605 6.304
135 HA VAL 17 HA VAL 17 -1.433 -3.944 4.556
136 HB VAL 17 HB VAL 17 0.562 -4.189 6.010
137 1HG1 VAL 17 1HG1 VAL 17 -0.306 -2.930 7.942
138 2HG1 VAL 17 2HG1 VAL 17 0.345 -4.508 8.385
139 3HG1 VAL 17 3HG1 VAL 17 -1.400 -4.269 8.294
140 1HG2 VAL 17 1HG2 VAL 17 -1.666 -6.133 6.603
141 2HG2 VAL 17 2HG2 VAL 17 0.058 -6.449 6.785
142 3HG2 VAL 17 3HG2 VAL 17 -0.621 -6.157 5.184
143 H ARG 18 H ARG 18 -3.499 -2.227 4.979
144 HA ARG 18 HA ARG 18 -5.140 -3.231 7.157
145 1HB ARG 18 1HB ARG 18 -5.133 -0.813 6.543
146 2HB ARG 18 2HB ARG 18 -5.856 -1.239 4.997
147 1HG ARG 18 1HG ARG 18 -7.783 -2.209 6.226
148 2HG ARG 18 2HG ARG 18 -7.071 -1.611 7.726
149 1HD ARG 18 1HD ARG 18 -7.167 0.680 6.834
150 2HD ARG 18 2HD ARG 18 -7.922 0.063 5.365
151 HE ARG 18 HE ARG 18 -9.239 -0.454 7.924
152 1HH1 ARG 18 1HH1 ARG 18 -9.150 1.272 4.895
153 2HH1 ARG 18 2HH1 ARG 18 -10.800 1.792 4.999
154 1HH2 ARG 18 1HH2 ARG 18 -11.407 0.228 8.066
155 2HH2 ARG 18 2HH2 ARG 18 -12.081 1.199 6.800
156 H GLY 19 H GLY 19 -4.684 -3.738 3.778
157 1HA GLY 19 1HA GLY 19 -6.566 -5.930 3.817
158 2HA GLY 19 2HA GLY 19 -7.043 -4.599 2.772
159 H THR 20 H THR 20 -4.718 -7.149 3.306
160 HA THR 20 HA THR 20 -2.869 -6.738 1.323
161 HB THR 20 HB THR 20 -2.595 -8.586 2.818
162 HG1 THR 20 1HG THR 20 -1.806 -9.963 1.341
163 1HG2 THR 20 1HG2 THR 20 -5.070 -9.760 1.546
164 2HG2 THR 20 2HG2 THR 20 -4.933 -9.148 3.193
165 3HG2 THR 20 3HG2 THR 20 -4.033 -10.585 2.708
166 H CYS 21 H CYS 21 -2.755 -6.963 -0.847
167 HA CYS 21 HA CYS 21 -5.248 -7.144 -2.300
168 1HB CYS 21 1HB CYS 21 -3.489 -5.469 -2.867
169 2HB CYS 21 2HB CYS 21 -2.437 -6.790 -3.363
170 H GLY 22 H GLY 22 -3.311 -9.419 -1.054
171 1HA GLY 22 1HA GLY 22 -4.369 -11.518 -2.614
172 2HA GLY 22 2HA GLY 22 -2.721 -11.193 -3.132
173 H ILE 23 H ILE 23 -1.496 -12.772 -2.337
174 HA ILE 23 HA ILE 23 -2.002 -13.780 0.362
175 HB ILE 23 HB ILE 23 -0.057 -14.809 -1.707
176 1HG1 ILE 23 1HG1 ILE 23 -2.793 -15.876 -0.978
177 2HG1 ILE 23 2HG1 ILE 23 -2.449 -14.928 -2.420
178 1HG2 ILE 23 1HG2 ILE 23 -1.090 -16.051 0.840
179 2HG2 ILE 23 2HG2 ILE 23 0.534 -15.415 0.579
180 3HG2 ILE 23 3HG2 ILE 23 -0.014 -16.828 -0.323
181 1HD1 ILE 23 1HD1 ILE 23 -1.308 -17.631 -1.755
182 2HD1 ILE 23 2HD1 ILE 23 -0.913 -16.677 -3.184
183 3HD1 ILE 23 3HD1 ILE 23 -2.554 -17.280 -2.952
184 H ARG 24 H ARG 24 0.740 -12.621 -1.595
185 HA ARG 24 HA ARG 24 2.097 -11.867 0.909
186 1HB ARG 24 1HB ARG 24 4.217 -12.110 -0.293
187 2HB ARG 24 2HB ARG 24 3.297 -13.607 -0.332
188 1HG ARG 24 1HG ARG 24 2.544 -13.062 -2.609
189 2HG ARG 24 2HG ARG 24 3.528 -11.598 -2.563
190 1HD ARG 24 1HD ARG 24 4.702 -13.366 -3.739
191 2HD ARG 24 2HD ARG 24 5.535 -12.969 -2.237
192 HE ARG 24 HE ARG 24 3.852 -15.058 -1.625
193 1HH1 ARG 24 1HH1 ARG 24 6.488 -14.505 -3.836
194 2HH1 ARG 24 2HH1 ARG 24 7.004 -16.157 -3.837
195 1HH2 ARG 24 1HH2 ARG 24 4.526 -17.236 -1.619
196 2HH2 ARG 24 2HH2 ARG 24 5.890 -17.710 -2.578
197 H PHE 25 H PHE 25 0.245 -10.512 -1.269
198 HA PHE 25 HA PHE 25 1.909 -8.252 -2.014
199 1HB PHE 25 1HB PHE 25 -1.038 -8.741 -2.499
200 2HB PHE 25 2HB PHE 25 -0.070 -7.457 -3.217
201 HD1 PHE 25 1HD PHE 25 1.488 -7.918 -4.995
202 HD2 PHE 25 2HD PHE 25 -0.806 -11.038 -3.230
203 HE1 PHE 25 1HE PHE 25 2.070 -9.400 -6.870
204 HE2 PHE 25 2HE PHE 25 -0.227 -12.527 -5.102
205 HZ PHE 25 HZ PHE 25 1.214 -11.708 -6.925
206 H LEU 26 H LEU 26 1.566 -6.126 -1.359
207 HA LEU 26 HA LEU 26 0.055 -5.846 1.153
208 1HB LEU 26 1HB LEU 26 2.550 -4.488 0.164
209 2HB LEU 26 2HB LEU 26 1.597 -3.823 1.475
210 HG LEU 26 HG LEU 26 1.940 -6.000 2.702
211 1HD1 LEU 26 1HD1 LEU 26 3.848 -7.380 1.982
212 2HD1 LEU 26 2HD1 LEU 26 3.935 -6.448 0.488
213 3HD1 LEU 26 3HD1 LEU 26 2.510 -7.426 0.834
214 1HD2 LEU 26 1HD2 LEU 26 4.376 -4.373 1.988
215 2HD2 LEU 26 2HD2 LEU 26 4.228 -5.435 3.388
216 3HD2 LEU 26 3HD2 LEU 26 3.206 -4.004 3.253
217 H TYR 27 H TYR 27 -0.658 -3.522 1.564
218 HA TYR 27 HA TYR 27 -1.789 -2.451 -0.931
219 1HB TYR 27 1HB TYR 27 -3.120 -3.384 1.320
220 2HB TYR 27 2HB TYR 27 -3.162 -1.633 1.499
221 HD1 TYR 27 1HD TYR 27 -3.559 -4.094 -1.285
222 HD2 TYR 27 2HD TYR 27 -5.075 -0.636 0.677
223 HE1 TYR 27 1HE TYR 27 -5.411 -3.994 -2.903
224 HE2 TYR 27 2HE TYR 27 -6.931 -0.528 -0.933
225 HH TYR 27 HH TYR 27 -7.457 -1.285 -3.190
226 H CYS 28 H CYS 28 -1.304 -0.442 -1.477
227 HA CYS 28 HA CYS 28 -0.071 1.304 0.554
228 1HB CYS 28 1HB CYS 28 1.466 0.451 -1.255
229 2HB CYS 28 2HB CYS 28 0.488 1.340 -2.416
230 H CYS 29 H CYS 29 -0.959 3.289 0.835
231 HA CYS 29 HA CYS 29 -2.573 4.481 -1.250
232 1HB CYS 29 1HB CYS 29 -3.899 2.827 0.445
233 2HB CYS 29 2HB CYS 29 -4.034 4.353 1.312
234 HA PRO 30 HA PRO 30 -0.938 8.030 0.901
235 1HB PRO 30 1HB PRO 30 -1.836 9.947 -0.727
236 2HB PRO 30 2HB PRO 30 -0.605 8.798 -1.263
237 1HG PRO 30 1HG PRO 30 -3.528 8.863 -1.865
238 2HG PRO 30 2HG PRO 30 -2.174 8.437 -2.924
239 1HD PRO 30 1HD PRO 30 -3.818 6.625 -1.596
240 2HD PRO 30 2HD PRO 30 -2.216 6.261 -2.264
241 H ARG 31 H ARG 31 -1.799 8.623 2.806
242 HA ARG 31 HA ARG 31 -4.621 9.433 2.897
243 1HB ARG 31 1HB ARG 31 -4.494 9.056 5.305
244 2HB ARG 31 2HB ARG 31 -3.981 7.623 4.425
245 1HG ARG 31 1HG ARG 31 -1.652 8.171 4.846
246 2HG ARG 31 2HG ARG 31 -2.139 9.646 5.684
247 1HD ARG 31 1HD ARG 31 -3.351 8.280 7.334
248 2HD ARG 31 2HD ARG 31 -2.804 6.822 6.510
249 HE ARG 31 HE ARG 31 -0.598 8.447 7.227
250 1HH1 ARG 31 1HH1 ARG 31 -2.972 6.286 8.587
251 2HH1 ARG 31 2HH1 ARG 31 -1.960 5.800 9.906
252 1HH2 ARG 31 1HH2 ARG 31 0.737 7.814 8.959
253 2HH2 ARG 31 2HH2 ARG 31 0.148 6.670 10.118
254 H ARG 32 H ARG 32 -2.051 10.986 2.148
255 HA ARG 32 HA ARG 32 -2.889 13.459 3.330
256 1HB ARG 32 1HB ARG 32 -1.510 12.561 5.155
257 2HB ARG 32 2HB ARG 32 -0.160 12.367 4.046
258 1HG ARG 32 1HG ARG 32 -0.054 14.776 3.728
259 2HG ARG 32 2HG ARG 32 -1.438 14.986 4.804
260 1HD ARG 32 1HD ARG 32 -0.176 14.059 6.654
261 2HD ARG 32 2HD ARG 32 1.191 13.735 5.590
262 HE ARG 32 HE ARG 32 0.349 16.504 5.757
263 1HH1 ARG 32 1HH1 ARG 32 2.488 14.012 6.917
264 2HH1 ARG 32 2HH1 ARG 32 3.663 15.126 7.531
265 1HH2 ARG 32 1HH2 ARG 32 1.892 17.981 6.564
266 2HH2 ARG 32 2HH2 ARG 32 3.326 17.381 7.328
Start of MODEL 8
1 1H GLY 1 1H GLY 1 -10.562 11.804 -4.918
2 2H GLY 1 2H GLY 1 -9.856 11.404 -3.434
3 3H GLY 1 3H GLY 1 -10.173 10.194 -4.572
4 1HA GLY 1 1HA GLY 1 -8.560 11.143 -6.092
5 2HA GLY 1 2HA GLY 1 -8.241 12.420 -4.928
6 H LEU 2 H LEU 2 -8.687 10.122 -2.848
7 HA LEU 2 HA LEU 2 -5.873 9.286 -2.881
8 1HB LEU 2 1HB LEU 2 -7.857 9.212 -0.605
9 2HB LEU 2 2HB LEU 2 -6.145 8.845 -0.499
10 HG LEU 2 HG LEU 2 -7.293 11.553 -1.192
11 1HD1 LEU 2 1HD1 LEU 2 -6.029 10.577 1.366
12 2HD1 LEU 2 2HD1 LEU 2 -7.744 10.914 1.128
13 3HD1 LEU 2 3HD1 LEU 2 -6.566 12.223 1.029
14 1HD2 LEU 2 1HD2 LEU 2 -5.108 11.174 -2.201
15 2HD2 LEU 2 2HD2 LEU 2 -4.458 10.677 -0.639
16 3HD2 LEU 2 3HD2 LEU 2 -4.993 12.340 -0.883
17 H LEU 3 H LEU 3 -6.470 7.677 -4.541
18 HA LEU 3 HA LEU 3 -8.023 5.399 -3.601
19 1HB LEU 3 1HB LEU 3 -6.642 5.894 -6.241
20 2HB LEU 3 2HB LEU 3 -7.667 4.518 -5.879
21 HG LEU 3 HG LEU 3 -8.619 7.382 -5.842
22 1HD1 LEU 3 1HD1 LEU 3 -9.678 6.897 -7.978
23 2HD1 LEU 3 2HD1 LEU 3 -8.946 5.293 -7.990
24 3HD1 LEU 3 3HD1 LEU 3 -7.927 6.727 -8.093
25 1HD2 LEU 3 1HD2 LEU 3 -10.836 6.400 -5.813
26 2HD2 LEU 3 2HD2 LEU 3 -9.899 5.821 -4.436
27 3HD2 LEU 3 3HD2 LEU 3 -10.143 4.779 -5.838
28 H CYS 4 H CYS 4 -7.201 3.322 -3.331
29 HA CYS 4 HA CYS 4 -4.352 3.233 -2.710
30 1HB CYS 4 1HB CYS 4 -6.431 1.105 -2.188
31 2HB CYS 4 2HB CYS 4 -4.833 1.236 -1.463
32 H TYR 5 H TYR 5 -3.159 1.195 -3.256
33 HA TYR 5 HA TYR 5 -4.041 -0.089 -5.726
34 1HB TYR 5 1HB TYR 5 -1.377 1.316 -5.435
35 2HB TYR 5 2HB TYR 5 -1.842 0.297 -6.793
36 HD1 TYR 5 1HD TYR 5 -2.142 3.572 -5.257
37 HD2 TYR 5 2HD TYR 5 -3.608 1.052 -8.355
38 HE1 TYR 5 1HE TYR 5 -3.114 5.531 -6.382
39 HE2 TYR 5 2HE TYR 5 -4.583 3.004 -9.489
40 HH TYR 5 HH TYR 5 -5.328 5.259 -8.962
41 H CYS 6 H CYS 6 -3.035 -2.085 -6.160
42 HA CYS 6 HA CYS 6 -2.072 -3.442 -3.792
43 1HB CYS 6 1HB CYS 6 -3.687 -4.621 -5.122
44 2HB CYS 6 2HB CYS 6 -2.732 -4.394 -6.584
45 H ARG 7 H ARG 7 0.018 -3.085 -3.305
46 HA ARG 7 HA ARG 7 1.996 -2.972 -5.454
47 1HB ARG 7 1HB ARG 7 2.229 -2.388 -2.498
48 2HB ARG 7 2HB ARG 7 3.558 -2.267 -3.640
49 1HG ARG 7 1HG ARG 7 1.005 -0.695 -3.881
50 2HG ARG 7 2HG ARG 7 2.455 -0.105 -3.065
51 1HD ARG 7 1HD ARG 7 3.703 -0.523 -5.203
52 2HD ARG 7 2HD ARG 7 2.148 -0.842 -5.968
53 HE ARG 7 HE ARG 7 1.678 1.553 -4.981
54 1HH1 ARG 7 1HH1 ARG 7 4.537 0.358 -6.567
55 2HH1 ARG 7 2HH1 ARG 7 4.978 1.902 -7.219
56 1HH2 ARG 7 1HH2 ARG 7 2.250 3.591 -5.831
57 2HH2 ARG 7 2HH2 ARG 7 3.678 3.740 -6.800
58 H LYS 8 H LYS 8 4.127 -4.074 -5.008
59 HA LYS 8 HA LYS 8 3.752 -6.666 -3.672
60 1HB LYS 8 1HB LYS 8 3.426 -7.005 -6.070
61 2HB LYS 8 2HB LYS 8 4.965 -6.227 -6.407
62 1HG LYS 8 1HG LYS 8 6.051 -8.052 -5.047
63 2HG LYS 8 2HG LYS 8 4.486 -8.871 -5.061
64 1HD LYS 8 1HD LYS 8 4.513 -8.917 -7.494
65 2HD LYS 8 2HD LYS 8 6.043 -8.040 -7.511
66 1HE LYS 8 1HE LYS 8 6.471 -10.383 -7.863
67 2HE LYS 8 2HE LYS 8 7.086 -9.914 -6.279
68 1HZ LYS 8 1HZ LYS 8 5.916 -12.017 -6.176
69 2HZ LYS 8 2HZ LYS 8 4.513 -11.304 -6.795
70 3HZ LYS 8 3HZ LYS 8 5.093 -10.846 -5.274
71 H GLY 9 H GLY 9 5.046 -6.145 -1.935
72 1HA GLY 9 1HA GLY 9 7.316 -6.634 -1.187
73 2HA GLY 9 2HA GLY 9 7.898 -5.746 -2.586
74 H HIS 10 H HIS 10 7.547 -3.417 -2.625
75 HA HIS 10 HA HIS 10 7.017 -2.195 -0.021
76 1HB HIS 10 1HB HIS 10 9.534 -2.701 -0.436
77 2HB HIS 10 2HB HIS 10 9.453 -1.355 -1.566
78 HD1 HIS 10 1HD HIS 10 9.473 -2.164 2.060
79 HD2 HIS 10 2HD HIS 10 9.104 1.182 -0.374
80 HE1 HIS 10 1HE HIS 10 9.759 -0.187 3.588
81 HE2 HIS 10 2HE HIS 10 9.491 1.829 2.099
82 H CYS 11 H CYS 11 5.961 -0.292 -0.165
83 HA CYS 11 HA CYS 11 5.454 0.756 -2.858
84 1HB CYS 11 1HB CYS 11 3.506 0.113 -1.444
85 2HB CYS 11 2HB CYS 11 3.978 1.350 -0.286
86 H LYS 12 H LYS 12 5.031 3.206 -2.876
87 HA LYS 12 HA LYS 12 7.440 4.516 -2.214
88 1HB LYS 12 1HB LYS 12 5.817 6.596 -2.737
89 2HB LYS 12 2HB LYS 12 6.552 5.605 -3.986
90 1HG LYS 12 1HG LYS 12 4.487 4.239 -4.057
91 2HG LYS 12 2HG LYS 12 3.755 5.346 -2.897
92 1HD LYS 12 1HD LYS 12 4.848 6.174 -5.582
93 2HD LYS 12 2HD LYS 12 3.149 5.813 -5.269
94 1HE LYS 12 1HE LYS 12 3.097 7.604 -3.587
95 2HE LYS 12 2HE LYS 12 4.784 7.974 -3.941
96 1HZ LYS 12 1HZ LYS 12 3.300 9.474 -5.103
97 2HZ LYS 12 2HZ LYS 12 2.525 8.175 -5.860
98 3HZ LYS 12 3HZ LYS 12 4.144 8.515 -6.212
99 H ARG 13 H ARG 13 4.367 5.966 -1.245
100 HA ARG 13 HA ARG 13 5.320 6.007 1.530
101 1HB ARG 13 1HB ARG 13 4.022 8.420 0.293
102 2HB ARG 13 2HB ARG 13 4.926 8.308 1.794
103 1HG ARG 13 1HG ARG 13 6.584 9.211 0.601
104 2HG ARG 13 2HG ARG 13 6.817 7.567 0.003
105 1HD ARG 13 1HD ARG 13 5.399 8.048 -1.916
106 2HD ARG 13 2HD ARG 13 5.105 9.676 -1.308
107 HE ARG 13 HE ARG 13 7.885 9.185 -1.626
108 1HH1 ARG 13 1HH1 ARG 13 4.978 9.904 -3.410
109 2HH1 ARG 13 2HH1 ARG 13 5.816 10.685 -4.709
110 1HH2 ARG 13 1HH2 ARG 13 8.995 10.213 -3.332
111 2HH2 ARG 13 2HH2 ARG 13 8.099 10.862 -4.666
112 H GLY 14 H GLY 14 3.828 4.585 2.315
113 1HA GLY 14 1HA GLY 14 1.555 5.077 3.440
114 2HA GLY 14 2HA GLY 14 0.989 5.150 1.780
115 H GLU 15 H GLU 15 3.195 2.937 3.493
116 HA GLU 15 HA GLU 15 1.920 0.668 2.224
117 1HB GLU 15 1HB GLU 15 4.274 0.938 4.091
118 2HB GLU 15 2HB GLU 15 3.657 -0.621 3.563
119 1HG GLU 15 1HG GLU 15 4.237 -0.220 1.332
120 2HG GLU 15 2HG GLU 15 4.501 1.500 1.618
121 H ARG 16 H ARG 16 0.244 -0.376 3.064
122 HA ARG 16 HA ARG 16 0.030 -0.690 5.957
123 1HB ARG 16 1HB ARG 16 -2.186 0.455 4.248
124 2HB ARG 16 2HB ARG 16 -2.368 -0.051 5.922
125 1HG ARG 16 1HG ARG 16 -0.664 1.636 6.560
126 2HG ARG 16 2HG ARG 16 -0.654 2.195 4.887
127 1HD ARG 16 1HD ARG 16 -3.024 2.176 6.752
128 2HD ARG 16 2HD ARG 16 -2.100 3.593 6.257
129 HE ARG 16 HE ARG 16 -2.992 2.421 3.927
130 1HH1 ARG 16 1HH1 ARG 16 -4.435 3.775 6.798
131 2HH1 ARG 16 2HH1 ARG 16 -5.875 4.293 5.985
132 1HH2 ARG 16 1HH2 ARG 16 -4.884 3.098 2.851
133 2HH2 ARG 16 2HH2 ARG 16 -6.129 3.908 3.742
134 H VAL 17 H VAL 17 -1.922 -2.149 6.475
135 HA VAL 17 HA VAL 17 -2.287 -4.154 4.367
136 HB VAL 17 HB VAL 17 -0.515 -4.876 5.980
137 1HG1 VAL 17 1HG1 VAL 17 -2.792 -5.000 7.951
138 2HG1 VAL 17 2HG1 VAL 17 -1.452 -3.854 7.995
139 3HG1 VAL 17 3HG1 VAL 17 -1.147 -5.577 8.218
140 1HG2 VAL 17 1HG2 VAL 17 -1.352 -7.140 6.247
141 2HG2 VAL 17 2HG2 VAL 17 -1.819 -6.493 4.675
142 3HG2 VAL 17 3HG2 VAL 17 -3.003 -6.582 5.979
143 H ARG 18 H ARG 18 -4.056 -2.115 5.076
144 HA ARG 18 HA ARG 18 -6.062 -2.959 6.891
145 1HB ARG 18 1HB ARG 18 -5.842 -0.620 6.165
146 2HB ARG 18 2HB ARG 18 -6.264 -1.083 4.523
147 1HG ARG 18 1HG ARG 18 -8.180 -0.103 5.562
148 2HG ARG 18 2HG ARG 18 -8.477 -1.830 5.355
149 1HD ARG 18 1HD ARG 18 -7.897 -2.217 7.693
150 2HD ARG 18 2HD ARG 18 -7.568 -0.497 7.903
151 HE ARG 18 HE ARG 18 -10.200 -0.891 6.941
152 1HH1 ARG 18 1HH1 ARG 18 -8.260 -1.201 9.820
153 2HH1 ARG 18 2HH1 ARG 18 -9.596 -0.987 10.899
154 1HH2 ARG 18 1HH2 ARG 18 -11.966 -0.609 8.357
155 2HH2 ARG 18 2HH2 ARG 18 -11.703 -0.653 10.068
156 H GLY 19 H GLY 19 -5.395 -3.586 3.542
157 1HA GLY 19 1HA GLY 19 -7.444 -5.669 3.530
158 2HA GLY 19 2HA GLY 19 -7.551 -4.428 2.287
159 H THR 20 H THR 20 -5.432 -6.912 3.639
160 HA THR 20 HA THR 20 -3.309 -6.934 1.971
161 HB THR 20 HB THR 20 -3.501 -8.555 3.750
162 HG1 THR 20 1HG THR 20 -3.406 -10.090 1.370
163 1HG2 THR 20 1HG2 THR 20 -5.617 -9.888 2.058
164 2HG2 THR 20 2HG2 THR 20 -5.891 -9.039 3.578
165 3HG2 THR 20 3HG2 THR 20 -4.945 -10.526 3.558
166 H CYS 21 H CYS 21 -2.831 -7.370 -0.084
167 HA CYS 21 HA CYS 21 -5.028 -7.803 -1.937
168 1HB CYS 21 1HB CYS 21 -3.455 -6.014 -2.427
169 2HB CYS 21 2HB CYS 21 -2.110 -7.146 -2.388
170 H GLY 22 H GLY 22 -2.595 -9.618 -0.399
171 1HA GLY 22 1HA GLY 22 -3.427 -12.062 -1.500
172 2HA GLY 22 2HA GLY 22 -1.986 -11.539 -2.359
173 H ILE 23 H ILE 23 -0.590 -13.084 -1.624
174 HA ILE 23 HA ILE 23 -0.286 -13.438 1.265
175 HB ILE 23 HB ILE 23 1.163 -14.925 -0.926
176 1HG1 ILE 23 1HG1 ILE 23 -1.241 -15.255 -1.208
177 2HG1 ILE 23 2HG1 ILE 23 -0.492 -16.726 -0.598
178 1HG2 ILE 23 1HG2 ILE 23 1.505 -16.614 0.830
179 2HG2 ILE 23 2HG2 ILE 23 0.713 -15.547 1.989
180 3HG2 ILE 23 3HG2 ILE 23 2.234 -15.061 1.240
181 1HD1 ILE 23 1HD1 ILE 23 -2.609 -16.316 0.496
182 2HD1 ILE 23 2HD1 ILE 23 -2.053 -14.727 1.023
183 3HD1 ILE 23 3HD1 ILE 23 -1.283 -16.184 1.652
184 H ARG 24 H ARG 24 1.581 -12.536 -1.601
185 HA ARG 24 HA ARG 24 3.733 -11.548 0.141
186 1HB ARG 24 1HB ARG 24 5.128 -11.562 -1.901
187 2HB ARG 24 2HB ARG 24 4.482 -13.152 -1.519
188 1HG ARG 24 1HG ARG 24 2.634 -12.626 -3.187
189 2HG ARG 24 2HG ARG 24 3.643 -11.272 -3.701
190 1HD ARG 24 1HD ARG 24 5.450 -12.785 -4.250
191 2HD ARG 24 2HD ARG 24 4.524 -14.156 -3.640
192 HE ARG 24 HE ARG 24 3.130 -12.764 -5.700
193 1HH1 ARG 24 1HH1 ARG 24 5.673 -15.075 -5.117
194 2HH1 ARG 24 2HH1 ARG 24 5.498 -15.848 -6.657
195 1HH2 ARG 24 1HH2 ARG 24 2.895 -13.777 -7.729
196 2HH2 ARG 24 2HH2 ARG 24 3.921 -15.109 -8.142
197 H PHE 25 H PHE 25 1.026 -10.449 -1.272
198 HA PHE 25 HA PHE 25 2.150 -7.903 -2.182
199 1HB PHE 25 1HB PHE 25 -0.700 -8.904 -2.347
200 2HB PHE 25 2HB PHE 25 -0.063 -7.450 -3.104
201 HD1 PHE 25 1HD PHE 25 1.403 -7.597 -5.046
202 HD2 PHE 25 2HD PHE 25 -0.282 -11.077 -3.268
203 HE1 PHE 25 1HE PHE 25 1.966 -8.893 -7.060
204 HE2 PHE 25 2HE PHE 25 0.279 -12.380 -5.279
205 HZ PHE 25 HZ PHE 25 1.404 -11.288 -7.178
206 H LEU 26 H LEU 26 0.591 -5.983 -1.640
207 HA LEU 26 HA LEU 26 -0.595 -6.087 0.988
208 1HB LEU 26 1HB LEU 26 0.816 -4.441 2.023
209 2HB LEU 26 2HB LEU 26 1.804 -5.789 1.497
210 HG LEU 26 HG LEU 26 1.545 -3.240 -0.090
211 1HD1 LEU 26 1HD1 LEU 26 3.660 -3.981 1.926
212 2HD1 LEU 26 2HD1 LEU 26 2.444 -2.718 2.118
213 3HD1 LEU 26 3HD1 LEU 26 3.682 -2.567 0.871
214 1HD2 LEU 26 1HD2 LEU 26 3.516 -5.521 -0.143
215 2HD2 LEU 26 2HD2 LEU 26 3.671 -4.033 -1.076
216 3HD2 LEU 26 3HD2 LEU 26 2.322 -5.127 -1.378
217 H TYR 27 H TYR 27 -1.315 -3.774 1.635
218 HA TYR 27 HA TYR 27 -2.397 -2.537 -0.803
219 1HB TYR 27 1HB TYR 27 -3.700 -3.478 1.458
220 2HB TYR 27 2HB TYR 27 -3.670 -1.734 1.687
221 HD1 TYR 27 1HD TYR 27 -4.211 -4.063 -1.187
222 HD2 TYR 27 2HD TYR 27 -5.595 -0.675 0.983
223 HE1 TYR 27 1HE TYR 27 -6.099 -3.843 -2.745
224 HE2 TYR 27 2HE TYR 27 -7.487 -0.447 -0.569
225 HH TYR 27 HH TYR 27 -8.093 -1.083 -2.843
226 H CYS 28 H CYS 28 -1.809 -0.557 -1.335
227 HA CYS 28 HA CYS 28 -0.533 1.125 0.721
228 1HB CYS 28 1HB CYS 28 1.132 0.256 -0.854
229 2HB CYS 28 2HB CYS 28 0.205 0.897 -2.205
230 H CYS 29 H CYS 29 -1.156 3.224 0.844
231 HA CYS 29 HA CYS 29 -2.797 4.362 -1.280
232 1HB CYS 29 1HB CYS 29 -4.001 3.213 0.935
233 2HB CYS 29 2HB CYS 29 -3.943 4.925 1.346
234 HA PRO 30 HA PRO 30 -0.426 7.969 -0.301
235 1HB PRO 30 1HB PRO 30 -2.165 9.915 -1.122
236 2HB PRO 30 2HB PRO 30 -1.174 8.955 -2.226
237 1HG PRO 30 1HG PRO 30 -4.047 8.601 -1.463
238 2HG PRO 30 2HG PRO 30 -3.289 8.471 -3.060
239 1HD PRO 30 1HD PRO 30 -3.923 6.296 -1.613
240 2HD PRO 30 2HD PRO 30 -2.477 6.344 -2.642
241 H ARG 31 H ARG 31 -0.408 7.831 1.960
242 HA ARG 31 HA ARG 31 -2.602 8.680 3.574
243 1HB ARG 31 1HB ARG 31 -0.969 8.557 5.434
244 2HB ARG 31 2HB ARG 31 -0.997 7.097 4.455
245 1HG ARG 31 1HG ARG 31 1.011 7.913 3.260
246 2HG ARG 31 2HG ARG 31 1.060 9.294 4.357
247 1HD ARG 31 1HD ARG 31 1.254 6.389 5.150
248 2HD ARG 31 2HD ARG 31 2.597 7.529 5.067
249 HE ARG 31 HE ARG 31 0.553 8.492 6.782
250 1HH1 ARG 31 1HH1 ARG 31 3.153 6.179 6.611
251 2HH1 ARG 31 2HH1 ARG 31 3.424 6.164 8.322
252 1HH2 ARG 31 1HH2 ARG 31 0.902 8.480 9.035
253 2HH2 ARG 31 2HH2 ARG 31 2.144 7.472 9.700
254 H ARG 32 H ARG 32 -0.037 10.289 1.953
255 HA ARG 32 HA ARG 32 -0.023 12.635 3.610
256 1HB ARG 32 1HB ARG 32 1.088 12.175 0.835
257 2HB ARG 32 2HB ARG 32 1.392 13.598 1.822
258 1HG ARG 32 1HG ARG 32 2.147 10.792 2.608
259 2HG ARG 32 2HG ARG 32 3.236 11.948 1.839
260 1HD ARG 32 1HD ARG 32 2.910 13.485 3.730
261 2HD ARG 32 2HD ARG 32 1.857 12.299 4.499
262 HE ARG 32 HE ARG 32 4.406 11.190 3.897
263 1HH1 ARG 32 1HH1 ARG 32 2.734 13.258 6.148
264 2HH1 ARG 32 2HH1 ARG 32 3.829 12.940 7.453
265 1HH2 ARG 32 1HH2 ARG 32 5.853 10.767 5.610
266 2HH2 ARG 32 2HH2 ARG 32 5.600 11.525 7.146
Start of MODEL 9
1 1H GLY 1 1H GLY 1 -4.460 11.610 -2.417
2 2H GLY 1 2H GLY 1 -2.918 12.150 -2.857
3 3H GLY 1 3H GLY 1 -3.357 10.539 -3.127
4 1HA GLY 1 1HA GLY 1 -4.477 12.935 -4.475
5 2HA GLY 1 2HA GLY 1 -3.434 11.720 -5.200
6 H LEU 2 H LEU 2 -4.293 9.476 -5.240
7 HA LEU 2 HA LEU 2 -7.195 9.535 -5.732
8 1HB LEU 2 1HB LEU 2 -5.012 7.859 -6.960
9 2HB LEU 2 2HB LEU 2 -6.716 7.516 -7.180
10 HG LEU 2 HG LEU 2 -6.939 9.852 -8.148
11 1HD1 LEU 2 1HD1 LEU 2 -3.932 9.637 -8.205
12 2HD1 LEU 2 2HD1 LEU 2 -4.880 10.804 -7.284
13 3HD1 LEU 2 3HD1 LEU 2 -4.891 10.856 -9.045
14 1HD2 LEU 2 1HD2 LEU 2 -5.176 7.875 -9.589
15 2HD2 LEU 2 2HD2 LEU 2 -6.119 9.162 -10.339
16 3HD2 LEU 2 3HD2 LEU 2 -6.938 7.831 -9.520
17 H LEU 3 H LEU 3 -7.691 6.832 -5.884
18 HA LEU 3 HA LEU 3 -7.993 6.145 -3.157
19 1HB LEU 3 1HB LEU 3 -8.310 4.434 -5.626
20 2HB LEU 3 2HB LEU 3 -8.865 3.999 -4.021
21 HG LEU 3 HG LEU 3 -9.866 6.379 -5.586
22 1HD1 LEU 3 1HD1 LEU 3 -11.904 5.065 -5.904
23 2HD1 LEU 3 2HD1 LEU 3 -11.131 3.681 -5.132
24 3HD1 LEU 3 3HD1 LEU 3 -10.511 4.297 -6.664
25 1HD2 LEU 3 1HD2 LEU 3 -11.629 6.430 -3.883
26 2HD2 LEU 3 2HD2 LEU 3 -10.032 6.678 -3.178
27 3HD2 LEU 3 3HD2 LEU 3 -10.830 5.114 -3.023
28 H CYS 4 H CYS 4 -7.425 3.632 -2.662
29 HA CYS 4 HA CYS 4 -4.618 3.612 -2.253
30 1HB CYS 4 1HB CYS 4 -6.473 1.248 -1.970
31 2HB CYS 4 2HB CYS 4 -4.958 1.535 -1.123
32 H TYR 5 H TYR 5 -3.458 1.360 -2.753
33 HA TYR 5 HA TYR 5 -4.038 0.467 -5.468
34 1HB TYR 5 1HB TYR 5 -1.401 1.697 -4.652
35 2HB TYR 5 2HB TYR 5 -1.656 0.798 -6.144
36 HD1 TYR 5 1HD TYR 5 -1.731 3.996 -4.625
37 HD2 TYR 5 2HD TYR 5 -3.536 1.684 -7.706
38 HE1 TYR 5 1HE TYR 5 -2.468 6.064 -5.737
39 HE2 TYR 5 2HE TYR 5 -4.278 3.744 -8.827
40 HH TYR 5 HH TYR 5 -3.105 6.811 -8.001
41 H CYS 6 H CYS 6 -3.226 -1.553 -5.982
42 HA CYS 6 HA CYS 6 -2.319 -3.137 -3.691
43 1HB CYS 6 1HB CYS 6 -4.242 -4.067 -4.769
44 2HB CYS 6 2HB CYS 6 -3.518 -3.884 -6.362
45 H ARG 7 H ARG 7 -0.165 -3.154 -3.495
46 HA ARG 7 HA ARG 7 1.439 -3.535 -5.939
47 1HB ARG 7 1HB ARG 7 2.043 -2.035 -3.401
48 2HB ARG 7 2HB ARG 7 3.317 -2.539 -4.503
49 1HG ARG 7 1HG ARG 7 2.362 -1.222 -6.282
50 2HG ARG 7 2HG ARG 7 0.984 -0.795 -5.265
51 1HD ARG 7 1HD ARG 7 2.391 0.444 -3.774
52 2HD ARG 7 2HD ARG 7 3.843 -0.123 -4.595
53 HE ARG 7 HE ARG 7 3.341 1.306 -6.410
54 1HH1 ARG 7 1HH1 ARG 7 1.106 1.627 -3.752
55 2HH1 ARG 7 2HH1 ARG 7 0.522 3.174 -4.264
56 1HH2 ARG 7 1HH2 ARG 7 2.577 3.342 -7.087
57 2HH2 ARG 7 2HH2 ARG 7 1.357 4.149 -6.160
58 H LYS 8 H LYS 8 3.790 -4.343 -5.072
59 HA LYS 8 HA LYS 8 3.337 -6.626 -3.281
60 1HB LYS 8 1HB LYS 8 3.144 -7.412 -5.611
61 2HB LYS 8 2HB LYS 8 4.744 -6.770 -5.953
62 1HG LYS 8 1HG LYS 8 5.726 -8.327 -4.360
63 2HG LYS 8 2HG LYS 8 4.122 -8.957 -3.979
64 1HD LYS 8 1HD LYS 8 5.164 -10.459 -5.526
65 2HD LYS 8 2HD LYS 8 3.882 -9.597 -6.379
66 1HE LYS 8 1HE LYS 8 5.853 -9.724 -7.774
67 2HE LYS 8 2HE LYS 8 5.568 -8.051 -7.296
68 1HZ LYS 8 1HZ LYS 8 7.910 -8.676 -7.130
69 2HZ LYS 8 2HZ LYS 8 7.520 -9.882 -6.011
70 3HZ LYS 8 3HZ LYS 8 7.274 -8.256 -5.620
71 H GLY 9 H GLY 9 4.848 -6.794 -1.759
72 1HA GLY 9 1HA GLY 9 7.083 -6.894 -0.977
73 2HA GLY 9 2HA GLY 9 7.573 -5.876 -2.323
74 H HIS 10 H HIS 10 7.538 -3.670 -2.112
75 HA HIS 10 HA HIS 10 6.516 -2.533 0.387
76 1HB HIS 10 1HB HIS 10 9.020 -3.129 0.513
77 2HB HIS 10 2HB HIS 10 9.260 -1.801 -0.617
78 HD1 HIS 10 1HD HIS 10 8.414 -2.540 2.936
79 HD2 HIS 10 2HD HIS 10 8.882 0.772 0.468
80 HE1 HIS 10 1HE HIS 10 8.515 -0.559 4.481
81 HE2 HIS 10 2HE HIS 10 8.758 1.439 2.964
82 H CYS 11 H CYS 11 5.449 -0.678 0.050
83 HA CYS 11 HA CYS 11 5.339 0.415 -2.616
84 1HB CYS 11 1HB CYS 11 3.313 0.184 -1.196
85 2HB CYS 11 2HB CYS 11 3.974 1.392 -0.100
86 H LYS 12 H LYS 12 5.497 2.766 -2.993
87 HA LYS 12 HA LYS 12 7.998 3.749 -1.961
88 1HB LYS 12 1HB LYS 12 7.712 5.562 -3.578
89 2HB LYS 12 2HB LYS 12 7.465 3.994 -4.332
90 1HG LYS 12 1HG LYS 12 5.017 4.331 -4.108
91 2HG LYS 12 2HG LYS 12 5.340 5.954 -3.497
92 1HD LYS 12 1HD LYS 12 4.986 6.391 -5.727
93 2HD LYS 12 2HD LYS 12 6.737 6.177 -5.702
94 1HE LYS 12 1HE LYS 12 4.706 4.076 -6.447
95 2HE LYS 12 2HE LYS 12 5.711 4.984 -7.575
96 1HZ LYS 12 1HZ LYS 12 7.673 3.998 -6.529
97 2HZ LYS 12 2HZ LYS 12 6.647 2.812 -7.164
98 3HZ LYS 12 3HZ LYS 12 6.681 3.095 -5.497
99 H ARG 13 H ARG 13 4.647 4.281 -1.326
100 HA ARG 13 HA ARG 13 5.199 5.819 0.975
101 1HB ARG 13 1HB ARG 13 4.202 7.955 0.279
102 2HB ARG 13 2HB ARG 13 5.670 7.595 -0.610
103 1HG ARG 13 1HG ARG 13 4.276 6.795 -2.495
104 2HG ARG 13 2HG ARG 13 2.844 7.309 -1.606
105 1HD ARG 13 1HD ARG 13 3.523 8.989 -3.241
106 2HD ARG 13 2HD ARG 13 3.659 9.605 -1.596
107 HE ARG 13 HE ARG 13 6.142 8.579 -2.281
108 1HH1 ARG 13 1HH1 ARG 13 4.009 11.115 -3.361
109 2HH1 ARG 13 2HH1 ARG 13 5.294 12.135 -3.916
110 1HH2 ARG 13 1HH2 ARG 13 7.839 9.915 -3.011
111 2HH2 ARG 13 2HH2 ARG 13 7.472 11.452 -3.717
112 H GLY 14 H GLY 14 3.697 5.061 2.299
113 1HA GLY 14 1HA GLY 14 1.374 5.197 2.992
114 2HA GLY 14 2HA GLY 14 0.919 4.923 1.318
115 H GLU 15 H GLU 15 3.483 3.082 2.788
116 HA GLU 15 HA GLU 15 2.382 0.603 2.111
117 1HB GLU 15 1HB GLU 15 4.394 1.179 4.296
118 2HB GLU 15 2HB GLU 15 4.111 -0.380 3.536
119 1HG GLU 15 1HG GLU 15 6.020 0.391 2.488
120 2HG GLU 15 2HG GLU 15 4.741 0.804 1.346
121 H ARG 16 H ARG 16 0.639 -0.363 2.909
122 HA ARG 16 HA ARG 16 0.157 -0.283 5.794
123 1HB ARG 16 1HB ARG 16 -1.894 0.421 3.692
124 2HB ARG 16 2HB ARG 16 -2.278 0.104 5.379
125 1HG ARG 16 1HG ARG 16 -0.986 2.008 6.083
126 2HG ARG 16 2HG ARG 16 -0.430 2.283 4.431
127 1HD ARG 16 1HD ARG 16 -2.228 3.822 5.030
128 2HD ARG 16 2HD ARG 16 -2.719 2.741 3.727
129 HE ARG 16 HE ARG 16 -3.521 1.591 6.137
130 1HH1 ARG 16 1HH1 ARG 16 -4.218 4.406 4.207
131 2HH1 ARG 16 2HH1 ARG 16 -5.857 4.534 4.752
132 1HH2 ARG 16 1HH2 ARG 16 -5.679 1.753 6.862
133 2HH2 ARG 16 2HH2 ARG 16 -6.687 3.027 6.261
134 H VAL 17 H VAL 17 -1.236 -1.961 6.577
135 HA VAL 17 HA VAL 17 -1.675 -4.181 4.704
136 HB VAL 17 HB VAL 17 -0.633 -4.677 7.485
137 1HG1 VAL 17 1HG1 VAL 17 -1.739 -6.539 6.372
138 2HG1 VAL 17 2HG1 VAL 17 -0.012 -6.851 6.540
139 3HG1 VAL 17 3HG1 VAL 17 -0.671 -6.359 4.981
140 1HG2 VAL 17 1HG2 VAL 17 1.048 -3.328 6.373
141 2HG2 VAL 17 2HG2 VAL 17 0.998 -4.388 4.964
142 3HG2 VAL 17 3HG2 VAL 17 1.601 -4.998 6.505
143 H ARG 18 H ARG 18 -3.657 -2.465 5.462
144 HA ARG 18 HA ARG 18 -5.114 -3.693 7.672
145 1HB ARG 18 1HB ARG 18 -5.031 -1.200 7.379
146 2HB ARG 18 2HB ARG 18 -5.961 -1.394 5.900
147 1HG ARG 18 1HG ARG 18 -7.832 -2.268 7.123
148 2HG ARG 18 2HG ARG 18 -6.898 -2.278 8.620
149 1HD ARG 18 1HD ARG 18 -6.678 0.181 8.448
150 2HD ARG 18 2HD ARG 18 -7.711 0.146 7.021
151 HE ARG 18 HE ARG 18 -9.326 -1.006 8.729
152 1HH1 ARG 18 1HH1 ARG 18 -7.200 1.699 9.278
153 2HH1 ARG 18 2HH1 ARG 18 -8.204 2.405 10.500
154 1HH2 ARG 18 1HH2 ARG 18 -10.652 -0.086 10.340
155 2HH2 ARG 18 2HH2 ARG 18 -10.165 1.391 11.104
156 H GLY 19 H GLY 19 -4.913 -3.750 4.264
157 1HA GLY 19 1HA GLY 19 -7.077 -5.716 4.151
158 2HA GLY 19 2HA GLY 19 -7.192 -4.315 3.093
159 H THR 20 H THR 20 -5.048 -6.991 3.979
160 HA THR 20 HA THR 20 -3.130 -6.870 2.060
161 HB THR 20 HB THR 20 -2.920 -9.304 2.183
162 HG1 THR 20 1HG THR 20 -5.319 -9.592 2.220
163 1HG2 THR 20 1HG2 THR 20 -3.647 -8.103 4.858
164 2HG2 THR 20 2HG2 THR 20 -2.087 -7.936 4.052
165 3HG2 THR 20 3HG2 THR 20 -2.634 -9.523 4.594
166 H CYS 21 H CYS 21 -2.909 -7.240 -0.057
167 HA CYS 21 HA CYS 21 -5.346 -7.668 -1.611
168 1HB CYS 21 1HB CYS 21 -3.970 -5.713 -2.152
169 2HB CYS 21 2HB CYS 21 -2.587 -6.756 -2.455
170 H GLY 22 H GLY 22 -2.593 -9.351 -0.553
171 1HA GLY 22 1HA GLY 22 -3.379 -11.761 -1.821
172 2HA GLY 22 2HA GLY 22 -2.006 -11.063 -2.667
173 H ILE 23 H ILE 23 -0.780 -12.927 -2.069
174 HA ILE 23 HA ILE 23 -0.276 -13.453 0.724
175 HB ILE 23 HB ILE 23 1.151 -14.555 -1.699
176 1HG1 ILE 23 1HG1 ILE 23 -1.242 -15.090 -1.759
177 2HG1 ILE 23 2HG1 ILE 23 -0.288 -16.531 -1.423
178 1HG2 ILE 23 1HG2 ILE 23 2.458 -14.781 0.327
179 2HG2 ILE 23 2HG2 ILE 23 1.845 -16.356 -0.177
180 3HG2 ILE 23 3HG2 ILE 23 1.081 -15.500 1.163
181 1HD1 ILE 23 1HD1 ILE 23 -2.279 -16.484 -0.058
182 2HD1 ILE 23 2HD1 ILE 23 -1.827 -14.908 0.590
183 3HD1 ILE 23 3HD1 ILE 23 -0.844 -16.327 0.954
184 H ARG 24 H ARG 24 1.820 -12.523 -2.011
185 HA ARG 24 HA ARG 24 3.748 -11.416 -0.114
186 1HB ARG 24 1HB ARG 24 5.281 -11.293 -2.023
187 2HB ARG 24 2HB ARG 24 4.630 -12.914 -1.837
188 1HG ARG 24 1HG ARG 24 3.300 -11.017 -3.712
189 2HG ARG 24 2HG ARG 24 4.801 -11.810 -4.193
190 1HD ARG 24 1HD ARG 24 2.280 -13.195 -3.280
191 2HD ARG 24 2HD ARG 24 2.839 -13.061 -4.946
192 HE ARG 24 HE ARG 24 4.894 -14.228 -3.501
193 1HH1 ARG 24 1HH1 ARG 24 1.597 -14.968 -4.350
194 2HH1 ARG 24 2HH1 ARG 24 1.843 -16.683 -4.338
195 1HH2 ARG 24 1HH2 ARG 24 5.228 -16.482 -3.482
196 2HH2 ARG 24 2HH2 ARG 24 3.908 -17.544 -3.840
197 H PHE 25 H PHE 25 1.086 -10.369 -1.653
198 HA PHE 25 HA PHE 25 2.093 -7.781 -2.509
199 1HB PHE 25 1HB PHE 25 -0.695 -8.954 -2.493
200 2HB PHE 25 2HB PHE 25 -0.294 -7.356 -3.113
201 HD1 PHE 25 1HD PHE 25 0.285 -10.974 -3.600
202 HD2 PHE 25 2HD PHE 25 0.570 -7.075 -5.278
203 HE1 PHE 25 1HE PHE 25 0.800 -11.961 -5.794
204 HE2 PHE 25 2HE PHE 25 1.084 -8.053 -7.476
205 HZ PHE 25 HZ PHE 25 1.199 -10.500 -7.736
206 H LEU 26 H LEU 26 0.434 -5.919 -1.836
207 HA LEU 26 HA LEU 26 -0.480 -6.031 0.877
208 1HB LEU 26 1HB LEU 26 1.014 -4.437 1.849
209 2HB LEU 26 2HB LEU 26 1.966 -5.750 1.186
210 HG LEU 26 HG LEU 26 1.548 -3.151 -0.277
211 1HD1 LEU 26 1HD1 LEU 26 2.604 -2.677 1.868
212 2HD1 LEU 26 2HD1 LEU 26 3.748 -2.478 0.541
213 3HD1 LEU 26 3HD1 LEU 26 3.816 -3.919 1.555
214 1HD2 LEU 26 1HD2 LEU 26 3.570 -3.862 -1.480
215 2HD2 LEU 26 2HD2 LEU 26 2.255 -5.023 -1.658
216 3HD2 LEU 26 3HD2 LEU 26 3.585 -5.361 -0.552
217 H TYR 27 H TYR 27 -1.058 -3.677 1.614
218 HA TYR 27 HA TYR 27 -2.352 -2.410 -0.704
219 1HB TYR 27 1HB TYR 27 -3.474 -3.384 1.633
220 2HB TYR 27 2HB TYR 27 -3.396 -1.648 1.908
221 HD1 TYR 27 1HD TYR 27 -5.356 -0.535 1.394
222 HD2 TYR 27 2HD TYR 27 -4.221 -3.889 -0.966
223 HE1 TYR 27 1HE TYR 27 -7.368 -0.239 0.016
224 HE2 TYR 27 2HE TYR 27 -6.229 -3.598 -2.354
225 HH TYR 27 HH TYR 27 -8.135 -0.813 -2.275
226 H CYS 28 H CYS 28 -1.753 -0.436 -1.264
227 HA CYS 28 HA CYS 28 -0.323 1.205 0.721
228 1HB CYS 28 1HB CYS 28 1.238 0.389 -0.970
229 2HB CYS 28 2HB CYS 28 0.208 1.022 -2.251
230 H CYS 29 H CYS 29 -1.641 2.783 1.315
231 HA CYS 29 HA CYS 29 -3.150 4.196 -0.782
232 1HB CYS 29 1HB CYS 29 -4.311 2.783 1.192
233 2HB CYS 29 2HB CYS 29 -4.120 4.325 2.018
234 HA PRO 30 HA PRO 30 -0.627 7.662 0.477
235 1HB PRO 30 1HB PRO 30 -2.121 9.628 -0.708
236 2HB PRO 30 2HB PRO 30 -0.967 8.609 -1.576
237 1HG PRO 30 1HG PRO 30 -3.941 8.353 -1.370
238 2HG PRO 30 2HG PRO 30 -2.895 8.148 -2.787
239 1HD PRO 30 1HD PRO 30 -3.866 6.041 -1.428
240 2HD PRO 30 2HD PRO 30 -2.247 6.017 -2.158
241 H ARG 31 H ARG 31 -0.633 8.548 2.431
242 HA ARG 31 HA ARG 31 -2.945 8.755 4.041
243 1HB ARG 31 1HB ARG 31 -0.181 9.930 4.364
244 2HB ARG 31 2HB ARG 31 -1.434 10.037 5.593
245 1HG ARG 31 1HG ARG 31 -1.512 7.572 5.680
246 2HG ARG 31 2HG ARG 31 -0.185 7.516 4.519
247 1HD ARG 31 1HD ARG 31 1.281 8.639 6.061
248 2HD ARG 31 2HD ARG 31 -0.046 8.902 7.192
249 HE ARG 31 HE ARG 31 0.472 6.133 6.573
250 1HH1 ARG 31 1HH1 ARG 31 1.223 8.816 8.668
251 2HH1 ARG 31 2HH1 ARG 31 1.761 7.812 9.973
252 1HH2 ARG 31 1HH2 ARG 31 1.176 4.806 8.286
253 2HH2 ARG 31 2HH2 ARG 31 1.737 5.533 9.754
254 H ARG 32 H ARG 32 -4.491 10.022 3.067
255 HA ARG 32 HA ARG 32 -3.825 12.769 2.364
256 1HB ARG 32 1HB ARG 32 -6.214 12.857 1.579
257 2HB ARG 32 2HB ARG 32 -5.200 11.686 0.751
258 1HG ARG 32 1HG ARG 32 -6.180 9.878 2.005
259 2HG ARG 32 2HG ARG 32 -7.107 11.014 2.985
260 1HD ARG 32 1HD ARG 32 -7.384 10.563 0.016
261 2HD ARG 32 2HD ARG 32 -8.508 10.025 1.265
262 HE ARG 32 HE ARG 32 -8.545 12.626 1.707
263 1HH1 ARG 32 1HH1 ARG 32 -8.585 10.918 -1.332
264 2HH1 ARG 32 2HH1 ARG 32 -9.516 12.129 -2.147
265 1HH2 ARG 32 1HH2 ARG 32 -9.769 14.224 0.641
266 2HH2 ARG 32 2HH2 ARG 32 -10.188 14.010 -1.027
Start of MODEL 10
1 1H GLY 1 1H GLY 1 -8.626 12.858 -2.329
2 2H GLY 1 2H GLY 1 -9.003 11.959 -0.947
3 3H GLY 1 3H GLY 1 -9.631 11.502 -2.449
4 1HA GLY 1 1HA GLY 1 -7.422 10.984 -3.263
5 2HA GLY 1 2HA GLY 1 -6.754 11.483 -1.716
6 H LEU 2 H LEU 2 -9.332 9.328 -2.913
7 HA LEU 2 HA LEU 2 -8.473 7.354 -0.906
8 1HB LEU 2 1HB LEU 2 -11.136 7.536 -2.317
9 2HB LEU 2 2HB LEU 2 -10.713 6.426 -1.027
10 HG LEU 2 HG LEU 2 -10.884 9.428 -0.741
11 1HD1 LEU 2 1HD1 LEU 2 -12.766 7.274 0.214
12 2HD1 LEU 2 2HD1 LEU 2 -13.072 8.395 -1.111
13 3HD1 LEU 2 3HD1 LEU 2 -12.911 9.002 0.536
14 1HD2 LEU 2 1HD2 LEU 2 -9.263 8.428 0.782
15 2HD2 LEU 2 2HD2 LEU 2 -10.473 7.262 1.320
16 3HD2 LEU 2 3HD2 LEU 2 -10.692 8.979 1.657
17 H LEU 3 H LEU 3 -7.044 7.592 -3.296
18 HA LEU 3 HA LEU 3 -7.924 5.277 -4.880
19 1HB LEU 3 1HB LEU 3 -5.949 7.471 -5.508
20 2HB LEU 3 2HB LEU 3 -6.225 6.080 -6.536
21 HG LEU 3 HG LEU 3 -8.670 6.838 -6.630
22 1HD1 LEU 3 1HD1 LEU 3 -7.403 9.360 -5.572
23 2HD1 LEU 3 2HD1 LEU 3 -8.649 8.393 -4.781
24 3HD1 LEU 3 3HD1 LEU 3 -9.015 9.250 -6.278
25 1HD2 LEU 3 1HD2 LEU 3 -6.504 8.528 -7.871
26 2HD2 LEU 3 2HD2 LEU 3 -8.181 8.454 -8.414
27 3HD2 LEU 3 3HD2 LEU 3 -7.158 7.021 -8.515
28 H CYS 4 H CYS 4 -7.187 3.600 -3.602
29 HA CYS 4 HA CYS 4 -4.397 3.553 -2.779
30 1HB CYS 4 1HB CYS 4 -6.513 1.427 -2.399
31 2HB CYS 4 2HB CYS 4 -4.968 1.543 -1.563
32 H TYR 5 H TYR 5 -2.865 2.086 -3.513
33 HA TYR 5 HA TYR 5 -3.600 0.580 -5.937
34 1HB TYR 5 1HB TYR 5 -0.975 1.975 -5.372
35 2HB TYR 5 2HB TYR 5 -1.351 1.036 -6.813
36 HD1 TYR 5 1HD TYR 5 -3.631 1.864 -8.010
37 HD2 TYR 5 2HD TYR 5 -1.098 4.262 -5.574
38 HE1 TYR 5 1HE TYR 5 -4.506 3.886 -9.101
39 HE2 TYR 5 2HE TYR 5 -1.967 6.291 -6.658
40 HH TYR 5 HH TYR 5 -3.046 6.915 -8.804
41 H CYS 6 H CYS 6 -2.518 -1.387 -6.316
42 HA CYS 6 HA CYS 6 -1.653 -2.722 -3.874
43 1HB CYS 6 1HB CYS 6 -3.241 -4.024 -4.984
44 2HB CYS 6 2HB CYS 6 -2.578 -3.654 -6.572
45 H ARG 7 H ARG 7 0.345 -3.549 -3.524
46 HA ARG 7 HA ARG 7 2.303 -3.510 -5.695
47 1HB ARG 7 1HB ARG 7 2.672 -2.104 -3.046
48 2HB ARG 7 2HB ARG 7 3.982 -2.438 -4.172
49 1HG ARG 7 1HG ARG 7 2.723 -1.117 -5.887
50 2HG ARG 7 2HG ARG 7 1.604 -0.649 -4.606
51 1HD ARG 7 1HD ARG 7 3.475 0.321 -3.347
52 2HD ARG 7 2HD ARG 7 4.574 -0.125 -4.651
53 HE ARG 7 HE ARG 7 2.317 1.633 -5.264
54 1HH1 ARG 7 1HH1 ARG 7 5.744 1.196 -4.814
55 2HH1 ARG 7 2HH1 ARG 7 6.166 2.690 -5.582
56 1HH2 ARG 7 1HH2 ARG 7 2.862 3.602 -6.279
57 2HH2 ARG 7 2HH2 ARG 7 4.527 4.057 -6.416
58 H LYS 8 H LYS 8 4.386 -4.594 -4.991
59 HA LYS 8 HA LYS 8 3.761 -6.785 -3.122
60 1HB LYS 8 1HB LYS 8 3.832 -7.541 -5.462
61 2HB LYS 8 2HB LYS 8 5.464 -6.907 -5.618
62 1HG LYS 8 1HG LYS 8 6.213 -8.482 -3.878
63 2HG LYS 8 2HG LYS 8 4.582 -9.150 -3.814
64 1HD LYS 8 1HD LYS 8 4.753 -9.778 -6.178
65 2HD LYS 8 2HD LYS 8 6.390 -9.119 -6.231
66 1HE LYS 8 1HE LYS 8 5.449 -11.411 -4.509
67 2HE LYS 8 2HE LYS 8 6.424 -11.546 -5.970
68 1HZ LYS 8 1HZ LYS 8 8.169 -10.276 -4.869
69 2HZ LYS 8 2HZ LYS 8 7.797 -11.676 -3.998
70 3HZ LYS 8 3HZ LYS 8 7.233 -10.174 -3.463
71 H GLY 9 H GLY 9 4.983 -6.797 -1.367
72 1HA GLY 9 1HA GLY 9 7.116 -7.012 -0.318
73 2HA GLY 9 2HA GLY 9 7.810 -6.034 -1.600
74 H HIS 10 H HIS 10 7.280 -3.732 -1.621
75 HA HIS 10 HA HIS 10 6.193 -2.581 0.802
76 1HB HIS 10 1HB HIS 10 8.733 -3.182 1.092
77 2HB HIS 10 2HB HIS 10 8.987 -1.747 0.106
78 HD1 HIS 10 1HD HIS 10 7.523 -2.799 3.420
79 HD2 HIS 10 2HD HIS 10 8.760 0.641 1.446
80 HE1 HIS 10 1HE HIS 10 7.494 -0.981 5.158
81 HE2 HIS 10 2HE HIS 10 8.299 1.081 3.953
82 H CYS 11 H CYS 11 5.251 -0.655 0.376
83 HA CYS 11 HA CYS 11 5.191 0.297 -2.309
84 1HB CYS 11 1HB CYS 11 3.262 0.427 -0.712
85 2HB CYS 11 2HB CYS 11 4.128 1.686 0.158
86 H LYS 12 H LYS 12 5.457 2.748 -2.701
87 HA LYS 12 HA LYS 12 8.202 3.366 -2.235
88 1HB LYS 12 1HB LYS 12 7.746 5.405 -3.537
89 2HB LYS 12 2HB LYS 12 7.161 3.957 -4.344
90 1HG LYS 12 1HG LYS 12 4.888 4.458 -3.540
91 2HG LYS 12 2HG LYS 12 5.499 5.946 -2.811
92 1HD LYS 12 1HD LYS 12 6.216 6.725 -5.026
93 2HD LYS 12 2HD LYS 12 5.573 5.247 -5.746
94 1HE LYS 12 1HE LYS 12 4.016 7.117 -5.996
95 2HE LYS 12 2HE LYS 12 3.334 5.836 -4.994
96 1HZ LYS 12 1HZ LYS 12 2.909 8.015 -4.048
97 2HZ LYS 12 2HZ LYS 12 4.568 8.345 -3.990
98 3HZ LYS 12 3HZ LYS 12 3.916 7.117 -3.028
99 H ARG 13 H ARG 13 5.147 4.660 -1.017
100 HA ARG 13 HA ARG 13 6.324 5.529 1.400
101 1HB ARG 13 1HB ARG 13 5.987 7.982 1.051
102 2HB ARG 13 2HB ARG 13 7.304 7.294 0.120
103 1HG ARG 13 1HG ARG 13 5.929 7.269 -1.869
104 2HG ARG 13 2HG ARG 13 4.551 7.877 -0.949
105 1HD ARG 13 1HD ARG 13 7.170 9.319 -1.332
106 2HD ARG 13 2HD ARG 13 5.692 9.639 -2.238
107 HE ARG 13 HE ARG 13 4.814 10.005 0.227
108 1HH1 ARG 13 1HH1 ARG 13 7.793 11.070 -1.237
109 2HH1 ARG 13 2HH1 ARG 13 7.928 12.478 -0.239
110 1HH2 ARG 13 1HH2 ARG 13 4.987 11.854 1.544
111 2HH2 ARG 13 2HH2 ARG 13 6.335 12.924 1.343
112 H GLY 14 H GLY 14 4.264 3.980 1.282
113 1HA GLY 14 1HA GLY 14 2.208 5.296 2.649
114 2HA GLY 14 2HA GLY 14 1.710 5.136 0.971
115 H GLU 15 H GLU 15 3.719 2.830 2.684
116 HA GLU 15 HA GLU 15 2.223 0.604 1.888
117 1HB GLU 15 1HB GLU 15 3.909 0.609 4.375
118 2HB GLU 15 2HB GLU 15 3.663 -0.691 3.219
119 1HG GLU 15 1HG GLU 15 5.770 -0.040 2.653
120 2HG GLU 15 2HG GLU 15 4.829 0.979 1.572
121 H ARG 16 H ARG 16 0.715 -0.678 2.937
122 HA ARG 16 HA ARG 16 -0.188 -0.051 5.591
123 1HB ARG 16 1HB ARG 16 -1.250 1.670 3.994
124 2HB ARG 16 2HB ARG 16 -2.217 0.327 3.402
125 1HG ARG 16 1HG ARG 16 -3.549 1.398 5.001
126 2HG ARG 16 2HG ARG 16 -2.921 -0.039 5.811
127 1HD ARG 16 1HD ARG 16 -1.543 2.618 6.024
128 2HD ARG 16 2HD ARG 16 -2.878 2.185 7.092
129 HE ARG 16 HE ARG 16 -0.931 0.139 7.089
130 1HH1 ARG 16 1HH1 ARG 16 -1.484 3.375 8.258
131 2HH1 ARG 16 2HH1 ARG 16 -0.436 3.197 9.626
132 1HH2 ARG 16 1HH2 ARG 16 0.448 -0.104 8.887
133 2HH2 ARG 16 2HH2 ARG 16 0.663 1.220 9.983
134 H VAL 17 H VAL 17 -1.883 -1.487 6.330
135 HA VAL 17 HA VAL 17 -2.216 -3.900 4.681
136 HB VAL 17 HB VAL 17 -1.788 -4.054 7.660
137 1HG1 VAL 17 1HG1 VAL 17 -1.541 -6.095 5.452
138 2HG1 VAL 17 2HG1 VAL 17 -2.873 -5.965 6.601
139 3HG1 VAL 17 3HG1 VAL 17 -1.258 -6.393 7.167
140 1HG2 VAL 17 1HG2 VAL 17 0.305 -4.281 5.501
141 2HG2 VAL 17 2HG2 VAL 17 0.538 -4.735 7.188
142 3HG2 VAL 17 3HG2 VAL 17 0.221 -3.053 6.764
143 H ARG 18 H ARG 18 -4.092 -1.924 4.783
144 HA ARG 18 HA ARG 18 -6.049 -2.360 6.832
145 1HB ARG 18 1HB ARG 18 -5.912 -0.210 5.668
146 2HB ARG 18 2HB ARG 18 -6.273 -0.996 4.137
147 1HG ARG 18 1HG ARG 18 -8.486 -1.632 5.013
148 2HG ARG 18 2HG ARG 18 -8.118 -0.767 6.507
149 1HD ARG 18 1HD ARG 18 -7.900 1.316 5.273
150 2HD ARG 18 2HD ARG 18 -8.194 0.467 3.756
151 HE ARG 18 HE ARG 18 -10.308 0.141 5.669
152 1HH1 ARG 18 1HH1 ARG 18 -9.020 2.187 3.159
153 2HH1 ARG 18 2HH1 ARG 18 -10.544 2.923 2.797
154 1HH2 ARG 18 1HH2 ARG 18 -12.322 1.107 5.200
155 2HH2 ARG 18 2HH2 ARG 18 -12.422 2.310 3.958
156 H GLY 19 H GLY 19 -5.347 -3.603 3.682
157 1HA GLY 19 1HA GLY 19 -7.430 -5.642 4.039
158 2HA GLY 19 2HA GLY 19 -7.317 -4.777 2.510
159 H THR 20 H THR 20 -6.256 -5.842 0.987
160 HA THR 20 HA THR 20 -3.659 -6.813 1.248
161 HB THR 20 HB THR 20 -4.494 -8.595 2.624
162 HG1 THR 20 1HG THR 20 -3.002 -9.519 1.372
163 1HG2 THR 20 1HG2 THR 20 -6.847 -8.511 1.977
164 2HG2 THR 20 2HG2 THR 20 -6.222 -10.156 1.844
165 3HG2 THR 20 3HG2 THR 20 -6.446 -9.178 0.395
166 H CYS 21 H CYS 21 -2.965 -8.094 -0.679
167 HA CYS 21 HA CYS 21 -4.762 -7.723 -2.975
168 1HB CYS 21 1HB CYS 21 -3.159 -5.858 -2.922
169 2HB CYS 21 2HB CYS 21 -1.824 -7.005 -2.903
170 H GLY 22 H GLY 22 -2.619 -9.677 -1.236
171 1HA GLY 22 1HA GLY 22 -3.112 -11.962 -2.805
172 2HA GLY 22 2HA GLY 22 -1.527 -11.328 -3.220
173 H ILE 23 H ILE 23 -0.623 -13.303 -2.411
174 HA ILE 23 HA ILE 23 -0.962 -14.139 0.279
175 HB ILE 23 HB ILE 23 1.342 -14.737 -1.582
176 1HG1 ILE 23 1HG1 ILE 23 -1.174 -16.340 -1.078
177 2HG1 ILE 23 2HG1 ILE 23 -0.907 -15.331 -2.495
178 1HG2 ILE 23 1HG2 ILE 23 0.368 -16.157 0.894
179 2HG2 ILE 23 2HG2 ILE 23 1.864 -15.237 0.735
180 3HG2 ILE 23 3HG2 ILE 23 1.647 -16.732 -0.176
181 1HD1 ILE 23 1HD1 ILE 23 0.723 -17.735 -1.712
182 2HD1 ILE 23 2HD1 ILE 23 0.984 -16.727 -3.135
183 3HD1 ILE 23 3HD1 ILE 23 -0.496 -17.671 -2.983
184 H ARG 24 H ARG 24 1.845 -12.626 -1.325
185 HA ARG 24 HA ARG 24 2.702 -11.619 1.302
186 1HB ARG 24 1HB ARG 24 4.949 -11.408 0.312
187 2HB ARG 24 2HB ARG 24 4.354 -13.061 0.249
188 1HG ARG 24 1HG ARG 24 3.967 -11.272 -2.104
189 2HG ARG 24 2HG ARG 24 5.543 -12.008 -1.813
190 1HD ARG 24 1HD ARG 24 4.576 -14.214 -1.878
191 2HD ARG 24 2HD ARG 24 2.951 -13.540 -1.996
192 HE ARG 24 HE ARG 24 4.173 -12.505 -4.159
193 1HH1 ARG 24 1HH1 ARG 24 3.941 -15.754 -2.920
194 2HH1 ARG 24 2HH1 ARG 24 4.015 -16.492 -4.484
195 1HH2 ARG 24 1HH2 ARG 24 4.270 -13.468 -6.220
196 2HH2 ARG 24 2HH2 ARG 24 4.203 -15.193 -6.360
197 H PHE 25 H PHE 25 0.997 -10.609 -1.246
198 HA PHE 25 HA PHE 25 2.250 -8.099 -1.824
199 1HB PHE 25 1HB PHE 25 -0.542 -9.117 -2.382
200 2HB PHE 25 2HB PHE 25 0.088 -7.583 -2.971
201 HD1 PHE 25 1HD PHE 25 1.307 -7.480 -4.955
202 HD2 PHE 25 2HD PHE 25 0.647 -11.249 -3.089
203 HE1 PHE 25 1HE PHE 25 2.227 -8.617 -6.933
204 HE2 PHE 25 2HE PHE 25 1.568 -12.392 -5.064
205 HZ PHE 25 HZ PHE 25 2.360 -11.076 -6.989
206 H LEU 26 H LEU 26 1.501 -6.017 -1.239
207 HA LEU 26 HA LEU 26 -0.163 -5.954 1.192
208 1HB LEU 26 1HB LEU 26 2.163 -4.116 0.614
209 2HB LEU 26 2HB LEU 26 1.205 -4.175 2.079
210 HG LEU 26 HG LEU 26 2.086 -6.615 2.260
211 1HD1 LEU 26 1HD1 LEU 26 3.113 -6.767 0.081
212 2HD1 LEU 26 2HD1 LEU 26 4.354 -6.871 1.329
213 3HD1 LEU 26 3HD1 LEU 26 4.131 -5.370 0.430
214 1HD2 LEU 26 1HD2 LEU 26 3.856 -4.225 2.752
215 2HD2 LEU 26 2HD2 LEU 26 4.048 -5.813 3.494
216 3HD2 LEU 26 3HD2 LEU 26 2.613 -4.846 3.838
217 H TYR 27 H TYR 27 -1.077 -3.732 1.616
218 HA TYR 27 HA TYR 27 -2.002 -2.629 -0.946
219 1HB TYR 27 1HB TYR 27 -3.459 -3.605 1.195
220 2HB TYR 27 2HB TYR 27 -3.551 -1.858 1.400
221 HD1 TYR 27 1HD TYR 27 -5.183 -0.683 0.242
222 HD2 TYR 27 2HD TYR 27 -3.933 -4.477 -1.224
223 HE1 TYR 27 1HE TYR 27 -6.913 -0.572 -1.501
224 HE2 TYR 27 2HE TYR 27 -5.662 -4.375 -2.972
225 HH TYR 27 HH TYR 27 -7.840 -3.242 -3.347
226 H CYS 28 H CYS 28 -1.397 -0.672 -1.498
227 HA CYS 28 HA CYS 28 -0.341 1.126 0.582
228 1HB CYS 28 1HB CYS 28 1.295 0.425 -1.147
229 2HB CYS 28 2HB CYS 28 0.254 1.115 -2.387
230 H CYS 29 H CYS 29 -0.831 3.397 0.402
231 HA CYS 29 HA CYS 29 -2.774 4.311 -1.489
232 1HB CYS 29 1HB CYS 29 -3.987 2.918 0.386
233 2HB CYS 29 2HB CYS 29 -3.781 4.391 1.326
234 HA PRO 30 HA PRO 30 -0.620 8.074 -0.471
235 1HB PRO 30 1HB PRO 30 -3.074 9.404 -1.475
236 2HB PRO 30 2HB PRO 30 -1.397 9.595 -1.997
237 1HG PRO 30 1HG PRO 30 -3.153 8.266 -3.498
238 2HG PRO 30 2HG PRO 30 -1.470 7.722 -3.359
239 1HD PRO 30 1HD PRO 30 -3.928 6.643 -2.037
240 2HD PRO 30 2HD PRO 30 -2.536 5.773 -2.713
241 H ARG 31 H ARG 31 -0.483 9.170 1.377
242 HA ARG 31 HA ARG 31 -2.727 9.155 3.217
243 1HB ARG 31 1HB ARG 31 -0.491 8.571 4.033
244 2HB ARG 31 2HB ARG 31 0.108 10.152 3.552
245 1HG ARG 31 1HG ARG 31 -1.426 11.200 5.164
246 2HG ARG 31 2HG ARG 31 -1.954 9.596 5.675
247 1HD ARG 31 1HD ARG 31 0.866 10.657 5.837
248 2HD ARG 31 2HD ARG 31 -0.262 10.530 7.187
249 HE ARG 31 HE ARG 31 -0.204 8.073 6.773
250 1HH1 ARG 31 1HH1 ARG 31 2.432 10.096 5.716
251 2HH1 ARG 31 2HH1 ARG 31 3.605 8.825 5.789
252 1HH2 ARG 31 1HH2 ARG 31 1.337 6.396 6.873
253 2HH2 ARG 31 2HH2 ARG 31 2.984 6.723 6.449
254 H ARG 32 H ARG 32 -0.739 11.488 1.464
255 HA ARG 32 HA ARG 32 -2.855 13.415 1.460
256 1HB ARG 32 1HB ARG 32 -1.990 13.846 3.696
257 2HB ARG 32 2HB ARG 32 -0.359 14.008 3.062
258 1HG ARG 32 1HG ARG 32 -1.266 16.185 3.517
259 2HG ARG 32 2HG ARG 32 -1.083 15.980 1.774
260 1HD ARG 32 1HD ARG 32 -3.204 17.046 2.279
261 2HD ARG 32 2HD ARG 32 -3.471 15.441 1.598
262 HE ARG 32 HE ARG 32 -3.473 15.077 4.316
263 1HH1 ARG 32 1HH1 ARG 32 -5.286 17.012 2.055
264 2HH1 ARG 32 2HH1 ARG 32 -6.731 17.006 3.010
265 1HH2 ARG 32 1HH2 ARG 32 -5.371 15.066 5.581
266 2HH2 ARG 32 2HH2 ARG 32 -6.779 15.901 5.015
Start of MODEL 11
1 1H GLY 1 1H GLY 1 -9.341 13.113 -4.985
2 2H GLY 1 2H GLY 1 -7.852 12.942 -4.202
3 3H GLY 1 3H GLY 1 -9.079 13.865 -3.491
4 1HA GLY 1 1HA GLY 1 -8.914 11.736 -2.389
5 2HA GLY 1 2HA GLY 1 -10.453 11.899 -3.222
6 H LEU 2 H LEU 2 -7.219 10.500 -3.468
7 HA LEU 2 HA LEU 2 -8.196 8.628 -5.504
8 1HB LEU 2 1HB LEU 2 -5.414 9.322 -4.572
9 2HB LEU 2 2HB LEU 2 -5.755 8.011 -5.685
10 HG LEU 2 HG LEU 2 -6.842 9.769 -7.187
11 1HD1 LEU 2 1HD1 LEU 2 -6.012 12.065 -6.877
12 2HD1 LEU 2 2HD1 LEU 2 -5.329 11.591 -5.322
13 3HD1 LEU 2 3HD1 LEU 2 -7.075 11.551 -5.567
14 1HD2 LEU 2 1HD2 LEU 2 -4.701 8.741 -7.698
15 2HD2 LEU 2 2HD2 LEU 2 -3.877 9.895 -6.648
16 3HD2 LEU 2 3HD2 LEU 2 -4.677 10.455 -8.117
17 H LEU 3 H LEU 3 -7.993 6.390 -5.255
18 HA LEU 3 HA LEU 3 -8.149 5.490 -2.503
19 1HB LEU 3 1HB LEU 3 -8.582 4.099 -5.142
20 2HB LEU 3 2HB LEU 3 -8.657 3.263 -3.604
21 HG LEU 3 HG LEU 3 -10.891 3.752 -4.339
22 1HD1 LEU 3 1HD1 LEU 3 -10.349 3.960 -1.917
23 2HD1 LEU 3 2HD1 LEU 3 -11.754 4.895 -2.432
24 3HD1 LEU 3 3HD1 LEU 3 -10.213 5.704 -2.150
25 1HD2 LEU 3 1HD2 LEU 3 -10.380 5.610 -5.838
26 2HD2 LEU 3 2HD2 LEU 3 -10.057 6.648 -4.447
27 3HD2 LEU 3 3HD2 LEU 3 -11.683 6.022 -4.723
28 H CYS 4 H CYS 4 -7.103 3.222 -2.112
29 HA CYS 4 HA CYS 4 -4.292 3.599 -2.212
30 1HB CYS 4 1HB CYS 4 -5.571 0.946 -1.622
31 2HB CYS 4 2HB CYS 4 -4.119 1.657 -0.924
32 H TYR 5 H TYR 5 -3.019 1.372 -2.846
33 HA TYR 5 HA TYR 5 -3.900 0.444 -5.465
34 1HB TYR 5 1HB TYR 5 -1.266 1.864 -5.025
35 2HB TYR 5 2HB TYR 5 -1.700 0.990 -6.489
36 HD1 TYR 5 1HD TYR 5 -1.927 4.098 -4.707
37 HD2 TYR 5 2HD TYR 5 -3.672 1.819 -7.847
38 HE1 TYR 5 1HE TYR 5 -2.968 6.139 -5.602
39 HE2 TYR 5 2HE TYR 5 -4.716 3.854 -8.751
40 HH TYR 5 HH TYR 5 -3.852 6.977 -7.721
41 H CYS 6 H CYS 6 -3.274 -1.594 -5.918
42 HA CYS 6 HA CYS 6 -2.032 -3.130 -3.835
43 1HB CYS 6 1HB CYS 6 -3.765 -4.246 -4.977
44 2HB CYS 6 2HB CYS 6 -3.140 -3.787 -6.556
45 H ARG 7 H ARG 7 0.026 -3.741 -3.653
46 HA ARG 7 HA ARG 7 1.778 -3.607 -5.995
47 1HB ARG 7 1HB ARG 7 2.031 -2.012 -3.495
48 2HB ARG 7 2HB ARG 7 3.508 -2.646 -4.209
49 1HG ARG 7 1HG ARG 7 3.473 -1.162 -5.873
50 2HG ARG 7 2HG ARG 7 1.743 -1.369 -6.145
51 1HD ARG 7 1HD ARG 7 1.200 0.168 -4.420
52 2HD ARG 7 2HD ARG 7 2.861 0.193 -3.829
53 HE ARG 7 HE ARG 7 3.335 1.790 -5.387
54 1HH1 ARG 7 1HH1 ARG 7 0.419 0.145 -6.354
55 2HH1 ARG 7 2HH1 ARG 7 0.110 1.208 -7.684
56 1HH2 ARG 7 1HH2 ARG 7 2.930 3.197 -7.133
57 2HH2 ARG 7 2HH2 ARG 7 1.534 2.943 -8.125
58 H LYS 8 H LYS 8 4.012 -4.529 -5.397
59 HA LYS 8 HA LYS 8 3.622 -6.869 -3.646
60 1HB LYS 8 1HB LYS 8 3.667 -7.539 -5.985
61 2HB LYS 8 2HB LYS 8 5.177 -6.675 -6.232
62 1HG LYS 8 1HG LYS 8 6.279 -8.203 -4.645
63 2HG LYS 8 2HG LYS 8 4.765 -9.096 -4.488
64 1HD LYS 8 1HD LYS 8 4.814 -9.610 -6.875
65 2HD LYS 8 2HD LYS 8 6.312 -8.695 -7.049
66 1HE LYS 8 1HE LYS 8 7.423 -10.247 -5.506
67 2HE LYS 8 2HE LYS 8 5.926 -11.167 -5.363
68 1HZ LYS 8 1HZ LYS 8 7.487 -10.767 -7.858
69 2HZ LYS 8 2HZ LYS 8 6.039 -11.632 -7.738
70 3HZ LYS 8 3HZ LYS 8 7.425 -12.191 -6.945
71 H GLY 9 H GLY 9 4.938 -6.941 -1.955
72 1HA GLY 9 1HA GLY 9 7.094 -6.995 -0.962
73 2HA GLY 9 2HA GLY 9 7.672 -5.917 -2.224
74 H HIS 10 H HIS 10 6.961 -3.662 -2.137
75 HA HIS 10 HA HIS 10 5.793 -2.661 0.283
76 1HB HIS 10 1HB HIS 10 7.705 -1.425 1.096
77 2HB HIS 10 2HB HIS 10 8.117 -3.136 1.005
78 HD1 HIS 10 1HD HIS 10 8.403 -0.140 -1.317
79 HD2 HIS 10 2HD HIS 10 10.549 -3.486 -0.114
80 HE1 HIS 10 1HE HIS 10 10.558 -0.041 -2.579
81 HE2 HIS 10 2HE HIS 10 11.881 -2.035 -1.791
82 H CYS 11 H CYS 11 5.402 -0.388 0.237
83 HA CYS 11 HA CYS 11 5.481 0.711 -2.491
84 1HB CYS 11 1HB CYS 11 3.235 0.341 -1.421
85 2HB CYS 11 2HB CYS 11 3.673 1.548 -0.219
86 H LYS 12 H LYS 12 5.424 3.227 -2.442
87 HA LYS 12 HA LYS 12 7.422 4.153 -0.487
88 1HB LYS 12 1HB LYS 12 8.298 5.642 -2.261
89 2HB LYS 12 2HB LYS 12 8.465 3.937 -2.657
90 1HG LYS 12 1HG LYS 12 6.504 4.072 -4.100
91 2HG LYS 12 2HG LYS 12 6.322 5.781 -3.695
92 1HD LYS 12 1HD LYS 12 8.537 6.231 -4.659
93 2HD LYS 12 2HD LYS 12 8.688 4.526 -5.088
94 1HE LYS 12 1HE LYS 12 6.724 4.714 -6.531
95 2HE LYS 12 2HE LYS 12 6.564 6.415 -6.094
96 1HZ LYS 12 1HZ LYS 12 8.860 5.194 -7.529
97 2HZ LYS 12 2HZ LYS 12 8.745 6.820 -7.078
98 3HZ LYS 12 3HZ LYS 12 7.668 6.180 -8.214
99 H ARG 13 H ARG 13 4.533 4.337 -0.269
100 HA ARG 13 HA ARG 13 4.314 6.997 0.585
101 1HB ARG 13 1HB ARG 13 2.572 7.757 -1.064
102 2HB ARG 13 2HB ARG 13 4.213 7.685 -1.682
103 1HG ARG 13 1HG ARG 13 3.694 5.513 -2.726
104 2HG ARG 13 2HG ARG 13 2.028 5.670 -2.163
105 1HD ARG 13 1HD ARG 13 1.773 7.719 -3.462
106 2HD ARG 13 2HD ARG 13 3.445 7.594 -4.004
107 HE ARG 13 HE ARG 13 2.018 5.241 -4.658
108 1HH1 ARG 13 1HH1 ARG 13 2.368 8.580 -5.590
109 2HH1 ARG 13 2HH1 ARG 13 1.914 8.303 -7.238
110 1HH2 ARG 13 1HH2 ARG 13 1.422 4.867 -6.828
111 2HH2 ARG 13 2HH2 ARG 13 1.378 6.192 -7.942
112 H GLY 14 H GLY 14 3.679 5.356 2.259
113 1HA GLY 14 1HA GLY 14 1.819 5.021 3.677
114 2HA GLY 14 2HA GLY 14 0.760 5.179 2.286
115 H GLU 15 H GLU 15 3.254 3.028 3.635
116 HA GLU 15 HA GLU 15 2.176 0.760 2.189
117 1HB GLU 15 1HB GLU 15 4.353 0.838 4.289
118 2HB GLU 15 2HB GLU 15 3.985 -0.510 3.224
119 1HG GLU 15 1HG GLU 15 5.860 0.498 2.288
120 2HG GLU 15 2HG GLU 15 4.513 1.065 1.303
121 H ARG 16 H ARG 16 0.134 0.376 2.994
122 HA ARG 16 HA ARG 16 -0.056 -0.243 5.866
123 1HB ARG 16 1HB ARG 16 -2.243 0.522 3.924
124 2HB ARG 16 2HB ARG 16 -2.484 0.134 5.622
125 1HG ARG 16 1HG ARG 16 -1.143 2.056 6.271
126 2HG ARG 16 2HG ARG 16 -0.847 2.435 4.572
127 1HD ARG 16 1HD ARG 16 -2.616 3.842 5.478
128 2HD ARG 16 2HD ARG 16 -3.246 2.769 4.229
129 HE ARG 16 HE ARG 16 -3.523 1.735 6.898
130 1HH1 ARG 16 1HH1 ARG 16 -4.967 3.729 4.429
131 2HH1 ARG 16 2HH1 ARG 16 -6.574 3.561 5.054
132 1HH2 ARG 16 1HH2 ARG 16 -5.635 1.512 7.727
133 2HH2 ARG 16 2HH2 ARG 16 -6.953 2.304 6.929
134 H VAL 17 H VAL 17 -1.565 -1.981 6.457
135 HA VAL 17 HA VAL 17 -1.724 -4.087 4.408
136 HB VAL 17 HB VAL 17 -1.206 -4.708 7.307
137 1HG1 VAL 17 1HG1 VAL 17 -0.494 -6.855 6.449
138 2HG1 VAL 17 2HG1 VAL 17 -0.710 -6.294 4.791
139 3HG1 VAL 17 3HG1 VAL 17 -2.109 -6.479 5.848
140 1HG2 VAL 17 1HG2 VAL 17 0.870 -4.373 5.143
141 2HG2 VAL 17 2HG2 VAL 17 1.163 -4.980 6.772
142 3HG2 VAL 17 3HG2 VAL 17 0.645 -3.311 6.533
143 H ARG 18 H ARG 18 -3.801 -2.375 4.896
144 HA ARG 18 HA ARG 18 -5.632 -3.449 6.828
145 1HB ARG 18 1HB ARG 18 -5.705 -1.083 6.180
146 2HB ARG 18 2HB ARG 18 -6.091 -1.538 4.527
147 1HG ARG 18 1HG ARG 18 -8.205 -2.482 5.258
148 2HG ARG 18 2HG ARG 18 -7.814 -2.092 6.934
149 1HD ARG 18 1HD ARG 18 -7.749 0.288 6.360
150 2HD ARG 18 2HD ARG 18 -8.142 -0.105 4.688
151 HE ARG 18 HE ARG 18 -10.266 -1.072 5.679
152 1HH1 ARG 18 1HH1 ARG 18 -8.527 1.576 7.132
153 2HH1 ARG 18 2HH1 ARG 18 -9.933 2.260 7.876
154 1HH2 ARG 18 1HH2 ARG 18 -12.122 -0.178 6.658
155 2HH2 ARG 18 2HH2 ARG 18 -11.976 1.261 7.609
156 H GLY 19 H GLY 19 -5.411 -3.471 3.288
157 1HA GLY 19 1HA GLY 19 -7.092 -5.900 3.287
158 2HA GLY 19 2HA GLY 19 -7.295 -4.629 2.088
159 H THR 20 H THR 20 -5.030 -7.026 3.331
160 HA THR 20 HA THR 20 -2.925 -6.812 1.617
161 HB THR 20 HB THR 20 -2.550 -9.223 1.872
162 HG1 THR 20 1HG THR 20 -4.321 -10.387 1.945
163 1HG2 THR 20 1HG2 THR 20 -1.967 -7.741 3.730
164 2HG2 THR 20 2HG2 THR 20 -2.506 -9.314 4.320
165 3HG2 THR 20 3HG2 THR 20 -3.591 -7.926 4.393
166 H CYS 21 H CYS 21 -2.645 -6.896 -0.493
167 HA CYS 21 HA CYS 21 -4.788 -7.572 -2.264
168 1HB CYS 21 1HB CYS 21 -3.178 -5.767 -2.758
169 2HB CYS 21 2HB CYS 21 -1.885 -6.955 -2.863
170 H GLY 22 H GLY 22 -2.582 -9.403 -0.604
171 1HA GLY 22 1HA GLY 22 -3.294 -11.837 -1.765
172 2HA GLY 22 2HA GLY 22 -1.785 -11.331 -2.511
173 H ILE 23 H ILE 23 -0.671 -13.099 -1.601
174 HA ILE 23 HA ILE 23 -0.537 -13.304 1.297
175 HB ILE 23 HB ILE 23 0.989 -14.895 -0.768
176 1HG1 ILE 23 1HG1 ILE 23 -1.572 -15.615 0.677
177 2HG1 ILE 23 2HG1 ILE 23 -1.482 -15.104 -1.005
178 1HG2 ILE 23 1HG2 ILE 23 1.990 -14.932 1.455
179 2HG2 ILE 23 2HG2 ILE 23 1.295 -16.503 1.055
180 3HG2 ILE 23 3HG2 ILE 23 0.444 -15.416 2.154
181 1HD1 ILE 23 1HD1 ILE 23 -0.098 -17.068 -1.505
182 2HD1 ILE 23 2HD1 ILE 23 -1.681 -17.501 -0.861
183 3HD1 ILE 23 3HD1 ILE 23 -0.256 -17.586 0.173
184 H ARG 24 H ARG 24 1.632 -12.584 -1.416
185 HA ARG 24 HA ARG 24 3.629 -11.587 0.495
186 1HB ARG 24 1HB ARG 24 5.221 -11.710 -1.381
187 2HB ARG 24 2HB ARG 24 4.469 -13.267 -1.056
188 1HG ARG 24 1HG ARG 24 2.929 -12.898 -2.932
189 2HG ARG 24 2HG ARG 24 3.731 -11.363 -3.270
190 1HD ARG 24 1HD ARG 24 5.834 -12.549 -3.664
191 2HD ARG 24 2HD ARG 24 5.034 -14.083 -3.322
192 HE ARG 24 HE ARG 24 3.644 -12.776 -5.377
193 1HH1 ARG 24 1HH1 ARG 24 6.702 -14.339 -4.795
194 2HH1 ARG 24 2HH1 ARG 24 6.907 -14.838 -6.441
195 1HH2 ARG 24 1HH2 ARG 24 3.907 -13.425 -7.548
196 2HH2 ARG 24 2HH2 ARG 24 5.319 -14.317 -8.006
197 H PHE 25 H PHE 25 1.100 -10.449 -1.161
198 HA PHE 25 HA PHE 25 2.359 -7.990 -2.115
199 1HB PHE 25 1HB PHE 25 -0.489 -8.989 -2.328
200 2HB PHE 25 2HB PHE 25 0.088 -7.467 -2.996
201 HD1 PHE 25 1HD PHE 25 0.464 -11.141 -3.201
202 HD2 PHE 25 2HD PHE 25 1.163 -7.386 -5.078
203 HE1 PHE 25 1HE PHE 25 1.120 -12.301 -5.270
204 HE2 PHE 25 2HE PHE 25 1.819 -8.539 -7.149
205 HZ PHE 25 HZ PHE 25 1.798 -11.000 -7.248
206 H LEU 26 H LEU 26 0.779 -5.999 -1.700
207 HA LEU 26 HA LEU 26 -0.330 -5.954 0.968
208 1HB LEU 26 1HB LEU 26 1.084 -4.207 1.828
209 2HB LEU 26 2HB LEU 26 2.071 -5.580 1.375
210 HG LEU 26 HG LEU 26 1.719 -3.199 -0.430
211 1HD1 LEU 26 1HD1 LEU 26 2.614 -2.379 1.667
212 2HD1 LEU 26 2HD1 LEU 26 3.873 -2.390 0.431
213 3HD1 LEU 26 3HD1 LEU 26 3.838 -3.649 1.666
214 1HD2 LEU 26 1HD2 LEU 26 3.846 -4.011 -1.369
215 2HD2 LEU 26 2HD2 LEU 26 2.553 -5.202 -1.505
216 3HD2 LEU 26 3HD2 LEU 26 3.792 -5.384 -0.263
217 H TYR 27 H TYR 27 -0.879 -3.494 1.485
218 HA TYR 27 HA TYR 27 -2.102 -2.419 -0.968
219 1HB TYR 27 1HB TYR 27 -3.356 -3.337 1.330
220 2HB TYR 27 2HB TYR 27 -3.363 -1.590 1.521
221 HD1 TYR 27 1HD TYR 27 -5.400 -0.687 0.920
222 HD2 TYR 27 2HD TYR 27 -3.824 -3.899 -1.382
223 HE1 TYR 27 1HE TYR 27 -7.327 -0.536 -0.598
224 HE2 TYR 27 2HE TYR 27 -5.749 -3.756 -2.908
225 HH TYR 27 HH TYR 27 -8.071 -2.939 -2.872
226 H CYS 28 H CYS 28 -1.590 -0.405 -1.532
227 HA CYS 28 HA CYS 28 -0.105 1.228 0.420
228 1HB CYS 28 1HB CYS 28 1.257 0.571 -1.491
229 2HB CYS 28 2HB CYS 28 0.056 1.224 -2.598
230 H CYS 29 H CYS 29 -1.566 2.577 1.307
231 HA CYS 29 HA CYS 29 -3.497 3.914 -0.436
232 1HB CYS 29 1HB CYS 29 -3.290 3.904 2.581
233 2HB CYS 29 2HB CYS 29 -4.578 4.646 1.640
234 HA PRO 30 HA PRO 30 -0.885 7.518 -0.651
235 1HB PRO 30 1HB PRO 30 -3.401 8.959 -1.233
236 2HB PRO 30 2HB PRO 30 -1.927 8.832 -2.199
237 1HG PRO 30 1HG PRO 30 -4.154 7.534 -2.900
238 2HG PRO 30 2HG PRO 30 -2.553 6.807 -3.128
239 1HD PRO 30 1HD PRO 30 -4.591 6.278 -1.000
240 2HD PRO 30 2HD PRO 30 -3.553 5.134 -1.876
241 H ARG 31 H ARG 31 -0.166 8.492 1.118
242 HA ARG 31 HA ARG 31 -1.994 10.112 2.709
243 1HB ARG 31 1HB ARG 31 -1.934 7.939 3.864
244 2HB ARG 31 2HB ARG 31 -0.180 8.028 3.942
245 1HG ARG 31 1HG ARG 31 -0.312 9.975 5.378
246 2HG ARG 31 2HG ARG 31 -2.073 9.971 5.251
247 1HD ARG 31 1HD ARG 31 -2.130 7.757 6.312
248 2HD ARG 31 2HD ARG 31 -0.372 7.790 6.458
249 HE ARG 31 HE ARG 31 -0.977 9.992 7.777
250 1HH1 ARG 31 1HH1 ARG 31 -2.539 6.878 7.884
251 2HH1 ARG 31 2HH1 ARG 31 -3.049 7.048 9.530
252 1HH2 ARG 31 1HH2 ARG 31 -1.650 10.226 9.940
253 2HH2 ARG 31 2HH2 ARG 31 -2.548 8.953 10.697
254 H ARG 32 H ARG 32 -0.934 11.899 1.831
255 HA ARG 32 HA ARG 32 1.934 12.172 2.244
256 1HB ARG 32 1HB ARG 32 0.876 12.904 0.117
257 2HB ARG 32 2HB ARG 32 -0.027 14.118 1.013
258 1HG ARG 32 1HG ARG 32 1.834 15.187 -0.008
259 2HG ARG 32 2HG ARG 32 2.145 15.107 1.727
260 1HD ARG 32 1HD ARG 32 4.146 14.536 0.468
261 2HD ARG 32 2HD ARG 32 3.564 13.144 1.380
262 HE ARG 32 HE ARG 32 2.515 13.123 -1.250
263 1HH1 ARG 32 1HH1 ARG 32 5.446 12.528 0.539
264 2HH1 ARG 32 2HH1 ARG 32 6.067 11.389 -0.610
265 1HH2 ARG 32 1HH2 ARG 32 3.326 11.627 -2.766
266 2HH2 ARG 32 2HH2 ARG 32 4.863 10.878 -2.487
Start of MODEL 12
1 1H GLY 1 1H GLY 1 -10.736 11.034 -6.032
2 2H GLY 1 2H GLY 1 -9.764 11.864 -7.140
3 3H GLY 1 3H GLY 1 -10.893 12.709 -6.208
4 1HA GLY 1 1HA GLY 1 -8.682 13.062 -5.335
5 2HA GLY 1 2HA GLY 1 -9.681 12.181 -4.190
6 H LEU 2 H LEU 2 -7.649 11.502 -3.241
7 HA LEU 2 HA LEU 2 -5.760 9.936 -4.641
8 1HB LEU 2 1HB LEU 2 -6.400 10.027 -1.692
9 2HB LEU 2 2HB LEU 2 -4.987 9.255 -2.388
10 HG LEU 2 HG LEU 2 -5.594 12.205 -2.617
11 1HD1 LEU 2 1HD1 LEU 2 -3.805 12.505 -0.968
12 2HD1 LEU 2 2HD1 LEU 2 -3.700 10.756 -0.769
13 3HD1 LEU 2 3HD1 LEU 2 -5.169 11.609 -0.297
14 1HD2 LEU 2 1HD2 LEU 2 -4.220 11.352 -4.433
15 2HD2 LEU 2 2HD2 LEU 2 -3.129 10.592 -3.274
16 3HD2 LEU 2 3HD2 LEU 2 -3.254 12.351 -3.346
17 H LEU 3 H LEU 3 -5.283 7.628 -4.138
18 HA LEU 3 HA LEU 3 -7.509 5.964 -3.350
19 1HB LEU 3 1HB LEU 3 -7.975 6.476 -5.733
20 2HB LEU 3 2HB LEU 3 -6.421 5.784 -6.161
21 HG LEU 3 HG LEU 3 -7.197 3.597 -5.253
22 1HD1 LEU 3 1HD1 LEU 3 -9.589 3.285 -4.848
23 2HD1 LEU 3 2HD1 LEU 3 -9.848 5.019 -5.046
24 3HD1 LEU 3 3HD1 LEU 3 -8.879 4.420 -3.701
25 1HD2 LEU 3 1HD2 LEU 3 -8.893 4.816 -7.430
26 2HD2 LEU 3 2HD2 LEU 3 -8.699 3.089 -7.126
27 3HD2 LEU 3 3HD2 LEU 3 -7.314 4.056 -7.636
28 H CYS 4 H CYS 4 -6.924 3.731 -3.102
29 HA CYS 4 HA CYS 4 -4.047 3.396 -2.652
30 1HB CYS 4 1HB CYS 4 -6.149 1.458 -1.734
31 2HB CYS 4 2HB CYS 4 -4.571 1.790 -1.031
32 H TYR 5 H TYR 5 -2.882 1.692 -3.524
33 HA TYR 5 HA TYR 5 -4.281 0.056 -5.536
34 1HB TYR 5 1HB TYR 5 -1.516 1.256 -5.799
35 2HB TYR 5 2HB TYR 5 -2.310 0.226 -6.985
36 HD1 TYR 5 1HD TYR 5 -2.035 3.584 -5.634
37 HD2 TYR 5 2HD TYR 5 -4.266 1.076 -8.249
38 HE1 TYR 5 1HE TYR 5 -3.027 5.573 -6.685
39 HE2 TYR 5 2HE TYR 5 -5.262 3.058 -9.308
40 HH TYR 5 HH TYR 5 -5.710 5.421 -8.742
41 H CYS 6 H CYS 6 -2.907 -1.871 -6.215
42 HA CYS 6 HA CYS 6 -1.932 -3.180 -3.784
43 1HB CYS 6 1HB CYS 6 -2.616 -4.355 -6.490
44 2HB CYS 6 2HB CYS 6 -2.187 -5.271 -5.049
45 H ARG 7 H ARG 7 0.136 -3.807 -3.504
46 HA ARG 7 HA ARG 7 1.956 -3.768 -5.800
47 1HB ARG 7 1HB ARG 7 2.371 -2.254 -3.224
48 2HB ARG 7 2HB ARG 7 3.661 -2.584 -4.371
49 1HG ARG 7 1HG ARG 7 2.312 -1.382 -6.102
50 2HG ARG 7 2HG ARG 7 1.201 -0.913 -4.813
51 1HD ARG 7 1HD ARG 7 3.036 0.196 -3.636
52 2HD ARG 7 2HD ARG 7 4.148 -0.280 -4.917
53 HE ARG 7 HE ARG 7 1.877 1.560 -5.319
54 1HH1 ARG 7 1HH1 ARG 7 5.154 0.551 -5.979
55 2HH1 ARG 7 2HH1 ARG 7 5.466 1.857 -7.072
56 1HH2 ARG 7 1HH2 ARG 7 2.286 3.273 -6.761
57 2HH2 ARG 7 2HH2 ARG 7 3.839 3.400 -7.517
58 H LYS 8 H LYS 8 4.245 -4.507 -4.945
59 HA LYS 8 HA LYS 8 3.837 -6.777 -3.110
60 1HB LYS 8 1HB LYS 8 3.958 -7.564 -5.434
61 2HB LYS 8 2HB LYS 8 5.501 -6.746 -5.634
62 1HG LYS 8 1HG LYS 8 6.514 -8.204 -3.977
63 2HG LYS 8 2HG LYS 8 4.962 -9.002 -3.714
64 1HD LYS 8 1HD LYS 8 4.953 -9.736 -6.055
65 2HD LYS 8 2HD LYS 8 6.514 -8.949 -6.303
66 1HE LYS 8 1HE LYS 8 7.542 -10.424 -4.671
67 2HE LYS 8 2HE LYS 8 5.982 -11.176 -4.339
68 1HZ LYS 8 1HZ LYS 8 5.919 -11.956 -6.630
69 2HZ LYS 8 2HZ LYS 8 7.302 -12.524 -5.839
70 3HZ LYS 8 3HZ LYS 8 7.423 -11.243 -6.937
71 H GLY 9 H GLY 9 5.440 -7.193 -1.644
72 1HA GLY 9 1HA GLY 9 7.407 -6.925 -0.468
73 2HA GLY 9 2HA GLY 9 8.049 -6.024 -1.833
74 H HIS 10 H HIS 10 7.835 -3.790 -1.899
75 HA HIS 10 HA HIS 10 6.779 -2.542 0.545
76 1HB HIS 10 1HB HIS 10 8.622 -0.844 0.293
77 2HB HIS 10 2HB HIS 10 9.160 -2.461 0.741
78 HD1 HIS 10 1HD HIS 10 8.325 -1.332 -2.760
79 HD2 HIS 10 2HD HIS 10 11.614 -2.448 -0.484
80 HE1 HIS 10 1HE HIS 10 10.222 -1.529 -4.381
81 HE2 HIS 10 2HE HIS 10 12.235 -2.077 -2.967
82 H CYS 11 H CYS 11 6.392 -0.148 0.247
83 HA CYS 11 HA CYS 11 5.122 0.275 -2.372
84 1HB CYS 11 1HB CYS 11 4.569 1.792 0.180
85 2HB CYS 11 2HB CYS 11 3.604 1.781 -1.289
86 H LYS 12 H LYS 12 4.800 2.931 -2.464
87 HA LYS 12 HA LYS 12 7.556 3.915 -2.652
88 1HB LYS 12 1HB LYS 12 6.604 5.625 -4.189
89 2HB LYS 12 2HB LYS 12 6.386 3.975 -4.755
90 1HG LYS 12 1HG LYS 12 4.080 3.991 -4.063
91 2HG LYS 12 2HG LYS 12 4.275 5.588 -3.339
92 1HD LYS 12 1HD LYS 12 4.725 5.024 -6.264
93 2HD LYS 12 2HD LYS 12 3.179 5.560 -5.603
94 1HE LYS 12 1HE LYS 12 4.273 7.576 -4.723
95 2HE LYS 12 2HE LYS 12 5.802 7.041 -5.420
96 1HZ LYS 12 1HZ LYS 12 4.828 7.181 -7.613
97 2HZ LYS 12 2HZ LYS 12 4.675 8.668 -6.821
98 3HZ LYS 12 3HZ LYS 12 3.336 7.644 -6.963
99 H ARG 13 H ARG 13 4.553 4.420 -1.056
100 HA ARG 13 HA ARG 13 5.644 6.088 0.907
101 1HB ARG 13 1HB ARG 13 4.438 8.199 0.352
102 2HB ARG 13 2HB ARG 13 5.747 7.818 -0.750
103 1HG ARG 13 1HG ARG 13 4.056 6.873 -2.316
104 2HG ARG 13 2HG ARG 13 2.799 7.484 -1.241
105 1HD ARG 13 1HD ARG 13 3.277 8.989 -3.141
106 2HD ARG 13 2HD ARG 13 3.546 9.744 -1.571
107 HE ARG 13 HE ARG 13 5.963 8.649 -2.482
108 1HH1 ARG 13 1HH1 ARG 13 3.746 11.231 -3.224
109 2HH1 ARG 13 2HH1 ARG 13 4.965 12.255 -3.908
110 1HH2 ARG 13 1HH2 ARG 13 7.576 9.993 -3.375
111 2HH2 ARG 13 2HH2 ARG 13 7.141 11.551 -3.993
112 H GLY 14 H GLY 14 4.517 5.256 2.539
113 1HA GLY 14 1HA GLY 14 2.580 5.236 3.897
114 2HA GLY 14 2HA GLY 14 1.598 5.471 2.458
115 H GLU 15 H GLU 15 3.954 3.052 3.624
116 HA GLU 15 HA GLU 15 2.630 0.897 2.315
117 1HB GLU 15 1HB GLU 15 4.625 0.797 4.585
118 2HB GLU 15 2HB GLU 15 4.181 -0.545 3.543
119 1HG GLU 15 1HG GLU 15 6.223 0.183 2.714
120 2HG GLU 15 2HG GLU 15 5.037 0.886 1.623
121 H ARG 16 H ARG 16 0.901 -0.236 2.966
122 HA ARG 16 HA ARG 16 0.263 -0.327 5.824
123 1HB ARG 16 1HB ARG 16 -1.716 0.455 3.678
124 2HB ARG 16 2HB ARG 16 -2.100 0.187 5.372
125 1HG ARG 16 1HG ARG 16 -0.785 2.079 6.033
126 2HG ARG 16 2HG ARG 16 -0.192 2.295 4.385
127 1HD ARG 16 1HD ARG 16 -2.466 2.774 3.629
128 2HD ARG 16 2HD ARG 16 -3.064 2.544 5.271
129 HE ARG 16 HE ARG 16 -1.072 4.500 5.337
130 1HH1 ARG 16 1HH1 ARG 16 -4.275 4.040 4.045
131 2HH1 ARG 16 2HH1 ARG 16 -4.686 5.720 4.118
132 1HH2 ARG 16 1HH2 ARG 16 -1.603 6.715 5.435
133 2HH2 ARG 16 2HH2 ARG 16 -3.166 7.241 4.905
134 H VAL 17 H VAL 17 -1.313 -1.962 6.389
135 HA VAL 17 HA VAL 17 -1.646 -4.084 4.400
136 HB VAL 17 HB VAL 17 0.332 -4.568 5.855
137 1HG1 VAL 17 1HG1 VAL 17 -1.734 -4.767 8.039
138 2HG1 VAL 17 2HG1 VAL 17 -0.453 -3.562 7.917
139 3HG1 VAL 17 3HG1 VAL 17 -0.046 -5.258 8.172
140 1HG2 VAL 17 1HG2 VAL 17 -0.284 -6.890 6.328
141 2HG2 VAL 17 2HG2 VAL 17 -0.872 -6.370 4.749
142 3HG2 VAL 17 3HG2 VAL 17 -1.986 -6.481 6.111
143 H ARG 18 H ARG 18 -3.507 -2.175 5.219
144 HA ARG 18 HA ARG 18 -5.243 -3.145 7.255
145 1HB ARG 18 1HB ARG 18 -5.157 -0.774 6.414
146 2HB ARG 18 2HB ARG 18 -5.955 -1.325 4.948
147 1HG ARG 18 1HG ARG 18 -7.639 -0.411 6.314
148 2HG ARG 18 2HG ARG 18 -7.823 -2.162 6.420
149 1HD ARG 18 1HD ARG 18 -8.049 -1.142 8.616
150 2HD ARG 18 2HD ARG 18 -6.608 -2.157 8.546
151 HE ARG 18 HE ARG 18 -5.857 0.456 7.908
152 1HH1 ARG 18 1HH1 ARG 18 -7.075 -1.346 10.632
153 2HH1 ARG 18 2HH1 ARG 18 -6.321 -0.323 11.809
154 1HH2 ARG 18 1HH2 ARG 18 -4.860 1.805 9.450
155 2HH2 ARG 18 2HH2 ARG 18 -5.061 1.468 11.137
156 H GLY 19 H GLY 19 -5.146 -3.446 3.745
157 1HA GLY 19 1HA GLY 19 -6.982 -5.733 3.954
158 2HA GLY 19 2HA GLY 19 -7.321 -4.460 2.790
159 H THR 20 H THR 20 -5.097 -7.028 3.668
160 HA THR 20 HA THR 20 -3.165 -6.863 1.744
161 HB THR 20 HB THR 20 -3.038 -9.353 1.798
162 HG1 THR 20 1HG THR 20 -4.701 -9.926 3.736
163 1HG2 THR 20 1HG2 THR 20 -1.895 -8.038 3.500
164 2HG2 THR 20 2HG2 THR 20 -2.532 -9.525 4.202
165 3HG2 THR 20 3HG2 THR 20 -3.362 -7.994 4.476
166 H CYS 21 H CYS 21 -3.045 -7.024 -0.393
167 HA CYS 21 HA CYS 21 -5.483 -7.550 -1.893
168 1HB CYS 21 1HB CYS 21 -3.932 -5.569 -2.315
169 2HB CYS 21 2HB CYS 21 -2.807 -6.729 -3.013
170 H GLY 22 H GLY 22 -2.910 -9.320 -0.770
171 1HA GLY 22 1HA GLY 22 -3.602 -11.612 -2.305
172 2HA GLY 22 2HA GLY 22 -2.086 -10.928 -2.870
173 H ILE 23 H ILE 23 -1.308 -13.101 -2.190
174 HA ILE 23 HA ILE 23 -1.169 -13.692 0.614
175 HB ILE 23 HB ILE 23 0.399 -14.891 -1.674
176 1HG1 ILE 23 1HG1 ILE 23 -2.085 -15.928 -0.291
177 2HG1 ILE 23 2HG1 ILE 23 -2.084 -15.120 -1.855
178 1HG2 ILE 23 1HG2 ILE 23 -0.029 -15.864 1.149
179 2HG2 ILE 23 2HG2 ILE 23 1.484 -15.268 0.465
180 3HG2 ILE 23 3HG2 ILE 23 0.776 -16.769 -0.133
181 1HD1 ILE 23 1HD1 ILE 23 -0.715 -17.719 -1.198
182 2HD1 ILE 23 2HD1 ILE 23 -0.683 -16.908 -2.764
183 3HD1 ILE 23 3HD1 ILE 23 -2.205 -17.522 -2.120
184 H ARG 24 H ARG 24 1.243 -12.717 -1.823
185 HA ARG 24 HA ARG 24 3.056 -11.954 0.354
186 1HB ARG 24 1HB ARG 24 4.835 -11.977 -1.293
187 2HB ARG 24 2HB ARG 24 3.952 -13.494 -1.359
188 1HG ARG 24 1HG ARG 24 3.234 -11.271 -3.220
189 2HG ARG 24 2HG ARG 24 4.633 -12.293 -3.552
190 1HD ARG 24 1HD ARG 24 1.832 -13.304 -3.078
191 2HD ARG 24 2HD ARG 24 2.563 -13.072 -4.665
192 HE ARG 24 HE ARG 24 4.295 -14.701 -3.292
193 1HH1 ARG 24 1HH1 ARG 24 0.939 -14.829 -4.218
194 2HH1 ARG 24 2HH1 ARG 24 0.908 -16.556 -4.347
195 1HH2 ARG 24 1HH2 ARG 24 4.264 -16.974 -3.459
196 2HH2 ARG 24 2HH2 ARG 24 2.797 -17.775 -3.914
197 H PHE 25 H PHE 25 0.787 -10.616 -1.642
198 HA PHE 25 HA PHE 25 2.149 -8.118 -2.166
199 1HB PHE 25 1HB PHE 25 -0.701 -9.007 -2.635
200 2HB PHE 25 2HB PHE 25 -0.079 -7.422 -3.081
201 HD1 PHE 25 1HD PHE 25 0.149 -11.033 -3.762
202 HD2 PHE 25 2HD PHE 25 1.256 -7.120 -5.018
203 HE1 PHE 25 1HE PHE 25 0.915 -11.945 -5.915
204 HE2 PHE 25 2HE PHE 25 2.023 -8.024 -7.172
205 HZ PHE 25 HZ PHE 25 1.853 -10.440 -7.624
206 H LEU 26 H LEU 26 0.806 -6.075 -1.630
207 HA LEU 26 HA LEU 26 -0.478 -6.182 0.976
208 1HB LEU 26 1HB LEU 26 0.966 -4.446 1.921
209 2HB LEU 26 2HB LEU 26 1.858 -5.913 1.571
210 HG LEU 26 HG LEU 26 1.848 -3.601 -0.345
211 1HD1 LEU 26 1HD1 LEU 26 3.949 -2.862 0.694
212 2HD1 LEU 26 2HD1 LEU 26 3.703 -4.034 1.989
213 3HD1 LEU 26 3HD1 LEU 26 2.570 -2.699 1.780
214 1HD2 LEU 26 1HD2 LEU 26 4.007 -4.581 -1.008
215 2HD2 LEU 26 2HD2 LEU 26 2.668 -5.710 -1.211
216 3HD2 LEU 26 3HD2 LEU 26 3.761 -5.877 0.163
217 H TYR 27 H TYR 27 -0.965 -3.718 1.617
218 HA TYR 27 HA TYR 27 -2.136 -2.547 -0.815
219 1HB TYR 27 1HB TYR 27 -3.414 -3.385 1.486
220 2HB TYR 27 2HB TYR 27 -3.288 -1.643 1.709
221 HD1 TYR 27 1HD TYR 27 -5.157 -0.468 1.029
222 HD2 TYR 27 2HD TYR 27 -4.039 -3.966 -1.119
223 HE1 TYR 27 1HE TYR 27 -7.065 -0.140 -0.485
224 HE2 TYR 27 2HE TYR 27 -5.944 -3.647 -2.640
225 HH TYR 27 HH TYR 27 -8.137 -2.533 -2.637
226 H CYS 28 H CYS 28 -1.377 -0.681 -1.464
227 HA CYS 28 HA CYS 28 0.080 1.001 0.469
228 1HB CYS 28 1HB CYS 28 0.448 0.976 -2.530
229 2HB CYS 28 2HB CYS 28 1.468 1.768 -1.333
230 H CYS 29 H CYS 29 -0.617 3.028 0.810
231 HA CYS 29 HA CYS 29 -2.328 4.321 -1.164
232 1HB CYS 29 1HB CYS 29 -3.628 2.948 0.685
233 2HB CYS 29 2HB CYS 29 -3.284 4.369 1.666
234 HA PRO 30 HA PRO 30 0.024 7.915 -0.094
235 1HB PRO 30 1HB PRO 30 -2.531 9.402 -0.420
236 2HB PRO 30 2HB PRO 30 -0.968 9.664 -1.202
237 1HG PRO 30 1HG PRO 30 -2.980 8.563 -2.545
238 2HG PRO 30 2HG PRO 30 -1.319 7.980 -2.763
239 1HD PRO 30 1HD PRO 30 -3.565 6.768 -1.206
240 2HD PRO 30 2HD PRO 30 -2.326 5.976 -2.202
241 H ARG 31 H ARG 31 -0.435 10.086 1.229
242 HA ARG 31 HA ARG 31 -0.537 9.425 3.909
243 1HB ARG 31 1HB ARG 31 0.413 11.522 3.070
244 2HB ARG 31 2HB ARG 31 -1.194 12.089 2.635
245 1HG ARG 31 1HG ARG 31 -1.845 12.086 4.981
246 2HG ARG 31 2HG ARG 31 -0.249 11.480 5.430
247 1HD ARG 31 1HD ARG 31 0.771 13.509 4.503
248 2HD ARG 31 2HD ARG 31 -0.830 14.113 4.076
249 HE ARG 31 HE ARG 31 -1.142 13.760 6.676
250 1HH1 ARG 31 1HH1 ARG 31 1.544 15.140 4.936
251 2HH1 ARG 31 2HH1 ARG 31 2.000 16.201 6.228
252 1HH2 ARG 31 1HH2 ARG 31 -0.546 15.152 8.380
253 2HH2 ARG 31 2HH2 ARG 31 0.814 16.207 8.185
254 H ARG 32 H ARG 32 -3.110 11.140 2.115
255 HA ARG 32 HA ARG 32 -5.012 10.297 4.182
256 1HB ARG 32 1HB ARG 32 -4.858 12.716 3.597
257 2HB ARG 32 2HB ARG 32 -5.395 12.321 1.969
258 1HG ARG 32 1HG ARG 32 -7.510 11.499 2.850
259 2HG ARG 32 2HG ARG 32 -6.971 11.854 4.493
260 1HD ARG 32 1HD ARG 32 -7.389 13.849 2.270
261 2HD ARG 32 2HD ARG 32 -8.422 13.621 3.680
262 HE ARG 32 HE ARG 32 -6.065 14.176 4.817
263 1HH1 ARG 32 1HH1 ARG 32 -7.798 15.727 2.221
264 2HH1 ARG 32 2HH1 ARG 32 -7.161 17.302 2.565
265 1HH2 ARG 32 1HH2 ARG 32 -5.220 16.242 5.276
266 2HH2 ARG 32 2HH2 ARG 32 -5.693 17.593 4.300
Start of MODEL 13
1 1H GLY 1 1H GLY 1 -9.910 9.894 -3.272
2 2H GLY 1 2H GLY 1 -8.354 10.375 -2.811
3 3H GLY 1 3H GLY 1 -9.680 11.373 -2.483
4 1HA GLY 1 1HA GLY 1 -8.946 10.226 -0.483
5 2HA GLY 1 2HA GLY 1 -10.580 9.771 -0.941
6 H LEU 2 H LEU 2 -10.682 7.801 -2.425
7 HA LEU 2 HA LEU 2 -8.901 5.757 -1.296
8 1HB LEU 2 1HB LEU 2 -11.530 5.732 -1.201
9 2HB LEU 2 2HB LEU 2 -11.384 5.117 -2.836
10 HG LEU 2 HG LEU 2 -10.045 3.824 -0.461
11 1HD1 LEU 2 1HD1 LEU 2 -11.854 2.171 -0.542
12 2HD1 LEU 2 2HD1 LEU 2 -12.680 3.143 -1.760
13 3HD1 LEU 2 3HD1 LEU 2 -12.452 3.779 -0.130
14 1HD2 LEU 2 1HD2 LEU 2 -9.897 1.891 -1.971
15 2HD2 LEU 2 2HD2 LEU 2 -9.029 3.290 -2.603
16 3HD2 LEU 2 3HD2 LEU 2 -10.606 2.858 -3.265
17 H LEU 3 H LEU 3 -7.197 6.341 -2.780
18 HA LEU 3 HA LEU 3 -7.526 5.004 -5.368
19 1HB LEU 3 1HB LEU 3 -6.259 7.716 -4.969
20 2HB LEU 3 2HB LEU 3 -6.188 6.791 -6.456
21 HG LEU 3 HG LEU 3 -8.740 7.799 -5.195
22 1HD1 LEU 3 1HD1 LEU 3 -8.755 9.441 -7.012
23 2HD1 LEU 3 2HD1 LEU 3 -7.160 8.888 -7.521
24 3HD1 LEU 3 3HD1 LEU 3 -7.367 9.656 -5.947
25 1HD2 LEU 3 1HD2 LEU 3 -9.045 5.800 -6.557
26 2HD2 LEU 3 2HD2 LEU 3 -8.188 6.568 -7.894
27 3HD2 LEU 3 3HD2 LEU 3 -9.737 7.214 -7.351
28 H CYS 4 H CYS 4 -6.443 3.442 -3.778
29 HA CYS 4 HA CYS 4 -3.587 3.938 -3.446
30 1HB CYS 4 1HB CYS 4 -5.084 1.468 -2.582
31 2HB CYS 4 2HB CYS 4 -3.563 2.096 -1.956
32 H TYR 5 H TYR 5 -2.267 1.756 -3.746
33 HA TYR 5 HA TYR 5 -3.017 0.477 -6.275
34 1HB TYR 5 1HB TYR 5 -0.310 1.710 -5.716
35 2HB TYR 5 2HB TYR 5 -0.729 0.765 -7.142
36 HD1 TYR 5 1HD TYR 5 -2.198 1.700 -8.865
37 HD2 TYR 5 2HD TYR 5 -1.042 3.996 -5.475
38 HE1 TYR 5 1HE TYR 5 -2.942 3.748 -10.005
39 HE2 TYR 5 2HE TYR 5 -1.783 6.050 -6.606
40 HH TYR 5 HH TYR 5 -2.180 6.870 -8.860
41 H CYS 6 H CYS 6 -2.369 -1.629 -6.482
42 HA CYS 6 HA CYS 6 -1.528 -2.959 -4.060
43 1HB CYS 6 1HB CYS 6 -2.055 -4.143 -6.795
44 2HB CYS 6 2HB CYS 6 -1.960 -5.019 -5.271
45 H ARG 7 H ARG 7 0.513 -3.385 -3.536
46 HA ARG 7 HA ARG 7 2.485 -3.703 -5.705
47 1HB ARG 7 1HB ARG 7 2.846 -2.235 -3.091
48 2HB ARG 7 2HB ARG 7 4.168 -2.657 -4.169
49 1HG ARG 7 1HG ARG 7 3.037 -1.321 -5.950
50 2HG ARG 7 2HG ARG 7 1.882 -0.783 -4.726
51 1HD ARG 7 1HD ARG 7 3.704 0.165 -3.413
52 2HD ARG 7 2HD ARG 7 4.872 -0.395 -4.608
53 HE ARG 7 HE ARG 7 2.845 1.692 -5.078
54 1HH1 ARG 7 1HH1 ARG 7 5.903 0.182 -5.814
55 2HH1 ARG 7 2HH1 ARG 7 6.386 1.415 -6.927
56 1HH2 ARG 7 1HH2 ARG 7 3.479 3.316 -6.543
57 2HH2 ARG 7 2HH2 ARG 7 5.011 3.196 -7.341
58 H LYS 8 H LYS 8 4.662 -4.509 -4.448
59 HA LYS 8 HA LYS 8 3.951 -6.641 -2.579
60 1HB LYS 8 1HB LYS 8 3.837 -7.579 -4.890
61 2HB LYS 8 2HB LYS 8 5.532 -7.158 -5.103
62 1HG LYS 8 1HG LYS 8 6.147 -8.659 -3.287
63 2HG LYS 8 2HG LYS 8 4.448 -9.066 -3.039
64 1HD LYS 8 1HD LYS 8 5.462 -10.813 -4.331
65 2HD LYS 8 2HD LYS 8 4.374 -9.907 -5.383
66 1HE LYS 8 1HE LYS 8 6.272 -8.669 -6.291
67 2HE LYS 8 2HE LYS 8 7.365 -9.546 -5.221
68 1HZ LYS 8 1HZ LYS 8 6.751 -11.600 -6.335
69 2HZ LYS 8 2HZ LYS 8 7.365 -10.483 -7.446
70 3HZ LYS 8 3HZ LYS 8 5.699 -10.760 -7.359
71 H GLY 9 H GLY 9 5.434 -6.898 -1.018
72 1HA GLY 9 1HA GLY 9 7.682 -7.067 -0.226
73 2HA GLY 9 2HA GLY 9 8.180 -5.974 -1.509
74 H HIS 10 H HIS 10 7.241 -3.719 -1.345
75 HA HIS 10 HA HIS 10 6.417 -2.775 1.221
76 1HB HIS 10 1HB HIS 10 8.956 -3.217 1.409
77 2HB HIS 10 2HB HIS 10 9.136 -1.808 0.368
78 HD1 HIS 10 1HD HIS 10 8.015 -2.809 3.808
79 HD2 HIS 10 2HD HIS 10 8.720 0.644 1.607
80 HE1 HIS 10 1HE HIS 10 7.947 -0.925 5.473
81 HE2 HIS 10 2HE HIS 10 8.448 1.146 4.130
82 H CYS 11 H CYS 11 5.786 -0.585 1.184
83 HA CYS 11 HA CYS 11 5.342 0.442 -1.507
84 1HB CYS 11 1HB CYS 11 4.305 1.620 1.067
85 2HB CYS 11 2HB CYS 11 3.670 1.841 -0.558
86 H LYS 12 H LYS 12 5.962 2.473 -2.211
87 HA LYS 12 HA LYS 12 8.332 3.543 -0.922
88 1HB LYS 12 1HB LYS 12 8.701 4.765 -2.926
89 2HB LYS 12 2HB LYS 12 8.133 3.177 -3.419
90 1HG LYS 12 1HG LYS 12 5.884 4.096 -3.755
91 2HG LYS 12 2HG LYS 12 6.480 5.693 -3.292
92 1HD LYS 12 1HD LYS 12 8.051 5.638 -5.180
93 2HD LYS 12 2HD LYS 12 7.424 4.055 -5.646
94 1HE LYS 12 1HE LYS 12 5.200 5.048 -5.965
95 2HE LYS 12 2HE LYS 12 5.852 6.628 -5.534
96 1HZ LYS 12 1HZ LYS 12 5.724 6.394 -7.916
97 2HZ LYS 12 2HZ LYS 12 6.652 4.981 -7.872
98 3HZ LYS 12 3HZ LYS 12 7.348 6.462 -7.447
99 H ARG 13 H ARG 13 4.998 4.168 -1.002
100 HA ARG 13 HA ARG 13 5.338 6.527 0.630
101 1HB ARG 13 1HB ARG 13 5.138 6.978 -2.045
102 2HB ARG 13 2HB ARG 13 3.444 7.003 -1.581
103 1HG ARG 13 1HG ARG 13 4.229 9.234 -1.495
104 2HG ARG 13 2HG ARG 13 4.044 8.690 0.173
105 1HD ARG 13 1HD ARG 13 6.419 8.289 0.347
106 2HD ARG 13 2HD ARG 13 6.643 8.681 -1.358
107 HE ARG 13 HE ARG 13 5.448 10.828 0.096
108 1HH1 ARG 13 1HH1 ARG 13 8.481 9.266 -0.617
109 2HH1 ARG 13 2HH1 ARG 13 9.426 10.689 -0.336
110 1HH2 ARG 13 1HH2 ARG 13 6.686 12.707 0.467
111 2HH2 ARG 13 2HH2 ARG 13 8.407 12.645 0.280
112 H GLY 14 H GLY 14 4.031 6.140 2.288
113 1HA GLY 14 1HA GLY 14 2.130 5.655 3.485
114 2HA GLY 14 2HA GLY 14 1.236 5.772 1.977
115 H GLU 15 H GLU 15 3.229 3.608 3.937
116 HA GLU 15 HA GLU 15 2.293 1.288 2.447
117 1HB GLU 15 1HB GLU 15 3.886 0.967 4.938
118 2HB GLU 15 2HB GLU 15 4.000 0.099 3.416
119 1HG GLU 15 1HG GLU 15 5.974 1.277 3.460
120 2HG GLU 15 2HG GLU 15 4.939 2.325 2.491
121 H ARG 16 H ARG 16 0.808 -0.180 3.190
122 HA ARG 16 HA ARG 16 -0.027 -0.221 5.933
123 1HB ARG 16 1HB ARG 16 -1.197 1.794 4.947
124 2HB ARG 16 2HB ARG 16 -2.081 0.678 3.916
125 1HG ARG 16 1HG ARG 16 -3.562 0.968 5.634
126 2HG ARG 16 2HG ARG 16 -2.698 -0.470 6.177
127 1HD ARG 16 1HD ARG 16 -2.056 2.353 7.021
128 2HD ARG 16 2HD ARG 16 -3.021 1.218 7.962
129 HE ARG 16 HE ARG 16 -0.315 0.411 7.234
130 1HH1 ARG 16 1HH1 ARG 16 -2.518 1.594 9.658
131 2HH1 ARG 16 2HH1 ARG 16 -1.478 1.191 10.983
132 1HH2 ARG 16 1HH2 ARG 16 1.062 -0.121 8.971
133 2HH2 ARG 16 2HH2 ARG 16 0.556 0.216 10.593
134 H VAL 17 H VAL 17 -1.412 -1.940 6.446
135 HA VAL 17 HA VAL 17 -1.923 -3.848 4.265
136 HB VAL 17 HB VAL 17 -1.180 -4.760 7.034
137 1HG1 VAL 17 1HG1 VAL 17 -1.052 -6.107 4.339
138 2HG1 VAL 17 2HG1 VAL 17 -2.299 -6.357 5.559
139 3HG1 VAL 17 3HG1 VAL 17 -0.636 -6.842 5.887
140 1HG2 VAL 17 1HG2 VAL 17 0.685 -3.407 6.252
141 2HG2 VAL 17 2HG2 VAL 17 0.713 -4.299 4.730
142 3HG2 VAL 17 3HG2 VAL 17 1.114 -5.117 6.241
143 H ARG 18 H ARG 18 -3.825 -2.065 5.073
144 HA ARG 18 HA ARG 18 -5.542 -3.347 7.038
145 1HB ARG 18 1HB ARG 18 -5.331 -0.868 6.929
146 2HB ARG 18 2HB ARG 18 -6.070 -0.903 5.334
147 1HG ARG 18 1HG ARG 18 -7.736 -0.295 6.931
148 2HG ARG 18 2HG ARG 18 -8.091 -1.923 6.349
149 1HD ARG 18 1HD ARG 18 -7.014 -2.849 8.363
150 2HD ARG 18 2HD ARG 18 -6.734 -1.211 8.948
151 HE ARG 18 HE ARG 18 -9.430 -1.344 8.491
152 1HH1 ARG 18 1HH1 ARG 18 -7.144 -3.132 10.421
153 2HH1 ARG 18 2HH1 ARG 18 -8.301 -3.541 11.644
154 1HH2 ARG 18 1HH2 ARG 18 -10.959 -1.878 10.097
155 2HH2 ARG 18 2HH2 ARG 18 -10.469 -2.828 11.460
156 H GLY 19 H GLY 19 -5.204 -3.026 3.601
157 1HA GLY 19 1HA GLY 19 -7.439 -4.905 3.251
158 2HA GLY 19 2HA GLY 19 -7.356 -3.458 2.256
159 H THR 20 H THR 20 -5.458 -6.310 3.186
160 HA THR 20 HA THR 20 -3.451 -6.260 1.348
161 HB THR 20 HB THR 20 -3.529 -8.005 2.999
162 HG1 THR 20 1HG THR 20 -2.599 -8.408 0.790
163 1HG2 THR 20 1HG2 THR 20 -5.909 -9.103 1.497
164 2HG2 THR 20 2HG2 THR 20 -5.959 -8.327 3.079
165 3HG2 THR 20 3HG2 THR 20 -5.116 -9.862 2.877
166 H CYS 21 H CYS 21 -3.193 -6.552 -0.780
167 HA CYS 21 HA CYS 21 -5.608 -6.921 -2.395
168 1HB CYS 21 1HB CYS 21 -4.098 -4.916 -2.711
169 2HB CYS 21 2HB CYS 21 -2.877 -6.024 -3.326
170 H GLY 22 H GLY 22 -3.780 -9.033 -1.055
171 1HA GLY 22 1HA GLY 22 -4.175 -11.115 -2.820
172 2HA GLY 22 2HA GLY 22 -2.584 -10.480 -3.208
173 H ILE 23 H ILE 23 -1.518 -12.354 -2.563
174 HA ILE 23 HA ILE 23 -1.825 -13.264 0.187
175 HB ILE 23 HB ILE 23 -0.039 -14.318 -2.012
176 1HG1 ILE 23 1HG1 ILE 23 -2.622 -15.459 -0.925
177 2HG1 ILE 23 2HG1 ILE 23 -2.504 -14.533 -2.417
178 1HG2 ILE 23 1HG2 ILE 23 -0.719 -15.479 0.688
179 2HG2 ILE 23 2HG2 ILE 23 0.843 -14.822 0.199
180 3HG2 ILE 23 3HG2 ILE 23 0.223 -16.284 -0.569
181 1HD1 ILE 23 1HD1 ILE 23 -1.000 -16.239 -3.334
182 2HD1 ILE 23 2HD1 ILE 23 -2.572 -16.900 -2.887
183 3HD1 ILE 23 3HD1 ILE 23 -1.174 -17.171 -1.847
184 H ARG 24 H ARG 24 1.047 -12.632 -1.832
185 HA ARG 24 HA ARG 24 2.491 -11.774 0.552
186 1HB ARG 24 1HB ARG 24 4.489 -11.872 -0.876
187 2HB ARG 24 2HB ARG 24 3.595 -13.385 -0.906
188 1HG ARG 24 1HG ARG 24 2.558 -12.639 -3.053
189 2HG ARG 24 2HG ARG 24 3.663 -11.262 -3.035
190 1HD ARG 24 1HD ARG 24 4.559 -13.039 -4.423
191 2HD ARG 24 2HD ARG 24 5.569 -12.810 -2.996
192 HE ARG 24 HE ARG 24 3.612 -14.826 -2.565
193 1HH1 ARG 24 1HH1 ARG 24 6.670 -14.215 -4.124
194 2HH1 ARG 24 2HH1 ARG 24 7.179 -15.869 -4.058
195 1HH2 ARG 24 1HH2 ARG 24 4.275 -17.004 -2.475
196 2HH2 ARG 24 2HH2 ARG 24 5.819 -17.454 -3.121
197 H PHE 25 H PHE 25 0.509 -10.319 -1.548
198 HA PHE 25 HA PHE 25 2.081 -7.938 -2.077
199 1HB PHE 25 1HB PHE 25 -0.847 -8.495 -2.608
200 2HB PHE 25 2HB PHE 25 0.069 -7.118 -3.212
201 HD1 PHE 25 1HD PHE 25 -0.679 -10.643 -3.623
202 HD2 PHE 25 2HD PHE 25 1.791 -7.435 -4.933
203 HE1 PHE 25 1HE PHE 25 -0.049 -11.946 -5.614
204 HE2 PHE 25 2HE PHE 25 2.424 -8.731 -6.926
205 HZ PHE 25 HZ PHE 25 1.504 -10.989 -7.268
206 H LEU 26 H LEU 26 0.703 -5.806 -1.679
207 HA LEU 26 HA LEU 26 -0.684 -5.789 0.854
208 1HB LEU 26 1HB LEU 26 0.824 -4.200 1.930
209 2HB LEU 26 2HB LEU 26 1.623 -5.725 1.611
210 HG LEU 26 HG LEU 26 1.935 -3.339 -0.197
211 1HD1 LEU 26 1HD1 LEU 26 2.651 -2.671 2.018
212 2HD1 LEU 26 2HD1 LEU 26 4.050 -2.902 0.969
213 3HD1 LEU 26 3HD1 LEU 26 3.633 -4.129 2.164
214 1HD2 LEU 26 1HD2 LEU 26 2.572 -5.438 -1.199
215 2HD2 LEU 26 2HD2 LEU 26 3.537 -5.860 0.217
216 3HD2 LEU 26 3HD2 LEU 26 4.024 -4.515 -0.815
217 H TYR 27 H TYR 27 -1.129 -3.381 1.488
218 HA TYR 27 HA TYR 27 -2.095 -2.119 -0.975
219 1HB TYR 27 1HB TYR 27 -3.418 -2.776 1.357
220 2HB TYR 27 2HB TYR 27 -3.136 -1.049 1.538
221 HD1 TYR 27 1HD TYR 27 -4.038 -3.277 -1.321
222 HD2 TYR 27 2HD TYR 27 -4.991 0.190 0.952
223 HE1 TYR 27 1HE TYR 27 -5.942 -2.828 -2.815
224 HE2 TYR 27 2HE TYR 27 -6.896 0.650 -0.534
225 HH TYR 27 HH TYR 27 -8.065 -1.627 -2.783
226 H CYS 28 H CYS 28 -1.224 -0.319 -1.679
227 HA CYS 28 HA CYS 28 0.332 1.338 0.199
228 1HB CYS 28 1HB CYS 28 0.870 1.004 -2.757
229 2HB CYS 28 2HB CYS 28 1.875 1.848 -1.581
230 H CYS 29 H CYS 29 -0.950 3.032 0.638
231 HA CYS 29 HA CYS 29 -2.442 4.280 -1.558
232 1HB CYS 29 1HB CYS 29 -2.703 4.733 1.421
233 2HB CYS 29 2HB CYS 29 -3.756 5.387 0.171
234 HA PRO 30 HA PRO 30 0.207 7.790 -1.904
235 1HB PRO 30 1HB PRO 30 -2.245 9.466 -1.806
236 2HB PRO 30 2HB PRO 30 -0.979 9.392 -3.037
237 1HG PRO 30 1HG PRO 30 -3.373 8.304 -3.471
238 2HG PRO 30 2HG PRO 30 -1.892 7.520 -4.052
239 1HD PRO 30 1HD PRO 30 -3.605 6.836 -1.700
240 2HD PRO 30 2HD PRO 30 -2.754 5.762 -2.829
241 H ARG 31 H ARG 31 0.406 10.122 -0.944
242 HA ARG 31 HA ARG 31 0.749 9.862 1.840
243 1HB ARG 31 1HB ARG 31 0.742 12.340 0.109
244 2HB ARG 31 2HB ARG 31 1.295 12.285 1.777
245 1HG ARG 31 1HG ARG 31 3.048 10.703 1.145
246 2HG ARG 31 2HG ARG 31 2.496 10.768 -0.530
247 1HD ARG 31 1HD ARG 31 3.490 13.129 1.063
248 2HD ARG 31 2HD ARG 31 4.451 12.217 -0.101
249 HE ARG 31 HE ARG 31 2.639 12.933 -1.743
250 1HH1 ARG 31 1HH1 ARG 31 3.610 14.832 1.014
251 2HH1 ARG 31 2HH1 ARG 31 3.194 16.345 0.279
252 1HH2 ARG 31 1HH2 ARG 31 2.094 14.920 -2.718
253 2HH2 ARG 31 2HH2 ARG 31 2.333 16.395 -1.842
254 H ARG 32 H ARG 32 -1.202 9.338 2.814
255 HA ARG 32 HA ARG 32 -3.397 11.261 2.597
256 1HB ARG 32 1HB ARG 32 -3.282 8.533 3.897
257 2HB ARG 32 2HB ARG 32 -4.712 9.554 3.822
258 1HG ARG 32 1HG ARG 32 -3.246 8.499 1.414
259 2HG ARG 32 2HG ARG 32 -4.677 7.752 2.127
260 1HD ARG 32 1HD ARG 32 -4.535 10.563 1.041
261 2HD ARG 32 2HD ARG 32 -5.214 9.178 0.187
262 HE ARG 32 HE ARG 32 -6.593 9.227 2.521
263 1HH1 ARG 32 1HH1 ARG 32 -5.949 11.607 0.058
264 2HH1 ARG 32 2HH1 ARG 32 -7.440 12.453 0.305
265 1HH2 ARG 32 1HH2 ARG 32 -8.557 10.334 2.853
266 2HH2 ARG 32 2HH2 ARG 32 -8.922 11.729 1.893
Start of MODEL 14
1 1H GLY 1 1H GLY 1 -9.006 13.140 -3.893
2 2H GLY 1 2H GLY 1 -9.315 14.069 -5.273
3 3H GLY 1 3H GLY 1 -7.729 13.889 -4.714
4 1HA GLY 1 1HA GLY 1 -9.447 11.737 -5.823
5 2HA GLY 1 2HA GLY 1 -8.094 12.499 -6.646
6 H LEU 2 H LEU 2 -8.791 10.888 -3.544
7 HA LEU 2 HA LEU 2 -6.135 9.633 -3.700
8 1HB LEU 2 1HB LEU 2 -7.946 9.979 -1.307
9 2HB LEU 2 2HB LEU 2 -6.348 9.259 -1.285
10 HG LEU 2 HG LEU 2 -6.944 12.138 -1.979
11 1HD1 LEU 2 1HD1 LEU 2 -7.363 11.680 0.371
12 2HD1 LEU 2 2HD1 LEU 2 -5.900 12.644 0.177
13 3HD1 LEU 2 3HD1 LEU 2 -5.778 10.919 0.521
14 1HD2 LEU 2 1HD2 LEU 2 -4.322 10.699 -1.581
15 2HD2 LEU 2 2HD2 LEU 2 -4.518 12.432 -1.844
16 3HD2 LEU 2 3HD2 LEU 2 -4.959 11.293 -3.114
17 H LEU 3 H LEU 3 -5.924 7.454 -3.741
18 HA LEU 3 HA LEU 3 -8.122 5.708 -3.065
19 1HB LEU 3 1HB LEU 3 -8.551 6.458 -5.435
20 2HB LEU 3 2HB LEU 3 -7.058 5.658 -5.887
21 HG LEU 3 HG LEU 3 -8.039 3.514 -5.006
22 1HD1 LEU 3 1HD1 LEU 3 -10.560 5.166 -4.934
23 2HD1 LEU 3 2HD1 LEU 3 -9.731 4.462 -3.546
24 3HD1 LEU 3 3HD1 LEU 3 -10.473 3.414 -4.755
25 1HD2 LEU 3 1HD2 LEU 3 -7.971 3.973 -7.382
26 2HD2 LEU 3 2HD2 LEU 3 -9.467 4.903 -7.272
27 3HD2 LEU 3 3HD2 LEU 3 -9.484 3.164 -6.970
28 H CYS 4 H CYS 4 -7.441 3.690 -2.505
29 HA CYS 4 HA CYS 4 -4.609 3.304 -2.195
30 1HB CYS 4 1HB CYS 4 -6.772 1.283 -1.614
31 2HB CYS 4 2HB CYS 4 -5.175 1.400 -0.883
32 H TYR 5 H TYR 5 -3.314 1.756 -3.171
33 HA TYR 5 HA TYR 5 -4.511 0.277 -5.419
34 1HB TYR 5 1HB TYR 5 -1.862 1.739 -5.434
35 2HB TYR 5 2HB TYR 5 -2.469 0.722 -6.737
36 HD1 TYR 5 1HD TYR 5 -2.292 4.020 -5.479
37 HD2 TYR 5 2HD TYR 5 -4.784 1.409 -7.732
38 HE1 TYR 5 1HE TYR 5 -3.432 5.965 -6.460
39 HE2 TYR 5 2HE TYR 5 -5.931 3.348 -8.720
40 HH TYR 5 HH TYR 5 -4.739 6.511 -8.473
41 H CYS 6 H CYS 6 -3.501 -1.682 -5.992
42 HA CYS 6 HA CYS 6 -2.376 -3.112 -3.777
43 1HB CYS 6 1HB CYS 6 -3.879 -4.310 -5.199
44 2HB CYS 6 2HB CYS 6 -2.966 -3.875 -6.639
45 H ARG 7 H ARG 7 -0.290 -3.500 -3.334
46 HA ARG 7 HA ARG 7 1.701 -3.020 -5.445
47 1HB ARG 7 1HB ARG 7 1.835 -2.050 -2.588
48 2HB ARG 7 2HB ARG 7 3.184 -2.003 -3.712
49 1HG ARG 7 1HG ARG 7 0.557 -0.607 -4.159
50 2HG ARG 7 2HG ARG 7 1.989 0.153 -3.464
51 1HD ARG 7 1HD ARG 7 3.238 -0.328 -5.506
52 2HD ARG 7 2HD ARG 7 1.816 -1.109 -6.196
53 HE ARG 7 HE ARG 7 1.726 1.724 -5.423
54 1HH1 ARG 7 1HH1 ARG 7 1.478 -0.777 -7.835
55 2HH1 ARG 7 2HH1 ARG 7 0.852 0.283 -9.054
56 1HH2 ARG 7 1HH2 ARG 7 0.903 3.126 -7.019
57 2HH2 ARG 7 2HH2 ARG 7 0.524 2.502 -8.590
58 H LYS 8 H LYS 8 3.980 -3.694 -4.366
59 HA LYS 8 HA LYS 8 3.647 -6.521 -3.708
60 1HB LYS 8 1HB LYS 8 5.329 -5.228 -5.440
61 2HB LYS 8 2HB LYS 8 6.371 -5.480 -4.047
62 1HG LYS 8 1HG LYS 8 5.914 -7.876 -4.121
63 2HG LYS 8 2HG LYS 8 4.834 -7.631 -5.493
64 1HD LYS 8 1HD LYS 8 6.663 -6.854 -6.857
65 2HD LYS 8 2HD LYS 8 7.764 -6.918 -5.479
66 1HE LYS 8 1HE LYS 8 6.347 -9.289 -6.691
67 2HE LYS 8 2HE LYS 8 8.026 -8.846 -6.992
68 1HZ LYS 8 1HZ LYS 8 6.886 -9.565 -4.345
69 2HZ LYS 8 2HZ LYS 8 8.500 -9.168 -4.650
70 3HZ LYS 8 3HZ LYS 8 7.837 -10.576 -5.310
71 H GLY 9 H GLY 9 6.026 -7.026 -2.470
72 1HA GLY 9 1HA GLY 9 5.571 -6.917 0.181
73 2HA GLY 9 2HA GLY 9 7.195 -6.894 -0.480
74 H HIS 10 H HIS 10 6.944 -4.265 -1.702
75 HA HIS 10 HA HIS 10 6.522 -2.527 0.606
76 1HB HIS 10 1HB HIS 10 8.713 -1.380 0.119
77 2HB HIS 10 2HB HIS 10 8.849 -2.996 0.807
78 HD1 HIS 10 1HD HIS 10 8.893 -4.880 -1.359
79 HD2 HIS 10 2HD HIS 10 10.518 -1.091 -1.860
80 HE1 HIS 10 1HE HIS 10 10.460 -5.076 -3.302
81 HE2 HIS 10 2HE HIS 10 11.354 -2.748 -3.662
82 H CYS 11 H CYS 11 5.522 -0.690 0.088
83 HA CYS 11 HA CYS 11 5.031 -0.106 -2.710
84 1HB CYS 11 1HB CYS 11 3.174 -0.004 -1.085
85 2HB CYS 11 2HB CYS 11 4.010 1.276 -0.217
86 H LYS 12 H LYS 12 5.051 2.324 -3.293
87 HA LYS 12 HA LYS 12 7.748 3.242 -2.977
88 1HB LYS 12 1HB LYS 12 7.032 5.104 -4.452
89 2HB LYS 12 2HB LYS 12 6.675 3.518 -5.120
90 1HG LYS 12 1HG LYS 12 4.347 3.741 -4.419
91 2HG LYS 12 2HG LYS 12 4.705 5.331 -3.744
92 1HD LYS 12 1HD LYS 12 3.728 5.682 -5.887
93 2HD LYS 12 2HD LYS 12 5.451 6.030 -6.039
94 1HE LYS 12 1HE LYS 12 4.688 4.733 -7.941
95 2HE LYS 12 2HE LYS 12 5.808 3.783 -6.965
96 1HZ LYS 12 1HZ LYS 12 2.846 3.569 -6.892
97 2HZ LYS 12 2HZ LYS 12 3.923 2.652 -5.964
98 3HZ LYS 12 3HZ LYS 12 3.895 2.476 -7.646
99 H ARG 13 H ARG 13 4.712 3.910 -1.490
100 HA ARG 13 HA ARG 13 5.865 5.371 0.612
101 1HB ARG 13 1HB ARG 13 4.888 7.590 0.178
102 2HB ARG 13 2HB ARG 13 6.106 7.158 -1.008
103 1HG ARG 13 1HG ARG 13 4.395 6.607 -2.620
104 2HG ARG 13 2HG ARG 13 3.134 6.927 -1.429
105 1HD ARG 13 1HD ARG 13 5.120 8.947 -2.463
106 2HD ARG 13 2HD ARG 13 3.445 8.800 -2.994
107 HE ARG 13 HE ARG 13 3.132 9.144 -0.368
108 1HH1 ARG 13 1HH1 ARG 13 5.135 10.833 -2.666
109 2HH1 ARG 13 2HH1 ARG 13 5.054 12.342 -1.820
110 1HH2 ARG 13 1HH2 ARG 13 3.021 11.124 0.752
111 2HH2 ARG 13 2HH2 ARG 13 3.854 12.508 0.124
112 H GLY 14 H GLY 14 4.564 5.187 2.327
113 1HA GLY 14 1HA GLY 14 2.622 5.030 3.574
114 2HA GLY 14 2HA GLY 14 1.701 5.358 2.115
115 H GLU 15 H GLU 15 3.634 2.793 3.646
116 HA GLU 15 HA GLU 15 2.141 0.765 2.185
117 1HB GLU 15 1HB GLU 15 4.325 0.360 4.233
118 2HB GLU 15 2HB GLU 15 3.718 -0.822 3.083
119 1HG GLU 15 1HG GLU 15 5.720 -0.142 2.150
120 2HG GLU 15 2HG GLU 15 4.524 0.817 1.280
121 H ARG 16 H ARG 16 0.468 -0.333 3.003
122 HA ARG 16 HA ARG 16 0.099 -0.389 5.915
123 1HB ARG 16 1HB ARG 16 -2.040 0.325 3.902
124 2HB ARG 16 2HB ARG 16 -2.313 0.067 5.620
125 1HG ARG 16 1HG ARG 16 -0.966 1.974 6.177
126 2HG ARG 16 2HG ARG 16 -0.501 2.187 4.489
127 1HD ARG 16 1HD ARG 16 -2.818 2.656 3.900
128 2HD ARG 16 2HD ARG 16 -3.306 2.405 5.575
129 HE ARG 16 HE ARG 16 -1.322 4.392 5.481
130 1HH1 ARG 16 1HH1 ARG 16 -4.654 3.879 4.595
131 2HH1 ARG 16 2HH1 ARG 16 -5.085 5.549 4.750
132 1HH2 ARG 16 1HH2 ARG 16 -1.882 6.590 5.685
133 2HH2 ARG 16 2HH2 ARG 16 -3.510 7.090 5.370
134 H VAL 17 H VAL 17 -1.489 -2.034 6.617
135 HA VAL 17 HA VAL 17 -1.742 -4.258 4.709
136 HB VAL 17 HB VAL 17 -1.062 -4.751 7.596
137 1HG1 VAL 17 1HG1 VAL 17 -0.376 -6.932 6.771
138 2HG1 VAL 17 2HG1 VAL 17 -0.736 -6.438 5.116
139 3HG1 VAL 17 3HG1 VAL 17 -2.039 -6.589 6.295
140 1HG2 VAL 17 1HG2 VAL 17 0.771 -3.432 6.756
141 2HG2 VAL 17 2HG2 VAL 17 0.867 -4.422 5.301
142 3HG2 VAL 17 3HG2 VAL 17 1.281 -5.117 6.868
143 H ARG 18 H ARG 18 -3.850 -2.641 5.089
144 HA ARG 18 HA ARG 18 -5.530 -3.716 7.206
145 1HB ARG 18 1HB ARG 18 -5.690 -1.337 6.792
146 2HB ARG 18 2HB ARG 18 -6.036 -1.615 5.090
147 1HG ARG 18 1HG ARG 18 -8.051 -1.013 6.292
148 2HG ARG 18 2HG ARG 18 -8.159 -2.667 5.689
149 1HD ARG 18 1HD ARG 18 -7.481 -3.474 7.938
150 2HD ARG 18 2HD ARG 18 -7.524 -1.807 8.510
151 HE ARG 18 HE ARG 18 -9.996 -2.348 7.360
152 1HH1 ARG 18 1HH1 ARG 18 -8.087 -3.452 10.059
153 2HH1 ARG 18 2HH1 ARG 18 -9.463 -3.879 11.022
154 1HH2 ARG 18 1HH2 ARG 18 -11.812 -2.911 8.620
155 2HH2 ARG 18 2HH2 ARG 18 -11.579 -3.573 10.203
156 H GLY 19 H GLY 19 -5.031 -4.020 3.788
157 1HA GLY 19 1HA GLY 19 -6.884 -6.276 3.726
158 2HA GLY 19 2HA GLY 19 -7.194 -4.958 2.602
159 H THR 20 H THR 20 -4.915 -7.468 3.521
160 HA THR 20 HA THR 20 -2.866 -7.135 1.755
161 HB THR 20 HB THR 20 -2.566 -9.578 1.748
162 HG1 THR 20 1HG THR 20 -4.690 -10.105 3.410
163 1HG2 THR 20 1HG2 THR 20 -2.399 -9.898 4.175
164 2HG2 THR 20 2HG2 THR 20 -3.417 -8.481 4.432
165 3HG2 THR 20 3HG2 THR 20 -1.823 -8.302 3.697
166 H CYS 21 H CYS 21 -2.489 -7.389 -0.370
167 HA CYS 21 HA CYS 21 -4.777 -7.632 -2.120
168 1HB CYS 21 1HB CYS 21 -3.088 -5.905 -2.536
169 2HB CYS 21 2HB CYS 21 -1.856 -7.145 -2.739
170 H GLY 22 H GLY 22 -2.195 -9.639 -1.003
171 1HA GLY 22 1HA GLY 22 -3.307 -11.962 -2.180
172 2HA GLY 22 2HA GLY 22 -1.915 -11.439 -3.115
173 H ILE 23 H ILE 23 -0.305 -12.793 -2.645
174 HA ILE 23 HA ILE 23 -0.009 -13.925 -0.001
175 HB ILE 23 HB ILE 23 1.660 -14.228 -2.503
176 1HG1 ILE 23 1HG1 ILE 23 0.763 -16.622 -2.269
177 2HG1 ILE 23 2HG1 ILE 23 -0.397 -15.953 -1.128
178 1HG2 ILE 23 1HG2 ILE 23 3.112 -14.481 -0.594
179 2HG2 ILE 23 2HG2 ILE 23 2.802 -16.063 -1.307
180 3HG2 ILE 23 3HG2 ILE 23 1.970 -15.584 0.172
181 1HD1 ILE 23 1HD1 ILE 23 -1.361 -14.573 -2.817
182 2HD1 ILE 23 2HD1 ILE 23 -1.254 -16.219 -3.442
183 3HD1 ILE 23 3HD1 ILE 23 -0.090 -15.002 -3.962
184 H ARG 24 H ARG 24 2.494 -12.469 -2.070
185 HA ARG 24 HA ARG 24 3.706 -11.305 0.321
186 1HB ARG 24 1HB ARG 24 5.684 -10.953 -1.078
187 2HB ARG 24 2HB ARG 24 5.159 -12.629 -1.136
188 1HG ARG 24 1HG ARG 24 3.948 -12.004 -3.288
189 2HG ARG 24 2HG ARG 24 4.901 -10.517 -3.250
190 1HD ARG 24 1HD ARG 24 5.958 -12.250 -4.631
191 2HD ARG 24 2HD ARG 24 6.958 -11.806 -3.248
192 HE ARG 24 HE ARG 24 5.228 -14.144 -2.989
193 1HH1 ARG 24 1HH1 ARG 24 8.428 -12.836 -3.432
194 2HH1 ARG 24 2HH1 ARG 24 9.228 -14.307 -2.990
195 1HH2 ARG 24 1HH2 ARG 24 6.274 -16.082 -2.404
196 2HH2 ARG 24 2HH2 ARG 24 8.005 -16.150 -2.404
197 H PHE 25 H PHE 25 1.349 -10.354 -1.521
198 HA PHE 25 HA PHE 25 2.325 -7.657 -2.105
199 1HB PHE 25 1HB PHE 25 -0.337 -8.937 -2.769
200 2HB PHE 25 2HB PHE 25 0.221 -7.362 -3.322
201 HD1 PHE 25 1HD PHE 25 0.479 -10.966 -3.751
202 HD2 PHE 25 2HD PHE 25 1.966 -7.184 -5.013
203 HE1 PHE 25 1HE PHE 25 1.495 -12.028 -5.723
204 HE2 PHE 25 2HE PHE 25 2.986 -8.239 -6.988
205 HZ PHE 25 HZ PHE 25 2.751 -10.664 -7.346
206 H LEU 26 H LEU 26 1.346 -5.811 -1.259
207 HA LEU 26 HA LEU 26 -0.422 -6.253 1.055
208 1HB LEU 26 1HB LEU 26 1.818 -4.234 0.857
209 2HB LEU 26 2HB LEU 26 0.700 -4.384 2.196
210 HG LEU 26 HG LEU 26 1.617 -6.795 2.400
211 1HD1 LEU 26 1HD1 LEU 26 2.854 -6.867 0.326
212 2HD1 LEU 26 2HD1 LEU 26 3.967 -6.995 1.688
213 3HD1 LEU 26 3HD1 LEU 26 3.811 -5.469 0.816
214 1HD2 LEU 26 1HD2 LEU 26 3.453 -5.991 3.828
215 2HD2 LEU 26 2HD2 LEU 26 1.962 -5.083 4.075
216 3HD2 LEU 26 3HD2 LEU 26 3.273 -4.383 3.125
217 H TYR 27 H TYR 27 -1.065 -3.761 1.762
218 HA TYR 27 HA TYR 27 -2.302 -2.688 -0.682
219 1HB TYR 27 1HB TYR 27 -3.578 -3.680 1.540
220 2HB TYR 27 2HB TYR 27 -3.581 -1.945 1.844
221 HD1 TYR 27 1HD TYR 27 -5.483 -0.843 1.135
222 HD2 TYR 27 2HD TYR 27 -4.112 -4.208 -1.078
223 HE1 TYR 27 1HE TYR 27 -7.369 -0.580 -0.419
224 HE2 TYR 27 2HE TYR 27 -5.997 -3.953 -2.641
225 HH TYR 27 HH TYR 27 -8.245 -2.965 -2.670
226 H CYS 28 H CYS 28 -1.640 -0.788 -1.298
227 HA CYS 28 HA CYS 28 -0.315 0.976 0.645
228 1HB CYS 28 1HB CYS 28 0.956 0.194 -1.387
229 2HB CYS 28 2HB CYS 28 -0.180 1.108 -2.372
230 H CYS 29 H CYS 29 -0.873 3.171 0.767
231 HA CYS 29 HA CYS 29 -2.894 4.310 -0.898
232 1HB CYS 29 1HB CYS 29 -4.029 2.697 0.861
233 2HB CYS 29 2HB CYS 29 -3.800 4.071 1.937
234 HA PRO 30 HA PRO 30 -0.440 7.681 0.811
235 1HB PRO 30 1HB PRO 30 -1.433 9.634 -0.785
236 2HB PRO 30 2HB PRO 30 -0.231 8.464 -1.342
237 1HG PRO 30 1HG PRO 30 -3.196 8.478 -1.757
238 2HG PRO 30 2HG PRO 30 -1.905 8.113 -2.917
239 1HD PRO 30 1HD PRO 30 -3.335 6.179 -1.675
240 2HD PRO 30 2HD PRO 30 -1.634 5.963 -2.135
241 H ARG 31 H ARG 31 -0.802 9.316 2.273
242 HA ARG 31 HA ARG 31 -3.590 9.665 3.138
243 1HB ARG 31 1HB ARG 31 -2.056 8.720 4.815
244 2HB ARG 31 2HB ARG 31 -1.024 10.136 4.667
245 1HG ARG 31 1HG ARG 31 -2.832 11.546 5.508
246 2HG ARG 31 2HG ARG 31 -3.868 10.124 5.655
247 1HD ARG 31 1HD ARG 31 -2.312 9.148 7.262
248 2HD ARG 31 2HD ARG 31 -1.255 10.550 7.103
249 HE ARG 31 HE ARG 31 -3.885 11.310 7.876
250 1HH1 ARG 31 1HH1 ARG 31 -0.915 9.950 9.090
251 2HH1 ARG 31 2HH1 ARG 31 -1.171 10.508 10.709
252 1HH2 ARG 31 1HH2 ARG 31 -4.230 12.047 10.005
253 2HH2 ARG 31 2HH2 ARG 31 -3.055 11.699 11.230
254 H ARG 32 H ARG 32 -0.596 11.430 2.478
255 HA ARG 32 HA ARG 32 -2.090 13.957 2.559
256 1HB ARG 32 1HB ARG 32 0.888 13.428 2.554
257 2HB ARG 32 2HB ARG 32 0.159 15.028 2.554
258 1HG ARG 32 1HG ARG 32 -0.255 12.970 4.712
259 2HG ARG 32 2HG ARG 32 0.931 14.276 4.781
260 1HD ARG 32 1HD ARG 32 -0.876 15.919 4.594
261 2HD ARG 32 2HD ARG 32 -2.059 14.612 4.529
262 HE ARG 32 HE ARG 32 -0.606 14.249 6.857
263 1HH1 ARG 32 1HH1 ARG 32 -2.697 16.677 5.488
264 2HH1 ARG 32 2HH1 ARG 32 -3.275 17.229 7.025
265 1HH2 ARG 32 1HH2 ARG 32 -1.362 14.970 8.884
266 2HH2 ARG 32 2HH2 ARG 32 -2.516 16.260 8.954
Start of MODEL 15
1 1H GLY 1 1H GLY 1 -10.166 11.028 -0.056
2 2H GLY 1 2H GLY 1 -9.319 10.022 -1.121
3 3H GLY 1 3H GLY 1 -9.424 9.619 0.518
4 1HA GLY 1 1HA GLY 1 -11.802 9.291 0.335
5 2HA GLY 1 2HA GLY 1 -11.721 9.748 -1.359
6 H LEU 2 H LEU 2 -10.483 8.364 -2.805
7 HA LEU 2 HA LEU 2 -9.849 5.695 -1.853
8 1HB LEU 2 1HB LEU 2 -12.273 5.630 -2.351
9 2HB LEU 2 2HB LEU 2 -11.931 6.135 -3.996
10 HG LEU 2 HG LEU 2 -10.590 4.043 -4.294
11 1HD1 LEU 2 1HD1 LEU 2 -10.096 3.607 -1.944
12 2HD1 LEU 2 2HD1 LEU 2 -10.905 2.229 -2.690
13 3HD1 LEU 2 3HD1 LEU 2 -11.807 3.313 -1.632
14 1HD2 LEU 2 1HD2 LEU 2 -12.883 4.200 -5.103
15 2HD2 LEU 2 2HD2 LEU 2 -13.487 3.692 -3.526
16 3HD2 LEU 2 3HD2 LEU 2 -12.539 2.575 -4.509
17 H LEU 3 H LEU 3 -7.742 6.173 -2.492
18 HA LEU 3 HA LEU 3 -7.264 5.843 -5.340
19 1HB LEU 3 1HB LEU 3 -5.647 7.705 -5.414
20 2HB LEU 3 2HB LEU 3 -7.297 8.239 -5.160
21 HG LEU 3 HG LEU 3 -5.433 7.891 -2.831
22 1HD1 LEU 3 1HD1 LEU 3 -5.690 10.331 -4.584
23 2HD1 LEU 3 2HD1 LEU 3 -4.256 9.321 -4.398
24 3HD1 LEU 3 3HD1 LEU 3 -4.852 10.265 -3.033
25 1HD2 LEU 3 1HD2 LEU 3 -6.890 9.658 -1.887
26 2HD2 LEU 3 2HD2 LEU 3 -7.767 8.186 -2.300
27 3HD2 LEU 3 3HD2 LEU 3 -7.866 9.594 -3.355
28 H CYS 4 H CYS 4 -6.901 3.989 -3.346
29 HA CYS 4 HA CYS 4 -4.121 4.014 -2.528
30 1HB CYS 4 1HB CYS 4 -6.194 1.831 -2.216
31 2HB CYS 4 2HB CYS 4 -4.640 1.923 -1.393
32 H TYR 5 H TYR 5 -2.540 2.551 -3.222
33 HA TYR 5 HA TYR 5 -3.140 1.235 -5.789
34 1HB TYR 5 1HB TYR 5 -0.515 2.403 -4.843
35 2HB TYR 5 2HB TYR 5 -0.774 1.586 -6.381
36 HD1 TYR 5 1HD TYR 5 -2.889 2.631 -7.728
37 HD2 TYR 5 2HD TYR 5 -0.457 4.700 -4.917
38 HE1 TYR 5 1HE TYR 5 -3.527 4.770 -8.760
39 HE2 TYR 5 2HE TYR 5 -1.089 6.846 -5.941
40 HH TYR 5 HH TYR 5 -3.657 7.177 -8.080
41 H CYS 6 H CYS 6 -2.317 -0.797 -6.194
42 HA CYS 6 HA CYS 6 -1.679 -2.366 -3.826
43 1HB CYS 6 1HB CYS 6 -3.324 -3.452 -5.053
44 2HB CYS 6 2HB CYS 6 -2.621 -2.987 -6.599
45 H ARG 7 H ARG 7 0.267 -3.241 -3.399
46 HA ARG 7 HA ARG 7 2.260 -3.506 -5.505
47 1HB ARG 7 1HB ARG 7 2.594 -1.712 -3.107
48 2HB ARG 7 2HB ARG 7 3.975 -2.385 -3.963
49 1HG ARG 7 1HG ARG 7 2.872 -1.340 -6.060
50 2HG ARG 7 2HG ARG 7 1.975 -0.371 -4.889
51 1HD ARG 7 1HD ARG 7 4.195 0.244 -3.868
52 2HD ARG 7 2HD ARG 7 4.960 -0.525 -5.257
53 HE ARG 7 HE ARG 7 3.474 1.978 -5.239
54 1HH1 ARG 7 1HH1 ARG 7 5.095 -0.496 -7.081
55 2HH1 ARG 7 2HH1 ARG 7 5.283 0.495 -8.489
56 1HH2 ARG 7 1HH2 ARG 7 3.713 3.288 -7.089
57 2HH2 ARG 7 2HH2 ARG 7 4.498 2.645 -8.494
58 H LYS 8 H LYS 8 4.222 -4.672 -4.714
59 HA LYS 8 HA LYS 8 3.552 -6.462 -2.467
60 1HB LYS 8 1HB LYS 8 3.389 -7.542 -4.727
61 2HB LYS 8 2HB LYS 8 5.106 -7.232 -4.941
62 1HG LYS 8 1HG LYS 8 5.607 -8.627 -3.001
63 2HG LYS 8 2HG LYS 8 3.885 -8.935 -2.777
64 1HD LYS 8 1HD LYS 8 4.559 -10.815 -3.940
65 2HD LYS 8 2HD LYS 8 3.986 -9.770 -5.239
66 1HE LYS 8 1HE LYS 8 6.863 -10.022 -4.377
67 2HE LYS 8 2HE LYS 8 6.147 -10.880 -5.740
68 1HZ LYS 8 1HZ LYS 8 5.591 -8.678 -6.695
69 2HZ LYS 8 2HZ LYS 8 7.254 -8.953 -6.555
70 3HZ LYS 8 3HZ LYS 8 6.468 -7.946 -5.447
71 H GLY 9 H GLY 9 5.283 -7.216 -1.183
72 1HA GLY 9 1HA GLY 9 7.463 -7.259 -0.356
73 2HA GLY 9 2HA GLY 9 7.957 -6.208 -1.674
74 H HIS 10 H HIS 10 7.579 -3.939 -1.491
75 HA HIS 10 HA HIS 10 6.578 -2.808 0.931
76 1HB HIS 10 1HB HIS 10 8.767 -1.714 1.559
77 2HB HIS 10 2HB HIS 10 8.668 -3.444 1.876
78 HD1 HIS 10 1HD HIS 10 9.528 -4.792 -0.538
79 HD2 HIS 10 2HD HIS 10 11.216 -1.165 0.575
80 HE1 HIS 10 1HE HIS 10 11.728 -4.687 -1.729
81 HE2 HIS 10 2HE HIS 10 12.785 -2.531 -0.965
82 H CYS 11 H CYS 11 5.787 -0.858 0.487
83 HA CYS 11 HA CYS 11 6.209 0.294 -2.112
84 1HB CYS 11 1HB CYS 11 4.565 1.158 0.266
85 2HB CYS 11 2HB CYS 11 4.627 2.064 -1.240
86 H LYS 12 H LYS 12 6.496 2.746 -2.238
87 HA LYS 12 HA LYS 12 8.981 3.397 -0.890
88 1HB LYS 12 1HB LYS 12 9.027 5.342 -2.406
89 2HB LYS 12 2HB LYS 12 8.827 3.828 -3.279
90 1HG LYS 12 1HG LYS 12 6.447 4.257 -3.518
91 2HG LYS 12 2HG LYS 12 6.613 5.753 -2.597
92 1HD LYS 12 1HD LYS 12 8.103 6.652 -4.311
93 2HD LYS 12 2HD LYS 12 7.968 5.148 -5.225
94 1HE LYS 12 1HE LYS 12 6.509 6.908 -6.122
95 2HE LYS 12 2HE LYS 12 5.592 5.520 -5.540
96 1HZ LYS 12 1HZ LYS 12 5.138 6.740 -3.495
97 2HZ LYS 12 2HZ LYS 12 4.565 7.580 -4.845
98 3HZ LYS 12 3HZ LYS 12 5.990 8.077 -4.083
99 H ARG 13 H ARG 13 5.645 4.102 -0.625
100 HA ARG 13 HA ARG 13 5.958 5.490 1.805
101 1HB ARG 13 1HB ARG 13 5.226 7.715 1.148
102 2HB ARG 13 2HB ARG 13 6.718 7.298 0.326
103 1HG ARG 13 1HG ARG 13 5.362 6.679 -1.672
104 2HG ARG 13 2HG ARG 13 3.945 7.318 -0.837
105 1HD ARG 13 1HD ARG 13 6.447 8.872 -1.490
106 2HD ARG 13 2HD ARG 13 4.929 8.956 -2.384
107 HE ARG 13 HE ARG 13 4.204 9.563 0.157
108 1HH1 ARG 13 1HH1 ARG 13 6.636 10.803 -2.010
109 2HH1 ARG 13 2HH1 ARG 13 6.578 12.408 -1.361
110 1HH2 ARG 13 1HH2 ARG 13 4.120 11.673 1.014
111 2HH2 ARG 13 2HH2 ARG 13 5.148 12.902 0.357
112 H GLY 14 H GLY 14 4.138 5.232 2.944
113 1HA GLY 14 1HA GLY 14 1.790 5.302 3.270
114 2HA GLY 14 2HA GLY 14 1.569 5.090 1.541
115 H GLU 15 H GLU 15 3.843 3.049 3.146
116 HA GLU 15 HA GLU 15 2.636 0.669 2.330
117 1HB GLU 15 1HB GLU 15 4.599 1.162 4.575
118 2HB GLU 15 2HB GLU 15 4.179 -0.428 3.953
119 1HG GLU 15 1HG GLU 15 5.176 0.001 1.876
120 2HG GLU 15 2HG GLU 15 5.307 1.729 2.202
121 H ARG 16 H ARG 16 0.790 -0.220 2.989
122 HA ARG 16 HA ARG 16 0.143 -0.178 5.844
123 1HB ARG 16 1HB ARG 16 -1.729 0.682 3.635
124 2HB ARG 16 2HB ARG 16 -2.243 0.336 5.279
125 1HG ARG 16 1HG ARG 16 -0.194 2.428 4.591
126 2HG ARG 16 2HG ARG 16 -1.921 2.758 4.740
127 1HD ARG 16 1HD ARG 16 -0.182 1.585 6.908
128 2HD ARG 16 2HD ARG 16 -0.666 3.278 6.802
129 HE ARG 16 HE ARG 16 -2.937 1.588 6.758
130 1HH1 ARG 16 1HH1 ARG 16 -0.506 2.857 8.907
131 2HH1 ARG 16 2HH1 ARG 16 -1.513 2.755 10.313
132 1HH2 ARG 16 1HH2 ARG 16 -4.269 1.454 8.600
133 2HH2 ARG 16 2HH2 ARG 16 -3.652 1.958 10.138
134 H VAL 17 H VAL 17 -1.758 -1.628 6.320
135 HA VAL 17 HA VAL 17 -1.996 -3.880 4.461
136 HB VAL 17 HB VAL 17 -1.543 -4.370 7.400
137 1HG1 VAL 17 1HG1 VAL 17 -1.009 -6.638 6.633
138 2HG1 VAL 17 2HG1 VAL 17 -1.332 -6.144 4.970
139 3HG1 VAL 17 3HG1 VAL 17 -2.636 -6.150 6.156
140 1HG2 VAL 17 1HG2 VAL 17 0.457 -3.264 6.577
141 2HG2 VAL 17 2HG2 VAL 17 0.541 -4.387 5.219
142 3HG2 VAL 17 3HG2 VAL 17 0.777 -4.976 6.865
143 H ARG 18 H ARG 18 -3.904 -1.983 4.748
144 HA ARG 18 HA ARG 18 -5.796 -2.493 6.805
145 1HB ARG 18 1HB ARG 18 -5.806 -0.372 5.610
146 2HB ARG 18 2HB ARG 18 -6.133 -1.194 4.093
147 1HG ARG 18 1HG ARG 18 -8.139 -0.145 4.963
148 2HG ARG 18 2HG ARG 18 -8.312 -1.901 4.935
149 1HD ARG 18 1HD ARG 18 -9.199 -0.957 7.004
150 2HD ARG 18 2HD ARG 18 -7.810 -1.995 7.322
151 HE ARG 18 HE ARG 18 -7.299 0.862 7.084
152 1HH1 ARG 18 1HH1 ARG 18 -7.748 -1.911 9.145
153 2HH1 ARG 18 2HH1 ARG 18 -7.039 -1.157 10.533
154 1HH2 ARG 18 1HH2 ARG 18 -6.365 1.865 8.911
155 2HH2 ARG 18 2HH2 ARG 18 -6.254 0.989 10.400
156 H GLY 19 H GLY 19 -5.216 -3.753 3.622
157 1HA GLY 19 1HA GLY 19 -7.123 -5.913 4.158
158 2HA GLY 19 2HA GLY 19 -7.244 -5.033 2.639
159 H THR 20 H THR 20 -6.161 -5.830 0.974
160 HA THR 20 HA THR 20 -3.533 -6.752 1.027
161 HB THR 20 HB THR 20 -4.286 -8.670 2.277
162 HG1 THR 20 1HG THR 20 -3.527 -10.256 0.891
163 1HG2 THR 20 1HG2 THR 20 -6.667 -8.567 1.661
164 2HG2 THR 20 2HG2 THR 20 -6.005 -10.189 1.460
165 3HG2 THR 20 3HG2 THR 20 -6.265 -9.162 0.051
166 H CYS 21 H CYS 21 -2.994 -8.010 -1.046
167 HA CYS 21 HA CYS 21 -4.885 -7.369 -3.199
168 1HB CYS 21 1HB CYS 21 -3.182 -5.567 -3.018
169 2HB CYS 21 2HB CYS 21 -1.924 -6.765 -3.294
170 H GLY 22 H GLY 22 -3.413 -9.742 -1.669
171 1HA GLY 22 1HA GLY 22 -3.830 -11.755 -3.452
172 2HA GLY 22 2HA GLY 22 -2.212 -11.196 -3.845
173 H ILE 23 H ILE 23 -1.205 -13.092 -3.218
174 HA ILE 23 HA ILE 23 -1.630 -14.351 -0.711
175 HB ILE 23 HB ILE 23 0.814 -14.532 -2.480
176 1HG1 ILE 23 1HG1 ILE 23 -1.642 -16.300 -2.461
177 2HG1 ILE 23 2HG1 ILE 23 -1.340 -15.039 -3.651
178 1HG2 ILE 23 1HG2 ILE 23 1.115 -16.727 -1.416
179 2HG2 ILE 23 2HG2 ILE 23 -0.265 -16.396 -0.368
180 3HG2 ILE 23 3HG2 ILE 23 1.191 -15.407 -0.248
181 1HD1 ILE 23 1HD1 ILE 23 -0.762 -17.226 -4.522
182 2HD1 ILE 23 2HD1 ILE 23 0.363 -17.476 -3.186
183 3HD1 ILE 23 3HD1 ILE 23 0.674 -16.212 -4.376
184 H ARG 24 H ARG 24 1.388 -12.810 -1.818
185 HA ARG 24 HA ARG 24 1.793 -11.852 0.936
186 1HB ARG 24 1HB ARG 24 4.232 -11.809 0.322
187 2HB ARG 24 2HB ARG 24 3.509 -13.410 0.388
188 1HG ARG 24 1HG ARG 24 3.319 -13.430 -2.046
189 2HG ARG 24 2HG ARG 24 4.041 -11.820 -2.114
190 1HD ARG 24 1HD ARG 24 6.110 -12.630 -1.256
191 2HD ARG 24 2HD ARG 24 5.405 -14.198 -0.868
192 HE ARG 24 HE ARG 24 5.322 -13.481 -3.667
193 1HH1 ARG 24 1HH1 ARG 24 7.104 -15.064 -1.124
194 2HH1 ARG 24 2HH1 ARG 24 8.000 -16.076 -2.206
195 1HH2 ARG 24 1HH2 ARG 24 6.498 -14.812 -5.099
196 2HH2 ARG 24 2HH2 ARG 24 7.657 -15.933 -4.464
197 H PHE 25 H PHE 25 0.218 -10.426 -0.932
198 HA PHE 25 HA PHE 25 1.916 -8.191 -1.769
199 1HB PHE 25 1HB PHE 25 -0.949 -8.921 -2.385
200 2HB PHE 25 2HB PHE 25 -0.227 -7.390 -2.868
201 HD1 PHE 25 1HD PHE 25 0.869 -7.224 -4.894
202 HD2 PHE 25 2HD PHE 25 0.271 -11.065 -3.162
203 HE1 PHE 25 1HE PHE 25 1.743 -8.277 -6.938
204 HE2 PHE 25 2HE PHE 25 1.145 -12.126 -5.203
205 HZ PHE 25 HZ PHE 25 1.883 -10.731 -7.095
206 H LEU 26 H LEU 26 1.505 -6.055 -1.129
207 HA LEU 26 HA LEU 26 -0.093 -5.813 1.333
208 1HB LEU 26 1HB LEU 26 2.248 -4.083 0.546
209 2HB LEU 26 2HB LEU 26 1.410 -4.097 2.085
210 HG LEU 26 HG LEU 26 2.224 -6.569 2.208
211 1HD1 LEU 26 1HD1 LEU 26 3.097 -6.755 -0.030
212 2HD1 LEU 26 2HD1 LEU 26 4.427 -6.867 1.123
213 3HD1 LEU 26 3HD1 LEU 26 4.155 -5.369 0.230
214 1HD2 LEU 26 1HD2 LEU 26 2.899 -4.787 3.731
215 2HD2 LEU 26 2HD2 LEU 26 4.106 -4.243 2.567
216 3HD2 LEU 26 3HD2 LEU 26 4.264 -5.827 3.325
217 H TYR 27 H TYR 27 -1.000 -3.644 1.747
218 HA TYR 27 HA TYR 27 -1.861 -2.422 -0.788
219 1HB TYR 27 1HB TYR 27 -3.412 -3.573 1.202
220 2HB TYR 27 2HB TYR 27 -3.555 -1.844 1.507
221 HD1 TYR 27 1HD TYR 27 -5.055 -0.571 0.251
222 HD2 TYR 27 2HD TYR 27 -3.805 -4.365 -1.209
223 HE1 TYR 27 1HE TYR 27 -6.673 -0.385 -1.591
224 HE2 TYR 27 2HE TYR 27 -5.423 -4.192 -3.058
225 HH TYR 27 HH TYR 27 -7.027 -1.291 -3.831
226 H CYS 28 H CYS 28 -1.282 -0.396 -1.149
227 HA CYS 28 HA CYS 28 -0.498 1.251 1.163
228 1HB CYS 28 1HB CYS 28 0.719 1.272 -1.606
229 2HB CYS 28 2HB CYS 28 1.206 2.294 -0.254
230 H CYS 29 H CYS 29 -0.869 3.507 1.009
231 HA CYS 29 HA CYS 29 -2.563 4.440 -1.171
232 1HB CYS 29 1HB CYS 29 -3.825 3.484 0.991
233 2HB CYS 29 2HB CYS 29 -3.524 5.122 1.556
234 HA PRO 30 HA PRO 30 0.251 7.858 -0.386
235 1HB PRO 30 1HB PRO 30 -0.687 9.500 -2.341
236 2HB PRO 30 2HB PRO 30 0.392 8.138 -2.660
237 1HG PRO 30 1HG PRO 30 -2.583 8.308 -2.954
238 2HG PRO 30 2HG PRO 30 -1.389 7.585 -4.050
239 1HD PRO 30 1HD PRO 30 -2.879 6.096 -2.361
240 2HD PRO 30 2HD PRO 30 -1.214 5.657 -2.792
241 H ARG 31 H ARG 31 0.147 9.736 0.752
242 HA ARG 31 HA ARG 31 -2.480 10.522 1.754
243 1HB ARG 31 1HB ARG 31 0.323 11.204 2.649
244 2HB ARG 31 2HB ARG 31 -1.124 11.885 3.380
245 1HG ARG 31 1HG ARG 31 -1.840 9.721 4.121
246 2HG ARG 31 2HG ARG 31 -0.520 8.940 3.247
247 1HD ARG 31 1HD ARG 31 -0.119 9.179 5.694
248 2HD ARG 31 2HD ARG 31 1.110 9.937 4.686
249 HE ARG 31 HE ARG 31 0.050 12.079 5.194
250 1HH1 ARG 31 1HH1 ARG 31 -0.747 9.363 7.227
251 2HH1 ARG 31 2HH1 ARG 31 -1.187 10.345 8.584
252 1HH2 ARG 31 1HH2 ARG 31 -0.527 13.378 6.971
253 2HH2 ARG 31 2HH2 ARG 31 -1.060 12.628 8.439
254 H ARG 32 H ARG 32 0.384 11.966 0.238
255 HA ARG 32 HA ARG 32 -0.884 14.540 -0.033
256 1HB ARG 32 1HB ARG 32 1.715 13.469 -1.146
257 2HB ARG 32 2HB ARG 32 1.180 15.138 -1.287
258 1HG ARG 32 1HG ARG 32 1.652 13.717 1.325
259 2HG ARG 32 2HG ARG 32 2.826 14.761 0.520
260 1HD ARG 32 1HD ARG 32 0.077 15.597 1.444
261 2HD ARG 32 2HD ARG 32 1.589 15.944 2.284
262 HE ARG 32 HE ARG 32 2.043 16.994 -0.141
263 1HH1 ARG 32 1HH1 ARG 32 -0.656 17.293 2.046
264 2HH1 ARG 32 2HH1 ARG 32 -1.059 18.897 1.530
265 1HH2 ARG 32 1HH2 ARG 32 1.518 19.103 -0.823
266 2HH2 ARG 32 2HH2 ARG 32 0.177 19.925 -0.099
Start of MODEL 16
1 1H GLY 1 1H GLY 1 -7.154 11.465 -6.043
2 2H GLY 1 2H GLY 1 -7.395 9.895 -6.626
3 3H GLY 1 3H GLY 1 -6.926 11.128 -7.686
4 1HA GLY 1 1HA GLY 1 -5.045 9.717 -7.188
5 2HA GLY 1 2HA GLY 1 -4.802 11.341 -6.564
6 H LEU 2 H LEU 2 -6.958 10.516 -4.478
7 HA LEU 2 HA LEU 2 -5.016 9.570 -2.538
8 1HB LEU 2 1HB LEU 2 -7.846 10.571 -2.300
9 2HB LEU 2 2HB LEU 2 -6.962 9.914 -0.937
10 HG LEU 2 HG LEU 2 -5.217 11.699 -1.338
11 1HD1 LEU 2 1HD1 LEU 2 -7.364 12.785 -3.156
12 2HD1 LEU 2 2HD1 LEU 2 -5.754 12.251 -3.635
13 3HD1 LEU 2 3HD1 LEU 2 -5.943 13.674 -2.611
14 1HD2 LEU 2 1HD2 LEU 2 -8.022 12.580 -0.663
15 2HD2 LEU 2 2HD2 LEU 2 -6.545 13.455 -0.259
16 3HD2 LEU 2 3HD2 LEU 2 -6.854 11.872 0.453
17 H LEU 3 H LEU 3 -6.476 7.924 -4.731
18 HA LEU 3 HA LEU 3 -7.979 5.979 -3.255
19 1HB LEU 3 1HB LEU 3 -8.457 6.414 -5.605
20 2HB LEU 3 2HB LEU 3 -6.839 5.909 -6.050
21 HG LEU 3 HG LEU 3 -7.363 3.616 -5.274
22 1HD1 LEU 3 1HD1 LEU 3 -9.064 4.146 -3.622
23 2HD1 LEU 3 2HD1 LEU 3 -9.695 3.015 -4.820
24 3HD1 LEU 3 3HD1 LEU 3 -10.144 4.719 -4.895
25 1HD2 LEU 3 1HD2 LEU 3 -9.291 4.727 -7.308
26 2HD2 LEU 3 2HD2 LEU 3 -8.833 3.033 -7.132
27 3HD2 LEU 3 3HD2 LEU 3 -7.630 4.226 -7.625
28 H CYS 4 H CYS 4 -7.383 3.891 -2.692
29 HA CYS 4 HA CYS 4 -4.562 3.539 -2.148
30 1HB CYS 4 1HB CYS 4 -6.741 1.551 -1.541
31 2HB CYS 4 2HB CYS 4 -5.208 1.782 -0.708
32 H TYR 5 H TYR 5 -3.250 1.921 -2.960
33 HA TYR 5 HA TYR 5 -4.366 0.289 -5.139
34 1HB TYR 5 1HB TYR 5 -1.739 1.789 -5.174
35 2HB TYR 5 2HB TYR 5 -2.257 0.640 -6.403
36 HD1 TYR 5 1HD TYR 5 -4.219 1.186 -7.845
37 HD2 TYR 5 2HD TYR 5 -2.531 4.026 -5.165
38 HE1 TYR 5 1HE TYR 5 -5.355 2.998 -9.060
39 HE2 TYR 5 2HE TYR 5 -3.663 5.845 -6.371
40 HH TYR 5 HH TYR 5 -4.591 6.263 -8.625
41 H CYS 6 H CYS 6 -3.214 -1.656 -5.607
42 HA CYS 6 HA CYS 6 -1.944 -2.796 -3.229
43 1HB CYS 6 1HB CYS 6 -3.446 -4.394 -3.799
44 2HB CYS 6 2HB CYS 6 -3.557 -3.834 -5.464
45 H ARG 7 H ARG 7 0.108 -3.631 -3.217
46 HA ARG 7 HA ARG 7 1.623 -3.735 -5.705
47 1HB ARG 7 1HB ARG 7 2.412 -1.998 -3.367
48 2HB ARG 7 2HB ARG 7 3.499 -2.428 -4.679
49 1HG ARG 7 1HG ARG 7 1.871 -1.365 -6.255
50 2HG ARG 7 2HG ARG 7 0.990 -0.780 -4.843
51 1HD ARG 7 1HD ARG 7 2.999 0.400 -4.086
52 2HD ARG 7 2HD ARG 7 3.870 -0.178 -5.504
53 HE ARG 7 HE ARG 7 1.525 1.602 -5.674
54 1HH1 ARG 7 1HH1 ARG 7 4.729 0.657 -6.686
55 2HH1 ARG 7 2HH1 ARG 7 4.849 1.896 -7.888
56 1HH2 ARG 7 1HH2 ARG 7 1.684 3.232 -7.254
57 2HH2 ARG 7 2HH2 ARG 7 3.122 3.358 -8.211
58 H LYS 8 H LYS 8 4.074 -4.281 -4.940
59 HA LYS 8 HA LYS 8 3.850 -6.467 -2.977
60 1HB LYS 8 1HB LYS 8 3.925 -7.376 -5.248
61 2HB LYS 8 2HB LYS 8 5.399 -6.475 -5.575
62 1HG LYS 8 1HG LYS 8 6.462 -7.765 -3.686
63 2HG LYS 8 2HG LYS 8 5.025 -8.788 -3.694
64 1HD LYS 8 1HD LYS 8 6.790 -8.306 -6.092
65 2HD LYS 8 2HD LYS 8 6.925 -9.701 -5.020
66 1HE LYS 8 1HE LYS 8 4.660 -10.378 -5.582
67 2HE LYS 8 2HE LYS 8 4.467 -8.953 -6.601
68 1HZ LYS 8 1HZ LYS 8 6.205 -9.771 -8.044
69 2HZ LYS 8 2HZ LYS 8 4.990 -10.939 -7.891
70 3HZ LYS 8 3HZ LYS 8 6.447 -11.120 -7.051
71 H GLY 9 H GLY 9 5.437 -6.623 -1.481
72 1HA GLY 9 1HA GLY 9 7.350 -6.141 -0.303
73 2HA GLY 9 2HA GLY 9 8.058 -5.584 -1.810
74 H HIS 10 H HIS 10 8.019 -3.409 -2.324
75 HA HIS 10 HA HIS 10 7.328 -1.642 -0.080
76 1HB HIS 10 1HB HIS 10 9.716 -1.808 -1.098
77 2HB HIS 10 2HB HIS 10 9.049 -0.838 -2.406
78 HD1 HIS 10 1HD HIS 10 9.314 -0.652 1.385
79 HD2 HIS 10 2HD HIS 10 9.244 1.821 -1.953
80 HE1 HIS 10 1HE HIS 10 9.711 1.672 2.262
81 HE2 HIS 10 2HE HIS 10 9.551 3.163 0.237
82 H CYS 11 H CYS 11 6.753 0.659 -0.828
83 HA CYS 11 HA CYS 11 5.129 0.659 -3.262
84 1HB CYS 11 1HB CYS 11 4.095 1.353 -0.512
85 2HB CYS 11 2HB CYS 11 3.240 1.712 -2.002
86 H LYS 12 H LYS 12 3.949 3.073 -3.125
87 HA LYS 12 HA LYS 12 6.228 4.860 -3.286
88 1HB LYS 12 1HB LYS 12 4.654 6.430 -4.351
89 2HB LYS 12 2HB LYS 12 4.689 4.868 -5.155
90 1HG LYS 12 1HG LYS 12 2.623 4.257 -3.897
91 2HG LYS 12 2HG LYS 12 2.566 5.917 -3.300
92 1HD LYS 12 1HD LYS 12 2.453 6.734 -5.611
93 2HD LYS 12 2HD LYS 12 2.487 5.070 -6.196
94 1HE LYS 12 1HE LYS 12 0.211 5.881 -6.185
95 2HE LYS 12 2HE LYS 12 0.399 4.623 -4.966
96 1HZ LYS 12 1HZ LYS 12 0.615 6.370 -3.284
97 2HZ LYS 12 2HZ LYS 12 -0.871 6.457 -4.087
98 3HZ LYS 12 3HZ LYS 12 0.362 7.551 -4.470
99 H ARG 13 H ARG 13 3.051 4.863 -1.689
100 HA ARG 13 HA ARG 13 4.233 6.354 0.512
101 1HB ARG 13 1HB ARG 13 1.730 7.364 -0.837
102 2HB ARG 13 2HB ARG 13 2.618 8.110 0.478
103 1HG ARG 13 1HG ARG 13 4.437 8.667 -0.950
104 2HG ARG 13 2HG ARG 13 3.748 7.725 -2.274
105 1HD ARG 13 1HD ARG 13 1.881 9.238 -2.438
106 2HD ARG 13 2HD ARG 13 2.433 10.129 -1.021
107 HE ARG 13 HE ARG 13 4.528 10.409 -2.622
108 1HH1 ARG 13 1HH1 ARG 13 1.125 10.712 -3.306
109 2HH1 ARG 13 2HH1 ARG 13 1.349 11.888 -4.559
110 1HH2 ARG 13 1HH2 ARG 13 4.834 11.960 -4.269
111 2HH2 ARG 13 2HH2 ARG 13 3.458 12.596 -5.107
112 H GLY 14 H GLY 14 3.225 6.029 2.464
113 1HA GLY 14 1HA GLY 14 1.971 4.908 4.023
114 2HA GLY 14 2HA GLY 14 0.630 5.145 2.913
115 H GLU 15 H GLU 15 3.255 2.983 3.815
116 HA GLU 15 HA GLU 15 2.049 0.837 2.225
117 1HB GLU 15 1HB GLU 15 4.615 0.659 3.792
118 2HB GLU 15 2HB GLU 15 4.092 -0.348 2.452
119 1HG GLU 15 1HG GLU 15 5.690 0.999 1.486
120 2HG GLU 15 2HG GLU 15 4.191 1.829 1.079
121 H ARG 16 H ARG 16 0.493 -0.268 3.261
122 HA ARG 16 HA ARG 16 1.066 -1.247 5.953
123 1HB ARG 16 1HB ARG 16 -1.450 0.245 5.201
124 2HB ARG 16 2HB ARG 16 -1.244 -0.665 6.692
125 1HG ARG 16 1HG ARG 16 0.661 0.815 7.270
126 2HG ARG 16 2HG ARG 16 0.297 1.774 5.834
127 1HD ARG 16 1HD ARG 16 -0.690 2.798 7.798
128 2HD ARG 16 2HD ARG 16 -1.951 2.213 6.713
129 HE ARG 16 HE ARG 16 -1.202 0.372 8.809
130 1HH1 ARG 16 1HH1 ARG 16 -3.314 2.980 7.861
131 2HH1 ARG 16 2HH1 ARG 16 -4.531 2.587 9.028
132 1HH2 ARG 16 1HH2 ARG 16 -2.800 -0.149 10.347
133 2HH2 ARG 16 2HH2 ARG 16 -4.242 0.808 10.440
134 H VAL 17 H VAL 17 -1.201 -2.506 6.585
135 HA VAL 17 HA VAL 17 -1.919 -4.222 4.321
136 HB VAL 17 HB VAL 17 -1.215 -5.398 7.008
137 1HG1 VAL 17 1HG1 VAL 17 -1.588 -6.615 4.273
138 2HG1 VAL 17 2HG1 VAL 17 -2.695 -6.744 5.639
139 3HG1 VAL 17 3HG1 VAL 17 -1.101 -7.493 5.723
140 1HG2 VAL 17 1HG2 VAL 17 0.555 -5.173 4.575
141 2HG2 VAL 17 2HG2 VAL 17 0.907 -6.142 6.004
142 3HG2 VAL 17 3HG2 VAL 17 0.809 -4.386 6.133
143 H ARG 18 H ARG 18 -3.631 -2.348 5.089
144 HA ARG 18 HA ARG 18 -5.321 -2.929 7.265
145 1HB ARG 18 1HB ARG 18 -5.351 -0.770 6.058
146 2HB ARG 18 2HB ARG 18 -6.024 -1.577 4.648
147 1HG ARG 18 1HG ARG 18 -8.048 -2.087 5.837
148 2HG ARG 18 2HG ARG 18 -7.370 -1.456 7.338
149 1HD ARG 18 1HD ARG 18 -8.875 0.167 6.341
150 2HD ARG 18 2HD ARG 18 -7.219 0.770 6.322
151 HE ARG 18 HE ARG 18 -8.406 -0.474 3.935
152 1HH1 ARG 18 1HH1 ARG 18 -6.847 2.212 5.517
153 2HH1 ARG 18 2HH1 ARG 18 -6.604 3.100 4.050
154 1HH2 ARG 18 1HH2 ARG 18 -8.088 0.684 2.002
155 2HH2 ARG 18 2HH2 ARG 18 -7.311 2.231 2.051
156 H GLY 19 H GLY 19 -5.618 -3.684 3.821
157 1HA GLY 19 1HA GLY 19 -7.500 -5.849 4.517
158 2HA GLY 19 2HA GLY 19 -7.451 -5.026 2.960
159 H THR 20 H THR 20 -6.444 -6.071 1.377
160 HA THR 20 HA THR 20 -3.920 -7.228 1.553
161 HB THR 20 HB THR 20 -4.781 -8.982 2.898
162 HG1 THR 20 1HG THR 20 -4.830 -10.721 1.014
163 1HG2 THR 20 1HG2 THR 20 -7.158 -8.710 2.468
164 2HG2 THR 20 2HG2 THR 20 -6.689 -10.388 2.193
165 3HG2 THR 20 3HG2 THR 20 -6.952 -9.310 0.822
166 H CYS 21 H CYS 21 -3.266 -8.330 -0.416
167 HA CYS 21 HA CYS 21 -5.105 -7.855 -2.660
168 1HB CYS 21 1HB CYS 21 -3.458 -6.076 -2.654
169 2HB CYS 21 2HB CYS 21 -2.147 -7.245 -2.552
170 H GLY 22 H GLY 22 -2.645 -9.822 -1.196
171 1HA GLY 22 1HA GLY 22 -3.423 -12.110 -2.719
172 2HA GLY 22 2HA GLY 22 -1.862 -11.496 -3.241
173 H ILE 23 H ILE 23 -0.519 -13.065 -2.515
174 HA ILE 23 HA ILE 23 -0.764 -14.020 0.230
175 HB ILE 23 HB ILE 23 1.199 -14.852 -1.912
176 1HG1 ILE 23 1HG1 ILE 23 -1.313 -16.254 -0.972
177 2HG1 ILE 23 2HG1 ILE 23 -1.190 -15.327 -2.464
178 1HG2 ILE 23 1HG2 ILE 23 2.001 -15.278 0.354
179 2HG2 ILE 23 2HG2 ILE 23 1.613 -16.786 -0.474
180 3HG2 ILE 23 3HG2 ILE 23 0.504 -16.130 0.730
181 1HD1 ILE 23 1HD1 ILE 23 0.505 -16.879 -3.284
182 2HD1 ILE 23 2HD1 ILE 23 -1.000 -17.707 -2.886
183 3HD1 ILE 23 3HD1 ILE 23 0.378 -17.806 -1.790
184 H ARG 24 H ARG 24 1.928 -12.881 -1.813
185 HA ARG 24 HA ARG 24 3.268 -11.893 0.598
186 1HB ARG 24 1HB ARG 24 5.296 -11.815 -0.734
187 2HB ARG 24 2HB ARG 24 4.551 -13.400 -0.876
188 1HG ARG 24 1HG ARG 24 3.979 -11.307 -2.926
189 2HG ARG 24 2HG ARG 24 5.497 -12.205 -2.981
190 1HD ARG 24 1HD ARG 24 4.244 -14.310 -3.033
191 2HD ARG 24 2HD ARG 24 2.730 -13.408 -2.985
192 HE ARG 24 HE ARG 24 4.144 -12.450 -5.159
193 1HH1 ARG 24 1HH1 ARG 24 2.801 -15.493 -4.118
194 2HH1 ARG 24 2HH1 ARG 24 2.512 -16.063 -5.727
195 1HH2 ARG 24 1HH2 ARG 24 3.766 -13.192 -7.281
196 2HH2 ARG 24 2HH2 ARG 24 3.061 -14.755 -7.526
197 H PHE 25 H PHE 25 1.004 -10.615 -0.993
198 HA PHE 25 HA PHE 25 2.306 -8.121 -1.805
199 1HB PHE 25 1HB PHE 25 -0.539 -9.078 -2.175
200 2HB PHE 25 2HB PHE 25 0.081 -7.531 -2.743
201 HD1 PHE 25 1HD PHE 25 1.322 -7.369 -4.748
202 HD2 PHE 25 2HD PHE 25 0.333 -11.190 -3.154
203 HE1 PHE 25 1HE PHE 25 2.043 -8.429 -6.849
204 HE2 PHE 25 2HE PHE 25 1.052 -12.256 -5.250
205 HZ PHE 25 HZ PHE 25 1.909 -10.876 -7.102
206 H LEU 26 H LEU 26 0.639 -6.175 -1.335
207 HA LEU 26 HA LEU 26 -0.558 -6.280 1.275
208 1HB LEU 26 1HB LEU 26 0.853 -4.682 2.367
209 2HB LEU 26 2HB LEU 26 1.845 -6.016 1.816
210 HG LEU 26 HG LEU 26 1.608 -3.430 0.289
211 1HD1 LEU 26 1HD1 LEU 26 3.685 -4.208 2.330
212 2HD1 LEU 26 2HD1 LEU 26 2.463 -2.952 2.524
213 3HD1 LEU 26 3HD1 LEU 26 3.727 -2.773 1.305
214 1HD2 LEU 26 1HD2 LEU 26 3.592 -5.701 0.220
215 2HD2 LEU 26 2HD2 LEU 26 3.755 -4.190 -0.674
216 3HD2 LEU 26 3HD2 LEU 26 2.418 -5.282 -1.028
217 H TYR 27 H TYR 27 -1.353 -4.053 1.942
218 HA TYR 27 HA TYR 27 -2.300 -2.705 -0.495
219 1HB TYR 27 1HB TYR 27 -3.742 -3.790 1.597
220 2HB TYR 27 2HB TYR 27 -3.745 -2.062 1.952
221 HD1 TYR 27 1HD TYR 27 -5.171 -0.613 0.777
222 HD2 TYR 27 2HD TYR 27 -4.479 -4.540 -0.700
223 HE1 TYR 27 1HE TYR 27 -6.927 -0.278 -0.911
224 HE2 TYR 27 2HE TYR 27 -6.238 -4.220 -2.392
225 HH TYR 27 HH TYR 27 -7.549 -1.198 -3.132
226 H CYS 28 H CYS 28 -1.519 -0.785 -0.923
227 HA CYS 28 HA CYS 28 -0.516 0.858 1.307
228 1HB CYS 28 1HB CYS 28 0.541 0.735 -1.524
229 2HB CYS 28 2HB CYS 28 1.150 1.783 -0.248
230 H CYS 29 H CYS 29 -1.567 2.688 1.614
231 HA CYS 29 HA CYS 29 -2.966 3.911 -0.671
232 1HB CYS 29 1HB CYS 29 -4.383 2.777 1.176
233 2HB CYS 29 2HB CYS 29 -3.932 4.161 2.166
234 HA PRO 30 HA PRO 30 -0.486 7.460 0.362
235 1HB PRO 30 1HB PRO 30 -1.766 9.322 -1.121
236 2HB PRO 30 2HB PRO 30 -0.739 8.077 -1.841
237 1HG PRO 30 1HG PRO 30 -3.723 8.160 -1.594
238 2HG PRO 30 2HG PRO 30 -2.728 7.684 -2.984
239 1HD PRO 30 1HD PRO 30 -3.876 5.880 -1.315
240 2HD PRO 30 2HD PRO 30 -2.334 5.578 -2.141
241 H ARG 31 H ARG 31 -0.513 8.770 2.073
242 HA ARG 31 HA ARG 31 -3.096 9.861 2.980
243 1HB ARG 31 1HB ARG 31 -0.837 8.872 4.733
244 2HB ARG 31 2HB ARG 31 -2.334 9.602 5.300
245 1HG ARG 31 1HG ARG 31 -3.603 7.739 4.360
246 2HG ARG 31 2HG ARG 31 -2.104 7.007 3.786
247 1HD ARG 31 1HD ARG 31 -2.808 5.965 5.859
248 2HD ARG 31 2HD ARG 31 -1.306 6.854 6.101
249 HE ARG 31 HE ARG 31 -3.516 8.492 6.740
250 1HH1 ARG 31 1HH1 ARG 31 -1.710 5.762 7.938
251 2HH1 ARG 31 2HH1 ARG 31 -2.079 6.083 9.599
252 1HH2 ARG 31 1HH2 ARG 31 -4.009 8.919 8.924
253 2HH2 ARG 31 2HH2 ARG 31 -3.387 7.878 10.160
254 H ARG 32 H ARG 32 -2.715 11.837 1.975
255 HA ARG 32 HA ARG 32 -0.295 13.317 2.540
256 1HB ARG 32 1HB ARG 32 -1.354 13.464 0.329
257 2HB ARG 32 2HB ARG 32 -2.806 14.130 1.063
258 1HG ARG 32 1HG ARG 32 -1.515 16.079 1.813
259 2HG ARG 32 2HG ARG 32 -0.083 15.415 1.021
260 1HD ARG 32 1HD ARG 32 -1.193 17.111 -0.363
261 2HD ARG 32 2HD ARG 32 -1.193 15.526 -1.135
262 HE ARG 32 HE ARG 32 -3.574 16.134 0.381
263 1HH1 ARG 32 1HH1 ARG 32 -2.003 16.279 -2.728
264 2HH1 ARG 32 2HH1 ARG 32 -3.487 16.407 -3.613
265 1HH2 ARG 32 1HH2 ARG 32 -5.528 16.304 -0.779
266 2HH2 ARG 32 2HH2 ARG 32 -5.488 16.420 -2.507
Start of MODEL 17
1 1H GLY 1 1H GLY 1 -12.076 11.132 -4.341
2 2H GLY 1 2H GLY 1 -13.232 10.803 -3.151
3 3H GLY 1 3H GLY 1 -12.567 9.538 -4.055
4 1HA GLY 1 1HA GLY 1 -11.071 11.267 -2.163
5 2HA GLY 1 2HA GLY 1 -11.625 9.635 -1.817
6 H LEU 2 H LEU 2 -9.117 9.784 -1.403
7 HA LEU 2 HA LEU 2 -7.488 9.457 -3.754
8 1HB LEU 2 1HB LEU 2 -6.847 8.956 -0.845
9 2HB LEU 2 2HB LEU 2 -5.681 8.986 -2.153
10 HG LEU 2 HG LEU 2 -7.344 11.345 -1.260
11 1HD1 LEU 2 1HD1 LEU 2 -5.684 10.711 0.410
12 2HD1 LEU 2 2HD1 LEU 2 -5.245 12.227 -0.377
13 3HD1 LEU 2 3HD1 LEU 2 -4.423 10.731 -0.823
14 1HD2 LEU 2 1HD2 LEU 2 -5.864 12.639 -2.725
15 2HD2 LEU 2 2HD2 LEU 2 -6.789 11.441 -3.630
16 3HD2 LEU 2 3HD2 LEU 2 -5.090 11.146 -3.258
17 H LEU 3 H LEU 3 -7.411 7.648 -4.902
18 HA LEU 3 HA LEU 3 -8.360 5.152 -3.787
19 1HB LEU 3 1HB LEU 3 -7.291 5.789 -6.538
20 2HB LEU 3 2HB LEU 3 -8.034 4.273 -6.066
21 HG LEU 3 HG LEU 3 -9.439 6.947 -6.084
22 1HD1 LEU 3 1HD1 LEU 3 -10.631 6.057 -8.036
23 2HD1 LEU 3 2HD1 LEU 3 -9.579 4.642 -8.022
24 3HD1 LEU 3 3HD1 LEU 3 -8.904 6.239 -8.339
25 1HD2 LEU 3 1HD2 LEU 3 -10.358 5.418 -4.432
26 2HD2 LEU 3 2HD2 LEU 3 -10.475 4.147 -5.649
27 3HD2 LEU 3 3HD2 LEU 3 -11.468 5.599 -5.790
28 H CYS 4 H CYS 4 -7.173 3.337 -3.380
29 HA CYS 4 HA CYS 4 -4.312 3.725 -3.048
30 1HB CYS 4 1HB CYS 4 -5.970 1.308 -2.312
31 2HB CYS 4 2HB CYS 4 -4.359 1.708 -1.730
32 H TYR 5 H TYR 5 -3.054 1.498 -3.425
33 HA TYR 5 HA TYR 5 -3.801 0.327 -5.995
34 1HB TYR 5 1HB TYR 5 -1.161 1.700 -5.460
35 2HB TYR 5 2HB TYR 5 -1.475 0.664 -6.848
36 HD1 TYR 5 1HD TYR 5 -2.998 1.399 -8.630
37 HD2 TYR 5 2HD TYR 5 -2.054 3.936 -5.347
38 HE1 TYR 5 1HE TYR 5 -3.877 3.329 -9.876
39 HE2 TYR 5 2HE TYR 5 -2.933 5.873 -6.583
40 HH TYR 5 HH TYR 5 -3.336 6.533 -8.924
41 H CYS 6 H CYS 6 -2.253 -1.483 -6.583
42 HA CYS 6 HA CYS 6 -1.732 -3.050 -4.163
43 1HB CYS 6 1HB CYS 6 -3.214 -4.063 -5.831
44 2HB CYS 6 2HB CYS 6 -1.956 -3.915 -7.054
45 H ARG 7 H ARG 7 0.274 -3.308 -3.465
46 HA ARG 7 HA ARG 7 2.491 -3.046 -5.392
47 1HB ARG 7 1HB ARG 7 2.391 -2.153 -2.506
48 2HB ARG 7 2HB ARG 7 3.843 -2.151 -3.495
49 1HG ARG 7 1HG ARG 7 1.352 -0.603 -4.160
50 2HG ARG 7 2HG ARG 7 2.727 0.060 -3.276
51 1HD ARG 7 1HD ARG 7 4.181 -0.433 -5.184
52 2HD ARG 7 2HD ARG 7 2.800 -1.084 -6.065
53 HE ARG 7 HE ARG 7 2.770 1.708 -5.160
54 1HH1 ARG 7 1HH1 ARG 7 2.763 -0.649 -7.721
55 2HH1 ARG 7 2HH1 ARG 7 2.375 0.501 -8.957
56 1HH2 ARG 7 1HH2 ARG 7 2.257 3.232 -6.774
57 2HH2 ARG 7 2HH2 ARG 7 2.087 2.712 -8.417
58 H LYS 8 H LYS 8 4.303 -4.392 -5.081
59 HA LYS 8 HA LYS 8 3.736 -6.772 -3.449
60 1HB LYS 8 1HB LYS 8 3.943 -7.247 -5.823
61 2HB LYS 8 2HB LYS 8 5.502 -6.437 -5.879
62 1HG LYS 8 1HG LYS 8 6.434 -8.139 -4.385
63 2HG LYS 8 2HG LYS 8 4.870 -8.957 -4.355
64 1HD LYS 8 1HD LYS 8 5.005 -9.345 -6.751
65 2HD LYS 8 2HD LYS 8 6.531 -8.462 -6.827
66 1HE LYS 8 1HE LYS 8 7.561 -10.127 -5.356
67 2HE LYS 8 2HE LYS 8 6.036 -11.007 -5.284
68 1HZ LYS 8 1HZ LYS 8 7.608 -10.517 -7.755
69 2HZ LYS 8 2HZ LYS 8 6.178 -11.413 -7.647
70 3HZ LYS 8 3HZ LYS 8 7.583 -11.970 -6.887
71 H GLY 9 H GLY 9 5.046 -7.333 -1.820
72 1HA GLY 9 1HA GLY 9 6.944 -7.445 -0.500
73 2HA GLY 9 2HA GLY 9 7.808 -6.531 -1.727
74 H HIS 10 H HIS 10 7.388 -4.183 -1.806
75 HA HIS 10 HA HIS 10 6.297 -2.983 0.590
76 1HB HIS 10 1HB HIS 10 8.420 -1.693 1.010
77 2HB HIS 10 2HB HIS 10 8.502 -3.409 1.398
78 HD1 HIS 10 1HD HIS 10 9.328 -4.799 -0.990
79 HD2 HIS 10 2HD HIS 10 10.709 -0.959 -0.214
80 HE1 HIS 10 1HE HIS 10 11.409 -4.548 -2.358
81 HE2 HIS 10 2HE HIS 10 12.286 -2.251 -1.806
82 H CYS 11 H CYS 11 5.884 -0.751 0.386
83 HA CYS 11 HA CYS 11 5.878 0.174 -2.395
84 1HB CYS 11 1HB CYS 11 3.721 0.089 -1.126
85 2HB CYS 11 2HB CYS 11 4.366 1.308 -0.035
86 H LYS 12 H LYS 12 6.139 2.581 -2.685
87 HA LYS 12 HA LYS 12 8.652 3.367 -1.558
88 1HB LYS 12 1HB LYS 12 8.006 5.553 -2.903
89 2HB LYS 12 2HB LYS 12 8.565 4.102 -3.721
90 1HG LYS 12 1HG LYS 12 6.251 3.473 -4.192
91 2HG LYS 12 2HG LYS 12 5.690 4.931 -3.372
92 1HD LYS 12 1HD LYS 12 6.885 6.310 -5.003
93 2HD LYS 12 2HD LYS 12 7.457 4.853 -5.818
94 1HE LYS 12 1HE LYS 12 4.585 5.719 -5.512
95 2HE LYS 12 2HE LYS 12 5.545 5.802 -6.987
96 1HZ LYS 12 1HZ LYS 12 5.726 3.394 -6.962
97 2HZ LYS 12 2HZ LYS 12 4.102 3.868 -6.981
98 3HZ LYS 12 3HZ LYS 12 4.803 3.313 -5.545
99 H ARG 13 H ARG 13 5.300 4.366 -1.169
100 HA ARG 13 HA ARG 13 5.846 5.397 1.427
101 1HB ARG 13 1HB ARG 13 5.368 7.716 1.095
102 2HB ARG 13 2HB ARG 13 6.657 7.273 -0.007
103 1HG ARG 13 1HG ARG 13 3.809 7.296 -0.924
104 2HG ARG 13 2HG ARG 13 4.754 8.783 -0.851
105 1HD ARG 13 1HD ARG 13 6.412 7.844 -2.339
106 2HD ARG 13 2HD ARG 13 5.570 6.297 -2.344
107 HE ARG 13 HE ARG 13 3.712 7.484 -3.470
108 1HH1 ARG 13 1HH1 ARG 13 6.920 8.844 -3.569
109 2HH1 ARG 13 2HH1 ARG 13 6.646 9.710 -5.043
110 1HH2 ARG 13 1HH2 ARG 13 3.344 8.622 -5.411
111 2HH2 ARG 13 2HH2 ARG 13 4.614 9.586 -6.089
112 H GLY 14 H GLY 14 4.076 5.269 2.659
113 1HA GLY 14 1HA GLY 14 1.758 5.486 3.112
114 2HA GLY 14 2HA GLY 14 1.437 5.359 1.389
115 H GLU 15 H GLU 15 3.528 3.180 3.184
116 HA GLU 15 HA GLU 15 2.191 0.882 2.200
117 1HB GLU 15 1HB GLU 15 4.304 1.275 4.312
118 2HB GLU 15 2HB GLU 15 3.670 -0.312 3.900
119 1HG GLU 15 1HG GLU 15 4.505 -0.187 1.706
120 2HG GLU 15 2HG GLU 15 4.883 1.528 1.862
121 H ARG 16 H ARG 16 0.414 -0.065 2.917
122 HA ARG 16 HA ARG 16 -0.257 0.062 5.763
123 1HB ARG 16 1HB ARG 16 -2.071 0.908 3.504
124 2HB ARG 16 2HB ARG 16 -2.666 0.508 5.110
125 1HG ARG 16 1HG ARG 16 -0.652 2.669 4.530
126 2HG ARG 16 2HG ARG 16 -2.386 2.936 4.716
127 1HD ARG 16 1HD ARG 16 -2.250 1.974 6.991
128 2HD ARG 16 2HD ARG 16 -0.504 1.826 6.795
129 HE ARG 16 HE ARG 16 -1.300 4.489 6.311
130 1HH1 ARG 16 1HH1 ARG 16 -0.916 2.197 8.906
131 2HH1 ARG 16 2HH1 ARG 16 -0.623 3.409 10.108
132 1HH2 ARG 16 1HH2 ARG 16 -0.916 6.093 7.885
133 2HH2 ARG 16 2HH2 ARG 16 -0.623 5.625 9.527
134 H VAL 17 H VAL 17 -1.905 -1.514 6.394
135 HA VAL 17 HA VAL 17 -2.129 -3.770 4.518
136 HB VAL 17 HB VAL 17 -1.739 -4.220 7.465
137 1HG1 VAL 17 1HG1 VAL 17 -1.088 -6.449 6.754
138 2HG1 VAL 17 2HG1 VAL 17 -1.251 -5.976 5.062
139 3HG1 VAL 17 3HG1 VAL 17 -2.675 -6.038 6.101
140 1HG2 VAL 17 1HG2 VAL 17 0.640 -4.691 6.991
141 2HG2 VAL 17 2HG2 VAL 17 0.220 -2.995 6.759
142 3HG2 VAL 17 3HG2 VAL 17 0.418 -4.052 5.363
143 H ARG 18 H ARG 18 -4.126 -1.948 4.754
144 HA ARG 18 HA ARG 18 -6.073 -2.876 6.695
145 1HB ARG 18 1HB ARG 18 -5.957 -0.488 6.195
146 2HB ARG 18 2HB ARG 18 -6.275 -0.809 4.495
147 1HG ARG 18 1HG ARG 18 -8.489 -1.712 5.116
148 2HG ARG 18 2HG ARG 18 -8.165 -1.269 6.794
149 1HD ARG 18 1HD ARG 18 -7.993 1.067 6.176
150 2HD ARG 18 2HD ARG 18 -8.207 0.657 4.474
151 HE ARG 18 HE ARG 18 -10.323 0.040 6.416
152 1HH1 ARG 18 1HH1 ARG 18 -9.201 1.737 3.587
153 2HH1 ARG 18 2HH1 ARG 18 -10.782 2.267 3.118
154 1HH2 ARG 18 1HH2 ARG 18 -12.409 0.732 5.807
155 2HH2 ARG 18 2HH2 ARG 18 -12.607 1.693 4.379
156 H GLY 19 H GLY 19 -5.388 -3.143 3.281
157 1HA GLY 19 1HA GLY 19 -7.407 -5.266 3.084
158 2HA GLY 19 2HA GLY 19 -7.443 -3.956 1.911
159 H THR 20 H THR 20 -5.523 -6.627 3.154
160 HA THR 20 HA THR 20 -3.289 -6.565 1.598
161 HB THR 20 HB THR 20 -3.558 -8.283 3.258
162 HG1 THR 20 1HG THR 20 -2.213 -8.775 1.431
163 1HG2 THR 20 1HG2 THR 20 -5.694 -9.444 1.466
164 2HG2 THR 20 2HG2 THR 20 -5.966 -8.658 3.022
165 3HG2 THR 20 3HG2 THR 20 -5.076 -10.179 2.946
166 H CYS 21 H CYS 21 -2.696 -7.058 -0.445
167 HA CYS 21 HA CYS 21 -4.842 -7.321 -2.408
168 1HB CYS 21 1HB CYS 21 -3.184 -5.528 -2.714
169 2HB CYS 21 2HB CYS 21 -1.898 -6.727 -2.780
170 H GLY 22 H GLY 22 -2.600 -9.259 -0.798
171 1HA GLY 22 1HA GLY 22 -3.362 -11.627 -2.077
172 2HA GLY 22 2HA GLY 22 -1.862 -11.089 -2.817
173 H ILE 23 H ILE 23 -1.195 -13.243 -1.921
174 HA ILE 23 HA ILE 23 -0.957 -13.729 0.828
175 HB ILE 23 HB ILE 23 0.862 -14.716 -1.373
176 1HG1 ILE 23 1HG1 ILE 23 -1.490 -15.232 -1.840
177 2HG1 ILE 23 2HG1 ILE 23 -0.599 -16.693 -1.429
178 1HG2 ILE 23 1HG2 ILE 23 1.297 -16.599 0.150
179 2HG2 ILE 23 2HG2 ILE 23 0.337 -15.795 1.393
180 3HG2 ILE 23 3HG2 ILE 23 1.832 -15.057 0.818
181 1HD1 ILE 23 1HD1 ILE 23 -2.781 -16.704 -0.393
182 2HD1 ILE 23 2HD1 ILE 23 -2.444 -15.160 0.390
183 3HD1 ILE 23 3HD1 ILE 23 -1.525 -16.597 0.841
184 H ARG 24 H ARG 24 1.526 -12.552 -1.450
185 HA ARG 24 HA ARG 24 2.990 -11.455 0.855
186 1HB ARG 24 1HB ARG 24 5.004 -11.557 -0.476
187 2HB ARG 24 2HB ARG 24 4.224 -13.131 -0.496
188 1HG ARG 24 1HG ARG 24 3.768 -11.157 -2.701
189 2HG ARG 24 2HG ARG 24 5.190 -12.201 -2.684
190 1HD ARG 24 1HD ARG 24 2.308 -13.086 -2.660
191 2HD ARG 24 2HD ARG 24 3.431 -13.206 -4.012
192 HE ARG 24 HE ARG 24 3.983 -14.621 -1.497
193 1HH1 ARG 24 1HH1 ARG 24 3.360 -14.655 -4.927
194 2HH1 ARG 24 2HH1 ARG 24 3.763 -16.329 -5.113
195 1HH2 ARG 24 1HH2 ARG 24 4.515 -16.826 -1.735
196 2HH2 ARG 24 2HH2 ARG 24 4.421 -17.562 -3.300
197 H PHE 25 H PHE 25 0.724 -10.351 -0.883
198 HA PHE 25 HA PHE 25 2.045 -7.932 -1.886
199 1HB PHE 25 1HB PHE 25 -0.746 -9.001 -2.345
200 2HB PHE 25 2HB PHE 25 -0.140 -7.484 -3.000
201 HD1 PHE 25 1HD PHE 25 1.344 -7.445 -4.867
202 HD2 PHE 25 2HD PHE 25 0.132 -11.143 -3.147
203 HE1 PHE 25 1HE PHE 25 2.238 -8.642 -6.821
204 HE2 PHE 25 2HE PHE 25 1.024 -12.347 -5.097
205 HZ PHE 25 HZ PHE 25 2.080 -11.097 -6.938
206 H LEU 26 H LEU 26 1.357 -5.872 -1.272
207 HA LEU 26 HA LEU 26 -0.326 -5.762 1.143
208 1HB LEU 26 1HB LEU 26 2.071 -4.010 0.590
209 2HB LEU 26 2HB LEU 26 1.081 -4.004 2.034
210 HG LEU 26 HG LEU 26 1.863 -6.474 2.273
211 1HD1 LEU 26 1HD1 LEU 26 2.944 -6.697 0.126
212 2HD1 LEU 26 2HD1 LEU 26 4.148 -6.820 1.408
213 3HD1 LEU 26 3HD1 LEU 26 3.997 -5.327 0.480
214 1HD2 LEU 26 1HD2 LEU 26 2.411 -4.703 3.840
215 2HD2 LEU 26 2HD2 LEU 26 3.701 -4.139 2.778
216 3HD2 LEU 26 3HD2 LEU 26 3.820 -5.722 3.547
217 H TYR 27 H TYR 27 -0.984 -3.362 1.556
218 HA TYR 27 HA TYR 27 -1.945 -2.315 -1.019
219 1HB TYR 27 1HB TYR 27 -3.391 -3.099 1.216
220 2HB TYR 27 2HB TYR 27 -3.356 -1.343 1.336
221 HD1 TYR 27 1HD TYR 27 -5.353 -0.455 0.578
222 HD2 TYR 27 2HD TYR 27 -3.618 -3.712 -1.538
223 HE1 TYR 27 1HE TYR 27 -7.143 -0.308 -1.102
224 HE2 TYR 27 2HE TYR 27 -5.402 -3.573 -3.226
225 HH TYR 27 HH TYR 27 -7.516 -0.935 -3.456
226 H CYS 28 H CYS 28 -1.238 -0.398 -1.651
227 HA CYS 28 HA CYS 28 -0.027 1.371 0.373
228 1HB CYS 28 1HB CYS 28 1.641 0.397 -1.149
229 2HB CYS 28 2HB CYS 28 0.767 1.056 -2.527
230 H CYS 29 H CYS 29 -1.025 3.221 0.662
231 HA CYS 29 HA CYS 29 -2.548 4.397 -1.569
232 1HB CYS 29 1HB CYS 29 -3.634 3.427 0.774
233 2HB CYS 29 2HB CYS 29 -3.445 5.141 1.125
234 HA PRO 30 HA PRO 30 -0.294 8.193 -1.369
235 1HB PRO 30 1HB PRO 30 -2.901 9.431 -0.555
236 2HB PRO 30 2HB PRO 30 -1.719 9.990 -1.745
237 1HG PRO 30 1HG PRO 30 -3.935 8.738 -2.530
238 2HG PRO 30 2HG PRO 30 -2.384 8.437 -3.336
239 1HD PRO 30 1HD PRO 30 -3.917 6.708 -1.481
240 2HD PRO 30 2HD PRO 30 -2.786 6.257 -2.771
241 H ARG 31 H ARG 31 0.660 9.607 0.122
242 HA ARG 31 HA ARG 31 1.117 8.784 2.662
243 1HB ARG 31 1HB ARG 31 2.349 10.594 1.501
244 2HB ARG 31 2HB ARG 31 1.002 11.680 1.809
245 1HG ARG 31 1HG ARG 31 2.727 12.099 3.415
246 2HG ARG 31 2HG ARG 31 1.351 11.361 4.237
247 1HD ARG 31 1HD ARG 31 2.465 9.214 4.251
248 2HD ARG 31 2HD ARG 31 3.803 9.869 3.308
249 HE ARG 31 HE ARG 31 3.523 11.373 5.661
250 1HH1 ARG 31 1HH1 ARG 31 4.496 8.189 4.624
251 2HH1 ARG 31 2HH1 ARG 31 5.583 7.951 5.951
252 1HH2 ARG 31 1HH2 ARG 31 4.955 11.068 7.405
253 2HH2 ARG 31 2HH2 ARG 31 5.847 9.589 7.529
254 H ARG 32 H ARG 32 -1.457 11.015 1.672
255 HA ARG 32 HA ARG 32 -2.424 11.630 4.229
256 1HB ARG 32 1HB ARG 32 -3.988 11.449 1.649
257 2HB ARG 32 2HB ARG 32 -4.491 12.301 3.101
258 1HG ARG 32 1HG ARG 32 -2.017 12.977 1.527
259 2HG ARG 32 2HG ARG 32 -3.582 13.760 1.304
260 1HD ARG 32 1HD ARG 32 -3.550 14.569 3.576
261 2HD ARG 32 2HD ARG 32 -2.066 13.678 3.910
262 HE ARG 32 HE ARG 32 -1.071 15.182 2.119
263 1HH1 ARG 32 1HH1 ARG 32 -3.715 16.158 4.170
264 2HH1 ARG 32 2HH1 ARG 32 -3.317 17.842 4.096
265 1HH2 ARG 32 1HH2 ARG 32 -0.542 17.393 2.018
266 2HH2 ARG 32 2HH2 ARG 32 -1.514 18.544 2.872
Start of MODEL 18
1 1H GLY 1 1H GLY 1 -11.442 10.853 -3.584
2 2H GLY 1 2H GLY 1 -13.065 10.378 -3.533
3 3H GLY 1 3H GLY 1 -11.858 9.231 -3.828
4 1HA GLY 1 1HA GLY 1 -12.242 10.745 -1.303
5 2HA GLY 1 2HA GLY 1 -12.661 9.058 -1.557
6 H LEU 2 H LEU 2 -10.883 7.577 -2.099
7 HA LEU 2 HA LEU 2 -8.345 8.463 -0.895
8 1HB LEU 2 1HB LEU 2 -8.078 6.029 -0.236
9 2HB LEU 2 2HB LEU 2 -9.271 6.958 0.649
10 HG LEU 2 HG LEU 2 -10.944 5.946 -1.097
11 1HD1 LEU 2 1HD1 LEU 2 -9.316 4.897 -2.538
12 2HD1 LEU 2 2HD1 LEU 2 -10.301 3.660 -1.759
13 3HD1 LEU 2 3HD1 LEU 2 -8.666 3.975 -1.183
14 1HD2 LEU 2 1HD2 LEU 2 -9.752 4.323 1.149
15 2HD2 LEU 2 2HD2 LEU 2 -11.330 4.056 0.410
16 3HD2 LEU 2 3HD2 LEU 2 -11.016 5.544 1.304
17 H LEU 3 H LEU 3 -6.409 7.501 -1.711
18 HA LEU 3 HA LEU 3 -6.700 6.348 -4.405
19 1HB LEU 3 1HB LEU 3 -4.674 8.378 -3.467
20 2HB LEU 3 2HB LEU 3 -4.596 7.546 -5.008
21 HG LEU 3 HG LEU 3 -6.966 8.555 -5.391
22 1HD1 LEU 3 1HD1 LEU 3 -7.285 9.388 -3.122
23 2HD1 LEU 3 2HD1 LEU 3 -7.300 10.707 -4.290
24 3HD1 LEU 3 3HD1 LEU 3 -5.872 10.428 -3.297
25 1HD2 LEU 3 1HD2 LEU 3 -4.472 10.249 -5.441
26 2HD2 LEU 3 2HD2 LEU 3 -5.951 10.569 -6.348
27 3HD2 LEU 3 3HD2 LEU 3 -4.997 9.126 -6.696
28 H CYS 4 H CYS 4 -6.580 4.371 -2.985
29 HA CYS 4 HA CYS 4 -3.843 3.716 -2.171
30 1HB CYS 4 1HB CYS 4 -6.346 2.076 -1.754
31 2HB CYS 4 2HB CYS 4 -4.788 1.865 -0.961
32 H TYR 5 H TYR 5 -2.692 2.021 -3.067
33 HA TYR 5 HA TYR 5 -3.927 0.643 -5.354
34 1HB TYR 5 1HB TYR 5 -1.189 1.925 -5.296
35 2HB TYR 5 2HB TYR 5 -1.773 0.875 -6.583
36 HD1 TYR 5 1HD TYR 5 -3.722 1.616 -7.972
37 HD2 TYR 5 2HD TYR 5 -1.777 4.218 -5.227
38 HE1 TYR 5 1HE TYR 5 -4.728 3.551 -9.106
39 HE2 TYR 5 2HE TYR 5 -2.779 6.163 -6.351
40 HH TYR 5 HH TYR 5 -5.304 5.881 -8.608
41 H CYS 6 H CYS 6 -2.896 -1.355 -5.962
42 HA CYS 6 HA CYS 6 -1.993 -2.841 -3.651
43 1HB CYS 6 1HB CYS 6 -3.555 -4.012 -4.976
44 2HB CYS 6 2HB CYS 6 -2.732 -3.590 -6.473
45 H ARG 7 H ARG 7 0.070 -3.015 -3.114
46 HA ARG 7 HA ARG 7 2.106 -2.768 -5.229
47 1HB ARG 7 1HB ARG 7 2.216 -2.027 -2.308
48 2HB ARG 7 2HB ARG 7 3.638 -2.097 -3.333
49 1HG ARG 7 1HG ARG 7 1.257 -0.373 -3.947
50 2HG ARG 7 2HG ARG 7 2.635 0.178 -2.990
51 1HD ARG 7 1HD ARG 7 4.096 -0.504 -4.920
52 2HD ARG 7 2HD ARG 7 2.621 -0.733 -5.856
53 HE ARG 7 HE ARG 7 2.485 1.820 -4.816
54 1HH1 ARG 7 1HH1 ARG 7 4.604 0.006 -6.872
55 2HH1 ARG 7 2HH1 ARG 7 5.097 1.378 -7.813
56 1HH2 ARG 7 1HH2 ARG 7 3.113 3.652 -6.033
57 2HH2 ARG 7 2HH2 ARG 7 4.246 3.462 -7.330
58 H LYS 8 H LYS 8 4.151 -3.952 -4.789
59 HA LYS 8 HA LYS 8 3.659 -6.483 -3.363
60 1HB LYS 8 1HB LYS 8 3.482 -6.864 -5.769
61 2HB LYS 8 2HB LYS 8 5.052 -6.115 -6.022
62 1HG LYS 8 1HG LYS 8 6.089 -7.912 -4.686
63 2HG LYS 8 2HG LYS 8 4.506 -8.681 -4.542
64 1HD LYS 8 1HD LYS 8 4.387 -8.922 -6.964
65 2HD LYS 8 2HD LYS 8 5.942 -8.106 -7.135
66 1HE LYS 8 1HE LYS 8 5.492 -10.692 -5.651
67 2HE LYS 8 2HE LYS 8 6.122 -10.565 -7.293
68 1HZ LYS 8 1HZ LYS 8 7.397 -9.464 -4.847
69 2HZ LYS 8 2HZ LYS 8 7.996 -9.292 -6.420
70 3HZ LYS 8 3HZ LYS 8 7.911 -10.826 -5.711
71 H GLY 9 H GLY 9 5.176 -7.044 -1.929
72 1HA GLY 9 1HA GLY 9 7.306 -7.266 -1.007
73 2HA GLY 9 2HA GLY 9 7.936 -6.224 -2.274
74 H HIS 10 H HIS 10 7.024 -3.883 -2.089
75 HA HIS 10 HA HIS 10 6.411 -2.904 0.506
76 1HB HIS 10 1HB HIS 10 8.488 -1.700 0.958
77 2HB HIS 10 2HB HIS 10 8.787 -3.435 0.871
78 HD1 HIS 10 1HD HIS 10 8.858 -0.531 -1.578
79 HD2 HIS 10 2HD HIS 10 10.977 -3.969 -0.613
80 HE1 HIS 10 1HE HIS 10 10.775 -0.604 -3.177
81 HE2 HIS 10 2HE HIS 10 12.004 -2.736 -2.643
82 H CYS 11 H CYS 11 5.895 -0.698 0.516
83 HA CYS 11 HA CYS 11 5.742 0.494 -2.171
84 1HB CYS 11 1HB CYS 11 3.562 0.043 -1.130
85 2HB CYS 11 2HB CYS 11 4.013 1.033 0.253
86 H LYS 12 H LYS 12 5.702 2.938 -2.151
87 HA LYS 12 HA LYS 12 8.127 3.894 -1.076
88 1HB LYS 12 1HB LYS 12 5.940 5.758 -1.906
89 2HB LYS 12 2HB LYS 12 7.673 5.888 -2.171
90 1HG LYS 12 1HG LYS 12 5.996 3.792 -3.504
91 2HG LYS 12 2HG LYS 12 6.226 5.408 -4.182
92 1HD LYS 12 1HD LYS 12 8.652 5.052 -4.194
93 2HD LYS 12 2HD LYS 12 8.417 3.437 -3.521
94 1HE LYS 12 1HE LYS 12 8.772 3.353 -5.937
95 2HE LYS 12 2HE LYS 12 7.162 2.780 -5.504
96 1HZ LYS 12 1HZ LYS 12 7.811 5.490 -6.533
97 2HZ LYS 12 2HZ LYS 12 6.267 4.936 -6.123
98 3HZ LYS 12 3HZ LYS 12 7.095 4.241 -7.424
99 H ARG 13 H ARG 13 5.059 5.558 -0.511
100 HA ARG 13 HA ARG 13 5.654 5.623 2.367
101 1HB ARG 13 1HB ARG 13 4.417 8.032 1.137
102 2HB ARG 13 2HB ARG 13 5.492 7.907 2.521
103 1HG ARG 13 1HG ARG 13 6.895 8.912 1.046
104 2HG ARG 13 2HG ARG 13 7.235 7.225 0.653
105 1HD ARG 13 1HD ARG 13 5.712 7.318 -1.228
106 2HD ARG 13 2HD ARG 13 5.234 8.960 -0.796
107 HE ARG 13 HE ARG 13 8.053 8.537 -1.361
108 1HH1 ARG 13 1HH1 ARG 13 4.939 9.597 -2.514
109 2HH1 ARG 13 2HH1 ARG 13 5.596 10.508 -3.832
110 1HH2 ARG 13 1HH2 ARG 13 8.923 9.735 -3.095
111 2HH2 ARG 13 2HH2 ARG 13 7.857 10.588 -4.162
112 H GLY 14 H GLY 14 4.041 4.314 3.089
113 1HA GLY 14 1HA GLY 14 1.666 4.814 3.880
114 2HA GLY 14 2HA GLY 14 1.302 4.904 2.164
115 H GLU 15 H GLU 15 3.469 2.594 3.723
116 HA GLU 15 HA GLU 15 2.185 0.393 2.436
117 1HB GLU 15 1HB GLU 15 4.188 0.308 4.697
118 2HB GLU 15 2HB GLU 15 3.816 -0.989 3.568
119 1HG GLU 15 1HG GLU 15 4.659 0.528 1.739
120 2HG GLU 15 2HG GLU 15 5.233 1.596 3.020
121 H ARG 16 H ARG 16 0.273 -0.380 3.060
122 HA ARG 16 HA ARG 16 -0.217 -0.750 5.934
123 1HB ARG 16 1HB ARG 16 -2.274 0.254 3.961
124 2HB ARG 16 2HB ARG 16 -2.531 -0.037 5.675
125 1HG ARG 16 1HG ARG 16 -0.978 1.745 6.231
126 2HG ARG 16 2HG ARG 16 -0.659 2.018 4.517
127 1HD ARG 16 1HD ARG 16 -2.236 3.660 5.317
128 2HD ARG 16 2HD ARG 16 -3.040 2.568 4.191
129 HE ARG 16 HE ARG 16 -3.462 1.540 6.726
130 1HH1 ARG 16 1HH1 ARG 16 -4.223 4.456 4.978
131 2HH1 ARG 16 2HH1 ARG 16 -5.682 4.758 5.861
132 1HH2 ARG 16 1HH2 ARG 16 -5.381 1.929 7.894
133 2HH2 ARG 16 2HH2 ARG 16 -6.340 3.322 7.518
134 H VAL 17 H VAL 17 -2.255 -2.170 6.237
135 HA VAL 17 HA VAL 17 -2.420 -4.222 4.156
136 HB VAL 17 HB VAL 17 -0.791 -4.916 5.924
137 1HG1 VAL 17 1HG1 VAL 17 -3.224 -5.012 7.697
138 2HG1 VAL 17 2HG1 VAL 17 -1.884 -3.876 7.842
139 3HG1 VAL 17 3HG1 VAL 17 -1.612 -5.598 8.107
140 1HG2 VAL 17 1HG2 VAL 17 -1.640 -7.177 6.146
141 2HG2 VAL 17 2HG2 VAL 17 -1.982 -6.553 4.532
142 3HG2 VAL 17 3HG2 VAL 17 -3.266 -6.630 5.739
143 H ARG 18 H ARG 18 -4.243 -2.184 4.643
144 HA ARG 18 HA ARG 18 -6.401 -3.064 6.299
145 1HB ARG 18 1HB ARG 18 -6.128 -0.700 5.818
146 2HB ARG 18 2HB ARG 18 -6.289 -0.998 4.093
147 1HG ARG 18 1HG ARG 18 -8.333 -0.069 4.964
148 2HG ARG 18 2HG ARG 18 -8.605 -1.735 4.452
149 1HD ARG 18 1HD ARG 18 -9.704 -1.287 6.580
150 2HD ARG 18 2HD ARG 18 -8.421 -2.481 6.772
151 HE ARG 18 HE ARG 18 -7.479 0.148 7.309
152 1HH1 ARG 18 1HH1 ARG 18 -9.329 -2.474 8.668
153 2HH1 ARG 18 2HH1 ARG 18 -8.986 -2.037 10.309
154 1HH2 ARG 18 1HH2 ARG 18 -7.022 0.731 9.467
155 2HH2 ARG 18 2HH2 ARG 18 -7.677 -0.213 10.763
156 H GLY 19 H GLY 19 -5.550 -3.365 2.917
157 1HA GLY 19 1HA GLY 19 -7.709 -5.342 2.609
158 2HA GLY 19 2HA GLY 19 -7.501 -4.078 1.402
159 H THR 20 H THR 20 -5.953 -6.851 2.924
160 HA THR 20 HA THR 20 -3.599 -7.072 1.595
161 HB THR 20 HB THR 20 -4.156 -8.713 3.235
162 HG1 THR 20 1HG THR 20 -4.111 -10.638 1.430
163 1HG2 THR 20 1HG2 THR 20 -6.568 -8.817 2.887
164 2HG2 THR 20 2HG2 THR 20 -5.869 -10.436 2.857
165 3HG2 THR 20 3HG2 THR 20 -6.324 -9.644 1.348
166 H CYS 21 H CYS 21 -2.953 -7.216 -0.427
167 HA CYS 21 HA CYS 21 -4.911 -7.564 -2.544
168 1HB CYS 21 1HB CYS 21 -3.233 -5.742 -2.649
169 2HB CYS 21 2HB CYS 21 -1.953 -6.947 -2.709
170 H GLY 22 H GLY 22 -2.701 -9.459 -0.817
171 1HA GLY 22 1HA GLY 22 -3.344 -11.847 -2.095
172 2HA GLY 22 2HA GLY 22 -1.856 -11.266 -2.825
173 H ILE 23 H ILE 23 -0.737 -13.087 -2.015
174 HA ILE 23 HA ILE 23 -0.555 -13.431 0.864
175 HB ILE 23 HB ILE 23 0.790 -14.906 -1.405
176 1HG1 ILE 23 1HG1 ILE 23 -0.681 -16.789 -0.424
177 2HG1 ILE 23 2HG1 ILE 23 -1.564 -15.495 0.380
178 1HG2 ILE 23 1HG2 ILE 23 2.252 -14.944 0.513
179 2HG2 ILE 23 2HG2 ILE 23 1.500 -16.528 0.318
180 3HG2 ILE 23 3HG2 ILE 23 0.918 -15.423 1.562
181 1HD1 ILE 23 1HD1 ILE 23 -2.590 -16.245 -1.737
182 2HD1 ILE 23 2HD1 ILE 23 -1.156 -15.679 -2.594
183 3HD1 ILE 23 3HD1 ILE 23 -2.175 -14.531 -1.726
184 H ARG 24 H ARG 24 1.730 -12.803 -1.803
185 HA ARG 24 HA ARG 24 3.662 -11.770 0.138
186 1HB ARG 24 1HB ARG 24 5.276 -11.861 -1.700
187 2HB ARG 24 2HB ARG 24 4.481 -13.414 -1.483
188 1HG ARG 24 1HG ARG 24 2.913 -12.702 -3.349
189 2HG ARG 24 2HG ARG 24 4.055 -11.391 -3.659
190 1HD ARG 24 1HD ARG 24 4.500 -13.305 -5.106
191 2HD ARG 24 2HD ARG 24 5.841 -13.023 -3.995
192 HE ARG 24 HE ARG 24 4.287 -14.859 -2.716
193 1HH1 ARG 24 1HH1 ARG 24 5.804 -14.702 -5.851
194 2HH1 ARG 24 2HH1 ARG 24 6.026 -16.416 -5.969
195 1HH2 ARG 24 1HH2 ARG 24 4.575 -17.113 -2.866
196 2HH2 ARG 24 2HH2 ARG 24 5.325 -17.786 -4.275
197 H PHE 25 H PHE 25 1.121 -10.502 -1.162
198 HA PHE 25 HA PHE 25 2.391 -8.015 -2.083
199 1HB PHE 25 1HB PHE 25 -0.453 -8.969 -2.478
200 2HB PHE 25 2HB PHE 25 0.226 -7.476 -3.112
201 HD1 PHE 25 1HD PHE 25 0.405 -11.162 -3.321
202 HD2 PHE 25 2HD PHE 25 1.450 -7.447 -5.120
203 HE1 PHE 25 1HE PHE 25 1.107 -12.350 -5.360
204 HE2 PHE 25 2HE PHE 25 2.154 -8.628 -7.160
205 HZ PHE 25 HZ PHE 25 1.982 -11.081 -7.281
206 H LEU 26 H LEU 26 0.573 -6.151 -1.676
207 HA LEU 26 HA LEU 26 -0.695 -6.242 0.878
208 1HB LEU 26 1HB LEU 26 0.662 -4.583 2.013
209 2HB LEU 26 2HB LEU 26 1.629 -5.989 1.620
210 HG LEU 26 HG LEU 26 1.640 -3.537 -0.119
211 1HD1 LEU 26 1HD1 LEU 26 3.416 -4.109 2.248
212 2HD1 LEU 26 2HD1 LEU 26 2.224 -2.814 2.127
213 3HD1 LEU 26 3HD1 LEU 26 3.643 -2.806 1.081
214 1HD2 LEU 26 1HD2 LEU 26 3.854 -4.403 -0.752
215 2HD2 LEU 26 2HD2 LEU 26 2.566 -5.554 -1.103
216 3HD2 LEU 26 3HD2 LEU 26 3.600 -5.790 0.305
217 H TYR 27 H TYR 27 -1.210 -3.769 1.519
218 HA TYR 27 HA TYR 27 -2.068 -2.504 -0.995
219 1HB TYR 27 1HB TYR 27 -3.716 -3.570 0.926
220 2HB TYR 27 2HB TYR 27 -3.685 -1.862 1.354
221 HD1 TYR 27 1HD TYR 27 -3.989 -4.004 -1.685
222 HD2 TYR 27 2HD TYR 27 -5.264 -0.495 0.357
223 HE1 TYR 27 1HE TYR 27 -5.590 -3.537 -3.496
224 HE2 TYR 27 2HE TYR 27 -6.867 -0.020 -1.445
225 HH TYR 27 HH TYR 27 -7.696 -2.289 -3.820
226 H CYS 28 H CYS 28 -1.243 -0.607 -1.360
227 HA CYS 28 HA CYS 28 -0.215 0.979 0.895
228 1HB CYS 28 1HB CYS 28 1.471 0.298 -0.757
229 2HB CYS 28 2HB CYS 28 0.535 1.063 -2.035
230 H CYS 29 H CYS 29 -0.287 3.389 0.511
231 HA CYS 29 HA CYS 29 -2.313 4.406 -1.248
232 1HB CYS 29 1HB CYS 29 -3.413 3.371 0.932
233 2HB CYS 29 2HB CYS 29 -2.932 4.915 1.628
234 HA PRO 30 HA PRO 30 1.066 7.401 -0.365
235 1HB PRO 30 1HB PRO 30 0.607 8.805 -2.690
236 2HB PRO 30 2HB PRO 30 1.706 7.428 -2.551
237 1HG PRO 30 1HG PRO 30 -1.107 7.517 -3.558
238 2HG PRO 30 2HG PRO 30 0.283 6.615 -4.189
239 1HD PRO 30 1HD PRO 30 -1.617 5.420 -2.718
240 2HD PRO 30 2HD PRO 30 0.092 4.952 -2.586
241 H ARG 31 H ARG 31 0.742 9.105 0.889
242 HA ARG 31 HA ARG 31 -1.846 10.464 0.822
243 1HB ARG 31 1HB ARG 31 0.406 10.655 2.830
244 2HB ARG 31 2HB ARG 31 -1.175 11.408 2.988
245 1HG ARG 31 1HG ARG 31 -2.240 9.253 3.123
246 2HG ARG 31 2HG ARG 31 -0.704 8.439 2.814
247 1HD ARG 31 1HD ARG 31 -1.271 8.406 5.192
248 2HD ARG 31 2HD ARG 31 0.202 9.327 4.891
249 HE ARG 31 HE ARG 31 -2.224 10.896 5.002
250 1HH1 ARG 31 1HH1 ARG 31 0.487 9.597 6.765
251 2HH1 ARG 31 2HH1 ARG 31 0.381 10.763 8.041
252 1HH2 ARG 31 1HH2 ARG 31 -2.369 12.437 6.675
253 2HH2 ARG 31 2HH2 ARG 31 -1.245 12.377 7.991
254 H ARG 32 H ARG 32 -1.683 11.855 -0.917
255 HA ARG 32 HA ARG 32 0.592 13.658 -1.096
256 1HB ARG 32 1HB ARG 32 -1.870 13.416 -2.835
257 2HB ARG 32 2HB ARG 32 -0.488 14.452 -3.168
258 1HG ARG 32 1HG ARG 32 0.946 12.465 -3.321
259 2HG ARG 32 2HG ARG 32 -0.465 11.444 -3.035
260 1HD ARG 32 1HD ARG 32 -1.513 12.347 -5.063
261 2HD ARG 32 2HD ARG 32 -0.083 13.338 -5.352
262 HE ARG 32 HE ARG 32 0.676 10.636 -5.124
263 1HH1 ARG 32 1HH1 ARG 32 -0.995 12.799 -7.286
264 2HH1 ARG 32 2HH1 ARG 32 -0.594 11.895 -8.708
265 1HH2 ARG 32 1HH2 ARG 32 1.207 9.440 -6.992
266 2HH2 ARG 32 2HH2 ARG 32 0.657 9.986 -8.540
Start of MODEL 19
1 1H GLY 1 1H GLY 1 -9.449 10.059 1.039
2 2H GLY 1 2H GLY 1 -10.286 10.057 -0.431
3 3H GLY 1 3H GLY 1 -9.422 11.430 0.048
4 1HA GLY 1 1HA GLY 1 -8.220 10.215 -1.659
5 2HA GLY 1 2HA GLY 1 -7.337 10.255 -0.140
6 H LEU 2 H LEU 2 -9.841 8.251 -1.698
7 HA LEU 2 HA LEU 2 -8.590 5.875 -0.535
8 1HB LEU 2 1HB LEU 2 -11.261 6.314 -1.864
9 2HB LEU 2 2HB LEU 2 -10.667 4.729 -1.409
10 HG LEU 2 HG LEU 2 -10.501 5.627 0.970
11 1HD1 LEU 2 1HD1 LEU 2 -12.217 7.797 -0.229
12 2HD1 LEU 2 2HD1 LEU 2 -10.610 7.998 0.470
13 3HD1 LEU 2 3HD1 LEU 2 -11.966 7.527 1.495
14 1HD2 LEU 2 1HD2 LEU 2 -12.235 4.074 0.267
15 2HD2 LEU 2 2HD2 LEU 2 -13.210 5.413 -0.337
16 3HD2 LEU 2 3HD2 LEU 2 -12.889 5.266 1.390
17 H LEU 3 H LEU 3 -7.035 6.957 -2.461
18 HA LEU 3 HA LEU 3 -7.490 5.248 -4.816
19 1HB LEU 3 1HB LEU 3 -5.895 7.803 -4.610
20 2HB LEU 3 2HB LEU 3 -6.072 6.831 -6.059
21 HG LEU 3 HG LEU 3 -8.345 8.221 -4.638
22 1HD1 LEU 3 1HD1 LEU 3 -6.883 8.970 -7.166
23 2HD1 LEU 3 2HD1 LEU 3 -6.801 9.826 -5.627
24 3HD1 LEU 3 3HD1 LEU 3 -8.318 9.771 -6.525
25 1HD2 LEU 3 1HD2 LEU 3 -8.218 6.781 -7.284
26 2HD2 LEU 3 2HD2 LEU 3 -9.604 7.682 -6.673
27 3HD2 LEU 3 3HD2 LEU 3 -9.058 6.230 -5.835
28 H CYS 4 H CYS 4 -6.487 3.734 -3.037
29 HA CYS 4 HA CYS 4 -3.626 3.923 -2.766
30 1HB CYS 4 1HB CYS 4 -5.260 1.471 -2.155
31 2HB CYS 4 2HB CYS 4 -3.767 2.013 -1.398
32 H TYR 5 H TYR 5 -2.560 1.537 -3.153
33 HA TYR 5 HA TYR 5 -3.287 0.520 -5.781
34 1HB TYR 5 1HB TYR 5 -0.583 1.737 -5.181
35 2HB TYR 5 2HB TYR 5 -0.935 0.755 -6.598
36 HD1 TYR 5 1HD TYR 5 -2.694 1.595 -8.232
37 HD2 TYR 5 2HD TYR 5 -1.035 4.042 -5.172
38 HE1 TYR 5 1HE TYR 5 -3.436 3.602 -9.443
39 HE2 TYR 5 2HE TYR 5 -1.773 6.055 -6.375
40 HH TYR 5 HH TYR 5 -3.976 5.966 -8.932
41 H CYS 6 H CYS 6 -1.787 -1.335 -6.391
42 HA CYS 6 HA CYS 6 -1.419 -3.012 -4.019
43 1HB CYS 6 1HB CYS 6 -2.805 -3.968 -5.754
44 2HB CYS 6 2HB CYS 6 -1.566 -3.668 -6.968
45 H ARG 7 H ARG 7 0.531 -3.630 -3.304
46 HA ARG 7 HA ARG 7 2.852 -3.266 -5.073
47 1HB ARG 7 1HB ARG 7 2.606 -2.370 -2.202
48 2HB ARG 7 2HB ARG 7 4.136 -2.472 -3.062
49 1HG ARG 7 1HG ARG 7 1.807 -0.772 -3.923
50 2HG ARG 7 2HG ARG 7 3.180 -0.192 -2.980
51 1HD ARG 7 1HD ARG 7 4.697 -0.763 -4.779
52 2HD ARG 7 2HD ARG 7 3.370 -1.453 -5.713
53 HE ARG 7 HE ARG 7 3.294 1.386 -4.979
54 1HH1 ARG 7 1HH1 ARG 7 3.504 -1.112 -7.393
55 2HH1 ARG 7 2HH1 ARG 7 3.236 -0.032 -8.722
56 1HH2 ARG 7 1HH2 ARG 7 2.940 2.820 -6.720
57 2HH2 ARG 7 2HH2 ARG 7 2.915 2.205 -8.339
58 H LYS 8 H LYS 8 4.850 -4.335 -4.084
59 HA LYS 8 HA LYS 8 4.128 -6.810 -2.673
60 1HB LYS 8 1HB LYS 8 4.306 -7.403 -5.009
61 2HB LYS 8 2HB LYS 8 5.847 -6.568 -5.146
62 1HG LYS 8 1HG LYS 8 6.820 -8.191 -3.551
63 2HG LYS 8 2HG LYS 8 5.284 -9.059 -3.552
64 1HD LYS 8 1HD LYS 8 6.908 -8.517 -6.033
65 2HD LYS 8 2HD LYS 8 7.029 -10.000 -5.085
66 1HE LYS 8 1HE LYS 8 4.529 -8.956 -6.411
67 2HE LYS 8 2HE LYS 8 5.541 -10.268 -7.014
68 1HZ LYS 8 1HZ LYS 8 4.002 -10.252 -4.474
69 2HZ LYS 8 2HZ LYS 8 5.054 -11.488 -4.952
70 3HZ LYS 8 3HZ LYS 8 3.660 -11.169 -5.856
71 H GLY 9 H GLY 9 5.128 -6.599 -0.766
72 1HA GLY 9 1HA GLY 9 7.157 -6.928 0.460
73 2HA GLY 9 2HA GLY 9 8.021 -6.078 -0.812
74 H HIS 10 H HIS 10 7.889 -3.782 -0.908
75 HA HIS 10 HA HIS 10 6.667 -2.435 1.375
76 1HB HIS 10 1HB HIS 10 9.075 -3.126 1.913
77 2HB HIS 10 2HB HIS 10 9.565 -1.936 0.711
78 HD1 HIS 10 1HD HIS 10 8.048 -2.236 4.120
79 HD2 HIS 10 2HD HIS 10 9.359 0.727 1.517
80 HE1 HIS 10 1HE HIS 10 8.114 -0.122 5.484
81 HE2 HIS 10 2HE HIS 10 8.919 1.655 3.892
82 H CYS 11 H CYS 11 5.502 -0.845 0.524
83 HA CYS 11 HA CYS 11 5.937 0.179 -2.094
84 1HB CYS 11 1HB CYS 11 3.706 0.046 -0.984
85 2HB CYS 11 2HB CYS 11 4.207 1.336 0.103
86 H LYS 12 H LYS 12 6.055 2.624 -2.459
87 HA LYS 12 HA LYS 12 8.304 3.637 -0.885
88 1HB LYS 12 1HB LYS 12 8.624 5.204 -2.809
89 2HB LYS 12 2HB LYS 12 8.813 3.503 -3.211
90 1HG LYS 12 1HG LYS 12 6.581 3.457 -4.170
91 2HG LYS 12 2HG LYS 12 6.342 5.147 -3.724
92 1HD LYS 12 1HD LYS 12 8.534 4.186 -5.556
93 2HD LYS 12 2HD LYS 12 6.970 4.777 -6.119
94 1HE LYS 12 1HE LYS 12 7.399 6.927 -5.013
95 2HE LYS 12 2HE LYS 12 8.973 6.333 -4.484
96 1HZ LYS 12 1HZ LYS 12 9.148 7.701 -6.472
97 2HZ LYS 12 2HZ LYS 12 8.119 6.654 -7.311
98 3HZ LYS 12 3HZ LYS 12 9.634 6.112 -6.792
99 H ARG 13 H ARG 13 4.985 4.138 -1.275
100 HA ARG 13 HA ARG 13 5.197 6.545 0.340
101 1HB ARG 13 1HB ARG 13 3.544 6.568 -2.182
102 2HB ARG 13 2HB ARG 13 3.805 7.886 -1.058
103 1HG ARG 13 1HG ARG 13 6.140 8.010 -1.685
104 2HG ARG 13 2HG ARG 13 5.927 6.644 -2.781
105 1HD ARG 13 1HD ARG 13 5.888 8.761 -3.994
106 2HD ARG 13 2HD ARG 13 4.333 7.937 -4.099
107 HE ARG 13 HE ARG 13 4.368 9.779 -1.938
108 1HH1 ARG 13 1HH1 ARG 13 4.130 9.601 -5.412
109 2HH1 ARG 13 2HH1 ARG 13 3.220 11.069 -5.552
110 1HH2 ARG 13 1HH2 ARG 13 3.172 11.708 -2.115
111 2HH2 ARG 13 2HH2 ARG 13 2.676 12.266 -3.678
112 H GLY 14 H GLY 14 4.259 5.330 2.013
113 1HA GLY 14 1HA GLY 14 2.288 5.129 3.287
114 2HA GLY 14 2HA GLY 14 1.351 5.170 1.806
115 H GLU 15 H GLU 15 3.719 3.109 3.491
116 HA GLU 15 HA GLU 15 2.665 0.727 2.231
117 1HB GLU 15 1HB GLU 15 4.650 0.916 4.504
118 2HB GLU 15 2HB GLU 15 4.370 -0.466 3.458
119 1HG GLU 15 1HG GLU 15 6.354 0.481 2.695
120 2HG GLU 15 2HG GLU 15 5.130 1.010 1.546
121 H ARG 16 H ARG 16 0.788 -0.126 2.939
122 HA ARG 16 HA ARG 16 0.416 -0.417 5.823
123 1HB ARG 16 1HB ARG 16 -1.630 0.827 3.982
124 2HB ARG 16 2HB ARG 16 -1.949 0.331 5.639
125 1HG ARG 16 1HG ARG 16 -0.285 1.932 6.439
126 2HG ARG 16 2HG ARG 16 0.030 2.432 4.776
127 1HD ARG 16 1HD ARG 16 -2.301 3.156 4.561
128 2HD ARG 16 2HD ARG 16 -2.605 2.664 6.227
129 HE ARG 16 HE ARG 16 -0.450 4.502 6.095
130 1HH1 ARG 16 1HH1 ARG 16 -3.923 4.310 5.905
131 2HH1 ARG 16 2HH1 ARG 16 -4.172 5.934 6.455
132 1HH2 ARG 16 1HH2 ARG 16 -0.765 6.641 6.816
133 2HH2 ARG 16 2HH2 ARG 16 -2.375 7.260 6.971
134 H VAL 17 H VAL 17 -1.464 -1.817 6.349
135 HA VAL 17 HA VAL 17 -1.990 -3.821 4.270
136 HB VAL 17 HB VAL 17 -0.219 -4.627 5.813
137 1HG1 VAL 17 1HG1 VAL 17 -2.363 -4.494 7.926
138 2HG1 VAL 17 2HG1 VAL 17 -0.944 -3.452 7.829
139 3HG1 VAL 17 3HG1 VAL 17 -0.750 -5.181 8.116
140 1HG2 VAL 17 1HG2 VAL 17 -2.813 -6.146 6.054
141 2HG2 VAL 17 2HG2 VAL 17 -1.192 -6.809 6.242
142 3HG2 VAL 17 3HG2 VAL 17 -1.719 -6.202 4.673
143 H ARG 18 H ARG 18 -3.701 -1.772 4.800
144 HA ARG 18 HA ARG 18 -5.627 -2.232 6.804
145 1HB ARG 18 1HB ARG 18 -5.277 -0.145 5.323
146 2HB ARG 18 2HB ARG 18 -6.251 -0.989 4.129
147 1HG ARG 18 1HG ARG 18 -7.262 -0.605 6.916
148 2HG ARG 18 2HG ARG 18 -7.383 0.690 5.725
149 1HD ARG 18 1HD ARG 18 -8.647 -0.763 4.244
150 2HD ARG 18 2HD ARG 18 -8.474 -2.101 5.379
151 HE ARG 18 HE ARG 18 -9.664 -0.129 6.836
152 1HH1 ARG 18 1HH1 ARG 18 -10.406 -1.744 3.839
153 2HH1 ARG 18 2HH1 ARG 18 -12.120 -1.576 4.023
154 1HH2 ARG 18 1HH2 ARG 18 -11.916 0.095 7.089
155 2HH2 ARG 18 2HH2 ARG 18 -12.979 -0.531 5.874
156 H GLY 19 H GLY 19 -5.615 -3.021 3.354
157 1HA GLY 19 1HA GLY 19 -7.600 -5.134 3.905
158 2HA GLY 19 2HA GLY 19 -7.487 -4.268 2.377
159 H THR 20 H THR 20 -6.473 -5.301 0.798
160 HA THR 20 HA THR 20 -3.974 -6.511 1.008
161 HB THR 20 HB THR 20 -4.995 -8.262 2.312
162 HG1 THR 20 1HG THR 20 -4.552 -10.048 0.854
163 1HG2 THR 20 1HG2 THR 20 -7.317 -7.968 1.582
164 2HG2 THR 20 2HG2 THR 20 -6.812 -9.652 1.441
165 3HG2 THR 20 3HG2 THR 20 -6.906 -8.636 0.003
166 H CYS 21 H CYS 21 -3.327 -7.638 -0.976
167 HA CYS 21 HA CYS 21 -5.060 -6.939 -3.252
168 1HB CYS 21 1HB CYS 21 -3.216 -5.438 -3.322
169 2HB CYS 21 2HB CYS 21 -2.066 -6.723 -2.971
170 H GLY 22 H GLY 22 -2.726 -9.202 -1.910
171 1HA GLY 22 1HA GLY 22 -3.911 -11.358 -3.424
172 2HA GLY 22 2HA GLY 22 -2.259 -10.984 -3.892
173 H ILE 23 H ILE 23 -1.249 -12.794 -3.174
174 HA ILE 23 HA ILE 23 -1.775 -13.958 -0.617
175 HB ILE 23 HB ILE 23 0.602 -14.422 -2.422
176 1HG1 ILE 23 1HG1 ILE 23 -2.014 -15.940 -2.280
177 2HG1 ILE 23 2HG1 ILE 23 -1.591 -14.794 -3.548
178 1HG2 ILE 23 1HG2 ILE 23 -0.592 -16.129 -0.240
179 2HG2 ILE 23 2HG2 ILE 23 0.912 -15.215 -0.130
180 3HG2 ILE 23 3HG2 ILE 23 0.780 -16.561 -1.261
181 1HD1 ILE 23 1HD1 ILE 23 0.275 -16.216 -4.211
182 2HD1 ILE 23 2HD1 ILE 23 -1.259 -17.082 -4.278
183 3HD1 ILE 23 3HD1 ILE 23 -0.147 -17.362 -2.940
184 H ARG 24 H ARG 24 1.256 -12.562 -1.894
185 HA ARG 24 HA ARG 24 1.991 -11.832 0.850
186 1HB ARG 24 1HB ARG 24 4.275 -11.592 -0.020
187 2HB ARG 24 2HB ARG 24 3.622 -13.190 -0.355
188 1HG ARG 24 1HG ARG 24 3.119 -12.481 -2.654
189 2HG ARG 24 2HG ARG 24 3.836 -10.907 -2.308
190 1HD ARG 24 1HD ARG 24 5.253 -13.568 -2.181
191 2HD ARG 24 2HD ARG 24 5.413 -12.375 -3.469
192 HE ARG 24 HE ARG 24 6.145 -10.923 -1.381
193 1HH1 ARG 24 1HH1 ARG 24 7.005 -14.191 -2.230
194 2HH1 ARG 24 2HH1 ARG 24 8.562 -14.115 -1.474
195 1HH2 ARG 24 1HH2 ARG 24 8.193 -10.815 -0.382
196 2HH2 ARG 24 2HH2 ARG 24 9.236 -12.197 -0.422
197 H PHE 25 H PHE 25 0.650 -10.483 -1.877
198 HA PHE 25 HA PHE 25 1.904 -7.967 -2.019
199 1HB PHE 25 1HB PHE 25 -0.923 -8.773 -2.726
200 2HB PHE 25 2HB PHE 25 -0.183 -7.238 -3.163
201 HD1 PHE 25 1HD PHE 25 -0.270 -10.831 -3.817
202 HD2 PHE 25 2HD PHE 25 1.500 -7.112 -4.890
203 HE1 PHE 25 1HE PHE 25 0.620 -11.852 -5.872
204 HE2 PHE 25 2HE PHE 25 2.392 -8.125 -6.946
205 HZ PHE 25 HZ PHE 25 1.952 -10.498 -7.440
206 H LEU 26 H LEU 26 0.832 -5.884 -1.469
207 HA LEU 26 HA LEU 26 -0.813 -5.985 0.945
208 1HB LEU 26 1HB LEU 26 0.597 -4.338 2.079
209 2HB LEU 26 2HB LEU 26 1.461 -5.832 1.781
210 HG LEU 26 HG LEU 26 1.746 -3.500 -0.083
211 1HD1 LEU 26 1HD1 LEU 26 2.213 -2.654 2.159
212 2HD1 LEU 26 2HD1 LEU 26 3.690 -2.775 1.202
213 3HD1 LEU 26 3HD1 LEU 26 3.336 -3.988 2.432
214 1HD2 LEU 26 1HD2 LEU 26 3.938 -4.536 -0.488
215 2HD2 LEU 26 2HD2 LEU 26 2.610 -5.640 -0.839
216 3HD2 LEU 26 3HD2 LEU 26 3.531 -5.817 0.653
217 H TYR 27 H TYR 27 -1.294 -3.548 1.597
218 HA TYR 27 HA TYR 27 -2.169 -2.283 -0.909
219 1HB TYR 27 1HB TYR 27 -3.694 -3.123 1.221
220 2HB TYR 27 2HB TYR 27 -3.525 -1.395 1.525
221 HD1 TYR 27 1HD TYR 27 -5.386 -0.231 0.809
222 HD2 TYR 27 2HD TYR 27 -3.961 -3.479 -1.540
223 HE1 TYR 27 1HE TYR 27 -7.124 0.230 -0.869
224 HE2 TYR 27 2HE TYR 27 -5.691 -3.024 -3.229
225 HH TYR 27 HH TYR 27 -7.546 -0.169 -3.242
226 H CYS 28 H CYS 28 -1.190 -0.509 -1.470
227 HA CYS 28 HA CYS 28 0.101 1.139 0.598
228 1HB CYS 28 1HB CYS 28 1.711 0.308 -0.984
229 2HB CYS 28 2HB CYS 28 0.710 0.806 -2.343
230 H CYS 29 H CYS 29 -1.103 2.839 1.142
231 HA CYS 29 HA CYS 29 -2.807 4.067 -0.910
232 1HB CYS 29 1HB CYS 29 -2.888 4.304 2.104
233 2HB CYS 29 2HB CYS 29 -3.966 5.149 0.999
234 HA PRO 30 HA PRO 30 -0.232 7.656 -1.053
235 1HB PRO 30 1HB PRO 30 -1.965 9.487 -1.989
236 2HB PRO 30 2HB PRO 30 -1.399 8.141 -2.987
237 1HG PRO 30 1HG PRO 30 -3.973 8.430 -1.483
238 2HG PRO 30 2HG PRO 30 -3.701 7.823 -3.127
239 1HD PRO 30 1HD PRO 30 -4.060 6.194 -0.973
240 2HD PRO 30 2HD PRO 30 -3.095 5.736 -2.390
241 H ARG 31 H ARG 31 0.071 9.788 -0.163
242 HA ARG 31 HA ARG 31 -0.799 9.994 2.533
243 1HB ARG 31 1HB ARG 31 1.400 10.777 1.870
244 2HB ARG 31 2HB ARG 31 0.685 11.948 0.770
245 1HG ARG 31 1HG ARG 31 -0.317 13.113 2.687
246 2HG ARG 31 2HG ARG 31 0.454 11.956 3.773
247 1HD ARG 31 1HD ARG 31 1.720 14.053 3.603
248 2HD ARG 31 2HD ARG 31 2.646 12.669 3.025
249 HE ARG 31 HE ARG 31 1.782 13.488 0.730
250 1HH1 ARG 31 1HH1 ARG 31 2.676 15.519 3.419
251 2HH1 ARG 31 2HH1 ARG 31 3.150 16.852 2.419
252 1HH2 ARG 31 1HH2 ARG 31 2.401 15.235 -0.591
253 2HH2 ARG 31 2HH2 ARG 31 2.990 16.692 0.139
254 H ARG 32 H ARG 32 -1.977 11.260 -0.470
255 HA ARG 32 HA ARG 32 -3.754 13.108 0.955
256 1HB ARG 32 1HB ARG 32 -4.255 14.036 -1.303
257 2HB ARG 32 2HB ARG 32 -2.568 14.180 -0.832
258 1HG ARG 32 1HG ARG 32 -2.008 12.261 -2.235
259 2HG ARG 32 2HG ARG 32 -3.704 12.108 -2.701
260 1HD ARG 32 1HD ARG 32 -3.591 14.431 -3.603
261 2HD ARG 32 2HD ARG 32 -1.859 14.423 -3.273
262 HE ARG 32 HE ARG 32 -2.733 12.221 -4.899
263 1HH1 ARG 32 1HH1 ARG 32 -1.680 15.544 -4.904
264 2HH1 ARG 32 2HH1 ARG 32 -1.135 15.502 -6.547
265 1HH2 ARG 32 1HH2 ARG 32 -2.019 12.159 -7.062
266 2HH2 ARG 32 2HH2 ARG 32 -1.329 13.578 -7.774
Start of MODEL 20
1 1H GLY 1 1H GLY 1 -7.197 12.607 -5.262
2 2H GLY 1 2H GLY 1 -6.084 12.781 -6.524
3 3H GLY 1 3H GLY 1 -5.537 12.585 -4.936
4 1HA GLY 1 1HA GLY 1 -7.045 10.551 -6.484
5 2HA GLY 1 2HA GLY 1 -5.305 10.539 -6.240
6 H LEU 2 H LEU 2 -8.374 10.580 -4.447
7 HA LEU 2 HA LEU 2 -7.068 9.380 -2.138
8 1HB LEU 2 1HB LEU 2 -8.712 11.195 -1.825
9 2HB LEU 2 2HB LEU 2 -9.950 10.185 -2.546
10 HG LEU 2 HG LEU 2 -9.643 8.558 -0.682
11 1HD1 LEU 2 1HD1 LEU 2 -7.909 10.736 0.476
12 2HD1 LEU 2 2HD1 LEU 2 -7.360 9.151 -0.065
13 3HD1 LEU 2 3HD1 LEU 2 -8.445 9.284 1.319
14 1HD2 LEU 2 1HD2 LEU 2 -10.815 9.910 0.990
15 2HD2 LEU 2 2HD2 LEU 2 -11.443 10.201 -0.631
16 3HD2 LEU 2 3HD2 LEU 2 -10.364 11.376 0.121
17 H LEU 3 H LEU 3 -6.535 7.367 -3.139
18 HA LEU 3 HA LEU 3 -8.543 5.369 -2.747
19 1HB LEU 3 1HB LEU 3 -9.153 6.160 -4.997
20 2HB LEU 3 2HB LEU 3 -7.525 5.822 -5.555
21 HG LEU 3 HG LEU 3 -7.910 3.408 -5.028
22 1HD1 LEU 3 1HD1 LEU 3 -10.760 4.308 -4.634
23 2HD1 LEU 3 2HD1 LEU 3 -9.686 3.692 -3.377
24 3HD1 LEU 3 3HD1 LEU 3 -10.197 2.638 -4.696
25 1HD2 LEU 3 1HD2 LEU 3 -8.126 4.201 -7.297
26 2HD2 LEU 3 2HD2 LEU 3 -9.783 4.723 -6.991
27 3HD2 LEU 3 3HD2 LEU 3 -9.382 3.006 -6.970
28 H CYS 4 H CYS 4 -7.569 3.590 -2.026
29 HA CYS 4 HA CYS 4 -4.707 3.433 -1.977
30 1HB CYS 4 1HB CYS 4 -6.725 1.350 -1.115
31 2HB CYS 4 2HB CYS 4 -5.028 1.424 -0.652
32 H TYR 5 H TYR 5 -3.464 1.594 -2.742
33 HA TYR 5 HA TYR 5 -4.671 0.191 -5.024
34 1HB TYR 5 1HB TYR 5 -1.965 1.544 -5.026
35 2HB TYR 5 2HB TYR 5 -2.602 0.540 -6.324
36 HD1 TYR 5 1HD TYR 5 -4.762 1.324 -7.469
37 HD2 TYR 5 2HD TYR 5 -2.397 3.836 -4.979
38 HE1 TYR 5 1HE TYR 5 -5.799 3.305 -8.492
39 HE2 TYR 5 2HE TYR 5 -3.429 5.824 -5.993
40 HH TYR 5 HH TYR 5 -6.204 5.667 -7.938
41 H CYS 6 H CYS 6 -3.133 -1.562 -5.831
42 HA CYS 6 HA CYS 6 -2.098 -3.030 -3.499
43 1HB CYS 6 1HB CYS 6 -3.797 -4.314 -4.504
44 2HB CYS 6 2HB CYS 6 -3.275 -3.896 -6.133
45 H ARG 7 H ARG 7 0.029 -3.416 -3.348
46 HA ARG 7 HA ARG 7 1.644 -3.251 -5.802
47 1HB ARG 7 1HB ARG 7 2.350 -2.011 -3.136
48 2HB ARG 7 2HB ARG 7 3.420 -2.090 -4.531
49 1HG ARG 7 1HG ARG 7 1.670 -0.800 -5.803
50 2HG ARG 7 2HG ARG 7 0.856 -0.547 -4.259
51 1HD ARG 7 1HD ARG 7 2.841 0.554 -3.379
52 2HD ARG 7 2HD ARG 7 3.690 0.264 -4.895
53 HE ARG 7 HE ARG 7 1.439 2.116 -4.514
54 1HH1 ARG 7 1HH1 ARG 7 4.107 0.924 -6.412
55 2HH1 ARG 7 2HH1 ARG 7 4.057 2.237 -7.540
56 1HH2 ARG 7 1HH2 ARG 7 1.364 3.843 -5.997
57 2HH2 ARG 7 2HH2 ARG 7 2.500 3.896 -7.303
58 H LYS 8 H LYS 8 3.935 -4.097 -5.368
59 HA LYS 8 HA LYS 8 3.695 -6.569 -3.786
60 1HB LYS 8 1HB LYS 8 3.846 -7.037 -6.155
61 2HB LYS 8 2HB LYS 8 5.268 -6.015 -6.305
62 1HG LYS 8 1HG LYS 8 6.511 -7.561 -4.854
63 2HG LYS 8 2HG LYS 8 5.088 -8.601 -4.773
64 1HD LYS 8 1HD LYS 8 5.175 -8.961 -7.168
65 2HD LYS 8 2HD LYS 8 6.530 -7.840 -7.311
66 1HE LYS 8 1HE LYS 8 7.895 -9.317 -5.915
67 2HE LYS 8 2HE LYS 8 6.541 -10.437 -5.775
68 1HZ LYS 8 1HZ LYS 8 7.907 -9.692 -8.305
69 2HZ LYS 8 2HZ LYS 8 6.619 -10.778 -8.163
70 3HZ LYS 8 3HZ LYS 8 8.115 -11.147 -7.465
71 H GLY 9 H GLY 9 4.768 -6.369 -1.929
72 1HA GLY 9 1HA GLY 9 6.722 -6.357 -0.648
73 2HA GLY 9 2HA GLY 9 7.591 -5.688 -2.019
74 H HIS 10 H HIS 10 8.053 -3.579 -2.026
75 HA HIS 10 HA HIS 10 7.201 -2.006 0.270
76 1HB HIS 10 1HB HIS 10 9.490 -1.997 -1.569
77 2HB HIS 10 2HB HIS 10 8.906 -0.393 -1.137
78 HD1 HIS 10 1HD HIS 10 10.020 -3.588 0.597
79 HD2 HIS 10 2HD HIS 10 9.847 0.515 1.238
80 HE1 HIS 10 1HE HIS 10 11.195 -3.199 2.787
81 HE2 HIS 10 2HE HIS 10 11.023 -0.717 3.186
82 H CYS 11 H CYS 11 6.906 0.397 -0.176
83 HA CYS 11 HA CYS 11 5.401 0.907 -2.637
84 1HB CYS 11 1HB CYS 11 4.378 1.380 0.168
85 2HB CYS 11 2HB CYS 11 3.617 2.027 -1.275
86 H LYS 12 H LYS 12 4.542 3.448 -2.153
87 HA LYS 12 HA LYS 12 7.078 4.875 -1.784
88 1HB LYS 12 1HB LYS 12 6.183 6.636 -3.163
89 2HB LYS 12 2HB LYS 12 5.993 5.100 -3.995
90 1HG LYS 12 1HG LYS 12 3.649 5.026 -3.389
91 2HG LYS 12 2HG LYS 12 3.823 6.518 -2.462
92 1HD LYS 12 1HD LYS 12 2.880 7.155 -4.531
93 2HD LYS 12 2HD LYS 12 4.581 7.609 -4.620
94 1HE LYS 12 1HE LYS 12 3.526 5.011 -5.708
95 2HE LYS 12 2HE LYS 12 3.598 6.485 -6.670
96 1HZ LYS 12 1HZ LYS 12 5.549 5.277 -7.129
97 2HZ LYS 12 2HZ LYS 12 5.858 4.973 -5.497
98 3HZ LYS 12 3HZ LYS 12 6.031 6.539 -6.110
99 H ARG 13 H ARG 13 3.824 4.638 -0.620
100 HA ARG 13 HA ARG 13 4.480 6.172 1.699
101 1HB ARG 13 1HB ARG 13 3.129 7.448 -0.570
102 2HB ARG 13 2HB ARG 13 2.303 7.646 0.960
103 1HG ARG 13 1HG ARG 13 4.164 8.736 1.936
104 2HG ARG 13 2HG ARG 13 5.207 8.294 0.584
105 1HD ARG 13 1HD ARG 13 3.770 9.666 -0.903
106 2HD ARG 13 2HD ARG 13 2.865 10.188 0.518
107 HE ARG 13 HE ARG 13 5.617 10.693 0.890
108 1HH1 ARG 13 1HH1 ARG 13 2.860 11.835 -0.909
109 2HH1 ARG 13 2HH1 ARG 13 3.460 13.453 -1.051
110 1HH2 ARG 13 1HH2 ARG 13 6.416 12.822 0.704
111 2HH2 ARG 13 2HH2 ARG 13 5.481 14.013 -0.137
112 H GLY 14 H GLY 14 3.156 5.702 3.381
113 1HA GLY 14 1HA GLY 14 1.478 4.709 4.585
114 2HA GLY 14 2HA GLY 14 0.449 4.954 3.184
115 H GLU 15 H GLU 15 2.808 2.776 4.643
116 HA GLU 15 HA GLU 15 1.868 0.602 2.909
117 1HB GLU 15 1HB GLU 15 4.327 0.959 4.607
118 2HB GLU 15 2HB GLU 15 3.850 -0.621 4.002
119 1HG GLU 15 1HG GLU 15 4.166 0.012 1.776
120 2HG GLU 15 2HG GLU 15 4.229 1.728 2.181
121 H ARG 16 H ARG 16 0.240 -0.570 3.707
122 HA ARG 16 HA ARG 16 0.385 -1.447 6.492
123 1HB ARG 16 1HB ARG 16 -2.095 -0.230 5.264
124 2HB ARG 16 2HB ARG 16 -2.002 -0.972 6.855
125 1HG ARG 16 1HG ARG 16 -0.270 0.758 7.440
126 2HG ARG 16 2HG ARG 16 -0.681 1.562 5.923
127 1HD ARG 16 1HD ARG 16 -1.923 2.592 7.700
128 2HD ARG 16 2HD ARG 16 -3.039 1.679 6.686
129 HE ARG 16 HE ARG 16 -2.289 -0.018 8.731
130 1HH1 ARG 16 1HH1 ARG 16 -3.887 3.064 8.430
131 2HH1 ARG 16 2HH1 ARG 16 -4.845 2.851 9.856
132 1HH2 ARG 16 1HH2 ARG 16 -3.548 -0.307 10.610
133 2HH2 ARG 16 2HH2 ARG 16 -4.655 0.935 11.094
134 H VAL 17 H VAL 17 -1.337 -3.150 6.941
135 HA VAL 17 HA VAL 17 -1.764 -4.809 4.548
136 HB VAL 17 HB VAL 17 -1.175 -6.004 7.244
137 1HG1 VAL 17 1HG1 VAL 17 -0.581 -7.969 5.918
138 2HG1 VAL 17 2HG1 VAL 17 -0.935 -7.080 4.436
139 3HG1 VAL 17 3HG1 VAL 17 -2.229 -7.443 5.577
140 1HG2 VAL 17 1HG2 VAL 17 1.153 -6.310 6.531
141 2HG2 VAL 17 2HG2 VAL 17 0.736 -4.604 6.689
142 3HG2 VAL 17 3HG2 VAL 17 0.833 -5.344 5.091
143 H ARG 18 H ARG 18 -3.721 -3.115 5.413
144 HA ARG 18 HA ARG 18 -5.525 -4.348 7.254
145 1HB ARG 18 1HB ARG 18 -5.617 -1.945 6.883
146 2HB ARG 18 2HB ARG 18 -5.963 -2.190 5.177
147 1HG ARG 18 1HG ARG 18 -8.084 -3.324 5.848
148 2HG ARG 18 2HG ARG 18 -7.745 -2.842 7.512
149 1HD ARG 18 1HD ARG 18 -7.815 -0.514 6.905
150 2HD ARG 18 2HD ARG 18 -7.968 -0.924 5.196
151 HE ARG 18 HE ARG 18 -10.053 -1.796 7.063
152 1HH1 ARG 18 1HH1 ARG 18 -9.038 0.221 4.406
153 2HH1 ARG 18 2HH1 ARG 18 -10.650 0.661 3.955
154 1HH2 ARG 18 1HH2 ARG 18 -12.180 -1.221 6.474
155 2HH2 ARG 18 2HH2 ARG 18 -12.437 -0.158 5.131
156 H GLY 19 H GLY 19 -5.728 -3.823 3.740
157 1HA GLY 19 1HA GLY 19 -7.405 -6.248 3.560
158 2HA GLY 19 2HA GLY 19 -7.517 -4.881 2.457
159 H THR 20 H THR 20 -5.343 -7.441 3.565
160 HA THR 20 HA THR 20 -3.239 -7.262 1.880
161 HB THR 20 HB THR 20 -3.283 -9.030 3.482
162 HG1 THR 20 1HG THR 20 -2.018 -9.604 1.746
163 1HG2 THR 20 1HG2 THR 20 -5.671 -9.495 3.513
164 2HG2 THR 20 2HG2 THR 20 -4.766 -10.987 3.252
165 3HG2 THR 20 3HG2 THR 20 -5.576 -10.198 1.899
166 H CYS 21 H CYS 21 -2.858 -7.321 -0.212
167 HA CYS 21 HA CYS 21 -5.035 -7.708 -2.064
168 1HB CYS 21 1HB CYS 21 -3.540 -5.873 -2.481
169 2HB CYS 21 2HB CYS 21 -2.138 -6.937 -2.431
170 H GLY 22 H GLY 22 -2.322 -9.515 -0.894
171 1HA GLY 22 1HA GLY 22 -3.228 -11.914 -2.097
172 2HA GLY 22 2HA GLY 22 -1.860 -11.278 -2.995
173 H ILE 23 H ILE 23 -0.877 -13.341 -2.337
174 HA ILE 23 HA ILE 23 -0.306 -13.955 0.355
175 HB ILE 23 HB ILE 23 1.334 -14.726 -2.061
176 1HG1 ILE 23 1HG1 ILE 23 -1.013 -15.310 -2.420
177 2HG1 ILE 23 2HG1 ILE 23 -0.057 -16.760 -2.140
178 1HG2 ILE 23 1HG2 ILE 23 1.020 -16.051 0.630
179 2HG2 ILE 23 2HG2 ILE 23 2.428 -15.144 0.082
180 3HG2 ILE 23 3HG2 ILE 23 1.988 -16.654 -0.717
181 1HD1 ILE 23 1HD1 ILE 23 -1.843 -15.389 -0.141
182 2HD1 ILE 23 2HD1 ILE 23 -0.850 -16.810 0.182
183 3HD1 ILE 23 3HD1 ILE 23 -2.169 -16.904 -0.984
184 H ARG 24 H ARG 24 1.685 -12.396 -2.152
185 HA ARG 24 HA ARG 24 3.501 -11.458 -0.036
186 1HB ARG 24 1HB ARG 24 5.166 -11.153 -1.798
187 2HB ARG 24 2HB ARG 24 4.562 -12.805 -1.789
188 1HG ARG 24 1HG ARG 24 3.046 -12.206 -3.658
189 2HG ARG 24 2HG ARG 24 3.804 -10.613 -3.707
190 1HD ARG 24 1HD ARG 24 4.819 -12.006 -5.383
191 2HD ARG 24 2HD ARG 24 5.989 -11.720 -4.094
192 HE ARG 24 HE ARG 24 4.504 -14.140 -3.731
193 1HH1 ARG 24 1HH1 ARG 24 7.233 -12.706 -5.357
194 2HH1 ARG 24 2HH1 ARG 24 8.083 -14.206 -5.526
195 1HH2 ARG 24 1HH2 ARG 24 5.618 -16.117 -3.949
196 2HH2 ARG 24 2HH2 ARG 24 7.166 -16.144 -4.725
197 H PHE 25 H PHE 25 1.003 -10.442 -2.000
198 HA PHE 25 HA PHE 25 1.950 -7.758 -2.480
199 1HB PHE 25 1HB PHE 25 -0.818 -8.937 -2.804
200 2HB PHE 25 2HB PHE 25 -0.299 -7.362 -3.391
201 HD1 PHE 25 1HD PHE 25 -0.058 -10.981 -3.872
202 HD2 PHE 25 2HD PHE 25 1.088 -7.157 -5.344
203 HE1 PHE 25 1HE PHE 25 0.673 -12.017 -5.980
204 HE2 PHE 25 2HE PHE 25 1.820 -8.185 -7.457
205 HZ PHE 25 HZ PHE 25 1.613 -10.619 -7.776
206 H LEU 26 H LEU 26 1.012 -5.856 -1.588
207 HA LEU 26 HA LEU 26 -0.437 -6.234 0.936
208 1HB LEU 26 1HB LEU 26 0.958 -4.795 2.147
209 2HB LEU 26 2HB LEU 26 2.045 -5.862 1.285
210 HG LEU 26 HG LEU 26 1.367 -3.062 0.383
211 1HD1 LEU 26 1HD1 LEU 26 3.783 -4.065 1.882
212 2HD1 LEU 26 2HD1 LEU 26 2.528 -3.004 2.523
213 3HD1 LEU 26 3HD1 LEU 26 3.578 -2.443 1.222
214 1HD2 LEU 26 1HD2 LEU 26 3.538 -3.440 -0.907
215 2HD2 LEU 26 2HD2 LEU 26 2.093 -4.264 -1.490
216 3HD2 LEU 26 3HD2 LEU 26 3.302 -5.154 -0.563
217 H TYR 27 H TYR 27 -1.055 -3.899 1.792
218 HA TYR 27 HA TYR 27 -2.283 -2.532 -0.508
219 1HB TYR 27 1HB TYR 27 -3.525 -3.739 1.647
220 2HB TYR 27 2HB TYR 27 -3.527 -2.035 2.085
221 HD1 TYR 27 1HD TYR 27 -4.110 -4.059 -1.001
222 HD2 TYR 27 2HD TYR 27 -5.447 -0.900 1.511
223 HE1 TYR 27 1HE TYR 27 -6.030 -3.695 -2.493
224 HE2 TYR 27 2HE TYR 27 -7.373 -0.526 0.029
225 HH TYR 27 HH TYR 27 -7.983 -0.944 -2.339
226 H CYS 28 H CYS 28 -1.724 -0.503 -0.866
227 HA CYS 28 HA CYS 28 -0.681 1.103 1.361
228 1HB CYS 28 1HB CYS 28 0.561 0.857 -1.385
229 2HB CYS 28 2HB CYS 28 1.040 2.042 -0.175
230 H CYS 29 H CYS 29 -1.341 3.186 1.412
231 HA CYS 29 HA CYS 29 -2.973 4.124 -0.856
232 1HB CYS 29 1HB CYS 29 -3.848 3.622 1.716
233 2HB CYS 29 2HB CYS 29 -3.569 5.360 1.728
234 HA PRO 30 HA PRO 30 -0.197 7.576 -1.049
235 1HB PRO 30 1HB PRO 30 -1.771 9.388 -2.305
236 2HB PRO 30 2HB PRO 30 -1.070 7.994 -3.135
237 1HG PRO 30 1HG PRO 30 -3.833 8.355 -2.039
238 2HG PRO 30 2HG PRO 30 -3.327 7.652 -3.587
239 1HD PRO 30 1HD PRO 30 -4.016 6.135 -1.452
240 2HD PRO 30 2HD PRO 30 -2.794 5.622 -2.633
241 H ARG 31 H ARG 31 0.384 9.086 0.377
242 HA ARG 31 HA ARG 31 -1.721 10.496 1.880
243 1HB ARG 31 1HB ARG 31 0.912 9.488 2.972
244 2HB ARG 31 2HB ARG 31 -0.274 10.429 3.867
245 1HG ARG 31 1HG ARG 31 -0.756 7.691 2.710
246 2HG ARG 31 2HG ARG 31 -0.358 8.031 4.394
247 1HD ARG 31 1HD ARG 31 -2.398 9.425 4.550
248 2HD ARG 31 2HD ARG 31 -2.806 8.964 2.897
249 HE ARG 31 HE ARG 31 -2.408 6.649 4.453
250 1HH1 ARG 31 1HH1 ARG 31 -4.672 9.266 4.024
251 2HH1 ARG 31 2HH1 ARG 31 -6.033 8.345 4.571
252 1HH2 ARG 31 1HH2 ARG 31 -4.194 5.435 5.174
253 2HH2 ARG 31 2HH2 ARG 31 -5.761 6.169 5.227
254 H ARG 32 H ARG 32 -1.620 12.402 0.760
255 HA ARG 32 HA ARG 32 0.830 13.956 1.133
256 1HB ARG 32 1HB ARG 32 0.473 14.897 -1.214
257 2HB ARG 32 2HB ARG 32 1.143 13.277 -1.098
258 1HG ARG 32 1HG ARG 32 -1.052 12.324 -1.565
259 2HG ARG 32 2HG ARG 32 -1.738 13.947 -1.665
260 1HD ARG 32 1HD ARG 32 -1.271 13.017 -3.884
261 2HD ARG 32 2HD ARG 32 -0.312 14.461 -3.561
262 HE ARG 32 HE ARG 32 0.992 11.944 -2.972
263 1HH1 ARG 32 1HH1 ARG 32 0.444 14.471 -5.310
264 2HH1 ARG 32 2HH1 ARG 32 1.870 14.110 -6.225
265 1HH2 ARG 32 1HH2 ARG 32 2.870 11.461 -4.171
266 2HH2 ARG 32 2HH2 ARG 32 3.247 12.400 -5.578