Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
8653 | 1mm3 RC | 5556 | 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 -19.670 3.913 4.181
2 2H GLY 1 2H GLY 1 -18.453 2.744 4.334
3 3H GLY 1 3H GLY 1 -18.050 4.392 4.312
4 1HA GLY 1 2HA GLY 1 -19.846 3.345 6.395
5 2HA GLY 1 1HA GLY 1 -18.105 3.155 6.553
6 HA PRO 2 HA PRO 2 -19.053 7.156 8.558
7 1HB PRO 2 2HB PRO 2 -16.466 6.595 9.867
8 2HB PRO 2 1HB PRO 2 -18.031 6.976 10.589
9 1HG PRO 2 2HG PRO 2 -17.011 4.509 10.711
10 2HG PRO 2 1HG PRO 2 -18.753 4.781 10.509
11 1HD PRO 2 2HD PRO 2 -16.696 4.028 8.461
12 2HD PRO 2 1HD PRO 2 -18.353 3.420 8.667
13 H LEU 3 H LEU 3 -15.552 6.593 8.336
14 HA LEU 3 HA LEU 3 -15.228 9.183 7.075
15 1HB LEU 3 2HB LEU 3 -13.219 7.100 7.935
16 2HB LEU 3 1HB LEU 3 -12.798 8.662 7.258
17 HG LEU 3 HG LEU 3 -14.527 9.193 9.419
18 1HD1 LEU 3 1HD1 LEU 3 -13.112 8.149 11.251
19 2HD1 LEU 3 2HD1 LEU 3 -14.231 7.079 10.404
20 3HD1 LEU 3 3HD1 LEU 3 -12.511 7.048 10.011
21 1HD2 LEU 3 1HD2 LEU 3 -12.481 10.417 8.454
22 2HD2 LEU 3 2HD2 LEU 3 -12.756 10.490 10.194
23 3HD2 LEU 3 3HD2 LEU 3 -11.541 9.394 9.539
24 H GLY 4 H GLY 4 -16.471 8.437 5.179
25 1HA GLY 4 1HA GLY 4 -16.440 7.983 2.912
26 2HA GLY 4 2HA GLY 4 -14.711 7.678 3.033
27 H SER 5 H SER 5 -14.488 5.729 2.070
28 HA SER 5 HA SER 5 -16.255 3.550 2.917
29 1HB SER 5 2HB SER 5 -14.475 2.519 1.042
30 2HB SER 5 1HB SER 5 -16.125 3.061 0.719
31 HG SER 5 HG SER 5 -14.782 4.158 -0.670
32 H ASP 6 H ASP 6 -13.370 4.966 3.711
33 HA ASP 6 HA ASP 6 -11.671 4.440 5.121
34 1HB ASP 6 2HB ASP 6 -13.112 3.234 6.599
35 2HB ASP 6 1HB ASP 6 -13.210 1.867 5.491
36 H HIS 7 H HIS 7 -12.520 1.511 3.288
37 HA HIS 7 HA HIS 7 -9.738 1.025 2.662
38 1HB HIS 7 2HB HIS 7 -11.758 -0.687 3.014
39 2HB HIS 7 1HB HIS 7 -11.896 -0.473 1.270
40 HD2 HIS 7 2HD HIS 7 -9.113 -0.737 0.082
41 HE1 HIS 7 1HE HIS 7 -8.373 -3.893 2.809
42 HE2 HIS 7 2HE HIS 7 -7.453 -2.598 0.831
43 H HIS 8 H HIS 8 -9.809 3.291 1.730
44 HA HIS 8 HA HIS 8 -9.479 3.107 -1.056
45 1HB HIS 8 2HB HIS 8 -11.881 3.194 -1.231
46 2HB HIS 8 1HB HIS 8 -11.967 4.544 -0.103
47 HD2 HIS 8 2HD HIS 8 -10.646 3.906 -3.757
48 HE1 HIS 8 1HE HIS 8 -11.632 7.988 -3.264
49 HE2 HIS 8 2HE HIS 8 -10.633 6.266 -4.836
50 H MET 9 H MET 9 -7.600 4.164 -0.937
51 HA MET 9 HA MET 9 -7.627 6.958 -0.219
52 1HB MET 9 2HB MET 9 -5.808 6.737 1.455
53 2HB MET 9 1HB MET 9 -7.326 6.025 1.982
54 1HG MET 9 2HG MET 9 -5.853 3.990 0.696
55 2HG MET 9 1HG MET 9 -4.753 4.831 1.786
56 1HE MET 9 1HE MET 9 -8.182 2.235 2.202
57 2HE MET 9 2HE MET 9 -6.785 2.252 1.126
58 3HE MET 9 3HE MET 9 -6.711 1.375 2.655
59 H GLU 10 H GLU 10 -6.128 8.089 -1.234
60 HA GLU 10 HA GLU 10 -4.386 6.687 -3.098
61 1HB GLU 10 2HB GLU 10 -3.979 8.977 -4.005
62 2HB GLU 10 1HB GLU 10 -5.675 8.513 -4.017
63 1HG GLU 10 2HG GLU 10 -4.633 10.035 -1.686
64 2HG GLU 10 1HG GLU 10 -4.896 10.887 -3.207
65 H PHE 11 H PHE 11 -3.885 6.689 -0.215
66 HA PHE 11 HA PHE 11 -1.115 7.510 -0.300
67 1HB PHE 11 2HB PHE 11 -1.201 8.819 1.745
68 2HB PHE 11 1HB PHE 11 -2.281 9.519 0.549
69 HD1 PHE 11 1HD PHE 11 -1.997 7.995 3.807
70 HD2 PHE 11 2HD PHE 11 -4.729 9.267 0.803
71 HE1 PHE 11 1HE PHE 11 -3.823 7.942 5.453
72 HE2 PHE 11 2HE PHE 11 -6.561 9.213 2.442
73 HZ PHE 11 HZ PHE 11 -6.110 8.554 4.772
74 H CYS 12 H CYS 12 -0.079 6.896 1.908
75 HA CYS 12 HA CYS 12 -0.443 4.116 2.154
76 1HB CYS 12 2HB CYS 12 1.327 6.149 3.384
77 2HB CYS 12 1HB CYS 12 1.151 4.618 4.235
78 HG CYS 12 HG CYS 12 3.303 5.176 2.057
79 H ARG 13 H ARG 13 -1.561 2.907 3.483
80 HA ARG 13 HA ARG 13 -3.616 3.846 5.107
81 1HB ARG 13 2HB ARG 13 -2.190 1.241 4.799
82 2HB ARG 13 1HB ARG 13 -3.254 1.441 6.185
83 1HG ARG 13 2HG ARG 13 -4.914 2.287 4.291
84 2HG ARG 13 1HG ARG 13 -3.894 1.235 3.305
85 1HD ARG 13 2HD ARG 13 -5.305 -0.377 3.996
86 2HD ARG 13 1HD ARG 13 -4.320 -0.350 5.459
87 HE ARG 13 HE ARG 13 -6.056 1.350 6.255
88 1HH1 ARG 13 2HH1 ARG 13 -6.758 -1.367 4.139
89 2HH1 ARG 13 1HH1 ARG 13 -8.421 -1.458 4.612
90 1HH2 ARG 13 2HH2 ARG 13 -8.242 1.216 6.868
91 2HH2 ARG 13 1HH2 ARG 13 -9.277 0.033 6.130
92 H VAL 14 H VAL 14 -0.336 2.860 5.953
93 HA VAL 14 HA VAL 14 -0.820 3.399 8.772
94 HB VAL 14 HB VAL 14 1.839 2.497 7.785
95 1HG1 VAL 14 1HG1 VAL 14 1.567 0.980 9.779
96 2HG1 VAL 14 2HG1 VAL 14 1.614 2.708 10.124
97 3HG1 VAL 14 3HG1 VAL 14 0.073 1.850 10.128
98 1HG2 VAL 14 1HG2 VAL 14 0.972 0.124 7.728
99 2HG2 VAL 14 2HG2 VAL 14 -0.652 0.805 7.652
100 3HG2 VAL 14 3HG2 VAL 14 0.505 1.135 6.359
101 H CYS 15 H CYS 15 1.634 4.169 6.377
102 HA CYS 15 HA CYS 15 2.786 6.232 8.004
103 1HB CYS 15 2HB CYS 15 4.198 5.938 5.628
104 2HB CYS 15 1HB CYS 15 4.534 5.137 7.168
105 H LYS 16 H LYS 16 0.198 6.646 6.621
106 HA LYS 16 HA LYS 16 -0.858 8.239 5.267
107 1HB LYS 16 2HB LYS 16 0.760 9.882 7.213
108 2HB LYS 16 1HB LYS 16 -0.775 10.330 6.482
109 1HG LYS 16 2HG LYS 16 -0.939 7.794 7.869
110 2HG LYS 16 1HG LYS 16 -0.408 9.100 8.928
111 1HD LYS 16 2HD LYS 16 -2.398 10.377 7.726
112 2HD LYS 16 1HD LYS 16 -2.992 8.731 7.512
113 1HE LYS 16 2HE LYS 16 -2.028 9.113 10.193
114 2HE LYS 16 1HE LYS 16 -3.219 10.348 9.788
115 1HZ LYS 16 1HZ LYS 16 -3.952 8.054 10.742
116 2HZ LYS 16 2HZ LYS 16 -3.805 7.552 9.127
117 3HZ LYS 16 3HZ LYS 16 -4.866 8.809 9.529
118 H ASP 17 H ASP 17 0.690 7.683 3.398
119 HA ASP 17 HA ASP 17 2.731 9.587 2.789
120 1HB ASP 17 2HB ASP 17 1.652 7.162 1.602
121 2HB ASP 17 1HB ASP 17 2.034 8.373 0.384
122 H GLY 18 H GLY 18 2.461 10.291 0.167
123 1HA GLY 18 1HA GLY 18 -0.122 11.385 -0.402
124 2HA GLY 18 2HA GLY 18 0.993 12.614 0.193
125 H GLY 19 H GLY 19 3.350 11.462 -1.055
126 1HA GLY 19 1HA GLY 19 2.838 12.481 -3.755
127 2HA GLY 19 2HA GLY 19 4.412 12.284 -2.999
128 H GLU 20 H GLU 20 5.522 10.386 -3.236
129 HA GLU 20 HA GLU 20 4.819 8.718 -5.436
130 1HB GLU 20 2HB GLU 20 6.915 8.165 -3.327
131 2HB GLU 20 1HB GLU 20 6.843 7.495 -4.950
132 1HG GLU 20 2HG GLU 20 7.065 10.445 -4.560
133 2HG GLU 20 1HG GLU 20 8.491 9.418 -4.414
134 H LEU 21 H LEU 21 3.609 6.928 -5.464
135 HA LEU 21 HA LEU 21 3.179 5.467 -2.956
136 1HB LEU 21 2HB LEU 21 1.222 7.081 -4.418
137 2HB LEU 21 1HB LEU 21 0.680 5.445 -4.105
138 HG LEU 21 HG LEU 21 -0.114 6.380 -2.209
139 1HD1 LEU 21 1HD1 LEU 21 1.230 4.978 -1.038
140 2HD1 LEU 21 2HD1 LEU 21 2.716 5.674 -1.683
141 3HD1 LEU 21 3HD1 LEU 21 1.826 6.518 -0.415
142 1HD2 LEU 21 1HD2 LEU 21 1.649 8.552 -2.972
143 2HD2 LEU 21 2HD2 LEU 21 0.081 8.590 -2.164
144 3HD2 LEU 21 3HD2 LEU 21 1.551 8.340 -1.223
145 H LEU 22 H LEU 22 2.833 3.321 -3.162
146 HA LEU 22 HA LEU 22 2.681 2.204 -5.888
147 1HB LEU 22 2HB LEU 22 4.812 1.595 -5.116
148 2HB LEU 22 1HB LEU 22 4.246 1.339 -3.479
149 HG LEU 22 HG LEU 22 2.970 -0.678 -4.392
150 1HD1 LEU 22 1HD1 LEU 22 4.606 -1.405 -6.483
151 2HD1 LEU 22 2HD1 LEU 22 2.934 -0.861 -6.614
152 3HD1 LEU 22 3HD1 LEU 22 4.253 0.290 -6.813
153 1HD2 LEU 22 1HD2 LEU 22 5.463 -0.404 -3.332
154 2HD2 LEU 22 2HD2 LEU 22 4.658 -1.944 -3.640
155 3HD2 LEU 22 3HD2 LEU 22 5.800 -1.293 -4.819
156 H CYS 23 H CYS 23 0.747 1.360 -6.218
157 HA CYS 23 HA CYS 23 -0.819 0.478 -3.890
158 1HB CYS 23 2HB CYS 23 -2.173 1.073 -6.454
159 2HB CYS 23 1HB CYS 23 -2.644 1.485 -4.808
160 HG CYS 23 HG CYS 23 -0.904 3.272 -7.051
161 H CYS 24 H CYS 24 -2.483 -1.220 -4.304
162 HA CYS 24 HA CYS 24 -1.260 -3.485 -5.528
163 1HB CYS 24 2HB CYS 24 -3.976 -4.054 -5.012
164 2HB CYS 24 1HB CYS 24 -2.583 -4.472 -4.021
165 H ASP 25 H ASP 25 -3.061 -4.930 -6.786
166 HA ASP 25 HA ASP 25 -4.009 -3.285 -9.045
167 1HB ASP 25 2HB ASP 25 -2.129 -5.195 -9.298
168 2HB ASP 25 1HB ASP 25 -3.566 -6.202 -9.441
169 H THR 26 H THR 26 -5.179 -4.220 -6.431
170 HA THR 26 HA THR 26 -7.581 -5.535 -7.513
171 HB THR 26 HB THR 26 -7.651 -6.555 -5.097
172 HG1 THR 26 1HG THR 26 -5.927 -5.935 -4.011
173 1HG2 THR 26 1HG2 THR 26 -7.448 -7.909 -7.112
174 2HG2 THR 26 2HG2 THR 26 -6.341 -8.505 -5.874
175 3HG2 THR 26 3HG2 THR 26 -5.726 -7.534 -7.213
176 H CYS 27 H CYS 27 -6.330 -3.863 -4.632
177 HA CYS 27 HA CYS 27 -8.974 -2.644 -4.260
178 1HB CYS 27 2HB CYS 27 -7.303 -2.349 -1.969
179 2HB CYS 27 1HB CYS 27 -8.753 -3.335 -2.142
180 HA PRO 28 HA PRO 28 -7.084 1.310 -4.783
181 1HB PRO 28 2HB PRO 28 -8.936 2.862 -3.496
182 2HB PRO 28 1HB PRO 28 -9.193 2.108 -5.069
183 1HG PRO 28 2HG PRO 28 -10.439 1.486 -2.528
184 2HG PRO 28 1HG PRO 28 -10.845 0.884 -4.141
185 1HD PRO 28 2HD PRO 28 -9.304 -0.403 -2.019
186 2HD PRO 28 1HD PRO 28 -9.979 -1.109 -3.500
187 H SER 29 H SER 29 -5.528 0.229 -2.903
188 HA SER 29 HA SER 29 -5.257 2.407 -0.937
189 1HB SER 29 2HB SER 29 -4.119 -0.274 -0.307
190 2HB SER 29 1HB SER 29 -4.752 0.964 0.780
191 HG SER 29 HG SER 29 -5.974 -1.189 0.010
192 H SER 30 H SER 30 -3.126 3.091 -0.505
193 HA SER 30 HA SER 30 -1.135 2.148 -2.458
194 1HB SER 30 2HB SER 30 -1.292 4.995 -1.488
195 2HB SER 30 1HB SER 30 -0.494 4.364 -2.928
196 HG SER 30 HG SER 30 -2.815 3.715 -3.471
197 H TYR 31 H TYR 31 0.997 1.995 -1.779
198 HA TYR 31 HA TYR 31 1.550 2.625 1.037
199 1HB TYR 31 2HB TYR 31 2.127 -0.017 -0.325
200 2HB TYR 31 1HB TYR 31 2.687 0.430 1.280
201 HD1 TYR 31 1HD TYR 31 -0.159 -0.653 -0.721
202 HD2 TYR 31 2HD TYR 31 1.112 0.509 3.176
203 HE1 TYR 31 1HE TYR 31 -2.210 -1.608 0.225
204 HE2 TYR 31 2HE TYR 31 -0.947 -0.432 4.129
205 HH TYR 31 HH TYR 31 -3.412 -1.962 2.037
206 H HIS 32 H HIS 32 4.001 1.823 1.368
207 HA HIS 32 HA HIS 32 5.717 3.299 -0.507
208 1HB HIS 32 2HB HIS 32 6.142 1.974 2.189
209 2HB HIS 32 1HB HIS 32 7.506 2.372 1.168
210 HD2 HIS 32 2HD HIS 32 8.421 4.908 1.357
211 HE1 HIS 32 1HE HIS 32 5.526 6.183 4.175
212 HE2 HIS 32 2HE HIS 32 7.623 6.840 2.895
213 H ILE 33 H ILE 33 7.536 0.972 0.783
214 HA ILE 33 HA ILE 33 6.631 -1.237 -0.903
215 HB ILE 33 HB ILE 33 8.949 -1.854 -1.439
216 1HG1 ILE 33 2HG1 ILE 33 9.713 0.840 -0.287
217 1HG2 ILE 33 1HG2 ILE 33 7.780 -0.632 -3.110
218 2HG2 ILE 33 2HG2 ILE 33 8.066 0.897 -2.276
219 3HG2 ILE 33 3HG2 ILE 33 9.411 0.037 -3.029
220 1HD1 ILE 33 1HD1 ILE 33 11.689 0.618 -1.238
221 2HD1 ILE 33 2HD1 ILE 33 11.866 -1.015 -0.596
222 3HD1 ILE 33 3HD1 ILE 33 11.055 -0.759 -2.141
223 H HIS 34 H HIS 34 6.946 -0.235 2.135
224 HA HIS 34 HA HIS 34 7.555 -2.876 3.179
225 1HB HIS 34 2HB HIS 34 9.294 -2.011 4.731
226 2HB HIS 34 1HB HIS 34 9.774 -1.932 3.041
227 HD2 HIS 34 2HD HIS 34 9.509 0.748 1.927
228 HE1 HIS 34 1HE HIS 34 10.051 2.504 5.738
229 HE2 HIS 34 2HE HIS 34 10.207 2.881 3.234
230 H CYS 35 H CYS 35 5.297 -0.832 3.184
231 HA CYS 35 HA CYS 35 5.030 0.042 5.885
232 1HB CYS 35 2HB CYS 35 2.668 -0.284 4.096
233 2HB CYS 35 1HB CYS 35 3.108 1.064 5.149
234 H LEU 36 H LEU 36 4.401 -2.864 4.229
235 HA LEU 36 HA LEU 36 2.572 -3.847 6.289
236 1HB LEU 36 2HB LEU 36 2.887 -5.865 4.433
237 2HB LEU 36 1HB LEU 36 1.562 -4.718 4.495
238 HG LEU 36 HG LEU 36 3.954 -3.775 3.051
239 1HD1 LEU 36 1HD1 LEU 36 2.419 -5.414 1.260
240 2HD1 LEU 36 2HD1 LEU 36 4.159 -5.398 1.550
241 3HD1 LEU 36 3HD1 LEU 36 3.106 -6.395 2.555
242 1HD2 LEU 36 1HD2 LEU 36 2.158 -3.103 1.437
243 2HD2 LEU 36 2HD2 LEU 36 0.983 -3.783 2.559
244 3HD2 LEU 36 3HD2 LEU 36 1.991 -2.424 3.055
245 H ARG 37 H ARG 37 2.966 -6.281 6.812
246 HA ARG 37 HA ARG 37 5.456 -6.513 8.092
247 1HB ARG 37 2HB ARG 37 3.131 -7.776 8.427
248 2HB ARG 37 1HB ARG 37 3.959 -9.000 7.473
249 1HG ARG 37 2HG ARG 37 5.113 -9.666 9.239
250 2HG ARG 37 1HG ARG 37 5.702 -8.028 9.526
251 1HD ARG 37 2HD ARG 37 4.043 -7.547 11.032
252 2HD ARG 37 1HD ARG 37 2.910 -8.691 10.311
253 HE ARG 37 HE ARG 37 4.960 -9.257 12.297
254 1HH1 ARG 37 2HH1 ARG 37 2.522 -10.486 10.102
255 2HH1 ARG 37 1HH1 ARG 37 2.518 -12.081 10.795
256 1HH2 ARG 37 2HH2 ARG 37 4.929 -11.343 13.240
257 2HH2 ARG 37 1HH2 ARG 37 3.873 -12.563 12.587
258 HA PRO 38 HA PRO 38 6.866 -9.385 4.470
259 1HB PRO 38 2HB PRO 38 5.023 -8.929 2.256
260 2HB PRO 38 1HB PRO 38 5.504 -10.456 2.997
261 1HG PRO 38 2HG PRO 38 3.003 -9.437 3.241
262 2HG PRO 38 1HG PRO 38 3.765 -10.434 4.497
263 1HD PRO 38 2HD PRO 38 3.473 -7.450 4.359
264 2HD PRO 38 1HD PRO 38 3.252 -8.543 5.744
265 H ALA 39 H ALA 39 7.888 -7.185 4.957
266 HA ALA 39 HA ALA 39 7.528 -5.082 3.072
267 1HB ALA 39 1HB ALA 39 8.030 -4.405 5.249
268 2HB ALA 39 2HB ALA 39 9.384 -5.526 5.385
269 3HB ALA 39 3HB ALA 39 9.515 -4.106 4.347
270 H LEU 40 H LEU 40 8.982 -4.235 1.605
271 HA LEU 40 HA LEU 40 11.185 -6.017 0.790
272 1HB LEU 40 2HB LEU 40 9.474 -4.205 -0.927
273 2HB LEU 40 1HB LEU 40 10.887 -5.069 -1.495
274 HG LEU 40 HG LEU 40 9.410 -7.124 -0.503
275 1HD1 LEU 40 1HD1 LEU 40 7.310 -6.475 -0.148
276 2HD1 LEU 40 2HD1 LEU 40 7.602 -4.891 -0.866
277 3HD1 LEU 40 3HD1 LEU 40 7.172 -6.259 -1.892
278 1HD2 LEU 40 1HD2 LEU 40 8.621 -6.528 -3.217
279 2HD2 LEU 40 2HD2 LEU 40 10.341 -6.230 -2.964
280 3HD2 LEU 40 3HD2 LEU 40 9.657 -7.816 -2.600
281 H TYR 41 H TYR 41 13.103 -4.969 0.090
282 HA TYR 41 HA TYR 41 13.287 -2.142 0.916
283 1HB TYR 41 2HB TYR 41 15.209 -4.407 1.101
284 2HB TYR 41 1HB TYR 41 15.877 -2.823 0.726
285 HD1 TYR 41 1HD TYR 41 12.883 -2.963 2.783
286 HD2 TYR 41 2HD TYR 41 17.136 -2.922 2.855
287 HE1 TYR 41 1HE TYR 41 12.830 -2.381 5.174
288 HE2 TYR 41 2HE TYR 41 17.094 -2.339 5.242
289 HH TYR 41 HH TYR 41 15.765 -1.560 6.929
290 H GLU 42 H GLU 42 13.043 -4.199 -1.609
291 HA GLU 42 HA GLU 42 14.449 -2.439 -3.490
292 1HB GLU 42 2HB GLU 42 14.163 -4.329 -5.091
293 2HB GLU 42 1HB GLU 42 15.126 -4.753 -3.683
294 1HG GLU 42 2HG GLU 42 12.229 -5.302 -3.513
295 2HG GLU 42 1HG GLU 42 13.163 -6.294 -4.632
296 H VAL 43 H VAL 43 13.304 -1.717 -5.356
297 HA VAL 43 HA VAL 43 10.458 -1.352 -4.874
298 HB VAL 43 HB VAL 43 11.100 -0.246 -7.379
299 1HG1 VAL 43 1HG1 VAL 43 9.771 0.480 -5.135
300 2HG1 VAL 43 2HG1 VAL 43 11.167 1.558 -5.068
301 3HG1 VAL 43 3HG1 VAL 43 10.117 1.562 -6.486
302 1HG2 VAL 43 1HG2 VAL 43 13.495 -0.549 -6.634
303 2HG2 VAL 43 2HG2 VAL 43 13.018 1.093 -7.064
304 3HG2 VAL 43 3HG2 VAL 43 13.155 0.632 -5.368
305 HA PRO 44 HA PRO 44 9.667 -4.906 -7.469
306 1HB PRO 44 2HB PRO 44 6.958 -4.829 -7.245
307 2HB PRO 44 1HB PRO 44 8.009 -5.470 -5.979
308 1HG PRO 44 2HG PRO 44 6.692 -2.798 -6.179
309 2HG PRO 44 1HG PRO 44 6.893 -3.847 -4.764
310 1HD PRO 44 2HD PRO 44 8.468 -1.683 -5.246
311 2HD PRO 44 1HD PRO 44 9.035 -3.121 -4.375
312 H ASP 45 H ASP 45 10.294 -4.135 -9.455
313 HA ASP 45 HA ASP 45 8.949 -2.034 -10.794
314 1HB ASP 45 2HB ASP 45 10.604 -2.189 -12.385
315 2HB ASP 45 1HB ASP 45 11.404 -2.967 -11.025
316 H GLY 46 H GLY 46 8.341 -5.396 -10.596
317 1HA GLY 46 1HA GLY 46 6.738 -5.374 -13.047
318 2HA GLY 46 2HA GLY 46 7.165 -6.795 -12.105
319 H GLU 47 H GLU 47 5.897 -7.423 -10.405
320 HA GLU 47 HA GLU 47 3.336 -5.985 -10.163
321 1HB GLU 47 2HB GLU 47 4.030 -8.876 -10.256
322 2HB GLU 47 1HB GLU 47 2.709 -8.401 -9.196
323 1HG GLU 47 2HG GLU 47 1.571 -8.849 -11.117
324 2HG GLU 47 1HG GLU 47 1.871 -7.123 -11.321
325 H TRP 48 H TRP 48 2.235 -6.316 -8.057
326 HA TRP 48 HA TRP 48 3.656 -7.047 -5.728
327 1HB TRP 48 2HB TRP 48 4.907 -4.978 -6.136
328 2HB TRP 48 1HB TRP 48 3.405 -4.070 -6.254
329 HD1 TRP 48 HD TRP 48 5.716 -5.714 -3.690
330 HE1 TRP 48 1HE TRP 48 5.091 -4.853 -1.348
331 HE3 TRP 48 3HE TRP 48 1.474 -3.120 -4.883
332 HZ2 TRP 48 2HZ TRP 48 3.075 -3.277 -0.169
333 HZ3 TRP 48 3HZ TRP 48 0.249 -1.973 -3.084
334 HH2 TRP 48 HH TRP 48 1.041 -2.047 -0.774
335 H GLN 49 H GLN 49 2.234 -7.295 -4.048
336 HA GLN 49 HA GLN 49 -0.327 -5.910 -4.203
337 1HB GLN 49 2HB GLN 49 -0.120 -8.536 -5.025
338 2HB GLN 49 1HB GLN 49 -0.672 -8.679 -3.361
339 1HG GLN 49 2HG GLN 49 -2.318 -6.740 -4.242
340 2HG GLN 49 1HG GLN 49 -2.059 -7.638 -5.736
341 1HE2 GLN 49 1HE2 GLN 49 -3.450 -7.669 -2.576
342 2HE2 GLN 49 2HE2 GLN 49 -4.317 -9.162 -2.750
343 H CYS 50 H CYS 50 -1.589 -6.118 -2.246
344 HA CYS 50 HA CYS 50 -0.066 -5.468 0.046
345 1HB CYS 50 2HB CYS 50 -2.611 -5.771 0.929
346 2HB CYS 50 1HB CYS 50 -2.074 -4.358 0.013
347 HA PRO 51 HA PRO 51 -0.066 -9.423 2.225
348 1HB PRO 51 2HB PRO 51 -0.685 -8.675 4.754
349 2HB PRO 51 1HB PRO 51 0.913 -8.412 4.050
350 1HG PRO 51 2HG PRO 51 -1.339 -6.488 4.413
351 2HG PRO 51 1HG PRO 51 0.403 -6.228 4.607
352 1HD PRO 51 2HD PRO 51 -1.012 -5.452 2.398
353 2HD PRO 51 1HD PRO 51 0.718 -5.845 2.372
354 H ARG 52 H ARG 52 -2.610 -7.193 3.090
355 HA ARG 52 HA ARG 52 -4.682 -8.774 2.037
356 1HB ARG 52 2HB ARG 52 -3.998 -9.414 4.706
357 2HB ARG 52 1HB ARG 52 -5.466 -8.453 4.799
358 1HG ARG 52 2HG ARG 52 -6.561 -10.344 4.431
359 2HG ARG 52 1HG ARG 52 -5.999 -10.228 2.762
360 1HD ARG 52 2HD ARG 52 -3.989 -11.358 4.525
361 2HD ARG 52 1HD ARG 52 -5.486 -12.288 4.540
362 HE ARG 52 HE ARG 52 -3.949 -11.658 2.100
363 1HH1 ARG 52 2HH1 ARG 52 -6.024 -13.764 3.979
364 2HH1 ARG 52 1HH1 ARG 52 -6.015 -15.040 2.798
365 1HH2 ARG 52 2HH2 ARG 52 -3.968 -13.310 0.517
366 2HH2 ARG 52 1HH2 ARG 52 -4.856 -14.774 0.816
367 H CYS 53 H CYS 53 -3.369 -6.092 2.257
368 HA CYS 53 HA CYS 53 -3.760 -3.890 2.508
369 1HB CYS 53 2HB CYS 53 -5.859 -5.047 0.988
370 2HB CYS 53 1HB CYS 53 -6.552 -3.768 1.985
371 H THR 54 H THR 54 -3.835 -5.300 4.882
372 HA THR 54 HA THR 54 -5.269 -3.478 6.565
373 HB THR 54 HB THR 54 -7.057 -5.121 5.900
374 HG1 THR 54 1HG THR 54 -7.782 -5.424 8.074
375 1HG2 THR 54 1HG2 THR 54 -6.940 -7.334 7.193
376 2HG2 THR 54 2HG2 THR 54 -5.205 -7.034 7.285
377 3HG2 THR 54 3HG2 THR 54 -5.989 -7.194 5.714
378 H CYS 55 H CYS 55 -5.238 -5.156 8.900
379 HA CYS 55 HA CYS 55 -2.604 -4.843 9.780
380 1HB CYS 55 2HB CYS 55 -3.786 -6.923 11.295
381 2HB CYS 55 1HB CYS 55 -3.674 -5.214 11.708
382 HG CYS 55 HG CYS 55 -6.181 -4.669 11.519
383 HA PRO 56 HA PRO 56 -0.946 -8.306 7.554
384 1HB PRO 56 2HB PRO 56 1.660 -7.812 8.011
385 2HB PRO 56 1HB PRO 56 0.688 -6.821 6.918
386 1HG PRO 56 2HG PRO 56 1.498 -6.283 9.747
387 2HG PRO 56 1HG PRO 56 1.457 -5.176 8.363
388 1HD PRO 56 2HD PRO 56 -0.496 -5.289 10.272
389 2HD PRO 56 1HD PRO 56 -0.784 -4.767 8.601
390 H ALA 57 H ALA 57 -1.998 -9.063 10.017
391 HA ALA 57 HA ALA 57 0.131 -10.609 11.317
392 1HB ALA 57 1HB ALA 57 -2.725 -10.057 12.073
393 2HB ALA 57 2HB ALA 57 -1.735 -11.261 12.900
394 3HB ALA 57 3HB ALA 57 -1.256 -9.564 12.914
395 H LEU 58 H LEU 58 -2.381 -10.861 9.036
396 HA LEU 58 HA LEU 58 -2.652 -13.738 9.278
397 1HB LEU 58 2HB LEU 58 -3.775 -12.297 6.943
398 2HB LEU 58 1HB LEU 58 -4.478 -13.575 7.915
399 HG LEU 58 HG LEU 58 -4.163 -10.991 9.295
400 1HD1 LEU 58 1HD1 LEU 58 -6.302 -10.179 8.187
401 2HD1 LEU 58 2HD1 LEU 58 -4.812 -10.024 7.256
402 3HD1 LEU 58 3HD1 LEU 58 -5.942 -11.330 6.899
403 1HD2 LEU 58 1HD2 LEU 58 -6.368 -13.029 9.023
404 2HD2 LEU 58 2HD2 LEU 58 -5.268 -12.823 10.387
405 3HD2 LEU 58 3HD2 LEU 58 -6.466 -11.580 10.024
406 H LYS 59 H LYS 59 -2.572 -14.945 7.081
407 HA LYS 59 HA LYS 59 0.101 -14.538 6.020
408 1HB LYS 59 2HB LYS 59 -0.677 -16.814 6.613
409 2HB LYS 59 1HB LYS 59 -1.929 -16.693 5.384
410 1HG LYS 59 2HG LYS 59 0.111 -16.209 3.805
411 2HG LYS 59 1HG LYS 59 1.008 -17.042 5.077
412 1HD LYS 59 2HD LYS 59 -1.170 -18.670 4.714
413 2HD LYS 59 1HD LYS 59 -0.838 -18.100 3.076
414 1HE LYS 59 2HE LYS 59 1.629 -18.762 4.342
415 2HE LYS 59 1HE LYS 59 0.508 -20.105 4.547
416 1HZ LYS 59 1HZ LYS 59 1.054 -18.816 1.928
417 2HZ LYS 59 2HZ LYS 59 0.216 -20.265 2.215
418 3HZ LYS 59 3HZ LYS 59 1.886 -20.185 2.491
419 H GLY 60 H GLY 60 0.378 -13.168 4.404
420 1HA GLY 60 1HA GLY 60 -1.816 -12.601 2.562
421 2HA GLY 60 2HA GLY 60 -0.276 -11.753 2.643
422 H LYS 61 H LYS 61 1.299 -14.184 2.643
423 HA LYS 61 HA LYS 61 0.756 -15.247 -0.035
424 1HB LYS 61 2HB LYS 61 2.973 -13.555 0.749
425 2HB LYS 61 1HB LYS 61 3.550 -15.117 0.185
426 1HG LYS 61 2HG LYS 61 1.624 -14.387 -1.670
427 2HG LYS 61 1HG LYS 61 2.486 -12.889 -1.309
428 1HD LYS 61 2HD LYS 61 3.666 -13.870 -3.092
429 2HD LYS 61 1HD LYS 61 4.626 -14.219 -1.651
430 1HE LYS 61 2HE LYS 61 3.365 -16.436 -1.557
431 2HE LYS 61 1HE LYS 61 2.828 -16.064 -3.196
432 1HZ LYS 61 1HZ LYS 61 5.185 -17.277 -2.461
433 2HZ LYS 61 2HZ LYS 61 5.635 -15.713 -2.938
434 3HZ LYS 61 3HZ LYS 61 4.769 -16.709 -4.005
Start of MODEL 2
1 1H GLY 1 1H GLY 1 -19.202 0.315 3.542
2 2H GLY 1 2H GLY 1 -20.093 1.747 3.719
3 3H GLY 1 3H GLY 1 -20.710 0.475 2.783
4 1HA GLY 1 2HA GLY 1 -21.869 0.429 4.827
5 2HA GLY 1 1HA GLY 1 -20.754 -0.929 4.811
6 HA PRO 2 HA PRO 2 -20.101 0.936 8.927
7 1HB PRO 2 2HB PRO 2 -18.638 -1.617 9.276
8 2HB PRO 2 1HB PRO 2 -19.890 -0.891 10.288
9 1HG PRO 2 2HG PRO 2 -20.428 -3.005 8.750
10 2HG PRO 2 1HG PRO 2 -21.614 -1.703 8.969
11 1HD PRO 2 2HD PRO 2 -19.804 -2.248 6.653
12 2HD PRO 2 1HD PRO 2 -21.496 -1.710 6.657
13 H LEU 3 H LEU 3 -17.525 -1.158 7.621
14 HA LEU 3 HA LEU 3 -15.679 1.122 7.845
15 1HB LEU 3 2HB LEU 3 -15.403 -1.664 8.829
16 2HB LEU 3 1HB LEU 3 -13.982 -0.937 8.105
17 HG LEU 3 HG LEU 3 -15.511 0.314 10.384
18 1HD1 LEU 3 1HD1 LEU 3 -13.346 -0.473 11.616
19 2HD1 LEU 3 2HD1 LEU 3 -14.707 -1.578 11.411
20 3HD1 LEU 3 3HD1 LEU 3 -13.309 -1.694 10.345
21 1HD2 LEU 3 1HD2 LEU 3 -12.911 1.181 10.451
22 2HD2 LEU 3 2HD2 LEU 3 -13.249 1.102 8.721
23 3HD2 LEU 3 3HD2 LEU 3 -14.273 2.075 9.775
24 H GLY 4 H GLY 4 -13.932 1.105 6.311
25 1HA GLY 4 1HA GLY 4 -12.889 0.169 4.355
26 2HA GLY 4 2HA GLY 4 -14.401 -0.654 3.991
27 H SER 5 H SER 5 -15.303 2.305 5.021
28 HA SER 5 HA SER 5 -15.920 3.249 2.395
29 1HB SER 5 2HB SER 5 -16.107 5.259 4.490
30 2HB SER 5 1HB SER 5 -17.386 4.552 3.503
31 HG SER 5 HG SER 5 -17.896 3.800 5.445
32 H ASP 6 H ASP 6 -13.272 3.461 4.468
33 HA ASP 6 HA ASP 6 -12.083 5.608 2.840
34 1HB ASP 6 2HB ASP 6 -12.348 5.962 5.389
35 2HB ASP 6 1HB ASP 6 -11.062 4.770 5.546
36 H HIS 7 H HIS 7 -12.044 3.425 1.539
37 HA HIS 7 HA HIS 7 -9.773 1.749 2.278
38 1HB HIS 7 2HB HIS 7 -12.025 0.841 1.501
39 2HB HIS 7 1HB HIS 7 -11.609 1.431 -0.102
40 HD2 HIS 7 2HD HIS 7 -9.172 0.197 -1.143
41 HE1 HIS 7 1HE HIS 7 -9.935 -3.319 1.085
42 HE2 HIS 7 2HE HIS 7 -8.635 -2.326 -0.852
43 H HIS 8 H HIS 8 -10.883 3.782 -0.400
44 HA HIS 8 HA HIS 8 -8.375 3.518 -1.806
45 1HB HIS 8 2HB HIS 8 -9.346 4.875 -3.510
46 2HB HIS 8 1HB HIS 8 -10.605 3.781 -2.958
47 HD2 HIS 8 2HD HIS 8 -10.296 7.319 -3.890
48 HE1 HIS 8 1HE HIS 8 -13.351 7.224 -0.965
49 HE2 HIS 8 2HE HIS 8 -12.387 8.515 -2.920
50 H MET 9 H MET 9 -6.718 4.941 -1.858
51 HA MET 9 HA MET 9 -6.891 7.596 -0.843
52 1HB MET 9 2HB MET 9 -5.441 7.323 1.118
53 2HB MET 9 1HB MET 9 -6.941 6.429 1.304
54 1HG MET 9 2HG MET 9 -5.600 4.408 0.454
55 2HG MET 9 1HG MET 9 -4.182 5.391 0.816
56 1HE MET 9 1HE MET 9 -7.340 4.726 4.051
57 2HE MET 9 2HE MET 9 -7.580 5.369 2.425
58 3HE MET 9 3HE MET 9 -7.426 3.628 2.675
59 H GLU 10 H GLU 10 -5.176 8.818 -1.443
60 HA GLU 10 HA GLU 10 -3.307 7.642 -3.294
61 1HB GLU 10 2HB GLU 10 -3.186 10.472 -2.279
62 2HB GLU 10 1HB GLU 10 -2.696 9.846 -3.848
63 1HG GLU 10 2HG GLU 10 -4.634 10.752 -4.519
64 2HG GLU 10 1HG GLU 10 -5.316 9.247 -3.905
65 H PHE 11 H PHE 11 -3.382 8.323 0.021
66 HA PHE 11 HA PHE 11 -0.464 8.202 0.308
67 1HB PHE 11 2HB PHE 11 -0.922 8.610 2.726
68 2HB PHE 11 1HB PHE 11 -1.505 9.903 1.685
69 HD1 PHE 11 1HD PHE 11 -2.395 7.358 4.077
70 HD2 PHE 11 2HD PHE 11 -3.934 10.114 1.234
71 HE1 PHE 11 1HE PHE 11 -4.621 7.165 5.105
72 HE2 PHE 11 2HE PHE 11 -6.163 9.927 2.253
73 HZ PHE 11 HZ PHE 11 -6.508 8.455 4.193
74 H CYS 12 H CYS 12 0.036 6.813 2.419
75 HA CYS 12 HA CYS 12 -0.749 4.154 1.580
76 1HB CYS 12 2HB CYS 12 1.383 3.686 2.023
77 2HB CYS 12 1HB CYS 12 1.606 5.366 2.497
78 HG CYS 12 HG CYS 12 2.167 4.938 4.872
79 H ARG 13 H ARG 13 -1.474 2.534 2.975
80 HA ARG 13 HA ARG 13 -3.486 3.441 4.710
81 1HB ARG 13 2HB ARG 13 -2.412 0.661 4.224
82 2HB ARG 13 1HB ARG 13 -3.846 1.004 5.183
83 1HG ARG 13 2HG ARG 13 -4.592 2.283 3.011
84 2HG ARG 13 1HG ARG 13 -3.436 1.192 2.243
85 1HD ARG 13 2HD ARG 13 -5.437 0.020 2.116
86 2HD ARG 13 1HD ARG 13 -4.661 -0.666 3.542
87 HE ARG 13 HE ARG 13 -6.149 1.212 4.678
88 1HH1 ARG 13 2HH1 ARG 13 -6.983 -1.009 2.100
89 2HH1 ARG 13 1HH1 ARG 13 -8.655 -1.108 2.556
90 1HH2 ARG 13 2HH2 ARG 13 -8.364 1.087 5.272
91 2HH2 ARG 13 1HH2 ARG 13 -9.434 0.053 4.367
92 H VAL 14 H VAL 14 -0.374 1.892 5.395
93 HA VAL 14 HA VAL 14 -0.909 1.789 8.226
94 HB VAL 14 HB VAL 14 1.780 1.313 6.970
95 1HG1 VAL 14 1HG1 VAL 14 2.282 0.116 8.860
96 2HG1 VAL 14 2HG1 VAL 14 1.208 1.343 9.530
97 3HG1 VAL 14 3HG1 VAL 14 0.595 -0.276 9.193
98 1HG2 VAL 14 1HG2 VAL 14 -0.426 0.088 6.000
99 2HG2 VAL 14 2HG2 VAL 14 1.172 -0.655 6.050
100 3HG2 VAL 14 3HG2 VAL 14 -0.002 -1.005 7.319
101 H CYS 15 H CYS 15 2.064 3.062 6.731
102 HA CYS 15 HA CYS 15 2.061 5.235 8.640
103 1HB CYS 15 2HB CYS 15 4.235 5.716 7.101
104 2HB CYS 15 1HB CYS 15 4.242 4.713 8.543
105 H LYS 16 H LYS 16 0.079 5.914 7.658
106 HA LYS 16 HA LYS 16 -0.572 6.656 5.235
107 1HB LYS 16 2HB LYS 16 -1.909 8.587 6.456
108 2HB LYS 16 1HB LYS 16 -2.325 6.892 6.659
109 1HG LYS 16 2HG LYS 16 -1.579 6.818 8.810
110 2HG LYS 16 1HG LYS 16 -0.372 8.080 8.552
111 1HD LYS 16 2HD LYS 16 -3.063 9.079 8.174
112 2HD LYS 16 1HD LYS 16 -2.849 8.368 9.775
113 1HE LYS 16 2HE LYS 16 -0.627 10.070 8.926
114 2HE LYS 16 1HE LYS 16 -2.163 10.924 9.072
115 1HZ LYS 16 1HZ LYS 16 -1.029 10.998 11.158
116 2HZ LYS 16 2HZ LYS 16 -0.813 9.315 11.174
117 3HZ LYS 16 3HZ LYS 16 -2.370 9.973 11.329
118 H ASP 17 H ASP 17 1.606 7.297 4.576
119 HA ASP 17 HA ASP 17 1.881 10.236 4.564
120 1HB ASP 17 2HB ASP 17 3.629 8.594 5.733
121 2HB ASP 17 1HB ASP 17 4.221 8.443 4.083
122 H GLY 18 H GLY 18 3.354 10.875 2.641
123 1HA GLY 18 1HA GLY 18 2.227 9.586 0.242
124 2HA GLY 18 2HA GLY 18 2.849 11.233 0.321
125 H GLY 19 H GLY 19 4.576 11.338 -0.958
126 1HA GLY 19 1HA GLY 19 6.783 10.993 -1.564
127 2HA GLY 19 2HA GLY 19 6.874 9.696 -0.378
128 H GLU 20 H GLU 20 7.819 8.166 -1.664
129 HA GLU 20 HA GLU 20 6.716 7.553 -4.268
130 1HB GLU 20 2HB GLU 20 9.088 6.784 -2.709
131 2HB GLU 20 1HB GLU 20 8.416 5.488 -3.691
132 1HG GLU 20 2HG GLU 20 9.321 8.193 -4.646
133 2HG GLU 20 1HG GLU 20 10.119 6.645 -4.927
134 H LEU 21 H LEU 21 4.832 6.540 -4.353
135 HA LEU 21 HA LEU 21 4.346 4.351 -2.438
136 1HB LEU 21 2HB LEU 21 2.344 6.262 -3.639
137 2HB LEU 21 1HB LEU 21 1.953 4.921 -2.578
138 HG LEU 21 HG LEU 21 3.920 6.761 -1.437
139 1HD1 LEU 21 1HD1 LEU 21 2.154 8.103 -2.906
140 2HD1 LEU 21 2HD1 LEU 21 1.178 7.876 -1.455
141 3HD1 LEU 21 3HD1 LEU 21 2.739 8.691 -1.350
142 1HD2 LEU 21 1HD2 LEU 21 1.384 5.401 -0.600
143 2HD2 LEU 21 2HD2 LEU 21 3.022 5.184 0.019
144 3HD2 LEU 21 3HD2 LEU 21 2.121 6.650 0.404
145 H LEU 22 H LEU 22 3.402 2.507 -3.149
146 HA LEU 22 HA LEU 22 2.907 2.277 -6.045
147 1HB LEU 22 2HB LEU 22 3.852 0.161 -6.124
148 2HB LEU 22 1HB LEU 22 4.933 1.008 -5.035
149 HG LEU 22 HG LEU 22 2.833 -0.262 -3.533
150 1HD1 LEU 22 1HD1 LEU 22 3.138 -2.530 -4.057
151 2HD1 LEU 22 2HD1 LEU 22 2.881 -1.728 -5.607
152 3HD1 LEU 22 3HD1 LEU 22 4.511 -2.188 -5.111
153 1HD2 LEU 22 1HD2 LEU 22 4.854 -1.415 -2.538
154 2HD2 LEU 22 2HD2 LEU 22 5.828 -0.488 -3.679
155 3HD2 LEU 22 3HD2 LEU 22 4.850 0.348 -2.471
156 H CYS 23 H CYS 23 1.161 0.806 -6.609
157 HA CYS 23 HA CYS 23 -0.781 0.495 -4.408
158 1HB CYS 23 2HB CYS 23 -1.990 0.761 -7.038
159 2HB CYS 23 1HB CYS 23 -2.312 1.664 -5.559
160 HG CYS 23 HG CYS 23 0.411 2.377 -7.482
161 H CYS 24 H CYS 24 -2.261 -1.274 -4.557
162 HA CYS 24 HA CYS 24 -1.031 -3.620 -5.588
163 1HB CYS 24 2HB CYS 24 -3.652 -4.252 -4.838
164 2HB CYS 24 1HB CYS 24 -2.195 -4.427 -3.869
165 H ASP 25 H ASP 25 -2.968 -5.235 -6.437
166 HA ASP 25 HA ASP 25 -3.450 -4.257 -9.129
167 1HB ASP 25 2HB ASP 25 -2.452 -6.507 -8.703
168 2HB ASP 25 1HB ASP 25 -3.965 -7.000 -7.956
169 H THR 26 H THR 26 -5.227 -5.076 -6.258
170 HA THR 26 HA THR 26 -7.749 -5.070 -7.714
171 HB THR 26 HB THR 26 -8.627 -5.780 -5.394
172 HG1 THR 26 1HG THR 26 -6.998 -5.385 -3.990
173 1HG2 THR 26 1HG2 THR 26 -7.125 -8.052 -5.838
174 2HG2 THR 26 2HG2 THR 26 -7.119 -7.253 -7.411
175 3HG2 THR 26 3HG2 THR 26 -8.649 -7.654 -6.631
176 H CYS 27 H CYS 27 -6.532 -3.716 -4.679
177 HA CYS 27 HA CYS 27 -8.729 -1.872 -4.558
178 1HB CYS 27 2HB CYS 27 -6.769 -1.577 -2.468
179 2HB CYS 27 1HB CYS 27 -8.418 -2.199 -2.370
180 HA PRO 28 HA PRO 28 -6.427 1.716 -5.754
181 1HB PRO 28 2HB PRO 28 -8.205 3.514 -4.493
182 2HB PRO 28 1HB PRO 28 -8.315 2.900 -6.142
183 1HG PRO 28 2HG PRO 28 -10.110 2.361 -4.069
184 2HG PRO 28 1HG PRO 28 -9.986 1.471 -5.597
185 1HD PRO 28 2HD PRO 28 -8.883 0.792 -2.907
186 2HD PRO 28 1HD PRO 28 -9.527 -0.279 -4.172
187 H SER 29 H SER 29 -5.650 0.478 -3.155
188 HA SER 29 HA SER 29 -5.092 2.791 -1.470
189 1HB SER 29 2HB SER 29 -3.884 0.264 -0.646
190 2HB SER 29 1HB SER 29 -5.003 1.311 0.229
191 HG SER 29 HG SER 29 -5.613 -0.984 -0.593
192 H SER 30 H SER 30 -2.984 3.417 -0.919
193 HA SER 30 HA SER 30 -0.913 2.473 -2.780
194 1HB SER 30 2HB SER 30 -0.850 5.187 -1.479
195 2HB SER 30 1HB SER 30 -0.031 4.642 -2.943
196 HG SER 30 HG SER 30 -2.795 5.188 -2.583
197 H TYR 31 H TYR 31 1.148 2.119 -1.957
198 HA TYR 31 HA TYR 31 1.402 2.142 0.978
199 1HB TYR 31 2HB TYR 31 1.856 -0.148 -0.931
200 2HB TYR 31 1HB TYR 31 2.607 -0.107 0.657
201 HD1 TYR 31 1HD TYR 31 1.310 -0.523 2.650
202 HD2 TYR 31 2HD TYR 31 -0.566 -0.403 -1.170
203 HE1 TYR 31 1HE TYR 31 -0.704 -1.545 3.613
204 HE2 TYR 31 2HE TYR 31 -2.588 -1.425 -0.213
205 HH TYR 31 HH TYR 31 -3.527 -2.323 1.576
206 H HIS 32 H HIS 32 3.638 1.708 1.672
207 HA HIS 32 HA HIS 32 5.641 2.891 -0.131
208 1HB HIS 32 2HB HIS 32 5.710 2.351 2.859
209 2HB HIS 32 1HB HIS 32 7.084 2.918 1.931
210 HD2 HIS 32 2HD HIS 32 6.764 5.565 0.877
211 HE1 HIS 32 1HE HIS 32 3.869 6.555 3.807
212 HE2 HIS 32 2HE HIS 32 5.288 7.445 1.893
213 H ILE 33 H ILE 33 7.863 1.515 0.990
214 HA ILE 33 HA ILE 33 7.150 -1.258 0.315
215 HB ILE 33 HB ILE 33 9.610 -1.592 -0.123
216 1HG1 ILE 33 2HG1 ILE 33 9.572 1.424 0.088
217 1HG2 ILE 33 1HG2 ILE 33 7.716 0.015 -1.736
218 2HG2 ILE 33 2HG2 ILE 33 9.381 -0.081 -2.308
219 3HG2 ILE 33 3HG2 ILE 33 8.444 -1.556 -2.075
220 1HD1 ILE 33 1HD1 ILE 33 12.152 0.402 -0.574
221 2HD1 ILE 33 2HD1 ILE 33 10.995 -0.049 -1.829
222 3HD1 ILE 33 3HD1 ILE 33 11.200 1.646 -1.387
223 H HIS 34 H HIS 34 7.042 0.235 2.948
224 HA HIS 34 HA HIS 34 8.339 -1.879 4.487
225 1HB HIS 34 2HB HIS 34 9.380 -0.322 6.053
226 2HB HIS 34 1HB HIS 34 9.981 -0.052 4.422
227 HD2 HIS 34 2HD HIS 34 9.076 2.319 3.194
228 HE1 HIS 34 1HE HIS 34 7.741 4.023 6.824
229 HE2 HIS 34 2HE HIS 34 8.488 4.510 4.449
230 H CYS 35 H CYS 35 5.515 -0.587 3.856
231 HA CYS 35 HA CYS 35 4.567 0.089 6.476
232 1HB CYS 35 2HB CYS 35 2.690 -0.663 4.288
233 2HB CYS 35 1HB CYS 35 2.590 0.654 5.453
234 H LEU 36 H LEU 36 4.869 -2.790 4.616
235 HA LEU 36 HA LEU 36 2.979 -4.245 6.294
236 1HB LEU 36 2HB LEU 36 4.399 -5.881 4.381
237 2HB LEU 36 1HB LEU 36 2.678 -5.595 4.542
238 HG LEU 36 HG LEU 36 4.355 -3.497 3.239
239 1HD1 LEU 36 1HD1 LEU 36 3.308 -5.222 1.248
240 2HD1 LEU 36 2HD1 LEU 36 4.991 -4.779 1.547
241 3HD1 LEU 36 3HD1 LEU 36 4.292 -6.187 2.348
242 1HD2 LEU 36 1HD2 LEU 36 2.079 -3.751 1.812
243 2HD2 LEU 36 2HD2 LEU 36 1.529 -4.299 3.395
244 3HD2 LEU 36 3HD2 LEU 36 2.248 -2.699 3.218
245 H ARG 37 H ARG 37 3.890 -6.676 6.632
246 HA ARG 37 HA ARG 37 5.939 -6.394 8.576
247 1HB ARG 37 2HB ARG 37 4.463 -8.736 7.430
248 2HB ARG 37 1HB ARG 37 5.852 -8.996 8.473
249 1HG ARG 37 2HG ARG 37 3.492 -7.317 9.273
250 2HG ARG 37 1HG ARG 37 3.616 -9.046 9.604
251 1HD ARG 37 2HD ARG 37 4.590 -8.401 11.518
252 2HD ARG 37 1HD ARG 37 6.016 -8.149 10.515
253 HE ARG 37 HE ARG 37 5.688 -5.854 10.637
254 1HH1 ARG 37 2HH1 ARG 37 3.137 -7.588 12.296
255 2HH1 ARG 37 1HH1 ARG 37 2.501 -6.160 13.068
256 1HH2 ARG 37 2HH2 ARG 37 4.851 -3.984 11.640
257 2HH2 ARG 37 1HH2 ARG 37 3.466 -4.118 12.681
258 HA PRO 38 HA PRO 38 8.870 -8.536 5.458
259 1HB PRO 38 2HB PRO 38 7.590 -8.754 2.874
260 2HB PRO 38 1HB PRO 38 8.224 -10.042 3.899
261 1HG PRO 38 2HG PRO 38 5.569 -9.702 3.394
262 2HG PRO 38 1HG PRO 38 6.198 -10.439 4.878
263 1HD PRO 38 2HD PRO 38 5.240 -7.636 4.415
264 2HD PRO 38 1HD PRO 38 4.937 -8.717 5.794
265 H ALA 39 H ALA 39 9.988 -6.637 5.480
266 HA ALA 39 HA ALA 39 9.206 -4.331 4.018
267 1HB ALA 39 1HB ALA 39 10.546 -4.129 6.027
268 2HB ALA 39 2HB ALA 39 11.861 -5.029 5.270
269 3HB ALA 39 3HB ALA 39 11.412 -3.439 4.652
270 H LEU 40 H LEU 40 9.633 -3.728 2.010
271 HA LEU 40 HA LEU 40 11.177 -5.535 0.304
272 1HB LEU 40 2HB LEU 40 9.440 -3.172 -0.428
273 2HB LEU 40 1HB LEU 40 10.172 -4.297 -1.556
274 HG LEU 40 HG LEU 40 8.632 -5.833 0.256
275 1HD1 LEU 40 1HD1 LEU 40 6.384 -4.854 -0.253
276 2HD1 LEU 40 2HD1 LEU 40 7.355 -3.933 0.894
277 3HD1 LEU 40 3HD1 LEU 40 7.212 -3.389 -0.778
278 1HD2 LEU 40 1HD2 LEU 40 9.232 -5.970 -2.304
279 2HD2 LEU 40 2HD2 LEU 40 7.774 -6.726 -1.661
280 3HD2 LEU 40 3HD2 LEU 40 7.672 -5.165 -2.475
281 H TYR 41 H TYR 41 13.009 -4.926 -0.746
282 HA TYR 41 HA TYR 41 14.150 -2.344 0.077
283 1HB TYR 41 2HB TYR 41 15.405 -4.898 -0.923
284 2HB TYR 41 1HB TYR 41 16.310 -3.393 -0.777
285 HD1 TYR 41 1HD TYR 41 16.248 -2.247 1.560
286 HD2 TYR 41 2HD TYR 41 15.281 -6.339 0.909
287 HE1 TYR 41 1HE TYR 41 16.648 -2.715 3.939
288 HE2 TYR 41 2HE TYR 41 15.677 -6.817 3.287
289 HH TYR 41 HH TYR 41 17.301 -4.765 5.332
290 H GLU 42 H GLU 42 12.461 -3.642 -2.365
291 HA GLU 42 HA GLU 42 13.252 -1.540 -4.190
292 1HB GLU 42 2HB GLU 42 13.043 -3.369 -6.082
293 2HB GLU 42 1HB GLU 42 14.581 -3.077 -5.277
294 1HG GLU 42 2HG GLU 42 14.104 -4.970 -3.764
295 2HG GLU 42 1HG GLU 42 12.624 -5.283 -4.669
296 H VAL 43 H VAL 43 11.531 -0.729 -5.261
297 HA VAL 43 HA VAL 43 8.956 -1.427 -4.334
298 HB VAL 43 HB VAL 43 9.324 0.848 -4.878
299 1HG1 VAL 43 1HG1 VAL 43 10.615 -0.233 -7.234
300 2HG1 VAL 43 2HG1 VAL 43 9.537 1.109 -7.618
301 3HG1 VAL 43 3HG1 VAL 43 10.829 1.325 -6.436
302 1HG2 VAL 43 1HG2 VAL 43 7.639 1.070 -6.947
303 2HG2 VAL 43 2HG2 VAL 43 7.344 -0.613 -6.514
304 3HG2 VAL 43 3HG2 VAL 43 7.111 0.657 -5.315
305 HA PRO 44 HA PRO 44 8.164 -4.610 -7.347
306 1HB PRO 44 2HB PRO 44 5.971 -5.614 -6.178
307 2HB PRO 44 1HB PRO 44 7.578 -5.836 -5.475
308 1HG PRO 44 2HG PRO 44 5.423 -3.906 -4.714
309 2HG PRO 44 1HG PRO 44 6.506 -4.846 -3.672
310 1HD PRO 44 2HD PRO 44 6.883 -2.194 -4.318
311 2HD PRO 44 1HD PRO 44 8.174 -3.298 -3.811
312 H ASP 45 H ASP 45 7.658 -3.114 -9.072
313 HA ASP 45 HA ASP 45 4.828 -2.371 -9.291
314 1HB ASP 45 2HB ASP 45 6.603 -0.634 -9.696
315 2HB ASP 45 1HB ASP 45 7.103 -1.556 -11.110
316 H GLY 46 H GLY 46 3.791 -4.198 -9.923
317 1HA GLY 46 1HA GLY 46 3.605 -4.957 -12.544
318 2HA GLY 46 2HA GLY 46 4.897 -5.964 -11.904
319 H GLU 47 H GLU 47 4.388 -7.748 -10.797
320 HA GLU 47 HA GLU 47 1.540 -8.251 -10.297
321 1HB GLU 47 2HB GLU 47 3.882 -10.137 -10.590
322 2HB GLU 47 1HB GLU 47 2.266 -10.651 -10.124
323 1HG GLU 47 2HG GLU 47 1.594 -9.395 -12.339
324 2HG GLU 47 1HG GLU 47 3.280 -9.714 -12.754
325 H TRP 48 H TRP 48 1.355 -7.171 -8.349
326 HA TRP 48 HA TRP 48 2.497 -8.574 -6.056
327 1HB TRP 48 2HB TRP 48 4.012 -6.676 -6.460
328 2HB TRP 48 1HB TRP 48 2.645 -5.569 -6.425
329 HD1 TRP 48 HD TRP 48 4.808 -7.728 -4.109
330 HE1 TRP 48 1HE TRP 48 4.493 -6.910 -1.689
331 HE3 TRP 48 3HE TRP 48 1.022 -4.373 -4.873
332 HZ2 TRP 48 2HZ TRP 48 2.858 -5.077 -0.292
333 HZ3 TRP 48 3HZ TRP 48 0.141 -3.131 -2.940
334 HH2 TRP 48 HH TRP 48 1.037 -3.480 -0.699
335 H GLN 49 H GLN 49 1.109 -8.719 -4.360
336 HA GLN 49 HA GLN 49 -1.291 -7.039 -4.436
337 1HB GLN 49 2HB GLN 49 -1.180 -9.986 -4.476
338 2HB GLN 49 1HB GLN 49 -2.316 -9.282 -3.329
339 1HG GLN 49 2HG GLN 49 -2.395 -8.073 -5.990
340 2HG GLN 49 1HG GLN 49 -2.832 -9.780 -5.956
341 1HE2 GLN 49 1HE2 GLN 49 -3.520 -6.724 -4.218
342 2HE2 GLN 49 2HE2 GLN 49 -5.202 -7.051 -4.008
343 H CYS 50 H CYS 50 -2.401 -6.960 -2.364
344 HA CYS 50 HA CYS 50 -0.431 -6.261 -0.418
345 1HB CYS 50 2HB CYS 50 -2.834 -5.555 0.608
346 2HB CYS 50 1HB CYS 50 -1.959 -4.603 -0.595
347 HA PRO 51 HA PRO 51 -1.827 -9.283 2.627
348 1HB PRO 51 2HB PRO 51 -0.279 -8.459 4.639
349 2HB PRO 51 1HB PRO 51 0.443 -9.134 3.173
350 1HG PRO 51 2HG PRO 51 0.401 -6.340 4.125
351 2HG PRO 51 1HG PRO 51 1.513 -7.125 2.992
352 1HD PRO 51 2HD PRO 51 -0.831 -5.512 2.409
353 2HD PRO 51 1HD PRO 51 0.377 -6.164 1.283
354 H ARG 52 H ARG 52 -3.105 -6.390 2.290
355 HA ARG 52 HA ARG 52 -4.292 -6.289 4.975
356 1HB ARG 52 2HB ARG 52 -2.381 -4.515 4.009
357 2HB ARG 52 1HB ARG 52 -3.906 -3.647 3.873
358 1HG ARG 52 2HG ARG 52 -3.519 -3.090 6.004
359 2HG ARG 52 1HG ARG 52 -4.127 -4.708 6.360
360 1HD ARG 52 2HD ARG 52 -1.252 -4.458 5.692
361 2HD ARG 52 1HD ARG 52 -1.771 -3.810 7.247
362 HE ARG 52 HE ARG 52 -2.195 -6.615 6.413
363 1HH1 ARG 52 2HH1 ARG 52 -1.487 -4.200 8.850
364 2HH1 ARG 52 1HH1 ARG 52 -1.310 -5.359 10.132
365 1HH2 ARG 52 2HH2 ARG 52 -1.933 -8.156 8.097
366 2HH2 ARG 52 1HH2 ARG 52 -1.531 -7.603 9.697
367 H CYS 53 H CYS 53 -4.661 -4.316 1.958
368 HA CYS 53 HA CYS 53 -7.363 -3.856 2.592
369 1HB CYS 53 2HB CYS 53 -7.105 -3.263 -0.106
370 2HB CYS 53 1HB CYS 53 -6.888 -2.153 1.240
371 H THR 54 H THR 54 -5.861 -6.446 1.015
372 HA THR 54 HA THR 54 -8.085 -7.214 -0.617
373 HB THR 54 HB THR 54 -6.490 -9.454 -0.278
374 HG1 THR 54 1HG THR 54 -4.637 -7.371 -0.632
375 1HG2 THR 54 1HG2 THR 54 -6.287 -7.182 -2.248
376 2HG2 THR 54 2HG2 THR 54 -7.293 -8.624 -2.402
377 3HG2 THR 54 3HG2 THR 54 -5.535 -8.762 -2.463
378 H CYS 55 H CYS 55 -9.913 -7.644 0.490
379 HA CYS 55 HA CYS 55 -9.764 -9.637 2.657
380 1HB CYS 55 2HB CYS 55 -12.035 -7.716 2.584
381 2HB CYS 55 1HB CYS 55 -11.214 -8.432 3.968
382 HG CYS 55 HG CYS 55 -9.633 -6.077 2.079
383 HA PRO 56 HA PRO 56 -12.550 -12.063 0.257
384 1HB PRO 56 2HB PRO 56 -13.982 -13.346 2.189
385 2HB PRO 56 1HB PRO 56 -12.307 -13.750 1.793
386 1HG PRO 56 2HG PRO 56 -13.377 -12.072 4.029
387 2HG PRO 56 1HG PRO 56 -12.074 -13.276 4.057
388 1HD PRO 56 2HD PRO 56 -11.594 -10.615 3.970
389 2HD PRO 56 1HD PRO 56 -10.523 -11.802 3.198
390 H ALA 57 H ALA 57 -13.805 -9.824 2.584
391 HA ALA 57 HA ALA 57 -16.538 -10.061 1.627
392 1HB ALA 57 1HB ALA 57 -15.339 -9.260 4.045
393 2HB ALA 57 2HB ALA 57 -16.179 -7.851 3.398
394 3HB ALA 57 3HB ALA 57 -17.059 -9.357 3.661
395 H LEU 58 H LEU 58 -13.832 -8.518 0.570
396 HA LEU 58 HA LEU 58 -15.381 -6.749 -1.099
397 1HB LEU 58 2HB LEU 58 -14.810 -5.463 1.039
398 2HB LEU 58 1HB LEU 58 -13.143 -5.525 0.498
399 HG LEU 58 HG LEU 58 -14.150 -4.481 -1.706
400 1HD1 LEU 58 1HD1 LEU 58 -16.335 -4.088 -1.556
401 2HD1 LEU 58 2HD1 LEU 58 -16.346 -4.350 0.187
402 3HD1 LEU 58 3HD1 LEU 58 -15.909 -2.770 -0.462
403 1HD2 LEU 58 1HD2 LEU 58 -12.965 -2.724 -1.054
404 2HD2 LEU 58 2HD2 LEU 58 -14.087 -2.368 0.259
405 3HD2 LEU 58 3HD2 LEU 58 -12.777 -3.523 0.508
406 H LYS 59 H LYS 59 -14.675 -7.676 -2.915
407 HA LYS 59 HA LYS 59 -11.817 -8.195 -3.254
408 1HB LYS 59 2HB LYS 59 -14.240 -8.971 -4.880
409 2HB LYS 59 1HB LYS 59 -12.590 -9.328 -5.371
410 1HG LYS 59 2HG LYS 59 -13.150 -10.191 -2.657
411 2HG LYS 59 1HG LYS 59 -14.227 -10.930 -3.843
412 1HD LYS 59 2HD LYS 59 -11.333 -10.832 -4.486
413 2HD LYS 59 1HD LYS 59 -11.853 -11.963 -3.237
414 1HE LYS 59 2HE LYS 59 -12.486 -13.380 -4.822
415 2HE LYS 59 1HE LYS 59 -13.681 -12.205 -5.370
416 1HZ LYS 59 1HZ LYS 59 -12.274 -11.403 -7.000
417 2HZ LYS 59 2HZ LYS 59 -11.933 -13.066 -7.020
418 3HZ LYS 59 3HZ LYS 59 -10.875 -11.995 -6.241
419 H GLY 60 H GLY 60 -10.900 -7.723 -5.458
420 1HA GLY 60 1HA GLY 60 -11.582 -4.958 -6.181
421 2HA GLY 60 2HA GLY 60 -10.104 -5.809 -6.619
422 H LYS 61 H LYS 61 -11.486 -8.210 -7.424
423 HA LYS 61 HA LYS 61 -13.257 -7.431 -9.572
424 1HB LYS 61 2HB LYS 61 -10.858 -7.264 -10.451
425 2HB LYS 61 1HB LYS 61 -10.779 -9.009 -10.264
426 1HG LYS 61 2HG LYS 61 -11.324 -8.143 -12.571
427 2HG LYS 61 1HG LYS 61 -12.413 -9.369 -11.919
428 1HD LYS 61 2HD LYS 61 -13.571 -7.044 -11.060
429 2HD LYS 61 1HD LYS 61 -12.927 -6.581 -12.638
430 1HE LYS 61 2HE LYS 61 -14.944 -7.396 -13.303
431 2HE LYS 61 1HE LYS 61 -14.016 -8.895 -13.339
432 1HZ LYS 61 1HZ LYS 61 -14.816 -9.127 -10.920
433 2HZ LYS 61 2HZ LYS 61 -15.904 -9.473 -12.174
434 3HZ LYS 61 3HZ LYS 61 -15.999 -7.992 -11.354
Start of MODEL 3
1 1H GLY 1 1H GLY 1 -7.909 10.304 -1.751
2 2H GLY 1 2H GLY 1 -7.153 8.792 -1.754
3 3H GLY 1 3H GLY 1 -6.386 10.124 -1.027
4 1HA GLY 1 2HA GLY 1 -8.537 8.433 -0.022
5 2HA GLY 1 1HA GLY 1 -7.187 9.158 0.839
6 HA PRO 2 HA PRO 2 -10.212 12.055 2.335
7 1HB PRO 2 2HB PRO 2 -8.024 13.672 3.354
8 2HB PRO 2 1HB PRO 2 -9.188 12.695 4.250
9 1HG PRO 2 2HG PRO 2 -6.545 12.073 4.062
10 2HG PRO 2 1HG PRO 2 -7.822 10.861 4.275
11 1HD PRO 2 2HD PRO 2 -6.367 11.668 1.784
12 2HD PRO 2 1HD PRO 2 -6.847 10.048 2.337
13 H LEU 3 H LEU 3 -10.264 12.520 -0.140
14 HA LEU 3 HA LEU 3 -9.831 15.391 -0.459
15 1HB LEU 3 2HB LEU 3 -8.537 13.245 -2.069
16 2HB LEU 3 1HB LEU 3 -9.130 14.651 -2.932
17 HG LEU 3 HG LEU 3 -7.168 14.763 -0.637
18 1HD1 LEU 3 1HD1 LEU 3 -6.510 13.686 -2.944
19 2HD1 LEU 3 2HD1 LEU 3 -6.432 15.371 -3.455
20 3HD1 LEU 3 3HD1 LEU 3 -5.426 14.807 -2.120
21 1HD2 LEU 3 1HD2 LEU 3 -7.999 16.870 -0.619
22 2HD2 LEU 3 2HD2 LEU 3 -6.866 17.071 -1.956
23 3HD2 LEU 3 3HD2 LEU 3 -8.575 16.775 -2.284
24 H GLY 4 H GLY 4 -12.159 13.966 0.078
25 1HA GLY 4 1HA GLY 4 -14.361 14.154 -0.679
26 2HA GLY 4 2HA GLY 4 -13.756 14.629 -2.260
27 H SER 5 H SER 5 -14.913 13.212 -3.497
28 HA SER 5 HA SER 5 -15.045 10.403 -2.897
29 1HB SER 5 2HB SER 5 -15.601 11.447 -5.644
30 2HB SER 5 1HB SER 5 -16.486 10.250 -4.695
31 HG SER 5 HG SER 5 -17.173 12.015 -3.339
32 H ASP 6 H ASP 6 -12.896 9.748 -2.726
33 HA ASP 6 HA ASP 6 -11.312 9.867 -5.207
34 1HB ASP 6 2HB ASP 6 -10.540 10.897 -2.883
35 2HB ASP 6 1HB ASP 6 -10.055 9.233 -2.576
36 H HIS 7 H HIS 7 -9.788 8.027 -5.479
37 HA HIS 7 HA HIS 7 -11.166 5.512 -4.852
38 1HB HIS 7 2HB HIS 7 -10.508 6.274 -7.268
39 2HB HIS 7 1HB HIS 7 -8.897 5.731 -6.806
40 HD2 HIS 7 2HD HIS 7 -8.475 3.065 -6.949
41 HE1 HIS 7 1HE HIS 7 -12.492 1.978 -7.718
42 HE2 HIS 7 2HE HIS 7 -10.106 1.130 -7.530
43 H HIS 8 H HIS 8 -7.756 6.142 -5.578
44 HA HIS 8 HA HIS 8 -7.015 4.551 -3.250
45 1HB HIS 8 2HB HIS 8 -4.757 4.547 -4.175
46 2HB HIS 8 1HB HIS 8 -5.916 4.030 -5.392
47 HD2 HIS 8 2HD HIS 8 -2.869 5.884 -5.500
48 HE1 HIS 8 1HE HIS 8 -5.429 8.132 -8.008
49 HE2 HIS 8 2HE HIS 8 -3.015 7.534 -7.506
50 H MET 9 H MET 9 -4.715 5.535 -2.365
51 HA MET 9 HA MET 9 -5.496 8.191 -1.377
52 1HB MET 9 2HB MET 9 -3.443 6.385 -0.116
53 2HB MET 9 1HB MET 9 -4.294 7.740 0.612
54 1HG MET 9 2HG MET 9 -5.849 6.384 1.383
55 2HG MET 9 1HG MET 9 -6.218 5.834 -0.250
56 1HE MET 9 1HE MET 9 -6.637 2.878 0.809
57 2HE MET 9 2HE MET 9 -5.925 2.946 2.421
58 3HE MET 9 3HE MET 9 -6.930 4.277 1.843
59 H GLU 10 H GLU 10 -3.910 9.807 -1.098
60 HA GLU 10 HA GLU 10 -1.845 9.814 -3.141
61 1HB GLU 10 2HB GLU 10 -1.823 12.069 -1.284
62 2HB GLU 10 1HB GLU 10 -1.991 12.063 -3.032
63 1HG GLU 10 2HG GLU 10 -3.946 13.058 -2.236
64 2HG GLU 10 1HG GLU 10 -4.416 11.411 -2.651
65 H PHE 11 H PHE 11 -2.046 8.462 -0.283
66 HA PHE 11 HA PHE 11 0.800 8.632 0.292
67 1HB PHE 11 2HB PHE 11 0.414 9.086 2.668
68 2HB PHE 11 1HB PHE 11 -0.241 10.393 1.686
69 HD1 PHE 11 1HD PHE 11 -2.759 10.335 1.190
70 HD2 PHE 11 2HD PHE 11 -0.918 8.010 4.237
71 HE1 PHE 11 1HE PHE 11 -4.936 10.063 2.293
72 HE2 PHE 11 2HE PHE 11 -3.092 7.734 5.345
73 HZ PHE 11 HZ PHE 11 -5.106 8.761 4.373
74 H CYS 12 H CYS 12 1.298 7.007 2.120
75 HA CYS 12 HA CYS 12 -0.175 4.562 1.519
76 1HB CYS 12 2HB CYS 12 1.792 3.540 1.851
77 2HB CYS 12 1HB CYS 12 2.527 5.119 2.087
78 HG CYS 12 HG CYS 12 2.993 4.943 4.608
79 H ARG 13 H ARG 13 -1.780 3.907 2.771
80 HA ARG 13 HA ARG 13 -2.762 5.445 4.851
81 1HB ARG 13 2HB ARG 13 -4.309 3.532 5.293
82 2HB ARG 13 1HB ARG 13 -4.242 4.040 3.613
83 1HG ARG 13 2HG ARG 13 -3.794 1.963 3.018
84 2HG ARG 13 1HG ARG 13 -2.300 2.020 3.955
85 1HD ARG 13 2HD ARG 13 -3.454 0.183 4.825
86 2HD ARG 13 1HD ARG 13 -3.764 1.479 5.980
87 HE ARG 13 HE ARG 13 -5.696 0.640 3.903
88 1HH1 ARG 13 2HH1 ARG 13 -4.948 1.658 7.173
89 2HH1 ARG 13 1HH1 ARG 13 -6.622 1.776 7.648
90 1HH2 ARG 13 2HH2 ARG 13 -7.872 0.748 4.532
91 2HH2 ARG 13 1HH2 ARG 13 -8.282 1.232 6.151
92 H VAL 14 H VAL 14 -0.196 3.284 5.050
93 HA VAL 14 HA VAL 14 -0.669 2.387 7.737
94 HB VAL 14 HB VAL 14 1.939 2.286 6.219
95 1HG1 VAL 14 1HG1 VAL 14 1.160 0.176 8.122
96 2HG1 VAL 14 2HG1 VAL 14 2.728 0.936 7.847
97 3HG1 VAL 14 3HG1 VAL 14 1.509 1.754 8.826
98 1HG2 VAL 14 1HG2 VAL 14 0.985 -0.192 5.933
99 2HG2 VAL 14 2HG2 VAL 14 -0.544 0.686 5.948
100 3HG2 VAL 14 3HG2 VAL 14 0.689 1.081 4.749
101 H CYS 15 H CYS 15 2.085 4.264 6.446
102 HA CYS 15 HA CYS 15 2.454 5.448 9.061
103 1HB CYS 15 2HB CYS 15 4.594 6.134 8.322
104 2HB CYS 15 1HB CYS 15 4.343 4.538 7.629
105 H LYS 16 H LYS 16 0.600 6.183 6.485
106 HA LYS 16 HA LYS 16 -0.605 7.980 5.847
107 1HB LYS 16 2HB LYS 16 0.463 8.999 8.457
108 2HB LYS 16 1HB LYS 16 -0.478 10.048 7.404
109 1HG LYS 16 2HG LYS 16 -1.856 7.575 7.653
110 2HG LYS 16 1HG LYS 16 -1.400 8.129 9.266
111 1HD LYS 16 2HD LYS 16 -2.479 10.203 7.482
112 2HD LYS 16 1HD LYS 16 -3.621 8.940 7.946
113 1HE LYS 16 2HE LYS 16 -3.946 10.212 9.765
114 2HE LYS 16 1HE LYS 16 -2.441 9.488 10.330
115 1HZ LYS 16 1HZ LYS 16 -1.807 11.676 8.703
116 2HZ LYS 16 2HZ LYS 16 -1.538 11.492 10.369
117 3HZ LYS 16 3HZ LYS 16 -2.984 12.185 9.814
118 H ASP 17 H ASP 17 2.494 7.710 5.435
119 HA ASP 17 HA ASP 17 3.033 10.436 4.510
120 1HB ASP 17 2HB ASP 17 4.650 8.586 5.740
121 2HB ASP 17 1HB ASP 17 5.080 8.385 4.047
122 H GLY 18 H GLY 18 3.640 10.884 2.375
123 1HA GLY 18 1HA GLY 18 2.623 8.947 0.409
124 2HA GLY 18 2HA GLY 18 2.902 10.662 0.118
125 H GLY 19 H GLY 19 4.056 9.975 -1.802
126 1HA GLY 19 1HA GLY 19 6.433 10.292 -2.387
127 2HA GLY 19 2HA GLY 19 6.812 9.103 -1.150
128 H GLU 20 H GLU 20 7.534 7.332 -2.091
129 HA GLU 20 HA GLU 20 6.504 6.493 -4.680
130 1HB GLU 20 2HB GLU 20 8.914 6.013 -3.129
131 2HB GLU 20 1HB GLU 20 8.224 4.514 -3.736
132 1HG GLU 20 2HG GLU 20 9.748 6.491 -5.121
133 2HG GLU 20 1HG GLU 20 9.201 4.911 -5.676
134 H LEU 21 H LEU 21 4.465 5.815 -4.354
135 HA LEU 21 HA LEU 21 4.003 3.808 -2.269
136 1HB LEU 21 2HB LEU 21 1.854 5.199 -3.841
137 2HB LEU 21 1HB LEU 21 1.737 4.430 -2.269
138 HG LEU 21 HG LEU 21 3.443 6.866 -2.648
139 1HD1 LEU 21 1HD1 LEU 21 0.487 6.681 -2.589
140 2HD1 LEU 21 2HD1 LEU 21 1.243 7.950 -1.626
141 3HD1 LEU 21 3HD1 LEU 21 1.534 7.870 -3.364
142 1HD2 LEU 21 1HD2 LEU 21 2.675 7.143 -0.228
143 2HD2 LEU 21 2HD2 LEU 21 2.110 5.477 -0.347
144 3HD2 LEU 21 3HD2 LEU 21 3.820 5.848 -0.574
145 H LEU 22 H LEU 22 2.908 1.922 -2.689
146 HA LEU 22 HA LEU 22 2.955 1.033 -5.486
147 1HB LEU 22 2HB LEU 22 3.252 -0.323 -2.860
148 2HB LEU 22 1HB LEU 22 2.416 -1.213 -4.115
149 HG LEU 22 HG LEU 22 4.645 -1.911 -4.262
150 1HD1 LEU 22 1HD1 LEU 22 5.036 0.126 -6.317
151 2HD1 LEU 22 2HD1 LEU 22 4.934 -1.629 -6.461
152 3HD1 LEU 22 3HD1 LEU 22 3.461 -0.662 -6.380
153 1HD2 LEU 22 1HD2 LEU 22 5.192 0.614 -3.165
154 2HD2 LEU 22 2HD2 LEU 22 6.313 -0.720 -3.436
155 3HD2 LEU 22 3HD2 LEU 22 6.091 0.511 -4.679
156 H CYS 23 H CYS 23 1.094 0.790 -6.514
157 HA CYS 23 HA CYS 23 -1.390 1.190 -5.046
158 1HB CYS 23 2HB CYS 23 -0.842 0.969 -8.015
159 2HB CYS 23 1HB CYS 23 -2.411 1.326 -7.301
160 HG CYS 23 HG CYS 23 0.305 3.334 -7.610
161 H CYS 24 H CYS 24 -2.909 -0.328 -4.758
162 HA CYS 24 HA CYS 24 -2.298 -2.987 -4.594
163 1HB CYS 24 2HB CYS 24 -4.905 -1.531 -4.853
164 2HB CYS 24 1HB CYS 24 -4.856 -3.277 -4.669
165 H ASP 25 H ASP 25 -3.270 -4.828 -5.706
166 HA ASP 25 HA ASP 25 -3.162 -4.522 -8.606
167 1HB ASP 25 2HB ASP 25 -2.002 -6.416 -7.325
168 2HB ASP 25 1HB ASP 25 -3.610 -7.100 -7.108
169 H THR 26 H THR 26 -5.462 -4.275 -6.255
170 HA THR 26 HA THR 26 -7.595 -4.573 -8.171
171 HB THR 26 HB THR 26 -7.710 -6.811 -7.548
172 HG1 THR 26 1HG THR 26 -9.759 -6.096 -7.266
173 1HG2 THR 26 1HG2 THR 26 -7.730 -7.397 -4.995
174 2HG2 THR 26 2HG2 THR 26 -6.859 -5.871 -4.845
175 3HG2 THR 26 3HG2 THR 26 -6.202 -7.166 -5.844
176 H CYS 27 H CYS 27 -6.943 -4.202 -4.674
177 HA CYS 27 HA CYS 27 -9.277 -2.665 -4.220
178 1HB CYS 27 2HB CYS 27 -7.280 -2.348 -2.175
179 2HB CYS 27 1HB CYS 27 -8.792 -3.252 -2.122
180 HA PRO 28 HA PRO 28 -7.615 1.380 -4.870
181 1HB PRO 28 2HB PRO 28 -9.327 2.874 -3.485
182 2HB PRO 28 1HB PRO 28 -9.898 1.815 -4.781
183 1HG PRO 28 2HG PRO 28 -10.080 1.475 -1.833
184 2HG PRO 28 1HG PRO 28 -11.206 0.953 -3.097
185 1HD PRO 28 2HD PRO 28 -9.232 -0.621 -1.806
186 2HD PRO 28 1HD PRO 28 -10.219 -1.083 -3.205
187 H SER 29 H SER 29 -5.929 0.168 -2.913
188 HA SER 29 HA SER 29 -5.551 2.368 -0.989
189 1HB SER 29 2HB SER 29 -4.064 0.095 -0.183
190 2HB SER 29 1HB SER 29 -5.507 0.767 0.579
191 HG SER 29 HG SER 29 -5.344 -1.232 -1.433
192 H SER 30 H SER 30 -3.355 2.884 -0.384
193 HA SER 30 HA SER 30 -1.337 2.180 -2.397
194 1HB SER 30 2HB SER 30 -1.124 4.867 -1.165
195 2HB SER 30 1HB SER 30 -0.777 4.351 -2.815
196 HG SER 30 HG SER 30 -2.597 5.726 -2.722
197 H TYR 31 H TYR 31 0.515 1.433 -1.537
198 HA TYR 31 HA TYR 31 0.942 1.837 1.360
199 1HB TYR 31 2HB TYR 31 1.418 -0.651 -0.297
200 2HB TYR 31 1HB TYR 31 1.903 -0.465 1.383
201 HD1 TYR 31 1HD TYR 31 -0.523 -1.795 -0.698
202 HD2 TYR 31 2HD TYR 31 -0.122 0.332 2.961
203 HE1 TYR 31 1HE TYR 31 -2.713 -2.634 0.022
204 HE2 TYR 31 2HE TYR 31 -2.316 -0.493 3.689
205 HH TYR 31 HH TYR 31 -4.245 -2.658 1.606
206 H HIS 32 H HIS 32 3.191 1.380 2.040
207 HA HIS 32 HA HIS 32 5.155 2.211 0.010
208 1HB HIS 32 2HB HIS 32 5.099 2.441 3.001
209 2HB HIS 32 1HB HIS 32 6.649 2.274 2.190
210 HD2 HIS 32 2HD HIS 32 6.579 4.358 -0.135
211 HE1 HIS 32 1HE HIS 32 5.052 7.080 2.731
212 HE2 HIS 32 2HE HIS 32 6.382 6.852 0.572
213 H ILE 33 H ILE 33 7.045 0.870 -0.179
214 HA ILE 33 HA ILE 33 6.527 -1.866 -0.146
215 HB ILE 33 HB ILE 33 9.192 -1.949 -0.181
216 1HG1 ILE 33 2HG1 ILE 33 8.573 0.872 -1.088
217 1HG2 ILE 33 1HG2 ILE 33 7.238 -1.169 -2.306
218 2HG2 ILE 33 2HG2 ILE 33 8.951 -1.338 -2.685
219 3HG2 ILE 33 3HG2 ILE 33 8.048 -2.713 -2.046
220 1HD1 ILE 33 1HD1 ILE 33 10.411 -0.052 -2.338
221 2HD1 ILE 33 2HD1 ILE 33 11.018 1.122 -1.171
222 3HD1 ILE 33 3HD1 ILE 33 11.181 -0.604 -0.852
223 H HIS 34 H HIS 34 8.183 0.137 2.247
224 HA HIS 34 HA HIS 34 8.606 -2.245 3.893
225 1HB HIS 34 2HB HIS 34 10.195 -0.896 5.175
226 2HB HIS 34 1HB HIS 34 10.589 -0.878 3.462
227 HD2 HIS 34 2HD HIS 34 9.254 1.613 2.248
228 HE1 HIS 34 1HE HIS 34 10.413 3.735 5.719
229 HE2 HIS 34 2HE HIS 34 9.493 3.946 3.362
230 H CYS 35 H CYS 35 6.061 -0.489 3.551
231 HA CYS 35 HA CYS 35 5.659 0.061 6.406
232 1HB CYS 35 2HB CYS 35 4.338 1.144 3.936
233 2HB CYS 35 1HB CYS 35 3.524 1.236 5.498
234 H LEU 36 H LEU 36 5.328 -2.384 4.389
235 HA LEU 36 HA LEU 36 2.778 -3.334 5.479
236 1HB LEU 36 2HB LEU 36 4.566 -4.711 3.476
237 2HB LEU 36 1HB LEU 36 2.915 -5.134 3.890
238 HG LEU 36 HG LEU 36 3.301 -2.403 2.836
239 1HD1 LEU 36 1HD1 LEU 36 4.367 -4.688 1.443
240 2HD1 LEU 36 2HD1 LEU 36 3.043 -3.951 0.541
241 3HD1 LEU 36 3HD1 LEU 36 4.434 -2.976 1.018
242 1HD2 LEU 36 1HD2 LEU 36 1.091 -2.714 2.853
243 2HD2 LEU 36 2HD2 LEU 36 1.339 -3.694 1.407
244 3HD2 LEU 36 3HD2 LEU 36 1.249 -4.464 2.992
245 H ARG 37 H ARG 37 2.848 -5.674 6.253
246 HA ARG 37 HA ARG 37 4.732 -5.907 8.348
247 1HB ARG 37 2HB ARG 37 2.718 -7.785 7.165
248 2HB ARG 37 1HB ARG 37 3.859 -8.358 8.375
249 1HG ARG 37 2HG ARG 37 2.770 -5.954 9.361
250 2HG ARG 37 1HG ARG 37 1.429 -6.916 8.736
251 1HD ARG 37 2HD ARG 37 3.522 -7.894 10.675
252 2HD ARG 37 1HD ARG 37 1.894 -7.369 11.109
253 HE ARG 37 HE ARG 37 1.069 -9.253 9.743
254 1HH1 ARG 37 2HH1 ARG 37 4.364 -9.336 10.919
255 2HH1 ARG 37 1HH1 ARG 37 4.490 -11.070 10.816
256 1HH2 ARG 37 2HH2 ARG 37 1.233 -11.512 9.573
257 2HH2 ARG 37 1HH2 ARG 37 2.704 -12.316 10.051
258 HA PRO 38 HA PRO 38 7.219 -8.889 5.551
259 1HB PRO 38 2HB PRO 38 6.089 -9.086 2.928
260 2HB PRO 38 1HB PRO 38 6.211 -10.355 4.147
261 1HG PRO 38 2HG PRO 38 3.841 -9.255 3.261
262 2HG PRO 38 1HG PRO 38 4.053 -10.080 4.816
263 1HD PRO 38 2HD PRO 38 4.035 -7.145 4.212
264 2HD PRO 38 1HD PRO 38 3.312 -8.019 5.581
265 H ALA 39 H ALA 39 7.760 -6.430 5.876
266 HA ALA 39 HA ALA 39 7.661 -4.548 3.915
267 1HB ALA 39 1HB ALA 39 9.403 -3.374 5.063
268 2HB ALA 39 2HB ALA 39 8.388 -4.184 6.255
269 3HB ALA 39 3HB ALA 39 9.962 -4.859 5.833
270 H LEU 40 H LEU 40 8.722 -4.006 2.133
271 HA LEU 40 HA LEU 40 10.973 -5.704 1.280
272 1HB LEU 40 2HB LEU 40 9.251 -4.076 -0.573
273 2HB LEU 40 1HB LEU 40 10.324 -5.403 -0.972
274 HG LEU 40 HG LEU 40 8.348 -6.412 0.799
275 1HD1 LEU 40 1HD1 LEU 40 7.329 -4.236 -0.662
276 2HD1 LEU 40 2HD1 LEU 40 6.720 -5.696 -1.442
277 3HD1 LEU 40 3HD1 LEU 40 6.431 -5.428 0.276
278 1HD2 LEU 40 1HD2 LEU 40 7.710 -7.512 -1.535
279 2HD2 LEU 40 2HD2 LEU 40 9.277 -6.836 -1.982
280 3HD2 LEU 40 3HD2 LEU 40 9.157 -7.971 -0.639
281 H TYR 41 H TYR 41 12.717 -4.663 0.211
282 HA TYR 41 HA TYR 41 12.961 -1.808 0.910
283 1HB TYR 41 2HB TYR 41 14.873 -4.096 0.910
284 2HB TYR 41 1HB TYR 41 15.509 -2.503 0.521
285 HD1 TYR 41 1HD TYR 41 12.810 -2.041 2.725
286 HD2 TYR 41 2HD TYR 41 16.864 -3.332 2.646
287 HE1 TYR 41 1HE TYR 41 13.013 -1.532 5.119
288 HE2 TYR 41 2HE TYR 41 17.071 -2.842 5.046
289 HH TYR 41 HH TYR 41 14.325 -2.048 7.012
290 H GLU 42 H GLU 42 12.335 -3.761 -1.604
291 HA GLU 42 HA GLU 42 13.511 -1.877 -3.530
292 1HB GLU 42 2HB GLU 42 14.467 -4.341 -3.352
293 2HB GLU 42 1HB GLU 42 13.045 -4.724 -4.309
294 1HG GLU 42 2HG GLU 42 13.828 -2.894 -5.897
295 2HG GLU 42 1HG GLU 42 15.363 -2.967 -5.032
296 H VAL 43 H VAL 43 12.207 -1.296 -5.243
297 HA VAL 43 HA VAL 43 9.383 -1.679 -4.815
298 HB VAL 43 HB VAL 43 10.670 0.464 -5.658
299 1HG1 VAL 43 1HG1 VAL 43 9.769 -0.125 -8.356
300 2HG1 VAL 43 2HG1 VAL 43 11.272 0.612 -7.797
301 3HG1 VAL 43 3HG1 VAL 43 11.115 -1.143 -7.845
302 1HG2 VAL 43 1HG2 VAL 43 8.124 -0.066 -5.331
303 2HG2 VAL 43 2HG2 VAL 43 8.641 1.393 -6.177
304 3HG2 VAL 43 3HG2 VAL 43 8.106 -0.015 -7.094
305 HA PRO 44 HA PRO 44 8.940 -5.220 -7.423
306 1HB PRO 44 2HB PRO 44 6.182 -4.241 -7.890
307 2HB PRO 44 1HB PRO 44 6.729 -5.772 -7.201
308 1HG PRO 44 2HG PRO 44 5.647 -3.887 -5.660
309 2HG PRO 44 1HG PRO 44 7.006 -4.869 -5.081
310 1HD PRO 44 2HD PRO 44 7.004 -2.063 -6.127
311 2HD PRO 44 1HD PRO 44 7.898 -2.752 -4.756
312 H ASP 45 H ASP 45 8.575 -5.821 -9.618
313 HA ASP 45 HA ASP 45 9.276 -3.772 -11.498
314 1HB ASP 45 2HB ASP 45 10.266 -5.852 -11.943
315 2HB ASP 45 1HB ASP 45 8.760 -6.728 -11.689
316 H GLY 46 H GLY 46 6.408 -5.763 -10.885
317 1HA GLY 46 1HA GLY 46 4.631 -3.744 -11.772
318 2HA GLY 46 2HA GLY 46 4.859 -4.930 -13.046
319 H GLU 47 H GLU 47 4.995 -7.281 -11.729
320 HA GLU 47 HA GLU 47 2.246 -7.699 -11.047
321 1HB GLU 47 2HB GLU 47 4.646 -9.398 -11.470
322 2HB GLU 47 1HB GLU 47 3.333 -10.082 -10.521
323 1HG GLU 47 2HG GLU 47 2.063 -8.980 -12.710
324 2HG GLU 47 1HG GLU 47 3.545 -9.666 -13.375
325 H TRP 48 H TRP 48 2.098 -6.371 -9.144
326 HA TRP 48 HA TRP 48 3.299 -7.594 -6.751
327 1HB TRP 48 2HB TRP 48 3.936 -5.226 -7.152
328 2HB TRP 48 1HB TRP 48 2.236 -4.777 -7.077
329 HD1 TRP 48 HD TRP 48 4.758 -6.600 -4.743
330 HE1 TRP 48 1HE TRP 48 4.317 -5.815 -2.335
331 HE3 TRP 48 3HE TRP 48 0.785 -3.483 -5.611
332 HZ2 TRP 48 2HZ TRP 48 2.526 -4.109 -0.976
333 HZ3 TRP 48 3HZ TRP 48 -0.219 -2.309 -3.698
334 HH2 TRP 48 HH TRP 48 0.630 -2.619 -1.430
335 H GLN 49 H GLN 49 2.017 -7.996 -4.974
336 HA GLN 49 HA GLN 49 -0.858 -7.561 -5.216
337 1HB GLN 49 2HB GLN 49 0.341 -10.099 -5.493
338 2HB GLN 49 1HB GLN 49 -0.350 -10.062 -3.876
339 1HG GLN 49 2HG GLN 49 -2.045 -9.090 -6.097
340 2HG GLN 49 1HG GLN 49 -1.730 -10.822 -6.012
341 1HE2 GLN 49 1HE2 GLN 49 -3.220 -8.103 -4.459
342 2HE2 GLN 49 2HE2 GLN 49 -4.130 -9.003 -3.296
343 H CYS 50 H CYS 50 -1.728 -6.855 -3.343
344 HA CYS 50 HA CYS 50 0.085 -5.970 -1.381
345 1HB CYS 50 2HB CYS 50 -2.342 -5.461 -0.304
346 2HB CYS 50 1HB CYS 50 -1.572 -4.458 -1.531
347 HA PRO 51 HA PRO 51 -0.404 -9.484 1.394
348 1HB PRO 51 2HB PRO 51 1.690 -8.914 2.947
349 2HB PRO 51 1HB PRO 51 1.925 -9.546 1.312
350 1HG PRO 51 2HG PRO 51 2.150 -6.734 2.308
351 2HG PRO 51 1HG PRO 51 3.183 -7.599 1.157
352 1HD PRO 51 2HD PRO 51 1.160 -5.841 0.466
353 2HD PRO 51 1HD PRO 51 1.827 -7.091 -0.603
354 H ARG 52 H ARG 52 -2.012 -7.098 1.559
355 HA ARG 52 HA ARG 52 -2.134 -6.755 4.476
356 1HB ARG 52 2HB ARG 52 -1.482 -4.748 2.531
357 2HB ARG 52 1HB ARG 52 -3.019 -4.345 3.284
358 1HG ARG 52 2HG ARG 52 -0.394 -4.829 4.673
359 2HG ARG 52 1HG ARG 52 -1.242 -3.290 4.497
360 1HD ARG 52 2HD ARG 52 -2.644 -5.570 5.812
361 2HD ARG 52 1HD ARG 52 -1.407 -4.696 6.717
362 HE ARG 52 HE ARG 52 -3.938 -3.588 5.702
363 1HH1 ARG 52 2HH1 ARG 52 -1.004 -3.206 7.577
364 2HH1 ARG 52 1HH1 ARG 52 -1.605 -1.850 8.486
365 1HH2 ARG 52 2HH2 ARG 52 -4.739 -1.795 6.877
366 2HH2 ARG 52 1HH2 ARG 52 -3.725 -1.040 8.074
367 H CYS 53 H CYS 53 -3.968 -5.509 1.674
368 HA CYS 53 HA CYS 53 -6.442 -5.843 2.987
369 1HB CYS 53 2HB CYS 53 -6.669 -5.673 0.111
370 2HB CYS 53 1HB CYS 53 -7.134 -4.499 1.339
371 H THR 54 H THR 54 -4.687 -7.775 0.636
372 HA THR 54 HA THR 54 -6.846 -9.767 0.709
373 HB THR 54 HB THR 54 -5.518 -10.709 -1.319
374 HG1 THR 54 1HG THR 54 -4.666 -7.981 -1.377
375 1HG2 THR 54 1HG2 THR 54 -6.686 -9.044 -2.834
376 2HG2 THR 54 2HG2 THR 54 -7.183 -8.202 -1.366
377 3HG2 THR 54 3HG2 THR 54 -7.706 -9.862 -1.651
378 H CYS 55 H CYS 55 -5.848 -12.084 0.276
379 HA CYS 55 HA CYS 55 -4.179 -12.604 2.566
380 1HB CYS 55 2HB CYS 55 -4.842 -14.784 0.660
381 2HB CYS 55 1HB CYS 55 -4.925 -14.762 2.420
382 HG CYS 55 HG CYS 55 -7.245 -13.662 0.174
383 HA PRO 56 HA PRO 56 -0.435 -12.475 0.112
384 1HB PRO 56 2HB PRO 56 0.965 -13.124 2.576
385 2HB PRO 56 1HB PRO 56 0.978 -11.615 1.660
386 1HG PRO 56 2HG PRO 56 -0.181 -11.862 4.112
387 2HG PRO 56 1HG PRO 56 -0.730 -10.706 2.886
388 1HD PRO 56 2HD PRO 56 -1.873 -13.369 3.628
389 2HD PRO 56 1HD PRO 56 -2.712 -11.851 3.238
390 H ALA 57 H ALA 57 -1.456 -14.634 -0.667
391 HA ALA 57 HA ALA 57 -0.037 -16.937 0.471
392 1HB ALA 57 1HB ALA 57 -2.624 -16.556 -0.871
393 2HB ALA 57 2HB ALA 57 -1.756 -18.026 -1.311
394 3HB ALA 57 3HB ALA 57 -2.148 -17.706 0.378
395 H LEU 58 H LEU 58 0.785 -14.773 -1.641
396 HA LEU 58 HA LEU 58 2.386 -16.599 -3.187
397 1HB LEU 58 2HB LEU 58 0.008 -16.057 -4.314
398 2HB LEU 58 1HB LEU 58 0.905 -14.662 -4.878
399 HG LEU 58 HG LEU 58 2.470 -16.036 -6.053
400 1HD1 LEU 58 1HD1 LEU 58 1.241 -18.625 -5.605
401 2HD1 LEU 58 2HD1 LEU 58 2.940 -18.153 -5.550
402 3HD1 LEU 58 3HD1 LEU 58 1.918 -17.937 -4.129
403 1HD2 LEU 58 1HD2 LEU 58 0.393 -15.605 -7.225
404 2HD2 LEU 58 2HD2 LEU 58 0.984 -17.220 -7.620
405 3HD2 LEU 58 3HD2 LEU 58 -0.348 -17.022 -6.481
406 H LYS 59 H LYS 59 3.540 -15.072 -4.977
407 HA LYS 59 HA LYS 59 4.984 -13.395 -5.411
408 1HB LYS 59 2HB LYS 59 2.893 -12.069 -4.043
409 2HB LYS 59 1HB LYS 59 4.405 -11.447 -3.397
410 1HG LYS 59 2HG LYS 59 4.549 -10.115 -5.157
411 2HG LYS 59 1HG LYS 59 4.746 -11.543 -6.175
412 1HD LYS 59 2HD LYS 59 1.974 -11.092 -5.451
413 2HD LYS 59 1HD LYS 59 2.674 -9.705 -6.288
414 1HE LYS 59 2HE LYS 59 2.982 -10.859 -8.226
415 2HE LYS 59 1HE LYS 59 3.214 -12.400 -7.402
416 1HZ LYS 59 1HZ LYS 59 1.159 -12.519 -8.527
417 2HZ LYS 59 2HZ LYS 59 0.658 -11.003 -7.956
418 3HZ LYS 59 3HZ LYS 59 0.777 -12.315 -6.885
419 H GLY 60 H GLY 60 4.582 -13.024 -1.877
420 1HA GLY 60 1HA GLY 60 7.234 -14.157 -1.490
421 2HA GLY 60 2HA GLY 60 7.065 -12.454 -1.091
422 H LYS 61 H LYS 61 6.111 -15.707 -0.273
423 HA LYS 61 HA LYS 61 5.285 -14.711 2.374
424 1HB LYS 61 2HB LYS 61 3.389 -15.657 1.056
425 2HB LYS 61 1HB LYS 61 4.248 -17.191 0.983
426 1HG LYS 61 2HG LYS 61 2.582 -17.296 2.701
427 2HG LYS 61 1HG LYS 61 4.178 -17.305 3.452
428 1HD LYS 61 2HD LYS 61 3.427 -14.605 3.245
429 2HD LYS 61 1HD LYS 61 2.002 -15.467 3.824
430 1HE LYS 61 2HE LYS 61 3.062 -14.997 5.806
431 2HE LYS 61 1HE LYS 61 3.707 -16.599 5.448
432 1HZ LYS 61 1HZ LYS 61 5.098 -14.093 4.680
433 2HZ LYS 61 2HZ LYS 61 5.725 -15.670 4.692
434 3HZ LYS 61 3HZ LYS 61 5.370 -14.883 6.154
Start of MODEL 4
1 1H GLY 1 1H GLY 1 -14.515 0.611 14.128
2 2H GLY 1 2H GLY 1 -15.100 0.103 15.636
3 3H GLY 1 3H GLY 1 -16.186 0.451 14.382
4 1HA GLY 1 2HA GLY 1 -15.381 -2.009 15.009
5 2HA GLY 1 1HA GLY 1 -15.943 -1.532 13.412
6 HA PRO 2 HA PRO 2 -11.420 -3.056 13.433
7 1HB PRO 2 2HB PRO 2 -11.824 -5.436 12.163
8 2HB PRO 2 1HB PRO 2 -11.797 -5.262 13.920
9 1HG PRO 2 2HG PRO 2 -14.147 -5.425 12.076
10 2HG PRO 2 1HG PRO 2 -13.902 -6.205 13.650
11 1HD PRO 2 2HD PRO 2 -15.406 -3.984 13.362
12 2HD PRO 2 1HD PRO 2 -14.444 -4.290 14.822
13 H LEU 3 H LEU 3 -14.073 -3.010 11.160
14 HA LEU 3 HA LEU 3 -12.186 -2.641 8.936
15 1HB LEU 3 2HB LEU 3 -14.972 -3.666 9.133
16 2HB LEU 3 1HB LEU 3 -14.529 -2.798 7.674
17 HG LEU 3 HG LEU 3 -12.455 -4.621 8.052
18 1HD1 LEU 3 1HD1 LEU 3 -13.248 -6.306 9.257
19 2HD1 LEU 3 2HD1 LEU 3 -14.860 -5.590 9.312
20 3HD1 LEU 3 3HD1 LEU 3 -14.393 -6.612 7.952
21 1HD2 LEU 3 1HD2 LEU 3 -14.816 -4.395 6.238
22 2HD2 LEU 3 2HD2 LEU 3 -13.100 -4.193 5.882
23 3HD2 LEU 3 3HD2 LEU 3 -13.762 -5.806 6.136
24 H GLY 4 H GLY 4 -12.188 -0.806 7.742
25 1HA GLY 4 1HA GLY 4 -14.204 1.246 8.362
26 2HA GLY 4 2HA GLY 4 -12.497 1.658 8.483
27 H SER 5 H SER 5 -13.845 3.171 6.785
28 HA SER 5 HA SER 5 -13.878 2.049 4.127
29 1HB SER 5 2HB SER 5 -13.977 4.992 4.568
30 2HB SER 5 1HB SER 5 -14.952 3.979 3.502
31 HG SER 5 HG SER 5 -15.757 4.952 5.718
32 H ASP 6 H ASP 6 -11.490 1.468 4.791
33 HA ASP 6 HA ASP 6 -9.598 3.588 4.163
34 1HB ASP 6 2HB ASP 6 -9.478 0.943 5.423
35 2HB ASP 6 1HB ASP 6 -8.144 1.246 4.316
36 H HIS 7 H HIS 7 -10.784 3.668 1.994
37 HA HIS 7 HA HIS 7 -9.627 1.691 0.139
38 1HB HIS 7 2HB HIS 7 -12.270 2.274 0.497
39 2HB HIS 7 1HB HIS 7 -11.859 3.365 -0.821
40 HD2 HIS 7 2HD HIS 7 -11.631 2.229 -3.269
41 HE1 HIS 7 1HE HIS 7 -12.043 -1.781 -1.984
42 HE2 HIS 7 2HE HIS 7 -11.706 -0.266 -3.990
43 H HIS 8 H HIS 8 -10.643 5.098 0.303
44 HA HIS 8 HA HIS 8 -8.674 5.732 -1.776
45 1HB HIS 8 2HB HIS 8 -10.853 6.573 -2.292
46 2HB HIS 8 1HB HIS 8 -11.046 7.247 -0.679
47 HD2 HIS 8 2HD HIS 8 -8.737 7.944 -3.813
48 HE1 HIS 8 1HE HIS 8 -9.373 11.526 -1.650
49 HE2 HIS 8 2HE HIS 8 -8.410 10.521 -3.771
50 H MET 9 H MET 9 -6.794 6.575 -1.232
51 HA MET 9 HA MET 9 -6.571 8.663 0.677
52 1HB MET 9 2HB MET 9 -4.915 7.544 2.176
53 2HB MET 9 1HB MET 9 -6.554 6.936 2.343
54 1HG MET 9 2HG MET 9 -5.300 5.327 0.411
55 2HG MET 9 1HG MET 9 -4.148 5.529 1.732
56 1HE MET 9 1HE MET 9 -5.874 1.987 2.213
57 2HE MET 9 2HE MET 9 -6.203 2.760 0.662
58 3HE MET 9 3HE MET 9 -4.587 2.843 1.364
59 H GLU 10 H GLU 10 -5.009 9.979 0.030
60 HA GLU 10 HA GLU 10 -3.251 9.111 -2.124
61 1HB GLU 10 2HB GLU 10 -3.822 11.804 -0.879
62 2HB GLU 10 1HB GLU 10 -2.599 11.568 -2.121
63 1HG GLU 10 2HG GLU 10 -5.405 10.666 -2.592
64 2HG GLU 10 1HG GLU 10 -4.971 12.364 -2.782
65 H PHE 11 H PHE 11 -2.698 7.868 0.252
66 HA PHE 11 HA PHE 11 0.062 8.432 0.647
67 1HB PHE 11 2HB PHE 11 -0.036 9.020 3.028
68 2HB PHE 11 1HB PHE 11 -0.870 10.229 2.059
69 HD1 PHE 11 1HD PHE 11 -3.291 10.444 2.155
70 HD2 PHE 11 2HD PHE 11 -1.233 7.620 4.571
71 HE1 PHE 11 1HE PHE 11 -5.301 10.183 3.548
72 HE2 PHE 11 2HE PHE 11 -3.239 7.347 5.969
73 HZ PHE 11 HZ PHE 11 -5.279 8.629 5.457
74 H CYS 12 H CYS 12 0.984 6.927 2.297
75 HA CYS 12 HA CYS 12 -0.318 4.356 2.055
76 1HB CYS 12 2HB CYS 12 1.773 3.580 2.228
77 2HB CYS 12 1HB CYS 12 2.339 5.239 2.358
78 HG CYS 12 HG CYS 12 3.160 5.124 4.755
79 H ARG 13 H ARG 13 -1.731 3.602 3.467
80 HA ARG 13 HA ARG 13 -2.570 5.195 5.615
81 1HB ARG 13 2HB ARG 13 -4.308 3.616 5.946
82 2HB ARG 13 1HB ARG 13 -3.996 3.677 4.218
83 1HG ARG 13 2HG ARG 13 -3.324 1.529 4.129
84 2HG ARG 13 1HG ARG 13 -2.509 1.610 5.694
85 1HD ARG 13 2HD ARG 13 -4.549 1.338 6.869
86 2HD ARG 13 1HD ARG 13 -5.503 1.572 5.406
87 HE ARG 13 HE ARG 13 -3.781 -0.666 5.126
88 1HH1 ARG 13 2HH1 ARG 13 -6.789 0.381 6.605
89 2HH1 ARG 13 1HH1 ARG 13 -7.416 -1.237 6.756
90 1HH2 ARG 13 2HH2 ARG 13 -4.609 -2.797 5.337
91 2HH2 ARG 13 1HH2 ARG 13 -6.183 -3.033 6.055
92 H VAL 14 H VAL 14 0.186 3.863 5.817
93 HA VAL 14 HA VAL 14 -0.142 2.691 8.494
94 HB VAL 14 HB VAL 14 2.404 2.685 6.875
95 1HG1 VAL 14 1HG1 VAL 14 1.446 1.268 9.337
96 2HG1 VAL 14 2HG1 VAL 14 2.754 0.610 8.354
97 3HG1 VAL 14 3HG1 VAL 14 2.921 2.203 9.093
98 1HG2 VAL 14 1HG2 VAL 14 1.353 1.325 5.439
99 2HG2 VAL 14 2HG2 VAL 14 1.474 0.125 6.724
100 3HG2 VAL 14 3HG2 VAL 14 -0.007 1.061 6.530
101 H CYS 15 H CYS 15 2.396 4.591 6.882
102 HA CYS 15 HA CYS 15 2.931 5.998 9.346
103 1HB CYS 15 2HB CYS 15 4.967 6.648 8.357
104 2HB CYS 15 1HB CYS 15 4.673 5.025 7.743
105 H LYS 16 H LYS 16 0.916 6.483 6.765
106 HA LYS 16 HA LYS 16 -0.461 8.175 6.164
107 1HB LYS 16 2HB LYS 16 0.728 9.284 8.626
108 2HB LYS 16 1HB LYS 16 0.056 10.461 7.506
109 1HG LYS 16 2HG LYS 16 -1.912 10.056 8.440
110 2HG LYS 16 1HG LYS 16 -1.876 8.485 7.635
111 1HD LYS 16 2HD LYS 16 -0.294 8.435 10.042
112 2HD LYS 16 1HD LYS 16 -1.933 8.989 10.388
113 1HE LYS 16 2HE LYS 16 -1.582 6.612 8.635
114 2HE LYS 16 1HE LYS 16 -1.314 6.423 10.368
115 1HZ LYS 16 1HZ LYS 16 -3.492 6.536 10.773
116 2HZ LYS 16 2HZ LYS 16 -3.720 6.306 9.110
117 3HZ LYS 16 3HZ LYS 16 -3.715 7.873 9.752
118 H ASP 17 H ASP 17 2.741 8.081 5.646
119 HA ASP 17 HA ASP 17 3.013 10.628 4.276
120 1HB ASP 17 2HB ASP 17 4.806 8.782 5.332
121 2HB ASP 17 1HB ASP 17 4.978 8.591 3.591
122 H GLY 18 H GLY 18 3.062 10.891 2.014
123 1HA GLY 18 1HA GLY 18 2.290 8.538 0.432
124 2HA GLY 18 2HA GLY 18 1.229 9.940 0.444
125 H GLY 19 H GLY 19 4.768 9.516 0.149
126 1HA GLY 19 1HA GLY 19 4.877 11.495 -1.951
127 2HA GLY 19 2HA GLY 19 6.221 10.530 -1.351
128 H GLU 20 H GLU 20 6.022 8.129 -1.909
129 HA GLU 20 HA GLU 20 4.987 7.837 -4.656
130 1HB GLU 20 2HB GLU 20 7.557 6.948 -3.413
131 2HB GLU 20 1HB GLU 20 6.839 5.951 -4.671
132 1HG GLU 20 2HG GLU 20 7.147 7.531 -6.298
133 2HG GLU 20 1HG GLU 20 7.167 8.866 -5.148
134 H LEU 21 H LEU 21 3.119 6.778 -4.397
135 HA LEU 21 HA LEU 21 2.927 4.709 -2.347
136 1HB LEU 21 2HB LEU 21 0.936 6.287 -3.929
137 2HB LEU 21 1HB LEU 21 0.446 4.811 -3.125
138 HG LEU 21 HG LEU 21 -0.010 6.093 -1.357
139 1HD1 LEU 21 1HD1 LEU 21 1.608 6.117 0.208
140 2HD1 LEU 21 2HD1 LEU 21 2.505 5.207 -1.009
141 3HD1 LEU 21 3HD1 LEU 21 2.760 6.944 -0.842
142 1HD2 LEU 21 1HD2 LEU 21 1.555 8.437 -1.536
143 2HD2 LEU 21 2HD2 LEU 21 0.966 8.066 -3.157
144 3HD2 LEU 21 3HD2 LEU 21 -0.175 8.248 -1.823
145 H LEU 22 H LEU 22 3.203 2.682 -2.838
146 HA LEU 22 HA LEU 22 2.760 1.726 -5.569
147 1HB LEU 22 2HB LEU 22 4.578 0.526 -5.042
148 2HB LEU 22 1HB LEU 22 4.441 0.931 -3.344
149 HG LEU 22 HG LEU 22 2.478 -0.947 -3.600
150 1HD1 LEU 22 1HD1 LEU 22 4.763 -1.938 -5.284
151 2HD1 LEU 22 2HD1 LEU 22 3.233 -2.744 -4.942
152 3HD1 LEU 22 3HD1 LEU 22 3.262 -1.310 -5.968
153 1HD2 LEU 22 1HD2 LEU 22 4.569 -0.631 -2.039
154 2HD2 LEU 22 2HD2 LEU 22 3.779 -2.200 -2.192
155 3HD2 LEU 22 3HD2 LEU 22 5.262 -1.867 -3.087
156 H CYS 23 H CYS 23 1.108 0.328 -6.070
157 HA CYS 23 HA CYS 23 -0.759 -0.364 -3.900
158 1HB CYS 23 2HB CYS 23 -1.935 0.263 -6.545
159 2HB CYS 23 1HB CYS 23 -2.556 0.591 -4.931
160 HG CYS 23 HG CYS 23 0.071 2.470 -5.346
161 H CYS 24 H CYS 24 -2.208 -2.155 -4.420
162 HA CYS 24 HA CYS 24 -0.750 -4.254 -5.715
163 1HB CYS 24 2HB CYS 24 -3.007 -5.463 -5.010
164 2HB CYS 24 1HB CYS 24 -1.774 -5.047 -3.820
165 H ASP 25 H ASP 25 -2.994 -5.797 -6.502
166 HA ASP 25 HA ASP 25 -3.562 -4.577 -9.110
167 1HB ASP 25 2HB ASP 25 -2.542 -6.946 -8.806
168 2HB ASP 25 1HB ASP 25 -4.167 -7.420 -8.342
169 H THR 26 H THR 26 -5.066 -6.067 -6.328
170 HA THR 26 HA THR 26 -7.667 -5.924 -7.548
171 HB THR 26 HB THR 26 -8.042 -7.008 -5.055
172 HG1 THR 26 1HG THR 26 -6.032 -7.327 -4.342
173 1HG2 THR 26 1HG2 THR 26 -7.994 -9.147 -6.212
174 2HG2 THR 26 2HG2 THR 26 -7.047 -8.440 -7.524
175 3HG2 THR 26 3HG2 THR 26 -8.715 -7.924 -7.263
176 H CYS 27 H CYS 27 -5.903 -4.067 -5.220
177 HA CYS 27 HA CYS 27 -8.345 -2.518 -4.746
178 1HB CYS 27 2HB CYS 27 -6.556 -2.447 -2.453
179 2HB CYS 27 1HB CYS 27 -8.292 -2.716 -2.512
180 HA PRO 28 HA PRO 28 -5.560 0.915 -5.442
181 1HB PRO 28 2HB PRO 28 -6.982 2.943 -4.449
182 2HB PRO 28 1HB PRO 28 -7.549 2.043 -5.860
183 1HG PRO 28 2HG PRO 28 -8.470 1.909 -3.031
184 2HG PRO 28 1HG PRO 28 -9.401 1.726 -4.526
185 1HD PRO 28 2HD PRO 28 -8.424 -0.350 -2.898
186 2HD PRO 28 1HD PRO 28 -9.077 -0.518 -4.539
187 H SER 29 H SER 29 -5.145 -0.685 -3.003
188 HA SER 29 HA SER 29 -4.842 0.967 -0.748
189 1HB SER 29 2HB SER 29 -3.042 -1.308 -0.755
190 2HB SER 29 1HB SER 29 -4.465 -1.012 0.246
191 HG SER 29 HG SER 29 -4.218 -2.414 -2.161
192 H SER 30 H SER 30 -3.630 2.754 -1.003
193 HA SER 30 HA SER 30 -1.117 2.727 -2.365
194 1HB SER 30 2HB SER 30 -1.697 5.019 -0.621
195 2HB SER 30 1HB SER 30 -1.382 4.976 -2.358
196 HG SER 30 HG SER 30 -3.602 5.592 -1.547
197 H TYR 31 H TYR 31 0.662 1.910 -1.495
198 HA TYR 31 HA TYR 31 1.089 2.239 1.403
199 1HB TYR 31 2HB TYR 31 1.232 -0.211 -0.307
200 2HB TYR 31 1HB TYR 31 2.278 -0.080 1.102
201 HD1 TYR 31 1HD TYR 31 -0.772 -1.276 -0.021
202 HD2 TYR 31 2HD TYR 31 0.963 0.730 3.301
203 HE1 TYR 31 1HE TYR 31 -2.600 -2.081 1.410
204 HE2 TYR 31 2HE TYR 31 -0.859 -0.067 4.744
205 HH TYR 31 HH TYR 31 -2.520 -2.269 4.557
206 H HIS 32 H HIS 32 3.378 1.622 1.990
207 HA HIS 32 HA HIS 32 5.286 2.653 0.000
208 1HB HIS 32 2HB HIS 32 5.212 2.838 2.995
209 2HB HIS 32 1HB HIS 32 6.763 2.839 2.166
210 HD2 HIS 32 2HD HIS 32 6.303 4.874 -0.208
211 HE1 HIS 32 1HE HIS 32 4.746 7.460 2.758
212 HE2 HIS 32 2HE HIS 32 5.968 7.343 0.531
213 H ILE 33 H ILE 33 7.290 1.467 -0.145
214 HA ILE 33 HA ILE 33 6.882 -1.320 -0.108
215 HB ILE 33 HB ILE 33 9.087 -1.550 -0.973
216 1HG1 ILE 33 2HG1 ILE 33 9.672 1.318 -0.225
217 1HG2 ILE 33 1HG2 ILE 33 7.617 0.888 -1.887
218 2HG2 ILE 33 2HG2 ILE 33 9.118 0.397 -2.670
219 3HG2 ILE 33 3HG2 ILE 33 7.734 -0.698 -2.652
220 1HD1 ILE 33 1HD1 ILE 33 11.319 0.991 -1.699
221 2HD1 ILE 33 2HD1 ILE 33 12.058 0.059 -0.396
222 3HD1 ILE 33 3HD1 ILE 33 11.145 -0.763 -1.662
223 H HIS 34 H HIS 34 8.122 0.835 2.273
224 HA HIS 34 HA HIS 34 9.237 -1.414 3.800
225 1HB HIS 34 2HB HIS 34 10.473 0.394 5.052
226 2HB HIS 34 1HB HIS 34 10.914 0.220 3.357
227 HD2 HIS 34 2HD HIS 34 10.139 2.941 5.751
228 HE1 HIS 34 1HE HIS 34 9.122 4.460 1.938
229 HE2 HIS 34 2HE HIS 34 9.767 5.069 4.309
230 H CYS 35 H CYS 35 6.422 0.190 3.684
231 HA CYS 35 HA CYS 35 6.185 0.552 6.576
232 1HB CYS 35 2HB CYS 35 4.492 1.495 4.268
233 2HB CYS 35 1HB CYS 35 3.982 1.659 5.948
234 H LEU 36 H LEU 36 5.920 -1.978 4.716
235 HA LEU 36 HA LEU 36 3.490 -2.996 6.029
236 1HB LEU 36 2HB LEU 36 4.882 -4.380 3.763
237 2HB LEU 36 1HB LEU 36 3.231 -4.578 4.317
238 HG LEU 36 HG LEU 36 3.796 -1.878 3.360
239 1HD1 LEU 36 1HD1 LEU 36 3.493 -3.100 0.944
240 2HD1 LEU 36 2HD1 LEU 36 5.013 -2.467 1.579
241 3HD1 LEU 36 3HD1 LEU 36 4.624 -4.177 1.762
242 1HD2 LEU 36 1HD2 LEU 36 1.776 -3.654 2.134
243 2HD2 LEU 36 2HD2 LEU 36 1.595 -3.304 3.854
244 3HD2 LEU 36 3HD2 LEU 36 1.639 -1.984 2.685
245 H ARG 37 H ARG 37 3.638 -5.347 6.594
246 HA ARG 37 HA ARG 37 5.974 -5.839 8.184
247 1HB ARG 37 2HB ARG 37 3.448 -7.332 7.613
248 2HB ARG 37 1HB ARG 37 4.807 -8.195 8.320
249 1HG ARG 37 2HG ARG 37 4.038 -7.522 10.286
250 2HG ARG 37 1HG ARG 37 4.639 -5.918 9.858
251 1HD ARG 37 2HD ARG 37 2.202 -6.045 8.578
252 2HD ARG 37 1HD ARG 37 1.904 -6.893 10.095
253 HE ARG 37 HE ARG 37 2.454 -4.075 9.737
254 1HH1 ARG 37 2HH1 ARG 37 2.344 -6.770 11.987
255 2HH1 ARG 37 1HH1 ARG 37 2.278 -5.749 13.398
256 1HH2 ARG 37 2HH2 ARG 37 2.324 -2.739 11.586
257 2HH2 ARG 37 1HH2 ARG 37 2.250 -3.465 13.165
258 HA PRO 38 HA PRO 38 7.104 -8.913 4.676
259 1HB PRO 38 2HB PRO 38 5.246 -8.713 2.493
260 2HB PRO 38 1HB PRO 38 5.550 -10.108 3.530
261 1HG PRO 38 2HG PRO 38 3.193 -8.686 3.485
262 2HG PRO 38 1HG PRO 38 3.750 -9.665 4.851
263 1HD PRO 38 2HD PRO 38 3.923 -6.705 4.445
264 2HD PRO 38 1HD PRO 38 3.540 -7.621 5.919
265 H ALA 39 H ALA 39 8.019 -6.518 4.959
266 HA ALA 39 HA ALA 39 7.604 -4.636 2.939
267 1HB ALA 39 1HB ALA 39 9.027 -3.334 4.105
268 2HB ALA 39 2HB ALA 39 8.843 -4.595 5.325
269 3HB ALA 39 3HB ALA 39 10.241 -4.606 4.250
270 H LEU 40 H LEU 40 8.944 -3.905 1.282
271 HA LEU 40 HA LEU 40 10.662 -5.979 0.097
272 1HB LEU 40 2HB LEU 40 9.308 -3.724 -1.379
273 2HB LEU 40 1HB LEU 40 10.103 -5.127 -2.067
274 HG LEU 40 HG LEU 40 8.098 -6.214 -0.483
275 1HD1 LEU 40 1HD1 LEU 40 7.374 -3.584 -0.810
276 2HD1 LEU 40 2HD1 LEU 40 6.526 -4.396 -2.126
277 3HD1 LEU 40 3HD1 LEU 40 6.280 -4.922 -0.461
278 1HD2 LEU 40 1HD2 LEU 40 7.035 -6.701 -2.690
279 2HD2 LEU 40 2HD2 LEU 40 8.234 -5.644 -3.436
280 3HD2 LEU 40 3HD2 LEU 40 8.749 -7.107 -2.600
281 H TYR 41 H TYR 41 12.646 -5.343 -0.771
282 HA TYR 41 HA TYR 41 13.683 -2.899 0.440
283 1HB TYR 41 2HB TYR 41 15.054 -5.289 -0.799
284 2HB TYR 41 1HB TYR 41 15.917 -3.866 -0.214
285 HD1 TYR 41 1HD TYR 41 14.445 -3.217 2.235
286 HD2 TYR 41 2HD TYR 41 15.617 -7.002 0.688
287 HE1 TYR 41 1HE TYR 41 14.406 -4.149 4.509
288 HE2 TYR 41 2HE TYR 41 15.595 -7.944 2.961
289 HH TYR 41 HH TYR 41 14.353 -6.117 5.694
290 H GLU 42 H GLU 42 12.279 -3.671 -2.373
291 HA GLU 42 HA GLU 42 13.483 -1.345 -3.653
292 1HB GLU 42 2HB GLU 42 13.854 -4.006 -4.621
293 2HB GLU 42 1HB GLU 42 12.781 -3.168 -5.732
294 1HG GLU 42 2HG GLU 42 15.619 -2.594 -5.042
295 2HG GLU 42 1HG GLU 42 14.846 -2.710 -6.621
296 H VAL 43 H VAL 43 12.008 -0.606 -5.501
297 HA VAL 43 HA VAL 43 9.292 -0.747 -4.464
298 HB VAL 43 HB VAL 43 10.252 1.464 -4.928
299 1HG1 VAL 43 1HG1 VAL 43 10.979 0.274 -7.423
300 2HG1 VAL 43 2HG1 VAL 43 9.979 1.697 -7.715
301 3HG1 VAL 43 3HG1 VAL 43 11.449 1.835 -6.752
302 1HG2 VAL 43 1HG2 VAL 43 8.191 1.634 -6.914
303 2HG2 VAL 43 2HG2 VAL 43 7.712 0.521 -5.632
304 3HG2 VAL 43 3HG2 VAL 43 8.179 2.176 -5.236
305 HA PRO 44 HA PRO 44 8.307 -3.729 -7.592
306 1HB PRO 44 2HB PRO 44 5.624 -3.748 -6.469
307 2HB PRO 44 1HB PRO 44 6.860 -5.007 -6.408
308 1HG PRO 44 2HG PRO 44 6.067 -3.599 -4.221
309 2HG PRO 44 1HG PRO 44 7.699 -4.264 -4.408
310 1HD PRO 44 2HD PRO 44 6.736 -1.461 -4.835
311 2HD PRO 44 1HD PRO 44 8.230 -2.035 -4.063
312 H ASP 45 H ASP 45 8.102 -2.821 -9.560
313 HA ASP 45 HA ASP 45 5.812 -1.034 -10.040
314 1HB ASP 45 2HB ASP 45 8.343 -0.461 -10.590
315 2HB ASP 45 1HB ASP 45 8.002 -1.392 -12.045
316 H GLY 46 H GLY 46 6.316 -4.146 -10.101
317 1HA GLY 46 1HA GLY 46 5.100 -4.613 -12.744
318 2HA GLY 46 2HA GLY 46 6.019 -5.805 -11.837
319 H GLU 47 H GLU 47 5.043 -6.897 -10.114
320 HA GLU 47 HA GLU 47 2.127 -6.533 -9.914
321 1HB GLU 47 2HB GLU 47 3.628 -9.159 -9.867
322 2HB GLU 47 1HB GLU 47 1.893 -8.965 -9.663
323 1HG GLU 47 2HG GLU 47 1.772 -9.361 -11.850
324 2HG GLU 47 1HG GLU 47 2.331 -7.701 -12.042
325 H TRP 48 H TRP 48 1.220 -6.718 -7.898
326 HA TRP 48 HA TRP 48 2.793 -7.571 -5.629
327 1HB TRP 48 2HB TRP 48 3.537 -5.222 -6.007
328 2HB TRP 48 1HB TRP 48 1.871 -4.692 -5.801
329 HD1 TRP 48 HD TRP 48 4.473 -6.696 -3.706
330 HE1 TRP 48 1HE TRP 48 4.184 -6.011 -1.236
331 HE3 TRP 48 3HE TRP 48 0.550 -3.461 -4.223
332 HZ2 TRP 48 2HZ TRP 48 2.506 -4.317 0.280
333 HZ3 TRP 48 3HZ TRP 48 -0.339 -2.348 -2.217
334 HH2 TRP 48 HH TRP 48 0.621 -2.770 -0.012
335 H GLN 49 H GLN 49 1.549 -7.702 -3.685
336 HA GLN 49 HA GLN 49 -1.354 -7.406 -3.980
337 1HB GLN 49 2HB GLN 49 -0.175 -9.841 -4.235
338 2HB GLN 49 1HB GLN 49 -0.408 -9.785 -2.494
339 1HG GLN 49 2HG GLN 49 -2.337 -10.801 -3.221
340 2HG GLN 49 1HG GLN 49 -2.830 -9.114 -3.079
341 1HE2 GLN 49 1HE2 GLN 49 -3.956 -8.382 -4.696
342 2HE2 GLN 49 2HE2 GLN 49 -3.881 -8.944 -6.338
343 H CYS 50 H CYS 50 -2.156 -6.308 -2.282
344 HA CYS 50 HA CYS 50 -0.472 -5.784 0.004
345 1HB CYS 50 2HB CYS 50 -1.986 -4.097 0.589
346 2HB CYS 50 1HB CYS 50 -2.075 -4.113 -1.168
347 HA PRO 51 HA PRO 51 -2.240 -8.742 2.775
348 1HB PRO 51 2HB PRO 51 -2.407 -6.803 4.954
349 2HB PRO 51 1HB PRO 51 -1.314 -8.176 4.766
350 1HG PRO 51 2HG PRO 51 -0.467 -5.611 4.610
351 2HG PRO 51 1HG PRO 51 0.285 -6.926 3.689
352 1HD PRO 51 2HD PRO 51 -1.697 -4.870 2.776
353 2HD PRO 51 1HD PRO 51 -0.252 -5.491 1.948
354 H ARG 52 H ARG 52 -3.964 -6.189 1.650
355 HA ARG 52 HA ARG 52 -6.375 -6.897 3.197
356 1HB ARG 52 2HB ARG 52 -5.379 -4.515 3.323
357 2HB ARG 52 1HB ARG 52 -5.999 -4.323 1.691
358 1HG ARG 52 2HG ARG 52 -8.256 -5.042 2.696
359 2HG ARG 52 1HG ARG 52 -7.505 -4.672 4.250
360 1HD ARG 52 2HD ARG 52 -8.153 -2.563 3.900
361 2HD ARG 52 1HD ARG 52 -6.856 -2.487 2.709
362 HE ARG 52 HE ARG 52 -9.674 -2.494 2.206
363 1HH1 ARG 52 2HH1 ARG 52 -6.539 -3.263 0.842
364 2HH1 ARG 52 1HH1 ARG 52 -7.109 -3.270 -0.796
365 1HH2 ARG 52 2HH2 ARG 52 -10.415 -2.470 0.039
366 2HH2 ARG 52 1HH2 ARG 52 -9.308 -2.830 -1.248
367 H CYS 53 H CYS 53 -4.912 -7.463 0.349
368 HA CYS 53 HA CYS 53 -6.830 -6.986 -1.641
369 1HB CYS 53 2HB CYS 53 -4.550 -8.887 -1.298
370 2HB CYS 53 1HB CYS 53 -5.678 -9.167 -2.616
371 H THR 54 H THR 54 -6.390 -9.633 0.629
372 HA THR 54 HA THR 54 -8.643 -11.092 -0.500
373 HB THR 54 HB THR 54 -7.889 -12.712 1.449
374 HG1 THR 54 1HG THR 54 -5.457 -11.329 0.901
375 1HG2 THR 54 1HG2 THR 54 -6.209 -13.692 -0.109
376 2HG2 THR 54 2HG2 THR 54 -6.352 -12.243 -1.104
377 3HG2 THR 54 3HG2 THR 54 -7.745 -13.303 -0.886
378 H CYS 55 H CYS 55 -8.667 -8.565 1.323
379 HA CYS 55 HA CYS 55 -10.495 -9.633 3.366
380 1HB CYS 55 2HB CYS 55 -9.251 -6.885 3.365
381 2HB CYS 55 1HB CYS 55 -10.022 -7.727 4.707
382 HG CYS 55 HG CYS 55 -7.891 -9.792 4.475
383 HA PRO 56 HA PRO 56 -13.384 -7.550 0.583
384 1HB PRO 56 2HB PRO 56 -15.423 -9.246 0.899
385 2HB PRO 56 1HB PRO 56 -14.004 -9.693 -0.057
386 1HG PRO 56 2HG PRO 56 -14.736 -10.475 2.731
387 2HG PRO 56 1HG PRO 56 -14.001 -11.452 1.448
388 1HD PRO 56 2HD PRO 56 -12.621 -10.236 3.532
389 2HD PRO 56 1HD PRO 56 -11.898 -10.789 2.010
390 H ALA 57 H ALA 57 -16.154 -8.154 1.610
391 HA ALA 57 HA ALA 57 -17.755 -7.169 2.863
392 1HB ALA 57 1HB ALA 57 -15.668 -7.841 4.735
393 2HB ALA 57 2HB ALA 57 -16.532 -6.389 5.245
394 3HB ALA 57 3HB ALA 57 -17.419 -7.882 4.939
395 H LEU 58 H LEU 58 -16.274 -5.591 1.050
396 HA LEU 58 HA LEU 58 -15.799 -3.035 2.343
397 1HB LEU 58 2HB LEU 58 -15.743 -3.701 -0.601
398 2HB LEU 58 1HB LEU 58 -15.078 -2.271 0.168
399 HG LEU 58 HG LEU 58 -14.074 -5.042 0.787
400 1HD1 LEU 58 1HD1 LEU 58 -12.149 -3.912 -0.769
401 2HD1 LEU 58 2HD1 LEU 58 -13.323 -5.108 -1.318
402 3HD1 LEU 58 3HD1 LEU 58 -13.623 -3.391 -1.585
403 1HD2 LEU 58 1HD2 LEU 58 -13.649 -2.999 2.289
404 2HD2 LEU 58 2HD2 LEU 58 -12.269 -3.984 1.802
405 3HD2 LEU 58 3HD2 LEU 58 -12.585 -2.450 0.992
406 H LYS 59 H LYS 59 -18.369 -4.705 0.952
407 HA LYS 59 HA LYS 59 -20.481 -4.187 0.344
408 1HB LYS 59 2HB LYS 59 -19.946 -2.861 2.700
409 2HB LYS 59 1HB LYS 59 -20.620 -1.595 1.682
410 1HG LYS 59 2HG LYS 59 -22.332 -3.691 1.244
411 2HG LYS 59 1HG LYS 59 -21.922 -3.868 2.952
412 1HD LYS 59 2HD LYS 59 -23.549 -2.354 3.281
413 2HD LYS 59 1HD LYS 59 -22.333 -1.183 2.764
414 1HE LYS 59 2HE LYS 59 -23.618 -2.389 0.489
415 2HE LYS 59 1HE LYS 59 -24.815 -1.697 1.581
416 1HZ LYS 59 1HZ LYS 59 -23.578 -0.287 -0.277
417 2HZ LYS 59 2HZ LYS 59 -22.482 -0.049 0.998
418 3HZ LYS 59 3HZ LYS 59 -24.108 0.390 1.185
419 H GLY 60 H GLY 60 -18.853 -3.624 -1.666
420 1HA GLY 60 1HA GLY 60 -19.147 -0.910 -2.610
421 2HA GLY 60 2HA GLY 60 -18.487 -2.268 -3.511
422 H LYS 61 H LYS 61 -21.592 -1.274 -2.109
423 HA LYS 61 HA LYS 61 -22.903 -1.637 -4.674
424 1HB LYS 61 2HB LYS 61 -22.862 -3.769 -2.963
425 2HB LYS 61 1HB LYS 61 -24.339 -2.955 -2.461
426 1HG LYS 61 2HG LYS 61 -24.579 -2.948 -5.183
427 2HG LYS 61 1HG LYS 61 -23.762 -4.485 -4.877
428 1HD LYS 61 2HD LYS 61 -25.920 -5.173 -4.630
429 2HD LYS 61 1HD LYS 61 -25.611 -4.645 -2.974
430 1HE LYS 61 2HE LYS 61 -26.489 -2.451 -4.638
431 2HE LYS 61 1HE LYS 61 -27.648 -3.779 -4.665
432 1HZ LYS 61 1HZ LYS 61 -28.345 -3.182 -2.665
433 2HZ LYS 61 2HZ LYS 61 -27.264 -1.873 -2.667
434 3HZ LYS 61 3HZ LYS 61 -26.787 -3.368 -2.017
Start of MODEL 5
1 1H GLY 1 1H GLY 1 -15.278 7.428 15.226
2 2H GLY 1 2H GLY 1 -15.905 6.358 14.070
3 3H GLY 1 3H GLY 1 -14.270 6.799 14.017
4 1HA GLY 1 2HA GLY 1 -14.036 5.769 16.284
5 2HA GLY 1 1HA GLY 1 -15.631 5.080 16.004
6 HA PRO 2 HA PRO 2 -12.237 2.479 13.991
7 1HB PRO 2 2HB PRO 2 -12.051 0.447 15.750
8 2HB PRO 2 1HB PRO 2 -11.109 1.932 15.924
9 1HG PRO 2 2HG PRO 2 -13.602 1.089 17.340
10 2HG PRO 2 1HG PRO 2 -12.177 1.927 17.976
11 1HD PRO 2 2HD PRO 2 -14.527 3.178 17.304
12 2HD PRO 2 1HD PRO 2 -12.944 3.978 17.325
13 H LEU 3 H LEU 3 -13.872 2.115 12.438
14 HA LEU 3 HA LEU 3 -15.928 0.137 13.001
15 1HB LEU 3 2HB LEU 3 -15.395 1.266 10.282
16 2HB LEU 3 1HB LEU 3 -16.913 0.737 10.978
17 HG LEU 3 HG LEU 3 -15.575 3.117 12.174
18 1HD1 LEU 3 1HD1 LEU 3 -17.299 4.131 10.245
19 2HD1 LEU 3 2HD1 LEU 3 -15.537 4.227 10.246
20 3HD1 LEU 3 3HD1 LEU 3 -16.349 2.911 9.397
21 1HD2 LEU 3 1HD2 LEU 3 -18.462 2.465 11.596
22 2HD2 LEU 3 2HD2 LEU 3 -17.639 2.134 13.121
23 3HD2 LEU 3 3HD2 LEU 3 -17.852 3.798 12.577
24 H GLY 4 H GLY 4 -16.132 -1.854 11.971
25 1HA GLY 4 1HA GLY 4 -13.634 -3.138 11.322
26 2HA GLY 4 2HA GLY 4 -15.224 -3.891 11.343
27 H SER 5 H SER 5 -16.058 -1.512 9.582
28 HA SER 5 HA SER 5 -15.904 -2.800 7.076
29 1HB SER 5 2HB SER 5 -16.337 0.043 6.819
30 2HB SER 5 1HB SER 5 -17.493 -1.273 6.607
31 HG SER 5 HG SER 5 -17.764 0.433 8.398
32 H ASP 6 H ASP 6 -14.206 -2.932 5.769
33 HA ASP 6 HA ASP 6 -11.815 -1.474 6.299
34 1HB ASP 6 2HB ASP 6 -11.927 -3.819 5.363
35 2HB ASP 6 1HB ASP 6 -12.403 -3.101 3.824
36 H HIS 7 H HIS 7 -11.139 0.391 5.514
37 HA HIS 7 HA HIS 7 -12.770 1.660 3.433
38 1HB HIS 7 2HB HIS 7 -12.360 2.724 5.756
39 2HB HIS 7 1HB HIS 7 -10.752 3.092 5.142
40 HD2 HIS 7 2HD HIS 7 -11.762 4.002 2.099
41 HE1 HIS 7 1HE HIS 7 -13.860 6.932 4.318
42 HE2 HIS 7 2HE HIS 7 -12.791 6.389 2.086
43 H HIS 8 H HIS 8 -11.959 1.194 1.511
44 HA HIS 8 HA HIS 8 -9.118 1.103 1.011
45 1HB HIS 8 2HB HIS 8 -10.039 0.971 -1.445
46 2HB HIS 8 1HB HIS 8 -10.189 -0.416 -0.375
47 HD2 HIS 8 2HD HIS 8 -12.301 1.561 -2.716
48 HE1 HIS 8 1HE HIS 8 -14.984 -0.176 0.054
49 HE2 HIS 8 2HE HIS 8 -14.751 0.843 -2.250
50 H MET 9 H MET 9 -7.905 2.790 0.455
51 HA MET 9 HA MET 9 -8.973 5.019 -1.031
52 1HB MET 9 2HB MET 9 -9.651 5.787 1.115
53 2HB MET 9 1HB MET 9 -8.143 5.277 1.857
54 1HG MET 9 2HG MET 9 -7.975 7.585 1.742
55 2HG MET 9 1HG MET 9 -7.021 7.013 0.373
56 1HE MET 9 1HE MET 9 -7.907 9.473 -1.944
57 2HE MET 9 2HE MET 9 -7.916 10.226 -0.349
58 3HE MET 9 3HE MET 9 -6.797 8.905 -0.696
59 H GLU 10 H GLU 10 -7.343 6.245 -2.011
60 HA GLU 10 HA GLU 10 -4.895 4.827 -2.373
61 1HB GLU 10 2HB GLU 10 -6.196 6.089 -4.138
62 2HB GLU 10 1HB GLU 10 -5.574 7.569 -3.418
63 1HG GLU 10 2HG GLU 10 -3.462 7.220 -4.181
64 2HG GLU 10 1HG GLU 10 -3.624 5.465 -4.154
65 H PHE 11 H PHE 11 -3.966 4.933 -0.267
66 HA PHE 11 HA PHE 11 -1.949 6.853 -0.057
67 1HB PHE 11 2HB PHE 11 -2.556 8.223 1.748
68 2HB PHE 11 1HB PHE 11 -4.017 8.175 0.771
69 HD1 PHE 11 1HD PHE 11 -2.939 8.192 3.996
70 HD2 PHE 11 2HD PHE 11 -5.508 5.953 1.448
71 HE1 PHE 11 1HE PHE 11 -4.217 7.437 5.957
72 HE2 PHE 11 2HE PHE 11 -6.790 5.193 3.411
73 HZ PHE 11 HZ PHE 11 -6.145 5.934 5.667
74 H CYS 12 H CYS 12 -0.625 6.500 1.960
75 HA CYS 12 HA CYS 12 -0.369 3.724 2.487
76 1HB CYS 12 2HB CYS 12 0.900 6.195 3.592
77 2HB CYS 12 1HB CYS 12 1.111 4.671 4.448
78 HG CYS 12 HG CYS 12 3.160 5.669 2.461
79 H ARG 13 H ARG 13 -1.706 2.582 3.654
80 HA ARG 13 HA ARG 13 -3.693 3.629 5.301
81 1HB ARG 13 2HB ARG 13 -2.550 0.904 4.900
82 2HB ARG 13 1HB ARG 13 -3.651 1.161 6.247
83 1HG ARG 13 2HG ARG 13 -5.382 1.920 4.733
84 2HG ARG 13 1HG ARG 13 -4.277 1.772 3.364
85 1HD ARG 13 2HD ARG 13 -4.061 -0.649 3.881
86 2HD ARG 13 1HD ARG 13 -5.294 -0.451 5.123
87 HE ARG 13 HE ARG 13 -5.831 0.103 2.274
88 1HH1 ARG 13 2HH1 ARG 13 -6.638 -1.428 5.320
89 2HH1 ARG 13 1HH1 ARG 13 -8.172 -2.039 4.752
90 1HH2 ARG 13 2HH2 ARG 13 -7.814 -0.744 1.511
91 2HH2 ARG 13 1HH2 ARG 13 -8.837 -1.656 2.593
92 H VAL 14 H VAL 14 -0.394 2.877 6.066
93 HA VAL 14 HA VAL 14 -0.921 3.124 8.944
94 HB VAL 14 HB VAL 14 1.816 2.516 7.953
95 1HG1 VAL 14 1HG1 VAL 14 0.922 0.731 9.944
96 2HG1 VAL 14 2HG1 VAL 14 2.058 2.070 10.108
97 3HG1 VAL 14 3HG1 VAL 14 0.337 2.336 10.384
98 1HG2 VAL 14 1HG2 VAL 14 -0.537 0.842 7.371
99 2HG2 VAL 14 2HG2 VAL 14 1.035 0.912 6.574
100 3HG2 VAL 14 3HG2 VAL 14 0.847 0.002 8.074
101 H CYS 15 H CYS 15 1.724 4.089 6.789
102 HA CYS 15 HA CYS 15 2.442 6.337 8.374
103 1HB CYS 15 2HB CYS 15 3.861 6.375 5.980
104 2HB CYS 15 1HB CYS 15 4.355 5.620 7.498
105 H LYS 16 H LYS 16 -0.111 6.146 6.534
106 HA LYS 16 HA LYS 16 -1.416 7.614 5.315
107 1HB LYS 16 2HB LYS 16 -0.377 9.075 7.725
108 2HB LYS 16 1HB LYS 16 -1.623 9.760 6.689
109 1HG LYS 16 2HG LYS 16 -2.971 7.693 7.095
110 2HG LYS 16 1HG LYS 16 -1.767 7.225 8.299
111 1HD LYS 16 2HD LYS 16 -2.240 9.677 9.180
112 2HD LYS 16 1HD LYS 16 -3.783 9.408 8.367
113 1HE LYS 16 2HE LYS 16 -3.101 7.083 9.875
114 2HE LYS 16 1HE LYS 16 -2.966 8.501 10.913
115 1HZ LYS 16 1HZ LYS 16 -5.339 8.023 9.217
116 2HZ LYS 16 2HZ LYS 16 -5.191 9.071 10.542
117 3HZ LYS 16 3HZ LYS 16 -5.217 7.390 10.786
118 H ASP 17 H ASP 17 0.964 7.556 3.938
119 HA ASP 17 HA ASP 17 1.386 10.393 3.263
120 1HB ASP 17 2HB ASP 17 3.598 9.700 2.389
121 2HB ASP 17 1HB ASP 17 3.425 9.363 4.108
122 H GLY 18 H GLY 18 2.068 10.726 0.963
123 1HA GLY 18 1HA GLY 18 0.882 8.788 -0.893
124 2HA GLY 18 2HA GLY 18 0.272 10.439 -0.906
125 H GLY 19 H GLY 19 1.012 10.290 -3.189
126 1HA GLY 19 1HA GLY 19 2.548 11.580 -4.503
127 2HA GLY 19 2HA GLY 19 3.806 11.221 -3.328
128 H GLU 20 H GLU 20 5.239 9.722 -3.873
129 HA GLU 20 HA GLU 20 4.770 8.081 -6.225
130 1HB GLU 20 2HB GLU 20 7.124 8.660 -4.473
131 2HB GLU 20 1HB GLU 20 7.135 7.196 -5.446
132 1HG GLU 20 2HG GLU 20 7.708 9.883 -6.216
133 2HG GLU 20 1HG GLU 20 7.885 8.397 -7.143
134 H LEU 21 H LEU 21 2.905 7.252 -4.895
135 HA LEU 21 HA LEU 21 3.506 5.319 -2.849
136 1HB LEU 21 2HB LEU 21 1.324 6.904 -3.607
137 2HB LEU 21 1HB LEU 21 0.806 5.256 -3.884
138 HG LEU 21 HG LEU 21 0.879 4.708 -1.634
139 1HD1 LEU 21 1HD1 LEU 21 3.217 5.602 -1.324
140 2HD1 LEU 21 2HD1 LEU 21 2.476 7.160 -0.961
141 3HD1 LEU 21 3HD1 LEU 21 2.130 5.760 0.059
142 1HD2 LEU 21 1HD2 LEU 21 0.213 7.290 -0.712
143 2HD2 LEU 21 2HD2 LEU 21 -0.345 7.164 -2.380
144 3HD2 LEU 21 3HD2 LEU 21 -0.871 5.981 -1.181
145 H LEU 22 H LEU 22 3.643 3.175 -3.068
146 HA LEU 22 HA LEU 22 3.357 1.982 -5.718
147 1HB LEU 22 2HB LEU 22 5.284 1.190 -4.659
148 2HB LEU 22 1HB LEU 22 4.500 1.083 -3.094
149 HG LEU 22 HG LEU 22 3.119 -0.829 -4.125
150 1HD1 LEU 22 1HD1 LEU 22 3.455 -0.902 -6.369
151 2HD1 LEU 22 2HD1 LEU 22 5.104 -0.286 -6.255
152 3HD1 LEU 22 3HD1 LEU 22 4.765 -1.974 -5.873
153 1HD2 LEU 22 1HD2 LEU 22 6.011 -1.527 -3.924
154 2HD2 LEU 22 2HD2 LEU 22 5.183 -0.853 -2.520
155 3HD2 LEU 22 3HD2 LEU 22 4.605 -2.351 -3.251
156 H CYS 23 H CYS 23 1.348 1.506 -6.274
157 HA CYS 23 HA CYS 23 -0.670 1.145 -4.267
158 1HB CYS 23 2HB CYS 23 -1.609 0.697 -6.956
159 2HB CYS 23 1HB CYS 23 -1.996 2.008 -5.844
160 HG CYS 23 HG CYS 23 -0.327 3.807 -6.779
161 H CYS 24 H CYS 24 -2.291 -0.515 -4.366
162 HA CYS 24 HA CYS 24 -1.281 -3.182 -4.523
163 1HB CYS 24 2HB CYS 24 -3.113 -2.224 -2.996
164 2HB CYS 24 1HB CYS 24 -4.175 -2.317 -4.391
165 H ASP 25 H ASP 25 -3.493 -4.475 -5.623
166 HA ASP 25 HA ASP 25 -3.605 -3.540 -8.403
167 1HB ASP 25 2HB ASP 25 -2.183 -5.254 -8.899
168 2HB ASP 25 1HB ASP 25 -2.581 -6.148 -7.436
169 H THR 26 H THR 26 -5.052 -5.287 -5.743
170 HA THR 26 HA THR 26 -7.530 -5.542 -7.268
171 HB THR 26 HB THR 26 -7.906 -7.441 -6.175
172 HG1 THR 26 1HG THR 26 -7.238 -6.433 -3.612
173 1HG2 THR 26 1HG2 THR 26 -5.527 -7.274 -4.407
174 2HG2 THR 26 2HG2 THR 26 -5.256 -7.233 -6.150
175 3HG2 THR 26 3HG2 THR 26 -6.096 -8.602 -5.419
176 H CYS 27 H CYS 27 -6.074 -3.529 -4.936
177 HA CYS 27 HA CYS 27 -8.626 -2.157 -4.633
178 1HB CYS 27 2HB CYS 27 -8.531 -1.942 -2.301
179 2HB CYS 27 1HB CYS 27 -8.085 -3.618 -2.578
180 HA PRO 28 HA PRO 28 -6.168 1.383 -5.420
181 1HB PRO 28 2HB PRO 28 -7.502 3.379 -4.233
182 2HB PRO 28 1HB PRO 28 -8.219 2.449 -5.557
183 1HG PRO 28 2HG PRO 28 -8.651 2.176 -2.603
184 2HG PRO 28 1HG PRO 28 -9.848 2.164 -3.913
185 1HD PRO 28 2HD PRO 28 -8.876 -0.103 -2.733
186 2HD PRO 28 1HD PRO 28 -9.459 -0.043 -4.409
187 H SER 29 H SER 29 -6.075 0.145 -2.340
188 HA SER 29 HA SER 29 -4.862 2.280 -0.904
189 1HB SER 29 2HB SER 29 -4.277 -0.598 -0.290
190 2HB SER 29 1HB SER 29 -4.534 0.748 0.820
191 HG SER 29 HG SER 29 -6.402 -0.843 -0.549
192 H SER 30 H SER 30 -2.759 2.903 -0.755
193 HA SER 30 HA SER 30 -0.786 1.324 -2.236
194 1HB SER 30 2HB SER 30 -0.417 4.238 -2.395
195 2HB SER 30 1HB SER 30 -0.235 3.006 -3.645
196 HG SER 30 HG SER 30 -2.772 3.049 -3.228
197 H TYR 31 H TYR 31 1.472 1.896 -1.711
198 HA TYR 31 HA TYR 31 1.773 2.889 1.043
199 1HB TYR 31 2HB TYR 31 2.482 0.156 -0.024
200 2HB TYR 31 1HB TYR 31 3.196 0.799 1.448
201 HD1 TYR 31 1HD TYR 31 1.797 1.161 3.449
202 HD2 TYR 31 2HD TYR 31 0.229 -0.638 -0.073
203 HE1 TYR 31 1HE TYR 31 -0.119 0.313 4.736
204 HE2 TYR 31 2HE TYR 31 -1.689 -1.479 1.205
205 HH TYR 31 HH TYR 31 -1.765 -1.531 4.575
206 H HIS 32 H HIS 32 4.238 2.302 1.596
207 HA HIS 32 HA HIS 32 6.017 3.689 -0.273
208 1HB HIS 32 2HB HIS 32 6.325 2.513 2.511
209 2HB HIS 32 1HB HIS 32 7.728 2.919 1.554
210 HD2 HIS 32 2HD HIS 32 8.504 5.511 1.606
211 HE1 HIS 32 1HE HIS 32 5.505 6.757 4.325
212 HE2 HIS 32 2HE HIS 32 7.554 7.476 3.009
213 H ILE 33 H ILE 33 8.059 1.671 0.940
214 HA ILE 33 HA ILE 33 7.158 -0.792 -0.348
215 HB ILE 33 HB ILE 33 9.439 -1.318 -1.102
216 1HG1 ILE 33 2HG1 ILE 33 10.106 1.559 -0.439
217 1HG2 ILE 33 1HG2 ILE 33 8.061 -0.482 -2.790
218 2HG2 ILE 33 2HG2 ILE 33 8.104 1.157 -2.139
219 3HG2 ILE 33 3HG2 ILE 33 9.533 0.479 -2.923
220 1HD1 ILE 33 1HD1 ILE 33 12.473 0.476 -0.702
221 2HD1 ILE 33 2HD1 ILE 33 11.600 -0.644 -1.749
222 3HD1 ILE 33 3HD1 ILE 33 11.587 1.083 -2.101
223 H HIS 34 H HIS 34 7.479 0.504 2.436
224 HA HIS 34 HA HIS 34 8.642 -1.849 3.734
225 1HB HIS 34 2HB HIS 34 10.386 0.000 3.311
226 2HB HIS 34 1HB HIS 34 9.525 0.923 4.535
227 HD2 HIS 34 2HD HIS 34 10.041 -2.868 5.176
228 HE1 HIS 34 1HE HIS 34 12.670 -0.688 7.675
229 HE2 HIS 34 2HE HIS 34 11.774 -2.993 7.109
230 H CYS 35 H CYS 35 5.976 -0.116 3.541
231 HA CYS 35 HA CYS 35 5.516 0.782 6.197
232 1HB CYS 35 2HB CYS 35 3.236 0.011 4.444
233 2HB CYS 35 1HB CYS 35 3.465 1.459 5.423
234 H LEU 36 H LEU 36 4.615 -2.132 4.434
235 HA LEU 36 HA LEU 36 3.077 -3.147 6.641
236 1HB LEU 36 2HB LEU 36 3.128 -5.210 4.925
237 2HB LEU 36 1HB LEU 36 2.022 -3.858 4.783
238 HG LEU 36 HG LEU 36 4.607 -3.497 3.409
239 1HD1 LEU 36 1HD1 LEU 36 4.017 -4.914 1.529
240 2HD1 LEU 36 2HD1 LEU 36 4.203 -5.879 2.994
241 3HD1 LEU 36 3HD1 LEU 36 2.591 -5.492 2.391
242 1HD2 LEU 36 1HD2 LEU 36 1.745 -2.821 3.048
243 2HD2 LEU 36 2HD2 LEU 36 3.183 -1.816 2.858
244 3HD2 LEU 36 3HD2 LEU 36 2.736 -2.964 1.596
245 H ARG 37 H ARG 37 3.388 -5.689 6.936
246 HA ARG 37 HA ARG 37 5.809 -6.004 8.369
247 1HB ARG 37 2HB ARG 37 3.376 -7.295 8.337
248 2HB ARG 37 1HB ARG 37 4.458 -8.500 7.652
249 1HG ARG 37 2HG ARG 37 4.307 -8.812 10.029
250 2HG ARG 37 1HG ARG 37 5.928 -8.253 9.615
251 1HD ARG 37 2HD ARG 37 4.127 -6.053 10.158
252 2HD ARG 37 1HD ARG 37 4.233 -7.168 11.519
253 HE ARG 37 HE ARG 37 6.837 -6.688 10.664
254 1HH1 ARG 37 2HH1 ARG 37 4.155 -4.855 11.972
255 2HH1 ARG 37 1HH1 ARG 37 5.165 -3.693 12.778
256 1HH2 ARG 37 2HH2 ARG 37 8.184 -5.160 11.721
257 2HH2 ARG 37 1HH2 ARG 37 7.464 -3.870 12.642
258 HA PRO 38 HA PRO 38 7.299 -8.804 4.711
259 1HB PRO 38 2HB PRO 38 5.493 -8.240 2.480
260 2HB PRO 38 1HB PRO 38 5.986 -9.799 3.147
261 1HG PRO 38 2HG PRO 38 3.474 -8.847 3.421
262 2HG PRO 38 1HG PRO 38 4.253 -9.852 4.658
263 1HD PRO 38 2HD PRO 38 3.904 -6.874 4.583
264 2HD PRO 38 1HD PRO 38 3.680 -7.999 5.940
265 H ALA 39 H ALA 39 8.858 -7.182 4.808
266 HA ALA 39 HA ALA 39 8.519 -4.659 3.572
267 1HB ALA 39 1HB ALA 39 11.196 -4.837 3.921
268 2HB ALA 39 2HB ALA 39 10.048 -4.376 5.179
269 3HB ALA 39 3HB ALA 39 10.621 -6.042 5.074
270 H LEU 40 H LEU 40 9.011 -3.938 1.620
271 HA LEU 40 HA LEU 40 10.097 -5.816 -0.344
272 1HB LEU 40 2HB LEU 40 8.810 -3.099 -0.665
273 2HB LEU 40 1HB LEU 40 9.466 -4.037 -1.992
274 HG LEU 40 HG LEU 40 7.247 -4.547 -2.187
275 1HD1 LEU 40 1HD1 LEU 40 6.778 -6.745 -1.055
276 2HD1 LEU 40 2HD1 LEU 40 8.260 -6.668 -2.008
277 3HD1 LEU 40 3HD1 LEU 40 8.337 -6.567 -0.248
278 1HD2 LEU 40 1HD2 LEU 40 6.394 -5.072 0.518
279 2HD2 LEU 40 2HD2 LEU 40 7.059 -3.446 0.358
280 3HD2 LEU 40 3HD2 LEU 40 5.732 -3.961 -0.681
281 H TYR 41 H TYR 41 12.271 -5.829 0.033
282 HA TYR 41 HA TYR 41 13.728 -3.465 0.683
283 1HB TYR 41 2HB TYR 41 14.652 -6.224 -0.131
284 2HB TYR 41 1HB TYR 41 15.738 -4.937 0.385
285 HD1 TYR 41 1HD TYR 41 14.167 -7.792 1.470
286 HD2 TYR 41 2HD TYR 41 14.843 -3.778 2.703
287 HE1 TYR 41 1HE TYR 41 13.834 -8.462 3.812
288 HE2 TYR 41 2HE TYR 41 14.515 -4.438 5.050
289 HH TYR 41 HH TYR 41 14.194 -7.808 5.985
290 H GLU 42 H GLU 42 12.599 -4.763 -2.180
291 HA GLU 42 HA GLU 42 14.065 -2.757 -3.698
292 1HB GLU 42 2HB GLU 42 14.053 -4.510 -5.637
293 2HB GLU 42 1HB GLU 42 15.341 -4.553 -4.440
294 1HG GLU 42 2HG GLU 42 13.329 -6.176 -3.403
295 2HG GLU 42 1HG GLU 42 13.397 -6.559 -5.123
296 H VAL 43 H VAL 43 12.912 -2.234 -5.742
297 HA VAL 43 HA VAL 43 10.135 -1.947 -5.248
298 HB VAL 43 HB VAL 43 10.803 -1.596 -8.052
299 1HG1 VAL 43 1HG1 VAL 43 10.333 0.840 -6.638
300 2HG1 VAL 43 2HG1 VAL 43 9.270 -0.018 -7.754
301 3HG1 VAL 43 3HG1 VAL 43 9.236 -0.403 -6.034
302 1HG2 VAL 43 1HG2 VAL 43 13.077 -1.297 -6.934
303 2HG2 VAL 43 2HG2 VAL 43 12.495 0.031 -7.940
304 3HG2 VAL 43 3HG2 VAL 43 12.387 0.142 -6.183
305 HA PRO 44 HA PRO 44 9.089 -5.979 -6.822
306 1HB PRO 44 2HB PRO 44 6.547 -6.019 -5.954
307 2HB PRO 44 1HB PRO 44 7.916 -6.179 -4.847
308 1HG PRO 44 2HG PRO 44 6.223 -3.783 -5.436
309 2HG PRO 44 1HG PRO 44 6.858 -4.354 -3.883
310 1HD PRO 44 2HD PRO 44 7.981 -2.328 -5.363
311 2HD PRO 44 1HD PRO 44 8.870 -3.326 -4.195
312 H ASP 45 H ASP 45 9.329 -5.002 -9.025
313 HA ASP 45 HA ASP 45 7.072 -3.893 -10.354
314 1HB ASP 45 2HB ASP 45 9.165 -3.426 -11.352
315 2HB ASP 45 1HB ASP 45 9.650 -5.120 -11.323
316 H GLY 46 H GLY 46 5.405 -4.858 -11.363
317 1HA GLY 46 1HA GLY 46 4.769 -6.887 -12.723
318 2HA GLY 46 2HA GLY 46 5.384 -7.810 -11.359
319 H GLU 47 H GLU 47 3.680 -8.721 -10.405
320 HA GLU 47 HA GLU 47 1.265 -7.100 -9.991
321 1HB GLU 47 2HB GLU 47 1.504 -10.052 -9.445
322 2HB GLU 47 1HB GLU 47 0.045 -9.105 -9.693
323 1HG GLU 47 2HG GLU 47 0.087 -9.468 -11.875
324 2HG GLU 47 1HG GLU 47 1.772 -8.963 -11.993
325 H TRP 48 H TRP 48 1.440 -5.969 -8.158
326 HA TRP 48 HA TRP 48 2.410 -7.389 -5.762
327 1HB TRP 48 2HB TRP 48 3.766 -5.398 -6.423
328 2HB TRP 48 1HB TRP 48 2.333 -4.395 -6.216
329 HD1 TRP 48 HD TRP 48 4.722 -6.605 -4.131
330 HE1 TRP 48 1HE TRP 48 4.674 -5.769 -1.696
331 HE3 TRP 48 3HE TRP 48 1.060 -3.066 -4.557
332 HZ2 TRP 48 2HZ TRP 48 3.271 -3.864 -0.159
333 HZ3 TRP 48 3HZ TRP 48 0.423 -1.780 -2.558
334 HH2 TRP 48 HH TRP 48 1.504 -2.173 -0.405
335 H GLN 49 H GLN 49 1.172 -7.377 -3.937
336 HA GLN 49 HA GLN 49 -1.438 -6.029 -4.093
337 1HB GLN 49 2HB GLN 49 -1.468 -8.578 -2.635
338 2HB GLN 49 1HB GLN 49 -2.636 -7.921 -3.771
339 1HG GLN 49 2HG GLN 49 -0.141 -8.788 -5.014
340 2HG GLN 49 1HG GLN 49 -1.031 -10.079 -4.208
341 1HE2 GLN 49 1HE2 GLN 49 -1.692 -7.287 -6.295
342 2HE2 GLN 49 2HE2 GLN 49 -2.815 -8.108 -7.330
343 H CYS 50 H CYS 50 -2.178 -5.157 -2.211
344 HA CYS 50 HA CYS 50 -0.301 -4.557 -0.193
345 1HB CYS 50 2HB CYS 50 -2.022 -3.278 0.786
346 2HB CYS 50 1HB CYS 50 -2.359 -3.229 -0.942
347 HA PRO 51 HA PRO 51 -0.786 -7.756 2.843
348 1HB PRO 51 2HB PRO 51 -1.151 -6.422 5.191
349 2HB PRO 51 1HB PRO 51 0.409 -6.535 4.365
350 1HG PRO 51 2HG PRO 51 -1.590 -4.309 4.349
351 2HG PRO 51 1HG PRO 51 0.177 -4.228 4.485
352 1HD PRO 51 2HD PRO 51 -1.106 -3.734 2.163
353 2HD PRO 51 1HD PRO 51 0.492 -4.509 2.212
354 H ARG 52 H ARG 52 -3.411 -5.763 2.111
355 HA ARG 52 HA ARG 52 -5.225 -7.143 3.949
356 1HB ARG 52 2HB ARG 52 -5.242 -4.576 3.070
357 2HB ARG 52 1HB ARG 52 -6.347 -5.315 1.919
358 1HG ARG 52 2HG ARG 52 -6.967 -6.202 4.575
359 2HG ARG 52 1HG ARG 52 -6.904 -4.440 4.518
360 1HD ARG 52 2HD ARG 52 -9.072 -4.748 3.889
361 2HD ARG 52 1HD ARG 52 -8.300 -4.822 2.306
362 HE ARG 52 HE ARG 52 -9.003 -7.240 3.859
363 1HH1 ARG 52 2HH1 ARG 52 -8.870 -5.428 0.860
364 2HH1 ARG 52 1HH1 ARG 52 -9.501 -6.729 -0.107
365 1HH2 ARG 52 2HH2 ARG 52 -9.831 -8.956 2.583
366 2HH2 ARG 52 1HH2 ARG 52 -10.056 -8.729 0.876
367 H CYS 53 H CYS 53 -4.825 -6.590 0.451
368 HA CYS 53 HA CYS 53 -6.702 -8.673 -0.234
369 1HB CYS 53 2HB CYS 53 -4.685 -7.325 -2.043
370 2HB CYS 53 1HB CYS 53 -6.127 -8.205 -2.532
371 H THR 54 H THR 54 -3.301 -8.235 -1.042
372 HA THR 54 HA THR 54 -1.645 -9.699 -1.553
373 HB THR 54 HB THR 54 -1.915 -11.468 0.688
374 HG1 THR 54 1HG THR 54 -2.590 -8.741 1.099
375 1HG2 THR 54 1HG2 THR 54 0.136 -10.457 -0.484
376 2HG2 THR 54 2HG2 THR 54 0.175 -10.584 1.275
377 3HG2 THR 54 3HG2 THR 54 -0.171 -9.032 0.510
378 H CYS 55 H CYS 55 -2.794 -12.435 0.139
379 HA CYS 55 HA CYS 55 -3.450 -13.718 -2.423
380 1HB CYS 55 2HB CYS 55 -2.526 -15.464 -0.246
381 2HB CYS 55 1HB CYS 55 -2.070 -15.446 -1.947
382 HG CYS 55 HG CYS 55 -0.619 -13.897 0.684
383 HA PRO 56 HA PRO 56 -7.297 -14.147 -0.117
384 1HB PRO 56 2HB PRO 56 -8.452 -14.864 -2.696
385 2HB PRO 56 1HB PRO 56 -8.790 -13.463 -1.677
386 1HG PRO 56 2HG PRO 56 -7.503 -13.266 -4.048
387 2HG PRO 56 1HG PRO 56 -7.184 -12.173 -2.688
388 1HD PRO 56 2HD PRO 56 -5.618 -14.556 -3.615
389 2HD PRO 56 1HD PRO 56 -5.035 -12.969 -3.066
390 H ALA 57 H ALA 57 -6.036 -16.137 0.650
391 HA ALA 57 HA ALA 57 -6.266 -18.633 -0.592
392 1HB ALA 57 1HB ALA 57 -4.736 -18.552 1.154
393 2HB ALA 57 2HB ALA 57 -5.881 -17.785 2.255
394 3HB ALA 57 3HB ALA 57 -6.065 -19.488 1.838
395 H LEU 58 H LEU 58 -8.430 -16.923 1.590
396 HA LEU 58 HA LEU 58 -10.596 -18.695 0.734
397 1HB LEU 58 2HB LEU 58 -9.482 -18.830 3.299
398 2HB LEU 58 1HB LEU 58 -10.956 -17.901 3.496
399 HG LEU 58 HG LEU 58 -11.300 -20.324 1.885
400 1HD1 LEU 58 1HD1 LEU 58 -11.182 -21.863 3.758
401 2HD1 LEU 58 2HD1 LEU 58 -9.605 -21.131 3.456
402 3HD1 LEU 58 3HD1 LEU 58 -10.593 -20.569 4.802
403 1HD2 LEU 58 1HD2 LEU 58 -12.918 -18.590 3.182
404 2HD2 LEU 58 2HD2 LEU 58 -13.376 -20.235 2.746
405 3HD2 LEU 58 3HD2 LEU 58 -12.797 -19.883 4.376
406 H LYS 59 H LYS 59 -9.473 -15.871 0.445
407 HA LYS 59 HA LYS 59 -10.225 -13.771 0.078
408 1HB LYS 59 2HB LYS 59 -12.279 -15.422 -0.736
409 2HB LYS 59 1HB LYS 59 -13.085 -14.303 0.354
410 1HG LYS 59 2HG LYS 59 -11.622 -12.574 -1.104
411 2HG LYS 59 1HG LYS 59 -11.905 -13.844 -2.296
412 1HD LYS 59 2HD LYS 59 -13.863 -12.831 -2.663
413 2HD LYS 59 1HD LYS 59 -14.371 -13.550 -1.134
414 1HE LYS 59 2HE LYS 59 -12.939 -11.202 -0.513
415 2HE LYS 59 1HE LYS 59 -14.053 -10.794 -1.816
416 1HZ LYS 59 1HZ LYS 59 -14.622 -11.169 0.906
417 2HZ LYS 59 2HZ LYS 59 -15.434 -12.374 0.034
418 3HZ LYS 59 3HZ LYS 59 -15.686 -10.737 -0.343
419 H GLY 60 H GLY 60 -9.427 -14.150 2.585
420 1HA GLY 60 1HA GLY 60 -9.899 -12.204 4.147
421 2HA GLY 60 2HA GLY 60 -11.504 -12.908 4.273
422 H LYS 61 H LYS 61 -10.826 -15.600 4.372
423 HA LYS 61 HA LYS 61 -9.945 -15.776 7.117
424 1HB LYS 61 2HB LYS 61 -11.345 -17.529 5.194
425 2HB LYS 61 1HB LYS 61 -10.316 -18.356 6.356
426 1HG LYS 61 2HG LYS 61 -11.589 -16.771 8.050
427 2HG LYS 61 1HG LYS 61 -12.815 -16.824 6.781
428 1HD LYS 61 2HD LYS 61 -13.378 -18.608 8.178
429 2HD LYS 61 1HD LYS 61 -12.486 -19.373 6.862
430 1HE LYS 61 2HE LYS 61 -10.594 -18.604 8.807
431 2HE LYS 61 1HE LYS 61 -11.923 -19.380 9.666
432 1HZ LYS 61 1HZ LYS 61 -10.800 -21.232 9.118
433 2HZ LYS 61 2HZ LYS 61 -9.998 -20.514 7.812
434 3HZ LYS 61 3HZ LYS 61 -11.592 -21.064 7.629
Start of MODEL 6
1 1H GLY 1 1H GLY 1 -13.739 4.349 2.732
2 2H GLY 1 2H GLY 1 -14.149 3.579 1.277
3 3H GLY 1 3H GLY 1 -13.786 2.657 2.651
4 1HA GLY 1 2HA GLY 1 -16.033 2.534 2.754
5 2HA GLY 1 1HA GLY 1 -15.761 4.002 3.685
6 HA PRO 2 HA PRO 2 -18.845 5.088 0.422
7 1HB PRO 2 2HB PRO 2 -20.179 6.882 1.992
8 2HB PRO 2 1HB PRO 2 -20.552 5.157 1.943
9 1HG PRO 2 2HG PRO 2 -18.948 6.693 3.944
10 2HG PRO 2 1HG PRO 2 -20.111 5.382 4.206
11 1HD PRO 2 2HD PRO 2 -17.437 4.987 4.265
12 2HD PRO 2 1HD PRO 2 -18.572 3.743 3.706
13 H LEU 3 H LEU 3 -16.643 6.894 2.377
14 HA LEU 3 HA LEU 3 -16.737 9.116 0.444
15 1HB LEU 3 2HB LEU 3 -15.638 9.107 3.258
16 2HB LEU 3 1HB LEU 3 -15.619 10.472 2.160
17 HG LEU 3 HG LEU 3 -18.146 9.180 3.181
18 1HD1 LEU 3 1HD1 LEU 3 -18.004 11.657 4.318
19 2HD1 LEU 3 2HD1 LEU 3 -17.606 10.142 5.129
20 3HD1 LEU 3 3HD1 LEU 3 -16.327 11.116 4.399
21 1HD2 LEU 3 1HD2 LEU 3 -18.253 11.943 2.321
22 2HD2 LEU 3 2HD2 LEU 3 -17.716 10.873 1.029
23 3HD2 LEU 3 3HD2 LEU 3 -19.252 10.572 1.840
24 H GLY 4 H GLY 4 -14.314 10.225 0.758
25 1HA GLY 4 1HA GLY 4 -12.543 8.235 -0.400
26 2HA GLY 4 2HA GLY 4 -12.230 9.959 -0.257
27 H SER 5 H SER 5 -12.962 7.376 2.062
28 HA SER 5 HA SER 5 -10.407 7.906 3.391
29 1HB SER 5 2HB SER 5 -12.213 7.367 5.471
30 2HB SER 5 1HB SER 5 -11.440 8.912 5.113
31 HG SER 5 HG SER 5 -13.909 7.993 4.033
32 H ASP 6 H ASP 6 -9.395 6.138 4.107
33 HA ASP 6 HA ASP 6 -8.831 3.953 4.341
34 1HB ASP 6 2HB ASP 6 -10.966 4.231 5.947
35 2HB ASP 6 1HB ASP 6 -11.614 3.033 4.829
36 H HIS 7 H HIS 7 -9.550 4.926 1.747
37 HA HIS 7 HA HIS 7 -10.190 2.344 0.500
38 1HB HIS 7 2HB HIS 7 -11.952 4.493 0.488
39 2HB HIS 7 1HB HIS 7 -11.138 4.615 -1.069
40 HD2 HIS 7 2HD HIS 7 -11.134 1.865 -2.355
41 HE1 HIS 7 1HE HIS 7 -15.047 1.271 -0.860
42 HE2 HIS 7 2HE HIS 7 -13.248 0.355 -2.391
43 H HIS 8 H HIS 8 -9.816 5.329 -1.250
44 HA HIS 8 HA HIS 8 -7.058 4.575 -1.948
45 1HB HIS 8 2HB HIS 8 -8.661 4.375 -3.872
46 2HB HIS 8 1HB HIS 8 -8.983 6.098 -3.720
47 HD2 HIS 8 2HD HIS 8 -5.998 3.736 -4.684
48 HE1 HIS 8 1HE HIS 8 -5.279 7.620 -6.204
49 HE2 HIS 8 2HE HIS 8 -4.351 5.271 -5.981
50 H MET 9 H MET 9 -5.543 6.210 -1.934
51 HA MET 9 HA MET 9 -6.293 8.953 -1.482
52 1HB MET 9 2HB MET 9 -5.054 9.120 0.684
53 2HB MET 9 1HB MET 9 -6.540 8.182 0.789
54 1HG MET 9 2HG MET 9 -4.429 6.400 0.170
55 2HG MET 9 1HG MET 9 -3.897 7.433 1.497
56 1HE MET 9 1HE MET 9 -4.602 4.258 1.057
57 2HE MET 9 2HE MET 9 -5.921 3.683 2.077
58 3HE MET 9 3HE MET 9 -6.269 4.402 0.505
59 H GLU 10 H GLU 10 -4.269 10.324 -1.214
60 HA GLU 10 HA GLU 10 -2.269 9.272 -3.059
61 1HB GLU 10 2HB GLU 10 -3.022 12.021 -2.113
62 2HB GLU 10 1HB GLU 10 -1.484 11.745 -2.920
63 1HG GLU 10 2HG GLU 10 -4.088 10.892 -4.138
64 2HG GLU 10 1HG GLU 10 -3.439 12.519 -4.345
65 H PHE 11 H PHE 11 -2.285 8.283 -0.386
66 HA PHE 11 HA PHE 11 0.481 8.610 0.223
67 1HB PHE 11 2HB PHE 11 0.234 9.378 2.532
68 2HB PHE 11 1HB PHE 11 -0.388 10.583 1.414
69 HD1 PHE 11 1HD PHE 11 -2.833 10.927 1.202
70 HD2 PHE 11 2HD PHE 11 -1.161 8.336 4.138
71 HE1 PHE 11 1HE PHE 11 -4.947 10.993 2.462
72 HE2 PHE 11 2HE PHE 11 -3.273 8.396 5.399
73 HZ PHE 11 HZ PHE 11 -5.169 9.725 4.563
74 H CYS 12 H CYS 12 1.140 7.110 1.972
75 HA CYS 12 HA CYS 12 -0.442 4.695 1.744
76 1HB CYS 12 2HB CYS 12 1.530 3.662 1.969
77 2HB CYS 12 1HB CYS 12 2.297 5.242 2.043
78 HG CYS 12 HG CYS 12 3.086 5.124 4.461
79 H ARG 13 H ARG 13 -1.855 4.014 3.174
80 HA ARG 13 HA ARG 13 -2.838 5.672 5.132
81 1HB ARG 13 2HB ARG 13 -4.009 3.484 5.953
82 2HB ARG 13 1HB ARG 13 -4.382 4.148 4.370
83 1HG ARG 13 2HG ARG 13 -2.877 2.541 3.326
84 2HG ARG 13 1HG ARG 13 -2.462 1.890 4.914
85 1HD ARG 13 2HD ARG 13 -5.231 1.913 3.715
86 2HD ARG 13 1HD ARG 13 -4.143 0.525 3.721
87 HE ARG 13 HE ARG 13 -4.236 0.881 6.278
88 1HH1 ARG 13 2HH1 ARG 13 -6.900 1.255 4.015
89 2HH1 ARG 13 1HH1 ARG 13 -8.130 1.026 5.229
90 1HH2 ARG 13 2HH2 ARG 13 -5.846 0.545 7.860
91 2HH2 ARG 13 1HH2 ARG 13 -7.526 0.618 7.415
92 H VAL 14 H VAL 14 -0.208 3.501 5.453
93 HA VAL 14 HA VAL 14 -0.463 3.088 8.271
94 HB VAL 14 HB VAL 14 1.849 2.571 6.398
95 1HG1 VAL 14 1HG1 VAL 14 1.716 1.154 8.977
96 2HG1 VAL 14 2HG1 VAL 14 3.111 1.762 8.086
97 3HG1 VAL 14 3HG1 VAL 14 2.141 2.864 9.066
98 1HG2 VAL 14 1HG2 VAL 14 0.535 0.288 7.605
99 2HG2 VAL 14 2HG2 VAL 14 -0.582 1.274 6.660
100 3HG2 VAL 14 3HG2 VAL 14 0.878 0.629 5.908
101 H CYS 15 H CYS 15 2.203 4.685 6.493
102 HA CYS 15 HA CYS 15 2.861 6.126 8.910
103 1HB CYS 15 2HB CYS 15 4.960 6.560 7.944
104 2HB CYS 15 1HB CYS 15 4.539 4.949 7.376
105 H LYS 16 H LYS 16 0.840 6.703 6.396
106 HA LYS 16 HA LYS 16 -0.345 8.498 5.707
107 1HB LYS 16 2HB LYS 16 1.063 9.792 8.030
108 2HB LYS 16 1HB LYS 16 -0.080 10.665 7.018
109 1HG LYS 16 2HG LYS 16 -1.073 8.096 7.998
110 2HG LYS 16 1HG LYS 16 -0.719 9.272 9.264
111 1HD LYS 16 2HD LYS 16 -2.040 10.917 7.752
112 2HD LYS 16 1HD LYS 16 -2.682 9.448 7.012
113 1HE LYS 16 2HE LYS 16 -2.875 8.995 9.746
114 2HE LYS 16 1HE LYS 16 -3.334 10.687 9.547
115 1HZ LYS 16 1HZ LYS 16 -5.226 9.159 9.377
116 2HZ LYS 16 2HZ LYS 16 -4.513 8.418 8.028
117 3HZ LYS 16 3HZ LYS 16 -4.995 10.043 7.948
118 H ASP 17 H ASP 17 2.853 8.184 5.258
119 HA ASP 17 HA ASP 17 3.423 10.738 4.064
120 1HB ASP 17 2HB ASP 17 4.972 8.669 5.002
121 2HB ASP 17 1HB ASP 17 5.120 8.489 3.258
122 H GLY 18 H GLY 18 3.500 11.254 1.905
123 1HA GLY 18 1HA GLY 18 2.030 9.388 0.162
124 2HA GLY 18 2HA GLY 18 2.116 11.134 -0.053
125 H GLY 19 H GLY 19 3.070 11.456 -1.952
126 1HA GLY 19 1HA GLY 19 4.985 11.675 -3.301
127 2HA GLY 19 2HA GLY 19 5.775 10.430 -2.341
128 H GLU 20 H GLU 20 6.386 9.056 -3.945
129 HA GLU 20 HA GLU 20 4.292 8.034 -5.731
130 1HB GLU 20 2HB GLU 20 7.215 8.338 -5.934
131 2HB GLU 20 1HB GLU 20 6.594 6.809 -6.542
132 1HG GLU 20 2HG GLU 20 6.787 8.536 -8.284
133 2HG GLU 20 1HG GLU 20 5.139 7.946 -8.078
134 H LEU 21 H LEU 21 3.206 6.506 -4.710
135 HA LEU 21 HA LEU 21 4.567 4.739 -2.848
136 1HB LEU 21 2HB LEU 21 1.620 4.740 -3.365
137 2HB LEU 21 1HB LEU 21 2.481 4.353 -1.888
138 HG LEU 21 HG LEU 21 2.907 7.112 -2.682
139 1HD1 LEU 21 1HD1 LEU 21 0.195 6.049 -2.839
140 2HD1 LEU 21 2HD1 LEU 21 0.362 7.403 -1.722
141 3HD1 LEU 21 3HD1 LEU 21 0.849 7.587 -3.408
142 1HD2 LEU 21 1HD2 LEU 21 1.466 6.386 -0.218
143 2HD2 LEU 21 2HD2 LEU 21 3.071 5.685 -0.418
144 3HD2 LEU 21 3HD2 LEU 21 2.863 7.436 -0.452
145 H LEU 22 H LEU 22 3.678 2.485 -2.699
146 HA LEU 22 HA LEU 22 3.541 1.260 -5.373
147 1HB LEU 22 2HB LEU 22 5.526 0.583 -4.156
148 2HB LEU 22 1HB LEU 22 4.573 0.195 -2.739
149 HG LEU 22 HG LEU 22 3.433 -1.569 -4.252
150 1HD1 LEU 22 1HD1 LEU 22 5.079 -0.420 -6.159
151 2HD1 LEU 22 2HD1 LEU 22 5.900 -1.926 -5.735
152 3HD1 LEU 22 3HD1 LEU 22 4.226 -1.956 -6.298
153 1HD2 LEU 22 1HD2 LEU 22 4.918 -3.189 -3.482
154 2HD2 LEU 22 2HD2 LEU 22 6.314 -2.122 -3.639
155 3HD2 LEU 22 3HD2 LEU 22 5.140 -1.856 -2.347
156 H CYS 23 H CYS 23 1.446 0.929 -5.803
157 HA CYS 23 HA CYS 23 -0.335 0.261 -3.571
158 1HB CYS 23 2HB CYS 23 -1.576 0.998 -6.122
159 2HB CYS 23 1HB CYS 23 -1.868 1.623 -4.503
160 HG CYS 23 HG CYS 23 0.795 2.569 -6.438
161 H CYS 24 H CYS 24 -2.022 -1.238 -3.812
162 HA CYS 24 HA CYS 24 -1.325 -3.673 -5.026
163 1HB CYS 24 2HB CYS 24 -2.707 -3.474 -3.028
164 2HB CYS 24 1HB CYS 24 -3.956 -2.656 -3.944
165 H ASP 25 H ASP 25 -2.653 -4.865 -6.559
166 HA ASP 25 HA ASP 25 -3.576 -3.147 -8.757
167 1HB ASP 25 2HB ASP 25 -1.716 -4.892 -9.094
168 2HB ASP 25 1HB ASP 25 -2.993 -6.094 -8.966
169 H THR 26 H THR 26 -4.704 -5.081 -6.261
170 HA THR 26 HA THR 26 -7.184 -5.688 -7.730
171 HB THR 26 HB THR 26 -7.704 -7.249 -5.825
172 HG1 THR 26 1HG THR 26 -5.146 -6.364 -5.029
173 1HG2 THR 26 1HG2 THR 26 -6.995 -8.397 -7.685
174 2HG2 THR 26 2HG2 THR 26 -5.757 -8.870 -6.520
175 3HG2 THR 26 3HG2 THR 26 -5.417 -7.607 -7.705
176 H CYS 27 H CYS 27 -5.899 -4.222 -4.792
177 HA CYS 27 HA CYS 27 -8.512 -2.913 -4.412
178 1HB CYS 27 2HB CYS 27 -6.648 -2.893 -2.131
179 2HB CYS 27 1HB CYS 27 -8.384 -3.182 -2.168
180 HA PRO 28 HA PRO 28 -6.358 0.820 -5.223
181 1HB PRO 28 2HB PRO 28 -8.301 2.402 -3.789
182 2HB PRO 28 1HB PRO 28 -8.174 2.139 -5.528
183 1HG PRO 28 2HG PRO 28 -10.223 1.183 -3.987
184 2HG PRO 28 1HG PRO 28 -9.702 0.443 -5.512
185 1HD PRO 28 2HD PRO 28 -9.074 -0.365 -2.695
186 2HD PRO 28 1HD PRO 28 -9.451 -1.382 -4.105
187 H SER 29 H SER 29 -5.468 -0.505 -2.759
188 HA SER 29 HA SER 29 -5.225 1.611 -0.804
189 1HB SER 29 2HB SER 29 -3.600 -0.734 -0.292
190 2HB SER 29 1HB SER 29 -4.947 -0.083 0.641
191 HG SER 29 HG SER 29 -4.901 -2.243 -0.910
192 H SER 30 H SER 30 -3.676 3.058 -0.849
193 HA SER 30 HA SER 30 -1.282 2.671 -2.431
194 1HB SER 30 2HB SER 30 -1.239 5.082 -0.879
195 2HB SER 30 1HB SER 30 -1.433 4.903 -2.625
196 HG SER 30 HG SER 30 -3.273 5.878 -1.932
197 H TYR 31 H TYR 31 0.514 1.825 -1.598
198 HA TYR 31 HA TYR 31 0.927 1.991 1.313
199 1HB TYR 31 2HB TYR 31 0.620 -0.326 -0.447
200 2HB TYR 31 1HB TYR 31 2.064 -0.404 0.553
201 HD1 TYR 31 1HD TYR 31 -1.470 -0.894 0.435
202 HD2 TYR 31 2HD TYR 31 1.776 -0.112 3.069
203 HE1 TYR 31 1HE TYR 31 -2.811 -1.719 2.327
204 HE2 TYR 31 2HE TYR 31 0.446 -0.927 4.963
205 HH TYR 31 HH TYR 31 -1.420 -1.975 5.582
206 H HIS 32 H HIS 32 3.199 1.185 1.867
207 HA HIS 32 HA HIS 32 5.167 2.094 -0.116
208 1HB HIS 32 2HB HIS 32 5.052 2.524 2.852
209 2HB HIS 32 1HB HIS 32 6.612 2.412 2.049
210 HD2 HIS 32 2HD HIS 32 6.244 4.263 -0.489
211 HE1 HIS 32 1HE HIS 32 4.694 7.127 2.214
212 HE2 HIS 32 2HE HIS 32 5.901 6.791 -0.006
213 H ILE 33 H ILE 33 7.076 0.804 -0.219
214 HA ILE 33 HA ILE 33 6.684 -1.941 -0.008
215 HB ILE 33 HB ILE 33 9.249 -2.075 -0.143
216 1HG1 ILE 33 2HG1 ILE 33 9.479 0.636 -1.125
217 1HG2 ILE 33 1HG2 ILE 33 7.668 -2.236 -2.053
218 2HG2 ILE 33 2HG2 ILE 33 7.849 -0.498 -2.291
219 3HG2 ILE 33 3HG2 ILE 33 9.243 -1.563 -2.479
220 1HD1 ILE 33 1HD1 ILE 33 11.096 0.223 1.146
221 2HD1 ILE 33 2HD1 ILE 33 11.068 -1.288 0.228
222 3HD1 ILE 33 3HD1 ILE 33 11.563 0.214 -0.556
223 H HIS 34 H HIS 34 7.833 0.293 2.383
224 HA HIS 34 HA HIS 34 8.672 -1.920 4.112
225 1HB HIS 34 2HB HIS 34 9.823 -0.066 5.406
226 2HB HIS 34 1HB HIS 34 10.438 -0.353 3.781
227 HD2 HIS 34 2HD HIS 34 9.028 2.455 5.920
228 HE1 HIS 34 1HE HIS 34 9.134 3.856 1.934
229 HE2 HIS 34 2HE HIS 34 8.524 4.433 4.323
230 H CYS 35 H CYS 35 6.016 0.005 3.658
231 HA CYS 35 HA CYS 35 5.440 0.299 6.507
232 1HB CYS 35 2HB CYS 35 4.055 1.399 4.058
233 2HB CYS 35 1HB CYS 35 3.491 1.653 5.707
234 H LEU 36 H LEU 36 5.468 -2.305 5.700
235 HA LEU 36 HA LEU 36 2.817 -3.094 6.434
236 1HB LEU 36 2HB LEU 36 3.112 -4.849 4.360
237 2HB LEU 36 1HB LEU 36 2.056 -3.451 4.359
238 HG LEU 36 HG LEU 36 4.292 -2.272 3.480
239 1HD1 LEU 36 1HD1 LEU 36 5.381 -4.614 3.624
240 2HD1 LEU 36 2HD1 LEU 36 4.498 -4.927 2.130
241 3HD1 LEU 36 3HD1 LEU 36 5.670 -3.611 2.203
242 1HD2 LEU 36 1HD2 LEU 36 2.953 -1.915 1.752
243 2HD2 LEU 36 2HD2 LEU 36 3.080 -3.600 1.244
244 3HD2 LEU 36 3HD2 LEU 36 1.850 -3.122 2.413
245 H ARG 37 H ARG 37 2.782 -5.652 6.314
246 HA ARG 37 HA ARG 37 4.732 -6.560 8.108
247 1HB ARG 37 2HB ARG 37 2.335 -7.450 7.587
248 2HB ARG 37 1HB ARG 37 3.155 -8.460 6.406
249 1HG ARG 37 2HG ARG 37 4.687 -9.037 8.471
250 2HG ARG 37 1HG ARG 37 3.248 -8.546 9.370
251 1HD ARG 37 2HD ARG 37 2.511 -10.628 9.056
252 2HD ARG 37 1HD ARG 37 2.237 -10.161 7.378
253 HE ARG 37 HE ARG 37 4.911 -10.965 7.680
254 1HH1 ARG 37 2HH1 ARG 37 1.690 -12.344 7.757
255 2HH1 ARG 37 1HH1 ARG 37 2.214 -13.910 7.205
256 1HH2 ARG 37 2HH2 ARG 37 5.595 -12.999 6.907
257 2HH2 ARG 37 1HH2 ARG 37 4.428 -14.274 6.675
258 HA PRO 38 HA PRO 38 6.986 -8.817 4.581
259 1HB PRO 38 2HB PRO 38 6.132 -8.730 2.046
260 2HB PRO 38 1HB PRO 38 5.421 -9.842 3.223
261 1HG PRO 38 2HG PRO 38 4.363 -7.259 2.168
262 2HG PRO 38 1HG PRO 38 3.495 -8.750 2.574
263 1HD PRO 38 2HD PRO 38 3.671 -6.495 4.189
264 2HD PRO 38 1HD PRO 38 3.224 -8.120 4.739
265 H ALA 39 H ALA 39 8.011 -6.677 5.322
266 HA ALA 39 HA ALA 39 8.135 -4.441 3.648
267 1HB ALA 39 1HB ALA 39 8.864 -3.964 5.765
268 2HB ALA 39 2HB ALA 39 9.818 -5.442 5.893
269 3HB ALA 39 3HB ALA 39 10.402 -4.098 4.911
270 H LEU 40 H LEU 40 9.186 -3.977 1.873
271 HA LEU 40 HA LEU 40 11.250 -5.852 0.915
272 1HB LEU 40 2HB LEU 40 9.646 -4.178 -0.961
273 2HB LEU 40 1HB LEU 40 10.408 -5.733 -1.236
274 HG LEU 40 HG LEU 40 8.333 -6.000 0.739
275 1HD1 LEU 40 1HD1 LEU 40 7.496 -4.785 -1.889
276 2HD1 LEU 40 2HD1 LEU 40 6.411 -5.499 -0.695
277 3HD1 LEU 40 3HD1 LEU 40 7.330 -4.047 -0.296
278 1HD2 LEU 40 1HD2 LEU 40 8.043 -7.936 -0.331
279 2HD2 LEU 40 2HD2 LEU 40 7.901 -7.154 -1.905
280 3HD2 LEU 40 3HD2 LEU 40 9.494 -7.496 -1.231
281 H TYR 41 H TYR 41 12.262 -4.497 -1.186
282 HA TYR 41 HA TYR 41 13.184 -1.933 -0.056
283 1HB TYR 41 2HB TYR 41 14.828 -4.033 -1.485
284 2HB TYR 41 1HB TYR 41 15.421 -2.442 -1.017
285 HD1 TYR 41 1HD TYR 41 15.253 -1.865 1.518
286 HD2 TYR 41 2HD TYR 41 15.068 -5.822 -0.032
287 HE1 TYR 41 1HE TYR 41 15.878 -2.753 3.727
288 HE2 TYR 41 2HE TYR 41 15.691 -6.721 2.170
289 HH TYR 41 HH TYR 41 15.386 -5.301 4.886
290 H GLU 42 H GLU 42 11.122 -1.750 -1.705
291 HA GLU 42 HA GLU 42 10.322 -0.737 -3.567
292 1HB GLU 42 2HB GLU 42 13.168 0.201 -3.535
293 2HB GLU 42 1HB GLU 42 12.164 0.551 -4.936
294 1HG GLU 42 2HG GLU 42 11.315 2.290 -3.881
295 2HG GLU 42 1HG GLU 42 10.662 1.217 -2.644
296 H VAL 43 H VAL 43 10.638 -3.343 -3.813
297 HA VAL 43 HA VAL 43 12.139 -3.829 -6.208
298 HB VAL 43 HB VAL 43 10.966 -6.179 -4.965
299 1HG1 VAL 43 1HG1 VAL 43 13.481 -5.330 -6.242
300 2HG1 VAL 43 2HG1 VAL 43 13.628 -6.581 -5.007
301 3HG1 VAL 43 3HG1 VAL 43 12.578 -6.837 -6.402
302 1HG2 VAL 43 1HG2 VAL 43 13.244 -5.341 -3.371
303 2HG2 VAL 43 2HG2 VAL 43 11.869 -4.247 -3.187
304 3HG2 VAL 43 3HG2 VAL 43 11.678 -5.971 -2.860
305 HA PRO 44 HA PRO 44 7.930 -5.819 -7.486
306 1HB PRO 44 2HB PRO 44 5.799 -5.205 -5.907
307 2HB PRO 44 1HB PRO 44 6.811 -6.634 -5.652
308 1HG PRO 44 2HG PRO 44 6.918 -3.971 -4.283
309 2HG PRO 44 1HG PRO 44 7.009 -5.593 -3.572
310 1HD PRO 44 2HD PRO 44 9.231 -4.106 -4.016
311 2HD PRO 44 1HD PRO 44 9.228 -5.869 -4.199
312 H ASP 45 H ASP 45 6.244 -4.909 -8.742
313 HA ASP 45 HA ASP 45 5.313 -2.252 -8.496
314 1HB ASP 45 2HB ASP 45 7.355 -1.343 -9.151
315 2HB ASP 45 1HB ASP 45 7.730 -2.693 -10.214
316 H GLY 46 H GLY 46 3.399 -2.292 -9.475
317 1HA GLY 46 1HA GLY 46 1.825 -2.686 -11.145
318 2HA GLY 46 2HA GLY 46 3.053 -3.539 -12.072
319 H GLU 47 H GLU 47 3.838 -5.599 -10.828
320 HA GLU 47 HA GLU 47 1.472 -7.232 -10.389
321 1HB GLU 47 2HB GLU 47 4.351 -8.129 -10.261
322 2HB GLU 47 1HB GLU 47 2.925 -9.121 -10.524
323 1HG GLU 47 2HG GLU 47 2.699 -8.446 -12.720
324 2HG GLU 47 1HG GLU 47 3.641 -6.976 -12.471
325 H TRP 48 H TRP 48 1.226 -5.691 -8.402
326 HA TRP 48 HA TRP 48 2.275 -7.162 -6.100
327 1HB TRP 48 2HB TRP 48 3.681 -5.108 -6.516
328 2HB TRP 48 1HB TRP 48 2.243 -4.138 -6.206
329 HD1 TRP 48 HD TRP 48 4.559 -6.641 -4.377
330 HE1 TRP 48 1HE TRP 48 4.441 -6.148 -1.851
331 HE3 TRP 48 3HE TRP 48 0.952 -3.027 -4.441
332 HZ2 TRP 48 2HZ TRP 48 2.997 -4.440 -0.123
333 HZ3 TRP 48 3HZ TRP 48 0.255 -2.019 -2.312
334 HH2 TRP 48 HH TRP 48 1.255 -2.710 -0.201
335 H GLN 49 H GLN 49 1.062 -6.725 -4.123
336 HA GLN 49 HA GLN 49 -1.500 -5.431 -4.306
337 1HB GLN 49 2HB GLN 49 -2.853 -7.379 -3.893
338 2HB GLN 49 1HB GLN 49 -1.910 -7.662 -5.349
339 1HG GLN 49 2HG GLN 49 -0.358 -9.049 -4.103
340 2HG GLN 49 1HG GLN 49 -1.244 -8.725 -2.613
341 1HE2 GLN 49 1HE2 GLN 49 -3.724 -9.134 -2.963
342 2HE2 GLN 49 2HE2 GLN 49 -4.095 -10.674 -3.679
343 H CYS 50 H CYS 50 -2.497 -5.224 -2.219
344 HA CYS 50 HA CYS 50 -0.792 -4.794 -0.101
345 1HB CYS 50 2HB CYS 50 -3.475 -5.590 0.775
346 2HB CYS 50 1HB CYS 50 -2.609 -4.086 1.027
347 HA PRO 51 HA PRO 51 -0.364 -8.801 1.869
348 1HB PRO 51 2HB PRO 51 0.166 -8.074 4.391
349 2HB PRO 51 1HB PRO 51 1.320 -7.748 3.092
350 1HG PRO 51 2HG PRO 51 -0.617 -5.897 4.414
351 2HG PRO 51 1HG PRO 51 1.053 -5.593 3.904
352 1HD PRO 51 2HD PRO 51 -1.200 -4.859 2.472
353 2HD PRO 51 1HD PRO 51 0.419 -5.065 1.778
354 H ARG 52 H ARG 52 -3.008 -7.162 1.775
355 HA ARG 52 HA ARG 52 -4.348 -8.413 4.075
356 1HB ARG 52 2HB ARG 52 -5.447 -6.109 2.482
357 2HB ARG 52 1HB ARG 52 -5.886 -6.626 4.104
358 1HG ARG 52 2HG ARG 52 -4.005 -5.671 5.057
359 2HG ARG 52 1HG ARG 52 -3.124 -5.640 3.529
360 1HD ARG 52 2HD ARG 52 -3.891 -3.605 3.042
361 2HD ARG 52 1HD ARG 52 -5.556 -4.090 3.365
362 HE ARG 52 HE ARG 52 -3.661 -2.966 5.311
363 1HH1 ARG 52 2HH1 ARG 52 -6.928 -3.845 4.394
364 2HH1 ARG 52 1HH1 ARG 52 -7.649 -3.146 5.811
365 1HH2 ARG 52 2HH2 ARG 52 -4.594 -2.084 7.196
366 2HH2 ARG 52 1HH2 ARG 52 -6.325 -2.142 7.410
367 H CYS 53 H CYS 53 -4.479 -7.918 0.580
368 HA CYS 53 HA CYS 53 -7.019 -9.225 0.279
369 1HB CYS 53 2HB CYS 53 -5.988 -9.247 -2.202
370 2HB CYS 53 1HB CYS 53 -6.727 -7.815 -1.490
371 H THR 54 H THR 54 -3.808 -10.163 0.678
372 HA THR 54 HA THR 54 -4.006 -12.719 -0.648
373 HB THR 54 HB THR 54 -1.770 -12.734 1.030
374 HG1 THR 54 1HG THR 54 -1.974 -10.181 -0.235
375 1HG2 THR 54 1HG2 THR 54 -2.202 -13.276 -1.515
376 2HG2 THR 54 2HG2 THR 54 -0.586 -12.862 -0.942
377 3HG2 THR 54 3HG2 THR 54 -1.579 -11.640 -1.739
378 H CYS 55 H CYS 55 -6.071 -12.813 0.937
379 HA CYS 55 HA CYS 55 -5.642 -13.531 3.621
380 1HB CYS 55 2HB CYS 55 -8.008 -14.717 2.331
381 2HB CYS 55 1HB CYS 55 -7.889 -13.692 3.757
382 HG CYS 55 HG CYS 55 -8.461 -12.850 0.551
383 HA PRO 56 HA PRO 56 -5.641 -18.111 2.380
384 1HB PRO 56 2HB PRO 56 -6.014 -18.931 -0.136
385 2HB PRO 56 1HB PRO 56 -7.378 -18.451 0.881
386 1HG PRO 56 2HG PRO 56 -6.029 -16.953 -1.313
387 2HG PRO 56 1HG PRO 56 -7.745 -17.006 -0.876
388 1HD PRO 56 2HD PRO 56 -5.949 -14.986 -0.184
389 2HD PRO 56 1HD PRO 56 -7.525 -15.277 0.572
390 H ALA 57 H ALA 57 -3.484 -16.251 2.185
391 HA ALA 57 HA ALA 57 -1.493 -17.966 0.973
392 1HB ALA 57 1HB ALA 57 -1.204 -16.800 -0.895
393 2HB ALA 57 2HB ALA 57 -2.441 -15.643 -0.400
394 3HB ALA 57 3HB ALA 57 -0.761 -15.398 0.079
395 H LEU 58 H LEU 58 0.656 -17.442 1.640
396 HA LEU 58 HA LEU 58 0.721 -16.022 4.199
397 1HB LEU 58 2HB LEU 58 2.536 -17.999 2.849
398 2HB LEU 58 1HB LEU 58 3.119 -17.024 4.184
399 HG LEU 58 HG LEU 58 0.773 -18.067 5.186
400 1HD1 LEU 58 1HD1 LEU 58 0.685 -19.525 3.144
401 2HD1 LEU 58 2HD1 LEU 58 2.161 -20.299 3.720
402 3HD1 LEU 58 3HD1 LEU 58 0.686 -20.383 4.685
403 1HD2 LEU 58 1HD2 LEU 58 3.550 -18.162 5.695
404 2HD2 LEU 58 2HD2 LEU 58 2.223 -18.530 6.798
405 3HD2 LEU 58 3HD2 LEU 58 2.939 -19.812 5.820
406 H LYS 59 H LYS 59 1.234 -13.932 4.130
407 HA LYS 59 HA LYS 59 2.684 -12.910 1.832
408 1HB LYS 59 2HB LYS 59 0.698 -11.887 3.608
409 2HB LYS 59 1HB LYS 59 2.102 -10.832 3.674
410 1HG LYS 59 2HG LYS 59 0.426 -11.547 1.289
411 2HG LYS 59 1HG LYS 59 0.715 -9.956 1.995
412 1HD LYS 59 2HD LYS 59 2.480 -9.654 0.675
413 2HD LYS 59 1HD LYS 59 3.218 -11.139 1.278
414 1HE LYS 59 2HE LYS 59 2.105 -12.449 -0.377
415 2HE LYS 59 1HE LYS 59 1.119 -11.079 -0.881
416 1HZ LYS 59 1HZ LYS 59 3.002 -10.009 -1.804
417 2HZ LYS 59 2HZ LYS 59 3.037 -11.613 -2.356
418 3HZ LYS 59 3HZ LYS 59 4.076 -11.126 -1.113
419 H GLY 60 H GLY 60 4.578 -14.213 2.793
420 1HA GLY 60 1HA GLY 60 6.037 -12.885 4.909
421 2HA GLY 60 2HA GLY 60 6.621 -14.207 3.904
422 H LYS 61 H LYS 61 6.015 -12.982 1.412
423 HA LYS 61 HA LYS 61 7.615 -10.539 1.381
424 1HB LYS 61 2HB LYS 61 8.717 -12.989 0.647
425 2HB LYS 61 1HB LYS 61 8.255 -12.259 -0.883
426 1HG LYS 61 2HG LYS 61 10.530 -11.687 -0.381
427 2HG LYS 61 1HG LYS 61 9.531 -10.238 -0.268
428 1HD LYS 61 2HD LYS 61 9.658 -11.589 2.272
429 2HD LYS 61 1HD LYS 61 11.279 -11.246 1.666
430 1HE LYS 61 2HE LYS 61 10.477 -8.891 1.235
431 2HE LYS 61 1HE LYS 61 9.036 -9.307 2.160
432 1HZ LYS 61 1HZ LYS 61 11.143 -8.239 3.281
433 2HZ LYS 61 2HZ LYS 61 11.637 -9.858 3.380
434 3HZ LYS 61 3HZ LYS 61 10.182 -9.367 4.104
Start of MODEL 7
1 1H GLY 1 1H GLY 1 -10.745 8.121 0.917
2 2H GLY 1 2H GLY 1 -12.146 7.558 1.690
3 3H GLY 1 3H GLY 1 -10.644 6.850 2.035
4 1HA GLY 1 2HA GLY 1 -10.315 9.539 2.534
5 2HA GLY 1 1HA GLY 1 -11.874 9.107 3.220
6 HA PRO 2 HA PRO 2 -8.069 7.766 5.845
7 1HB PRO 2 2HB PRO 2 -8.881 9.994 7.609
8 2HB PRO 2 1HB PRO 2 -7.268 9.523 7.065
9 1HG PRO 2 2HG PRO 2 -8.471 11.715 6.115
10 2HG PRO 2 1HG PRO 2 -7.452 10.695 5.078
11 1HD PRO 2 2HD PRO 2 -10.437 10.839 5.259
12 2HD PRO 2 1HD PRO 2 -9.402 10.685 3.825
13 H LEU 3 H LEU 3 -11.297 8.926 6.646
14 HA LEU 3 HA LEU 3 -11.488 6.817 8.700
15 1HB LEU 3 2HB LEU 3 -13.165 9.318 8.643
16 2HB LEU 3 1HB LEU 3 -12.986 8.169 9.954
17 HG LEU 3 HG LEU 3 -10.727 9.916 8.984
18 1HD1 LEU 3 1HD1 LEU 3 -12.985 10.898 10.119
19 2HD1 LEU 3 2HD1 LEU 3 -12.011 10.543 11.544
20 3HD1 LEU 3 3HD1 LEU 3 -11.384 11.618 10.295
21 1HD2 LEU 3 1HD2 LEU 3 -10.691 9.063 11.739
22 2HD2 LEU 3 2HD2 LEU 3 -10.779 7.684 10.645
23 3HD2 LEU 3 3HD2 LEU 3 -9.472 8.857 10.481
24 H GLY 4 H GLY 4 -11.927 6.056 6.174
25 1HA GLY 4 1HA GLY 4 -13.583 4.709 5.178
26 2HA GLY 4 2HA GLY 4 -14.800 5.522 6.155
27 H SER 5 H SER 5 -15.993 5.659 4.128
28 HA SER 5 HA SER 5 -16.821 6.820 2.363
29 1HB SER 5 2HB SER 5 -15.031 9.139 3.041
30 2HB SER 5 1HB SER 5 -16.671 9.157 2.391
31 HG SER 5 HG SER 5 -17.072 8.007 4.588
32 H ASP 6 H ASP 6 -16.094 5.670 0.681
33 HA ASP 6 HA ASP 6 -15.067 5.295 -1.307
34 1HB ASP 6 2HB ASP 6 -14.879 7.762 -1.566
35 2HB ASP 6 1HB ASP 6 -13.326 7.703 -0.740
36 H HIS 7 H HIS 7 -13.874 3.577 -1.462
37 HA HIS 7 HA HIS 7 -11.806 3.021 0.467
38 1HB HIS 7 2HB HIS 7 -11.704 0.934 -1.309
39 2HB HIS 7 1HB HIS 7 -12.728 0.994 0.120
40 HD2 HIS 7 2HD HIS 7 -13.018 1.537 -3.748
41 HE1 HIS 7 1HE HIS 7 -16.864 0.941 -2.096
42 HE2 HIS 7 2HE HIS 7 -15.527 1.095 -4.245
43 H HIS 8 H HIS 8 -11.877 4.643 -2.429
44 HA HIS 8 HA HIS 8 -9.365 3.743 -3.512
45 1HB HIS 8 2HB HIS 8 -11.502 5.263 -4.466
46 2HB HIS 8 1HB HIS 8 -10.172 6.409 -4.346
47 HD2 HIS 8 2HD HIS 8 -7.717 5.138 -5.612
48 HE1 HIS 8 1HE HIS 8 -10.229 3.551 -8.620
49 HE2 HIS 8 2HE HIS 8 -7.865 4.269 -8.053
50 H MET 9 H MET 9 -7.878 3.934 -1.869
51 HA MET 9 HA MET 9 -7.545 6.424 -0.450
52 1HB MET 9 2HB MET 9 -6.971 3.779 0.108
53 2HB MET 9 1HB MET 9 -5.382 4.471 -0.197
54 1HG MET 9 2HG MET 9 -5.606 6.023 1.549
55 2HG MET 9 1HG MET 9 -7.341 5.739 1.683
56 1HE MET 9 1HE MET 9 -6.641 4.422 5.033
57 2HE MET 9 2HE MET 9 -7.242 5.705 3.982
58 3HE MET 9 3HE MET 9 -8.077 4.153 4.044
59 H GLU 10 H GLU 10 -5.906 7.891 -0.658
60 HA GLU 10 HA GLU 10 -4.141 7.553 -2.995
61 1HB GLU 10 2HB GLU 10 -4.505 10.316 -2.181
62 2HB GLU 10 1HB GLU 10 -4.726 9.582 -3.761
63 1HG GLU 10 2HG GLU 10 -6.845 10.266 -3.422
64 2HG GLU 10 1HG GLU 10 -6.958 8.710 -2.600
65 H PHE 11 H PHE 11 -3.735 6.852 -0.139
66 HA PHE 11 HA PHE 11 -1.113 7.950 0.178
67 1HB PHE 11 2HB PHE 11 -1.431 9.102 2.270
68 2HB PHE 11 1HB PHE 11 -2.564 9.776 1.108
69 HD1 PHE 11 1HD PHE 11 -4.972 8.819 1.158
70 HD2 PHE 11 2HD PHE 11 -2.176 8.402 4.340
71 HE1 PHE 11 1HE PHE 11 -6.820 8.399 2.724
72 HE2 PHE 11 2HE PHE 11 -4.024 7.972 5.908
73 HZ PHE 11 HZ PHE 11 -6.350 7.972 5.101
74 H CYS 12 H CYS 12 -0.106 7.112 2.255
75 HA CYS 12 HA CYS 12 -0.545 4.310 2.466
76 1HB CYS 12 2HB CYS 12 1.161 6.282 3.946
77 2HB CYS 12 1HB CYS 12 0.991 4.641 4.555
78 HG CYS 12 HG CYS 12 3.266 5.577 2.676
79 H ARG 13 H ARG 13 -2.005 3.271 3.629
80 HA ARG 13 HA ARG 13 -3.866 4.550 5.295
81 1HB ARG 13 2HB ARG 13 -4.670 2.331 5.856
82 2HB ARG 13 1HB ARG 13 -4.295 2.420 4.141
83 1HG ARG 13 2HG ARG 13 -2.511 0.999 4.313
84 2HG ARG 13 1HG ARG 13 -2.206 1.415 6.001
85 1HD ARG 13 2HD ARG 13 -3.071 -0.720 6.177
86 2HD ARG 13 1HD ARG 13 -4.500 0.283 6.425
87 HE ARG 13 HE ARG 13 -3.822 -1.091 3.901
88 1HH1 ARG 13 2HH1 ARG 13 -6.154 0.251 6.157
89 2HH1 ARG 13 1HH1 ARG 13 -7.535 -0.258 5.223
90 1HH2 ARG 13 2HH2 ARG 13 -5.626 -1.758 2.680
91 2HH2 ARG 13 1HH2 ARG 13 -7.234 -1.410 3.245
92 H VAL 14 H VAL 14 -0.687 3.606 6.015
93 HA VAL 14 HA VAL 14 -1.239 3.597 8.913
94 HB VAL 14 HB VAL 14 1.393 2.645 7.910
95 1HG1 VAL 14 1HG1 VAL 14 -0.493 1.853 10.110
96 2HG1 VAL 14 2HG1 VAL 14 0.976 0.955 9.727
97 3HG1 VAL 14 3HG1 VAL 14 1.082 2.636 10.251
98 1HG2 VAL 14 1HG2 VAL 14 -1.162 1.352 7.196
99 2HG2 VAL 14 2HG2 VAL 14 0.414 1.268 6.408
100 3HG2 VAL 14 3HG2 VAL 14 0.090 0.295 7.846
101 H CYS 15 H CYS 15 1.558 4.194 6.852
102 HA CYS 15 HA CYS 15 2.584 6.245 8.527
103 1HB CYS 15 2HB CYS 15 4.103 6.077 6.202
104 2HB CYS 15 1HB CYS 15 4.379 5.217 7.721
105 H LYS 16 H LYS 16 0.096 6.583 6.679
106 HA LYS 16 HA LYS 16 -0.938 8.314 5.552
107 1HB LYS 16 2HB LYS 16 0.108 8.988 8.138
108 2HB LYS 16 1HB LYS 16 0.036 10.430 7.136
109 1HG LYS 16 2HG LYS 16 -2.321 8.608 7.297
110 2HG LYS 16 1HG LYS 16 -2.000 9.768 8.586
111 1HD LYS 16 2HD LYS 16 -2.202 10.516 5.675
112 2HD LYS 16 1HD LYS 16 -3.565 10.571 6.795
113 1HE LYS 16 2HE LYS 16 -2.929 12.570 7.497
114 2HE LYS 16 1HE LYS 16 -1.365 11.920 7.986
115 1HZ LYS 16 1HZ LYS 16 -1.786 13.756 6.023
116 2HZ LYS 16 2HZ LYS 16 -1.566 12.319 5.156
117 3HZ LYS 16 3HZ LYS 16 -0.371 12.846 6.243
118 H ASP 17 H ASP 17 1.451 7.816 4.117
119 HA ASP 17 HA ASP 17 2.337 10.547 3.471
120 1HB ASP 17 2HB ASP 17 4.365 9.451 2.519
121 2HB ASP 17 1HB ASP 17 4.169 9.186 4.250
122 H GLY 18 H GLY 18 3.122 10.760 1.162
123 1HA GLY 18 1HA GLY 18 1.473 9.200 -0.710
124 2HA GLY 18 2HA GLY 18 1.398 10.962 -0.748
125 H GLY 19 H GLY 19 2.278 11.286 -2.754
126 1HA GLY 19 1HA GLY 19 4.138 11.849 -4.046
127 2HA GLY 19 2HA GLY 19 5.164 10.999 -2.899
128 H GLU 20 H GLU 20 6.124 9.256 -3.705
129 HA GLU 20 HA GLU 20 4.876 7.891 -5.983
130 1HB GLU 20 2HB GLU 20 7.615 8.409 -5.177
131 2HB GLU 20 1HB GLU 20 7.354 6.695 -5.468
132 1HG GLU 20 2HG GLU 20 6.907 8.968 -7.383
133 2HG GLU 20 1HG GLU 20 8.111 7.687 -7.493
134 H LEU 21 H LEU 21 3.359 6.592 -5.108
135 HA LEU 21 HA LEU 21 4.134 4.884 -2.853
136 1HB LEU 21 2HB LEU 21 1.392 5.547 -3.922
137 2HB LEU 21 1HB LEU 21 1.729 4.580 -2.499
138 HG LEU 21 HG LEU 21 2.883 7.295 -2.478
139 1HD1 LEU 21 1HD1 LEU 21 0.093 6.868 -3.099
140 2HD1 LEU 21 2HD1 LEU 21 0.295 7.711 -1.562
141 3HD1 LEU 21 3HD1 LEU 21 1.017 8.371 -3.030
142 1HD2 LEU 21 1HD2 LEU 21 3.121 5.917 -0.550
143 2HD2 LEU 21 2HD2 LEU 21 1.952 7.177 -0.155
144 3HD2 LEU 21 3HD2 LEU 21 1.398 5.545 -0.530
145 H LEU 22 H LEU 22 3.909 2.706 -2.904
146 HA LEU 22 HA LEU 22 3.545 1.461 -5.525
147 1HB LEU 22 2HB LEU 22 5.380 0.480 -4.499
148 2HB LEU 22 1HB LEU 22 4.671 0.579 -2.901
149 HG LEU 22 HG LEU 22 2.983 -1.189 -3.943
150 1HD1 LEU 22 1HD1 LEU 22 4.043 -2.704 -5.459
151 2HD1 LEU 22 2HD1 LEU 22 4.102 -1.088 -6.163
152 3HD1 LEU 22 3HD1 LEU 22 5.543 -1.776 -5.415
153 1HD2 LEU 22 1HD2 LEU 22 5.715 -1.664 -2.790
154 2HD2 LEU 22 2HD2 LEU 22 4.160 -1.659 -1.959
155 3HD2 LEU 22 3HD2 LEU 22 4.559 -2.965 -3.075
156 H CYS 23 H CYS 23 1.488 1.280 -6.033
157 HA CYS 23 HA CYS 23 -0.462 0.697 -3.931
158 1HB CYS 23 2HB CYS 23 -1.148 1.597 -6.714
159 2HB CYS 23 1HB CYS 23 -2.047 1.840 -5.220
160 HG CYS 23 HG CYS 23 0.950 3.378 -5.831
161 H CYS 24 H CYS 24 -1.658 -1.137 -3.916
162 HA CYS 24 HA CYS 24 -0.857 -3.324 -5.443
163 1HB CYS 24 2HB CYS 24 -3.387 -3.867 -4.419
164 2HB CYS 24 1HB CYS 24 -1.838 -4.175 -3.637
165 H ASP 25 H ASP 25 -2.063 -4.612 -6.912
166 HA ASP 25 HA ASP 25 -3.722 -3.052 -8.760
167 1HB ASP 25 2HB ASP 25 -1.753 -4.683 -9.404
168 2HB ASP 25 1HB ASP 25 -2.987 -5.921 -9.217
169 H THR 26 H THR 26 -3.999 -5.175 -6.201
170 HA THR 26 HA THR 26 -6.426 -6.444 -7.138
171 HB THR 26 HB THR 26 -6.171 -7.470 -4.713
172 HG1 THR 26 1HG THR 26 -4.498 -6.231 -3.917
173 1HG2 THR 26 1HG2 THR 26 -4.613 -9.149 -5.676
174 2HG2 THR 26 2HG2 THR 26 -4.340 -8.065 -7.045
175 3HG2 THR 26 3HG2 THR 26 -5.945 -8.747 -6.761
176 H CYS 27 H CYS 27 -5.517 -3.755 -5.265
177 HA CYS 27 HA CYS 27 -8.257 -3.081 -4.771
178 1HB CYS 27 2HB CYS 27 -8.409 -3.486 -2.566
179 2HB CYS 27 1HB CYS 27 -6.991 -4.507 -2.769
180 HA PRO 28 HA PRO 28 -6.380 0.851 -5.255
181 1HB PRO 28 2HB PRO 28 -8.312 2.505 -4.464
182 2HB PRO 28 1HB PRO 28 -8.551 1.405 -5.828
183 1HG PRO 28 2HG PRO 28 -9.502 1.166 -3.006
184 2HG PRO 28 1HG PRO 28 -10.350 0.773 -4.512
185 1HD PRO 28 2HD PRO 28 -9.059 -1.066 -2.881
186 2HD PRO 28 1HD PRO 28 -9.457 -1.322 -4.590
187 H SER 29 H SER 29 -5.026 -0.056 -3.134
188 HA SER 29 HA SER 29 -5.155 2.158 -1.188
189 1HB SER 29 2HB SER 29 -3.987 -0.608 -0.784
190 2HB SER 29 1HB SER 29 -4.033 0.680 0.420
191 HG SER 29 HG SER 29 -6.138 -0.875 -0.629
192 H SER 30 H SER 30 -2.987 2.796 -0.305
193 HA SER 30 HA SER 30 -0.865 2.495 -2.311
194 1HB SER 30 2HB SER 30 -1.015 5.136 -1.026
195 2HB SER 30 1HB SER 30 -0.739 4.720 -2.716
196 HG SER 30 HG SER 30 -3.077 4.192 -2.718
197 H TYR 31 H TYR 31 1.205 2.392 -1.552
198 HA TYR 31 HA TYR 31 1.659 2.774 1.320
199 1HB TYR 31 2HB TYR 31 2.323 0.263 -0.238
200 2HB TYR 31 1HB TYR 31 2.886 0.606 1.392
201 HD1 TYR 31 1HD TYR 31 1.186 0.779 3.263
202 HD2 TYR 31 2HD TYR 31 0.198 -0.667 -0.620
203 HE1 TYR 31 1HE TYR 31 -0.841 -0.271 4.169
204 HE2 TYR 31 2HE TYR 31 -1.824 -1.727 0.282
205 HH TYR 31 HH TYR 31 -2.980 -2.236 2.099
206 H HIS 32 H HIS 32 4.074 2.104 1.702
207 HA HIS 32 HA HIS 32 5.852 3.689 0.004
208 1HB HIS 32 2HB HIS 32 6.103 2.187 2.615
209 2HB HIS 32 1HB HIS 32 7.547 2.536 1.687
210 HD2 HIS 32 2HD HIS 32 8.598 4.993 2.010
211 HE1 HIS 32 1HE HIS 32 5.688 6.323 4.782
212 HE2 HIS 32 2HE HIS 32 8.060 6.666 3.923
213 H ILE 33 H ILE 33 7.571 1.204 1.201
214 HA ILE 33 HA ILE 33 6.737 -0.836 -0.693
215 HB ILE 33 HB ILE 33 9.032 -1.406 -1.313
216 1HG1 ILE 33 2HG1 ILE 33 9.865 1.133 0.114
217 1HG2 ILE 33 1HG2 ILE 33 8.129 -0.079 -2.955
218 2HG2 ILE 33 2HG2 ILE 33 7.971 1.316 -1.885
219 3HG2 ILE 33 3HG2 ILE 33 9.555 0.863 -2.518
220 1HD1 ILE 33 1HD1 ILE 33 11.149 -0.190 -1.936
221 2HD1 ILE 33 2HD1 ILE 33 11.886 0.919 -0.776
222 3HD1 ILE 33 3HD1 ILE 33 11.918 -0.819 -0.478
223 H HIS 34 H HIS 34 6.828 -0.120 2.348
224 HA HIS 34 HA HIS 34 7.412 -2.789 3.275
225 1HB HIS 34 2HB HIS 34 9.218 -2.199 4.765
226 2HB HIS 34 1HB HIS 34 9.651 -1.721 3.125
227 HD2 HIS 34 2HD HIS 34 9.734 -0.308 6.562
228 HE1 HIS 34 1HE HIS 34 9.580 3.020 3.958
229 HE2 HIS 34 2HE HIS 34 10.246 2.221 6.270
230 H CYS 35 H CYS 35 5.256 -0.537 3.414
231 HA CYS 35 HA CYS 35 5.054 0.197 6.147
232 1HB CYS 35 2HB CYS 35 2.621 -0.020 4.441
233 2HB CYS 35 1HB CYS 35 3.124 1.285 5.516
234 H LEU 36 H LEU 36 4.231 -2.601 4.369
235 HA LEU 36 HA LEU 36 2.394 -3.610 6.381
236 1HB LEU 36 2HB LEU 36 2.958 -5.602 4.468
237 2HB LEU 36 1HB LEU 36 1.498 -4.647 4.633
238 HG LEU 36 HG LEU 36 3.349 -3.013 3.268
239 1HD1 LEU 36 1HD1 LEU 36 4.692 -4.383 2.167
240 2HD1 LEU 36 2HD1 LEU 36 3.823 -5.806 2.744
241 3HD1 LEU 36 3HD1 LEU 36 3.275 -4.964 1.294
242 1HD2 LEU 36 1HD2 LEU 36 1.159 -2.682 2.704
243 2HD2 LEU 36 2HD2 LEU 36 1.680 -3.672 1.340
244 3HD2 LEU 36 3HD2 LEU 36 0.791 -4.407 2.673
245 H ARG 37 H ARG 37 2.784 -6.152 6.655
246 HA ARG 37 HA ARG 37 4.972 -6.426 8.365
247 1HB ARG 37 2HB ARG 37 3.496 -8.708 7.053
248 2HB ARG 37 1HB ARG 37 4.364 -8.736 8.581
249 1HG ARG 37 2HG ARG 37 2.654 -6.872 9.239
250 2HG ARG 37 1HG ARG 37 1.700 -7.589 7.940
251 1HD ARG 37 2HD ARG 37 2.767 -9.688 9.527
252 2HD ARG 37 1HD ARG 37 2.029 -8.504 10.605
253 HE ARG 37 HE ARG 37 0.413 -9.277 8.327
254 1HH1 ARG 37 2HH1 ARG 37 1.221 -9.851 11.678
255 2HH1 ARG 37 1HH1 ARG 37 -0.245 -10.718 12.029
256 1HH2 ARG 37 2HH2 ARG 37 -1.553 -10.365 8.784
257 2HH2 ARG 37 1HH2 ARG 37 -1.839 -10.982 10.388
258 HA PRO 38 HA PRO 38 7.337 -8.826 4.983
259 1HB PRO 38 2HB PRO 38 5.974 -8.614 2.443
260 2HB PRO 38 1HB PRO 38 6.362 -10.071 3.359
261 1HG PRO 38 2HG PRO 38 3.814 -9.165 2.973
262 2HG PRO 38 1HG PRO 38 4.312 -10.133 4.372
263 1HD PRO 38 2HD PRO 38 3.916 -7.170 4.162
264 2HD PRO 38 1HD PRO 38 3.452 -8.280 5.471
265 H ALA 39 H ALA 39 8.574 -6.926 5.322
266 HA ALA 39 HA ALA 39 8.254 -4.595 3.722
267 1HB ALA 39 1HB ALA 39 9.447 -4.932 6.030
268 2HB ALA 39 2HB ALA 39 10.860 -5.240 5.017
269 3HB ALA 39 3HB ALA 39 10.006 -3.702 4.897
270 H LEU 40 H LEU 40 9.112 -4.060 1.796
271 HA LEU 40 HA LEU 40 10.829 -6.076 0.517
272 1HB LEU 40 2HB LEU 40 9.086 -3.956 -0.739
273 2HB LEU 40 1HB LEU 40 10.067 -5.113 -1.617
274 HG LEU 40 HG LEU 40 8.317 -6.509 0.189
275 1HD1 LEU 40 1HD1 LEU 40 6.274 -5.654 -0.161
276 2HD1 LEU 40 2HD1 LEU 40 7.138 -4.167 -0.550
277 3HD1 LEU 40 3HD1 LEU 40 6.623 -5.251 -1.842
278 1HD2 LEU 40 1HD2 LEU 40 9.337 -7.536 -1.731
279 2HD2 LEU 40 2HD2 LEU 40 7.585 -7.556 -1.934
280 3HD2 LEU 40 3HD2 LEU 40 8.561 -6.379 -2.812
281 H TYR 41 H TYR 41 12.770 -5.523 -0.349
282 HA TYR 41 HA TYR 41 13.800 -2.888 0.384
283 1HB TYR 41 2HB TYR 41 15.176 -5.365 -0.674
284 2HB TYR 41 1HB TYR 41 16.008 -3.855 -0.320
285 HD1 TYR 41 1HD TYR 41 13.910 -3.544 2.167
286 HD2 TYR 41 2HD TYR 41 16.821 -6.396 0.937
287 HE1 TYR 41 1HE TYR 41 14.191 -4.256 4.502
288 HE2 TYR 41 2HE TYR 41 17.106 -7.115 3.272
289 HH TYR 41 HH TYR 41 16.083 -5.369 5.875
290 H GLU 42 H GLU 42 12.932 -4.804 -2.362
291 HA GLU 42 HA GLU 42 13.554 -2.532 -4.126
292 1HB GLU 42 2HB GLU 42 13.051 -4.873 -5.668
293 2HB GLU 42 1HB GLU 42 14.536 -3.940 -5.556
294 1HG GLU 42 2HG GLU 42 15.373 -5.907 -4.868
295 2HG GLU 42 1HG GLU 42 14.755 -5.369 -3.307
296 H VAL 43 H VAL 43 11.842 -1.526 -4.911
297 HA VAL 43 HA VAL 43 9.252 -2.224 -4.130
298 HB VAL 43 HB VAL 43 9.648 0.066 -4.520
299 1HG1 VAL 43 1HG1 VAL 43 10.273 0.967 -6.756
300 2HG1 VAL 43 2HG1 VAL 43 11.522 -0.024 -6.002
301 3HG1 VAL 43 3HG1 VAL 43 10.529 -0.691 -7.298
302 1HG2 VAL 43 1HG2 VAL 43 7.454 -1.066 -5.470
303 2HG2 VAL 43 2HG2 VAL 43 7.761 0.661 -5.657
304 3HG2 VAL 43 3HG2 VAL 43 8.084 -0.441 -6.996
305 HA PRO 44 HA PRO 44 8.394 -5.194 -7.372
306 1HB PRO 44 2HB PRO 44 6.082 -6.113 -6.349
307 2HB PRO 44 1HB PRO 44 7.643 -6.525 -5.631
308 1HG PRO 44 2HG PRO 44 5.634 -4.490 -4.760
309 2HG PRO 44 1HG PRO 44 6.597 -5.606 -3.775
310 1HD PRO 44 2HD PRO 44 7.221 -2.956 -4.157
311 2HD PRO 44 1HD PRO 44 8.406 -4.212 -3.758
312 H ASP 45 H ASP 45 8.067 -2.822 -8.380
313 HA ASP 45 HA ASP 45 5.517 -1.750 -8.718
314 1HB ASP 45 2HB ASP 45 7.375 -0.411 -9.318
315 2HB ASP 45 1HB ASP 45 8.012 -1.638 -10.408
316 H GLY 46 H GLY 46 3.778 -2.416 -9.766
317 1HA GLY 46 1HA GLY 46 3.336 -3.235 -12.239
318 2HA GLY 46 2HA GLY 46 4.007 -4.712 -11.563
319 H GLU 47 H GLU 47 2.221 -5.978 -11.642
320 HA GLU 47 HA GLU 47 -0.284 -5.048 -10.483
321 1HB GLU 47 2HB GLU 47 0.249 -7.859 -11.391
322 2HB GLU 47 1HB GLU 47 -1.275 -6.981 -11.357
323 1HG GLU 47 2HG GLU 47 -0.998 -6.311 -13.441
324 2HG GLU 47 1HG GLU 47 0.593 -5.644 -13.071
325 H TRP 48 H TRP 48 1.376 -4.810 -8.565
326 HA TRP 48 HA TRP 48 1.967 -7.106 -7.014
327 1HB TRP 48 2HB TRP 48 3.269 -5.104 -6.738
328 2HB TRP 48 1HB TRP 48 1.835 -4.155 -6.376
329 HD1 TRP 48 HD TRP 48 3.725 -7.157 -4.782
330 HE1 TRP 48 1HE TRP 48 3.665 -6.845 -2.228
331 HE3 TRP 48 3HE TRP 48 0.888 -2.917 -4.562
332 HZ2 TRP 48 2HZ TRP 48 2.528 -5.043 -0.367
333 HZ3 TRP 48 3HZ TRP 48 0.353 -1.966 -2.361
334 HH2 TRP 48 HH TRP 48 1.159 -3.009 -0.308
335 H GLN 49 H GLN 49 0.774 -8.143 -5.493
336 HA GLN 49 HA GLN 49 -1.977 -7.190 -5.110
337 1HB GLN 49 2HB GLN 49 -2.466 -9.309 -5.656
338 2HB GLN 49 1HB GLN 49 -0.784 -9.796 -5.534
339 1HG GLN 49 2HG GLN 49 -1.583 -11.123 -3.908
340 2HG GLN 49 1HG GLN 49 -1.398 -9.668 -2.928
341 1HE2 GLN 49 1HE2 GLN 49 -3.275 -8.355 -2.571
342 2HE2 GLN 49 2HE2 GLN 49 -4.852 -9.064 -2.593
343 H CYS 50 H CYS 50 -2.812 -6.808 -3.127
344 HA CYS 50 HA CYS 50 -1.119 -5.995 -1.102
345 1HB CYS 50 2HB CYS 50 -3.768 -6.786 -0.171
346 2HB CYS 50 1HB CYS 50 -2.961 -5.222 -0.137
347 HA PRO 51 HA PRO 51 -0.710 -9.741 1.354
348 1HB PRO 51 2HB PRO 51 1.573 -8.961 2.558
349 2HB PRO 51 1HB PRO 51 1.568 -9.615 0.918
350 1HG PRO 51 2HG PRO 51 2.058 -6.870 1.817
351 2HG PRO 51 1HG PRO 51 2.439 -7.624 0.261
352 1HD PRO 51 2HD PRO 51 0.165 -5.948 0.981
353 2HD PRO 51 1HD PRO 51 0.675 -6.510 -0.623
354 H ARG 52 H ARG 52 -1.985 -6.878 1.827
355 HA ARG 52 HA ARG 52 -2.126 -7.128 4.735
356 1HB ARG 52 2HB ARG 52 -0.300 -5.465 3.827
357 2HB ARG 52 1HB ARG 52 -1.681 -4.394 3.630
358 1HG ARG 52 2HG ARG 52 -0.512 -4.084 5.776
359 2HG ARG 52 1HG ARG 52 -2.203 -4.548 5.971
360 1HD ARG 52 2HD ARG 52 -0.512 -6.876 5.839
361 2HD ARG 52 1HD ARG 52 0.041 -5.777 7.101
362 HE ARG 52 HE ARG 52 -2.657 -6.962 6.943
363 1HH1 ARG 52 2HH1 ARG 52 -0.047 -5.498 8.775
364 2HH1 ARG 52 1HH1 ARG 52 -0.823 -5.754 10.316
365 1HH2 ARG 52 2HH2 ARG 52 -3.653 -7.326 8.948
366 2HH2 ARG 52 1HH2 ARG 52 -2.866 -6.815 10.416
367 H CYS 53 H CYS 53 -3.369 -5.192 1.944
368 HA CYS 53 HA CYS 53 -5.653 -4.436 3.521
369 1HB CYS 53 2HB CYS 53 -6.091 -3.829 0.803
370 2HB CYS 53 1HB CYS 53 -5.662 -2.721 2.098
371 H THR 54 H THR 54 -4.881 -6.654 0.998
372 HA THR 54 HA THR 54 -7.491 -7.287 0.209
373 HB THR 54 HB THR 54 -4.797 -8.079 -0.419
374 HG1 THR 54 1HG THR 54 -5.997 -7.111 -1.965
375 1HG2 THR 54 1HG2 THR 54 -6.776 -10.270 -0.026
376 2HG2 THR 54 2HG2 THR 54 -5.041 -10.235 0.288
377 3HG2 THR 54 3HG2 THR 54 -5.636 -10.363 -1.369
378 H CYS 55 H CYS 55 -5.597 -8.340 2.907
379 HA CYS 55 HA CYS 55 -6.794 -10.829 3.403
380 1HB CYS 55 2HB CYS 55 -5.975 -9.138 5.712
381 2HB CYS 55 1HB CYS 55 -5.658 -10.839 5.393
382 HG CYS 55 HG CYS 55 -3.777 -10.157 3.296
383 HA PRO 56 HA PRO 56 -10.073 -8.629 6.175
384 1HB PRO 56 2HB PRO 56 -9.903 -5.772 5.518
385 2HB PRO 56 1HB PRO 56 -9.945 -6.555 7.100
386 1HG PRO 56 2HG PRO 56 -7.720 -5.381 6.155
387 2HG PRO 56 1HG PRO 56 -7.659 -6.833 7.172
388 1HD PRO 56 2HD PRO 56 -7.392 -6.590 4.194
389 2HD PRO 56 1HD PRO 56 -6.451 -7.580 5.330
390 H ALA 57 H ALA 57 -9.303 -7.459 2.989
391 HA ALA 57 HA ALA 57 -11.980 -6.772 2.238
392 1HB ALA 57 1HB ALA 57 -9.578 -7.382 0.513
393 2HB ALA 57 2HB ALA 57 -11.089 -6.662 -0.042
394 3HB ALA 57 3HB ALA 57 -10.062 -5.789 1.094
395 H LEU 58 H LEU 58 -9.841 -9.502 1.450
396 HA LEU 58 HA LEU 58 -12.249 -11.122 0.935
397 1HB LEU 58 2HB LEU 58 -9.496 -11.514 -0.245
398 2HB LEU 58 1HB LEU 58 -10.920 -12.478 -0.587
399 HG LEU 58 HG LEU 58 -10.654 -9.548 -1.261
400 1HD1 LEU 58 1HD1 LEU 58 -10.107 -12.031 -2.847
401 2HD1 LEU 58 2HD1 LEU 58 -10.585 -10.526 -3.630
402 3HD1 LEU 58 3HD1 LEU 58 -9.110 -10.587 -2.667
403 1HD2 LEU 58 1HD2 LEU 58 -12.589 -10.287 -2.825
404 2HD2 LEU 58 2HD2 LEU 58 -12.773 -11.614 -1.678
405 3HD2 LEU 58 3HD2 LEU 58 -12.931 -9.946 -1.128
406 H LYS 59 H LYS 59 -9.044 -12.453 1.067
407 HA LYS 59 HA LYS 59 -9.429 -13.317 3.837
408 1HB LYS 59 2HB LYS 59 -9.051 -15.089 1.444
409 2HB LYS 59 1HB LYS 59 -8.385 -15.574 2.996
410 1HG LYS 59 2HG LYS 59 -11.268 -15.083 2.314
411 2HG LYS 59 1HG LYS 59 -10.505 -16.612 2.752
412 1HD LYS 59 2HD LYS 59 -10.598 -16.166 4.958
413 2HD LYS 59 1HD LYS 59 -10.186 -14.465 4.731
414 1HE LYS 59 2HE LYS 59 -12.379 -13.839 4.391
415 2HE LYS 59 1HE LYS 59 -12.869 -15.453 3.875
416 1HZ LYS 59 1HZ LYS 59 -13.779 -15.183 5.991
417 2HZ LYS 59 2HZ LYS 59 -12.373 -14.477 6.624
418 3HZ LYS 59 3HZ LYS 59 -12.400 -16.132 6.260
419 H GLY 60 H GLY 60 -7.451 -13.905 4.894
420 1HA GLY 60 1HA GLY 60 -5.196 -12.387 3.867
421 2HA GLY 60 2HA GLY 60 -5.317 -13.140 5.450
422 H LYS 61 H LYS 61 -3.025 -13.618 4.762
423 HA LYS 61 HA LYS 61 -2.997 -16.308 3.606
424 1HB LYS 61 2HB LYS 61 -1.296 -13.973 2.785
425 2HB LYS 61 1HB LYS 61 -0.672 -15.613 2.659
426 1HG LYS 61 2HG LYS 61 -2.229 -16.216 1.044
427 2HG LYS 61 1HG LYS 61 -3.301 -14.870 1.442
428 1HD LYS 61 2HD LYS 61 -2.365 -13.721 -0.219
429 2HD LYS 61 1HD LYS 61 -0.865 -13.703 0.712
430 1HE LYS 61 2HE LYS 61 -1.207 -16.234 -0.610
431 2HE LYS 61 1HE LYS 61 -1.321 -14.915 -1.773
432 1HZ LYS 61 1HZ LYS 61 0.963 -15.776 -1.411
433 2HZ LYS 61 2HZ LYS 61 0.894 -15.205 0.183
434 3HZ LYS 61 3HZ LYS 61 0.803 -14.115 -1.114
Start of MODEL 8
1 1H GLY 1 1H GLY 1 -2.921 5.322 -7.728
2 2H GLY 1 2H GLY 1 -3.196 5.058 -6.074
3 3H GLY 1 3H GLY 1 -2.325 6.420 -6.583
4 1HA GLY 1 2HA GLY 1 -4.920 6.254 -7.792
5 2HA GLY 1 1HA GLY 1 -4.988 6.346 -6.037
6 HA PRO 2 HA PRO 2 -3.620 10.418 -8.358
7 1HB PRO 2 2HB PRO 2 -6.492 11.000 -8.779
8 2HB PRO 2 1HB PRO 2 -5.122 11.253 -9.864
9 1HG PRO 2 2HG PRO 2 -6.881 9.295 -10.307
10 2HG PRO 2 1HG PRO 2 -5.152 9.061 -10.624
11 1HD PRO 2 2HD PRO 2 -6.799 8.116 -8.310
12 2HD PRO 2 1HD PRO 2 -5.511 7.272 -9.197
13 H LEU 3 H LEU 3 -6.851 10.353 -6.809
14 HA LEU 3 HA LEU 3 -5.746 12.130 -4.726
15 1HB LEU 3 2HB LEU 3 -8.164 12.393 -6.395
16 2HB LEU 3 1HB LEU 3 -8.408 12.699 -4.688
17 HG LEU 3 HG LEU 3 -6.740 14.222 -6.653
18 1HD1 LEU 3 1HD1 LEU 3 -8.378 15.436 -4.495
19 2HD1 LEU 3 2HD1 LEU 3 -8.103 15.976 -6.152
20 3HD1 LEU 3 3HD1 LEU 3 -9.221 14.650 -5.830
21 1HD2 LEU 3 1HD2 LEU 3 -6.351 14.085 -3.674
22 2HD2 LEU 3 2HD2 LEU 3 -5.142 13.941 -4.949
23 3HD2 LEU 3 3HD2 LEU 3 -5.893 15.503 -4.618
24 H GLY 4 H GLY 4 -6.697 11.934 -2.627
25 1HA GLY 4 1HA GLY 4 -7.748 9.228 -2.125
26 2HA GLY 4 2HA GLY 4 -7.000 10.275 -0.925
27 H SER 5 H SER 5 -9.804 10.091 -3.086
28 HA SER 5 HA SER 5 -11.310 12.126 -1.951
29 1HB SER 5 2HB SER 5 -13.121 10.155 -2.833
30 2HB SER 5 1HB SER 5 -12.516 11.537 -3.749
31 HG SER 5 HG SER 5 -11.174 10.274 -4.815
32 H ASP 6 H ASP 6 -11.879 8.647 -1.466
33 HA ASP 6 HA ASP 6 -12.005 8.918 1.368
34 1HB ASP 6 2HB ASP 6 -14.412 9.474 0.074
35 2HB ASP 6 1HB ASP 6 -14.575 7.793 0.576
36 H HIS 7 H HIS 7 -13.469 6.893 -1.154
37 HA HIS 7 HA HIS 7 -12.099 4.550 -0.028
38 1HB HIS 7 2HB HIS 7 -14.617 4.554 -0.744
39 2HB HIS 7 1HB HIS 7 -13.969 4.422 -2.374
40 HD2 HIS 7 2HD HIS 7 -11.559 2.318 -1.727
41 HE1 HIS 7 1HE HIS 7 -14.719 -0.107 -0.285
42 HE2 HIS 7 2HE HIS 7 -12.245 -0.027 -0.813
43 H HIS 8 H HIS 8 -10.268 6.025 -0.811
44 HA HIS 8 HA HIS 8 -9.002 4.898 -3.079
45 1HB HIS 8 2HB HIS 8 -10.831 6.716 -3.860
46 2HB HIS 8 1HB HIS 8 -9.490 7.796 -3.519
47 HD2 HIS 8 2HD HIS 8 -10.553 7.352 -6.568
48 HE1 HIS 8 1HE HIS 8 -6.947 5.185 -7.005
49 HE2 HIS 8 2HE HIS 8 -8.721 6.536 -8.215
50 H MET 9 H MET 9 -6.791 5.615 -3.167
51 HA MET 9 HA MET 9 -6.036 7.468 -1.019
52 1HB MET 9 2HB MET 9 -5.524 4.582 -1.149
53 2HB MET 9 1HB MET 9 -4.096 5.552 -0.819
54 1HG MET 9 2HG MET 9 -4.756 6.044 1.253
55 2HG MET 9 1HG MET 9 -6.427 6.315 0.760
56 1HE MET 9 1HE MET 9 -8.133 5.125 0.963
57 2HE MET 9 2HE MET 9 -8.320 3.380 1.132
58 3HE MET 9 3HE MET 9 -8.104 4.384 2.563
59 H GLU 10 H GLU 10 -4.111 8.503 -1.233
60 HA GLU 10 HA GLU 10 -2.545 8.019 -3.675
61 1HB GLU 10 2HB GLU 10 -2.052 10.570 -3.508
62 2HB GLU 10 1HB GLU 10 -3.563 10.046 -4.241
63 1HG GLU 10 2HG GLU 10 -4.805 11.006 -2.656
64 2HG GLU 10 1HG GLU 10 -3.740 10.465 -1.359
65 H PHE 11 H PHE 11 -2.420 7.147 -0.887
66 HA PHE 11 HA PHE 11 0.350 7.638 -0.317
67 1HB PHE 11 2HB PHE 11 -0.117 8.465 2.018
68 2HB PHE 11 1HB PHE 11 -0.476 9.633 0.752
69 HD1 PHE 11 1HD PHE 11 -2.696 10.406 0.378
70 HD2 PHE 11 2HD PHE 11 -1.934 7.332 3.215
71 HE1 PHE 11 1HE PHE 11 -4.974 10.670 1.270
72 HE2 PHE 11 2HE PHE 11 -4.210 7.588 4.111
73 HZ PHE 11 HZ PHE 11 -5.732 9.257 3.136
74 H CYS 12 H CYS 12 1.033 6.351 1.556
75 HA CYS 12 HA CYS 12 -0.284 3.801 1.467
76 1HB CYS 12 2HB CYS 12 1.817 3.152 1.878
77 2HB CYS 12 1HB CYS 12 2.299 4.811 2.215
78 HG CYS 12 HG CYS 12 2.412 4.673 4.762
79 H ARG 13 H ARG 13 -2.042 3.413 2.594
80 HA ARG 13 HA ARG 13 -3.090 5.102 4.530
81 1HB ARG 13 2HB ARG 13 -4.569 3.008 5.066
82 2HB ARG 13 1HB ARG 13 -4.704 3.819 3.513
83 1HG ARG 13 2HG ARG 13 -3.988 2.032 2.384
84 2HG ARG 13 1HG ARG 13 -2.711 1.682 3.550
85 1HD ARG 13 2HD ARG 13 -4.175 -0.161 3.644
86 2HD ARG 13 1HD ARG 13 -4.545 0.804 5.072
87 HE ARG 13 HE ARG 13 -6.517 1.617 3.916
88 1HH1 ARG 13 2HH1 ARG 13 -4.947 -1.226 2.597
89 2HH1 ARG 13 1HH1 ARG 13 -6.347 -1.757 1.716
90 1HH2 ARG 13 2HH2 ARG 13 -8.377 0.901 2.790
91 2HH2 ARG 13 1HH2 ARG 13 -8.300 -0.540 1.832
92 H VAL 14 H VAL 14 -0.672 2.782 4.953
93 HA VAL 14 HA VAL 14 -1.223 1.965 7.613
94 HB VAL 14 HB VAL 14 1.480 2.055 6.268
95 1HG1 VAL 14 1HG1 VAL 14 1.243 1.635 8.796
96 2HG1 VAL 14 2HG1 VAL 14 0.548 0.083 8.327
97 3HG1 VAL 14 3HG1 VAL 14 2.196 0.490 7.849
98 1HG2 VAL 14 1HG2 VAL 14 1.047 0.090 5.177
99 2HG2 VAL 14 2HG2 VAL 14 -0.187 -0.406 6.337
100 3HG2 VAL 14 3HG2 VAL 14 -0.556 0.823 5.130
101 H CYS 15 H CYS 15 0.741 4.578 6.245
102 HA CYS 15 HA CYS 15 1.051 5.651 8.965
103 1HB CYS 15 2HB CYS 15 3.285 6.264 8.528
104 2HB CYS 15 1HB CYS 15 3.132 4.635 7.884
105 H LYS 16 H LYS 16 -0.214 6.176 5.944
106 HA LYS 16 HA LYS 16 -1.309 7.896 4.978
107 1HB LYS 16 2HB LYS 16 -1.162 8.705 7.736
108 2HB LYS 16 1HB LYS 16 -1.005 10.110 6.691
109 1HG LYS 16 2HG LYS 16 -3.122 9.934 5.896
110 2HG LYS 16 1HG LYS 16 -3.153 8.177 6.051
111 1HD LYS 16 2HD LYS 16 -3.819 8.244 8.231
112 2HD LYS 16 1HD LYS 16 -3.004 9.779 8.543
113 1HE LYS 16 2HE LYS 16 -4.743 11.027 7.674
114 2HE LYS 16 1HE LYS 16 -5.353 9.691 6.698
115 1HZ LYS 16 1HZ LYS 16 -5.995 8.600 8.832
116 2HZ LYS 16 2HZ LYS 16 -6.850 10.022 8.487
117 3HZ LYS 16 3HZ LYS 16 -5.603 10.041 9.638
118 H ASP 17 H ASP 17 1.650 7.491 4.806
119 HA ASP 17 HA ASP 17 2.459 10.193 3.971
120 1HB ASP 17 2HB ASP 17 3.844 8.495 5.535
121 2HB ASP 17 1HB ASP 17 4.418 7.968 3.961
122 H GLY 18 H GLY 18 3.720 10.381 2.008
123 1HA GLY 18 1HA GLY 18 2.894 8.428 -0.050
124 2HA GLY 18 2HA GLY 18 3.218 10.129 -0.374
125 H GLY 19 H GLY 19 4.646 9.047 -2.035
126 1HA GLY 19 1HA GLY 19 7.100 9.370 -2.270
127 2HA GLY 19 2HA GLY 19 7.263 8.402 -0.810
128 H GLU 20 H GLU 20 7.843 6.373 -1.154
129 HA GLU 20 HA GLU 20 7.618 5.174 -3.774
130 1HB GLU 20 2HB GLU 20 8.357 3.564 -1.374
131 2HB GLU 20 1HB GLU 20 9.035 3.531 -2.996
132 1HG GLU 20 2HG GLU 20 10.773 4.533 -1.998
133 2HG GLU 20 1HG GLU 20 9.804 5.987 -2.227
134 H LEU 21 H LEU 21 5.370 5.137 -4.071
135 HA LEU 21 HA LEU 21 3.831 3.567 -2.144
136 1HB LEU 21 2HB LEU 21 2.978 5.514 -4.277
137 2HB LEU 21 1HB LEU 21 1.859 4.607 -3.278
138 HG LEU 21 HG LEU 21 3.857 6.645 -2.297
139 1HD1 LEU 21 1HD1 LEU 21 2.283 8.169 -2.590
140 2HD1 LEU 21 2HD1 LEU 21 1.314 6.961 -3.431
141 3HD1 LEU 21 3HD1 LEU 21 1.112 7.198 -1.696
142 1HD2 LEU 21 1HD2 LEU 21 2.322 6.304 -0.191
143 2HD2 LEU 21 2HD2 LEU 21 2.077 4.706 -0.900
144 3HD2 LEU 21 3HD2 LEU 21 3.703 5.249 -0.487
145 H LEU 22 H LEU 22 3.645 1.530 -2.594
146 HA LEU 22 HA LEU 22 3.444 0.498 -5.302
147 1HB LEU 22 2HB LEU 22 3.656 -0.608 -2.567
148 2HB LEU 22 1HB LEU 22 2.689 -1.549 -3.684
149 HG LEU 22 HG LEU 22 5.515 -0.708 -4.269
150 1HD1 LEU 22 1HD1 LEU 22 6.258 -2.276 -2.894
151 2HD1 LEU 22 2HD1 LEU 22 4.606 -2.617 -2.381
152 3HD1 LEU 22 3HD1 LEU 22 5.300 -3.486 -3.749
153 1HD2 LEU 22 1HD2 LEU 22 4.090 -1.276 -6.197
154 2HD2 LEU 22 2HD2 LEU 22 5.416 -2.416 -5.969
155 3HD2 LEU 22 3HD2 LEU 22 3.781 -2.855 -5.475
156 H CYS 23 H CYS 23 1.553 0.514 -6.364
157 HA CYS 23 HA CYS 23 -0.853 1.205 -4.921
158 1HB CYS 23 2HB CYS 23 0.024 1.186 -7.744
159 2HB CYS 23 1HB CYS 23 -1.690 0.895 -7.473
160 HG CYS 23 HG CYS 23 0.120 3.696 -6.763
161 H CYS 24 H CYS 24 -2.384 -0.120 -4.300
162 HA CYS 24 HA CYS 24 -2.356 -2.838 -4.236
163 1HB CYS 24 2HB CYS 24 -4.543 -0.799 -4.227
164 2HB CYS 24 1HB CYS 24 -4.944 -2.509 -4.155
165 H ASP 25 H ASP 25 -3.215 -4.502 -5.446
166 HA ASP 25 HA ASP 25 -3.481 -4.041 -8.293
167 1HB ASP 25 2HB ASP 25 -2.298 -6.044 -7.354
168 2HB ASP 25 1HB ASP 25 -3.846 -6.618 -6.748
169 H THR 26 H THR 26 -5.490 -5.134 -5.621
170 HA THR 26 HA THR 26 -7.839 -5.245 -7.342
171 HB THR 26 HB THR 26 -8.806 -6.164 -5.075
172 HG1 THR 26 1HG THR 26 -7.035 -5.646 -3.752
173 1HG2 THR 26 1HG2 THR 26 -8.032 -8.401 -5.671
174 2HG2 THR 26 2HG2 THR 26 -6.747 -7.704 -6.660
175 3HG2 THR 26 3HG2 THR 26 -8.436 -7.483 -7.122
176 H CYS 27 H CYS 27 -6.478 -3.452 -4.722
177 HA CYS 27 HA CYS 27 -8.978 -2.016 -4.247
178 1HB CYS 27 2HB CYS 27 -6.787 -1.565 -2.379
179 2HB CYS 27 1HB CYS 27 -8.416 -2.162 -2.070
180 HA PRO 28 HA PRO 28 -7.081 1.751 -5.618
181 1HB PRO 28 2HB PRO 28 -8.558 3.601 -4.396
182 2HB PRO 28 1HB PRO 28 -9.312 2.420 -5.474
183 1HG PRO 28 2HG PRO 28 -9.282 2.526 -2.498
184 2HG PRO 28 1HG PRO 28 -10.567 1.983 -3.589
185 1HD PRO 28 2HD PRO 28 -8.721 0.348 -2.221
186 2HD PRO 28 1HD PRO 28 -9.804 -0.154 -3.534
187 H SER 29 H SER 29 -6.118 0.630 -2.799
188 HA SER 29 HA SER 29 -5.208 3.057 -1.532
189 1HB SER 29 2HB SER 29 -4.009 0.824 -0.306
190 2HB SER 29 1HB SER 29 -5.416 1.726 0.256
191 HG SER 29 HG SER 29 -5.304 -0.628 -1.305
192 H SER 30 H SER 30 -2.926 3.158 -0.751
193 HA SER 30 HA SER 30 -1.005 2.074 -2.683
194 1HB SER 30 2HB SER 30 -0.193 4.649 -1.583
195 2HB SER 30 1HB SER 30 -0.242 4.120 -3.264
196 HG SER 30 HG SER 30 -2.457 4.637 -3.305
197 H TYR 31 H TYR 31 1.064 1.616 -1.771
198 HA TYR 31 HA TYR 31 1.108 1.619 1.175
199 1HB TYR 31 2HB TYR 31 1.392 -0.655 -0.753
200 2HB TYR 31 1HB TYR 31 2.201 -0.726 0.809
201 HD1 TYR 31 1HD TYR 31 -1.002 -0.841 -0.925
202 HD2 TYR 31 2HD TYR 31 0.902 -0.807 2.876
203 HE1 TYR 31 1HE TYR 31 -3.090 -1.607 0.120
204 HE2 TYR 31 2HE TYR 31 -1.177 -1.577 3.929
205 HH TYR 31 HH TYR 31 -3.904 -2.651 2.061
206 H HIS 32 H HIS 32 3.196 1.269 2.132
207 HA HIS 32 HA HIS 32 5.405 2.246 0.457
208 1HB HIS 32 2HB HIS 32 4.821 2.365 3.387
209 2HB HIS 32 1HB HIS 32 6.502 2.279 2.883
210 HD2 HIS 32 2HD HIS 32 6.671 4.383 0.530
211 HE1 HIS 32 1HE HIS 32 4.676 7.014 3.178
212 HE2 HIS 32 2HE HIS 32 6.241 6.860 1.185
213 H ILE 33 H ILE 33 7.297 1.024 0.315
214 HA ILE 33 HA ILE 33 6.955 -1.781 0.491
215 HB ILE 33 HB ILE 33 9.567 -1.695 0.120
216 1HG1 ILE 33 2HG1 ILE 33 8.761 1.030 -0.901
217 1HG2 ILE 33 1HG2 ILE 33 7.410 -2.041 -1.462
218 2HG2 ILE 33 2HG2 ILE 33 8.147 -0.633 -2.224
219 3HG2 ILE 33 3HG2 ILE 33 9.077 -2.119 -2.033
220 1HD1 ILE 33 1HD1 ILE 33 11.044 1.421 -1.289
221 2HD1 ILE 33 2HD1 ILE 33 11.525 -0.018 -0.392
222 3HD1 ILE 33 3HD1 ILE 33 10.716 -0.181 -1.950
223 H HIS 34 H HIS 34 7.773 0.465 2.857
224 HA HIS 34 HA HIS 34 8.979 -1.647 4.515
225 1HB HIS 34 2HB HIS 34 9.550 0.959 5.591
226 2HB HIS 34 1HB HIS 34 10.669 -0.303 5.095
227 HD2 HIS 34 2HD HIS 34 8.735 2.657 3.322
228 HE1 HIS 34 1HE HIS 34 12.462 1.983 1.438
229 HE2 HIS 34 2HE HIS 34 10.458 3.526 1.573
230 H CYS 35 H CYS 35 6.147 -0.240 4.061
231 HA CYS 35 HA CYS 35 5.603 0.180 6.915
232 1HB CYS 35 2HB CYS 35 4.270 1.156 4.415
233 2HB CYS 35 1HB CYS 35 3.339 1.042 5.906
234 H LEU 36 H LEU 36 5.676 -2.291 4.918
235 HA LEU 36 HA LEU 36 3.172 -3.516 5.844
236 1HB LEU 36 2HB LEU 36 5.120 -4.617 3.818
237 2HB LEU 36 1HB LEU 36 3.497 -5.194 4.153
238 HG LEU 36 HG LEU 36 3.771 -2.386 3.233
239 1HD1 LEU 36 1HD1 LEU 36 3.537 -3.662 0.861
240 2HD1 LEU 36 2HD1 LEU 36 5.046 -3.001 1.494
241 3HD1 LEU 36 3HD1 LEU 36 4.680 -4.715 1.696
242 1HD2 LEU 36 1HD2 LEU 36 1.652 -2.759 2.313
243 2HD2 LEU 36 2HD2 LEU 36 1.859 -4.510 2.322
244 3HD2 LEU 36 3HD2 LEU 36 1.625 -3.643 3.839
245 H ARG 37 H ARG 37 3.504 -5.967 6.291
246 HA ARG 37 HA ARG 37 5.434 -6.207 8.404
247 1HB ARG 37 2HB ARG 37 3.522 -8.198 7.179
248 2HB ARG 37 1HB ARG 37 4.602 -8.589 8.509
249 1HG ARG 37 2HG ARG 37 2.639 -6.326 8.661
250 2HG ARG 37 1HG ARG 37 2.212 -7.981 9.098
251 1HD ARG 37 2HD ARG 37 3.197 -7.775 11.083
252 2HD ARG 37 1HD ARG 37 4.696 -7.220 10.338
253 HE ARG 37 HE ARG 37 2.453 -5.491 11.171
254 1HH1 ARG 37 2HH1 ARG 37 5.849 -5.987 10.449
255 2HH1 ARG 37 1HH1 ARG 37 6.302 -4.348 10.825
256 1HH2 ARG 37 2HH2 ARG 37 3.034 -3.342 11.681
257 2HH2 ARG 37 1HH2 ARG 37 4.687 -2.830 11.513
258 HA PRO 38 HA PRO 38 7.828 -8.930 5.332
259 1HB PRO 38 2HB PRO 38 6.573 -9.377 2.853
260 2HB PRO 38 1HB PRO 38 6.700 -10.529 4.183
261 1HG PRO 38 2HG PRO 38 4.340 -9.353 3.216
262 2HG PRO 38 1HG PRO 38 4.521 -10.270 4.718
263 1HD PRO 38 2HD PRO 38 4.453 -7.325 4.290
264 2HD PRO 38 1HD PRO 38 3.881 -8.284 5.672
265 H ALA 39 H ALA 39 8.762 -6.776 5.392
266 HA ALA 39 HA ALA 39 8.204 -4.808 3.478
267 1HB ALA 39 1HB ALA 39 9.200 -4.095 5.476
268 2HB ALA 39 2HB ALA 39 10.539 -5.233 5.320
269 3HB ALA 39 3HB ALA 39 10.430 -3.846 4.237
270 H LEU 40 H LEU 40 9.327 -4.085 1.684
271 HA LEU 40 HA LEU 40 11.049 -6.097 0.391
272 1HB LEU 40 2HB LEU 40 9.368 -3.922 -0.871
273 2HB LEU 40 1HB LEU 40 10.381 -5.059 -1.741
274 HG LEU 40 HG LEU 40 8.657 -6.631 -0.169
275 1HD1 LEU 40 1HD1 LEU 40 7.454 -4.138 -0.538
276 2HD1 LEU 40 2HD1 LEU 40 6.709 -5.204 -1.730
277 3HD1 LEU 40 3HD1 LEU 40 6.680 -5.635 -0.020
278 1HD2 LEU 40 1HD2 LEU 40 8.362 -7.687 -2.129
279 2HD2 LEU 40 2HD2 LEU 40 7.902 -6.207 -2.971
280 3HD2 LEU 40 3HD2 LEU 40 9.605 -6.582 -2.716
281 H TYR 41 H TYR 41 12.999 -5.436 -0.488
282 HA TYR 41 HA TYR 41 13.975 -2.867 0.531
283 1HB TYR 41 2HB TYR 41 15.243 -5.452 -0.242
284 2HB TYR 41 1HB TYR 41 16.202 -3.986 -0.412
285 HD1 TYR 41 1HD TYR 41 13.798 -3.771 2.218
286 HD2 TYR 41 2HD TYR 41 17.683 -5.221 1.282
287 HE1 TYR 41 1HE TYR 41 14.333 -3.860 4.613
288 HE2 TYR 41 2HE TYR 41 18.235 -5.313 3.678
289 HH TYR 41 HH TYR 41 17.535 -4.362 5.773
290 H GLU 42 H GLU 42 12.525 -3.913 -2.135
291 HA GLU 42 HA GLU 42 13.701 -1.796 -3.750
292 1HB GLU 42 2HB GLU 42 13.867 -4.641 -4.360
293 2HB GLU 42 1HB GLU 42 13.051 -3.740 -5.633
294 1HG GLU 42 2HG GLU 42 15.288 -2.213 -4.961
295 2HG GLU 42 1HG GLU 42 15.844 -3.887 -4.993
296 H VAL 43 H VAL 43 12.223 -1.123 -5.499
297 HA VAL 43 HA VAL 43 9.448 -1.441 -4.604
298 HB VAL 43 HB VAL 43 10.365 0.598 -6.613
299 1HG1 VAL 43 1HG1 VAL 43 7.884 -0.105 -5.720
300 2HG1 VAL 43 2HG1 VAL 43 8.283 1.255 -4.670
301 3HG1 VAL 43 3HG1 VAL 43 8.307 1.456 -6.422
302 1HG2 VAL 43 1HG2 VAL 43 10.091 1.773 -4.034
303 2HG2 VAL 43 2HG2 VAL 43 11.264 0.460 -3.935
304 3HG2 VAL 43 3HG2 VAL 43 11.494 1.764 -5.101
305 HA PRO 44 HA PRO 44 8.954 -4.036 -8.266
306 1HB PRO 44 2HB PRO 44 6.242 -4.368 -7.211
307 2HB PRO 44 1HB PRO 44 7.485 -5.587 -7.499
308 1HG PRO 44 2HG PRO 44 6.742 -4.856 -5.012
309 2HG PRO 44 1HG PRO 44 8.403 -5.341 -5.401
310 1HD PRO 44 2HD PRO 44 7.267 -2.592 -5.040
311 2HD PRO 44 1HD PRO 44 8.819 -3.253 -4.483
312 H ASP 45 H ASP 45 7.012 -4.161 -9.859
313 HA ASP 45 HA ASP 45 6.428 -1.422 -10.641
314 1HB ASP 45 2HB ASP 45 7.019 -3.745 -12.049
315 2HB ASP 45 1HB ASP 45 5.296 -3.512 -12.334
316 H GLY 46 H GLY 46 4.037 -1.947 -12.093
317 1HA GLY 46 1HA GLY 46 2.093 -1.780 -9.945
318 2HA GLY 46 2HA GLY 46 1.775 -1.583 -11.663
319 H GLU 47 H GLU 47 3.448 -4.292 -10.233
320 HA GLU 47 HA GLU 47 1.137 -6.024 -10.794
321 1HB GLU 47 2HB GLU 47 4.040 -6.694 -11.310
322 2HB GLU 47 1HB GLU 47 2.671 -7.759 -11.587
323 1HG GLU 47 2HG GLU 47 1.856 -5.843 -13.147
324 2HG GLU 47 1HG GLU 47 3.553 -5.366 -13.121
325 H TRP 48 H TRP 48 1.100 -5.255 -8.401
326 HA TRP 48 HA TRP 48 2.475 -7.295 -6.795
327 1HB TRP 48 2HB TRP 48 3.817 -5.337 -6.519
328 2HB TRP 48 1HB TRP 48 2.402 -4.311 -6.328
329 HD1 TRP 48 HD TRP 48 4.309 -7.077 -4.418
330 HE1 TRP 48 1HE TRP 48 3.941 -6.712 -1.896
331 HE3 TRP 48 3HE TRP 48 0.996 -3.188 -4.646
332 HZ2 TRP 48 2HZ TRP 48 2.439 -4.996 -0.232
333 HZ3 TRP 48 3HZ TRP 48 0.139 -2.249 -2.543
334 HH2 TRP 48 HH TRP 48 0.853 -3.128 -0.381
335 H GLN 49 H GLN 49 1.240 -8.217 -5.247
336 HA GLN 49 HA GLN 49 -1.432 -7.071 -4.837
337 1HB GLN 49 2HB GLN 49 -0.493 -9.838 -5.183
338 2HB GLN 49 1HB GLN 49 -1.665 -9.607 -3.889
339 1HG GLN 49 2HG GLN 49 -2.235 -8.367 -6.524
340 2HG GLN 49 1HG GLN 49 -2.399 -10.116 -6.375
341 1HE2 GLN 49 1HE2 GLN 49 -3.243 -7.266 -4.373
342 2HE2 GLN 49 2HE2 GLN 49 -4.862 -7.778 -4.058
343 H CYS 50 H CYS 50 -1.991 -6.429 -2.927
344 HA CYS 50 HA CYS 50 -0.071 -6.003 -0.954
345 1HB CYS 50 2HB CYS 50 -2.502 -5.448 0.190
346 2HB CYS 50 1HB CYS 50 -1.602 -4.356 -0.871
347 HA PRO 51 HA PRO 51 -0.844 -9.582 1.634
348 1HB PRO 51 2HB PRO 51 1.007 -9.046 3.498
349 2HB PRO 51 1HB PRO 51 1.459 -9.573 1.875
350 1HG PRO 51 2HG PRO 51 1.602 -6.872 3.095
351 2HG PRO 51 1HG PRO 51 2.636 -7.607 1.859
352 1HD PRO 51 2HD PRO 51 0.502 -5.799 1.437
353 2HD PRO 51 1HD PRO 51 1.389 -6.709 0.202
354 H ARG 52 H ARG 52 -1.966 -6.609 1.997
355 HA ARG 52 HA ARG 52 -2.723 -6.894 4.827
356 1HB ARG 52 2HB ARG 52 -1.548 -4.763 3.722
357 2HB ARG 52 1HB ARG 52 -3.217 -4.361 3.348
358 1HG ARG 52 2HG ARG 52 -3.785 -4.057 5.544
359 2HG ARG 52 1HG ARG 52 -2.532 -5.152 6.133
360 1HD ARG 52 2HD ARG 52 -0.821 -3.513 5.559
361 2HD ARG 52 1HD ARG 52 -2.059 -2.420 4.945
362 HE ARG 52 HE ARG 52 -2.919 -2.307 7.260
363 1HH1 ARG 52 2HH1 ARG 52 0.362 -3.390 6.706
364 2HH1 ARG 52 1HH1 ARG 52 0.942 -2.890 8.266
365 1HH2 ARG 52 2HH2 ARG 52 -2.169 -1.636 9.321
366 2HH2 ARG 52 1HH2 ARG 52 -0.511 -1.909 9.755
367 H CYS 53 H CYS 53 -4.212 -5.207 2.061
368 HA CYS 53 HA CYS 53 -6.843 -5.909 2.903
369 1HB CYS 53 2HB CYS 53 -6.900 -4.995 0.247
370 2HB CYS 53 1HB CYS 53 -7.210 -4.057 1.707
371 H THR 54 H THR 54 -4.482 -7.156 0.766
372 HA THR 54 HA THR 54 -4.231 -9.012 -0.433
373 HB THR 54 HB THR 54 -6.308 -10.769 0.158
374 HG1 THR 54 1HG THR 54 -6.753 -9.054 1.870
375 1HG2 THR 54 1HG2 THR 54 -3.832 -11.134 0.017
376 2HG2 THR 54 2HG2 THR 54 -4.618 -11.944 1.372
377 3HG2 THR 54 3HG2 THR 54 -3.705 -10.457 1.640
378 H CYS 55 H CYS 55 -7.783 -8.508 -0.353
379 HA CYS 55 HA CYS 55 -7.779 -8.006 -3.178
380 1HB CYS 55 2HB CYS 55 -8.745 -10.629 -2.118
381 2HB CYS 55 1HB CYS 55 -9.591 -9.897 -3.474
382 HG CYS 55 HG CYS 55 -6.314 -9.905 -3.966
383 HA PRO 56 HA PRO 56 -12.180 -7.302 -1.610
384 1HB PRO 56 2HB PRO 56 -12.707 -8.406 0.976
385 2HB PRO 56 1HB PRO 56 -13.307 -8.962 -0.585
386 1HG PRO 56 2HG PRO 56 -11.561 -10.371 1.013
387 2HG PRO 56 1HG PRO 56 -11.744 -10.606 -0.734
388 1HD PRO 56 2HD PRO 56 -9.673 -9.051 0.765
389 2HD PRO 56 1HD PRO 56 -9.489 -10.088 -0.666
390 H ALA 57 H ALA 57 -10.966 -5.230 -1.317
391 HA ALA 57 HA ALA 57 -11.175 -4.258 1.459
392 1HB ALA 57 1HB ALA 57 -8.920 -4.147 0.293
393 2HB ALA 57 2HB ALA 57 -9.631 -2.902 -0.732
394 3HB ALA 57 3HB ALA 57 -9.516 -2.649 1.010
395 H LEU 58 H LEU 58 -13.154 -4.520 -0.891
396 HA LEU 58 HA LEU 58 -13.947 -1.724 -1.183
397 1HB LEU 58 2HB LEU 58 -14.224 -4.058 -2.788
398 2HB LEU 58 1HB LEU 58 -15.834 -3.507 -2.364
399 HG LEU 58 HG LEU 58 -13.939 -1.449 -3.348
400 1HD1 LEU 58 1HD1 LEU 58 -15.346 -2.971 -5.446
401 2HD1 LEU 58 2HD1 LEU 58 -13.801 -2.123 -5.499
402 3HD1 LEU 58 3HD1 LEU 58 -13.907 -3.719 -4.757
403 1HD2 LEU 58 1HD2 LEU 58 -16.625 -1.718 -4.479
404 2HD2 LEU 58 2HD2 LEU 58 -16.588 -1.503 -2.728
405 3HD2 LEU 58 3HD2 LEU 58 -15.820 -0.313 -3.779
406 H LYS 59 H LYS 59 -15.262 -4.817 -0.033
407 HA LYS 59 HA LYS 59 -17.286 -3.320 1.496
408 1HB LYS 59 2HB LYS 59 -17.263 -5.945 0.173
409 2HB LYS 59 1HB LYS 59 -17.932 -5.972 1.799
410 1HG LYS 59 2HG LYS 59 -19.820 -5.533 0.609
411 2HG LYS 59 1HG LYS 59 -19.273 -3.881 0.909
412 1HD LYS 59 2HD LYS 59 -17.970 -4.774 -1.429
413 2HD LYS 59 1HD LYS 59 -19.670 -5.219 -1.585
414 1HE LYS 59 2HE LYS 59 -19.775 -2.662 -0.575
415 2HE LYS 59 1HE LYS 59 -18.403 -2.602 -1.678
416 1HZ LYS 59 1HZ LYS 59 -21.165 -3.463 -2.339
417 2HZ LYS 59 2HZ LYS 59 -19.848 -3.558 -3.403
418 3HZ LYS 59 3HZ LYS 59 -20.390 -2.046 -2.859
419 H GLY 60 H GLY 60 -16.252 -2.729 3.323
420 1HA GLY 60 1HA GLY 60 -16.022 -3.906 5.604
421 2HA GLY 60 2HA GLY 60 -14.754 -4.802 4.780
422 H LYS 61 H LYS 61 -12.756 -4.007 4.825
423 HA LYS 61 HA LYS 61 -12.361 -1.139 5.180
424 1HB LYS 61 2HB LYS 61 -12.265 -2.700 7.394
425 2HB LYS 61 1HB LYS 61 -10.598 -2.834 6.850
426 1HG LYS 61 2HG LYS 61 -10.174 -0.908 7.851
427 2HG LYS 61 1HG LYS 61 -11.236 -0.108 6.690
428 1HD LYS 61 2HD LYS 61 -12.801 -1.398 8.723
429 2HD LYS 61 1HD LYS 61 -11.590 -0.351 9.470
430 1HE LYS 61 2HE LYS 61 -12.479 1.552 8.571
431 2HE LYS 61 1HE LYS 61 -13.119 0.715 7.157
432 1HZ LYS 61 1HZ LYS 61 -14.454 1.409 9.527
433 2HZ LYS 61 2HZ LYS 61 -14.434 -0.282 9.409
434 3HZ LYS 61 3HZ LYS 61 -15.081 0.647 8.146
Start of MODEL 9
1 1H GLY 1 1H GLY 1 -7.671 11.369 8.175
2 2H GLY 1 2H GLY 1 -9.300 11.761 7.927
3 3H GLY 1 3H GLY 1 -8.481 10.787 6.804
4 1HA GLY 1 2HA GLY 1 -8.106 9.319 8.960
5 2HA GLY 1 1HA GLY 1 -9.618 10.099 9.397
6 HA PRO 2 HA PRO 2 -10.835 6.380 7.037
7 1HB PRO 2 2HB PRO 2 -13.293 6.163 8.206
8 2HB PRO 2 1HB PRO 2 -11.817 5.482 8.898
9 1HG PRO 2 2HG PRO 2 -13.235 8.024 9.584
10 2HG PRO 2 1HG PRO 2 -12.477 6.833 10.658
11 1HD PRO 2 2HD PRO 2 -11.273 9.162 10.007
12 2HD PRO 2 1HD PRO 2 -10.359 7.669 10.306
13 H LEU 3 H LEU 3 -12.363 9.489 7.420
14 HA LEU 3 HA LEU 3 -14.424 9.050 5.471
15 1HB LEU 3 2HB LEU 3 -13.306 11.639 6.543
16 2HB LEU 3 1HB LEU 3 -14.785 11.469 5.618
17 HG LEU 3 HG LEU 3 -14.305 10.272 8.347
18 1HD1 LEU 3 1HD1 LEU 3 -14.748 12.296 9.135
19 2HD1 LEU 3 2HD1 LEU 3 -15.100 12.917 7.522
20 3HD1 LEU 3 3HD1 LEU 3 -16.371 12.132 8.460
21 1HD2 LEU 3 1HD2 LEU 3 -16.469 9.469 8.302
22 2HD2 LEU 3 2HD2 LEU 3 -16.961 10.563 7.010
23 3HD2 LEU 3 3HD2 LEU 3 -15.932 9.177 6.648
24 H GLY 4 H GLY 4 -14.365 9.350 3.328
25 1HA GLY 4 1HA GLY 4 -13.586 10.088 1.256
26 2HA GLY 4 2HA GLY 4 -12.239 10.878 2.063
27 H SER 5 H SER 5 -10.930 8.980 3.356
28 HA SER 5 HA SER 5 -9.625 7.535 1.288
29 1HB SER 5 2HB SER 5 -9.278 7.059 4.246
30 2HB SER 5 1HB SER 5 -8.086 6.865 2.957
31 HG SER 5 HG SER 5 -8.273 9.185 2.639
32 H ASP 6 H ASP 6 -12.467 6.890 2.848
33 HA ASP 6 HA ASP 6 -12.329 4.085 3.245
34 1HB ASP 6 2HB ASP 6 -14.105 5.386 4.268
35 2HB ASP 6 1HB ASP 6 -14.683 5.906 2.689
36 H HIS 7 H HIS 7 -12.983 6.140 0.498
37 HA HIS 7 HA HIS 7 -13.668 3.927 -1.245
38 1HB HIS 7 2HB HIS 7 -14.328 6.528 -1.361
39 2HB HIS 7 1HB HIS 7 -12.885 6.569 -2.366
40 HD2 HIS 7 2HD HIS 7 -13.323 3.822 -4.044
41 HE1 HIS 7 1HE HIS 7 -17.053 5.548 -5.044
42 HE2 HIS 7 2HE HIS 7 -15.268 3.895 -5.760
43 H HIS 8 H HIS 8 -11.085 6.366 -1.181
44 HA HIS 8 HA HIS 8 -9.047 4.398 -1.606
45 1HB HIS 8 2HB HIS 8 -8.180 5.699 -3.683
46 2HB HIS 8 1HB HIS 8 -9.465 4.519 -3.906
47 HD2 HIS 8 2HD HIS 8 -9.242 8.443 -3.476
48 HE1 HIS 8 1HE HIS 8 -12.497 7.419 -5.981
49 HE2 HIS 8 2HE HIS 8 -11.059 9.319 -5.115
50 H MET 9 H MET 9 -6.851 5.506 -1.690
51 HA MET 9 HA MET 9 -6.886 8.204 -0.603
52 1HB MET 9 2HB MET 9 -5.694 7.690 1.387
53 2HB MET 9 1HB MET 9 -7.059 6.588 1.320
54 1HG MET 9 2HG MET 9 -4.347 5.788 0.344
55 2HG MET 9 1HG MET 9 -4.794 5.668 2.043
56 1HE MET 9 1HE MET 9 -7.353 2.878 2.213
57 2HE MET 9 2HE MET 9 -6.236 3.944 3.065
58 3HE MET 9 3HE MET 9 -7.664 4.614 2.277
59 H GLU 10 H GLU 10 -5.105 9.375 -1.036
60 HA GLU 10 HA GLU 10 -3.245 8.253 -2.973
61 1HB GLU 10 2HB GLU 10 -2.628 10.975 -2.431
62 2HB GLU 10 1HB GLU 10 -3.371 10.298 -3.870
63 1HG GLU 10 2HG GLU 10 -4.783 12.029 -3.078
64 2HG GLU 10 1HG GLU 10 -5.581 10.496 -2.737
65 H PHE 11 H PHE 11 -2.932 7.307 -0.353
66 HA PHE 11 HA PHE 11 -0.148 7.834 0.062
67 1HB PHE 11 2HB PHE 11 -0.398 8.497 2.455
68 2HB PHE 11 1HB PHE 11 -0.955 9.723 1.325
69 HD1 PHE 11 1HD PHE 11 -1.913 7.374 3.935
70 HD2 PHE 11 2HD PHE 11 -3.331 10.231 1.116
71 HE1 PHE 11 1HE PHE 11 -4.066 7.471 5.118
72 HE2 PHE 11 2HE PHE 11 -5.488 10.329 2.295
73 HZ PHE 11 HZ PHE 11 -5.855 8.949 4.299
74 H CYS 12 H CYS 12 0.637 6.487 1.961
75 HA CYS 12 HA CYS 12 -0.652 3.906 1.694
76 1HB CYS 12 2HB CYS 12 1.434 3.149 1.897
77 2HB CYS 12 1HB CYS 12 2.002 4.798 2.121
78 HG CYS 12 HG CYS 12 2.539 4.680 4.622
79 H ARG 13 H ARG 13 -2.148 3.237 3.015
80 HA ARG 13 HA ARG 13 -3.222 4.773 5.015
81 1HB ARG 13 2HB ARG 13 -4.360 2.566 5.736
82 2HB ARG 13 1HB ARG 13 -4.658 3.187 4.120
83 1HG ARG 13 2HG ARG 13 -3.450 1.522 3.106
84 2HG ARG 13 1HG ARG 13 -2.448 1.238 4.531
85 1HD ARG 13 2HD ARG 13 -3.996 -0.612 4.151
86 2HD ARG 13 1HD ARG 13 -4.337 0.211 5.673
87 HE ARG 13 HE ARG 13 -6.313 1.074 4.756
88 1HH1 ARG 13 2HH1 ARG 13 -4.599 -0.989 2.500
89 2HH1 ARG 13 1HH1 ARG 13 -5.950 -1.148 1.416
90 1HH2 ARG 13 2HH2 ARG 13 -8.100 0.849 3.344
91 2HH2 ARG 13 1HH2 ARG 13 -7.929 -0.087 1.879
92 H VAL 14 H VAL 14 -0.633 2.480 5.316
93 HA VAL 14 HA VAL 14 -0.865 1.951 8.068
94 HB VAL 14 HB VAL 14 1.676 1.909 6.441
95 1HG1 VAL 14 1HG1 VAL 14 2.079 1.747 8.815
96 2HG1 VAL 14 2HG1 VAL 14 0.853 0.491 8.970
97 3HG1 VAL 14 3HG1 VAL 14 2.336 0.168 8.068
98 1HG2 VAL 14 1HG2 VAL 14 -0.695 0.391 6.101
99 2HG2 VAL 14 2HG2 VAL 14 0.858 0.191 5.290
100 3HG2 VAL 14 3HG2 VAL 14 0.531 -0.673 6.793
101 H CYS 15 H CYS 15 1.824 3.816 6.651
102 HA CYS 15 HA CYS 15 2.191 5.168 9.154
103 1HB CYS 15 2HB CYS 15 4.245 5.918 8.301
104 2HB CYS 15 1HB CYS 15 4.025 4.336 7.567
105 H LYS 16 H LYS 16 0.252 5.735 6.545
106 HA LYS 16 HA LYS 16 -1.151 7.413 5.973
107 1HB LYS 16 2HB LYS 16 0.024 8.833 8.363
108 2HB LYS 16 1HB LYS 16 -1.340 9.423 7.423
109 1HG LYS 16 2HG LYS 16 -1.297 6.778 8.858
110 2HG LYS 16 1HG LYS 16 -1.966 8.263 9.534
111 1HD LYS 16 2HD LYS 16 -3.499 8.383 7.579
112 2HD LYS 16 1HD LYS 16 -2.889 6.810 7.061
113 1HE LYS 16 2HE LYS 16 -3.635 6.669 9.811
114 2HE LYS 16 1HE LYS 16 -4.969 7.362 8.890
115 1HZ LYS 16 1HZ LYS 16 -5.128 4.955 8.985
116 2HZ LYS 16 2HZ LYS 16 -3.590 4.802 8.286
117 3HZ LYS 16 3HZ LYS 16 -4.862 5.469 7.391
118 H ASP 17 H ASP 17 2.090 7.529 5.670
119 HA ASP 17 HA ASP 17 2.370 10.207 4.644
120 1HB ASP 17 2HB ASP 17 4.156 8.358 5.556
121 2HB ASP 17 1HB ASP 17 4.351 8.197 3.815
122 H GLY 18 H GLY 18 2.725 10.793 2.495
123 1HA GLY 18 1HA GLY 18 1.534 8.924 0.540
124 2HA GLY 18 2HA GLY 18 1.428 10.679 0.435
125 H GLY 19 H GLY 19 2.709 11.574 -0.998
126 1HA GLY 19 1HA GLY 19 4.582 11.998 -2.269
127 2HA GLY 19 2HA GLY 19 5.463 10.847 -1.273
128 H GLU 20 H GLU 20 6.408 9.489 -2.640
129 HA GLU 20 HA GLU 20 4.922 8.467 -4.946
130 1HB GLU 20 2HB GLU 20 7.800 8.059 -4.105
131 2HB GLU 20 1HB GLU 20 7.076 7.414 -5.573
132 1HG GLU 20 2HG GLU 20 7.320 10.338 -4.905
133 2HG GLU 20 1HG GLU 20 8.407 9.444 -5.967
134 H LEU 21 H LEU 21 3.819 6.639 -4.793
135 HA LEU 21 HA LEU 21 4.584 4.722 -2.694
136 1HB LEU 21 2HB LEU 21 1.734 5.174 -3.501
137 2HB LEU 21 1HB LEU 21 2.361 4.467 -2.025
138 HG LEU 21 HG LEU 21 3.256 7.179 -2.191
139 1HD1 LEU 21 1HD1 LEU 21 1.196 7.296 -3.694
140 2HD1 LEU 21 2HD1 LEU 21 0.263 6.984 -2.232
141 3HD1 LEU 21 3HD1 LEU 21 1.281 8.421 -2.337
142 1HD2 LEU 21 1HD2 LEU 21 1.137 6.209 -0.328
143 2HD2 LEU 21 2HD2 LEU 21 2.761 5.525 -0.237
144 3HD2 LEU 21 3HD2 LEU 21 2.521 7.258 -0.017
145 H LEU 22 H LEU 22 3.564 2.588 -2.981
146 HA LEU 22 HA LEU 22 3.358 1.828 -5.816
147 1HB LEU 22 2HB LEU 22 4.970 0.350 -5.276
148 2HB LEU 22 1HB LEU 22 4.758 0.619 -3.558
149 HG LEU 22 HG LEU 22 2.574 -0.904 -4.084
150 1HD1 LEU 22 1HD1 LEU 22 4.330 -2.645 -5.510
151 2HD1 LEU 22 2HD1 LEU 22 2.728 -2.063 -5.967
152 3HD1 LEU 22 3HD1 LEU 22 4.159 -1.132 -6.401
153 1HD2 LEU 22 1HD2 LEU 22 3.783 -1.612 -2.295
154 2HD2 LEU 22 2HD2 LEU 22 4.298 -2.831 -3.459
155 3HD2 LEU 22 3HD2 LEU 22 5.327 -1.437 -3.126
156 H CYS 23 H CYS 23 1.323 1.538 -6.385
157 HA CYS 23 HA CYS 23 -0.690 1.303 -4.321
158 1HB CYS 23 2HB CYS 23 -1.210 1.491 -7.281
159 2HB CYS 23 1HB CYS 23 -2.242 2.013 -5.954
160 HG CYS 23 HG CYS 23 -1.020 4.139 -7.559
161 H CYS 24 H CYS 24 -2.398 -0.210 -4.331
162 HA CYS 24 HA CYS 24 -1.782 -2.867 -4.592
163 1HB CYS 24 2HB CYS 24 -4.503 -1.593 -4.890
164 2HB CYS 24 1HB CYS 24 -4.191 -3.269 -4.464
165 H ASP 25 H ASP 25 -2.621 -4.490 -6.013
166 HA ASP 25 HA ASP 25 -2.865 -3.607 -8.808
167 1HB ASP 25 2HB ASP 25 -1.286 -5.556 -7.968
168 2HB ASP 25 1HB ASP 25 -2.774 -6.495 -8.027
169 H THR 26 H THR 26 -4.644 -4.427 -6.124
170 HA THR 26 HA THR 26 -6.951 -5.268 -7.744
171 HB THR 26 HB THR 26 -7.774 -6.202 -5.481
172 HG1 THR 26 1HG THR 26 -6.332 -5.483 -3.993
173 1HG2 THR 26 1HG2 THR 26 -5.823 -7.292 -7.384
174 2HG2 THR 26 2HG2 THR 26 -7.341 -7.976 -6.798
175 3HG2 THR 26 3HG2 THR 26 -5.876 -8.128 -5.830
176 H CYS 27 H CYS 27 -6.341 -3.860 -4.539
177 HA CYS 27 HA CYS 27 -8.789 -2.392 -4.586
178 1HB CYS 27 2HB CYS 27 -6.884 -1.700 -2.501
179 2HB CYS 27 1HB CYS 27 -8.476 -2.443 -2.360
180 HA PRO 28 HA PRO 28 -7.037 1.497 -5.846
181 1HB PRO 28 2HB PRO 28 -8.858 3.213 -4.776
182 2HB PRO 28 1HB PRO 28 -9.211 2.149 -6.138
183 1HG PRO 28 2HG PRO 28 -10.200 2.026 -3.399
184 2HG PRO 28 1HG PRO 28 -10.774 1.163 -4.833
185 1HD PRO 28 2HD PRO 28 -9.036 0.219 -2.699
186 2HD PRO 28 1HD PRO 28 -9.808 -0.706 -4.000
187 H SER 29 H SER 29 -5.979 0.465 -3.245
188 HA SER 29 HA SER 29 -5.578 2.919 -1.721
189 1HB SER 29 2HB SER 29 -4.185 0.823 -0.485
190 2HB SER 29 1HB SER 29 -5.764 1.462 -0.025
191 HG SER 29 HG SER 29 -5.158 -0.742 -1.702
192 H SER 30 H SER 30 -3.326 3.243 -0.820
193 HA SER 30 HA SER 30 -1.285 2.566 -2.826
194 1HB SER 30 2HB SER 30 -1.295 5.168 -1.292
195 2HB SER 30 1HB SER 30 -0.356 4.747 -2.725
196 HG SER 30 HG SER 30 -3.064 5.469 -2.505
197 H TYR 31 H TYR 31 0.786 2.104 -2.005
198 HA TYR 31 HA TYR 31 0.976 1.917 0.929
199 1HB TYR 31 2HB TYR 31 1.188 -0.245 -1.123
200 2HB TYR 31 1HB TYR 31 2.172 -0.353 0.333
201 HD1 TYR 31 1HD TYR 31 -1.168 -0.590 -1.064
202 HD2 TYR 31 2HD TYR 31 1.096 -0.566 2.537
203 HE1 TYR 31 1HE TYR 31 -3.087 -1.528 0.144
204 HE2 TYR 31 2HE TYR 31 -0.825 -1.492 3.758
205 HH TYR 31 HH TYR 31 -3.673 -2.638 2.083
206 H HIS 32 H HIS 32 3.188 1.243 1.624
207 HA HIS 32 HA HIS 32 5.293 2.304 -0.128
208 1HB HIS 32 2HB HIS 32 4.989 2.503 2.868
209 2HB HIS 32 1HB HIS 32 6.559 2.636 2.092
210 HD2 HIS 32 2HD HIS 32 6.083 4.722 -0.229
211 HE1 HIS 32 1HE HIS 32 4.154 7.088 2.713
212 HE2 HIS 32 2HE HIS 32 5.355 7.120 0.470
213 H ILE 33 H ILE 33 7.281 1.081 -0.011
214 HA ILE 33 HA ILE 33 6.794 -1.704 0.134
215 HB ILE 33 HB ILE 33 9.352 -1.822 -0.200
216 1HG1 ILE 33 2HG1 ILE 33 9.070 1.035 -1.066
217 1HG2 ILE 33 1HG2 ILE 33 7.550 -2.074 -1.928
218 2HG2 ILE 33 2HG2 ILE 33 7.757 -0.361 -2.294
219 3HG2 ILE 33 3HG2 ILE 33 9.096 -1.485 -2.538
220 1HD1 ILE 33 1HD1 ILE 33 11.547 0.928 -0.284
221 2HD1 ILE 33 2HD1 ILE 33 11.324 -0.813 -0.464
222 3HD1 ILE 33 3HD1 ILE 33 11.079 0.255 -1.846
223 H HIS 34 H HIS 34 7.941 0.566 2.451
224 HA HIS 34 HA HIS 34 9.054 -1.574 4.114
225 1HB HIS 34 2HB HIS 34 10.023 0.334 5.438
226 2HB HIS 34 1HB HIS 34 10.591 0.224 3.776
227 HD2 HIS 34 2HD HIS 34 8.462 2.560 6.046
228 HE1 HIS 34 1HE HIS 34 9.051 4.438 2.301
229 HE2 HIS 34 2HE HIS 34 7.925 4.625 4.567
230 H CYS 35 H CYS 35 6.144 -0.122 3.767
231 HA CYS 35 HA CYS 35 5.631 0.156 6.629
232 1HB CYS 35 2HB CYS 35 3.985 0.981 4.230
233 2HB CYS 35 1HB CYS 35 3.527 1.261 5.909
234 H LEU 36 H LEU 36 5.796 -2.413 4.977
235 HA LEU 36 HA LEU 36 3.275 -3.559 5.986
236 1HB LEU 36 2HB LEU 36 4.872 -4.938 3.870
237 2HB LEU 36 1HB LEU 36 3.160 -5.065 4.229
238 HG LEU 36 HG LEU 36 3.909 -2.405 3.304
239 1HD1 LEU 36 1HD1 LEU 36 5.355 -3.048 1.721
240 2HD1 LEU 36 2HD1 LEU 36 4.901 -4.747 1.859
241 3HD1 LEU 36 3HD1 LEU 36 3.926 -3.650 0.882
242 1HD2 LEU 36 1HD2 LEU 36 1.730 -4.273 3.191
243 2HD2 LEU 36 2HD2 LEU 36 1.729 -2.533 2.898
244 3HD2 LEU 36 3HD2 LEU 36 2.090 -3.650 1.581
245 H ARG 37 H ARG 37 3.587 -5.979 6.474
246 HA ARG 37 HA ARG 37 5.766 -6.276 8.308
247 1HB ARG 37 2HB ARG 37 3.358 -7.757 7.653
248 2HB ARG 37 1HB ARG 37 4.736 -8.835 7.841
249 1HG ARG 37 2HG ARG 37 3.789 -6.815 9.864
250 2HG ARG 37 1HG ARG 37 3.521 -8.556 9.934
251 1HD ARG 37 2HD ARG 37 6.030 -6.993 10.365
252 2HD ARG 37 1HD ARG 37 5.338 -8.293 11.332
253 HE ARG 37 HE ARG 37 5.987 -9.712 9.266
254 1HH1 ARG 37 2HH1 ARG 37 7.796 -7.005 10.549
255 2HH1 ARG 37 1HH1 ARG 37 9.327 -7.571 9.949
256 1HH2 ARG 37 2HH2 ARG 37 7.983 -10.460 8.465
257 2HH2 ARG 37 1HH2 ARG 37 9.435 -9.553 8.780
258 HA PRO 38 HA PRO 38 7.684 -9.115 4.942
259 1HB PRO 38 2HB PRO 38 6.107 -9.066 2.538
260 2HB PRO 38 1HB PRO 38 6.456 -10.448 3.578
261 1HG PRO 38 2HG PRO 38 3.963 -9.333 3.261
262 2HG PRO 38 1HG PRO 38 4.468 -10.267 4.678
263 1HD PRO 38 2HD PRO 38 4.299 -7.304 4.324
264 2HD PRO 38 1HD PRO 38 3.872 -8.295 5.735
265 H ALA 39 H ALA 39 8.345 -6.692 5.346
266 HA ALA 39 HA ALA 39 8.016 -4.739 3.414
267 1HB ALA 39 1HB ALA 39 9.156 -3.510 4.870
268 2HB ALA 39 2HB ALA 39 9.359 -4.968 5.842
269 3HB ALA 39 3HB ALA 39 10.601 -4.506 4.678
270 H LEU 40 H LEU 40 9.298 -3.944 1.765
271 HA LEU 40 HA LEU 40 11.270 -5.839 0.672
272 1HB LEU 40 2HB LEU 40 9.449 -4.029 -0.919
273 2HB LEU 40 1HB LEU 40 10.570 -5.214 -1.559
274 HG LEU 40 HG LEU 40 8.854 -6.642 0.148
275 1HD1 LEU 40 1HD1 LEU 40 7.432 -4.515 -0.121
276 2HD1 LEU 40 2HD1 LEU 40 7.184 -5.070 -1.777
277 3HD1 LEU 40 3HD1 LEU 40 6.674 -6.079 -0.423
278 1HD2 LEU 40 1HD2 LEU 40 8.004 -7.465 -2.143
279 2HD2 LEU 40 2HD2 LEU 40 9.243 -6.401 -2.810
280 3HD2 LEU 40 3HD2 LEU 40 9.698 -7.716 -1.727
281 H TYR 41 H TYR 41 12.953 -4.858 -0.613
282 HA TYR 41 HA TYR 41 13.615 -2.160 0.350
283 1HB TYR 41 2HB TYR 41 15.375 -4.341 -0.795
284 2HB TYR 41 1HB TYR 41 15.944 -2.732 -0.363
285 HD1 TYR 41 1HD TYR 41 15.349 -6.034 0.800
286 HD2 TYR 41 2HD TYR 41 15.591 -1.984 2.086
287 HE1 TYR 41 1HE TYR 41 15.704 -6.794 3.111
288 HE2 TYR 41 2HE TYR 41 15.949 -2.736 4.396
289 HH TYR 41 HH TYR 41 15.267 -5.740 5.477
290 H GLU 42 H GLU 42 12.420 -3.783 -2.280
291 HA GLU 42 HA GLU 42 12.933 -1.467 -3.983
292 1HB GLU 42 2HB GLU 42 13.876 -4.129 -4.503
293 2HB GLU 42 1HB GLU 42 12.670 -3.696 -5.708
294 1HG GLU 42 2HG GLU 42 15.191 -2.200 -5.048
295 2HG GLU 42 1HG GLU 42 14.835 -3.093 -6.525
296 H VAL 43 H VAL 43 11.316 -1.457 -5.850
297 HA VAL 43 HA VAL 43 8.707 -2.022 -4.661
298 HB VAL 43 HB VAL 43 9.157 -0.461 -7.196
299 1HG1 VAL 43 1HG1 VAL 43 7.063 0.093 -5.149
300 2HG1 VAL 43 2HG1 VAL 43 7.026 0.344 -6.895
301 3HG1 VAL 43 3HG1 VAL 43 6.862 -1.283 -6.234
302 1HG2 VAL 43 1HG2 VAL 43 9.091 0.753 -4.443
303 2HG2 VAL 43 2HG2 VAL 43 10.590 0.393 -5.297
304 3HG2 VAL 43 3HG2 VAL 43 9.445 1.548 -5.978
305 HA PRO 44 HA PRO 44 8.278 -5.423 -7.528
306 1HB PRO 44 2HB PRO 44 5.741 -5.994 -6.284
307 2HB PRO 44 1HB PRO 44 7.264 -6.865 -6.111
308 1HG PRO 44 2HG PRO 44 6.078 -5.430 -4.094
309 2HG PRO 44 1HG PRO 44 7.816 -5.767 -4.187
310 1HD PRO 44 2HD PRO 44 6.323 -3.281 -4.937
311 2HD PRO 44 1HD PRO 44 7.890 -3.452 -4.114
312 H ASP 45 H ASP 45 7.917 -3.580 -9.116
313 HA ASP 45 HA ASP 45 5.260 -2.701 -9.647
314 1HB ASP 45 2HB ASP 45 7.189 -1.358 -10.337
315 2HB ASP 45 1HB ASP 45 7.716 -2.645 -11.418
316 H GLY 46 H GLY 46 3.689 -3.894 -10.458
317 1HA GLY 46 1HA GLY 46 2.877 -5.072 -12.455
318 2HA GLY 46 2HA GLY 46 4.388 -5.972 -12.441
319 H GLU 47 H GLU 47 4.708 -7.594 -10.901
320 HA GLU 47 HA GLU 47 2.230 -8.794 -9.982
321 1HB GLU 47 2HB GLU 47 5.001 -9.729 -10.457
322 2HB GLU 47 1HB GLU 47 4.091 -10.560 -9.202
323 1HG GLU 47 2HG GLU 47 3.294 -10.238 -12.084
324 2HG GLU 47 1HG GLU 47 3.844 -11.717 -11.294
325 H TRP 48 H TRP 48 1.465 -8.032 -8.147
326 HA TRP 48 HA TRP 48 2.829 -8.563 -5.720
327 1HB TRP 48 2HB TRP 48 3.990 -6.455 -6.258
328 2HB TRP 48 1HB TRP 48 2.438 -5.633 -6.387
329 HD1 TRP 48 HD TRP 48 4.521 -7.503 -3.698
330 HE1 TRP 48 1HE TRP 48 3.995 -6.454 -1.400
331 HE3 TRP 48 3HE TRP 48 0.930 -4.156 -5.146
332 HZ2 TRP 48 2HZ TRP 48 2.294 -4.460 -0.359
333 HZ3 TRP 48 3HZ TRP 48 -0.097 -2.718 -3.434
334 HH2 TRP 48 HH TRP 48 0.571 -2.869 -1.089
335 H GLN 49 H GLN 49 1.365 -8.983 -4.218
336 HA GLN 49 HA GLN 49 -1.276 -7.715 -4.435
337 1HB GLN 49 2HB GLN 49 -0.934 -10.377 -4.823
338 2HB GLN 49 1HB GLN 49 -1.153 -10.338 -3.078
339 1HG GLN 49 2HG GLN 49 -3.074 -8.831 -4.768
340 2HG GLN 49 1HG GLN 49 -3.188 -10.589 -4.726
341 1HE2 GLN 49 1HE2 GLN 49 -3.615 -7.648 -2.959
342 2HE2 GLN 49 2HE2 GLN 49 -4.365 -8.352 -1.572
343 H CYS 50 H CYS 50 -1.853 -6.632 -2.708
344 HA CYS 50 HA CYS 50 -0.074 -6.095 -0.646
345 1HB CYS 50 2HB CYS 50 -2.528 -5.258 0.249
346 2HB CYS 50 1HB CYS 50 -1.485 -4.356 -0.856
347 HA PRO 51 HA PRO 51 -1.247 -9.355 2.188
348 1HB PRO 51 2HB PRO 51 0.659 -8.919 4.008
349 2HB PRO 51 1HB PRO 51 1.054 -9.572 2.414
350 1HG PRO 51 2HG PRO 51 1.431 -6.818 3.476
351 2HG PRO 51 1HG PRO 51 2.440 -7.738 2.347
352 1HD PRO 51 2HD PRO 51 0.541 -5.774 1.672
353 2HD PRO 51 1HD PRO 51 1.314 -6.916 0.558
354 H ARG 52 H ARG 52 -2.716 -6.828 2.218
355 HA ARG 52 HA ARG 52 -3.359 -6.749 5.061
356 1HB ARG 52 2HB ARG 52 -1.687 -4.905 4.443
357 2HB ARG 52 1HB ARG 52 -3.013 -4.171 3.552
358 1HG ARG 52 2HG ARG 52 -4.319 -3.957 5.555
359 2HG ARG 52 1HG ARG 52 -3.113 -4.851 6.482
360 1HD ARG 52 2HD ARG 52 -1.756 -2.735 5.222
361 2HD ARG 52 1HD ARG 52 -3.237 -2.055 5.889
362 HE ARG 52 HE ARG 52 -1.060 -3.331 7.395
363 1HH1 ARG 52 2HH1 ARG 52 -4.166 -1.682 7.426
364 2HH1 ARG 52 1HH1 ARG 52 -4.058 -1.255 9.109
365 1HH2 ARG 52 2HH2 ARG 52 -0.949 -2.794 9.610
366 2HH2 ARG 52 1HH2 ARG 52 -2.241 -1.887 10.344
367 H CYS 53 H CYS 53 -4.243 -5.191 1.943
368 HA CYS 53 HA CYS 53 -7.001 -5.205 2.813
369 1HB CYS 53 2HB CYS 53 -7.009 -4.009 0.371
370 2HB CYS 53 1HB CYS 53 -6.799 -3.168 1.900
371 H THR 54 H THR 54 -6.747 -7.634 2.582
372 HA THR 54 HA THR 54 -6.874 -8.828 0.015
373 HB THR 54 HB THR 54 -8.355 -10.496 1.618
374 HG1 THR 54 1HG THR 54 -6.758 -10.246 3.594
375 1HG2 THR 54 1HG2 THR 54 -6.484 -11.286 0.398
376 2HG2 THR 54 2HG2 THR 54 -6.097 -11.572 2.095
377 3HG2 THR 54 3HG2 THR 54 -5.379 -10.201 1.246
378 H CYS 55 H CYS 55 -9.072 -7.173 2.051
379 HA CYS 55 HA CYS 55 -10.918 -6.958 -0.180
380 1HB CYS 55 2HB CYS 55 -12.373 -6.753 2.324
381 2HB CYS 55 1HB CYS 55 -12.753 -7.706 0.895
382 HG CYS 55 HG CYS 55 -11.423 -9.961 1.643
383 HA PRO 56 HA PRO 56 -9.461 -2.842 0.696
384 1HB PRO 56 2HB PRO 56 -11.533 -1.617 -0.782
385 2HB PRO 56 1HB PRO 56 -9.914 -2.017 -1.358
386 1HG PRO 56 2HG PRO 56 -12.468 -3.491 -1.709
387 2HG PRO 56 1HG PRO 56 -11.058 -3.403 -2.780
388 1HD PRO 56 2HD PRO 56 -11.596 -5.593 -1.324
389 2HD PRO 56 1HD PRO 56 -9.927 -5.064 -1.630
390 H ALA 57 H ALA 57 -12.892 -3.625 0.893
391 HA ALA 57 HA ALA 57 -13.160 -1.745 3.138
392 1HB ALA 57 1HB ALA 57 -15.572 -3.078 2.097
393 2HB ALA 57 2HB ALA 57 -15.324 -1.405 2.595
394 3HB ALA 57 3HB ALA 57 -14.792 -1.939 1.000
395 H LEU 58 H LEU 58 -12.029 -3.174 4.529
396 HA LEU 58 HA LEU 58 -12.736 -5.872 4.928
397 1HB LEU 58 2HB LEU 58 -11.367 -3.963 6.828
398 2HB LEU 58 1HB LEU 58 -11.410 -5.706 7.001
399 HG LEU 58 HG LEU 58 -10.281 -4.629 4.474
400 1HD1 LEU 58 1HD1 LEU 58 -8.505 -3.600 5.341
401 2HD1 LEU 58 2HD1 LEU 58 -9.421 -3.530 6.847
402 3HD1 LEU 58 3HD1 LEU 58 -8.280 -4.846 6.570
403 1HD2 LEU 58 1HD2 LEU 58 -8.759 -6.623 5.881
404 2HD2 LEU 58 2HD2 LEU 58 -10.453 -7.102 5.767
405 3HD2 LEU 58 3HD2 LEU 58 -9.544 -6.719 4.305
406 H LYS 59 H LYS 59 -14.883 -6.184 5.276
407 HA LYS 59 HA LYS 59 -16.017 -4.932 7.693
408 1HB LYS 59 2HB LYS 59 -17.410 -5.786 5.144
409 2HB LYS 59 1HB LYS 59 -18.235 -5.208 6.587
410 1HG LYS 59 2HG LYS 59 -17.147 -3.050 6.379
411 2HG LYS 59 1HG LYS 59 -16.245 -3.623 4.977
412 1HD LYS 59 2HD LYS 59 -19.191 -3.874 4.868
413 2HD LYS 59 1HD LYS 59 -18.525 -2.244 4.777
414 1HE LYS 59 2HE LYS 59 -16.910 -3.465 3.033
415 2HE LYS 59 1HE LYS 59 -18.334 -4.487 2.858
416 1HZ LYS 59 1HZ LYS 59 -19.643 -2.475 2.418
417 2HZ LYS 59 2HZ LYS 59 -18.409 -2.701 1.273
418 3HZ LYS 59 3HZ LYS 59 -18.230 -1.541 2.500
419 H GLY 60 H GLY 60 -15.665 -7.871 5.803
420 1HA GLY 60 1HA GLY 60 -16.554 -9.381 8.180
421 2HA GLY 60 2HA GLY 60 -17.109 -9.831 6.575
422 H LYS 61 H LYS 61 -14.185 -9.407 8.533
423 HA LYS 61 HA LYS 61 -12.829 -11.358 6.794
424 1HB LYS 61 2HB LYS 61 -11.952 -8.939 8.145
425 2HB LYS 61 1HB LYS 61 -10.941 -10.314 8.573
426 1HG LYS 61 2HG LYS 61 -11.556 -9.405 5.769
427 2HG LYS 61 1HG LYS 61 -10.066 -9.076 6.654
428 1HD LYS 61 2HD LYS 61 -9.446 -11.352 6.651
429 2HD LYS 61 1HD LYS 61 -11.061 -11.870 6.164
430 1HE LYS 61 2HE LYS 61 -10.202 -10.101 4.175
431 2HE LYS 61 1HE LYS 61 -8.805 -11.111 4.540
432 1HZ LYS 61 1HZ LYS 61 -11.395 -11.861 3.399
433 2HZ LYS 61 2HZ LYS 61 -10.610 -12.991 4.392
434 3HZ LYS 61 3HZ LYS 61 -9.832 -12.403 3.004
Start of MODEL 10
1 1H GLY 1 1H GLY 1 -4.982 14.986 0.783
2 2H GLY 1 2H GLY 1 -4.450 15.727 -0.648
3 3H GLY 1 3H GLY 1 -4.975 14.112 -0.673
4 1HA GLY 1 2HA GLY 1 -6.591 16.563 -0.327
5 2HA GLY 1 1HA GLY 1 -6.747 15.324 -1.565
6 HA PRO 2 HA PRO 2 -8.973 14.458 2.769
7 1HB PRO 2 2HB PRO 2 -11.145 16.221 1.760
8 2HB PRO 2 1HB PRO 2 -10.537 16.011 3.406
9 1HG PRO 2 2HG PRO 2 -9.935 18.194 2.004
10 2HG PRO 2 1HG PRO 2 -8.735 17.429 3.064
11 1HD PRO 2 2HD PRO 2 -8.976 17.333 0.087
12 2HD PRO 2 1HD PRO 2 -7.521 17.417 1.100
13 H LEU 3 H LEU 3 -10.279 14.987 -0.478
14 HA LEU 3 HA LEU 3 -11.910 12.556 -0.159
15 1HB LEU 3 2HB LEU 3 -12.224 15.026 -1.813
16 2HB LEU 3 1HB LEU 3 -12.932 13.527 -2.379
17 HG LEU 3 HG LEU 3 -13.526 14.743 0.317
18 1HD1 LEU 3 1HD1 LEU 3 -15.475 15.691 -0.557
19 2HD1 LEU 3 2HD1 LEU 3 -14.224 16.104 -1.730
20 3HD1 LEU 3 3HD1 LEU 3 -15.348 14.787 -2.065
21 1HD2 LEU 3 1HD2 LEU 3 -15.042 12.646 -1.220
22 2HD2 LEU 3 2HD2 LEU 3 -13.837 12.268 0.012
23 3HD2 LEU 3 3HD2 LEU 3 -15.294 13.163 0.447
24 H GLY 4 H GLY 4 -8.995 12.845 -0.815
25 1HA GLY 4 1HA GLY 4 -8.865 11.909 -3.575
26 2HA GLY 4 2HA GLY 4 -7.499 12.282 -2.534
27 H SER 5 H SER 5 -9.853 10.373 -1.035
28 HA SER 5 HA SER 5 -8.319 7.930 -1.618
29 1HB SER 5 2HB SER 5 -9.646 7.961 0.986
30 2HB SER 5 1HB SER 5 -7.975 7.561 0.580
31 HG SER 5 HG SER 5 -7.640 9.897 0.409
32 H ASP 6 H ASP 6 -10.296 8.275 -3.261
33 HA ASP 6 HA ASP 6 -12.545 6.715 -2.160
34 1HB ASP 6 2HB ASP 6 -12.814 9.236 -3.008
35 2HB ASP 6 1HB ASP 6 -12.987 8.414 -4.555
36 H HIS 7 H HIS 7 -11.132 7.602 -5.307
37 HA HIS 7 HA HIS 7 -11.817 5.086 -6.526
38 1HB HIS 7 2HB HIS 7 -11.374 7.410 -7.651
39 2HB HIS 7 1HB HIS 7 -9.682 6.940 -7.554
40 HD2 HIS 7 2HD HIS 7 -9.298 4.253 -8.828
41 HE1 HIS 7 1HE HIS 7 -12.231 5.249 -11.708
42 HE2 HIS 7 2HE HIS 7 -10.202 3.814 -11.218
43 H HIS 8 H HIS 8 -9.028 6.592 -5.066
44 HA HIS 8 HA HIS 8 -7.880 3.988 -4.527
45 1HB HIS 8 2HB HIS 8 -6.940 5.261 -6.737
46 2HB HIS 8 1HB HIS 8 -5.884 5.948 -5.507
47 HD2 HIS 8 2HD HIS 8 -4.687 3.752 -3.862
48 HE1 HIS 8 1HE HIS 8 -4.570 1.269 -7.283
49 HE2 HIS 8 2HE HIS 8 -3.790 1.546 -4.884
50 H MET 9 H MET 9 -5.444 6.107 -4.101
51 HA MET 9 HA MET 9 -6.304 7.842 -2.110
52 1HB MET 9 2HB MET 9 -5.433 6.845 -0.067
53 2HB MET 9 1HB MET 9 -6.668 5.808 -0.760
54 1HG MET 9 2HG MET 9 -4.677 4.551 -1.823
55 2HG MET 9 1HG MET 9 -3.718 5.389 -0.606
56 1HE MET 9 1HE MET 9 -5.254 5.583 1.912
57 2HE MET 9 2HE MET 9 -5.093 4.032 2.737
58 3HE MET 9 3HE MET 9 -3.693 4.765 1.955
59 H GLU 10 H GLU 10 -4.801 9.382 -1.894
60 HA GLU 10 HA GLU 10 -2.231 8.931 -3.194
61 1HB GLU 10 2HB GLU 10 -2.580 11.611 -2.188
62 2HB GLU 10 1HB GLU 10 -2.387 11.062 -3.847
63 1HG GLU 10 2HG GLU 10 -4.527 11.409 -4.289
64 2HG GLU 10 1HG GLU 10 -5.038 10.488 -2.875
65 H PHE 11 H PHE 11 -2.600 7.671 -0.738
66 HA PHE 11 HA PHE 11 -0.261 8.527 0.635
67 1HB PHE 11 2HB PHE 11 -1.191 9.065 2.782
68 2HB PHE 11 1HB PHE 11 -1.986 10.090 1.595
69 HD1 PHE 11 1HD PHE 11 -2.507 8.125 4.398
70 HD2 PHE 11 2HD PHE 11 -4.220 8.995 0.602
71 HE1 PHE 11 1HE PHE 11 -4.703 7.374 5.217
72 HE2 PHE 11 2HE PHE 11 -6.413 8.249 1.416
73 HZ PHE 11 HZ PHE 11 -6.662 7.440 3.727
74 H CYS 12 H CYS 12 0.207 7.051 2.460
75 HA CYS 12 HA CYS 12 -0.579 4.385 1.628
76 1HB CYS 12 2HB CYS 12 1.572 3.938 2.013
77 2HB CYS 12 1HB CYS 12 1.794 5.618 2.486
78 HG CYS 12 HG CYS 12 2.508 5.126 4.830
79 H ARG 13 H ARG 13 -1.131 2.723 3.163
80 HA ARG 13 HA ARG 13 -3.142 3.655 4.922
81 1HB ARG 13 2HB ARG 13 -2.049 0.855 4.611
82 2HB ARG 13 1HB ARG 13 -3.566 1.288 5.387
83 1HG ARG 13 2HG ARG 13 -3.793 2.451 2.904
84 2HG ARG 13 1HG ARG 13 -2.946 0.939 2.567
85 1HD ARG 13 2HD ARG 13 -5.529 1.212 4.101
86 2HD ARG 13 1HD ARG 13 -5.380 0.674 2.428
87 HE ARG 13 HE ARG 13 -4.028 -1.221 3.365
88 1HH1 ARG 13 2HH1 ARG 13 -6.443 0.428 5.307
89 2HH1 ARG 13 1HH1 ARG 13 -6.707 -0.937 6.351
90 1HH2 ARG 13 2HH2 ARG 13 -4.377 -2.999 4.736
91 2HH2 ARG 13 1HH2 ARG 13 -5.525 -2.887 6.036
92 H VAL 14 H VAL 14 0.055 2.251 5.541
93 HA VAL 14 HA VAL 14 -0.394 2.243 8.399
94 HB VAL 14 HB VAL 14 2.198 1.763 6.921
95 1HG1 VAL 14 1HG1 VAL 14 2.227 0.294 9.241
96 2HG1 VAL 14 2HG1 VAL 14 3.041 1.836 8.990
97 3HG1 VAL 14 3HG1 VAL 14 1.444 1.793 9.736
98 1HG2 VAL 14 1HG2 VAL 14 1.212 -0.660 7.864
99 2HG2 VAL 14 2HG2 VAL 14 -0.186 0.143 7.152
100 3HG2 VAL 14 3HG2 VAL 14 1.267 -0.123 6.186
101 H CYS 15 H CYS 15 2.480 3.553 6.790
102 HA CYS 15 HA CYS 15 2.404 5.878 8.503
103 1HB CYS 15 2HB CYS 15 4.502 6.334 6.855
104 2HB CYS 15 1HB CYS 15 4.607 5.438 8.360
105 H LYS 16 H LYS 16 0.394 6.499 7.601
106 HA LYS 16 HA LYS 16 -0.423 6.954 5.143
107 1HB LYS 16 2HB LYS 16 -1.058 8.900 7.349
108 2HB LYS 16 1HB LYS 16 -2.083 8.438 5.998
109 1HG LYS 16 2HG LYS 16 -1.780 6.039 7.085
110 2HG LYS 16 1HG LYS 16 -1.518 7.017 8.529
111 1HD LYS 16 2HD LYS 16 -3.683 7.541 8.688
112 2HD LYS 16 1HD LYS 16 -3.794 7.930 6.969
113 1HE LYS 16 2HE LYS 16 -4.332 5.751 6.381
114 2HE LYS 16 1HE LYS 16 -3.652 5.080 7.861
115 1HZ LYS 16 1HZ LYS 16 -5.918 4.926 8.188
116 2HZ LYS 16 2HZ LYS 16 -6.246 6.427 7.468
117 3HZ LYS 16 3HZ LYS 16 -5.536 6.364 9.006
118 H ASP 17 H ASP 17 1.792 7.578 4.383
119 HA ASP 17 HA ASP 17 1.990 10.507 4.065
120 1HB ASP 17 2HB ASP 17 3.840 8.998 5.193
121 2HB ASP 17 1HB ASP 17 4.246 8.607 3.528
122 H GLY 18 H GLY 18 3.044 11.123 1.948
123 1HA GLY 18 1HA GLY 18 1.837 9.545 -0.216
124 2HA GLY 18 2HA GLY 18 2.356 11.226 -0.332
125 H GLY 19 H GLY 19 4.153 11.544 -1.441
126 1HA GLY 19 1HA GLY 19 6.287 11.259 -2.244
127 2HA GLY 19 2HA GLY 19 6.515 10.030 -1.007
128 H GLU 20 H GLU 20 7.299 8.288 -1.991
129 HA GLU 20 HA GLU 20 6.296 7.517 -4.623
130 1HB GLU 20 2HB GLU 20 8.761 7.188 -3.258
131 2HB GLU 20 1HB GLU 20 8.093 5.583 -3.519
132 1HG GLU 20 2HG GLU 20 9.520 6.174 -5.355
133 2HG GLU 20 1HG GLU 20 7.847 6.098 -5.909
134 H LEU 21 H LEU 21 4.359 6.594 -4.506
135 HA LEU 21 HA LEU 21 3.870 4.664 -2.352
136 1HB LEU 21 2HB LEU 21 2.011 6.344 -4.017
137 2HB LEU 21 1HB LEU 21 1.446 5.046 -2.982
138 HG LEU 21 HG LEU 21 3.105 7.294 -1.881
139 1HD1 LEU 21 1HD1 LEU 21 0.582 7.946 -1.160
140 2HD1 LEU 21 2HD1 LEU 21 1.454 8.673 -2.511
141 3HD1 LEU 21 3HD1 LEU 21 0.320 7.353 -2.801
142 1HD2 LEU 21 1HD2 LEU 21 1.017 6.158 -0.232
143 2HD2 LEU 21 2HD2 LEU 21 2.134 4.926 -0.816
144 3HD2 LEU 21 3HD2 LEU 21 2.745 6.312 0.083
145 H LEU 22 H LEU 22 4.042 2.644 -2.883
146 HA LEU 22 HA LEU 22 3.555 1.667 -5.576
147 1HB LEU 22 2HB LEU 22 5.102 0.233 -4.745
148 2HB LEU 22 1HB LEU 22 4.679 0.587 -3.080
149 HG LEU 22 HG LEU 22 2.526 -0.865 -3.761
150 1HD1 LEU 22 1HD1 LEU 22 4.378 -1.274 -5.910
151 2HD1 LEU 22 2HD1 LEU 22 4.133 -2.781 -5.029
152 3HD1 LEU 22 3HD1 LEU 22 2.750 -1.917 -5.702
153 1HD2 LEU 22 1HD2 LEU 22 4.221 -1.174 -1.905
154 2HD2 LEU 22 2HD2 LEU 22 3.492 -2.646 -2.550
155 3HD2 LEU 22 3HD2 LEU 22 5.126 -2.186 -3.030
156 H CYS 23 H CYS 23 1.564 1.240 -6.251
157 HA CYS 23 HA CYS 23 -0.561 1.181 -4.237
158 1HB CYS 23 2HB CYS 23 -1.183 1.448 -7.134
159 2HB CYS 23 1HB CYS 23 -1.918 2.245 -5.747
160 HG CYS 23 HG CYS 23 1.094 3.383 -5.839
161 H CYS 24 H CYS 24 -2.120 -0.396 -4.178
162 HA CYS 24 HA CYS 24 -1.435 -2.993 -4.807
163 1HB CYS 24 2HB CYS 24 -4.246 -1.940 -4.555
164 2HB CYS 24 1HB CYS 24 -3.676 -3.565 -4.196
165 H ASP 25 H ASP 25 -2.334 -4.495 -6.306
166 HA ASP 25 HA ASP 25 -2.441 -3.512 -8.976
167 1HB ASP 25 2HB ASP 25 -1.496 -5.717 -8.418
168 2HB ASP 25 1HB ASP 25 -3.087 -6.272 -7.917
169 H THR 26 H THR 26 -4.837 -5.697 -7.548
170 HA THR 26 HA THR 26 -6.915 -4.282 -9.053
171 HB THR 26 HB THR 26 -6.695 -6.695 -9.457
172 HG1 THR 26 1HG THR 26 -9.056 -5.773 -8.167
173 1HG2 THR 26 1HG2 THR 26 -5.852 -7.427 -7.314
174 2HG2 THR 26 2HG2 THR 26 -7.343 -8.295 -7.686
175 3HG2 THR 26 3HG2 THR 26 -7.362 -6.965 -6.526
176 H CYS 27 H CYS 27 -5.714 -3.550 -6.355
177 HA CYS 27 HA CYS 27 -8.261 -3.281 -4.927
178 1HB CYS 27 2HB CYS 27 -7.175 -4.893 -3.655
179 2HB CYS 27 1HB CYS 27 -5.588 -4.221 -3.968
180 HA PRO 28 HA PRO 28 -7.194 0.932 -5.154
181 1HB PRO 28 2HB PRO 28 -9.186 1.980 -3.713
182 2HB PRO 28 1HB PRO 28 -9.503 1.075 -5.199
183 1HG PRO 28 2HG PRO 28 -9.778 0.209 -2.353
184 2HG PRO 28 1HG PRO 28 -10.816 -0.156 -3.742
185 1HD PRO 28 2HD PRO 28 -8.859 -1.843 -2.706
186 2HD PRO 28 1HD PRO 28 -9.564 -1.965 -4.327
187 H SER 29 H SER 29 -5.337 -0.094 -3.400
188 HA SER 29 HA SER 29 -5.306 1.982 -1.319
189 1HB SER 29 2HB SER 29 -4.105 -0.718 -0.800
190 2HB SER 29 1HB SER 29 -4.654 0.494 0.357
191 HG SER 29 HG SER 29 -6.300 -1.094 -1.345
192 H SER 30 H SER 30 -3.106 2.438 -0.496
193 HA SER 30 HA SER 30 -0.982 1.840 -2.422
194 1HB SER 30 2HB SER 30 -1.267 4.631 -1.353
195 2HB SER 30 1HB SER 30 -0.422 4.075 -2.797
196 HG SER 30 HG SER 30 -2.575 5.188 -3.016
197 H TYR 31 H TYR 31 1.071 1.810 -1.587
198 HA TYR 31 HA TYR 31 1.385 2.305 1.293
199 1HB TYR 31 2HB TYR 31 2.156 -0.225 -0.184
200 2HB TYR 31 1HB TYR 31 2.719 0.176 1.432
201 HD1 TYR 31 1HD TYR 31 -0.078 -1.015 -0.569
202 HD2 TYR 31 2HD TYR 31 1.164 0.140 3.331
203 HE1 TYR 31 1HE TYR 31 -2.064 -2.109 0.380
204 HE2 TYR 31 2HE TYR 31 -0.822 -0.944 4.290
205 HH TYR 31 HH TYR 31 -3.206 -2.585 2.195
206 H HIS 32 H HIS 32 3.847 1.790 1.775
207 HA HIS 32 HA HIS 32 5.485 3.145 -0.267
208 1HB HIS 32 2HB HIS 32 5.901 2.720 2.709
209 2HB HIS 32 1HB HIS 32 7.175 3.272 1.636
210 HD2 HIS 32 2HD HIS 32 6.698 5.846 0.485
211 HE1 HIS 32 1HE HIS 32 4.010 6.921 3.576
212 HE2 HIS 32 2HE HIS 32 5.287 7.754 1.538
213 H ILE 33 H ILE 33 7.796 1.818 1.286
214 HA ILE 33 HA ILE 33 7.298 -0.951 0.441
215 HB ILE 33 HB ILE 33 9.671 -1.211 -0.137
216 1HG1 ILE 33 2HG1 ILE 33 9.932 1.788 -0.065
217 1HG2 ILE 33 1HG2 ILE 33 8.251 0.980 -1.642
218 2HG2 ILE 33 2HG2 ILE 33 9.605 0.030 -2.259
219 3HG2 ILE 33 3HG2 ILE 33 8.070 -0.758 -1.895
220 1HD1 ILE 33 1HD1 ILE 33 12.115 1.510 -0.543
221 2HD1 ILE 33 2HD1 ILE 33 12.222 -0.028 0.313
222 3HD1 ILE 33 3HD1 ILE 33 11.509 0.036 -1.300
223 H HIS 34 H HIS 34 7.357 0.827 3.008
224 HA HIS 34 HA HIS 34 8.737 -1.170 4.645
225 1HB HIS 34 2HB HIS 34 9.852 1.334 4.095
226 2HB HIS 34 1HB HIS 34 9.164 1.496 5.708
227 HD2 HIS 34 2HD HIS 34 10.011 -0.849 7.387
228 HE1 HIS 34 1HE HIS 34 13.800 -0.751 5.507
229 HE2 HIS 34 2HE HIS 34 12.429 -1.789 7.375
230 H CYS 35 H CYS 35 5.890 -0.304 4.090
231 HA CYS 35 HA CYS 35 5.026 0.733 6.661
232 1HB CYS 35 2HB CYS 35 3.106 -0.266 4.608
233 2HB CYS 35 1HB CYS 35 2.995 1.147 5.656
234 H LEU 36 H LEU 36 4.269 -2.110 4.682
235 HA LEU 36 HA LEU 36 2.998 -3.443 6.878
236 1HB LEU 36 2HB LEU 36 3.449 -5.314 4.838
237 2HB LEU 36 1HB LEU 36 1.963 -4.454 5.192
238 HG LEU 36 HG LEU 36 3.219 -2.588 3.704
239 1HD1 LEU 36 1HD1 LEU 36 4.658 -5.049 3.250
240 2HD1 LEU 36 2HD1 LEU 36 3.900 -4.464 1.769
241 3HD1 LEU 36 3HD1 LEU 36 4.999 -3.419 2.669
242 1HD2 LEU 36 1HD2 LEU 36 1.901 -3.544 1.778
243 2HD2 LEU 36 2HD2 LEU 36 1.491 -4.894 2.840
244 3HD2 LEU 36 3HD2 LEU 36 0.993 -3.256 3.264
245 H ARG 37 H ARG 37 3.594 -5.629 7.569
246 HA ARG 37 HA ARG 37 6.210 -5.794 8.526
247 1HB ARG 37 2HB ARG 37 3.819 -7.368 8.696
248 2HB ARG 37 1HB ARG 37 5.199 -8.425 8.434
249 1HG ARG 37 2HG ARG 37 5.136 -6.314 10.571
250 2HG ARG 37 1HG ARG 37 4.598 -7.974 10.830
251 1HD ARG 37 2HD ARG 37 6.719 -8.410 11.376
252 2HD ARG 37 1HD ARG 37 7.049 -8.312 9.646
253 HE ARG 37 HE ARG 37 7.232 -5.896 11.316
254 1HH1 ARG 37 2HH1 ARG 37 8.739 -8.267 9.213
255 2HH1 ARG 37 1HH1 ARG 37 10.217 -7.354 9.051
256 1HH2 ARG 37 2HH2 ARG 37 9.147 -4.712 11.094
257 2HH2 ARG 37 1HH2 ARG 37 10.457 -5.346 10.137
258 HA PRO 38 HA PRO 38 7.300 -8.773 4.907
259 1HB PRO 38 2HB PRO 38 5.618 -8.983 2.816
260 2HB PRO 38 1HB PRO 38 5.471 -10.020 4.240
261 1HG PRO 38 2HG PRO 38 3.905 -7.588 3.496
262 2HG PRO 38 1HG PRO 38 3.342 -9.111 4.204
263 1HD PRO 38 2HD PRO 38 3.778 -6.825 5.651
264 2HD PRO 38 1HD PRO 38 3.876 -8.460 6.333
265 H ALA 39 H ALA 39 8.133 -6.392 5.194
266 HA ALA 39 HA ALA 39 7.508 -4.386 3.396
267 1HB ALA 39 1HB ALA 39 10.264 -4.163 4.095
268 2HB ALA 39 2HB ALA 39 8.884 -3.262 4.724
269 3HB ALA 39 3HB ALA 39 9.368 -4.777 5.484
270 H LEU 40 H LEU 40 8.781 -3.464 1.696
271 HA LEU 40 HA LEU 40 9.890 -5.542 -0.047
272 1HB LEU 40 2HB LEU 40 8.575 -2.890 -0.604
273 2HB LEU 40 1HB LEU 40 9.460 -3.768 -1.833
274 HG LEU 40 HG LEU 40 7.296 -4.397 -2.278
275 1HD1 LEU 40 1HD1 LEU 40 7.524 -6.602 -2.189
276 2HD1 LEU 40 2HD1 LEU 40 8.945 -6.335 -1.177
277 3HD1 LEU 40 3HD1 LEU 40 7.370 -6.617 -0.433
278 1HD2 LEU 40 1HD2 LEU 40 6.798 -4.471 0.689
279 2HD2 LEU 40 2HD2 LEU 40 6.190 -3.287 -0.470
280 3HD2 LEU 40 3HD2 LEU 40 5.626 -4.957 -0.535
281 H TYR 41 H TYR 41 11.968 -5.475 -0.569
282 HA TYR 41 HA TYR 41 13.629 -3.320 0.447
283 1HB TYR 41 2HB TYR 41 14.371 -5.829 -1.081
284 2HB TYR 41 1HB TYR 41 15.510 -4.712 -0.335
285 HD1 TYR 41 1HD TYR 41 15.756 -4.619 2.088
286 HD2 TYR 41 2HD TYR 41 13.098 -7.390 0.258
287 HE1 TYR 41 1HE TYR 41 15.619 -5.872 4.198
288 HE2 TYR 41 2HE TYR 41 12.948 -8.648 2.364
289 HH TYR 41 HH TYR 41 15.078 -8.353 4.827
290 H GLU 42 H GLU 42 12.156 -4.377 -2.446
291 HA GLU 42 HA GLU 42 13.178 -2.003 -3.816
292 1HB GLU 42 2HB GLU 42 13.129 -3.353 -5.970
293 2HB GLU 42 1HB GLU 42 14.463 -3.693 -4.875
294 1HG GLU 42 2HG GLU 42 12.303 -5.415 -4.217
295 2HG GLU 42 1HG GLU 42 12.566 -5.486 -5.960
296 H VAL 43 H VAL 43 11.642 -1.117 -5.312
297 HA VAL 43 HA VAL 43 8.959 -1.476 -4.438
298 HB VAL 43 HB VAL 43 9.698 0.035 -6.929
299 1HG1 VAL 43 1HG1 VAL 43 7.492 0.399 -6.806
300 2HG1 VAL 43 2HG1 VAL 43 7.399 -0.154 -5.135
301 3HG1 VAL 43 3HG1 VAL 43 7.889 1.503 -5.490
302 1HG2 VAL 43 1HG2 VAL 43 11.298 0.919 -5.497
303 2HG2 VAL 43 2HG2 VAL 43 9.929 2.005 -5.262
304 3HG2 VAL 43 3HG2 VAL 43 10.268 0.746 -4.076
305 HA PRO 44 HA PRO 44 8.020 -4.817 -7.231
306 1HB PRO 44 2HB PRO 44 5.292 -4.571 -6.189
307 2HB PRO 44 1HB PRO 44 6.428 -5.911 -6.031
308 1HG PRO 44 2HG PRO 44 5.750 -4.347 -3.940
309 2HG PRO 44 1HG PRO 44 7.364 -5.068 -4.102
310 1HD PRO 44 2HD PRO 44 6.466 -2.272 -4.702
311 2HD PRO 44 1HD PRO 44 7.953 -2.829 -3.902
312 H ASP 45 H ASP 45 7.050 -5.026 -9.201
313 HA ASP 45 HA ASP 45 5.046 -3.099 -10.064
314 1HB ASP 45 2HB ASP 45 7.013 -1.853 -10.597
315 2HB ASP 45 1HB ASP 45 7.817 -3.273 -11.258
316 H GLY 46 H GLY 46 3.614 -4.048 -11.379
317 1HA GLY 46 1HA GLY 46 3.444 -5.477 -13.451
318 2HA GLY 46 2HA GLY 46 4.378 -6.654 -12.538
319 H GLU 47 H GLU 47 3.400 -7.802 -10.856
320 HA GLU 47 HA GLU 47 0.480 -7.502 -10.640
321 1HB GLU 47 2HB GLU 47 1.659 -10.241 -10.495
322 2HB GLU 47 1HB GLU 47 0.055 -9.740 -11.007
323 1HG GLU 47 2HG GLU 47 0.813 -10.234 -13.047
324 2HG GLU 47 1HG GLU 47 1.562 -8.640 -12.957
325 H TRP 48 H TRP 48 1.040 -6.333 -8.690
326 HA TRP 48 HA TRP 48 2.002 -8.058 -6.510
327 1HB TRP 48 2HB TRP 48 3.285 -5.997 -6.832
328 2HB TRP 48 1HB TRP 48 1.817 -5.039 -6.670
329 HD1 TRP 48 HD TRP 48 4.131 -7.293 -4.553
330 HE1 TRP 48 1HE TRP 48 3.897 -6.594 -2.080
331 HE3 TRP 48 3HE TRP 48 0.374 -3.857 -5.036
332 HZ2 TRP 48 2HZ TRP 48 2.325 -4.814 -0.550
333 HZ3 TRP 48 3HZ TRP 48 -0.439 -2.701 -3.020
334 HH2 TRP 48 HH TRP 48 0.519 -3.170 -0.823
335 H GLN 49 H GLN 49 0.432 -8.985 -5.387
336 HA GLN 49 HA GLN 49 -2.045 -7.478 -4.904
337 1HB GLN 49 2HB GLN 49 -1.712 -10.123 -5.675
338 2HB GLN 49 1HB GLN 49 -2.021 -10.236 -3.948
339 1HG GLN 49 2HG GLN 49 -3.897 -9.980 -5.991
340 2HG GLN 49 1HG GLN 49 -4.189 -9.889 -4.255
341 1HE2 GLN 49 1HE2 GLN 49 -4.797 -7.998 -3.385
342 2HE2 GLN 49 2HE2 GLN 49 -4.921 -6.504 -4.251
343 H CYS 50 H CYS 50 -2.548 -6.846 -2.895
344 HA CYS 50 HA CYS 50 -0.405 -6.642 -1.087
345 1HB CYS 50 2HB CYS 50 -2.526 -5.692 0.287
346 2HB CYS 50 1HB CYS 50 -1.670 -4.780 -0.956
347 HA PRO 51 HA PRO 51 -1.627 -9.864 1.768
348 1HB PRO 51 2HB PRO 51 0.549 -9.720 3.307
349 2HB PRO 51 1HB PRO 51 0.665 -10.275 1.633
350 1HG PRO 51 2HG PRO 51 1.542 -7.718 2.829
351 2HG PRO 51 1HG PRO 51 2.124 -8.534 1.370
352 1HD PRO 51 2HD PRO 51 0.204 -6.385 1.581
353 2HD PRO 51 1HD PRO 51 0.846 -7.150 0.112
354 H ARG 52 H ARG 52 -2.485 -6.921 2.149
355 HA ARG 52 HA ARG 52 -2.688 -7.009 5.076
356 1HB ARG 52 2HB ARG 52 -0.996 -5.315 3.710
357 2HB ARG 52 1HB ARG 52 -2.397 -4.304 4.046
358 1HG ARG 52 2HG ARG 52 -1.173 -3.944 5.933
359 2HG ARG 52 1HG ARG 52 -2.149 -5.320 6.455
360 1HD ARG 52 2HD ARG 52 0.442 -5.889 5.126
361 2HD ARG 52 1HD ARG 52 0.490 -5.244 6.764
362 HE ARG 52 HE ARG 52 -0.817 -7.772 5.974
363 1HH1 ARG 52 2HH1 ARG 52 0.671 -5.711 8.401
364 2HH1 ARG 52 1HH1 ARG 52 0.720 -6.962 9.612
365 1HH2 ARG 52 2HH2 ARG 52 -0.756 -9.413 7.562
366 2HH2 ARG 52 1HH2 ARG 52 -0.111 -9.061 9.142
367 H CYS 53 H CYS 53 -3.868 -4.995 2.313
368 HA CYS 53 HA CYS 53 -6.038 -3.988 3.696
369 1HB CYS 53 2HB CYS 53 -6.405 -4.453 0.791
370 2HB CYS 53 1HB CYS 53 -6.686 -3.003 1.744
371 H THR 54 H THR 54 -5.845 -6.904 1.721
372 HA THR 54 HA THR 54 -7.258 -8.636 1.354
373 HB THR 54 HB THR 54 -8.749 -9.135 3.541
374 HG1 THR 54 1HG THR 54 -7.611 -7.030 4.365
375 1HG2 THR 54 1HG2 THR 54 -7.125 -10.664 2.649
376 2HG2 THR 54 2HG2 THR 54 -6.810 -10.459 4.371
377 3HG2 THR 54 3HG2 THR 54 -5.797 -9.636 3.187
378 H CYS 55 H CYS 55 -8.252 -6.747 0.008
379 HA CYS 55 HA CYS 55 -10.794 -5.737 0.733
380 1HB CYS 55 2HB CYS 55 -10.833 -5.579 -1.952
381 2HB CYS 55 1HB CYS 55 -9.919 -4.463 -0.942
382 HG CYS 55 HG CYS 55 -7.731 -4.882 -2.197
383 HA PRO 56 HA PRO 56 -13.541 -9.051 -0.225
384 1HB PRO 56 2HB PRO 56 -15.343 -7.217 -1.657
385 2HB PRO 56 1HB PRO 56 -15.608 -8.108 -0.155
386 1HG PRO 56 2HG PRO 56 -15.272 -5.451 -0.164
387 2HG PRO 56 1HG PRO 56 -14.633 -6.462 1.146
388 1HD PRO 56 2HD PRO 56 -13.199 -5.289 -1.212
389 2HD PRO 56 1HD PRO 56 -12.691 -5.358 0.490
390 H ALA 57 H ALA 57 -11.740 -7.705 -2.544
391 HA ALA 57 HA ALA 57 -13.030 -8.870 -4.870
392 1HB ALA 57 1HB ALA 57 -10.884 -6.982 -4.394
393 2HB ALA 57 2HB ALA 57 -10.418 -8.212 -5.568
394 3HB ALA 57 3HB ALA 57 -11.859 -7.234 -5.841
395 H LEU 58 H LEU 58 -13.046 -10.939 -3.605
396 HA LEU 58 HA LEU 58 -10.703 -12.536 -4.313
397 1HB LEU 58 2HB LEU 58 -11.371 -11.727 -1.650
398 2HB LEU 58 1HB LEU 58 -11.627 -13.456 -1.787
399 HG LEU 58 HG LEU 58 -9.135 -12.967 -2.989
400 1HD1 LEU 58 1HD1 LEU 58 -9.405 -10.748 -1.692
401 2HD1 LEU 58 2HD1 LEU 58 -9.107 -11.736 -0.262
402 3HD1 LEU 58 3HD1 LEU 58 -7.895 -11.646 -1.542
403 1HD2 LEU 58 1HD2 LEU 58 -8.486 -14.629 -1.608
404 2HD2 LEU 58 2HD2 LEU 58 -9.203 -13.875 -0.184
405 3HD2 LEU 58 3HD2 LEU 58 -10.219 -14.772 -1.313
406 H LYS 59 H LYS 59 -12.825 -12.658 -5.821
407 HA LYS 59 HA LYS 59 -14.934 -14.322 -4.950
408 1HB LYS 59 2HB LYS 59 -13.915 -13.671 -7.714
409 2HB LYS 59 1HB LYS 59 -15.380 -14.595 -7.409
410 1HG LYS 59 2HG LYS 59 -15.878 -12.435 -5.896
411 2HG LYS 59 1HG LYS 59 -14.869 -11.709 -7.148
412 1HD LYS 59 2HD LYS 59 -16.343 -12.654 -8.866
413 2HD LYS 59 1HD LYS 59 -17.358 -13.351 -7.603
414 1HE LYS 59 2HE LYS 59 -18.142 -11.277 -6.914
415 2HE LYS 59 1HE LYS 59 -16.782 -10.416 -7.637
416 1HZ LYS 59 1HZ LYS 59 -17.672 -10.644 -9.762
417 2HZ LYS 59 2HZ LYS 59 -19.020 -10.271 -8.801
418 3HZ LYS 59 3HZ LYS 59 -18.750 -11.871 -9.297
419 H GLY 60 H GLY 60 -11.792 -14.973 -6.318
420 1HA GLY 60 1HA GLY 60 -12.359 -17.856 -5.999
421 2HA GLY 60 2HA GLY 60 -11.372 -17.245 -7.320
422 H LYS 61 H LYS 61 -9.489 -15.862 -6.593
423 HA LYS 61 HA LYS 61 -8.382 -16.729 -4.024
424 1HB LYS 61 2HB LYS 61 -6.159 -17.062 -5.192
425 2HB LYS 61 1HB LYS 61 -7.374 -18.293 -5.508
426 1HG LYS 61 2HG LYS 61 -7.168 -17.950 -7.682
427 2HG LYS 61 1HG LYS 61 -7.645 -16.265 -7.473
428 1HD LYS 61 2HD LYS 61 -5.595 -15.705 -8.132
429 2HD LYS 61 1HD LYS 61 -5.009 -16.361 -6.600
430 1HE LYS 61 2HE LYS 61 -3.752 -17.640 -7.981
431 2HE LYS 61 1HE LYS 61 -5.207 -18.635 -7.991
432 1HZ LYS 61 1HZ LYS 61 -3.953 -17.495 -10.165
433 2HZ LYS 61 2HZ LYS 61 -5.383 -16.609 -9.964
434 3HZ LYS 61 3HZ LYS 61 -5.450 -18.291 -10.151
Start of MODEL 11
1 1H GLY 1 1H GLY 1 -7.702 -0.192 13.676
2 2H GLY 1 2H GLY 1 -8.680 -0.916 12.490
3 3H GLY 1 3H GLY 1 -9.388 -0.016 13.744
4 1HA GLY 1 2HA GLY 1 -8.179 1.971 12.911
5 2HA GLY 1 1HA GLY 1 -7.708 1.002 11.521
6 HA PRO 2 HA PRO 2 -12.503 2.177 11.608
7 1HB PRO 2 2HB PRO 2 -11.910 5.076 11.779
8 2HB PRO 2 1HB PRO 2 -13.208 4.148 12.536
9 1HG PRO 2 2HG PRO 2 -11.153 5.052 13.973
10 2HG PRO 2 1HG PRO 2 -11.871 3.463 14.296
11 1HD PRO 2 2HD PRO 2 -9.335 4.139 12.857
12 2HD PRO 2 1HD PRO 2 -9.671 2.815 13.992
13 H LEU 3 H LEU 3 -13.277 2.262 9.604
14 HA LEU 3 HA LEU 3 -11.566 3.400 7.521
15 1HB LEU 3 2HB LEU 3 -13.612 1.253 7.634
16 2HB LEU 3 1HB LEU 3 -13.440 2.123 6.120
17 HG LEU 3 HG LEU 3 -10.831 1.420 6.964
18 1HD1 LEU 3 1HD1 LEU 3 -12.861 -0.763 7.308
19 2HD1 LEU 3 2HD1 LEU 3 -11.187 -1.110 6.876
20 3HD1 LEU 3 3HD1 LEU 3 -11.553 -0.285 8.392
21 1HD2 LEU 3 1HD2 LEU 3 -12.188 1.572 4.655
22 2HD2 LEU 3 2HD2 LEU 3 -10.656 0.715 4.827
23 3HD2 LEU 3 3HD2 LEU 3 -12.177 -0.177 4.880
24 H GLY 4 H GLY 4 -12.034 5.307 6.687
25 1HA GLY 4 1HA GLY 4 -14.634 6.520 7.179
26 2HA GLY 4 2HA GLY 4 -13.233 7.302 6.455
27 H SER 5 H SER 5 -15.351 7.943 5.149
28 HA SER 5 HA SER 5 -16.074 5.999 3.135
29 1HB SER 5 2HB SER 5 -16.801 8.872 2.848
30 2HB SER 5 1HB SER 5 -17.779 7.429 2.575
31 HG SER 5 HG SER 5 -17.142 8.719 5.013
32 H ASP 6 H ASP 6 -13.444 6.183 2.936
33 HA ASP 6 HA ASP 6 -12.821 8.079 0.787
34 1HB ASP 6 2HB ASP 6 -11.274 6.806 2.905
35 2HB ASP 6 1HB ASP 6 -10.513 6.619 1.327
36 H HIS 7 H HIS 7 -13.250 7.366 -1.171
37 HA HIS 7 HA HIS 7 -13.377 4.524 -1.709
38 1HB HIS 7 2HB HIS 7 -13.887 5.739 -4.117
39 2HB HIS 7 1HB HIS 7 -15.103 5.304 -2.925
40 HD2 HIS 7 2HD HIS 7 -13.374 8.442 -4.410
41 HE1 HIS 7 1HE HIS 7 -16.407 9.692 -1.738
42 HE2 HIS 7 2HE HIS 7 -14.568 10.462 -3.305
43 H HIS 8 H HIS 8 -11.024 6.886 -1.883
44 HA HIS 8 HA HIS 8 -9.276 5.099 -3.336
45 1HB HIS 8 2HB HIS 8 -10.460 6.840 -4.949
46 2HB HIS 8 1HB HIS 8 -9.235 7.927 -4.306
47 HD2 HIS 8 2HD HIS 8 -6.537 7.055 -4.808
48 HE1 HIS 8 1HE HIS 8 -7.735 4.627 -8.056
49 HE2 HIS 8 2HE HIS 8 -5.793 5.854 -6.986
50 H MET 9 H MET 9 -7.163 5.303 -2.698
51 HA MET 9 HA MET 9 -6.547 7.507 -0.849
52 1HB MET 9 2HB MET 9 -6.864 4.875 -0.095
53 2HB MET 9 1HB MET 9 -5.124 5.006 -0.315
54 1HG MET 9 2HG MET 9 -4.877 6.503 1.388
55 2HG MET 9 1HG MET 9 -6.523 7.114 1.227
56 1HE MET 9 1HE MET 9 -7.378 7.019 3.739
57 2HE MET 9 2HE MET 9 -8.452 6.423 2.473
58 3HE MET 9 3HE MET 9 -8.317 5.548 3.996
59 H GLU 10 H GLU 10 -5.052 8.721 -1.760
60 HA GLU 10 HA GLU 10 -3.189 7.635 -3.701
61 1HB GLU 10 2HB GLU 10 -3.352 10.433 -2.565
62 2HB GLU 10 1HB GLU 10 -2.470 9.935 -4.001
63 1HG GLU 10 2HG GLU 10 -4.306 9.929 -5.292
64 2HG GLU 10 1HG GLU 10 -5.341 9.312 -4.006
65 H PHE 11 H PHE 11 -3.289 8.321 -0.358
66 HA PHE 11 HA PHE 11 -0.372 8.091 -0.135
67 1HB PHE 11 2HB PHE 11 -0.650 8.825 2.200
68 2HB PHE 11 1HB PHE 11 -1.308 10.001 1.071
69 HD1 PHE 11 1HD PHE 11 -3.790 10.147 0.775
70 HD2 PHE 11 2HD PHE 11 -1.994 7.829 3.861
71 HE1 PHE 11 1HE PHE 11 -5.920 10.134 2.004
72 HE2 PHE 11 2HE PHE 11 -4.126 7.804 5.087
73 HZ PHE 11 HZ PHE 11 -6.091 8.961 4.162
74 H CYS 12 H CYS 12 0.449 6.632 1.563
75 HA CYS 12 HA CYS 12 -0.753 4.086 1.237
76 1HB CYS 12 2HB CYS 12 1.170 3.211 2.114
77 2HB CYS 12 1HB CYS 12 1.758 4.787 1.606
78 HG CYS 12 HG CYS 12 2.925 5.061 3.878
79 H ARG 13 H ARG 13 -1.792 2.768 2.675
80 HA ARG 13 HA ARG 13 -3.527 4.079 4.437
81 1HB ARG 13 2HB ARG 13 -2.953 1.121 4.200
82 2HB ARG 13 1HB ARG 13 -4.341 1.826 5.020
83 1HG ARG 13 2HG ARG 13 -4.487 2.968 2.534
84 2HG ARG 13 1HG ARG 13 -3.875 1.351 2.179
85 1HD ARG 13 2HD ARG 13 -6.385 2.058 3.695
86 2HD ARG 13 1HD ARG 13 -6.278 1.323 2.097
87 HE ARG 13 HE ARG 13 -5.848 0.022 4.666
88 1HH1 ARG 13 2HH1 ARG 13 -5.781 -0.204 1.156
89 2HH1 ARG 13 1HH1 ARG 13 -5.619 -1.937 1.158
90 1HH2 ARG 13 2HH2 ARG 13 -5.665 -2.275 4.633
91 2HH2 ARG 13 1HH2 ARG 13 -5.563 -3.097 3.103
92 H VAL 14 H VAL 14 -0.865 1.820 5.165
93 HA VAL 14 HA VAL 14 -1.259 1.897 7.944
94 HB VAL 14 HB VAL 14 1.414 1.245 6.747
95 1HG1 VAL 14 1HG1 VAL 14 1.450 -0.434 8.510
96 2HG1 VAL 14 2HG1 VAL 14 1.138 1.164 9.186
97 3HG1 VAL 14 3HG1 VAL 14 -0.187 0.016 8.991
98 1HG2 VAL 14 1HG2 VAL 14 -1.119 0.057 6.027
99 2HG2 VAL 14 2HG2 VAL 14 0.488 -0.238 5.364
100 3HG2 VAL 14 3HG2 VAL 14 -0.054 -1.122 6.791
101 H CYS 15 H CYS 15 1.760 3.048 6.411
102 HA CYS 15 HA CYS 15 1.996 4.952 8.564
103 1HB CYS 15 2HB CYS 15 4.218 5.389 7.049
104 2HB CYS 15 1HB CYS 15 4.098 4.297 8.415
105 H LYS 16 H LYS 16 -0.044 5.413 6.665
106 HA LYS 16 HA LYS 16 -0.793 7.032 5.104
107 1HB LYS 16 2HB LYS 16 -0.227 8.326 7.764
108 2HB LYS 16 1HB LYS 16 -1.259 9.033 6.529
109 1HG LYS 16 2HG LYS 16 -2.952 7.584 6.913
110 2HG LYS 16 1HG LYS 16 -1.870 6.261 7.353
111 1HD LYS 16 2HD LYS 16 -2.947 6.831 9.354
112 2HD LYS 16 1HD LYS 16 -1.367 7.609 9.465
113 1HE LYS 16 2HE LYS 16 -2.235 9.706 9.293
114 2HE LYS 16 1HE LYS 16 -3.570 9.184 8.264
115 1HZ LYS 16 1HZ LYS 16 -3.402 8.552 11.159
116 2HZ LYS 16 2HZ LYS 16 -4.740 8.357 10.135
117 3HZ LYS 16 3HZ LYS 16 -4.208 9.914 10.549
118 H ASP 17 H ASP 17 1.493 6.908 3.940
119 HA ASP 17 HA ASP 17 2.305 9.684 3.568
120 1HB ASP 17 2HB ASP 17 3.790 8.736 5.337
121 2HB ASP 17 1HB ASP 17 4.323 7.514 4.192
122 H GLY 18 H GLY 18 3.611 9.988 1.620
123 1HA GLY 18 1HA GLY 18 3.068 7.870 -0.364
124 2HA GLY 18 2HA GLY 18 3.127 9.590 -0.736
125 H GLY 19 H GLY 19 4.796 9.846 -2.074
126 1HA GLY 19 1HA GLY 19 7.029 10.080 -2.652
127 2HA GLY 19 2HA GLY 19 7.475 9.356 -1.110
128 H GLU 20 H GLU 20 7.372 7.059 -0.915
129 HA GLU 20 HA GLU 20 7.962 5.633 -3.395
130 1HB GLU 20 2HB GLU 20 9.021 5.376 -0.897
131 2HB GLU 20 1HB GLU 20 7.771 4.140 -0.844
132 1HG GLU 20 2HG GLU 20 9.482 2.894 -1.644
133 2HG GLU 20 1HG GLU 20 8.834 3.484 -3.173
134 H LEU 21 H LEU 21 5.942 5.683 -4.373
135 HA LEU 21 HA LEU 21 3.719 4.596 -2.815
136 1HB LEU 21 2HB LEU 21 4.015 6.882 -4.441
137 2HB LEU 21 1HB LEU 21 2.898 5.821 -5.277
138 HG LEU 21 HG LEU 21 1.237 6.191 -3.799
139 1HD1 LEU 21 1HD1 LEU 21 1.607 6.528 -1.349
140 2HD1 LEU 21 2HD1 LEU 21 2.172 4.977 -1.973
141 3HD1 LEU 21 3HD1 LEU 21 3.327 6.266 -1.635
142 1HD2 LEU 21 1HD2 LEU 21 2.621 8.451 -4.306
143 2HD2 LEU 21 2HD2 LEU 21 1.087 8.402 -3.437
144 3HD2 LEU 21 3HD2 LEU 21 2.606 8.465 -2.542
145 H LEU 22 H LEU 22 3.742 2.482 -3.121
146 HA LEU 22 HA LEU 22 3.683 1.320 -5.800
147 1HB LEU 22 2HB LEU 22 4.170 0.345 -3.136
148 2HB LEU 22 1HB LEU 22 2.847 -0.551 -3.854
149 HG LEU 22 HG LEU 22 5.461 -0.194 -5.288
150 1HD1 LEU 22 1HD1 LEU 22 6.314 -1.292 -3.489
151 2HD1 LEU 22 2HD1 LEU 22 4.764 -2.009 -3.051
152 3HD1 LEU 22 3HD1 LEU 22 5.695 -2.675 -4.393
153 1HD2 LEU 22 1HD2 LEU 22 3.510 -2.459 -5.503
154 2HD2 LEU 22 2HD2 LEU 22 3.298 -0.969 -6.424
155 3HD2 LEU 22 3HD2 LEU 22 4.747 -1.948 -6.650
156 H CYS 23 H CYS 23 1.783 0.167 -6.521
157 HA CYS 23 HA CYS 23 -0.661 1.459 -5.555
158 1HB CYS 23 2HB CYS 23 -1.026 -0.102 -7.949
159 2HB CYS 23 1HB CYS 23 -1.229 1.631 -7.710
160 HG CYS 23 HG CYS 23 0.716 2.272 -9.227
161 H CYS 24 H CYS 24 -2.205 0.359 -4.549
162 HA CYS 24 HA CYS 24 -2.014 -2.209 -3.577
163 1HB CYS 24 2HB CYS 24 -4.031 -0.129 -3.803
164 2HB CYS 24 1HB CYS 24 -4.739 -1.736 -3.871
165 H ASP 25 H ASP 25 -2.883 -4.194 -4.188
166 HA ASP 25 HA ASP 25 -2.773 -4.758 -6.941
167 1HB ASP 25 2HB ASP 25 -2.236 -6.418 -5.209
168 2HB ASP 25 1HB ASP 25 -3.932 -6.467 -4.737
169 H THR 26 H THR 26 -5.625 -5.316 -4.856
170 HA THR 26 HA THR 26 -7.268 -4.696 -7.223
171 HB THR 26 HB THR 26 -7.485 -7.019 -6.584
172 HG1 THR 26 1HG THR 26 -9.638 -5.270 -6.208
173 1HG2 THR 26 1HG2 THR 26 -8.697 -7.392 -4.282
174 2HG2 THR 26 2HG2 THR 26 -7.881 -5.886 -3.856
175 3HG2 THR 26 3HG2 THR 26 -6.937 -7.287 -4.373
176 H CYS 27 H CYS 27 -6.278 -3.391 -4.429
177 HA CYS 27 HA CYS 27 -8.825 -2.153 -3.723
178 1HB CYS 27 2HB CYS 27 -6.484 -1.446 -2.125
179 2HB CYS 27 1HB CYS 27 -8.018 -2.154 -1.619
180 HA PRO 28 HA PRO 28 -7.461 1.683 -5.463
181 1HB PRO 28 2HB PRO 28 -9.118 3.397 -4.295
182 2HB PRO 28 1HB PRO 28 -9.752 2.053 -5.257
183 1HG PRO 28 2HG PRO 28 -9.635 2.379 -2.298
184 2HG PRO 28 1HG PRO 28 -10.859 1.577 -3.294
185 1HD PRO 28 2HD PRO 28 -8.729 0.344 -1.903
186 2HD PRO 28 1HD PRO 28 -9.806 -0.418 -3.090
187 H SER 29 H SER 29 -5.933 0.879 -2.934
188 HA SER 29 HA SER 29 -5.335 3.546 -1.871
189 1HB SER 29 2HB SER 29 -3.909 1.575 -0.431
190 2HB SER 29 1HB SER 29 -5.324 2.480 0.103
191 HG SER 29 HG SER 29 -5.190 -0.060 -1.139
192 H SER 30 H SER 30 -2.955 3.670 -1.121
193 HA SER 30 HA SER 30 -1.165 2.520 -3.124
194 1HB SER 30 2HB SER 30 -0.763 5.315 -2.067
195 2HB SER 30 1HB SER 30 -0.015 4.554 -3.470
196 HG SER 30 HG SER 30 -2.774 5.235 -3.219
197 H TYR 31 H TYR 31 1.066 2.331 -2.298
198 HA TYR 31 HA TYR 31 1.203 2.335 0.645
199 1HB TYR 31 2HB TYR 31 1.347 0.012 -1.215
200 2HB TYR 31 1HB TYR 31 2.428 0.014 0.172
201 HD1 TYR 31 1HD TYR 31 1.622 -0.505 2.340
202 HD2 TYR 31 2HD TYR 31 -1.125 0.111 -0.848
203 HE1 TYR 31 1HE TYR 31 -0.189 -1.400 3.736
204 HE2 TYR 31 2HE TYR 31 -2.947 -0.777 0.543
205 HH TYR 31 HH TYR 31 -3.226 -2.260 2.466
206 H HIS 32 H HIS 32 3.459 1.579 1.331
207 HA HIS 32 HA HIS 32 5.523 2.926 -0.285
208 1HB HIS 32 2HB HIS 32 5.364 1.976 2.573
209 2HB HIS 32 1HB HIS 32 6.930 2.172 1.804
210 HD2 HIS 32 2HD HIS 32 7.468 4.892 0.987
211 HE1 HIS 32 1HE HIS 32 4.874 6.399 3.976
212 HE2 HIS 32 2HE HIS 32 6.578 7.014 2.198
213 H ILE 33 H ILE 33 7.565 1.204 0.864
214 HA ILE 33 HA ILE 33 6.819 -1.410 -0.250
215 HB ILE 33 HB ILE 33 9.259 -1.843 -0.590
216 1HG1 ILE 33 2HG1 ILE 33 9.493 1.135 -0.092
217 1HG2 ILE 33 1HG2 ILE 33 7.981 0.424 -2.103
218 2HG2 ILE 33 2HG2 ILE 33 9.444 -0.409 -2.632
219 3HG2 ILE 33 3HG2 ILE 33 7.924 -1.296 -2.492
220 1HD1 ILE 33 1HD1 ILE 33 10.983 -0.076 -1.906
221 2HD1 ILE 33 2HD1 ILE 33 11.640 1.136 -0.805
222 3HD1 ILE 33 3HD1 ILE 33 11.874 -0.579 -0.469
223 H HIS 34 H HIS 34 6.843 0.139 2.468
224 HA HIS 34 HA HIS 34 7.758 -2.126 4.063
225 1HB HIS 34 2HB HIS 34 8.998 -0.469 5.579
226 2HB HIS 34 1HB HIS 34 9.771 -0.923 4.065
227 HD2 HIS 34 2HD HIS 34 8.200 2.178 5.791
228 HE1 HIS 34 1HE HIS 34 9.945 3.387 2.132
229 HE2 HIS 34 2HE HIS 34 9.007 4.182 4.351
230 H CYS 35 H CYS 35 5.125 -0.699 3.524
231 HA CYS 35 HA CYS 35 4.421 0.408 6.100
232 1HB CYS 35 2HB CYS 35 2.392 -0.583 4.125
233 2HB CYS 35 1HB CYS 35 2.288 0.777 5.235
234 H LEU 36 H LEU 36 4.369 -2.636 4.486
235 HA LEU 36 HA LEU 36 2.669 -3.858 6.513
236 1HB LEU 36 2HB LEU 36 3.394 -5.771 4.600
237 2HB LEU 36 1HB LEU 36 1.860 -4.932 4.740
238 HG LEU 36 HG LEU 36 3.507 -3.135 3.385
239 1HD1 LEU 36 1HD1 LEU 36 3.818 -5.166 1.484
240 2HD1 LEU 36 2HD1 LEU 36 5.084 -4.274 2.329
241 3HD1 LEU 36 3HD1 LEU 36 4.485 -5.795 2.991
242 1HD2 LEU 36 1HD2 LEU 36 1.432 -3.086 2.543
243 2HD2 LEU 36 2HD2 LEU 36 2.042 -4.300 1.419
244 3HD2 LEU 36 3HD2 LEU 36 1.153 -4.799 2.858
245 H ARG 37 H ARG 37 3.292 -6.212 7.007
246 HA ARG 37 HA ARG 37 5.826 -6.200 8.321
247 1HB ARG 37 2HB ARG 37 3.691 -7.371 9.090
248 2HB ARG 37 1HB ARG 37 4.073 -8.615 7.909
249 1HG ARG 37 2HG ARG 37 4.808 -9.224 10.156
250 2HG ARG 37 1HG ARG 37 6.165 -9.082 9.038
251 1HD ARG 37 2HD ARG 37 5.532 -6.592 10.422
252 2HD ARG 37 1HD ARG 37 5.988 -7.903 11.512
253 HE ARG 37 HE ARG 37 7.998 -8.125 9.951
254 1HH1 ARG 37 2HH1 ARG 37 6.389 -5.091 10.661
255 2HH1 ARG 37 1HH1 ARG 37 7.793 -4.124 10.323
256 1HH2 ARG 37 2HH2 ARG 37 9.844 -6.866 9.548
257 2HH2 ARG 37 1HH2 ARG 37 9.766 -5.136 9.702
258 HA PRO 38 HA PRO 38 7.184 -9.290 4.903
259 1HB PRO 38 2HB PRO 38 5.166 -9.408 2.830
260 2HB PRO 38 1HB PRO 38 5.788 -10.721 3.830
261 1HG PRO 38 2HG PRO 38 3.240 -9.776 4.017
262 2HG PRO 38 1HG PRO 38 4.112 -10.509 5.376
263 1HD PRO 38 2HD PRO 38 3.691 -7.606 4.742
264 2HD PRO 38 1HD PRO 38 3.570 -8.447 6.304
265 H ALA 39 H ALA 39 7.764 -6.755 5.001
266 HA ALA 39 HA ALA 39 7.176 -5.259 2.638
267 1HB ALA 39 1HB ALA 39 7.481 -4.118 4.734
268 2HB ALA 39 2HB ALA 39 9.113 -4.767 4.893
269 3HB ALA 39 3HB ALA 39 8.746 -3.610 3.612
270 H LEU 40 H LEU 40 9.189 -4.083 1.640
271 HA LEU 40 HA LEU 40 11.277 -6.049 1.006
272 1HB LEU 40 2HB LEU 40 10.303 -4.279 -1.183
273 2HB LEU 40 1HB LEU 40 11.023 -5.875 -1.278
274 HG LEU 40 HG LEU 40 8.468 -6.064 0.017
275 1HD1 LEU 40 1HD1 LEU 40 7.164 -5.457 -2.101
276 2HD1 LEU 40 2HD1 LEU 40 7.673 -4.141 -1.041
277 3HD1 LEU 40 3HD1 LEU 40 8.566 -4.476 -2.522
278 1HD2 LEU 40 1HD2 LEU 40 8.069 -7.719 -1.642
279 2HD2 LEU 40 2HD2 LEU 40 9.294 -7.036 -2.710
280 3HD2 LEU 40 3HD2 LEU 40 9.777 -7.824 -1.208
281 H TYR 41 H TYR 41 13.118 -4.904 -0.198
282 HA TYR 41 HA TYR 41 13.537 -2.277 1.070
283 1HB TYR 41 2HB TYR 41 15.548 -4.302 0.054
284 2HB TYR 41 1HB TYR 41 15.966 -2.714 0.695
285 HD1 TYR 41 1HD TYR 41 16.662 -5.650 1.664
286 HD2 TYR 41 2HD TYR 41 13.898 -2.677 2.937
287 HE1 TYR 41 1HE TYR 41 16.692 -6.597 3.933
288 HE2 TYR 41 2HE TYR 41 13.936 -3.605 5.210
289 HH TYR 41 HH TYR 41 15.143 -4.970 6.617
290 H GLU 42 H GLU 42 12.963 -3.859 -1.829
291 HA GLU 42 HA GLU 42 13.649 -1.434 -3.346
292 1HB GLU 42 2HB GLU 42 13.855 -4.332 -4.144
293 2HB GLU 42 1HB GLU 42 13.705 -3.065 -5.350
294 1HG GLU 42 2HG GLU 42 15.761 -2.073 -4.671
295 2HG GLU 42 1HG GLU 42 15.873 -3.148 -3.276
296 H VAL 43 H VAL 43 12.210 -1.327 -5.385
297 HA VAL 43 HA VAL 43 9.479 -2.008 -4.543
298 HB VAL 43 HB VAL 43 9.809 0.372 -4.938
299 1HG1 VAL 43 1HG1 VAL 43 10.057 0.497 -7.764
300 2HG1 VAL 43 2HG1 VAL 43 11.134 1.146 -6.527
301 3HG1 VAL 43 3HG1 VAL 43 11.374 -0.493 -7.132
302 1HG2 VAL 43 1HG2 VAL 43 8.158 0.419 -7.089
303 2HG2 VAL 43 2HG2 VAL 43 7.953 -1.243 -6.532
304 3HG2 VAL 43 3HG2 VAL 43 7.642 0.099 -5.432
305 HA PRO 44 HA PRO 44 9.649 -5.299 -7.498
306 1HB PRO 44 2HB PRO 44 6.934 -5.801 -7.533
307 2HB PRO 44 1HB PRO 44 8.053 -6.426 -6.319
308 1HG PRO 44 2HG PRO 44 6.231 -4.062 -6.179
309 2HG PRO 44 1HG PRO 44 6.605 -5.267 -4.931
310 1HD PRO 44 2HD PRO 44 7.712 -2.821 -4.903
311 2HD PRO 44 1HD PRO 44 8.621 -4.257 -4.388
312 H ASP 45 H ASP 45 9.038 -5.743 -9.639
313 HA ASP 45 HA ASP 45 7.930 -3.418 -11.070
314 1HB ASP 45 2HB ASP 45 10.227 -3.754 -11.676
315 2HB ASP 45 1HB ASP 45 9.976 -5.483 -11.889
316 H GLY 46 H GLY 46 5.923 -3.750 -11.756
317 1HA GLY 46 1HA GLY 46 4.517 -4.911 -13.351
318 2HA GLY 46 2HA GLY 46 5.258 -6.417 -12.831
319 H GLU 47 H GLU 47 4.104 -7.625 -11.509
320 HA GLU 47 HA GLU 47 1.663 -6.568 -10.369
321 1HB GLU 47 2HB GLU 47 2.869 -9.292 -10.683
322 2HB GLU 47 1HB GLU 47 1.560 -9.050 -9.533
323 1HG GLU 47 2HG GLU 47 0.703 -7.810 -11.870
324 2HG GLU 47 1HG GLU 47 1.474 -9.308 -12.396
325 H TRP 48 H TRP 48 1.084 -6.644 -8.201
326 HA TRP 48 HA TRP 48 2.927 -7.500 -6.192
327 1HB TRP 48 2HB TRP 48 3.896 -5.288 -6.599
328 2HB TRP 48 1HB TRP 48 2.314 -4.538 -6.402
329 HD1 TRP 48 HD TRP 48 4.688 -6.743 -4.246
330 HE1 TRP 48 1HE TRP 48 4.546 -5.921 -1.806
331 HE3 TRP 48 3HE TRP 48 1.176 -3.051 -4.826
332 HZ2 TRP 48 2HZ TRP 48 3.135 -3.980 -0.336
333 HZ3 TRP 48 3HZ TRP 48 0.487 -1.773 -2.845
334 HH2 TRP 48 HH TRP 48 1.447 -2.224 -0.647
335 H GLN 49 H GLN 49 1.453 -8.701 -5.169
336 HA GLN 49 HA GLN 49 -1.224 -7.681 -4.666
337 1HB GLN 49 2HB GLN 49 -0.216 -10.213 -5.086
338 2HB GLN 49 1HB GLN 49 -0.426 -10.179 -3.342
339 1HG GLN 49 2HG GLN 49 -2.607 -9.432 -5.268
340 2HG GLN 49 1HG GLN 49 -2.360 -11.073 -4.669
341 1HE2 GLN 49 1HE2 GLN 49 -4.307 -8.607 -4.276
342 2HE2 GLN 49 2HE2 GLN 49 -4.619 -8.674 -2.577
343 H CYS 50 H CYS 50 -1.423 -6.280 -3.051
344 HA CYS 50 HA CYS 50 0.510 -5.811 -1.119
345 1HB CYS 50 2HB CYS 50 -1.737 -4.687 -0.054
346 2HB CYS 50 1HB CYS 50 -0.757 -3.952 -1.321
347 HA PRO 51 HA PRO 51 -0.629 -9.161 1.672
348 1HB PRO 51 2HB PRO 51 1.593 -9.036 3.196
349 2HB PRO 51 1HB PRO 51 1.587 -9.780 1.593
350 1HG PRO 51 2HG PRO 51 2.552 -7.079 2.428
351 2HG PRO 51 1HG PRO 51 3.263 -8.213 1.267
352 1HD PRO 51 2HD PRO 51 1.753 -6.028 0.569
353 2HD PRO 51 1HD PRO 51 1.940 -7.476 -0.439
354 H ARG 52 H ARG 52 -1.997 -6.882 2.050
355 HA ARG 52 HA ARG 52 -1.979 -6.605 4.954
356 1HB ARG 52 2HB ARG 52 -1.234 -4.523 3.082
357 2HB ARG 52 1HB ARG 52 -2.678 -4.066 3.974
358 1HG ARG 52 2HG ARG 52 -0.273 -5.119 5.400
359 2HG ARG 52 1HG ARG 52 -0.380 -3.424 4.916
360 1HD ARG 52 2HD ARG 52 -1.541 -3.045 6.763
361 2HD ARG 52 1HD ARG 52 -2.841 -4.017 6.084
362 HE ARG 52 HE ARG 52 -0.724 -5.054 7.866
363 1HH1 ARG 52 2HH1 ARG 52 -3.999 -5.083 6.639
364 2HH1 ARG 52 1HH1 ARG 52 -4.501 -6.416 7.639
365 1HH2 ARG 52 2HH2 ARG 52 -1.390 -6.800 9.216
366 2HH2 ARG 52 1HH2 ARG 52 -3.023 -7.391 9.083
367 H CYS 53 H CYS 53 -3.580 -5.328 2.055
368 HA CYS 53 HA CYS 53 -6.210 -5.737 3.187
369 1HB CYS 53 2HB CYS 53 -6.262 -5.021 0.438
370 2HB CYS 53 1HB CYS 53 -6.614 -3.999 1.830
371 H THR 54 H THR 54 -4.872 -8.119 3.009
372 HA THR 54 HA THR 54 -5.312 -9.464 0.540
373 HB THR 54 HB THR 54 -4.947 -11.372 2.582
374 HG1 THR 54 1HG THR 54 -2.849 -10.130 3.322
375 1HG2 THR 54 1HG2 THR 54 -3.826 -11.753 0.597
376 2HG2 THR 54 2HG2 THR 54 -2.513 -11.197 1.636
377 3HG2 THR 54 3HG2 THR 54 -3.252 -10.088 0.480
378 H CYS 55 H CYS 55 -7.645 -8.940 0.404
379 HA CYS 55 HA CYS 55 -9.299 -10.789 1.989
380 1HB CYS 55 2HB CYS 55 -10.780 -8.939 0.304
381 2HB CYS 55 1HB CYS 55 -10.909 -9.216 2.038
382 HG CYS 55 HG CYS 55 -8.962 -6.955 0.393
383 HA PRO 56 HA PRO 56 -8.920 -13.204 -1.799
384 1HB PRO 56 2HB PRO 56 -10.774 -14.943 -0.258
385 2HB PRO 56 1HB PRO 56 -9.255 -15.350 -1.066
386 1HG PRO 56 2HG PRO 56 -9.372 -15.156 1.586
387 2HG PRO 56 1HG PRO 56 -7.957 -14.572 0.689
388 1HD PRO 56 2HD PRO 56 -10.202 -13.023 1.911
389 2HD PRO 56 1HD PRO 56 -8.473 -12.630 1.828
390 H ALA 57 H ALA 57 -10.079 -13.062 -3.575
391 HA ALA 57 HA ALA 57 -11.767 -12.688 -5.037
392 1HB ALA 57 1HB ALA 57 -13.013 -14.352 -2.943
393 2HB ALA 57 2HB ALA 57 -14.113 -13.514 -4.038
394 3HB ALA 57 3HB ALA 57 -12.893 -14.611 -4.684
395 H LEU 58 H LEU 58 -11.085 -10.414 -3.954
396 HA LEU 58 HA LEU 58 -13.226 -9.052 -2.609
397 1HB LEU 58 2HB LEU 58 -10.787 -8.431 -2.473
398 2HB LEU 58 1HB LEU 58 -10.918 -7.819 -4.112
399 HG LEU 58 HG LEU 58 -12.954 -6.475 -2.945
400 1HD1 LEU 58 1HD1 LEU 58 -11.597 -5.618 -0.805
401 2HD1 LEU 58 2HD1 LEU 58 -12.821 -6.884 -0.730
402 3HD1 LEU 58 3HD1 LEU 58 -11.113 -7.315 -0.797
403 1HD2 LEU 58 1HD2 LEU 58 -11.158 -5.533 -4.318
404 2HD2 LEU 58 2HD2 LEU 58 -11.457 -4.563 -2.875
405 3HD2 LEU 58 3HD2 LEU 58 -10.060 -5.635 -2.943
406 H LYS 59 H LYS 59 -12.326 -9.674 -5.874
407 HA LYS 59 HA LYS 59 -13.288 -9.279 -7.872
408 1HB LYS 59 2HB LYS 59 -15.568 -9.067 -5.987
409 2HB LYS 59 1HB LYS 59 -15.822 -8.435 -7.608
410 1HG LYS 59 2HG LYS 59 -14.978 -10.672 -8.456
411 2HG LYS 59 1HG LYS 59 -15.135 -11.240 -6.793
412 1HD LYS 59 2HD LYS 59 -17.531 -10.471 -6.872
413 2HD LYS 59 1HD LYS 59 -17.309 -10.204 -8.602
414 1HE LYS 59 2HE LYS 59 -18.077 -12.326 -8.714
415 2HE LYS 59 1HE LYS 59 -16.378 -12.703 -8.432
416 1HZ LYS 59 1HZ LYS 59 -17.246 -13.951 -6.788
417 2HZ LYS 59 2HZ LYS 59 -18.668 -13.032 -6.669
418 3HZ LYS 59 3HZ LYS 59 -17.241 -12.489 -5.927
419 H GLY 60 H GLY 60 -11.638 -7.396 -7.333
420 1HA GLY 60 1HA GLY 60 -13.056 -4.852 -7.852
421 2HA GLY 60 2HA GLY 60 -11.504 -4.957 -7.032
422 H LYS 61 H LYS 61 -12.044 -7.065 -9.674
423 HA LYS 61 HA LYS 61 -10.651 -5.279 -11.525
424 1HB LYS 61 2HB LYS 61 -9.691 -7.886 -10.479
425 2HB LYS 61 1HB LYS 61 -9.509 -7.629 -12.209
426 1HG LYS 61 2HG LYS 61 -8.620 -5.277 -10.930
427 2HG LYS 61 1HG LYS 61 -7.908 -6.644 -10.069
428 1HD LYS 61 2HD LYS 61 -7.146 -7.549 -12.253
429 2HD LYS 61 1HD LYS 61 -7.746 -6.081 -13.029
430 1HE LYS 61 2HE LYS 61 -6.169 -5.185 -10.914
431 2HE LYS 61 1HE LYS 61 -5.271 -6.536 -11.606
432 1HZ LYS 61 1HZ LYS 61 -5.915 -5.309 -13.827
433 2HZ LYS 61 2HZ LYS 61 -4.542 -4.864 -12.936
434 3HZ LYS 61 3HZ LYS 61 -5.969 -3.958 -12.799
Start of MODEL 12
1 1H GLY 1 1H GLY 1 -25.554 3.837 -2.483
2 2H GLY 1 2H GLY 1 -24.517 2.756 -3.276
3 3H GLY 1 3H GLY 1 -24.672 4.351 -3.837
4 1HA GLY 1 2HA GLY 1 -23.801 3.955 -1.077
5 2HA GLY 1 1HA GLY 1 -22.651 3.605 -2.359
6 HA PRO 2 HA PRO 2 -22.052 8.045 -1.810
7 1HB PRO 2 2HB PRO 2 -19.536 8.136 -2.718
8 2HB PRO 2 1HB PRO 2 -19.917 7.486 -1.119
9 1HG PRO 2 2HG PRO 2 -19.336 6.030 -3.668
10 2HG PRO 2 1HG PRO 2 -18.787 5.669 -2.021
11 1HD PRO 2 2HD PRO 2 -20.894 4.406 -3.259
12 2HD PRO 2 1HD PRO 2 -20.707 4.546 -1.501
13 H LEU 3 H LEU 3 -21.211 9.773 -3.334
14 HA LEU 3 HA LEU 3 -22.451 9.434 -5.927
15 1HB LEU 3 2HB LEU 3 -21.726 11.619 -4.224
16 2HB LEU 3 1HB LEU 3 -20.982 11.859 -5.794
17 HG LEU 3 HG LEU 3 -23.928 11.345 -5.389
18 1HD1 LEU 3 1HD1 LEU 3 -23.100 13.473 -4.359
19 2HD1 LEU 3 2HD1 LEU 3 -22.590 13.977 -5.970
20 3HD1 LEU 3 3HD1 LEU 3 -24.296 13.679 -5.638
21 1HD2 LEU 3 1HD2 LEU 3 -24.139 12.058 -7.687
22 2HD2 LEU 3 2HD2 LEU 3 -22.404 12.365 -7.780
23 3HD2 LEU 3 3HD2 LEU 3 -22.999 10.715 -7.587
24 H GLY 4 H GLY 4 -21.124 7.829 -6.837
25 1HA GLY 4 1HA GLY 4 -19.459 7.264 -8.364
26 2HA GLY 4 2HA GLY 4 -18.713 8.835 -8.097
27 H SER 5 H SER 5 -17.096 9.042 -6.639
28 HA SER 5 HA SER 5 -16.421 6.654 -5.052
29 1HB SER 5 2HB SER 5 -14.581 8.463 -6.621
30 2HB SER 5 1HB SER 5 -14.005 7.339 -5.388
31 HG SER 5 HG SER 5 -15.308 6.764 -7.840
32 H ASP 6 H ASP 6 -15.930 6.973 -2.965
33 HA ASP 6 HA ASP 6 -15.654 9.757 -2.035
34 1HB ASP 6 2HB ASP 6 -17.885 8.855 -1.447
35 2HB ASP 6 1HB ASP 6 -17.110 7.524 -0.596
36 H HIS 7 H HIS 7 -13.904 10.140 -0.861
37 HA HIS 7 HA HIS 7 -11.918 9.863 0.186
38 1HB HIS 7 2HB HIS 7 -13.620 8.848 1.874
39 2HB HIS 7 1HB HIS 7 -12.915 7.307 1.404
40 HD2 HIS 7 2HD HIS 7 -9.866 9.063 1.248
41 HE1 HIS 7 1HE HIS 7 -10.448 8.733 5.422
42 HE2 HIS 7 2HE HIS 7 -8.851 9.482 3.600
43 H HIS 8 H HIS 8 -10.743 9.490 -1.690
44 HA HIS 8 HA HIS 8 -10.229 6.744 -2.507
45 1HB HIS 8 2HB HIS 8 -10.332 8.903 -4.019
46 2HB HIS 8 1HB HIS 8 -8.652 9.077 -3.517
47 HD2 HIS 8 2HD HIS 8 -8.581 8.587 -6.490
48 HE1 HIS 8 1HE HIS 8 -8.494 4.422 -5.753
49 HE2 HIS 8 2HE HIS 8 -8.297 6.226 -7.525
50 H MET 9 H MET 9 -8.417 5.620 -2.032
51 HA MET 9 HA MET 9 -6.780 6.730 0.106
52 1HB MET 9 2HB MET 9 -7.944 4.284 -0.175
53 2HB MET 9 1HB MET 9 -6.308 3.943 -0.722
54 1HG MET 9 2HG MET 9 -5.626 3.824 1.375
55 2HG MET 9 1HG MET 9 -6.120 5.496 1.631
56 1HE MET 9 1HE MET 9 -9.085 5.499 1.204
57 2HE MET 9 2HE MET 9 -9.906 4.953 2.666
58 3HE MET 9 3HE MET 9 -8.620 6.155 2.775
59 H GLU 10 H GLU 10 -5.912 8.121 -1.783
60 HA GLU 10 HA GLU 10 -3.772 6.829 -3.282
61 1HB GLU 10 2HB GLU 10 -4.014 9.798 -3.145
62 2HB GLU 10 1HB GLU 10 -3.578 8.770 -4.500
63 1HG GLU 10 2HG GLU 10 -5.926 8.084 -4.713
64 2HG GLU 10 1HG GLU 10 -6.346 9.180 -3.399
65 H PHE 11 H PHE 11 -3.570 6.519 -0.563
66 HA PHE 11 HA PHE 11 -0.988 7.653 -0.036
67 1HB PHE 11 2HB PHE 11 -1.568 8.720 2.079
68 2HB PHE 11 1HB PHE 11 -2.505 9.448 0.780
69 HD1 PHE 11 1HD PHE 11 -2.626 7.898 3.976
70 HD2 PHE 11 2HD PHE 11 -4.908 8.594 0.453
71 HE1 PHE 11 1HE PHE 11 -4.694 7.448 5.232
72 HE2 PHE 11 2HE PHE 11 -6.977 8.151 1.703
73 HZ PHE 11 HZ PHE 11 -6.874 7.576 4.096
74 H CYS 12 H CYS 12 -0.109 6.749 2.045
75 HA CYS 12 HA CYS 12 -0.424 3.960 2.053
76 1HB CYS 12 2HB CYS 12 0.923 5.868 3.945
77 2HB CYS 12 1HB CYS 12 0.926 4.130 4.225
78 HG CYS 12 HG CYS 12 3.191 5.649 2.765
79 H ARG 13 H ARG 13 -1.501 2.553 3.351
80 HA ARG 13 HA ARG 13 -3.765 3.542 4.789
81 1HB ARG 13 2HB ARG 13 -2.782 0.966 3.875
82 2HB ARG 13 1HB ARG 13 -3.465 0.864 5.493
83 1HG ARG 13 2HG ARG 13 -5.488 2.073 4.565
84 2HG ARG 13 1HG ARG 13 -4.804 1.781 2.968
85 1HD ARG 13 2HD ARG 13 -4.670 -0.695 4.157
86 2HD ARG 13 1HD ARG 13 -6.193 -0.040 4.764
87 HE ARG 13 HE ARG 13 -5.558 -0.787 2.039
88 1HH1 ARG 13 2HH1 ARG 13 -7.794 0.851 4.199
89 2HH1 ARG 13 1HH1 ARG 13 -9.008 1.061 2.971
90 1HH2 ARG 13 2HH2 ARG 13 -7.163 -0.488 0.435
91 2HH2 ARG 13 1HH2 ARG 13 -8.666 0.284 0.856
92 H VAL 14 H VAL 14 -0.531 2.667 5.674
93 HA VAL 14 HA VAL 14 -1.235 2.660 8.530
94 HB VAL 14 HB VAL 14 1.547 2.091 7.663
95 1HG1 VAL 14 1HG1 VAL 14 1.323 1.858 9.928
96 2HG1 VAL 14 2HG1 VAL 14 -0.324 1.238 9.815
97 3HG1 VAL 14 3HG1 VAL 14 1.037 0.199 9.397
98 1HG2 VAL 14 1HG2 VAL 14 -0.552 -0.049 7.372
99 2HG2 VAL 14 2HG2 VAL 14 0.037 0.905 6.010
100 3HG2 VAL 14 3HG2 VAL 14 1.151 -0.117 6.917
101 H CYS 15 H CYS 15 1.565 3.691 6.652
102 HA CYS 15 HA CYS 15 2.206 5.846 8.389
103 1HB CYS 15 2HB CYS 15 3.763 5.993 6.081
104 2HB CYS 15 1HB CYS 15 4.166 5.172 7.591
105 H LYS 16 H LYS 16 -0.115 5.698 6.140
106 HA LYS 16 HA LYS 16 -1.351 7.218 4.945
107 1HB LYS 16 2HB LYS 16 -0.645 8.516 7.554
108 2HB LYS 16 1HB LYS 16 -1.746 9.290 6.423
109 1HG LYS 16 2HG LYS 16 -3.430 7.907 6.927
110 2HG LYS 16 1HG LYS 16 -2.379 6.489 6.977
111 1HD LYS 16 2HD LYS 16 -1.512 7.599 9.187
112 2HD LYS 16 1HD LYS 16 -3.073 8.422 9.141
113 1HE LYS 16 2HE LYS 16 -3.572 5.710 8.581
114 2HE LYS 16 1HE LYS 16 -2.457 5.743 9.948
115 1HZ LYS 16 1HZ LYS 16 -5.207 6.723 9.760
116 2HZ LYS 16 2HZ LYS 16 -4.136 7.581 10.761
117 3HZ LYS 16 3HZ LYS 16 -4.425 5.933 11.041
118 H ASP 17 H ASP 17 1.556 7.428 4.288
119 HA ASP 17 HA ASP 17 1.844 10.273 3.753
120 1HB ASP 17 2HB ASP 17 4.091 9.650 2.936
121 2HB ASP 17 1HB ASP 17 3.806 9.082 4.578
122 H GLY 18 H GLY 18 2.447 11.006 1.601
123 1HA GLY 18 1HA GLY 18 1.190 9.368 -0.511
124 2HA GLY 18 2HA GLY 18 0.929 11.105 -0.380
125 H GLY 19 H GLY 19 3.981 9.440 0.138
126 1HA GLY 19 1HA GLY 19 5.238 11.130 -1.861
127 2HA GLY 19 2HA GLY 19 6.053 10.012 -0.772
128 H GLU 20 H GLU 20 6.895 8.282 -1.681
129 HA GLU 20 HA GLU 20 6.351 7.556 -4.405
130 1HB GLU 20 2HB GLU 20 8.212 6.740 -2.278
131 2HB GLU 20 1HB GLU 20 7.699 5.421 -3.322
132 1HG GLU 20 2HG GLU 20 9.823 6.694 -3.940
133 2HG GLU 20 1HG GLU 20 8.644 6.381 -5.210
134 H LEU 21 H LEU 21 4.395 6.735 -4.825
135 HA LEU 21 HA LEU 21 3.169 5.002 -2.816
136 1HB LEU 21 2HB LEU 21 2.212 7.030 -4.682
137 2HB LEU 21 1HB LEU 21 1.216 5.590 -4.660
138 HG LEU 21 HG LEU 21 0.246 6.198 -2.752
139 1HD1 LEU 21 1HD1 LEU 21 1.376 5.785 -0.894
140 2HD1 LEU 21 2HD1 LEU 21 2.879 5.821 -1.815
141 3HD1 LEU 21 3HD1 LEU 21 2.265 7.298 -1.073
142 1HD2 LEU 21 1HD2 LEU 21 0.638 8.564 -1.983
143 2HD2 LEU 21 2HD2 LEU 21 1.861 8.678 -3.248
144 3HD2 LEU 21 3HD2 LEU 21 0.179 8.363 -3.674
145 H LEU 22 H LEU 22 3.574 2.966 -3.136
146 HA LEU 22 HA LEU 22 3.241 1.804 -5.819
147 1HB LEU 22 2HB LEU 22 5.311 1.099 -4.948
148 2HB LEU 22 1HB LEU 22 4.667 0.912 -3.330
149 HG LEU 22 HG LEU 22 3.260 -1.015 -4.426
150 1HD1 LEU 22 1HD1 LEU 22 5.602 -0.761 -6.306
151 2HD1 LEU 22 2HD1 LEU 22 4.531 -2.157 -6.198
152 3HD1 LEU 22 3HD1 LEU 22 3.895 -0.596 -6.719
153 1HD2 LEU 22 1HD2 LEU 22 4.619 -1.774 -2.785
154 2HD2 LEU 22 2HD2 LEU 22 5.512 -2.423 -4.160
155 3HD2 LEU 22 3HD2 LEU 22 6.031 -0.918 -3.404
156 H CYS 23 H CYS 23 1.263 1.075 -6.197
157 HA CYS 23 HA CYS 23 -0.457 0.493 -3.892
158 1HB CYS 23 2HB CYS 23 -1.539 1.052 -6.614
159 2HB CYS 23 1HB CYS 23 -2.189 1.494 -5.040
160 HG CYS 23 HG CYS 23 -1.329 3.906 -5.057
161 H CYS 24 H CYS 24 -1.960 -1.221 -3.911
162 HA CYS 24 HA CYS 24 -1.172 -3.563 -5.377
163 1HB CYS 24 2HB CYS 24 -3.725 -3.921 -4.196
164 2HB CYS 24 1HB CYS 24 -2.175 -4.521 -3.621
165 H ASP 25 H ASP 25 -2.894 -4.835 -6.576
166 HA ASP 25 HA ASP 25 -4.209 -3.035 -8.470
167 1HB ASP 25 2HB ASP 25 -2.697 -5.206 -8.963
168 2HB ASP 25 1HB ASP 25 -4.281 -5.969 -8.902
169 H THR 26 H THR 26 -4.904 -5.263 -5.947
170 HA THR 26 HA THR 26 -7.617 -5.771 -6.733
171 HB THR 26 HB THR 26 -7.722 -6.733 -4.349
172 HG1 THR 26 1HG THR 26 -5.938 -5.637 -3.468
173 1HG2 THR 26 1HG2 THR 26 -5.958 -8.574 -5.123
174 2HG2 THR 26 2HG2 THR 26 -6.093 -7.691 -6.646
175 3HG2 THR 26 3HG2 THR 26 -7.528 -8.400 -5.905
176 H CYS 27 H CYS 27 -5.961 -3.651 -4.476
177 HA CYS 27 HA CYS 27 -8.555 -2.469 -3.754
178 1HB CYS 27 2HB CYS 27 -6.463 -1.863 -1.869
179 2HB CYS 27 1HB CYS 27 -7.978 -2.724 -1.604
180 HA PRO 28 HA PRO 28 -6.956 1.347 -5.336
181 1HB PRO 28 2HB PRO 28 -8.738 3.065 -4.310
182 2HB PRO 28 1HB PRO 28 -9.215 1.855 -5.507
183 1HG PRO 28 2HG PRO 28 -9.572 1.829 -2.541
184 2HG PRO 28 1HG PRO 28 -10.704 1.325 -3.806
185 1HD PRO 28 2HD PRO 28 -9.116 -0.397 -2.350
186 2HD PRO 28 1HD PRO 28 -9.789 -0.762 -3.952
187 H SER 29 H SER 29 -5.651 0.364 -2.891
188 HA SER 29 HA SER 29 -5.212 2.864 -1.415
189 1HB SER 29 2HB SER 29 -3.813 0.662 -0.251
190 2HB SER 29 1HB SER 29 -5.185 1.555 0.407
191 HG SER 29 HG SER 29 -5.207 -0.920 -0.270
192 H SER 30 H SER 30 -2.927 3.272 -0.745
193 HA SER 30 HA SER 30 -0.975 2.259 -2.684
194 1HB SER 30 2HB SER 30 -0.897 5.139 -1.857
195 2HB SER 30 1HB SER 30 -0.237 4.375 -3.303
196 HG SER 30 HG SER 30 -3.020 4.468 -2.846
197 H TYR 31 H TYR 31 1.210 2.281 -1.949
198 HA TYR 31 HA TYR 31 1.568 2.748 0.936
199 1HB TYR 31 2HB TYR 31 2.059 0.191 -0.599
200 2HB TYR 31 1HB TYR 31 2.798 0.507 0.962
201 HD1 TYR 31 1HD TYR 31 1.472 0.439 3.005
202 HD2 TYR 31 2HD TYR 31 -0.321 -0.254 -0.792
203 HE1 TYR 31 1HE TYR 31 -0.506 -0.503 4.117
204 HE2 TYR 31 2HE TYR 31 -2.312 -1.184 0.314
205 HH TYR 31 HH TYR 31 -3.251 -1.775 2.245
206 H HIS 32 H HIS 32 3.941 1.913 1.400
207 HA HIS 32 HA HIS 32 5.894 3.346 -0.265
208 1HB HIS 32 2HB HIS 32 5.924 1.967 2.426
209 2HB HIS 32 1HB HIS 32 7.425 2.148 1.550
210 HD2 HIS 32 2HD HIS 32 8.609 4.601 1.686
211 HE1 HIS 32 1HE HIS 32 5.798 6.174 4.442
212 HE2 HIS 32 2HE HIS 32 8.152 6.414 3.492
213 H ILE 33 H ILE 33 7.835 1.227 0.590
214 HA ILE 33 HA ILE 33 6.801 -1.108 -0.847
215 HB ILE 33 HB ILE 33 9.147 -1.736 -1.379
216 1HG1 ILE 33 2HG1 ILE 33 10.003 1.084 -0.859
217 1HG2 ILE 33 1HG2 ILE 33 7.899 -0.762 -3.136
218 2HG2 ILE 33 2HG2 ILE 33 8.070 0.855 -2.455
219 3HG2 ILE 33 3HG2 ILE 33 9.471 0.038 -3.152
220 1HD1 ILE 33 1HD1 ILE 33 11.900 -0.938 -0.161
221 2HD1 ILE 33 2HD1 ILE 33 11.275 -1.230 -1.785
222 3HD1 ILE 33 3HD1 ILE 33 12.007 0.325 -1.387
223 H HIS 34 H HIS 34 7.062 0.036 2.075
224 HA HIS 34 HA HIS 34 7.739 -2.509 3.300
225 1HB HIS 34 2HB HIS 34 9.435 -1.408 4.825
226 2HB HIS 34 1HB HIS 34 9.941 -1.634 3.155
227 HD2 HIS 34 2HD HIS 34 9.144 1.238 5.658
228 HE1 HIS 34 1HE HIS 34 10.711 2.893 2.092
229 HE2 HIS 34 2HE HIS 34 10.211 3.332 4.537
230 H CYS 35 H CYS 35 5.379 -0.556 3.265
231 HA CYS 35 HA CYS 35 5.185 0.481 5.919
232 1HB CYS 35 2HB CYS 35 2.743 -0.196 4.355
233 2HB CYS 35 1HB CYS 35 3.103 1.239 5.309
234 H LEU 36 H LEU 36 3.989 -2.386 4.299
235 HA LEU 36 HA LEU 36 2.654 -3.363 6.644
236 1HB LEU 36 2HB LEU 36 2.713 -5.474 4.892
237 2HB LEU 36 1HB LEU 36 1.440 -4.278 5.012
238 HG LEU 36 HG LEU 36 3.417 -3.201 3.291
239 1HD1 LEU 36 1HD1 LEU 36 4.388 -5.228 2.739
240 2HD1 LEU 36 2HD1 LEU 36 2.862 -6.105 2.863
241 3HD1 LEU 36 3HD1 LEU 36 3.154 -5.031 1.495
242 1HD2 LEU 36 1HD2 LEU 36 1.216 -2.552 2.962
243 2HD2 LEU 36 2HD2 LEU 36 1.511 -3.649 1.611
244 3HD2 LEU 36 3HD2 LEU 36 0.617 -4.212 3.023
245 H ARG 37 H ARG 37 3.027 -5.678 7.302
246 HA ARG 37 HA ARG 37 5.482 -5.965 8.505
247 1HB ARG 37 2HB ARG 37 3.423 -7.176 9.149
248 2HB ARG 37 1HB ARG 37 3.606 -8.207 7.737
249 1HG ARG 37 2HG ARG 37 4.408 -9.378 9.657
250 2HG ARG 37 1HG ARG 37 5.785 -8.967 8.632
251 1HD ARG 37 2HD ARG 37 6.115 -6.941 10.100
252 2HD ARG 37 1HD ARG 37 4.922 -7.640 11.194
253 HE ARG 37 HE ARG 37 6.446 -9.574 11.406
254 1HH1 ARG 37 2HH1 ARG 37 7.743 -6.488 10.325
255 2HH1 ARG 37 1HH1 ARG 37 9.370 -6.870 10.815
256 1HH2 ARG 37 2HH2 ARG 37 8.604 -10.059 12.029
257 2HH2 ARG 37 1HH2 ARG 37 9.854 -8.879 11.766
258 HA PRO 38 HA PRO 38 7.101 -8.863 5.028
259 1HB PRO 38 2HB PRO 38 5.335 -8.614 2.727
260 2HB PRO 38 1HB PRO 38 5.823 -10.071 3.596
261 1HG PRO 38 2HG PRO 38 3.294 -9.097 3.671
262 2HG PRO 38 1HG PRO 38 4.025 -9.984 5.021
263 1HD PRO 38 2HD PRO 38 3.680 -7.028 4.660
264 2HD PRO 38 1HD PRO 38 3.423 -8.024 6.109
265 H ALA 39 H ALA 39 8.068 -6.582 5.371
266 HA ALA 39 HA ALA 39 7.812 -4.618 3.371
267 1HB ALA 39 1HB ALA 39 9.452 -3.438 4.514
268 2HB ALA 39 2HB ALA 39 8.721 -4.429 5.776
269 3HB ALA 39 3HB ALA 39 10.264 -4.904 5.064
270 H LEU 40 H LEU 40 9.011 -4.126 1.599
271 HA LEU 40 HA LEU 40 10.723 -6.264 0.563
272 1HB LEU 40 2HB LEU 40 9.338 -3.925 -0.742
273 2HB LEU 40 1HB LEU 40 10.533 -4.895 -1.578
274 HG LEU 40 HG LEU 40 8.652 -5.936 -2.308
275 1HD1 LEU 40 1HD1 LEU 40 9.980 -7.589 -1.037
276 2HD1 LEU 40 2HD1 LEU 40 8.939 -7.305 0.359
277 3HD1 LEU 40 3HD1 LEU 40 8.264 -7.992 -1.119
278 1HD2 LEU 40 1HD2 LEU 40 7.390 -5.176 0.312
279 2HD2 LEU 40 2HD2 LEU 40 7.018 -4.556 -1.298
280 3HD2 LEU 40 3HD2 LEU 40 6.602 -6.217 -0.874
281 H TYR 41 H TYR 41 12.735 -5.726 -0.453
282 HA TYR 41 HA TYR 41 13.974 -3.305 0.689
283 1HB TYR 41 2HB TYR 41 15.251 -5.943 -0.069
284 2HB TYR 41 1HB TYR 41 16.139 -4.520 0.476
285 HD1 TYR 41 1HD TYR 41 14.195 -7.396 1.489
286 HD2 TYR 41 2HD TYR 41 15.776 -3.673 2.810
287 HE1 TYR 41 1HE TYR 41 13.842 -8.079 3.825
288 HE2 TYR 41 2HE TYR 41 15.425 -4.348 5.148
289 HH TYR 41 HH TYR 41 13.604 -6.190 6.270
290 H GLU 42 H GLU 42 12.467 -3.982 -1.857
291 HA GLU 42 HA GLU 42 14.094 -2.357 -3.588
292 1HB GLU 42 2HB GLU 42 14.011 -5.212 -3.940
293 2HB GLU 42 1HB GLU 42 13.182 -4.442 -5.285
294 1HG GLU 42 2HG GLU 42 16.038 -4.266 -4.468
295 2HG GLU 42 1HG GLU 42 15.337 -4.562 -6.058
296 H VAL 43 H VAL 43 12.803 -1.773 -5.579
297 HA VAL 43 HA VAL 43 9.997 -1.464 -4.789
298 HB VAL 43 HB VAL 43 11.447 -0.108 -7.069
299 1HG1 VAL 43 1HG1 VAL 43 9.147 1.207 -5.840
300 2HG1 VAL 43 2HG1 VAL 43 9.540 0.964 -7.541
301 3HG1 VAL 43 3HG1 VAL 43 8.755 -0.322 -6.626
302 1HG2 VAL 43 1HG2 VAL 43 11.773 0.299 -4.296
303 2HG2 VAL 43 2HG2 VAL 43 12.406 1.274 -5.622
304 3HG2 VAL 43 3HG2 VAL 43 10.837 1.660 -4.914
305 HA PRO 44 HA PRO 44 9.205 -4.790 -7.716
306 1HB PRO 44 2HB PRO 44 6.446 -4.566 -6.754
307 2HB PRO 44 1HB PRO 44 7.566 -5.925 -6.626
308 1HG PRO 44 2HG PRO 44 6.835 -4.472 -4.478
309 2HG PRO 44 1HG PRO 44 8.450 -5.186 -4.632
310 1HD PRO 44 2HD PRO 44 7.575 -2.358 -5.122
311 2HD PRO 44 1HD PRO 44 9.028 -2.961 -4.291
312 H ASP 45 H ASP 45 9.417 -3.554 -9.603
313 HA ASP 45 HA ASP 45 7.213 -1.834 -10.414
314 1HB ASP 45 2HB ASP 45 9.773 -1.407 -10.761
315 2HB ASP 45 1HB ASP 45 9.577 -2.469 -12.152
316 H GLY 46 H GLY 46 5.478 -2.929 -11.102
317 1HA GLY 46 1HA GLY 46 5.026 -3.940 -13.499
318 2HA GLY 46 2HA GLY 46 5.846 -5.309 -12.762
319 H GLU 47 H GLU 47 4.902 -6.177 -10.763
320 HA GLU 47 HA GLU 47 2.018 -5.676 -10.519
321 1HB GLU 47 2HB GLU 47 3.356 -8.242 -11.267
322 2HB GLU 47 1HB GLU 47 1.902 -8.300 -10.280
323 1HG GLU 47 2HG GLU 47 1.414 -6.538 -12.441
324 2HG GLU 47 1HG GLU 47 2.140 -8.008 -13.088
325 H TRP 48 H TRP 48 1.754 -5.099 -8.467
326 HA TRP 48 HA TRP 48 3.112 -6.700 -6.407
327 1HB TRP 48 2HB TRP 48 4.113 -4.439 -6.571
328 2HB TRP 48 1HB TRP 48 2.529 -3.735 -6.264
329 HD1 TRP 48 HD TRP 48 5.173 -5.926 -4.478
330 HE1 TRP 48 1HE TRP 48 4.943 -5.549 -1.944
331 HE3 TRP 48 3HE TRP 48 1.047 -2.908 -4.480
332 HZ2 TRP 48 2HZ TRP 48 3.241 -4.156 -0.182
333 HZ3 TRP 48 3HZ TRP 48 0.177 -2.101 -2.325
334 HH2 TRP 48 HH TRP 48 1.253 -2.715 -0.218
335 H GLN 49 H GLN 49 1.937 -7.242 -4.622
336 HA GLN 49 HA GLN 49 -0.817 -6.293 -4.410
337 1HB GLN 49 2HB GLN 49 -1.315 -8.264 -5.529
338 2HB GLN 49 1HB GLN 49 0.078 -9.109 -4.873
339 1HG GLN 49 2HG GLN 49 -1.595 -10.157 -3.749
340 2HG GLN 49 1HG GLN 49 -1.235 -8.858 -2.614
341 1HE2 GLN 49 1HE2 GLN 49 -2.862 -7.623 -1.966
342 2HE2 GLN 49 2HE2 GLN 49 -4.413 -7.526 -2.734
343 H CYS 50 H CYS 50 -1.401 -5.926 -2.347
344 HA CYS 50 HA CYS 50 0.510 -6.111 -0.247
345 1HB CYS 50 2HB CYS 50 -1.311 -5.181 1.128
346 2HB CYS 50 1HB CYS 50 -1.197 -4.322 -0.407
347 HA PRO 51 HA PRO 51 -0.626 -10.023 1.705
348 1HB PRO 51 2HB PRO 51 -1.325 -8.660 4.219
349 2HB PRO 51 1HB PRO 51 -0.067 -9.860 3.911
350 1HG PRO 51 2HG PRO 51 0.503 -7.267 4.392
351 2HG PRO 51 1HG PRO 51 1.487 -8.274 3.314
352 1HD PRO 51 2HD PRO 51 -0.553 -6.198 2.642
353 2HD PRO 51 1HD PRO 51 0.986 -6.572 1.839
354 H ARG 52 H ARG 52 -2.593 -7.303 2.716
355 HA ARG 52 HA ARG 52 -4.910 -7.948 1.407
356 1HB ARG 52 2HB ARG 52 -4.682 -9.714 3.491
357 2HB ARG 52 1HB ARG 52 -5.614 -8.417 4.230
358 1HG ARG 52 2HG ARG 52 -7.445 -8.852 3.004
359 2HG ARG 52 1HG ARG 52 -6.512 -9.281 1.567
360 1HD ARG 52 2HD ARG 52 -7.074 -11.384 2.038
361 2HD ARG 52 1HD ARG 52 -5.867 -11.282 3.316
362 HE ARG 52 HE ARG 52 -8.765 -10.844 3.698
363 1HH1 ARG 52 2HH1 ARG 52 -5.622 -11.821 4.894
364 2HH1 ARG 52 1HH1 ARG 52 -6.206 -12.208 6.487
365 1HH2 ARG 52 2HH2 ARG 52 -9.542 -11.353 5.776
366 2HH2 ARG 52 1HH2 ARG 52 -8.444 -11.943 6.994
367 H CYS 53 H CYS 53 -3.332 -5.767 1.875
368 HA CYS 53 HA CYS 53 -3.156 -3.664 2.697
369 1HB CYS 53 2HB CYS 53 -5.877 -4.153 1.795
370 2HB CYS 53 1HB CYS 53 -5.773 -2.806 2.926
371 H THR 54 H THR 54 -2.659 -5.213 4.718
372 HA THR 54 HA THR 54 -4.408 -4.444 6.934
373 HB THR 54 HB THR 54 -4.137 -6.821 6.760
374 HG1 THR 54 1HG THR 54 -4.134 -6.021 8.893
375 1HG2 THR 54 1HG2 THR 54 -1.904 -6.638 5.532
376 2HG2 THR 54 2HG2 THR 54 -2.104 -7.984 6.653
377 3HG2 THR 54 3HG2 THR 54 -1.168 -6.568 7.131
378 H CYS 55 H CYS 55 -3.805 -2.859 8.198
379 HA CYS 55 HA CYS 55 -1.060 -1.916 8.186
380 1HB CYS 55 2HB CYS 55 -3.132 -0.636 9.895
381 2HB CYS 55 1HB CYS 55 -1.851 0.101 8.938
382 HG CYS 55 HG CYS 55 -4.751 -1.212 7.669
383 HA PRO 56 HA PRO 56 -1.364 -2.995 12.793
384 1HB PRO 56 2HB PRO 56 -3.808 -4.227 13.568
385 2HB PRO 56 1HB PRO 56 -3.266 -2.589 13.932
386 1HG PRO 56 2HG PRO 56 -5.421 -3.249 12.302
387 2HG PRO 56 1HG PRO 56 -4.589 -1.685 12.328
388 1HD PRO 56 2HD PRO 56 -4.280 -3.970 10.426
389 2HD PRO 56 1HD PRO 56 -4.221 -2.221 10.113
390 H ALA 57 H ALA 57 0.067 -4.607 11.896
391 HA ALA 57 HA ALA 57 -0.972 -7.353 11.916
392 1HB ALA 57 1HB ALA 57 1.490 -6.095 10.761
393 2HB ALA 57 2HB ALA 57 1.427 -7.832 11.064
394 3HB ALA 57 3HB ALA 57 0.264 -7.085 9.968
395 H LEU 58 H LEU 58 0.375 -8.997 12.986
396 HA LEU 58 HA LEU 58 1.395 -9.901 14.799
397 1HB LEU 58 2HB LEU 58 2.892 -7.465 14.309
398 2HB LEU 58 1HB LEU 58 2.854 -7.849 16.018
399 HG LEU 58 HG LEU 58 3.716 -9.821 13.909
400 1HD1 LEU 58 1HD1 LEU 58 5.139 -7.745 14.003
401 2HD1 LEU 58 2HD1 LEU 58 5.530 -8.186 15.664
402 3HD1 LEU 58 3HD1 LEU 58 5.977 -9.260 14.340
403 1HD2 LEU 58 1HD2 LEU 58 3.695 -9.769 16.900
404 2HD2 LEU 58 2HD2 LEU 58 3.178 -11.043 15.796
405 3HD2 LEU 58 3HD2 LEU 58 4.895 -10.727 16.034
406 H LYS 59 H LYS 59 1.639 -6.873 16.472
407 HA LYS 59 HA LYS 59 -0.715 -7.610 18.084
408 1HB LYS 59 2HB LYS 59 2.008 -7.137 18.876
409 2HB LYS 59 1HB LYS 59 0.969 -5.919 19.602
410 1HG LYS 59 2HG LYS 59 0.299 -8.836 19.759
411 2HG LYS 59 1HG LYS 59 1.397 -8.073 20.910
412 1HD LYS 59 2HD LYS 59 -1.435 -7.191 20.356
413 2HD LYS 59 1HD LYS 59 -0.928 -8.162 21.738
414 1HE LYS 59 2HE LYS 59 0.249 -6.396 22.699
415 2HE LYS 59 1HE LYS 59 0.339 -5.507 21.181
416 1HZ LYS 59 1HZ LYS 59 -2.018 -5.061 21.319
417 2HZ LYS 59 2HZ LYS 59 -1.246 -4.526 22.733
418 3HZ LYS 59 3HZ LYS 59 -2.141 -5.964 22.749
419 H GLY 60 H GLY 60 0.136 -5.603 15.768
420 1HA GLY 60 1HA GLY 60 -1.629 -3.865 15.369
421 2HA GLY 60 2HA GLY 60 -1.227 -3.275 16.975
422 H LYS 61 H LYS 61 -1.034 -1.342 15.361
423 HA LYS 61 HA LYS 61 1.813 -0.916 15.058
424 1HB LYS 61 2HB LYS 61 0.961 -1.740 12.822
425 2HB LYS 61 1HB LYS 61 -0.032 -0.291 12.747
426 1HG LYS 61 2HG LYS 61 1.686 0.695 11.752
427 2HG LYS 61 1HG LYS 61 2.497 0.668 13.319
428 1HD LYS 61 2HD LYS 61 3.800 -1.136 12.767
429 2HD LYS 61 1HD LYS 61 2.624 -1.767 11.613
430 1HE LYS 61 2HE LYS 61 4.102 -0.978 10.100
431 2HE LYS 61 1HE LYS 61 3.259 0.542 10.397
432 1HZ LYS 61 1HZ LYS 61 5.209 1.379 10.987
433 2HZ LYS 61 2HZ LYS 61 5.963 -0.137 10.924
434 3HZ LYS 61 3HZ LYS 61 5.200 0.370 12.352
Start of MODEL 13
1 1H GLY 1 1H GLY 1 -15.939 1.622 -4.667
2 2H GLY 1 2H GLY 1 -16.629 1.399 -3.135
3 3H GLY 1 3H GLY 1 -15.182 0.611 -3.532
4 1HA GLY 1 2HA GLY 1 -14.006 2.695 -3.642
5 2HA GLY 1 1HA GLY 1 -15.510 3.556 -3.334
6 HA PRO 2 HA PRO 2 -13.826 1.240 0.614
7 1HB PRO 2 2HB PRO 2 -11.024 2.123 0.421
8 2HB PRO 2 1HB PRO 2 -11.679 0.526 0.800
9 1HG PRO 2 2HG PRO 2 -10.494 1.015 -1.550
10 2HG PRO 2 1HG PRO 2 -11.902 -0.057 -1.428
11 1HD PRO 2 2HD PRO 2 -11.773 2.803 -2.327
12 2HD PRO 2 1HD PRO 2 -12.673 1.439 -3.029
13 H LEU 3 H LEU 3 -13.115 4.380 -0.613
14 HA LEU 3 HA LEU 3 -12.988 5.450 2.124
15 1HB LEU 3 2HB LEU 3 -12.243 6.787 -0.478
16 2HB LEU 3 1HB LEU 3 -12.102 7.505 1.112
17 HG LEU 3 HG LEU 3 -10.513 5.180 0.027
18 1HD1 LEU 3 1HD1 LEU 3 -10.028 7.662 -0.562
19 2HD1 LEU 3 2HD1 LEU 3 -9.411 7.742 1.088
20 3HD1 LEU 3 3HD1 LEU 3 -8.706 6.608 -0.062
21 1HD2 LEU 3 1HD2 LEU 3 -9.293 5.338 2.207
22 2HD2 LEU 3 2HD2 LEU 3 -10.604 6.360 2.798
23 3HD2 LEU 3 3HD2 LEU 3 -10.930 4.692 2.324
24 H GLY 4 H GLY 4 -15.309 4.642 0.202
25 1HA GLY 4 1HA GLY 4 -17.504 5.299 0.029
26 2HA GLY 4 2HA GLY 4 -17.142 6.584 1.171
27 H SER 5 H SER 5 -16.457 8.601 0.404
28 HA SER 5 HA SER 5 -17.593 9.374 -2.092
29 1HB SER 5 2HB SER 5 -15.945 11.445 -1.151
30 2HB SER 5 1HB SER 5 -17.683 11.270 -0.900
31 HG SER 5 HG SER 5 -17.330 10.758 1.106
32 H ASP 6 H ASP 6 -14.401 8.561 -0.974
33 HA ASP 6 HA ASP 6 -13.286 9.273 -3.604
34 1HB ASP 6 2HB ASP 6 -12.324 10.072 -1.222
35 2HB ASP 6 1HB ASP 6 -11.467 8.543 -1.371
36 H HIS 7 H HIS 7 -11.614 7.769 -4.420
37 HA HIS 7 HA HIS 7 -12.444 4.996 -3.889
38 1HB HIS 7 2HB HIS 7 -12.790 5.955 -6.207
39 2HB HIS 7 1HB HIS 7 -11.038 6.023 -6.356
40 HD2 HIS 7 2HD HIS 7 -10.435 4.018 -8.017
41 HE1 HIS 7 1HE HIS 7 -12.829 1.048 -6.189
42 HE2 HIS 7 2HE HIS 7 -11.280 1.563 -8.128
43 H HIS 8 H HIS 8 -9.540 6.666 -5.119
44 HA HIS 8 HA HIS 8 -7.889 4.638 -3.821
45 1HB HIS 8 2HB HIS 8 -7.678 5.838 -6.265
46 2HB HIS 8 1HB HIS 8 -6.553 6.799 -5.311
47 HD2 HIS 8 2HD HIS 8 -6.567 3.654 -7.318
48 HE1 HIS 8 1HE HIS 8 -3.389 3.254 -4.554
49 HE2 HIS 8 2HE HIS 8 -4.560 2.202 -6.540
50 H MET 9 H MET 9 -5.727 5.586 -2.968
51 HA MET 9 HA MET 9 -6.357 7.863 -1.204
52 1HB MET 9 2HB MET 9 -5.654 5.221 -0.486
53 2HB MET 9 1HB MET 9 -4.243 6.216 -0.156
54 1HG MET 9 2HG MET 9 -5.401 7.551 1.370
55 2HG MET 9 1HG MET 9 -6.972 6.980 0.806
56 1HE MET 9 1HE MET 9 -7.121 3.350 2.188
57 2HE MET 9 2HE MET 9 -7.958 4.620 1.295
58 3HE MET 9 3HE MET 9 -6.539 3.840 0.598
59 H GLU 10 H GLU 10 -4.749 9.397 -0.910
60 HA GLU 10 HA GLU 10 -2.576 9.262 -2.880
61 1HB GLU 10 2HB GLU 10 -3.604 11.659 -1.344
62 2HB GLU 10 1HB GLU 10 -2.445 11.685 -2.667
63 1HG GLU 10 2HG GLU 10 -5.073 10.441 -3.202
64 2HG GLU 10 1HG GLU 10 -5.032 12.190 -2.999
65 H PHE 11 H PHE 11 -2.599 7.919 -0.255
66 HA PHE 11 HA PHE 11 0.061 8.553 0.561
67 1HB PHE 11 2HB PHE 11 -0.422 9.187 2.874
68 2HB PHE 11 1HB PHE 11 -1.130 10.351 1.763
69 HD1 PHE 11 1HD PHE 11 -3.591 10.319 1.365
70 HD2 PHE 11 2HD PHE 11 -1.741 7.957 4.384
71 HE1 PHE 11 1HE PHE 11 -5.769 10.039 2.474
72 HE2 PHE 11 2HE PHE 11 -3.917 7.664 5.493
73 HZ PHE 11 HZ PHE 11 -5.934 8.707 4.539
74 H CYS 12 H CYS 12 0.873 7.033 2.102
75 HA CYS 12 HA CYS 12 -0.391 4.457 1.811
76 1HB CYS 12 2HB CYS 12 1.752 3.812 1.932
77 2HB CYS 12 1HB CYS 12 2.243 5.449 2.357
78 HG CYS 12 HG CYS 12 2.820 5.025 4.792
79 H ARG 13 H ARG 13 -1.935 3.770 3.136
80 HA ARG 13 HA ARG 13 -2.846 5.263 5.285
81 1HB ARG 13 2HB ARG 13 -4.028 2.946 5.873
82 2HB ARG 13 1HB ARG 13 -4.542 3.960 4.534
83 1HG ARG 13 2HG ARG 13 -2.645 2.397 3.349
84 2HG ARG 13 1HG ARG 13 -3.354 1.292 4.528
85 1HD ARG 13 2HD ARG 13 -5.585 2.439 3.530
86 2HD ARG 13 1HD ARG 13 -4.533 2.503 2.118
87 HE ARG 13 HE ARG 13 -4.266 0.038 2.426
88 1HH1 ARG 13 2HH1 ARG 13 -7.031 1.633 3.857
89 2HH1 ARG 13 1HH1 ARG 13 -8.102 0.279 3.611
90 1HH2 ARG 13 2HH2 ARG 13 -5.668 -1.760 2.097
91 2HH2 ARG 13 1HH2 ARG 13 -7.321 -1.650 2.635
92 H VAL 14 H VAL 14 -0.300 2.999 5.277
93 HA VAL 14 HA VAL 14 -0.464 2.087 7.945
94 HB VAL 14 HB VAL 14 1.929 2.298 6.112
95 1HG1 VAL 14 1HG1 VAL 14 2.773 0.442 7.707
96 2HG1 VAL 14 2HG1 VAL 14 2.924 2.128 8.198
97 3HG1 VAL 14 3HG1 VAL 14 1.623 1.132 8.851
98 1HG2 VAL 14 1HG2 VAL 14 1.448 -0.307 6.258
99 2HG2 VAL 14 2HG2 VAL 14 -0.192 0.273 6.551
100 3HG2 VAL 14 3HG2 VAL 14 0.655 0.730 5.073
101 H CYS 15 H CYS 15 1.339 4.797 6.479
102 HA CYS 15 HA CYS 15 1.902 5.739 9.210
103 1HB CYS 15 2HB CYS 15 4.069 6.397 8.576
104 2HB CYS 15 1HB CYS 15 3.851 4.809 7.853
105 H LYS 16 H LYS 16 0.147 6.422 6.551
106 HA LYS 16 HA LYS 16 -1.075 8.205 5.894
107 1HB LYS 16 2HB LYS 16 0.041 9.222 8.442
108 2HB LYS 16 1HB LYS 16 -0.578 10.421 7.314
109 1HG LYS 16 2HG LYS 16 -2.352 8.132 7.714
110 2HG LYS 16 1HG LYS 16 -2.060 9.092 9.166
111 1HD LYS 16 2HD LYS 16 -2.765 10.414 6.573
112 2HD LYS 16 1HD LYS 16 -4.021 9.736 7.610
113 1HE LYS 16 2HE LYS 16 -3.989 11.627 8.777
114 2HE LYS 16 1HE LYS 16 -2.360 11.212 9.308
115 1HZ LYS 16 1HZ LYS 16 -2.361 12.340 6.688
116 2HZ LYS 16 2HZ LYS 16 -1.499 12.819 8.064
117 3HZ LYS 16 3HZ LYS 16 -3.080 13.390 7.810
118 H ASP 17 H ASP 17 2.222 8.043 5.766
119 HA ASP 17 HA ASP 17 2.700 10.586 4.474
120 1HB ASP 17 2HB ASP 17 4.300 8.713 5.759
121 2HB ASP 17 1HB ASP 17 4.734 8.534 4.065
122 H GLY 18 H GLY 18 3.196 10.906 2.299
123 1HA GLY 18 1HA GLY 18 2.300 8.734 0.500
124 2HA GLY 18 2HA GLY 18 2.188 10.452 0.124
125 H GLY 19 H GLY 19 3.357 10.173 -1.819
126 1HA GLY 19 1HA GLY 19 5.513 10.829 -2.663
127 2HA GLY 19 2HA GLY 19 6.259 9.931 -1.349
128 H GLU 20 H GLU 20 7.059 8.009 -1.817
129 HA GLU 20 HA GLU 20 6.573 6.824 -4.416
130 1HB GLU 20 2HB GLU 20 8.146 5.577 -2.171
131 2HB GLU 20 1HB GLU 20 8.305 5.296 -3.900
132 1HG GLU 20 2HG GLU 20 9.717 6.994 -4.160
133 2HG GLU 20 1HG GLU 20 8.751 8.068 -3.149
134 H LEU 21 H LEU 21 4.354 6.383 -4.209
135 HA LEU 21 HA LEU 21 3.549 4.561 -2.097
136 1HB LEU 21 2HB LEU 21 2.262 6.575 -3.764
137 2HB LEU 21 1HB LEU 21 1.307 5.117 -3.606
138 HG LEU 21 HG LEU 21 0.729 5.575 -1.485
139 1HD1 LEU 21 1HD1 LEU 21 3.096 5.102 -0.755
140 2HD1 LEU 21 2HD1 LEU 21 3.383 6.838 -0.862
141 3HD1 LEU 21 3HD1 LEU 21 2.181 6.213 0.266
142 1HD2 LEU 21 1HD2 LEU 21 1.596 8.241 -1.180
143 2HD2 LEU 21 2HD2 LEU 21 1.246 7.992 -2.890
144 3HD2 LEU 21 3HD2 LEU 21 0.009 7.656 -1.679
145 H LEU 22 H LEU 22 3.954 2.515 -2.515
146 HA LEU 22 HA LEU 22 3.408 1.359 -5.136
147 1HB LEU 22 2HB LEU 22 5.253 0.306 -4.168
148 2HB LEU 22 1HB LEU 22 4.543 0.315 -2.564
149 HG LEU 22 HG LEU 22 2.806 -1.335 -3.649
150 1HD1 LEU 22 1HD1 LEU 22 4.858 -1.076 -5.694
151 2HD1 LEU 22 2HD1 LEU 22 4.588 -2.746 -5.194
152 3HD1 LEU 22 3HD1 LEU 22 3.241 -1.774 -5.788
153 1HD2 LEU 22 1HD2 LEU 22 3.968 -3.111 -2.697
154 2HD2 LEU 22 2HD2 LEU 22 5.541 -2.437 -3.122
155 3HD2 LEU 22 3HD2 LEU 22 4.585 -1.705 -1.833
156 H CYS 23 H CYS 23 1.374 0.958 -5.627
157 HA CYS 23 HA CYS 23 -0.505 0.390 -3.436
158 1HB CYS 23 2HB CYS 23 -1.496 1.187 -6.128
159 2HB CYS 23 1HB CYS 23 -2.126 1.584 -4.533
160 HG CYS 23 HG CYS 23 0.846 2.976 -5.085
161 H CYS 24 H CYS 24 -2.024 -1.291 -3.676
162 HA CYS 24 HA CYS 24 -1.146 -3.590 -4.999
163 1HB CYS 24 2HB CYS 24 -4.012 -3.487 -4.477
164 2HB CYS 24 1HB CYS 24 -2.780 -4.541 -3.785
165 H ASP 25 H ASP 25 -2.279 -4.798 -6.699
166 HA ASP 25 HA ASP 25 -2.456 -3.269 -9.029
167 1HB ASP 25 2HB ASP 25 -1.824 -5.626 -9.088
168 2HB ASP 25 1HB ASP 25 -3.434 -6.092 -8.558
169 H THR 26 H THR 26 -5.096 -5.399 -8.075
170 HA THR 26 HA THR 26 -6.967 -3.539 -9.285
171 HB THR 26 HB THR 26 -7.018 -5.914 -9.932
172 HG1 THR 26 1HG THR 26 -9.036 -4.439 -9.554
173 1HG2 THR 26 1HG2 THR 26 -7.937 -6.460 -7.109
174 2HG2 THR 26 2HG2 THR 26 -6.327 -6.826 -7.736
175 3HG2 THR 26 3HG2 THR 26 -7.743 -7.638 -8.408
176 H CYS 27 H CYS 27 -5.682 -3.674 -6.390
177 HA CYS 27 HA CYS 27 -8.166 -2.945 -5.010
178 1HB CYS 27 2HB CYS 27 -7.301 -4.772 -3.832
179 2HB CYS 27 1HB CYS 27 -5.645 -4.233 -4.015
180 HA PRO 28 HA PRO 28 -6.458 1.035 -5.315
181 1HB PRO 28 2HB PRO 28 -8.498 2.374 -4.216
182 2HB PRO 28 1HB PRO 28 -8.695 1.466 -5.720
183 1HG PRO 28 2HG PRO 28 -9.537 0.749 -2.950
184 2HG PRO 28 1HG PRO 28 -10.354 0.435 -4.490
185 1HD PRO 28 2HD PRO 28 -8.787 -1.396 -3.066
186 2HD PRO 28 1HD PRO 28 -9.260 -1.543 -4.768
187 H SER 29 H SER 29 -4.980 -0.053 -3.330
188 HA SER 29 HA SER 29 -5.156 1.971 -1.204
189 1HB SER 29 2HB SER 29 -4.152 -0.822 -0.730
190 2HB SER 29 1HB SER 29 -4.703 0.368 0.451
191 HG SER 29 HG SER 29 -6.234 -1.173 -1.364
192 H SER 30 H SER 30 -3.397 3.149 -0.936
193 HA SER 30 HA SER 30 -0.980 2.411 -2.377
194 1HB SER 30 2HB SER 30 -0.749 4.968 -1.171
195 2HB SER 30 1HB SER 30 -1.012 4.595 -2.875
196 HG SER 30 HG SER 30 -2.777 5.739 -2.383
197 H TYR 31 H TYR 31 0.950 2.002 -1.419
198 HA TYR 31 HA TYR 31 1.143 2.293 1.505
199 1HB TYR 31 2HB TYR 31 1.635 -0.174 -0.158
200 2HB TYR 31 1HB TYR 31 2.351 0.032 1.437
201 HD1 TYR 31 1HD TYR 31 0.601 0.701 3.320
202 HD2 TYR 31 2HD TYR 31 -0.360 -1.288 -0.311
203 HE1 TYR 31 1HE TYR 31 -1.450 -0.175 4.351
204 HE2 TYR 31 2HE TYR 31 -2.415 -2.166 0.706
205 HH TYR 31 HH TYR 31 -3.660 -2.287 2.518
206 H HIS 32 H HIS 32 3.449 1.626 2.167
207 HA HIS 32 HA HIS 32 5.405 2.683 0.242
208 1HB HIS 32 2HB HIS 32 5.288 2.850 3.245
209 2HB HIS 32 1HB HIS 32 6.843 2.854 2.427
210 HD2 HIS 32 2HD HIS 32 6.679 4.984 0.212
211 HE1 HIS 32 1HE HIS 32 4.704 7.459 3.027
212 HE2 HIS 32 2HE HIS 32 6.140 7.427 0.926
213 H ILE 33 H ILE 33 7.163 1.316 -0.168
214 HA ILE 33 HA ILE 33 6.677 -1.413 0.046
215 HB ILE 33 HB ILE 33 9.197 -1.665 -0.444
216 1HG1 ILE 33 2HG1 ILE 33 8.899 1.320 -0.848
217 1HG2 ILE 33 1HG2 ILE 33 8.549 -0.315 -2.755
218 2HG2 ILE 33 2HG2 ILE 33 8.164 -1.995 -2.384
219 3HG2 ILE 33 3HG2 ILE 33 6.980 -0.728 -2.067
220 1HD1 ILE 33 1HD1 ILE 33 11.162 1.371 -1.545
221 2HD1 ILE 33 2HD1 ILE 33 11.374 -0.344 -1.198
222 3HD1 ILE 33 3HD1 ILE 33 10.337 0.163 -2.531
223 H HIS 34 H HIS 34 8.358 0.724 2.249
224 HA HIS 34 HA HIS 34 9.182 -1.558 3.888
225 1HB HIS 34 2HB HIS 34 10.496 0.750 3.296
226 2HB HIS 34 1HB HIS 34 9.780 1.163 4.851
227 HD2 HIS 34 2HD HIS 34 10.664 -0.386 7.025
228 HE1 HIS 34 1HE HIS 34 13.923 -2.037 4.899
229 HE2 HIS 34 2HE HIS 34 12.733 -1.948 7.133
230 H CYS 35 H CYS 35 6.447 0.225 3.595
231 HA CYS 35 HA CYS 35 5.953 0.428 6.474
232 1HB CYS 35 2HB CYS 35 4.580 1.527 4.050
233 2HB CYS 35 1HB CYS 35 3.692 1.380 5.563
234 H LEU 36 H LEU 36 5.294 -1.565 3.773
235 HA LEU 36 HA LEU 36 2.989 -2.905 4.779
236 1HB LEU 36 2HB LEU 36 5.114 -3.734 2.802
237 2HB LEU 36 1HB LEU 36 3.696 -4.699 3.168
238 HG LEU 36 HG LEU 36 3.218 -1.898 2.338
239 1HD1 LEU 36 1HD1 LEU 36 3.696 -3.900 0.191
240 2HD1 LEU 36 2HD1 LEU 36 3.737 -2.138 0.119
241 3HD1 LEU 36 3HD1 LEU 36 5.067 -3.022 0.868
242 1HD2 LEU 36 1HD2 LEU 36 1.523 -3.765 2.923
243 2HD2 LEU 36 2HD2 LEU 36 1.230 -2.752 1.509
244 3HD2 LEU 36 3HD2 LEU 36 1.894 -4.374 1.310
245 H ARG 37 H ARG 37 2.940 -5.061 5.654
246 HA ARG 37 HA ARG 37 4.604 -5.424 7.848
247 1HB ARG 37 2HB ARG 37 2.301 -6.597 6.944
248 2HB ARG 37 1HB ARG 37 3.459 -7.913 6.802
249 1HG ARG 37 2HG ARG 37 3.788 -6.579 9.320
250 2HG ARG 37 1HG ARG 37 2.106 -7.061 9.092
251 1HD ARG 37 2HD ARG 37 3.389 -8.816 10.195
252 2HD ARG 37 1HD ARG 37 2.808 -9.341 8.616
253 HE ARG 37 HE ARG 37 5.591 -8.560 9.221
254 1HH1 ARG 37 2HH1 ARG 37 3.231 -10.335 7.331
255 2HH1 ARG 37 1HH1 ARG 37 4.438 -11.170 6.388
256 1HH2 ARG 37 2HH2 ARG 37 7.173 -9.648 7.964
257 2HH2 ARG 37 1HH2 ARG 37 6.659 -10.789 6.752
258 HA PRO 38 HA PRO 38 7.419 -8.344 5.420
259 1HB PRO 38 2HB PRO 38 6.789 -9.098 2.881
260 2HB PRO 38 1HB PRO 38 6.238 -9.972 4.311
261 1HG PRO 38 2HG PRO 38 4.704 -8.343 2.444
262 2HG PRO 38 1HG PRO 38 4.128 -9.486 3.666
263 1HD PRO 38 2HD PRO 38 4.267 -6.590 3.795
264 2HD PRO 38 1HD PRO 38 3.515 -7.721 4.936
265 H ALA 39 H ALA 39 8.146 -6.034 5.553
266 HA ALA 39 HA ALA 39 8.054 -4.149 3.619
267 1HB ALA 39 1HB ALA 39 9.002 -3.706 5.788
268 2HB ALA 39 2HB ALA 39 10.389 -4.734 5.428
269 3HB ALA 39 3HB ALA 39 10.150 -3.234 4.535
270 H LEU 40 H LEU 40 8.811 -3.804 1.676
271 HA LEU 40 HA LEU 40 10.704 -5.732 0.531
272 1HB LEU 40 2HB LEU 40 8.771 -3.794 -0.741
273 2HB LEU 40 1HB LEU 40 9.934 -4.739 -1.651
274 HG LEU 40 HG LEU 40 8.420 -6.498 0.024
275 1HD1 LEU 40 1HD1 LEU 40 6.914 -4.264 -0.758
276 2HD1 LEU 40 2HD1 LEU 40 6.445 -5.578 -1.835
277 3HD1 LEU 40 3HD1 LEU 40 6.323 -5.784 -0.087
278 1HD2 LEU 40 1HD2 LEU 40 9.657 -6.710 -2.294
279 2HD2 LEU 40 2HD2 LEU 40 8.285 -7.741 -1.888
280 3HD2 LEU 40 3HD2 LEU 40 8.053 -6.331 -2.923
281 H TYR 41 H TYR 41 12.641 -5.100 -0.269
282 HA TYR 41 HA TYR 41 13.539 -2.430 0.441
283 1HB TYR 41 2HB TYR 41 14.929 -4.922 -0.515
284 2HB TYR 41 1HB TYR 41 15.769 -3.374 -0.445
285 HD1 TYR 41 1HD TYR 41 15.432 -2.107 1.894
286 HD2 TYR 41 2HD TYR 41 15.136 -6.311 1.312
287 HE1 TYR 41 1HE TYR 41 15.912 -2.463 4.278
288 HE2 TYR 41 2HE TYR 41 15.607 -6.677 3.697
289 HH TYR 41 HH TYR 41 15.822 -5.705 5.707
290 H GLU 42 H GLU 42 12.442 -4.115 -2.308
291 HA GLU 42 HA GLU 42 13.128 -1.799 -3.980
292 1HB GLU 42 2HB GLU 42 13.521 -4.703 -4.552
293 2HB GLU 42 1HB GLU 42 13.056 -3.648 -5.878
294 1HG GLU 42 2HG GLU 42 15.188 -2.441 -4.409
295 2HG GLU 42 1HG GLU 42 15.620 -4.098 -4.831
296 H VAL 43 H VAL 43 11.565 -1.277 -5.574
297 HA VAL 43 HA VAL 43 8.887 -1.806 -4.737
298 HB VAL 43 HB VAL 43 9.826 -0.467 -7.281
299 1HG1 VAL 43 1HG1 VAL 43 7.164 -0.488 -5.871
300 2HG1 VAL 43 2HG1 VAL 43 7.595 0.666 -7.133
301 3HG1 VAL 43 3HG1 VAL 43 7.530 -1.057 -7.500
302 1HG2 VAL 43 1HG2 VAL 43 8.923 1.485 -5.535
303 2HG2 VAL 43 2HG2 VAL 43 9.881 0.408 -4.518
304 3HG2 VAL 43 3HG2 VAL 43 10.602 1.140 -5.951
305 HA PRO 44 HA PRO 44 8.455 -5.729 -6.781
306 1HB PRO 44 2HB PRO 44 5.574 -5.024 -6.522
307 2HB PRO 44 1HB PRO 44 6.420 -6.498 -6.038
308 1HG PRO 44 2HG PRO 44 5.674 -4.697 -4.225
309 2HG PRO 44 1HG PRO 44 7.218 -5.557 -4.080
310 1HD PRO 44 2HD PRO 44 6.682 -2.748 -4.925
311 2HD PRO 44 1HD PRO 44 8.050 -3.415 -4.012
312 H ASP 45 H ASP 45 7.992 -6.500 -8.788
313 HA ASP 45 HA ASP 45 7.086 -4.502 -10.755
314 1HB ASP 45 2HB ASP 45 9.227 -5.027 -11.432
315 2HB ASP 45 1HB ASP 45 9.132 -6.675 -10.821
316 H GLY 46 H GLY 46 5.473 -4.949 -12.147
317 1HA GLY 46 1HA GLY 46 3.813 -6.082 -13.237
318 2HA GLY 46 2HA GLY 46 4.669 -7.561 -12.841
319 H GLU 47 H GLU 47 3.748 -8.928 -11.472
320 HA GLU 47 HA GLU 47 1.101 -8.339 -10.562
321 1HB GLU 47 2HB GLU 47 2.506 -10.788 -9.631
322 2HB GLU 47 1HB GLU 47 0.867 -10.596 -10.237
323 1HG GLU 47 2HG GLU 47 1.637 -11.604 -12.065
324 2HG GLU 47 1HG GLU 47 2.346 -10.035 -12.454
325 H TRP 48 H TRP 48 0.390 -7.839 -8.583
326 HA TRP 48 HA TRP 48 1.780 -8.533 -6.232
327 1HB TRP 48 2HB TRP 48 3.082 -6.476 -6.988
328 2HB TRP 48 1HB TRP 48 1.619 -5.550 -6.655
329 HD1 TRP 48 HD TRP 48 4.317 -7.610 -4.853
330 HE1 TRP 48 1HE TRP 48 4.287 -6.997 -2.353
331 HE3 TRP 48 3HE TRP 48 0.196 -4.593 -4.815
332 HZ2 TRP 48 2HZ TRP 48 2.718 -5.436 -0.600
333 HZ3 TRP 48 3HZ TRP 48 -0.503 -3.575 -2.685
334 HH2 TRP 48 HH TRP 48 0.731 -3.994 -0.623
335 H GLN 49 H GLN 49 0.333 -8.885 -4.740
336 HA GLN 49 HA GLN 49 -2.036 -7.182 -4.614
337 1HB GLN 49 2HB GLN 49 -2.023 -10.084 -5.095
338 2HB GLN 49 1HB GLN 49 -3.063 -9.576 -3.771
339 1HG GLN 49 2HG GLN 49 -3.201 -8.183 -6.410
340 2HG GLN 49 1HG GLN 49 -4.018 -9.728 -6.170
341 1HE2 GLN 49 1HE2 GLN 49 -3.670 -6.546 -4.620
342 2HE2 GLN 49 2HE2 GLN 49 -5.313 -6.432 -4.097
343 H CYS 50 H CYS 50 -2.907 -7.001 -2.503
344 HA CYS 50 HA CYS 50 -0.881 -6.776 -0.605
345 1HB CYS 50 2HB CYS 50 -3.310 -6.585 0.742
346 2HB CYS 50 1HB CYS 50 -2.394 -5.271 0.006
347 HA PRO 51 HA PRO 51 -1.065 -10.679 1.495
348 1HB PRO 51 2HB PRO 51 0.252 -10.015 3.749
349 2HB PRO 51 1HB PRO 51 1.070 -10.149 2.188
350 1HG PRO 51 2HG PRO 51 0.157 -7.701 3.644
351 2HG PRO 51 1HG PRO 51 1.657 -7.975 2.741
352 1HD PRO 51 2HD PRO 51 -0.517 -6.632 1.741
353 2HD PRO 51 1HD PRO 51 0.677 -7.476 0.735
354 H ARG 52 H ARG 52 -2.284 -7.746 2.946
355 HA ARG 52 HA ARG 52 -4.504 -9.125 4.102
356 1HB ARG 52 2HB ARG 52 -4.040 -8.212 6.446
357 2HB ARG 52 1HB ARG 52 -3.117 -9.620 5.947
358 1HG ARG 52 2HG ARG 52 -1.380 -8.447 6.755
359 2HG ARG 52 1HG ARG 52 -1.438 -7.649 5.181
360 1HD ARG 52 2HD ARG 52 -2.232 -5.721 6.039
361 2HD ARG 52 1HD ARG 52 -3.227 -6.542 7.240
362 HE ARG 52 HE ARG 52 -0.841 -6.949 8.296
363 1HH1 ARG 52 2HH1 ARG 52 -2.117 -4.061 6.773
364 2HH1 ARG 52 1HH1 ARG 52 -1.189 -2.974 7.762
365 1HH2 ARG 52 2HH2 ARG 52 0.375 -5.519 9.617
366 2HH2 ARG 52 1HH2 ARG 52 0.244 -3.801 9.370
367 H CYS 53 H CYS 53 -4.202 -7.075 2.180
368 HA CYS 53 HA CYS 53 -5.339 -4.777 3.623
369 1HB CYS 53 2HB CYS 53 -3.394 -3.906 2.743
370 2HB CYS 53 1HB CYS 53 -3.433 -4.958 1.340
371 H THR 54 H THR 54 -5.562 -6.872 0.817
372 HA THR 54 HA THR 54 -7.872 -5.719 -0.350
373 HB THR 54 HB THR 54 -7.903 -8.527 -0.773
374 HG1 THR 54 1HG THR 54 -5.277 -7.405 -1.037
375 1HG2 THR 54 1HG2 THR 54 -6.750 -6.339 -2.504
376 2HG2 THR 54 2HG2 THR 54 -8.465 -6.730 -2.388
377 3HG2 THR 54 3HG2 THR 54 -7.335 -7.914 -3.044
378 H CYS 55 H CYS 55 -7.309 -8.066 2.180
379 HA CYS 55 HA CYS 55 -10.151 -7.910 2.901
380 1HB CYS 55 2HB CYS 55 -9.112 -10.419 3.758
381 2HB CYS 55 1HB CYS 55 -10.421 -10.114 2.619
382 HG CYS 55 HG CYS 55 -7.127 -10.203 1.690
383 HA PRO 56 HA PRO 56 -7.557 -6.628 6.440
384 1HB PRO 56 2HB PRO 56 -9.828 -4.927 7.128
385 2HB PRO 56 1HB PRO 56 -8.175 -4.463 6.719
386 1HG PRO 56 2HG PRO 56 -10.271 -3.968 5.082
387 2HG PRO 56 1HG PRO 56 -8.639 -4.298 4.471
388 1HD PRO 56 2HD PRO 56 -10.997 -6.135 4.669
389 2HD PRO 56 1HD PRO 56 -9.831 -5.945 3.342
390 H ALA 57 H ALA 57 -9.086 -9.019 6.468
391 HA ALA 57 HA ALA 57 -10.856 -8.958 8.746
392 1HB ALA 57 1HB ALA 57 -9.732 -11.373 7.342
393 2HB ALA 57 2HB ALA 57 -11.162 -11.298 8.370
394 3HB ALA 57 3HB ALA 57 -11.165 -10.499 6.798
395 H LEU 58 H LEU 58 -7.730 -10.495 8.011
396 HA LEU 58 HA LEU 58 -7.235 -11.224 10.725
397 1HB LEU 58 2HB LEU 58 -6.234 -12.442 8.859
398 2HB LEU 58 1HB LEU 58 -5.360 -11.002 8.365
399 HG LEU 58 HG LEU 58 -4.765 -11.656 11.118
400 1HD1 LEU 58 1HD1 LEU 58 -3.611 -13.728 9.380
401 2HD1 LEU 58 2HD1 LEU 58 -4.111 -13.806 11.070
402 3HD1 LEU 58 3HD1 LEU 58 -5.314 -13.937 9.787
403 1HD2 LEU 58 1HD2 LEU 58 -3.400 -10.199 9.758
404 2HD2 LEU 58 2HD2 LEU 58 -2.462 -11.614 10.237
405 3HD2 LEU 58 3HD2 LEU 58 -3.112 -11.499 8.603
406 H LYS 59 H LYS 59 -6.027 -8.645 8.611
407 HA LYS 59 HA LYS 59 -5.602 -6.920 10.890
408 1HB LYS 59 2HB LYS 59 -3.442 -8.447 9.863
409 2HB LYS 59 1HB LYS 59 -3.188 -6.788 9.344
410 1HG LYS 59 2HG LYS 59 -2.373 -6.320 11.344
411 2HG LYS 59 1HG LYS 59 -3.948 -6.685 12.052
412 1HD LYS 59 2HD LYS 59 -2.651 -9.144 11.473
413 2HD LYS 59 1HD LYS 59 -1.509 -8.111 12.336
414 1HE LYS 59 2HE LYS 59 -4.333 -8.573 13.265
415 2HE LYS 59 1HE LYS 59 -2.980 -9.585 13.767
416 1HZ LYS 59 1HZ LYS 59 -3.072 -8.037 15.437
417 2HZ LYS 59 2HZ LYS 59 -3.531 -6.767 14.408
418 3HZ LYS 59 3HZ LYS 59 -1.929 -7.321 14.406
419 H GLY 60 H GLY 60 -4.725 -4.745 10.083
420 1HA GLY 60 1HA GLY 60 -4.880 -4.043 7.359
421 2HA GLY 60 2HA GLY 60 -6.424 -3.700 8.134
422 H LYS 61 H LYS 61 -6.544 -1.602 8.556
423 HA LYS 61 HA LYS 61 -4.155 -0.184 9.491
424 1HB LYS 61 2HB LYS 61 -6.157 0.555 7.720
425 2HB LYS 61 1HB LYS 61 -6.588 1.401 9.200
426 1HG LYS 61 2HG LYS 61 -3.775 1.666 8.708
427 2HG LYS 61 1HG LYS 61 -4.695 2.152 7.283
428 1HD LYS 61 2HD LYS 61 -4.821 4.131 8.353
429 2HD LYS 61 1HD LYS 61 -6.140 3.347 9.226
430 1HE LYS 61 2HE LYS 61 -4.905 4.113 10.992
431 2HE LYS 61 1HE LYS 61 -4.174 2.525 10.776
432 1HZ LYS 61 1HZ LYS 61 -2.291 3.723 10.774
433 2HZ LYS 61 2HZ LYS 61 -3.055 5.164 10.305
434 3HZ LYS 61 3HZ LYS 61 -2.669 3.991 9.143
Start of MODEL 14
1 1H GLY 1 1H GLY 1 -17.205 0.341 7.649
2 2H GLY 1 2H GLY 1 -17.067 0.506 5.971
3 3H GLY 1 3H GLY 1 -16.397 -0.844 6.747
4 1HA GLY 1 2HA GLY 1 -18.609 -1.597 7.396
5 2HA GLY 1 1HA GLY 1 -19.293 -0.204 6.568
6 HA PRO 2 HA PRO 2 -19.480 -3.753 3.568
7 1HB PRO 2 2HB PRO 2 -21.575 -1.934 2.508
8 2HB PRO 2 1HB PRO 2 -21.629 -3.681 2.777
9 1HG PRO 2 2HG PRO 2 -22.911 -2.011 4.411
10 2HG PRO 2 1HG PRO 2 -22.091 -3.453 5.036
11 1HD PRO 2 2HD PRO 2 -21.226 -0.593 5.128
12 2HD PRO 2 1HD PRO 2 -21.046 -1.868 6.350
13 H LEU 3 H LEU 3 -20.047 -0.346 2.662
14 HA LEU 3 HA LEU 3 -18.373 -0.667 0.297
15 1HB LEU 3 2HB LEU 3 -20.412 1.218 1.195
16 2HB LEU 3 1HB LEU 3 -19.011 2.021 0.512
17 HG LEU 3 HG LEU 3 -19.271 0.634 -1.539
18 1HD1 LEU 3 1HD1 LEU 3 -20.740 -1.031 -1.715
19 2HD1 LEU 3 2HD1 LEU 3 -20.904 -0.925 0.037
20 3HD1 LEU 3 3HD1 LEU 3 -22.039 -0.071 -1.007
21 1HD2 LEU 3 1HD2 LEU 3 -20.283 2.945 -1.157
22 2HD2 LEU 3 2HD2 LEU 3 -20.940 1.979 -2.478
23 3HD2 LEU 3 3HD2 LEU 3 -21.820 2.104 -0.955
24 H GLY 4 H GLY 4 -16.418 -1.100 1.394
25 1HA GLY 4 1HA GLY 4 -15.355 0.748 3.308
26 2HA GLY 4 2HA GLY 4 -14.511 -0.622 2.600
27 H SER 5 H SER 5 -14.663 0.012 -0.080
28 HA SER 5 HA SER 5 -12.645 2.061 -0.242
29 1HB SER 5 2HB SER 5 -13.901 0.694 -2.607
30 2HB SER 5 1HB SER 5 -12.247 1.278 -2.415
31 HG SER 5 HG SER 5 -12.239 -0.410 -0.605
32 H ASP 6 H ASP 6 -14.200 3.663 0.601
33 HA ASP 6 HA ASP 6 -16.371 4.600 -0.968
34 1HB ASP 6 2HB ASP 6 -16.382 5.164 1.340
35 2HB ASP 6 1HB ASP 6 -14.754 5.827 1.265
36 H HIS 7 H HIS 7 -12.979 5.481 -0.720
37 HA HIS 7 HA HIS 7 -13.165 6.763 -3.330
38 1HB HIS 7 2HB HIS 7 -13.429 8.638 -1.778
39 2HB HIS 7 1HB HIS 7 -11.987 8.144 -0.901
40 HD2 HIS 7 2HD HIS 7 -10.054 9.876 -1.496
41 HE1 HIS 7 1HE HIS 7 -10.883 10.268 -5.623
42 HE2 HIS 7 2HE HIS 7 -9.426 11.069 -3.717
43 H HIS 8 H HIS 8 -11.061 7.014 -4.338
44 HA HIS 8 HA HIS 8 -9.355 4.787 -3.965
45 1HB HIS 8 2HB HIS 8 -9.775 6.344 -6.054
46 2HB HIS 8 1HB HIS 8 -8.444 7.270 -5.370
47 HD2 HIS 8 2HD HIS 8 -9.114 3.860 -7.109
48 HE1 HIS 8 1HE HIS 8 -4.940 4.457 -6.753
49 HE2 HIS 8 2HE HIS 8 -6.754 2.880 -7.564
50 H MET 9 H MET 9 -7.926 4.532 -2.385
51 HA MET 9 HA MET 9 -7.007 6.833 -0.873
52 1HB MET 9 2HB MET 9 -6.794 3.855 -0.492
53 2HB MET 9 1HB MET 9 -5.839 4.970 0.477
54 1HG MET 9 2HG MET 9 -7.856 6.016 1.308
55 2HG MET 9 1HG MET 9 -8.843 4.971 0.290
56 1HE MET 9 1HE MET 9 -8.508 1.513 1.794
57 2HE MET 9 2HE MET 9 -9.847 2.581 1.372
58 3HE MET 9 3HE MET 9 -8.463 2.430 0.288
59 H GLU 10 H GLU 10 -5.762 7.753 -2.584
60 HA GLU 10 HA GLU 10 -3.474 6.323 -3.603
61 1HB GLU 10 2HB GLU 10 -3.224 9.121 -4.076
62 2HB GLU 10 1HB GLU 10 -3.610 7.847 -5.224
63 1HG GLU 10 2HG GLU 10 -5.476 9.057 -5.513
64 2HG GLU 10 1HG GLU 10 -6.017 8.168 -4.091
65 H PHE 11 H PHE 11 -3.468 6.356 -0.864
66 HA PHE 11 HA PHE 11 -0.925 7.594 -0.345
67 1HB PHE 11 2HB PHE 11 -1.550 8.909 1.531
68 2HB PHE 11 1HB PHE 11 -2.700 9.327 0.267
69 HD1 PHE 11 1HD PHE 11 -4.977 8.142 0.324
70 HD2 PHE 11 2HD PHE 11 -2.287 8.236 3.618
71 HE1 PHE 11 1HE PHE 11 -6.836 7.632 1.850
72 HE2 PHE 11 2HE PHE 11 -4.139 7.724 5.154
73 HZ PHE 11 HZ PHE 11 -6.418 7.420 4.269
74 H CYS 12 H CYS 12 -0.140 6.953 1.844
75 HA CYS 12 HA CYS 12 -0.393 4.136 2.143
76 1HB CYS 12 2HB CYS 12 1.289 6.267 3.147
77 2HB CYS 12 1HB CYS 12 0.829 5.173 4.444
78 HG CYS 12 HG CYS 12 3.371 4.817 2.865
79 H ARG 13 H ARG 13 -2.027 3.140 3.162
80 HA ARG 13 HA ARG 13 -3.488 4.506 5.289
81 1HB ARG 13 2HB ARG 13 -4.575 2.087 5.400
82 2HB ARG 13 1HB ARG 13 -5.062 3.258 4.186
83 1HG ARG 13 2HG ARG 13 -3.965 2.144 2.482
84 2HG ARG 13 1HG ARG 13 -2.893 1.293 3.597
85 1HD ARG 13 2HD ARG 13 -5.438 0.487 4.358
86 2HD ARG 13 1HD ARG 13 -5.513 0.534 2.596
87 HE ARG 13 HE ARG 13 -3.389 -0.934 4.026
88 1HH1 ARG 13 2HH1 ARG 13 -6.074 -0.918 1.777
89 2HH1 ARG 13 1HH1 ARG 13 -5.619 -2.406 1.012
90 1HH2 ARG 13 2HH2 ARG 13 -2.794 -2.901 3.049
91 2HH2 ARG 13 1HH2 ARG 13 -3.732 -3.543 1.723
92 H VAL 14 H VAL 14 -0.618 3.705 5.336
93 HA VAL 14 HA VAL 14 -0.634 2.091 7.795
94 HB VAL 14 HB VAL 14 1.814 2.330 6.081
95 1HG1 VAL 14 1HG1 VAL 14 0.755 0.390 8.107
96 2HG1 VAL 14 2HG1 VAL 14 2.093 -0.025 7.033
97 3HG1 VAL 14 3HG1 VAL 14 2.244 1.334 8.148
98 1HG2 VAL 14 1HG2 VAL 14 -0.647 0.929 5.335
99 2HG2 VAL 14 2HG2 VAL 14 0.744 1.378 4.349
100 3HG2 VAL 14 3HG2 VAL 14 0.791 -0.092 5.324
101 H CYS 15 H CYS 15 1.265 4.549 6.029
102 HA CYS 15 HA CYS 15 2.079 5.658 8.619
103 1HB CYS 15 2HB CYS 15 4.118 6.307 7.660
104 2HB CYS 15 1HB CYS 15 3.803 4.727 6.953
105 H LYS 16 H LYS 16 -0.093 6.218 6.286
106 HA LYS 16 HA LYS 16 -1.417 7.949 5.712
107 1HB LYS 16 2HB LYS 16 -0.020 9.097 8.088
108 2HB LYS 16 1HB LYS 16 -1.008 10.150 7.087
109 1HG LYS 16 2HG LYS 16 -2.091 7.572 8.151
110 2HG LYS 16 1HG LYS 16 -2.081 9.038 9.132
111 1HD LYS 16 2HD LYS 16 -3.088 9.756 6.600
112 2HD LYS 16 1HD LYS 16 -3.898 8.261 7.066
113 1HE LYS 16 2HE LYS 16 -5.200 9.389 8.456
114 2HE LYS 16 1HE LYS 16 -3.781 9.931 9.350
115 1HZ LYS 16 1HZ LYS 16 -5.161 11.772 8.543
116 2HZ LYS 16 2HZ LYS 16 -4.880 11.282 6.943
117 3HZ LYS 16 3HZ LYS 16 -3.591 11.824 7.903
118 H ASP 17 H ASP 17 1.601 7.723 4.793
119 HA ASP 17 HA ASP 17 2.115 10.392 3.866
120 1HB ASP 17 2HB ASP 17 3.867 8.567 4.334
121 2HB ASP 17 1HB ASP 17 3.432 7.950 2.745
122 H GLY 18 H GLY 18 1.725 11.282 1.897
123 1HA GLY 18 1HA GLY 18 0.390 9.544 -0.086
124 2HA GLY 18 2HA GLY 18 -0.199 11.162 0.283
125 H GLY 19 H GLY 19 3.216 10.451 0.148
126 1HA GLY 19 1HA GLY 19 3.504 12.400 -1.981
127 2HA GLY 19 2HA GLY 19 4.803 11.631 -1.082
128 H GLU 20 H GLU 20 5.722 9.757 -1.841
129 HA GLU 20 HA GLU 20 4.833 8.913 -4.522
130 1HB GLU 20 2HB GLU 20 7.602 8.574 -3.359
131 2HB GLU 20 1HB GLU 20 7.099 8.280 -5.019
132 1HG GLU 20 2HG GLU 20 7.771 10.329 -5.500
133 2HG GLU 20 1HG GLU 20 6.431 10.937 -4.528
134 H LEU 21 H LEU 21 3.771 7.054 -4.441
135 HA LEU 21 HA LEU 21 4.749 4.949 -2.639
136 1HB LEU 21 2HB LEU 21 1.809 5.408 -2.987
137 2HB LEU 21 1HB LEU 21 2.644 4.531 -1.721
138 HG LEU 21 HG LEU 21 3.416 7.300 -1.658
139 1HD1 LEU 21 1HD1 LEU 21 1.125 7.466 -2.757
140 2HD1 LEU 21 2HD1 LEU 21 0.479 6.884 -1.224
141 3HD1 LEU 21 3HD1 LEU 21 1.382 8.397 -1.281
142 1HD2 LEU 21 1HD2 LEU 21 2.674 5.152 0.096
143 2HD2 LEU 21 2HD2 LEU 21 3.621 6.600 0.436
144 3HD2 LEU 21 3HD2 LEU 21 1.863 6.642 0.574
145 H LEU 22 H LEU 22 3.381 2.892 -3.095
146 HA LEU 22 HA LEU 22 2.838 2.652 -5.967
147 1HB LEU 22 2HB LEU 22 4.300 0.982 -6.269
148 2HB LEU 22 1HB LEU 22 5.031 1.514 -4.770
149 HG LEU 22 HG LEU 22 2.830 -0.408 -4.433
150 1HD1 LEU 22 1HD1 LEU 22 4.963 -0.906 -6.339
151 2HD1 LEU 22 2HD1 LEU 22 4.938 -2.086 -5.027
152 3HD1 LEU 22 3HD1 LEU 22 3.498 -1.832 -6.012
153 1HD2 LEU 22 1HD2 LEU 22 4.962 -1.419 -3.151
154 2HD2 LEU 22 2HD2 LEU 22 5.448 0.274 -3.244
155 3HD2 LEU 22 3HD2 LEU 22 3.927 -0.165 -2.469
156 H CYS 23 H CYS 23 0.912 1.756 -6.401
157 HA CYS 23 HA CYS 23 -0.780 1.296 -4.109
158 1HB CYS 23 2HB CYS 23 -2.022 0.981 -6.732
159 2HB CYS 23 1HB CYS 23 -2.432 2.072 -5.416
160 HG CYS 23 HG CYS 23 -1.525 3.067 -8.176
161 H CYS 24 H CYS 24 -2.520 -0.375 -4.287
162 HA CYS 24 HA CYS 24 -1.337 -2.976 -4.512
163 1HB CYS 24 2HB CYS 24 -3.016 -2.244 -2.765
164 2HB CYS 24 1HB CYS 24 -4.240 -2.278 -4.026
165 H ASP 25 H ASP 25 -3.023 -4.669 -5.490
166 HA ASP 25 HA ASP 25 -3.556 -3.791 -8.256
167 1HB ASP 25 2HB ASP 25 -1.772 -5.662 -7.699
168 2HB ASP 25 1HB ASP 25 -3.198 -6.683 -7.590
169 H THR 26 H THR 26 -4.906 -4.882 -5.364
170 HA THR 26 HA THR 26 -7.336 -5.718 -6.799
171 HB THR 26 HB THR 26 -7.631 -7.064 -4.510
172 HG1 THR 26 1HG THR 26 -5.784 -6.864 -3.443
173 1HG2 THR 26 1HG2 THR 26 -5.872 -8.021 -6.769
174 2HG2 THR 26 2HG2 THR 26 -7.634 -7.947 -6.841
175 3HG2 THR 26 3HG2 THR 26 -6.844 -9.019 -5.686
176 H CYS 27 H CYS 27 -6.035 -3.652 -4.373
177 HA CYS 27 HA CYS 27 -8.756 -2.672 -3.925
178 1HB CYS 27 2HB CYS 27 -8.373 -2.214 -1.606
179 2HB CYS 27 1HB CYS 27 -7.969 -3.902 -1.886
180 HA PRO 28 HA PRO 28 -6.980 1.155 -5.115
181 1HB PRO 28 2HB PRO 28 -8.740 2.922 -4.124
182 2HB PRO 28 1HB PRO 28 -9.193 1.779 -5.396
183 1HG PRO 28 2HG PRO 28 -9.726 1.649 -2.455
184 2HG PRO 28 1HG PRO 28 -10.803 1.262 -3.807
185 1HD PRO 28 2HD PRO 28 -9.422 -0.614 -2.357
186 2HD PRO 28 1HD PRO 28 -9.961 -0.851 -4.030
187 H SER 29 H SER 29 -5.405 0.293 -3.109
188 HA SER 29 HA SER 29 -5.120 2.648 -1.357
189 1HB SER 29 2HB SER 29 -4.104 -0.032 -0.510
190 2HB SER 29 1HB SER 29 -4.676 1.312 0.478
191 HG SER 29 HG SER 29 -6.109 -0.720 -0.807
192 H SER 30 H SER 30 -2.933 3.200 -0.745
193 HA SER 30 HA SER 30 -0.911 2.116 -2.592
194 1HB SER 30 2HB SER 30 -0.855 4.958 -1.595
195 2HB SER 30 1HB SER 30 -0.021 4.260 -2.985
196 HG SER 30 HG SER 30 -2.845 4.391 -2.814
197 H TYR 31 H TYR 31 1.156 1.818 -1.809
198 HA TYR 31 HA TYR 31 1.487 2.089 1.116
199 1HB TYR 31 2HB TYR 31 1.743 -0.250 -0.688
200 2HB TYR 31 1HB TYR 31 3.001 -0.074 0.526
201 HD1 TYR 31 1HD TYR 31 -0.702 0.472 0.620
202 HD2 TYR 31 2HD TYR 31 2.656 -1.592 2.208
203 HE1 TYR 31 1HE TYR 31 -2.167 -0.665 2.227
204 HE2 TYR 31 2HE TYR 31 1.205 -2.727 3.831
205 HH TYR 31 HH TYR 31 -0.883 -2.632 4.823
206 H HIS 32 H HIS 32 3.813 1.665 1.717
207 HA HIS 32 HA HIS 32 5.713 2.793 -0.237
208 1HB HIS 32 2HB HIS 32 5.658 2.829 2.770
209 2HB HIS 32 1HB HIS 32 7.218 2.734 1.964
210 HD2 HIS 32 2HD HIS 32 7.623 4.987 0.101
211 HE1 HIS 32 1HE HIS 32 5.227 7.464 2.566
212 HE2 HIS 32 2HE HIS 32 6.772 7.407 0.548
213 H ILE 33 H ILE 33 7.883 1.513 -0.103
214 HA ILE 33 HA ILE 33 7.209 -1.297 -0.209
215 HB ILE 33 HB ILE 33 9.441 -1.712 -0.964
216 1HG1 ILE 33 2HG1 ILE 33 10.209 1.167 -0.573
217 1HG2 ILE 33 1HG2 ILE 33 7.847 0.440 -2.136
218 2HG2 ILE 33 2HG2 ILE 33 9.533 0.429 -2.654
219 3HG2 ILE 33 3HG2 ILE 33 8.530 -1.005 -2.883
220 1HD1 ILE 33 1HD1 ILE 33 12.057 -1.160 -0.400
221 2HD1 ILE 33 2HD1 ILE 33 11.520 -0.585 -1.980
222 3HD1 ILE 33 3HD1 ILE 33 12.378 0.504 -0.891
223 H HIS 34 H HIS 34 8.114 0.825 2.190
224 HA HIS 34 HA HIS 34 9.116 -1.356 3.896
225 1HB HIS 34 2HB HIS 34 10.012 1.383 3.499
226 2HB HIS 34 1HB HIS 34 9.677 1.046 5.193
227 HD2 HIS 34 2HD HIS 34 10.847 -1.978 5.365
228 HE1 HIS 34 1HE HIS 34 14.396 -0.195 3.911
229 HE2 HIS 34 2HE HIS 34 13.433 -2.139 5.228
230 H CYS 35 H CYS 35 6.320 -0.086 3.205
231 HA CYS 35 HA CYS 35 5.493 0.401 5.980
232 1HB CYS 35 2HB CYS 35 4.530 1.462 3.356
233 2HB CYS 35 1HB CYS 35 3.392 1.358 4.699
234 H LEU 36 H LEU 36 5.852 -2.238 4.875
235 HA LEU 36 HA LEU 36 3.165 -3.208 5.447
236 1HB LEU 36 2HB LEU 36 3.426 -5.024 3.753
237 2HB LEU 36 1HB LEU 36 3.194 -3.423 3.081
238 HG LEU 36 HG LEU 36 6.009 -4.235 3.381
239 1HD1 LEU 36 1HD1 LEU 36 4.418 -6.244 2.549
240 2HD1 LEU 36 2HD1 LEU 36 4.711 -5.419 1.019
241 3HD1 LEU 36 3HD1 LEU 36 6.070 -5.999 1.981
242 1HD2 LEU 36 1HD2 LEU 36 5.490 -2.184 2.280
243 2HD2 LEU 36 2HD2 LEU 36 6.046 -3.320 1.050
244 3HD2 LEU 36 3HD2 LEU 36 4.324 -2.981 1.223
245 H ARG 37 H ARG 37 3.141 -5.384 6.295
246 HA ARG 37 HA ARG 37 5.031 -5.781 8.270
247 1HB ARG 37 2HB ARG 37 2.631 -6.924 7.623
248 2HB ARG 37 1HB ARG 37 3.745 -8.262 7.380
249 1HG ARG 37 2HG ARG 37 3.926 -6.664 9.883
250 2HG ARG 37 1HG ARG 37 2.627 -7.845 9.703
251 1HD ARG 37 2HD ARG 37 5.586 -8.387 9.471
252 2HD ARG 37 1HD ARG 37 4.541 -8.842 10.816
253 HE ARG 37 HE ARG 37 3.308 -10.103 8.851
254 1HH1 ARG 37 2HH1 ARG 37 6.756 -9.794 9.406
255 2HH1 ARG 37 1HH1 ARG 37 7.126 -11.384 8.796
256 1HH2 ARG 37 2HH2 ARG 37 3.784 -12.186 8.038
257 2HH2 ARG 37 1HH2 ARG 37 5.433 -12.746 8.022
258 HA PRO 38 HA PRO 38 7.508 -8.868 5.657
259 1HB PRO 38 2HB PRO 38 6.670 -9.740 3.278
260 2HB PRO 38 1HB PRO 38 6.026 -10.419 4.776
261 1HG PRO 38 2HG PRO 38 4.782 -8.504 2.873
262 2HG PRO 38 1HG PRO 38 4.023 -9.765 3.856
263 1HD PRO 38 2HD PRO 38 4.135 -7.013 4.446
264 2HD PRO 38 1HD PRO 38 3.640 -8.313 5.548
265 H ALA 39 H ALA 39 8.091 -6.396 5.629
266 HA ALA 39 HA ALA 39 7.989 -4.723 3.519
267 1HB ALA 39 1HB ALA 39 8.943 -4.010 5.585
268 2HB ALA 39 2HB ALA 39 10.296 -5.128 5.411
269 3HB ALA 39 3HB ALA 39 10.143 -3.752 4.318
270 H LEU 40 H LEU 40 8.952 -4.390 1.604
271 HA LEU 40 HA LEU 40 10.327 -6.634 0.424
272 1HB LEU 40 2HB LEU 40 9.641 -3.949 -0.777
273 2HB LEU 40 1HB LEU 40 10.159 -5.373 -1.658
274 HG LEU 40 HG LEU 40 7.815 -5.933 -0.051
275 1HD1 LEU 40 1HD1 LEU 40 6.250 -4.577 -1.393
276 2HD1 LEU 40 2HD1 LEU 40 7.288 -3.598 -0.354
277 3HD1 LEU 40 3HD1 LEU 40 7.625 -3.713 -2.082
278 1HD2 LEU 40 1HD2 LEU 40 8.895 -6.413 -2.724
279 2HD2 LEU 40 2HD2 LEU 40 7.928 -7.458 -1.681
280 3HD2 LEU 40 3HD2 LEU 40 7.142 -6.235 -2.677
281 H TYR 41 H TYR 41 12.353 -6.425 -0.736
282 HA TYR 41 HA TYR 41 14.192 -4.645 0.695
283 1HB TYR 41 2HB TYR 41 14.644 -7.143 -0.948
284 2HB TYR 41 1HB TYR 41 15.958 -6.138 -0.339
285 HD1 TYR 41 1HD TYR 41 16.026 -5.729 2.208
286 HD2 TYR 41 2HD TYR 41 13.769 -8.845 0.394
287 HE1 TYR 41 1HE TYR 41 15.955 -6.920 4.356
288 HE2 TYR 41 2HE TYR 41 13.700 -10.048 2.536
289 HH TYR 41 HH TYR 41 14.744 -10.181 4.618
290 H GLU 42 H GLU 42 12.494 -4.852 -2.137
291 HA GLU 42 HA GLU 42 13.995 -2.647 -3.258
292 1HB GLU 42 2HB GLU 42 13.850 -3.663 -5.567
293 2HB GLU 42 1HB GLU 42 15.029 -4.398 -4.491
294 1HG GLU 42 2HG GLU 42 14.001 -6.380 -4.516
295 2HG GLU 42 1HG GLU 42 12.393 -5.660 -4.418
296 H VAL 43 H VAL 43 12.721 -1.783 -5.230
297 HA VAL 43 HA VAL 43 9.944 -1.562 -4.384
298 HB VAL 43 HB VAL 43 11.351 -0.145 -6.655
299 1HG1 VAL 43 1HG1 VAL 43 9.511 1.386 -6.635
300 2HG1 VAL 43 2HG1 VAL 43 8.867 -0.250 -6.778
301 3HG1 VAL 43 3HG1 VAL 43 8.802 0.593 -5.229
302 1HG2 VAL 43 1HG2 VAL 43 11.701 1.703 -5.197
303 2HG2 VAL 43 2HG2 VAL 43 10.775 0.940 -3.906
304 3HG2 VAL 43 3HG2 VAL 43 12.335 0.272 -4.385
305 HA PRO 44 HA PRO 44 8.761 -4.842 -7.167
306 1HB PRO 44 2HB PRO 44 6.077 -3.642 -6.718
307 2HB PRO 44 1HB PRO 44 6.610 -5.316 -6.526
308 1HG PRO 44 2HG PRO 44 6.177 -3.774 -4.400
309 2HG PRO 44 1HG PRO 44 7.531 -4.917 -4.436
310 1HD PRO 44 2HD PRO 44 7.542 -1.954 -4.806
311 2HD PRO 44 1HD PRO 44 8.713 -2.988 -3.962
312 H ASP 45 H ASP 45 9.452 -4.302 -9.164
313 HA ASP 45 HA ASP 45 8.321 -2.069 -10.619
314 1HB ASP 45 2HB ASP 45 10.759 -3.082 -10.739
315 2HB ASP 45 1HB ASP 45 10.026 -4.160 -11.923
316 H GLY 46 H GLY 46 6.133 -2.670 -10.711
317 1HA GLY 46 1HA GLY 46 4.924 -3.566 -12.837
318 2HA GLY 46 2HA GLY 46 5.502 -5.105 -12.214
319 H GLU 47 H GLU 47 3.521 -5.981 -11.789
320 HA GLU 47 HA GLU 47 1.522 -4.539 -10.302
321 1HB GLU 47 2HB GLU 47 1.366 -7.494 -10.580
322 2HB GLU 47 1HB GLU 47 0.113 -6.281 -10.800
323 1HG GLU 47 2HG GLU 47 0.355 -6.872 -12.956
324 2HG GLU 47 1HG GLU 47 1.662 -5.687 -12.897
325 H TRP 48 H TRP 48 1.267 -4.499 -8.166
326 HA TRP 48 HA TRP 48 2.487 -6.622 -6.541
327 1HB TRP 48 2HB TRP 48 3.954 -4.655 -6.429
328 2HB TRP 48 1HB TRP 48 2.588 -3.652 -5.961
329 HD1 TRP 48 HD TRP 48 4.691 -6.589 -4.574
330 HE1 TRP 48 1HE TRP 48 4.634 -6.462 -2.002
331 HE3 TRP 48 3HE TRP 48 1.403 -2.712 -4.037
332 HZ2 TRP 48 2HZ TRP 48 3.356 -4.916 -0.018
333 HZ3 TRP 48 3HZ TRP 48 0.813 -1.974 -1.769
334 HH2 TRP 48 HH TRP 48 1.770 -3.054 0.200
335 H GLN 49 H GLN 49 1.350 -7.088 -4.617
336 HA GLN 49 HA GLN 49 -1.319 -5.867 -4.417
337 1HB GLN 49 2HB GLN 49 -1.570 -8.045 -5.434
338 2HB GLN 49 1HB GLN 49 -0.569 -8.786 -4.198
339 1HG GLN 49 2HG GLN 49 -2.258 -8.358 -2.524
340 2HG GLN 49 1HG GLN 49 -3.248 -7.511 -3.712
341 1HE2 GLN 49 1HE2 GLN 49 -4.717 -8.635 -4.754
342 2HE2 GLN 49 2HE2 GLN 49 -4.767 -10.369 -4.907
343 H CYS 50 H CYS 50 -1.949 -5.285 -2.412
344 HA CYS 50 HA CYS 50 0.000 -5.127 -0.375
345 1HB CYS 50 2HB CYS 50 -1.554 -3.856 0.815
346 2HB CYS 50 1HB CYS 50 -2.036 -3.587 -0.855
347 HA PRO 51 HA PRO 51 -0.730 -8.854 1.875
348 1HB PRO 51 2HB PRO 51 0.118 -7.640 4.351
349 2HB PRO 51 1HB PRO 51 1.034 -8.705 3.284
350 1HG PRO 51 2HG PRO 51 1.623 -6.060 3.681
351 2HG PRO 51 1HG PRO 51 2.054 -6.961 2.217
352 1HD PRO 51 2HD PRO 51 -0.235 -5.083 2.684
353 2HD PRO 51 1HD PRO 51 0.810 -5.257 1.256
354 H ARG 52 H ARG 52 -2.740 -6.343 2.057
355 HA ARG 52 HA ARG 52 -4.217 -7.455 4.351
356 1HB ARG 52 2HB ARG 52 -3.800 -4.673 3.438
357 2HB ARG 52 1HB ARG 52 -5.409 -5.067 4.027
358 1HG ARG 52 2HG ARG 52 -2.826 -5.408 5.535
359 2HG ARG 52 1HG ARG 52 -4.044 -4.163 5.810
360 1HD ARG 52 2HD ARG 52 -5.577 -5.680 6.680
361 2HD ARG 52 1HD ARG 52 -4.768 -7.064 5.947
362 HE ARG 52 HE ARG 52 -3.697 -5.546 8.244
363 1HH1 ARG 52 2HH1 ARG 52 -4.245 -8.548 6.522
364 2HH1 ARG 52 1HH1 ARG 52 -3.350 -9.514 7.654
365 1HH2 ARG 52 2HH2 ARG 52 -2.541 -6.815 9.757
366 2HH2 ARG 52 1HH2 ARG 52 -2.394 -8.530 9.514
367 H CYS 53 H CYS 53 -4.121 -7.611 1.139
368 HA CYS 53 HA CYS 53 -6.995 -7.460 0.671
369 1HB CYS 53 2HB CYS 53 -4.585 -7.594 -1.007
370 2HB CYS 53 1HB CYS 53 -5.914 -8.588 -1.589
371 H THR 54 H THR 54 -5.159 -9.477 2.264
372 HA THR 54 HA THR 54 -5.594 -12.026 1.139
373 HB THR 54 HB THR 54 -5.409 -12.223 3.974
374 HG1 THR 54 1HG THR 54 -3.298 -10.609 3.082
375 1HG2 THR 54 1HG2 THR 54 -2.900 -12.433 2.514
376 2HG2 THR 54 2HG2 THR 54 -4.216 -13.305 1.731
377 3HG2 THR 54 3HG2 THR 54 -3.793 -13.667 3.405
378 H CYS 55 H CYS 55 -7.739 -12.310 0.598
379 HA CYS 55 HA CYS 55 -9.883 -11.765 2.388
380 1HB CYS 55 2HB CYS 55 -10.153 -13.726 0.143
381 2HB CYS 55 1HB CYS 55 -11.282 -12.489 0.682
382 HG CYS 55 HG CYS 55 -8.763 -10.789 -0.313
383 HA PRO 56 HA PRO 56 -9.601 -15.364 4.931
384 1HB PRO 56 2HB PRO 56 -12.191 -15.406 5.836
385 2HB PRO 56 1HB PRO 56 -10.934 -14.342 6.475
386 1HG PRO 56 2HG PRO 56 -13.102 -13.749 4.508
387 2HG PRO 56 1HG PRO 56 -12.465 -12.740 5.819
388 1HD PRO 56 2HD PRO 56 -11.786 -12.354 3.229
389 2HD PRO 56 1HD PRO 56 -10.666 -12.028 4.569
390 H ALA 57 H ALA 57 -11.841 -15.047 2.333
391 HA ALA 57 HA ALA 57 -12.471 -17.906 2.341
392 1HB ALA 57 1HB ALA 57 -14.388 -17.299 1.390
393 2HB ALA 57 2HB ALA 57 -13.890 -15.612 1.508
394 3HB ALA 57 3HB ALA 57 -13.520 -16.542 0.056
395 H LEU 58 H LEU 58 -11.896 -19.242 0.587
396 HA LEU 58 HA LEU 58 -9.370 -18.545 -0.605
397 1HB LEU 58 2HB LEU 58 -10.992 -20.963 -0.258
398 2HB LEU 58 1HB LEU 58 -10.150 -20.898 -1.795
399 HG LEU 58 HG LEU 58 -8.062 -20.339 -0.319
400 1HD1 LEU 58 1HD1 LEU 58 -8.094 -20.893 1.892
401 2HD1 LEU 58 2HD1 LEU 58 -9.748 -20.302 1.712
402 3HD1 LEU 58 3HD1 LEU 58 -9.423 -22.038 1.706
403 1HD2 LEU 58 1HD2 LEU 58 -7.934 -22.941 0.128
404 2HD2 LEU 58 2HD2 LEU 58 -9.366 -22.947 -0.901
405 3HD2 LEU 58 3HD2 LEU 58 -7.849 -22.280 -1.504
406 H LYS 59 H LYS 59 -9.415 -17.118 -2.231
407 HA LYS 59 HA LYS 59 -11.520 -17.351 -4.264
408 1HB LYS 59 2HB LYS 59 -10.174 -15.146 -3.037
409 2HB LYS 59 1HB LYS 59 -9.828 -15.117 -4.762
410 1HG LYS 59 2HG LYS 59 -12.639 -15.480 -3.820
411 2HG LYS 59 1HG LYS 59 -11.908 -13.874 -3.821
412 1HD LYS 59 2HD LYS 59 -11.810 -13.771 -6.102
413 2HD LYS 59 1HD LYS 59 -11.638 -15.519 -6.282
414 1HE LYS 59 2HE LYS 59 -13.987 -15.824 -5.754
415 2HE LYS 59 1HE LYS 59 -14.176 -14.090 -5.486
416 1HZ LYS 59 1HZ LYS 59 -14.453 -15.491 -7.874
417 2HZ LYS 59 2HZ LYS 59 -13.060 -14.534 -8.039
418 3HZ LYS 59 3HZ LYS 59 -14.542 -13.815 -7.634
419 H GLY 60 H GLY 60 -8.008 -17.265 -3.870
420 1HA GLY 60 1HA GLY 60 -7.445 -19.095 -5.869
421 2HA GLY 60 2HA GLY 60 -7.397 -17.516 -6.642
422 H LYS 61 H LYS 61 -6.262 -15.894 -4.891
423 HA LYS 61 HA LYS 61 -3.712 -17.175 -4.168
424 1HB LYS 61 2HB LYS 61 -4.256 -14.692 -5.690
425 2HB LYS 61 1HB LYS 61 -2.955 -14.614 -4.508
426 1HG LYS 61 2HG LYS 61 -1.679 -16.198 -5.622
427 2HG LYS 61 1HG LYS 61 -3.065 -16.835 -6.508
428 1HD LYS 61 2HD LYS 61 -3.149 -14.924 -7.919
429 2HD LYS 61 1HD LYS 61 -1.998 -14.050 -6.905
430 1HE LYS 61 2HE LYS 61 -0.212 -15.084 -7.815
431 2HE LYS 61 1HE LYS 61 -1.050 -16.628 -7.959
432 1HZ LYS 61 1HZ LYS 61 -0.632 -15.868 -10.134
433 2HZ LYS 61 2HZ LYS 61 -1.196 -14.305 -9.792
434 3HZ LYS 61 3HZ LYS 61 -2.287 -15.604 -9.866
Start of MODEL 15
1 1H GLY 1 1H GLY 1 -8.298 11.182 -13.094
2 2H GLY 1 2H GLY 1 -8.368 12.226 -14.431
3 3H GLY 1 3H GLY 1 -7.007 11.248 -14.191
4 1HA GLY 1 2HA GLY 1 -8.421 10.368 -15.943
5 2HA GLY 1 1HA GLY 1 -8.283 9.266 -14.579
6 HA PRO 2 HA PRO 2 -12.737 11.183 -14.852
7 1HB PRO 2 2HB PRO 2 -13.661 11.239 -17.392
8 2HB PRO 2 1HB PRO 2 -12.824 12.608 -16.653
9 1HG PRO 2 2HG PRO 2 -11.772 10.534 -18.535
10 2HG PRO 2 1HG PRO 2 -11.477 12.282 -18.515
11 1HD PRO 2 2HD PRO 2 -9.718 10.451 -17.520
12 2HD PRO 2 1HD PRO 2 -9.845 12.113 -16.910
13 H LEU 3 H LEU 3 -12.558 8.947 -13.968
14 HA LEU 3 HA LEU 3 -13.773 6.956 -15.767
15 1HB LEU 3 2HB LEU 3 -11.641 6.821 -13.727
16 2HB LEU 3 1HB LEU 3 -12.774 5.483 -13.722
17 HG LEU 3 HG LEU 3 -12.269 5.211 -16.194
18 1HD1 LEU 3 1HD1 LEU 3 -9.649 6.268 -16.146
19 2HD1 LEU 3 2HD1 LEU 3 -10.987 6.704 -17.209
20 3HD1 LEU 3 3HD1 LEU 3 -10.752 7.565 -15.687
21 1HD2 LEU 3 1HD2 LEU 3 -10.184 3.992 -15.757
22 2HD2 LEU 3 2HD2 LEU 3 -10.059 4.789 -14.190
23 3HD2 LEU 3 3HD2 LEU 3 -11.401 3.693 -14.515
24 H GLY 4 H GLY 4 -15.321 8.885 -14.366
25 1HA GLY 4 1HA GLY 4 -17.358 8.824 -13.251
26 2HA GLY 4 2HA GLY 4 -17.091 7.117 -12.914
27 H SER 5 H SER 5 -16.631 6.581 -10.889
28 HA SER 5 HA SER 5 -15.774 8.699 -9.046
29 1HB SER 5 2HB SER 5 -16.348 6.050 -7.903
30 2HB SER 5 1HB SER 5 -16.916 7.644 -7.400
31 HG SER 5 HG SER 5 -18.311 7.476 -9.377
32 H ASP 6 H ASP 6 -15.187 5.218 -9.428
33 HA ASP 6 HA ASP 6 -13.344 3.929 -9.085
34 1HB ASP 6 2HB ASP 6 -12.933 5.050 -11.321
35 2HB ASP 6 1HB ASP 6 -11.867 6.167 -10.474
36 H HIS 7 H HIS 7 -11.001 6.384 -9.130
37 HA HIS 7 HA HIS 7 -9.602 7.286 -7.622
38 1HB HIS 7 2HB HIS 7 -12.131 7.798 -6.670
39 2HB HIS 7 1HB HIS 7 -11.332 7.078 -5.274
40 HD2 HIS 7 2HD HIS 7 -8.451 8.404 -5.380
41 HE1 HIS 7 1HE HIS 7 -10.516 12.077 -5.701
42 HE2 HIS 7 2HE HIS 7 -8.378 10.953 -4.931
43 H HIS 8 H HIS 8 -8.515 6.965 -5.474
44 HA HIS 8 HA HIS 8 -8.628 4.329 -4.344
45 1HB HIS 8 2HB HIS 8 -6.413 3.628 -4.921
46 2HB HIS 8 1HB HIS 8 -7.214 4.075 -6.420
47 HD2 HIS 8 2HD HIS 8 -4.092 4.907 -4.392
48 HE1 HIS 8 1HE HIS 8 -4.337 7.687 -7.574
49 HE2 HIS 8 2HE HIS 8 -2.951 6.906 -5.600
50 H MET 9 H MET 9 -6.708 4.157 -2.700
51 HA MET 9 HA MET 9 -6.887 6.493 -1.012
52 1HB MET 9 2HB MET 9 -6.846 3.926 -0.390
53 2HB MET 9 1HB MET 9 -5.106 4.162 -0.421
54 1HG MET 9 2HG MET 9 -5.389 5.997 1.233
55 2HG MET 9 1HG MET 9 -7.099 5.580 1.329
56 1HE MET 9 1HE MET 9 -7.413 3.144 3.862
57 2HE MET 9 2HE MET 9 -6.873 4.767 4.289
58 3HE MET 9 3HE MET 9 -7.969 4.533 2.927
59 H GLU 10 H GLU 10 -5.693 8.161 -1.813
60 HA GLU 10 HA GLU 10 -3.114 7.729 -3.005
61 1HB GLU 10 2HB GLU 10 -4.041 10.458 -2.224
62 2HB GLU 10 1HB GLU 10 -3.189 9.936 -3.670
63 1HG GLU 10 2HG GLU 10 -5.180 10.258 -4.641
64 2HG GLU 10 1HG GLU 10 -5.525 8.647 -4.015
65 H PHE 11 H PHE 11 -3.101 6.773 -0.406
66 HA PHE 11 HA PHE 11 -0.752 7.971 0.562
67 1HB PHE 11 2HB PHE 11 -1.503 8.797 2.730
68 2HB PHE 11 1HB PHE 11 -2.305 9.673 1.432
69 HD1 PHE 11 1HD PHE 11 -4.696 9.199 0.931
70 HD2 PHE 11 2HD PHE 11 -2.710 7.546 4.308
71 HE1 PHE 11 1HE PHE 11 -6.876 8.705 1.961
72 HE2 PHE 11 2HE PHE 11 -4.888 7.031 5.341
73 HZ PHE 11 HZ PHE 11 -6.975 7.614 4.168
74 H CYS 12 H CYS 12 0.184 6.792 2.293
75 HA CYS 12 HA CYS 12 -0.246 4.038 2.178
76 1HB CYS 12 2HB CYS 12 1.171 5.663 4.300
77 2HB CYS 12 1HB CYS 12 1.268 3.915 4.149
78 HG CYS 12 HG CYS 12 3.240 6.080 2.867
79 H ARG 13 H ARG 13 -1.156 2.560 3.584
80 HA ARG 13 HA ARG 13 -3.371 3.460 5.176
81 1HB ARG 13 2HB ARG 13 -2.194 0.833 4.439
82 2HB ARG 13 1HB ARG 13 -3.147 0.893 5.915
83 1HG ARG 13 2HG ARG 13 -4.965 1.980 4.530
84 2HG ARG 13 1HG ARG 13 -4.023 1.507 3.116
85 1HD ARG 13 2HD ARG 13 -4.055 -0.845 4.287
86 2HD ARG 13 1HD ARG 13 -5.485 -0.192 5.084
87 HE ARG 13 HE ARG 13 -5.192 -0.872 2.278
88 1HH1 ARG 13 2HH1 ARG 13 -7.160 0.566 4.793
89 2HH1 ARG 13 1HH1 ARG 13 -8.578 0.699 3.792
90 1HH2 ARG 13 2HH2 ARG 13 -7.043 -0.719 0.955
91 2HH2 ARG 13 1HH2 ARG 13 -8.512 -0.034 1.599
92 H VAL 14 H VAL 14 -0.039 3.011 5.726
93 HA VAL 14 HA VAL 14 -0.434 3.010 8.648
94 HB VAL 14 HB VAL 14 2.202 2.482 7.290
95 1HG1 VAL 14 1HG1 VAL 14 1.213 1.434 9.919
96 2HG1 VAL 14 2HG1 VAL 14 2.873 1.588 9.344
97 3HG1 VAL 14 3HG1 VAL 14 1.950 3.029 9.774
98 1HG2 VAL 14 1HG2 VAL 14 0.707 0.843 6.355
99 2HG2 VAL 14 2HG2 VAL 14 1.725 0.059 7.564
100 3HG2 VAL 14 3HG2 VAL 14 0.055 0.469 7.951
101 H CYS 15 H CYS 15 2.215 4.097 6.576
102 HA CYS 15 HA CYS 15 2.636 6.442 8.116
103 1HB CYS 15 2HB CYS 15 4.239 6.561 5.844
104 2HB CYS 15 1HB CYS 15 4.673 5.933 7.432
105 H LYS 16 H LYS 16 0.193 6.100 6.284
106 HA LYS 16 HA LYS 16 -1.188 7.482 5.032
107 1HB LYS 16 2HB LYS 16 -0.356 8.504 7.596
108 2HB LYS 16 1HB LYS 16 -0.818 9.822 6.527
109 1HG LYS 16 2HG LYS 16 -2.952 8.606 6.088
110 2HG LYS 16 1HG LYS 16 -2.487 7.464 7.352
111 1HD LYS 16 2HD LYS 16 -2.931 8.923 9.008
112 2HD LYS 16 1HD LYS 16 -2.305 10.300 8.098
113 1HE LYS 16 2HE LYS 16 -4.813 9.081 7.120
114 2HE LYS 16 1HE LYS 16 -4.902 9.963 8.645
115 1HZ LYS 16 1HZ LYS 16 -3.525 11.689 7.170
116 2HZ LYS 16 2HZ LYS 16 -5.218 11.693 7.264
117 3HZ LYS 16 3HZ LYS 16 -4.442 10.952 5.949
118 H ASP 17 H ASP 17 1.483 7.592 3.811
119 HA ASP 17 HA ASP 17 1.522 10.412 2.988
120 1HB ASP 17 2HB ASP 17 3.897 10.136 2.541
121 2HB ASP 17 1HB ASP 17 3.545 9.643 4.192
122 H GLY 18 H GLY 18 2.328 10.834 0.804
123 1HA GLY 18 1HA GLY 18 1.580 8.691 -1.092
124 2HA GLY 18 2HA GLY 18 1.101 10.370 -1.334
125 H GLY 19 H GLY 19 2.219 10.054 -3.427
126 1HA GLY 19 1HA GLY 19 4.128 11.271 -4.376
127 2HA GLY 19 2HA GLY 19 5.117 10.571 -3.102
128 H GLU 20 H GLU 20 6.203 8.767 -3.537
129 HA GLU 20 HA GLU 20 5.747 7.401 -6.072
130 1HB GLU 20 2HB GLU 20 8.068 7.908 -5.199
131 2HB GLU 20 1HB GLU 20 7.773 6.728 -3.929
132 1HG GLU 20 2HG GLU 20 8.838 5.390 -5.407
133 2HG GLU 20 1HG GLU 20 7.193 5.194 -6.007
134 H LEU 21 H LEU 21 3.563 6.896 -5.192
135 HA LEU 21 HA LEU 21 3.495 4.914 -3.091
136 1HB LEU 21 2HB LEU 21 1.813 6.975 -3.949
137 2HB LEU 21 1HB LEU 21 0.943 5.499 -4.315
138 HG LEU 21 HG LEU 21 0.820 4.862 -2.065
139 1HD1 LEU 21 1HD1 LEU 21 2.523 5.109 -0.669
140 2HD1 LEU 21 2HD1 LEU 21 3.344 6.133 -1.848
141 3HD1 LEU 21 3HD1 LEU 21 2.270 6.854 -0.648
142 1HD2 LEU 21 1HD2 LEU 21 0.599 7.638 -1.298
143 2HD2 LEU 21 2HD2 LEU 21 -0.116 7.340 -2.883
144 3HD2 LEU 21 3HD2 LEU 21 -0.658 6.414 -1.484
145 H LEU 22 H LEU 22 3.275 2.827 -3.351
146 HA LEU 22 HA LEU 22 2.686 1.759 -6.019
147 1HB LEU 22 2HB LEU 22 4.123 0.756 -3.617
148 2HB LEU 22 1HB LEU 22 3.273 -0.430 -4.588
149 HG LEU 22 HG LEU 22 4.658 0.938 -6.501
150 1HD1 LEU 22 1HD1 LEU 22 6.981 1.077 -5.616
151 2HD1 LEU 22 2HD1 LEU 22 5.881 2.285 -4.951
152 3HD1 LEU 22 3HD1 LEU 22 6.320 0.872 -3.992
153 1HD2 LEU 22 1HD2 LEU 22 6.129 -0.997 -6.541
154 2HD2 LEU 22 2HD2 LEU 22 5.601 -1.451 -4.921
155 3HD2 LEU 22 3HD2 LEU 22 4.459 -1.489 -6.264
156 H CYS 23 H CYS 23 0.640 1.260 -6.394
157 HA CYS 23 HA CYS 23 -1.146 0.820 -4.118
158 1HB CYS 23 2HB CYS 23 -1.978 1.171 -6.991
159 2HB CYS 23 1HB CYS 23 -2.932 1.452 -5.539
160 HG CYS 23 HG CYS 23 -1.873 3.820 -4.866
161 H CYS 24 H CYS 24 -2.720 -0.855 -4.150
162 HA CYS 24 HA CYS 24 -1.799 -3.393 -4.821
163 1HB CYS 24 2HB CYS 24 -3.543 -2.789 -3.125
164 2HB CYS 24 1HB CYS 24 -4.671 -2.547 -4.450
165 H ASP 25 H ASP 25 -3.374 -4.902 -6.023
166 HA ASP 25 HA ASP 25 -3.908 -3.823 -8.715
167 1HB ASP 25 2HB ASP 25 -2.198 -5.827 -8.230
168 2HB ASP 25 1HB ASP 25 -3.687 -6.761 -8.257
169 H THR 26 H THR 26 -5.249 -4.745 -5.857
170 HA THR 26 HA THR 26 -7.791 -5.443 -7.165
171 HB THR 26 HB THR 26 -8.174 -6.838 -4.965
172 HG1 THR 26 1HG THR 26 -5.518 -6.238 -4.831
173 1HG2 THR 26 1HG2 THR 26 -6.361 -7.955 -7.099
174 2HG2 THR 26 2HG2 THR 26 -8.080 -7.640 -7.356
175 3HG2 THR 26 3HG2 THR 26 -7.572 -8.816 -6.143
176 H CYS 27 H CYS 27 -6.345 -4.415 -4.060
177 HA CYS 27 HA CYS 27 -8.777 -2.950 -3.394
178 1HB CYS 27 2HB CYS 27 -6.364 -2.626 -1.708
179 2HB CYS 27 1HB CYS 27 -8.034 -2.915 -1.236
180 HA PRO 28 HA PRO 28 -7.076 0.878 -4.804
181 1HB PRO 28 2HB PRO 28 -8.443 2.677 -3.388
182 2HB PRO 28 1HB PRO 28 -9.264 1.574 -4.498
183 1HG PRO 28 2HG PRO 28 -9.062 1.464 -1.523
184 2HG PRO 28 1HG PRO 28 -10.433 1.069 -2.573
185 1HD PRO 28 2HD PRO 28 -8.666 -0.770 -1.454
186 2HD PRO 28 1HD PRO 28 -9.742 -1.079 -2.830
187 H SER 29 H SER 29 -6.008 -0.330 -2.001
188 HA SER 29 HA SER 29 -5.003 1.969 -0.657
189 1HB SER 29 2HB SER 29 -3.515 -0.403 -0.022
190 2HB SER 29 1HB SER 29 -4.696 0.462 0.964
191 HG SER 29 HG SER 29 -4.973 -1.836 -0.531
192 H SER 30 H SER 30 -2.847 2.652 -0.440
193 HA SER 30 HA SER 30 -0.926 1.631 -2.389
194 1HB SER 30 2HB SER 30 -1.084 4.585 -1.958
195 2HB SER 30 1HB SER 30 -0.452 3.691 -3.338
196 HG SER 30 HG SER 30 -3.066 4.442 -2.729
197 H TYR 31 H TYR 31 1.254 1.917 -1.807
198 HA TYR 31 HA TYR 31 1.762 2.837 0.947
199 1HB TYR 31 2HB TYR 31 2.485 0.140 -0.215
200 2HB TYR 31 1HB TYR 31 3.083 0.747 1.320
201 HD1 TYR 31 1HD TYR 31 0.221 -0.670 -0.448
202 HD2 TYR 31 2HD TYR 31 1.609 0.879 3.265
203 HE1 TYR 31 1HE TYR 31 -1.703 -1.687 0.691
204 HE2 TYR 31 2HE TYR 31 -0.324 -0.121 4.408
205 HH TYR 31 HH TYR 31 -2.771 -1.990 2.620
206 H HIS 32 H HIS 32 4.224 2.224 1.353
207 HA HIS 32 HA HIS 32 5.955 3.579 -0.576
208 1HB HIS 32 2HB HIS 32 6.262 2.383 2.177
209 2HB HIS 32 1HB HIS 32 7.685 2.568 1.181
210 HD2 HIS 32 2HD HIS 32 8.715 5.103 0.985
211 HE1 HIS 32 1HE HIS 32 6.138 6.721 3.931
212 HE2 HIS 32 2HE HIS 32 8.134 7.178 2.422
213 H ILE 33 H ILE 33 7.970 1.441 0.479
214 HA ILE 33 HA ILE 33 6.982 -0.882 -1.003
215 HB ILE 33 HB ILE 33 9.203 -1.486 -1.726
216 1HG1 ILE 33 2HG1 ILE 33 10.402 1.096 -0.828
217 1HG2 ILE 33 1HG2 ILE 33 9.467 0.036 -3.461
218 2HG2 ILE 33 2HG2 ILE 33 7.784 0.259 -2.983
219 3HG2 ILE 33 3HG2 ILE 33 9.009 1.411 -2.455
220 1HD1 ILE 33 1HD1 ILE 33 11.411 -1.675 -1.353
221 2HD1 ILE 33 2HD1 ILE 33 11.883 -0.159 -2.120
222 3HD1 ILE 33 3HD1 ILE 33 12.362 -0.492 -0.456
223 H HIS 34 H HIS 34 7.382 0.283 1.945
224 HA HIS 34 HA HIS 34 8.107 -2.283 3.114
225 1HB HIS 34 2HB HIS 34 9.893 -1.298 4.505
226 2HB HIS 34 1HB HIS 34 10.270 -1.225 2.787
227 HD2 HIS 34 2HD HIS 34 10.239 1.016 5.803
228 HE1 HIS 34 1HE HIS 34 10.157 3.565 2.430
229 HE2 HIS 34 2HE HIS 34 10.733 3.398 4.894
230 H CYS 35 H CYS 35 5.813 -0.122 3.179
231 HA CYS 35 HA CYS 35 5.706 0.798 5.854
232 1HB CYS 35 2HB CYS 35 3.183 0.223 4.375
233 2HB CYS 35 1HB CYS 35 3.637 1.642 5.316
234 H LEU 36 H LEU 36 4.211 -1.925 4.217
235 HA LEU 36 HA LEU 36 2.765 -2.933 6.387
236 1HB LEU 36 2HB LEU 36 3.129 -5.127 4.844
237 2HB LEU 36 1HB LEU 36 1.925 -3.890 4.539
238 HG LEU 36 HG LEU 36 4.541 -3.318 3.335
239 1HD1 LEU 36 1HD1 LEU 36 3.154 -5.243 1.678
240 2HD1 LEU 36 2HD1 LEU 36 4.863 -5.143 2.105
241 3HD1 LEU 36 3HD1 LEU 36 3.732 -5.958 3.184
242 1HD2 LEU 36 1HD2 LEU 36 3.253 -2.468 1.600
243 2HD2 LEU 36 2HD2 LEU 36 1.896 -3.539 1.950
244 3HD2 LEU 36 3HD2 LEU 36 2.244 -2.179 3.018
245 H ARG 37 H ARG 37 3.057 -5.172 7.265
246 HA ARG 37 HA ARG 37 5.418 -5.340 8.774
247 1HB ARG 37 2HB ARG 37 2.971 -6.892 8.452
248 2HB ARG 37 1HB ARG 37 4.367 -7.907 8.794
249 1HG ARG 37 2HG ARG 37 2.966 -7.030 10.755
250 2HG ARG 37 1HG ARG 37 4.724 -6.938 10.867
251 1HD ARG 37 2HD ARG 37 4.356 -4.801 11.440
252 2HD ARG 37 1HD ARG 37 4.138 -4.554 9.709
253 HE ARG 37 HE ARG 37 1.759 -5.279 11.207
254 1HH1 ARG 37 2HH1 ARG 37 3.695 -2.729 9.791
255 2HH1 ARG 37 1HH1 ARG 37 2.401 -1.568 9.814
256 1HH2 ARG 37 2HH2 ARG 37 0.061 -3.757 11.260
257 2HH2 ARG 37 1HH2 ARG 37 0.330 -2.143 10.657
258 HA PRO 38 HA PRO 38 7.057 -8.643 5.723
259 1HB PRO 38 2HB PRO 38 5.371 -8.874 3.406
260 2HB PRO 38 1HB PRO 38 5.710 -10.103 4.625
261 1HG PRO 38 2HG PRO 38 3.252 -8.921 4.244
262 2HG PRO 38 1HG PRO 38 3.778 -9.685 5.756
263 1HD PRO 38 2HD PRO 38 3.713 -6.785 5.012
264 2HD PRO 38 1HD PRO 38 3.321 -7.565 6.561
265 H ALA 39 H ALA 39 7.887 -6.249 5.731
266 HA ALA 39 HA ALA 39 7.525 -4.589 3.524
267 1HB ALA 39 1HB ALA 39 9.307 -3.294 4.375
268 2HB ALA 39 2HB ALA 39 8.494 -3.997 5.773
269 3HB ALA 39 3HB ALA 39 10.017 -4.681 5.202
270 H LEU 40 H LEU 40 8.761 -4.149 1.714
271 HA LEU 40 HA LEU 40 10.404 -6.368 0.757
272 1HB LEU 40 2HB LEU 40 9.294 -3.941 -0.664
273 2HB LEU 40 1HB LEU 40 10.305 -5.156 -1.424
274 HG LEU 40 HG LEU 40 8.146 -6.533 -0.223
275 1HD1 LEU 40 1HD1 LEU 40 7.174 -4.271 -1.957
276 2HD1 LEU 40 2HD1 LEU 40 6.207 -5.516 -1.168
277 3HD1 LEU 40 3HD1 LEU 40 7.034 -4.297 -0.199
278 1HD2 LEU 40 1HD2 LEU 40 8.856 -7.563 -2.100
279 2HD2 LEU 40 2HD2 LEU 40 7.596 -6.589 -2.859
280 3HD2 LEU 40 3HD2 LEU 40 9.274 -6.050 -2.903
281 H TYR 41 H TYR 41 12.516 -6.057 0.079
282 HA TYR 41 HA TYR 41 13.786 -3.618 1.136
283 1HB TYR 41 2HB TYR 41 15.068 -6.314 0.618
284 2HB TYR 41 1HB TYR 41 15.832 -4.917 1.373
285 HD1 TYR 41 1HD TYR 41 15.292 -4.287 3.664
286 HD2 TYR 41 2HD TYR 41 13.479 -7.677 1.843
287 HE1 TYR 41 1HE TYR 41 14.503 -5.041 5.868
288 HE2 TYR 41 2HE TYR 41 12.689 -8.442 4.040
289 HH TYR 41 HH TYR 41 13.848 -7.255 6.935
290 H GLU 42 H GLU 42 12.690 -4.971 -1.566
291 HA GLU 42 HA GLU 42 14.590 -3.493 -3.234
292 1HB GLU 42 2HB GLU 42 14.053 -6.280 -3.341
293 2HB GLU 42 1HB GLU 42 13.310 -5.555 -4.760
294 1HG GLU 42 2HG GLU 42 16.183 -5.181 -3.944
295 2HG GLU 42 1HG GLU 42 15.612 -6.328 -5.155
296 H VAL 43 H VAL 43 13.649 -2.458 -5.056
297 HA VAL 43 HA VAL 43 10.932 -1.611 -4.556
298 HB VAL 43 HB VAL 43 12.731 -0.782 -6.841
299 1HG1 VAL 43 1HG1 VAL 43 11.331 1.194 -6.931
300 2HG1 VAL 43 2HG1 VAL 43 10.344 -0.257 -7.111
301 3HG1 VAL 43 3HG1 VAL 43 10.372 0.607 -5.572
302 1HG2 VAL 43 1HG2 VAL 43 12.565 1.207 -4.819
303 2HG2 VAL 43 2HG2 VAL 43 13.071 -0.306 -4.067
304 3HG2 VAL 43 3HG2 VAL 43 13.991 0.359 -5.417
305 HA PRO 44 HA PRO 44 9.431 -4.798 -7.279
306 1HB PRO 44 2HB PRO 44 6.767 -3.814 -6.608
307 2HB PRO 44 1HB PRO 44 7.525 -5.351 -6.189
308 1HG PRO 44 2HG PRO 44 7.001 -3.420 -4.361
309 2HG PRO 44 1HG PRO 44 8.361 -4.549 -4.208
310 1HD PRO 44 2HD PRO 44 8.346 -1.704 -5.144
311 2HD PRO 44 1HD PRO 44 9.517 -2.544 -4.104
312 H ASP 45 H ASP 45 9.757 -4.291 -9.366
313 HA ASP 45 HA ASP 45 8.307 -2.053 -10.573
314 1HB ASP 45 2HB ASP 45 10.449 -1.996 -11.435
315 2HB ASP 45 1HB ASP 45 10.637 -3.742 -11.363
316 H GLY 46 H GLY 46 6.677 -2.317 -12.034
317 1HA GLY 46 1HA GLY 46 5.407 -3.640 -13.592
318 2HA GLY 46 2HA GLY 46 5.907 -5.076 -12.706
319 H GLU 47 H GLU 47 4.070 -5.947 -11.970
320 HA GLU 47 HA GLU 47 1.914 -4.288 -10.988
321 1HB GLU 47 2HB GLU 47 2.051 -7.285 -10.745
322 2HB GLU 47 1HB GLU 47 0.630 -6.261 -10.890
323 1HG GLU 47 2HG GLU 47 0.610 -6.780 -13.038
324 2HG GLU 47 1HG GLU 47 2.043 -5.769 -13.213
325 H TRP 48 H TRP 48 0.953 -4.643 -8.857
326 HA TRP 48 HA TRP 48 2.466 -5.916 -6.793
327 1HB TRP 48 2HB TRP 48 3.705 -3.720 -7.145
328 2HB TRP 48 1HB TRP 48 2.250 -2.905 -6.583
329 HD1 TRP 48 HD TRP 48 4.921 -5.387 -5.302
330 HE1 TRP 48 1HE TRP 48 5.047 -5.173 -2.741
331 HE3 TRP 48 3HE TRP 48 1.080 -2.092 -4.570
332 HZ2 TRP 48 2HZ TRP 48 3.691 -3.794 -0.683
333 HZ3 TRP 48 3HZ TRP 48 0.559 -1.379 -2.273
334 HH2 TRP 48 HH TRP 48 1.839 -2.214 -0.373
335 H GLN 49 H GLN 49 1.379 -5.686 -4.670
336 HA GLN 49 HA GLN 49 -1.158 -4.442 -4.477
337 1HB GLN 49 2HB GLN 49 -2.636 -6.240 -4.571
338 2HB GLN 49 1HB GLN 49 -1.551 -6.550 -5.916
339 1HG GLN 49 2HG GLN 49 -0.384 -8.220 -4.677
340 2HG GLN 49 1HG GLN 49 -1.270 -7.813 -3.207
341 1HE2 GLN 49 1HE2 GLN 49 -3.536 -8.254 -3.139
342 2HE2 GLN 49 2HE2 GLN 49 -4.205 -9.519 -4.121
343 H CYS 50 H CYS 50 -2.012 -4.545 -2.329
344 HA CYS 50 HA CYS 50 -0.076 -4.602 -0.342
345 1HB CYS 50 2HB CYS 50 -2.619 -5.047 0.884
346 2HB CYS 50 1HB CYS 50 -1.690 -3.564 0.792
347 HA PRO 51 HA PRO 51 -0.439 -8.825 1.235
348 1HB PRO 51 2HB PRO 51 0.379 -8.542 3.750
349 2HB PRO 51 1HB PRO 51 1.482 -8.180 2.416
350 1HG PRO 51 2HG PRO 51 -0.001 -6.323 4.206
351 2HG PRO 51 1HG PRO 51 1.594 -6.131 3.462
352 1HD PRO 51 2HD PRO 51 -0.860 -5.059 2.537
353 2HD PRO 51 1HD PRO 51 0.695 -5.057 1.683
354 H ARG 52 H ARG 52 -2.580 -6.472 1.851
355 HA ARG 52 HA ARG 52 -3.974 -7.749 4.077
356 1HB ARG 52 2HB ARG 52 -3.600 -5.054 3.170
357 2HB ARG 52 1HB ARG 52 -5.321 -5.402 3.264
358 1HG ARG 52 2HG ARG 52 -5.299 -5.269 5.474
359 2HG ARG 52 1HG ARG 52 -3.944 -6.394 5.592
360 1HD ARG 52 2HD ARG 52 -2.700 -4.161 4.681
361 2HD ARG 52 1HD ARG 52 -3.983 -3.457 5.667
362 HE ARG 52 HE ARG 52 -1.926 -5.338 6.644
363 1HH1 ARG 52 2HH1 ARG 52 -4.328 -2.838 7.217
364 2HH1 ARG 52 1HH1 ARG 52 -3.867 -2.598 8.877
365 1HH2 ARG 52 2HH2 ARG 52 -1.362 -5.066 8.842
366 2HH2 ARG 52 1HH2 ARG 52 -2.200 -3.882 9.810
367 H CYS 53 H CYS 53 -4.102 -7.709 0.718
368 HA CYS 53 HA CYS 53 -6.915 -7.835 0.325
369 1HB CYS 53 2HB CYS 53 -5.308 -9.264 -1.628
370 2HB CYS 53 1HB CYS 53 -6.276 -7.804 -1.831
371 H THR 54 H THR 54 -4.352 -10.127 0.945
372 HA THR 54 HA THR 54 -6.372 -12.163 1.551
373 HB THR 54 HB THR 54 -4.634 -13.870 0.694
374 HG1 THR 54 1HG THR 54 -3.751 -11.453 -0.549
375 1HG2 THR 54 1HG2 THR 54 -6.700 -13.700 -0.442
376 2HG2 THR 54 2HG2 THR 54 -5.464 -13.544 -1.692
377 3HG2 THR 54 3HG2 THR 54 -6.298 -12.109 -1.091
378 H CYS 55 H CYS 55 -2.846 -12.296 1.536
379 HA CYS 55 HA CYS 55 -2.391 -11.726 4.258
380 1HB CYS 55 2HB CYS 55 -3.312 -14.419 3.658
381 2HB CYS 55 1HB CYS 55 -1.683 -14.449 4.325
382 HG CYS 55 HG CYS 55 -4.025 -12.609 5.960
383 HA PRO 56 HA PRO 56 1.813 -11.825 2.752
384 1HB PRO 56 2HB PRO 56 3.236 -13.206 4.649
385 2HB PRO 56 1HB PRO 56 2.726 -11.524 4.825
386 1HG PRO 56 2HG PRO 56 1.478 -14.009 5.922
387 2HG PRO 56 1HG PRO 56 1.712 -12.434 6.702
388 1HD PRO 56 2HD PRO 56 -0.670 -13.196 5.705
389 2HD PRO 56 1HD PRO 56 -0.129 -11.505 5.658
390 H ALA 57 H ALA 57 0.143 -14.725 3.300
391 HA ALA 57 HA ALA 57 2.024 -16.225 1.603
392 1HB ALA 57 1HB ALA 57 1.013 -17.005 4.034
393 2HB ALA 57 2HB ALA 57 -0.070 -17.798 2.890
394 3HB ALA 57 3HB ALA 57 1.669 -18.081 2.801
395 H LEU 58 H LEU 58 0.277 -18.194 0.718
396 HA LEU 58 HA LEU 58 -1.222 -18.658 -0.919
397 1HB LEU 58 2HB LEU 58 -2.581 -17.074 0.946
398 2HB LEU 58 1HB LEU 58 -3.002 -16.397 -0.615
399 HG LEU 58 HG LEU 58 -3.200 -19.347 -0.344
400 1HD1 LEU 58 1HD1 LEU 58 -4.540 -19.313 1.423
401 2HD1 LEU 58 2HD1 LEU 58 -4.506 -17.551 1.479
402 3HD1 LEU 58 3HD1 LEU 58 -5.691 -18.377 0.466
403 1HD2 LEU 58 1HD2 LEU 58 -4.883 -17.213 -1.650
404 2HD2 LEU 58 2HD2 LEU 58 -3.739 -18.293 -2.448
405 3HD2 LEU 58 3HD2 LEU 58 -5.208 -18.945 -1.722
406 H LYS 59 H LYS 59 0.975 -17.360 -1.809
407 HA LYS 59 HA LYS 59 -0.126 -15.709 -3.978
408 1HB LYS 59 2HB LYS 59 1.383 -14.585 -2.071
409 2HB LYS 59 1HB LYS 59 2.672 -15.194 -3.098
410 1HG LYS 59 2HG LYS 59 2.068 -12.863 -3.597
411 2HG LYS 59 1HG LYS 59 1.845 -13.942 -4.977
412 1HD LYS 59 2HD LYS 59 -0.379 -13.608 -5.028
413 2HD LYS 59 1HD LYS 59 -0.526 -13.655 -3.269
414 1HE LYS 59 2HE LYS 59 0.891 -11.298 -4.025
415 2HE LYS 59 1HE LYS 59 -0.593 -11.400 -4.972
416 1HZ LYS 59 1HZ LYS 59 -0.736 -11.912 -2.090
417 2HZ LYS 59 2HZ LYS 59 -1.895 -11.236 -3.126
418 3HZ LYS 59 3HZ LYS 59 -0.569 -10.309 -2.615
419 H GLY 60 H GLY 60 0.260 -18.489 -3.934
420 1HA GLY 60 1HA GLY 60 1.111 -19.456 -6.159
421 2HA GLY 60 2HA GLY 60 2.676 -18.902 -5.571
422 H LYS 61 H LYS 61 2.235 -19.457 -2.852
423 HA LYS 61 HA LYS 61 1.576 -22.267 -2.633
424 1HB LYS 61 2HB LYS 61 4.152 -21.855 -3.124
425 2HB LYS 61 1HB LYS 61 4.182 -21.452 -1.412
426 1HG LYS 61 2HG LYS 61 2.745 -23.905 -1.837
427 2HG LYS 61 1HG LYS 61 4.350 -23.987 -2.565
428 1HD LYS 61 2HD LYS 61 5.027 -24.547 -0.499
429 2HD LYS 61 1HD LYS 61 4.899 -22.819 -0.166
430 1HE LYS 61 2HE LYS 61 3.633 -23.615 1.552
431 2HE LYS 61 1HE LYS 61 2.378 -23.479 0.320
432 1HZ LYS 61 1HZ LYS 61 3.782 -25.910 1.252
433 2HZ LYS 61 2HZ LYS 61 2.940 -25.878 -0.222
434 3HZ LYS 61 3HZ LYS 61 2.113 -25.598 1.228
Start of MODEL 16
1 1H GLY 1 1H GLY 1 -20.822 9.162 6.423
2 2H GLY 1 2H GLY 1 -19.875 7.796 6.109
3 3H GLY 1 3H GLY 1 -19.484 9.281 5.390
4 1HA GLY 1 2HA GLY 1 -19.462 9.927 8.005
5 2HA GLY 1 1HA GLY 1 -18.852 8.275 8.020
6 HA PRO 2 HA PRO 2 -14.905 10.028 7.015
7 1HB PRO 2 2HB PRO 2 -14.077 7.415 6.013
8 2HB PRO 2 1HB PRO 2 -13.541 8.272 7.459
9 1HG PRO 2 2HG PRO 2 -15.054 6.030 7.570
10 2HG PRO 2 1HG PRO 2 -15.161 7.319 8.785
11 1HD PRO 2 2HD PRO 2 -16.956 6.753 6.451
12 2HD PRO 2 1HD PRO 2 -17.383 7.217 8.114
13 H LEU 3 H LEU 3 -14.830 11.320 5.267
14 HA LEU 3 HA LEU 3 -15.137 10.078 2.610
15 1HB LEU 3 2HB LEU 3 -15.578 12.592 1.989
16 2HB LEU 3 1HB LEU 3 -16.860 11.578 2.622
17 HG LEU 3 HG LEU 3 -15.711 12.710 4.891
18 1HD1 LEU 3 1HD1 LEU 3 -14.480 14.360 3.786
19 2HD1 LEU 3 2HD1 LEU 3 -15.757 14.647 2.604
20 3HD1 LEU 3 3HD1 LEU 3 -15.965 15.176 4.274
21 1HD2 LEU 3 1HD2 LEU 3 -17.818 13.902 5.059
22 2HD2 LEU 3 2HD2 LEU 3 -18.139 13.614 3.348
23 3HD2 LEU 3 3HD2 LEU 3 -18.089 12.260 4.474
24 H GLY 4 H GLY 4 -13.901 11.114 0.865
25 1HA GLY 4 1HA GLY 4 -12.044 12.452 0.147
26 2HA GLY 4 2HA GLY 4 -11.432 12.424 1.795
27 H SER 5 H SER 5 -10.525 10.432 2.601
28 HA SER 5 HA SER 5 -9.731 8.559 0.487
29 1HB SER 5 2HB SER 5 -7.881 9.616 2.638
30 2HB SER 5 1HB SER 5 -7.461 8.471 1.365
31 HG SER 5 HG SER 5 -7.074 10.108 0.119
32 H ASP 6 H ASP 6 -11.686 7.570 1.618
33 HA ASP 6 HA ASP 6 -10.822 6.061 3.995
34 1HB ASP 6 2HB ASP 6 -12.878 7.082 4.527
35 2HB ASP 6 1HB ASP 6 -13.547 6.772 2.927
36 H HIS 7 H HIS 7 -12.526 5.734 0.915
37 HA HIS 7 HA HIS 7 -11.556 2.958 0.739
38 1HB HIS 7 2HB HIS 7 -14.083 3.451 0.546
39 2HB HIS 7 1HB HIS 7 -13.696 4.150 -1.023
40 HD2 HIS 7 2HD HIS 7 -12.635 2.271 -2.914
41 HE1 HIS 7 1HE HIS 7 -14.201 -1.045 -0.804
42 HE2 HIS 7 2HE HIS 7 -13.351 -0.221 -3.046
43 H HIS 8 H HIS 8 -10.045 2.535 -0.724
44 HA HIS 8 HA HIS 8 -8.503 2.778 -2.363
45 1HB HIS 8 2HB HIS 8 -10.571 3.186 -3.800
46 2HB HIS 8 1HB HIS 8 -10.232 4.904 -3.629
47 HD2 HIS 8 2HD HIS 8 -7.068 2.811 -4.042
48 HE1 HIS 8 1HE HIS 8 -8.029 4.446 -7.824
49 HE2 HIS 8 2HE HIS 8 -6.191 3.439 -6.402
50 H MET 9 H MET 9 -7.394 3.700 -0.459
51 HA MET 9 HA MET 9 -7.048 6.526 -0.239
52 1HB MET 9 2HB MET 9 -5.671 4.118 0.903
53 2HB MET 9 1HB MET 9 -4.938 5.705 1.080
54 1HG MET 9 2HG MET 9 -6.541 6.439 2.518
55 2HG MET 9 1HG MET 9 -7.784 5.378 1.861
56 1HE MET 9 1HE MET 9 -7.320 4.531 5.694
57 2HE MET 9 2HE MET 9 -6.289 5.888 5.233
58 3HE MET 9 3HE MET 9 -7.931 5.772 4.598
59 H GLU 10 H GLU 10 -5.672 7.836 -1.307
60 HA GLU 10 HA GLU 10 -3.842 6.646 -3.259
61 1HB GLU 10 2HB GLU 10 -3.691 9.510 -3.178
62 2HB GLU 10 1HB GLU 10 -4.237 8.470 -4.485
63 1HG GLU 10 2HG GLU 10 -6.138 9.648 -4.174
64 2HG GLU 10 1HG GLU 10 -6.419 8.378 -2.981
65 H PHE 11 H PHE 11 -3.804 7.226 -0.144
66 HA PHE 11 HA PHE 11 -0.923 7.742 -0.118
67 1HB PHE 11 2HB PHE 11 -1.045 9.074 1.837
68 2HB PHE 11 1HB PHE 11 -2.314 9.697 0.791
69 HD1 PHE 11 1HD PHE 11 -4.706 8.847 1.216
70 HD2 PHE 11 2HD PHE 11 -1.526 8.425 4.010
71 HE1 PHE 11 1HE PHE 11 -6.340 8.542 3.029
72 HE2 PHE 11 2HE PHE 11 -3.157 8.112 5.824
73 HZ PHE 11 HZ PHE 11 -5.569 8.174 5.337
74 H CYS 12 H CYS 12 -0.001 6.867 2.052
75 HA CYS 12 HA CYS 12 -0.710 4.119 2.159
76 1HB CYS 12 2HB CYS 12 1.274 5.865 3.522
77 2HB CYS 12 1HB CYS 12 0.891 4.312 4.262
78 HG CYS 12 HG CYS 12 3.135 4.824 2.152
79 H ARG 13 H ARG 13 -2.132 3.137 3.378
80 HA ARG 13 HA ARG 13 -3.711 4.466 5.342
81 1HB ARG 13 2HB ARG 13 -3.694 1.614 5.722
82 2HB ARG 13 1HB ARG 13 -4.990 2.642 5.127
83 1HG ARG 13 2HG ARG 13 -4.110 2.472 2.867
84 2HG ARG 13 1HG ARG 13 -2.768 1.486 3.451
85 1HD ARG 13 2HD ARG 13 -4.581 0.152 2.438
86 2HD ARG 13 1HD ARG 13 -4.280 -0.256 4.128
87 HE ARG 13 HE ARG 13 -6.284 1.648 4.134
88 1HH1 ARG 13 2HH1 ARG 13 -5.812 -1.595 2.893
89 2HH1 ARG 13 1HH1 ARG 13 -7.496 -2.014 3.001
90 1HH2 ARG 13 2HH2 ARG 13 -8.498 1.117 4.261
91 2HH2 ARG 13 1HH2 ARG 13 -9.032 -0.461 3.742
92 H VAL 14 H VAL 14 -0.607 3.137 5.378
93 HA VAL 14 HA VAL 14 -0.632 2.686 8.265
94 HB VAL 14 HB VAL 14 1.469 1.973 6.214
95 1HG1 VAL 14 1HG1 VAL 14 2.634 0.813 7.908
96 2HG1 VAL 14 2HG1 VAL 14 2.265 2.400 8.579
97 3HG1 VAL 14 3HG1 VAL 14 1.307 0.999 9.054
98 1HG2 VAL 14 1HG2 VAL 14 -0.992 0.712 6.950
99 2HG2 VAL 14 2HG2 VAL 14 0.197 0.216 5.746
100 3HG2 VAL 14 3HG2 VAL 14 0.362 -0.316 7.420
101 H CYS 15 H CYS 15 1.850 3.954 6.023
102 HA CYS 15 HA CYS 15 2.994 5.500 8.114
103 1HB CYS 15 2HB CYS 15 4.801 5.778 6.719
104 2HB CYS 15 1HB CYS 15 4.084 4.332 6.021
105 H LYS 16 H LYS 16 0.491 6.146 5.990
106 HA LYS 16 HA LYS 16 -0.835 7.950 5.683
107 1HB LYS 16 2HB LYS 16 1.049 9.127 7.693
108 2HB LYS 16 1HB LYS 16 -0.121 10.148 6.870
109 1HG LYS 16 2HG LYS 16 -1.248 7.690 7.981
110 2HG LYS 16 1HG LYS 16 -0.578 8.796 9.181
111 1HD LYS 16 2HD LYS 16 -1.955 10.598 8.340
112 2HD LYS 16 1HD LYS 16 -2.562 9.565 7.044
113 1HE LYS 16 2HE LYS 16 -4.127 8.713 8.369
114 2HE LYS 16 1HE LYS 16 -2.936 8.301 9.602
115 1HZ LYS 16 1HZ LYS 16 -4.073 9.805 10.794
116 2HZ LYS 16 2HZ LYS 16 -4.712 10.585 9.431
117 3HZ LYS 16 3HZ LYS 16 -3.134 10.938 9.948
118 H ASP 17 H ASP 17 2.299 7.709 4.644
119 HA ASP 17 HA ASP 17 2.269 10.199 3.115
120 1HB ASP 17 2HB ASP 17 4.302 8.274 3.924
121 2HB ASP 17 1HB ASP 17 4.421 8.688 2.218
122 H GLY 18 H GLY 18 1.845 10.326 0.970
123 1HA GLY 18 1HA GLY 18 1.683 7.907 -0.635
124 2HA GLY 18 2HA GLY 18 0.147 8.713 -0.339
125 H GLY 19 H GLY 19 -0.234 9.291 -2.442
126 1HA GLY 19 1HA GLY 19 -0.138 11.295 -3.831
127 2HA GLY 19 2HA GLY 19 1.595 11.342 -3.528
128 H GLU 20 H GLU 20 2.864 10.526 -5.051
129 HA GLU 20 HA GLU 20 1.670 8.682 -7.014
130 1HB GLU 20 2HB GLU 20 4.174 10.351 -7.313
131 2HB GLU 20 1HB GLU 20 3.397 9.388 -8.562
132 1HG GLU 20 2HG GLU 20 1.346 10.973 -7.894
133 2HG GLU 20 1HG GLU 20 2.691 12.048 -7.508
134 H LEU 21 H LEU 21 1.948 6.947 -5.541
135 HA LEU 21 HA LEU 21 4.719 5.987 -5.338
136 1HB LEU 21 2HB LEU 21 4.470 5.447 -3.073
137 2HB LEU 21 1HB LEU 21 3.791 7.053 -3.224
138 HG LEU 21 HG LEU 21 2.089 4.559 -3.207
139 1HD1 LEU 21 1HD1 LEU 21 3.565 5.663 -1.057
140 2HD1 LEU 21 2HD1 LEU 21 1.863 6.045 -0.795
141 3HD1 LEU 21 3HD1 LEU 21 2.367 4.370 -1.017
142 1HD2 LEU 21 1HD2 LEU 21 0.619 6.623 -2.205
143 2HD2 LEU 21 2HD2 LEU 21 1.612 7.438 -3.413
144 3HD2 LEU 21 3HD2 LEU 21 0.589 6.080 -3.884
145 H LEU 22 H LEU 22 4.459 3.605 -4.229
146 HA LEU 22 HA LEU 22 3.220 1.994 -6.231
147 1HB LEU 22 2HB LEU 22 5.089 0.961 -5.397
148 2HB LEU 22 1HB LEU 22 4.819 1.543 -3.767
149 HG LEU 22 HG LEU 22 2.738 -0.206 -4.072
150 1HD1 LEU 22 1HD1 LEU 22 4.451 -0.782 -6.203
151 2HD1 LEU 22 2HD1 LEU 22 4.758 -2.027 -4.993
152 3HD1 LEU 22 3HD1 LEU 22 3.120 -1.768 -5.596
153 1HD2 LEU 22 1HD2 LEU 22 4.826 0.119 -2.392
154 2HD2 LEU 22 2HD2 LEU 22 3.710 -1.245 -2.328
155 3HD2 LEU 22 3HD2 LEU 22 5.260 -1.411 -3.153
156 H CYS 23 H CYS 23 1.410 0.640 -6.034
157 HA CYS 23 HA CYS 23 -0.235 0.799 -3.646
158 1HB CYS 23 2HB CYS 23 -2.169 1.551 -5.299
159 2HB CYS 23 1HB CYS 23 -1.144 2.737 -4.497
160 HG CYS 23 HG CYS 23 -0.791 1.645 -7.725
161 H CYS 24 H CYS 24 -1.894 -0.789 -3.589
162 HA CYS 24 HA CYS 24 -1.444 -3.132 -5.087
163 1HB CYS 24 2HB CYS 24 -4.165 -2.885 -4.071
164 2HB CYS 24 1HB CYS 24 -2.914 -4.043 -3.647
165 H ASP 25 H ASP 25 -2.281 -3.837 -6.977
166 HA ASP 25 HA ASP 25 -3.699 -1.857 -8.574
167 1HB ASP 25 2HB ASP 25 -1.654 -3.374 -9.280
168 2HB ASP 25 1HB ASP 25 -2.925 -4.532 -9.656
169 H THR 26 H THR 26 -4.204 -4.937 -7.110
170 HA THR 26 HA THR 26 -6.872 -5.139 -8.320
171 HB THR 26 HB THR 26 -5.459 -7.082 -8.704
172 HG1 THR 26 1HG THR 26 -7.739 -7.386 -8.230
173 1HG2 THR 26 1HG2 THR 26 -5.191 -7.154 -5.706
174 2HG2 THR 26 2HG2 THR 26 -3.910 -6.930 -6.900
175 3HG2 THR 26 3HG2 THR 26 -4.736 -8.485 -6.771
176 H CYS 27 H CYS 27 -5.601 -3.696 -5.858
177 HA CYS 27 HA CYS 27 -7.949 -4.033 -4.204
178 1HB CYS 27 2HB CYS 27 -6.625 -5.511 -2.989
179 2HB CYS 27 1HB CYS 27 -5.147 -4.615 -3.306
180 HA PRO 28 HA PRO 28 -7.453 0.268 -4.406
181 1HB PRO 28 2HB PRO 28 -9.447 1.041 -2.757
182 2HB PRO 28 1HB PRO 28 -9.743 0.241 -4.303
183 1HG PRO 28 2HG PRO 28 -9.866 -0.860 -1.542
184 2HG PRO 28 1HG PRO 28 -10.851 -1.261 -2.958
185 1HD PRO 28 2HD PRO 28 -8.699 -2.748 -1.994
186 2HD PRO 28 1HD PRO 28 -9.401 -2.888 -3.615
187 H SER 29 H SER 29 -5.274 0.046 -3.198
188 HA SER 29 HA SER 29 -5.338 1.982 -1.036
189 1HB SER 29 2HB SER 29 -4.163 -0.780 -0.682
190 2HB SER 29 1HB SER 29 -3.844 0.571 0.404
191 HG SER 29 HG SER 29 -5.608 -0.974 0.945
192 H SER 30 H SER 30 -2.979 2.480 -0.342
193 HA SER 30 HA SER 30 -1.085 2.068 -2.532
194 1HB SER 30 2HB SER 30 -1.502 4.753 -1.201
195 2HB SER 30 1HB SER 30 -0.390 4.387 -2.521
196 HG SER 30 HG SER 30 -3.212 4.529 -2.551
197 H TYR 31 H TYR 31 1.100 1.961 -1.905
198 HA TYR 31 HA TYR 31 1.693 2.133 0.964
199 1HB TYR 31 2HB TYR 31 1.803 -0.354 -0.718
200 2HB TYR 31 1HB TYR 31 2.847 -0.166 0.686
201 HD1 TYR 31 1HD TYR 31 -0.009 -1.673 -0.346
202 HD2 TYR 31 2HD TYR 31 1.350 0.840 2.802
203 HE1 TYR 31 1HE TYR 31 -1.816 -2.503 1.088
204 HE2 TYR 31 2HE TYR 31 -0.458 0.016 4.247
205 HH TYR 31 HH TYR 31 -2.989 -2.075 2.997
206 H HIS 32 H HIS 32 4.028 1.578 1.379
207 HA HIS 32 HA HIS 32 5.778 2.278 -0.876
208 1HB HIS 32 2HB HIS 32 6.086 2.975 2.050
209 2HB HIS 32 1HB HIS 32 7.422 3.014 0.920
210 HD2 HIS 32 2HD HIS 32 7.234 5.065 -1.065
211 HE1 HIS 32 1HE HIS 32 4.450 7.274 1.241
212 HE2 HIS 32 2HE HIS 32 5.880 7.278 -0.860
213 H ILE 33 H ILE 33 8.099 1.307 -0.252
214 HA ILE 33 HA ILE 33 7.655 -1.494 0.398
215 HB ILE 33 HB ILE 33 10.203 -1.626 0.106
216 1HG1 ILE 33 2HG1 ILE 33 9.962 0.877 -1.502
217 1HG2 ILE 33 1HG2 ILE 33 9.852 -2.234 -2.036
218 2HG2 ILE 33 2HG2 ILE 33 8.163 -1.991 -1.587
219 3HG2 ILE 33 3HG2 ILE 33 9.038 -0.724 -2.447
220 1HD1 ILE 33 1HD1 ILE 33 11.992 -0.356 -1.752
221 2HD1 ILE 33 2HD1 ILE 33 12.334 1.118 -0.845
222 3HD1 ILE 33 3HD1 ILE 33 12.218 -0.429 -0.004
223 H HIS 34 H HIS 34 6.865 -0.556 2.546
224 HA HIS 34 HA HIS 34 8.672 -1.210 4.628
225 1HB HIS 34 2HB HIS 34 9.099 1.340 3.647
226 2HB HIS 34 1HB HIS 34 8.023 1.623 5.010
227 HD2 HIS 34 2HD HIS 34 9.875 -1.208 6.289
228 HE1 HIS 34 1HE HIS 34 12.454 2.075 6.969
229 HE2 HIS 34 2HE HIS 34 12.074 -0.396 7.398
230 H CYS 35 H CYS 35 5.894 0.706 3.683
231 HA CYS 35 HA CYS 35 4.662 0.678 6.214
232 1HB CYS 35 2HB CYS 35 3.197 1.312 3.691
233 2HB CYS 35 1HB CYS 35 3.226 2.189 5.227
234 H LEU 36 H LEU 36 5.107 -1.969 5.495
235 HA LEU 36 HA LEU 36 2.503 -2.985 6.031
236 1HB LEU 36 2HB LEU 36 2.642 -4.776 4.238
237 2HB LEU 36 1HB LEU 36 2.163 -3.175 3.716
238 HG LEU 36 HG LEU 36 5.023 -3.493 3.471
239 1HD1 LEU 36 1HD1 LEU 36 4.951 -5.165 1.647
240 2HD1 LEU 36 2HD1 LEU 36 4.567 -5.854 3.226
241 3HD1 LEU 36 3HD1 LEU 36 3.275 -5.511 2.072
242 1HD2 LEU 36 1HD2 LEU 36 4.637 -2.220 1.674
243 2HD2 LEU 36 2HD2 LEU 36 3.432 -3.341 1.037
244 3HD2 LEU 36 3HD2 LEU 36 2.968 -2.134 2.240
245 H ARG 37 H ARG 37 2.616 -5.288 6.655
246 HA ARG 37 HA ARG 37 4.735 -5.647 8.428
247 1HB ARG 37 2HB ARG 37 2.444 -7.307 7.538
248 2HB ARG 37 1HB ARG 37 3.758 -8.149 8.344
249 1HG ARG 37 2HG ARG 37 1.652 -6.998 9.603
250 2HG ARG 37 1HG ARG 37 3.212 -7.333 10.351
251 1HD ARG 37 2HD ARG 37 3.064 -5.146 10.904
252 2HD ARG 37 1HD ARG 37 3.764 -4.946 9.300
253 HE ARG 37 HE ARG 37 1.001 -4.969 8.993
254 1HH1 ARG 37 2HH1 ARG 37 3.479 -2.985 10.453
255 2HH1 ARG 37 1HH1 ARG 37 2.532 -1.525 10.390
256 1HH2 ARG 37 2HH2 ARG 37 -0.251 -3.064 8.906
257 2HH2 ARG 37 1HH2 ARG 37 0.400 -1.575 9.536
258 HA PRO 38 HA PRO 38 6.829 -8.786 5.542
259 1HB PRO 38 2HB PRO 38 5.442 -9.167 3.070
260 2HB PRO 38 1HB PRO 38 5.640 -10.325 4.386
261 1HG PRO 38 2HG PRO 38 3.234 -9.189 3.624
262 2HG PRO 38 1HG PRO 38 3.558 -9.916 5.208
263 1HD PRO 38 2HD PRO 38 3.555 -7.035 4.403
264 2HD PRO 38 1HD PRO 38 2.984 -7.791 5.907
265 H ALA 39 H ALA 39 7.362 -6.215 5.557
266 HA ALA 39 HA ALA 39 7.282 -4.779 3.160
267 1HB ALA 39 1HB ALA 39 7.692 -3.476 5.022
268 2HB ALA 39 2HB ALA 39 8.930 -4.568 5.644
269 3HB ALA 39 3HB ALA 39 9.280 -3.536 4.258
270 H LEU 40 H LEU 40 8.647 -4.547 1.472
271 HA LEU 40 HA LEU 40 10.794 -6.534 1.233
272 1HB LEU 40 2HB LEU 40 9.543 -4.962 -1.012
273 2HB LEU 40 1HB LEU 40 10.538 -6.399 -1.133
274 HG LEU 40 HG LEU 40 8.315 -7.148 0.411
275 1HD1 LEU 40 1HD1 LEU 40 6.437 -6.585 -1.042
276 2HD1 LEU 40 2HD1 LEU 40 7.168 -5.134 -0.353
277 3HD1 LEU 40 3HD1 LEU 40 7.496 -5.576 -2.028
278 1HD2 LEU 40 1HD2 LEU 40 8.066 -7.893 -2.351
279 2HD2 LEU 40 2HD2 LEU 40 9.752 -7.989 -1.839
280 3HD2 LEU 40 3HD2 LEU 40 8.512 -8.882 -0.959
281 H TYR 41 H TYR 41 12.647 -5.795 -0.166
282 HA TYR 41 HA TYR 41 13.434 -3.076 0.631
283 1HB TYR 41 2HB TYR 41 14.928 -5.592 0.076
284 2HB TYR 41 1HB TYR 41 15.715 -4.083 -0.368
285 HD1 TYR 41 1HD TYR 41 13.471 -4.464 2.543
286 HD2 TYR 41 2HD TYR 41 17.502 -4.197 1.208
287 HE1 TYR 41 1HE TYR 41 14.214 -4.168 4.866
288 HE2 TYR 41 2HE TYR 41 18.258 -3.920 3.531
289 HH TYR 41 HH TYR 41 15.947 -3.940 6.244
290 H GLU 42 H GLU 42 12.658 -5.106 -2.039
291 HA GLU 42 HA GLU 42 13.534 -3.058 -3.947
292 1HB GLU 42 2HB GLU 42 12.965 -5.984 -4.153
293 2HB GLU 42 1HB GLU 42 12.746 -4.983 -5.581
294 1HG GLU 42 2HG GLU 42 14.905 -5.202 -5.987
295 2HG GLU 42 1HG GLU 42 15.226 -4.247 -4.541
296 H VAL 43 H VAL 43 12.129 -1.909 -5.121
297 HA VAL 43 HA VAL 43 9.397 -1.822 -4.263
298 HB VAL 43 HB VAL 43 10.509 -0.352 -6.643
299 1HG1 VAL 43 1HG1 VAL 43 8.848 1.273 -5.082
300 2HG1 VAL 43 2HG1 VAL 43 8.478 0.543 -6.646
301 3HG1 VAL 43 3HG1 VAL 43 8.054 -0.301 -5.155
302 1HG2 VAL 43 1HG2 VAL 43 12.088 -0.056 -4.798
303 2HG2 VAL 43 2HG2 VAL 43 11.219 1.439 -5.145
304 3HG2 VAL 43 3HG2 VAL 43 10.767 0.461 -3.749
305 HA PRO 44 HA PRO 44 7.965 -4.721 -7.325
306 1HB PRO 44 2HB PRO 44 5.280 -4.067 -6.407
307 2HB PRO 44 1HB PRO 44 6.181 -5.572 -6.217
308 1HG PRO 44 2HG PRO 44 5.606 -3.927 -4.140
309 2HG PRO 44 1HG PRO 44 7.059 -4.943 -4.193
310 1HD PRO 44 2HD PRO 44 6.766 -2.017 -4.778
311 2HD PRO 44 1HD PRO 44 8.051 -2.866 -3.890
312 H ASP 45 H ASP 45 6.157 -4.752 -8.994
313 HA ASP 45 HA ASP 45 6.287 -2.295 -10.500
314 1HB ASP 45 2HB ASP 45 6.405 -4.752 -11.375
315 2HB ASP 45 1HB ASP 45 4.649 -4.690 -11.294
316 H GLY 46 H GLY 46 4.049 -1.909 -11.791
317 1HA GLY 46 1HA GLY 46 2.284 -0.712 -9.925
318 2HA GLY 46 2HA GLY 46 1.982 -0.909 -11.647
319 H GLU 47 H GLU 47 2.119 -3.708 -11.773
320 HA GLU 47 HA GLU 47 -0.469 -4.448 -10.750
321 1HB GLU 47 2HB GLU 47 1.589 -5.697 -12.502
322 2HB GLU 47 1HB GLU 47 0.471 -6.771 -11.671
323 1HG GLU 47 2HG GLU 47 -1.285 -5.026 -12.649
324 2HG GLU 47 1HG GLU 47 -0.011 -4.843 -13.855
325 H TRP 48 H TRP 48 -0.102 -4.228 -8.509
326 HA TRP 48 HA TRP 48 1.537 -6.373 -7.337
327 1HB TRP 48 2HB TRP 48 2.628 -4.165 -7.155
328 2HB TRP 48 1HB TRP 48 1.210 -3.540 -6.324
329 HD1 TRP 48 HD TRP 48 3.703 -6.472 -5.755
330 HE1 TRP 48 1HE TRP 48 4.212 -6.593 -3.236
331 HE3 TRP 48 3HE TRP 48 0.656 -2.701 -4.150
332 HZ2 TRP 48 2HZ TRP 48 3.414 -5.251 -0.870
333 HZ3 TRP 48 3HZ TRP 48 0.583 -2.185 -1.746
334 HH2 TRP 48 HH TRP 48 1.931 -3.435 -0.143
335 H GLN 49 H GLN 49 0.769 -7.372 -5.532
336 HA GLN 49 HA GLN 49 -1.889 -6.553 -4.573
337 1HB GLN 49 2HB GLN 49 -2.344 -8.593 -5.650
338 2HB GLN 49 1HB GLN 49 -0.814 -9.304 -5.156
339 1HG GLN 49 2HG GLN 49 -2.315 -10.414 -3.814
340 2HG GLN 49 1HG GLN 49 -1.787 -9.107 -2.759
341 1HE2 GLN 49 1HE2 GLN 49 -3.233 -7.595 -2.094
342 2HE2 GLN 49 2HE2 GLN 49 -4.920 -7.644 -2.475
343 H CYS 50 H CYS 50 -1.886 -5.991 -2.516
344 HA CYS 50 HA CYS 50 0.423 -6.014 -0.913
345 1HB CYS 50 2HB CYS 50 -1.276 -5.369 0.894
346 2HB CYS 50 1HB CYS 50 -1.200 -4.323 -0.524
347 HA PRO 51 HA PRO 51 0.308 -9.847 1.447
348 1HB PRO 51 2HB PRO 51 -0.108 -8.847 4.022
349 2HB PRO 51 1HB PRO 51 1.466 -9.103 3.266
350 1HG PRO 51 2HG PRO 51 -0.119 -6.592 3.546
351 2HG PRO 51 1HG PRO 51 1.638 -6.825 3.607
352 1HD PRO 51 2HD PRO 51 0.429 -5.784 1.452
353 2HD PRO 51 1HD PRO 51 1.837 -6.855 1.301
354 H ARG 52 H ARG 52 -1.869 -7.389 2.672
355 HA ARG 52 HA ARG 52 -4.197 -8.325 1.635
356 1HB ARG 52 2HB ARG 52 -3.517 -10.036 3.731
357 2HB ARG 52 1HB ARG 52 -4.677 -8.928 4.454
358 1HG ARG 52 2HG ARG 52 -5.363 -11.177 3.147
359 2HG ARG 52 1HG ARG 52 -6.403 -9.761 3.282
360 1HD ARG 52 2HD ARG 52 -5.576 -8.949 1.122
361 2HD ARG 52 1HD ARG 52 -4.541 -10.369 0.986
362 HE ARG 52 HE ARG 52 -6.877 -11.557 1.211
363 1HH1 ARG 52 2HH1 ARG 52 -6.111 -8.662 -0.614
364 2HH1 ARG 52 1HH1 ARG 52 -7.290 -8.974 -1.847
365 1HH2 ARG 52 2HH2 ARG 52 -8.430 -11.969 -0.413
366 2HH2 ARG 52 1HH2 ARG 52 -8.597 -10.859 -1.743
367 H CYS 53 H CYS 53 -2.755 -5.993 2.150
368 HA CYS 53 HA CYS 53 -2.735 -3.931 3.076
369 1HB CYS 53 2HB CYS 53 -5.362 -4.554 2.068
370 2HB CYS 53 1HB CYS 53 -5.455 -3.358 3.361
371 H THR 54 H THR 54 -2.124 -5.555 4.970
372 HA THR 54 HA THR 54 -3.939 -5.626 7.155
373 HB THR 54 HB THR 54 -1.420 -6.347 8.103
374 HG1 THR 54 1HG THR 54 -0.602 -7.642 6.360
375 1HG2 THR 54 1HG2 THR 54 -3.143 -7.778 8.653
376 2HG2 THR 54 2HG2 THR 54 -2.337 -8.710 7.390
377 3HG2 THR 54 3HG2 THR 54 -3.796 -7.793 7.015
378 H CYS 55 H CYS 55 -4.041 -3.111 7.092
379 HA CYS 55 HA CYS 55 -1.931 -1.651 8.321
380 1HB CYS 55 2HB CYS 55 -4.541 -0.514 8.829
381 2HB CYS 55 1HB CYS 55 -3.220 0.114 7.848
382 HG CYS 55 HG CYS 55 -5.598 -0.031 6.329
383 HA PRO 56 HA PRO 56 -4.134 -2.523 12.458
384 1HB PRO 56 2HB PRO 56 -6.431 -4.175 12.211
385 2HB PRO 56 1HB PRO 56 -6.397 -2.452 12.583
386 1HG PRO 56 2HG PRO 56 -7.437 -3.583 10.266
387 2HG PRO 56 1HG PRO 56 -6.987 -1.883 10.471
388 1HD PRO 56 2HD PRO 56 -5.466 -4.103 9.181
389 2HD PRO 56 1HD PRO 56 -5.582 -2.390 8.717
390 H ALA 57 H ALA 57 -2.219 -4.027 11.323
391 HA ALA 57 HA ALA 57 -2.720 -6.815 11.287
392 1HB ALA 57 1HB ALA 57 -0.930 -5.800 9.980
393 2HB ALA 57 2HB ALA 57 -0.093 -5.345 11.464
394 3HB ALA 57 3HB ALA 57 -0.301 -7.048 11.056
395 H LEU 58 H LEU 58 -1.771 -4.593 13.796
396 HA LEU 58 HA LEU 58 -0.760 -6.608 15.562
397 1HB LEU 58 2HB LEU 58 -0.545 -3.912 15.492
398 2HB LEU 58 1HB LEU 58 -1.783 -4.094 16.722
399 HG LEU 58 HG LEU 58 0.011 -5.903 17.607
400 1HD1 LEU 58 1HD1 LEU 58 1.422 -4.194 15.724
401 2HD1 LEU 58 2HD1 LEU 58 2.133 -4.173 17.338
402 3HD1 LEU 58 3HD1 LEU 58 1.925 -5.703 16.486
403 1HD2 LEU 58 1HD2 LEU 58 0.613 -3.121 18.378
404 2HD2 LEU 58 2HD2 LEU 58 -1.070 -3.626 18.533
405 3HD2 LEU 58 3HD2 LEU 58 0.199 -4.515 19.377
406 H LYS 59 H LYS 59 -2.530 -8.099 15.351
407 HA LYS 59 HA LYS 59 -4.678 -7.539 17.272
408 1HB LYS 59 2HB LYS 59 -5.304 -7.231 14.766
409 2HB LYS 59 1HB LYS 59 -5.250 -8.987 14.699
410 1HG LYS 59 2HG LYS 59 -6.802 -8.169 16.955
411 2HG LYS 59 1HG LYS 59 -7.380 -7.347 15.503
412 1HD LYS 59 2HD LYS 59 -7.859 -9.359 14.414
413 2HD LYS 59 1HD LYS 59 -6.830 -10.296 15.499
414 1HE LYS 59 2HE LYS 59 -9.287 -8.867 16.468
415 2HE LYS 59 1HE LYS 59 -9.361 -10.495 15.796
416 1HZ LYS 59 1HZ LYS 59 -7.691 -11.151 17.500
417 2HZ LYS 59 2HZ LYS 59 -9.189 -10.675 18.140
418 3HZ LYS 59 3HZ LYS 59 -7.868 -9.614 18.207
419 H GLY 60 H GLY 60 -2.379 -9.675 15.914
420 1HA GLY 60 1HA GLY 60 -1.664 -11.748 16.652
421 2HA GLY 60 2HA GLY 60 -2.894 -11.685 17.910
422 H LYS 61 H LYS 61 -4.798 -12.701 17.617
423 HA LYS 61 HA LYS 61 -5.500 -13.647 14.955
424 1HB LYS 61 2HB LYS 61 -4.710 -15.388 17.159
425 2HB LYS 61 1HB LYS 61 -6.340 -15.733 16.597
426 1HG LYS 61 2HG LYS 61 -3.936 -15.588 14.791
427 2HG LYS 61 1HG LYS 61 -4.554 -17.080 15.500
428 1HD LYS 61 2HD LYS 61 -5.876 -17.255 13.710
429 2HD LYS 61 1HD LYS 61 -6.788 -15.890 14.357
430 1HE LYS 61 2HE LYS 61 -6.109 -14.560 12.708
431 2HE LYS 61 1HE LYS 61 -4.420 -14.977 12.991
432 1HZ LYS 61 1HZ LYS 61 -4.720 -16.957 11.628
433 2HZ LYS 61 2HZ LYS 61 -5.102 -15.553 10.752
434 3HZ LYS 61 3HZ LYS 61 -6.343 -16.545 11.348
Start of MODEL 17
1 1H GLY 1 1H GLY 1 -15.611 -8.594 9.903
2 2H GLY 1 2H GLY 1 -16.522 -7.879 8.667
3 3H GLY 1 3H GLY 1 -16.348 -7.087 10.155
4 1HA GLY 1 2HA GLY 1 -14.316 -6.289 9.679
5 2HA GLY 1 1HA GLY 1 -13.872 -7.741 8.792
6 HA PRO 2 HA PRO 2 -16.039 -4.345 6.036
7 1HB PRO 2 2HB PRO 2 -14.546 -2.071 6.183
8 2HB PRO 2 1HB PRO 2 -15.978 -2.363 7.175
9 1HG PRO 2 2HG PRO 2 -13.089 -2.683 7.881
10 2HG PRO 2 1HG PRO 2 -14.407 -1.994 8.847
11 1HD PRO 2 2HD PRO 2 -13.488 -4.504 9.235
12 2HD PRO 2 1HD PRO 2 -15.190 -4.067 9.487
13 H LEU 3 H LEU 3 -15.403 -5.270 4.189
14 HA LEU 3 HA LEU 3 -12.647 -5.511 3.403
15 1HB LEU 3 2HB LEU 3 -13.420 -6.603 1.478
16 2HB LEU 3 1HB LEU 3 -14.540 -7.081 2.736
17 HG LEU 3 HG LEU 3 -15.625 -4.778 1.486
18 1HD1 LEU 3 1HD1 LEU 3 -14.053 -5.400 -0.372
19 2HD1 LEU 3 2HD1 LEU 3 -14.943 -6.914 -0.522
20 3HD1 LEU 3 3HD1 LEU 3 -15.761 -5.378 -0.810
21 1HD2 LEU 3 1HD2 LEU 3 -17.191 -6.759 0.628
22 2HD2 LEU 3 2HD2 LEU 3 -16.303 -7.630 1.879
23 3HD2 LEU 3 3HD2 LEU 3 -17.213 -6.179 2.295
24 H GLY 4 H GLY 4 -15.320 -3.341 2.824
25 1HA GLY 4 1HA GLY 4 -13.778 -1.731 0.927
26 2HA GLY 4 2HA GLY 4 -15.432 -1.428 1.452
27 H SER 5 H SER 5 -12.152 -1.590 2.768
28 HA SER 5 HA SER 5 -12.778 -0.016 5.034
29 1HB SER 5 2HB SER 5 -9.949 -0.203 4.247
30 2HB SER 5 1HB SER 5 -10.735 -0.682 5.752
31 HG SER 5 HG SER 5 -11.449 -2.576 4.727
32 H ASP 6 H ASP 6 -10.674 0.690 2.228
33 HA ASP 6 HA ASP 6 -11.573 3.452 2.283
34 1HB ASP 6 2HB ASP 6 -9.380 3.040 3.742
35 2HB ASP 6 1HB ASP 6 -8.611 3.130 2.161
36 H HIS 7 H HIS 7 -12.436 3.214 0.294
37 HA HIS 7 HA HIS 7 -11.046 1.912 -1.840
38 1HB HIS 7 2HB HIS 7 -13.161 3.447 -2.928
39 2HB HIS 7 1HB HIS 7 -13.137 1.718 -2.610
40 HD2 HIS 7 2HD HIS 7 -14.833 4.912 -1.378
41 HE1 HIS 7 1HE HIS 7 -15.912 1.781 1.251
42 HE2 HIS 7 2HE HIS 7 -16.514 4.100 0.425
43 H HIS 8 H HIS 8 -10.405 2.840 -3.824
44 HA HIS 8 HA HIS 8 -9.365 4.307 -5.192
45 1HB HIS 8 2HB HIS 8 -11.315 5.941 -3.860
46 2HB HIS 8 1HB HIS 8 -9.834 6.866 -4.078
47 HD2 HIS 8 2HD HIS 8 -8.900 6.206 -6.991
48 HE1 HIS 8 1HE HIS 8 -12.915 6.870 -8.159
49 HE2 HIS 8 2HE HIS 8 -10.545 6.509 -8.981
50 H MET 9 H MET 9 -9.205 5.899 -2.024
51 HA MET 9 HA MET 9 -7.500 6.523 -0.687
52 1HB MET 9 2HB MET 9 -6.642 3.968 -1.850
53 2HB MET 9 1HB MET 9 -5.331 4.958 -1.219
54 1HG MET 9 2HG MET 9 -6.925 5.177 0.848
55 2HG MET 9 1HG MET 9 -7.599 3.680 0.207
56 1HE MET 9 1HE MET 9 -5.973 4.998 2.643
57 2HE MET 9 2HE MET 9 -4.979 3.710 3.326
58 3HE MET 9 3HE MET 9 -4.235 4.978 2.349
59 H GLU 10 H GLU 10 -4.786 6.643 -0.962
60 HA GLU 10 HA GLU 10 -3.771 7.698 -3.329
61 1HB GLU 10 2HB GLU 10 -5.618 9.463 -2.361
62 2HB GLU 10 1HB GLU 10 -4.149 10.059 -1.602
63 1HG GLU 10 2HG GLU 10 -3.867 11.210 -3.487
64 2HG GLU 10 1HG GLU 10 -3.325 9.678 -4.170
65 H PHE 11 H PHE 11 -3.810 7.808 0.176
66 HA PHE 11 HA PHE 11 -0.893 8.138 0.176
67 1HB PHE 11 2HB PHE 11 -1.115 9.268 2.322
68 2HB PHE 11 1HB PHE 11 -2.133 10.059 1.123
69 HD1 PHE 11 1HD PHE 11 -4.627 9.065 1.050
70 HD2 PHE 11 2HD PHE 11 -2.008 8.933 4.400
71 HE1 PHE 11 1HE PHE 11 -6.561 8.817 2.548
72 HE2 PHE 11 2HE PHE 11 -3.938 8.689 5.905
73 HZ PHE 11 HZ PHE 11 -6.217 8.627 4.979
74 H CYS 12 H CYS 12 0.232 7.170 2.048
75 HA CYS 12 HA CYS 12 -0.324 4.430 2.325
76 1HB CYS 12 2HB CYS 12 1.520 6.336 3.717
77 2HB CYS 12 1HB CYS 12 1.333 4.700 4.339
78 HG CYS 12 HG CYS 12 3.434 5.667 2.182
79 H ARG 13 H ARG 13 -1.165 3.214 3.995
80 HA ARG 13 HA ARG 13 -3.216 4.413 5.548
81 1HB ARG 13 2HB ARG 13 -2.134 1.681 5.170
82 2HB ARG 13 1HB ARG 13 -2.989 1.976 6.678
83 1HG ARG 13 2HG ARG 13 -4.998 2.408 5.605
84 2HG ARG 13 1HG ARG 13 -4.209 2.769 4.069
85 1HD ARG 13 2HD ARG 13 -4.659 0.686 3.441
86 2HD ARG 13 1HD ARG 13 -3.490 0.141 4.644
87 HE ARG 13 HE ARG 13 -6.354 0.512 5.270
88 1HH1 ARG 13 2HH1 ARG 13 -3.474 -1.464 5.220
89 2HH1 ARG 13 1HH1 ARG 13 -4.105 -2.648 6.335
90 1HH2 ARG 13 2HH2 ARG 13 -7.204 -1.027 6.729
91 2HH2 ARG 13 1HH2 ARG 13 -6.222 -2.386 7.202
92 H VAL 14 H VAL 14 0.125 3.790 6.171
93 HA VAL 14 HA VAL 14 -0.261 4.336 9.044
94 HB VAL 14 HB VAL 14 2.356 3.335 8.042
95 1HG1 VAL 14 1HG1 VAL 14 1.998 1.963 10.219
96 2HG1 VAL 14 2HG1 VAL 14 2.380 3.682 10.318
97 3HG1 VAL 14 3HG1 VAL 14 0.717 3.135 10.528
98 1HG2 VAL 14 1HG2 VAL 14 -0.152 1.683 8.122
99 2HG2 VAL 14 2HG2 VAL 14 1.050 1.801 6.835
100 3HG2 VAL 14 3HG2 VAL 14 1.444 0.962 8.340
101 H CYS 15 H CYS 15 2.333 4.742 6.677
102 HA CYS 15 HA CYS 15 3.303 7.133 7.872
103 1HB CYS 15 2HB CYS 15 4.588 6.725 5.442
104 2HB CYS 15 1HB CYS 15 5.108 6.149 7.026
105 H LYS 16 H LYS 16 0.652 6.831 6.172
106 HA LYS 16 HA LYS 16 -0.657 8.192 4.842
107 1HB LYS 16 2HB LYS 16 0.507 10.372 6.540
108 2HB LYS 16 1HB LYS 16 -1.158 10.146 6.023
109 1HG LYS 16 2HG LYS 16 0.115 8.138 7.826
110 2HG LYS 16 1HG LYS 16 -0.471 9.666 8.485
111 1HD LYS 16 2HD LYS 16 -2.687 9.204 7.880
112 2HD LYS 16 1HD LYS 16 -2.206 7.936 6.749
113 1HE LYS 16 2HE LYS 16 -2.016 6.375 8.371
114 2HE LYS 16 1HE LYS 16 -1.416 7.529 9.560
115 1HZ LYS 16 1HZ LYS 16 -3.796 6.461 9.749
116 2HZ LYS 16 2HZ LYS 16 -4.214 7.755 8.735
117 3HZ LYS 16 3HZ LYS 16 -3.500 8.059 10.241
118 H ASP 17 H ASP 17 1.965 7.942 3.565
119 HA ASP 17 HA ASP 17 2.415 10.630 2.507
120 1HB ASP 17 2HB ASP 17 4.370 9.518 1.373
121 2HB ASP 17 1HB ASP 17 4.415 9.449 3.133
122 H GLY 18 H GLY 18 2.448 11.029 0.233
123 1HA GLY 18 1HA GLY 18 1.057 9.006 -1.400
124 2HA GLY 18 2HA GLY 18 0.478 10.670 -1.374
125 H GLY 19 H GLY 19 0.926 10.155 -3.779
126 1HA GLY 19 1HA GLY 19 2.139 11.204 -5.502
127 2HA GLY 19 2HA GLY 19 3.494 11.405 -4.402
128 H GLU 20 H GLU 20 5.169 10.081 -4.630
129 HA GLU 20 HA GLU 20 5.043 7.966 -6.592
130 1HB GLU 20 2HB GLU 20 7.167 9.415 -5.123
131 2HB GLU 20 1HB GLU 20 7.537 7.755 -5.573
132 1HG GLU 20 2HG GLU 20 7.120 10.143 -7.276
133 2HG GLU 20 1HG GLU 20 8.308 8.847 -7.412
134 H LEU 21 H LEU 21 3.402 6.850 -5.184
135 HA LEU 21 HA LEU 21 4.815 4.950 -3.457
136 1HB LEU 21 2HB LEU 21 3.454 5.237 -1.677
137 2HB LEU 21 1HB LEU 21 3.310 6.846 -2.348
138 HG LEU 21 HG LEU 21 1.320 4.701 -3.028
139 1HD1 LEU 21 1HD1 LEU 21 -0.034 5.915 -1.182
140 2HD1 LEU 21 2HD1 LEU 21 1.117 4.659 -0.724
141 3HD1 LEU 21 3HD1 LEU 21 1.552 6.358 -0.554
142 1HD2 LEU 21 1HD2 LEU 21 0.411 7.429 -2.718
143 2HD2 LEU 21 2HD2 LEU 21 1.709 7.298 -3.904
144 3HD2 LEU 21 3HD2 LEU 21 0.244 6.333 -4.092
145 H LEU 22 H LEU 22 3.506 2.923 -3.121
146 HA LEU 22 HA LEU 22 2.476 2.178 -5.756
147 1HB LEU 22 2HB LEU 22 4.003 0.829 -3.623
148 2HB LEU 22 1HB LEU 22 2.829 -0.171 -4.458
149 HG LEU 22 HG LEU 22 4.215 1.182 -6.484
150 1HD1 LEU 22 1HD1 LEU 22 5.907 0.689 -4.138
151 2HD1 LEU 22 2HD1 LEU 22 6.532 0.051 -5.659
152 3HD1 LEU 22 3HD1 LEU 22 6.151 1.767 -5.513
153 1HD2 LEU 22 1HD2 LEU 22 3.298 -1.111 -6.513
154 2HD2 LEU 22 2HD2 LEU 22 4.962 -1.024 -7.093
155 3HD2 LEU 22 3HD2 LEU 22 4.625 -1.624 -5.470
156 H CYS 23 H CYS 23 0.613 1.004 -6.050
157 HA CYS 23 HA CYS 23 -1.151 0.728 -3.706
158 1HB CYS 23 2HB CYS 23 -2.202 1.211 -6.487
159 2HB CYS 23 1HB CYS 23 -3.044 1.387 -4.950
160 HG CYS 23 HG CYS 23 -2.781 3.934 -4.972
161 H CYS 24 H CYS 24 -2.484 -1.132 -3.701
162 HA CYS 24 HA CYS 24 -1.275 -3.454 -4.622
163 1HB CYS 24 2HB CYS 24 -2.941 -3.203 -2.727
164 2HB CYS 24 1HB CYS 24 -4.209 -3.203 -3.948
165 H ASP 25 H ASP 25 -2.204 -5.108 -6.032
166 HA ASP 25 HA ASP 25 -2.807 -4.012 -8.626
167 1HB ASP 25 2HB ASP 25 -1.348 -6.021 -8.285
168 2HB ASP 25 1HB ASP 25 -2.773 -6.914 -7.766
169 H THR 26 H THR 26 -4.526 -5.714 -6.086
170 HA THR 26 HA THR 26 -6.967 -5.705 -7.709
171 HB THR 26 HB THR 26 -7.870 -7.134 -5.806
172 HG1 THR 26 1HG THR 26 -6.450 -6.764 -4.155
173 1HG2 THR 26 1HG2 THR 26 -6.641 -9.156 -6.548
174 2HG2 THR 26 2HG2 THR 26 -5.493 -8.114 -7.387
175 3HG2 THR 26 3HG2 THR 26 -7.184 -8.147 -7.890
176 H CYS 27 H CYS 27 -5.672 -4.570 -4.631
177 HA CYS 27 HA CYS 27 -8.195 -3.170 -4.123
178 1HB CYS 27 2HB CYS 27 -6.144 -3.342 -2.000
179 2HB CYS 27 1HB CYS 27 -7.887 -3.584 -1.910
180 HA PRO 28 HA PRO 28 -6.182 0.710 -4.503
181 1HB PRO 28 2HB PRO 28 -7.742 2.310 -3.037
182 2HB PRO 28 1HB PRO 28 -8.359 1.474 -4.467
183 1HG PRO 28 2HG PRO 28 -8.766 0.853 -1.584
184 2HG PRO 28 1HG PRO 28 -9.885 0.666 -2.944
185 1HD PRO 28 2HD PRO 28 -8.341 -1.364 -1.784
186 2HD PRO 28 1HD PRO 28 -9.170 -1.447 -3.349
187 H SER 29 H SER 29 -5.751 -0.942 -1.692
188 HA SER 29 HA SER 29 -4.889 0.971 0.160
189 1HB SER 29 2HB SER 29 -3.301 -1.470 0.224
190 2HB SER 29 1HB SER 29 -4.443 -0.841 1.413
191 HG SER 29 HG SER 29 -4.769 -2.918 -0.141
192 H SER 30 H SER 30 -3.275 2.354 0.074
193 HA SER 30 HA SER 30 -1.139 1.881 -1.882
194 1HB SER 30 2HB SER 30 -1.512 4.606 -0.823
195 2HB SER 30 1HB SER 30 -1.302 4.054 -2.487
196 HG SER 30 HG SER 30 -3.642 3.147 -1.695
197 H TYR 31 H TYR 31 0.967 1.957 -1.313
198 HA TYR 31 HA TYR 31 1.707 2.819 1.387
199 1HB TYR 31 2HB TYR 31 2.300 0.074 0.260
200 2HB TYR 31 1HB TYR 31 3.038 0.733 1.714
201 HD1 TYR 31 1HD TYR 31 1.354 1.468 3.606
202 HD2 TYR 31 2HD TYR 31 0.400 -1.210 0.435
203 HE1 TYR 31 1HE TYR 31 -0.487 0.540 4.942
204 HE2 TYR 31 2HE TYR 31 -1.438 -2.140 1.768
205 HH TYR 31 HH TYR 31 -1.710 -1.981 4.858
206 H HIS 32 H HIS 32 4.236 2.179 1.544
207 HA HIS 32 HA HIS 32 5.669 3.541 -0.613
208 1HB HIS 32 2HB HIS 32 6.415 2.419 2.093
209 2HB HIS 32 1HB HIS 32 7.661 2.700 0.900
210 HD2 HIS 32 2HD HIS 32 8.610 5.219 0.757
211 HE1 HIS 32 1HE HIS 32 6.121 6.771 3.810
212 HE2 HIS 32 2HE HIS 32 8.122 7.239 2.308
213 H ILE 33 H ILE 33 7.533 1.174 0.765
214 HA ILE 33 HA ILE 33 6.612 -0.991 -0.975
215 HB ILE 33 HB ILE 33 8.874 -1.628 -1.583
216 1HG1 ILE 33 2HG1 ILE 33 10.204 0.846 -0.775
217 1HG2 ILE 33 1HG2 ILE 33 7.759 0.982 -2.321
218 2HG2 ILE 33 2HG2 ILE 33 9.462 0.760 -2.717
219 3HG2 ILE 33 3HG2 ILE 33 8.257 -0.370 -3.338
220 1HD1 ILE 33 1HD1 ILE 33 11.057 -1.868 0.090
221 2HD1 ILE 33 2HD1 ILE 33 11.169 -1.424 -1.613
222 3HD1 ILE 33 3HD1 ILE 33 12.028 -0.477 -0.397
223 H HIS 34 H HIS 34 6.894 -0.077 2.068
224 HA HIS 34 HA HIS 34 7.488 -2.742 3.077
225 1HB HIS 34 2HB HIS 34 9.239 -1.898 4.620
226 2HB HIS 34 1HB HIS 34 9.702 -1.765 2.928
227 HD2 HIS 34 2HD HIS 34 9.525 0.363 6.041
228 HE1 HIS 34 1HE HIS 34 9.876 3.025 2.771
229 HE2 HIS 34 2HE HIS 34 10.236 2.739 5.265
230 H CYS 35 H CYS 35 5.293 -0.553 3.135
231 HA CYS 35 HA CYS 35 5.123 0.084 5.945
232 1HB CYS 35 2HB CYS 35 2.843 0.506 4.075
233 2HB CYS 35 1HB CYS 35 3.515 1.590 5.296
234 H LEU 36 H LEU 36 4.527 -2.635 4.292
235 HA LEU 36 HA LEU 36 2.193 -3.412 5.902
236 1HB LEU 36 2HB LEU 36 1.812 -5.118 4.085
237 2HB LEU 36 1HB LEU 36 1.539 -3.448 3.631
238 HG LEU 36 HG LEU 36 4.201 -4.680 3.046
239 1HD1 LEU 36 1HD1 LEU 36 3.334 -6.248 1.740
240 2HD1 LEU 36 2HD1 LEU 36 1.695 -5.680 2.057
241 3HD1 LEU 36 3HD1 LEU 36 2.637 -4.972 0.745
242 1HD2 LEU 36 1HD2 LEU 36 2.560 -2.813 1.360
243 2HD2 LEU 36 2HD2 LEU 36 3.562 -2.227 2.689
244 3HD2 LEU 36 3HD2 LEU 36 4.303 -3.083 1.337
245 H ARG 37 H ARG 37 2.181 -6.047 5.784
246 HA ARG 37 HA ARG 37 4.133 -6.861 7.592
247 1HB ARG 37 2HB ARG 37 2.546 -8.691 5.785
248 2HB ARG 37 1HB ARG 37 3.311 -9.122 7.308
249 1HG ARG 37 2HG ARG 37 1.673 -7.038 8.017
250 2HG ARG 37 1HG ARG 37 0.730 -7.890 6.792
251 1HD ARG 37 2HD ARG 37 2.009 -9.734 8.608
252 2HD ARG 37 1HD ARG 37 1.015 -8.570 9.479
253 HE ARG 37 HE ARG 37 -0.236 -9.853 7.191
254 1HH1 ARG 37 2HH1 ARG 37 0.293 -9.862 10.656
255 2HH1 ARG 37 1HH1 ARG 37 -1.136 -10.795 11.010
256 1HH2 ARG 37 2HH2 ARG 37 -2.135 -11.064 7.644
257 2HH2 ARG 37 1HH2 ARG 37 -2.533 -11.457 9.293
258 HA PRO 38 HA PRO 38 6.674 -8.968 4.181
259 1HB PRO 38 2HB PRO 38 5.515 -8.730 1.576
260 2HB PRO 38 1HB PRO 38 5.717 -10.190 2.543
261 1HG PRO 38 2HG PRO 38 3.286 -9.060 1.899
262 2HG PRO 38 1HG PRO 38 3.566 -10.152 3.264
263 1HD PRO 38 2HD PRO 38 3.366 -7.167 3.234
264 2HD PRO 38 1HD PRO 38 2.756 -8.329 4.433
265 H ALA 39 H ALA 39 8.007 -7.203 4.542
266 HA ALA 39 HA ALA 39 7.788 -4.824 2.905
267 1HB ALA 39 1HB ALA 39 10.092 -5.504 4.705
268 2HB ALA 39 2HB ALA 39 9.491 -3.915 4.233
269 3HB ALA 39 3HB ALA 39 8.556 -4.918 5.341
270 H LEU 40 H LEU 40 9.189 -4.201 1.279
271 HA LEU 40 HA LEU 40 10.731 -6.402 0.110
272 1HB LEU 40 2HB LEU 40 9.383 -3.972 -0.975
273 2HB LEU 40 1HB LEU 40 10.764 -4.618 -1.844
274 HG LEU 40 HG LEU 40 9.453 -6.880 -1.695
275 1HD1 LEU 40 1HD1 LEU 40 7.610 -6.483 -0.394
276 2HD1 LEU 40 2HD1 LEU 40 7.408 -4.833 -0.984
277 3HD1 LEU 40 3HD1 LEU 40 6.942 -6.196 -2.001
278 1HD2 LEU 40 1HD2 LEU 40 10.015 -5.689 -3.756
279 2HD2 LEU 40 2HD2 LEU 40 8.394 -6.379 -3.831
280 3HD2 LEU 40 3HD2 LEU 40 8.604 -4.654 -3.542
281 H TYR 41 H TYR 41 12.764 -5.751 -1.060
282 HA TYR 41 HA TYR 41 14.379 -4.131 0.759
283 1HB TYR 41 2HB TYR 41 15.401 -5.606 -1.662
284 2HB TYR 41 1HB TYR 41 16.278 -5.162 -0.202
285 HD1 TYR 41 1HD TYR 41 14.784 -7.813 -1.913
286 HD2 TYR 41 2HD TYR 41 15.276 -6.267 2.021
287 HE1 TYR 41 1HE TYR 41 14.334 -10.046 -0.987
288 HE2 TYR 41 2HE TYR 41 14.833 -8.498 2.957
289 HH TYR 41 HH TYR 41 13.342 -10.803 1.579
290 H GLU 42 H GLU 42 13.377 -4.282 -2.599
291 HA GLU 42 HA GLU 42 14.154 -1.465 -2.912
292 1HB GLU 42 2HB GLU 42 14.967 -3.799 -4.517
293 2HB GLU 42 1HB GLU 42 14.369 -2.437 -5.456
294 1HG GLU 42 2HG GLU 42 16.008 -1.064 -3.966
295 2HG GLU 42 1HG GLU 42 16.779 -2.628 -3.717
296 H VAL 43 H VAL 43 13.038 -0.587 -4.993
297 HA VAL 43 HA VAL 43 10.223 -0.857 -4.727
298 HB VAL 43 HB VAL 43 11.798 0.272 -7.054
299 1HG1 VAL 43 1HG1 VAL 43 9.158 -0.337 -7.053
300 2HG1 VAL 43 2HG1 VAL 43 9.119 1.318 -6.446
301 3HG1 VAL 43 3HG1 VAL 43 9.879 0.965 -7.998
302 1HG2 VAL 43 1HG2 VAL 43 10.516 1.839 -4.835
303 2HG2 VAL 43 2HG2 VAL 43 12.186 1.277 -4.747
304 3HG2 VAL 43 3HG2 VAL 43 11.694 2.384 -6.030
305 HA PRO 44 HA PRO 44 9.734 -4.791 -6.658
306 1HB PRO 44 2HB PRO 44 7.081 -4.327 -7.472
307 2HB PRO 44 1HB PRO 44 7.602 -5.061 -5.954
308 1HG PRO 44 2HG PRO 44 6.783 -2.262 -6.524
309 2HG PRO 44 1HG PRO 44 6.547 -3.231 -5.058
310 1HD PRO 44 2HD PRO 44 8.395 -1.295 -5.166
311 2HD PRO 44 1HD PRO 44 8.694 -2.808 -4.285
312 H ASP 45 H ASP 45 9.908 -5.659 -8.640
313 HA ASP 45 HA ASP 45 9.758 -3.811 -10.930
314 1HB ASP 45 2HB ASP 45 11.953 -4.568 -10.941
315 2HB ASP 45 1HB ASP 45 11.521 -6.147 -10.294
316 H GLY 46 H GLY 46 8.887 -6.997 -9.734
317 1HA GLY 46 1HA GLY 46 7.402 -7.608 -12.164
318 2HA GLY 46 2HA GLY 46 7.635 -8.673 -10.785
319 H GLU 47 H GLU 47 6.159 -8.682 -9.135
320 HA GLU 47 HA GLU 47 3.763 -7.031 -9.597
321 1HB GLU 47 2HB GLU 47 3.994 -9.808 -8.426
322 2HB GLU 47 1HB GLU 47 2.500 -8.887 -8.535
323 1HG GLU 47 2HG GLU 47 2.164 -9.640 -10.580
324 2HG GLU 47 1HG GLU 47 3.698 -8.950 -11.108
325 H TRP 48 H TRP 48 2.408 -6.749 -7.631
326 HA TRP 48 HA TRP 48 3.645 -6.942 -5.066
327 1HB TRP 48 2HB TRP 48 4.715 -4.863 -5.946
328 2HB TRP 48 1HB TRP 48 3.111 -4.155 -6.126
329 HD1 TRP 48 HD TRP 48 5.468 -5.452 -3.353
330 HE1 TRP 48 1HE TRP 48 4.858 -4.255 -1.157
331 HE3 TRP 48 3HE TRP 48 1.398 -2.827 -4.968
332 HZ2 TRP 48 2HZ TRP 48 2.884 -2.450 -0.230
333 HZ3 TRP 48 3HZ TRP 48 0.201 -1.397 -3.365
334 HH2 TRP 48 HH TRP 48 0.933 -1.209 -1.049
335 H GLN 49 H GLN 49 2.133 -7.009 -3.493
336 HA GLN 49 HA GLN 49 -0.590 -6.104 -4.115
337 1HB GLN 49 2HB GLN 49 0.281 -8.873 -3.337
338 2HB GLN 49 1HB GLN 49 -1.322 -8.293 -2.903
339 1HG GLN 49 2HG GLN 49 -0.919 -7.713 -5.641
340 2HG GLN 49 1HG GLN 49 -0.421 -9.381 -5.366
341 1HE2 GLN 49 1HE2 GLN 49 -3.048 -7.137 -4.558
342 2HE2 GLN 49 2HE2 GLN 49 -4.318 -8.308 -4.712
343 H CYS 50 H CYS 50 -1.757 -5.402 -2.368
344 HA CYS 50 HA CYS 50 -0.287 -4.635 -0.040
345 1HB CYS 50 2HB CYS 50 -2.140 -3.350 0.491
346 2HB CYS 50 1HB CYS 50 -2.327 -3.498 -1.250
347 HA PRO 51 HA PRO 51 -1.381 -8.050 2.579
348 1HB PRO 51 2HB PRO 51 -1.381 -6.992 5.023
349 2HB PRO 51 1HB PRO 51 0.085 -6.977 4.034
350 1HG PRO 51 2HG PRO 51 -1.868 -4.774 4.559
351 2HG PRO 51 1HG PRO 51 -0.098 -4.708 4.483
352 1HD PRO 51 2HD PRO 51 -1.811 -4.011 2.413
353 2HD PRO 51 1HD PRO 51 -0.101 -4.446 2.221
354 H ARG 52 H ARG 52 -3.666 -5.823 1.854
355 HA ARG 52 HA ARG 52 -5.579 -6.485 3.924
356 1HB ARG 52 2HB ARG 52 -5.169 -4.319 2.193
357 2HB ARG 52 1HB ARG 52 -6.694 -5.037 1.693
358 1HG ARG 52 2HG ARG 52 -7.454 -4.898 4.063
359 2HG ARG 52 1HG ARG 52 -5.974 -4.005 4.427
360 1HD ARG 52 2HD ARG 52 -7.526 -2.314 4.056
361 2HD ARG 52 1HD ARG 52 -6.705 -2.450 2.503
362 HE ARG 52 HE ARG 52 -9.453 -3.194 3.112
363 1HH1 ARG 52 2HH1 ARG 52 -6.839 -3.068 0.786
364 2HH1 ARG 52 1HH1 ARG 52 -7.836 -3.534 -0.556
365 1HH2 ARG 52 2HH2 ARG 52 -10.783 -3.782 1.333
366 2HH2 ARG 52 1HH2 ARG 52 -10.076 -3.934 -0.254
367 H CYS 53 H CYS 53 -4.726 -7.716 0.844
368 HA CYS 53 HA CYS 53 -7.362 -8.904 0.434
369 1HB CYS 53 2HB CYS 53 -5.952 -9.823 -1.631
370 2HB CYS 53 1HB CYS 53 -6.644 -8.205 -1.618
371 H THR 54 H THR 54 -4.333 -9.606 1.765
372 HA THR 54 HA THR 54 -4.319 -12.416 1.240
373 HB THR 54 HB THR 54 -2.570 -11.637 3.396
374 HG1 THR 54 1HG THR 54 -2.330 -10.097 0.996
375 1HG2 THR 54 1HG2 THR 54 -1.798 -12.178 0.543
376 2HG2 THR 54 2HG2 THR 54 -2.385 -13.469 1.590
377 3HG2 THR 54 3HG2 THR 54 -0.922 -12.583 2.019
378 H CYS 55 H CYS 55 -5.404 -10.380 3.867
379 HA CYS 55 HA CYS 55 -5.559 -12.419 5.828
380 1HB CYS 55 2HB CYS 55 -7.042 -9.793 5.656
381 2HB CYS 55 1HB CYS 55 -6.985 -10.832 7.077
382 HG CYS 55 HG CYS 55 -3.904 -10.407 6.300
383 HA PRO 56 HA PRO 56 -10.172 -12.935 4.584
384 1HB PRO 56 2HB PRO 56 -11.060 -11.846 2.286
385 2HB PRO 56 1HB PRO 56 -11.080 -10.955 3.814
386 1HG PRO 56 2HG PRO 56 -9.118 -10.802 1.557
387 2HG PRO 56 1HG PRO 56 -9.839 -9.487 2.502
388 1HD PRO 56 2HD PRO 56 -7.339 -10.460 2.962
389 2HD PRO 56 1HD PRO 56 -8.357 -9.749 4.231
390 H ALA 57 H ALA 57 -10.891 -14.729 3.452
391 HA ALA 57 HA ALA 57 -8.976 -16.146 1.894
392 1HB ALA 57 1HB ALA 57 -11.841 -16.666 2.637
393 2HB ALA 57 2HB ALA 57 -10.948 -17.745 1.565
394 3HB ALA 57 3HB ALA 57 -10.387 -17.478 3.216
395 H LEU 58 H LEU 58 -9.845 -17.234 -0.237
396 HA LEU 58 HA LEU 58 -10.245 -15.105 -2.121
397 1HB LEU 58 2HB LEU 58 -10.566 -17.322 -3.628
398 2HB LEU 58 1HB LEU 58 -9.012 -16.618 -3.229
399 HG LEU 58 HG LEU 58 -9.713 -18.412 -1.135
400 1HD1 LEU 58 1HD1 LEU 58 -10.879 -20.011 -2.140
401 2HD1 LEU 58 2HD1 LEU 58 -10.703 -19.235 -3.713
402 3HD1 LEU 58 3HD1 LEU 58 -9.456 -20.339 -3.127
403 1HD2 LEU 58 1HD2 LEU 58 -7.554 -17.925 -3.048
404 2HD2 LEU 58 2HD2 LEU 58 -7.484 -18.360 -1.340
405 3HD2 LEU 58 3HD2 LEU 58 -7.712 -19.613 -2.559
406 H LYS 59 H LYS 59 -12.247 -14.526 -0.937
407 HA LYS 59 HA LYS 59 -14.550 -15.006 -2.461
408 1HB LYS 59 2HB LYS 59 -14.413 -17.217 -1.238
409 2HB LYS 59 1HB LYS 59 -14.622 -16.328 0.264
410 1HG LYS 59 2HG LYS 59 -16.687 -15.587 -1.572
411 2HG LYS 59 1HG LYS 59 -16.611 -17.345 -1.439
412 1HD LYS 59 2HD LYS 59 -16.367 -16.551 1.170
413 2HD LYS 59 1HD LYS 59 -17.474 -15.343 0.514
414 1HE LYS 59 2HE LYS 59 -19.121 -16.819 0.725
415 2HE LYS 59 1HE LYS 59 -18.333 -17.807 -0.505
416 1HZ LYS 59 1HZ LYS 59 -16.937 -18.414 1.722
417 2HZ LYS 59 2HZ LYS 59 -18.224 -19.328 1.103
418 3HZ LYS 59 3HZ LYS 59 -18.503 -18.204 2.341
419 H GLY 60 H GLY 60 -13.035 -14.095 0.534
420 1HA GLY 60 1HA GLY 60 -13.405 -11.598 0.946
421 2HA GLY 60 2HA GLY 60 -15.101 -12.061 1.010
422 H LYS 61 H LYS 61 -15.154 -11.263 3.179
423 HA LYS 61 HA LYS 61 -14.486 -13.353 5.069
424 1HB LYS 61 2HB LYS 61 -13.014 -10.843 4.936
425 2HB LYS 61 1HB LYS 61 -13.772 -11.083 6.505
426 1HG LYS 61 2HG LYS 61 -12.406 -13.451 5.466
427 2HG LYS 61 1HG LYS 61 -11.347 -12.070 5.758
428 1HD LYS 61 2HD LYS 61 -11.293 -12.905 7.853
429 2HD LYS 61 1HD LYS 61 -12.815 -12.027 8.017
430 1HE LYS 61 2HE LYS 61 -13.128 -14.249 8.865
431 2HE LYS 61 1HE LYS 61 -14.013 -14.104 7.349
432 1HZ LYS 61 1HZ LYS 61 -12.030 -15.961 8.034
433 2HZ LYS 61 2HZ LYS 61 -11.432 -15.011 6.765
434 3HZ LYS 61 3HZ LYS 61 -12.901 -15.835 6.583
Start of MODEL 18
1 1H GLY 1 1H GLY 1 -7.077 14.693 -12.467
2 2H GLY 1 2H GLY 1 -6.785 13.024 -12.455
3 3H GLY 1 3H GLY 1 -8.272 13.616 -13.004
4 1HA GLY 1 2HA GLY 1 -7.502 14.141 -15.029
5 2HA GLY 1 1HA GLY 1 -5.946 14.649 -14.384
6 HA PRO 2 HA PRO 2 -5.476 10.604 -16.706
7 1HB PRO 2 2HB PRO 2 -2.951 11.964 -17.464
8 2HB PRO 2 1HB PRO 2 -4.101 11.088 -18.480
9 1HG PRO 2 2HG PRO 2 -3.965 13.745 -18.567
10 2HG PRO 2 1HG PRO 2 -5.528 12.909 -18.662
11 1HD PRO 2 2HD PRO 2 -4.266 14.315 -16.337
12 2HD PRO 2 1HD PRO 2 -5.961 14.321 -16.873
13 H LEU 3 H LEU 3 -2.749 12.436 -15.285
14 HA LEU 3 HA LEU 3 -1.558 10.004 -14.284
15 1HB LEU 3 2HB LEU 3 -0.618 12.548 -14.914
16 2HB LEU 3 1HB LEU 3 -0.489 12.461 -13.167
17 HG LEU 3 HG LEU 3 0.621 10.272 -14.897
18 1HD1 LEU 3 1HD1 LEU 3 2.315 12.539 -13.958
19 2HD1 LEU 3 2HD1 LEU 3 2.620 11.366 -15.239
20 3HD1 LEU 3 3HD1 LEU 3 1.446 12.661 -15.488
21 1HD2 LEU 3 1HD2 LEU 3 1.669 11.269 -12.278
22 2HD2 LEU 3 2HD2 LEU 3 0.304 10.154 -12.341
23 3HD2 LEU 3 3HD2 LEU 3 1.860 9.682 -13.023
24 H GLY 4 H GLY 4 -3.001 12.922 -12.848
25 1HA GLY 4 1HA GLY 4 -2.960 11.823 -10.188
26 2HA GLY 4 2HA GLY 4 -3.768 13.300 -10.700
27 H SER 5 H SER 5 -4.118 9.974 -9.976
28 HA SER 5 HA SER 5 -6.912 10.026 -10.904
29 1HB SER 5 2HB SER 5 -6.000 7.399 -10.141
30 2HB SER 5 1HB SER 5 -6.590 7.955 -11.707
31 HG SER 5 HG SER 5 -4.200 8.961 -11.504
32 H ASP 6 H ASP 6 -8.472 10.045 -9.418
33 HA ASP 6 HA ASP 6 -7.874 10.196 -6.651
34 1HB ASP 6 2HB ASP 6 -9.825 11.341 -7.425
35 2HB ASP 6 1HB ASP 6 -10.487 9.870 -8.130
36 H HIS 7 H HIS 7 -7.620 8.654 -5.185
37 HA HIS 7 HA HIS 7 -8.595 5.944 -5.815
38 1HB HIS 7 2HB HIS 7 -5.901 6.801 -5.595
39 2HB HIS 7 1HB HIS 7 -6.249 5.837 -4.163
40 HD2 HIS 7 2HD HIS 7 -8.366 4.087 -6.481
41 HE1 HIS 7 1HE HIS 7 -4.513 2.569 -7.342
42 HE2 HIS 7 2HE HIS 7 -7.005 2.093 -7.429
43 H HIS 8 H HIS 8 -9.313 4.711 -4.087
44 HA HIS 8 HA HIS 8 -10.546 6.028 -1.969
45 1HB HIS 8 2HB HIS 8 -9.810 3.129 -2.369
46 2HB HIS 8 1HB HIS 8 -10.705 3.683 -0.958
47 HD2 HIS 8 2HD HIS 8 -13.290 4.721 -1.526
48 HE1 HIS 8 1HE HIS 8 -13.426 2.937 -5.360
49 HE2 HIS 8 2HE HIS 8 -14.743 4.227 -3.618
50 H MET 9 H MET 9 -7.410 4.480 -2.171
51 HA MET 9 HA MET 9 -6.706 5.736 0.386
52 1HB MET 9 2HB MET 9 -6.517 2.902 -0.333
53 2HB MET 9 1HB MET 9 -4.990 3.574 0.218
54 1HG MET 9 2HG MET 9 -5.742 3.920 2.336
55 2HG MET 9 1HG MET 9 -7.416 4.133 1.825
56 1HE MET 9 1HE MET 9 -7.989 2.052 0.029
57 2HE MET 9 2HE MET 9 -7.992 0.384 0.600
58 3HE MET 9 3HE MET 9 -9.096 1.561 1.311
59 H GLU 10 H GLU 10 -6.101 7.395 -1.243
60 HA GLU 10 HA GLU 10 -3.940 6.841 -3.041
61 1HB GLU 10 2HB GLU 10 -3.936 9.328 -3.378
62 2HB GLU 10 1HB GLU 10 -5.488 8.555 -3.671
63 1HG GLU 10 2HG GLU 10 -6.349 10.123 -2.363
64 2HG GLU 10 1HG GLU 10 -5.641 9.230 -1.020
65 H PHE 11 H PHE 11 -3.875 6.882 0.140
66 HA PHE 11 HA PHE 11 -1.136 7.887 0.251
67 1HB PHE 11 2HB PHE 11 -1.514 9.109 2.262
68 2HB PHE 11 1HB PHE 11 -2.778 9.600 1.145
69 HD1 PHE 11 1HD PHE 11 -2.150 8.784 4.428
70 HD2 PHE 11 2HD PHE 11 -4.975 8.012 1.339
71 HE1 PHE 11 1HE PHE 11 -3.846 8.212 6.122
72 HE2 PHE 11 2HE PHE 11 -6.669 7.440 3.026
73 HZ PHE 11 HZ PHE 11 -6.105 7.534 5.420
74 H CYS 12 H CYS 12 0.036 7.052 2.150
75 HA CYS 12 HA CYS 12 -0.294 4.263 2.426
76 1HB CYS 12 2HB CYS 12 1.418 6.319 3.763
77 2HB CYS 12 1HB CYS 12 1.326 4.700 4.447
78 HG CYS 12 HG CYS 12 3.409 5.671 2.323
79 H ARG 13 H ARG 13 -1.434 3.081 3.804
80 HA ARG 13 HA ARG 13 -3.397 4.194 5.454
81 1HB ARG 13 2HB ARG 13 -2.310 1.495 4.986
82 2HB ARG 13 1HB ARG 13 -3.105 1.720 6.539
83 1HG ARG 13 2HG ARG 13 -5.091 2.597 5.324
84 2HG ARG 13 1HG ARG 13 -4.288 2.176 3.810
85 1HD ARG 13 2HD ARG 13 -5.436 0.253 4.076
86 2HD ARG 13 1HD ARG 13 -4.055 -0.164 5.091
87 HE ARG 13 HE ARG 13 -5.375 0.129 6.997
88 1HH1 ARG 13 2HH1 ARG 13 -7.174 0.840 4.075
89 2HH1 ARG 13 1HH1 ARG 13 -8.720 0.750 4.855
90 1HH2 ARG 13 2HH2 ARG 13 -7.388 0.044 8.033
91 2HH2 ARG 13 1HH2 ARG 13 -8.844 0.316 7.123
92 H VAL 14 H VAL 14 -0.071 3.387 6.185
93 HA VAL 14 HA VAL 14 -0.527 3.938 9.041
94 HB VAL 14 HB VAL 14 2.161 3.114 8.096
95 1HG1 VAL 14 1HG1 VAL 14 0.418 2.588 10.473
96 2HG1 VAL 14 2HG1 VAL 14 1.860 1.621 10.162
97 3HG1 VAL 14 3HG1 VAL 14 2.000 3.362 10.403
98 1HG2 VAL 14 1HG2 VAL 14 1.053 1.574 6.744
99 2HG2 VAL 14 2HG2 VAL 14 1.355 0.676 8.234
100 3HG2 VAL 14 3HG2 VAL 14 -0.248 1.339 7.913
101 H CYS 15 H CYS 15 2.119 4.509 6.770
102 HA CYS 15 HA CYS 15 3.036 6.826 8.118
103 1HB CYS 15 2HB CYS 15 4.382 6.540 5.698
104 2HB CYS 15 1HB CYS 15 4.857 5.881 7.267
105 H LYS 16 H LYS 16 0.457 6.653 6.258
106 HA LYS 16 HA LYS 16 -0.845 8.160 5.137
107 1HB LYS 16 2HB LYS 16 0.583 9.614 7.309
108 2HB LYS 16 1HB LYS 16 -0.507 10.507 6.257
109 1HG LYS 16 2HG LYS 16 -1.974 8.282 6.953
110 2HG LYS 16 1HG LYS 16 -1.095 8.677 8.433
111 1HD LYS 16 2HD LYS 16 -2.276 10.975 7.031
112 2HD LYS 16 1HD LYS 16 -3.440 9.814 7.675
113 1HE LYS 16 2HE LYS 16 -3.159 10.657 9.702
114 2HE LYS 16 1HE LYS 16 -1.450 10.224 9.646
115 1HZ LYS 16 1HZ LYS 16 -2.142 12.669 10.009
116 2HZ LYS 16 2HZ LYS 16 -2.383 12.688 8.329
117 3HZ LYS 16 3HZ LYS 16 -0.852 12.319 8.962
118 H ASP 17 H ASP 17 2.052 8.000 3.972
119 HA ASP 17 HA ASP 17 2.319 10.649 2.838
120 1HB ASP 17 2HB ASP 17 4.182 9.583 1.516
121 2HB ASP 17 1HB ASP 17 4.375 9.480 3.263
122 H GLY 18 H GLY 18 2.259 11.067 0.545
123 1HA GLY 18 1HA GLY 18 0.565 9.171 -0.953
124 2HA GLY 18 2HA GLY 18 0.114 10.870 -0.841
125 H GLY 19 H GLY 19 0.196 10.660 -3.227
126 1HA GLY 19 1HA GLY 19 1.314 11.691 -5.017
127 2HA GLY 19 2HA GLY 19 2.833 11.502 -4.153
128 H GLU 20 H GLU 20 4.165 9.990 -4.845
129 HA GLU 20 HA GLU 20 3.151 7.979 -6.728
130 1HB GLU 20 2HB GLU 20 5.873 9.124 -6.173
131 2HB GLU 20 1HB GLU 20 5.706 7.584 -7.005
132 1HG GLU 20 2HG GLU 20 5.628 8.794 -8.865
133 2HG GLU 20 1HG GLU 20 3.973 9.176 -8.390
134 H LEU 21 H LEU 21 2.430 6.241 -5.630
135 HA LEU 21 HA LEU 21 4.174 5.188 -3.494
136 1HB LEU 21 2HB LEU 21 1.177 4.918 -3.691
137 2HB LEU 21 1HB LEU 21 2.193 4.351 -2.381
138 HG LEU 21 HG LEU 21 2.715 7.091 -2.555
139 1HD1 LEU 21 1HD1 LEU 21 0.459 6.885 -3.936
140 2HD1 LEU 21 2HD1 LEU 21 -0.231 6.866 -2.314
141 3HD1 LEU 21 3HD1 LEU 21 0.763 8.227 -2.832
142 1HD2 LEU 21 1HD2 LEU 21 2.698 6.381 -0.419
143 2HD2 LEU 21 2HD2 LEU 21 1.004 6.870 -0.473
144 3HD2 LEU 21 3HD2 LEU 21 1.443 5.181 -0.719
145 H LEU 22 H LEU 22 3.566 2.841 -3.018
146 HA LEU 22 HA LEU 22 3.366 1.352 -5.549
147 1HB LEU 22 2HB LEU 22 5.403 0.871 -4.308
148 2HB LEU 22 1HB LEU 22 4.475 0.550 -2.856
149 HG LEU 22 HG LEU 22 3.377 -1.339 -4.255
150 1HD1 LEU 22 1HD1 LEU 22 4.370 -2.053 -6.166
151 2HD1 LEU 22 2HD1 LEU 22 4.736 -0.333 -6.305
152 3HD1 LEU 22 3HD1 LEU 22 5.961 -1.450 -5.702
153 1HD2 LEU 22 1HD2 LEU 22 6.183 -1.382 -3.172
154 2HD2 LEU 22 2HD2 LEU 22 4.692 -1.868 -2.365
155 3HD2 LEU 22 3HD2 LEU 22 5.332 -2.837 -3.692
156 H CYS 23 H CYS 23 1.267 0.999 -5.872
157 HA CYS 23 HA CYS 23 -0.449 0.476 -3.566
158 1HB CYS 23 2HB CYS 23 -1.983 0.787 -5.929
159 2HB CYS 23 1HB CYS 23 -1.802 1.924 -4.597
160 HG CYS 23 HG CYS 23 0.114 1.804 -7.433
161 H CYS 24 H CYS 24 -2.277 -1.050 -3.871
162 HA CYS 24 HA CYS 24 -1.352 -3.607 -4.704
163 1HB CYS 24 2HB CYS 24 -2.992 -3.187 -2.841
164 2HB CYS 24 1HB CYS 24 -4.196 -2.784 -4.058
165 H ASP 25 H ASP 25 -3.224 -4.902 -5.987
166 HA ASP 25 HA ASP 25 -3.525 -3.497 -8.564
167 1HB ASP 25 2HB ASP 25 -2.095 -5.620 -8.479
168 2HB ASP 25 1HB ASP 25 -3.595 -6.492 -8.201
169 H THR 26 H THR 26 -5.065 -5.652 -6.238
170 HA THR 26 HA THR 26 -7.599 -5.460 -7.650
171 HB THR 26 HB THR 26 -8.329 -6.961 -5.661
172 HG1 THR 26 1HG THR 26 -6.666 -6.843 -4.245
173 1HG2 THR 26 1HG2 THR 26 -6.325 -7.824 -7.745
174 2HG2 THR 26 2HG2 THR 26 -8.087 -7.862 -7.869
175 3HG2 THR 26 3HG2 THR 26 -7.257 -8.948 -6.752
176 H CYS 27 H CYS 27 -6.017 -4.153 -4.858
177 HA CYS 27 HA CYS 27 -8.507 -2.757 -4.142
178 1HB CYS 27 2HB CYS 27 -6.367 -2.998 -2.110
179 2HB CYS 27 1HB CYS 27 -8.115 -3.118 -1.926
180 HA PRO 28 HA PRO 28 -6.317 0.953 -4.934
181 1HB PRO 28 2HB PRO 28 -7.993 2.504 -3.188
182 2HB PRO 28 1HB PRO 28 -8.134 2.294 -4.934
183 1HG PRO 28 2HG PRO 28 -9.947 1.332 -3.111
184 2HG PRO 28 1HG PRO 28 -9.709 0.660 -4.732
185 1HD PRO 28 2HD PRO 28 -8.656 -0.311 -2.102
186 2HD PRO 28 1HD PRO 28 -9.291 -1.242 -3.477
187 H SER 29 H SER 29 -5.420 -0.582 -2.459
188 HA SER 29 HA SER 29 -4.759 1.422 -0.513
189 1HB SER 29 2HB SER 29 -3.173 -0.937 -0.212
190 2HB SER 29 1HB SER 29 -4.557 -0.418 0.755
191 HG SER 29 HG SER 29 -4.462 -2.515 -0.773
192 H SER 30 H SER 30 -2.954 2.653 -0.425
193 HA SER 30 HA SER 30 -0.755 1.968 -2.245
194 1HB SER 30 2HB SER 30 -1.476 4.767 -1.374
195 2HB SER 30 1HB SER 30 -0.343 4.294 -2.640
196 HG SER 30 HG SER 30 -3.167 4.164 -2.635
197 H TYR 31 H TYR 31 1.304 2.015 -1.519
198 HA TYR 31 HA TYR 31 1.794 2.895 1.237
199 1HB TYR 31 2HB TYR 31 2.442 0.154 0.128
200 2HB TYR 31 1HB TYR 31 3.039 0.768 1.663
201 HD1 TYR 31 1HD TYR 31 1.385 1.243 3.516
202 HD2 TYR 31 2HD TYR 31 0.295 -0.808 -0.055
203 HE1 TYR 31 1HE TYR 31 -0.621 0.370 4.632
204 HE2 TYR 31 2HE TYR 31 -1.711 -1.686 1.060
205 HH TYR 31 HH TYR 31 -2.149 -1.731 4.308
206 H HIS 32 H HIS 32 4.297 2.162 1.611
207 HA HIS 32 HA HIS 32 5.953 3.544 -0.380
208 1HB HIS 32 2HB HIS 32 6.428 2.394 2.381
209 2HB HIS 32 1HB HIS 32 7.777 2.720 1.318
210 HD2 HIS 32 2HD HIS 32 8.684 5.257 1.287
211 HE1 HIS 32 1HE HIS 32 5.925 6.694 4.166
212 HE2 HIS 32 2HE HIS 32 8.188 7.083 3.067
213 H ILE 33 H ILE 33 7.836 1.306 1.001
214 HA ILE 33 HA ILE 33 6.941 -1.004 -0.542
215 HB ILE 33 HB ILE 33 9.272 -1.583 -1.124
216 1HG1 ILE 33 2HG1 ILE 33 10.201 1.197 -0.651
217 1HG2 ILE 33 1HG2 ILE 33 8.090 -0.611 -2.884
218 2HG2 ILE 33 2HG2 ILE 33 8.095 0.983 -2.125
219 3HG2 ILE 33 3HG2 ILE 33 9.583 0.327 -2.812
220 1HD1 ILE 33 1HD1 ILE 33 11.403 -1.210 -1.357
221 2HD1 ILE 33 2HD1 ILE 33 12.203 0.311 -0.961
222 3HD1 ILE 33 3HD1 ILE 33 11.925 -0.893 0.297
223 H HIS 34 H HIS 34 7.185 0.117 2.368
224 HA HIS 34 HA HIS 34 8.098 -2.368 3.589
225 1HB HIS 34 2HB HIS 34 9.674 -1.140 5.080
226 2HB HIS 34 1HB HIS 34 10.158 -1.115 3.387
227 HD2 HIS 34 2HD HIS 34 9.155 1.296 6.223
228 HE1 HIS 34 1HE HIS 34 9.906 3.585 2.746
229 HE2 HIS 34 2HE HIS 34 9.618 3.664 5.260
230 H CYS 35 H CYS 35 5.649 -0.380 3.470
231 HA CYS 35 HA CYS 35 5.348 0.471 6.181
232 1HB CYS 35 2HB CYS 35 3.004 0.210 4.361
233 2HB CYS 35 1HB CYS 35 3.465 1.546 5.419
234 H LEU 36 H LEU 36 4.567 -2.343 4.376
235 HA LEU 36 HA LEU 36 2.713 -3.350 6.392
236 1HB LEU 36 2HB LEU 36 2.822 -5.341 4.611
237 2HB LEU 36 1HB LEU 36 1.769 -3.952 4.426
238 HG LEU 36 HG LEU 36 4.440 -3.588 3.258
239 1HD1 LEU 36 1HD1 LEU 36 4.188 -5.936 2.749
240 2HD1 LEU 36 2HD1 LEU 36 2.554 -5.660 2.145
241 3HD1 LEU 36 3HD1 LEU 36 3.939 -4.981 1.287
242 1HD2 LEU 36 1HD2 LEU 36 2.579 -2.012 2.986
243 2HD2 LEU 36 2HD2 LEU 36 3.136 -2.655 1.441
244 3HD2 LEU 36 3HD2 LEU 36 1.648 -3.266 2.166
245 H ARG 37 H ARG 37 3.012 -5.890 6.634
246 HA ARG 37 HA ARG 37 5.343 -6.264 8.173
247 1HB ARG 37 2HB ARG 37 3.127 -7.447 8.451
248 2HB ARG 37 1HB ARG 37 3.576 -8.451 7.080
249 1HG ARG 37 2HG ARG 37 5.196 -9.567 8.250
250 2HG ARG 37 1HG ARG 37 5.442 -8.239 9.388
251 1HD ARG 37 2HD ARG 37 2.945 -8.795 10.031
252 2HD ARG 37 1HD ARG 37 3.372 -10.374 9.371
253 HE ARG 37 HE ARG 37 5.413 -9.758 11.090
254 1HH1 ARG 37 2HH1 ARG 37 1.940 -10.020 11.349
255 2HH1 ARG 37 1HH1 ARG 37 1.960 -10.567 13.000
256 1HH2 ARG 37 2HH2 ARG 37 5.467 -10.466 13.269
257 2HH2 ARG 37 1HH2 ARG 37 3.973 -10.830 14.092
258 HA PRO 38 HA PRO 38 7.108 -8.918 4.582
259 1HB PRO 38 2HB PRO 38 5.457 -8.540 2.221
260 2HB PRO 38 1HB PRO 38 5.870 -10.042 3.048
261 1HG PRO 38 2HG PRO 38 3.360 -9.002 3.026
262 2HG PRO 38 1HG PRO 38 3.989 -9.994 4.356
263 1HD PRO 38 2HD PRO 38 3.730 -7.013 4.170
264 2HD PRO 38 1HD PRO 38 3.380 -8.091 5.538
265 H ALA 39 H ALA 39 8.096 -6.676 5.089
266 HA ALA 39 HA ALA 39 7.959 -4.608 3.161
267 1HB ALA 39 1HB ALA 39 9.393 -5.143 5.619
268 2HB ALA 39 2HB ALA 39 10.407 -4.328 4.428
269 3HB ALA 39 3HB ALA 39 8.876 -3.606 4.925
270 H LEU 40 H LEU 40 9.348 -4.048 1.508
271 HA LEU 40 HA LEU 40 11.039 -6.248 0.530
272 1HB LEU 40 2HB LEU 40 9.891 -3.963 -1.074
273 2HB LEU 40 1HB LEU 40 10.659 -5.413 -1.692
274 HG LEU 40 HG LEU 40 8.452 -6.240 -0.107
275 1HD1 LEU 40 1HD1 LEU 40 6.668 -4.983 -0.689
276 2HD1 LEU 40 2HD1 LEU 40 7.887 -3.714 -0.811
277 3HD1 LEU 40 3HD1 LEU 40 7.340 -4.555 -2.262
278 1HD2 LEU 40 1HD2 LEU 40 9.208 -6.302 -3.000
279 2HD2 LEU 40 2HD2 LEU 40 9.107 -7.626 -1.841
280 3HD2 LEU 40 3HD2 LEU 40 7.632 -6.895 -2.475
281 H TYR 41 H TYR 41 12.938 -5.523 -0.790
282 HA TYR 41 HA TYR 41 14.317 -3.376 0.639
283 1HB TYR 41 2HB TYR 41 15.374 -5.445 -1.299
284 2HB TYR 41 1HB TYR 41 16.354 -4.262 -0.441
285 HD1 TYR 41 1HD TYR 41 15.819 -4.298 2.237
286 HD2 TYR 41 2HD TYR 41 15.424 -7.574 -0.448
287 HE1 TYR 41 1HE TYR 41 16.065 -5.865 4.121
288 HE2 TYR 41 2HE TYR 41 15.655 -9.147 1.427
289 HH TYR 41 HH TYR 41 16.791 -8.248 4.469
290 H GLU 42 H GLU 42 12.844 -4.092 -2.360
291 HA GLU 42 HA GLU 42 13.527 -1.427 -3.336
292 1HB GLU 42 2HB GLU 42 14.473 -3.916 -4.516
293 2HB GLU 42 1HB GLU 42 13.506 -2.985 -5.651
294 1HG GLU 42 2HG GLU 42 15.654 -1.620 -4.107
295 2HG GLU 42 1HG GLU 42 16.083 -2.629 -5.486
296 H VAL 43 H VAL 43 12.154 -1.000 -5.392
297 HA VAL 43 HA VAL 43 9.404 -1.589 -4.715
298 HB VAL 43 HB VAL 43 10.359 -0.186 -7.212
299 1HG1 VAL 43 1HG1 VAL 43 8.206 0.190 -7.606
300 2HG1 VAL 43 2HG1 VAL 43 7.824 -0.895 -6.268
301 3HG1 VAL 43 3HG1 VAL 43 7.969 0.839 -5.983
302 1HG2 VAL 43 1HG2 VAL 43 10.586 0.679 -4.448
303 2HG2 VAL 43 2HG2 VAL 43 11.263 1.388 -5.914
304 3HG2 VAL 43 3HG2 VAL 43 9.616 1.785 -5.421
305 HA PRO 44 HA PRO 44 9.380 -5.396 -7.066
306 1HB PRO 44 2HB PRO 44 6.612 -5.575 -7.119
307 2HB PRO 44 1HB PRO 44 7.652 -6.194 -5.833
308 1HG PRO 44 2HG PRO 44 6.116 -3.640 -5.960
309 2HG PRO 44 1HG PRO 44 6.375 -4.729 -4.584
310 1HD PRO 44 2HD PRO 44 7.733 -2.437 -4.822
311 2HD PRO 44 1HD PRO 44 8.504 -3.900 -4.175
312 H ASP 45 H ASP 45 9.022 -5.984 -9.168
313 HA ASP 45 HA ASP 45 8.539 -3.791 -10.981
314 1HB ASP 45 2HB ASP 45 10.374 -5.471 -11.302
315 2HB ASP 45 1HB ASP 45 9.137 -6.672 -11.663
316 H GLY 46 H GLY 46 6.297 -3.443 -10.554
317 1HA GLY 46 1HA GLY 46 4.151 -3.505 -11.386
318 2HA GLY 46 2HA GLY 46 4.635 -4.834 -12.423
319 H GLU 47 H GLU 47 5.118 -6.915 -11.051
320 HA GLU 47 HA GLU 47 2.618 -7.721 -10.032
321 1HB GLU 47 2HB GLU 47 5.323 -9.056 -9.965
322 2HB GLU 47 1HB GLU 47 3.849 -9.834 -9.405
323 1HG GLU 47 2HG GLU 47 4.543 -8.969 -12.197
324 2HG GLU 47 1HG GLU 47 4.238 -10.599 -11.603
325 H TRP 48 H TRP 48 1.798 -7.080 -8.198
326 HA TRP 48 HA TRP 48 2.899 -7.735 -5.697
327 1HB TRP 48 2HB TRP 48 4.350 -5.743 -6.267
328 2HB TRP 48 1HB TRP 48 2.891 -4.757 -6.239
329 HD1 TRP 48 HD TRP 48 5.080 -6.882 -3.877
330 HE1 TRP 48 1HE TRP 48 4.731 -6.027 -1.475
331 HE3 TRP 48 3HE TRP 48 1.366 -3.480 -4.753
332 HZ2 TRP 48 2HZ TRP 48 3.101 -4.156 -0.129
333 HZ3 TRP 48 3HZ TRP 48 0.466 -2.195 -2.855
334 HH2 TRP 48 HH TRP 48 1.318 -2.529 -0.588
335 H GLN 49 H GLN 49 1.387 -7.480 -4.045
336 HA GLN 49 HA GLN 49 -1.063 -6.003 -4.617
337 1HB GLN 49 2HB GLN 49 -0.853 -8.914 -4.546
338 2HB GLN 49 1HB GLN 49 -2.025 -8.295 -3.391
339 1HG GLN 49 2HG GLN 49 -3.302 -7.269 -5.081
340 2HG GLN 49 1HG GLN 49 -2.018 -7.465 -6.273
341 1HE2 GLN 49 1HE2 GLN 49 -4.947 -8.522 -5.539
342 2HE2 GLN 49 2HE2 GLN 49 -4.860 -10.145 -6.148
343 H CYS 50 H CYS 50 -2.146 -5.299 -2.769
344 HA CYS 50 HA CYS 50 -0.479 -4.839 -0.550
345 1HB CYS 50 2HB CYS 50 -2.153 -3.441 0.250
346 2HB CYS 50 1HB CYS 50 -2.459 -3.439 -1.480
347 HA PRO 51 HA PRO 51 -1.291 -8.294 2.011
348 1HB PRO 51 2HB PRO 51 -0.811 -7.328 4.465
349 2HB PRO 51 1HB PRO 51 0.467 -7.440 3.247
350 1HG PRO 51 2HG PRO 51 -1.165 -5.061 4.067
351 2HG PRO 51 1HG PRO 51 0.583 -5.172 3.791
352 1HD PRO 51 2HD PRO 51 -1.161 -4.197 1.940
353 2HD PRO 51 1HD PRO 51 0.360 -5.007 1.513
354 H ARG 52 H ARG 52 -3.689 -6.387 1.495
355 HA ARG 52 HA ARG 52 -5.220 -7.083 3.913
356 1HB ARG 52 2HB ARG 52 -5.914 -4.992 1.853
357 2HB ARG 52 1HB ARG 52 -6.696 -5.253 3.406
358 1HG ARG 52 2HG ARG 52 -4.807 -4.472 4.595
359 2HG ARG 52 1HG ARG 52 -3.800 -4.499 3.148
360 1HD ARG 52 2HD ARG 52 -5.841 -2.529 4.017
361 2HD ARG 52 1HD ARG 52 -4.279 -2.272 3.242
362 HE ARG 52 HE ARG 52 -5.334 -2.987 1.142
363 1HH1 ARG 52 2HH1 ARG 52 -7.421 -2.067 3.801
364 2HH1 ARG 52 1HH1 ARG 52 -8.730 -1.562 2.771
365 1HH2 ARG 52 2HH2 ARG 52 -7.046 -2.319 -0.221
366 2HH2 ARG 52 1HH2 ARG 52 -8.529 -1.726 0.474
367 H CYS 53 H CYS 53 -4.990 -7.656 0.516
368 HA CYS 53 HA CYS 53 -7.690 -8.699 0.299
369 1HB CYS 53 2HB CYS 53 -6.505 -9.516 -1.962
370 2HB CYS 53 1HB CYS 53 -7.110 -7.875 -1.756
371 H THR 54 H THR 54 -4.457 -9.714 0.909
372 HA THR 54 HA THR 54 -4.706 -12.477 0.428
373 HB THR 54 HB THR 54 -2.854 -12.041 2.534
374 HG1 THR 54 1HG THR 54 -2.419 -10.161 0.450
375 1HG2 THR 54 1HG2 THR 54 -1.913 -11.998 -0.268
376 2HG2 THR 54 2HG2 THR 54 -2.907 -13.378 0.197
377 3HG2 THR 54 3HG2 THR 54 -1.418 -13.029 1.075
378 H CYS 55 H CYS 55 -5.655 -14.018 1.557
379 HA CYS 55 HA CYS 55 -6.414 -13.470 4.354
380 1HB CYS 55 2HB CYS 55 -7.821 -15.663 2.975
381 2HB CYS 55 1HB CYS 55 -8.457 -14.407 4.034
382 HG CYS 55 HG CYS 55 -7.801 -12.657 1.531
383 HA PRO 56 HA PRO 56 -3.066 -16.540 4.395
384 1HB PRO 56 2HB PRO 56 -2.483 -16.177 7.056
385 2HB PRO 56 1HB PRO 56 -1.816 -15.194 5.749
386 1HG PRO 56 2HG PRO 56 -4.117 -14.618 7.570
387 2HG PRO 56 1HG PRO 56 -2.830 -13.532 7.009
388 1HD PRO 56 2HD PRO 56 -5.284 -13.476 5.929
389 2HD PRO 56 1HD PRO 56 -3.828 -13.211 4.946
390 H ALA 57 H ALA 57 -2.872 -18.603 5.184
391 HA ALA 57 HA ALA 57 -5.265 -19.800 6.268
392 1HB ALA 57 1HB ALA 57 -3.813 -20.868 4.520
393 2HB ALA 57 2HB ALA 57 -2.592 -21.107 5.769
394 3HB ALA 57 3HB ALA 57 -4.166 -21.892 5.911
395 H LEU 58 H LEU 58 -4.394 -21.739 7.959
396 HA LEU 58 HA LEU 58 -3.771 -20.225 10.341
397 1HB LEU 58 2HB LEU 58 -5.180 -22.572 9.792
398 2HB LEU 58 1HB LEU 58 -3.770 -23.098 10.692
399 HG LEU 58 HG LEU 58 -4.553 -21.032 12.239
400 1HD1 LEU 58 1HD1 LEU 58 -6.690 -20.443 12.039
401 2HD1 LEU 58 2HD1 LEU 58 -6.670 -21.253 10.474
402 3HD1 LEU 58 3HD1 LEU 58 -7.219 -22.120 11.908
403 1HD2 LEU 58 1HD2 LEU 58 -4.657 -22.681 13.717
404 2HD2 LEU 58 2HD2 LEU 58 -6.099 -23.348 12.952
405 3HD2 LEU 58 3HD2 LEU 58 -4.499 -23.821 12.380
406 H LYS 59 H LYS 59 -1.687 -19.531 9.984
407 HA LYS 59 HA LYS 59 0.560 -19.542 10.200
408 1HB LYS 59 2HB LYS 59 -0.219 -21.905 11.622
409 2HB LYS 59 1HB LYS 59 1.275 -22.222 10.753
410 1HG LYS 59 2HG LYS 59 1.722 -21.432 13.000
411 2HG LYS 59 1HG LYS 59 2.305 -20.275 11.802
412 1HD LYS 59 2HD LYS 59 0.946 -18.667 12.555
413 2HD LYS 59 1HD LYS 59 -0.440 -19.760 12.606
414 1HE LYS 59 2HE LYS 59 -0.086 -19.065 14.831
415 2HE LYS 59 1HE LYS 59 0.555 -20.704 14.733
416 1HZ LYS 59 1HZ LYS 59 2.136 -19.436 15.901
417 2HZ LYS 59 2HZ LYS 59 2.073 -18.160 14.783
418 3HZ LYS 59 3HZ LYS 59 2.780 -19.636 14.344
419 H GLY 60 H GLY 60 0.028 -22.863 9.033
420 1HA GLY 60 1HA GLY 60 1.012 -22.059 6.408
421 2HA GLY 60 2HA GLY 60 1.939 -23.282 7.265
422 H LYS 61 H LYS 61 -0.090 -23.033 4.862
423 HA LYS 61 HA LYS 61 -0.991 -25.735 5.031
424 1HB LYS 61 2HB LYS 61 -2.704 -24.465 6.401
425 2HB LYS 61 1HB LYS 61 -3.139 -23.612 4.928
426 1HG LYS 61 2HG LYS 61 -4.305 -25.345 4.118
427 2HG LYS 61 1HG LYS 61 -3.133 -26.532 4.691
428 1HD LYS 61 2HD LYS 61 -4.407 -27.008 6.451
429 2HD LYS 61 1HD LYS 61 -4.445 -25.309 6.927
430 1HE LYS 61 2HE LYS 61 -6.205 -25.146 4.981
431 2HE LYS 61 1HE LYS 61 -6.382 -26.873 5.291
432 1HZ LYS 61 1HZ LYS 61 -7.805 -25.094 6.563
433 2HZ LYS 61 2HZ LYS 61 -6.449 -25.057 7.583
434 3HZ LYS 61 3HZ LYS 61 -7.281 -26.513 7.328
Start of MODEL 19
1 1H GLY 1 1H GLY 1 -15.573 0.237 -8.198
2 2H GLY 1 2H GLY 1 -16.761 0.663 -9.329
3 3H GLY 1 3H GLY 1 -15.652 -0.566 -9.691
4 1HA GLY 1 2HA GLY 1 -18.100 -1.057 -8.824
5 2HA GLY 1 1HA GLY 1 -16.736 -2.120 -8.506
6 HA PRO 2 HA PRO 2 -18.626 -0.963 -4.415
7 1HB PRO 2 2HB PRO 2 -18.401 -3.471 -3.348
8 2HB PRO 2 1HB PRO 2 -19.813 -2.909 -4.247
9 1HG PRO 2 2HG PRO 2 -17.531 -4.605 -5.161
10 2HG PRO 2 1HG PRO 2 -19.258 -4.748 -5.538
11 1HD PRO 2 2HD PRO 2 -17.468 -3.666 -7.260
12 2HD PRO 2 1HD PRO 2 -19.163 -3.146 -7.183
13 H LEU 3 H LEU 3 -15.948 -3.215 -5.009
14 HA LEU 3 HA LEU 3 -13.816 -3.314 -4.298
15 1HB LEU 3 2HB LEU 3 -14.139 -0.709 -4.606
16 2HB LEU 3 1HB LEU 3 -13.971 -0.709 -2.862
17 HG LEU 3 HG LEU 3 -11.881 -0.307 -4.316
18 1HD1 LEU 3 1HD1 LEU 3 -12.266 -1.749 -1.834
19 2HD1 LEU 3 2HD1 LEU 3 -10.757 -2.186 -2.635
20 3HD1 LEU 3 3HD1 LEU 3 -11.094 -0.498 -2.248
21 1HD2 LEU 3 1HD2 LEU 3 -11.622 -3.275 -4.340
22 2HD2 LEU 3 2HD2 LEU 3 -12.503 -2.480 -5.645
23 3HD2 LEU 3 3HD2 LEU 3 -10.817 -2.065 -5.336
24 H GLY 4 H GLY 4 -15.637 -1.675 -1.704
25 1HA GLY 4 1HA GLY 4 -16.119 -2.670 0.417
26 2HA GLY 4 2HA GLY 4 -14.826 -3.833 0.127
27 H SER 5 H SER 5 -15.647 -0.666 1.205
28 HA SER 5 HA SER 5 -14.518 0.962 2.320
29 1HB SER 5 2HB SER 5 -12.145 -0.900 2.563
30 2HB SER 5 1HB SER 5 -12.547 0.480 3.583
31 HG SER 5 HG SER 5 -14.594 -0.873 3.944
32 H ASP 6 H ASP 6 -14.695 1.216 -0.242
33 HA ASP 6 HA ASP 6 -12.284 1.233 -1.718
34 1HB ASP 6 2HB ASP 6 -14.346 1.054 -2.916
35 2HB ASP 6 1HB ASP 6 -14.967 2.535 -2.193
36 H HIS 7 H HIS 7 -10.693 2.396 -0.779
37 HA HIS 7 HA HIS 7 -11.188 5.274 -0.447
38 1HB HIS 7 2HB HIS 7 -10.268 3.368 1.450
39 2HB HIS 7 1HB HIS 7 -8.929 4.452 1.089
40 HD2 HIS 7 2HD HIS 7 -10.283 7.291 0.987
41 HE1 HIS 7 1HE HIS 7 -12.121 6.240 4.648
42 HE2 HIS 7 2HE HIS 7 -11.300 8.157 3.208
43 H HIS 8 H HIS 8 -10.373 6.171 -2.210
44 HA HIS 8 HA HIS 8 -8.032 5.245 -3.561
45 1HB HIS 8 2HB HIS 8 -9.723 6.473 -4.797
46 2HB HIS 8 1HB HIS 8 -9.558 7.859 -3.725
47 HD2 HIS 8 2HD HIS 8 -6.883 5.932 -5.923
48 HE1 HIS 8 1HE HIS 8 -6.547 10.111 -6.485
49 HE2 HIS 8 2HE HIS 8 -5.476 7.857 -6.946
50 H MET 9 H MET 9 -6.174 5.270 -2.488
51 HA MET 9 HA MET 9 -5.690 7.315 -0.508
52 1HB MET 9 2HB MET 9 -4.936 4.599 -0.915
53 2HB MET 9 1HB MET 9 -3.471 5.561 -0.770
54 1HG MET 9 2HG MET 9 -3.912 6.157 1.393
55 2HG MET 9 1HG MET 9 -5.655 5.970 1.204
56 1HE MET 9 1HE MET 9 -6.783 3.189 2.304
57 2HE MET 9 2HE MET 9 -6.778 4.003 0.741
58 3HE MET 9 3HE MET 9 -6.205 2.338 0.871
59 H GLU 10 H GLU 10 -4.667 9.123 -0.920
60 HA GLU 10 HA GLU 10 -2.853 9.325 -3.203
61 1HB GLU 10 2HB GLU 10 -3.715 11.425 -1.200
62 2HB GLU 10 1HB GLU 10 -2.767 11.718 -2.653
63 1HG GLU 10 2HG GLU 10 -5.245 10.332 -3.230
64 2HG GLU 10 1HG GLU 10 -5.513 11.878 -2.421
65 H PHE 11 H PHE 11 -2.876 8.844 0.151
66 HA PHE 11 HA PHE 11 0.065 8.949 0.248
67 1HB PHE 11 2HB PHE 11 -0.353 9.065 2.811
68 2HB PHE 11 1HB PHE 11 -0.503 10.538 1.861
69 HD1 PHE 11 1HD PHE 11 -2.311 7.974 3.751
70 HD2 PHE 11 2HD PHE 11 -2.642 11.592 1.531
71 HE1 PHE 11 1HE PHE 11 -4.591 8.296 4.614
72 HE2 PHE 11 2HE PHE 11 -4.914 11.922 2.403
73 HZ PHE 11 HZ PHE 11 -5.896 10.273 3.946
74 H CYS 12 H CYS 12 0.534 7.431 2.412
75 HA CYS 12 HA CYS 12 -0.328 4.845 1.426
76 1HB CYS 12 2HB CYS 12 1.713 4.169 2.042
77 2HB CYS 12 1HB CYS 12 2.053 5.853 2.425
78 HG CYS 12 HG CYS 12 2.415 5.568 4.878
79 H ARG 13 H ARG 13 -1.033 3.153 2.868
80 HA ARG 13 HA ARG 13 -3.171 4.032 4.480
81 1HB ARG 13 2HB ARG 13 -2.539 1.690 3.201
82 2HB ARG 13 1HB ARG 13 -2.361 1.244 4.892
83 1HG ARG 13 2HG ARG 13 -4.693 2.442 5.108
84 2HG ARG 13 1HG ARG 13 -4.787 2.061 3.389
85 1HD ARG 13 2HD ARG 13 -3.912 -0.114 5.191
86 2HD ARG 13 1HD ARG 13 -5.599 0.383 5.308
87 HE ARG 13 HE ARG 13 -4.327 -1.011 3.113
88 1HH1 ARG 13 2HH1 ARG 13 -7.091 0.935 4.090
89 2HH1 ARG 13 1HH1 ARG 13 -8.103 0.355 2.799
90 1HH2 ARG 13 2HH2 ARG 13 -5.661 -1.758 1.415
91 2HH2 ARG 13 1HH2 ARG 13 -7.290 -1.161 1.286
92 H VAL 14 H VAL 14 -0.226 2.242 5.446
93 HA VAL 14 HA VAL 14 -0.933 2.416 8.196
94 HB VAL 14 HB VAL 14 1.774 1.666 7.085
95 1HG1 VAL 14 1HG1 VAL 14 1.020 2.019 9.677
96 2HG1 VAL 14 2HG1 VAL 14 0.696 0.300 9.445
97 3HG1 VAL 14 3HG1 VAL 14 2.311 0.943 9.141
98 1HG2 VAL 14 1HG2 VAL 14 0.965 -0.648 7.071
99 2HG2 VAL 14 2HG2 VAL 14 -0.647 -0.088 7.519
100 3HG2 VAL 14 3HG2 VAL 14 0.043 0.364 5.960
101 H CYS 15 H CYS 15 2.060 3.618 6.660
102 HA CYS 15 HA CYS 15 2.147 5.741 8.647
103 1HB CYS 15 2HB CYS 15 4.460 6.027 7.271
104 2HB CYS 15 1HB CYS 15 4.271 5.025 8.700
105 H LYS 16 H LYS 16 0.281 6.542 7.469
106 HA LYS 16 HA LYS 16 -0.217 7.393 5.087
107 1HB LYS 16 2HB LYS 16 -0.680 9.021 7.583
108 2HB LYS 16 1HB LYS 16 -1.465 9.332 6.042
109 1HG LYS 16 2HG LYS 16 -3.058 7.901 6.590
110 2HG LYS 16 1HG LYS 16 -1.862 6.603 6.620
111 1HD LYS 16 2HD LYS 16 -1.343 7.551 9.007
112 2HD LYS 16 1HD LYS 16 -2.971 8.219 8.871
113 1HE LYS 16 2HE LYS 16 -3.934 6.073 8.624
114 2HE LYS 16 1HE LYS 16 -2.363 5.322 8.349
115 1HZ LYS 16 1HZ LYS 16 -1.871 6.173 10.725
116 2HZ LYS 16 2HZ LYS 16 -2.815 4.778 10.524
117 3HZ LYS 16 3HZ LYS 16 -3.561 6.264 10.870
118 H ASP 17 H ASP 17 1.920 7.710 4.261
119 HA ASP 17 HA ASP 17 2.512 10.557 3.934
120 1HB ASP 17 2HB ASP 17 3.857 9.191 5.837
121 2HB ASP 17 1HB ASP 17 4.863 8.822 4.441
122 H GLY 18 H GLY 18 4.534 10.691 2.386
123 1HA GLY 18 1HA GLY 18 5.727 9.606 0.591
124 2HA GLY 18 2HA GLY 18 4.319 8.581 0.334
125 H GLY 19 H GLY 19 5.815 10.300 -1.522
126 1HA GLY 19 1HA GLY 19 3.829 12.330 -2.241
127 2HA GLY 19 2HA GLY 19 5.403 12.104 -2.998
128 H GLU 20 H GLU 20 5.548 9.655 -3.810
129 HA GLU 20 HA GLU 20 3.054 9.025 -5.233
130 1HB GLU 20 2HB GLU 20 5.023 7.824 -6.761
131 2HB GLU 20 1HB GLU 20 4.139 9.283 -7.179
132 1HG GLU 20 2HG GLU 20 6.159 10.189 -7.391
133 2HG GLU 20 1HG GLU 20 6.124 10.292 -5.631
134 H LEU 21 H LEU 21 2.242 7.254 -4.429
135 HA LEU 21 HA LEU 21 4.019 5.344 -3.085
136 1HB LEU 21 2HB LEU 21 1.084 5.952 -2.860
137 2HB LEU 21 1HB LEU 21 1.762 4.481 -2.197
138 HG LEU 21 HG LEU 21 1.718 5.852 -0.349
139 1HD1 LEU 21 1HD1 LEU 21 4.411 6.316 -1.614
140 2HD1 LEU 21 2HD1 LEU 21 4.024 6.682 0.068
141 3HD1 LEU 21 3HD1 LEU 21 3.948 5.018 -0.512
142 1HD2 LEU 21 1HD2 LEU 21 1.514 8.077 -0.387
143 2HD2 LEU 21 2HD2 LEU 21 2.913 8.285 -1.441
144 3HD2 LEU 21 3HD2 LEU 21 1.343 7.879 -2.131
145 H LEU 22 H LEU 22 2.754 3.050 -3.070
146 HA LEU 22 HA LEU 22 2.340 2.384 -5.905
147 1HB LEU 22 2HB LEU 22 3.921 0.836 -5.661
148 2HB LEU 22 1HB LEU 22 4.134 1.299 -3.986
149 HG LEU 22 HG LEU 22 1.834 -0.363 -4.119
150 1HD1 LEU 22 1HD1 LEU 22 4.238 -1.523 -5.519
151 2HD1 LEU 22 2HD1 LEU 22 2.807 -2.417 -5.009
152 3HD1 LEU 22 3HD1 LEU 22 2.673 -1.176 -6.253
153 1HD2 LEU 22 1HD2 LEU 22 3.280 -0.106 -2.187
154 2HD2 LEU 22 2HD2 LEU 22 3.190 -1.802 -2.665
155 3HD2 LEU 22 3HD2 LEU 22 4.619 -0.847 -3.066
156 H CYS 23 H CYS 23 0.574 1.191 -6.466
157 HA CYS 23 HA CYS 23 -1.389 0.705 -4.316
158 1HB CYS 23 2HB CYS 23 -1.902 1.207 -7.262
159 2HB CYS 23 1HB CYS 23 -3.130 0.969 -6.022
160 HG CYS 23 HG CYS 23 -2.301 3.326 -4.602
161 H CYS 24 H CYS 24 -2.606 -1.275 -4.394
162 HA CYS 24 HA CYS 24 -1.029 -3.446 -5.324
163 1HB CYS 24 2HB CYS 24 -3.507 -4.482 -4.604
164 2HB CYS 24 1HB CYS 24 -2.084 -4.344 -3.580
165 H ASP 25 H ASP 25 -2.727 -5.356 -6.124
166 HA ASP 25 HA ASP 25 -3.341 -4.529 -8.856
167 1HB ASP 25 2HB ASP 25 -1.923 -6.587 -8.227
168 2HB ASP 25 1HB ASP 25 -3.443 -7.341 -7.770
169 H THR 26 H THR 26 -4.953 -4.938 -5.960
170 HA THR 26 HA THR 26 -7.467 -5.622 -7.329
171 HB THR 26 HB THR 26 -8.193 -6.283 -4.938
172 HG1 THR 26 1HG THR 26 -6.559 -5.612 -3.651
173 1HG2 THR 26 1HG2 THR 26 -7.995 -8.006 -6.516
174 2HG2 THR 26 2HG2 THR 26 -6.948 -8.515 -5.192
175 3HG2 THR 26 3HG2 THR 26 -6.247 -7.807 -6.648
176 H CYS 27 H CYS 27 -6.175 -3.739 -4.603
177 HA CYS 27 HA CYS 27 -8.621 -2.137 -4.622
178 1HB CYS 27 2HB CYS 27 -6.852 -1.775 -2.349
179 2HB CYS 27 1HB CYS 27 -8.539 -2.279 -2.385
180 HA PRO 28 HA PRO 28 -6.325 1.526 -5.661
181 1HB PRO 28 2HB PRO 28 -7.906 3.454 -4.715
182 2HB PRO 28 1HB PRO 28 -8.462 2.372 -5.999
183 1HG PRO 28 2HG PRO 28 -9.095 2.334 -3.080
184 2HG PRO 28 1HG PRO 28 -10.157 2.011 -4.460
185 1HD PRO 28 2HD PRO 28 -8.917 0.079 -2.893
186 2HD PRO 28 1HD PRO 28 -9.574 -0.185 -4.517
187 H SER 29 H SER 29 -5.801 0.213 -2.956
188 HA SER 29 HA SER 29 -5.222 2.322 -1.118
189 1HB SER 29 2HB SER 29 -3.701 0.088 -0.411
190 2HB SER 29 1HB SER 29 -5.309 0.495 0.193
191 HG SER 29 HG SER 29 -4.587 -1.251 -1.920
192 H SER 30 H SER 30 -3.108 3.004 -0.469
193 HA SER 30 HA SER 30 -1.001 2.440 -2.429
194 1HB SER 30 2HB SER 30 -1.626 5.149 -1.230
195 2HB SER 30 1HB SER 30 -0.283 4.785 -2.318
196 HG SER 30 HG SER 30 -2.718 5.504 -2.985
197 H TYR 31 H TYR 31 0.963 2.050 -1.624
198 HA TYR 31 HA TYR 31 1.371 2.404 1.273
199 1HB TYR 31 2HB TYR 31 2.027 -0.044 -0.381
200 2HB TYR 31 1HB TYR 31 2.515 0.195 1.291
201 HD1 TYR 31 1HD TYR 31 0.771 0.262 3.084
202 HD2 TYR 31 2HD TYR 31 -0.151 -0.811 -0.929
203 HE1 TYR 31 1HE TYR 31 -1.339 -0.748 3.843
204 HE2 TYR 31 2HE TYR 31 -2.260 -1.831 -0.178
205 HH TYR 31 HH TYR 31 -3.477 -2.481 1.597
206 H HIS 32 H HIS 32 3.692 1.968 1.849
207 HA HIS 32 HA HIS 32 5.524 3.329 -0.003
208 1HB HIS 32 2HB HIS 32 5.683 2.494 2.901
209 2HB HIS 32 1HB HIS 32 7.135 2.893 1.999
210 HD2 HIS 32 2HD HIS 32 7.235 5.626 1.113
211 HE1 HIS 32 1HE HIS 32 4.571 6.861 4.166
212 HE2 HIS 32 2HE HIS 32 6.443 7.597 2.611
213 H ILE 33 H ILE 33 7.531 1.504 1.612
214 HA ILE 33 HA ILE 33 6.973 -1.013 0.210
215 HB ILE 33 HB ILE 33 9.393 -1.371 -0.121
216 1HG1 ILE 33 2HG1 ILE 33 9.965 1.518 0.301
217 1HG2 ILE 33 1HG2 ILE 33 8.207 -0.587 -2.003
218 2HG2 ILE 33 2HG2 ILE 33 8.140 1.057 -1.369
219 3HG2 ILE 33 3HG2 ILE 33 9.677 0.386 -1.919
220 1HD1 ILE 33 1HD1 ILE 33 11.480 -1.035 0.414
221 2HD1 ILE 33 2HD1 ILE 33 11.859 0.469 -0.425
222 3HD1 ILE 33 3HD1 ILE 33 12.061 0.359 1.323
223 H HIS 34 H HIS 34 6.985 0.367 3.076
224 HA HIS 34 HA HIS 34 7.959 -2.021 4.462
225 1HB HIS 34 2HB HIS 34 9.066 -0.502 6.153
226 2HB HIS 34 1HB HIS 34 9.848 -0.582 4.579
227 HD2 HIS 34 2HD HIS 34 8.234 1.962 6.956
228 HE1 HIS 34 1HE HIS 34 9.293 3.988 3.395
229 HE2 HIS 34 2HE HIS 34 8.693 4.262 5.841
230 H CYS 35 H CYS 35 5.337 -0.237 3.974
231 HA CYS 35 HA CYS 35 4.465 0.385 6.614
232 1HB CYS 35 2HB CYS 35 2.511 -0.199 4.440
233 2HB CYS 35 1HB CYS 35 2.528 1.120 5.607
234 H LEU 36 H LEU 36 4.274 -2.383 4.521
235 HA LEU 36 HA LEU 36 2.526 -3.855 6.305
236 1HB LEU 36 2HB LEU 36 3.815 -5.435 4.242
237 2HB LEU 36 1HB LEU 36 2.109 -5.157 4.534
238 HG LEU 36 HG LEU 36 3.393 -2.833 3.350
239 1HD1 LEU 36 1HD1 LEU 36 4.003 -5.464 2.238
240 2HD1 LEU 36 2HD1 LEU 36 3.279 -4.342 1.086
241 3HD1 LEU 36 3HD1 LEU 36 4.756 -3.897 1.939
242 1HD2 LEU 36 1HD2 LEU 36 0.884 -3.815 3.529
243 2HD2 LEU 36 2HD2 LEU 36 1.397 -2.628 2.330
244 3HD2 LEU 36 3HD2 LEU 36 1.319 -4.337 1.902
245 H ARG 37 H ARG 37 3.270 -6.164 6.867
246 HA ARG 37 HA ARG 37 5.613 -5.968 8.453
247 1HB ARG 37 2HB ARG 37 3.464 -7.858 8.087
248 2HB ARG 37 1HB ARG 37 5.009 -8.687 8.219
249 1HG ARG 37 2HG ARG 37 4.847 -6.621 10.194
250 2HG ARG 37 1HG ARG 37 3.424 -7.661 10.285
251 1HD ARG 37 2HD ARG 37 5.771 -9.263 9.916
252 2HD ARG 37 1HD ARG 37 6.007 -8.167 11.279
253 HE ARG 37 HE ARG 37 3.957 -10.246 11.040
254 1HH1 ARG 37 2HH1 ARG 37 5.554 -7.769 12.945
255 2HH1 ARG 37 1HH1 ARG 37 4.750 -8.219 14.425
256 1HH2 ARG 37 2HH2 ARG 37 2.956 -10.870 12.970
257 2HH2 ARG 37 1HH2 ARG 37 3.294 -10.014 14.448
258 HA PRO 38 HA PRO 38 7.737 -8.786 5.207
259 1HB PRO 38 2HB PRO 38 6.127 -8.856 2.798
260 2HB PRO 38 1HB PRO 38 6.666 -10.200 3.803
261 1HG PRO 38 2HG PRO 38 4.061 -9.431 3.605
262 2HG PRO 38 1HG PRO 38 4.742 -10.218 5.041
263 1HD PRO 38 2HD PRO 38 4.196 -7.312 4.547
264 2HD PRO 38 1HD PRO 38 3.913 -8.280 6.010
265 H ALA 39 H ALA 39 8.515 -6.455 5.461
266 HA ALA 39 HA ALA 39 8.129 -4.504 3.504
267 1HB ALA 39 1HB ALA 39 10.479 -4.982 5.327
268 2HB ALA 39 2HB ALA 39 10.269 -3.535 4.343
269 3HB ALA 39 3HB ALA 39 9.106 -3.915 5.613
270 H LEU 40 H LEU 40 9.006 -4.099 1.561
271 HA LEU 40 HA LEU 40 10.623 -6.218 0.374
272 1HB LEU 40 2HB LEU 40 9.095 -3.889 -0.777
273 2HB LEU 40 1HB LEU 40 10.154 -4.891 -1.751
274 HG LEU 40 HG LEU 40 8.479 -6.705 -0.447
275 1HD1 LEU 40 1HD1 LEU 40 7.082 -4.154 -1.057
276 2HD1 LEU 40 2HD1 LEU 40 6.259 -5.670 -1.427
277 3HD1 LEU 40 3HD1 LEU 40 6.784 -5.329 0.222
278 1HD2 LEU 40 1HD2 LEU 40 9.432 -6.505 -2.856
279 2HD2 LEU 40 2HD2 LEU 40 7.906 -7.345 -2.590
280 3HD2 LEU 40 3HD2 LEU 40 7.906 -5.690 -3.198
281 H TYR 41 H TYR 41 12.527 -5.728 -0.888
282 HA TYR 41 HA TYR 41 14.143 -3.702 0.401
283 1HB TYR 41 2HB TYR 41 15.043 -5.373 -1.932
284 2HB TYR 41 1HB TYR 41 16.008 -4.700 -0.625
285 HD1 TYR 41 1HD TYR 41 15.289 -7.670 -1.878
286 HD2 TYR 41 2HD TYR 41 14.644 -5.593 1.781
287 HE1 TYR 41 1HE TYR 41 15.161 -9.815 -0.687
288 HE2 TYR 41 2HE TYR 41 14.513 -7.737 2.980
289 HH TYR 41 HH TYR 41 13.834 -10.420 1.880
290 H GLU 42 H GLU 42 12.716 -4.336 -2.737
291 HA GLU 42 HA GLU 42 13.303 -1.548 -3.491
292 1HB GLU 42 2HB GLU 42 13.889 -3.985 -4.924
293 2HB GLU 42 1HB GLU 42 12.760 -3.003 -5.846
294 1HG GLU 42 2HG GLU 42 14.682 -2.119 -6.628
295 2HG GLU 42 1HG GLU 42 14.493 -1.100 -5.202
296 H VAL 43 H VAL 43 11.643 -0.578 -4.887
297 HA VAL 43 HA VAL 43 9.039 -1.018 -3.890
298 HB VAL 43 HB VAL 43 9.707 0.431 -6.456
299 1HG1 VAL 43 1HG1 VAL 43 7.701 1.777 -5.113
300 2HG1 VAL 43 2HG1 VAL 43 7.495 0.701 -6.496
301 3HG1 VAL 43 3HG1 VAL 43 7.310 0.074 -4.856
302 1HG2 VAL 43 1HG2 VAL 43 10.790 2.000 -5.316
303 2HG2 VAL 43 2HG2 VAL 43 9.408 2.206 -4.241
304 3HG2 VAL 43 3HG2 VAL 43 10.650 1.014 -3.858
305 HA PRO 44 HA PRO 44 7.972 -4.381 -6.616
306 1HB PRO 44 2HB PRO 44 5.451 -4.768 -5.695
307 2HB PRO 44 1HB PRO 44 6.887 -5.311 -4.825
308 1HG PRO 44 2HG PRO 44 5.109 -3.010 -4.284
309 2HG PRO 44 1HG PRO 44 6.061 -3.986 -3.157
310 1HD PRO 44 2HD PRO 44 6.722 -1.439 -4.126
311 2HD PRO 44 1HD PRO 44 7.807 -2.551 -3.276
312 H ASP 45 H ASP 45 8.087 -2.332 -8.110
313 HA ASP 45 HA ASP 45 5.586 -1.239 -8.960
314 1HB ASP 45 2HB ASP 45 7.654 0.060 -9.107
315 2HB ASP 45 1HB ASP 45 8.336 -1.120 -10.219
316 H GLY 46 H GLY 46 4.158 -2.368 -10.063
317 1HA GLY 46 1HA GLY 46 3.795 -3.267 -12.390
318 2HA GLY 46 2HA GLY 46 5.139 -4.344 -12.024
319 H GLU 47 H GLU 47 4.573 -6.297 -11.449
320 HA GLU 47 HA GLU 47 1.860 -6.909 -10.676
321 1HB GLU 47 2HB GLU 47 4.048 -8.937 -10.544
322 2HB GLU 47 1HB GLU 47 2.390 -9.115 -11.096
323 1HG GLU 47 2HG GLU 47 3.427 -9.245 -13.095
324 2HG GLU 47 1HG GLU 47 3.256 -7.492 -13.008
325 H TRP 48 H TRP 48 1.127 -6.971 -8.672
326 HA TRP 48 HA TRP 48 2.557 -8.037 -6.475
327 1HB TRP 48 2HB TRP 48 3.752 -5.879 -6.643
328 2HB TRP 48 1HB TRP 48 2.220 -5.027 -6.492
329 HD1 TRP 48 HD TRP 48 4.423 -7.437 -4.397
330 HE1 TRP 48 1HE TRP 48 4.093 -6.859 -1.909
331 HE3 TRP 48 3HE TRP 48 0.816 -3.843 -4.887
332 HZ2 TRP 48 2HZ TRP 48 2.497 -5.115 -0.369
333 HZ3 TRP 48 3HZ TRP 48 -0.058 -2.772 -2.853
334 HH2 TRP 48 HH TRP 48 0.766 -3.395 -0.644
335 H GLN 49 H GLN 49 1.134 -8.709 -5.003
336 HA GLN 49 HA GLN 49 -1.505 -7.418 -4.937
337 1HB GLN 49 2HB GLN 49 -1.033 -10.069 -5.630
338 2HB GLN 49 1HB GLN 49 -1.513 -10.154 -3.939
339 1HG GLN 49 2HG GLN 49 -3.206 -8.375 -5.485
340 2HG GLN 49 1HG GLN 49 -3.195 -10.023 -6.114
341 1HE2 GLN 49 1HE2 GLN 49 -4.428 -7.942 -3.755
342 2HE2 GLN 49 2HE2 GLN 49 -5.210 -9.129 -2.771
343 H CYS 50 H CYS 50 -2.422 -7.154 -2.900
344 HA CYS 50 HA CYS 50 -0.535 -6.419 -0.992
345 1HB CYS 50 2HB CYS 50 -3.027 -6.432 0.254
346 2HB CYS 50 1HB CYS 50 -2.256 -5.086 -0.582
347 HA PRO 51 HA PRO 51 -0.685 -9.916 1.814
348 1HB PRO 51 2HB PRO 51 1.282 -9.042 3.407
349 2HB PRO 51 1HB PRO 51 1.635 -9.718 1.813
350 1HG PRO 51 2HG PRO 51 1.730 -6.910 2.731
351 2HG PRO 51 1HG PRO 51 2.614 -7.693 1.412
352 1HD PRO 51 2HD PRO 51 0.241 -6.093 1.242
353 2HD PRO 51 1HD PRO 51 1.107 -6.905 -0.077
354 H ARG 52 H ARG 52 -1.972 -6.995 1.873
355 HA ARG 52 HA ARG 52 -2.592 -7.029 4.747
356 1HB ARG 52 2HB ARG 52 -1.040 -5.171 4.035
357 2HB ARG 52 1HB ARG 52 -2.364 -4.531 3.071
358 1HG ARG 52 2HG ARG 52 -2.239 -3.356 5.169
359 2HG ARG 52 1HG ARG 52 -3.718 -4.318 5.118
360 1HD ARG 52 2HD ARG 52 -1.336 -5.616 6.297
361 2HD ARG 52 1HD ARG 52 -2.042 -4.290 7.216
362 HE ARG 52 HE ARG 52 -4.180 -5.560 7.101
363 1HH1 ARG 52 2HH1 ARG 52 -1.128 -7.225 6.732
364 2HH1 ARG 52 1HH1 ARG 52 -1.747 -8.759 7.259
365 1HH2 ARG 52 2HH2 ARG 52 -5.012 -7.595 7.789
366 2HH2 ARG 52 1HH2 ARG 52 -3.948 -8.967 7.876
367 H CYS 53 H CYS 53 -3.837 -5.211 1.884
368 HA CYS 53 HA CYS 53 -6.487 -5.513 2.958
369 1HB CYS 53 2HB CYS 53 -6.906 -4.275 0.607
370 2HB CYS 53 1HB CYS 53 -6.446 -3.444 2.084
371 H THR 54 H THR 54 -5.580 -7.958 2.423
372 HA THR 54 HA THR 54 -6.773 -8.825 -0.101
373 HB THR 54 HB THR 54 -5.971 -11.053 1.445
374 HG1 THR 54 1HG THR 54 -3.734 -9.372 1.241
375 1HG2 THR 54 1HG2 THR 54 -4.227 -9.842 -0.656
376 2HG2 THR 54 2HG2 THR 54 -5.835 -10.423 -1.096
377 3HG2 THR 54 3HG2 THR 54 -4.656 -11.534 -0.396
378 H CYS 55 H CYS 55 -8.399 -7.613 1.745
379 HA CYS 55 HA CYS 55 -10.672 -7.993 2.144
380 1HB CYS 55 2HB CYS 55 -9.829 -10.790 2.868
381 2HB CYS 55 1HB CYS 55 -11.409 -10.139 3.296
382 HG CYS 55 HG CYS 55 -10.462 -9.916 0.050
383 HA PRO 56 HA PRO 56 -9.816 -7.903 6.768
384 1HB PRO 56 2HB PRO 56 -7.884 -9.290 7.968
385 2HB PRO 56 1HB PRO 56 -9.374 -10.085 7.445
386 1HG PRO 56 2HG PRO 56 -6.673 -10.095 6.177
387 2HG PRO 56 1HG PRO 56 -7.854 -11.408 6.319
388 1HD PRO 56 2HD PRO 56 -7.473 -9.805 4.068
389 2HD PRO 56 1HD PRO 56 -8.896 -10.811 4.392
390 H ALA 57 H ALA 57 -8.889 -5.994 5.324
391 HA ALA 57 HA ALA 57 -6.174 -5.364 5.316
392 1HB ALA 57 1HB ALA 57 -8.318 -4.208 4.239
393 2HB ALA 57 2HB ALA 57 -8.096 -3.131 5.618
394 3HB ALA 57 3HB ALA 57 -6.789 -3.355 4.455
395 H LEU 58 H LEU 58 -8.687 -4.471 7.658
396 HA LEU 58 HA LEU 58 -6.703 -4.409 9.763
397 1HB LEU 58 2HB LEU 58 -7.931 -1.964 8.659
398 2HB LEU 58 1HB LEU 58 -7.984 -2.099 10.406
399 HG LEU 58 HG LEU 58 -5.338 -2.737 9.521
400 1HD1 LEU 58 1HD1 LEU 58 -5.365 -0.010 8.860
401 2HD1 LEU 58 2HD1 LEU 58 -4.992 -1.376 7.808
402 3HD1 LEU 58 3HD1 LEU 58 -6.643 -0.764 7.907
403 1HD2 LEU 58 1HD2 LEU 58 -5.051 -1.790 11.507
404 2HD2 LEU 58 2HD2 LEU 58 -5.419 -0.224 10.782
405 3HD2 LEU 58 3HD2 LEU 58 -6.709 -1.190 11.499
406 H LYS 59 H LYS 59 -9.946 -3.034 9.358
407 HA LYS 59 HA LYS 59 -11.065 -5.160 11.021
408 1HB LYS 59 2HB LYS 59 -10.735 -2.381 11.863
409 2HB LYS 59 1HB LYS 59 -12.406 -2.920 11.947
410 1HG LYS 59 2HG LYS 59 -11.862 -4.671 13.441
411 2HG LYS 59 1HG LYS 59 -10.132 -4.450 13.177
412 1HD LYS 59 2HD LYS 59 -11.724 -2.158 14.214
413 2HD LYS 59 1HD LYS 59 -11.327 -3.478 15.318
414 1HE LYS 59 2HE LYS 59 -9.348 -1.895 13.680
415 2HE LYS 59 1HE LYS 59 -9.660 -1.673 15.399
416 1HZ LYS 59 1HZ LYS 59 -9.077 -4.386 14.882
417 2HZ LYS 59 2HZ LYS 59 -8.240 -3.291 15.866
418 3HZ LYS 59 3HZ LYS 59 -7.855 -3.415 14.219
419 H GLY 60 H GLY 60 -12.292 -5.969 9.391
420 1HA GLY 60 1HA GLY 60 -13.651 -4.342 7.491
421 2HA GLY 60 2HA GLY 60 -13.876 -6.067 7.728
422 H LYS 61 H LYS 61 -15.443 -3.233 7.747
423 HA LYS 61 HA LYS 61 -17.672 -4.344 9.211
424 1HB LYS 61 2HB LYS 61 -15.992 -2.758 10.669
425 2HB LYS 61 1HB LYS 61 -17.136 -1.574 10.051
426 1HG LYS 61 2HG LYS 61 -18.718 -2.228 11.465
427 2HG LYS 61 1HG LYS 61 -18.471 -3.932 11.072
428 1HD LYS 61 2HD LYS 61 -16.230 -3.324 12.528
429 2HD LYS 61 1HD LYS 61 -17.475 -2.358 13.321
430 1HE LYS 61 2HE LYS 61 -17.852 -5.273 12.692
431 2HE LYS 61 1HE LYS 61 -17.117 -4.718 14.197
432 1HZ LYS 61 1HZ LYS 61 -19.280 -3.245 14.249
433 2HZ LYS 61 2HZ LYS 61 -19.282 -4.839 14.828
434 3HZ LYS 61 3HZ LYS 61 -19.889 -4.499 13.282
Start of MODEL 20
1 1H GLY 1 1H GLY 1 -16.868 13.769 -7.786
2 2H GLY 1 2H GLY 1 -17.180 12.149 -7.388
3 3H GLY 1 3H GLY 1 -15.631 12.795 -7.158
4 1HA GLY 1 2HA GLY 1 -17.183 14.481 -5.718
5 2HA GLY 1 1HA GLY 1 -17.941 12.915 -5.458
6 HA PRO 2 HA PRO 2 -14.341 13.517 -2.483
7 1HB PRO 2 2HB PRO 2 -16.356 12.448 -0.599
8 2HB PRO 2 1HB PRO 2 -15.281 13.839 -0.425
9 1HG PRO 2 2HG PRO 2 -17.899 14.166 -0.837
10 2HG PRO 2 1HG PRO 2 -16.710 15.254 -1.578
11 1HD PRO 2 2HD PRO 2 -18.214 12.970 -2.801
12 2HD PRO 2 1HD PRO 2 -17.847 14.568 -3.484
13 H LEU 3 H LEU 3 -13.212 11.818 -3.362
14 HA LEU 3 HA LEU 3 -14.166 9.096 -3.013
15 1HB LEU 3 2HB LEU 3 -12.237 10.478 -4.708
16 2HB LEU 3 1HB LEU 3 -11.603 8.976 -4.066
17 HG LEU 3 HG LEU 3 -13.308 7.693 -5.119
18 1HD1 LEU 3 1HD1 LEU 3 -14.754 10.222 -5.104
19 2HD1 LEU 3 2HD1 LEU 3 -14.887 9.350 -6.632
20 3HD1 LEU 3 3HD1 LEU 3 -15.362 8.566 -5.124
21 1HD2 LEU 3 1HD2 LEU 3 -11.909 7.917 -6.859
22 2HD2 LEU 3 2HD2 LEU 3 -13.190 8.925 -7.535
23 3HD2 LEU 3 3HD2 LEU 3 -11.827 9.672 -6.699
24 H GLY 4 H GLY 4 -12.968 7.479 -1.924
25 1HA GLY 4 1HA GLY 4 -11.222 6.751 -0.473
26 2HA GLY 4 2HA GLY 4 -10.871 8.431 -0.095
27 H SER 5 H SER 5 -14.064 7.017 -0.138
28 HA SER 5 HA SER 5 -14.738 8.088 2.368
29 1HB SER 5 2HB SER 5 -16.485 5.925 1.618
30 2HB SER 5 1HB SER 5 -16.796 7.663 1.598
31 HG SER 5 HG SER 5 -16.542 7.656 -0.481
32 H ASP 6 H ASP 6 -14.836 4.614 1.535
33 HA ASP 6 HA ASP 6 -13.709 4.056 4.200
34 1HB ASP 6 2HB ASP 6 -16.051 3.609 4.401
35 2HB ASP 6 1HB ASP 6 -16.073 2.722 2.880
36 H HIS 7 H HIS 7 -14.244 2.870 0.908
37 HA HIS 7 HA HIS 7 -11.947 1.068 1.310
38 1HB HIS 7 2HB HIS 7 -14.380 0.203 0.633
39 2HB HIS 7 1HB HIS 7 -13.798 0.618 -0.978
40 HD2 HIS 7 2HD HIS 7 -10.759 -0.442 -0.746
41 HE1 HIS 7 1HE HIS 7 -12.554 -4.102 0.384
42 HE2 HIS 7 2HE HIS 7 -10.363 -2.946 -0.165
43 H HIS 8 H HIS 8 -10.806 3.158 0.892
44 HA HIS 8 HA HIS 8 -9.607 3.071 -1.630
45 1HB HIS 8 2HB HIS 8 -11.822 4.147 -2.258
46 2HB HIS 8 1HB HIS 8 -11.324 5.536 -1.299
47 HD2 HIS 8 2HD HIS 8 -9.082 3.599 -3.898
48 HE1 HIS 8 1HE HIS 8 -9.477 7.644 -5.066
49 HE2 HIS 8 2HE HIS 8 -8.478 5.393 -5.674
50 H MET 9 H MET 9 -7.644 3.371 -0.839
51 HA MET 9 HA MET 9 -7.161 5.762 0.814
52 1HB MET 9 2HB MET 9 -6.825 3.030 1.548
53 2HB MET 9 1HB MET 9 -5.225 3.749 1.405
54 1HG MET 9 2HG MET 9 -6.322 5.664 2.829
55 2HG MET 9 1HG MET 9 -7.430 4.375 3.295
56 1HE MET 9 1HE MET 9 -6.745 3.639 5.924
57 2HE MET 9 2HE MET 9 -5.300 4.510 6.442
58 3HE MET 9 3HE MET 9 -6.565 5.353 5.546
59 H GLU 10 H GLU 10 -6.407 6.960 -0.915
60 HA GLU 10 HA GLU 10 -4.290 5.935 -2.604
61 1HB GLU 10 2HB GLU 10 -5.680 8.604 -2.397
62 2HB GLU 10 1HB GLU 10 -4.320 8.332 -3.479
63 1HG GLU 10 2HG GLU 10 -6.093 6.233 -3.971
64 2HG GLU 10 1HG GLU 10 -7.093 7.680 -3.823
65 H PHE 11 H PHE 11 -3.599 5.844 0.058
66 HA PHE 11 HA PHE 11 -1.105 7.184 0.060
67 1HB PHE 11 2HB PHE 11 -1.438 8.474 2.170
68 2HB PHE 11 1HB PHE 11 -2.366 9.112 0.817
69 HD1 PHE 11 1HD PHE 11 -2.489 7.659 4.118
70 HD2 PHE 11 2HD PHE 11 -4.816 8.748 0.728
71 HE1 PHE 11 1HE PHE 11 -4.531 7.534 5.481
72 HE2 PHE 11 2HE PHE 11 -6.864 8.623 2.086
73 HZ PHE 11 HZ PHE 11 -6.723 8.018 4.470
74 H CYS 12 H CYS 12 0.079 6.662 2.157
75 HA CYS 12 HA CYS 12 -0.056 3.899 2.553
76 1HB CYS 12 2HB CYS 12 1.333 6.082 4.081
77 2HB CYS 12 1HB CYS 12 1.485 4.387 4.528
78 HG CYS 12 HG CYS 12 3.475 5.893 2.694
79 H ARG 13 H ARG 13 -0.941 2.609 4.050
80 HA ARG 13 HA ARG 13 -3.119 3.558 5.607
81 1HB ARG 13 2HB ARG 13 -1.645 0.924 5.707
82 2HB ARG 13 1HB ARG 13 -3.157 1.255 6.543
83 1HG ARG 13 2HG ARG 13 -3.625 1.982 3.896
84 2HG ARG 13 1HG ARG 13 -2.699 0.483 3.807
85 1HD ARG 13 2HD ARG 13 -4.290 -0.687 5.114
86 2HD ARG 13 1HD ARG 13 -5.100 0.808 5.584
87 HE ARG 13 HE ARG 13 -5.089 -0.131 2.793
88 1HH1 ARG 13 2HH1 ARG 13 -6.800 0.916 5.660
89 2HH1 ARG 13 1HH1 ARG 13 -8.333 1.074 4.850
90 1HH2 ARG 13 2HH2 ARG 13 -7.091 0.054 1.713
91 2HH2 ARG 13 1HH2 ARG 13 -8.502 0.561 2.601
92 H VAL 14 H VAL 14 0.253 2.959 6.319
93 HA VAL 14 HA VAL 14 -0.184 3.452 9.176
94 HB VAL 14 HB VAL 14 2.542 2.925 8.102
95 1HG1 VAL 14 1HG1 VAL 14 2.297 1.329 10.219
96 2HG1 VAL 14 2HG1 VAL 14 2.680 3.044 10.362
97 3HG1 VAL 14 3HG1 VAL 14 1.026 2.488 10.609
98 1HG2 VAL 14 1HG2 VAL 14 1.554 1.254 6.835
99 2HG2 VAL 14 2HG2 VAL 14 1.956 0.410 8.331
100 3HG2 VAL 14 3HG2 VAL 14 0.299 0.943 8.036
101 H CYS 15 H CYS 15 2.350 4.364 6.883
102 HA CYS 15 HA CYS 15 2.924 6.799 8.226
103 1HB CYS 15 2HB CYS 15 4.320 6.733 5.819
104 2HB CYS 15 1HB CYS 15 4.886 6.173 7.393
105 H LYS 16 H LYS 16 0.362 6.267 6.475
106 HA LYS 16 HA LYS 16 -1.054 7.528 5.125
107 1HB LYS 16 2HB LYS 16 -0.124 9.362 7.332
108 2HB LYS 16 1HB LYS 16 -1.544 9.660 6.340
109 1HG LYS 16 2HG LYS 16 -1.854 7.057 7.306
110 2HG LYS 16 1HG LYS 16 -1.246 8.003 8.668
111 1HD LYS 16 2HD LYS 16 -3.067 9.726 7.787
112 2HD LYS 16 1HD LYS 16 -3.801 8.245 7.171
113 1HE LYS 16 2HE LYS 16 -2.947 7.796 9.851
114 2HE LYS 16 1HE LYS 16 -3.882 9.291 9.802
115 1HZ LYS 16 1HZ LYS 16 -5.471 7.800 8.357
116 2HZ LYS 16 2HZ LYS 16 -5.549 7.776 10.049
117 3HZ LYS 16 3HZ LYS 16 -4.730 6.545 9.228
118 H ASP 17 H ASP 17 1.538 7.651 3.897
119 HA ASP 17 HA ASP 17 1.708 10.468 3.103
120 1HB ASP 17 2HB ASP 17 4.024 9.983 2.494
121 2HB ASP 17 1HB ASP 17 3.718 9.519 4.162
122 H GLY 18 H GLY 18 2.748 10.727 0.866
123 1HA GLY 18 1HA GLY 18 1.688 8.759 -1.044
124 2HA GLY 18 2HA GLY 18 1.294 10.468 -1.248
125 H GLY 19 H GLY 19 2.356 10.213 -3.357
126 1HA GLY 19 1HA GLY 19 4.207 11.146 -4.500
127 2HA GLY 19 2HA GLY 19 5.215 10.806 -3.100
128 H GLU 20 H GLU 20 6.432 9.019 -3.089
129 HA GLU 20 HA GLU 20 6.392 7.270 -5.403
130 1HB GLU 20 2HB GLU 20 8.401 8.105 -3.762
131 2HB GLU 20 1HB GLU 20 8.047 6.529 -3.070
132 1HG GLU 20 2HG GLU 20 9.763 6.192 -4.642
133 2HG GLU 20 1HG GLU 20 8.285 5.580 -5.386
134 H LEU 21 H LEU 21 4.135 6.700 -4.872
135 HA LEU 21 HA LEU 21 3.891 4.783 -2.669
136 1HB LEU 21 2HB LEU 21 2.351 6.973 -3.468
137 2HB LEU 21 1HB LEU 21 1.412 5.570 -3.942
138 HG LEU 21 HG LEU 21 1.353 4.760 -1.678
139 1HD1 LEU 21 1HD1 LEU 21 3.696 5.652 -1.170
140 2HD1 LEU 21 2HD1 LEU 21 2.886 7.165 -0.757
141 3HD1 LEU 21 3HD1 LEU 21 2.500 5.687 0.129
142 1HD2 LEU 21 1HD2 LEU 21 0.806 7.597 -1.135
143 2HD2 LEU 21 2HD2 LEU 21 0.032 6.929 -2.573
144 3HD2 LEU 21 3HD2 LEU 21 -0.243 6.185 -0.998
145 H LEU 22 H LEU 22 3.074 2.773 -2.958
146 HA LEU 22 HA LEU 22 2.665 1.901 -5.740
147 1HB LEU 22 2HB LEU 22 4.286 0.827 -3.618
148 2HB LEU 22 1HB LEU 22 3.078 -0.350 -4.100
149 HG LEU 22 HG LEU 22 4.303 0.812 -6.434
150 1HD1 LEU 22 1HD1 LEU 22 6.369 1.139 -5.639
151 2HD1 LEU 22 2HD1 LEU 22 6.077 0.164 -4.197
152 3HD1 LEU 22 3HD1 LEU 22 6.488 -0.620 -5.723
153 1HD2 LEU 22 1HD2 LEU 22 4.204 -1.963 -5.265
154 2HD2 LEU 22 2HD2 LEU 22 3.121 -1.279 -6.477
155 3HD2 LEU 22 3HD2 LEU 22 4.813 -1.579 -6.874
156 H CYS 23 H CYS 23 0.800 0.899 -6.243
157 HA CYS 23 HA CYS 23 -1.114 0.396 -4.061
158 1HB CYS 23 2HB CYS 23 -2.246 1.064 -6.696
159 2HB CYS 23 1HB CYS 23 -2.722 1.612 -5.093
160 HG CYS 23 HG CYS 23 -2.084 3.992 -5.955
161 H CYS 24 H CYS 24 -2.325 -1.460 -4.200
162 HA CYS 24 HA CYS 24 -1.229 -3.606 -5.659
163 1HB CYS 24 2HB CYS 24 -3.797 -4.326 -4.751
164 2HB CYS 24 1HB CYS 24 -2.254 -4.610 -3.938
165 H ASP 25 H ASP 25 -2.611 -5.110 -6.932
166 HA ASP 25 HA ASP 25 -4.011 -3.659 -9.050
167 1HB ASP 25 2HB ASP 25 -2.250 -5.536 -9.418
168 2HB ASP 25 1HB ASP 25 -3.547 -6.633 -8.977
169 H THR 26 H THR 26 -4.631 -5.256 -6.192
170 HA THR 26 HA THR 26 -7.187 -6.322 -7.088
171 HB THR 26 HB THR 26 -6.905 -7.317 -4.603
172 HG1 THR 26 1HG THR 26 -4.952 -6.697 -3.949
173 1HG2 THR 26 1HG2 THR 26 -7.179 -8.603 -6.681
174 2HG2 THR 26 2HG2 THR 26 -5.911 -9.291 -5.666
175 3HG2 THR 26 3HG2 THR 26 -5.482 -8.318 -7.078
176 H CYS 27 H CYS 27 -5.888 -4.084 -4.644
177 HA CYS 27 HA CYS 27 -8.625 -3.151 -4.278
178 1HB CYS 27 2HB CYS 27 -8.759 -3.506 -2.048
179 2HB CYS 27 1HB CYS 27 -7.597 -4.771 -2.397
180 HA PRO 28 HA PRO 28 -6.814 0.766 -4.647
181 1HB PRO 28 2HB PRO 28 -8.695 2.352 -3.584
182 2HB PRO 28 1HB PRO 28 -8.997 1.389 -5.035
183 1HG PRO 28 2HG PRO 28 -9.807 0.858 -2.207
184 2HG PRO 28 1HG PRO 28 -10.731 0.625 -3.701
185 1HD PRO 28 2HD PRO 28 -9.418 -1.388 -2.358
186 2HD PRO 28 1HD PRO 28 -9.808 -1.425 -4.089
187 H SER 29 H SER 29 -5.299 -0.238 -2.740
188 HA SER 29 HA SER 29 -5.214 1.877 -0.692
189 1HB SER 29 2HB SER 29 -4.138 -0.937 -0.388
190 2HB SER 29 1HB SER 29 -4.186 0.319 0.850
191 HG SER 29 HG SER 29 -6.293 -1.211 -0.242
192 H SER 30 H SER 30 -2.880 2.274 0.078
193 HA SER 30 HA SER 30 -0.905 1.751 -2.004
194 1HB SER 30 2HB SER 30 -1.573 4.557 -1.104
195 2HB SER 30 1HB SER 30 -0.376 4.095 -2.314
196 HG SER 30 HG SER 30 -2.631 2.996 -3.072
197 H TYR 31 H TYR 31 1.251 2.058 -1.410
198 HA TYR 31 HA TYR 31 1.845 2.737 1.380
199 1HB TYR 31 2HB TYR 31 2.497 0.084 0.071
200 2HB TYR 31 1HB TYR 31 3.264 0.650 1.547
201 HD1 TYR 31 1HD TYR 31 0.239 -0.754 0.077
202 HD2 TYR 31 2HD TYR 31 1.994 0.753 3.649
203 HE1 TYR 31 1HE TYR 31 -1.550 -1.801 1.395
204 HE2 TYR 31 2HE TYR 31 0.208 -0.287 4.971
205 HH TYR 31 HH TYR 31 -2.570 -1.797 3.456
206 H HIS 32 H HIS 32 4.364 2.233 1.630
207 HA HIS 32 HA HIS 32 5.893 3.683 -0.416
208 1HB HIS 32 2HB HIS 32 6.489 2.526 2.312
209 2HB HIS 32 1HB HIS 32 7.806 2.804 1.195
210 HD2 HIS 32 2HD HIS 32 8.740 5.341 1.051
211 HE1 HIS 32 1HE HIS 32 6.181 6.847 4.072
212 HE2 HIS 32 2HE HIS 32 8.368 7.207 2.822
213 H ILE 33 H ILE 33 7.778 1.378 0.975
214 HA ILE 33 HA ILE 33 6.943 -0.873 -0.680
215 HB ILE 33 HB ILE 33 9.187 -1.403 -1.399
216 1HG1 ILE 33 2HG1 ILE 33 10.213 1.210 -0.316
217 1HG2 ILE 33 1HG2 ILE 33 8.152 -0.116 -3.021
218 2HG2 ILE 33 2HG2 ILE 33 8.197 1.345 -2.035
219 3HG2 ILE 33 3HG2 ILE 33 9.678 0.732 -2.771
220 1HD1 ILE 33 1HD1 ILE 33 12.213 -0.663 -0.209
221 2HD1 ILE 33 2HD1 ILE 33 11.360 -1.068 -1.699
222 3HD1 ILE 33 3HD1 ILE 33 11.998 0.560 -1.461
223 H HIS 34 H HIS 34 7.119 0.128 2.271
224 HA HIS 34 HA HIS 34 7.898 -2.406 3.423
225 1HB HIS 34 2HB HIS 34 9.623 -1.371 4.905
226 2HB HIS 34 1HB HIS 34 10.079 -1.430 3.208
227 HD2 HIS 34 2HD HIS 34 9.875 1.032 6.059
228 HE1 HIS 34 1HE HIS 34 10.217 3.296 2.504
229 HE2 HIS 34 2HE HIS 34 10.196 3.397 5.038
230 H CYS 35 H CYS 35 5.562 -0.463 3.395
231 HA CYS 35 HA CYS 35 5.396 0.383 6.168
232 1HB CYS 35 2HB CYS 35 3.048 0.483 4.338
233 2HB CYS 35 1HB CYS 35 3.652 1.702 5.461
234 H LEU 36 H LEU 36 4.534 -2.254 4.221
235 HA LEU 36 HA LEU 36 2.418 -3.192 5.994
236 1HB LEU 36 2HB LEU 36 1.928 -4.790 4.212
237 2HB LEU 36 1HB LEU 36 1.971 -3.152 3.604
238 HG LEU 36 HG LEU 36 4.538 -4.538 3.361
239 1HD1 LEU 36 1HD1 LEU 36 2.120 -5.556 1.884
240 2HD1 LEU 36 2HD1 LEU 36 3.787 -5.875 1.407
241 3HD1 LEU 36 3HD1 LEU 36 3.184 -6.472 2.951
242 1HD2 LEU 36 1HD2 LEU 36 4.562 -3.484 1.239
243 2HD2 LEU 36 2HD2 LEU 36 2.820 -3.211 1.283
244 3HD2 LEU 36 3HD2 LEU 36 3.881 -2.322 2.378
245 H ARG 37 H ARG 37 3.064 -5.938 4.961
246 HA ARG 37 HA ARG 37 4.439 -7.010 7.151
247 1HB ARG 37 2HB ARG 37 3.393 -7.956 4.555
248 2HB ARG 37 1HB ARG 37 4.720 -8.911 5.202
249 1HG ARG 37 2HG ARG 37 3.210 -10.001 6.399
250 2HG ARG 37 1HG ARG 37 3.040 -8.539 7.371
251 1HD ARG 37 2HD ARG 37 1.516 -8.368 4.918
252 2HD ARG 37 1HD ARG 37 1.063 -9.785 5.863
253 HE ARG 37 HE ARG 37 1.036 -7.027 6.922
254 1HH1 ARG 37 2HH1 ARG 37 -0.364 -10.220 6.632
255 2HH1 ARG 37 1HH1 ARG 37 -1.627 -9.913 7.776
256 1HH2 ARG 37 2HH2 ARG 37 -0.619 -6.617 8.447
257 2HH2 ARG 37 1HH2 ARG 37 -1.765 -7.869 8.823
258 HA PRO 38 HA PRO 38 8.880 -7.526 6.772
259 1HB PRO 38 2HB PRO 38 8.404 -9.495 4.566
260 2HB PRO 38 1HB PRO 38 9.580 -9.553 5.884
261 1HG PRO 38 2HG PRO 38 7.095 -10.794 5.904
262 2HG PRO 38 1HG PRO 38 8.071 -10.432 7.335
263 1HD PRO 38 2HD PRO 38 5.541 -9.334 6.682
264 2HD PRO 38 1HD PRO 38 6.628 -8.801 7.981
265 H ALA 39 H ALA 39 9.586 -5.681 6.030
266 HA ALA 39 HA ALA 39 8.975 -4.253 3.841
267 1HB ALA 39 1HB ALA 39 10.319 -2.919 4.993
268 2HB ALA 39 2HB ALA 39 11.143 -4.286 5.743
269 3HB ALA 39 3HB ALA 39 11.672 -3.695 4.169
270 H LEU 40 H LEU 40 9.523 -4.042 1.743
271 HA LEU 40 HA LEU 40 10.916 -6.243 0.465
272 1HB LEU 40 2HB LEU 40 9.487 -3.793 -0.566
273 2HB LEU 40 1HB LEU 40 10.396 -4.858 -1.623
274 HG LEU 40 HG LEU 40 8.709 -6.575 -0.233
275 1HD1 LEU 40 1HD1 LEU 40 6.627 -5.680 -0.036
276 2HD1 LEU 40 2HD1 LEU 40 7.589 -4.249 0.333
277 3HD1 LEU 40 3HD1 LEU 40 6.908 -4.462 -1.280
278 1HD2 LEU 40 1HD2 LEU 40 7.622 -6.850 -2.383
279 2HD2 LEU 40 2HD2 LEU 40 8.312 -5.328 -2.947
280 3HD2 LEU 40 3HD2 LEU 40 9.366 -6.695 -2.597
281 H TYR 41 H TYR 41 12.980 -6.200 -0.167
282 HA TYR 41 HA TYR 41 14.602 -3.995 0.679
283 1HB TYR 41 2HB TYR 41 15.344 -6.533 -0.793
284 2HB TYR 41 1HB TYR 41 16.490 -5.394 -0.086
285 HD1 TYR 41 1HD TYR 41 15.427 -4.741 2.479
286 HD2 TYR 41 2HD TYR 41 15.343 -8.485 0.467
287 HE1 TYR 41 1HE TYR 41 15.220 -5.891 4.641
288 HE2 TYR 41 2HE TYR 41 15.141 -9.648 2.624
289 HH TYR 41 HH TYR 41 15.922 -8.760 5.282
290 H GLU 42 H GLU 42 13.079 -4.897 -2.218
291 HA GLU 42 HA GLU 42 14.362 -2.628 -3.568
292 1HB GLU 42 2HB GLU 42 13.746 -5.345 -4.704
293 2HB GLU 42 1HB GLU 42 13.815 -3.928 -5.739
294 1HG GLU 42 2HG GLU 42 15.973 -4.374 -5.948
295 2HG GLU 42 1HG GLU 42 16.145 -3.743 -4.310
296 H VAL 43 H VAL 43 12.932 -1.454 -4.946
297 HA VAL 43 HA VAL 43 10.270 -1.289 -4.001
298 HB VAL 43 HB VAL 43 11.262 0.699 -4.867
299 1HG1 VAL 43 1HG1 VAL 43 11.725 0.841 -7.394
300 2HG1 VAL 43 2HG1 VAL 43 12.910 0.024 -6.374
301 3HG1 VAL 43 3HG1 VAL 43 11.773 -0.921 -7.336
302 1HG2 VAL 43 1HG2 VAL 43 8.780 0.081 -5.401
303 2HG2 VAL 43 2HG2 VAL 43 9.505 1.533 -6.092
304 3HG2 VAL 43 3HG2 VAL 43 9.352 0.073 -7.069
305 HA PRO 44 HA PRO 44 8.703 -4.784 -6.215
306 1HB PRO 44 2HB PRO 44 6.019 -4.113 -5.858
307 2HB PRO 44 1HB PRO 44 7.000 -5.094 -4.769
308 1HG PRO 44 2HG PRO 44 6.242 -2.231 -4.581
309 2HG PRO 44 1HG PRO 44 6.519 -3.414 -3.291
310 1HD PRO 44 2HD PRO 44 8.305 -1.481 -3.906
311 2HD PRO 44 1HD PRO 44 8.794 -3.072 -3.292
312 H ASP 45 H ASP 45 8.389 -5.102 -8.284
313 HA ASP 45 HA ASP 45 7.150 -2.969 -9.897
314 1HB ASP 45 2HB ASP 45 9.507 -2.897 -10.347
315 2HB ASP 45 1HB ASP 45 9.591 -4.649 -10.502
316 H GLY 46 H GLY 46 5.558 -3.605 -11.240
317 1HA GLY 46 1HA GLY 46 4.572 -5.235 -12.742
318 2HA GLY 46 2HA GLY 46 5.228 -6.500 -11.710
319 H GLU 47 H GLU 47 3.135 -7.422 -11.517
320 HA GLU 47 HA GLU 47 0.973 -5.913 -10.384
321 1HB GLU 47 2HB GLU 47 1.086 -8.912 -10.391
322 2HB GLU 47 1HB GLU 47 -0.308 -7.857 -10.574
323 1HG GLU 47 2HG GLU 47 -0.130 -8.452 -12.726
324 2HG GLU 47 1HG GLU 47 1.072 -7.164 -12.767
325 H TRP 48 H TRP 48 1.702 -5.088 -8.448
326 HA TRP 48 HA TRP 48 2.472 -6.987 -6.349
327 1HB TRP 48 2HB TRP 48 3.946 -5.071 -6.554
328 2HB TRP 48 1HB TRP 48 2.583 -3.962 -6.484
329 HD1 TRP 48 HD TRP 48 4.584 -6.355 -4.221
330 HE1 TRP 48 1HE TRP 48 4.280 -5.590 -1.783
331 HE3 TRP 48 3HE TRP 48 1.117 -2.661 -4.951
332 HZ2 TRP 48 2HZ TRP 48 2.774 -3.672 -0.362
333 HZ3 TRP 48 3HZ TRP 48 0.295 -1.418 -2.997
334 HH2 TRP 48 HH TRP 48 1.110 -1.910 -0.754
335 H GLN 49 H GLN 49 1.305 -7.071 -4.381
336 HA GLN 49 HA GLN 49 -1.293 -5.710 -4.342
337 1HB GLN 49 2HB GLN 49 -0.868 -8.678 -3.944
338 2HB GLN 49 1HB GLN 49 -2.368 -7.831 -3.597
339 1HG GLN 49 2HG GLN 49 -2.810 -7.431 -5.844
340 2HG GLN 49 1HG GLN 49 -1.136 -7.708 -6.322
341 1HE2 GLN 49 1HE2 GLN 49 -3.000 -9.722 -4.161
342 2HE2 GLN 49 2HE2 GLN 49 -3.064 -11.112 -5.192
343 H CYS 50 H CYS 50 -1.944 -5.065 -2.336
344 HA CYS 50 HA CYS 50 -0.037 -5.323 -0.181
345 1HB CYS 50 2HB CYS 50 -1.086 -3.528 0.794
346 2HB CYS 50 1HB CYS 50 -1.526 -3.254 -0.886
347 HA PRO 51 HA PRO 51 -2.082 -8.508 2.029
348 1HB PRO 51 2HB PRO 51 -1.778 -7.316 4.637
349 2HB PRO 51 1HB PRO 51 -0.790 -8.566 3.879
350 1HG PRO 51 2HG PRO 51 0.093 -6.026 4.414
351 2HG PRO 51 1HG PRO 51 0.763 -7.062 3.144
352 1HD PRO 51 2HD PRO 51 -1.201 -4.821 2.921
353 2HD PRO 51 1HD PRO 51 0.150 -5.254 1.848
354 H ARG 52 H ARG 52 -3.703 -5.777 1.581
355 HA ARG 52 HA ARG 52 -5.780 -6.419 3.560
356 1HB ARG 52 2HB ARG 52 -4.782 -3.874 2.444
357 2HB ARG 52 1HB ARG 52 -6.520 -3.977 2.690
358 1HG ARG 52 2HG ARG 52 -4.359 -4.313 4.753
359 2HG ARG 52 1HG ARG 52 -5.544 -3.012 4.639
360 1HD ARG 52 2HD ARG 52 -7.259 -4.991 4.811
361 2HD ARG 52 1HD ARG 52 -5.895 -5.835 5.540
362 HE ARG 52 HE ARG 52 -5.842 -3.747 7.062
363 1HH1 ARG 52 2HH1 ARG 52 -8.747 -5.185 5.725
364 2HH1 ARG 52 1HH1 ARG 52 -9.736 -4.754 7.088
365 1HH2 ARG 52 2HH2 ARG 52 -7.142 -3.169 8.843
366 2HH2 ARG 52 1HH2 ARG 52 -8.830 -3.578 8.849
367 H CYS 53 H CYS 53 -5.177 -6.354 0.130
368 HA CYS 53 HA CYS 53 -7.927 -6.085 -0.616
369 1HB CYS 53 2HB CYS 53 -6.534 -7.579 -2.576
370 2HB CYS 53 1HB CYS 53 -7.031 -5.898 -2.646
371 H THR 54 H THR 54 -5.670 -8.801 -0.521
372 HA THR 54 HA THR 54 -5.944 -11.045 -0.316
373 HB THR 54 HB THR 54 -8.181 -11.174 1.451
374 HG1 THR 54 1HG THR 54 -7.740 -8.830 1.584
375 1HG2 THR 54 1HG2 THR 54 -6.702 -12.323 2.709
376 2HG2 THR 54 2HG2 THR 54 -5.474 -11.060 2.598
377 3HG2 THR 54 3HG2 THR 54 -5.677 -12.213 1.278
378 H CYS 55 H CYS 55 -6.869 -10.746 -2.616
379 HA CYS 55 HA CYS 55 -9.682 -11.501 -2.818
380 1HB CYS 55 2HB CYS 55 -8.858 -9.862 -4.425
381 2HB CYS 55 1HB CYS 55 -7.585 -10.965 -4.935
382 HG CYS 55 HG CYS 55 -10.385 -10.552 -6.357
383 HA PRO 56 HA PRO 56 -8.215 -15.730 -2.803
384 1HB PRO 56 2HB PRO 56 -10.594 -16.897 -2.389
385 2HB PRO 56 1HB PRO 56 -9.766 -16.003 -1.109
386 1HG PRO 56 2HG PRO 56 -12.024 -15.141 -2.868
387 2HG PRO 56 1HG PRO 56 -11.797 -14.877 -1.130
388 1HD PRO 56 2HD PRO 56 -11.247 -13.004 -3.063
389 2HD PRO 56 1HD PRO 56 -10.476 -13.038 -1.465
390 H ALA 57 H ALA 57 -8.414 -14.502 -5.307
391 HA ALA 57 HA ALA 57 -8.753 -14.889 -7.521
392 1HB ALA 57 1HB ALA 57 -9.162 -17.790 -7.122
393 2HB ALA 57 2HB ALA 57 -8.075 -16.934 -8.216
394 3HB ALA 57 3HB ALA 57 -7.656 -17.106 -6.512
395 H LEU 58 H LEU 58 -10.885 -13.794 -7.020
396 HA LEU 58 HA LEU 58 -13.265 -15.264 -6.764
397 1HB LEU 58 2HB LEU 58 -12.766 -12.503 -7.876
398 2HB LEU 58 1HB LEU 58 -14.366 -13.164 -7.599
399 HG LEU 58 HG LEU 58 -12.277 -12.605 -5.491
400 1HD1 LEU 58 1HD1 LEU 58 -14.717 -11.293 -4.999
401 2HD1 LEU 58 2HD1 LEU 58 -13.166 -10.574 -5.431
402 3HD1 LEU 58 3HD1 LEU 58 -14.319 -11.008 -6.694
403 1HD2 LEU 58 1HD2 LEU 58 -14.017 -14.631 -5.326
404 2HD2 LEU 58 2HD2 LEU 58 -13.537 -13.660 -3.933
405 3HD2 LEU 58 3HD2 LEU 58 -15.052 -13.316 -4.766
406 H LYS 59 H LYS 59 -11.411 -14.285 -9.568
407 HA LYS 59 HA LYS 59 -13.201 -15.927 -11.224
408 1HB LYS 59 2HB LYS 59 -12.094 -13.194 -11.811
409 2HB LYS 59 1HB LYS 59 -12.518 -14.291 -13.117
410 1HG LYS 59 2HG LYS 59 -14.795 -14.455 -11.859
411 2HG LYS 59 1HG LYS 59 -14.278 -12.929 -11.138
412 1HD LYS 59 2HD LYS 59 -14.931 -11.851 -12.965
413 2HD LYS 59 1HD LYS 59 -13.775 -12.781 -13.922
414 1HE LYS 59 2HE LYS 59 -15.911 -14.517 -13.461
415 2HE LYS 59 1HE LYS 59 -16.653 -12.962 -13.831
416 1HZ LYS 59 1HZ LYS 59 -14.509 -14.109 -15.514
417 2HZ LYS 59 2HZ LYS 59 -15.611 -12.882 -15.904
418 3HZ LYS 59 3HZ LYS 59 -16.145 -14.491 -15.763
419 H GLY 60 H GLY 60 -10.000 -14.348 -11.122
420 1HA GLY 60 1HA GLY 60 -8.668 -16.834 -11.646
421 2HA GLY 60 2HA GLY 60 -8.683 -15.780 -13.054
422 H LYS 61 H LYS 61 -7.085 -16.571 -10.211
423 HA LYS 61 HA LYS 61 -5.375 -14.197 -10.488
424 1HB LYS 61 2HB LYS 61 -6.674 -15.258 -8.017
425 2HB LYS 61 1HB LYS 61 -5.044 -14.618 -7.881
426 1HG LYS 61 2HG LYS 61 -7.480 -13.149 -8.865
427 2HG LYS 61 1HG LYS 61 -6.635 -12.903 -7.336
428 1HD LYS 61 2HD LYS 61 -5.236 -12.577 -9.971
429 2HD LYS 61 1HD LYS 61 -6.168 -11.261 -9.256
430 1HE LYS 61 2HE LYS 61 -4.457 -10.743 -7.945
431 2HE LYS 61 1HE LYS 61 -4.479 -12.362 -7.250
432 1HZ LYS 61 1HZ LYS 61 -2.599 -12.829 -8.295
433 2HZ LYS 61 2HZ LYS 61 -2.533 -11.241 -8.887
434 3HZ LYS 61 3HZ LYS 61 -3.286 -12.454 -9.801