NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
8349 |
1m36   |
5464 | 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 16.678 -19.197 0.212
2 2H GLY 1 2H GLY 1 17.961 -19.462 -0.861
3 3H GLY 1 3H GLY 1 16.359 -19.570 -1.411
4 1HA GLY 1 2HA GLY 1 17.916 -17.398 -1.668
5 2HA GLY 1 1HA GLY 1 16.159 -17.378 -1.700
6 H SER 2 H SER 2 15.633 -15.547 -0.636
7 HA SER 2 HA SER 2 17.001 -14.921 1.873
8 1HB SER 2 2HB SER 2 15.069 -12.975 1.511
9 2HB SER 2 1HB SER 2 16.750 -12.854 0.996
10 HG SER 2 HG SER 2 14.477 -13.594 -0.522
11 H ARG 3 H ARG 3 14.272 -16.543 0.760
12 HA ARG 3 HA ARG 3 12.437 -17.453 1.723
13 1HB ARG 3 2HB ARG 3 14.473 -17.667 3.618
14 2HB ARG 3 1HB ARG 3 13.105 -17.030 4.520
15 1HG ARG 3 2HG ARG 3 11.738 -18.905 3.538
16 2HG ARG 3 1HG ARG 3 13.255 -19.588 2.954
17 1HD ARG 3 2HD ARG 3 13.696 -20.450 4.954
18 2HD ARG 3 1HD ARG 3 13.502 -18.873 5.720
19 HE ARG 3 HE ARG 3 11.278 -20.753 5.205
20 1HH1 ARG 3 2HH1 ARG 3 12.869 -18.324 7.181
21 2HH1 ARG 3 1HH1 ARG 3 11.605 -18.294 8.371
22 1HH2 ARG 3 2HH2 ARG 3 9.621 -20.719 6.781
23 2HH2 ARG 3 1HH2 ARG 3 9.767 -19.661 8.160
24 H LEU 4 H LEU 4 12.374 -14.699 1.094
25 HA LEU 4 HA LEU 4 10.721 -13.547 3.234
26 1HB LEU 4 2HB LEU 4 12.136 -11.839 2.739
27 2HB LEU 4 1HB LEU 4 12.458 -12.430 1.122
28 HG LEU 4 HG LEU 4 9.837 -11.559 0.956
29 1HD1 LEU 4 1HD1 LEU 4 10.757 -9.087 1.921
30 2HD1 LEU 4 2HD1 LEU 4 9.433 -10.070 2.547
31 3HD1 LEU 4 3HD1 LEU 4 11.061 -10.266 3.198
32 1HD2 LEU 4 1HD2 LEU 4 12.253 -9.881 0.333
33 2HD2 LEU 4 2HD2 LEU 4 11.784 -11.287 -0.622
34 3HD2 LEU 4 3HD2 LEU 4 10.698 -9.903 -0.499
35 HA PRO 5 HA PRO 5 7.337 -14.849 0.600
36 1HB PRO 5 2HB PRO 5 5.362 -14.173 2.326
37 2HB PRO 5 1HB PRO 5 6.316 -15.651 2.495
38 1HG PRO 5 2HG PRO 5 6.587 -13.042 3.930
39 2HG PRO 5 1HG PRO 5 6.722 -14.691 4.569
40 1HD PRO 5 2HD PRO 5 8.881 -13.144 3.984
41 2HD PRO 5 1HD PRO 5 8.905 -14.915 3.875
42 H LYS 6 H LYS 6 6.697 -13.658 -1.029
43 HA LYS 6 HA LYS 6 6.542 -10.793 -0.868
44 1HB LYS 6 2HB LYS 6 6.544 -12.818 -2.964
45 2HB LYS 6 1HB LYS 6 5.358 -11.556 -3.270
46 1HG LYS 6 2HG LYS 6 8.231 -10.971 -2.612
47 2HG LYS 6 1HG LYS 6 7.640 -11.188 -4.260
48 1HD LYS 6 2HD LYS 6 5.867 -9.383 -3.068
49 2HD LYS 6 1HD LYS 6 7.476 -8.874 -2.546
50 1HE LYS 6 2HE LYS 6 7.176 -9.586 -5.396
51 2HE LYS 6 1HE LYS 6 6.363 -8.115 -4.869
52 1HZ LYS 6 1HZ LYS 6 8.420 -7.327 -5.438
53 2HZ LYS 6 2HZ LYS 6 9.233 -8.727 -4.940
54 3HZ LYS 6 3HZ LYS 6 8.661 -7.622 -3.787
55 H LEU 7 H LEU 7 4.879 -9.825 0.056
56 HA LEU 7 HA LEU 7 2.281 -11.142 0.112
57 1HB LEU 7 2HB LEU 7 3.682 -9.152 1.751
58 2HB LEU 7 1HB LEU 7 1.983 -8.804 1.505
59 HG LEU 7 HG LEU 7 2.028 -10.001 3.502
60 1HD1 LEU 7 1HD1 LEU 7 0.431 -10.906 1.783
61 2HD1 LEU 7 2HD1 LEU 7 1.592 -12.201 1.491
62 3HD1 LEU 7 3HD1 LEU 7 0.855 -12.020 3.083
63 1HD2 LEU 7 1HD2 LEU 7 4.472 -10.902 2.700
64 2HD2 LEU 7 2HD2 LEU 7 3.605 -11.452 4.135
65 3HD2 LEU 7 3HD2 LEU 7 3.501 -12.375 2.635
66 H TYR 8 H TYR 8 0.456 -9.221 0.167
67 HA TYR 8 HA TYR 8 0.432 -8.342 -2.556
68 1HB TYR 8 2HB TYR 8 -1.561 -8.343 -0.292
69 2HB TYR 8 1HB TYR 8 -1.909 -7.703 -1.887
70 HD1 TYR 8 1HD TYR 8 -2.159 -9.182 -3.810
71 HD2 TYR 8 2HD TYR 8 -1.274 -10.722 0.054
72 HE1 TYR 8 1HE TYR 8 -2.696 -11.448 -4.597
73 HE2 TYR 8 2HE TYR 8 -1.810 -12.991 -0.719
74 HH TYR 8 HH TYR 8 -2.096 -13.803 -3.969
75 H LEU 9 H LEU 9 1.771 -6.615 -2.771
76 HA LEU 9 HA LEU 9 1.885 -4.511 -0.851
77 1HB LEU 9 2HB LEU 9 3.782 -5.304 -2.287
78 2HB LEU 9 1HB LEU 9 2.994 -4.548 -3.658
79 HG LEU 9 HG LEU 9 3.213 -2.350 -2.557
80 1HD1 LEU 9 1HD1 LEU 9 3.219 -3.158 -0.229
81 2HD1 LEU 9 2HD1 LEU 9 4.825 -3.836 -0.491
82 3HD1 LEU 9 3HD1 LEU 9 4.580 -2.093 -0.580
83 1HD2 LEU 9 1HD2 LEU 9 5.774 -3.912 -2.841
84 2HD2 LEU 9 2HD2 LEU 9 4.913 -3.063 -4.124
85 3HD2 LEU 9 3HD2 LEU 9 5.652 -2.153 -2.805
86 H CYS 10 H CYS 10 0.819 -2.646 -0.786
87 HA CYS 10 HA CYS 10 -1.214 -2.005 -2.693
88 1HB CYS 10 2HB CYS 10 -1.877 -1.343 -0.558
89 2HB CYS 10 1HB CYS 10 -0.256 -0.849 -0.097
90 H GLU 11 H GLU 11 -1.123 -0.394 -4.110
91 HA GLU 11 HA GLU 11 1.550 0.476 -4.883
92 1HB GLU 11 2HB GLU 11 -1.059 0.412 -6.405
93 2HB GLU 11 1HB GLU 11 0.445 1.046 -7.061
94 1HG GLU 11 2HG GLU 11 1.475 -1.075 -7.018
95 2HG GLU 11 1HG GLU 11 0.188 -1.760 -6.027
96 H PHE 12 H PHE 12 -0.734 1.701 -2.982
97 HA PHE 12 HA PHE 12 -0.494 4.443 -4.033
98 1HB PHE 12 2HB PHE 12 -2.409 3.491 -1.904
99 2HB PHE 12 1HB PHE 12 -2.455 5.011 -2.790
100 HD1 PHE 12 1HD PHE 12 -3.258 1.462 -2.864
101 HD2 PHE 12 2HD PHE 12 -3.204 5.074 -5.118
102 HE1 PHE 12 1HE PHE 12 -4.761 0.442 -4.523
103 HE2 PHE 12 2HE PHE 12 -4.710 4.060 -6.781
104 HZ PHE 12 HZ PHE 12 -5.492 1.745 -6.482
105 H CYS 13 H CYS 13 -0.260 2.561 -1.006
106 HA CYS 13 HA CYS 13 1.525 4.685 -0.011
107 1HB CYS 13 2HB CYS 13 0.819 4.294 2.251
108 2HB CYS 13 1HB CYS 13 -0.619 4.560 1.272
109 H LEU 14 H LEU 14 1.256 1.552 -1.016
110 HA LEU 14 HA LEU 14 2.655 -0.204 -1.129
111 1HB LEU 14 2HB LEU 14 4.694 1.784 -0.140
112 2HB LEU 14 1HB LEU 14 5.061 0.213 -0.825
113 HG LEU 14 HG LEU 14 3.415 2.000 -2.514
114 1HD1 LEU 14 1HD1 LEU 14 5.251 3.357 -3.234
115 2HD1 LEU 14 2HD1 LEU 14 5.083 3.533 -1.488
116 3HD1 LEU 14 3HD1 LEU 14 6.363 2.517 -2.149
117 1HD2 LEU 14 1HD2 LEU 14 4.346 0.822 -4.218
118 2HD2 LEU 14 2HD2 LEU 14 5.900 0.647 -3.403
119 3HD2 LEU 14 3HD2 LEU 14 4.537 -0.367 -2.931
120 H LYS 15 H LYS 15 1.307 -1.024 0.634
121 HA LYS 15 HA LYS 15 3.023 -1.742 2.912
122 1HB LYS 15 2HB LYS 15 0.007 -1.525 3.001
123 2HB LYS 15 1HB LYS 15 1.054 -2.009 4.325
124 1HG LYS 15 2HG LYS 15 0.899 0.713 3.051
125 2HG LYS 15 1HG LYS 15 0.318 0.252 4.652
126 1HD LYS 15 2HD LYS 15 2.410 0.226 5.556
127 2HD LYS 15 1HD LYS 15 3.177 -0.250 4.039
128 1HE LYS 15 2HE LYS 15 3.493 2.175 5.011
129 2HE LYS 15 1HE LYS 15 3.321 1.909 3.276
130 1HZ LYS 15 1HZ LYS 15 1.101 2.642 5.107
131 2HZ LYS 15 2HZ LYS 15 1.000 2.482 3.418
132 3HZ LYS 15 3HZ LYS 15 1.925 3.732 4.100
133 H TYR 16 H TYR 16 2.683 -3.973 3.652
134 HA TYR 16 HA TYR 16 1.925 -5.654 1.392
135 1HB TYR 16 2HB TYR 16 3.600 -6.102 3.842
136 2HB TYR 16 1HB TYR 16 3.034 -7.453 2.859
137 HD1 TYR 16 1HD TYR 16 3.464 -7.142 0.252
138 HD2 TYR 16 2HD TYR 16 5.648 -5.192 3.333
139 HE1 TYR 16 1HE TYR 16 5.326 -6.778 -1.311
140 HE2 TYR 16 2HE TYR 16 7.524 -4.833 1.783
141 HH TYR 16 HH TYR 16 7.933 -4.675 -0.592
142 H MET 17 H MET 17 -0.124 -6.180 1.351
143 HA MET 17 HA MET 17 -1.614 -6.676 3.803
144 1HB MET 17 2HB MET 17 -2.640 -7.023 0.985
145 2HB MET 17 1HB MET 17 -3.566 -6.729 2.446
146 1HG MET 17 2HG MET 17 -1.832 -4.797 0.938
147 2HG MET 17 1HG MET 17 -3.574 -4.721 1.204
148 1HE MET 17 1HE MET 17 -4.352 -5.168 3.674
149 2HE MET 17 2HE MET 17 -3.754 -4.216 5.032
150 3HE MET 17 3HE MET 17 -4.588 -3.421 3.694
151 H LYS 18 H LYS 18 -2.579 -8.674 4.314
152 HA LYS 18 HA LYS 18 -0.916 -10.898 3.587
153 1HB LYS 18 2HB LYS 18 -3.400 -10.947 5.306
154 2HB LYS 18 1HB LYS 18 -2.108 -12.138 5.275
155 1HG LYS 18 2HG LYS 18 -1.447 -9.319 5.967
156 2HG LYS 18 1HG LYS 18 -2.243 -10.334 7.170
157 1HD LYS 18 2HD LYS 18 -0.292 -11.273 7.666
158 2HD LYS 18 1HD LYS 18 -0.134 -11.835 6.001
159 1HE LYS 18 2HE LYS 18 1.118 -9.987 5.361
160 2HE LYS 18 1HE LYS 18 0.548 -9.010 6.714
161 1HZ LYS 18 1HZ LYS 18 1.974 -10.068 8.184
162 2HZ LYS 18 2HZ LYS 18 2.921 -9.928 6.782
163 3HZ LYS 18 3HZ LYS 18 2.199 -11.413 7.176
164 H SER 19 H SER 19 -4.246 -9.946 2.950
165 HA SER 19 HA SER 19 -4.463 -12.250 1.131
166 1HB SER 19 2HB SER 19 -6.998 -11.050 1.964
167 2HB SER 19 1HB SER 19 -6.504 -12.741 1.956
168 HG SER 19 HG SER 19 -5.734 -12.558 3.963
169 H ARG 20 H ARG 20 -5.536 -11.942 -0.848
170 HA ARG 20 HA ARG 20 -5.111 -9.437 -2.119
171 1HB ARG 20 2HB ARG 20 -5.207 -11.832 -3.117
172 2HB ARG 20 1HB ARG 20 -6.947 -11.578 -3.155
173 1HG ARG 20 2HG ARG 20 -6.179 -9.330 -4.358
174 2HG ARG 20 1HG ARG 20 -4.811 -10.363 -4.783
175 1HD ARG 20 2HD ARG 20 -6.029 -11.582 -6.214
176 2HD ARG 20 1HD ARG 20 -7.401 -11.665 -5.109
177 HE ARG 20 HE ARG 20 -6.882 -9.549 -7.081
178 1HH1 ARG 20 2HH1 ARG 20 -9.002 -11.076 -4.746
179 2HH1 ARG 20 1HH1 ARG 20 -10.405 -10.167 -5.234
180 1HH2 ARG 20 2HH2 ARG 20 -8.722 -8.350 -7.726
181 2HH2 ARG 20 1HH2 ARG 20 -10.241 -8.595 -6.913
182 H THR 21 H THR 21 -7.895 -11.078 -0.740
183 HA THR 21 HA THR 21 -9.937 -9.361 -1.588
184 HB THR 21 HB THR 21 -10.732 -10.174 0.921
185 HG1 THR 21 1HG THR 21 -9.834 -12.282 1.165
186 1HG2 THR 21 1HG2 THR 21 -11.893 -10.533 -1.245
187 2HG2 THR 21 2HG2 THR 21 -11.886 -11.976 -0.226
188 3HG2 THR 21 3HG2 THR 21 -10.773 -11.851 -1.590
189 H ILE 22 H ILE 22 -7.949 -9.318 1.353
190 HA ILE 22 HA ILE 22 -9.092 -6.987 2.462
191 HB ILE 22 HB ILE 22 -6.646 -8.601 2.992
192 1HG1 ILE 22 2HG1 ILE 22 -8.539 -7.529 5.043
193 1HG2 ILE 22 1HG2 ILE 22 -5.997 -6.980 4.789
194 2HG2 ILE 22 2HG2 ILE 22 -5.675 -6.439 3.143
195 3HG2 ILE 22 3HG2 ILE 22 -7.065 -5.805 4.022
196 1HD1 ILE 22 1HD1 ILE 22 -7.748 -10.370 4.879
197 2HD1 ILE 22 2HD1 ILE 22 -6.514 -9.199 5.344
198 3HD1 ILE 22 3HD1 ILE 22 -7.998 -9.334 6.285
199 H LEU 23 H LEU 23 -6.413 -7.550 0.254
200 HA LEU 23 HA LEU 23 -5.354 -4.932 0.253
201 1HB LEU 23 2HB LEU 23 -4.023 -6.659 -0.675
202 2HB LEU 23 1HB LEU 23 -5.301 -7.169 -1.759
203 HG LEU 23 HG LEU 23 -5.038 -4.931 -2.928
204 1HD1 LEU 23 1HD1 LEU 23 -3.828 -3.823 -1.078
205 2HD1 LEU 23 2HD1 LEU 23 -2.442 -4.864 -1.401
206 3HD1 LEU 23 3HD1 LEU 23 -2.986 -3.715 -2.624
207 1HD2 LEU 23 1HD2 LEU 23 -2.444 -6.272 -3.235
208 2HD2 LEU 23 2HD2 LEU 23 -3.859 -7.323 -3.352
209 3HD2 LEU 23 3HD2 LEU 23 -3.704 -5.930 -4.426
210 H GLN 24 H GLN 24 -7.915 -6.493 -1.607
211 HA GLN 24 HA GLN 24 -8.451 -4.367 -3.381
212 1HB GLN 24 2HB GLN 24 -10.231 -6.559 -2.304
213 2HB GLN 24 1HB GLN 24 -10.733 -5.428 -3.553
214 1HG GLN 24 2HG GLN 24 -8.577 -7.509 -3.701
215 2HG GLN 24 1HG GLN 24 -10.056 -7.401 -4.651
216 1HE2 GLN 24 1HE2 GLN 24 -10.129 -4.931 -5.587
217 2HE2 GLN 24 2HE2 GLN 24 -8.728 -4.558 -6.541
218 H GLN 25 H GLN 25 -9.734 -5.166 -0.180
219 HA GLN 25 HA GLN 25 -11.572 -3.021 0.006
220 1HB GLN 25 2HB GLN 25 -10.146 -4.713 2.056
221 2HB GLN 25 1HB GLN 25 -11.239 -3.418 2.526
222 1HG GLN 25 2HG GLN 25 -13.052 -4.616 2.048
223 2HG GLN 25 1HG GLN 25 -12.366 -5.241 0.550
224 1HE2 GLN 25 1HE2 GLN 25 -12.991 -7.316 0.837
225 2HE2 GLN 25 2HE2 GLN 25 -12.363 -8.354 2.080
226 H HIS 26 H HIS 26 -8.183 -3.386 0.888
227 HA HIS 26 HA HIS 26 -7.835 -0.866 2.117
228 1HB HIS 26 2HB HIS 26 -6.227 -2.657 2.460
229 2HB HIS 26 1HB HIS 26 -5.846 -2.695 0.743
230 HD1 HIS 26 1HD HIS 26 -4.812 -1.116 3.909
231 HD2 HIS 26 2HD HIS 26 -4.486 -0.304 -0.177
232 HE1 HIS 26 1HE HIS 26 -3.014 0.672 3.658
233 H MET 27 H MET 27 -7.642 -1.963 -1.212
234 HA MET 27 HA MET 27 -6.431 0.348 -2.280
235 1HB MET 27 2HB MET 27 -7.968 -1.943 -3.437
236 2HB MET 27 1HB MET 27 -7.583 -0.555 -4.448
237 1HG MET 27 2HG MET 27 -5.177 -0.887 -3.695
238 2HG MET 27 1HG MET 27 -5.707 -2.458 -3.097
239 1HE MET 27 1HE MET 27 -3.952 -3.957 -5.717
240 2HE MET 27 2HE MET 27 -3.406 -2.315 -6.055
241 3HE MET 27 3HE MET 27 -3.650 -2.838 -4.389
242 H LYS 28 H LYS 28 -9.614 -0.259 -1.218
243 HA LYS 28 HA LYS 28 -10.844 1.866 -2.745
244 1HB LYS 28 2HB LYS 28 -11.705 -0.088 -0.700
245 2HB LYS 28 1HB LYS 28 -12.526 1.467 -0.643
246 1HG LYS 28 2HG LYS 28 -13.909 0.436 -2.093
247 2HG LYS 28 1HG LYS 28 -12.712 0.985 -3.266
248 1HD LYS 28 2HD LYS 28 -11.553 -1.283 -2.752
249 2HD LYS 28 1HD LYS 28 -13.134 -1.749 -2.124
250 1HE LYS 28 2HE LYS 28 -12.746 -0.590 -4.872
251 2HE LYS 28 1HE LYS 28 -12.668 -2.321 -4.548
252 1HZ LYS 28 1HZ LYS 28 -14.996 -0.524 -4.143
253 2HZ LYS 28 2HZ LYS 28 -14.940 -2.125 -3.587
254 3HZ LYS 28 3HZ LYS 28 -14.861 -1.801 -5.253
255 H LYS 29 H LYS 29 -9.601 1.328 0.500
256 HA LYS 29 HA LYS 29 -10.174 3.872 1.566
257 1HB LYS 29 2HB LYS 29 -9.702 2.148 3.111
258 2HB LYS 29 1HB LYS 29 -8.216 1.704 2.284
259 1HG LYS 29 2HG LYS 29 -8.224 4.447 3.296
260 2HG LYS 29 1HG LYS 29 -8.382 3.214 4.548
261 1HD LYS 29 2HD LYS 29 -6.307 2.333 4.138
262 2HD LYS 29 1HD LYS 29 -6.312 2.827 2.442
263 1HE LYS 29 2HE LYS 29 -6.413 5.157 4.081
264 2HE LYS 29 1HE LYS 29 -5.105 4.124 4.656
265 1HZ LYS 29 1HZ LYS 29 -3.875 4.657 2.906
266 2HZ LYS 29 2HZ LYS 29 -5.030 5.838 2.508
267 3HZ LYS 29 3HZ LYS 29 -5.116 4.294 1.813
268 H CYS 30 H CYS 30 -7.318 2.532 0.001
269 HA CYS 30 HA CYS 30 -5.854 4.997 0.193
270 1HB CYS 30 2HB CYS 30 -5.274 2.263 -0.221
271 2HB CYS 30 1HB CYS 30 -4.724 3.113 -1.654
272 H GLY 31 H GLY 31 -8.321 4.007 -1.710
273 1HA GLY 31 1HA GLY 31 -7.370 5.489 -4.069
274 2HA GLY 31 2HA GLY 31 -8.679 4.305 -4.079
275 H TRP 32 H TRP 32 -8.742 6.290 -1.357
276 HA TRP 32 HA TRP 32 -11.090 7.673 -2.353
277 1HB TRP 32 2HB TRP 32 -9.808 7.379 0.352
278 2HB TRP 32 1HB TRP 32 -11.032 8.612 0.072
279 HD1 TRP 32 HD TRP 32 -11.067 5.646 1.782
280 HE1 TRP 32 1HE TRP 32 -13.205 4.238 1.487
281 HE3 TRP 32 3HE TRP 32 -12.890 7.819 -2.475
282 HZ2 TRP 32 2HZ TRP 32 -15.369 4.079 -0.296
283 HZ3 TRP 32 3HZ TRP 32 -15.010 6.985 -3.402
284 HH2 TRP 32 HH TRP 32 -16.222 5.153 -2.335
285 H PHE 33 H PHE 33 -9.378 8.662 -3.915
286 HA PHE 33 HA PHE 33 -8.763 11.313 -2.860
287 1HB PHE 33 2HB PHE 33 -6.542 11.346 -3.802
288 2HB PHE 33 1HB PHE 33 -6.678 9.949 -2.734
289 HD1 PHE 33 1HD PHE 33 -7.017 7.673 -3.766
290 HD2 PHE 33 2HD PHE 33 -5.943 11.099 -6.047
291 HE1 PHE 33 1HE PHE 33 -6.213 6.213 -5.575
292 HE2 PHE 33 2HE PHE 33 -5.146 9.645 -7.862
293 HZ PHE 33 HZ PHE 33 -5.280 7.198 -7.631
Start of MODEL 2
1 1H GLY 1 1H GLY 1 16.085 -9.568 4.063
2 2H GLY 1 2H GLY 1 17.183 -10.844 4.269
3 3H GLY 1 3H GLY 1 15.530 -11.171 4.105
4 1HA GLY 1 2HA GLY 1 17.445 -11.065 2.105
5 2HA GLY 1 1HA GLY 1 15.712 -11.304 1.925
6 H SER 2 H SER 2 14.496 -9.707 1.057
7 HA SER 2 HA SER 2 15.835 -7.498 -0.172
8 1HB SER 2 2HB SER 2 13.033 -7.114 -0.295
9 2HB SER 2 1HB SER 2 14.086 -7.763 -1.553
10 HG SER 2 HG SER 2 13.150 -9.614 -1.246
11 H ARG 3 H ARG 3 13.158 -7.679 2.154
12 HA ARG 3 HA ARG 3 14.260 -5.802 3.945
13 1HB ARG 3 2HB ARG 3 13.318 -4.451 1.836
14 2HB ARG 3 1HB ARG 3 11.807 -4.642 2.712
15 1HG ARG 3 2HG ARG 3 12.629 -2.578 3.406
16 2HG ARG 3 1HG ARG 3 13.050 -3.679 4.721
17 1HD ARG 3 2HD ARG 3 14.886 -2.127 4.085
18 2HD ARG 3 1HD ARG 3 15.312 -3.833 3.958
19 HE ARG 3 HE ARG 3 14.828 -3.544 1.499
20 1HH1 ARG 3 2HH1 ARG 3 15.994 -0.939 3.526
21 2HH1 ARG 3 1HH1 ARG 3 16.676 -0.040 2.200
22 1HH2 ARG 3 2HH2 ARG 3 15.754 -2.410 -0.240
23 2HH2 ARG 3 1HH2 ARG 3 16.538 -0.878 0.050
24 H LEU 4 H LEU 4 10.903 -6.031 2.911
25 HA LEU 4 HA LEU 4 10.284 -7.651 5.295
26 1HB LEU 4 2HB LEU 4 9.283 -5.134 4.644
27 2HB LEU 4 1HB LEU 4 8.032 -6.230 4.093
28 HG LEU 4 HG LEU 4 8.721 -7.110 6.667
29 1HD1 LEU 4 1HD1 LEU 4 8.168 -4.971 7.932
30 2HD1 LEU 4 2HD1 LEU 4 9.803 -5.130 7.293
31 3HD1 LEU 4 3HD1 LEU 4 8.626 -4.117 6.459
32 1HD2 LEU 4 1HD2 LEU 4 6.387 -5.577 5.546
33 2HD2 LEU 4 2HD2 LEU 4 6.524 -7.314 5.819
34 3HD2 LEU 4 3HD2 LEU 4 6.422 -6.211 7.190
35 HA PRO 5 HA PRO 5 8.851 -10.826 2.562
36 1HB PRO 5 2HB PRO 5 6.347 -11.385 3.626
37 2HB PRO 5 1HB PRO 5 7.870 -12.076 4.191
38 1HG PRO 5 2HG PRO 5 6.306 -9.778 5.285
39 2HG PRO 5 1HG PRO 5 7.193 -11.047 6.150
40 1HD PRO 5 2HD PRO 5 8.209 -8.587 5.891
41 2HD PRO 5 1HD PRO 5 9.251 -10.021 5.799
42 H LYS 6 H LYS 6 8.016 -10.703 0.590
43 HA LYS 6 HA LYS 6 6.495 -8.392 -0.133
44 1HB LYS 6 2HB LYS 6 7.932 -10.549 -1.539
45 2HB LYS 6 1HB LYS 6 6.561 -9.870 -2.407
46 1HG LYS 6 2HG LYS 6 7.510 -7.646 -2.216
47 2HG LYS 6 1HG LYS 6 8.862 -8.288 -1.278
48 1HD LYS 6 2HD LYS 6 9.834 -9.280 -3.109
49 2HD LYS 6 1HD LYS 6 8.298 -9.460 -3.958
50 1HE LYS 6 2HE LYS 6 8.239 -7.106 -4.450
51 2HE LYS 6 1HE LYS 6 9.684 -6.829 -3.478
52 1HZ LYS 6 1HZ LYS 6 9.459 -8.200 -6.089
53 2HZ LYS 6 2HZ LYS 6 10.809 -8.431 -5.088
54 3HZ LYS 6 3HZ LYS 6 10.436 -6.879 -5.664
55 H LEU 7 H LEU 7 4.571 -8.701 0.991
56 HA LEU 7 HA LEU 7 2.830 -10.922 0.374
57 1HB LEU 7 2HB LEU 7 2.691 -8.485 2.090
58 2HB LEU 7 1HB LEU 7 1.192 -9.236 1.614
59 HG LEU 7 HG LEU 7 1.996 -9.892 3.863
60 1HD1 LEU 7 1HD1 LEU 7 0.545 -11.311 2.294
61 2HD1 LEU 7 2HD1 LEU 7 1.991 -12.296 2.068
62 3HD1 LEU 7 3HD1 LEU 7 1.294 -12.108 3.677
63 1HD2 LEU 7 1HD2 LEU 7 3.900 -11.862 3.034
64 2HD2 LEU 7 2HD2 LEU 7 4.441 -10.258 2.539
65 3HD2 LEU 7 3HD2 LEU 7 4.066 -10.579 4.232
66 H TYR 8 H TYR 8 0.479 -9.044 0.447
67 HA TYR 8 HA TYR 8 0.403 -8.420 -2.405
68 1HB TYR 8 2HB TYR 8 -1.796 -8.271 -0.320
69 2HB TYR 8 1HB TYR 8 -2.001 -8.067 -2.062
70 HD1 TYR 8 1HD TYR 8 -2.389 -9.923 -3.439
71 HD2 TYR 8 2HD TYR 8 -0.951 -10.530 0.516
72 HE1 TYR 8 1HE TYR 8 -2.716 -12.347 -3.693
73 HE2 TYR 8 2HE TYR 8 -1.269 -12.946 0.275
74 HH TYR 8 HH TYR 8 -2.568 -14.514 -1.046
75 H LEU 9 H LEU 9 1.810 -6.668 -2.398
76 HA LEU 9 HA LEU 9 1.349 -4.403 -0.681
77 1HB LEU 9 2HB LEU 9 3.609 -5.060 -1.273
78 2HB LEU 9 1HB LEU 9 3.249 -4.867 -2.977
79 HG LEU 9 HG LEU 9 2.687 -2.367 -2.045
80 1HD1 LEU 9 1HD1 LEU 9 5.090 -2.201 -0.732
81 2HD1 LEU 9 2HD1 LEU 9 3.499 -2.184 0.032
82 3HD1 LEU 9 3HD1 LEU 9 4.403 -3.694 -0.091
83 1HD2 LEU 9 1HD2 LEU 9 5.272 -3.541 -3.056
84 2HD2 LEU 9 2HD2 LEU 9 3.992 -2.769 -3.996
85 3HD2 LEU 9 3HD2 LEU 9 4.982 -1.806 -2.898
86 H CYS 10 H CYS 10 0.320 -2.514 -1.195
87 HA CYS 10 HA CYS 10 -1.320 -2.424 -3.479
88 1HB CYS 10 2HB CYS 10 -1.150 0.129 -2.322
89 2HB CYS 10 1HB CYS 10 -2.391 -1.086 -2.069
90 H GLU 11 H GLU 11 -1.152 0.353 -3.949
91 HA GLU 11 HA GLU 11 1.418 0.694 -5.316
92 1HB GLU 11 2HB GLU 11 -1.309 0.952 -6.591
93 2HB GLU 11 1HB GLU 11 0.182 1.523 -7.329
94 1HG GLU 11 2HG GLU 11 -0.002 -1.322 -6.471
95 2HG GLU 11 1HG GLU 11 -0.828 -0.814 -7.944
96 H PHE 12 H PHE 12 -0.772 1.917 -3.214
97 HA PHE 12 HA PHE 12 -0.224 4.695 -4.001
98 1HB PHE 12 2HB PHE 12 -2.453 3.903 -2.145
99 2HB PHE 12 1HB PHE 12 -2.285 5.368 -3.107
100 HD1 PHE 12 1HD PHE 12 -2.648 5.271 -5.564
101 HD2 PHE 12 2HD PHE 12 -3.474 1.956 -3.029
102 HE1 PHE 12 1HE PHE 12 -4.027 4.263 -7.334
103 HE2 PHE 12 2HE PHE 12 -4.852 0.938 -4.795
104 HZ PHE 12 HZ PHE 12 -5.129 2.094 -6.952
105 H CYS 13 H CYS 13 -1.003 2.919 -0.979
106 HA CYS 13 HA CYS 13 0.853 4.675 0.444
107 1HB CYS 13 2HB CYS 13 -0.246 4.151 2.383
108 2HB CYS 13 1HB CYS 13 -1.546 3.817 1.249
109 H LEU 14 H LEU 14 0.660 1.682 -1.029
110 HA LEU 14 HA LEU 14 2.027 -0.061 -1.303
111 1HB LEU 14 2HB LEU 14 4.174 1.808 -0.306
112 2HB LEU 14 1HB LEU 14 4.414 0.356 -1.258
113 HG LEU 14 HG LEU 14 2.681 2.479 -2.411
114 1HD1 LEU 14 1HD1 LEU 14 4.228 4.059 -2.534
115 2HD1 LEU 14 2HD1 LEU 14 5.216 3.115 -1.421
116 3HD1 LEU 14 3HD1 LEU 14 5.412 2.914 -3.160
117 1HD2 LEU 14 1HD2 LEU 14 2.852 1.017 -4.079
118 2HD2 LEU 14 2HD2 LEU 14 4.526 1.542 -4.255
119 3HD2 LEU 14 3HD2 LEU 14 4.143 0.135 -3.265
120 H LYS 15 H LYS 15 0.843 -1.027 0.472
121 HA LYS 15 HA LYS 15 2.691 -1.685 2.685
122 1HB LYS 15 2HB LYS 15 0.277 -0.310 2.965
123 2HB LYS 15 1HB LYS 15 -0.102 -1.961 3.430
124 1HG LYS 15 2HG LYS 15 0.551 -0.513 5.324
125 2HG LYS 15 1HG LYS 15 1.578 -1.935 5.135
126 1HD LYS 15 2HD LYS 15 3.052 -0.152 5.575
127 2HD LYS 15 1HD LYS 15 3.165 -0.430 3.838
128 1HE LYS 15 2HE LYS 15 1.263 1.393 3.767
129 2HE LYS 15 1HE LYS 15 1.949 1.844 5.328
130 1HZ LYS 15 1HZ LYS 15 3.101 2.056 2.655
131 2HZ LYS 15 2HZ LYS 15 4.164 1.673 3.919
132 3HZ LYS 15 3HZ LYS 15 3.250 3.098 3.984
133 H TYR 16 H TYR 16 2.732 -3.834 3.322
134 HA TYR 16 HA TYR 16 1.843 -5.687 1.320
135 1HB TYR 16 2HB TYR 16 3.376 -6.003 3.903
136 2HB TYR 16 1HB TYR 16 2.976 -7.359 2.853
137 HD1 TYR 16 1HD TYR 16 3.517 -6.623 0.221
138 HD2 TYR 16 2HD TYR 16 5.569 -5.356 3.720
139 HE1 TYR 16 1HE TYR 16 5.529 -6.179 -1.130
140 HE2 TYR 16 2HE TYR 16 7.589 -4.917 2.388
141 HH TYR 16 HH TYR 16 7.574 -5.184 -1.136
142 H MET 17 H MET 17 -0.214 -6.305 1.294
143 HA MET 17 HA MET 17 -1.690 -6.621 3.795
144 1HB MET 17 2HB MET 17 -2.567 -6.847 0.909
145 2HB MET 17 1HB MET 17 -3.632 -7.090 2.285
146 1HG MET 17 2HG MET 17 -2.140 -4.547 1.689
147 2HG MET 17 1HG MET 17 -3.832 -4.852 1.294
148 1HE MET 17 1HE MET 17 -1.260 -3.756 3.663
149 2HE MET 17 2HE MET 17 -2.397 -2.428 3.431
150 3HE MET 17 3HE MET 17 -2.181 -3.135 5.032
151 H LYS 18 H LYS 18 -2.673 -8.558 4.424
152 HA LYS 18 HA LYS 18 -1.022 -10.830 3.899
153 1HB LYS 18 2HB LYS 18 -2.880 -9.999 5.908
154 2HB LYS 18 1HB LYS 18 -3.310 -11.619 5.376
155 1HG LYS 18 2HG LYS 18 -1.813 -11.758 7.249
156 2HG LYS 18 1HG LYS 18 -0.994 -12.346 5.799
157 1HD LYS 18 2HD LYS 18 -0.132 -9.910 5.601
158 2HD LYS 18 1HD LYS 18 -0.580 -9.789 7.304
159 1HE LYS 18 2HE LYS 18 0.781 -12.018 7.498
160 2HE LYS 18 1HE LYS 18 1.527 -11.452 6.003
161 1HZ LYS 18 1HZ LYS 18 2.467 -10.803 8.360
162 2HZ LYS 18 2HZ LYS 18 1.328 -9.553 8.222
163 3HZ LYS 18 3HZ LYS 18 2.540 -9.729 7.048
164 H SER 19 H SER 19 -4.112 -9.776 2.739
165 HA SER 19 HA SER 19 -4.303 -12.239 1.158
166 1HB SER 19 2HB SER 19 -6.770 -10.949 2.298
167 2HB SER 19 1HB SER 19 -6.576 -12.580 1.650
168 HG SER 19 HG SER 19 -5.321 -13.095 3.468
169 H ARG 20 H ARG 20 -5.422 -12.046 -0.819
170 HA ARG 20 HA ARG 20 -5.071 -9.595 -2.197
171 1HB ARG 20 2HB ARG 20 -5.517 -12.205 -2.930
172 2HB ARG 20 1HB ARG 20 -7.053 -11.447 -3.325
173 1HG ARG 20 2HG ARG 20 -6.109 -10.051 -4.909
174 2HG ARG 20 1HG ARG 20 -4.485 -10.211 -4.232
175 1HD ARG 20 2HD ARG 20 -4.831 -12.739 -4.879
176 2HD ARG 20 1HD ARG 20 -6.004 -12.060 -6.010
177 HE ARG 20 HE ARG 20 -3.114 -11.444 -5.964
178 1HH1 ARG 20 2HH1 ARG 20 -6.189 -11.636 -7.652
179 2HH1 ARG 20 1HH1 ARG 20 -5.512 -11.169 -9.187
180 1HH2 ARG 20 2HH2 ARG 20 -2.230 -10.838 -7.971
181 2HH2 ARG 20 1HH2 ARG 20 -3.254 -10.728 -9.371
182 H THR 21 H THR 21 -7.873 -11.200 -0.780
183 HA THR 21 HA THR 21 -9.874 -9.410 -1.580
184 HB THR 21 HB THR 21 -10.717 -10.310 0.869
185 HG1 THR 21 1HG THR 21 -9.741 -12.218 1.316
186 1HG2 THR 21 1HG2 THR 21 -10.770 -11.626 -1.840
187 2HG2 THR 21 2HG2 THR 21 -12.018 -10.628 -1.095
188 3HG2 THR 21 3HG2 THR 21 -11.681 -12.239 -0.461
189 H ILE 22 H ILE 22 -7.651 -9.378 1.164
190 HA ILE 22 HA ILE 22 -8.788 -7.177 2.535
191 HB ILE 22 HB ILE 22 -6.004 -8.346 2.545
192 1HG1 ILE 22 2HG1 ILE 22 -8.174 -8.342 4.654
193 1HG2 ILE 22 1HG2 ILE 22 -5.232 -6.521 3.532
194 2HG2 ILE 22 2HG2 ILE 22 -6.821 -5.766 3.437
195 3HG2 ILE 22 3HG2 ILE 22 -6.395 -6.752 4.836
196 1HD1 ILE 22 1HD1 ILE 22 -5.511 -8.777 5.037
197 2HD1 ILE 22 2HD1 ILE 22 -6.813 -9.418 6.041
198 3HD1 ILE 22 3HD1 ILE 22 -6.126 -10.405 4.751
199 H LEU 23 H LEU 23 -6.078 -7.467 0.241
200 HA LEU 23 HA LEU 23 -5.454 -4.738 0.099
201 1HB LEU 23 2HB LEU 23 -4.004 -6.531 -0.755
202 2HB LEU 23 1HB LEU 23 -5.150 -6.842 -2.045
203 HG LEU 23 HG LEU 23 -4.745 -4.515 -2.884
204 1HD1 LEU 23 1HD1 LEU 23 -2.204 -4.192 -1.538
205 2HD1 LEU 23 2HD1 LEU 23 -3.517 -3.038 -1.766
206 3HD1 LEU 23 3HD1 LEU 23 -3.556 -4.159 -0.407
207 1HD2 LEU 23 1HD2 LEU 23 -2.918 -5.129 -4.132
208 2HD2 LEU 23 2HD2 LEU 23 -2.101 -5.891 -2.765
209 3HD2 LEU 23 3HD2 LEU 23 -3.464 -6.700 -3.543
210 H GLN 24 H GLN 24 -7.833 -6.670 -1.632
211 HA GLN 24 HA GLN 24 -8.537 -4.831 -3.614
212 1HB GLN 24 2HB GLN 24 -9.477 -7.332 -2.665
213 2HB GLN 24 1HB GLN 24 -10.864 -6.254 -2.743
214 1HG GLN 24 2HG GLN 24 -9.102 -6.179 -5.086
215 2HG GLN 24 1HG GLN 24 -9.929 -7.710 -4.815
216 1HE2 GLN 24 1HE2 GLN 24 -12.132 -7.823 -5.021
217 2HE2 GLN 24 2HE2 GLN 24 -13.076 -6.546 -5.719
218 H GLN 25 H GLN 25 -9.778 -5.241 -0.324
219 HA GLN 25 HA GLN 25 -11.657 -3.078 -0.576
220 1HB GLN 25 2HB GLN 25 -10.693 -4.719 1.768
221 2HB GLN 25 1HB GLN 25 -11.848 -3.405 1.942
222 1HG GLN 25 2HG GLN 25 -13.519 -4.550 0.860
223 2HG GLN 25 1HG GLN 25 -12.389 -5.585 -0.015
224 1HE2 GLN 25 1HE2 GLN 25 -11.253 -7.207 1.223
225 2HE2 GLN 25 2HE2 GLN 25 -12.031 -7.927 2.593
226 H HIS 26 H HIS 26 -8.528 -3.592 0.983
227 HA HIS 26 HA HIS 26 -8.293 -1.148 2.283
228 1HB HIS 26 2HB HIS 26 -6.731 -2.794 2.901
229 2HB HIS 26 1HB HIS 26 -6.277 -3.123 1.236
230 HD1 HIS 26 1HD HIS 26 -5.461 -0.875 4.128
231 HD2 HIS 26 2HD HIS 26 -4.415 -1.356 0.115
232 HE1 HIS 26 1HE HIS 26 -3.403 0.572 3.729
233 H MET 27 H MET 27 -7.516 -2.029 -1.048
234 HA MET 27 HA MET 27 -6.059 0.234 -1.758
235 1HB MET 27 2HB MET 27 -7.595 -1.821 -3.251
236 2HB MET 27 1HB MET 27 -7.179 -0.347 -4.115
237 1HG MET 27 2HG MET 27 -4.805 -0.717 -3.430
238 2HG MET 27 1HG MET 27 -5.300 -2.290 -2.806
239 1HE MET 27 1HE MET 27 -3.036 -2.644 -4.719
240 2HE MET 27 2HE MET 27 -3.310 -2.360 -6.437
241 3HE MET 27 3HE MET 27 -3.301 -1.003 -5.307
242 H LYS 28 H LYS 28 -9.417 -0.033 -1.135
243 HA LYS 28 HA LYS 28 -10.249 2.236 -2.684
244 1HB LYS 28 2HB LYS 28 -11.468 0.408 -0.719
245 2HB LYS 28 1HB LYS 28 -12.115 2.043 -0.709
246 1HG LYS 28 2HG LYS 28 -13.487 0.861 -2.183
247 2HG LYS 28 1HG LYS 28 -12.392 1.774 -3.223
248 1HD LYS 28 2HD LYS 28 -10.970 -0.481 -2.954
249 2HD LYS 28 1HD LYS 28 -12.594 -1.139 -2.772
250 1HE LYS 28 2HE LYS 28 -13.142 0.217 -4.897
251 2HE LYS 28 1HE LYS 28 -11.394 0.303 -5.109
252 1HZ LYS 28 1HZ LYS 28 -11.249 -2.037 -5.251
253 2HZ LYS 28 2HZ LYS 28 -12.516 -1.574 -6.276
254 3HZ LYS 28 3HZ LYS 28 -12.859 -2.252 -4.756
255 H LYS 29 H LYS 29 -9.072 1.666 0.562
256 HA LYS 29 HA LYS 29 -9.418 4.451 1.330
257 1HB LYS 29 2HB LYS 29 -8.004 2.274 2.871
258 2HB LYS 29 1HB LYS 29 -8.618 3.798 3.496
259 1HG LYS 29 2HG LYS 29 -10.540 2.827 3.993
260 2HG LYS 29 1HG LYS 29 -10.781 2.413 2.294
261 1HD LYS 29 2HD LYS 29 -10.719 0.290 3.031
262 2HD LYS 29 1HD LYS 29 -8.972 0.530 3.058
263 1HE LYS 29 2HE LYS 29 -9.342 -0.273 5.178
264 2HE LYS 29 1HE LYS 29 -9.427 1.467 5.450
265 1HZ LYS 29 1HZ LYS 29 -11.307 -0.320 6.205
266 2HZ LYS 29 2HZ LYS 29 -11.952 0.275 4.755
267 3HZ LYS 29 3HZ LYS 29 -11.568 1.345 6.010
268 H CYS 30 H CYS 30 -6.987 2.239 0.250
269 HA CYS 30 HA CYS 30 -4.660 3.696 0.802
270 1HB CYS 30 2HB CYS 30 -4.951 1.278 -0.063
271 2HB CYS 30 1HB CYS 30 -5.048 2.001 -1.663
272 H GLY 31 H GLY 31 -6.760 3.659 -2.071
273 1HA GLY 31 1HA GLY 31 -5.312 5.809 -3.344
274 2HA GLY 31 2HA GLY 31 -6.810 5.074 -3.906
275 H TRP 32 H TRP 32 -7.504 5.739 -0.834
276 HA TRP 32 HA TRP 32 -8.922 8.170 -1.520
277 1HB TRP 32 2HB TRP 32 -9.321 6.042 0.297
278 2HB TRP 32 1HB TRP 32 -9.154 7.516 1.252
279 HD1 TRP 32 HD TRP 32 -11.070 6.490 -1.964
280 HE1 TRP 32 1HE TRP 32 -13.398 7.578 -1.873
281 HE3 TRP 32 3HE TRP 32 -10.618 8.989 2.476
282 HZ2 TRP 32 2HZ TRP 32 -14.823 9.280 -0.165
283 HZ3 TRP 32 3HZ TRP 32 -12.526 10.331 3.265
284 HH2 TRP 32 HH TRP 32 -14.588 10.471 1.968
285 H PHE 33 H PHE 33 -6.298 7.166 0.607
286 HA PHE 33 HA PHE 33 -5.683 10.008 1.061
287 1HB PHE 33 2HB PHE 33 -5.493 7.709 3.019
288 2HB PHE 33 1HB PHE 33 -4.747 9.284 3.293
289 HD1 PHE 33 1HD PHE 33 -7.633 7.323 3.772
290 HD2 PHE 33 2HD PHE 33 -6.350 11.330 3.144
291 HE1 PHE 33 1HE PHE 33 -9.743 8.143 4.733
292 HE2 PHE 33 2HE PHE 33 -8.456 12.159 4.105
293 HZ PHE 33 HZ PHE 33 -10.155 10.565 4.904
Start of MODEL 3
1 1H GLY 1 1H GLY 1 9.390 -15.645 8.407
2 2H GLY 1 2H GLY 1 9.896 -17.128 9.046
3 3H GLY 1 3H GLY 1 8.257 -16.692 9.112
4 1HA GLY 1 2HA GLY 1 8.108 -18.009 7.307
5 2HA GLY 1 1HA GLY 1 8.614 -16.527 6.501
6 H SER 2 H SER 2 9.058 -19.456 5.926
7 HA SER 2 HA SER 2 11.809 -20.012 6.365
8 1HB SER 2 2HB SER 2 10.319 -21.235 4.078
9 2HB SER 2 1HB SER 2 11.421 -21.990 5.228
10 HG SER 2 HG SER 2 9.753 -21.670 6.831
11 H ARG 3 H ARG 3 10.003 -18.507 3.740
12 HA ARG 3 HA ARG 3 12.570 -17.605 2.622
13 1HB ARG 3 2HB ARG 3 10.201 -18.688 1.090
14 2HB ARG 3 1HB ARG 3 11.458 -17.721 0.333
15 1HG ARG 3 2HG ARG 3 12.019 -20.278 1.810
16 2HG ARG 3 1HG ARG 3 11.686 -20.205 0.080
17 1HD ARG 3 2HD ARG 3 13.961 -20.098 0.029
18 2HD ARG 3 1HD ARG 3 13.592 -18.377 0.148
19 HE ARG 3 HE ARG 3 13.817 -19.184 2.744
20 1HH1 ARG 3 2HH1 ARG 3 15.897 -19.419 -0.065
21 2HH1 ARG 3 1HH1 ARG 3 17.365 -19.373 0.861
22 1HH2 ARG 3 2HH2 ARG 3 15.743 -19.098 3.965
23 2HH2 ARG 3 1HH2 ARG 3 17.278 -19.178 3.148
24 H LEU 4 H LEU 4 11.850 -15.822 0.813
25 HA LEU 4 HA LEU 4 10.641 -13.721 2.337
26 1HB LEU 4 2HB LEU 4 12.394 -13.114 0.838
27 2HB LEU 4 1HB LEU 4 11.610 -13.914 -0.511
28 HG LEU 4 HG LEU 4 9.771 -11.989 0.354
29 1HD1 LEU 4 1HD1 LEU 4 10.825 -10.056 0.849
30 2HD1 LEU 4 2HD1 LEU 4 12.060 -11.152 1.466
31 3HD1 LEU 4 3HD1 LEU 4 12.235 -10.441 -0.138
32 1HD2 LEU 4 1HD2 LEU 4 11.725 -11.850 -1.941
33 2HD2 LEU 4 2HD2 LEU 4 10.200 -12.736 -1.950
34 3HD2 LEU 4 3HD2 LEU 4 10.197 -10.978 -1.806
35 HA PRO 5 HA PRO 5 6.536 -14.845 1.056
36 1HB PRO 5 2HB PRO 5 5.207 -12.937 2.433
37 2HB PRO 5 1HB PRO 5 5.924 -14.347 3.219
38 1HG PRO 5 2HG PRO 5 6.960 -11.549 3.035
39 2HG PRO 5 1HG PRO 5 6.984 -12.665 4.413
40 1HD PRO 5 2HD PRO 5 9.136 -12.205 2.789
41 2HD PRO 5 1HD PRO 5 8.876 -13.719 3.675
42 H LYS 6 H LYS 6 5.289 -14.299 -0.614
43 HA LYS 6 HA LYS 6 5.746 -11.683 -1.881
44 1HB LYS 6 2HB LYS 6 4.340 -14.049 -3.124
45 2HB LYS 6 1HB LYS 6 5.002 -12.638 -3.937
46 1HG LYS 6 2HG LYS 6 6.757 -13.932 -4.384
47 2HG LYS 6 1HG LYS 6 7.203 -13.693 -2.694
48 1HD LYS 6 2HD LYS 6 6.652 -15.797 -2.119
49 2HD LYS 6 1HD LYS 6 5.238 -15.821 -3.171
50 1HE LYS 6 2HE LYS 6 6.492 -16.442 -5.039
51 2HE LYS 6 1HE LYS 6 8.008 -15.931 -4.299
52 1HZ LYS 6 1HZ LYS 6 7.527 -17.780 -2.614
53 2HZ LYS 6 2HZ LYS 6 8.064 -18.235 -4.161
54 3HZ LYS 6 3HZ LYS 6 6.420 -18.362 -3.760
55 H LEU 7 H LEU 7 4.364 -10.421 -0.676
56 HA LEU 7 HA LEU 7 1.632 -11.306 -0.253
57 1HB LEU 7 2HB LEU 7 3.265 -9.004 0.730
58 2HB LEU 7 1HB LEU 7 1.525 -8.945 0.853
59 HG LEU 7 HG LEU 7 2.022 -9.766 2.918
60 1HD1 LEU 7 1HD1 LEU 7 1.247 -11.791 1.049
61 2HD1 LEU 7 2HD1 LEU 7 2.255 -12.504 2.308
62 3HD1 LEU 7 3HD1 LEU 7 0.801 -11.609 2.748
63 1HD2 LEU 7 1HD2 LEU 7 4.265 -9.899 3.141
64 2HD2 LEU 7 2HD2 LEU 7 3.937 -11.628 3.011
65 3HD2 LEU 7 3HD2 LEU 7 4.484 -10.725 1.598
66 H TYR 8 H TYR 8 0.287 -8.939 -0.232
67 HA TYR 8 HA TYR 8 0.242 -8.187 -3.081
68 1HB TYR 8 2HB TYR 8 -2.102 -7.968 -1.186
69 2HB TYR 8 1HB TYR 8 -2.119 -7.959 -2.951
70 HD1 TYR 8 1HD TYR 8 -2.402 -9.965 -4.157
71 HD2 TYR 8 2HD TYR 8 -1.474 -10.134 -0.007
72 HE1 TYR 8 1HE TYR 8 -2.777 -12.395 -4.171
73 HE2 TYR 8 2HE TYR 8 -1.837 -12.556 -0.012
74 HH TYR 8 HH TYR 8 -2.109 -14.382 -1.322
75 H LEU 9 H LEU 9 1.740 -6.551 -2.755
76 HA LEU 9 HA LEU 9 1.491 -4.666 -0.660
77 1HB LEU 9 2HB LEU 9 3.646 -5.207 -1.565
78 2HB LEU 9 1HB LEU 9 3.154 -4.699 -3.168
79 HG LEU 9 HG LEU 9 2.849 -2.357 -2.092
80 1HD1 LEU 9 1HD1 LEU 9 3.051 -2.902 0.213
81 2HD1 LEU 9 2HD1 LEU 9 4.565 -3.763 -0.063
82 3HD1 LEU 9 3HD1 LEU 9 4.505 -2.009 -0.241
83 1HD2 LEU 9 1HD2 LEU 9 5.607 -2.425 -2.078
84 2HD2 LEU 9 2HD2 LEU 9 5.157 -3.761 -3.136
85 3HD2 LEU 9 3HD2 LEU 9 4.576 -2.132 -3.480
86 H CYS 10 H CYS 10 0.433 -2.804 -0.561
87 HA CYS 10 HA CYS 10 -1.078 -1.813 -2.804
88 1HB CYS 10 2HB CYS 10 -2.195 -1.401 -0.782
89 2HB CYS 10 1HB CYS 10 -0.714 -0.961 0.060
90 H GLU 11 H GLU 11 0.035 -0.831 -4.342
91 HA GLU 11 HA GLU 11 2.543 0.437 -3.786
92 1HB GLU 11 2HB GLU 11 1.047 -0.392 -6.172
93 2HB GLU 11 1HB GLU 11 1.988 1.081 -6.387
94 1HG GLU 11 2HG GLU 11 3.976 0.015 -6.113
95 2HG GLU 11 1HG GLU 11 3.294 -1.241 -5.084
96 H PHE 12 H PHE 12 -0.154 1.535 -2.797
97 HA PHE 12 HA PHE 12 0.072 4.225 -3.964
98 1HB PHE 12 2HB PHE 12 -2.167 3.247 -2.196
99 2HB PHE 12 1HB PHE 12 -2.160 4.643 -3.272
100 HD1 PHE 12 1HD PHE 12 -1.452 3.873 -5.814
101 HD2 PHE 12 2HD PHE 12 -3.479 1.518 -2.904
102 HE1 PHE 12 1HE PHE 12 -2.411 2.490 -7.609
103 HE2 PHE 12 2HE PHE 12 -4.432 0.124 -4.690
104 HZ PHE 12 HZ PHE 12 -3.900 0.611 -7.046
105 H CYS 13 H CYS 13 -0.165 2.542 -0.824
106 HA CYS 13 HA CYS 13 1.202 4.876 0.348
107 1HB CYS 13 2HB CYS 13 0.291 4.328 2.521
108 2HB CYS 13 1HB CYS 13 -1.026 4.489 1.369
109 H LEU 14 H LEU 14 1.504 1.759 -0.663
110 HA LEU 14 HA LEU 14 3.200 0.288 -0.687
111 1HB LEU 14 2HB LEU 14 4.627 2.553 0.680
112 2HB LEU 14 1HB LEU 14 5.421 1.031 0.318
113 HG LEU 14 HG LEU 14 4.018 2.425 -1.905
114 1HD1 LEU 14 1HD1 LEU 14 5.113 4.320 -1.210
115 2HD1 LEU 14 2HD1 LEU 14 6.468 3.420 -0.530
116 3HD1 LEU 14 3HD1 LEU 14 6.311 3.588 -2.278
117 1HD2 LEU 14 1HD2 LEU 14 6.391 1.586 -2.853
118 2HD2 LEU 14 2HD2 LEU 14 6.174 0.454 -1.519
119 3HD2 LEU 14 3HD2 LEU 14 4.951 0.569 -2.783
120 H LYS 15 H LYS 15 1.580 -0.758 0.755
121 HA LYS 15 HA LYS 15 3.027 -1.704 3.111
122 1HB LYS 15 2HB LYS 15 0.841 -0.068 3.398
123 2HB LYS 15 1HB LYS 15 0.116 -1.667 3.480
124 1HG LYS 15 2HG LYS 15 2.543 -1.285 5.100
125 2HG LYS 15 1HG LYS 15 1.125 -0.364 5.607
126 1HD LYS 15 2HD LYS 15 -0.161 -2.320 5.916
127 2HD LYS 15 1HD LYS 15 0.994 -3.312 5.023
128 1HE LYS 15 2HE LYS 15 1.509 -3.886 7.185
129 2HE LYS 15 1HE LYS 15 2.642 -2.561 6.912
130 1HZ LYS 15 1HZ LYS 15 0.113 -1.639 7.893
131 2HZ LYS 15 2HZ LYS 15 1.678 -1.357 8.493
132 3HZ LYS 15 3HZ LYS 15 0.836 -2.751 8.954
133 H TYR 16 H TYR 16 3.229 -3.841 3.038
134 HA TYR 16 HA TYR 16 2.026 -5.371 0.965
135 1HB TYR 16 2HB TYR 16 3.871 -5.940 3.251
136 2HB TYR 16 1HB TYR 16 3.095 -7.294 2.438
137 HD1 TYR 16 1HD TYR 16 3.370 -7.402 -0.144
138 HD2 TYR 16 2HD TYR 16 5.843 -5.051 2.397
139 HE1 TYR 16 1HE TYR 16 5.094 -7.337 -1.891
140 HE2 TYR 16 2HE TYR 16 7.576 -4.981 0.650
141 HH TYR 16 HH TYR 16 7.538 -5.220 -2.010
142 H MET 17 H MET 17 0.002 -6.152 0.977
143 HA MET 17 HA MET 17 -1.361 -6.615 3.519
144 1HB MET 17 2HB MET 17 -2.322 -6.669 0.656
145 2HB MET 17 1HB MET 17 -3.346 -7.045 2.034
146 1HG MET 17 2HG MET 17 -1.972 -4.430 1.481
147 2HG MET 17 1HG MET 17 -3.691 -4.771 1.313
148 1HE MET 17 1HE MET 17 -1.757 -2.837 4.639
149 2HE MET 17 2HE MET 17 -1.367 -2.997 2.927
150 3HE MET 17 3HE MET 17 -2.843 -2.170 3.421
151 H LYS 18 H LYS 18 -2.058 -8.615 4.215
152 HA LYS 18 HA LYS 18 -0.537 -10.829 3.139
153 1HB LYS 18 2HB LYS 18 -2.433 -11.062 5.451
154 2HB LYS 18 1HB LYS 18 -0.931 -11.927 5.159
155 1HG LYS 18 2HG LYS 18 -0.994 -8.979 5.715
156 2HG LYS 18 1HG LYS 18 -0.929 -10.185 7.003
157 1HD LYS 18 2HD LYS 18 1.079 -11.118 5.592
158 2HD LYS 18 1HD LYS 18 1.121 -9.471 4.958
159 1HE LYS 18 2HE LYS 18 2.282 -8.879 6.758
160 2HE LYS 18 1HE LYS 18 0.843 -9.201 7.726
161 1HZ LYS 18 1HZ LYS 18 1.588 -11.521 7.935
162 2HZ LYS 18 2HZ LYS 18 2.701 -10.423 8.597
163 3HZ LYS 18 3HZ LYS 18 3.007 -11.137 7.090
164 H SER 19 H SER 19 -3.462 -9.610 2.326
165 HA SER 19 HA SER 19 -4.282 -12.140 1.187
166 1HB SER 19 2HB SER 19 -5.987 -10.654 3.190
167 2HB SER 19 1HB SER 19 -6.654 -11.822 2.049
168 HG SER 19 HG SER 19 -4.441 -12.629 3.541
169 H ARG 20 H ARG 20 -5.526 -11.940 -0.646
170 HA ARG 20 HA ARG 20 -5.341 -9.503 -2.056
171 1HB ARG 20 2HB ARG 20 -5.563 -11.987 -2.882
172 2HB ARG 20 1HB ARG 20 -7.287 -11.631 -2.851
173 1HG ARG 20 2HG ARG 20 -7.107 -9.995 -4.489
174 2HG ARG 20 1HG ARG 20 -5.365 -9.832 -4.262
175 1HD ARG 20 2HD ARG 20 -5.812 -12.513 -4.959
176 2HD ARG 20 1HD ARG 20 -6.812 -11.550 -6.047
177 HE ARG 20 HE ARG 20 -4.678 -10.248 -6.478
178 1HH1 ARG 20 2HH1 ARG 20 -4.755 -13.671 -5.726
179 2HH1 ARG 20 1HH1 ARG 20 -3.191 -13.992 -6.419
180 1HH2 ARG 20 2HH2 ARG 20 -2.638 -10.662 -7.412
181 2HH2 ARG 20 1HH2 ARG 20 -1.982 -12.277 -7.381
182 H THR 21 H THR 21 -8.032 -11.091 -0.383
183 HA THR 21 HA THR 21 -9.987 -9.196 -1.196
184 HB THR 21 HB THR 21 -10.079 -11.635 0.045
185 HG1 THR 21 1HG THR 21 -11.710 -10.227 -1.186
186 1HG2 THR 21 1HG2 THR 21 -9.633 -10.899 2.253
187 2HG2 THR 21 2HG2 THR 21 -11.372 -11.191 2.168
188 3HG2 THR 21 3HG2 THR 21 -10.750 -9.543 2.101
189 H ILE 22 H ILE 22 -7.599 -9.238 1.311
190 HA ILE 22 HA ILE 22 -8.735 -7.068 2.825
191 HB ILE 22 HB ILE 22 -6.197 -8.633 2.929
192 1HG1 ILE 22 2HG1 ILE 22 -7.835 -7.695 5.255
193 1HG2 ILE 22 1HG2 ILE 22 -4.972 -6.796 3.325
194 2HG2 ILE 22 2HG2 ILE 22 -6.393 -5.792 3.615
195 3HG2 ILE 22 3HG2 ILE 22 -5.759 -6.815 4.904
196 1HD1 ILE 22 1HD1 ILE 22 -6.398 -10.267 4.663
197 2HD1 ILE 22 2HD1 ILE 22 -5.910 -9.016 5.808
198 3HD1 ILE 22 3HD1 ILE 22 -7.374 -9.955 6.098
199 H LEU 23 H LEU 23 -6.315 -7.505 0.297
200 HA LEU 23 HA LEU 23 -5.462 -4.803 0.169
201 1HB LEU 23 2HB LEU 23 -4.526 -7.060 -0.889
202 2HB LEU 23 1HB LEU 23 -5.474 -6.529 -2.260
203 HG LEU 23 HG LEU 23 -2.854 -5.706 -1.440
204 1HD1 LEU 23 1HD1 LEU 23 -3.463 -6.343 -3.683
205 2HD1 LEU 23 2HD1 LEU 23 -4.592 -4.992 -3.794
206 3HD1 LEU 23 3HD1 LEU 23 -2.859 -4.687 -3.672
207 1HD2 LEU 23 1HD2 LEU 23 -3.928 -3.860 -0.268
208 2HD2 LEU 23 2HD2 LEU 23 -3.082 -3.283 -1.705
209 3HD2 LEU 23 3HD2 LEU 23 -4.838 -3.449 -1.723
210 H GLN 24 H GLN 24 -8.026 -6.646 -1.387
211 HA GLN 24 HA GLN 24 -8.839 -4.725 -3.252
212 1HB GLN 24 2HB GLN 24 -9.906 -7.200 -2.125
213 2HB GLN 24 1HB GLN 24 -11.160 -6.052 -2.580
214 1HG GLN 24 2HG GLN 24 -8.978 -7.111 -4.362
215 2HG GLN 24 1HG GLN 24 -10.681 -7.569 -4.399
216 1HE2 GLN 24 1HE2 GLN 24 -8.355 -5.561 -5.680
217 2HE2 GLN 24 2HE2 GLN 24 -9.397 -4.418 -6.470
218 H GLN 25 H GLN 25 -9.877 -5.248 0.105
219 HA GLN 25 HA GLN 25 -11.784 -3.104 0.016
220 1HB GLN 25 2HB GLN 25 -12.225 -3.572 2.285
221 2HB GLN 25 1HB GLN 25 -11.861 -5.133 1.568
222 1HG GLN 25 2HG GLN 25 -9.474 -4.743 2.404
223 2HG GLN 25 1HG GLN 25 -10.180 -3.472 3.397
224 1HE2 GLN 25 1HE2 GLN 25 -11.002 -6.820 2.521
225 2HE2 GLN 25 2HE2 GLN 25 -11.309 -7.339 4.145
226 H HIS 26 H HIS 26 -8.419 -3.433 0.704
227 HA HIS 26 HA HIS 26 -8.068 -0.945 2.067
228 1HB HIS 26 2HB HIS 26 -6.456 -2.762 2.343
229 2HB HIS 26 1HB HIS 26 -6.098 -2.737 0.621
230 HD1 HIS 26 1HD HIS 26 -5.084 -1.222 3.825
231 HD2 HIS 26 2HD HIS 26 -4.704 -0.378 -0.245
232 HE1 HIS 26 1HE HIS 26 -3.336 0.613 3.618
233 H MET 27 H MET 27 -7.778 -2.048 -1.278
234 HA MET 27 HA MET 27 -6.605 0.262 -2.345
235 1HB MET 27 2HB MET 27 -8.235 -1.963 -3.520
236 2HB MET 27 1HB MET 27 -7.709 -0.612 -4.517
237 1HG MET 27 2HG MET 27 -5.385 -1.095 -3.959
238 2HG MET 27 1HG MET 27 -5.908 -2.436 -2.943
239 1HE MET 27 1HE MET 27 -5.905 -2.288 -7.531
240 2HE MET 27 2HE MET 27 -6.507 -0.979 -6.511
241 3HE MET 27 3HE MET 27 -4.796 -1.399 -6.486
242 H LYS 28 H LYS 28 -9.817 -0.328 -1.328
243 HA LYS 28 HA LYS 28 -11.102 1.685 -2.899
244 1HB LYS 28 2HB LYS 28 -11.834 -0.136 -0.716
245 2HB LYS 28 1HB LYS 28 -12.634 1.427 -0.624
246 1HG LYS 28 2HG LYS 28 -14.054 -0.039 -1.832
247 2HG LYS 28 1HG LYS 28 -13.371 1.103 -2.990
248 1HD LYS 28 2HD LYS 28 -11.565 -1.014 -2.935
249 2HD LYS 28 1HD LYS 28 -13.156 -1.781 -2.890
250 1HE LYS 28 2HE LYS 28 -12.948 0.428 -4.798
251 2HE LYS 28 1HE LYS 28 -11.865 -0.920 -5.145
252 1HZ LYS 28 1HZ LYS 28 -14.460 -1.857 -4.471
253 2HZ LYS 28 2HZ LYS 28 -13.558 -2.117 -5.884
254 3HZ LYS 28 3HZ LYS 28 -14.546 -0.745 -5.751
255 H LYS 29 H LYS 29 -9.682 1.518 0.324
256 HA LYS 29 HA LYS 29 -10.272 4.217 1.042
257 1HB LYS 29 2HB LYS 29 -9.913 2.775 2.866
258 2HB LYS 29 1HB LYS 29 -8.467 2.085 2.147
259 1HG LYS 29 2HG LYS 29 -8.260 4.946 2.674
260 2HG LYS 29 1HG LYS 29 -8.520 3.968 4.119
261 1HD LYS 29 2HD LYS 29 -6.524 2.852 3.891
262 2HD LYS 29 1HD LYS 29 -6.485 3.065 2.139
263 1HE LYS 29 2HE LYS 29 -6.306 5.507 3.806
264 2HE LYS 29 1HE LYS 29 -4.904 4.437 3.800
265 1HZ LYS 29 1HZ LYS 29 -4.603 6.022 2.084
266 2HZ LYS 29 2HZ LYS 29 -6.161 5.774 1.468
267 3HZ LYS 29 3HZ LYS 29 -4.987 4.558 1.319
268 H CYS 30 H CYS 30 -7.509 2.538 -0.318
269 HA CYS 30 HA CYS 30 -5.953 4.964 -0.444
270 1HB CYS 30 2HB CYS 30 -5.487 2.139 -0.403
271 2HB CYS 30 1HB CYS 30 -4.695 2.838 -1.802
272 H GLY 31 H GLY 31 -8.417 4.688 -2.083
273 1HA GLY 31 1HA GLY 31 -7.440 5.835 -4.474
274 2HA GLY 31 2HA GLY 31 -7.872 4.154 -4.765
275 H TRP 32 H TRP 32 -9.288 6.822 -2.887
276 HA TRP 32 HA TRP 32 -11.948 6.018 -3.478
277 1HB TRP 32 2HB TRP 32 -10.694 8.400 -2.164
278 2HB TRP 32 1HB TRP 32 -12.398 8.452 -2.599
279 HD1 TRP 32 HD TRP 32 -10.467 7.864 0.313
280 HE1 TRP 32 1HE TRP 32 -11.634 6.285 1.987
281 HE3 TRP 32 3HE TRP 32 -13.985 5.850 -2.800
282 HZ2 TRP 32 2HZ TRP 32 -13.755 4.423 1.970
283 HZ3 TRP 32 3HZ TRP 32 -15.543 4.178 -1.895
284 HH2 TRP 32 HH TRP 32 -15.431 3.480 0.441
285 H PHE 33 H PHE 33 -9.682 8.246 -4.913
286 HA PHE 33 HA PHE 33 -11.605 8.685 -7.085
287 1HB PHE 33 2HB PHE 33 -11.095 10.715 -5.480
288 2HB PHE 33 1HB PHE 33 -9.608 10.815 -6.425
289 HD1 PHE 33 1HD PHE 33 -9.593 11.769 -8.567
290 HD2 PHE 33 2HD PHE 33 -13.297 10.876 -6.667
291 HE1 PHE 33 1HE PHE 33 -10.791 13.006 -10.324
292 HE2 PHE 33 2HE PHE 33 -14.499 12.113 -8.420
293 HZ PHE 33 HZ PHE 33 -13.246 13.180 -10.251
Start of MODEL 4
1 1H GLY 1 1H GLY 1 11.421 -15.214 -6.731
2 2H GLY 1 2H GLY 1 12.962 -14.843 -6.131
3 3H GLY 1 3H GLY 1 12.166 -13.747 -7.149
4 1HA GLY 1 2HA GLY 1 10.868 -12.926 -5.529
5 2HA GLY 1 1HA GLY 1 10.743 -14.491 -4.736
6 H SER 2 H SER 2 11.160 -12.119 -3.343
7 HA SER 2 HA SER 2 14.003 -12.081 -2.661
8 1HB SER 2 2HB SER 2 12.336 -10.304 -1.090
9 2HB SER 2 1HB SER 2 13.645 -9.906 -2.206
10 HG SER 2 HG SER 2 12.020 -10.265 -3.913
11 H ARG 3 H ARG 3 14.002 -11.431 -0.010
12 HA ARG 3 HA ARG 3 13.559 -13.925 1.285
13 1HB ARG 3 2HB ARG 3 15.096 -11.768 1.848
14 2HB ARG 3 1HB ARG 3 13.756 -11.478 2.948
15 1HG ARG 3 2HG ARG 3 14.734 -14.223 3.001
16 2HG ARG 3 1HG ARG 3 15.944 -13.026 3.467
17 1HD ARG 3 2HD ARG 3 15.011 -13.168 5.502
18 2HD ARG 3 1HD ARG 3 13.744 -12.149 4.818
19 HE ARG 3 HE ARG 3 13.089 -14.791 4.224
20 1HH1 ARG 3 2HH1 ARG 3 13.464 -12.772 7.076
21 2HH1 ARG 3 1HH1 ARG 3 12.307 -13.667 8.011
22 1HH2 ARG 3 2HH2 ARG 3 11.536 -15.937 5.457
23 2HH2 ARG 3 1HH2 ARG 3 11.216 -15.462 7.100
24 H LEU 4 H LEU 4 11.780 -10.937 1.037
25 HA LEU 4 HA LEU 4 9.660 -11.848 2.801
26 1HB LEU 4 2HB LEU 4 10.558 -9.365 2.182
27 2HB LEU 4 1HB LEU 4 9.239 -9.507 1.037
28 HG LEU 4 HG LEU 4 8.329 -10.344 3.626
29 1HD1 LEU 4 1HD1 LEU 4 10.283 -8.284 3.740
30 2HD1 LEU 4 2HD1 LEU 4 8.704 -7.575 4.077
31 3HD1 LEU 4 3HD1 LEU 4 9.284 -8.934 5.040
32 1HD2 LEU 4 1HD2 LEU 4 7.672 -8.125 1.705
33 2HD2 LEU 4 2HD2 LEU 4 6.790 -9.623 1.991
34 3HD2 LEU 4 3HD2 LEU 4 6.802 -8.358 3.219
35 HA PRO 5 HA PRO 5 7.538 -13.973 -0.464
36 1HB PRO 5 2HB PRO 5 5.079 -13.491 1.096
37 2HB PRO 5 1HB PRO 5 5.836 -15.020 0.642
38 1HG PRO 5 2HG PRO 5 5.883 -14.126 3.170
39 2HG PRO 5 1HG PRO 5 7.250 -15.016 2.470
40 1HD PRO 5 2HD PRO 5 6.930 -12.068 2.912
41 2HD PRO 5 1HD PRO 5 8.357 -13.096 3.163
42 H LYS 6 H LYS 6 6.037 -13.567 -2.139
43 HA LYS 6 HA LYS 6 5.662 -10.764 -2.686
44 1HB LYS 6 2HB LYS 6 5.864 -13.136 -4.232
45 2HB LYS 6 1HB LYS 6 4.300 -12.413 -4.584
46 1HG LYS 6 2HG LYS 6 6.854 -10.840 -4.657
47 2HG LYS 6 1HG LYS 6 6.237 -11.720 -6.056
48 1HD LYS 6 2HD LYS 6 4.857 -10.042 -6.527
49 2HD LYS 6 1HD LYS 6 4.119 -10.174 -4.930
50 1HE LYS 6 2HE LYS 6 5.164 -8.349 -4.191
51 2HE LYS 6 1HE LYS 6 6.715 -8.888 -4.831
52 1HZ LYS 6 1HZ LYS 6 6.453 -7.144 -6.192
53 2HZ LYS 6 2HZ LYS 6 4.774 -7.070 -5.976
54 3HZ LYS 6 3HZ LYS 6 5.436 -8.181 -7.073
55 H LEU 7 H LEU 7 4.204 -10.140 -1.083
56 HA LEU 7 HA LEU 7 1.590 -11.381 -0.931
57 1HB LEU 7 2HB LEU 7 2.999 -9.186 0.511
58 2HB LEU 7 1HB LEU 7 1.253 -9.193 0.538
59 HG LEU 7 HG LEU 7 1.805 -10.280 2.498
60 1HD1 LEU 7 1HD1 LEU 7 1.807 -12.847 1.111
61 2HD1 LEU 7 2HD1 LEU 7 0.640 -12.169 2.244
62 3HD1 LEU 7 3HD1 LEU 7 0.563 -11.739 0.535
63 1HD2 LEU 7 1HD2 LEU 7 4.181 -10.438 2.182
64 2HD2 LEU 7 2HD2 LEU 7 3.558 -12.015 2.663
65 3HD2 LEU 7 3HD2 LEU 7 3.980 -11.710 0.978
66 H TYR 8 H TYR 8 0.195 -8.884 -0.440
67 HA TYR 8 HA TYR 8 -0.134 -7.988 -3.224
68 1HB TYR 8 2HB TYR 8 -2.150 -7.759 -0.977
69 2HB TYR 8 1HB TYR 8 -2.433 -7.535 -2.708
70 HD1 TYR 8 1HD TYR 8 -1.797 -10.016 -0.062
71 HD2 TYR 8 2HD TYR 8 -2.751 -9.404 -4.158
72 HE1 TYR 8 1HE TYR 8 -2.325 -12.399 -0.285
73 HE2 TYR 8 2HE TYR 8 -3.302 -11.783 -4.390
74 HH TYR 8 HH TYR 8 -2.980 -13.850 -3.400
75 H LEU 9 H LEU 9 0.700 -6.072 -3.622
76 HA LEU 9 HA LEU 9 1.393 -4.356 -1.384
77 1HB LEU 9 2HB LEU 9 2.932 -5.134 -3.292
78 2HB LEU 9 1HB LEU 9 2.125 -3.918 -4.263
79 HG LEU 9 HG LEU 9 2.923 -2.155 -2.803
80 1HD1 LEU 9 1HD1 LEU 9 3.328 -4.341 -0.982
81 2HD1 LEU 9 2HD1 LEU 9 4.813 -3.409 -1.175
82 3HD1 LEU 9 3HD1 LEU 9 3.326 -2.606 -0.670
83 1HD2 LEU 9 1HD2 LEU 9 5.325 -3.875 -3.234
84 2HD2 LEU 9 2HD2 LEU 9 4.387 -3.309 -4.617
85 3HD2 LEU 9 3HD2 LEU 9 5.119 -2.144 -3.512
86 H CYS 10 H CYS 10 0.647 -2.357 -1.009
87 HA CYS 10 HA CYS 10 -1.425 -1.253 -2.712
88 1HB CYS 10 2HB CYS 10 -1.976 -0.994 -0.395
89 2HB CYS 10 1HB CYS 10 -0.351 -0.451 0.003
90 H GLU 11 H GLU 11 -1.099 0.698 -3.703
91 HA GLU 11 HA GLU 11 1.681 1.244 -4.378
92 1HB GLU 11 2HB GLU 11 -0.917 2.030 -5.691
93 2HB GLU 11 1HB GLU 11 0.653 2.598 -6.240
94 1HG GLU 11 2HG GLU 11 1.287 0.130 -6.411
95 2HG GLU 11 1HG GLU 11 -0.442 -0.189 -6.270
96 H PHE 12 H PHE 12 -0.635 2.434 -2.316
97 HA PHE 12 HA PHE 12 0.446 5.170 -2.437
98 1HB PHE 12 2HB PHE 12 -1.997 4.369 -0.876
99 2HB PHE 12 1HB PHE 12 -1.551 5.961 -1.481
100 HD1 PHE 12 1HD PHE 12 -1.663 6.386 -3.963
101 HD2 PHE 12 2HD PHE 12 -3.332 2.919 -2.148
102 HE1 PHE 12 1HE PHE 12 -3.056 6.015 -5.956
103 HE2 PHE 12 2HE PHE 12 -4.731 2.545 -4.136
104 HZ PHE 12 HZ PHE 12 -4.595 4.096 -6.043
105 H CYS 13 H CYS 13 0.102 2.335 -0.468
106 HA CYS 13 HA CYS 13 1.431 3.687 1.783
107 1HB CYS 13 2HB CYS 13 0.156 0.946 1.644
108 2HB CYS 13 1HB CYS 13 0.881 1.665 3.078
109 H LEU 14 H LEU 14 1.683 1.160 -0.588
110 HA LEU 14 HA LEU 14 3.341 -0.170 -1.303
111 1HB LEU 14 2HB LEU 14 4.918 2.018 -0.024
112 2HB LEU 14 1HB LEU 14 5.746 0.536 -0.470
113 HG LEU 14 HG LEU 14 4.041 1.895 -2.510
114 1HD1 LEU 14 1HD1 LEU 14 5.618 3.556 -1.329
115 2HD1 LEU 14 2HD1 LEU 14 6.905 2.679 -2.156
116 3HD1 LEU 14 3HD1 LEU 14 5.638 3.471 -3.090
117 1HD2 LEU 14 1HD2 LEU 14 4.971 -0.268 -3.042
118 2HD2 LEU 14 2HD2 LEU 14 5.767 0.972 -4.011
119 3HD2 LEU 14 3HD2 LEU 14 6.588 0.286 -2.609
120 H LYS 15 H LYS 15 1.868 -0.702 1.005
121 HA LYS 15 HA LYS 15 3.762 -2.228 2.658
122 1HB LYS 15 2HB LYS 15 1.722 -0.516 3.437
123 2HB LYS 15 1HB LYS 15 1.000 -2.110 3.605
124 1HG LYS 15 2HG LYS 15 3.546 -2.321 4.738
125 2HG LYS 15 1HG LYS 15 2.894 -0.779 5.297
126 1HD LYS 15 2HD LYS 15 0.942 -2.941 5.379
127 2HD LYS 15 1HD LYS 15 2.357 -3.246 6.388
128 1HE LYS 15 2HE LYS 15 1.438 -1.942 7.932
129 2HE LYS 15 1HE LYS 15 1.714 -0.580 6.849
130 1HZ LYS 15 1HZ LYS 15 -0.725 -2.266 6.748
131 2HZ LYS 15 2HZ LYS 15 -0.462 -0.778 5.973
132 3HZ LYS 15 3HZ LYS 15 -0.614 -0.841 7.659
133 H TYR 16 H TYR 16 3.419 -4.450 2.920
134 HA TYR 16 HA TYR 16 1.883 -5.631 0.766
135 1HB TYR 16 2HB TYR 16 3.985 -6.609 2.658
136 2HB TYR 16 1HB TYR 16 2.979 -7.773 1.802
137 HD1 TYR 16 1HD TYR 16 2.836 -7.427 -0.797
138 HD2 TYR 16 2HD TYR 16 5.931 -5.849 1.658
139 HE1 TYR 16 1HE TYR 16 4.284 -7.212 -2.771
140 HE2 TYR 16 2HE TYR 16 7.390 -5.637 -0.311
141 HH TYR 16 HH TYR 16 7.260 -5.471 -2.682
142 H MET 17 H MET 17 -0.111 -6.239 1.014
143 HA MET 17 HA MET 17 -1.292 -6.581 3.631
144 1HB MET 17 2HB MET 17 -2.414 -6.795 0.832
145 2HB MET 17 1HB MET 17 -3.380 -6.984 2.281
146 1HG MET 17 2HG MET 17 -1.992 -4.525 1.277
147 2HG MET 17 1HG MET 17 -3.715 -4.781 1.540
148 1HE MET 17 1HE MET 17 -1.103 -2.913 2.335
149 2HE MET 17 2HE MET 17 -2.424 -2.000 3.062
150 3HE MET 17 3HE MET 17 -1.071 -2.537 4.057
151 H LYS 18 H LYS 18 -1.888 -8.475 4.552
152 HA LYS 18 HA LYS 18 -0.521 -10.799 3.614
153 1HB LYS 18 2HB LYS 18 -2.459 -10.676 5.924
154 2HB LYS 18 1HB LYS 18 -1.142 -11.815 5.684
155 1HG LYS 18 2HG LYS 18 -0.719 -8.865 6.069
156 2HG LYS 18 1HG LYS 18 -0.730 -10.032 7.392
157 1HD LYS 18 2HD LYS 18 1.376 -10.615 6.967
158 2HD LYS 18 1HD LYS 18 0.992 -10.942 5.276
159 1HE LYS 18 2HE LYS 18 2.762 -9.206 5.646
160 2HE LYS 18 1HE LYS 18 1.399 -8.683 4.662
161 1HZ LYS 18 1HZ LYS 18 1.555 -8.146 7.570
162 2HZ LYS 18 2HZ LYS 18 0.528 -7.426 6.427
163 3HZ LYS 18 3HZ LYS 18 2.191 -7.080 6.414
164 H SER 19 H SER 19 -3.655 -9.621 3.067
165 HA SER 19 HA SER 19 -4.445 -12.244 2.020
166 1HB SER 19 2HB SER 19 -6.495 -10.463 3.303
167 2HB SER 19 1HB SER 19 -6.556 -12.205 3.012
168 HG SER 19 HG SER 19 -4.669 -12.192 4.574
169 H ARG 20 H ARG 20 -5.909 -12.207 0.282
170 HA ARG 20 HA ARG 20 -5.516 -10.105 -1.576
171 1HB ARG 20 2HB ARG 20 -6.228 -12.693 -1.791
172 2HB ARG 20 1HB ARG 20 -7.814 -11.947 -1.924
173 1HG ARG 20 2HG ARG 20 -7.347 -10.979 -3.928
174 2HG ARG 20 1HG ARG 20 -5.619 -10.861 -3.592
175 1HD ARG 20 2HD ARG 20 -5.365 -13.250 -3.919
176 2HD ARG 20 1HD ARG 20 -7.101 -13.422 -4.172
177 HE ARG 20 HE ARG 20 -5.416 -11.811 -5.984
178 1HH1 ARG 20 2HH1 ARG 20 -7.866 -14.236 -5.416
179 2HH1 ARG 20 1HH1 ARG 20 -8.154 -14.539 -7.102
180 1HH2 ARG 20 2HH2 ARG 20 -5.770 -12.202 -8.217
181 2HH2 ARG 20 1HH2 ARG 20 -6.927 -13.415 -8.695
182 H THR 21 H THR 21 -8.255 -11.126 0.406
183 HA THR 21 HA THR 21 -10.161 -9.286 -0.460
184 HB THR 21 HB THR 21 -10.733 -9.656 2.204
185 HG1 THR 21 1HG THR 21 -9.837 -11.518 2.864
186 1HG2 THR 21 1HG2 THR 21 -11.270 -11.591 -0.051
187 2HG2 THR 21 2HG2 THR 21 -12.199 -10.128 0.273
188 3HG2 THR 21 3HG2 THR 21 -12.196 -11.449 1.443
189 H ILE 22 H ILE 22 -7.661 -9.028 2.020
190 HA ILE 22 HA ILE 22 -8.460 -6.595 3.151
191 HB ILE 22 HB ILE 22 -5.759 -7.920 2.953
192 1HG1 ILE 22 2HG1 ILE 22 -7.679 -7.555 5.263
193 1HG2 ILE 22 1HG2 ILE 22 -5.893 -5.991 5.055
194 2HG2 ILE 22 2HG2 ILE 22 -4.742 -6.115 3.725
195 3HG2 ILE 22 3HG2 ILE 22 -6.242 -5.214 3.511
196 1HD1 ILE 22 1HD1 ILE 22 -5.392 -7.719 6.053
197 2HD1 ILE 22 2HD1 ILE 22 -6.306 -9.177 6.441
198 3HD1 ILE 22 3HD1 ILE 22 -5.160 -9.188 5.102
199 H LEU 23 H LEU 23 -5.958 -7.240 0.680
200 HA LEU 23 HA LEU 23 -5.379 -4.531 0.181
201 1HB LEU 23 2HB LEU 23 -4.171 -6.788 -0.488
202 2HB LEU 23 1HB LEU 23 -5.073 -6.571 -1.971
203 HG LEU 23 HG LEU 23 -2.574 -5.486 -1.330
204 1HD1 LEU 23 1HD1 LEU 23 -4.543 -5.017 -3.538
205 2HD1 LEU 23 2HD1 LEU 23 -2.933 -4.300 -3.536
206 3HD1 LEU 23 3HD1 LEU 23 -3.116 -6.054 -3.530
207 1HD2 LEU 23 1HD2 LEU 23 -3.246 -3.004 -1.829
208 2HD2 LEU 23 2HD2 LEU 23 -4.750 -3.469 -1.032
209 3HD2 LEU 23 3HD2 LEU 23 -3.216 -3.611 -0.173
210 H GLN 24 H GLN 24 -7.762 -6.719 -1.196
211 HA GLN 24 HA GLN 24 -8.489 -5.219 -3.442
212 1HB GLN 24 2HB GLN 24 -9.619 -7.433 -1.913
213 2HB GLN 24 1HB GLN 24 -10.840 -6.412 -2.659
214 1HG GLN 24 2HG GLN 24 -8.610 -7.902 -4.011
215 2HG GLN 24 1HG GLN 24 -10.347 -8.164 -4.178
216 1HE2 GLN 24 1HE2 GLN 24 -11.583 -6.328 -5.072
217 2HE2 GLN 24 2HE2 GLN 24 -10.845 -5.390 -6.336
218 H GLN 25 H GLN 25 -9.892 -5.182 -0.160
219 HA GLN 25 HA GLN 25 -11.585 -2.949 -0.857
220 1HB GLN 25 2HB GLN 25 -12.325 -2.998 1.459
221 2HB GLN 25 1HB GLN 25 -12.349 -4.616 0.775
222 1HG GLN 25 2HG GLN 25 -10.015 -4.848 1.871
223 2HG GLN 25 1HG GLN 25 -10.523 -3.461 2.838
224 1HE2 GLN 25 1HE2 GLN 25 -11.333 -6.746 1.928
225 2HE2 GLN 25 2HE2 GLN 25 -12.266 -7.112 3.342
226 H HIS 26 H HIS 26 -8.436 -3.426 0.468
227 HA HIS 26 HA HIS 26 -8.120 -0.961 1.788
228 1HB HIS 26 2HB HIS 26 -6.534 -2.785 2.149
229 2HB HIS 26 1HB HIS 26 -6.030 -2.710 0.462
230 HD1 HIS 26 1HD HIS 26 -5.290 -1.274 3.779
231 HD2 HIS 26 2HD HIS 26 -4.667 -0.240 -0.218
232 HE1 HIS 26 1HE HIS 26 -3.687 0.701 3.767
233 H MET 27 H MET 27 -7.132 -1.956 -1.496
234 HA MET 27 HA MET 27 -6.146 0.608 -2.174
235 1HB MET 27 2HB MET 27 -6.633 -1.936 -3.620
236 2HB MET 27 1HB MET 27 -6.490 -0.478 -4.596
237 1HG MET 27 2HG MET 27 -4.341 -0.053 -3.245
238 2HG MET 27 1HG MET 27 -4.460 -1.757 -2.812
239 1HE MET 27 1HE MET 27 -4.217 0.701 -6.072
240 2HE MET 27 2HE MET 27 -2.928 0.671 -4.868
241 3HE MET 27 3HE MET 27 -2.650 -0.003 -6.474
242 H LYS 28 H LYS 28 -9.280 -0.557 -1.944
243 HA LYS 28 HA LYS 28 -10.452 1.177 -3.935
244 1HB LYS 28 2HB LYS 28 -11.386 -0.908 -2.111
245 2HB LYS 28 1HB LYS 28 -12.481 0.466 -2.187
246 1HG LYS 28 2HG LYS 28 -13.133 -1.204 -3.797
247 2HG LYS 28 1HG LYS 28 -12.565 0.243 -4.633
248 1HD LYS 28 2HD LYS 28 -10.259 -1.175 -4.424
249 2HD LYS 28 1HD LYS 28 -11.442 -2.477 -4.576
250 1HE LYS 28 2HE LYS 28 -12.046 -1.872 -6.697
251 2HE LYS 28 1HE LYS 28 -11.667 -0.170 -6.435
252 1HZ LYS 28 1HZ LYS 28 -10.157 -1.495 -7.967
253 2HZ LYS 28 2HZ LYS 28 -9.540 -2.221 -6.565
254 3HZ LYS 28 3HZ LYS 28 -9.409 -0.544 -6.781
255 H LYS 29 H LYS 29 -9.845 1.176 -0.479
256 HA LYS 29 HA LYS 29 -11.183 3.712 -0.079
257 1HB LYS 29 2HB LYS 29 -10.727 1.652 1.591
258 2HB LYS 29 1HB LYS 29 -9.340 2.660 1.981
259 1HG LYS 29 2HG LYS 29 -11.939 4.043 1.883
260 2HG LYS 29 1HG LYS 29 -11.733 2.867 3.185
261 1HD LYS 29 2HD LYS 29 -9.372 4.486 2.923
262 2HD LYS 29 1HD LYS 29 -10.800 5.513 3.090
263 1HE LYS 29 2HE LYS 29 -10.061 3.242 4.932
264 2HE LYS 29 1HE LYS 29 -9.781 4.952 5.261
265 1HZ LYS 29 1HZ LYS 29 -12.188 3.415 5.521
266 2HZ LYS 29 2HZ LYS 29 -12.424 4.845 4.639
267 3HZ LYS 29 3HZ LYS 29 -11.781 4.913 6.207
268 H CYS 30 H CYS 30 -7.919 2.451 -0.268
269 HA CYS 30 HA CYS 30 -6.578 4.892 0.263
270 1HB CYS 30 2HB CYS 30 -5.844 2.256 0.009
271 2HB CYS 30 1HB CYS 30 -5.171 2.970 -1.451
272 H GLY 31 H GLY 31 -8.087 3.556 -2.536
273 1HA GLY 31 1HA GLY 31 -6.711 5.084 -4.512
274 2HA GLY 31 2HA GLY 31 -8.258 4.270 -4.717
275 H TRP 32 H TRP 32 -8.998 5.942 -2.162
276 HA TRP 32 HA TRP 32 -10.157 8.137 -3.652
277 1HB TRP 32 2HB TRP 32 -10.390 7.219 -0.785
278 2HB TRP 32 1HB TRP 32 -11.106 8.727 -1.348
279 HD1 TRP 32 HD TRP 32 -12.113 5.345 -0.714
280 HE1 TRP 32 1HE TRP 32 -14.164 4.647 -2.107
281 HE3 TRP 32 3HE TRP 32 -12.075 9.122 -4.156
282 HZ2 TRP 32 2HZ TRP 32 -15.578 5.588 -4.351
283 HZ3 TRP 32 3HZ TRP 32 -13.813 9.148 -5.894
284 HH2 TRP 32 HH TRP 32 -15.529 7.414 -5.988
285 H PHE 33 H PHE 33 -7.894 8.870 -4.141
286 HA PHE 33 HA PHE 33 -6.450 10.153 -2.002
287 1HB PHE 33 2HB PHE 33 -5.774 9.174 -4.522
288 2HB PHE 33 1HB PHE 33 -5.634 10.924 -4.689
289 HD1 PHE 33 1HD PHE 33 -3.836 12.092 -3.743
290 HD2 PHE 33 2HD PHE 33 -4.477 8.013 -2.727
291 HE1 PHE 33 1HE PHE 33 -1.640 12.030 -2.637
292 HE2 PHE 33 2HE PHE 33 -2.287 7.943 -1.608
293 HZ PHE 33 HZ PHE 33 -0.864 9.953 -1.565
Start of MODEL 5
1 1H GLY 1 1H GLY 1 8.916 -0.419 0.989
2 2H GLY 1 2H GLY 1 9.105 -2.031 0.486
3 3H GLY 1 3H GLY 1 10.108 -0.823 -0.147
4 1HA GLY 1 2HA GLY 1 11.564 -1.088 1.476
5 2HA GLY 1 1HA GLY 1 10.300 -0.763 2.654
6 H SER 2 H SER 2 11.875 -2.385 3.734
7 HA SER 2 HA SER 2 10.930 -5.119 3.146
8 1HB SER 2 2HB SER 2 13.395 -4.816 4.754
9 2HB SER 2 1HB SER 2 13.026 -5.948 3.452
10 HG SER 2 HG SER 2 13.249 -4.040 2.023
11 H ARG 3 H ARG 3 9.282 -3.616 4.661
12 HA ARG 3 HA ARG 3 9.845 -4.228 7.466
13 1HB ARG 3 2HB ARG 3 8.840 -2.006 6.663
14 2HB ARG 3 1HB ARG 3 7.352 -2.908 6.409
15 1HG ARG 3 2HG ARG 3 6.911 -2.258 8.509
16 2HG ARG 3 1HG ARG 3 7.917 -3.639 8.936
17 1HD ARG 3 2HD ARG 3 8.414 -0.766 9.249
18 2HD ARG 3 1HD ARG 3 9.044 -2.129 10.168
19 HE ARG 3 HE ARG 3 10.272 -0.814 7.902
20 1HH1 ARG 3 2HH1 ARG 3 10.239 -3.654 9.964
21 2HH1 ARG 3 1HH1 ARG 3 11.846 -4.151 9.517
22 1HH2 ARG 3 2HH2 ARG 3 12.412 -1.431 7.375
23 2HH2 ARG 3 1HH2 ARG 3 13.084 -2.881 8.069
24 H LEU 4 H LEU 4 7.926 -5.224 4.772
25 HA LEU 4 HA LEU 4 7.008 -7.541 6.314
26 1HB LEU 4 2HB LEU 4 5.344 -5.511 4.982
27 2HB LEU 4 1HB LEU 4 4.951 -7.161 4.539
28 HG LEU 4 HG LEU 4 5.042 -7.421 7.225
29 1HD1 LEU 4 1HD1 LEU 4 5.515 -5.019 7.530
30 2HD1 LEU 4 2HD1 LEU 4 3.982 -4.640 6.745
31 3HD1 LEU 4 3HD1 LEU 4 3.994 -5.516 8.275
32 1HD2 LEU 4 1HD2 LEU 4 2.449 -6.608 6.823
33 2HD2 LEU 4 2HD2 LEU 4 2.981 -7.057 5.203
34 3HD2 LEU 4 3HD2 LEU 4 3.085 -8.225 6.522
35 HA PRO 5 HA PRO 5 8.536 -9.840 2.907
36 1HB PRO 5 2HB PRO 5 6.198 -11.633 3.013
37 2HB PRO 5 1HB PRO 5 7.898 -11.986 3.331
38 1HG PRO 5 2HG PRO 5 6.101 -11.890 5.314
39 2HG PRO 5 1HG PRO 5 7.762 -11.314 5.539
40 1HD PRO 5 2HD PRO 5 5.261 -9.740 5.046
41 2HD PRO 5 1HD PRO 5 6.589 -9.417 6.182
42 H LYS 6 H LYS 6 7.687 -11.069 0.812
43 HA LYS 6 HA LYS 6 6.457 -9.033 -0.785
44 1HB LYS 6 2HB LYS 6 8.156 -11.216 -1.247
45 2HB LYS 6 1HB LYS 6 6.681 -11.573 -2.136
46 1HG LYS 6 2HG LYS 6 6.998 -9.043 -2.897
47 2HG LYS 6 1HG LYS 6 8.685 -9.434 -2.550
48 1HD LYS 6 2HD LYS 6 7.434 -11.569 -4.025
49 2HD LYS 6 1HD LYS 6 7.239 -10.031 -4.871
50 1HE LYS 6 2HE LYS 6 9.285 -10.481 -5.680
51 2HE LYS 6 1HE LYS 6 9.837 -9.879 -4.117
52 1HZ LYS 6 1HZ LYS 6 10.908 -11.916 -4.402
53 2HZ LYS 6 2HZ LYS 6 9.514 -12.688 -4.993
54 3HZ LYS 6 3HZ LYS 6 9.624 -12.277 -3.352
55 H LEU 7 H LEU 7 4.424 -8.917 0.243
56 HA LEU 7 HA LEU 7 2.579 -11.124 -0.341
57 1HB LEU 7 2HB LEU 7 1.937 -8.682 1.284
58 2HB LEU 7 1HB LEU 7 1.131 -10.230 1.294
59 HG LEU 7 HG LEU 7 3.883 -9.696 2.407
60 1HD1 LEU 7 1HD1 LEU 7 2.952 -9.679 4.536
61 2HD1 LEU 7 2HD1 LEU 7 1.808 -8.730 3.587
62 3HD1 LEU 7 3HD1 LEU 7 1.444 -10.409 3.985
63 1HD2 LEU 7 1HD2 LEU 7 4.151 -11.898 2.229
64 2HD2 LEU 7 2HD2 LEU 7 2.892 -12.054 3.454
65 3HD2 LEU 7 3HD2 LEU 7 2.471 -12.133 1.743
66 H TYR 8 H TYR 8 0.389 -9.063 -0.058
67 HA TYR 8 HA TYR 8 0.314 -8.211 -2.843
68 1HB TYR 8 2HB TYR 8 -1.703 -7.978 -0.593
69 2HB TYR 8 1HB TYR 8 -1.973 -7.385 -2.231
70 HD1 TYR 8 1HD TYR 8 -1.413 -10.447 -0.221
71 HD2 TYR 8 2HD TYR 8 -2.661 -8.830 -3.950
72 HE1 TYR 8 1HE TYR 8 -2.264 -12.653 -0.885
73 HE2 TYR 8 2HE TYR 8 -3.512 -11.028 -4.626
74 HH TYR 8 HH TYR 8 -3.201 -13.861 -2.486
75 H LEU 9 H LEU 9 1.601 -6.489 -3.171
76 HA LEU 9 HA LEU 9 1.888 -4.466 -1.132
77 1HB LEU 9 2HB LEU 9 3.801 -5.204 -2.492
78 2HB LEU 9 1HB LEU 9 3.011 -4.585 -3.930
79 HG LEU 9 HG LEU 9 3.171 -2.298 -3.053
80 1HD1 LEU 9 1HD1 LEU 9 4.288 -1.769 -1.026
81 2HD1 LEU 9 2HD1 LEU 9 3.070 -2.985 -0.643
82 3HD1 LEU 9 3HD1 LEU 9 4.766 -3.449 -0.777
83 1HD2 LEU 9 1HD2 LEU 9 5.759 -2.254 -2.927
84 2HD2 LEU 9 2HD2 LEU 9 5.632 -3.977 -3.285
85 3HD2 LEU 9 3HD2 LEU 9 4.974 -2.792 -4.413
86 H CYS 10 H CYS 10 0.695 -2.727 -0.939
87 HA CYS 10 HA CYS 10 -1.171 -1.918 -2.992
88 1HB CYS 10 2HB CYS 10 -2.024 -1.722 -0.778
89 2HB CYS 10 1HB CYS 10 -0.555 -0.947 -0.200
90 H GLU 11 H GLU 11 -0.366 -0.789 -4.618
91 HA GLU 11 HA GLU 11 2.091 0.618 -4.460
92 1HB GLU 11 2HB GLU 11 0.048 0.093 -6.533
93 2HB GLU 11 1HB GLU 11 1.042 1.525 -6.770
94 1HG GLU 11 2HG GLU 11 2.557 0.198 -7.676
95 2HG GLU 11 1HG GLU 11 2.853 -0.447 -6.065
96 H PHE 12 H PHE 12 -0.587 1.491 -2.975
97 HA PHE 12 HA PHE 12 -0.507 4.304 -3.786
98 1HB PHE 12 2HB PHE 12 -2.455 2.872 -1.972
99 2HB PHE 12 1HB PHE 12 -2.556 4.564 -2.446
100 HD1 PHE 12 1HD PHE 12 -1.811 4.282 -5.333
101 HD2 PHE 12 2HD PHE 12 -4.433 2.015 -2.869
102 HE1 PHE 12 1HE PHE 12 -3.127 3.657 -7.314
103 HE2 PHE 12 2HE PHE 12 -5.757 1.386 -4.846
104 HZ PHE 12 HZ PHE 12 -5.103 2.206 -7.074
105 H CYS 13 H CYS 13 -0.101 2.238 -0.913
106 HA CYS 13 HA CYS 13 1.276 4.518 0.355
107 1HB CYS 13 2HB CYS 13 0.569 3.694 2.546
108 2HB CYS 13 1HB CYS 13 -0.827 4.034 1.530
109 H LEU 14 H LEU 14 1.586 1.506 -0.935
110 HA LEU 14 HA LEU 14 3.212 -0.029 -1.054
111 1HB LEU 14 2HB LEU 14 4.791 2.167 0.256
112 2HB LEU 14 1HB LEU 14 5.507 0.657 -0.278
113 HG LEU 14 HG LEU 14 3.909 2.233 -2.237
114 1HD1 LEU 14 1HD1 LEU 14 5.429 3.829 -1.047
115 2HD1 LEU 14 2HD1 LEU 14 6.784 2.870 -1.645
116 3HD1 LEU 14 3HD1 LEU 14 5.702 3.672 -2.782
117 1HD2 LEU 14 1HD2 LEU 14 5.937 1.372 -3.631
118 2HD2 LEU 14 2HD2 LEU 14 6.148 0.266 -2.273
119 3HD2 LEU 14 3HD2 LEU 14 4.635 0.271 -3.179
120 H LYS 15 H LYS 15 1.428 -0.490 0.865
121 HA LYS 15 HA LYS 15 3.058 -1.692 3.003
122 1HB LYS 15 2HB LYS 15 0.985 -0.041 3.455
123 2HB LYS 15 1HB LYS 15 0.104 -1.556 3.305
124 1HG LYS 15 2HG LYS 15 0.614 -1.109 5.621
125 2HG LYS 15 1HG LYS 15 1.499 -2.531 5.070
126 1HD LYS 15 2HD LYS 15 3.366 -1.579 5.814
127 2HD LYS 15 1HD LYS 15 3.181 -0.355 4.556
128 1HE LYS 15 2HE LYS 15 1.511 0.098 6.914
129 2HE LYS 15 1HE LYS 15 3.243 0.134 7.247
130 1HZ LYS 15 1HZ LYS 15 1.646 1.891 5.507
131 2HZ LYS 15 2HZ LYS 15 3.292 1.657 5.168
132 3HZ LYS 15 3HZ LYS 15 2.820 2.298 6.662
133 H TYR 16 H TYR 16 2.600 -3.909 3.502
134 HA TYR 16 HA TYR 16 1.612 -5.332 1.151
135 1HB TYR 16 2HB TYR 16 3.441 -6.049 3.419
136 2HB TYR 16 1HB TYR 16 2.727 -7.305 2.411
137 HD1 TYR 16 1HD TYR 16 5.343 -4.873 2.698
138 HD2 TYR 16 2HD TYR 16 3.137 -7.205 -0.095
139 HE1 TYR 16 1HE TYR 16 7.116 -4.541 1.032
140 HE2 TYR 16 2HE TYR 16 4.908 -6.871 -1.773
141 HH TYR 16 HH TYR 16 6.751 -5.682 -2.294
142 H MET 17 H MET 17 -0.205 -6.424 1.120
143 HA MET 17 HA MET 17 -1.670 -6.844 3.632
144 1HB MET 17 2HB MET 17 -2.909 -7.390 0.981
145 2HB MET 17 1HB MET 17 -3.637 -6.739 2.443
146 1HG MET 17 2HG MET 17 -1.621 -5.074 1.053
147 2HG MET 17 1HG MET 17 -3.199 -5.265 0.285
148 1HE MET 17 1HE MET 17 -2.288 -1.982 2.887
149 2HE MET 17 2HE MET 17 -1.137 -3.319 2.847
150 3HE MET 17 3HE MET 17 -1.718 -2.608 1.342
151 H LYS 18 H LYS 18 -2.254 -8.869 4.306
152 HA LYS 18 HA LYS 18 -0.677 -11.016 3.259
153 1HB LYS 18 2HB LYS 18 -1.279 -10.575 5.707
154 2HB LYS 18 1HB LYS 18 -2.839 -11.294 5.333
155 1HG LYS 18 2HG LYS 18 -1.916 -13.241 5.873
156 2HG LYS 18 1HG LYS 18 -1.048 -13.134 4.340
157 1HD LYS 18 2HD LYS 18 0.276 -11.576 6.373
158 2HD LYS 18 1HD LYS 18 0.049 -13.241 6.908
159 1HE LYS 18 2HE LYS 18 1.392 -12.326 4.365
160 2HE LYS 18 1HE LYS 18 2.176 -13.027 5.779
161 1HZ LYS 18 1HZ LYS 18 1.060 -15.098 5.380
162 2HZ LYS 18 2HZ LYS 18 1.861 -14.626 3.960
163 3HZ LYS 18 3HZ LYS 18 0.183 -14.438 4.086
164 H SER 19 H SER 19 -4.045 -10.098 3.015
165 HA SER 19 HA SER 19 -4.483 -12.465 1.325
166 1HB SER 19 2HB SER 19 -6.780 -11.167 2.734
167 2HB SER 19 1HB SER 19 -6.575 -12.846 2.232
168 HG SER 19 HG SER 19 -5.273 -13.219 3.964
169 H ARG 20 H ARG 20 -5.854 -12.240 -0.461
170 HA ARG 20 HA ARG 20 -5.550 -9.880 -1.940
171 1HB ARG 20 2HB ARG 20 -6.126 -12.378 -2.625
172 2HB ARG 20 1HB ARG 20 -7.774 -11.769 -2.571
173 1HG ARG 20 2HG ARG 20 -7.392 -10.243 -4.296
174 2HG ARG 20 1HG ARG 20 -5.640 -10.382 -4.142
175 1HD ARG 20 2HD ARG 20 -7.294 -12.764 -4.876
176 2HD ARG 20 1HD ARG 20 -6.840 -11.579 -6.100
177 HE ARG 20 HE ARG 20 -4.806 -12.925 -4.438
178 1HH1 ARG 20 2HH1 ARG 20 -6.105 -12.040 -7.574
179 2HH1 ARG 20 1HH1 ARG 20 -4.734 -12.652 -8.458
180 1HH2 ARG 20 2HH2 ARG 20 -2.991 -13.702 -5.587
181 2HH2 ARG 20 1HH2 ARG 20 -2.936 -13.550 -7.318
182 H THR 21 H THR 21 -8.310 -11.147 -0.117
183 HA THR 21 HA THR 21 -10.169 -9.182 -0.854
184 HB THR 21 HB THR 21 -10.738 -11.327 0.299
185 HG1 THR 21 1HG THR 21 -12.049 -9.218 0.275
186 1HG2 THR 21 1HG2 THR 21 -9.175 -10.084 2.439
187 2HG2 THR 21 2HG2 THR 21 -9.576 -11.779 2.166
188 3HG2 THR 21 3HG2 THR 21 -10.732 -10.720 2.972
189 H ILE 22 H ILE 22 -7.547 -9.098 1.414
190 HA ILE 22 HA ILE 22 -8.411 -6.750 2.809
191 HB ILE 22 HB ILE 22 -5.697 -8.061 2.588
192 1HG1 ILE 22 2HG1 ILE 22 -7.621 -7.975 4.916
193 1HG2 ILE 22 1HG2 ILE 22 -6.064 -5.468 3.194
194 2HG2 ILE 22 2HG2 ILE 22 -6.250 -6.196 4.790
195 3HG2 ILE 22 3HG2 ILE 22 -4.771 -6.461 3.868
196 1HD1 ILE 22 1HD1 ILE 22 -6.156 -9.132 6.118
197 2HD1 ILE 22 2HD1 ILE 22 -5.747 -10.184 4.764
198 3HD1 ILE 22 3HD1 ILE 22 -4.954 -8.617 4.935
199 H LEU 23 H LEU 23 -5.979 -7.452 0.321
200 HA LEU 23 HA LEU 23 -5.145 -4.844 -0.210
201 1HB LEU 23 2HB LEU 23 -4.274 -7.152 -1.046
202 2HB LEU 23 1HB LEU 23 -5.413 -6.930 -2.355
203 HG LEU 23 HG LEU 23 -2.805 -6.147 -2.398
204 1HD1 LEU 23 1HD1 LEU 23 -3.718 -4.556 -4.271
205 2HD1 LEU 23 2HD1 LEU 23 -3.810 -6.310 -4.429
206 3HD1 LEU 23 3HD1 LEU 23 -5.231 -5.395 -3.926
207 1HD2 LEU 23 1HD2 LEU 23 -2.918 -4.355 -0.896
208 2HD2 LEU 23 2HD2 LEU 23 -2.970 -3.616 -2.495
209 3HD2 LEU 23 3HD2 LEU 23 -4.452 -3.787 -1.554
210 H GLN 24 H GLN 24 -7.763 -6.732 -1.639
211 HA GLN 24 HA GLN 24 -8.536 -4.923 -3.621
212 1HB GLN 24 2HB GLN 24 -9.911 -7.151 -2.173
213 2HB GLN 24 1HB GLN 24 -10.839 -6.123 -3.255
214 1HG GLN 24 2HG GLN 24 -8.300 -7.297 -4.254
215 2HG GLN 24 1HG GLN 24 -9.708 -8.345 -4.089
216 1HE2 GLN 24 1HE2 GLN 24 -8.182 -5.922 -5.932
217 2HE2 GLN 24 2HE2 GLN 24 -9.419 -5.745 -7.138
218 H GLN 25 H GLN 25 -9.810 -5.314 -0.319
219 HA GLN 25 HA GLN 25 -11.666 -3.165 -0.623
220 1HB GLN 25 2HB GLN 25 -10.745 -4.849 1.684
221 2HB GLN 25 1HB GLN 25 -11.771 -3.446 1.957
222 1HG GLN 25 2HG GLN 25 -13.540 -4.369 0.697
223 2HG GLN 25 1HG GLN 25 -12.503 -5.627 0.027
224 1HE2 GLN 25 1HE2 GLN 25 -11.438 -7.000 1.811
225 2HE2 GLN 25 2HE2 GLN 25 -12.516 -7.563 3.044
226 H HIS 26 H HIS 26 -8.455 -3.494 0.764
227 HA HIS 26 HA HIS 26 -8.334 -1.010 2.072
228 1HB HIS 26 2HB HIS 26 -6.708 -2.638 2.652
229 2HB HIS 26 1HB HIS 26 -6.218 -2.860 0.979
230 HD1 HIS 26 1HD HIS 26 -5.327 -1.021 4.028
231 HD2 HIS 26 2HD HIS 26 -4.763 -0.567 -0.080
232 HE1 HIS 26 1HE HIS 26 -3.454 0.681 3.725
233 H MET 27 H MET 27 -7.556 -1.960 -1.242
234 HA MET 27 HA MET 27 -6.274 0.411 -2.005
235 1HB MET 27 2HB MET 27 -7.585 -1.834 -3.462
236 2HB MET 27 1HB MET 27 -7.199 -0.374 -4.363
237 1HG MET 27 2HG MET 27 -4.847 -0.628 -3.373
238 2HG MET 27 1HG MET 27 -5.347 -2.269 -2.976
239 1HE MET 27 1HE MET 27 -2.774 -2.298 -5.040
240 2HE MET 27 2HE MET 27 -3.125 -1.304 -6.454
241 3HE MET 27 3HE MET 27 -3.221 -0.603 -4.839
242 H LYS 28 H LYS 28 -9.556 -0.144 -1.349
243 HA LYS 28 HA LYS 28 -10.562 1.965 -3.060
244 1HB LYS 28 2HB LYS 28 -12.052 0.656 -0.793
245 2HB LYS 28 1HB LYS 28 -12.717 1.442 -2.217
246 1HG LYS 28 2HG LYS 28 -11.343 -1.221 -2.041
247 2HG LYS 28 1HG LYS 28 -13.000 -0.871 -2.542
248 1HD LYS 28 2HD LYS 28 -11.707 0.590 -4.354
249 2HD LYS 28 1HD LYS 28 -10.457 -0.617 -4.041
250 1HE LYS 28 2HE LYS 28 -12.246 -2.362 -4.412
251 2HE LYS 28 1HE LYS 28 -13.268 -1.061 -5.017
252 1HZ LYS 28 1HZ LYS 28 -11.372 -0.563 -6.591
253 2HZ LYS 28 2HZ LYS 28 -12.244 -1.984 -6.896
254 3HZ LYS 28 3HZ LYS 28 -10.727 -2.070 -6.150
255 H LYS 29 H LYS 29 -9.422 1.588 0.187
256 HA LYS 29 HA LYS 29 -10.464 4.187 0.977
257 1HB LYS 29 2HB LYS 29 -9.936 3.672 3.172
258 2HB LYS 29 1HB LYS 29 -10.363 2.106 2.501
259 1HG LYS 29 2HG LYS 29 -8.383 1.287 3.022
260 2HG LYS 29 1HG LYS 29 -7.561 2.581 2.152
261 1HD LYS 29 2HD LYS 29 -6.771 2.978 4.256
262 2HD LYS 29 1HD LYS 29 -8.232 3.966 4.297
263 1HE LYS 29 2HE LYS 29 -9.421 2.010 5.309
264 2HE LYS 29 1HE LYS 29 -7.862 1.192 5.417
265 1HZ LYS 29 1HZ LYS 29 -7.101 3.186 6.729
266 2HZ LYS 29 2HZ LYS 29 -8.231 2.181 7.499
267 3HZ LYS 29 3HZ LYS 29 -8.730 3.653 6.818
268 H CYS 30 H CYS 30 -7.524 2.712 -0.074
269 HA CYS 30 HA CYS 30 -5.847 4.940 0.646
270 1HB CYS 30 2HB CYS 30 -5.435 2.290 -0.107
271 2HB CYS 30 1HB CYS 30 -4.835 3.221 -1.469
272 H GLY 31 H GLY 31 -7.027 3.552 -2.410
273 1HA GLY 31 1HA GLY 31 -6.662 6.156 -3.729
274 2HA GLY 31 2HA GLY 31 -7.003 4.626 -4.541
275 H TRP 32 H TRP 32 -8.428 6.772 -2.108
276 HA TRP 32 HA TRP 32 -11.045 5.825 -2.365
277 1HB TRP 32 2HB TRP 32 -9.702 7.823 -0.853
278 2HB TRP 32 1HB TRP 32 -11.106 8.578 -1.599
279 HD1 TRP 32 HD TRP 32 -10.134 6.572 1.325
280 HE1 TRP 32 1HE TRP 32 -12.209 5.713 2.574
281 HE3 TRP 32 3HE TRP 32 -13.677 7.584 -2.213
282 HZ2 TRP 32 2HZ TRP 32 -14.980 5.487 2.120
283 HZ3 TRP 32 3HZ TRP 32 -16.022 7.015 -1.726
284 HH2 TRP 32 HH TRP 32 -16.657 5.987 0.398
285 H PHE 33 H PHE 33 -9.397 8.501 -3.970
286 HA PHE 33 HA PHE 33 -11.690 8.678 -5.808
287 1HB PHE 33 2HB PHE 33 -10.613 10.742 -4.154
288 2HB PHE 33 1HB PHE 33 -10.249 11.138 -5.837
289 HD1 PHE 33 1HD PHE 33 -11.938 11.869 -7.308
290 HD2 PHE 33 2HD PHE 33 -12.975 10.367 -3.465
291 HE1 PHE 33 1HE PHE 33 -14.237 12.690 -7.613
292 HE2 PHE 33 2HE PHE 33 -15.280 11.176 -3.766
293 HZ PHE 33 HZ PHE 33 -15.910 12.339 -5.842
Start of MODEL 6
1 1H GLY 1 1H GLY 1 10.262 -20.089 6.481
2 2H GLY 1 2H GLY 1 9.912 -18.437 6.626
3 3H GLY 1 3H GLY 1 9.584 -19.487 7.915
4 1HA GLY 1 2HA GLY 1 11.730 -19.613 8.585
5 2HA GLY 1 1HA GLY 1 12.337 -19.351 6.955
6 H SER 2 H SER 2 13.810 -17.832 8.002
7 HA SER 2 HA SER 2 12.639 -15.378 9.033
8 1HB SER 2 2HB SER 2 15.512 -15.313 8.627
9 2HB SER 2 1HB SER 2 14.594 -15.199 10.129
10 HG SER 2 HG SER 2 14.515 -17.444 10.227
11 H ARG 3 H ARG 3 11.909 -15.758 6.394
12 HA ARG 3 HA ARG 3 13.301 -13.529 5.102
13 1HB ARG 3 2HB ARG 3 12.911 -16.285 3.978
14 2HB ARG 3 1HB ARG 3 12.977 -14.894 2.904
15 1HG ARG 3 2HG ARG 3 15.165 -14.644 4.644
16 2HG ARG 3 1HG ARG 3 15.119 -16.335 4.141
17 1HD ARG 3 2HD ARG 3 15.160 -13.914 2.343
18 2HD ARG 3 1HD ARG 3 16.478 -15.057 2.603
19 HE ARG 3 HE ARG 3 14.664 -16.712 1.679
20 1HH1 ARG 3 2HH1 ARG 3 15.453 -13.489 0.553
21 2HH1 ARG 3 1HH1 ARG 3 14.878 -13.783 -1.061
22 1HH2 ARG 3 2HH2 ARG 3 13.931 -17.103 -0.422
23 2HH2 ARG 3 1HH2 ARG 3 14.028 -15.847 -1.622
24 H LEU 4 H LEU 4 12.031 -12.443 3.496
25 HA LEU 4 HA LEU 4 9.147 -13.030 3.706
26 1HB LEU 4 2HB LEU 4 10.385 -10.734 4.556
27 2HB LEU 4 1HB LEU 4 9.882 -10.293 2.935
28 HG LEU 4 HG LEU 4 7.842 -11.580 4.664
29 1HD1 LEU 4 1HD1 LEU 4 9.023 -8.876 5.166
30 2HD1 LEU 4 2HD1 LEU 4 7.335 -9.221 5.541
31 3HD1 LEU 4 3HD1 LEU 4 8.618 -10.144 6.322
32 1HD2 LEU 4 1HD2 LEU 4 6.458 -10.717 3.149
33 2HD2 LEU 4 2HD2 LEU 4 7.179 -9.116 3.297
34 3HD2 LEU 4 3HD2 LEU 4 7.891 -10.304 2.205
35 HA PRO 5 HA PRO 5 10.039 -13.826 -0.633
36 1HB PRO 5 2HB PRO 5 7.593 -14.940 -1.169
37 2HB PRO 5 1HB PRO 5 8.947 -15.821 -0.455
38 1HG PRO 5 2HG PRO 5 6.573 -14.592 0.885
39 2HG PRO 5 1HG PRO 5 7.353 -16.153 1.199
40 1HD PRO 5 2HD PRO 5 7.780 -14.003 2.765
41 2HD PRO 5 1HD PRO 5 9.054 -15.195 2.437
42 H LYS 6 H LYS 6 6.579 -13.158 -0.248
43 HA LYS 6 HA LYS 6 6.760 -10.529 -1.364
44 1HB LYS 6 2HB LYS 6 5.707 -10.899 -3.455
45 2HB LYS 6 1HB LYS 6 6.986 -12.102 -3.360
46 1HG LYS 6 2HG LYS 6 5.440 -13.599 -3.915
47 2HG LYS 6 1HG LYS 6 4.798 -13.401 -2.283
48 1HD LYS 6 2HD LYS 6 2.910 -12.594 -3.132
49 2HD LYS 6 1HD LYS 6 3.810 -11.261 -3.858
50 1HE LYS 6 2HE LYS 6 4.038 -13.785 -5.317
51 2HE LYS 6 1HE LYS 6 2.392 -13.157 -5.231
52 1HZ LYS 6 1HZ LYS 6 3.012 -11.929 -6.972
53 2HZ LYS 6 2HZ LYS 6 4.668 -12.157 -6.688
54 3HZ LYS 6 3HZ LYS 6 3.823 -10.958 -5.842
55 H LEU 7 H LEU 7 4.581 -9.554 -1.589
56 HA LEU 7 HA LEU 7 2.378 -10.989 -0.377
57 1HB LEU 7 2HB LEU 7 3.970 -9.148 1.159
58 2HB LEU 7 1HB LEU 7 2.352 -8.508 0.960
59 HG LEU 7 HG LEU 7 1.890 -9.683 2.812
60 1HD1 LEU 7 1HD1 LEU 7 0.664 -11.476 2.281
61 2HD1 LEU 7 2HD1 LEU 7 1.168 -11.145 0.624
62 3HD1 LEU 7 3HD1 LEU 7 2.043 -12.332 1.590
63 1HD2 LEU 7 1HD2 LEU 7 3.362 -11.900 3.191
64 2HD2 LEU 7 2HD2 LEU 7 4.479 -10.947 2.215
65 3HD2 LEU 7 3HD2 LEU 7 3.853 -10.293 3.728
66 H TYR 8 H TYR 8 0.484 -9.206 -0.133
67 HA TYR 8 HA TYR 8 0.114 -8.244 -2.796
68 1HB TYR 8 2HB TYR 8 -1.624 -8.230 -0.322
69 2HB TYR 8 1HB TYR 8 -2.147 -7.776 -1.932
70 HD1 TYR 8 1HD TYR 8 -2.244 -9.495 -3.738
71 HD2 TYR 8 2HD TYR 8 -1.458 -10.502 0.317
72 HE1 TYR 8 1HE TYR 8 -2.760 -11.845 -4.231
73 HE2 TYR 8 2HE TYR 8 -1.969 -12.856 -0.163
74 HH TYR 8 HH TYR 8 -1.901 -14.241 -2.866
75 H LEU 9 H LEU 9 1.701 -6.573 -2.819
76 HA LEU 9 HA LEU 9 1.707 -4.461 -0.925
77 1HB LEU 9 2HB LEU 9 3.645 -5.221 -2.329
78 2HB LEU 9 1HB LEU 9 2.873 -4.465 -3.708
79 HG LEU 9 HG LEU 9 2.981 -2.283 -2.452
80 1HD1 LEU 9 1HD1 LEU 9 4.982 -3.700 -0.717
81 2HD1 LEU 9 2HD1 LEU 9 4.355 -2.057 -0.555
82 3HD1 LEU 9 3HD1 LEU 9 3.308 -3.438 -0.221
83 1HD2 LEU 9 1HD2 LEU 9 5.271 -1.876 -3.035
84 2HD2 LEU 9 2HD2 LEU 9 5.630 -3.604 -2.989
85 3HD2 LEU 9 3HD2 LEU 9 4.562 -2.956 -4.235
86 H CYS 10 H CYS 10 0.450 -2.711 -0.811
87 HA CYS 10 HA CYS 10 -1.664 -2.205 -2.575
88 1HB CYS 10 2HB CYS 10 -2.246 -1.065 -0.736
89 2HB CYS 10 1HB CYS 10 -0.607 -1.135 -0.120
90 H GLU 11 H GLU 11 1.575 -0.896 -2.321
91 HA GLU 11 HA GLU 11 2.953 0.086 -3.813
92 1HB GLU 11 2HB GLU 11 0.684 -0.286 -5.766
93 2HB GLU 11 1HB GLU 11 2.294 0.275 -6.199
94 1HG GLU 11 2HG GLU 11 2.969 -1.971 -4.937
95 2HG GLU 11 1HG GLU 11 1.353 -2.429 -5.471
96 H PHE 12 H PHE 12 0.077 1.460 -2.809
97 HA PHE 12 HA PHE 12 0.828 4.090 -3.921
98 1HB PHE 12 2HB PHE 12 -1.742 3.321 -2.518
99 2HB PHE 12 1HB PHE 12 -1.408 4.840 -3.343
100 HD1 PHE 12 1HD PHE 12 -0.566 4.445 -5.875
101 HD2 PHE 12 2HD PHE 12 -3.074 1.831 -3.637
102 HE1 PHE 12 1HE PHE 12 -1.450 3.509 -7.969
103 HE2 PHE 12 2HE PHE 12 -3.961 0.888 -5.728
104 HZ PHE 12 HZ PHE 12 -3.147 1.728 -7.897
105 H CYS 13 H CYS 13 -0.119 2.449 -0.960
106 HA CYS 13 HA CYS 13 1.231 4.470 0.693
107 1HB CYS 13 2HB CYS 13 -0.053 1.934 1.703
108 2HB CYS 13 1HB CYS 13 0.286 3.414 2.593
109 H LEU 14 H LEU 14 1.586 1.578 -0.970
110 HA LEU 14 HA LEU 14 3.219 0.048 -1.227
111 1HB LEU 14 2HB LEU 14 4.862 2.120 0.216
112 2HB LEU 14 1HB LEU 14 5.531 0.676 -0.518
113 HG LEU 14 HG LEU 14 3.881 2.472 -2.226
114 1HD1 LEU 14 1HD1 LEU 14 6.546 3.150 -1.080
115 2HD1 LEU 14 2HD1 LEU 14 6.157 3.632 -2.731
116 3HD1 LEU 14 3HD1 LEU 14 5.155 4.188 -1.392
117 1HD2 LEU 14 1HD2 LEU 14 6.203 0.611 -2.573
118 2HD2 LEU 14 2HD2 LEU 14 4.608 0.558 -3.329
119 3HD2 LEU 14 3HD2 LEU 14 5.775 1.788 -3.817
120 H LYS 15 H LYS 15 1.473 -0.465 0.743
121 HA LYS 15 HA LYS 15 3.122 -1.622 2.887
122 1HB LYS 15 2HB LYS 15 0.151 -1.046 2.882
123 2HB LYS 15 1HB LYS 15 1.054 -1.754 4.215
124 1HG LYS 15 2HG LYS 15 1.969 0.866 3.175
125 2HG LYS 15 1HG LYS 15 0.470 0.825 4.107
126 1HD LYS 15 2HD LYS 15 2.344 -0.771 5.489
127 2HD LYS 15 1HD LYS 15 3.175 0.717 5.032
128 1HE LYS 15 2HE LYS 15 0.728 0.370 6.727
129 2HE LYS 15 1HE LYS 15 2.231 1.203 7.115
130 1HZ LYS 15 1HZ LYS 15 0.035 2.104 5.349
131 2HZ LYS 15 2HZ LYS 15 1.583 2.792 5.261
132 3HZ LYS 15 3HZ LYS 15 0.692 2.891 6.702
133 H TYR 16 H TYR 16 2.882 -3.785 3.389
134 HA TYR 16 HA TYR 16 1.965 -5.423 1.176
135 1HB TYR 16 2HB TYR 16 3.463 -6.024 3.725
136 2HB TYR 16 1HB TYR 16 2.933 -7.286 2.619
137 HD1 TYR 16 1HD TYR 16 5.649 -5.431 3.551
138 HD2 TYR 16 2HD TYR 16 3.587 -6.650 0.043
139 HE1 TYR 16 1HE TYR 16 7.719 -5.153 2.253
140 HE2 TYR 16 2HE TYR 16 5.649 -6.372 -1.277
141 HH TYR 16 HH TYR 16 7.913 -4.780 -0.846
142 H MET 17 H MET 17 -0.101 -6.007 1.097
143 HA MET 17 HA MET 17 -1.606 -6.408 3.572
144 1HB MET 17 2HB MET 17 -2.548 -6.701 0.712
145 2HB MET 17 1HB MET 17 -3.556 -6.669 2.149
146 1HG MET 17 2HG MET 17 -1.789 -4.350 1.530
147 2HG MET 17 1HG MET 17 -3.314 -4.557 0.674
148 1HE MET 17 1HE MET 17 -1.455 -3.775 3.834
149 2HE MET 17 2HE MET 17 -2.083 -2.259 3.189
150 3HE MET 17 3HE MET 17 -2.631 -2.845 4.759
151 H LYS 18 H LYS 18 -2.445 -8.385 4.182
152 HA LYS 18 HA LYS 18 -0.770 -10.581 3.375
153 1HB LYS 18 2HB LYS 18 -2.538 -9.942 5.628
154 2HB LYS 18 1HB LYS 18 -2.535 -11.642 5.183
155 1HG LYS 18 2HG LYS 18 -0.854 -11.545 6.748
156 2HG LYS 18 1HG LYS 18 0.046 -11.391 5.238
157 1HD LYS 18 2HD LYS 18 -0.741 -8.792 6.021
158 2HD LYS 18 1HD LYS 18 -0.078 -9.592 7.448
159 1HE LYS 18 2HE LYS 18 1.747 -10.318 5.603
160 2HE LYS 18 1HE LYS 18 1.248 -8.759 4.946
161 1HZ LYS 18 1HZ LYS 18 1.916 -7.655 6.881
162 2HZ LYS 18 2HZ LYS 18 3.168 -8.760 6.578
163 3HZ LYS 18 3HZ LYS 18 2.023 -9.087 7.785
164 H SER 19 H SER 19 -4.102 -9.669 2.885
165 HA SER 19 HA SER 19 -4.528 -12.198 1.441
166 1HB SER 19 2HB SER 19 -6.694 -10.581 2.778
167 2HB SER 19 1HB SER 19 -6.792 -12.238 2.177
168 HG SER 19 HG SER 19 -5.298 -12.838 3.816
169 H ARG 20 H ARG 20 -5.954 -12.145 -0.367
170 HA ARG 20 HA ARG 20 -5.567 -9.975 -2.142
171 1HB ARG 20 2HB ARG 20 -6.910 -12.569 -2.141
172 2HB ARG 20 1HB ARG 20 -7.769 -11.364 -3.085
173 1HG ARG 20 2HG ARG 20 -6.163 -11.265 -4.675
174 2HG ARG 20 1HG ARG 20 -4.856 -11.565 -3.527
175 1HD ARG 20 2HD ARG 20 -6.826 -13.650 -4.456
176 2HD ARG 20 1HD ARG 20 -5.220 -13.419 -5.146
177 HE ARG 20 HE ARG 20 -4.320 -13.982 -2.925
178 1HH1 ARG 20 2HH1 ARG 20 -7.605 -14.949 -3.710
179 2HH1 ARG 20 1HH1 ARG 20 -7.628 -16.239 -2.543
180 1HH2 ARG 20 2HH2 ARG 20 -4.365 -15.672 -1.389
181 2HH2 ARG 20 1HH2 ARG 20 -5.798 -16.649 -1.227
182 H THR 21 H THR 21 -8.339 -11.066 -0.242
183 HA THR 21 HA THR 21 -10.200 -9.129 -1.014
184 HB THR 21 HB THR 21 -10.820 -9.685 1.615
185 HG1 THR 21 1HG THR 21 -9.663 -11.348 2.226
186 1HG2 THR 21 1HG2 THR 21 -12.240 -9.986 -0.414
187 2HG2 THR 21 2HG2 THR 21 -12.346 -11.326 0.729
188 3HG2 THR 21 3HG2 THR 21 -11.381 -11.493 -0.738
189 H ILE 22 H ILE 22 -7.849 -9.196 1.624
190 HA ILE 22 HA ILE 22 -8.546 -6.761 2.821
191 HB ILE 22 HB ILE 22 -6.142 -8.532 2.901
192 1HG1 ILE 22 2HG1 ILE 22 -7.808 -7.389 5.145
193 1HG2 ILE 22 1HG2 ILE 22 -6.163 -5.975 4.457
194 2HG2 ILE 22 2HG2 ILE 22 -4.824 -7.081 4.154
195 3HG2 ILE 22 3HG2 ILE 22 -5.439 -6.064 2.852
196 1HD1 ILE 22 1HD1 ILE 22 -5.656 -8.528 5.718
197 2HD1 ILE 22 2HD1 ILE 22 -7.102 -9.253 6.425
198 3HD1 ILE 22 3HD1 ILE 22 -6.334 -10.001 5.024
199 H LEU 23 H LEU 23 -6.248 -7.532 0.241
200 HA LEU 23 HA LEU 23 -5.139 -4.935 0.009
201 1HB LEU 23 2HB LEU 23 -4.463 -7.309 -0.991
202 2HB LEU 23 1HB LEU 23 -5.374 -6.720 -2.365
203 HG LEU 23 HG LEU 23 -2.687 -6.011 -1.442
204 1HD1 LEU 23 1HD1 LEU 23 -3.456 -5.145 -4.079
205 2HD1 LEU 23 2HD1 LEU 23 -2.267 -6.350 -3.583
206 3HD1 LEU 23 3HD1 LEU 23 -3.958 -6.807 -3.774
207 1HD2 LEU 23 1HD2 LEU 23 -4.488 -3.939 -1.190
208 2HD2 LEU 23 2HD2 LEU 23 -2.745 -3.784 -1.404
209 3HD2 LEU 23 3HD2 LEU 23 -3.815 -3.705 -2.804
210 H GLN 24 H GLN 24 -7.734 -6.609 -1.750
211 HA GLN 24 HA GLN 24 -8.312 -4.504 -3.517
212 1HB GLN 24 2HB GLN 24 -9.835 -6.912 -2.592
213 2HB GLN 24 1HB GLN 24 -10.623 -5.714 -3.609
214 1HG GLN 24 2HG GLN 24 -8.497 -7.659 -4.259
215 2HG GLN 24 1HG GLN 24 -9.867 -7.113 -5.220
216 1HE2 GLN 24 1HE2 GLN 24 -6.596 -7.059 -4.974
217 2HE2 GLN 24 2HE2 GLN 24 -6.261 -5.650 -5.923
218 H GLN 25 H GLN 25 -9.700 -5.333 -0.357
219 HA GLN 25 HA GLN 25 -11.599 -3.202 -0.415
220 1HB GLN 25 2HB GLN 25 -12.213 -3.830 1.754
221 2HB GLN 25 1HB GLN 25 -11.713 -5.336 1.001
222 1HG GLN 25 2HG GLN 25 -9.440 -4.912 2.086
223 2HG GLN 25 1HG GLN 25 -10.275 -3.700 3.057
224 1HE2 GLN 25 1HE2 GLN 25 -11.758 -6.669 1.965
225 2HE2 GLN 25 2HE2 GLN 25 -11.898 -7.403 3.528
226 H HIS 26 H HIS 26 -8.250 -3.453 0.432
227 HA HIS 26 HA HIS 26 -8.078 -1.060 1.975
228 1HB HIS 26 2HB HIS 26 -6.225 -2.564 2.155
229 2HB HIS 26 1HB HIS 26 -6.014 -2.622 0.407
230 HD1 HIS 26 1HD HIS 26 -5.187 -0.537 3.419
231 HD2 HIS 26 2HD HIS 26 -4.683 -0.409 -0.723
232 HE1 HIS 26 1HE HIS 26 -3.577 1.370 2.938
233 H MET 27 H MET 27 -7.690 -1.845 -1.453
234 HA MET 27 HA MET 27 -6.876 0.683 -2.329
235 1HB MET 27 2HB MET 27 -8.039 -1.725 -3.616
236 2HB MET 27 1HB MET 27 -8.089 -0.225 -4.531
237 1HG MET 27 2HG MET 27 -5.629 -0.013 -4.125
238 2HG MET 27 1HG MET 27 -5.668 -1.643 -3.459
239 1HE MET 27 1HE MET 27 -5.236 -3.907 -5.917
240 2HE MET 27 2HE MET 27 -3.891 -2.771 -6.012
241 3HE MET 27 3HE MET 27 -4.667 -3.095 -4.461
242 H LYS 28 H LYS 28 -9.909 -0.324 -1.195
243 HA LYS 28 HA LYS 28 -11.470 1.652 -2.608
244 1HB LYS 28 2HB LYS 28 -11.982 -0.452 -0.596
245 2HB LYS 28 1HB LYS 28 -13.016 0.965 -0.480
246 1HG LYS 28 2HG LYS 28 -13.876 -0.953 -1.877
247 2HG LYS 28 1HG LYS 28 -13.894 0.639 -2.633
248 1HD LYS 28 2HD LYS 28 -12.372 0.058 -4.194
249 2HD LYS 28 1HD LYS 28 -11.435 -0.917 -3.062
250 1HE LYS 28 2HE LYS 28 -12.294 -2.744 -3.984
251 2HE LYS 28 1HE LYS 28 -13.888 -2.246 -3.417
252 1HZ LYS 28 1HZ LYS 28 -14.395 -2.219 -5.580
253 2HZ LYS 28 2HZ LYS 28 -12.774 -2.168 -6.076
254 3HZ LYS 28 3HZ LYS 28 -13.566 -0.738 -5.626
255 H LYS 29 H LYS 29 -9.700 1.394 0.375
256 HA LYS 29 HA LYS 29 -10.653 3.984 1.328
257 1HB LYS 29 2HB LYS 29 -10.389 2.386 3.077
258 2HB LYS 29 1HB LYS 29 -8.808 1.897 2.487
259 1HG LYS 29 2HG LYS 29 -8.861 4.711 3.139
260 2HG LYS 29 1HG LYS 29 -9.355 3.713 4.508
261 1HD LYS 29 2HD LYS 29 -7.319 2.375 4.271
262 2HD LYS 29 1HD LYS 29 -6.824 3.366 2.897
263 1HE LYS 29 2HE LYS 29 -7.486 4.891 5.306
264 2HE LYS 29 1HE LYS 29 -6.113 3.800 5.495
265 1HZ LYS 29 1HZ LYS 29 -6.403 5.867 3.375
266 2HZ LYS 29 2HZ LYS 29 -5.082 4.818 3.558
267 3HZ LYS 29 3HZ LYS 29 -5.409 5.982 4.745
268 H CYS 30 H CYS 30 -7.905 2.424 -0.096
269 HA CYS 30 HA CYS 30 -5.967 4.429 0.140
270 1HB CYS 30 2HB CYS 30 -5.799 1.976 -0.713
271 2HB CYS 30 1HB CYS 30 -6.220 2.655 -2.281
272 H GLY 31 H GLY 31 -8.501 3.878 -2.272
273 1HA GLY 31 1HA GLY 31 -7.751 6.180 -3.851
274 2HA GLY 31 2HA GLY 31 -9.178 5.173 -4.079
275 H TRP 32 H TRP 32 -9.394 5.792 -0.960
276 HA TRP 32 HA TRP 32 -11.191 8.053 -1.365
277 1HB TRP 32 2HB TRP 32 -11.060 5.806 0.462
278 2HB TRP 32 1HB TRP 32 -11.273 7.329 1.327
279 HD1 TRP 32 HD TRP 32 -12.877 5.568 -1.739
280 HE1 TRP 32 1HE TRP 32 -15.398 6.088 -1.722
281 HE3 TRP 32 3HE TRP 32 -13.040 8.589 2.380
282 HZ2 TRP 32 2HZ TRP 32 -17.193 7.592 -0.173
283 HZ3 TRP 32 3HZ TRP 32 -15.208 9.530 3.065
284 HH2 TRP 32 HH TRP 32 -17.244 9.037 1.812
285 H PHE 33 H PHE 33 -9.344 9.485 -1.755
286 HA PHE 33 HA PHE 33 -7.828 10.212 0.637
287 1HB PHE 33 2HB PHE 33 -6.522 11.667 -0.919
288 2HB PHE 33 1HB PHE 33 -6.470 9.959 -1.348
289 HD1 PHE 33 1HD PHE 33 -7.426 9.165 -3.385
290 HD2 PHE 33 2HD PHE 33 -7.813 13.255 -2.275
291 HE1 PHE 33 1HE PHE 33 -8.184 9.709 -5.661
292 HE2 PHE 33 2HE PHE 33 -8.570 13.805 -4.549
293 HZ PHE 33 HZ PHE 33 -8.761 12.030 -6.245
Start of MODEL 7
1 1H GLY 1 1H GLY 1 15.852 -9.103 9.700
2 2H GLY 1 2H GLY 1 14.671 -8.499 8.643
3 3H GLY 1 3H GLY 1 16.302 -8.500 8.182
4 1HA GLY 1 2HA GLY 1 16.210 -11.012 8.457
5 2HA GLY 1 1HA GLY 1 14.464 -10.795 8.448
6 H SER 2 H SER 2 17.149 -11.354 6.555
7 HA SER 2 HA SER 2 16.498 -9.943 4.203
8 1HB SER 2 2HB SER 2 17.872 -12.389 3.603
9 2HB SER 2 1HB SER 2 18.505 -10.743 3.613
10 HG SER 2 HG SER 2 19.628 -11.441 5.251
11 H ARG 3 H ARG 3 15.650 -13.172 5.365
12 HA ARG 3 HA ARG 3 14.117 -13.696 2.936
13 1HB ARG 3 2HB ARG 3 15.610 -15.424 4.100
14 2HB ARG 3 1HB ARG 3 14.370 -15.499 5.343
15 1HG ARG 3 2HG ARG 3 13.955 -17.297 3.884
16 2HG ARG 3 1HG ARG 3 12.735 -16.075 3.514
17 1HD ARG 3 2HD ARG 3 14.291 -15.278 1.682
18 2HD ARG 3 1HD ARG 3 15.215 -16.755 1.954
19 HE ARG 3 HE ARG 3 12.561 -17.503 1.595
20 1HH1 ARG 3 2HH1 ARG 3 15.088 -15.937 -0.250
21 2HH1 ARG 3 1HH1 ARG 3 14.548 -16.562 -1.782
22 1HH2 ARG 3 2HH2 ARG 3 11.808 -18.302 -0.413
23 2HH2 ARG 3 1HH2 ARG 3 12.664 -17.899 -1.874
24 H LEU 4 H LEU 4 12.714 -11.822 3.559
25 HA LEU 4 HA LEU 4 10.808 -12.449 5.696
26 1HB LEU 4 2HB LEU 4 11.975 -10.066 4.806
27 2HB LEU 4 1HB LEU 4 10.311 -9.981 4.262
28 HG LEU 4 HG LEU 4 9.527 -10.324 6.562
29 1HD1 LEU 4 1HD1 LEU 4 12.471 -10.407 7.191
30 2HD1 LEU 4 2HD1 LEU 4 11.212 -10.161 8.399
31 3HD1 LEU 4 3HD1 LEU 4 11.269 -11.665 7.480
32 1HD2 LEU 4 1HD2 LEU 4 10.177 -8.045 5.556
33 2HD2 LEU 4 2HD2 LEU 4 9.924 -8.153 7.297
34 3HD2 LEU 4 3HD2 LEU 4 11.563 -8.127 6.643
35 HA PRO 5 HA PRO 5 7.717 -13.958 2.939
36 1HB PRO 5 2HB PRO 5 5.472 -12.877 4.135
37 2HB PRO 5 1HB PRO 5 6.269 -14.367 4.646
38 1HG PRO 5 2HG PRO 5 6.499 -11.611 5.770
39 2HG PRO 5 1HG PRO 5 6.446 -13.170 6.615
40 1HD PRO 5 2HD PRO 5 8.752 -11.833 6.259
41 2HD PRO 5 1HD PRO 5 8.683 -13.607 6.209
42 H LYS 6 H LYS 6 6.854 -13.294 1.063
43 HA LYS 6 HA LYS 6 6.732 -10.398 0.596
44 1HB LYS 6 2HB LYS 6 7.357 -12.754 -1.092
45 2HB LYS 6 1HB LYS 6 6.497 -11.434 -1.874
46 1HG LYS 6 2HG LYS 6 8.400 -10.013 -0.679
47 2HG LYS 6 1HG LYS 6 9.262 -11.546 -0.829
48 1HD LYS 6 2HD LYS 6 9.801 -10.749 -2.865
49 2HD LYS 6 1HD LYS 6 8.196 -11.333 -3.302
50 1HE LYS 6 2HE LYS 6 7.691 -8.835 -2.269
51 2HE LYS 6 1HE LYS 6 9.214 -8.611 -3.126
52 1HZ LYS 6 1HZ LYS 6 8.055 -9.792 -5.041
53 2HZ LYS 6 2HZ LYS 6 7.578 -8.198 -4.706
54 3HZ LYS 6 3HZ LYS 6 6.608 -9.494 -4.203
55 H LEU 7 H LEU 7 4.779 -9.718 1.120
56 HA LEU 7 HA LEU 7 2.417 -11.302 0.590
57 1HB LEU 7 2HB LEU 7 2.973 -8.707 1.979
58 2HB LEU 7 1HB LEU 7 1.338 -9.112 1.526
59 HG LEU 7 HG LEU 7 1.557 -9.732 3.783
60 1HD1 LEU 7 1HD1 LEU 7 1.956 -12.254 2.177
61 2HD1 LEU 7 2HD1 LEU 7 1.207 -12.129 3.768
62 3HD1 LEU 7 3HD1 LEU 7 0.427 -11.396 2.365
63 1HD2 LEU 7 1HD2 LEU 7 4.268 -10.451 2.990
64 2HD2 LEU 7 2HD2 LEU 7 3.638 -9.948 4.557
65 3HD2 LEU 7 3HD2 LEU 7 3.515 -11.635 4.058
66 H TYR 8 H TYR 8 0.729 -8.961 0.177
67 HA TYR 8 HA TYR 8 1.263 -8.521 -2.676
68 1HB TYR 8 2HB TYR 8 -1.292 -7.875 -1.191
69 2HB TYR 8 1HB TYR 8 -1.063 -8.033 -2.932
70 HD1 TYR 8 1HD TYR 8 -1.362 -10.113 -4.000
71 HD2 TYR 8 2HD TYR 8 -1.103 -9.958 0.242
72 HE1 TYR 8 1HE TYR 8 -2.043 -12.472 -3.874
73 HE2 TYR 8 2HE TYR 8 -1.771 -12.316 0.379
74 HH TYR 8 HH TYR 8 -2.941 -14.061 -2.385
75 H LEU 9 H LEU 9 1.541 -6.450 -3.460
76 HA LEU 9 HA LEU 9 1.981 -4.424 -1.381
77 1HB LEU 9 2HB LEU 9 3.652 -5.355 -3.315
78 2HB LEU 9 1HB LEU 9 2.999 -3.937 -4.098
79 HG LEU 9 HG LEU 9 4.297 -3.878 -1.382
80 1HD1 LEU 9 1HD1 LEU 9 5.835 -2.585 -3.401
81 2HD1 LEU 9 2HD1 LEU 9 6.292 -3.926 -2.347
82 3HD1 LEU 9 3HD1 LEU 9 5.522 -4.249 -3.901
83 1HD2 LEU 9 1HD2 LEU 9 4.521 -1.425 -2.624
84 2HD2 LEU 9 2HD2 LEU 9 2.883 -1.958 -3.002
85 3HD2 LEU 9 3HD2 LEU 9 3.409 -1.854 -1.323
86 H CYS 10 H CYS 10 0.571 -2.825 -1.185
87 HA CYS 10 HA CYS 10 -1.525 -2.300 -2.981
88 1HB CYS 10 2HB CYS 10 -2.243 -1.219 -1.160
89 2HB CYS 10 1HB CYS 10 -0.699 -1.495 -0.391
90 H GLU 11 H GLU 11 1.615 -0.872 -2.474
91 HA GLU 11 HA GLU 11 3.032 0.275 -3.783
92 1HB GLU 11 2HB GLU 11 0.970 -0.321 -5.885
93 2HB GLU 11 1HB GLU 11 2.451 0.564 -6.232
94 1HG GLU 11 2HG GLU 11 3.742 -1.368 -5.359
95 2HG GLU 11 1HG GLU 11 2.226 -2.250 -5.187
96 H PHE 12 H PHE 12 0.063 1.419 -2.909
97 HA PHE 12 HA PHE 12 0.646 4.121 -3.929
98 1HB PHE 12 2HB PHE 12 -1.808 3.033 -2.525
99 2HB PHE 12 1HB PHE 12 -1.602 4.707 -3.028
100 HD1 PHE 12 1HD PHE 12 -3.390 1.982 -3.836
101 HD2 PHE 12 2HD PHE 12 -0.583 4.620 -5.665
102 HE1 PHE 12 1HE PHE 12 -4.312 1.439 -6.047
103 HE2 PHE 12 2HE PHE 12 -1.509 4.073 -7.874
104 HZ PHE 12 HZ PHE 12 -3.374 2.481 -8.068
105 H CYS 13 H CYS 13 -0.063 2.319 -0.994
106 HA CYS 13 HA CYS 13 1.295 4.329 0.667
107 1HB CYS 13 2HB CYS 13 0.179 1.713 1.659
108 2HB CYS 13 1HB CYS 13 0.480 3.188 2.566
109 H LEU 14 H LEU 14 1.619 1.442 -1.051
110 HA LEU 14 HA LEU 14 3.293 -0.029 -1.407
111 1HB LEU 14 2HB LEU 14 4.901 2.029 0.095
112 2HB LEU 14 1HB LEU 14 5.604 0.548 -0.525
113 HG LEU 14 HG LEU 14 4.096 2.162 -2.483
114 1HD1 LEU 14 1HD1 LEU 14 6.740 3.220 -2.365
115 2HD1 LEU 14 2HD1 LEU 14 5.199 4.069 -2.262
116 3HD1 LEU 14 3HD1 LEU 14 5.960 3.447 -0.799
117 1HD2 LEU 14 1HD2 LEU 14 5.325 0.065 -2.998
118 2HD2 LEU 14 2HD2 LEU 14 5.843 1.454 -3.952
119 3HD2 LEU 14 3HD2 LEU 14 6.827 0.899 -2.597
120 H LYS 15 H LYS 15 1.468 -0.463 0.564
121 HA LYS 15 HA LYS 15 2.988 -1.640 2.780
122 1HB LYS 15 2HB LYS 15 0.515 -0.202 2.641
123 2HB LYS 15 1HB LYS 15 0.188 -1.825 3.232
124 1HG LYS 15 2HG LYS 15 0.605 -0.187 5.029
125 2HG LYS 15 1HG LYS 15 1.738 -1.540 5.042
126 1HD LYS 15 2HD LYS 15 3.256 0.119 5.253
127 2HD LYS 15 1HD LYS 15 3.104 0.170 3.497
128 1HE LYS 15 2HE LYS 15 1.443 1.954 3.692
129 2HE LYS 15 1HE LYS 15 1.580 1.894 5.448
130 1HZ LYS 15 1HZ LYS 15 3.138 3.366 3.648
131 2HZ LYS 15 2HZ LYS 15 4.149 2.211 4.367
132 3HZ LYS 15 3HZ LYS 15 3.276 3.290 5.338
133 H TYR 16 H TYR 16 2.584 -3.770 3.416
134 HA TYR 16 HA TYR 16 1.771 -5.489 1.216
135 1HB TYR 16 2HB TYR 16 3.527 -5.762 3.588
136 2HB TYR 16 1HB TYR 16 2.707 -7.222 3.042
137 HD1 TYR 16 1HD TYR 16 3.334 -4.880 0.435
138 HD2 TYR 16 2HD TYR 16 5.099 -8.030 2.670
139 HE1 TYR 16 1HE TYR 16 5.002 -5.197 -1.350
140 HE2 TYR 16 2HE TYR 16 6.783 -8.354 0.905
141 HH TYR 16 HH TYR 16 7.399 -6.134 -1.472
142 H MET 17 H MET 17 -0.291 -5.958 1.156
143 HA MET 17 HA MET 17 -1.927 -6.291 3.508
144 1HB MET 17 2HB MET 17 -2.431 -6.817 0.571
145 2HB MET 17 1HB MET 17 -3.637 -7.066 1.821
146 1HG MET 17 2HG MET 17 -4.165 -4.986 0.998
147 2HG MET 17 1HG MET 17 -3.214 -4.609 2.427
148 1HE MET 17 1HE MET 17 -0.862 -5.503 -1.026
149 2HE MET 17 2HE MET 17 -2.572 -5.927 -0.935
150 3HE MET 17 3HE MET 17 -2.058 -4.543 -1.899
151 H LYS 18 H LYS 18 -2.756 -8.258 4.282
152 HA LYS 18 HA LYS 18 -0.974 -10.475 3.939
153 1HB LYS 18 2HB LYS 18 -2.842 -9.624 5.881
154 2HB LYS 18 1HB LYS 18 -3.366 -11.215 5.344
155 1HG LYS 18 2HG LYS 18 -1.946 -11.935 6.919
156 2HG LYS 18 1HG LYS 18 -0.726 -11.659 5.674
157 1HD LYS 18 2HD LYS 18 -1.292 -9.214 7.077
158 2HD LYS 18 1HD LYS 18 -0.867 -10.491 8.220
159 1HE LYS 18 2HE LYS 18 0.964 -10.804 6.177
160 2HE LYS 18 1HE LYS 18 0.797 -9.053 6.323
161 1HZ LYS 18 1HZ LYS 18 1.491 -10.947 8.500
162 2HZ LYS 18 2HZ LYS 18 1.233 -9.283 8.716
163 3HZ LYS 18 3HZ LYS 18 2.532 -9.826 7.767
164 H SER 19 H SER 19 -3.963 -9.538 2.538
165 HA SER 19 HA SER 19 -3.947 -11.971 0.938
166 1HB SER 19 2HB SER 19 -6.549 -10.962 2.074
167 2HB SER 19 1HB SER 19 -6.216 -12.517 1.311
168 HG SER 19 HG SER 19 -4.950 -13.071 3.127
169 H ARG 20 H ARG 20 -5.196 -11.755 -1.050
170 HA ARG 20 HA ARG 20 -4.982 -9.122 -2.194
171 1HB ARG 20 2HB ARG 20 -4.956 -11.654 -3.232
172 2HB ARG 20 1HB ARG 20 -6.579 -11.122 -3.646
173 1HG ARG 20 2HG ARG 20 -5.491 -9.044 -4.611
174 2HG ARG 20 1HG ARG 20 -3.959 -9.907 -4.458
175 1HD ARG 20 2HD ARG 20 -4.398 -10.741 -6.483
176 2HD ARG 20 1HD ARG 20 -5.593 -11.754 -5.675
177 HE ARG 20 HE ARG 20 -7.204 -9.889 -6.167
178 1HH1 ARG 20 2HH1 ARG 20 -4.414 -10.547 -8.188
179 2HH1 ARG 20 1HH1 ARG 20 -5.102 -9.796 -9.601
180 1HH2 ARG 20 2HH2 ARG 20 -8.115 -8.926 -8.025
181 2HH2 ARG 20 1HH2 ARG 20 -7.202 -8.859 -9.501
182 H THR 21 H THR 21 -7.455 -11.137 -0.823
183 HA THR 21 HA THR 21 -9.748 -9.671 -1.575
184 HB THR 21 HB THR 21 -10.356 -10.740 0.872
185 HG1 THR 21 1HG THR 21 -9.091 -12.517 1.206
186 1HG2 THR 21 1HG2 THR 21 -10.183 -12.467 -1.580
187 2HG2 THR 21 2HG2 THR 21 -11.332 -11.134 -1.478
188 3HG2 THR 21 3HG2 THR 21 -11.417 -12.463 -0.319
189 H ILE 22 H ILE 22 -7.375 -9.344 0.984
190 HA ILE 22 HA ILE 22 -8.741 -7.350 2.489
191 HB ILE 22 HB ILE 22 -5.927 -8.378 2.397
192 1HG1 ILE 22 2HG1 ILE 22 -7.801 -8.045 4.739
193 1HG2 ILE 22 1HG2 ILE 22 -4.977 -6.627 3.395
194 2HG2 ILE 22 2HG2 ILE 22 -6.378 -5.705 2.848
195 3HG2 ILE 22 3HG2 ILE 22 -6.351 -6.389 4.475
196 1HD1 ILE 22 1HD1 ILE 22 -5.399 -9.778 4.262
197 2HD1 ILE 22 2HD1 ILE 22 -5.621 -8.550 5.507
198 3HD1 ILE 22 3HD1 ILE 22 -6.550 -10.047 5.570
199 H LEU 23 H LEU 23 -6.361 -7.313 -0.126
200 HA LEU 23 HA LEU 23 -5.886 -4.549 -0.192
201 1HB LEU 23 2HB LEU 23 -4.433 -6.040 -1.373
202 2HB LEU 23 1HB LEU 23 -5.758 -6.649 -2.347
203 HG LEU 23 HG LEU 23 -5.939 -4.493 -3.488
204 1HD1 LEU 23 1HD1 LEU 23 -3.970 -3.677 -1.417
205 2HD1 LEU 23 2HD1 LEU 23 -3.815 -2.974 -3.028
206 3HD1 LEU 23 3HD1 LEU 23 -5.316 -2.781 -2.124
207 1HD2 LEU 23 1HD2 LEU 23 -4.533 -5.494 -4.887
208 2HD2 LEU 23 2HD2 LEU 23 -3.229 -4.611 -4.098
209 3HD2 LEU 23 3HD2 LEU 23 -3.638 -6.242 -3.564
210 H GLN 24 H GLN 24 -8.449 -6.513 -1.545
211 HA GLN 24 HA GLN 24 -9.582 -4.658 -3.303
212 1HB GLN 24 2HB GLN 24 -10.835 -6.863 -1.666
213 2HB GLN 24 1HB GLN 24 -11.735 -5.916 -2.844
214 1HG GLN 24 2HG GLN 24 -9.541 -7.893 -3.292
215 2HG GLN 24 1HG GLN 24 -11.148 -7.824 -4.015
216 1HE2 GLN 24 1HE2 GLN 24 -8.074 -7.586 -4.781
217 2HE2 GLN 24 2HE2 GLN 24 -8.124 -6.410 -6.058
218 H GLN 25 H GLN 25 -9.975 -5.100 0.172
219 HA GLN 25 HA GLN 25 -11.926 -2.983 0.404
220 1HB GLN 25 2HB GLN 25 -10.394 -4.046 2.748
221 2HB GLN 25 1HB GLN 25 -12.064 -3.509 2.664
222 1HG GLN 25 2HG GLN 25 -10.932 -6.096 1.631
223 2HG GLN 25 1HG GLN 25 -12.029 -5.872 2.993
224 1HE2 GLN 25 1HE2 GLN 25 -12.245 -7.424 0.474
225 2HE2 GLN 25 2HE2 GLN 25 -13.738 -6.906 -0.243
226 H HIS 26 H HIS 26 -8.482 -3.439 0.911
227 HA HIS 26 HA HIS 26 -7.870 -1.053 2.211
228 1HB HIS 26 2HB HIS 26 -6.218 -2.821 2.018
229 2HB HIS 26 1HB HIS 26 -6.204 -2.673 0.263
230 HD1 HIS 26 1HD HIS 26 -4.752 -1.185 3.364
231 HD2 HIS 26 2HD HIS 26 -4.865 -0.376 -0.733
232 HE1 HIS 26 1HE HIS 26 -3.046 0.652 2.930
233 H MET 27 H MET 27 -8.097 -1.762 -1.250
234 HA MET 27 HA MET 27 -7.165 0.781 -2.081
235 1HB MET 27 2HB MET 27 -8.385 -1.574 -3.386
236 2HB MET 27 1HB MET 27 -8.447 -0.056 -4.268
237 1HG MET 27 2HG MET 27 -5.843 -0.158 -3.397
238 2HG MET 27 1HG MET 27 -6.204 -1.844 -3.762
239 1HE MET 27 1HE MET 27 -4.581 -1.470 -7.097
240 2HE MET 27 2HE MET 27 -3.917 -0.915 -5.559
241 3HE MET 27 3HE MET 27 -4.851 -2.410 -5.629
242 H LYS 28 H LYS 28 -10.044 -0.059 -0.680
243 HA LYS 28 HA LYS 28 -11.722 1.880 -2.008
244 1HB LYS 28 2HB LYS 28 -11.977 0.027 0.259
245 2HB LYS 28 1HB LYS 28 -12.811 1.559 0.491
246 1HG LYS 28 2HG LYS 28 -14.450 0.291 -0.485
247 2HG LYS 28 1HG LYS 28 -13.748 1.086 -1.896
248 1HD LYS 28 2HD LYS 28 -12.297 -1.312 -1.329
249 2HD LYS 28 1HD LYS 28 -14.022 -1.675 -1.418
250 1HE LYS 28 2HE LYS 28 -14.096 -0.458 -3.592
251 2HE LYS 28 1HE LYS 28 -12.343 -0.305 -3.508
252 1HZ LYS 28 1HZ LYS 28 -12.924 -2.978 -3.078
253 2HZ LYS 28 2HZ LYS 28 -12.203 -2.288 -4.451
254 3HZ LYS 28 3HZ LYS 28 -13.886 -2.497 -4.387
255 H LYS 29 H LYS 29 -9.804 1.682 0.945
256 HA LYS 29 HA LYS 29 -10.144 4.461 1.622
257 1HB LYS 29 2HB LYS 29 -9.699 2.677 3.319
258 2HB LYS 29 1HB LYS 29 -8.090 2.488 2.636
259 1HG LYS 29 2HG LYS 29 -8.238 5.185 3.131
260 2HG LYS 29 1HG LYS 29 -9.114 4.476 4.489
261 1HD LYS 29 2HD LYS 29 -7.256 3.501 5.344
262 2HD LYS 29 1HD LYS 29 -6.580 3.158 3.749
263 1HE LYS 29 2HE LYS 29 -5.280 4.816 5.085
264 2HE LYS 29 1HE LYS 29 -5.814 5.406 3.512
265 1HZ LYS 29 1HZ LYS 29 -6.112 6.804 5.713
266 2HZ LYS 29 2HZ LYS 29 -7.558 5.920 5.803
267 3HZ LYS 29 3HZ LYS 29 -7.231 6.885 4.442
268 H CYS 30 H CYS 30 -7.916 2.450 -0.096
269 HA CYS 30 HA CYS 30 -6.040 4.599 -0.656
270 1HB CYS 30 2HB CYS 30 -5.693 1.927 -0.434
271 2HB CYS 30 1HB CYS 30 -5.939 2.043 -2.173
272 H GLY 31 H GLY 31 -8.733 5.020 -1.385
273 1HA GLY 31 1HA GLY 31 -8.464 5.853 -4.097
274 2HA GLY 31 2HA GLY 31 -9.509 4.437 -3.958
275 H TRP 32 H TRP 32 -8.989 7.464 -2.191
276 HA TRP 32 HA TRP 32 -11.731 7.612 -1.390
277 1HB TRP 32 2HB TRP 32 -9.251 8.872 -0.704
278 2HB TRP 32 1HB TRP 32 -10.468 10.111 -1.002
279 HD1 TRP 32 HD TRP 32 -9.710 7.165 1.325
280 HE1 TRP 32 1HE TRP 32 -11.206 7.360 3.413
281 HE3 TRP 32 3HE TRP 32 -12.634 11.088 -0.156
282 HZ2 TRP 32 2HZ TRP 32 -13.342 8.969 4.296
283 HZ3 TRP 32 3HZ TRP 32 -14.383 11.897 1.376
284 HH2 TRP 32 HH TRP 32 -14.729 10.857 3.556
285 H PHE 33 H PHE 33 -9.747 9.134 -3.845
286 HA PHE 33 HA PHE 33 -12.175 10.339 -4.974
287 1HB PHE 33 2HB PHE 33 -9.455 11.627 -4.664
288 2HB PHE 33 1HB PHE 33 -10.702 12.250 -5.747
289 HD1 PHE 33 1HD PHE 33 -9.489 12.111 -2.368
290 HD2 PHE 33 2HD PHE 33 -12.891 12.996 -4.769
291 HE1 PHE 33 1HE PHE 33 -10.474 13.374 -0.500
292 HE2 PHE 33 2HE PHE 33 -13.883 14.259 -2.906
293 HZ PHE 33 HZ PHE 33 -12.676 14.448 -0.765
Start of MODEL 8
1 1H GLY 1 1H GLY 1 12.682 -21.660 0.891
2 2H GLY 1 2H GLY 1 12.147 -20.065 1.109
3 3H GLY 1 3H GLY 1 11.047 -21.349 1.218
4 1HA GLY 1 2HA GLY 1 12.236 -22.195 3.169
5 2HA GLY 1 1HA GLY 1 13.283 -20.785 3.081
6 H SER 2 H SER 2 12.285 -20.764 5.379
7 HA SER 2 HA SER 2 9.615 -19.649 5.491
8 1HB SER 2 2HB SER 2 11.568 -19.847 7.781
9 2HB SER 2 1HB SER 2 9.804 -19.818 7.845
10 HG SER 2 HG SER 2 9.795 -21.857 6.824
11 H ARG 3 H ARG 3 10.864 -18.001 3.919
12 HA ARG 3 HA ARG 3 11.462 -15.655 5.593
13 1HB ARG 3 2HB ARG 3 13.039 -16.771 3.533
14 2HB ARG 3 1HB ARG 3 12.329 -15.307 2.865
15 1HG ARG 3 2HG ARG 3 13.142 -14.329 5.203
16 2HG ARG 3 1HG ARG 3 14.303 -15.646 5.042
17 1HD ARG 3 2HD ARG 3 14.462 -13.111 3.893
18 2HD ARG 3 1HD ARG 3 15.485 -14.503 3.546
19 HE ARG 3 HE ARG 3 13.015 -13.906 2.037
20 1HH1 ARG 3 2HH1 ARG 3 16.389 -14.848 2.156
21 2HH1 ARG 3 1HH1 ARG 3 16.484 -15.170 0.446
22 1HH2 ARG 3 2HH2 ARG 3 13.142 -14.318 -0.189
23 2HH2 ARG 3 1HH2 ARG 3 14.654 -14.809 -0.901
24 H LEU 4 H LEU 4 10.320 -13.796 5.127
25 HA LEU 4 HA LEU 4 7.812 -14.176 3.833
26 1HB LEU 4 2HB LEU 4 8.983 -12.297 5.617
27 2HB LEU 4 1HB LEU 4 8.338 -11.409 4.251
28 HG LEU 4 HG LEU 4 6.427 -13.368 5.176
29 1HD1 LEU 4 1HD1 LEU 4 7.527 -13.101 7.330
30 2HD1 LEU 4 2HD1 LEU 4 7.384 -11.348 7.201
31 3HD1 LEU 4 3HD1 LEU 4 5.934 -12.343 7.342
32 1HD2 LEU 4 1HD2 LEU 4 6.556 -10.676 4.201
33 2HD2 LEU 4 2HD2 LEU 4 5.182 -11.781 4.254
34 3HD2 LEU 4 3HD2 LEU 4 5.537 -10.746 5.638
35 HA PRO 5 HA PRO 5 9.360 -12.885 -0.149
36 1HB PRO 5 2HB PRO 5 6.994 -13.861 -1.372
37 2HB PRO 5 1HB PRO 5 8.532 -14.707 -1.216
38 1HG PRO 5 2HG PRO 5 6.139 -15.426 0.030
39 2HG PRO 5 1HG PRO 5 7.754 -16.006 0.471
40 1HD PRO 5 2HD PRO 5 6.100 -13.856 1.719
41 2HD PRO 5 1HD PRO 5 7.211 -15.017 2.479
42 H LYS 6 H LYS 6 7.370 -12.273 -2.134
43 HA LYS 6 HA LYS 6 6.657 -9.590 -1.307
44 1HB LYS 6 2HB LYS 6 5.997 -9.224 -3.589
45 2HB LYS 6 1HB LYS 6 7.531 -10.077 -3.598
46 1HG LYS 6 2HG LYS 6 6.642 -11.569 -4.965
47 2HG LYS 6 1HG LYS 6 5.550 -12.059 -3.667
48 1HD LYS 6 2HD LYS 6 3.805 -10.827 -4.484
49 2HD LYS 6 1HD LYS 6 4.861 -9.634 -5.243
50 1HE LYS 6 2HE LYS 6 4.783 -10.702 -7.187
51 2HE LYS 6 1HE LYS 6 5.245 -12.226 -6.427
52 1HZ LYS 6 1HZ LYS 6 3.183 -12.953 -6.647
53 2HZ LYS 6 2HZ LYS 6 2.769 -11.526 -7.470
54 3HZ LYS 6 3HZ LYS 6 2.569 -11.627 -5.787
55 H LEU 7 H LEU 7 4.452 -8.799 -1.473
56 HA LEU 7 HA LEU 7 2.433 -10.894 -1.050
57 1HB LEU 7 2HB LEU 7 3.340 -8.776 0.753
58 2HB LEU 7 1HB LEU 7 1.607 -8.798 0.537
59 HG LEU 7 HG LEU 7 1.924 -10.105 2.422
60 1HD1 LEU 7 1HD1 LEU 7 1.139 -11.404 0.049
61 2HD1 LEU 7 2HD1 LEU 7 2.112 -12.555 0.964
62 3HD1 LEU 7 3HD1 LEU 7 0.697 -11.808 1.707
63 1HD2 LEU 7 1HD2 LEU 7 3.741 -12.090 2.048
64 2HD2 LEU 7 2HD2 LEU 7 4.481 -10.764 1.151
65 3HD2 LEU 7 3HD2 LEU 7 4.075 -10.557 2.855
66 H TYR 8 H TYR 8 0.290 -9.278 -0.596
67 HA TYR 8 HA TYR 8 -0.169 -8.049 -3.193
68 1HB TYR 8 2HB TYR 8 -2.168 -8.136 -0.940
69 2HB TYR 8 1HB TYR 8 -2.464 -8.126 -2.681
70 HD1 TYR 8 1HD TYR 8 -2.502 -10.165 -3.935
71 HD2 TYR 8 2HD TYR 8 -1.391 -10.209 0.169
72 HE1 TYR 8 1HE TYR 8 -2.647 -12.620 -3.925
73 HE2 TYR 8 2HE TYR 8 -1.520 -12.656 0.188
74 HH TYR 8 HH TYR 8 -2.984 -14.446 -2.301
75 H LEU 9 H LEU 9 1.019 -6.243 -3.170
76 HA LEU 9 HA LEU 9 1.101 -4.591 -0.814
77 1HB LEU 9 2HB LEU 9 3.187 -4.988 -1.731
78 2HB LEU 9 1HB LEU 9 2.617 -4.809 -3.375
79 HG LEU 9 HG LEU 9 2.321 -2.283 -2.126
80 1HD1 LEU 9 1HD1 LEU 9 3.967 -3.245 -0.481
81 2HD1 LEU 9 2HD1 LEU 9 5.112 -3.359 -1.816
82 3HD1 LEU 9 3HD1 LEU 9 4.494 -1.784 -1.317
83 1HD2 LEU 9 1HD2 LEU 9 2.734 -2.734 -4.504
84 2HD2 LEU 9 2HD2 LEU 9 3.913 -1.605 -3.835
85 3HD2 LEU 9 3HD2 LEU 9 4.361 -3.290 -4.104
86 H CYS 10 H CYS 10 0.291 -2.577 -0.557
87 HA CYS 10 HA CYS 10 -1.490 -1.482 -2.537
88 1HB CYS 10 2HB CYS 10 -2.153 -1.049 -0.255
89 2HB CYS 10 1HB CYS 10 -0.554 -0.440 0.155
90 H GLU 11 H GLU 11 -0.776 -0.287 -4.120
91 HA GLU 11 HA GLU 11 1.978 0.385 -4.342
92 1HB GLU 11 2HB GLU 11 -0.420 0.605 -6.065
93 2HB GLU 11 1HB GLU 11 0.909 1.702 -6.418
94 1HG GLU 11 2HG GLU 11 2.293 0.038 -7.095
95 2HG GLU 11 1HG GLU 11 1.563 -1.157 -6.022
96 H PHE 12 H PHE 12 -0.462 1.880 -2.692
97 HA PHE 12 HA PHE 12 0.617 4.574 -3.168
98 1HB PHE 12 2HB PHE 12 -1.821 4.081 -1.504
99 2HB PHE 12 1HB PHE 12 -1.413 5.476 -2.497
100 HD1 PHE 12 1HD PHE 12 -3.656 2.924 -2.237
101 HD2 PHE 12 2HD PHE 12 -1.049 4.661 -5.118
102 HE1 PHE 12 1HE PHE 12 -5.059 2.028 -4.045
103 HE2 PHE 12 2HE PHE 12 -2.453 3.766 -6.930
104 HZ PHE 12 HZ PHE 12 -4.460 2.446 -6.394
105 H CYS 13 H CYS 13 0.122 2.120 -0.726
106 HA CYS 13 HA CYS 13 1.351 3.825 1.324
107 1HB CYS 13 2HB CYS 13 0.046 1.102 1.463
108 2HB CYS 13 1HB CYS 13 0.830 1.880 2.831
109 H LEU 14 H LEU 14 1.877 1.119 -0.724
110 HA LEU 14 HA LEU 14 3.565 -0.276 -1.128
111 1HB LEU 14 2HB LEU 14 5.070 2.008 0.085
112 2HB LEU 14 1HB LEU 14 5.900 0.500 -0.262
113 HG LEU 14 HG LEU 14 4.270 1.690 -2.441
114 1HD1 LEU 14 1HD1 LEU 14 5.279 3.676 -2.205
115 2HD1 LEU 14 2HD1 LEU 14 6.559 3.024 -1.179
116 3HD1 LEU 14 3HD1 LEU 14 6.660 2.850 -2.931
117 1HD2 LEU 14 1HD2 LEU 14 5.414 0.241 -3.675
118 2HD2 LEU 14 2HD2 LEU 14 6.957 0.813 -3.042
119 3HD2 LEU 14 3HD2 LEU 14 6.046 -0.420 -2.169
120 H LYS 15 H LYS 15 1.947 -0.963 0.819
121 HA LYS 15 HA LYS 15 3.692 -2.150 2.873
122 1HB LYS 15 2HB LYS 15 1.554 -0.450 3.304
123 2HB LYS 15 1HB LYS 15 0.842 -2.040 3.528
124 1HG LYS 15 2HG LYS 15 1.567 -1.280 5.649
125 2HG LYS 15 1HG LYS 15 2.687 -2.545 5.141
126 1HD LYS 15 2HD LYS 15 4.422 -1.090 4.880
127 2HD LYS 15 1HD LYS 15 3.369 0.256 4.438
128 1HE LYS 15 2HE LYS 15 2.939 -0.646 7.166
129 2HE LYS 15 1HE LYS 15 4.601 -0.128 6.881
130 1HZ LYS 15 1HZ LYS 15 2.151 1.469 6.340
131 2HZ LYS 15 2HZ LYS 15 3.733 1.966 5.995
132 3HZ LYS 15 3HZ LYS 15 3.255 1.722 7.603
133 H TYR 16 H TYR 16 3.568 -4.323 3.152
134 HA TYR 16 HA TYR 16 2.281 -5.832 1.073
135 1HB TYR 16 2HB TYR 16 4.171 -6.445 3.310
136 2HB TYR 16 1HB TYR 16 3.328 -7.766 2.514
137 HD1 TYR 16 1HD TYR 16 6.007 -8.154 2.277
138 HD2 TYR 16 2HD TYR 16 3.684 -5.358 0.081
139 HE1 TYR 16 1HE TYR 16 7.703 -8.158 0.495
140 HE2 TYR 16 2HE TYR 16 5.366 -5.353 -1.717
141 HH TYR 16 HH TYR 16 8.210 -6.027 -1.555
142 H MET 17 H MET 17 0.141 -6.114 1.258
143 HA MET 17 HA MET 17 -1.080 -6.749 3.822
144 1HB MET 17 2HB MET 17 -2.342 -6.623 1.090
145 2HB MET 17 1HB MET 17 -3.196 -6.737 2.615
146 1HG MET 17 2HG MET 17 -1.674 -4.531 3.023
147 2HG MET 17 1HG MET 17 -1.988 -4.426 1.294
148 1HE MET 17 1HE MET 17 -4.364 -2.551 4.274
149 2HE MET 17 2HE MET 17 -3.894 -4.110 4.951
150 3HE MET 17 3HE MET 17 -2.678 -3.062 4.225
151 H LYS 18 H LYS 18 -2.005 -8.725 4.325
152 HA LYS 18 HA LYS 18 -0.539 -10.913 3.160
153 1HB LYS 18 2HB LYS 18 -1.855 -10.348 5.673
154 2HB LYS 18 1HB LYS 18 -2.258 -11.960 5.097
155 1HG LYS 18 2HG LYS 18 -0.289 -11.905 6.589
156 2HG LYS 18 1HG LYS 18 0.059 -12.570 4.992
157 1HD LYS 18 2HD LYS 18 1.855 -11.101 5.625
158 2HD LYS 18 1HD LYS 18 0.940 -10.342 4.321
159 1HE LYS 18 2HE LYS 18 1.369 -8.646 5.914
160 2HE LYS 18 1HE LYS 18 -0.329 -9.081 6.088
161 1HZ LYS 18 1HZ LYS 18 0.325 -10.518 7.968
162 2HZ LYS 18 2HZ LYS 18 0.643 -8.876 8.240
163 3HZ LYS 18 3HZ LYS 18 1.909 -9.930 7.841
164 H SER 19 H SER 19 -3.835 -9.812 3.055
165 HA SER 19 HA SER 19 -4.495 -12.158 1.400
166 1HB SER 19 2HB SER 19 -6.596 -10.731 3.003
167 2HB SER 19 1HB SER 19 -6.590 -12.391 2.404
168 HG SER 19 HG SER 19 -5.133 -12.954 3.989
169 H ARG 20 H ARG 20 -5.579 -11.758 -0.509
170 HA ARG 20 HA ARG 20 -5.309 -9.131 -1.530
171 1HB ARG 20 2HB ARG 20 -5.457 -11.571 -2.699
172 2HB ARG 20 1HB ARG 20 -7.063 -10.941 -3.050
173 1HG ARG 20 2HG ARG 20 -5.891 -8.846 -3.883
174 2HG ARG 20 1HG ARG 20 -4.402 -9.784 -3.818
175 1HD ARG 20 2HD ARG 20 -5.194 -11.315 -5.447
176 2HD ARG 20 1HD ARG 20 -6.838 -10.685 -5.335
177 HE ARG 20 HE ARG 20 -4.645 -8.978 -6.319
178 1HH1 ARG 20 2HH1 ARG 20 -7.716 -10.582 -6.835
179 2HH1 ARG 20 1HH1 ARG 20 -8.095 -9.671 -8.270
180 1HH2 ARG 20 2HH2 ARG 20 -5.121 -7.809 -8.229
181 2HH2 ARG 20 1HH2 ARG 20 -6.610 -8.113 -9.070
182 H THR 21 H THR 21 -7.961 -10.793 -0.021
183 HA THR 21 HA THR 21 -10.055 -9.079 -0.916
184 HB THR 21 HB THR 21 -10.937 -9.811 1.518
185 HG1 THR 21 1HG THR 21 -10.026 -11.981 1.859
186 1HG2 THR 21 1HG2 THR 21 -12.101 -11.551 0.460
187 2HG2 THR 21 2HG2 THR 21 -10.772 -11.885 -0.651
188 3HG2 THR 21 3HG2 THR 21 -11.740 -10.425 -0.849
189 H ILE 22 H ILE 22 -7.836 -9.065 1.803
190 HA ILE 22 HA ILE 22 -8.772 -6.751 3.120
191 HB ILE 22 HB ILE 22 -6.201 -8.296 3.112
192 1HG1 ILE 22 2HG1 ILE 22 -7.982 -7.567 5.430
193 1HG2 ILE 22 1HG2 ILE 22 -5.074 -6.408 3.556
194 2HG2 ILE 22 2HG2 ILE 22 -6.534 -5.513 3.985
195 3HG2 ILE 22 3HG2 ILE 22 -5.780 -6.590 5.164
196 1HD1 ILE 22 1HD1 ILE 22 -6.745 -8.929 6.654
197 2HD1 ILE 22 2HD1 ILE 22 -6.806 -10.195 5.429
198 3HD1 ILE 22 3HD1 ILE 22 -5.580 -8.933 5.330
199 H LEU 23 H LEU 23 -6.284 -7.299 0.663
200 HA LEU 23 HA LEU 23 -5.427 -4.616 0.462
201 1HB LEU 23 2HB LEU 23 -4.421 -6.909 -0.390
202 2HB LEU 23 1HB LEU 23 -5.272 -6.480 -1.857
203 HG LEU 23 HG LEU 23 -2.710 -5.616 -0.967
204 1HD1 LEU 23 1HD1 LEU 23 -4.346 -5.683 -3.356
205 2HD1 LEU 23 2HD1 LEU 23 -3.286 -4.275 -3.295
206 3HD1 LEU 23 3HD1 LEU 23 -2.607 -5.898 -3.160
207 1HD2 LEU 23 1HD2 LEU 23 -3.057 -3.150 -1.484
208 2HD2 LEU 23 2HD2 LEU 23 -4.762 -3.430 -1.138
209 3HD2 LEU 23 3HD2 LEU 23 -3.551 -3.708 0.111
210 H GLN 24 H GLN 24 -7.890 -6.495 -1.250
211 HA GLN 24 HA GLN 24 -8.494 -4.593 -3.234
212 1HB GLN 24 2HB GLN 24 -9.535 -7.109 -2.349
213 2HB GLN 24 1HB GLN 24 -10.873 -5.985 -2.548
214 1HG GLN 24 2HG GLN 24 -10.801 -6.730 -4.665
215 2HG GLN 24 1HG GLN 24 -9.554 -5.496 -4.823
216 1HE2 GLN 24 1HE2 GLN 24 -10.278 -8.842 -4.835
217 2HE2 GLN 24 2HE2 GLN 24 -8.685 -9.409 -5.211
218 H GLN 25 H GLN 25 -9.975 -5.227 -0.077
219 HA GLN 25 HA GLN 25 -11.864 -3.144 -0.139
220 1HB GLN 25 2HB GLN 25 -10.541 -4.695 2.067
221 2HB GLN 25 1HB GLN 25 -11.605 -3.347 2.441
222 1HG GLN 25 2HG GLN 25 -13.479 -4.422 1.606
223 2HG GLN 25 1HG GLN 25 -12.527 -5.542 0.632
224 1HE2 GLN 25 1HE2 GLN 25 -12.639 -7.531 1.361
225 2HE2 GLN 25 2HE2 GLN 25 -12.726 -8.014 3.030
226 H HIS 26 H HIS 26 -8.500 -3.278 0.861
227 HA HIS 26 HA HIS 26 -8.373 -0.695 2.005
228 1HB HIS 26 2HB HIS 26 -6.712 -2.364 2.570
229 2HB HIS 26 1HB HIS 26 -6.206 -2.488 0.889
230 HD1 HIS 26 1HD HIS 26 -5.539 -0.611 4.000
231 HD2 HIS 26 2HD HIS 26 -4.851 -0.127 -0.085
232 HE1 HIS 26 1HE HIS 26 -3.820 1.256 3.763
233 H MET 27 H MET 27 -7.318 -1.910 -1.187
234 HA MET 27 HA MET 27 -6.339 0.557 -2.096
235 1HB MET 27 2HB MET 27 -7.036 -2.040 -3.353
236 2HB MET 27 1HB MET 27 -6.882 -0.652 -4.421
237 1HG MET 27 2HG MET 27 -4.624 -0.255 -3.356
238 2HG MET 27 1HG MET 27 -4.799 -1.851 -2.619
239 1HE MET 27 1HE MET 27 -2.764 -0.927 -6.261
240 2HE MET 27 2HE MET 27 -2.994 -0.143 -4.697
241 3HE MET 27 3HE MET 27 -2.106 -1.663 -4.798
242 H LYS 28 H LYS 28 -9.534 -0.695 -1.947
243 HA LYS 28 HA LYS 28 -10.640 1.147 -3.869
244 1HB LYS 28 2HB LYS 28 -11.640 -1.041 -2.152
245 2HB LYS 28 1HB LYS 28 -12.793 0.244 -2.487
246 1HG LYS 28 2HG LYS 28 -12.743 -1.792 -4.039
247 2HG LYS 28 1HG LYS 28 -12.809 -0.187 -4.766
248 1HD LYS 28 2HD LYS 28 -10.071 -0.900 -4.388
249 2HD LYS 28 1HD LYS 28 -10.896 -2.235 -5.195
250 1HE LYS 28 2HE LYS 28 -11.683 -0.785 -6.937
251 2HE LYS 28 1HE LYS 28 -11.072 0.635 -6.092
252 1HZ LYS 28 1HZ LYS 28 -9.751 -0.730 -8.019
253 2HZ LYS 28 2HZ LYS 28 -9.056 -1.356 -6.604
254 3HZ LYS 28 3HZ LYS 28 -9.030 0.313 -6.894
255 H LYS 29 H LYS 29 -9.589 1.359 -0.720
256 HA LYS 29 HA LYS 29 -11.325 3.654 -0.134
257 1HB LYS 29 2HB LYS 29 -10.931 1.627 1.511
258 2HB LYS 29 1HB LYS 29 -9.452 2.500 1.889
259 1HG LYS 29 2HG LYS 29 -11.848 4.171 1.887
260 2HG LYS 29 1HG LYS 29 -11.869 2.881 3.091
261 1HD LYS 29 2HD LYS 29 -9.581 4.808 2.729
262 2HD LYS 29 1HD LYS 29 -10.894 5.047 3.886
263 1HE LYS 29 2HE LYS 29 -10.243 3.217 5.180
264 2HE LYS 29 1HE LYS 29 -9.292 2.516 3.871
265 1HZ LYS 29 1HZ LYS 29 -7.653 3.391 5.171
266 2HZ LYS 29 2HZ LYS 29 -8.599 4.694 5.709
267 3HZ LYS 29 3HZ LYS 29 -7.938 4.712 4.147
268 H CYS 30 H CYS 30 -8.023 2.534 -0.332
269 HA CYS 30 HA CYS 30 -6.722 4.963 0.278
270 1HB CYS 30 2HB CYS 30 -5.893 2.412 -0.097
271 2HB CYS 30 1HB CYS 30 -5.429 3.112 -1.641
272 H GLY 31 H GLY 31 -7.514 3.405 -2.826
273 1HA GLY 31 1HA GLY 31 -6.745 5.791 -4.295
274 2HA GLY 31 2HA GLY 31 -7.314 4.275 -4.986
275 H TRP 32 H TRP 32 -8.722 6.562 -2.657
276 HA TRP 32 HA TRP 32 -11.332 6.363 -3.812
277 1HB TRP 32 2HB TRP 32 -10.411 7.123 -1.380
278 2HB TRP 32 1HB TRP 32 -10.720 8.699 -2.112
279 HD1 TRP 32 HD TRP 32 -12.530 5.513 -0.993
280 HE1 TRP 32 1HE TRP 32 -15.055 6.002 -0.897
281 HE3 TRP 32 3HE TRP 32 -12.520 10.211 -3.013
282 HZ2 TRP 32 2HZ TRP 32 -16.793 8.096 -1.582
283 HZ3 TRP 32 3HZ TRP 32 -14.668 11.395 -3.253
284 HH2 TRP 32 HH TRP 32 -16.764 10.358 -2.547
285 H PHE 33 H PHE 33 -8.755 8.787 -3.888
286 HA PHE 33 HA PHE 33 -9.863 9.849 -6.366
287 1HB PHE 33 2HB PHE 33 -10.397 11.158 -3.999
288 2HB PHE 33 1HB PHE 33 -8.947 11.982 -4.573
289 HD1 PHE 33 1HD PHE 33 -11.934 10.585 -6.327
290 HD2 PHE 33 2HD PHE 33 -9.522 13.994 -5.504
291 HE1 PHE 33 1HE PHE 33 -13.308 11.923 -7.867
292 HE2 PHE 33 2HE PHE 33 -10.893 15.338 -7.041
293 HZ PHE 33 HZ PHE 33 -12.787 14.303 -8.228
Start of MODEL 9
1 1H GLY 1 1H GLY 1 17.856 -15.636 7.494
2 2H GLY 1 2H GLY 1 19.510 -15.960 7.299
3 3H GLY 1 3H GLY 1 18.386 -17.227 7.236
4 1HA GLY 1 2HA GLY 1 19.397 -15.895 5.092
5 2HA GLY 1 1HA GLY 1 17.961 -16.915 5.094
6 H SER 2 H SER 2 18.185 -14.844 3.302
7 HA SER 2 HA SER 2 16.461 -12.733 4.410
8 1HB SER 2 2HB SER 2 17.713 -12.515 1.705
9 2HB SER 2 1HB SER 2 17.379 -11.255 2.894
10 HG SER 2 HG SER 2 19.087 -12.213 4.182
11 H ARG 3 H ARG 3 14.435 -13.566 4.253
12 HA ARG 3 HA ARG 3 13.536 -14.325 1.550
13 1HB ARG 3 2HB ARG 3 13.550 -16.132 3.392
14 2HB ARG 3 1HB ARG 3 12.197 -15.247 4.084
15 1HG ARG 3 2HG ARG 3 11.055 -16.748 2.821
16 2HG ARG 3 1HG ARG 3 11.257 -15.468 1.623
17 1HD ARG 3 2HD ARG 3 11.782 -17.756 0.784
18 2HD ARG 3 1HD ARG 3 13.104 -16.600 0.620
19 HE ARG 3 HE ARG 3 12.993 -18.544 2.846
20 1HH1 ARG 3 2HH1 ARG 3 14.675 -17.013 0.180
21 2HH1 ARG 3 1HH1 ARG 3 16.189 -17.802 0.517
22 1HH2 ARG 3 2HH2 ARG 3 14.969 -19.598 3.289
23 2HH2 ARG 3 1HH2 ARG 3 16.364 -19.248 2.311
24 H LEU 4 H LEU 4 12.057 -13.054 0.692
25 HA LEU 4 HA LEU 4 10.333 -11.471 2.469
26 1HB LEU 4 2HB LEU 4 12.398 -10.382 1.016
27 2HB LEU 4 1HB LEU 4 11.030 -10.157 -0.056
28 HG LEU 4 HG LEU 4 11.602 -8.248 1.540
29 1HD1 LEU 4 1HD1 LEU 4 9.559 -8.193 0.343
30 2HD1 LEU 4 2HD1 LEU 4 8.842 -9.427 1.381
31 3HD1 LEU 4 3HD1 LEU 4 9.180 -7.819 2.025
32 1HD2 LEU 4 1HD2 LEU 4 11.482 -10.242 3.439
33 2HD2 LEU 4 2HD2 LEU 4 11.480 -8.504 3.750
34 3HD2 LEU 4 3HD2 LEU 4 9.954 -9.383 3.645
35 HA PRO 5 HA PRO 5 7.531 -13.715 -0.278
36 1HB PRO 5 2HB PRO 5 5.515 -12.629 1.570
37 2HB PRO 5 1HB PRO 5 5.855 -14.306 1.141
38 1HG PRO 5 2HG PRO 5 6.480 -13.308 3.555
39 2HG PRO 5 1HG PRO 5 7.489 -14.528 2.755
40 1HD PRO 5 2HD PRO 5 7.913 -11.574 2.992
41 2HD PRO 5 1HD PRO 5 9.096 -12.896 3.102
42 H LYS 6 H LYS 6 6.206 -13.040 -1.894
43 HA LYS 6 HA LYS 6 5.973 -10.155 -2.279
44 1HB LYS 6 2HB LYS 6 5.145 -12.302 -4.229
45 2HB LYS 6 1HB LYS 6 5.521 -10.619 -4.567
46 1HG LYS 6 2HG LYS 6 7.665 -12.294 -3.393
47 2HG LYS 6 1HG LYS 6 7.220 -12.576 -5.078
48 1HD LYS 6 2HD LYS 6 8.310 -10.751 -5.733
49 2HD LYS 6 1HD LYS 6 7.445 -9.756 -4.561
50 1HE LYS 6 2HE LYS 6 9.163 -11.029 -2.927
51 2HE LYS 6 1HE LYS 6 10.121 -10.986 -4.407
52 1HZ LYS 6 1HZ LYS 6 9.684 -8.563 -4.495
53 2HZ LYS 6 2HZ LYS 6 10.585 -9.038 -3.138
54 3HZ LYS 6 3HZ LYS 6 8.936 -8.674 -2.975
55 H LEU 7 H LEU 7 4.379 -9.795 -0.704
56 HA LEU 7 HA LEU 7 1.891 -11.195 -0.751
57 1HB LEU 7 2HB LEU 7 3.111 -9.022 0.825
58 2HB LEU 7 1HB LEU 7 1.368 -8.955 0.696
59 HG LEU 7 HG LEU 7 1.724 -10.118 2.674
60 1HD1 LEU 7 1HD1 LEU 7 0.125 -11.458 1.771
61 2HD1 LEU 7 2HD1 LEU 7 1.106 -11.863 0.362
62 3HD1 LEU 7 3HD1 LEU 7 1.420 -12.650 1.909
63 1HD2 LEU 7 1HD2 LEU 7 4.098 -11.165 1.274
64 2HD2 LEU 7 2HD2 LEU 7 3.897 -10.651 2.948
65 3HD2 LEU 7 3HD2 LEU 7 3.333 -12.242 2.441
66 H TYR 8 H TYR 8 0.329 -8.736 -0.222
67 HA TYR 8 HA TYR 8 -0.129 -7.962 -3.021
68 1HB TYR 8 2HB TYR 8 -2.133 -7.793 -0.764
69 2HB TYR 8 1HB TYR 8 -2.445 -7.722 -2.501
70 HD1 TYR 8 1HD TYR 8 -1.841 -9.896 0.358
71 HD2 TYR 8 2HD TYR 8 -2.348 -9.764 -3.860
72 HE1 TYR 8 1HE TYR 8 -2.163 -12.329 0.330
73 HE2 TYR 8 2HE TYR 8 -2.689 -12.194 -3.899
74 HH TYR 8 HH TYR 8 -2.154 -14.171 -1.061
75 H LEU 9 H LEU 9 0.736 -6.095 -3.426
76 HA LEU 9 HA LEU 9 1.351 -4.254 -1.312
77 1HB LEU 9 2HB LEU 9 2.717 -5.017 -3.427
78 2HB LEU 9 1HB LEU 9 1.870 -3.686 -4.193
79 HG LEU 9 HG LEU 9 2.837 -2.105 -2.640
80 1HD1 LEU 9 1HD1 LEU 9 4.799 -3.516 -1.275
81 2HD1 LEU 9 2HD1 LEU 9 3.329 -2.819 -0.590
82 3HD1 LEU 9 3HD1 LEU 9 3.349 -4.505 -1.109
83 1HD2 LEU 9 1HD2 LEU 9 4.139 -2.691 -4.622
84 2HD2 LEU 9 2HD2 LEU 9 5.195 -2.330 -3.259
85 3HD2 LEU 9 3HD2 LEU 9 4.913 -4.003 -3.734
86 H CYS 10 H CYS 10 0.574 -2.243 -0.965
87 HA CYS 10 HA CYS 10 -1.693 -1.294 -2.503
88 1HB CYS 10 2HB CYS 10 -2.015 -0.858 -0.176
89 2HB CYS 10 1HB CYS 10 -0.356 -0.303 0.025
90 H GLU 11 H GLU 11 -1.456 0.189 -4.000
91 HA GLU 11 HA GLU 11 1.142 0.833 -4.960
92 1HB GLU 11 2HB GLU 11 -1.652 1.289 -5.850
93 2HB GLU 11 1HB GLU 11 -0.434 2.393 -6.477
94 1HG GLU 11 2HG GLU 11 0.397 0.862 -7.853
95 2HG GLU 11 1HG GLU 11 0.387 -0.389 -6.615
96 H PHE 12 H PHE 12 -0.574 2.188 -2.487
97 HA PHE 12 HA PHE 12 0.612 4.847 -2.968
98 1HB PHE 12 2HB PHE 12 -1.823 4.308 -1.268
99 2HB PHE 12 1HB PHE 12 -1.233 5.864 -1.845
100 HD1 PHE 12 1HD PHE 12 -3.425 3.143 -2.472
101 HD2 PHE 12 2HD PHE 12 -1.226 6.244 -4.383
102 HE1 PHE 12 1HE PHE 12 -4.865 2.937 -4.455
103 HE2 PHE 12 2HE PHE 12 -2.664 6.044 -6.370
104 HZ PHE 12 HZ PHE 12 -4.489 4.389 -6.406
105 H CYS 13 H CYS 13 -0.044 2.340 -0.568
106 HA CYS 13 HA CYS 13 1.586 3.756 1.423
107 1HB CYS 13 2HB CYS 13 0.135 1.106 1.587
108 2HB CYS 13 1HB CYS 13 0.998 1.876 2.912
109 H LEU 14 H LEU 14 1.525 1.040 -0.704
110 HA LEU 14 HA LEU 14 2.984 -0.501 -1.358
111 1HB LEU 14 2HB LEU 14 5.019 1.481 -0.356
112 2HB LEU 14 1HB LEU 14 5.407 0.052 -1.300
113 HG LEU 14 HG LEU 14 3.398 1.938 -2.421
114 1HD1 LEU 14 1HD1 LEU 14 5.005 3.533 -1.741
115 2HD1 LEU 14 2HD1 LEU 14 6.342 2.510 -2.268
116 3HD1 LEU 14 3HD1 LEU 14 5.266 3.241 -3.461
117 1HD2 LEU 14 1HD2 LEU 14 3.843 -0.040 -3.661
118 2HD2 LEU 14 2HD2 LEU 14 4.611 1.300 -4.515
119 3HD2 LEU 14 3HD2 LEU 14 5.586 0.202 -3.535
120 H LYS 15 H LYS 15 1.757 -0.737 1.087
121 HA LYS 15 HA LYS 15 3.730 -2.128 2.759
122 1HB LYS 15 2HB LYS 15 0.831 -1.535 3.398
123 2HB LYS 15 1HB LYS 15 2.044 -2.172 4.500
124 1HG LYS 15 2HG LYS 15 2.321 0.520 3.204
125 2HG LYS 15 1HG LYS 15 1.441 0.284 4.715
126 1HD LYS 15 2HD LYS 15 3.331 -0.093 5.914
127 2HD LYS 15 1HD LYS 15 4.145 -0.902 4.573
128 1HE LYS 15 2HE LYS 15 5.356 1.061 4.816
129 2HE LYS 15 1HE LYS 15 4.242 1.433 3.502
130 1HZ LYS 15 1HZ LYS 15 3.446 2.077 6.253
131 2HZ LYS 15 2HZ LYS 15 3.028 2.843 4.801
132 3HZ LYS 15 3HZ LYS 15 4.566 3.080 5.469
133 H TYR 16 H TYR 16 3.275 -4.311 3.386
134 HA TYR 16 HA TYR 16 2.056 -5.749 1.190
135 1HB TYR 16 2HB TYR 16 3.764 -6.604 3.521
136 2HB TYR 16 1HB TYR 16 3.063 -7.750 2.379
137 HD1 TYR 16 1HD TYR 16 5.954 -6.028 3.121
138 HD2 TYR 16 2HD TYR 16 3.442 -6.937 -0.185
139 HE1 TYR 16 1HE TYR 16 7.841 -5.645 1.591
140 HE2 TYR 16 2HE TYR 16 5.314 -6.542 -1.727
141 HH TYR 16 HH TYR 16 7.839 -4.918 -1.191
142 H MET 17 H MET 17 -0.029 -6.087 1.263
143 HA MET 17 HA MET 17 -1.463 -6.480 3.748
144 1HB MET 17 2HB MET 17 -2.318 -6.562 0.866
145 2HB MET 17 1HB MET 17 -3.421 -6.826 2.201
146 1HG MET 17 2HG MET 17 -1.818 -4.327 1.724
147 2HG MET 17 1HG MET 17 -3.520 -4.538 1.329
148 1HE MET 17 1HE MET 17 -1.588 -2.946 4.817
149 2HE MET 17 2HE MET 17 -1.367 -2.868 3.069
150 3HE MET 17 3HE MET 17 -2.681 -1.974 3.836
151 H LYS 18 H LYS 18 -2.230 -8.386 4.527
152 HA LYS 18 HA LYS 18 -0.715 -10.660 3.729
153 1HB LYS 18 2HB LYS 18 -2.152 -9.824 6.036
154 2HB LYS 18 1HB LYS 18 -2.734 -11.422 5.588
155 1HG LYS 18 2HG LYS 18 -1.004 -12.031 6.918
156 2HG LYS 18 1HG LYS 18 -0.137 -11.902 5.386
157 1HD LYS 18 2HD LYS 18 -0.341 -9.398 6.906
158 2HD LYS 18 1HD LYS 18 0.607 -10.662 7.690
159 1HE LYS 18 2HE LYS 18 1.447 -10.725 5.053
160 2HE LYS 18 1HE LYS 18 1.244 -9.007 5.393
161 1HZ LYS 18 1HZ LYS 18 2.624 -9.359 7.412
162 2HZ LYS 18 2HZ LYS 18 3.457 -9.613 5.955
163 3HZ LYS 18 3HZ LYS 18 2.939 -10.938 6.877
164 H SER 19 H SER 19 -4.076 -9.744 3.323
165 HA SER 19 HA SER 19 -4.467 -12.232 1.803
166 1HB SER 19 2HB SER 19 -6.758 -10.771 3.069
167 2HB SER 19 1HB SER 19 -6.635 -12.472 2.622
168 HG SER 19 HG SER 19 -4.931 -12.537 4.317
169 H ARG 20 H ARG 20 -5.576 -12.126 -0.121
170 HA ARG 20 HA ARG 20 -5.197 -9.835 -1.681
171 1HB ARG 20 2HB ARG 20 -5.592 -12.360 -2.296
172 2HB ARG 20 1HB ARG 20 -7.276 -11.863 -2.402
173 1HG ARG 20 2HG ARG 20 -6.638 -10.141 -4.043
174 2HG ARG 20 1HG ARG 20 -4.972 -10.717 -3.964
175 1HD ARG 20 2HD ARG 20 -6.255 -11.606 -5.899
176 2HD ARG 20 1HD ARG 20 -5.606 -12.855 -4.839
177 HE ARG 20 HE ARG 20 -7.824 -13.184 -3.955
178 1HH1 ARG 20 2HH1 ARG 20 -7.590 -11.242 -6.865
179 2HH1 ARG 20 1HH1 ARG 20 -9.271 -11.445 -7.289
180 1HH2 ARG 20 2HH2 ARG 20 -10.034 -13.472 -4.508
181 2HH2 ARG 20 1HH2 ARG 20 -10.648 -12.756 -5.974
182 H THR 21 H THR 21 -8.140 -11.128 -0.167
183 HA THR 21 HA THR 21 -9.863 -9.132 -1.180
184 HB THR 21 HB THR 21 -10.230 -11.479 0.171
185 HG1 THR 21 1HG THR 21 -11.666 -10.227 -1.274
186 1HG2 THR 21 1HG2 THR 21 -11.289 -11.118 2.257
187 2HG2 THR 21 2HG2 THR 21 -11.282 -9.366 2.042
188 3HG2 THR 21 3HG2 THR 21 -9.769 -10.228 2.324
189 H ILE 22 H ILE 22 -7.600 -9.152 1.422
190 HA ILE 22 HA ILE 22 -8.704 -6.894 2.819
191 HB ILE 22 HB ILE 22 -6.276 -8.574 3.061
192 1HG1 ILE 22 2HG1 ILE 22 -7.873 -7.267 5.247
193 1HG2 ILE 22 1HG2 ILE 22 -5.554 -6.084 2.894
194 2HG2 ILE 22 2HG2 ILE 22 -6.237 -5.969 4.517
195 3HG2 ILE 22 3HG2 ILE 22 -4.919 -7.095 4.191
196 1HD1 ILE 22 1HD1 ILE 22 -7.464 -9.550 6.285
197 2HD1 ILE 22 2HD1 ILE 22 -6.256 -9.772 5.020
198 3HD1 ILE 22 3HD1 ILE 22 -6.090 -8.445 6.173
199 H LEU 23 H LEU 23 -6.222 -7.457 0.371
200 HA LEU 23 HA LEU 23 -5.268 -4.799 0.267
201 1HB LEU 23 2HB LEU 23 -4.291 -7.024 -0.710
202 2HB LEU 23 1HB LEU 23 -5.229 -6.593 -2.125
203 HG LEU 23 HG LEU 23 -2.630 -5.772 -1.486
204 1HD1 LEU 23 1HD1 LEU 23 -3.043 -4.318 -3.564
205 2HD1 LEU 23 2HD1 LEU 23 -3.193 -6.068 -3.704
206 3HD1 LEU 23 3HD1 LEU 23 -4.639 -5.067 -3.578
207 1HD2 LEU 23 1HD2 LEU 23 -4.630 -3.617 -0.978
208 2HD2 LEU 23 2HD2 LEU 23 -3.118 -3.967 -0.140
209 3HD2 LEU 23 3HD2 LEU 23 -3.089 -3.219 -1.736
210 H GLN 24 H GLN 24 -7.668 -6.529 -1.753
211 HA GLN 24 HA GLN 24 -8.216 -4.289 -3.387
212 1HB GLN 24 2HB GLN 24 -10.297 -5.514 -4.024
213 2HB GLN 24 1HB GLN 24 -8.822 -6.450 -4.203
214 1HG GLN 24 2HG GLN 24 -9.839 -8.057 -3.076
215 2HG GLN 24 1HG GLN 24 -9.679 -7.040 -1.644
216 1HE2 GLN 24 1HE2 GLN 24 -11.485 -6.857 -0.567
217 2HE2 GLN 24 2HE2 GLN 24 -13.087 -6.801 -1.233
218 H GLN 25 H GLN 25 -9.291 -5.182 -0.233
219 HA GLN 25 HA GLN 25 -11.512 -3.348 -0.145
220 1HB GLN 25 2HB GLN 25 -10.116 -5.137 1.766
221 2HB GLN 25 1HB GLN 25 -10.889 -3.719 2.460
222 1HG GLN 25 2HG GLN 25 -12.968 -4.461 1.159
223 2HG GLN 25 1HG GLN 25 -12.133 -6.004 0.982
224 1HE2 GLN 25 1HE2 GLN 25 -13.253 -7.318 2.288
225 2HE2 GLN 25 2HE2 GLN 25 -13.514 -7.040 3.980
226 H HIS 26 H HIS 26 -8.142 -3.393 0.854
227 HA HIS 26 HA HIS 26 -8.136 -0.858 2.091
228 1HB HIS 26 2HB HIS 26 -6.425 -2.467 2.646
229 2HB HIS 26 1HB HIS 26 -5.890 -2.548 0.971
230 HD1 HIS 26 1HD HIS 26 -5.263 -0.754 4.124
231 HD2 HIS 26 2HD HIS 26 -4.654 -0.088 0.053
232 HE1 HIS 26 1HE HIS 26 -3.615 1.179 3.938
233 H MET 27 H MET 27 -6.969 -1.903 -1.108
234 HA MET 27 HA MET 27 -6.028 0.647 -1.806
235 1HB MET 27 2HB MET 27 -6.414 -1.923 -3.227
236 2HB MET 27 1HB MET 27 -6.241 -0.480 -4.217
237 1HG MET 27 2HG MET 27 -4.232 -0.299 -2.290
238 2HG MET 27 1HG MET 27 -4.242 -1.986 -2.809
239 1HE MET 27 1HE MET 27 -3.801 -2.881 -4.798
240 2HE MET 27 2HE MET 27 -4.560 -2.045 -6.150
241 3HE MET 27 3HE MET 27 -2.803 -2.179 -6.072
242 H LYS 28 H LYS 28 -9.194 -0.582 -1.832
243 HA LYS 28 HA LYS 28 -10.137 1.306 -3.832
244 1HB LYS 28 2HB LYS 28 -11.284 -0.952 -2.335
245 2HB LYS 28 1HB LYS 28 -12.385 0.403 -2.558
246 1HG LYS 28 2HG LYS 28 -12.577 -1.294 -4.326
247 2HG LYS 28 1HG LYS 28 -12.112 0.290 -4.949
248 1HD LYS 28 2HD LYS 28 -10.154 -0.470 -5.718
249 2HD LYS 28 1HD LYS 28 -9.826 -1.378 -4.237
250 1HE LYS 28 2HE LYS 28 -11.059 -3.235 -4.990
251 2HE LYS 28 1HE LYS 28 -11.814 -2.314 -6.287
252 1HZ LYS 28 1HZ LYS 28 -9.734 -2.200 -7.440
253 2HZ LYS 28 2HZ LYS 28 -10.045 -3.823 -7.055
254 3HZ LYS 28 3HZ LYS 28 -8.914 -2.939 -6.151
255 H LYS 29 H LYS 29 -9.404 1.201 -0.553
256 HA LYS 29 HA LYS 29 -11.093 3.472 0.151
257 1HB LYS 29 2HB LYS 29 -10.834 1.586 1.752
258 2HB LYS 29 1HB LYS 29 -9.111 1.919 1.829
259 1HG LYS 29 2HG LYS 29 -10.664 4.284 2.404
260 2HG LYS 29 1HG LYS 29 -11.090 2.948 3.475
261 1HD LYS 29 2HD LYS 29 -8.279 2.947 3.235
262 2HD LYS 29 1HD LYS 29 -8.771 4.618 3.518
263 1HE LYS 29 2HE LYS 29 -10.012 3.950 5.486
264 2HE LYS 29 1HE LYS 29 -9.620 2.256 5.189
265 1HZ LYS 29 1HZ LYS 29 -7.272 3.858 5.268
266 2HZ LYS 29 2HZ LYS 29 -7.675 2.502 6.204
267 3HZ LYS 29 3HZ LYS 29 -8.174 4.049 6.691
268 H CYS 30 H CYS 30 -7.741 2.519 -0.215
269 HA CYS 30 HA CYS 30 -6.573 5.045 0.342
270 1HB CYS 30 2HB CYS 30 -5.669 2.458 -0.121
271 2HB CYS 30 1HB CYS 30 -5.098 3.354 -1.519
272 H GLY 31 H GLY 31 -7.281 3.313 -2.684
273 1HA GLY 31 1HA GLY 31 -6.780 5.720 -4.244
274 2HA GLY 31 2HA GLY 31 -7.173 4.123 -4.877
275 H TRP 32 H TRP 32 -8.703 6.536 -2.751
276 HA TRP 32 HA TRP 32 -11.326 5.858 -3.769
277 1HB TRP 32 2HB TRP 32 -10.449 6.834 -1.378
278 2HB TRP 32 1HB TRP 32 -11.059 8.296 -2.149
279 HD1 TRP 32 HD TRP 32 -12.232 4.834 -0.971
280 HE1 TRP 32 1HE TRP 32 -14.799 4.870 -0.748
281 HE3 TRP 32 3HE TRP 32 -13.139 9.484 -2.889
282 HZ2 TRP 32 2HZ TRP 32 -16.902 6.643 -1.300
283 HZ3 TRP 32 3HZ TRP 32 -15.464 10.278 -2.998
284 HH2 TRP 32 HH TRP 32 -17.312 8.882 -2.217
285 H PHE 33 H PHE 33 -9.791 9.049 -3.405
286 HA PHE 33 HA PHE 33 -9.775 9.712 -6.124
287 1HB PHE 33 2HB PHE 33 -12.354 9.930 -4.951
288 2HB PHE 33 1HB PHE 33 -11.748 11.568 -5.189
289 HD1 PHE 33 1HD PHE 33 -10.711 12.039 -7.549
290 HD2 PHE 33 2HD PHE 33 -13.421 8.873 -6.696
291 HE1 PHE 33 1HE PHE 33 -11.307 11.909 -9.931
292 HE2 PHE 33 2HE PHE 33 -14.027 8.742 -9.077
293 HZ PHE 33 HZ PHE 33 -12.965 10.262 -10.699
Start of MODEL 10
1 1H GLY 1 1H GLY 1 10.498 -8.733 -0.328
2 2H GLY 1 2H GLY 1 11.670 -7.537 -0.593
3 3H GLY 1 3H GLY 1 11.410 -8.140 0.970
4 1HA GLY 1 2HA GLY 1 11.978 -10.329 -0.658
5 2HA GLY 1 1HA GLY 1 13.173 -9.087 -1.008
6 H SER 2 H SER 2 14.789 -8.721 0.413
7 HA SER 2 HA SER 2 15.277 -10.513 2.562
8 1HB SER 2 2HB SER 2 16.749 -8.081 2.887
9 2HB SER 2 1HB SER 2 17.331 -9.640 2.304
10 HG SER 2 HG SER 2 17.426 -8.810 0.385
11 H ARG 3 H ARG 3 14.019 -7.251 2.294
12 HA ARG 3 HA ARG 3 13.185 -7.358 5.117
13 1HB ARG 3 2HB ARG 3 13.519 -4.980 3.275
14 2HB ARG 3 1HB ARG 3 12.820 -4.895 4.885
15 1HG ARG 3 2HG ARG 3 15.370 -6.206 4.992
16 2HG ARG 3 1HG ARG 3 15.511 -4.647 4.178
17 1HD ARG 3 2HD ARG 3 14.227 -5.105 6.867
18 2HD ARG 3 1HD ARG 3 15.851 -4.471 6.608
19 HE ARG 3 HE ARG 3 14.296 -2.772 5.188
20 1HH1 ARG 3 2HH1 ARG 3 14.203 -3.917 8.495
21 2HH1 ARG 3 1HH1 ARG 3 13.462 -2.469 9.112
22 1HH2 ARG 3 2HH2 ARG 3 13.337 -0.862 5.988
23 2HH2 ARG 3 1HH2 ARG 3 12.950 -0.738 7.681
24 H LEU 4 H LEU 4 11.132 -7.762 5.442
25 HA LEU 4 HA LEU 4 8.886 -7.948 5.197
26 1HB LEU 4 2HB LEU 4 9.413 -5.932 3.051
27 2HB LEU 4 1HB LEU 4 7.834 -6.688 3.165
28 HG LEU 4 HG LEU 4 8.942 -5.507 5.655
29 1HD1 LEU 4 1HD1 LEU 4 8.688 -3.310 5.092
30 2HD1 LEU 4 2HD1 LEU 4 9.287 -3.944 3.559
31 3HD1 LEU 4 3HD1 LEU 4 7.561 -3.662 3.782
32 1HD2 LEU 4 1HD2 LEU 4 6.701 -6.689 5.344
33 2HD2 LEU 4 2HD2 LEU 4 6.691 -5.129 6.166
34 3HD2 LEU 4 3HD2 LEU 4 6.199 -5.238 4.475
35 HA PRO 5 HA PRO 5 8.820 -11.439 2.506
36 1HB PRO 5 2HB PRO 5 6.007 -11.778 3.174
37 2HB PRO 5 1HB PRO 5 7.390 -12.765 3.654
38 1HG PRO 5 2HG PRO 5 6.001 -11.207 5.396
39 2HG PRO 5 1HG PRO 5 7.722 -11.583 5.591
40 1HD PRO 5 2HD PRO 5 6.431 -9.102 4.528
41 2HD PRO 5 1HD PRO 5 7.844 -9.269 5.595
42 H LYS 6 H LYS 6 7.107 -12.432 0.893
43 HA LYS 6 HA LYS 6 6.476 -10.281 -0.972
44 1HB LYS 6 2HB LYS 6 7.450 -12.877 -1.301
45 2HB LYS 6 1HB LYS 6 5.790 -12.955 -1.876
46 1HG LYS 6 2HG LYS 6 6.389 -10.849 -3.228
47 2HG LYS 6 1HG LYS 6 8.063 -11.307 -2.907
48 1HD LYS 6 2HD LYS 6 7.964 -12.734 -4.606
49 2HD LYS 6 1HD LYS 6 6.727 -13.644 -3.738
50 1HE LYS 6 2HE LYS 6 5.553 -11.317 -4.922
51 2HE LYS 6 1HE LYS 6 6.456 -12.210 -6.145
52 1HZ LYS 6 1HZ LYS 6 4.323 -13.300 -4.385
53 2HZ LYS 6 2HZ LYS 6 5.236 -14.219 -5.480
54 3HZ LYS 6 3HZ LYS 6 4.202 -13.002 -6.053
55 H LEU 7 H LEU 7 4.617 -9.328 -0.425
56 HA LEU 7 HA LEU 7 2.257 -11.052 -0.057
57 1HB LEU 7 2HB LEU 7 3.163 -8.629 1.409
58 2HB LEU 7 1HB LEU 7 1.446 -8.813 1.148
59 HG LEU 7 HG LEU 7 1.733 -9.730 3.245
60 1HD1 LEU 7 1HD1 LEU 7 0.546 -11.489 2.566
61 2HD1 LEU 7 2HD1 LEU 7 1.493 -11.668 1.089
62 3HD1 LEU 7 3HD1 LEU 7 2.071 -12.375 2.598
63 1HD2 LEU 7 1HD2 LEU 7 3.966 -9.768 3.714
64 2HD2 LEU 7 2HD2 LEU 7 3.666 -11.496 3.541
65 3HD2 LEU 7 3HD2 LEU 7 4.385 -10.588 2.210
66 H TYR 8 H TYR 8 0.597 -8.635 0.046
67 HA TYR 8 HA TYR 8 0.459 -8.113 -2.837
68 1HB TYR 8 2HB TYR 8 -1.656 -7.707 -0.703
69 2HB TYR 8 1HB TYR 8 -1.876 -7.498 -2.439
70 HD1 TYR 8 1HD TYR 8 -2.834 -9.222 -3.617
71 HD2 TYR 8 2HD TYR 8 -0.774 -10.124 -0.012
72 HE1 TYR 8 1HE TYR 8 -3.503 -11.572 -3.830
73 HE2 TYR 8 2HE TYR 8 -1.425 -12.473 -0.211
74 HH TYR 8 HH TYR 8 -2.137 -13.994 -2.547
75 H LEU 9 H LEU 9 1.741 -6.381 -3.180
76 HA LEU 9 HA LEU 9 1.919 -4.220 -1.307
77 1HB LEU 9 2HB LEU 9 3.787 -5.022 -2.755
78 2HB LEU 9 1HB LEU 9 2.942 -4.358 -4.139
79 HG LEU 9 HG LEU 9 3.169 -2.103 -3.228
80 1HD1 LEU 9 1HD1 LEU 9 3.150 -2.160 -0.954
81 2HD1 LEU 9 2HD1 LEU 9 4.181 -3.589 -0.868
82 3HD1 LEU 9 3HD1 LEU 9 4.887 -2.015 -1.232
83 1HD2 LEU 9 1HD2 LEU 9 5.734 -3.682 -3.308
84 2HD2 LEU 9 2HD2 LEU 9 4.934 -2.887 -4.664
85 3HD2 LEU 9 3HD2 LEU 9 5.634 -1.921 -3.363
86 H CYS 10 H CYS 10 0.499 -2.627 -1.124
87 HA CYS 10 HA CYS 10 -1.582 -2.136 -2.917
88 1HB CYS 10 2HB CYS 10 -2.299 -1.005 -1.137
89 2HB CYS 10 1HB CYS 10 -0.782 -1.363 -0.348
90 H GLU 11 H GLU 11 1.622 -0.852 -2.612
91 HA GLU 11 HA GLU 11 2.982 0.272 -4.015
92 1HB GLU 11 2HB GLU 11 0.757 -0.443 -5.885
93 2HB GLU 11 1HB GLU 11 2.068 0.596 -6.426
94 1HG GLU 11 2HG GLU 11 3.684 -1.135 -5.810
95 2HG GLU 11 1HG GLU 11 2.355 -2.182 -5.314
96 H PHE 12 H PHE 12 0.255 1.571 -2.826
97 HA PHE 12 HA PHE 12 0.851 4.212 -4.011
98 1HB PHE 12 2HB PHE 12 -1.704 3.260 -2.696
99 2HB PHE 12 1HB PHE 12 -1.414 4.894 -3.280
100 HD1 PHE 12 1HD PHE 12 -0.546 4.947 -5.820
101 HD2 PHE 12 2HD PHE 12 -2.918 1.876 -4.063
102 HE1 PHE 12 1HE PHE 12 -1.349 4.297 -8.054
103 HE2 PHE 12 2HE PHE 12 -3.723 1.223 -6.290
104 HZ PHE 12 HZ PHE 12 -2.941 2.430 -8.290
105 H CYS 13 H CYS 13 -0.166 2.609 -1.034
106 HA CYS 13 HA CYS 13 1.206 4.644 0.583
107 1HB CYS 13 2HB CYS 13 -0.137 2.232 1.759
108 2HB CYS 13 1HB CYS 13 0.075 3.833 2.457
109 H LEU 14 H LEU 14 1.460 1.631 -0.903
110 HA LEU 14 HA LEU 14 3.100 0.103 -1.114
111 1HB LEU 14 2HB LEU 14 4.746 2.098 0.431
112 2HB LEU 14 1HB LEU 14 5.388 0.674 -0.367
113 HG LEU 14 HG LEU 14 3.807 2.539 -2.045
114 1HD1 LEU 14 1HD1 LEU 14 5.792 3.584 -0.392
115 2HD1 LEU 14 2HD1 LEU 14 6.547 3.400 -1.976
116 3HD1 LEU 14 3HD1 LEU 14 5.066 4.342 -1.807
117 1HD2 LEU 14 1HD2 LEU 14 4.631 0.931 -3.393
118 2HD2 LEU 14 2HD2 LEU 14 6.055 1.973 -3.397
119 3HD2 LEU 14 3HD2 LEU 14 5.989 0.575 -2.324
120 H LYS 15 H LYS 15 1.243 -0.149 0.930
121 HA LYS 15 HA LYS 15 2.756 -1.493 3.059
122 1HB LYS 15 2HB LYS 15 0.239 -0.114 2.989
123 2HB LYS 15 1HB LYS 15 -0.042 -1.789 3.443
124 1HG LYS 15 2HG LYS 15 0.347 -0.137 5.323
125 2HG LYS 15 1HG LYS 15 1.316 -1.612 5.351
126 1HD LYS 15 2HD LYS 15 3.263 -0.503 4.823
127 2HD LYS 15 1HD LYS 15 2.417 0.801 3.986
128 1HE LYS 15 2HE LYS 15 3.035 1.912 5.875
129 2HE LYS 15 1HE LYS 15 1.485 1.270 6.416
130 1HZ LYS 15 1HZ LYS 15 2.681 -0.591 7.434
131 2HZ LYS 15 2HZ LYS 15 3.172 0.900 8.074
132 3HZ LYS 15 3HZ LYS 15 4.160 0.094 6.956
133 H TYR 16 H TYR 16 2.174 -3.725 3.550
134 HA TYR 16 HA TYR 16 1.457 -5.175 1.096
135 1HB TYR 16 2HB TYR 16 3.181 -5.868 3.462
136 2HB TYR 16 1HB TYR 16 2.583 -7.112 2.370
137 HD1 TYR 16 1HD TYR 16 5.134 -4.703 2.963
138 HD2 TYR 16 2HD TYR 16 3.138 -6.835 -0.129
139 HE1 TYR 16 1HE TYR 16 7.041 -4.303 1.464
140 HE2 TYR 16 2HE TYR 16 5.035 -6.430 -1.641
141 HH TYR 16 HH TYR 16 7.778 -4.415 -0.648
142 H MET 17 H MET 17 -0.411 -6.210 1.014
143 HA MET 17 HA MET 17 -1.944 -6.597 3.472
144 1HB MET 17 2HB MET 17 -2.800 -7.311 0.665
145 2HB MET 17 1HB MET 17 -3.820 -7.099 2.079
146 1HG MET 17 2HG MET 17 -2.513 -5.046 0.361
147 2HG MET 17 1HG MET 17 -4.184 -5.168 0.904
148 1HE MET 17 1HE MET 17 -2.128 -2.978 0.604
149 2HE MET 17 2HE MET 17 -2.523 -1.876 1.923
150 3HE MET 17 3HE MET 17 -0.992 -2.749 1.934
151 H LYS 18 H LYS 18 -2.695 -8.629 4.154
152 HA LYS 18 HA LYS 18 -0.847 -10.762 3.617
153 1HB LYS 18 2HB LYS 18 -3.351 -10.725 5.315
154 2HB LYS 18 1HB LYS 18 -2.150 -12.008 5.301
155 1HG LYS 18 2HG LYS 18 -1.708 -9.163 6.183
156 2HG LYS 18 1HG LYS 18 -1.847 -10.578 7.229
157 1HD LYS 18 2HD LYS 18 0.332 -10.966 7.017
158 2HD LYS 18 1HD LYS 18 0.156 -11.087 5.266
159 1HE LYS 18 2HE LYS 18 0.865 -8.960 4.909
160 2HE LYS 18 1HE LYS 18 0.156 -8.362 6.409
161 1HZ LYS 18 1HZ LYS 18 2.602 -8.329 6.401
162 2HZ LYS 18 2HZ LYS 18 2.617 -10.021 6.259
163 3HZ LYS 18 3HZ LYS 18 1.968 -9.293 7.646
164 H SER 19 H SER 19 -4.239 -10.109 2.898
165 HA SER 19 HA SER 19 -4.194 -12.385 1.037
166 1HB SER 19 2HB SER 19 -6.728 -11.537 2.392
167 2HB SER 19 1HB SER 19 -6.299 -13.105 1.709
168 HG SER 19 HG SER 19 -4.848 -13.400 3.448
169 H ARG 20 H ARG 20 -5.721 -12.215 -0.736
170 HA ARG 20 HA ARG 20 -5.582 -9.748 -2.077
171 1HB ARG 20 2HB ARG 20 -6.114 -12.298 -2.829
172 2HB ARG 20 1HB ARG 20 -7.732 -11.612 -2.883
173 1HG ARG 20 2HG ARG 20 -7.259 -10.274 -4.648
174 2HG ARG 20 1HG ARG 20 -5.571 -10.067 -4.176
175 1HD ARG 20 2HD ARG 20 -5.738 -12.754 -4.744
176 2HD ARG 20 1HD ARG 20 -6.791 -12.026 -5.957
177 HE ARG 20 HE ARG 20 -4.793 -10.535 -6.440
178 1HH1 ARG 20 2HH1 ARG 20 -4.485 -13.818 -5.235
179 2HH1 ARG 20 1HH1 ARG 20 -2.911 -14.061 -5.943
180 1HH2 ARG 20 2HH2 ARG 20 -2.732 -10.851 -7.367
181 2HH2 ARG 20 1HH2 ARG 20 -1.906 -12.367 -7.127
182 H THR 21 H THR 21 -8.077 -11.243 -0.130
183 HA THR 21 HA THR 21 -10.239 -9.577 -0.649
184 HB THR 21 HB THR 21 -10.443 -10.152 2.042
185 HG1 THR 21 1HG THR 21 -9.591 -12.554 1.635
186 1HG2 THR 21 1HG2 THR 21 -11.873 -11.944 1.363
187 2HG2 THR 21 2HG2 THR 21 -11.044 -12.094 -0.185
188 3HG2 THR 21 3HG2 THR 21 -12.025 -10.669 0.155
189 H ILE 22 H ILE 22 -7.622 -9.250 1.706
190 HA ILE 22 HA ILE 22 -8.525 -6.824 2.840
191 HB ILE 22 HB ILE 22 -5.820 -8.162 2.801
192 1HG1 ILE 22 2HG1 ILE 22 -7.319 -7.715 5.312
193 1HG2 ILE 22 1HG2 ILE 22 -4.842 -6.365 3.653
194 2HG2 ILE 22 2HG2 ILE 22 -6.303 -5.457 3.270
195 3HG2 ILE 22 3HG2 ILE 22 -6.110 -6.184 4.865
196 1HD1 ILE 22 1HD1 ILE 22 -6.404 -9.677 6.004
197 2HD1 ILE 22 2HD1 ILE 22 -6.382 -10.370 4.383
198 3HD1 ILE 22 3HD1 ILE 22 -5.184 -9.159 4.840
199 H LEU 23 H LEU 23 -6.276 -7.622 0.242
200 HA LEU 23 HA LEU 23 -5.260 -5.046 -0.192
201 1HB LEU 23 2HB LEU 23 -4.664 -7.470 -1.156
202 2HB LEU 23 1HB LEU 23 -5.623 -6.890 -2.499
203 HG LEU 23 HG LEU 23 -2.881 -6.281 -1.785
204 1HD1 LEU 23 1HD1 LEU 23 -4.354 -6.881 -4.027
205 2HD1 LEU 23 2HD1 LEU 23 -3.892 -5.193 -4.263
206 3HD1 LEU 23 3HD1 LEU 23 -2.653 -6.413 -3.975
207 1HD2 LEU 23 1HD2 LEU 23 -3.184 -3.863 -2.694
208 2HD2 LEU 23 2HD2 LEU 23 -4.801 -4.019 -2.006
209 3HD2 LEU 23 3HD2 LEU 23 -3.383 -4.201 -0.974
210 H GLN 24 H GLN 24 -8.019 -6.734 -1.601
211 HA GLN 24 HA GLN 24 -8.702 -4.694 -3.443
212 1HB GLN 24 2HB GLN 24 -10.381 -6.899 -2.242
213 2HB GLN 24 1HB GLN 24 -10.895 -5.871 -3.574
214 1HG GLN 24 2HG GLN 24 -8.307 -7.130 -4.026
215 2HG GLN 24 1HG GLN 24 -9.616 -8.283 -3.792
216 1HE2 GLN 24 1HE2 GLN 24 -7.933 -6.854 -6.095
217 2HE2 GLN 24 2HE2 GLN 24 -9.133 -6.701 -7.341
218 H GLN 25 H GLN 25 -9.621 -5.310 -0.097
219 HA GLN 25 HA GLN 25 -11.612 -3.237 -0.077
220 1HB GLN 25 2HB GLN 25 -12.124 -3.913 2.048
221 2HB GLN 25 1HB GLN 25 -11.331 -5.371 1.474
222 1HG GLN 25 2HG GLN 25 -9.197 -4.270 2.484
223 2HG GLN 25 1HG GLN 25 -10.361 -3.322 3.406
224 1HE2 GLN 25 1HE2 GLN 25 -10.711 -6.657 2.359
225 2HE2 GLN 25 2HE2 GLN 25 -10.724 -7.352 3.946
226 H HIS 26 H HIS 26 -8.200 -3.479 0.695
227 HA HIS 26 HA HIS 26 -7.983 -1.020 2.082
228 1HB HIS 26 2HB HIS 26 -6.163 -2.538 2.356
229 2HB HIS 26 1HB HIS 26 -5.948 -2.715 0.618
230 HD1 HIS 26 1HD HIS 26 -4.865 -0.635 3.512
231 HD2 HIS 26 2HD HIS 26 -4.738 -0.445 -0.656
232 HE1 HIS 26 1HE HIS 26 -3.249 1.237 2.914
233 H MET 27 H MET 27 -7.578 -1.919 -1.330
234 HA MET 27 HA MET 27 -6.586 0.558 -2.169
235 1HB MET 27 2HB MET 27 -7.726 -1.813 -3.526
236 2HB MET 27 1HB MET 27 -7.668 -0.321 -4.454
237 1HG MET 27 2HG MET 27 -5.256 -0.154 -3.972
238 2HG MET 27 1HG MET 27 -5.344 -1.702 -3.133
239 1HE MET 27 1HE MET 27 -3.824 -3.304 -4.479
240 2HE MET 27 2HE MET 27 -3.493 -3.021 -6.187
241 3HE MET 27 3HE MET 27 -3.191 -1.745 -5.007
242 H LYS 28 H LYS 28 -9.714 -0.253 -1.216
243 HA LYS 28 HA LYS 28 -11.147 1.722 -2.722
244 1HB LYS 28 2HB LYS 28 -11.728 -0.162 -0.551
245 2HB LYS 28 1HB LYS 28 -12.584 1.367 -0.406
246 1HG LYS 28 2HG LYS 28 -14.018 -0.041 -1.599
247 2HG LYS 28 1HG LYS 28 -13.308 1.032 -2.808
248 1HD LYS 28 2HD LYS 28 -11.559 -1.138 -2.645
249 2HD LYS 28 1HD LYS 28 -13.177 -1.847 -2.591
250 1HE LYS 28 2HE LYS 28 -13.773 -0.573 -4.616
251 2HE LYS 28 1HE LYS 28 -12.128 0.061 -4.678
252 1HZ LYS 28 1HZ LYS 28 -12.649 -1.922 -6.130
253 2HZ LYS 28 2HZ LYS 28 -12.685 -2.846 -4.704
254 3HZ LYS 28 3HZ LYS 28 -11.265 -2.037 -5.157
255 H LYS 29 H LYS 29 -9.998 1.550 0.651
256 HA LYS 29 HA LYS 29 -10.421 4.374 1.056
257 1HB LYS 29 2HB LYS 29 -9.557 4.006 3.288
258 2HB LYS 29 1HB LYS 29 -10.721 2.750 2.892
259 1HG LYS 29 2HG LYS 29 -8.106 1.874 2.146
260 2HG LYS 29 1HG LYS 29 -8.083 2.451 3.814
261 1HD LYS 29 2HD LYS 29 -10.419 0.824 3.197
262 2HD LYS 29 1HD LYS 29 -8.896 -0.042 2.984
263 1HE LYS 29 2HE LYS 29 -8.536 -0.148 5.185
264 2HE LYS 29 1HE LYS 29 -8.957 1.548 5.419
265 1HZ LYS 29 1HZ LYS 29 -11.362 0.512 4.978
266 2HZ LYS 29 2HZ LYS 29 -10.679 0.646 6.523
267 3HZ LYS 29 3HZ LYS 29 -10.605 -0.832 5.692
268 H CYS 30 H CYS 30 -8.026 2.504 -0.345
269 HA CYS 30 HA CYS 30 -5.683 3.916 0.342
270 1HB CYS 30 2HB CYS 30 -5.792 1.686 -0.814
271 2HB CYS 30 1HB CYS 30 -6.328 2.518 -2.265
272 H GLY 31 H GLY 31 -7.928 4.199 -2.387
273 1HA GLY 31 1HA GLY 31 -6.760 6.772 -3.141
274 2HA GLY 31 2HA GLY 31 -7.981 5.879 -4.043
275 H TRP 32 H TRP 32 -8.477 6.182 -0.671
276 HA TRP 32 HA TRP 32 -10.837 7.813 -1.071
277 1HB TRP 32 2HB TRP 32 -9.886 5.990 0.915
278 2HB TRP 32 1HB TRP 32 -10.284 7.528 1.684
279 HD1 TRP 32 HD TRP 32 -12.146 6.132 -1.364
280 HE1 TRP 32 1HE TRP 32 -14.601 5.744 -0.704
281 HE3 TRP 32 3HE TRP 32 -11.801 7.117 3.641
282 HZ2 TRP 32 2HZ TRP 32 -16.155 5.860 1.602
283 HZ3 TRP 32 3HZ TRP 32 -13.841 6.949 5.012
284 HH2 TRP 32 HH TRP 32 -15.981 6.329 4.013
285 H PHE 33 H PHE 33 -7.572 8.367 -0.562
286 HA PHE 33 HA PHE 33 -8.109 11.088 0.422
287 1HB PHE 33 2HB PHE 33 -5.448 9.786 0.887
288 2HB PHE 33 1HB PHE 33 -6.233 11.075 1.799
289 HD1 PHE 33 1HD PHE 33 -8.489 10.307 2.984
290 HD2 PHE 33 2HD PHE 33 -5.307 7.723 1.852
291 HE1 PHE 33 1HE PHE 33 -9.244 8.661 4.645
292 HE2 PHE 33 2HE PHE 33 -6.052 6.071 3.514
293 HZ PHE 33 HZ PHE 33 -8.026 6.536 4.913
Start of MODEL 11
1 1H GLY 1 1H GLY 1 6.920 -8.516 13.657
2 2H GLY 1 2H GLY 1 8.564 -8.165 13.865
3 3H GLY 1 3H GLY 1 7.782 -9.228 14.935
4 1HA GLY 1 2HA GLY 1 9.271 -10.092 12.960
5 2HA GLY 1 1HA GLY 1 7.853 -10.969 13.519
6 H SER 2 H SER 2 9.383 -9.832 10.843
7 HA SER 2 HA SER 2 6.875 -9.811 9.300
8 1HB SER 2 2HB SER 2 8.909 -8.207 8.031
9 2HB SER 2 1HB SER 2 7.281 -7.746 8.528
10 HG SER 2 HG SER 2 9.707 -7.576 9.968
11 H ARG 3 H ARG 3 7.832 -12.174 9.367
12 HA ARG 3 HA ARG 3 9.895 -12.594 7.358
13 1HB ARG 3 2HB ARG 3 9.256 -13.994 9.586
14 2HB ARG 3 1HB ARG 3 8.350 -14.902 8.383
15 1HG ARG 3 2HG ARG 3 11.178 -14.255 7.773
16 2HG ARG 3 1HG ARG 3 10.855 -15.483 8.998
17 1HD ARG 3 2HD ARG 3 10.804 -16.867 7.218
18 2HD ARG 3 1HD ARG 3 9.150 -16.276 7.066
19 HE ARG 3 HE ARG 3 10.918 -14.567 5.668
20 1HH1 ARG 3 2HH1 ARG 3 9.382 -17.712 5.468
21 2HH1 ARG 3 1HH1 ARG 3 9.494 -17.802 3.732
22 1HH2 ARG 3 2HH2 ARG 3 11.049 -14.662 3.389
23 2HH2 ARG 3 1HH2 ARG 3 10.484 -16.082 2.553
24 H LEU 4 H LEU 4 8.472 -11.443 5.789
25 HA LEU 4 HA LEU 4 6.582 -13.323 4.536
26 1HB LEU 4 2HB LEU 4 6.136 -10.595 3.724
27 2HB LEU 4 1HB LEU 4 5.010 -11.746 4.418
28 HG LEU 4 HG LEU 4 6.873 -10.493 6.335
29 1HD1 LEU 4 1HD1 LEU 4 6.562 -8.444 5.410
30 2HD1 LEU 4 2HD1 LEU 4 5.065 -8.911 4.602
31 3HD1 LEU 4 3HD1 LEU 4 5.058 -8.537 6.325
32 1HD2 LEU 4 1HD2 LEU 4 5.150 -10.800 7.799
33 2HD2 LEU 4 2HD2 LEU 4 3.909 -10.536 6.574
34 3HD2 LEU 4 3HD2 LEU 4 4.782 -12.069 6.631
35 HA PRO 5 HA PRO 5 9.441 -13.070 1.150
36 1HB PRO 5 2HB PRO 5 7.359 -14.348 -0.453
37 2HB PRO 5 1HB PRO 5 8.932 -14.977 0.037
38 1HG PRO 5 2HG PRO 5 6.599 -15.922 1.036
39 2HG PRO 5 1HG PRO 5 8.107 -15.903 1.966
40 1HD PRO 5 2HD PRO 5 5.766 -14.046 2.108
41 2HD PRO 5 1HD PRO 5 6.773 -14.701 3.417
42 H LYS 6 H LYS 6 6.230 -12.979 -0.360
43 HA LYS 6 HA LYS 6 6.440 -10.147 -0.867
44 1HB LYS 6 2HB LYS 6 6.082 -10.484 -3.359
45 2HB LYS 6 1HB LYS 6 7.700 -10.798 -2.755
46 1HG LYS 6 2HG LYS 6 7.494 -13.097 -3.025
47 2HG LYS 6 1HG LYS 6 5.731 -13.026 -3.083
48 1HD LYS 6 2HD LYS 6 7.298 -11.600 -5.178
49 2HD LYS 6 1HD LYS 6 7.144 -13.354 -5.276
50 1HE LYS 6 2HE LYS 6 5.078 -13.181 -6.065
51 2HE LYS 6 1HE LYS 6 4.593 -12.185 -4.693
52 1HZ LYS 6 1HZ LYS 6 5.719 -10.299 -5.960
53 2HZ LYS 6 2HZ LYS 6 4.223 -10.846 -6.545
54 3HZ LYS 6 3HZ LYS 6 5.659 -11.322 -7.309
55 H LEU 7 H LEU 7 4.553 -9.756 0.107
56 HA LEU 7 HA LEU 7 2.227 -11.396 -0.398
57 1HB LEU 7 2HB LEU 7 2.343 -8.808 1.144
58 2HB LEU 7 1HB LEU 7 1.126 -10.064 1.257
59 HG LEU 7 HG LEU 7 3.984 -10.241 2.210
60 1HD1 LEU 7 1HD1 LEU 7 2.321 -8.905 3.546
61 2HD1 LEU 7 2HD1 LEU 7 1.443 -10.413 3.800
62 3HD1 LEU 7 3HD1 LEU 7 3.096 -10.246 4.393
63 1HD2 LEU 7 1HD2 LEU 7 2.169 -12.370 3.007
64 2HD2 LEU 7 2HD2 LEU 7 2.455 -12.333 1.267
65 3HD2 LEU 7 3HD2 LEU 7 3.815 -12.460 2.383
66 H TYR 8 H TYR 8 0.398 -9.065 -0.086
67 HA TYR 8 HA TYR 8 0.316 -8.259 -2.910
68 1HB TYR 8 2HB TYR 8 -1.831 -7.858 -0.819
69 2HB TYR 8 1HB TYR 8 -2.004 -7.751 -2.569
70 HD1 TYR 8 1HD TYR 8 -2.332 -9.714 -3.899
71 HD2 TYR 8 2HD TYR 8 -1.569 -10.061 0.271
72 HE1 TYR 8 1HE TYR 8 -3.008 -12.077 -3.974
73 HE2 TYR 8 2HE TYR 8 -2.221 -12.428 0.201
74 HH TYR 8 HH TYR 8 -2.694 -14.131 -2.740
75 H LEU 9 H LEU 9 0.792 -6.237 -3.491
76 HA LEU 9 HA LEU 9 1.572 -4.415 -1.357
77 1HB LEU 9 2HB LEU 9 2.982 -5.211 -3.399
78 2HB LEU 9 1HB LEU 9 2.093 -3.980 -4.272
79 HG LEU 9 HG LEU 9 3.030 -2.235 -2.957
80 1HD1 LEU 9 1HD1 LEU 9 4.880 -3.373 -1.244
81 2HD1 LEU 9 2HD1 LEU 9 3.355 -2.609 -0.792
82 3HD1 LEU 9 3HD1 LEU 9 3.430 -4.355 -1.029
83 1HD2 LEU 9 1HD2 LEU 9 5.380 -4.046 -3.290
84 2HD2 LEU 9 2HD2 LEU 9 4.452 -3.536 -4.702
85 3HD2 LEU 9 3HD2 LEU 9 5.218 -2.330 -3.668
86 H CYS 10 H CYS 10 0.741 -2.419 -1.017
87 HA CYS 10 HA CYS 10 -1.459 -1.487 -2.671
88 1HB CYS 10 2HB CYS 10 -1.963 -1.144 -0.363
89 2HB CYS 10 1HB CYS 10 -0.342 -0.559 -0.014
90 H GLU 11 H GLU 11 -1.192 0.198 -3.988
91 HA GLU 11 HA GLU 11 1.518 0.922 -4.684
92 1HB GLU 11 2HB GLU 11 -0.792 2.225 -6.028
93 2HB GLU 11 1HB GLU 11 0.695 1.590 -6.716
94 1HG GLU 11 2HG GLU 11 -0.457 -0.699 -5.900
95 2HG GLU 11 1HG GLU 11 -1.890 0.274 -6.235
96 H PHE 12 H PHE 12 -0.718 2.101 -2.549
97 HA PHE 12 HA PHE 12 0.205 4.878 -2.850
98 1HB PHE 12 2HB PHE 12 -2.150 3.997 -1.192
99 2HB PHE 12 1HB PHE 12 -1.809 5.592 -1.855
100 HD1 PHE 12 1HD PHE 12 -2.197 6.056 -4.231
101 HD2 PHE 12 2HD PHE 12 -3.188 2.286 -2.517
102 HE1 PHE 12 1HE PHE 12 -3.587 5.531 -6.194
103 HE2 PHE 12 2HE PHE 12 -4.579 1.755 -4.475
104 HZ PHE 12 HZ PHE 12 -4.783 3.379 -6.319
105 H CYS 13 H CYS 13 0.081 2.154 -0.683
106 HA CYS 13 HA CYS 13 1.393 3.709 1.451
107 1HB CYS 13 2HB CYS 13 0.277 0.894 1.434
108 2HB CYS 13 1HB CYS 13 1.100 1.629 2.803
109 H LEU 14 H LEU 14 1.718 1.070 -0.761
110 HA LEU 14 HA LEU 14 3.408 -0.222 -1.463
111 1HB LEU 14 2HB LEU 14 5.145 1.873 -0.165
112 2HB LEU 14 1HB LEU 14 5.760 0.535 -1.122
113 HG LEU 14 HG LEU 14 3.692 2.194 -2.422
114 1HD1 LEU 14 1HD1 LEU 14 6.450 3.311 -2.411
115 2HD1 LEU 14 2HD1 LEU 14 4.911 4.092 -2.778
116 3HD1 LEU 14 3HD1 LEU 14 5.338 3.727 -1.107
117 1HD2 LEU 14 1HD2 LEU 14 4.496 0.690 -3.905
118 2HD2 LEU 14 2HD2 LEU 14 5.665 1.978 -4.190
119 3HD2 LEU 14 3HD2 LEU 14 6.087 0.619 -3.148
120 H LYS 15 H LYS 15 1.999 -0.666 0.857
121 HA LYS 15 HA LYS 15 3.929 -2.124 2.528
122 1HB LYS 15 2HB LYS 15 1.758 -0.399 3.245
123 2HB LYS 15 1HB LYS 15 1.369 -2.033 3.767
124 1HG LYS 15 2HG LYS 15 2.525 -0.670 5.483
125 2HG LYS 15 1HG LYS 15 3.365 -2.165 5.070
126 1HD LYS 15 2HD LYS 15 5.128 -0.713 5.016
127 2HD LYS 15 1HD LYS 15 4.587 -0.587 3.340
128 1HE LYS 15 2HE LYS 15 4.623 1.630 3.774
129 2HE LYS 15 1HE LYS 15 3.046 1.305 4.490
130 1HZ LYS 15 1HZ LYS 15 5.409 0.987 6.184
131 2HZ LYS 15 2HZ LYS 15 3.845 1.501 6.592
132 3HZ LYS 15 3HZ LYS 15 4.913 2.566 5.811
133 H TYR 16 H TYR 16 3.406 -4.279 3.066
134 HA TYR 16 HA TYR 16 1.862 -5.551 0.963
135 1HB TYR 16 2HB TYR 16 3.907 -6.483 2.946
136 2HB TYR 16 1HB TYR 16 2.899 -7.650 2.096
137 HD1 TYR 16 1HD TYR 16 2.799 -7.294 -0.525
138 HD2 TYR 16 2HD TYR 16 5.919 -5.882 1.990
139 HE1 TYR 16 1HE TYR 16 4.305 -7.197 -2.463
140 HE2 TYR 16 2HE TYR 16 7.440 -5.787 0.059
141 HH TYR 16 HH TYR 16 7.245 -5.573 -2.434
142 H MET 17 H MET 17 0.000 -6.549 1.183
143 HA MET 17 HA MET 17 -1.259 -6.655 3.834
144 1HB MET 17 2HB MET 17 -2.685 -7.251 1.277
145 2HB MET 17 1HB MET 17 -3.335 -6.610 2.775
146 1HG MET 17 2HG MET 17 -1.372 -4.979 1.253
147 2HG MET 17 1HG MET 17 -3.024 -5.103 0.656
148 1HE MET 17 1HE MET 17 -1.529 -2.071 3.312
149 2HE MET 17 2HE MET 17 -0.750 -3.115 2.122
150 3HE MET 17 3HE MET 17 -2.014 -1.993 1.619
151 H LYS 18 H LYS 18 -2.383 -8.579 4.497
152 HA LYS 18 HA LYS 18 -0.824 -10.893 3.898
153 1HB LYS 18 2HB LYS 18 -2.847 -10.129 5.886
154 2HB LYS 18 1HB LYS 18 -2.850 -11.836 5.468
155 1HG LYS 18 2HG LYS 18 -0.416 -10.308 6.363
156 2HG LYS 18 1HG LYS 18 -1.429 -11.293 7.418
157 1HD LYS 18 2HD LYS 18 -0.538 -13.213 6.674
158 2HD LYS 18 1HD LYS 18 -0.543 -12.673 4.995
159 1HE LYS 18 2HE LYS 18 1.592 -11.979 5.080
160 2HE LYS 18 1HE LYS 18 1.402 -11.294 6.696
161 1HZ LYS 18 1HZ LYS 18 2.772 -13.563 6.071
162 2HZ LYS 18 2HZ LYS 18 1.315 -14.160 6.699
163 3HZ LYS 18 3HZ LYS 18 2.268 -13.102 7.624
164 H SER 19 H SER 19 -4.069 -9.855 3.015
165 HA SER 19 HA SER 19 -4.221 -12.222 1.291
166 1HB SER 19 2HB SER 19 -6.283 -12.869 2.019
167 2HB SER 19 1HB SER 19 -5.737 -12.089 3.501
168 HG SER 19 HG SER 19 -7.823 -11.398 2.904
169 H ARG 20 H ARG 20 -5.625 -11.981 -0.555
170 HA ARG 20 HA ARG 20 -5.190 -9.532 -1.890
171 1HB ARG 20 2HB ARG 20 -5.546 -11.966 -2.801
172 2HB ARG 20 1HB ARG 20 -7.244 -11.507 -2.802
173 1HG ARG 20 2HG ARG 20 -6.856 -9.745 -4.337
174 2HG ARG 20 1HG ARG 20 -5.109 -9.899 -4.167
175 1HD ARG 20 2HD ARG 20 -6.340 -10.916 -6.239
176 2HD ARG 20 1HD ARG 20 -5.010 -11.781 -5.472
177 HE ARG 20 HE ARG 20 -7.846 -12.369 -4.874
178 1HH1 ARG 20 2HH1 ARG 20 -4.590 -13.410 -5.691
179 2HH1 ARG 20 1HH1 ARG 20 -4.974 -15.104 -5.545
180 1HH2 ARG 20 2HH2 ARG 20 -8.318 -14.596 -4.653
181 2HH2 ARG 20 1HH2 ARG 20 -7.068 -15.769 -4.943
182 H THR 21 H THR 21 -8.006 -10.954 -0.289
183 HA THR 21 HA THR 21 -9.806 -8.940 -1.175
184 HB THR 21 HB THR 21 -10.100 -11.384 0.032
185 HG1 THR 21 1HG THR 21 -11.526 -9.880 -1.326
186 1HG2 THR 21 1HG2 THR 21 -9.729 -10.504 2.262
187 2HG2 THR 21 2HG2 THR 21 -11.417 -10.983 2.074
188 3HG2 THR 21 3HG2 THR 21 -10.972 -9.279 2.009
189 H ILE 22 H ILE 22 -7.537 -9.159 1.431
190 HA ILE 22 HA ILE 22 -8.568 -7.026 3.019
191 HB ILE 22 HB ILE 22 -5.921 -8.422 2.824
192 1HG1 ILE 22 2HG1 ILE 22 -7.618 -7.861 5.247
193 1HG2 ILE 22 1HG2 ILE 22 -4.759 -6.918 4.098
194 2HG2 ILE 22 2HG2 ILE 22 -5.755 -5.816 3.147
195 3HG2 ILE 22 3HG2 ILE 22 -6.218 -6.218 4.800
196 1HD1 ILE 22 1HD1 ILE 22 -5.611 -10.009 4.609
197 2HD1 ILE 22 2HD1 ILE 22 -5.481 -8.742 5.830
198 3HD1 ILE 22 3HD1 ILE 22 -6.678 -10.023 6.015
199 H LEU 23 H LEU 23 -6.222 -7.280 0.375
200 HA LEU 23 HA LEU 23 -5.644 -4.487 0.298
201 1HB LEU 23 2HB LEU 23 -4.068 -6.154 -0.570
202 2HB LEU 23 1HB LEU 23 -5.223 -6.600 -1.811
203 HG LEU 23 HG LEU 23 -5.062 -4.303 -2.742
204 1HD1 LEU 23 1HD1 LEU 23 -3.005 -4.000 -0.572
205 2HD1 LEU 23 2HD1 LEU 23 -3.069 -2.956 -1.991
206 3HD1 LEU 23 3HD1 LEU 23 -4.430 -3.007 -0.872
207 1HD2 LEU 23 1HD2 LEU 23 -2.327 -5.516 -2.530
208 2HD2 LEU 23 2HD2 LEU 23 -3.623 -6.279 -3.453
209 3HD2 LEU 23 3HD2 LEU 23 -3.054 -4.668 -3.896
210 H GLN 24 H GLN 24 -7.972 -6.605 -1.230
211 HA GLN 24 HA GLN 24 -8.868 -4.986 -3.306
212 1HB GLN 24 2HB GLN 24 -10.011 -7.201 -1.710
213 2HB GLN 24 1HB GLN 24 -11.179 -6.175 -2.532
214 1HG GLN 24 2HG GLN 24 -10.534 -6.860 -4.601
215 2HG GLN 24 1HG GLN 24 -8.871 -7.172 -4.105
216 1HE2 GLN 24 1HE2 GLN 24 -8.867 -9.193 -5.085
217 2HE2 GLN 24 2HE2 GLN 24 -9.715 -10.545 -4.404
218 H GLN 25 H GLN 25 -10.053 -5.174 0.039
219 HA GLN 25 HA GLN 25 -11.847 -2.965 -0.250
220 1HB GLN 25 2HB GLN 25 -10.701 -4.034 2.329
221 2HB GLN 25 1HB GLN 25 -12.205 -3.152 2.109
222 1HG GLN 25 2HG GLN 25 -13.287 -4.981 1.165
223 2HG GLN 25 1HG GLN 25 -11.772 -5.803 0.790
224 1HE2 GLN 25 1HE2 GLN 25 -13.396 -7.413 1.921
225 2HE2 GLN 25 2HE2 GLN 25 -13.108 -7.625 3.622
226 H HIS 26 H HIS 26 -8.524 -3.373 0.781
227 HA HIS 26 HA HIS 26 -8.160 -0.867 1.984
228 1HB HIS 26 2HB HIS 26 -6.566 -2.701 2.297
229 2HB HIS 26 1HB HIS 26 -6.123 -2.626 0.594
230 HD1 HIS 26 1HD HIS 26 -5.361 -1.099 3.885
231 HD2 HIS 26 2HD HIS 26 -4.682 -0.263 -0.144
232 HE1 HIS 26 1HE HIS 26 -3.663 0.794 3.803
233 H MET 27 H MET 27 -7.372 -1.926 -1.333
234 HA MET 27 HA MET 27 -6.338 0.545 -2.161
235 1HB MET 27 2HB MET 27 -7.254 -1.927 -3.518
236 2HB MET 27 1HB MET 27 -7.131 -0.477 -4.506
237 1HG MET 27 2HG MET 27 -4.766 -0.469 -3.117
238 2HG MET 27 1HG MET 27 -5.046 -2.184 -3.411
239 1HE MET 27 1HE MET 27 -2.852 -2.487 -5.405
240 2HE MET 27 2HE MET 27 -4.379 -3.318 -5.107
241 3HE MET 27 3HE MET 27 -3.946 -2.825 -6.744
242 H LYS 28 H LYS 28 -9.586 -0.626 -1.946
243 HA LYS 28 HA LYS 28 -10.759 1.383 -3.611
244 1HB LYS 28 2HB LYS 28 -11.698 -0.830 -1.918
245 2HB LYS 28 1HB LYS 28 -12.790 0.547 -1.981
246 1HG LYS 28 2HG LYS 28 -13.362 -1.093 -3.672
247 2HG LYS 28 1HG LYS 28 -12.831 0.417 -4.416
248 1HD LYS 28 2HD LYS 28 -10.491 -1.018 -4.169
249 2HD LYS 28 1HD LYS 28 -11.682 -2.258 -4.574
250 1HE LYS 28 2HE LYS 28 -12.018 0.130 -6.183
251 2HE LYS 28 1HE LYS 28 -10.397 -0.545 -6.343
252 1HZ LYS 28 1HZ LYS 28 -12.413 -1.373 -7.805
253 2HZ LYS 28 2HZ LYS 28 -12.640 -2.410 -6.481
254 3HZ LYS 28 3HZ LYS 28 -11.168 -2.418 -7.324
255 H LYS 29 H LYS 29 -9.377 1.462 -0.564
256 HA LYS 29 HA LYS 29 -10.947 3.822 0.198
257 1HB LYS 29 2HB LYS 29 -10.646 1.828 1.815
258 2HB LYS 29 1HB LYS 29 -9.005 2.429 2.014
259 1HG LYS 29 2HG LYS 29 -10.763 4.628 2.310
260 2HG LYS 29 1HG LYS 29 -11.389 3.301 3.291
261 1HD LYS 29 2HD LYS 29 -9.824 3.674 4.822
262 2HD LYS 29 1HD LYS 29 -8.564 3.412 3.616
263 1HE LYS 29 2HE LYS 29 -8.304 5.594 4.649
264 2HE LYS 29 1HE LYS 29 -8.728 5.767 2.946
265 1HZ LYS 29 1HZ LYS 29 -11.068 5.716 4.543
266 2HZ LYS 29 2HZ LYS 29 -10.509 6.938 3.506
267 3HZ LYS 29 3HZ LYS 29 -10.004 6.901 5.124
268 H CYS 30 H CYS 30 -7.714 2.572 -0.299
269 HA CYS 30 HA CYS 30 -6.359 4.989 0.310
270 1HB CYS 30 2HB CYS 30 -5.652 2.349 -0.169
271 2HB CYS 30 1HB CYS 30 -4.969 3.217 -1.536
272 H GLY 31 H GLY 31 -7.550 3.524 -2.679
273 1HA GLY 31 1HA GLY 31 -6.500 5.715 -4.281
274 2HA GLY 31 2HA GLY 31 -7.406 4.324 -4.870
275 H TRP 32 H TRP 32 -8.412 6.451 -2.249
276 HA TRP 32 HA TRP 32 -10.899 6.983 -3.625
277 1HB TRP 32 2HB TRP 32 -10.002 6.974 -0.902
278 2HB TRP 32 1HB TRP 32 -10.700 8.549 -1.267
279 HD1 TRP 32 HD TRP 32 -11.787 5.607 0.294
280 HE1 TRP 32 1HE TRP 32 -14.286 5.111 -0.060
281 HE3 TRP 32 3HE TRP 32 -12.673 8.689 -3.686
282 HZ2 TRP 32 2HZ TRP 32 -16.358 5.926 -1.785
283 HZ3 TRP 32 3HZ TRP 32 -14.946 8.773 -4.626
284 HH2 TRP 32 HH TRP 32 -16.749 7.420 -3.692
285 H PHE 33 H PHE 33 -9.386 8.058 -5.308
286 HA PHE 33 HA PHE 33 -9.843 10.872 -5.130
287 1HB PHE 33 2HB PHE 33 -7.461 10.180 -4.035
288 2HB PHE 33 1HB PHE 33 -6.985 10.340 -5.724
289 HD1 PHE 33 1HD PHE 33 -8.075 12.556 -6.852
290 HD2 PHE 33 2HD PHE 33 -7.145 12.023 -2.737
291 HE1 PHE 33 1HE PHE 33 -7.917 14.995 -6.575
292 HE2 PHE 33 2HE PHE 33 -6.983 14.459 -2.450
293 HZ PHE 33 HZ PHE 33 -7.370 15.949 -4.371
Start of MODEL 12
1 1H GLY 1 1H GLY 1 12.249 -5.597 12.093
2 2H GLY 1 2H GLY 1 12.511 -3.933 12.282
3 3H GLY 1 3H GLY 1 13.286 -4.781 11.032
4 1HA GLY 1 2HA GLY 1 10.525 -3.850 11.221
5 2HA GLY 1 1HA GLY 1 11.619 -3.833 9.845
6 H SER 2 H SER 2 9.148 -4.635 9.324
7 HA SER 2 HA SER 2 8.669 -7.411 9.698
8 1HB SER 2 2HB SER 2 7.317 -6.447 7.377
9 2HB SER 2 1HB SER 2 6.651 -6.754 8.982
10 HG SER 2 HG SER 2 6.878 -4.680 9.509
11 H ARG 3 H ARG 3 8.922 -9.125 8.279
12 HA ARG 3 HA ARG 3 10.710 -8.629 5.986
13 1HB ARG 3 2HB ARG 3 11.245 -10.133 8.319
14 2HB ARG 3 1HB ARG 3 11.005 -11.294 7.020
15 1HG ARG 3 2HG ARG 3 12.621 -9.419 5.846
16 2HG ARG 3 1HG ARG 3 13.214 -9.462 7.507
17 1HD ARG 3 2HD ARG 3 13.980 -11.586 7.322
18 2HD ARG 3 1HD ARG 3 12.680 -12.075 6.238
19 HE ARG 3 HE ARG 3 14.620 -10.259 5.082
20 1HH1 ARG 3 2HH1 ARG 3 13.671 -13.601 5.596
21 2HH1 ARG 3 1HH1 ARG 3 14.645 -14.212 4.287
22 1HH2 ARG 3 2HH2 ARG 3 15.904 -11.062 3.358
23 2HH2 ARG 3 1HH2 ARG 3 15.942 -12.775 3.046
24 H LEU 4 H LEU 4 8.314 -8.484 5.199
25 HA LEU 4 HA LEU 4 7.022 -11.019 4.743
26 1HB LEU 4 2HB LEU 4 6.396 -8.397 3.401
27 2HB LEU 4 1HB LEU 4 5.332 -9.775 3.613
28 HG LEU 4 HG LEU 4 6.168 -8.904 6.197
29 1HD1 LEU 4 1HD1 LEU 4 5.039 -6.634 6.079
30 2HD1 LEU 4 2HD1 LEU 4 6.671 -6.744 5.418
31 3HD1 LEU 4 3HD1 LEU 4 5.281 -6.721 4.334
32 1HD2 LEU 4 1HD2 LEU 4 3.826 -9.682 4.794
33 2HD2 LEU 4 2HD2 LEU 4 4.080 -9.561 6.535
34 3HD2 LEU 4 3HD2 LEU 4 3.489 -8.167 5.631
35 HA PRO 5 HA PRO 5 9.415 -11.852 1.102
36 1HB PRO 5 2HB PRO 5 8.121 -14.121 0.350
37 2HB PRO 5 1HB PRO 5 9.289 -14.060 1.669
38 1HG PRO 5 2HG PRO 5 6.318 -14.140 1.763
39 2HG PRO 5 1HG PRO 5 7.498 -14.867 2.864
40 1HD PRO 5 2HD PRO 5 6.095 -12.550 3.364
41 2HD PRO 5 1HD PRO 5 7.628 -12.989 4.138
42 H LYS 6 H LYS 6 6.455 -13.324 -0.029
43 HA LYS 6 HA LYS 6 6.113 -11.086 -1.904
44 1HB LYS 6 2HB LYS 6 5.124 -12.777 -3.488
45 2HB LYS 6 1HB LYS 6 6.851 -12.935 -3.210
46 1HG LYS 6 2HG LYS 6 6.563 -15.051 -2.658
47 2HG LYS 6 1HG LYS 6 5.533 -14.562 -1.311
48 1HD LYS 6 2HD LYS 6 3.821 -15.534 -2.343
49 2HD LYS 6 1HD LYS 6 3.955 -14.317 -3.615
50 1HE LYS 6 2HE LYS 6 5.838 -15.906 -4.508
51 2HE LYS 6 1HE LYS 6 4.999 -17.113 -3.531
52 1HZ LYS 6 1HZ LYS 6 4.168 -17.138 -5.777
53 2HZ LYS 6 2HZ LYS 6 3.812 -15.483 -5.712
54 3HZ LYS 6 3HZ LYS 6 2.953 -16.573 -4.740
55 H LEU 7 H LEU 7 4.363 -9.981 -1.506
56 HA LEU 7 HA LEU 7 1.930 -11.377 -0.632
57 1HB LEU 7 2HB LEU 7 3.420 -9.262 0.805
58 2HB LEU 7 1HB LEU 7 1.690 -9.039 0.712
59 HG LEU 7 HG LEU 7 1.865 -10.149 2.708
60 1HD1 LEU 7 1HD1 LEU 7 0.497 -11.456 0.985
61 2HD1 LEU 7 2HD1 LEU 7 1.841 -12.598 0.973
62 3HD1 LEU 7 3HD1 LEU 7 0.960 -12.286 2.469
63 1HD2 LEU 7 1HD2 LEU 7 4.291 -11.362 1.505
64 2HD2 LEU 7 2HD2 LEU 7 4.065 -10.605 3.082
65 3HD2 LEU 7 3HD2 LEU 7 3.477 -12.244 2.797
66 H TYR 8 H TYR 8 0.509 -8.895 -0.270
67 HA TYR 8 HA TYR 8 0.444 -7.894 -3.041
68 1HB TYR 8 2HB TYR 8 -2.057 -7.993 -1.400
69 2HB TYR 8 1HB TYR 8 -1.857 -8.127 -3.151
70 HD1 TYR 8 1HD TYR 8 -2.081 -9.922 -0.020
71 HD2 TYR 8 2HD TYR 8 -1.021 -10.273 -4.122
72 HE1 TYR 8 1HE TYR 8 -2.130 -12.370 0.184
73 HE2 TYR 8 2HE TYR 8 -1.071 -12.720 -3.933
74 HH TYR 8 HH TYR 8 -0.776 -14.351 -1.354
75 H LEU 9 H LEU 9 1.242 -5.899 -2.912
76 HA LEU 9 HA LEU 9 0.827 -4.358 -0.479
77 1HB LEU 9 2HB LEU 9 2.616 -2.961 -1.231
78 2HB LEU 9 1HB LEU 9 3.094 -4.628 -1.415
79 HG LEU 9 HG LEU 9 1.882 -3.558 -3.821
80 1HD1 LEU 9 1HD1 LEU 9 4.391 -2.274 -2.753
81 2HD1 LEU 9 2HD1 LEU 9 3.819 -2.146 -4.416
82 3HD1 LEU 9 3HD1 LEU 9 2.860 -1.471 -3.099
83 1HD2 LEU 9 1HD2 LEU 9 3.879 -5.376 -2.902
84 2HD2 LEU 9 2HD2 LEU 9 3.088 -5.296 -4.478
85 3HD2 LEU 9 3HD2 LEU 9 4.542 -4.345 -4.171
86 H CYS 10 H CYS 10 0.330 -2.114 -0.589
87 HA CYS 10 HA CYS 10 -1.757 -1.475 -2.457
88 1HB CYS 10 2HB CYS 10 -2.249 -0.845 -0.218
89 2HB CYS 10 1HB CYS 10 -0.640 -0.182 0.035
90 H GLU 11 H GLU 11 -1.563 0.107 -3.943
91 HA GLU 11 HA GLU 11 1.061 0.655 -4.937
92 1HB GLU 11 2HB GLU 11 -1.642 1.675 -5.829
93 2HB GLU 11 1HB GLU 11 -0.137 1.964 -6.692
94 1HG GLU 11 2HG GLU 11 -1.310 -0.752 -6.135
95 2HG GLU 11 1HG GLU 11 -1.475 0.134 -7.649
96 H PHE 12 H PHE 12 -0.879 2.143 -2.631
97 HA PHE 12 HA PHE 12 0.476 4.727 -3.034
98 1HB PHE 12 2HB PHE 12 -1.948 4.360 -1.297
99 2HB PHE 12 1HB PHE 12 -1.366 5.823 -2.087
100 HD1 PHE 12 1HD PHE 12 -1.560 5.995 -4.593
101 HD2 PHE 12 2HD PHE 12 -3.517 2.973 -2.335
102 HE1 PHE 12 1HE PHE 12 -3.096 5.592 -6.472
103 HE2 PHE 12 2HE PHE 12 -5.058 2.556 -4.208
104 HZ PHE 12 HZ PHE 12 -4.847 3.871 -6.280
105 H CYS 13 H CYS 13 -0.041 2.103 -0.808
106 HA CYS 13 HA CYS 13 1.444 3.533 1.298
107 1HB CYS 13 2HB CYS 13 -0.144 0.956 1.412
108 2HB CYS 13 1HB CYS 13 0.736 1.653 2.767
109 H LEU 14 H LEU 14 1.430 0.757 -0.787
110 HA LEU 14 HA LEU 14 2.957 -0.749 -1.407
111 1HB LEU 14 2HB LEU 14 4.966 1.190 -0.264
112 2HB LEU 14 1HB LEU 14 5.319 -0.132 -1.364
113 HG LEU 14 HG LEU 14 3.268 1.547 -2.482
114 1HD1 LEU 14 1HD1 LEU 14 5.678 3.161 -2.521
115 2HD1 LEU 14 2HD1 LEU 14 3.997 3.630 -2.262
116 3HD1 LEU 14 3HD1 LEU 14 4.963 3.037 -0.912
117 1HD2 LEU 14 1HD2 LEU 14 4.819 1.654 -4.353
118 2HD2 LEU 14 2HD2 LEU 14 6.094 0.961 -3.348
119 3HD2 LEU 14 3HD2 LEU 14 4.665 0.006 -3.746
120 H LYS 15 H LYS 15 1.723 -0.833 1.185
121 HA LYS 15 HA LYS 15 3.695 -2.289 2.788
122 1HB LYS 15 2HB LYS 15 2.390 -0.580 3.964
123 2HB LYS 15 1HB LYS 15 0.896 -1.353 3.455
124 1HG LYS 15 2HG LYS 15 1.149 -2.076 5.637
125 2HG LYS 15 1HG LYS 15 1.800 -3.421 4.696
126 1HD LYS 15 2HD LYS 15 3.473 -3.194 6.231
127 2HD LYS 15 1HD LYS 15 4.054 -2.064 5.007
128 1HE LYS 15 2HE LYS 15 2.254 -0.676 6.714
129 2HE LYS 15 1HE LYS 15 3.400 -1.557 7.725
130 1HZ LYS 15 1HZ LYS 15 4.159 0.689 7.131
131 2HZ LYS 15 2HZ LYS 15 4.165 0.250 5.493
132 3HZ LYS 15 3HZ LYS 15 5.215 -0.520 6.581
133 H TYR 16 H TYR 16 3.754 -4.415 2.617
134 HA TYR 16 HA TYR 16 2.073 -5.885 0.961
135 1HB TYR 16 2HB TYR 16 4.021 -6.704 3.107
136 2HB TYR 16 1HB TYR 16 3.142 -7.890 2.146
137 HD1 TYR 16 1HD TYR 16 3.481 -5.361 -0.080
138 HD2 TYR 16 2HD TYR 16 5.915 -8.169 1.978
139 HE1 TYR 16 1HE TYR 16 5.173 -5.166 -1.841
140 HE2 TYR 16 2HE TYR 16 7.626 -7.984 0.221
141 HH TYR 16 HH TYR 16 7.267 -5.684 -2.464
142 H MET 17 H MET 17 0.068 -6.495 1.223
143 HA MET 17 HA MET 17 -1.047 -6.848 3.910
144 1HB MET 17 2HB MET 17 -2.353 -6.735 1.183
145 2HB MET 17 1HB MET 17 -3.224 -7.069 2.667
146 1HG MET 17 2HG MET 17 -1.656 -4.560 2.147
147 2HG MET 17 1HG MET 17 -3.391 -4.725 1.901
148 1HE MET 17 1HE MET 17 -2.552 -2.540 3.169
149 2HE MET 17 2HE MET 17 -3.359 -2.397 4.732
150 3HE MET 17 3HE MET 17 -1.618 -2.662 4.661
151 H LYS 18 H LYS 18 -1.972 -8.832 4.530
152 HA LYS 18 HA LYS 18 -0.492 -11.036 3.463
153 1HB LYS 18 2HB LYS 18 -2.628 -11.066 5.595
154 2HB LYS 18 1HB LYS 18 -1.424 -12.312 5.297
155 1HG LYS 18 2HG LYS 18 -0.870 -9.503 6.233
156 2HG LYS 18 1HG LYS 18 -0.831 -10.963 7.225
157 1HD LYS 18 2HD LYS 18 0.881 -10.667 4.776
158 2HD LYS 18 1HD LYS 18 1.401 -10.059 6.348
159 1HE LYS 18 2HE LYS 18 0.498 -12.648 6.837
160 2HE LYS 18 1HE LYS 18 1.389 -12.760 5.320
161 1HZ LYS 18 1HZ LYS 18 2.613 -11.271 7.525
162 2HZ LYS 18 2HZ LYS 18 3.341 -12.205 6.311
163 3HZ LYS 18 3HZ LYS 18 2.591 -12.963 7.627
164 H SER 19 H SER 19 -3.708 -9.852 3.024
165 HA SER 19 HA SER 19 -4.283 -12.217 1.374
166 1HB SER 19 2HB SER 19 -6.537 -10.804 2.730
167 2HB SER 19 1HB SER 19 -6.404 -12.493 2.235
168 HG SER 19 HG SER 19 -4.886 -12.768 3.970
169 H ARG 20 H ARG 20 -5.290 -11.851 -0.558
170 HA ARG 20 HA ARG 20 -5.042 -9.320 -1.784
171 1HB ARG 20 2HB ARG 20 -5.902 -11.988 -2.511
172 2HB ARG 20 1HB ARG 20 -6.952 -10.777 -3.232
173 1HG ARG 20 2HG ARG 20 -5.010 -9.677 -4.223
174 2HG ARG 20 1HG ARG 20 -3.954 -10.893 -3.497
175 1HD ARG 20 2HD ARG 20 -5.772 -11.092 -5.824
176 2HD ARG 20 1HD ARG 20 -4.199 -11.836 -5.547
177 HE ARG 20 HE ARG 20 -5.285 -13.532 -4.239
178 1HH1 ARG 20 2HH1 ARG 20 -7.429 -11.413 -6.016
179 2HH1 ARG 20 1HH1 ARG 20 -8.773 -12.516 -5.985
180 1HH2 ARG 20 2HH2 ARG 20 -7.055 -14.992 -4.170
181 2HH2 ARG 20 1HH2 ARG 20 -8.557 -14.551 -4.931
182 H THR 21 H THR 21 -7.731 -11.000 -0.279
183 HA THR 21 HA THR 21 -9.847 -9.338 -0.997
184 HB THR 21 HB THR 21 -10.500 -10.114 1.544
185 HG1 THR 21 1HG THR 21 -9.370 -11.862 2.116
186 1HG2 THR 21 1HG2 THR 21 -10.572 -12.058 -0.751
187 2HG2 THR 21 2HG2 THR 21 -11.587 -10.616 -0.720
188 3HG2 THR 21 3HG2 THR 21 -11.751 -11.836 0.541
189 H ILE 22 H ILE 22 -7.574 -9.123 1.696
190 HA ILE 22 HA ILE 22 -8.730 -6.863 2.955
191 HB ILE 22 HB ILE 22 -6.100 -8.280 3.139
192 1HG1 ILE 22 2HG1 ILE 22 -7.910 -7.526 5.404
193 1HG2 ILE 22 1HG2 ILE 22 -4.960 -6.561 3.945
194 2HG2 ILE 22 2HG2 ILE 22 -6.310 -5.503 3.526
195 3HG2 ILE 22 3HG2 ILE 22 -6.227 -6.235 5.129
196 1HD1 ILE 22 1HD1 ILE 22 -6.336 -8.712 6.440
197 2HD1 ILE 22 2HD1 ILE 22 -7.185 -10.104 5.761
198 3HD1 ILE 22 3HD1 ILE 22 -5.767 -9.452 4.943
199 H LEU 23 H LEU 23 -6.014 -7.263 0.706
200 HA LEU 23 HA LEU 23 -5.239 -4.570 0.621
201 1HB LEU 23 2HB LEU 23 -4.165 -6.814 -0.294
202 2HB LEU 23 1HB LEU 23 -4.940 -6.308 -1.779
203 HG LEU 23 HG LEU 23 -2.436 -5.503 -0.745
204 1HD1 LEU 23 1HD1 LEU 23 -4.056 -4.643 -3.125
205 2HD1 LEU 23 2HD1 LEU 23 -2.349 -4.263 -2.884
206 3HD1 LEU 23 3HD1 LEU 23 -2.864 -5.942 -3.048
207 1HD2 LEU 23 1HD2 LEU 23 -2.781 -2.992 -1.025
208 2HD2 LEU 23 2HD2 LEU 23 -4.492 -3.311 -0.741
209 3HD2 LEU 23 3HD2 LEU 23 -3.301 -3.710 0.499
210 H GLN 24 H GLN 24 -7.538 -6.398 -1.349
211 HA GLN 24 HA GLN 24 -8.029 -4.405 -3.256
212 1HB GLN 24 2HB GLN 24 -9.190 -6.953 -2.499
213 2HB GLN 24 1HB GLN 24 -10.424 -5.801 -2.996
214 1HG GLN 24 2HG GLN 24 -8.025 -6.687 -4.581
215 2HG GLN 24 1HG GLN 24 -9.716 -7.072 -4.901
216 1HE2 GLN 24 1HE2 GLN 24 -7.189 -4.782 -5.254
217 2HE2 GLN 24 2HE2 GLN 24 -8.073 -3.603 -6.168
218 H GLN 25 H GLN 25 -9.822 -5.195 -0.272
219 HA GLN 25 HA GLN 25 -11.669 -3.059 -0.529
220 1HB GLN 25 2HB GLN 25 -12.492 -3.672 1.557
221 2HB GLN 25 1HB GLN 25 -11.813 -5.177 0.956
222 1HG GLN 25 2HG GLN 25 -9.691 -4.419 2.258
223 2HG GLN 25 1HG GLN 25 -10.828 -3.380 3.116
224 1HE2 GLN 25 1HE2 GLN 25 -10.813 -6.726 1.928
225 2HE2 GLN 25 2HE2 GLN 25 -11.371 -7.429 3.409
226 H HIS 26 H HIS 26 -8.412 -3.211 0.553
227 HA HIS 26 HA HIS 26 -8.460 -0.780 2.078
228 1HB HIS 26 2HB HIS 26 -6.730 -2.332 2.642
229 2HB HIS 26 1HB HIS 26 -6.210 -2.473 0.966
230 HD1 HIS 26 1HD HIS 26 -5.666 -0.486 4.050
231 HD2 HIS 26 2HD HIS 26 -4.826 -0.164 -0.026
232 HE1 HIS 26 1HE HIS 26 -4.034 1.449 3.785
233 H MET 27 H MET 27 -7.165 -1.690 -1.118
234 HA MET 27 HA MET 27 -6.316 0.890 -1.796
235 1HB MET 27 2HB MET 27 -6.742 -1.649 -3.268
236 2HB MET 27 1HB MET 27 -6.632 -0.179 -4.228
237 1HG MET 27 2HG MET 27 -4.470 0.326 -3.146
238 2HG MET 27 1HG MET 27 -4.574 -1.208 -2.285
239 1HE MET 27 1HE MET 27 -3.874 -0.632 -6.794
240 2HE MET 27 2HE MET 27 -5.502 -0.421 -6.147
241 3HE MET 27 3HE MET 27 -4.195 0.630 -5.604
242 H LYS 28 H LYS 28 -9.444 -0.473 -1.816
243 HA LYS 28 HA LYS 28 -10.614 1.211 -3.788
244 1HB LYS 28 2HB LYS 28 -11.540 -0.754 -1.834
245 2HB LYS 28 1HB LYS 28 -12.663 0.583 -2.051
246 1HG LYS 28 2HG LYS 28 -13.204 -1.248 -3.540
247 2HG LYS 28 1HG LYS 28 -12.694 0.170 -4.457
248 1HD LYS 28 2HD LYS 28 -10.359 -1.296 -3.948
249 2HD LYS 28 1HD LYS 28 -11.581 -2.477 -4.426
250 1HE LYS 28 2HE LYS 28 -12.082 -0.736 -6.317
251 2HE LYS 28 1HE LYS 28 -10.441 -0.195 -5.969
252 1HZ LYS 28 1HZ LYS 28 -10.715 -3.051 -6.253
253 2HZ LYS 28 2HZ LYS 28 -9.561 -2.001 -6.912
254 3HZ LYS 28 3HZ LYS 28 -11.072 -2.182 -7.665
255 H LYS 29 H LYS 29 -9.760 1.626 -0.453
256 HA LYS 29 HA LYS 29 -11.251 4.141 -0.335
257 1HB LYS 29 2HB LYS 29 -11.120 4.074 1.972
258 2HB LYS 29 1HB LYS 29 -11.242 2.371 1.559
259 1HG LYS 29 2HG LYS 29 -9.288 1.922 2.493
260 2HG LYS 29 1HG LYS 29 -8.492 3.237 1.626
261 1HD LYS 29 2HD LYS 29 -8.338 4.344 3.543
262 2HD LYS 29 1HD LYS 29 -10.099 4.448 3.583
263 1HE LYS 29 2HE LYS 29 -10.255 2.949 5.229
264 2HE LYS 29 1HE LYS 29 -9.113 1.855 4.449
265 1HZ LYS 29 1HZ LYS 29 -8.172 2.517 6.495
266 2HZ LYS 29 2HZ LYS 29 -8.489 4.160 6.208
267 3HZ LYS 29 3HZ LYS 29 -7.315 3.350 5.291
268 H CYS 30 H CYS 30 -8.056 2.834 -0.508
269 HA CYS 30 HA CYS 30 -6.673 5.237 0.129
270 1HB CYS 30 2HB CYS 30 -5.965 2.606 -0.127
271 2HB CYS 30 1HB CYS 30 -5.291 3.297 -1.597
272 H GLY 31 H GLY 31 -7.877 3.774 -2.814
273 1HA GLY 31 1HA GLY 31 -6.478 5.559 -4.577
274 2HA GLY 31 2HA GLY 31 -7.738 4.416 -5.026
275 H TRP 32 H TRP 32 -7.667 7.223 -2.853
276 HA TRP 32 HA TRP 32 -10.008 8.287 -4.273
277 1HB TRP 32 2HB TRP 32 -9.163 8.269 -1.446
278 2HB TRP 32 1HB TRP 32 -9.816 9.803 -2.017
279 HD1 TRP 32 HD TRP 32 -10.819 6.123 -1.547
280 HE1 TRP 32 1HE TRP 32 -13.388 5.967 -1.531
281 HE3 TRP 32 3HE TRP 32 -11.919 10.974 -2.717
282 HZ2 TRP 32 2HZ TRP 32 -15.584 7.687 -1.957
283 HZ3 TRP 32 3HZ TRP 32 -14.282 11.639 -2.894
284 HH2 TRP 32 HH TRP 32 -16.076 10.028 -2.517
285 H PHE 33 H PHE 33 -9.645 10.912 -3.120
286 HA PHE 33 HA PHE 33 -7.099 11.885 -4.062
287 1HB PHE 33 2HB PHE 33 -9.427 11.976 -5.768
288 2HB PHE 33 1HB PHE 33 -8.920 13.614 -5.348
289 HD1 PHE 33 1HD PHE 33 -8.346 10.821 -7.458
290 HD2 PHE 33 2HD PHE 33 -6.435 14.185 -5.684
291 HE1 PHE 33 1HE PHE 33 -6.569 10.701 -9.154
292 HE2 PHE 33 2HE PHE 33 -4.651 14.068 -7.376
293 HZ PHE 33 HZ PHE 33 -4.720 12.327 -9.114
Start of MODEL 13
1 1H GLY 1 1H GLY 1 18.750 -5.362 0.884
2 2H GLY 1 2H GLY 1 17.314 -5.528 1.774
3 3H GLY 1 3H GLY 1 17.465 -4.287 0.628
4 1HA GLY 1 2HA GLY 1 17.075 -5.627 -1.128
5 2HA GLY 1 1HA GLY 1 17.855 -6.998 -0.353
6 H SER 2 H SER 2 16.387 -8.580 -0.363
7 HA SER 2 HA SER 2 13.628 -7.925 0.392
8 1HB SER 2 2HB SER 2 14.657 -10.512 -0.793
9 2HB SER 2 1HB SER 2 12.978 -9.988 -0.661
10 HG SER 2 HG SER 2 14.998 -8.702 -2.215
11 H ARG 3 H ARG 3 13.749 -7.850 2.620
12 HA ARG 3 HA ARG 3 14.781 -10.175 4.058
13 1HB ARG 3 2HB ARG 3 15.143 -7.839 4.920
14 2HB ARG 3 1HB ARG 3 13.406 -7.725 5.179
15 1HG ARG 3 2HG ARG 3 13.671 -8.630 7.176
16 2HG ARG 3 1HG ARG 3 14.269 -10.106 6.417
17 1HD ARG 3 2HD ARG 3 16.196 -7.883 6.627
18 2HD ARG 3 1HD ARG 3 15.695 -8.612 8.152
19 HE ARG 3 HE ARG 3 17.191 -9.903 5.992
20 1HH1 ARG 3 2HH1 ARG 3 15.692 -10.120 9.160
21 2HH1 ARG 3 1HH1 ARG 3 16.493 -11.604 9.580
22 1HH2 ARG 3 2HH2 ARG 3 18.246 -11.849 6.542
23 2HH2 ARG 3 1HH2 ARG 3 17.946 -12.594 8.084
24 H LEU 4 H LEU 4 11.837 -8.584 3.142
25 HA LEU 4 HA LEU 4 10.199 -10.710 4.333
26 1HB LEU 4 2HB LEU 4 9.408 -8.425 4.702
27 2HB LEU 4 1HB LEU 4 9.443 -8.109 2.979
28 HG LEU 4 HG LEU 4 7.761 -10.382 3.535
29 1HD1 LEU 4 1HD1 LEU 4 6.019 -8.653 4.601
30 2HD1 LEU 4 2HD1 LEU 4 7.032 -9.724 5.570
31 3HD1 LEU 4 3HD1 LEU 4 7.510 -8.045 5.320
32 1HD2 LEU 4 1HD2 LEU 4 6.294 -9.299 2.100
33 2HD2 LEU 4 2HD2 LEU 4 6.850 -7.696 2.580
34 3HD2 LEU 4 3HD2 LEU 4 7.870 -8.714 1.563
35 HA PRO 5 HA PRO 5 10.240 -12.852 0.461
36 1HB PRO 5 2HB PRO 5 7.808 -14.136 0.672
37 2HB PRO 5 1HB PRO 5 9.302 -14.688 1.435
38 1HG PRO 5 2HG PRO 5 7.028 -13.146 2.609
39 2HG PRO 5 1HG PRO 5 7.987 -14.454 3.327
40 1HD PRO 5 2HD PRO 5 8.390 -11.871 3.967
41 2HD PRO 5 1HD PRO 5 9.727 -13.037 3.884
42 H LYS 6 H LYS 6 6.769 -12.565 0.716
43 HA LYS 6 HA LYS 6 6.522 -10.223 -0.854
44 1HB LYS 6 2HB LYS 6 5.484 -11.237 -2.854
45 2HB LYS 6 1HB LYS 6 7.183 -11.648 -2.702
46 1HG LYS 6 2HG LYS 6 6.509 -13.735 -3.119
47 2HG LYS 6 1HG LYS 6 5.997 -13.746 -1.432
48 1HD LYS 6 2HD LYS 6 4.303 -14.517 -3.185
49 2HD LYS 6 1HD LYS 6 3.757 -13.351 -1.981
50 1HE LYS 6 2HE LYS 6 2.994 -12.178 -3.725
51 2HE LYS 6 1HE LYS 6 4.678 -11.728 -3.986
52 1HZ LYS 6 1HZ LYS 6 4.883 -13.640 -5.490
53 2HZ LYS 6 2HZ LYS 6 3.715 -12.529 -6.018
54 3HZ LYS 6 3HZ LYS 6 3.232 -13.980 -5.286
55 H LEU 7 H LEU 7 4.377 -9.550 -1.073
56 HA LEU 7 HA LEU 7 2.300 -11.236 0.108
57 1HB LEU 7 2HB LEU 7 3.331 -8.725 1.273
58 2HB LEU 7 1HB LEU 7 1.595 -8.830 1.154
59 HG LEU 7 HG LEU 7 1.876 -9.652 3.255
60 1HD1 LEU 7 1HD1 LEU 7 2.504 -12.262 1.940
61 2HD1 LEU 7 2HD1 LEU 7 1.409 -11.916 3.278
62 3HD1 LEU 7 3HD1 LEU 7 0.968 -11.452 1.635
63 1HD2 LEU 7 1HD2 LEU 7 4.586 -10.073 2.365
64 2HD2 LEU 7 2HD2 LEU 7 3.963 -9.778 3.989
65 3HD2 LEU 7 3HD2 LEU 7 4.018 -11.421 3.350
66 H TYR 8 H TYR 8 0.829 -8.521 0.176
67 HA TYR 8 HA TYR 8 0.367 -8.287 -2.720
68 1HB TYR 8 2HB TYR 8 -1.698 -8.086 -0.509
69 2HB TYR 8 1HB TYR 8 -2.006 -7.839 -2.230
70 HD1 TYR 8 1HD TYR 8 -2.460 -9.664 -3.642
71 HD2 TYR 8 2HD TYR 8 -0.900 -10.360 0.249
72 HE1 TYR 8 1HE TYR 8 -2.827 -12.072 -3.929
73 HE2 TYR 8 2HE TYR 8 -1.256 -12.762 -0.023
74 HH TYR 8 HH TYR 8 -2.261 -14.353 -1.285
75 H LEU 9 H LEU 9 1.673 -6.562 -2.979
76 HA LEU 9 HA LEU 9 1.795 -4.402 -1.161
77 1HB LEU 9 2HB LEU 9 3.605 -5.176 -2.726
78 2HB LEU 9 1HB LEU 9 2.704 -4.434 -4.033
79 HG LEU 9 HG LEU 9 3.033 -2.244 -3.123
80 1HD1 LEU 9 1HD1 LEU 9 2.805 -2.854 -0.745
81 2HD1 LEU 9 2HD1 LEU 9 4.424 -3.553 -0.791
82 3HD1 LEU 9 3HD1 LEU 9 4.204 -1.824 -1.051
83 1HD2 LEU 9 1HD2 LEU 9 4.852 -2.976 -4.464
84 2HD2 LEU 9 2HD2 LEU 9 5.543 -2.161 -3.061
85 3HD2 LEU 9 3HD2 LEU 9 5.529 -3.922 -3.138
86 H CYS 10 H CYS 10 0.501 -2.745 -0.930
87 HA CYS 10 HA CYS 10 -1.755 -2.237 -2.492
88 1HB CYS 10 2HB CYS 10 -2.133 -1.207 -0.538
89 2HB CYS 10 1HB CYS 10 -0.419 -1.111 -0.175
90 H GLU 11 H GLU 11 1.383 -0.670 -2.396
91 HA GLU 11 HA GLU 11 2.657 0.341 -3.946
92 1HB GLU 11 2HB GLU 11 2.327 -0.062 -6.123
93 2HB GLU 11 1HB GLU 11 1.016 -1.092 -5.563
94 1HG GLU 11 2HG GLU 11 -0.597 0.409 -6.150
95 2HG GLU 11 1HG GLU 11 0.500 1.780 -6.044
96 H PHE 12 H PHE 12 -0.471 1.438 -3.085
97 HA PHE 12 HA PHE 12 -0.088 4.123 -4.106
98 1HB PHE 12 2HB PHE 12 -2.144 3.084 -2.142
99 2HB PHE 12 1HB PHE 12 -2.171 4.652 -2.941
100 HD1 PHE 12 1HD PHE 12 -1.363 3.762 -5.698
101 HD2 PHE 12 2HD PHE 12 -4.140 2.155 -2.903
102 HE1 PHE 12 1HE PHE 12 -2.666 2.799 -7.550
103 HE2 PHE 12 2HE PHE 12 -5.447 1.188 -4.748
104 HZ PHE 12 HZ PHE 12 -4.710 1.508 -7.074
105 H CYS 13 H CYS 13 -0.174 2.547 -0.933
106 HA CYS 13 HA CYS 13 1.558 4.713 0.051
107 1HB CYS 13 2HB CYS 13 0.757 4.357 2.302
108 2HB CYS 13 1HB CYS 13 -0.625 4.641 1.252
109 H LEU 14 H LEU 14 1.465 1.687 -1.068
110 HA LEU 14 HA LEU 14 2.900 -0.053 -1.124
111 1HB LEU 14 2HB LEU 14 4.744 1.848 0.320
112 2HB LEU 14 1HB LEU 14 5.229 0.315 -0.379
113 HG LEU 14 HG LEU 14 3.879 2.070 -2.289
114 1HD1 LEU 14 1HD1 LEU 14 6.626 2.949 -1.530
115 2HD1 LEU 14 2HD1 LEU 14 5.364 3.816 -2.407
116 3HD1 LEU 14 3HD1 LEU 14 5.232 3.593 -0.662
117 1HD2 LEU 14 1HD2 LEU 14 5.990 1.498 -3.568
118 2HD2 LEU 14 2HD2 LEU 14 6.431 0.485 -2.194
119 3HD2 LEU 14 3HD2 LEU 14 4.961 0.141 -3.105
120 H LYS 15 H LYS 15 1.060 -0.499 0.598
121 HA LYS 15 HA LYS 15 2.364 -1.431 3.066
122 1HB LYS 15 2HB LYS 15 0.148 -0.003 3.019
123 2HB LYS 15 1HB LYS 15 -0.601 -1.542 2.623
124 1HG LYS 15 2HG LYS 15 -0.770 -1.227 4.971
125 2HG LYS 15 1HG LYS 15 0.431 -2.490 4.689
126 1HD LYS 15 2HD LYS 15 1.875 -1.318 5.906
127 2HD LYS 15 1HD LYS 15 1.831 -0.056 4.674
128 1HE LYS 15 2HE LYS 15 -0.437 0.504 6.017
129 2HE LYS 15 1HE LYS 15 0.538 -0.173 7.321
130 1HZ LYS 15 1HZ LYS 15 0.712 2.299 6.967
131 2HZ LYS 15 2HZ LYS 15 1.542 1.960 5.527
132 3HZ LYS 15 3HZ LYS 15 2.182 1.457 7.015
133 H TYR 16 H TYR 16 2.302 -3.640 3.570
134 HA TYR 16 HA TYR 16 1.705 -5.344 1.268
135 1HB TYR 16 2HB TYR 16 3.422 -5.693 3.712
136 2HB TYR 16 1HB TYR 16 2.965 -7.068 2.711
137 HD1 TYR 16 1HD TYR 16 3.446 -6.796 0.152
138 HD2 TYR 16 2HD TYR 16 5.344 -4.527 3.204
139 HE1 TYR 16 1HE TYR 16 5.311 -6.312 -1.376
140 HE2 TYR 16 2HE TYR 16 7.215 -4.032 1.685
141 HH TYR 16 HH TYR 16 8.249 -4.869 -0.294
142 H MET 17 H MET 17 -0.231 -6.209 1.224
143 HA MET 17 HA MET 17 -1.655 -6.730 3.719
144 1HB MET 17 2HB MET 17 -2.853 -7.379 1.063
145 2HB MET 17 1HB MET 17 -3.624 -6.767 2.515
146 1HG MET 17 2HG MET 17 -2.065 -5.259 0.447
147 2HG MET 17 1HG MET 17 -3.744 -5.046 0.935
148 1HE MET 17 1HE MET 17 -3.755 -3.119 4.081
149 2HE MET 17 2HE MET 17 -4.459 -4.474 3.197
150 3HE MET 17 3HE MET 17 -3.271 -4.771 4.466
151 H LYS 18 H LYS 18 -2.506 -8.767 4.250
152 HA LYS 18 HA LYS 18 -0.678 -10.877 3.621
153 1HB LYS 18 2HB LYS 18 -3.212 -11.004 5.262
154 2HB LYS 18 1HB LYS 18 -1.895 -12.169 5.278
155 1HG LYS 18 2HG LYS 18 -0.944 -9.500 5.843
156 2HG LYS 18 1HG LYS 18 -2.218 -9.991 6.960
157 1HD LYS 18 2HD LYS 18 -0.521 -10.956 8.080
158 2HD LYS 18 1HD LYS 18 -0.722 -12.241 6.887
159 1HE LYS 18 2HE LYS 18 1.372 -11.911 6.228
160 2HE LYS 18 1HE LYS 18 0.921 -10.291 5.699
161 1HZ LYS 18 1HZ LYS 18 1.263 -9.714 8.185
162 2HZ LYS 18 2HZ LYS 18 2.612 -9.867 7.171
163 3HZ LYS 18 3HZ LYS 18 2.190 -11.132 8.217
164 H SER 19 H SER 19 -3.935 -10.060 2.672
165 HA SER 19 HA SER 19 -3.853 -12.256 0.744
166 1HB SER 19 2HB SER 19 -6.457 -11.694 2.117
167 2HB SER 19 1HB SER 19 -5.902 -13.173 1.331
168 HG SER 19 HG SER 19 -4.696 -13.683 3.089
169 H ARG 20 H ARG 20 -5.205 -11.923 -1.112
170 HA ARG 20 HA ARG 20 -5.196 -9.231 -1.996
171 1HB ARG 20 2HB ARG 20 -5.220 -11.597 -3.274
172 2HB ARG 20 1HB ARG 20 -6.921 -11.176 -3.421
173 1HG ARG 20 2HG ARG 20 -6.313 -9.060 -4.479
174 2HG ARG 20 1HG ARG 20 -4.605 -9.468 -4.315
175 1HD ARG 20 2HD ARG 20 -6.377 -11.409 -5.703
176 2HD ARG 20 1HD ARG 20 -5.953 -9.926 -6.557
177 HE ARG 20 HE ARG 20 -3.680 -10.581 -6.513
178 1HH1 ARG 20 2HH1 ARG 20 -5.900 -13.030 -5.327
179 2HH1 ARG 20 1HH1 ARG 20 -4.717 -14.307 -5.376
180 1HH2 ARG 20 2HH2 ARG 20 -2.125 -12.256 -6.584
181 2HH2 ARG 20 1HH2 ARG 20 -2.562 -13.860 -6.061
182 H THR 21 H THR 21 -7.572 -11.185 -0.420
183 HA THR 21 HA THR 21 -9.925 -9.808 -1.078
184 HB THR 21 HB THR 21 -10.323 -10.610 1.508
185 HG1 THR 21 1HG THR 21 -9.053 -12.402 1.891
186 1HG2 THR 21 1HG2 THR 21 -10.407 -12.234 -1.033
187 2HG2 THR 21 2HG2 THR 21 -11.717 -11.285 -0.329
188 3HG2 THR 21 3HG2 THR 21 -11.145 -12.741 0.488
189 H ILE 22 H ILE 22 -7.613 -9.385 1.567
190 HA ILE 22 HA ILE 22 -8.867 -7.141 2.763
191 HB ILE 22 HB ILE 22 -6.107 -8.329 2.927
192 1HG1 ILE 22 2HG1 ILE 22 -7.414 -8.109 5.431
193 1HG2 ILE 22 1HG2 ILE 22 -7.086 -5.836 4.294
194 2HG2 ILE 22 2HG2 ILE 22 -5.667 -6.751 4.800
195 3HG2 ILE 22 3HG2 ILE 22 -5.706 -6.000 3.207
196 1HD1 ILE 22 1HD1 ILE 22 -7.261 -10.587 3.747
197 2HD1 ILE 22 2HD1 ILE 22 -5.884 -9.928 4.634
198 3HD1 ILE 22 3HD1 ILE 22 -7.321 -10.461 5.506
199 H LEU 23 H LEU 23 -6.257 -7.550 0.420
200 HA LEU 23 HA LEU 23 -5.497 -4.871 0.117
201 1HB LEU 23 2HB LEU 23 -4.147 -6.636 -0.770
202 2HB LEU 23 1HB LEU 23 -5.454 -7.206 -1.789
203 HG LEU 23 HG LEU 23 -5.264 -4.888 -2.942
204 1HD1 LEU 23 1HD1 LEU 23 -3.322 -3.674 -2.696
205 2HD1 LEU 23 2HD1 LEU 23 -3.626 -4.189 -1.037
206 3HD1 LEU 23 3HD1 LEU 23 -2.434 -5.039 -2.019
207 1HD2 LEU 23 1HD2 LEU 23 -4.376 -7.327 -3.580
208 2HD2 LEU 23 2HD2 LEU 23 -4.076 -5.904 -4.578
209 3HD2 LEU 23 3HD2 LEU 23 -2.835 -6.476 -3.465
210 H GLN 24 H GLN 24 -8.074 -6.743 -1.350
211 HA GLN 24 HA GLN 24 -8.862 -4.899 -3.315
212 1HB GLN 24 2HB GLN 24 -9.684 -7.430 -2.427
213 2HB GLN 24 1HB GLN 24 -11.098 -6.398 -2.269
214 1HG GLN 24 2HG GLN 24 -9.486 -6.474 -4.791
215 2HG GLN 24 1HG GLN 24 -10.762 -7.647 -4.466
216 1HE2 GLN 24 1HE2 GLN 24 -10.022 -4.568 -5.619
217 2HE2 GLN 24 2HE2 GLN 24 -11.646 -3.974 -5.794
218 H GLN 25 H GLN 25 -9.440 -5.004 0.110
219 HA GLN 25 HA GLN 25 -11.569 -3.019 -0.044
220 1HB GLN 25 2HB GLN 25 -10.247 -3.961 2.491
221 2HB GLN 25 1HB GLN 25 -11.860 -3.297 2.286
222 1HG GLN 25 2HG GLN 25 -10.867 -6.034 1.582
223 2HG GLN 25 1HG GLN 25 -12.153 -5.585 2.697
224 1HE2 GLN 25 1HE2 GLN 25 -11.694 -7.081 -0.049
225 2HE2 GLN 25 2HE2 GLN 25 -13.131 -6.655 -0.924
226 H HIS 26 H HIS 26 -8.224 -3.353 0.949
227 HA HIS 26 HA HIS 26 -7.803 -0.841 2.075
228 1HB HIS 26 2HB HIS 26 -6.190 -2.666 2.270
229 2HB HIS 26 1HB HIS 26 -5.875 -2.605 0.540
230 HD1 HIS 26 1HD HIS 26 -4.902 -1.032 3.763
231 HD2 HIS 26 2HD HIS 26 -4.417 -0.318 -0.320
232 HE1 HIS 26 1HE HIS 26 -3.113 0.765 3.543
233 H MET 27 H MET 27 -7.600 -1.893 -1.289
234 HA MET 27 HA MET 27 -6.461 0.451 -2.321
235 1HB MET 27 2HB MET 27 -7.979 -1.842 -3.476
236 2HB MET 27 1HB MET 27 -7.676 -0.434 -4.482
237 1HG MET 27 2HG MET 27 -5.248 -0.683 -3.955
238 2HG MET 27 1HG MET 27 -5.641 -2.207 -3.160
239 1HE MET 27 1HE MET 27 -3.588 -2.493 -4.810
240 2HE MET 27 2HE MET 27 -3.831 -3.316 -6.349
241 3HE MET 27 3HE MET 27 -3.750 -1.556 -6.293
242 H LYS 28 H LYS 28 -9.604 -0.115 -1.184
243 HA LYS 28 HA LYS 28 -10.946 1.810 -2.839
244 1HB LYS 28 2HB LYS 28 -11.664 -0.005 -0.659
245 2HB LYS 28 1HB LYS 28 -12.498 1.541 -0.579
246 1HG LYS 28 2HG LYS 28 -13.945 0.330 -1.859
247 2HG LYS 28 1HG LYS 28 -12.956 1.092 -3.109
248 1HD LYS 28 2HD LYS 28 -12.218 -0.883 -3.836
249 2HD LYS 28 1HD LYS 28 -11.796 -1.399 -2.200
250 1HE LYS 28 2HE LYS 28 -14.190 -1.949 -1.820
251 2HE LYS 28 1HE LYS 28 -14.505 -1.559 -3.510
252 1HZ LYS 28 1HZ LYS 28 -14.075 -3.991 -2.820
253 2HZ LYS 28 2HZ LYS 28 -12.439 -3.539 -2.830
254 3HZ LYS 28 3HZ LYS 28 -13.367 -3.397 -4.242
255 H LYS 29 H LYS 29 -9.725 1.758 0.508
256 HA LYS 29 HA LYS 29 -10.441 4.498 0.919
257 1HB LYS 29 2HB LYS 29 -8.947 4.181 3.023
258 2HB LYS 29 1HB LYS 29 -10.480 3.329 2.922
259 1HG LYS 29 2HG LYS 29 -9.338 1.500 3.420
260 2HG LYS 29 1HG LYS 29 -8.701 1.569 1.778
261 1HD LYS 29 2HD LYS 29 -6.825 1.374 3.218
262 2HD LYS 29 1HD LYS 29 -6.866 3.052 2.675
263 1HE LYS 29 2HE LYS 29 -8.291 3.360 4.873
264 2HE LYS 29 1HE LYS 29 -7.423 1.907 5.363
265 1HZ LYS 29 1HZ LYS 29 -6.424 4.205 5.883
266 2HZ LYS 29 2HZ LYS 29 -5.953 4.208 4.255
267 3HZ LYS 29 3HZ LYS 29 -5.400 2.985 5.298
268 H CYS 30 H CYS 30 -7.506 2.769 0.114
269 HA CYS 30 HA CYS 30 -5.774 5.004 0.386
270 1HB CYS 30 2HB CYS 30 -5.353 2.361 0.173
271 2HB CYS 30 1HB CYS 30 -5.032 2.834 -1.493
272 H GLY 31 H GLY 31 -7.821 3.826 -2.168
273 1HA GLY 31 1HA GLY 31 -6.634 5.389 -4.262
274 2HA GLY 31 2HA GLY 31 -8.215 4.610 -4.305
275 H TRP 32 H TRP 32 -8.582 6.115 -1.605
276 HA TRP 32 HA TRP 32 -9.633 8.557 -2.838
277 1HB TRP 32 2HB TRP 32 -10.442 6.876 -0.533
278 2HB TRP 32 1HB TRP 32 -10.664 8.614 -0.348
279 HD1 TRP 32 HD TRP 32 -11.994 5.617 -2.269
280 HE1 TRP 32 1HE TRP 32 -14.132 6.303 -3.521
281 HE3 TRP 32 3HE TRP 32 -11.822 10.658 -1.452
282 HZ2 TRP 32 2HZ TRP 32 -15.547 8.673 -4.095
283 HZ3 TRP 32 3HZ TRP 32 -13.608 12.067 -2.394
284 HH2 TRP 32 HH TRP 32 -15.435 11.091 -3.685
285 H PHE 33 H PHE 33 -8.379 7.719 0.385
286 HA PHE 33 HA PHE 33 -6.403 9.842 0.186
287 1HB PHE 33 2HB PHE 33 -8.856 10.259 1.529
288 2HB PHE 33 1HB PHE 33 -7.636 10.026 2.782
289 HD1 PHE 33 1HD PHE 33 -6.403 11.833 3.479
290 HD2 PHE 33 2HD PHE 33 -8.181 11.915 -0.385
291 HE1 PHE 33 1HE PHE 33 -5.654 14.158 3.188
292 HE2 PHE 33 2HE PHE 33 -7.431 14.238 -0.685
293 HZ PHE 33 HZ PHE 33 -6.164 15.360 1.103
Start of MODEL 14
1 1H GLY 1 1H GLY 1 12.518 -21.592 5.963
2 2H GLY 1 2H GLY 1 13.163 -21.602 4.395
3 3H GLY 1 3H GLY 1 12.512 -23.022 5.048
4 1HA GLY 1 2HA GLY 1 10.668 -22.484 3.942
5 2HA GLY 1 1HA GLY 1 10.426 -21.349 5.265
6 H SER 2 H SER 2 9.420 -19.747 4.107
7 HA SER 2 HA SER 2 10.531 -18.730 1.653
8 1HB SER 2 2HB SER 2 8.725 -16.879 2.897
9 2HB SER 2 1HB SER 2 8.474 -17.869 1.459
10 HG SER 2 HG SER 2 7.659 -19.499 2.704
11 H ARG 3 H ARG 3 11.398 -16.600 1.368
12 HA ARG 3 HA ARG 3 12.986 -15.734 3.672
13 1HB ARG 3 2HB ARG 3 13.265 -15.587 0.740
14 2HB ARG 3 1HB ARG 3 13.787 -14.147 1.603
15 1HG ARG 3 2HG ARG 3 15.463 -15.285 2.741
16 2HG ARG 3 1HG ARG 3 14.733 -16.861 2.432
17 1HD ARG 3 2HD ARG 3 15.645 -17.030 0.371
18 2HD ARG 3 1HD ARG 3 15.485 -15.305 0.048
19 HE ARG 3 HE ARG 3 17.703 -16.632 1.433
20 1HH1 ARG 3 2HH1 ARG 3 16.263 -13.693 0.185
21 2HH1 ARG 3 1HH1 ARG 3 17.752 -12.796 0.202
22 1HH2 ARG 3 2HH2 ARG 3 19.662 -15.472 1.468
23 2HH2 ARG 3 1HH2 ARG 3 19.695 -13.812 0.931
24 H LEU 4 H LEU 4 11.802 -13.769 1.007
25 HA LEU 4 HA LEU 4 10.166 -12.228 2.894
26 1HB LEU 4 2HB LEU 4 12.488 -11.275 1.677
27 2HB LEU 4 1HB LEU 4 11.188 -10.623 0.696
28 HG LEU 4 HG LEU 4 11.267 -10.310 3.691
29 1HD1 LEU 4 1HD1 LEU 4 11.976 -8.030 1.958
30 2HD1 LEU 4 2HD1 LEU 4 12.574 -8.475 3.556
31 3HD1 LEU 4 3HD1 LEU 4 13.195 -9.292 2.123
32 1HD2 LEU 4 1HD2 LEU 4 9.477 -9.491 1.525
33 2HD2 LEU 4 2HD2 LEU 4 9.179 -9.626 3.258
34 3HD2 LEU 4 3HD2 LEU 4 9.947 -8.178 2.605
35 HA PRO 5 HA PRO 5 7.659 -13.977 -0.574
36 1HB PRO 5 2HB PRO 5 5.557 -13.440 1.458
37 2HB PRO 5 1HB PRO 5 5.837 -14.888 0.485
38 1HG PRO 5 2HG PRO 5 6.450 -14.841 3.076
39 2HG PRO 5 1HG PRO 5 7.477 -15.687 1.904
40 1HD PRO 5 2HD PRO 5 7.899 -13.047 3.237
41 2HD PRO 5 1HD PRO 5 9.083 -14.305 2.823
42 H LYS 6 H LYS 6 6.768 -12.778 -2.129
43 HA LYS 6 HA LYS 6 6.437 -9.955 -1.691
44 1HB LYS 6 2HB LYS 6 7.370 -10.918 -3.806
45 2HB LYS 6 1HB LYS 6 5.772 -11.558 -4.167
46 1HG LYS 6 2HG LYS 6 5.830 -9.606 -5.393
47 2HG LYS 6 1HG LYS 6 4.987 -9.112 -3.926
48 1HD LYS 6 2HD LYS 6 7.320 -8.441 -3.068
49 2HD LYS 6 1HD LYS 6 7.809 -8.534 -4.761
50 1HE LYS 6 2HE LYS 6 5.458 -6.907 -3.827
51 2HE LYS 6 1HE LYS 6 7.093 -6.255 -3.914
52 1HZ LYS 6 1HZ LYS 6 5.557 -7.390 -6.192
53 2HZ LYS 6 2HZ LYS 6 7.132 -6.764 -6.280
54 3HZ LYS 6 3HZ LYS 6 5.832 -5.743 -5.907
55 H LEU 7 H LEU 7 4.753 -9.668 -0.314
56 HA LEU 7 HA LEU 7 2.252 -10.972 -0.523
57 1HB LEU 7 2HB LEU 7 3.300 -8.624 0.981
58 2HB LEU 7 1HB LEU 7 1.570 -8.813 0.867
59 HG LEU 7 HG LEU 7 2.090 -9.793 2.899
60 1HD1 LEU 7 1HD1 LEU 7 1.366 -11.521 0.742
61 2HD1 LEU 7 2HD1 LEU 7 2.340 -12.418 1.905
62 3HD1 LEU 7 3HD1 LEU 7 0.877 -11.591 2.435
63 1HD2 LEU 7 1HD2 LEU 7 4.621 -10.409 1.597
64 2HD2 LEU 7 2HD2 LEU 7 4.261 -10.104 3.297
65 3HD2 LEU 7 3HD2 LEU 7 4.026 -11.716 2.620
66 H TYR 8 H TYR 8 0.315 -9.143 -0.401
67 HA TYR 8 HA TYR 8 0.151 -8.186 -3.134
68 1HB TYR 8 2HB TYR 8 -1.967 -7.886 -0.998
69 2HB TYR 8 1HB TYR 8 -2.177 -7.905 -2.750
70 HD1 TYR 8 1HD TYR 8 -2.690 -9.919 -3.849
71 HD2 TYR 8 2HD TYR 8 -1.161 -10.044 0.117
72 HE1 TYR 8 1HE TYR 8 -3.115 -12.338 -3.762
73 HE2 TYR 8 2HE TYR 8 -1.569 -12.455 0.212
74 HH TYR 8 HH TYR 8 -1.773 -14.372 -1.847
75 H LEU 9 H LEU 9 1.489 -6.474 -3.274
76 HA LEU 9 HA LEU 9 1.626 -4.481 -1.225
77 1HB LEU 9 2HB LEU 9 3.564 -5.193 -2.567
78 2HB LEU 9 1HB LEU 9 2.807 -4.533 -4.003
79 HG LEU 9 HG LEU 9 2.991 -2.278 -3.097
80 1HD1 LEU 9 1HD1 LEU 9 3.875 -1.752 -1.012
81 2HD1 LEU 9 2HD1 LEU 9 2.823 -3.128 -0.682
82 3HD1 LEU 9 3HD1 LEU 9 4.568 -3.359 -0.795
83 1HD2 LEU 9 1HD2 LEU 9 5.629 -2.426 -2.741
84 2HD2 LEU 9 2HD2 LEU 9 5.349 -4.030 -3.420
85 3HD2 LEU 9 3HD2 LEU 9 4.865 -2.593 -4.322
86 H CYS 10 H CYS 10 0.322 -2.801 -0.996
87 HA CYS 10 HA CYS 10 -1.687 -2.067 -2.788
88 1HB CYS 10 2HB CYS 10 -2.318 -1.011 -0.928
89 2HB CYS 10 1HB CYS 10 -0.779 -1.382 -0.191
90 H GLU 11 H GLU 11 1.561 -0.859 -2.258
91 HA GLU 11 HA GLU 11 3.036 0.247 -3.547
92 1HB GLU 11 2HB GLU 11 1.179 -0.896 -5.452
93 2HB GLU 11 1HB GLU 11 1.884 0.602 -6.047
94 1HG GLU 11 2HG GLU 11 4.102 -0.260 -5.720
95 2HG GLU 11 1HG GLU 11 3.463 -1.728 -4.985
96 H PHE 12 H PHE 12 0.148 1.525 -2.686
97 HA PHE 12 HA PHE 12 0.789 4.153 -3.858
98 1HB PHE 12 2HB PHE 12 -1.747 3.375 -2.416
99 2HB PHE 12 1HB PHE 12 -1.467 4.817 -3.390
100 HD1 PHE 12 1HD PHE 12 -3.221 1.918 -3.414
101 HD2 PHE 12 2HD PHE 12 -0.421 4.012 -5.845
102 HE1 PHE 12 1HE PHE 12 -4.054 0.727 -5.396
103 HE2 PHE 12 2HE PHE 12 -1.254 2.827 -7.833
104 HZ PHE 12 HZ PHE 12 -3.070 1.177 -7.611
105 H CYS 13 H CYS 13 -0.186 2.590 -0.853
106 HA CYS 13 HA CYS 13 1.234 4.625 0.725
107 1HB CYS 13 2HB CYS 13 -0.024 2.182 1.933
108 2HB CYS 13 1HB CYS 13 0.210 3.774 2.640
109 H LEU 14 H LEU 14 1.450 1.636 -0.820
110 HA LEU 14 HA LEU 14 3.072 0.090 -1.088
111 1HB LEU 14 2HB LEU 14 4.731 2.076 0.454
112 2HB LEU 14 1HB LEU 14 5.374 0.584 -0.206
113 HG LEU 14 HG LEU 14 3.941 2.374 -2.091
114 1HD1 LEU 14 1HD1 LEU 14 6.210 3.554 -2.408
115 2HD1 LEU 14 2HD1 LEU 14 5.142 4.093 -1.114
116 3HD1 LEU 14 3HD1 LEU 14 6.522 3.058 -0.744
117 1HD2 LEU 14 1HD2 LEU 14 5.730 0.150 -2.174
118 2HD2 LEU 14 2HD2 LEU 14 4.862 0.928 -3.498
119 3HD2 LEU 14 3HD2 LEU 14 6.459 1.514 -3.021
120 H LYS 15 H LYS 15 1.177 -0.284 0.811
121 HA LYS 15 HA LYS 15 2.569 -1.518 3.079
122 1HB LYS 15 2HB LYS 15 -0.405 -1.219 2.610
123 2HB LYS 15 1HB LYS 15 0.368 -1.786 4.083
124 1HG LYS 15 2HG LYS 15 0.995 0.930 3.021
125 2HG LYS 15 1HG LYS 15 -0.489 0.649 3.936
126 1HD LYS 15 2HD LYS 15 0.666 0.100 5.875
127 2HD LYS 15 1HD LYS 15 2.149 -0.282 4.998
128 1HE LYS 15 2HE LYS 15 2.590 1.763 6.059
129 2HE LYS 15 1HE LYS 15 2.229 2.195 4.388
130 1HZ LYS 15 1HZ LYS 15 -0.166 2.482 5.302
131 2HZ LYS 15 2HZ LYS 15 0.977 3.706 5.561
132 3HZ LYS 15 3HZ LYS 15 0.606 2.617 6.807
133 H TYR 16 H TYR 16 2.403 -3.734 3.472
134 HA TYR 16 HA TYR 16 1.757 -5.290 1.077
135 1HB TYR 16 2HB TYR 16 3.523 -5.765 3.456
136 2HB TYR 16 1HB TYR 16 2.988 -7.115 2.459
137 HD1 TYR 16 1HD TYR 16 3.447 -6.943 -0.074
138 HD2 TYR 16 2HD TYR 16 5.390 -4.529 2.839
139 HE1 TYR 16 1HE TYR 16 5.267 -6.489 -1.671
140 HE2 TYR 16 2HE TYR 16 7.212 -4.069 1.254
141 HH TYR 16 HH TYR 16 8.135 -5.538 -0.965
142 H MET 17 H MET 17 -0.206 -6.114 1.017
143 HA MET 17 HA MET 17 -1.632 -6.686 3.485
144 1HB MET 17 2HB MET 17 -2.531 -7.001 0.630
145 2HB MET 17 1HB MET 17 -3.558 -7.125 2.044
146 1HG MET 17 2HG MET 17 -2.032 -4.644 1.321
147 2HG MET 17 1HG MET 17 -3.680 -4.964 0.792
148 1HE MET 17 1HE MET 17 -1.534 -3.269 2.918
149 2HE MET 17 2HE MET 17 -2.406 -2.833 4.386
150 3HE MET 17 3HE MET 17 -1.519 -4.355 4.308
151 H LYS 18 H LYS 18 -2.247 -8.686 4.176
152 HA LYS 18 HA LYS 18 -0.515 -10.814 3.299
153 1HB LYS 18 2HB LYS 18 -2.177 -10.230 5.634
154 2HB LYS 18 1HB LYS 18 -2.187 -11.928 5.179
155 1HG LYS 18 2HG LYS 18 -0.431 -11.811 6.673
156 2HG LYS 18 1HG LYS 18 0.383 -11.696 5.112
157 1HD LYS 18 2HD LYS 18 -0.374 -9.078 5.988
158 2HD LYS 18 1HD LYS 18 0.516 -9.894 7.274
159 1HE LYS 18 2HE LYS 18 1.879 -10.484 4.901
160 2HE LYS 18 1HE LYS 18 1.484 -8.770 4.811
161 1HZ LYS 18 1HZ LYS 18 2.986 -8.289 6.365
162 2HZ LYS 18 2HZ LYS 18 3.593 -9.855 6.147
163 3HZ LYS 18 3HZ LYS 18 2.479 -9.543 7.389
164 H SER 19 H SER 19 -3.797 -9.924 2.751
165 HA SER 19 HA SER 19 -4.153 -12.377 1.190
166 1HB SER 19 2HB SER 19 -6.472 -11.232 2.724
167 2HB SER 19 1HB SER 19 -6.267 -12.857 2.068
168 HG SER 19 HG SER 19 -4.739 -13.282 3.671
169 H ARG 20 H ARG 20 -5.410 -12.159 -0.672
170 HA ARG 20 HA ARG 20 -5.292 -9.686 -1.974
171 1HB ARG 20 2HB ARG 20 -5.493 -12.121 -2.896
172 2HB ARG 20 1HB ARG 20 -7.225 -11.817 -2.817
173 1HG ARG 20 2HG ARG 20 -7.178 -10.330 -4.521
174 2HG ARG 20 1HG ARG 20 -5.556 -9.765 -4.119
175 1HD ARG 20 2HD ARG 20 -4.801 -12.109 -4.900
176 2HD ARG 20 1HD ARG 20 -6.376 -12.177 -5.690
177 HE ARG 20 HE ARG 20 -5.576 -9.922 -6.690
178 1HH1 ARG 20 2HH1 ARG 20 -3.569 -12.727 -6.038
179 2HH1 ARG 20 1HH1 ARG 20 -2.446 -12.369 -7.319
180 1HH2 ARG 20 2HH2 ARG 20 -4.108 -9.479 -8.390
181 2HH2 ARG 20 1HH2 ARG 20 -2.748 -10.536 -8.641
182 H THR 21 H THR 21 -7.959 -11.359 -0.396
183 HA THR 21 HA THR 21 -10.040 -9.622 -1.050
184 HB THR 21 HB THR 21 -10.717 -10.439 1.465
185 HG1 THR 21 1HG THR 21 -9.063 -12.522 0.420
186 1HG2 THR 21 1HG2 THR 21 -12.148 -11.852 0.394
187 2HG2 THR 21 2HG2 THR 21 -10.885 -12.514 -0.645
188 3HG2 THR 21 3HG2 THR 21 -11.594 -10.941 -1.012
189 H ILE 22 H ILE 22 -7.713 -9.549 1.598
190 HA ILE 22 HA ILE 22 -8.738 -7.279 2.920
191 HB ILE 22 HB ILE 22 -6.161 -8.783 2.984
192 1HG1 ILE 22 2HG1 ILE 22 -7.743 -7.892 5.357
193 1HG2 ILE 22 1HG2 ILE 22 -5.746 -6.947 4.943
194 2HG2 ILE 22 2HG2 ILE 22 -4.992 -6.908 3.347
195 3HG2 ILE 22 3HG2 ILE 22 -6.438 -5.950 3.662
196 1HD1 ILE 22 1HD1 ILE 22 -6.315 -10.447 4.667
197 2HD1 ILE 22 2HD1 ILE 22 -5.782 -9.205 5.803
198 3HD1 ILE 22 3HD1 ILE 22 -7.225 -10.158 6.152
199 H LEU 23 H LEU 23 -6.278 -7.692 0.403
200 HA LEU 23 HA LEU 23 -5.438 -5.010 0.265
201 1HB LEU 23 2HB LEU 23 -4.124 -6.711 -0.781
202 2HB LEU 23 1HB LEU 23 -5.470 -7.213 -1.787
203 HG LEU 23 HG LEU 23 -5.284 -4.714 -2.669
204 1HD1 LEU 23 1HD1 LEU 23 -3.486 -4.129 -1.090
205 2HD1 LEU 23 2HD1 LEU 23 -2.454 -5.344 -1.844
206 3HD1 LEU 23 3HD1 LEU 23 -2.996 -3.948 -2.774
207 1HD2 LEU 23 1HD2 LEU 23 -3.679 -7.121 -3.467
208 2HD2 LEU 23 2HD2 LEU 23 -5.157 -6.485 -4.189
209 3HD2 LEU 23 3HD2 LEU 23 -3.633 -5.619 -4.393
210 H GLN 24 H GLN 24 -8.050 -6.760 -1.318
211 HA GLN 24 HA GLN 24 -8.880 -4.662 -3.028
212 1HB GLN 24 2HB GLN 24 -10.242 -7.127 -1.962
213 2HB GLN 24 1HB GLN 24 -11.097 -5.973 -2.976
214 1HG GLN 24 2HG GLN 24 -8.641 -7.546 -3.711
215 2HG GLN 24 1HG GLN 24 -10.276 -7.783 -4.323
216 1HE2 GLN 24 1HE2 GLN 24 -7.455 -6.815 -5.321
217 2HE2 GLN 24 2HE2 GLN 24 -7.871 -5.516 -6.390
218 H GLN 25 H GLN 25 -9.364 -5.310 0.333
219 HA GLN 25 HA GLN 25 -11.567 -3.438 0.590
220 1HB GLN 25 2HB GLN 25 -9.980 -4.997 2.636
221 2HB GLN 25 1HB GLN 25 -11.305 -3.915 3.041
222 1HG GLN 25 2HG GLN 25 -12.901 -5.339 2.234
223 2HG GLN 25 1HG GLN 25 -11.806 -6.078 1.066
224 1HE2 GLN 25 1HE2 GLN 25 -12.957 -7.998 2.033
225 2HE2 GLN 25 2HE2 GLN 25 -12.201 -8.745 3.397
226 H HIS 26 H HIS 26 -8.106 -3.537 1.029
227 HA HIS 26 HA HIS 26 -7.849 -1.131 2.512
228 1HB HIS 26 2HB HIS 26 -5.969 -2.614 2.550
229 2HB HIS 26 1HB HIS 26 -5.888 -2.673 0.791
230 HD1 HIS 26 1HD HIS 26 -5.077 -0.398 3.707
231 HD2 HIS 26 2HD HIS 26 -4.468 -0.627 -0.412
232 HE1 HIS 26 1HE HIS 26 -3.613 1.579 3.072
233 H MET 27 H MET 27 -7.627 -1.894 -0.938
234 HA MET 27 HA MET 27 -7.084 0.782 -1.731
235 1HB MET 27 2HB MET 27 -7.866 -1.723 -3.173
236 2HB MET 27 1HB MET 27 -7.881 -0.185 -4.022
237 1HG MET 27 2HG MET 27 -5.504 0.130 -3.307
238 2HG MET 27 1HG MET 27 -5.537 -1.529 -2.711
239 1HE MET 27 1HE MET 27 -3.955 -2.769 -3.925
240 2HE MET 27 2HE MET 27 -3.633 -2.730 -5.658
241 3HE MET 27 3HE MET 27 -3.216 -1.343 -4.651
242 H LYS 28 H LYS 28 -8.672 1.603 -3.622
243 HA LYS 28 HA LYS 28 -10.637 2.604 -4.166
244 1HB LYS 28 2HB LYS 28 -11.741 0.505 -2.318
245 2HB LYS 28 1HB LYS 28 -12.775 1.770 -2.968
246 1HG LYS 28 2HG LYS 28 -13.085 0.020 -4.450
247 2HG LYS 28 1HG LYS 28 -11.881 1.019 -5.267
248 1HD LYS 28 2HD LYS 28 -10.253 -0.541 -5.061
249 2HD LYS 28 1HD LYS 28 -10.812 -1.064 -3.470
250 1HE LYS 28 2HE LYS 28 -11.762 -2.841 -4.402
251 2HE LYS 28 1HE LYS 28 -12.800 -1.781 -5.356
252 1HZ LYS 28 1HZ LYS 28 -10.137 -2.855 -6.113
253 2HZ LYS 28 2HZ LYS 28 -10.938 -1.639 -6.984
254 3HZ LYS 28 3HZ LYS 28 -11.632 -3.177 -6.849
255 H LYS 29 H LYS 29 -9.616 2.331 -0.897
256 HA LYS 29 HA LYS 29 -10.540 5.059 -0.439
257 1HB LYS 29 2HB LYS 29 -11.505 4.602 1.548
258 2HB LYS 29 1HB LYS 29 -11.580 2.948 0.967
259 1HG LYS 29 2HG LYS 29 -9.035 3.568 2.215
260 2HG LYS 29 1HG LYS 29 -10.404 3.814 3.300
261 1HD LYS 29 2HD LYS 29 -10.348 1.325 1.677
262 2HD LYS 29 1HD LYS 29 -9.236 1.448 3.042
263 1HE LYS 29 2HE LYS 29 -10.923 1.477 4.588
264 2HE LYS 29 1HE LYS 29 -12.080 2.194 3.468
265 1HZ LYS 29 1HZ LYS 29 -12.062 -0.388 4.188
266 2HZ LYS 29 2HZ LYS 29 -11.192 -0.456 2.735
267 3HZ LYS 29 3HZ LYS 29 -12.756 0.200 2.753
268 H CYS 30 H CYS 30 -8.133 2.899 -0.872
269 HA CYS 30 HA CYS 30 -6.045 3.625 0.812
270 1HB CYS 30 2HB CYS 30 -5.709 1.730 -0.549
271 2HB CYS 30 1HB CYS 30 -6.254 2.559 -1.998
272 H GLY 31 H GLY 31 -5.874 5.628 1.215
273 1HA GLY 31 1HA GLY 31 -6.570 7.889 0.497
274 2HA GLY 31 2HA GLY 31 -4.842 7.790 0.776
275 H TRP 32 H TRP 32 -7.367 7.997 -1.588
276 HA TRP 32 HA TRP 32 -5.441 8.430 -3.752
277 1HB TRP 32 2HB TRP 32 -8.387 7.890 -3.627
278 2HB TRP 32 1HB TRP 32 -7.729 8.710 -5.038
279 HD1 TRP 32 HD TRP 32 -8.548 5.367 -3.916
280 HE1 TRP 32 1HE TRP 32 -7.302 3.573 -5.278
281 HE3 TRP 32 3HE TRP 32 -5.032 8.338 -6.152
282 HZ2 TRP 32 2HZ TRP 32 -5.130 3.437 -7.067
283 HZ3 TRP 32 3HZ TRP 32 -3.408 7.292 -7.678
284 HH2 TRP 32 HH TRP 32 -3.455 4.891 -8.119
285 H PHE 33 H PHE 33 -8.561 9.980 -3.341
286 HA PHE 33 HA PHE 33 -7.295 12.596 -3.642
287 1HB PHE 33 2HB PHE 33 -9.977 13.110 -3.572
288 2HB PHE 33 1HB PHE 33 -9.064 12.794 -5.045
289 HD1 PHE 33 1HD PHE 33 -9.643 11.028 -6.428
290 HD2 PHE 33 2HD PHE 33 -11.089 11.095 -2.424
291 HE1 PHE 33 1HE PHE 33 -11.085 9.097 -6.919
292 HE2 PHE 33 2HE PHE 33 -12.536 9.166 -2.912
293 HZ PHE 33 HZ PHE 33 -12.535 8.162 -5.160
Start of MODEL 15
1 1H GLY 1 1H GLY 1 7.880 -7.034 -6.844
2 2H GLY 1 2H GLY 1 7.943 -6.938 -5.150
3 3H GLY 1 3H GLY 1 6.841 -7.985 -5.901
4 1HA GLY 1 2HA GLY 1 9.735 -8.278 -5.544
5 2HA GLY 1 1HA GLY 1 8.457 -9.463 -5.305
6 H SER 2 H SER 2 11.039 -9.139 -7.042
7 HA SER 2 HA SER 2 10.208 -9.276 -9.732
8 1HB SER 2 2HB SER 2 12.671 -10.721 -9.164
9 2HB SER 2 1HB SER 2 12.426 -9.252 -10.113
10 HG SER 2 HG SER 2 13.004 -8.085 -8.452
11 H ARG 3 H ARG 3 10.778 -11.744 -7.271
12 HA ARG 3 HA ARG 3 9.445 -13.661 -9.060
13 1HB ARG 3 2HB ARG 3 10.717 -15.486 -7.932
14 2HB ARG 3 1HB ARG 3 11.725 -14.408 -8.887
15 1HG ARG 3 2HG ARG 3 12.986 -13.945 -7.130
16 2HG ARG 3 1HG ARG 3 11.576 -13.467 -6.183
17 1HD ARG 3 2HD ARG 3 11.342 -16.181 -6.190
18 2HD ARG 3 1HD ARG 3 13.094 -15.975 -6.177
19 HE ARG 3 HE ARG 3 12.394 -14.305 -4.237
20 1HH1 ARG 3 2HH1 ARG 3 11.347 -17.584 -4.883
21 2HH1 ARG 3 1HH1 ARG 3 10.976 -17.933 -3.219
22 1HH2 ARG 3 2HH2 ARG 3 11.905 -14.751 -2.049
23 2HH2 ARG 3 1HH2 ARG 3 11.300 -16.320 -1.600
24 H LEU 4 H LEU 4 7.783 -14.782 -8.214
25 HA LEU 4 HA LEU 4 6.098 -15.378 -6.817
26 1HB LEU 4 2HB LEU 4 8.347 -15.141 -5.017
27 2HB LEU 4 1HB LEU 4 6.871 -14.617 -4.230
28 HG LEU 4 HG LEU 4 6.065 -16.953 -5.396
29 1HD1 LEU 4 1HD1 LEU 4 8.155 -18.354 -4.325
30 2HD1 LEU 4 2HD1 LEU 4 7.887 -18.071 -6.046
31 3HD1 LEU 4 3HD1 LEU 4 8.970 -17.018 -5.139
32 1HD2 LEU 4 1HD2 LEU 4 5.806 -17.717 -3.240
33 2HD2 LEU 4 2HD2 LEU 4 7.330 -17.014 -2.695
34 3HD2 LEU 4 3HD2 LEU 4 5.934 -15.976 -2.986
35 HA PRO 5 HA PRO 5 3.768 -11.687 -6.408
36 1HB PRO 5 2HB PRO 5 2.055 -12.298 -4.337
37 2HB PRO 5 1HB PRO 5 1.838 -12.838 -6.004
38 1HG PRO 5 2HG PRO 5 2.989 -14.310 -3.670
39 2HG PRO 5 1HG PRO 5 1.912 -14.899 -4.951
40 1HD PRO 5 2HD PRO 5 4.548 -15.426 -4.971
41 2HD PRO 5 1HD PRO 5 3.644 -15.135 -6.473
42 H LYS 6 H LYS 6 5.003 -13.046 -3.402
43 HA LYS 6 HA LYS 6 5.850 -12.140 -1.509
44 1HB LYS 6 2HB LYS 6 6.959 -10.715 -3.631
45 2HB LYS 6 1HB LYS 6 6.414 -9.468 -2.521
46 1HG LYS 6 2HG LYS 6 7.754 -10.338 -0.760
47 2HG LYS 6 1HG LYS 6 8.146 -11.780 -1.700
48 1HD LYS 6 2HD LYS 6 9.416 -10.486 -3.269
49 2HD LYS 6 1HD LYS 6 8.891 -8.976 -2.520
50 1HE LYS 6 2HE LYS 6 10.017 -9.766 -0.412
51 2HE LYS 6 1HE LYS 6 10.708 -11.081 -1.362
52 1HZ LYS 6 1HZ LYS 6 11.767 -8.583 -1.046
53 2HZ LYS 6 2HZ LYS 6 11.092 -8.534 -2.599
54 3HZ LYS 6 3HZ LYS 6 12.230 -9.731 -2.207
55 H LEU 7 H LEU 7 3.353 -12.213 -1.329
56 HA LEU 7 HA LEU 7 1.489 -11.423 -0.323
57 1HB LEU 7 2HB LEU 7 3.380 -9.250 0.536
58 2HB LEU 7 1HB LEU 7 1.678 -9.170 0.902
59 HG LEU 7 HG LEU 7 2.508 -10.077 2.841
60 1HD1 LEU 7 1HD1 LEU 7 2.013 -12.508 2.840
61 2HD1 LEU 7 2HD1 LEU 7 0.761 -11.535 2.066
62 3HD1 LEU 7 3HD1 LEU 7 1.904 -12.449 1.080
63 1HD2 LEU 7 1HD2 LEU 7 4.433 -11.708 1.182
64 2HD2 LEU 7 2HD2 LEU 7 4.819 -10.285 2.150
65 3HD2 LEU 7 3HD2 LEU 7 4.294 -11.771 2.938
66 H TYR 8 H TYR 8 0.426 -8.876 -0.129
67 HA TYR 8 HA TYR 8 0.142 -8.162 -2.968
68 1HB TYR 8 2HB TYR 8 -2.032 -8.050 -0.867
69 2HB TYR 8 1HB TYR 8 -2.216 -7.899 -2.619
70 HD1 TYR 8 1HD TYR 8 -2.275 -9.842 -4.028
71 HD2 TYR 8 2HD TYR 8 -1.530 -10.252 0.140
72 HE1 TYR 8 1HE TYR 8 -2.574 -12.274 -4.213
73 HE2 TYR 8 2HE TYR 8 -1.818 -12.679 -0.039
74 HH TYR 8 HH TYR 8 -1.768 -14.330 -2.914
75 H LEU 9 H LEU 9 1.395 -6.416 -3.050
76 HA LEU 9 HA LEU 9 1.513 -4.510 -0.932
77 1HB LEU 9 2HB LEU 9 3.470 -5.071 -2.239
78 2HB LEU 9 1HB LEU 9 2.684 -4.529 -3.708
79 HG LEU 9 HG LEU 9 2.597 -2.215 -2.580
80 1HD1 LEU 9 1HD1 LEU 9 4.494 -1.879 -0.984
81 2HD1 LEU 9 2HD1 LEU 9 3.136 -2.796 -0.335
82 3HD1 LEU 9 3HD1 LEU 9 4.604 -3.634 -0.842
83 1HD2 LEU 9 1HD2 LEU 9 5.049 -1.850 -3.191
84 2HD2 LEU 9 2HD2 LEU 9 5.081 -3.570 -3.585
85 3HD2 LEU 9 3HD2 LEU 9 3.988 -2.485 -4.447
86 H CYS 10 H CYS 10 0.639 -2.549 -0.762
87 HA CYS 10 HA CYS 10 -1.291 -1.626 -2.719
88 1HB CYS 10 2HB CYS 10 -2.074 -1.281 -0.504
89 2HB CYS 10 1HB CYS 10 -0.502 -0.712 0.048
90 H GLU 11 H GLU 11 -0.796 -0.117 -4.117
91 HA GLU 11 HA GLU 11 1.949 0.839 -4.174
92 1HB GLU 11 2HB GLU 11 -0.188 0.966 -6.311
93 2HB GLU 11 1HB GLU 11 1.509 1.391 -6.522
94 1HG GLU 11 2HG GLU 11 1.918 -1.036 -5.670
95 2HG GLU 11 1HG GLU 11 0.250 -1.287 -6.183
96 H PHE 12 H PHE 12 -0.419 1.911 -2.543
97 HA PHE 12 HA PHE 12 -0.195 4.713 -3.419
98 1HB PHE 12 2HB PHE 12 -2.352 3.503 -1.676
99 2HB PHE 12 1HB PHE 12 -2.320 5.136 -2.337
100 HD1 PHE 12 1HD PHE 12 -3.585 1.896 -2.780
101 HD2 PHE 12 2HD PHE 12 -2.120 5.249 -4.962
102 HE1 PHE 12 1HE PHE 12 -4.755 1.101 -4.787
103 HE2 PHE 12 2HE PHE 12 -3.301 4.461 -6.969
104 HZ PHE 12 HZ PHE 12 -4.620 2.385 -6.883
105 H CYS 13 H CYS 13 -0.278 2.629 -0.516
106 HA CYS 13 HA CYS 13 1.316 4.713 0.832
107 1HB CYS 13 2HB CYS 13 0.560 3.878 2.990
108 2HB CYS 13 1HB CYS 13 -0.822 4.323 1.999
109 H LEU 14 H LEU 14 1.472 1.872 -0.715
110 HA LEU 14 HA LEU 14 2.967 0.207 -0.931
111 1HB LEU 14 2HB LEU 14 4.666 2.377 0.258
112 2HB LEU 14 1HB LEU 14 5.344 0.835 -0.240
113 HG LEU 14 HG LEU 14 3.678 2.302 -2.218
114 1HD1 LEU 14 1HD1 LEU 14 4.885 4.172 -1.754
115 2HD1 LEU 14 2HD1 LEU 14 6.269 3.266 -1.143
116 3HD1 LEU 14 3HD1 LEU 14 5.985 3.377 -2.880
117 1HD2 LEU 14 1HD2 LEU 14 5.693 1.438 -3.624
118 2HD2 LEU 14 2HD2 LEU 14 5.989 0.415 -2.217
119 3HD2 LEU 14 3HD2 LEU 14 4.451 0.312 -3.076
120 H LYS 15 H LYS 15 1.507 -0.764 0.753
121 HA LYS 15 HA LYS 15 3.211 -1.818 2.902
122 1HB LYS 15 2HB LYS 15 1.546 -0.281 3.892
123 2HB LYS 15 1HB LYS 15 0.255 -1.195 3.125
124 1HG LYS 15 2HG LYS 15 0.134 -2.276 5.069
125 2HG LYS 15 1HG LYS 15 1.564 -3.143 4.505
126 1HD LYS 15 2HD LYS 15 2.890 -1.206 5.564
127 2HD LYS 15 1HD LYS 15 1.387 -0.837 6.414
128 1HE LYS 15 2HE LYS 15 1.805 -3.616 6.652
129 2HE LYS 15 1HE LYS 15 3.349 -2.836 6.997
130 1HZ LYS 15 1HZ LYS 15 2.563 -1.895 8.866
131 2HZ LYS 15 2HZ LYS 15 1.464 -3.185 8.818
132 3HZ LYS 15 3HZ LYS 15 0.999 -1.653 8.246
133 H TYR 16 H TYR 16 2.977 -4.056 3.259
134 HA TYR 16 HA TYR 16 1.788 -5.465 1.006
135 1HB TYR 16 2HB TYR 16 3.660 -6.289 3.220
136 2HB TYR 16 1HB TYR 16 2.952 -7.457 2.109
137 HD1 TYR 16 1HD TYR 16 5.694 -5.332 2.693
138 HD2 TYR 16 2HD TYR 16 3.291 -6.914 -0.439
139 HE1 TYR 16 1HE TYR 16 7.504 -4.891 1.091
140 HE2 TYR 16 2HE TYR 16 5.094 -6.469 -2.053
141 HH TYR 16 HH TYR 16 7.232 -5.876 -2.306
142 H MET 17 H MET 17 -0.014 -6.626 1.085
143 HA MET 17 HA MET 17 -1.324 -6.976 3.686
144 1HB MET 17 2HB MET 17 -2.518 -7.309 0.930
145 2HB MET 17 1HB MET 17 -3.392 -7.302 2.450
146 1HG MET 17 2HG MET 17 -1.860 -4.963 1.350
147 2HG MET 17 1HG MET 17 -3.593 -5.206 1.166
148 1HE MET 17 1HE MET 17 -2.781 -2.266 2.905
149 2HE MET 17 2HE MET 17 -1.571 -2.817 4.064
150 3HE MET 17 3HE MET 17 -1.388 -3.195 2.351
151 H LYS 18 H LYS 18 -2.147 -8.979 4.319
152 HA LYS 18 HA LYS 18 -0.469 -11.159 3.523
153 1HB LYS 18 2HB LYS 18 -2.784 -11.055 5.468
154 2HB LYS 18 1HB LYS 18 -1.698 -12.424 5.274
155 1HG LYS 18 2HG LYS 18 -0.830 -9.667 6.107
156 2HG LYS 18 1HG LYS 18 -1.167 -10.997 7.217
157 1HD LYS 18 2HD LYS 18 0.822 -11.944 6.836
158 2HD LYS 18 1HD LYS 18 0.658 -11.762 5.088
159 1HE LYS 18 2HE LYS 18 1.600 -9.634 5.097
160 2HE LYS 18 1HE LYS 18 1.306 -9.408 6.820
161 1HZ LYS 18 1HZ LYS 18 3.229 -10.376 7.343
162 2HZ LYS 18 2HZ LYS 18 3.660 -10.131 5.726
163 3HZ LYS 18 3HZ LYS 18 3.037 -11.634 6.218
164 H SER 19 H SER 19 -3.752 -10.221 2.852
165 HA SER 19 HA SER 19 -3.986 -12.543 1.076
166 1HB SER 19 2HB SER 19 -6.424 -11.581 2.521
167 2HB SER 19 1HB SER 19 -6.062 -13.182 1.878
168 HG SER 19 HG SER 19 -5.986 -13.049 4.199
169 H ARG 20 H ARG 20 -5.315 -12.204 -0.777
170 HA ARG 20 HA ARG 20 -5.119 -9.583 -1.813
171 1HB ARG 20 2HB ARG 20 -5.378 -11.995 -2.971
172 2HB ARG 20 1HB ARG 20 -7.044 -11.436 -3.095
173 1HG ARG 20 2HG ARG 20 -6.345 -9.467 -4.294
174 2HG ARG 20 1HG ARG 20 -4.647 -9.896 -4.070
175 1HD ARG 20 2HD ARG 20 -5.323 -10.493 -6.299
176 2HD ARG 20 1HD ARG 20 -5.041 -11.964 -5.368
177 HE ARG 20 HE ARG 20 -7.224 -12.526 -5.669
178 1HH1 ARG 20 2HH1 ARG 20 -6.890 -9.092 -6.319
179 2HH1 ARG 20 1HH1 ARG 20 -8.543 -8.904 -6.835
180 1HH2 ARG 20 2HH2 ARG 20 -9.377 -12.284 -6.337
181 2HH2 ARG 20 1HH2 ARG 20 -9.966 -10.716 -6.832
182 H THR 21 H THR 21 -7.771 -11.366 -0.344
183 HA THR 21 HA THR 21 -9.818 -9.527 -0.984
184 HB THR 21 HB THR 21 -9.836 -11.972 0.133
185 HG1 THR 21 1HG THR 21 -12.042 -10.508 0.923
186 1HG2 THR 21 1HG2 THR 21 -9.177 -10.484 2.342
187 2HG2 THR 21 2HG2 THR 21 -9.944 -12.071 2.375
188 3HG2 THR 21 3HG2 THR 21 -10.931 -10.613 2.481
189 H ILE 22 H ILE 22 -7.273 -9.456 1.360
190 HA ILE 22 HA ILE 22 -8.415 -7.426 3.039
191 HB ILE 22 HB ILE 22 -5.601 -8.481 2.732
192 1HG1 ILE 22 2HG1 ILE 22 -7.556 -8.707 5.031
193 1HG2 ILE 22 1HG2 ILE 22 -6.089 -6.943 5.134
194 2HG2 ILE 22 2HG2 ILE 22 -4.765 -6.837 3.973
195 3HG2 ILE 22 3HG2 ILE 22 -6.269 -5.967 3.676
196 1HD1 ILE 22 1HD1 ILE 22 -4.922 -10.030 4.482
197 2HD1 ILE 22 2HD1 ILE 22 -5.375 -9.040 5.870
198 3HD1 ILE 22 3HD1 ILE 22 -6.090 -10.638 5.654
199 H LEU 23 H LEU 23 -6.074 -7.565 0.384
200 HA LEU 23 HA LEU 23 -5.527 -4.789 0.299
201 1HB LEU 23 2HB LEU 23 -4.087 -6.525 -0.723
202 2HB LEU 23 1HB LEU 23 -5.326 -6.817 -1.928
203 HG LEU 23 HG LEU 23 -5.065 -4.427 -2.657
204 1HD1 LEU 23 1HD1 LEU 23 -3.211 -3.141 -1.967
205 2HD1 LEU 23 2HD1 LEU 23 -3.983 -3.719 -0.491
206 3HD1 LEU 23 3HD1 LEU 23 -2.509 -4.491 -1.078
207 1HD2 LEU 23 1HD2 LEU 23 -4.007 -5.648 -4.205
208 2HD2 LEU 23 2HD2 LEU 23 -2.536 -5.045 -3.441
209 3HD2 LEU 23 3HD2 LEU 23 -3.171 -6.631 -3.002
210 H GLN 24 H GLN 24 -8.001 -6.809 -1.124
211 HA GLN 24 HA GLN 24 -9.034 -4.916 -2.952
212 1HB GLN 24 2HB GLN 24 -10.141 -7.371 -1.634
213 2HB GLN 24 1HB GLN 24 -11.182 -6.341 -2.609
214 1HG GLN 24 2HG GLN 24 -9.828 -6.694 -4.545
215 2HG GLN 24 1HG GLN 24 -8.614 -7.553 -3.597
216 1HE2 GLN 24 1HE2 GLN 24 -11.980 -7.664 -4.633
217 2HE2 GLN 24 2HE2 GLN 24 -12.103 -9.395 -4.650
218 H GLN 25 H GLN 25 -9.620 -5.545 0.455
219 HA GLN 25 HA GLN 25 -11.768 -3.661 0.727
220 1HB GLN 25 2HB GLN 25 -9.998 -5.126 2.674
221 2HB GLN 25 1HB GLN 25 -11.108 -3.877 3.218
222 1HG GLN 25 2HG GLN 25 -12.982 -5.118 2.626
223 2HG GLN 25 1HG GLN 25 -12.060 -6.185 1.570
224 1HE2 GLN 25 1HE2 GLN 25 -10.589 -7.680 2.572
225 2HE2 GLN 25 2HE2 GLN 25 -10.916 -8.281 4.165
226 H HIS 26 H HIS 26 -8.370 -3.510 0.523
227 HA HIS 26 HA HIS 26 -8.125 -1.008 1.959
228 1HB HIS 26 2HB HIS 26 -6.412 -2.799 2.156
229 2HB HIS 26 1HB HIS 26 -6.031 -2.590 0.451
230 HD1 HIS 26 1HD HIS 26 -5.605 -0.900 3.805
231 HD2 HIS 26 2HD HIS 26 -4.491 -0.392 -0.183
232 HE1 HIS 26 1HE HIS 26 -3.825 0.918 3.770
233 H MET 27 H MET 27 -7.590 -2.164 -1.380
234 HA MET 27 HA MET 27 -7.107 0.521 -2.308
235 1HB MET 27 2HB MET 27 -7.710 -1.817 -4.062
236 2HB MET 27 1HB MET 27 -6.878 -0.335 -4.476
237 1HG MET 27 2HG MET 27 -5.087 -1.041 -2.835
238 2HG MET 27 1HG MET 27 -5.869 -2.621 -2.821
239 1HE MET 27 1HE MET 27 -2.922 -1.951 -3.458
240 2HE MET 27 2HE MET 27 -2.431 -2.148 -5.140
241 3HE MET 27 3HE MET 27 -3.059 -0.598 -4.582
242 H LYS 28 H LYS 28 -8.633 1.752 -2.134
243 HA LYS 28 HA LYS 28 -10.688 2.141 -3.805
244 1HB LYS 28 2HB LYS 28 -12.699 1.711 -2.184
245 2HB LYS 28 1HB LYS 28 -12.124 0.432 -3.235
246 1HG LYS 28 2HG LYS 28 -12.649 -0.344 -0.965
247 2HG LYS 28 1HG LYS 28 -10.960 -0.615 -1.396
248 1HD LYS 28 2HD LYS 28 -10.482 0.364 0.558
249 2HD LYS 28 1HD LYS 28 -10.894 1.871 -0.276
250 1HE LYS 28 2HE LYS 28 -12.121 1.872 1.756
251 2HE LYS 28 1HE LYS 28 -13.274 1.501 0.476
252 1HZ LYS 28 1HZ LYS 28 -11.982 -0.750 1.827
253 2HZ LYS 28 2HZ LYS 28 -13.558 -0.614 1.215
254 3HZ LYS 28 3HZ LYS 28 -13.158 0.108 2.699
255 H LYS 29 H LYS 29 -9.047 2.663 -0.970
256 HA LYS 29 HA LYS 29 -10.369 5.255 -0.560
257 1HB LYS 29 2HB LYS 29 -10.863 3.740 1.292
258 2HB LYS 29 1HB LYS 29 -9.148 3.415 1.506
259 1HG LYS 29 2HG LYS 29 -9.680 6.243 1.637
260 2HG LYS 29 1HG LYS 29 -10.675 5.351 2.790
261 1HD LYS 29 2HD LYS 29 -8.779 4.409 3.841
262 2HD LYS 29 1HD LYS 29 -7.712 4.901 2.524
263 1HE LYS 29 2HE LYS 29 -9.192 7.044 3.929
264 2HE LYS 29 1HE LYS 29 -7.897 6.250 4.826
265 1HZ LYS 29 1HZ LYS 29 -7.731 7.835 2.340
266 2HZ LYS 29 2HZ LYS 29 -6.522 6.699 2.719
267 3HZ LYS 29 3HZ LYS 29 -6.834 7.987 3.774
268 H CYS 30 H CYS 30 -7.377 3.436 -0.285
269 HA CYS 30 HA CYS 30 -5.662 5.470 0.460
270 1HB CYS 30 2HB CYS 30 -5.448 2.798 -0.024
271 2HB CYS 30 1HB CYS 30 -4.527 3.460 -1.365
272 H GLY 31 H GLY 31 -6.499 4.370 -2.810
273 1HA GLY 31 1HA GLY 31 -4.776 6.315 -4.047
274 2HA GLY 31 2HA GLY 31 -5.884 5.228 -4.869
275 H TRP 32 H TRP 32 -7.438 6.920 -2.413
276 HA TRP 32 HA TRP 32 -8.385 8.931 -4.338
277 1HB TRP 32 2HB TRP 32 -9.926 7.309 -2.316
278 2HB TRP 32 1HB TRP 32 -10.571 8.799 -3.005
279 HD1 TRP 32 HD TRP 32 -10.406 5.167 -3.653
280 HE1 TRP 32 1HE TRP 32 -11.221 4.632 -6.033
281 HE3 TRP 32 3HE TRP 32 -10.413 9.895 -5.577
282 HZ2 TRP 32 2HZ TRP 32 -11.778 6.033 -8.410
283 HZ3 TRP 32 3HZ TRP 32 -11.093 10.215 -7.920
284 HH2 TRP 32 HH TRP 32 -11.764 8.320 -9.307
285 H PHE 33 H PHE 33 -9.622 8.939 -1.123
286 HA PHE 33 HA PHE 33 -7.951 11.289 -0.518
287 1HB PHE 33 2HB PHE 33 -10.515 10.939 0.924
288 2HB PHE 33 1HB PHE 33 -9.769 12.402 0.283
289 HD1 PHE 33 1HD PHE 33 -12.161 9.761 -0.292
290 HD2 PHE 33 2HD PHE 33 -10.003 12.935 -2.138
291 HE1 PHE 33 1HE PHE 33 -13.730 9.726 -2.184
292 HE2 PHE 33 2HE PHE 33 -11.570 12.900 -4.036
293 HZ PHE 33 HZ PHE 33 -13.437 11.297 -4.060
Start of MODEL 16
1 1H GLY 1 1H GLY 1 17.382 -18.616 3.969
2 2H GLY 1 2H GLY 1 15.819 -19.077 4.429
3 3H GLY 1 3H GLY 1 16.049 -17.677 3.501
4 1HA GLY 1 2HA GLY 1 17.221 -19.863 2.173
5 2HA GLY 1 1HA GLY 1 15.567 -20.266 2.608
6 H SER 2 H SER 2 14.686 -20.180 0.582
7 HA SER 2 HA SER 2 14.579 -17.498 -0.624
8 1HB SER 2 2HB SER 2 14.430 -19.863 -2.429
9 2HB SER 2 1HB SER 2 15.084 -18.254 -2.731
10 HG SER 2 HG SER 2 16.935 -18.795 -1.639
11 H ARG 3 H ARG 3 12.825 -19.372 1.111
12 HA ARG 3 HA ARG 3 10.449 -19.442 -0.613
13 1HB ARG 3 2HB ARG 3 11.218 -21.379 0.987
14 2HB ARG 3 1HB ARG 3 10.446 -20.400 2.226
15 1HG ARG 3 2HG ARG 3 8.723 -20.649 -0.058
16 2HG ARG 3 1HG ARG 3 9.238 -22.240 0.505
17 1HD ARG 3 2HD ARG 3 7.888 -22.120 2.266
18 2HD ARG 3 1HD ARG 3 8.566 -20.565 2.740
19 HE ARG 3 HE ARG 3 6.648 -20.439 0.578
20 1HH1 ARG 3 2HH1 ARG 3 7.150 -20.305 4.050
21 2HH1 ARG 3 1HH1 ARG 3 5.666 -19.450 4.357
22 1HH2 ARG 3 2HH2 ARG 3 4.674 -19.352 0.991
23 2HH2 ARG 3 1HH2 ARG 3 4.241 -18.947 2.629
24 H LEU 4 H LEU 4 10.891 -16.994 -0.432
25 HA LEU 4 HA LEU 4 9.753 -15.858 2.006
26 1HB LEU 4 2HB LEU 4 11.547 -14.910 -0.124
27 2HB LEU 4 1HB LEU 4 10.367 -13.727 0.413
28 HG LEU 4 HG LEU 4 11.182 -14.226 2.786
29 1HD1 LEU 4 1HD1 LEU 4 13.756 -15.081 1.609
30 2HD1 LEU 4 2HD1 LEU 4 13.038 -15.468 3.171
31 3HD1 LEU 4 3HD1 LEU 4 12.485 -16.296 1.716
32 1HD2 LEU 4 1HD2 LEU 4 13.318 -12.848 2.346
33 2HD2 LEU 4 2HD2 LEU 4 12.764 -12.819 0.673
34 3HD2 LEU 4 3HD2 LEU 4 11.755 -12.140 1.948
35 HA PRO 5 HA PRO 5 5.839 -15.784 -0.088
36 1HB PRO 5 2HB PRO 5 5.006 -14.147 2.223
37 2HB PRO 5 1HB PRO 5 4.377 -15.698 1.658
38 1HG PRO 5 2HG PRO 5 5.852 -15.523 3.886
39 2HG PRO 5 1HG PRO 5 5.988 -16.913 2.791
40 1HD PRO 5 2HD PRO 5 7.793 -14.536 3.070
41 2HD PRO 5 1HD PRO 5 8.213 -16.250 2.855
42 H LYS 6 H LYS 6 5.227 -14.470 -1.653
43 HA LYS 6 HA LYS 6 5.959 -11.644 -1.552
44 1HB LYS 6 2HB LYS 6 5.864 -13.538 -3.608
45 2HB LYS 6 1HB LYS 6 4.508 -12.463 -3.926
46 1HG LYS 6 2HG LYS 6 7.070 -11.165 -3.261
47 2HG LYS 6 1HG LYS 6 6.998 -12.014 -4.805
48 1HD LYS 6 2HD LYS 6 4.602 -10.547 -4.575
49 2HD LYS 6 1HD LYS 6 5.908 -9.466 -4.085
50 1HE LYS 6 2HE LYS 6 5.933 -9.101 -6.339
51 2HE LYS 6 1HE LYS 6 7.065 -10.449 -6.240
52 1HZ LYS 6 1HZ LYS 6 5.559 -11.904 -7.128
53 2HZ LYS 6 2HZ LYS 6 5.123 -10.491 -7.949
54 3HZ LYS 6 3HZ LYS 6 4.209 -11.014 -6.626
55 H LEU 7 H LEU 7 4.534 -10.576 -0.306
56 HA LEU 7 HA LEU 7 1.752 -11.240 -0.223
57 1HB LEU 7 2HB LEU 7 3.410 -9.051 0.972
58 2HB LEU 7 1HB LEU 7 1.668 -9.002 1.074
59 HG LEU 7 HG LEU 7 2.251 -9.925 3.104
60 1HD1 LEU 7 1HD1 LEU 7 1.550 -12.020 1.113
61 2HD1 LEU 7 2HD1 LEU 7 1.990 -12.529 2.743
62 3HD1 LEU 7 3HD1 LEU 7 0.637 -11.425 2.499
63 1HD2 LEU 7 1HD2 LEU 7 4.501 -10.282 3.152
64 2HD2 LEU 7 2HD2 LEU 7 3.951 -11.955 3.049
65 3HD2 LEU 7 3HD2 LEU 7 4.514 -11.120 1.600
66 H TYR 8 H TYR 8 0.476 -8.840 -0.123
67 HA TYR 8 HA TYR 8 0.461 -8.104 -2.959
68 1HB TYR 8 2HB TYR 8 -1.691 -7.703 -0.862
69 2HB TYR 8 1HB TYR 8 -1.852 -7.418 -2.596
70 HD1 TYR 8 1HD TYR 8 -0.936 -10.157 -0.227
71 HD2 TYR 8 2HD TYR 8 -2.801 -9.080 -3.890
72 HE1 TYR 8 1HE TYR 8 -1.618 -12.478 -0.543
73 HE2 TYR 8 2HE TYR 8 -3.506 -11.408 -4.221
74 HH TYR 8 HH TYR 8 -3.898 -13.416 -2.961
75 H LEU 9 H LEU 9 1.050 -6.143 -3.584
76 HA LEU 9 HA LEU 9 1.697 -4.197 -1.501
77 1HB LEU 9 2HB LEU 9 3.445 -4.897 -3.089
78 2HB LEU 9 1HB LEU 9 2.483 -4.272 -4.414
79 HG LEU 9 HG LEU 9 2.700 -1.998 -3.511
80 1HD1 LEU 9 1HD1 LEU 9 3.318 -3.272 -1.136
81 2HD1 LEU 9 2HD1 LEU 9 4.852 -2.574 -1.658
82 3HD1 LEU 9 3HD1 LEU 9 3.434 -1.543 -1.462
83 1HD2 LEU 9 1HD2 LEU 9 4.511 -3.344 -4.943
84 2HD2 LEU 9 2HD2 LEU 9 4.725 -1.659 -4.464
85 3HD2 LEU 9 3HD2 LEU 9 5.502 -2.943 -3.538
86 H CYS 10 H CYS 10 0.339 -2.620 -1.089
87 HA CYS 10 HA CYS 10 -1.868 -1.922 -2.656
88 1HB CYS 10 2HB CYS 10 -2.396 -0.926 -0.728
89 2HB CYS 10 1HB CYS 10 -0.833 -1.390 -0.101
90 H GLU 11 H GLU 11 1.401 -0.773 -2.509
91 HA GLU 11 HA GLU 11 2.692 0.408 -3.914
92 1HB GLU 11 2HB GLU 11 0.405 -0.308 -5.572
93 2HB GLU 11 1HB GLU 11 1.220 1.156 -6.111
94 1HG GLU 11 2HG GLU 11 3.285 0.023 -6.343
95 2HG GLU 11 1HG GLU 11 2.667 -1.407 -5.521
96 H PHE 12 H PHE 12 -0.186 1.751 -2.709
97 HA PHE 12 HA PHE 12 0.613 4.448 -3.548
98 1HB PHE 12 2HB PHE 12 -1.877 3.488 -2.124
99 2HB PHE 12 1HB PHE 12 -1.562 5.156 -2.591
100 HD1 PHE 12 1HD PHE 12 -3.313 2.329 -3.482
101 HD2 PHE 12 2HD PHE 12 -0.825 5.329 -5.196
102 HE1 PHE 12 1HE PHE 12 -4.306 1.892 -5.687
103 HE2 PHE 12 2HE PHE 12 -1.820 4.899 -7.399
104 HZ PHE 12 HZ PHE 12 -3.563 3.178 -7.648
105 H CYS 13 H CYS 13 -0.269 2.679 -0.603
106 HA CYS 13 HA CYS 13 1.318 4.541 1.022
107 1HB CYS 13 2HB CYS 13 0.042 2.081 2.157
108 2HB CYS 13 1HB CYS 13 0.323 3.638 2.918
109 H LEU 14 H LEU 14 1.362 1.672 -0.711
110 HA LEU 14 HA LEU 14 2.874 0.066 -1.136
111 1HB LEU 14 2HB LEU 14 4.688 2.052 0.209
112 2HB LEU 14 1HB LEU 14 5.277 0.520 -0.409
113 HG LEU 14 HG LEU 14 3.709 2.129 -2.318
114 1HD1 LEU 14 1HD1 LEU 14 5.821 3.342 -0.822
115 2HD1 LEU 14 2HD1 LEU 14 6.315 3.152 -2.505
116 3HD1 LEU 14 3HD1 LEU 14 4.831 4.022 -2.114
117 1HD2 LEU 14 1HD2 LEU 14 6.145 0.399 -2.335
118 2HD2 LEU 14 2HD2 LEU 14 4.635 0.220 -3.230
119 3HD2 LEU 14 3HD2 LEU 14 5.790 1.469 -3.692
120 H LYS 15 H LYS 15 1.202 -0.463 0.860
121 HA LYS 15 HA LYS 15 2.837 -1.671 2.985
122 1HB LYS 15 2HB LYS 15 -0.156 -1.248 2.875
123 2HB LYS 15 1HB LYS 15 0.738 -1.912 4.234
124 1HG LYS 15 2HG LYS 15 1.089 0.873 3.146
125 2HG LYS 15 1HG LYS 15 0.096 0.449 4.541
126 1HD LYS 15 2HD LYS 15 2.110 -0.470 5.646
127 2HD LYS 15 1HD LYS 15 3.077 0.068 4.270
128 1HE LYS 15 2HE LYS 15 1.362 2.127 5.483
129 2HE LYS 15 1HE LYS 15 2.653 1.524 6.521
130 1HZ LYS 15 1HZ LYS 15 3.756 1.963 4.006
131 2HZ LYS 15 2HZ LYS 15 4.049 2.821 5.431
132 3HZ LYS 15 3HZ LYS 15 2.827 3.334 4.373
133 H TYR 16 H TYR 16 2.661 -3.867 3.427
134 HA TYR 16 HA TYR 16 1.823 -5.463 1.153
135 1HB TYR 16 2HB TYR 16 3.638 -5.844 3.470
136 2HB TYR 16 1HB TYR 16 2.860 -7.286 2.823
137 HD1 TYR 16 1HD TYR 16 3.396 -4.701 0.409
138 HD2 TYR 16 2HD TYR 16 5.252 -7.996 2.346
139 HE1 TYR 16 1HE TYR 16 5.068 -4.811 -1.397
140 HE2 TYR 16 2HE TYR 16 6.928 -8.119 0.551
141 HH TYR 16 HH TYR 16 7.294 -5.639 -1.798
142 H MET 17 H MET 17 -0.022 -6.472 1.059
143 HA MET 17 HA MET 17 -1.592 -6.858 3.508
144 1HB MET 17 2HB MET 17 -2.705 -7.542 0.832
145 2HB MET 17 1HB MET 17 -3.501 -6.831 2.229
146 1HG MET 17 2HG MET 17 -1.460 -5.140 0.967
147 2HG MET 17 1HG MET 17 -2.874 -5.489 -0.027
148 1HE MET 17 1HE MET 17 -2.579 -2.023 2.361
149 2HE MET 17 2HE MET 17 -1.643 -3.289 3.157
150 3HE MET 17 3HE MET 17 -1.435 -2.989 1.433
151 H LYS 18 H LYS 18 -2.284 -8.869 4.167
152 HA LYS 18 HA LYS 18 -0.603 -11.040 3.368
153 1HB LYS 18 2HB LYS 18 -2.351 -10.404 5.578
154 2HB LYS 18 1HB LYS 18 -2.621 -12.054 5.029
155 1HG LYS 18 2HG LYS 18 -0.979 -12.210 6.691
156 2HG LYS 18 1HG LYS 18 -0.106 -12.357 5.165
157 1HD LYS 18 2HD LYS 18 0.156 -9.765 5.413
158 2HD LYS 18 1HD LYS 18 -0.157 -10.101 7.116
159 1HE LYS 18 2HE LYS 18 1.674 -11.869 6.921
160 2HE LYS 18 1HE LYS 18 2.097 -11.090 5.398
161 1HZ LYS 18 1HZ LYS 18 3.392 -10.285 7.324
162 2HZ LYS 18 2HZ LYS 18 1.959 -9.676 8.003
163 3HZ LYS 18 3HZ LYS 18 2.530 -9.055 6.534
164 H SER 19 H SER 19 -3.705 -9.964 2.385
165 HA SER 19 HA SER 19 -3.929 -12.269 0.644
166 1HB SER 19 2HB SER 19 -6.024 -13.014 1.360
167 2HB SER 19 1HB SER 19 -5.214 -12.646 2.880
168 HG SER 19 HG SER 19 -7.164 -11.684 3.046
169 H ARG 20 H ARG 20 -5.836 -11.956 -0.897
170 HA ARG 20 HA ARG 20 -5.701 -9.262 -1.926
171 1HB ARG 20 2HB ARG 20 -5.809 -11.613 -3.192
172 2HB ARG 20 1HB ARG 20 -7.534 -11.269 -3.124
173 1HG ARG 20 2HG ARG 20 -7.386 -9.515 -4.545
174 2HG ARG 20 1HG ARG 20 -5.755 -9.093 -4.026
175 1HD ARG 20 2HD ARG 20 -4.995 -11.211 -5.196
176 2HD ARG 20 1HD ARG 20 -6.602 -11.270 -5.917
177 HE ARG 20 HE ARG 20 -4.577 -9.180 -6.376
178 1HH1 ARG 20 2HH1 ARG 20 -7.517 -10.848 -7.303
179 2HH1 ARG 20 1HH1 ARG 20 -7.711 -9.950 -8.783
180 1HH2 ARG 20 2HH2 ARG 20 -4.823 -7.992 -8.313
181 2HH2 ARG 20 1HH2 ARG 20 -6.173 -8.329 -9.363
182 H THR 21 H THR 21 -7.718 -11.046 0.160
183 HA THR 21 HA THR 21 -10.127 -9.557 -0.329
184 HB THR 21 HB THR 21 -9.516 -11.867 1.101
185 HG1 THR 21 1HG THR 21 -11.850 -10.237 0.959
186 1HG2 THR 21 1HG2 THR 21 -9.948 -11.580 3.356
187 2HG2 THR 21 2HG2 THR 21 -10.688 -9.995 3.121
188 3HG2 THR 21 3HG2 THR 21 -8.937 -10.182 2.984
189 H ILE 22 H ILE 22 -7.250 -9.256 1.631
190 HA ILE 22 HA ILE 22 -8.201 -6.967 3.101
191 HB ILE 22 HB ILE 22 -5.463 -8.212 2.823
192 1HG1 ILE 22 2HG1 ILE 22 -7.024 -8.028 5.370
193 1HG2 ILE 22 1HG2 ILE 22 -4.510 -6.580 4.057
194 2HG2 ILE 22 2HG2 ILE 22 -5.788 -5.613 3.321
195 3HG2 ILE 22 3HG2 ILE 22 -5.989 -6.241 4.956
196 1HD1 ILE 22 1HD1 ILE 22 -5.292 -10.234 4.288
197 2HD1 ILE 22 2HD1 ILE 22 -4.721 -8.947 5.349
198 3HD1 ILE 22 3HD1 ILE 22 -5.941 -10.083 5.921
199 H LEU 23 H LEU 23 -6.095 -7.642 0.352
200 HA LEU 23 HA LEU 23 -5.170 -5.054 -0.174
201 1HB LEU 23 2HB LEU 23 -4.653 -7.452 -1.186
202 2HB LEU 23 1HB LEU 23 -5.808 -6.942 -2.394
203 HG LEU 23 HG LEU 23 -3.020 -6.336 -2.187
204 1HD1 LEU 23 1HD1 LEU 23 -4.063 -5.040 -4.398
205 2HD1 LEU 23 2HD1 LEU 23 -3.423 -6.680 -4.333
206 3HD1 LEU 23 3HD1 LEU 23 -5.151 -6.398 -4.127
207 1HD2 LEU 23 1HD2 LEU 23 -3.504 -4.314 -1.036
208 2HD2 LEU 23 2HD2 LEU 23 -3.183 -3.897 -2.719
209 3HD2 LEU 23 3HD2 LEU 23 -4.843 -3.943 -2.123
210 H GLN 24 H GLN 24 -8.078 -6.758 -1.235
211 HA GLN 24 HA GLN 24 -9.003 -4.714 -2.966
212 1HB GLN 24 2HB GLN 24 -10.048 -7.243 -1.874
213 2HB GLN 24 1HB GLN 24 -11.273 -6.051 -2.280
214 1HG GLN 24 2HG GLN 24 -9.130 -6.685 -4.251
215 2HG GLN 24 1HG GLN 24 -10.487 -7.793 -4.043
216 1HE2 GLN 24 1HE2 GLN 24 -9.541 -5.802 -6.177
217 2HE2 GLN 24 2HE2 GLN 24 -10.995 -4.958 -6.590
218 H GLN 25 H GLN 25 -9.576 -5.458 0.424
219 HA GLN 25 HA GLN 25 -11.601 -3.475 0.768
220 1HB GLN 25 2HB GLN 25 -10.020 -5.248 2.579
221 2HB GLN 25 1HB GLN 25 -10.875 -3.877 3.273
222 1HG GLN 25 2HG GLN 25 -12.974 -4.700 2.435
223 2HG GLN 25 1HG GLN 25 -12.159 -6.008 1.583
224 1HE2 GLN 25 1HE2 GLN 25 -11.367 -7.753 2.733
225 2HE2 GLN 25 2HE2 GLN 25 -11.839 -8.085 4.369
226 H HIS 26 H HIS 26 -8.118 -3.562 1.129
227 HA HIS 26 HA HIS 26 -7.886 -1.083 2.497
228 1HB HIS 26 2HB HIS 26 -6.046 -2.637 2.615
229 2HB HIS 26 1HB HIS 26 -5.886 -2.660 0.861
230 HD1 HIS 26 1HD HIS 26 -5.117 -0.510 3.867
231 HD2 HIS 26 2HD HIS 26 -4.499 -0.527 -0.255
232 HE1 HIS 26 1HE HIS 26 -3.551 1.425 3.357
233 H MET 27 H MET 27 -7.487 -2.001 -0.924
234 HA MET 27 HA MET 27 -6.925 0.640 -1.791
235 1HB MET 27 2HB MET 27 -7.676 -1.899 -3.197
236 2HB MET 27 1HB MET 27 -7.614 -0.387 -4.084
237 1HG MET 27 2HG MET 27 -5.292 -0.101 -3.551
238 2HG MET 27 1HG MET 27 -5.328 -1.503 -2.483
239 1HE MET 27 1HE MET 27 -3.880 -0.526 -5.807
240 2HE MET 27 2HE MET 27 -4.876 -1.375 -6.990
241 3HE MET 27 3HE MET 27 -5.585 -0.113 -5.983
242 H LYS 28 H LYS 28 -8.365 1.457 -3.723
243 HA LYS 28 HA LYS 28 -10.295 2.472 -4.413
244 1HB LYS 28 2HB LYS 28 -11.551 0.564 -2.455
245 2HB LYS 28 1HB LYS 28 -12.487 1.863 -3.181
246 1HG LYS 28 2HG LYS 28 -12.943 0.162 -4.629
247 2HG LYS 28 1HG LYS 28 -11.535 0.877 -5.418
248 1HD LYS 28 2HD LYS 28 -10.115 -0.831 -4.705
249 2HD LYS 28 1HD LYS 28 -11.219 -1.344 -3.427
250 1HE LYS 28 2HE LYS 28 -12.170 -1.509 -6.235
251 2HE LYS 28 1HE LYS 28 -10.967 -2.683 -5.708
252 1HZ LYS 28 1HZ LYS 28 -12.703 -3.825 -4.945
253 2HZ LYS 28 2HZ LYS 28 -13.757 -2.501 -5.052
254 3HZ LYS 28 3HZ LYS 28 -12.773 -2.693 -3.686
255 H LYS 29 H LYS 29 -10.217 1.982 -0.904
256 HA LYS 29 HA LYS 29 -10.927 4.731 -0.343
257 1HB LYS 29 2HB LYS 29 -11.583 2.902 1.186
258 2HB LYS 29 1HB LYS 29 -9.885 2.557 1.481
259 1HG LYS 29 2HG LYS 29 -9.967 5.176 2.127
260 2HG LYS 29 1HG LYS 29 -11.603 4.677 2.566
261 1HD LYS 29 2HD LYS 29 -10.890 3.428 4.295
262 2HD LYS 29 1HD LYS 29 -9.488 2.828 3.406
263 1HE LYS 29 2HE LYS 29 -8.345 4.113 4.861
264 2HE LYS 29 1HE LYS 29 -8.774 5.404 3.741
265 1HZ LYS 29 1HZ LYS 29 -10.748 5.839 5.133
266 2HZ LYS 29 2HZ LYS 29 -9.287 6.093 5.954
267 3HZ LYS 29 3HZ LYS 29 -10.196 4.690 6.253
268 H CYS 30 H CYS 30 -8.111 2.693 -0.477
269 HA CYS 30 HA CYS 30 -6.147 4.389 0.540
270 1HB CYS 30 2HB CYS 30 -5.620 2.102 0.161
271 2HB CYS 30 1HB CYS 30 -6.116 2.187 -1.524
272 H GLY 31 H GLY 31 -6.809 3.741 -2.904
273 1HA GLY 31 1HA GLY 31 -5.472 6.192 -3.677
274 2HA GLY 31 2HA GLY 31 -6.183 4.996 -4.757
275 H TRP 32 H TRP 32 -7.316 7.209 -2.210
276 HA TRP 32 HA TRP 32 -9.791 7.674 -3.639
277 1HB TRP 32 2HB TRP 32 -9.083 7.709 -0.976
278 2HB TRP 32 1HB TRP 32 -9.259 9.422 -1.364
279 HD1 TRP 32 HD TRP 32 -11.280 6.140 -1.693
280 HE1 TRP 32 1HE TRP 32 -13.785 6.723 -1.570
281 HE3 TRP 32 3HE TRP 32 -10.905 11.233 -1.424
282 HZ2 TRP 32 2HZ TRP 32 -15.367 9.032 -1.392
283 HZ3 TRP 32 3HZ TRP 32 -12.973 12.559 -1.279
284 HH2 TRP 32 HH TRP 32 -15.166 11.476 -1.261
285 H PHE 33 H PHE 33 -7.999 8.475 -5.358
286 HA PHE 33 HA PHE 33 -8.156 11.404 -5.224
287 1HB PHE 33 2HB PHE 33 -6.106 11.432 -6.723
288 2HB PHE 33 1HB PHE 33 -5.826 10.967 -5.047
289 HD1 PHE 33 1HD PHE 33 -6.227 9.614 -8.476
290 HD2 PHE 33 2HD PHE 33 -4.835 8.917 -4.516
291 HE1 PHE 33 1HE PHE 33 -5.118 7.555 -9.233
292 HE2 PHE 33 2HE PHE 33 -3.723 6.854 -5.267
293 HZ PHE 33 HZ PHE 33 -3.864 6.172 -7.629
Start of MODEL 17
1 1H GLY 1 1H GLY 1 3.054 -17.545 -10.632
2 2H GLY 1 2H GLY 1 1.959 -17.037 -9.443
3 3H GLY 1 3H GLY 1 3.029 -18.314 -9.123
4 1HA GLY 1 2HA GLY 1 3.987 -15.601 -9.783
5 2HA GLY 1 1HA GLY 1 3.612 -16.075 -8.132
6 H SER 2 H SER 2 5.782 -16.478 -10.831
7 HA SER 2 HA SER 2 7.377 -18.554 -9.771
8 1HB SER 2 2HB SER 2 8.836 -16.688 -11.459
9 2HB SER 2 1HB SER 2 8.386 -18.365 -11.775
10 HG SER 2 HG SER 2 7.310 -17.160 -13.275
11 H ARG 3 H ARG 3 7.538 -15.039 -9.574
12 HA ARG 3 HA ARG 3 9.785 -15.236 -7.690
13 1HB ARG 3 2HB ARG 3 8.608 -12.637 -8.610
14 2HB ARG 3 1HB ARG 3 10.249 -12.987 -8.089
15 1HG ARG 3 2HG ARG 3 9.241 -14.256 -10.585
16 2HG ARG 3 1HG ARG 3 9.694 -12.550 -10.609
17 1HD ARG 3 2HD ARG 3 11.636 -14.249 -9.254
18 2HD ARG 3 1HD ARG 3 11.402 -14.668 -10.949
19 HE ARG 3 HE ARG 3 12.448 -12.143 -9.899
20 1HH1 ARG 3 2HH1 ARG 3 11.559 -14.121 -12.661
21 2HH1 ARG 3 1HH1 ARG 3 12.423 -13.129 -13.803
22 1HH2 ARG 3 2HH2 ARG 3 13.598 -10.866 -11.387
23 2HH2 ARG 3 1HH2 ARG 3 13.603 -11.292 -13.072
24 H LEU 4 H LEU 4 9.618 -14.365 -5.604
25 HA LEU 4 HA LEU 4 7.101 -14.672 -4.349
26 1HB LEU 4 2HB LEU 4 9.412 -14.923 -3.306
27 2HB LEU 4 1HB LEU 4 9.461 -13.173 -3.218
28 HG LEU 4 HG LEU 4 7.037 -13.840 -2.026
29 1HD1 LEU 4 1HD1 LEU 4 7.823 -15.442 -0.244
30 2HD1 LEU 4 2HD1 LEU 4 7.530 -16.146 -1.832
31 3HD1 LEU 4 3HD1 LEU 4 9.180 -15.823 -1.302
32 1HD2 LEU 4 1HD2 LEU 4 9.189 -13.557 -0.117
33 2HD2 LEU 4 2HD2 LEU 4 9.348 -12.410 -1.446
34 3HD2 LEU 4 3HD2 LEU 4 7.864 -12.455 -0.495
35 HA PRO 5 HA PRO 5 5.530 -10.666 -5.504
36 1HB PRO 5 2HB PRO 5 3.154 -10.874 -4.210
37 2HB PRO 5 1HB PRO 5 3.490 -11.688 -5.742
38 1HG PRO 5 2HG PRO 5 3.568 -12.784 -2.955
39 2HG PRO 5 1HG PRO 5 2.900 -13.513 -4.428
40 1HD PRO 5 2HD PRO 5 5.318 -14.207 -3.447
41 2HD PRO 5 1HD PRO 5 4.972 -14.189 -5.189
42 H LYS 6 H LYS 6 6.089 -11.816 -2.327
43 HA LYS 6 HA LYS 6 6.487 -10.843 -0.326
44 1HB LYS 6 2HB LYS 6 6.689 -8.287 -1.936
45 2HB LYS 6 1HB LYS 6 7.139 -8.453 -0.245
46 1HG LYS 6 2HG LYS 6 9.078 -9.504 -0.722
47 2HG LYS 6 1HG LYS 6 8.411 -10.333 -2.131
48 1HD LYS 6 2HD LYS 6 8.620 -7.410 -2.375
49 2HD LYS 6 1HD LYS 6 10.160 -8.264 -2.256
50 1HE LYS 6 2HE LYS 6 9.998 -8.803 -4.402
51 2HE LYS 6 1HE LYS 6 8.542 -9.731 -4.041
52 1HZ LYS 6 1HZ LYS 6 7.508 -7.310 -4.139
53 2HZ LYS 6 2HZ LYS 6 7.676 -8.277 -5.522
54 3HZ LYS 6 3HZ LYS 6 8.817 -7.066 -5.191
55 H LEU 7 H LEU 7 4.155 -11.546 -0.360
56 HA LEU 7 HA LEU 7 2.012 -11.268 0.347
57 1HB LEU 7 2HB LEU 7 3.171 -8.680 1.317
58 2HB LEU 7 1HB LEU 7 1.451 -8.959 1.404
59 HG LEU 7 HG LEU 7 2.264 -9.516 3.532
60 1HD1 LEU 7 1HD1 LEU 7 1.834 -11.889 3.740
61 2HD1 LEU 7 2HD1 LEU 7 0.710 -11.159 2.593
62 3HD1 LEU 7 3HD1 LEU 7 2.077 -12.105 2.007
63 1HD2 LEU 7 1HD2 LEU 7 4.579 -9.620 3.318
64 2HD2 LEU 7 2HD2 LEU 7 4.129 -11.276 3.725
65 3HD2 LEU 7 3HD2 LEU 7 4.504 -10.850 2.055
66 H TYR 8 H TYR 8 0.760 -8.510 0.272
67 HA TYR 8 HA TYR 8 0.420 -8.326 -2.643
68 1HB TYR 8 2HB TYR 8 -1.695 -8.006 -0.497
69 2HB TYR 8 1HB TYR 8 -1.956 -7.820 -2.232
70 HD1 TYR 8 1HD TYR 8 -1.112 -10.259 0.419
71 HD2 TYR 8 2HD TYR 8 -2.259 -9.705 -3.636
72 HE1 TYR 8 1HE TYR 8 -1.508 -12.669 0.212
73 HE2 TYR 8 2HE TYR 8 -2.677 -12.115 -3.852
74 HH TYR 8 HH TYR 8 -2.306 -14.311 -1.085
75 H LEU 9 H LEU 9 1.594 -6.580 -3.102
76 HA LEU 9 HA LEU 9 1.847 -4.365 -1.347
77 1HB LEU 9 2HB LEU 9 3.300 -5.325 -3.433
78 2HB LEU 9 1HB LEU 9 2.518 -3.957 -4.188
79 HG LEU 9 HG LEU 9 4.295 -3.879 -1.760
80 1HD1 LEU 9 1HD1 LEU 9 5.347 -2.201 -3.639
81 2HD1 LEU 9 2HD1 LEU 9 5.884 -3.854 -3.326
82 3HD1 LEU 9 3HD1 LEU 9 4.732 -3.531 -4.622
83 1HD2 LEU 9 1HD2 LEU 9 3.242 -2.015 -1.207
84 2HD2 LEU 9 2HD2 LEU 9 3.938 -1.297 -2.659
85 3HD2 LEU 9 3HD2 LEU 9 2.321 -1.999 -2.711
86 H CYS 10 H CYS 10 0.677 -2.625 -1.135
87 HA CYS 10 HA CYS 10 -1.722 -2.168 -2.579
88 1HB CYS 10 2HB CYS 10 -1.995 -1.205 -0.556
89 2HB CYS 10 1HB CYS 10 -0.266 -1.028 -0.311
90 H GLU 11 H GLU 11 1.395 -0.527 -2.457
91 HA GLU 11 HA GLU 11 2.634 0.555 -3.998
92 1HB GLU 11 2HB GLU 11 0.455 -0.405 -5.810
93 2HB GLU 11 1HB GLU 11 1.654 0.743 -6.395
94 1HG GLU 11 2HG GLU 11 3.226 -1.129 -5.202
95 2HG GLU 11 1HG GLU 11 1.895 -2.112 -5.814
96 H PHE 12 H PHE 12 -0.419 1.519 -3.012
97 HA PHE 12 HA PHE 12 -0.170 4.195 -4.177
98 1HB PHE 12 2HB PHE 12 -2.241 3.097 -2.258
99 2HB PHE 12 1HB PHE 12 -2.289 4.680 -3.024
100 HD1 PHE 12 1HD PHE 12 -3.471 1.414 -3.184
101 HD2 PHE 12 2HD PHE 12 -2.131 4.595 -5.671
102 HE1 PHE 12 1HE PHE 12 -4.698 0.442 -5.080
103 HE2 PHE 12 2HE PHE 12 -3.355 3.629 -7.573
104 HZ PHE 12 HZ PHE 12 -4.641 1.549 -7.282
105 H CYS 13 H CYS 13 -0.057 2.516 -1.074
106 HA CYS 13 HA CYS 13 1.580 4.740 -0.056
107 1HB CYS 13 2HB CYS 13 0.751 4.451 2.173
108 2HB CYS 13 1HB CYS 13 -0.637 4.643 1.111
109 H LEU 14 H LEU 14 1.510 1.688 -1.118
110 HA LEU 14 HA LEU 14 2.965 -0.041 -1.127
111 1HB LEU 14 2HB LEU 14 4.812 1.851 0.321
112 2HB LEU 14 1HB LEU 14 5.281 0.385 -0.518
113 HG LEU 14 HG LEU 14 3.844 2.430 -2.110
114 1HD1 LEU 14 1HD1 LEU 14 5.710 3.836 -2.416
115 2HD1 LEU 14 2HD1 LEU 14 5.496 3.680 -0.672
116 3HD1 LEU 14 3HD1 LEU 14 6.762 2.765 -1.492
117 1HD2 LEU 14 1HD2 LEU 14 4.533 1.044 -3.695
118 2HD2 LEU 14 2HD2 LEU 14 6.198 1.500 -3.330
119 3HD2 LEU 14 3HD2 LEU 14 5.466 0.113 -2.524
120 H LYS 15 H LYS 15 1.130 -0.436 0.692
121 HA LYS 15 HA LYS 15 2.615 -1.477 3.013
122 1HB LYS 15 2HB LYS 15 0.932 0.349 3.518
123 2HB LYS 15 1HB LYS 15 -0.320 -0.768 2.988
124 1HG LYS 15 2HG LYS 15 -0.366 -1.120 5.244
125 2HG LYS 15 1HG LYS 15 0.786 -2.361 4.750
126 1HD LYS 15 2HD LYS 15 2.593 -0.619 5.205
127 2HD LYS 15 1HD LYS 15 1.332 0.306 6.025
128 1HE LYS 15 2HE LYS 15 2.217 -2.499 6.697
129 2HE LYS 15 1HE LYS 15 2.595 -1.041 7.613
130 1HZ LYS 15 1HZ LYS 15 0.704 -2.440 8.474
131 2HZ LYS 15 2HZ LYS 15 -0.192 -1.928 7.127
132 3HZ LYS 15 3HZ LYS 15 0.363 -0.794 8.255
133 H TYR 16 H TYR 16 2.751 -3.594 3.029
134 HA TYR 16 HA TYR 16 1.435 -5.201 1.126
135 1HB TYR 16 2HB TYR 16 3.098 -5.859 3.551
136 2HB TYR 16 1HB TYR 16 2.491 -7.087 2.442
137 HD1 TYR 16 1HD TYR 16 2.802 -5.638 -0.123
138 HD2 TYR 16 2HD TYR 16 5.399 -5.965 3.208
139 HE1 TYR 16 1HE TYR 16 4.724 -5.298 -1.619
140 HE2 TYR 16 2HE TYR 16 7.351 -5.625 1.740
141 HH TYR 16 HH TYR 16 8.046 -5.569 -0.410
142 H MET 17 H MET 17 -0.424 -6.205 1.163
143 HA MET 17 HA MET 17 -1.881 -6.438 3.698
144 1HB MET 17 2HB MET 17 -2.815 -6.715 0.836
145 2HB MET 17 1HB MET 17 -3.837 -6.991 2.234
146 1HG MET 17 2HG MET 17 -2.429 -4.395 1.694
147 2HG MET 17 1HG MET 17 -4.074 -4.745 1.173
148 1HE MET 17 1HE MET 17 -2.649 -2.448 3.728
149 2HE MET 17 2HE MET 17 -2.565 -3.430 5.192
150 3HE MET 17 3HE MET 17 -1.636 -3.892 3.766
151 H LYS 18 H LYS 18 -2.752 -8.440 4.335
152 HA LYS 18 HA LYS 18 -0.938 -10.575 3.757
153 1HB LYS 18 2HB LYS 18 -2.962 -9.958 5.778
154 2HB LYS 18 1HB LYS 18 -2.868 -11.667 5.378
155 1HG LYS 18 2HG LYS 18 -1.402 -10.669 7.292
156 2HG LYS 18 1HG LYS 18 -0.746 -11.895 6.205
157 1HD LYS 18 2HD LYS 18 0.929 -10.488 5.787
158 2HD LYS 18 1HD LYS 18 -0.231 -9.469 4.935
159 1HE LYS 18 2HE LYS 18 -0.070 -7.887 6.489
160 2HE LYS 18 1HE LYS 18 -0.431 -9.045 7.770
161 1HZ LYS 18 1HZ LYS 18 2.000 -9.716 7.545
162 2HZ LYS 18 2HZ LYS 18 1.674 -8.223 8.283
163 3HZ LYS 18 3HZ LYS 18 2.206 -8.272 6.675
164 H SER 19 H SER 19 -4.170 -9.791 2.760
165 HA SER 19 HA SER 19 -4.245 -12.303 1.230
166 1HB SER 19 2HB SER 19 -6.800 -11.084 2.151
167 2HB SER 19 1HB SER 19 -6.409 -12.778 1.844
168 HG SER 19 HG SER 19 -4.982 -12.518 3.789
169 H ARG 20 H ARG 20 -5.522 -12.227 -0.716
170 HA ARG 20 HA ARG 20 -5.093 -9.883 -2.246
171 1HB ARG 20 2HB ARG 20 -5.601 -12.498 -2.825
172 2HB ARG 20 1HB ARG 20 -7.155 -11.767 -3.198
173 1HG ARG 20 2HG ARG 20 -6.377 -10.734 -5.032
174 2HG ARG 20 1HG ARG 20 -4.829 -10.345 -4.279
175 1HD ARG 20 2HD ARG 20 -4.142 -11.864 -5.844
176 2HD ARG 20 1HD ARG 20 -4.446 -12.938 -4.480
177 HE ARG 20 HE ARG 20 -6.641 -13.407 -5.538
178 1HH1 ARG 20 2HH1 ARG 20 -4.006 -12.170 -7.488
179 2HH1 ARG 20 1HH1 ARG 20 -4.624 -12.838 -8.974
180 1HH2 ARG 20 2HH2 ARG 20 -7.444 -14.310 -7.483
181 2HH2 ARG 20 1HH2 ARG 20 -6.552 -14.087 -8.961
182 H THR 21 H THR 21 -7.968 -11.272 -0.715
183 HA THR 21 HA THR 21 -9.851 -9.417 -1.673
184 HB THR 21 HB THR 21 -10.852 -10.131 0.757
185 HG1 THR 21 1HG THR 21 -9.709 -11.713 1.565
186 1HG2 THR 21 1HG2 THR 21 -11.933 -12.012 -0.433
187 2HG2 THR 21 2HG2 THR 21 -10.807 -11.784 -1.772
188 3HG2 THR 21 3HG2 THR 21 -11.963 -10.514 -1.366
189 H ILE 22 H ILE 22 -7.816 -9.462 1.211
190 HA ILE 22 HA ILE 22 -8.850 -7.151 2.430
191 HB ILE 22 HB ILE 22 -6.227 -8.602 2.690
192 1HG1 ILE 22 2HG1 ILE 22 -8.572 -8.263 4.570
193 1HG2 ILE 22 1HG2 ILE 22 -5.301 -6.887 3.735
194 2HG2 ILE 22 2HG2 ILE 22 -6.738 -5.911 3.427
195 3HG2 ILE 22 3HG2 ILE 22 -6.628 -6.879 4.898
196 1HD1 ILE 22 1HD1 ILE 22 -6.291 -10.209 4.778
197 2HD1 ILE 22 2HD1 ILE 22 -6.408 -8.708 5.699
198 3HD1 ILE 22 3HD1 ILE 22 -7.617 -9.972 5.920
199 H LEU 23 H LEU 23 -6.271 -7.669 0.072
200 HA LEU 23 HA LEU 23 -5.221 -5.051 0.079
201 1HB LEU 23 2HB LEU 23 -4.469 -7.335 -1.076
202 2HB LEU 23 1HB LEU 23 -5.305 -6.632 -2.443
203 HG LEU 23 HG LEU 23 -2.691 -5.976 -1.294
204 1HD1 LEU 23 1HD1 LEU 23 -3.982 -6.317 -3.856
205 2HD1 LEU 23 2HD1 LEU 23 -2.913 -4.915 -3.827
206 3HD1 LEU 23 3HD1 LEU 23 -2.289 -6.510 -3.403
207 1HD2 LEU 23 1HD2 LEU 23 -3.854 -3.965 -0.578
208 2HD2 LEU 23 2HD2 LEU 23 -2.747 -3.614 -1.905
209 3HD2 LEU 23 3HD2 LEU 23 -4.480 -3.732 -2.210
210 H GLN 24 H GLN 24 -7.878 -6.582 -1.651
211 HA GLN 24 HA GLN 24 -8.527 -4.407 -3.339
212 1HB GLN 24 2HB GLN 24 -9.729 -6.952 -2.582
213 2HB GLN 24 1HB GLN 24 -10.923 -5.689 -2.850
214 1HG GLN 24 2HG GLN 24 -8.747 -6.194 -4.838
215 2HG GLN 24 1HG GLN 24 -10.219 -7.167 -4.827
216 1HE2 GLN 24 1HE2 GLN 24 -11.715 -6.490 -6.159
217 2HE2 GLN 24 2HE2 GLN 24 -11.989 -4.854 -6.655
218 H GLN 25 H GLN 25 -9.526 -5.309 -0.074
219 HA GLN 25 HA GLN 25 -11.437 -3.241 0.313
220 1HB GLN 25 2HB GLN 25 -9.697 -4.517 2.432
221 2HB GLN 25 1HB GLN 25 -11.236 -3.707 2.674
222 1HG GLN 25 2HG GLN 25 -12.450 -5.482 1.841
223 2HG GLN 25 1HG GLN 25 -11.082 -6.123 0.933
224 1HE2 GLN 25 1HE2 GLN 25 -12.119 -8.056 2.127
225 2HE2 GLN 25 2HE2 GLN 25 -11.389 -8.459 3.652
226 H HIS 26 H HIS 26 -7.983 -3.524 0.975
227 HA HIS 26 HA HIS 26 -7.615 -1.050 2.225
228 1HB HIS 26 2HB HIS 26 -5.936 -2.804 2.341
229 2HB HIS 26 1HB HIS 26 -5.680 -2.719 0.602
230 HD1 HIS 26 1HD HIS 26 -4.605 -1.182 3.806
231 HD2 HIS 26 2HD HIS 26 -4.377 -0.326 -0.274
232 HE1 HIS 26 1HE HIS 26 -2.863 0.650 3.538
233 H MET 27 H MET 27 -7.453 -1.974 -1.178
234 HA MET 27 HA MET 27 -6.486 0.477 -2.169
235 1HB MET 27 2HB MET 27 -7.877 -1.879 -3.348
236 2HB MET 27 1HB MET 27 -7.709 -0.424 -4.321
237 1HG MET 27 2HG MET 27 -5.233 -0.533 -3.774
238 2HG MET 27 1HG MET 27 -5.550 -2.158 -3.173
239 1HE MET 27 1HE MET 27 -4.107 -3.422 -4.517
240 2HE MET 27 2HE MET 27 -4.078 -3.571 -6.274
241 3HE MET 27 3HE MET 27 -3.369 -2.154 -5.497
242 H LYS 28 H LYS 28 -9.420 -0.192 -0.787
243 HA LYS 28 HA LYS 28 -11.024 1.650 -2.327
244 1HB LYS 28 2HB LYS 28 -11.471 -0.218 -0.120
245 2HB LYS 28 1HB LYS 28 -12.327 1.305 0.086
246 1HG LYS 28 2HG LYS 28 -13.816 -0.132 -1.026
247 2HG LYS 28 1HG LYS 28 -13.209 0.975 -2.261
248 1HD LYS 28 2HD LYS 28 -11.391 -1.009 -2.456
249 2HD LYS 28 1HD LYS 28 -12.810 -1.929 -1.949
250 1HE LYS 28 2HE LYS 28 -14.069 -1.190 -3.811
251 2HE LYS 28 1HE LYS 28 -12.871 0.037 -4.224
252 1HZ LYS 28 1HZ LYS 28 -12.490 -2.907 -4.394
253 2HZ LYS 28 2HZ LYS 28 -11.310 -1.740 -4.768
254 3HZ LYS 28 3HZ LYS 28 -12.717 -1.850 -5.701
255 H LYS 29 H LYS 29 -9.525 1.595 0.898
256 HA LYS 29 HA LYS 29 -10.135 4.334 1.447
257 1HB LYS 29 2HB LYS 29 -7.819 3.338 2.885
258 2HB LYS 29 1HB LYS 29 -9.372 3.872 3.506
259 1HG LYS 29 2HG LYS 29 -9.914 1.786 3.988
260 2HG LYS 29 1HG LYS 29 -9.720 1.325 2.295
261 1HD LYS 29 2HD LYS 29 -7.793 0.294 2.707
262 2HD LYS 29 1HD LYS 29 -7.169 1.672 3.614
263 1HE LYS 29 2HE LYS 29 -9.241 0.108 4.989
264 2HE LYS 29 1HE LYS 29 -7.735 -0.756 4.686
265 1HZ LYS 29 1HZ LYS 29 -6.673 1.387 5.643
266 2HZ LYS 29 2HZ LYS 29 -7.323 0.230 6.701
267 3HZ LYS 29 3HZ LYS 29 -8.205 1.633 6.332
268 H CYS 30 H CYS 30 -7.428 2.573 0.125
269 HA CYS 30 HA CYS 30 -5.820 4.962 -0.190
270 1HB CYS 30 2HB CYS 30 -5.335 2.173 -0.109
271 2HB CYS 30 1HB CYS 30 -4.826 2.735 -1.693
272 H GLY 31 H GLY 31 -8.086 5.508 -1.366
273 1HA GLY 31 1HA GLY 31 -7.415 6.144 -4.015
274 2HA GLY 31 2HA GLY 31 -8.483 4.740 -4.038
275 H TRP 32 H TRP 32 -10.118 5.240 -1.933
276 HA TRP 32 HA TRP 32 -11.658 7.582 -2.804
277 1HB TRP 32 2HB TRP 32 -12.999 5.647 -2.760
278 2HB TRP 32 1HB TRP 32 -12.297 5.093 -1.239
279 HD1 TRP 32 HD TRP 32 -13.568 5.670 0.867
280 HE1 TRP 32 1HE TRP 32 -15.492 7.271 1.480
281 HE3 TRP 32 3HE TRP 32 -14.047 8.053 -3.613
282 HZ2 TRP 32 2HZ TRP 32 -16.993 9.278 0.179
283 HZ3 TRP 32 3HZ TRP 32 -15.759 9.801 -3.851
284 HH2 TRP 32 HH TRP 32 -17.212 10.400 -1.986
285 H PHE 33 H PHE 33 -11.195 5.997 0.355
286 HA PHE 33 HA PHE 33 -9.570 7.806 1.596
287 1HB PHE 33 2HB PHE 33 -12.125 8.998 1.179
288 2HB PHE 33 1HB PHE 33 -11.973 8.654 2.903
289 HD1 PHE 33 1HD PHE 33 -12.197 11.289 2.746
290 HD2 PHE 33 2HD PHE 33 -8.759 9.058 1.598
291 HE1 PHE 33 1HE PHE 33 -10.804 13.301 3.010
292 HE2 PHE 33 2HE PHE 33 -7.362 11.061 1.866
293 HZ PHE 33 HZ PHE 33 -8.384 13.186 2.567
Start of MODEL 18
1 1H GLY 1 1H GLY 1 12.359 -11.421 5.721
2 2H GLY 1 2H GLY 1 13.374 -10.125 5.317
3 3H GLY 1 3H GLY 1 12.124 -10.582 4.266
4 1HA GLY 1 2HA GLY 1 12.004 -8.625 6.162
5 2HA GLY 1 1HA GLY 1 10.637 -9.336 5.312
6 H SER 2 H SER 2 9.411 -8.869 7.240
7 HA SER 2 HA SER 2 9.705 -11.028 9.211
8 1HB SER 2 2HB SER 2 8.557 -8.560 10.309
9 2HB SER 2 1HB SER 2 9.780 -9.635 10.992
10 HG SER 2 HG SER 2 10.099 -7.463 9.209
11 H ARG 3 H ARG 3 7.639 -11.373 10.439
12 HA ARG 3 HA ARG 3 5.432 -11.880 10.483
13 1HB ARG 3 2HB ARG 3 5.153 -9.412 8.756
14 2HB ARG 3 1HB ARG 3 3.830 -10.240 9.566
15 1HG ARG 3 2HG ARG 3 6.114 -9.329 11.222
16 2HG ARG 3 1HG ARG 3 5.000 -8.108 10.599
17 1HD ARG 3 2HD ARG 3 3.920 -8.605 12.533
18 2HD ARG 3 1HD ARG 3 3.212 -9.852 11.507
19 HE ARG 3 HE ARG 3 5.393 -10.268 13.453
20 1HH1 ARG 3 2HH1 ARG 3 2.780 -11.500 11.459
21 2HH1 ARG 3 1HH1 ARG 3 2.863 -13.111 12.118
22 1HH2 ARG 3 2HH2 ARG 3 5.505 -12.384 14.327
23 2HH2 ARG 3 1HH2 ARG 3 4.376 -13.601 13.792
24 H LEU 4 H LEU 4 7.185 -12.878 8.304
25 HA LEU 4 HA LEU 4 7.074 -14.180 6.451
26 1HB LEU 4 2HB LEU 4 4.904 -14.862 8.004
27 2HB LEU 4 1HB LEU 4 4.175 -14.561 6.437
28 HG LEU 4 HG LEU 4 5.713 -16.202 5.421
29 1HD1 LEU 4 1HD1 LEU 4 7.157 -15.846 7.785
30 2HD1 LEU 4 2HD1 LEU 4 6.547 -17.499 7.846
31 3HD1 LEU 4 3HD1 LEU 4 7.513 -16.966 6.469
32 1HD2 LEU 4 1HD2 LEU 4 3.457 -16.680 6.873
33 2HD2 LEU 4 2HD2 LEU 4 4.287 -17.870 5.869
34 3HD2 LEU 4 3HD2 LEU 4 4.604 -17.804 7.603
35 HA PRO 5 HA PRO 5 5.651 -10.607 3.934
36 1HB PRO 5 2HB PRO 5 8.244 -10.971 2.598
37 2HB PRO 5 1HB PRO 5 7.576 -9.539 3.388
38 1HG PRO 5 2HG PRO 5 9.600 -10.914 4.474
39 2HG PRO 5 1HG PRO 5 8.334 -10.174 5.474
40 1HD PRO 5 2HD PRO 5 8.619 -13.034 4.609
41 2HD PRO 5 1HD PRO 5 8.232 -12.381 6.217
42 H LYS 6 H LYS 6 6.782 -10.558 1.309
43 HA LYS 6 HA LYS 6 6.392 -11.302 -0.796
44 1HB LYS 6 2HB LYS 6 6.762 -13.772 0.670
45 2HB LYS 6 1HB LYS 6 5.547 -13.973 -0.583
46 1HG LYS 6 2HG LYS 6 7.241 -12.925 -2.167
47 2HG LYS 6 1HG LYS 6 8.425 -13.196 -0.885
48 1HD LYS 6 2HD LYS 6 7.176 -15.616 -1.015
49 2HD LYS 6 1HD LYS 6 7.140 -15.098 -2.702
50 1HE LYS 6 2HE LYS 6 9.672 -14.847 -1.146
51 2HE LYS 6 1HE LYS 6 9.191 -16.429 -1.757
52 1HZ LYS 6 1HZ LYS 6 9.525 -13.980 -3.414
53 2HZ LYS 6 2HZ LYS 6 9.123 -15.529 -3.986
54 3HZ LYS 6 3HZ LYS 6 10.646 -15.246 -3.299
55 H LEU 7 H LEU 7 4.561 -9.869 0.148
56 HA LEU 7 HA LEU 7 1.985 -11.278 -0.128
57 1HB LEU 7 2HB LEU 7 2.336 -8.621 1.225
58 2HB LEU 7 1HB LEU 7 1.026 -9.770 1.397
59 HG LEU 7 HG LEU 7 3.830 -10.176 2.439
60 1HD1 LEU 7 1HD1 LEU 7 2.012 -8.461 3.469
61 2HD1 LEU 7 2HD1 LEU 7 1.598 -9.951 4.320
62 3HD1 LEU 7 3HD1 LEU 7 3.239 -9.311 4.410
63 1HD2 LEU 7 1HD2 LEU 7 1.630 -11.976 2.007
64 2HD2 LEU 7 2HD2 LEU 7 3.256 -12.320 2.599
65 3HD2 LEU 7 3HD2 LEU 7 1.989 -11.845 3.729
66 H TYR 8 H TYR 8 0.343 -9.087 -0.388
67 HA TYR 8 HA TYR 8 0.970 -8.228 -3.111
68 1HB TYR 8 2HB TYR 8 -1.610 -7.550 -1.765
69 2HB TYR 8 1HB TYR 8 -1.298 -7.946 -3.453
70 HD1 TYR 8 1HD TYR 8 -1.403 -10.195 -4.234
71 HD2 TYR 8 2HD TYR 8 -1.777 -9.358 -0.082
72 HE1 TYR 8 1HE TYR 8 -2.186 -12.484 -3.844
73 HE2 TYR 8 2HE TYR 8 -2.568 -11.643 0.317
74 HH TYR 8 HH TYR 8 -3.700 -13.483 -1.054
75 H LEU 9 H LEU 9 1.537 -6.211 -3.583
76 HA LEU 9 HA LEU 9 1.928 -4.384 -1.364
77 1HB LEU 9 2HB LEU 9 3.686 -4.991 -3.079
78 2HB LEU 9 1HB LEU 9 2.777 -4.038 -4.234
79 HG LEU 9 HG LEU 9 3.187 -2.018 -2.988
80 1HD1 LEU 9 1HD1 LEU 9 4.136 -3.921 -0.907
81 2HD1 LEU 9 2HD1 LEU 9 4.883 -2.327 -1.007
82 3HD1 LEU 9 3HD1 LEU 9 3.145 -2.472 -0.742
83 1HD2 LEU 9 1HD2 LEU 9 4.921 -2.579 -4.521
84 2HD2 LEU 9 2HD2 LEU 9 5.694 -2.003 -3.044
85 3HD2 LEU 9 3HD2 LEU 9 5.629 -3.732 -3.387
86 H CYS 10 H CYS 10 0.953 -2.471 -1.085
87 HA CYS 10 HA CYS 10 -1.259 -1.723 -2.784
88 1HB CYS 10 2HB CYS 10 -1.797 -1.441 -0.505
89 2HB CYS 10 1HB CYS 10 -0.221 -0.762 -0.122
90 H GLU 11 H GLU 11 -1.115 -0.208 -4.247
91 HA GLU 11 HA GLU 11 1.448 0.981 -4.824
92 1HB GLU 11 2HB GLU 11 -1.169 0.760 -6.249
93 2HB GLU 11 1HB GLU 11 -0.030 1.998 -6.760
94 1HG GLU 11 2HG GLU 11 1.321 0.523 -7.739
95 2HG GLU 11 1HG GLU 11 1.170 -0.640 -6.424
96 H PHE 12 H PHE 12 -0.790 1.841 -2.677
97 HA PHE 12 HA PHE 12 -0.666 4.701 -3.354
98 1HB PHE 12 2HB PHE 12 -2.625 3.261 -1.561
99 2HB PHE 12 1HB PHE 12 -2.662 4.975 -1.964
100 HD1 PHE 12 1HD PHE 12 -3.852 1.773 -2.826
101 HD2 PHE 12 2HD PHE 12 -2.771 5.531 -4.506
102 HE1 PHE 12 1HE PHE 12 -5.200 1.266 -4.820
103 HE2 PHE 12 2HE PHE 12 -4.117 5.029 -6.500
104 HZ PHE 12 HZ PHE 12 -5.332 2.894 -6.659
105 H CYS 13 H CYS 13 -0.211 2.416 -0.674
106 HA CYS 13 HA CYS 13 1.392 4.533 0.597
107 1HB CYS 13 2HB CYS 13 0.754 3.802 2.808
108 2HB CYS 13 1HB CYS 13 -0.691 4.189 1.884
109 H LEU 14 H LEU 14 1.447 1.693 -0.928
110 HA LEU 14 HA LEU 14 2.916 0.015 -1.196
111 1HB LEU 14 2HB LEU 14 4.675 2.205 -0.130
112 2HB LEU 14 1HB LEU 14 5.325 0.664 -0.666
113 HG LEU 14 HG LEU 14 3.521 1.847 -2.619
114 1HD1 LEU 14 1HD1 LEU 14 4.601 3.862 -1.465
115 2HD1 LEU 14 2HD1 LEU 14 6.094 3.323 -2.236
116 3HD1 LEU 14 3HD1 LEU 14 4.696 3.750 -3.223
117 1HD2 LEU 14 1HD2 LEU 14 5.105 -0.060 -2.938
118 2HD2 LEU 14 2HD2 LEU 14 5.224 1.219 -4.146
119 3HD2 LEU 14 3HD2 LEU 14 6.424 1.107 -2.857
120 H LYS 15 H LYS 15 1.511 -0.822 0.668
121 HA LYS 15 HA LYS 15 3.387 -1.966 2.612
122 1HB LYS 15 2HB LYS 15 0.521 -1.158 3.152
123 2HB LYS 15 1HB LYS 15 1.490 -2.148 4.236
124 1HG LYS 15 2HG LYS 15 2.365 0.592 3.380
125 2HG LYS 15 1HG LYS 15 1.296 0.336 4.761
126 1HD LYS 15 2HD LYS 15 3.101 -1.324 5.561
127 2HD LYS 15 1HD LYS 15 4.146 -0.516 4.391
128 1HE LYS 15 2HE LYS 15 2.627 1.285 6.145
129 2HE LYS 15 1HE LYS 15 3.811 0.273 6.970
130 1HZ LYS 15 1HZ LYS 15 4.247 2.345 4.925
131 2HZ LYS 15 2HZ LYS 15 5.365 1.084 5.085
132 3HZ LYS 15 3HZ LYS 15 5.045 2.104 6.403
133 H TYR 16 H TYR 16 2.814 -4.187 3.221
134 HA TYR 16 HA TYR 16 1.564 -5.522 0.948
135 1HB TYR 16 2HB TYR 16 3.459 -6.418 3.111
136 2HB TYR 16 1HB TYR 16 2.699 -7.555 2.003
137 HD1 TYR 16 1HD TYR 16 5.447 -5.369 2.519
138 HD2 TYR 16 2HD TYR 16 3.050 -7.126 -0.523
139 HE1 TYR 16 1HE TYR 16 7.233 -4.951 0.879
140 HE2 TYR 16 2HE TYR 16 4.826 -6.712 -2.170
141 HH TYR 16 HH TYR 16 7.637 -4.791 -1.409
142 H MET 17 H MET 17 -0.323 -6.552 1.060
143 HA MET 17 HA MET 17 -1.678 -6.754 3.642
144 1HB MET 17 2HB MET 17 -2.752 -7.420 0.898
145 2HB MET 17 1HB MET 17 -3.682 -7.225 2.375
146 1HG MET 17 2HG MET 17 -2.444 -5.170 0.620
147 2HG MET 17 1HG MET 17 -4.053 -5.233 1.330
148 1HE MET 17 1HE MET 17 -1.450 -3.294 0.967
149 2HE MET 17 2HE MET 17 -2.592 -2.211 1.767
150 3HE MET 17 3HE MET 17 -1.001 -2.494 2.473
151 H LYS 18 H LYS 18 -2.508 -8.692 4.483
152 HA LYS 18 HA LYS 18 -0.896 -10.998 3.867
153 1HB LYS 18 2HB LYS 18 -1.803 -10.171 6.177
154 2HB LYS 18 1HB LYS 18 -3.236 -11.088 5.736
155 1HG LYS 18 2HG LYS 18 -2.187 -12.792 6.731
156 2HG LYS 18 1HG LYS 18 -1.276 -12.896 5.225
157 1HD LYS 18 2HD LYS 18 -0.281 -10.993 7.266
158 2HD LYS 18 1HD LYS 18 -0.104 -12.712 7.623
159 1HE LYS 18 2HE LYS 18 0.672 -12.336 4.934
160 2HE LYS 18 1HE LYS 18 1.445 -11.065 5.876
161 1HZ LYS 18 1HZ LYS 18 2.072 -13.829 5.744
162 2HZ LYS 18 2HZ LYS 18 1.768 -13.366 7.350
163 3HZ LYS 18 3HZ LYS 18 2.952 -12.560 6.444
164 H SER 19 H SER 19 -4.123 -9.946 3.102
165 HA SER 19 HA SER 19 -4.451 -12.386 1.513
166 1HB SER 19 2HB SER 19 -6.688 -11.163 3.146
167 2HB SER 19 1HB SER 19 -6.784 -12.612 2.143
168 HG SER 19 HG SER 19 -4.796 -13.042 3.771
169 H ARG 20 H ARG 20 -5.672 -12.141 -0.389
170 HA ARG 20 HA ARG 20 -5.303 -9.654 -1.644
171 1HB ARG 20 2HB ARG 20 -5.556 -12.118 -2.588
172 2HB ARG 20 1HB ARG 20 -7.226 -11.606 -2.808
173 1HG ARG 20 2HG ARG 20 -6.627 -9.896 -4.285
174 2HG ARG 20 1HG ARG 20 -4.933 -9.957 -3.798
175 1HD ARG 20 2HD ARG 20 -5.622 -12.524 -4.738
176 2HD ARG 20 1HD ARG 20 -6.246 -11.357 -5.906
177 HE ARG 20 HE ARG 20 -3.790 -10.422 -5.597
178 1HH1 ARG 20 2HH1 ARG 20 -4.881 -13.731 -5.942
179 2HH1 ARG 20 1HH1 ARG 20 -3.412 -14.272 -6.702
180 1HH2 ARG 20 2HH2 ARG 20 -1.846 -11.127 -6.591
181 2HH2 ARG 20 1HH2 ARG 20 -1.692 -12.795 -7.078
182 H THR 21 H THR 21 -8.149 -11.103 -0.153
183 HA THR 21 HA THR 21 -10.020 -9.223 -1.142
184 HB THR 21 HB THR 21 -10.220 -11.523 0.317
185 HG1 THR 21 1HG THR 21 -11.996 -11.088 -0.751
186 1HG2 THR 21 1HG2 THR 21 -9.851 -10.814 2.477
187 2HG2 THR 21 2HG2 THR 21 -11.604 -10.655 2.356
188 3HG2 THR 21 3HG2 THR 21 -10.576 -9.231 2.197
189 H ILE 22 H ILE 22 -7.667 -9.133 1.390
190 HA ILE 22 HA ILE 22 -8.687 -6.795 2.703
191 HB ILE 22 HB ILE 22 -6.044 -8.246 2.812
192 1HG1 ILE 22 2HG1 ILE 22 -8.000 -7.793 5.056
193 1HG2 ILE 22 1HG2 ILE 22 -5.578 -6.713 4.783
194 2HG2 ILE 22 2HG2 ILE 22 -5.413 -6.014 3.171
195 3HG2 ILE 22 3HG2 ILE 22 -6.849 -5.676 4.136
196 1HD1 ILE 22 1HD1 ILE 22 -5.957 -8.673 5.844
197 2HD1 ILE 22 2HD1 ILE 22 -7.098 -10.017 5.785
198 3HD1 ILE 22 3HD1 ILE 22 -5.872 -9.845 4.526
199 H LEU 23 H LEU 23 -6.279 -7.563 0.244
200 HA LEU 23 HA LEU 23 -5.208 -4.978 -0.074
201 1HB LEU 23 2HB LEU 23 -4.555 -7.387 -1.032
202 2HB LEU 23 1HB LEU 23 -5.442 -6.795 -2.420
203 HG LEU 23 HG LEU 23 -2.739 -6.295 -1.683
204 1HD1 LEU 23 1HD1 LEU 23 -2.508 -5.752 -3.871
205 2HD1 LEU 23 2HD1 LEU 23 -4.011 -6.673 -3.938
206 3HD1 LEU 23 3HD1 LEU 23 -4.055 -4.911 -3.947
207 1HD2 LEU 23 1HD2 LEU 23 -3.663 -4.342 -0.461
208 2HD2 LEU 23 2HD2 LEU 23 -2.576 -3.919 -1.784
209 3HD2 LEU 23 3HD2 LEU 23 -4.318 -3.754 -1.991
210 H GLN 24 H GLN 24 -7.992 -6.607 -1.478
211 HA GLN 24 HA GLN 24 -8.638 -4.670 -3.428
212 1HB GLN 24 2HB GLN 24 -10.300 -6.738 -1.992
213 2HB GLN 24 1HB GLN 24 -10.957 -5.700 -3.250
214 1HG GLN 24 2HG GLN 24 -8.744 -7.717 -3.539
215 2HG GLN 24 1HG GLN 24 -10.373 -7.816 -4.202
216 1HE2 GLN 24 1HE2 GLN 24 -7.407 -7.488 -5.192
217 2HE2 GLN 24 2HE2 GLN 24 -7.586 -6.367 -6.499
218 H GLN 25 H GLN 25 -10.057 -5.205 -0.184
219 HA GLN 25 HA GLN 25 -11.682 -2.902 -0.245
220 1HB GLN 25 2HB GLN 25 -11.862 -3.199 2.215
221 2HB GLN 25 1HB GLN 25 -12.177 -4.674 1.316
222 1HG GLN 25 2HG GLN 25 -10.332 -5.724 2.108
223 2HG GLN 25 1HG GLN 25 -9.405 -4.234 2.256
224 1HE2 GLN 25 1HE2 GLN 25 -12.187 -5.911 3.656
225 2HE2 GLN 25 2HE2 GLN 25 -11.904 -5.388 5.282
226 H HIS 26 H HIS 26 -8.377 -3.427 0.752
227 HA HIS 26 HA HIS 26 -8.009 -0.974 2.091
228 1HB HIS 26 2HB HIS 26 -6.484 -2.822 2.466
229 2HB HIS 26 1HB HIS 26 -6.013 -2.827 0.771
230 HD1 HIS 26 1HD HIS 26 -5.138 -1.330 4.024
231 HD2 HIS 26 2HD HIS 26 -4.520 -0.488 -0.010
232 HE1 HIS 26 1HE HIS 26 -3.320 0.455 3.917
233 H MET 27 H MET 27 -7.137 -2.002 -1.211
234 HA MET 27 HA MET 27 -5.937 0.401 -1.965
235 1HB MET 27 2HB MET 27 -7.021 -1.961 -3.407
236 2HB MET 27 1HB MET 27 -6.726 -0.509 -4.355
237 1HG MET 27 2HG MET 27 -4.399 -0.514 -3.312
238 2HG MET 27 1HG MET 27 -4.767 -2.163 -2.809
239 1HE MET 27 1HE MET 27 -5.644 -3.672 -6.421
240 2HE MET 27 2HE MET 27 -5.388 -4.166 -4.748
241 3HE MET 27 3HE MET 27 -6.658 -3.006 -5.140
242 H LYS 28 H LYS 28 -9.268 -0.446 -1.766
243 HA LYS 28 HA LYS 28 -10.208 1.634 -3.502
244 1HB LYS 28 2HB LYS 28 -11.399 -0.462 -1.804
245 2HB LYS 28 1HB LYS 28 -12.369 0.994 -1.977
246 1HG LYS 28 2HG LYS 28 -12.896 -0.778 -3.623
247 2HG LYS 28 1HG LYS 28 -12.429 0.757 -4.355
248 1HD LYS 28 2HD LYS 28 -10.028 -0.589 -4.108
249 2HD LYS 28 1HD LYS 28 -11.172 -1.863 -4.536
250 1HE LYS 28 2HE LYS 28 -11.684 -0.915 -6.570
251 2HE LYS 28 1HE LYS 28 -11.221 0.704 -6.050
252 1HZ LYS 28 1HZ LYS 28 -9.706 -0.489 -7.678
253 2HZ LYS 28 2HZ LYS 28 -9.219 -1.453 -6.376
254 3HZ LYS 28 3HZ LYS 28 -8.965 0.224 -6.332
255 H LYS 29 H LYS 29 -9.229 1.426 -0.218
256 HA LYS 29 HA LYS 29 -10.562 3.930 0.477
257 1HB LYS 29 2HB LYS 29 -10.554 1.971 2.064
258 2HB LYS 29 1HB LYS 29 -8.817 2.199 2.229
259 1HG LYS 29 2HG LYS 29 -10.124 4.693 2.680
260 2HG LYS 29 1HG LYS 29 -10.885 3.446 3.674
261 1HD LYS 29 2HD LYS 29 -8.564 2.774 4.394
262 2HD LYS 29 1HD LYS 29 -7.979 4.236 3.596
263 1HE LYS 29 2HE LYS 29 -10.223 4.500 5.523
264 2HE LYS 29 1HE LYS 29 -8.613 4.191 6.169
265 1HZ LYS 29 1HZ LYS 29 -9.454 6.471 4.469
266 2HZ LYS 29 2HZ LYS 29 -7.834 6.127 4.839
267 3HZ LYS 29 3HZ LYS 29 -8.919 6.527 6.076
268 H CYS 30 H CYS 30 -7.390 2.548 -0.010
269 HA CYS 30 HA CYS 30 -5.906 4.850 0.773
270 1HB CYS 30 2HB CYS 30 -5.336 2.216 0.165
271 2HB CYS 30 1HB CYS 30 -4.639 3.091 -1.188
272 H GLY 31 H GLY 31 -7.331 3.703 -2.216
273 1HA GLY 31 1HA GLY 31 -5.959 5.559 -3.910
274 2HA GLY 31 2HA GLY 31 -7.326 4.546 -4.360
275 H TRP 32 H TRP 32 -6.998 7.068 -1.892
276 HA TRP 32 HA TRP 32 -9.113 8.577 -3.273
277 1HB TRP 32 2HB TRP 32 -8.766 7.882 -0.394
278 2HB TRP 32 1HB TRP 32 -9.429 9.468 -0.776
279 HD1 TRP 32 HD TRP 32 -10.551 6.104 -0.050
280 HE1 TRP 32 1HE TRP 32 -12.954 5.691 -0.891
281 HE3 TRP 32 3HE TRP 32 -11.022 10.140 -3.157
282 HZ2 TRP 32 2HZ TRP 32 -14.796 6.920 -2.646
283 HZ3 TRP 32 3HZ TRP 32 -13.135 10.447 -4.382
284 HH2 TRP 32 HH TRP 32 -14.980 8.866 -4.134
285 H PHE 33 H PHE 33 -6.207 8.717 -3.555
286 HA PHE 33 HA PHE 33 -5.968 11.573 -3.201
287 1HB PHE 33 2HB PHE 33 -4.084 11.634 -1.852
288 2HB PHE 33 1HB PHE 33 -4.967 10.284 -1.142
289 HD1 PHE 33 1HD PHE 33 -4.326 7.920 -1.983
290 HD2 PHE 33 2HD PHE 33 -1.878 11.366 -2.487
291 HE1 PHE 33 1HE PHE 33 -2.357 6.476 -2.283
292 HE2 PHE 33 2HE PHE 33 0.094 9.926 -2.792
293 HZ PHE 33 HZ PHE 33 -0.145 7.478 -2.689
Start of MODEL 19
1 1H GLY 1 1H GLY 1 3.518 -17.377 4.253
2 2H GLY 1 2H GLY 1 3.139 -16.203 3.095
3 3H GLY 1 3H GLY 1 4.423 -15.945 4.170
4 1HA GLY 1 2HA GLY 1 4.423 -18.255 2.337
5 2HA GLY 1 1HA GLY 1 4.959 -16.675 1.786
6 H SER 2 H SER 2 6.204 -19.438 2.552
7 HA SER 2 HA SER 2 8.155 -18.698 4.538
8 1HB SER 2 2HB SER 2 8.293 -21.085 2.696
9 2HB SER 2 1HB SER 2 8.990 -20.910 4.308
10 HG SER 2 HG SER 2 6.212 -20.989 3.687
11 H ARG 3 H ARG 3 10.281 -18.190 4.231
12 HA ARG 3 HA ARG 3 12.165 -17.424 3.223
13 1HB ARG 3 2HB ARG 3 11.099 -19.183 1.207
14 2HB ARG 3 1HB ARG 3 11.807 -17.762 0.452
15 1HG ARG 3 2HG ARG 3 13.684 -18.475 2.334
16 2HG ARG 3 1HG ARG 3 13.090 -20.025 1.738
17 1HD ARG 3 2HD ARG 3 14.289 -17.769 0.151
18 2HD ARG 3 1HD ARG 3 14.933 -19.396 0.367
19 HE ARG 3 HE ARG 3 12.916 -20.157 -0.923
20 1HH1 ARG 3 2HH1 ARG 3 14.224 -16.920 -1.315
21 2HH1 ARG 3 1HH1 ARG 3 13.577 -16.721 -2.922
22 1HH2 ARG 3 2HH2 ARG 3 12.039 -19.872 -3.019
23 2HH2 ARG 3 1HH2 ARG 3 12.350 -18.399 -3.887
24 H LEU 4 H LEU 4 9.728 -16.907 0.691
25 HA LEU 4 HA LEU 4 10.096 -14.004 1.039
26 1HB LEU 4 2HB LEU 4 8.701 -15.193 -1.324
27 2HB LEU 4 1HB LEU 4 9.543 -13.661 -1.192
28 HG LEU 4 HG LEU 4 11.311 -15.962 -0.844
29 1HD1 LEU 4 1HD1 LEU 4 11.065 -17.048 -2.810
30 2HD1 LEU 4 2HD1 LEU 4 9.391 -16.522 -2.629
31 3HD1 LEU 4 3HD1 LEU 4 10.496 -15.612 -3.660
32 1HD2 LEU 4 1HD2 LEU 4 11.445 -13.799 -2.920
33 2HD2 LEU 4 2HD2 LEU 4 11.842 -13.485 -1.232
34 3HD2 LEU 4 3HD2 LEU 4 12.765 -14.676 -2.146
35 HA PRO 5 HA PRO 5 6.197 -13.962 3.118
36 1HB PRO 5 2HB PRO 5 5.998 -11.270 1.877
37 2HB PRO 5 1HB PRO 5 5.806 -11.744 3.565
38 1HG PRO 5 2HG PRO 5 8.020 -10.525 2.742
39 2HG PRO 5 1HG PRO 5 8.086 -11.831 3.939
40 1HD PRO 5 2HD PRO 5 8.802 -11.870 1.046
41 2HD PRO 5 1HD PRO 5 9.537 -12.745 2.405
42 H LYS 6 H LYS 6 6.406 -12.726 -0.188
43 HA LYS 6 HA LYS 6 4.998 -12.776 -1.954
44 1HB LYS 6 2HB LYS 6 4.977 -15.388 -0.766
45 2HB LYS 6 1HB LYS 6 3.389 -15.047 -1.441
46 1HG LYS 6 2HG LYS 6 4.843 -16.180 -3.037
47 2HG LYS 6 1HG LYS 6 4.379 -14.575 -3.603
48 1HD LYS 6 2HD LYS 6 6.500 -13.703 -3.245
49 2HD LYS 6 1HD LYS 6 6.936 -14.971 -2.098
50 1HE LYS 6 2HE LYS 6 8.149 -15.400 -4.089
51 2HE LYS 6 1HE LYS 6 6.850 -16.592 -4.020
52 1HZ LYS 6 1HZ LYS 6 6.791 -15.849 -6.193
53 2HZ LYS 6 2HZ LYS 6 7.110 -14.235 -5.779
54 3HZ LYS 6 3HZ LYS 6 5.587 -14.907 -5.462
55 H LEU 7 H LEU 7 4.121 -10.911 -0.581
56 HA LEU 7 HA LEU 7 1.276 -11.393 0.026
57 1HB LEU 7 2HB LEU 7 3.259 -9.389 1.016
58 2HB LEU 7 1HB LEU 7 1.576 -8.941 0.956
59 HG LEU 7 HG LEU 7 1.168 -9.965 2.879
60 1HD1 LEU 7 1HD1 LEU 7 1.125 -12.237 3.125
61 2HD1 LEU 7 2HD1 LEU 7 1.225 -12.117 1.369
62 3HD1 LEU 7 3HD1 LEU 7 2.671 -12.468 2.313
63 1HD2 LEU 7 1HD2 LEU 7 3.996 -10.910 3.092
64 2HD2 LEU 7 2HD2 LEU 7 3.593 -9.191 3.163
65 3HD2 LEU 7 3HD2 LEU 7 2.917 -10.305 4.348
66 H TYR 8 H TYR 8 0.326 -8.839 -0.235
67 HA TYR 8 HA TYR 8 0.725 -8.257 -3.098
68 1HB TYR 8 2HB TYR 8 -1.849 -7.556 -1.768
69 2HB TYR 8 1HB TYR 8 -1.544 -8.054 -3.433
70 HD1 TYR 8 1HD TYR 8 -1.943 -9.245 0.022
71 HD2 TYR 8 2HD TYR 8 -1.681 -10.356 -4.068
72 HE1 TYR 8 1HE TYR 8 -2.631 -11.514 0.613
73 HE2 TYR 8 2HE TYR 8 -2.385 -12.642 -3.498
74 HH TYR 8 HH TYR 8 -2.706 -14.106 -1.806
75 H LEU 9 H LEU 9 1.296 -6.237 -3.561
76 HA LEU 9 HA LEU 9 1.691 -4.432 -1.325
77 1HB LEU 9 2HB LEU 9 3.486 -5.012 -2.977
78 2HB LEU 9 1HB LEU 9 2.585 -4.124 -4.189
79 HG LEU 9 HG LEU 9 2.872 -2.052 -2.913
80 1HD1 LEU 9 1HD1 LEU 9 4.867 -3.261 -1.098
81 2HD1 LEU 9 2HD1 LEU 9 3.749 -1.921 -0.832
82 3HD1 LEU 9 3HD1 LEU 9 3.172 -3.584 -0.727
83 1HD2 LEU 9 1HD2 LEU 9 5.189 -3.685 -3.803
84 2HD2 LEU 9 2HD2 LEU 9 4.562 -2.157 -4.434
85 3HD2 LEU 9 3HD2 LEU 9 5.521 -2.174 -2.953
86 H CYS 10 H CYS 10 0.973 -2.346 -1.187
87 HA CYS 10 HA CYS 10 -1.420 -1.642 -2.603
88 1HB CYS 10 2HB CYS 10 -1.317 -1.067 -0.262
89 2HB CYS 10 1HB CYS 10 0.233 -0.288 -0.461
90 H GLU 11 H GLU 11 -1.233 0.895 -3.134
91 HA GLU 11 HA GLU 11 1.096 1.276 -4.885
92 1HB GLU 11 2HB GLU 11 -1.792 1.273 -5.623
93 2HB GLU 11 1HB GLU 11 -0.728 2.413 -6.435
94 1HG GLU 11 2HG GLU 11 0.521 -0.138 -6.425
95 2HG GLU 11 1HG GLU 11 -1.135 -0.316 -7.004
96 H PHE 12 H PHE 12 -0.903 2.450 -2.499
97 HA PHE 12 HA PHE 12 -0.291 5.248 -3.174
98 1HB PHE 12 2HB PHE 12 -2.469 4.200 -1.355
99 2HB PHE 12 1HB PHE 12 -2.215 5.878 -1.827
100 HD1 PHE 12 1HD PHE 12 -3.775 2.772 -2.678
101 HD2 PHE 12 2HD PHE 12 -2.435 6.485 -4.276
102 HE1 PHE 12 1HE PHE 12 -5.219 2.446 -4.642
103 HE2 PHE 12 2HE PHE 12 -3.867 6.154 -6.250
104 HZ PHE 12 HZ PHE 12 -5.265 4.137 -6.430
105 H CYS 13 H CYS 13 -0.276 2.874 -0.541
106 HA CYS 13 HA CYS 13 1.559 4.687 0.877
107 1HB CYS 13 2HB CYS 13 0.875 3.787 2.992
108 2HB CYS 13 1HB CYS 13 -0.564 4.296 2.120
109 H LEU 14 H LEU 14 1.176 1.778 -0.725
110 HA LEU 14 HA LEU 14 2.518 0.026 -1.183
111 1HB LEU 14 2HB LEU 14 4.655 1.909 -0.198
112 2HB LEU 14 1HB LEU 14 4.949 0.432 -1.097
113 HG LEU 14 HG LEU 14 3.164 2.497 -2.300
114 1HD1 LEU 14 1HD1 LEU 14 5.428 3.296 -3.379
115 2HD1 LEU 14 2HD1 LEU 14 4.828 3.996 -1.876
116 3HD1 LEU 14 3HD1 LEU 14 6.087 2.762 -1.831
117 1HD2 LEU 14 1HD2 LEU 14 3.244 0.849 -3.816
118 2HD2 LEU 14 2HD2 LEU 14 4.820 1.527 -4.226
119 3HD2 LEU 14 3HD2 LEU 14 4.710 0.150 -3.128
120 H LYS 15 H LYS 15 1.326 -0.849 0.745
121 HA LYS 15 HA LYS 15 3.319 -1.932 2.607
122 1HB LYS 15 2HB LYS 15 0.487 -1.070 3.143
123 2HB LYS 15 1HB LYS 15 1.195 -2.381 4.076
124 1HG LYS 15 2HG LYS 15 3.025 -0.191 4.004
125 2HG LYS 15 1HG LYS 15 1.436 0.384 4.512
126 1HD LYS 15 2HD LYS 15 2.780 -2.029 5.712
127 2HD LYS 15 1HD LYS 15 2.962 -0.399 6.362
128 1HE LYS 15 2HE LYS 15 1.075 -0.659 7.500
129 2HE LYS 15 1HE LYS 15 0.200 -0.843 5.980
130 1HZ LYS 15 1HZ LYS 15 0.309 -3.134 6.091
131 2HZ LYS 15 2HZ LYS 15 0.069 -2.714 7.712
132 3HZ LYS 15 3HZ LYS 15 1.617 -3.140 7.170
133 H TYR 16 H TYR 16 2.798 -4.182 3.249
134 HA TYR 16 HA TYR 16 1.685 -5.585 0.927
135 1HB TYR 16 2HB TYR 16 3.584 -6.442 3.109
136 2HB TYR 16 1HB TYR 16 2.895 -7.568 1.945
137 HD1 TYR 16 1HD TYR 16 3.318 -7.092 -0.551
138 HD2 TYR 16 2HD TYR 16 5.526 -5.252 2.590
139 HE1 TYR 16 1HE TYR 16 5.137 -6.566 -2.135
140 HE2 TYR 16 2HE TYR 16 7.337 -4.725 1.018
141 HH TYR 16 HH TYR 16 7.282 -4.426 -1.846
142 H MET 17 H MET 17 -0.172 -6.647 1.037
143 HA MET 17 HA MET 17 -1.496 -6.887 3.640
144 1HB MET 17 2HB MET 17 -2.665 -7.542 0.940
145 2HB MET 17 1HB MET 17 -3.530 -7.269 2.442
146 1HG MET 17 2HG MET 17 -2.242 -5.300 0.610
147 2HG MET 17 1HG MET 17 -3.875 -5.329 1.260
148 1HE MET 17 1HE MET 17 -2.485 -2.794 1.043
149 2HE MET 17 2HE MET 17 -1.766 -2.094 2.493
150 3HE MET 17 3HE MET 17 -0.809 -3.160 1.462
151 H LYS 18 H LYS 18 -2.185 -8.827 4.501
152 HA LYS 18 HA LYS 18 -0.662 -11.129 3.612
153 1HB LYS 18 2HB LYS 18 -2.273 -10.441 6.029
154 2HB LYS 18 1HB LYS 18 -1.947 -12.134 5.683
155 1HG LYS 18 2HG LYS 18 -0.104 -11.772 6.899
156 2HG LYS 18 1HG LYS 18 0.525 -11.090 5.397
157 1HD LYS 18 2HD LYS 18 -1.001 -9.119 6.831
158 2HD LYS 18 1HD LYS 18 0.248 -9.804 7.873
159 1HE LYS 18 2HE LYS 18 1.448 -9.374 5.368
160 2HE LYS 18 1HE LYS 18 0.501 -7.929 5.716
161 1HZ LYS 18 1HZ LYS 18 2.672 -7.638 6.608
162 2HZ LYS 18 2HZ LYS 18 2.618 -9.130 7.411
163 3HZ LYS 18 3HZ LYS 18 1.612 -7.865 7.915
164 H SER 19 H SER 19 -3.924 -9.985 3.408
165 HA SER 19 HA SER 19 -4.638 -12.498 2.062
166 1HB SER 19 2HB SER 19 -6.702 -10.836 3.494
167 2HB SER 19 1HB SER 19 -6.803 -12.519 2.980
168 HG SER 19 HG SER 19 -5.256 -13.035 4.588
169 H ARG 20 H ARG 20 -5.798 -12.304 0.160
170 HA ARG 20 HA ARG 20 -5.296 -9.965 -1.314
171 1HB ARG 20 2HB ARG 20 -5.763 -12.486 -2.022
172 2HB ARG 20 1HB ARG 20 -7.386 -11.852 -2.263
173 1HG ARG 20 2HG ARG 20 -6.457 -10.116 -3.743
174 2HG ARG 20 1HG ARG 20 -4.860 -10.842 -3.548
175 1HD ARG 20 2HD ARG 20 -5.521 -11.848 -5.487
176 2HD ARG 20 1HD ARG 20 -6.133 -13.015 -4.317
177 HE ARG 20 HE ARG 20 -8.332 -12.005 -4.588
178 1HH1 ARG 20 2HH1 ARG 20 -5.920 -11.128 -6.981
179 2HH1 ARG 20 1HH1 ARG 20 -7.091 -10.847 -8.241
180 1HH2 ARG 20 2HH2 ARG 20 -9.869 -11.614 -6.237
181 2HH2 ARG 20 1HH2 ARG 20 -9.333 -11.064 -7.799
182 H THR 21 H THR 21 -8.184 -11.104 0.337
183 HA THR 21 HA THR 21 -10.040 -9.291 -0.743
184 HB THR 21 HB THR 21 -11.076 -9.608 1.676
185 HG1 THR 21 1HG THR 21 -9.984 -12.027 1.922
186 1HG2 THR 21 1HG2 THR 21 -10.824 -11.999 -0.138
187 2HG2 THR 21 2HG2 THR 21 -11.808 -10.592 -0.544
188 3HG2 THR 21 3HG2 THR 21 -12.186 -11.550 0.887
189 H ILE 22 H ILE 22 -7.689 -9.000 1.830
190 HA ILE 22 HA ILE 22 -8.558 -6.514 2.871
191 HB ILE 22 HB ILE 22 -5.920 -7.970 2.955
192 1HG1 ILE 22 2HG1 ILE 22 -7.675 -7.255 5.282
193 1HG2 ILE 22 1HG2 ILE 22 -6.175 -5.798 4.861
194 2HG2 ILE 22 2HG2 ILE 22 -4.826 -6.231 3.804
195 3HG2 ILE 22 3HG2 ILE 22 -6.146 -5.236 3.188
196 1HD1 ILE 22 1HD1 ILE 22 -5.368 -8.260 5.570
197 2HD1 ILE 22 2HD1 ILE 22 -6.707 -9.081 6.374
198 3HD1 ILE 22 3HD1 ILE 22 -6.044 -9.734 4.875
199 H LEU 23 H LEU 23 -6.016 -7.432 0.556
200 HA LEU 23 HA LEU 23 -5.145 -4.855 -0.109
201 1HB LEU 23 2HB LEU 23 -4.296 -7.283 -0.752
202 2HB LEU 23 1HB LEU 23 -5.229 -6.979 -2.204
203 HG LEU 23 HG LEU 23 -2.581 -6.252 -1.709
204 1HD1 LEU 23 1HD1 LEU 23 -2.681 -5.307 -3.915
205 2HD1 LEU 23 2HD1 LEU 23 -3.619 -6.797 -3.856
206 3HD1 LEU 23 3HD1 LEU 23 -4.440 -5.234 -3.839
207 1HD2 LEU 23 1HD2 LEU 23 -2.773 -3.747 -2.152
208 2HD2 LEU 23 2HD2 LEU 23 -4.409 -3.884 -1.505
209 3HD2 LEU 23 3HD2 LEU 23 -3.025 -4.312 -0.498
210 H GLN 24 H GLN 24 -7.720 -6.837 -1.524
211 HA GLN 24 HA GLN 24 -8.356 -5.199 -3.685
212 1HB GLN 24 2HB GLN 24 -9.937 -7.175 -2.068
213 2HB GLN 24 1HB GLN 24 -10.716 -6.239 -3.335
214 1HG GLN 24 2HG GLN 24 -8.890 -7.088 -4.877
215 2HG GLN 24 1HG GLN 24 -8.493 -8.231 -3.599
216 1HE2 GLN 24 1HE2 GLN 24 -10.070 -7.967 -6.399
217 2HE2 GLN 24 2HE2 GLN 24 -11.322 -9.144 -6.175
218 H GLN 25 H GLN 25 -9.760 -5.233 -0.411
219 HA GLN 25 HA GLN 25 -11.455 -2.986 -0.876
220 1HB GLN 25 2HB GLN 25 -10.555 -4.477 1.561
221 2HB GLN 25 1HB GLN 25 -11.442 -2.968 1.725
222 1HG GLN 25 2HG GLN 25 -13.346 -3.850 0.680
223 2HG GLN 25 1HG GLN 25 -12.464 -5.246 0.071
224 1HE2 GLN 25 1HE2 GLN 25 -11.395 -6.551 1.881
225 2HE2 GLN 25 2HE2 GLN 25 -12.389 -6.881 3.258
226 H HIS 26 H HIS 26 -8.228 -3.413 0.439
227 HA HIS 26 HA HIS 26 -7.849 -0.903 1.569
228 1HB HIS 26 2HB HIS 26 -6.318 -2.810 1.902
229 2HB HIS 26 1HB HIS 26 -5.776 -2.660 0.234
230 HD1 HIS 26 1HD HIS 26 -5.290 -1.205 3.632
231 HD2 HIS 26 2HD HIS 26 -4.195 -0.368 -0.314
232 HE1 HIS 26 1HE HIS 26 -3.526 0.635 3.730
233 H MET 27 H MET 27 -7.337 -1.979 -1.758
234 HA MET 27 HA MET 27 -6.054 0.370 -2.630
235 1HB MET 27 2HB MET 27 -7.377 -1.932 -3.992
236 2HB MET 27 1HB MET 27 -6.947 -0.515 -4.942
237 1HG MET 27 2HG MET 27 -4.620 -0.765 -3.901
238 2HG MET 27 1HG MET 27 -5.150 -2.381 -3.437
239 1HE MET 27 1HE MET 27 -2.781 -2.141 -4.665
240 2HE MET 27 2HE MET 27 -2.726 -3.163 -6.101
241 3HE MET 27 3HE MET 27 -2.675 -1.409 -6.266
242 H LYS 28 H LYS 28 -9.348 -0.299 -1.992
243 HA LYS 28 HA LYS 28 -10.186 2.121 -3.440
244 1HB LYS 28 2HB LYS 28 -12.338 0.744 -2.073
245 2HB LYS 28 1HB LYS 28 -12.186 1.164 -3.772
246 1HG LYS 28 2HG LYS 28 -10.734 -1.196 -2.650
247 2HG LYS 28 1HG LYS 28 -12.434 -1.310 -3.108
248 1HD LYS 28 2HD LYS 28 -11.581 -0.208 -5.333
249 2HD LYS 28 1HD LYS 28 -10.029 -0.866 -4.813
250 1HE LYS 28 2HE LYS 28 -10.611 -2.890 -5.504
251 2HE LYS 28 1HE LYS 28 -12.052 -2.855 -4.489
252 1HZ LYS 28 1HZ LYS 28 -12.267 -3.096 -7.054
253 2HZ LYS 28 2HZ LYS 28 -12.063 -1.413 -7.053
254 3HZ LYS 28 3HZ LYS 28 -13.353 -2.112 -6.203
255 H LYS 29 H LYS 29 -8.724 1.629 -0.755
256 HA LYS 29 HA LYS 29 -10.434 3.394 0.870
257 1HB LYS 29 2HB LYS 29 -10.255 1.115 1.801
258 2HB LYS 29 1HB LYS 29 -8.506 1.265 1.820
259 1HG LYS 29 2HG LYS 29 -9.342 3.463 3.248
260 2HG LYS 29 1HG LYS 29 -10.479 2.202 3.725
261 1HD LYS 29 2HD LYS 29 -8.590 0.721 4.259
262 2HD LYS 29 1HD LYS 29 -7.470 2.007 3.809
263 1HE LYS 29 2HE LYS 29 -7.797 3.143 5.726
264 2HE LYS 29 1HE LYS 29 -9.518 2.764 5.778
265 1HZ LYS 29 1HZ LYS 29 -7.240 1.154 6.749
266 2HZ LYS 29 2HZ LYS 29 -8.727 0.420 6.386
267 3HZ LYS 29 3HZ LYS 29 -8.645 1.623 7.580
268 H CYS 30 H CYS 30 -7.259 2.645 -0.294
269 HA CYS 30 HA CYS 30 -5.931 4.695 1.214
270 1HB CYS 30 2HB CYS 30 -5.117 2.403 0.001
271 2HB CYS 30 1HB CYS 30 -4.601 3.594 -1.182
272 H GLY 31 H GLY 31 -7.896 4.739 -1.472
273 1HA GLY 31 1HA GLY 31 -6.553 7.112 -2.592
274 2HA GLY 31 2HA GLY 31 -7.679 6.082 -3.474
275 H TRP 32 H TRP 32 -7.696 7.939 -0.411
276 HA TRP 32 HA TRP 32 -10.192 9.200 -1.334
277 1HB TRP 32 2HB TRP 32 -9.653 7.872 1.311
278 2HB TRP 32 1HB TRP 32 -10.884 9.120 1.148
279 HD1 TRP 32 HD TRP 32 -10.696 5.559 1.229
280 HE1 TRP 32 1HE TRP 32 -12.631 4.440 -0.043
281 HE3 TRP 32 3HE TRP 32 -12.347 9.591 -1.458
282 HZ2 TRP 32 2HZ TRP 32 -14.604 5.170 -1.921
283 HZ3 TRP 32 3HZ TRP 32 -14.267 9.291 -2.967
284 HH2 TRP 32 HH TRP 32 -15.368 7.125 -3.195
285 H PHE 33 H PHE 33 -7.096 9.723 -0.505
286 HA PHE 33 HA PHE 33 -7.667 12.447 0.401
287 1HB PHE 33 2HB PHE 33 -6.104 10.377 1.837
288 2HB PHE 33 1HB PHE 33 -5.366 11.977 1.751
289 HD1 PHE 33 1HD PHE 33 -7.967 9.948 3.225
290 HD2 PHE 33 2HD PHE 33 -6.544 13.926 2.721
291 HE1 PHE 33 1HE PHE 33 -9.364 10.682 5.111
292 HE2 PHE 33 2HE PHE 33 -7.943 14.669 4.607
293 HZ PHE 33 HZ PHE 33 -9.353 13.045 5.803
Start of MODEL 20
1 1H GLY 1 1H GLY 1 6.856 -14.330 7.939
2 2H GLY 1 2H GLY 1 6.927 -13.915 6.296
3 3H GLY 1 3H GLY 1 8.021 -15.045 6.931
4 1HA GLY 1 2HA GLY 1 5.780 -16.267 7.575
5 2HA GLY 1 1HA GLY 1 5.232 -15.377 6.159
6 H SER 2 H SER 2 5.605 -18.275 6.557
7 HA SER 2 HA SER 2 7.944 -19.028 5.092
8 1HB SER 2 2HB SER 2 5.618 -20.869 5.499
9 2HB SER 2 1HB SER 2 7.345 -21.221 5.568
10 HG SER 2 HG SER 2 7.294 -20.832 7.618
11 H ARG 3 H ARG 3 4.791 -18.049 4.181
12 HA ARG 3 HA ARG 3 4.618 -19.518 1.734
13 1HB ARG 3 2HB ARG 3 2.724 -18.379 3.091
14 2HB ARG 3 1HB ARG 3 3.201 -16.917 2.242
15 1HG ARG 3 2HG ARG 3 2.214 -17.556 0.352
16 2HG ARG 3 1HG ARG 3 2.810 -19.211 0.485
17 1HD ARG 3 2HD ARG 3 0.657 -18.299 2.328
18 2HD ARG 3 1HD ARG 3 0.242 -18.674 0.657
19 HE ARG 3 HE ARG 3 1.534 -20.880 1.279
20 1HH1 ARG 3 2HH1 ARG 3 -0.732 -19.058 3.247
21 2HH1 ARG 3 1HH1 ARG 3 -1.315 -20.461 4.101
22 1HH2 ARG 3 2HH2 ARG 3 0.783 -22.723 2.425
23 2HH2 ARG 3 1HH2 ARG 3 -0.434 -22.536 3.657
24 H LEU 4 H LEU 4 4.509 -15.990 1.835
25 HA LEU 4 HA LEU 4 6.955 -15.712 0.350
26 1HB LEU 4 2HB LEU 4 5.046 -16.373 -1.288
27 2HB LEU 4 1HB LEU 4 4.493 -14.727 -1.048
28 HG LEU 4 HG LEU 4 7.070 -14.245 -1.666
29 1HD1 LEU 4 1HD1 LEU 4 7.051 -16.898 -2.064
30 2HD1 LEU 4 2HD1 LEU 4 6.532 -16.351 -3.660
31 3HD1 LEU 4 3HD1 LEU 4 8.061 -15.782 -2.986
32 1HD2 LEU 4 1HD2 LEU 4 6.288 -13.497 -3.737
33 2HD2 LEU 4 2HD2 LEU 4 5.064 -14.761 -3.834
34 3HD2 LEU 4 3HD2 LEU 4 4.871 -13.433 -2.689
35 HA PRO 5 HA PRO 5 6.524 -12.056 2.894
36 1HB PRO 5 2HB PRO 5 9.072 -11.328 1.595
37 2HB PRO 5 1HB PRO 5 8.691 -11.491 3.313
38 1HG PRO 5 2HG PRO 5 10.184 -13.317 2.077
39 2HG PRO 5 1HG PRO 5 8.983 -13.789 3.294
40 1HD PRO 5 2HD PRO 5 8.793 -13.916 0.303
41 2HD PRO 5 1HD PRO 5 8.293 -15.117 1.514
42 H LYS 6 H LYS 6 7.031 -12.175 -0.521
43 HA LYS 6 HA LYS 6 6.432 -9.373 -0.955
44 1HB LYS 6 2HB LYS 6 6.828 -11.720 -2.805
45 2HB LYS 6 1HB LYS 6 6.283 -10.153 -3.387
46 1HG LYS 6 2HG LYS 6 8.766 -10.324 -1.745
47 2HG LYS 6 1HG LYS 6 8.809 -10.780 -3.450
48 1HD LYS 6 2HD LYS 6 7.403 -8.275 -3.000
49 2HD LYS 6 1HD LYS 6 9.073 -8.225 -2.432
50 1HE LYS 6 2HE LYS 6 9.650 -7.816 -4.545
51 2HE LYS 6 1HE LYS 6 9.250 -9.502 -4.876
52 1HZ LYS 6 1HZ LYS 6 7.178 -7.403 -4.952
53 2HZ LYS 6 2HZ LYS 6 7.166 -8.931 -5.690
54 3HZ LYS 6 3HZ LYS 6 8.163 -7.697 -6.302
55 H LEU 7 H LEU 7 4.490 -9.464 0.313
56 HA LEU 7 HA LEU 7 2.283 -11.097 -0.344
57 1HB LEU 7 2HB LEU 7 2.786 -8.743 1.385
58 2HB LEU 7 1HB LEU 7 1.123 -9.026 0.927
59 HG LEU 7 HG LEU 7 1.530 -9.999 3.079
60 1HD1 LEU 7 1HD1 LEU 7 1.497 -12.576 1.908
61 2HD1 LEU 7 2HD1 LEU 7 0.138 -11.623 2.505
62 3HD1 LEU 7 3HD1 LEU 7 0.644 -11.481 0.820
63 1HD2 LEU 7 1HD2 LEU 7 3.159 -11.942 3.228
64 2HD2 LEU 7 2HD2 LEU 7 3.841 -11.342 1.715
65 3HD2 LEU 7 3HD2 LEU 7 3.850 -10.321 3.154
66 H TYR 8 H TYR 8 0.191 -9.224 -0.297
67 HA TYR 8 HA TYR 8 0.169 -8.360 -3.076
68 1HB TYR 8 2HB TYR 8 -2.058 -8.010 -1.068
69 2HB TYR 8 1HB TYR 8 -2.176 -8.076 -2.829
70 HD1 TYR 8 1HD TYR 8 -1.628 -10.080 0.217
71 HD2 TYR 8 2HD TYR 8 -2.316 -10.171 -3.980
72 HE1 TYR 8 1HE TYR 8 -2.029 -12.492 0.346
73 HE2 TYR 8 2HE TYR 8 -2.734 -12.593 -3.859
74 HH TYR 8 HH TYR 8 -2.939 -14.361 -2.535
75 H LEU 9 H LEU 9 1.352 -6.590 -3.310
76 HA LEU 9 HA LEU 9 1.588 -4.659 -1.224
77 1HB LEU 9 2HB LEU 9 3.435 -5.335 -2.770
78 2HB LEU 9 1HB LEU 9 2.609 -4.474 -4.055
79 HG LEU 9 HG LEU 9 2.878 -2.363 -2.831
80 1HD1 LEU 9 1HD1 LEU 9 3.873 -4.206 -0.740
81 2HD1 LEU 9 2HD1 LEU 9 4.685 -2.649 -0.906
82 3HD1 LEU 9 3HD1 LEU 9 2.950 -2.711 -0.592
83 1HD2 LEU 9 1HD2 LEU 9 5.073 -2.025 -3.430
84 2HD2 LEU 9 2HD2 LEU 9 5.589 -3.608 -2.837
85 3HD2 LEU 9 3HD2 LEU 9 4.686 -3.483 -4.351
86 H CYS 10 H CYS 10 0.924 -2.574 -1.159
87 HA CYS 10 HA CYS 10 -1.321 -1.825 -2.800
88 1HB CYS 10 2HB CYS 10 -1.587 -1.418 -0.460
89 2HB CYS 10 1HB CYS 10 -0.006 -0.670 -0.340
90 H GLU 11 H GLU 11 -1.284 0.345 -3.678
91 HA GLU 11 HA GLU 11 1.334 0.949 -4.871
92 1HB GLU 11 2HB GLU 11 -1.387 1.617 -6.005
93 2HB GLU 11 1HB GLU 11 0.165 1.776 -6.816
94 1HG GLU 11 2HG GLU 11 -0.450 -0.921 -5.846
95 2HG GLU 11 1HG GLU 11 -1.525 -0.316 -7.106
96 H PHE 12 H PHE 12 -0.976 2.116 -2.745
97 HA PHE 12 HA PHE 12 -0.383 4.920 -3.357
98 1HB PHE 12 2HB PHE 12 -2.422 3.809 -1.423
99 2HB PHE 12 1HB PHE 12 -2.288 5.476 -1.975
100 HD1 PHE 12 1HD PHE 12 -3.525 2.160 -2.725
101 HD2 PHE 12 2HD PHE 12 -2.857 6.051 -4.315
102 HE1 PHE 12 1HE PHE 12 -5.049 1.654 -4.590
103 HE2 PHE 12 2HE PHE 12 -4.377 5.550 -6.181
104 HZ PHE 12 HZ PHE 12 -5.475 3.350 -6.321
105 H CYS 13 H CYS 13 -0.320 2.639 -0.630
106 HA CYS 13 HA CYS 13 1.512 4.514 0.712
107 1HB CYS 13 2HB CYS 13 0.850 3.614 2.837
108 2HB CYS 13 1HB CYS 13 -0.610 4.040 1.953
109 H LEU 14 H LEU 14 1.145 1.510 -0.758
110 HA LEU 14 HA LEU 14 2.539 -0.192 -1.231
111 1HB LEU 14 2HB LEU 14 4.670 1.646 -0.153
112 2HB LEU 14 1HB LEU 14 4.958 0.183 -1.078
113 HG LEU 14 HG LEU 14 3.182 2.124 -2.388
114 1HD1 LEU 14 1HD1 LEU 14 4.583 3.866 -2.653
115 2HD1 LEU 14 2HD1 LEU 14 5.199 3.320 -1.092
116 3HD1 LEU 14 3HD1 LEU 14 6.029 2.856 -2.579
117 1HD2 LEU 14 1HD2 LEU 14 4.721 1.574 -4.287
118 2HD2 LEU 14 2HD2 LEU 14 5.575 0.486 -3.192
119 3HD2 LEU 14 3HD2 LEU 14 3.881 0.191 -3.585
120 H LYS 15 H LYS 15 1.156 -0.590 0.997
121 HA LYS 15 HA LYS 15 3.065 -1.832 2.864
122 1HB LYS 15 2HB LYS 15 0.175 -1.029 3.157
123 2HB LYS 15 1HB LYS 15 0.906 -2.209 4.236
124 1HG LYS 15 2HG LYS 15 2.504 0.201 3.968
125 2HG LYS 15 1HG LYS 15 0.882 0.516 4.580
126 1HD LYS 15 2HD LYS 15 1.259 -1.282 6.276
127 2HD LYS 15 1HD LYS 15 2.933 -1.375 5.724
128 1HE LYS 15 2HE LYS 15 1.598 1.100 6.817
129 2HE LYS 15 1HE LYS 15 2.662 0.034 7.735
130 1HZ LYS 15 1HZ LYS 15 4.428 0.529 6.114
131 2HZ LYS 15 2HZ LYS 15 3.899 1.911 6.940
132 3HZ LYS 15 3HZ LYS 15 3.400 1.640 5.344
133 H TYR 16 H TYR 16 2.841 -4.075 3.305
134 HA TYR 16 HA TYR 16 1.718 -5.529 1.061
135 1HB TYR 16 2HB TYR 16 3.587 -6.241 3.307
136 2HB TYR 16 1HB TYR 16 2.851 -7.494 2.313
137 HD1 TYR 16 1HD TYR 16 5.634 -5.387 2.655
138 HD2 TYR 16 2HD TYR 16 3.099 -7.104 -0.300
139 HE1 TYR 16 1HE TYR 16 7.397 -5.079 0.970
140 HE2 TYR 16 2HE TYR 16 4.864 -6.808 -1.991
141 HH TYR 16 HH TYR 16 6.865 -5.924 -2.439
142 H MET 17 H MET 17 -0.339 -6.092 1.157
143 HA MET 17 HA MET 17 -1.640 -6.547 3.710
144 1HB MET 17 2HB MET 17 -2.639 -6.525 0.879
145 2HB MET 17 1HB MET 17 -3.662 -6.956 2.234
146 1HG MET 17 2HG MET 17 -2.259 -4.330 1.825
147 2HG MET 17 1HG MET 17 -3.978 -4.640 1.615
148 1HE MET 17 1HE MET 17 -1.270 -3.504 3.475
149 2HE MET 17 2HE MET 17 -2.417 -2.362 4.176
150 3HE MET 17 3HE MET 17 -1.621 -3.558 5.202
151 H LYS 18 H LYS 18 -2.244 -8.472 4.516
152 HA LYS 18 HA LYS 18 -0.736 -10.696 3.559
153 1HB LYS 18 2HB LYS 18 -2.750 -10.640 5.809
154 2HB LYS 18 1HB LYS 18 -1.486 -11.837 5.559
155 1HG LYS 18 2HG LYS 18 -0.268 -9.273 5.642
156 2HG LYS 18 1HG LYS 18 -1.360 -9.415 7.020
157 1HD LYS 18 2HD LYS 18 0.541 -10.340 7.905
158 2HD LYS 18 1HD LYS 18 -0.235 -11.782 7.249
159 1HE LYS 18 2HE LYS 18 1.144 -11.640 5.252
160 2HE LYS 18 1HE LYS 18 1.877 -10.149 5.843
161 1HZ LYS 18 1HZ LYS 18 3.430 -11.510 6.650
162 2HZ LYS 18 2HZ LYS 18 2.447 -12.889 6.545
163 3HZ LYS 18 3HZ LYS 18 2.314 -11.854 7.881
164 H SER 19 H SER 19 -3.797 -9.640 2.731
165 HA SER 19 HA SER 19 -4.355 -12.205 1.476
166 1HB SER 19 2HB SER 19 -6.540 -10.792 3.009
167 2HB SER 19 1HB SER 19 -6.587 -12.401 2.286
168 HG SER 19 HG SER 19 -4.591 -12.538 3.899
169 H ARG 20 H ARG 20 -5.578 -12.065 -0.397
170 HA ARG 20 HA ARG 20 -5.395 -9.639 -1.832
171 1HB ARG 20 2HB ARG 20 -5.606 -12.171 -2.600
172 2HB ARG 20 1HB ARG 20 -7.313 -11.755 -2.686
173 1HG ARG 20 2HG ARG 20 -6.485 -9.722 -4.065
174 2HG ARG 20 1HG ARG 20 -5.025 -10.690 -4.276
175 1HD ARG 20 2HD ARG 20 -6.747 -10.932 -6.089
176 2HD ARG 20 1HD ARG 20 -6.230 -12.438 -5.331
177 HE ARG 20 HE ARG 20 -8.328 -12.643 -4.319
178 1HH1 ARG 20 2HH1 ARG 20 -8.100 -9.740 -6.280
179 2HH1 ARG 20 1HH1 ARG 20 -9.821 -9.477 -6.306
180 1HH2 ARG 20 2HH2 ARG 20 -10.578 -12.258 -4.296
181 2HH2 ARG 20 1HH2 ARG 20 -11.224 -10.876 -5.138
182 H THR 21 H THR 21 -8.047 -11.244 -0.167
183 HA THR 21 HA THR 21 -10.166 -9.598 -0.929
184 HB THR 21 HB THR 21 -10.692 -10.294 1.696
185 HG1 THR 21 1HG THR 21 -9.540 -12.040 2.184
186 1HG2 THR 21 1HG2 THR 21 -12.046 -10.687 -0.390
187 2HG2 THR 21 2HG2 THR 21 -12.049 -12.027 0.759
188 3HG2 THR 21 3HG2 THR 21 -11.041 -12.107 -0.687
189 H ILE 22 H ILE 22 -7.739 -9.265 1.598
190 HA ILE 22 HA ILE 22 -8.874 -6.941 2.793
191 HB ILE 22 HB ILE 22 -6.205 -8.307 3.002
192 1HG1 ILE 22 2HG1 ILE 22 -8.165 -7.672 5.199
193 1HG2 ILE 22 1HG2 ILE 22 -5.345 -6.250 3.373
194 2HG2 ILE 22 2HG2 ILE 22 -6.906 -5.559 3.825
195 3HG2 ILE 22 3HG2 ILE 22 -6.005 -6.536 4.985
196 1HD1 ILE 22 1HD1 ILE 22 -6.814 -8.858 6.479
197 2HD1 ILE 22 2HD1 ILE 22 -6.960 -10.235 5.387
198 3HD1 ILE 22 3HD1 ILE 22 -5.698 -9.033 5.121
199 H LEU 23 H LEU 23 -6.229 -7.530 0.495
200 HA LEU 23 HA LEU 23 -5.391 -4.875 0.173
201 1HB LEU 23 2HB LEU 23 -4.455 -7.203 -0.678
202 2HB LEU 23 1HB LEU 23 -5.328 -6.765 -2.129
203 HG LEU 23 HG LEU 23 -2.721 -6.001 -1.365
204 1HD1 LEU 23 1HD1 LEU 23 -4.545 -5.336 -3.644
205 2HD1 LEU 23 2HD1 LEU 23 -2.882 -4.757 -3.566
206 3HD1 LEU 23 3HD1 LEU 23 -3.213 -6.489 -3.593
207 1HD2 LEU 23 1HD2 LEU 23 -3.733 -4.132 -0.118
208 2HD2 LEU 23 2HD2 LEU 23 -2.776 -3.590 -1.497
209 3HD2 LEU 23 3HD2 LEU 23 -4.538 -3.603 -1.596
210 H GLN 24 H GLN 24 -7.929 -6.721 -1.439
211 HA GLN 24 HA GLN 24 -8.549 -4.896 -3.474
212 1HB GLN 24 2HB GLN 24 -9.981 -7.124 -2.122
213 2HB GLN 24 1HB GLN 24 -10.939 -6.007 -3.083
214 1HG GLN 24 2HG GLN 24 -8.531 -7.495 -4.100
215 2HG GLN 24 1HG GLN 24 -10.200 -8.021 -4.310
216 1HE2 GLN 24 1HE2 GLN 24 -7.756 -6.638 -5.889
217 2HE2 GLN 24 2HE2 GLN 24 -8.624 -5.631 -6.995
218 H GLN 25 H GLN 25 -9.783 -5.168 -0.166
219 HA GLN 25 HA GLN 25 -11.545 -2.916 -0.413
220 1HB GLN 25 2HB GLN 25 -10.489 -4.448 1.966
221 2HB GLN 25 1HB GLN 25 -11.590 -3.086 2.120
222 1HG GLN 25 2HG GLN 25 -13.342 -4.237 1.083
223 2HG GLN 25 1HG GLN 25 -12.259 -5.467 0.426
224 1HE2 GLN 25 1HE2 GLN 25 -11.426 -7.060 1.829
225 2HE2 GLN 25 2HE2 GLN 25 -12.193 -7.416 3.340
226 H HIS 26 H HIS 26 -8.313 -3.512 0.817
227 HA HIS 26 HA HIS 26 -7.826 -1.085 2.064
228 1HB HIS 26 2HB HIS 26 -6.332 -2.972 2.371
229 2HB HIS 26 1HB HIS 26 -5.893 -2.952 0.664
230 HD1 HIS 26 1HD HIS 26 -4.986 -1.465 3.926
231 HD2 HIS 26 2HD HIS 26 -4.353 -0.646 -0.111
232 HE1 HIS 26 1HE HIS 26 -3.192 0.339 3.814
233 H MET 27 H MET 27 -6.826 -2.024 -1.243
234 HA MET 27 HA MET 27 -5.675 0.437 -1.869
235 1HB MET 27 2HB MET 27 -6.600 -1.903 -3.441
236 2HB MET 27 1HB MET 27 -6.328 -0.408 -4.325
237 1HG MET 27 2HG MET 27 -4.095 -0.645 -2.716
238 2HG MET 27 1HG MET 27 -4.425 -2.296 -3.235
239 1HE MET 27 1HE MET 27 -2.012 -2.329 -5.633
240 2HE MET 27 2HE MET 27 -3.186 -3.137 -4.591
241 3HE MET 27 3HE MET 27 -3.536 -2.912 -6.304
242 H LYS 28 H LYS 28 -8.980 -0.534 -1.881
243 HA LYS 28 HA LYS 28 -9.946 1.556 -3.575
244 1HB LYS 28 2HB LYS 28 -11.091 -0.600 -1.941
245 2HB LYS 28 1HB LYS 28 -12.088 0.845 -2.035
246 1HG LYS 28 2HG LYS 28 -12.685 -0.758 -3.767
247 2HG LYS 28 1HG LYS 28 -12.057 0.736 -4.465
248 1HD LYS 28 2HD LYS 28 -9.870 -1.035 -4.038
249 2HD LYS 28 1HD LYS 28 -11.150 -1.927 -4.866
250 1HE LYS 28 2HE LYS 28 -11.270 0.148 -6.405
251 2HE LYS 28 1HE LYS 28 -9.679 0.530 -5.746
252 1HZ LYS 28 1HZ LYS 28 -10.418 -1.997 -7.128
253 2HZ LYS 28 2HZ LYS 28 -8.885 -1.621 -6.507
254 3HZ LYS 28 3HZ LYS 28 -9.517 -0.728 -7.803
255 H LYS 29 H LYS 29 -9.179 1.269 -0.189
256 HA LYS 29 HA LYS 29 -10.483 3.796 0.414
257 1HB LYS 29 2HB LYS 29 -10.676 2.985 2.473
258 2HB LYS 29 1HB LYS 29 -9.937 1.496 1.908
259 1HG LYS 29 2HG LYS 29 -7.852 3.336 2.428
260 2HG LYS 29 1HG LYS 29 -8.960 3.365 3.801
261 1HD LYS 29 2HD LYS 29 -8.737 0.682 3.196
262 2HD LYS 29 1HD LYS 29 -7.106 1.300 2.949
263 1HE LYS 29 2HE LYS 29 -8.081 0.506 5.339
264 2HE LYS 29 1HE LYS 29 -6.777 1.675 5.137
265 1HZ LYS 29 1HZ LYS 29 -8.573 3.426 5.159
266 2HZ LYS 29 2HZ LYS 29 -8.306 2.627 6.627
267 3HZ LYS 29 3HZ LYS 29 -9.645 2.214 5.674
268 H CYS 30 H CYS 30 -7.296 2.460 -0.044
269 HA CYS 30 HA CYS 30 -5.842 4.707 0.905
270 1HB CYS 30 2HB CYS 30 -5.221 2.151 0.095
271 2HB CYS 30 1HB CYS 30 -4.551 3.134 -1.195
272 H GLY 31 H GLY 31 -7.486 3.996 -2.041
273 1HA GLY 31 1HA GLY 31 -6.137 5.832 -3.745
274 2HA GLY 31 2HA GLY 31 -7.762 5.192 -3.988
275 H TRP 32 H TRP 32 -8.378 6.232 -1.174
276 HA TRP 32 HA TRP 32 -9.237 8.865 -2.039
277 1HB TRP 32 2HB TRP 32 -9.768 7.344 0.523
278 2HB TRP 32 1HB TRP 32 -10.505 8.884 0.083
279 HD1 TRP 32 HD TRP 32 -11.507 5.501 0.210
280 HE1 TRP 32 1HE TRP 32 -13.249 4.886 -1.582
281 HE3 TRP 32 3HE TRP 32 -10.905 9.513 -2.900
282 HZ2 TRP 32 2HZ TRP 32 -14.238 5.979 -3.983
283 HZ3 TRP 32 3HZ TRP 32 -12.296 9.654 -4.927
284 HH2 TRP 32 HH TRP 32 -13.933 7.916 -5.456
285 H PHE 33 H PHE 33 -6.657 7.476 -0.383
286 HA PHE 33 HA PHE 33 -4.894 8.248 0.813
287 1HB PHE 33 2HB PHE 33 -5.653 10.452 -1.019
288 2HB PHE 33 1HB PHE 33 -4.526 10.860 0.277
289 HD1 PHE 33 1HD PHE 33 -5.023 8.926 -2.781
290 HD2 PHE 33 2HD PHE 33 -2.307 9.908 0.342
291 HE1 PHE 33 1HE PHE 33 -3.173 7.971 -4.097
292 HE2 PHE 33 2HE PHE 33 -0.453 8.958 -0.965
293 HZ PHE 33 HZ PHE 33 -0.884 7.985 -3.186
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