Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
654479 | 7jh1 RC | 30777 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 1 1HT ALA 1 16.013 3.645 14.602
2 H2 ALA 1 2HT ALA 1 17.143 3.870 13.343
3 H3 ALA 1 3HT ALA 1 16.029 2.639 13.252
4 HA ALA 1 HA ALA 1 14.230 4.139 13.039
5 HB1 ALA 1 1HB ALA 1 16.331 6.313 13.160
6 HB2 ALA 1 2HB ALA 1 15.148 5.965 14.415
7 HB3 ALA 1 3HB ALA 1 14.617 6.532 12.835
8 H ARG 2 H ARG 2 13.757 5.293 10.978
9 HA ARG 2 HA ARG 2 13.727 5.384 8.769
10 HB2 ARG 2 2HB ARG 2 16.734 5.206 8.944
11 HB3 ARG 2 1HB ARG 2 15.850 5.535 7.469
12 HG2 ARG 2 2HG ARG 2 14.996 7.605 8.455
13 HG3 ARG 2 1HG ARG 2 15.908 7.267 9.930
14 HD2 ARG 2 2HD ARG 2 17.985 7.258 8.632
15 HD3 ARG 2 1HD ARG 2 17.071 7.621 7.171
16 HE ARG 2 HE ARG 2 16.434 9.593 8.938
17 HH11 ARG 2 1HH1 ARG 2 19.433 8.367 7.489
18 HH12 ARG 2 2HH1 ARG 2 20.241 9.866 7.542
19 HH21 ARG 2 1HH2 ARG 2 17.568 11.687 8.971
20 HH22 ARG 2 2HH2 ARG 2 19.168 11.773 8.380
21 H LYS 3 H LYS 3 12.627 3.550 8.396
22 HA LYS 3 HA LYS 3 14.250 1.344 7.420
23 HB2 LYS 3 2HB LYS 3 12.452 -0.229 8.148
24 HB3 LYS 3 1HB LYS 3 13.235 0.589 9.490
25 HG2 LYS 3 2HG LYS 3 11.327 2.089 9.686
26 HG3 LYS 3 1HG LYS 3 10.557 1.310 8.307
27 HD2 LYS 3 2HD LYS 3 9.594 0.458 10.370
28 HD3 LYS 3 1HD LYS 3 10.513 -0.822 9.583
29 HE2 LYS 3 2HE LYS 3 12.391 -0.403 11.107
30 HE3 LYS 3 1HE LYS 3 11.476 0.897 11.867
31 HZ1 LYS 3 1HZ LYS 3 9.832 -0.761 12.574
32 HZ2 LYS 3 2HZ LYS 3 11.366 -1.072 13.168
33 HZ3 LYS 3 3HZ LYS 3 10.779 -1.999 11.900
34 H SER 4 H SER 4 14.026 1.070 5.310
35 HA SER 4 HA SER 4 11.900 2.442 3.928
36 HB2 SER 4 2HB SER 4 14.163 0.752 2.849
37 HB3 SER 4 1HB SER 4 13.136 1.850 1.928
38 HG SER 4 HG SER 4 15.224 2.651 2.580
39 H CYS 5 H CYS 5 12.182 -0.493 5.376
40 HA CYS 5 HA CYS 5 10.350 -1.771 3.481
41 HB2 CYS 5 2HB CYS 5 12.387 -3.052 5.303
42 HB3 CYS 5 1HB CYS 5 11.234 -3.915 4.291
43 H CYS 6 H CYS 6 8.729 -3.145 4.464
44 HA CYS 6 HA CYS 6 8.083 -2.495 7.231
45 HB2 CYS 6 2HB CYS 6 6.396 -3.320 4.877
46 HB3 CYS 6 1HB CYS 6 5.787 -3.138 6.512
47 H LEU 7 H LEU 7 7.704 -4.236 8.534
48 HA LEU 7 HA LEU 7 7.977 -6.917 7.354
49 HB2 LEU 7 2HB LEU 7 8.771 -5.999 10.134
50 HB3 LEU 7 1HB LEU 7 8.762 -7.665 9.625
51 HG LEU 7 HG LEU 7 10.532 -7.060 7.918
52 HD11 LEU 7 1HD1 LEU 7 11.852 -5.043 8.297
53 HD12 LEU 7 2HD1 LEU 7 10.654 -4.493 9.473
54 HD13 LEU 7 3HD1 LEU 7 10.206 -4.674 7.782
55 HD21 LEU 7 1HD2 LEU 7 11.073 -8.201 9.982
56 HD22 LEU 7 2HD2 LEU 7 11.181 -6.660 10.829
57 HD23 LEU 7 3HD2 LEU 7 12.344 -7.054 9.560
58 H LYS 8 H LYS 8 5.748 -4.902 8.244
59 HA LYS 8 HA LYS 8 4.007 -6.946 9.336
60 HB2 LYS 8 2HB LYS 8 3.017 -5.236 10.752
61 HB3 LYS 8 1HB LYS 8 4.700 -5.531 11.200
62 HG2 LYS 8 2HG LYS 8 5.314 -3.498 9.884
63 HG3 LYS 8 1HG LYS 8 3.604 -3.211 9.607
64 HD2 LYS 8 2HD LYS 8 4.967 -3.292 12.298
65 HD3 LYS 8 1HD LYS 8 4.480 -1.840 11.438
66 HE2 LYS 8 2HE LYS 8 2.130 -2.591 11.552
67 HE3 LYS 8 1HE LYS 8 2.648 -4.003 12.469
68 HZ1 LYS 8 1HZ LYS 8 1.847 -2.251 13.916
69 HZ2 LYS 8 2HZ LYS 8 2.971 -1.183 13.304
70 HZ3 LYS 8 3HZ LYS 8 3.487 -2.534 14.194
71 H TYR 9 H TYR 9 1.757 -6.361 8.897
72 HA TYR 9 HA TYR 9 1.379 -4.398 6.753
73 HB2 TYR 9 2HB TYR 9 -0.432 -6.870 7.043
74 HB3 TYR 9 1HB TYR 9 -0.230 -5.756 5.750
75 HD1 TYR 9 1HD TYR 9 1.439 -5.984 4.126
76 HD2 TYR 9 2HD TYR 9 1.239 -8.680 7.368
77 HE1 TYR 9 1HE TYR 9 2.930 -7.531 2.926
78 HE2 TYR 9 2HE TYR 9 2.725 -10.247 6.182
79 HH TYR 9 HH TYR 9 4.434 -9.318 3.384
80 H THR 10 H THR 10 -0.631 -3.242 7.002
81 HA THR 10 HA THR 10 -1.317 -2.789 9.669
82 HB THR 10 HB THR 10 -1.434 -0.964 8.059
83 HG1 THR 10 1HG THR 10 -4.082 -0.890 8.452
84 HG21 THR 10 1HG2 THR 10 -3.203 -0.858 6.337
85 HG22 THR 10 2HG2 THR 10 -3.701 -2.499 6.761
86 HG23 THR 10 3HG2 THR 10 -2.105 -2.214 6.066
87 H LYS 11 H LYS 11 -2.979 -3.469 10.842
88 HA LYS 11 HA LYS 11 -4.449 -5.758 9.916
89 HB2 LYS 11 2HB LYS 11 -3.557 -5.678 12.210
90 HB3 LYS 11 1HB LYS 11 -4.548 -4.270 12.555
91 HG2 LYS 11 2HG LYS 11 -6.557 -5.610 12.251
92 HG3 LYS 11 1HG LYS 11 -5.568 -7.031 11.903
93 HD2 LYS 11 2HD LYS 11 -4.609 -6.903 14.147
94 HD3 LYS 11 1HD LYS 11 -5.568 -5.462 14.486
95 HE2 LYS 11 2HE LYS 11 -6.646 -8.216 13.866
96 HE3 LYS 11 1HE LYS 11 -6.611 -7.456 15.449
97 HZ1 LYS 11 1HZ LYS 11 -8.789 -7.271 14.418
98 HZ2 LYS 11 2HZ LYS 11 -8.154 -6.486 13.099
99 HZ3 LYS 11 3HZ LYS 11 -8.113 -5.754 14.623
100 H ARG 12 H ARG 12 -4.902 -2.398 10.196
101 HA ARG 12 HA ARG 12 -7.792 -2.612 9.805
102 HB2 ARG 12 2HB ARG 12 -7.124 -1.089 11.553
103 HB3 ARG 12 1HB ARG 12 -6.026 -0.259 10.457
104 HG2 ARG 12 2HG ARG 12 -7.971 0.442 9.100
105 HG3 ARG 12 1HG ARG 12 -9.032 -0.299 10.301
106 HD2 ARG 12 2HD ARG 12 -8.199 1.193 12.004
107 HD3 ARG 12 1HD ARG 12 -7.020 1.856 10.872
108 HE ARG 12 HE ARG 12 -9.750 2.099 10.017
109 HH11 ARG 12 1HH1 ARG 12 -7.119 3.618 11.830
110 HH12 ARG 12 2HH1 ARG 12 -7.726 5.201 11.659
111 HH21 ARG 12 1HH2 ARG 12 -10.597 4.296 9.810
112 HH22 ARG 12 2HH2 ARG 12 -9.750 5.586 10.515
113 HA PRO 13 HA PRO 13 -6.985 -1.847 5.383
114 HB2 PRO 13 2HB PRO 13 -9.952 -1.661 5.489
115 HB3 PRO 13 1HB PRO 13 -8.927 -2.616 4.408
116 HG2 PRO 13 2HG PRO 13 -10.277 -3.802 6.357
117 HG3 PRO 13 1HG PRO 13 -8.615 -4.289 5.979
118 HD2 PRO 13 2HD PRO 13 -9.610 -2.578 8.231
119 HD3 PRO 13 1HD PRO 13 -8.366 -3.856 8.207
120 H LEU 14 H LEU 14 -7.014 0.069 4.247
121 HA LEU 14 HA LEU 14 -7.926 2.490 5.618
122 HB2 LEU 14 2HB LEU 14 -6.238 2.066 3.160
123 HB3 LEU 14 1HB LEU 14 -6.683 3.631 3.785
124 HG LEU 14 HG LEU 14 -4.935 1.628 5.224
125 HD11 LEU 14 1HD1 LEU 14 -3.935 2.482 3.163
126 HD12 LEU 14 2HD1 LEU 14 -3.122 3.160 4.572
127 HD13 LEU 14 3HD1 LEU 14 -4.292 4.129 3.667
128 HD21 LEU 14 1HD2 LEU 14 -6.107 3.158 6.742
129 HD22 LEU 14 2HD2 LEU 14 -5.593 4.522 5.748
130 HD23 LEU 14 3HD2 LEU 14 -4.391 3.590 6.635
131 HA PRO 15 HA PRO 15 -10.938 2.949 2.263
132 HB2 PRO 15 2HB PRO 15 -11.066 5.809 2.617
133 HB3 PRO 15 1HB PRO 15 -12.237 4.613 3.175
134 HG2 PRO 15 2HG PRO 15 -10.645 6.147 4.841
135 HG3 PRO 15 1HG PRO 15 -11.395 4.611 5.297
136 HD2 PRO 15 2HD PRO 15 -8.589 5.178 4.452
137 HD3 PRO 15 1HD PRO 15 -9.205 4.034 5.669
138 H LEU 16 H LEU 16 -10.539 3.311 0.121
139 HA LEU 16 HA LEU 16 -7.964 4.117 -0.689
140 HB2 LEU 16 2HB LEU 16 -9.059 2.477 -1.955
141 HB3 LEU 16 1HB LEU 16 -10.443 3.554 -2.265
142 HG LEU 16 HG LEU 16 -8.904 4.891 -3.649
143 HD11 LEU 16 1HD1 LEU 16 -6.740 3.879 -4.275
144 HD12 LEU 16 2HD1 LEU 16 -6.979 2.645 -3.032
145 HD13 LEU 16 3HD1 LEU 16 -6.806 4.334 -2.576
146 HD21 LEU 16 1HD2 LEU 16 -9.100 1.985 -4.270
147 HD22 LEU 16 2HD2 LEU 16 -8.872 3.326 -5.435
148 HD23 LEU 16 3HD2 LEU 16 -10.351 3.214 -4.452
149 H LYS 17 H LYS 17 -10.937 5.725 -0.498
150 HA LYS 17 HA LYS 17 -10.349 8.013 -1.991
151 HB2 LYS 17 2HB LYS 17 -12.207 7.644 0.350
152 HB3 LYS 17 1HB LYS 17 -12.146 9.097 -0.637
153 HG2 LYS 17 2HG LYS 17 -12.782 7.822 -2.600
154 HG3 LYS 17 1HG LYS 17 -12.788 6.336 -1.656
155 HD2 LYS 17 2HD LYS 17 -14.584 7.211 -0.266
156 HD3 LYS 17 1HD LYS 17 -14.557 8.729 -1.157
157 HE2 LYS 17 2HE LYS 17 -15.164 7.542 -3.203
158 HE3 LYS 17 1HE LYS 17 -15.180 6.016 -2.318
159 HZ1 LYS 17 1HZ LYS 17 -17.392 6.954 -2.605
160 HZ2 LYS 17 2HZ LYS 17 -16.946 8.332 -1.753
161 HZ3 LYS 17 3HZ LYS 17 -16.986 6.832 -0.979
162 H ARG 18 H ARG 18 -8.829 6.940 0.702
163 HA ARG 18 HA ARG 18 -8.042 9.701 1.533
164 HB2 ARG 18 2HB ARG 18 -9.294 8.313 3.283
165 HB3 ARG 18 1HB ARG 18 -7.951 7.200 3.231
166 HG2 ARG 18 2HG ARG 18 -7.808 8.659 5.159
167 HG3 ARG 18 1HG ARG 18 -6.452 8.939 4.062
168 HD2 ARG 18 2HD ARG 18 -7.380 11.044 4.918
169 HD3 ARG 18 1HD ARG 18 -7.574 10.928 3.173
170 HE ARG 18 HE ARG 18 -9.881 9.908 4.282
171 HH11 ARG 18 1HH1 ARG 18 -8.250 13.050 4.282
172 HH12 ARG 18 2HH1 ARG 18 -9.674 13.936 4.466
173 HH21 ARG 18 1HH2 ARG 18 -11.806 11.108 4.532
174 HH22 ARG 18 2HH2 ARG 18 -11.762 12.819 4.628
175 H ILE 19 H ILE 19 -6.975 7.408 -0.375
176 HA ILE 19 HA ILE 19 -4.232 7.396 0.670
177 HB ILE 19 HB ILE 19 -5.443 5.526 -1.396
178 HG12 ILE 19 2HG1 ILE 19 -4.751 4.932 1.467
179 HG13 ILE 19 1HG1 ILE 19 -6.399 5.313 0.946
180 HG21 ILE 19 1HG2 ILE 19 -2.822 5.450 0.142
181 HG22 ILE 19 2HG2 ILE 19 -2.989 5.770 -1.581
182 HG23 ILE 19 3HG2 ILE 19 -3.394 4.184 -0.929
183 HD11 ILE 19 1HD1 ILE 19 -6.371 3.321 -0.496
184 HD12 ILE 19 2HD1 ILE 19 -5.985 2.873 1.165
185 HD13 ILE 19 3HD1 ILE 19 -4.717 3.048 -0.050
186 H LYS 20 H LYS 20 -2.688 8.352 -0.515
187 HA LYS 20 HA LYS 20 -3.520 9.807 -2.857
188 HB2 LYS 20 2HB LYS 20 -0.844 9.829 -1.421
189 HB3 LYS 20 1HB LYS 20 -1.331 10.929 -2.686
190 HG2 LYS 20 2HG LYS 20 -2.514 10.707 0.016
191 HG3 LYS 20 1HG LYS 20 -1.490 12.002 -0.610
192 HD2 LYS 20 2HD LYS 20 -4.234 11.227 -1.505
193 HD3 LYS 20 1HD LYS 20 -3.812 12.650 -0.597
194 HE2 LYS 20 2HE LYS 20 -2.840 12.156 -3.428
195 HE3 LYS 20 1HE LYS 20 -4.123 13.261 -2.961
196 HZ1 LYS 20 1HZ LYS 20 -2.497 14.508 -1.638
197 HZ2 LYS 20 2HZ LYS 20 -2.080 14.466 -3.249
198 HZ3 LYS 20 3HZ LYS 20 -1.253 13.498 -2.164
199 H SER 21 H SER 21 -1.085 7.307 -1.959
200 HA SER 21 HA SER 21 -0.925 6.155 -4.529
201 HB2 SER 21 2HB SER 21 1.388 7.962 -3.715
202 HB3 SER 21 1HB SER 21 1.446 6.796 -5.033
203 HG SER 21 HG SER 21 -0.684 8.511 -5.146
204 H TYR 22 H TYR 22 1.130 4.600 -4.544
205 HA TYR 22 HA TYR 22 1.820 3.792 -1.795
206 HB2 TYR 22 2HB TYR 22 1.450 1.482 -2.285
207 HB3 TYR 22 1HB TYR 22 -0.040 2.353 -2.573
208 HD1 TYR 22 1HD TYR 22 -1.118 2.107 -4.586
209 HD2 TYR 22 2HD TYR 22 2.907 0.867 -4.358
210 HE1 TYR 22 1HE TYR 22 -1.313 1.079 -6.787
211 HE2 TYR 22 2HE TYR 22 2.731 -0.158 -6.590
212 HH TYR 22 HH TYR 22 0.119 0.468 -8.630
213 H THR 23 H THR 23 3.486 2.141 -1.820
214 HA THR 23 HA THR 23 5.429 2.465 -4.004
215 HB THR 23 HB THR 23 5.993 2.177 -1.042
216 HG1 THR 23 1HG THR 23 5.129 4.275 -1.967
217 HG21 THR 23 1HG2 THR 23 7.682 1.187 -2.489
218 HG22 THR 23 2HG2 THR 23 8.324 2.622 -1.678
219 HG23 THR 23 3HG2 THR 23 7.842 2.697 -3.383
220 H ILE 24 H ILE 24 6.346 0.479 -4.683
221 HA ILE 24 HA ILE 24 5.101 -1.889 -3.562
222 HB ILE 24 HB ILE 24 6.887 -1.617 -6.006
223 HG12 ILE 24 2HG1 ILE 24 3.882 -1.937 -5.778
224 HG13 ILE 24 1HG1 ILE 24 4.743 -0.488 -6.286
225 HG21 ILE 24 1HG2 ILE 24 5.276 -3.982 -5.030
226 HG22 ILE 24 2HG2 ILE 24 7.033 -3.852 -5.038
227 HG23 ILE 24 3HG2 ILE 24 6.146 -3.898 -6.564
228 HD11 ILE 24 1HD1 ILE 24 4.712 -3.122 -7.748
229 HD12 ILE 24 2HD1 ILE 24 5.557 -1.663 -8.266
230 HD13 ILE 24 3HD1 ILE 24 3.794 -1.682 -8.189
231 H GLN 25 H GLN 25 6.080 -2.752 -1.875
232 HA GLN 25 HA GLN 25 8.973 -2.718 -1.696
233 HB2 GLN 25 2HB GLN 25 7.975 -2.291 0.381
234 HB3 GLN 25 1HB GLN 25 6.774 -3.548 0.202
235 HG2 GLN 25 2HG GLN 25 8.498 -5.228 0.472
236 HG3 GLN 25 1HG GLN 25 9.707 -3.956 0.636
237 HE21 GLN 25 1HE2 GLN 25 8.704 -6.080 2.466
238 HE22 GLN 25 2HE2 GLN 25 8.314 -5.246 3.924
239 H SER 26 H SER 26 10.148 -4.289 -2.490
240 HA SER 26 HA SER 26 8.819 -6.641 -3.437
241 HB2 SER 26 2HB SER 26 11.035 -7.096 -4.469
242 HB3 SER 26 1HB SER 26 10.367 -5.530 -4.931
243 HG SER 26 HG SER 26 12.475 -5.174 -4.390
244 H ASN 27 H ASN 27 9.171 -8.724 -2.656
245 HA ASN 27 HA ASN 27 10.118 -9.097 -0.032
246 HB2 ASN 27 2HB ASN 27 8.258 -10.254 -1.317
247 HB3 ASN 27 1HB ASN 27 9.502 -11.047 -2.253
248 HD21 ASN 27 1HD2 ASN 27 7.383 -11.980 -0.508
249 HD22 ASN 27 2HD2 ASN 27 8.171 -12.995 0.634
250 H GLU 28 H GLU 28 11.466 -8.811 -3.057
251 HA GLU 28 HA GLU 28 13.731 -10.487 -2.965
252 HB2 GLU 28 2HB GLU 28 12.763 -9.596 -5.000
253 HB3 GLU 28 1HB GLU 28 13.085 -7.961 -4.458
254 HG2 GLU 28 2HG GLU 28 15.459 -8.428 -4.527
255 HG3 GLU 28 1HG GLU 28 15.110 -10.047 -5.142
256 H ALA 29 H ALA 29 13.144 -7.029 -2.230
257 HA ALA 29 HA ALA 29 15.896 -6.752 -1.276
258 HB1 ALA 29 1HB ALA 29 15.500 -4.352 -1.352
259 HB2 ALA 29 2HB ALA 29 13.810 -4.634 -1.763
260 HB3 ALA 29 3HB ALA 29 15.082 -5.108 -2.890
261 H CYS 30 H CYS 30 12.649 -6.814 -0.107
262 HA CYS 30 HA CYS 30 13.623 -6.149 2.585
263 HB2 CYS 30 2HB CYS 30 10.857 -5.939 1.414
264 HB3 CYS 30 1HB CYS 30 11.323 -5.496 3.051
265 H ASN 31 H ASN 31 12.401 -7.377 4.315
266 HA ASN 31 HA ASN 31 12.682 -10.121 3.940
267 HB2 ASN 31 2HB ASN 31 11.078 -8.656 6.040
268 HB3 ASN 31 1HB ASN 31 11.346 -10.391 6.059
269 HD21 ASN 31 1HD2 ASN 31 12.441 -10.333 8.004
270 HD22 ASN 31 2HD2 ASN 31 14.017 -9.658 8.148
271 H ILE 32 H ILE 32 9.799 -8.160 3.691
272 HA ILE 32 HA ILE 32 8.409 -10.502 2.571
273 HB ILE 32 HB ILE 32 6.316 -9.776 3.624
274 HG12 ILE 32 2HG1 ILE 32 7.977 -7.625 4.956
275 HG13 ILE 32 1HG1 ILE 32 6.814 -7.354 3.669
276 HG21 ILE 32 1HG2 ILE 32 8.549 -9.923 5.602
277 HG22 ILE 32 2HG2 ILE 32 7.756 -11.318 4.861
278 HG23 ILE 32 3HG2 ILE 32 6.852 -10.255 5.964
279 HD11 ILE 32 1HD1 ILE 32 6.200 -8.396 6.422
280 HD12 ILE 32 2HD1 ILE 32 5.022 -8.120 5.136
281 HD13 ILE 32 3HD1 ILE 32 5.901 -6.760 5.835
282 H LYS 33 H LYS 33 6.415 -9.697 1.364
283 HA LYS 33 HA LYS 33 7.077 -7.218 -0.017
284 HB2 LYS 33 2HB LYS 33 6.638 -9.176 -1.470
285 HB3 LYS 33 1HB LYS 33 5.057 -9.374 -0.726
286 HG2 LYS 33 2HG LYS 33 4.356 -7.217 -1.630
287 HG3 LYS 33 1HG LYS 33 5.956 -6.990 -2.322
288 HD2 LYS 33 2HD LYS 33 5.635 -8.949 -3.743
289 HD3 LYS 33 1HD LYS 33 4.040 -9.208 -3.034
290 HE2 LYS 33 2HE LYS 33 3.287 -7.058 -3.883
291 HE3 LYS 33 1HE LYS 33 4.887 -6.736 -4.546
292 HZ1 LYS 33 1HZ LYS 33 3.124 -8.978 -5.367
293 HZ2 LYS 33 2HZ LYS 33 4.613 -8.577 -6.057
294 HZ3 LYS 33 3HZ LYS 33 3.307 -7.533 -6.205
295 H ALA 34 H ALA 34 6.090 -5.467 0.793
296 HA ALA 34 HA ALA 34 3.319 -5.665 1.671
297 HB1 ALA 34 1HB ALA 34 4.675 -5.806 3.750
298 HB2 ALA 34 2HB ALA 34 3.780 -4.303 3.681
299 HB3 ALA 34 3HB ALA 34 5.498 -4.314 3.298
300 H ILE 35 H ILE 35 2.269 -4.231 0.421
301 HA ILE 35 HA ILE 35 3.692 -2.159 -0.958
302 HB ILE 35 HB ILE 35 0.699 -2.588 -0.675
303 HG12 ILE 35 2HG1 ILE 35 1.855 -4.468 -1.717
304 HG13 ILE 35 1HG1 ILE 35 0.810 -3.648 -2.877
305 HG21 ILE 35 1HG2 ILE 35 0.495 -1.150 -2.716
306 HG22 ILE 35 2HG2 ILE 35 2.217 -0.846 -2.641
307 HG23 ILE 35 3HG2 ILE 35 1.173 -0.291 -1.343
308 HD11 ILE 35 1HD1 ILE 35 2.842 -4.313 -3.896
309 HD12 ILE 35 2HD1 ILE 35 3.813 -3.494 -2.659
310 HD13 ILE 35 3HD1 ILE 35 2.837 -2.550 -3.791
311 H ILE 36 H ILE 36 3.998 -0.066 -0.359
312 HA ILE 36 HA ILE 36 2.973 0.595 2.279
313 HB ILE 36 HB ILE 36 5.141 2.037 0.712
314 HG12 ILE 36 2HG1 ILE 36 6.618 1.157 2.653
315 HG13 ILE 36 1HG1 ILE 36 5.336 -0.025 2.889
316 HG21 ILE 36 1HG2 ILE 36 4.013 3.538 2.201
317 HG22 ILE 36 2HG2 ILE 36 5.655 3.169 2.764
318 HG23 ILE 36 3HG2 ILE 36 4.268 2.410 3.549
319 HD11 ILE 36 1HD1 ILE 36 5.662 -0.803 0.623
320 HD12 ILE 36 2HD1 ILE 36 7.142 -0.894 1.597
321 HD13 ILE 36 3HD1 ILE 36 6.926 0.418 0.415
322 H PHE 37 H PHE 37 1.238 1.613 2.284
323 HA PHE 37 HA PHE 37 0.284 3.233 0.096
324 HB2 PHE 37 2HB PHE 37 -0.800 2.195 2.678
325 HB3 PHE 37 1HB PHE 37 -1.645 3.458 1.784
326 HD1 PHE 37 1HD PHE 37 0.127 0.439 0.504
327 HD2 PHE 37 2HD PHE 37 -3.492 2.442 1.131
328 HE1 PHE 37 1HE PHE 37 -1.083 -1.297 -0.863
329 HE2 PHE 37 2HE PHE 37 -4.696 0.752 -0.208
330 HZ PHE 37 HZ PHE 37 -3.479 -1.102 -1.191
331 H THR 38 H THR 38 0.076 5.369 0.201
332 HA THR 38 HA THR 38 0.851 6.651 2.710
333 HB THR 38 HB THR 38 1.294 7.726 -0.100
334 HG1 THR 38 1HG THR 38 2.622 5.934 1.333
335 HG21 THR 38 1HG2 THR 38 1.000 9.443 1.585
336 HG22 THR 38 2HG2 THR 38 2.709 9.390 1.112
337 HG23 THR 38 3HG2 THR 38 2.164 8.659 2.631
338 H THR 39 H THR 39 -0.656 8.049 3.527
339 HA THR 39 HA THR 39 -3.158 8.135 2.073
340 HB THR 39 HB THR 39 -4.017 9.172 4.202
341 HG1 THR 39 1HG THR 39 -2.618 8.658 6.037
342 HG21 THR 39 1HG2 THR 39 -4.385 6.818 3.703
343 HG22 THR 39 2HG2 THR 39 -4.053 7.009 5.427
344 HG23 THR 39 3HG2 THR 39 -2.797 6.416 4.344
345 H LYS 40 H LYS 40 -4.409 10.286 2.507
346 HA LYS 40 HA LYS 40 -2.995 12.305 1.173
347 HB2 LYS 40 2HB LYS 40 -5.452 12.647 2.842
348 HB3 LYS 40 1HB LYS 40 -4.948 13.734 1.547
349 HG2 LYS 40 2HG LYS 40 -5.219 11.440 0.094
350 HG3 LYS 40 1HG LYS 40 -6.214 11.061 1.447
351 HD2 LYS 40 2HD LYS 40 -7.675 12.907 1.102
352 HD3 LYS 40 1HD LYS 40 -6.558 13.563 -0.119
353 HE2 LYS 40 2HE LYS 40 -6.940 11.688 -1.554
354 HE3 LYS 40 1HE LYS 40 -7.980 10.931 -0.358
355 HZ1 LYS 40 1HZ LYS 40 -9.538 12.776 -0.616
356 HZ2 LYS 40 2HZ LYS 40 -9.240 12.005 -2.087
357 HZ3 LYS 40 3HZ LYS 40 -8.523 13.485 -1.767
358 H LYS 41 H LYS 41 -3.240 11.525 4.518
359 HA LYS 41 HA LYS 41 -2.184 14.032 5.437
360 HB2 LYS 41 2HB LYS 41 -2.381 11.334 6.788
361 HB3 LYS 41 1HB LYS 41 -1.633 12.708 7.562
362 HG2 LYS 41 2HG LYS 41 -3.831 12.511 8.433
363 HG3 LYS 41 1HG LYS 41 -3.846 13.893 7.355
364 HD2 LYS 41 2HD LYS 41 -4.891 12.521 5.615
365 HD3 LYS 41 1HD LYS 41 -4.850 11.124 6.687
366 HE2 LYS 41 2HE LYS 41 -6.355 13.695 7.208
367 HE3 LYS 41 1HE LYS 41 -7.073 12.178 6.678
368 HZ1 LYS 41 1HZ LYS 41 -5.688 12.651 9.272
369 HZ2 LYS 41 2HZ LYS 41 -6.306 11.177 8.784
370 HZ3 LYS 41 3HZ LYS 41 -7.345 12.474 9.041
371 H GLY 42 H GLY 42 -1.011 11.480 3.733
372 HA2 GLY 42 2HA GLY 42 1.020 11.193 2.808
373 HA3 GLY 42 1HA GLY 42 1.629 12.508 3.777
374 H ARG 43 H ARG 43 0.014 10.095 5.530
375 HA ARG 43 HA ARG 43 2.331 9.310 6.932
376 HB2 ARG 43 2HB ARG 43 0.059 9.593 7.869
377 HB3 ARG 43 1HB ARG 43 -0.460 8.255 6.849
378 HG2 ARG 43 2HG ARG 43 1.004 6.764 7.976
379 HG3 ARG 43 1HG ARG 43 1.614 8.085 8.988
380 HD2 ARG 43 2HD ARG 43 -0.644 8.376 9.933
381 HD3 ARG 43 1HD ARG 43 -1.229 7.042 8.939
382 HE ARG 43 HE ARG 43 0.973 6.248 10.503
383 HH11 ARG 43 1HH1 ARG 43 -2.493 6.963 10.810
384 HH12 ARG 43 2HH1 ARG 43 -2.761 5.900 12.105
385 HH21 ARG 43 1HH2 ARG 43 0.616 4.805 12.334
386 HH22 ARG 43 2HH2 ARG 43 -0.931 4.659 13.013
387 H LYS 44 H LYS 44 3.239 7.200 6.909
388 HA LYS 44 HA LYS 44 2.813 5.688 4.446
389 HB2 LYS 44 2HB LYS 44 4.966 5.474 6.558
390 HB3 LYS 44 1HB LYS 44 4.898 4.497 5.102
391 HG2 LYS 44 2HG LYS 44 5.246 7.492 5.212
392 HG3 LYS 44 1HG LYS 44 6.509 6.311 4.873
393 HD2 LYS 44 2HD LYS 44 5.265 5.585 2.869
394 HD3 LYS 44 1HD LYS 44 4.040 6.806 3.206
395 HE2 LYS 44 2HE LYS 44 5.569 7.581 1.498
396 HE3 LYS 44 1HE LYS 44 5.732 8.562 2.951
397 HZ1 LYS 44 1HZ LYS 44 7.525 6.317 2.214
398 HZ2 LYS 44 2HZ LYS 44 7.756 7.382 3.512
399 HZ3 LYS 44 3HZ LYS 44 7.875 7.927 1.929
400 H ILE 45 H ILE 45 1.714 3.862 4.427
401 HA ILE 45 HA ILE 45 1.194 2.460 6.966
402 HB ILE 45 HB ILE 45 -0.709 2.633 4.596
403 HG12 ILE 45 2HG1 ILE 45 -2.277 3.848 6.250
404 HG13 ILE 45 1HG1 ILE 45 -0.838 4.090 7.248
405 HG21 ILE 45 1HG2 ILE 45 -1.098 1.376 7.294
406 HG22 ILE 45 2HG2 ILE 45 -0.911 0.543 5.754
407 HG23 ILE 45 3HG2 ILE 45 -2.343 1.532 6.055
408 HD11 ILE 45 1HD1 ILE 45 -1.441 6.012 5.961
409 HD12 ILE 45 2HD1 ILE 45 -1.257 5.083 4.467
410 HD13 ILE 45 3HD1 ILE 45 0.148 5.401 5.493
411 H CYS 46 H CYS 46 1.700 0.329 6.894
412 HA CYS 46 HA CYS 46 2.696 -0.778 4.365
413 HB2 CYS 46 2HB CYS 46 2.720 -1.911 7.167
414 HB3 CYS 46 1HB CYS 46 3.641 -2.549 5.817
415 H ALA 47 H ALA 47 1.215 -1.892 3.126
416 HA ALA 47 HA ALA 47 -0.975 -3.151 4.635
417 HB1 ALA 47 1HB ALA 47 -1.075 -2.030 1.838
418 HB2 ALA 47 2HB ALA 47 -1.735 -1.258 3.279
419 HB3 ALA 47 3HB ALA 47 -2.411 -2.784 2.707
420 H ASN 48 H ASN 48 -1.754 -5.167 3.945
421 HA ASN 48 HA ASN 48 0.252 -6.839 2.823
422 HB2 ASN 48 2HB ASN 48 -0.972 -7.751 4.603
423 HB3 ASN 48 1HB ASN 48 -2.524 -7.342 3.931
424 HD21 ASN 48 1HD2 ASN 48 0.214 -8.943 2.323
425 HD22 ASN 48 2HD2 ASN 48 -0.677 -10.410 2.044
426 HA PRO 49 HA PRO 49 -0.835 -6.088 -1.452
427 HB2 PRO 49 2HB PRO 49 0.972 -8.382 -1.835
428 HB3 PRO 49 1HB PRO 49 1.059 -6.759 -2.524
429 HG2 PRO 49 2HG PRO 49 2.668 -7.705 -0.558
430 HG3 PRO 49 1HG PRO 49 2.329 -5.992 -0.762
431 HD2 PRO 49 2HD PRO 49 1.400 -7.874 1.282
432 HD3 PRO 49 1HD PRO 49 1.476 -6.112 1.322
433 H ASN 50 H ASN 50 -1.110 -8.988 0.368
434 HA ASN 50 HA ASN 50 -2.360 -10.500 -1.703
435 HB2 ASN 50 2HB ASN 50 -2.300 -11.079 1.267
436 HB3 ASN 50 1HB ASN 50 -2.871 -12.140 -0.020
437 HD21 ASN 50 1HD2 ASN 50 -0.732 -11.551 -1.885
438 HD22 ASN 50 2HD2 ASN 50 0.685 -12.272 -1.227
439 H GLU 51 H GLU 51 -3.426 -8.017 0.369
440 HA GLU 51 HA GLU 51 -6.026 -9.057 0.906
441 HB2 GLU 51 2HB GLU 51 -5.053 -6.227 1.240
442 HB3 GLU 51 1HB GLU 51 -6.519 -6.918 1.912
443 HG2 GLU 51 2HG GLU 51 -4.862 -8.584 3.139
444 HG3 GLU 51 1HG GLU 51 -3.722 -7.440 2.523
445 H LYS 52 H LYS 52 -7.851 -8.727 -0.051
446 HA LYS 52 HA LYS 52 -7.923 -8.178 -2.770
447 HB2 LYS 52 2HB LYS 52 -9.522 -9.620 -1.606
448 HB3 LYS 52 1HB LYS 52 -10.191 -8.230 -0.782
449 HG2 LYS 52 2HG LYS 52 -10.995 -7.342 -2.889
450 HG3 LYS 52 1HG LYS 52 -10.254 -8.693 -3.750
451 HD2 LYS 52 2HD LYS 52 -11.662 -10.257 -2.488
452 HD3 LYS 52 1HD LYS 52 -12.426 -8.895 -1.670
453 HE2 LYS 52 2HE LYS 52 -13.266 -8.067 -3.782
454 HE3 LYS 52 1HE LYS 52 -12.437 -9.369 -4.639
455 HZ1 LYS 52 1HZ LYS 52 -14.630 -9.735 -2.660
456 HZ2 LYS 52 2HZ LYS 52 -13.801 -10.956 -3.496
457 HZ3 LYS 52 3HZ LYS 52 -14.755 -9.892 -4.348
458 H TRP 53 H TRP 53 -8.576 -6.038 -0.026
459 HA TRP 53 HA TRP 53 -9.658 -3.955 -1.622
460 HB2 TRP 53 2HB TRP 53 -9.486 -2.490 0.320
461 HB3 TRP 53 1HB TRP 53 -10.051 -4.060 0.851
462 HD1 TRP 53 HD TRP 53 -8.187 -5.557 2.328
463 HE1 TRP 53 1HE TRP 53 -6.312 -4.808 3.795
464 HE3 TRP 53 3HE TRP 53 -7.717 -0.755 0.602
465 HZ2 TRP 53 2HZ TRP 53 -4.747 -2.472 4.219
466 HZ3 TRP 53 3HZ TRP 53 -5.984 0.660 1.605
467 HH2 TRP 53 HH TRP 53 -4.528 -0.181 3.382
468 H VAL 54 H VAL 54 -6.464 -4.902 -0.746
469 HA VAL 54 HA VAL 54 -5.136 -2.531 -1.526
470 HB VAL 54 HB VAL 54 -4.087 -5.361 -1.132
471 HG11 VAL 54 1HG1 VAL 54 -2.516 -2.801 -1.505
472 HG12 VAL 54 2HG1 VAL 54 -2.566 -4.156 -2.631
473 HG13 VAL 54 3HG1 VAL 54 -1.848 -4.355 -1.032
474 HG21 VAL 54 1HG2 VAL 54 -3.904 -2.902 0.583
475 HG22 VAL 54 2HG2 VAL 54 -3.246 -4.496 0.975
476 HG23 VAL 54 3HG2 VAL 54 -4.993 -4.255 0.846
477 H GLN 55 H GLN 55 -6.113 -5.458 -3.168
478 HA GLN 55 HA GLN 55 -4.710 -5.140 -5.605
479 HB2 GLN 55 2HB GLN 55 -7.559 -6.136 -5.353
480 HB3 GLN 55 1HB GLN 55 -6.413 -6.519 -6.621
481 HG2 GLN 55 2HG GLN 55 -6.267 -7.393 -3.754
482 HG3 GLN 55 1HG GLN 55 -6.742 -8.397 -5.120
483 HE21 GLN 55 1HE2 GLN 55 -4.685 -8.820 -3.208
484 HE22 GLN 55 2HE2 GLN 55 -3.190 -8.865 -4.035
485 H LYS 56 H LYS 56 -7.881 -4.009 -4.564
486 HA LYS 56 HA LYS 56 -8.597 -2.607 -6.910
487 HB2 LYS 56 2HB LYS 56 -9.453 -2.103 -4.063
488 HB3 LYS 56 1HB LYS 56 -10.236 -1.458 -5.494
489 HG2 LYS 56 2HG LYS 56 -10.847 -3.705 -6.189
490 HG3 LYS 56 1HG LYS 56 -10.024 -4.374 -4.775
491 HD2 LYS 56 2HD LYS 56 -11.522 -3.109 -3.313
492 HD3 LYS 56 1HD LYS 56 -12.336 -2.454 -4.734
493 HE2 LYS 56 2HE LYS 56 -12.195 -5.370 -3.974
494 HE3 LYS 56 1HE LYS 56 -13.563 -4.302 -3.704
495 HZ1 LYS 56 1HZ LYS 56 -12.459 -5.093 -6.346
496 HZ2 LYS 56 2HZ LYS 56 -13.730 -4.008 -6.120
497 HZ3 LYS 56 3HZ LYS 56 -13.908 -5.615 -5.662
498 H ALA 57 H ALA 57 -7.139 -1.572 -3.867
499 HA ALA 57 HA ALA 57 -6.895 1.144 -4.452
500 HB1 ALA 57 1HB ALA 57 -5.229 1.213 -2.674
501 HB2 ALA 57 2HB ALA 57 -5.102 -0.534 -2.672
502 HB3 ALA 57 3HB ALA 57 -6.622 0.255 -2.193
503 H MET 58 H MET 58 -4.511 -1.480 -4.876
504 HA MET 58 HA MET 58 -2.587 0.130 -5.871
505 HB2 MET 58 2HB MET 58 -3.021 -2.794 -6.224
506 HB3 MET 58 1HB MET 58 -1.653 -2.026 -7.000
507 HG2 MET 58 2HG MET 58 -1.098 -1.143 -4.652
508 HG3 MET 58 1HG MET 58 -2.260 -2.331 -4.083
509 HE1 MET 58 1HE MET 58 -0.570 -5.685 -5.277
510 HE2 MET 58 2HE MET 58 -1.777 -4.772 -6.193
511 HE3 MET 58 3HE MET 58 -1.972 -5.011 -4.447
512 H LYS 59 H LYS 59 -5.180 -1.497 -7.674
513 HA LYS 59 HA LYS 59 -4.075 -0.877 -10.176
514 HB2 LYS 59 2HB LYS 59 -5.790 -2.651 -9.721
515 HB3 LYS 59 1HB LYS 59 -6.973 -1.375 -9.487
516 HG2 LYS 59 2HG LYS 59 -6.656 -0.624 -11.764
517 HG3 LYS 59 1HG LYS 59 -5.412 -1.849 -12.002
518 HD2 LYS 59 2HD LYS 59 -7.133 -3.581 -11.479
519 HD3 LYS 59 1HD LYS 59 -8.339 -2.299 -11.476
520 HE2 LYS 59 2HE LYS 59 -8.281 -3.433 -13.643
521 HE3 LYS 59 1HE LYS 59 -7.788 -1.749 -13.789
522 HZ1 LYS 59 1HZ LYS 59 -5.902 -4.048 -13.635
523 HZ2 LYS 59 2HZ LYS 59 -5.479 -2.436 -13.905
524 HZ3 LYS 59 3HZ LYS 59 -6.366 -3.279 -15.044
525 H HIS 60 H HIS 60 -6.223 0.787 -7.968
526 HA HIS 60 HA HIS 60 -7.003 2.812 -9.791
527 HB2 HIS 60 2HB HIS 60 -8.439 2.241 -7.952
528 HB3 HIS 60 1HB HIS 60 -7.165 2.554 -6.791
529 HD1 HIS 60 1HD HIS 60 -9.554 4.372 -9.098
530 HD2 HIS 60 2HD HIS 60 -7.050 5.053 -5.879
531 HE1 HIS 60 1HE HIS 60 -10.051 6.720 -8.368
532 HE2 HIS 60 2HE HIS 60 -8.284 7.210 -6.642
533 H LEU 61 H LEU 61 -4.519 2.534 -7.319
534 HA LEU 61 HA LEU 61 -3.640 5.257 -7.563
535 HB2 LEU 61 2HB LEU 61 -2.344 2.865 -6.280
536 HB3 LEU 61 1HB LEU 61 -1.813 4.522 -6.084
537 HG LEU 61 HG LEU 61 -4.497 3.465 -5.212
538 HD11 LEU 61 1HD1 LEU 61 -2.009 4.017 -3.609
539 HD12 LEU 61 2HD1 LEU 61 -2.826 2.455 -3.846
540 HD13 LEU 61 3HD1 LEU 61 -3.613 3.734 -2.941
541 HD21 LEU 61 1HD2 LEU 61 -3.150 6.120 -4.709
542 HD22 LEU 61 2HD2 LEU 61 -4.664 5.584 -3.988
543 HD23 LEU 61 3HD2 LEU 61 -4.564 5.838 -5.728
544 H ASP 62 H ASP 62 -2.855 2.259 -9.114
545 HA ASP 62 HA ASP 62 -0.316 3.013 -10.207
546 HB2 ASP 62 2HB ASP 62 -1.025 0.652 -9.891
547 HB3 ASP 62 1HB ASP 62 -2.287 0.884 -11.075
548 H LYS 63 H LYS 63 -3.511 3.741 -10.936
549 HA LYS 63 HA LYS 63 -3.343 4.178 -13.732
550 HB2 LYS 63 2HB LYS 63 -5.271 5.171 -11.661
551 HB3 LYS 63 1HB LYS 63 -5.468 5.449 -13.381
552 HG2 LYS 63 2HG LYS 63 -5.624 3.078 -13.768
553 HG3 LYS 63 1HG LYS 63 -5.304 2.761 -12.066
554 HD2 LYS 63 2HD LYS 63 -7.361 3.968 -11.468
555 HD3 LYS 63 1HD LYS 63 -7.678 4.244 -13.176
556 HE2 LYS 63 2HE LYS 63 -7.402 1.535 -11.897
557 HE3 LYS 63 1HE LYS 63 -8.936 2.308 -12.267
558 HZ1 LYS 63 1HZ LYS 63 -6.848 1.540 -14.238
559 HZ2 LYS 63 2HZ LYS 63 -8.252 2.355 -14.626
560 HZ3 LYS 63 3HZ LYS 63 -8.337 0.780 -14.024
561 H LYS 64 H LYS 64 -2.361 6.047 -10.989
562 HA LYS 64 HA LYS 64 -1.962 8.293 -12.789
563 HB2 LYS 64 2HB LYS 64 -3.983 8.662 -11.408
564 HB3 LYS 64 1HB LYS 64 -3.007 8.491 -9.961
565 HG2 LYS 64 2HG LYS 64 -1.747 10.472 -10.557
566 HG3 LYS 64 1HG LYS 64 -2.664 10.614 -12.061
567 HD2 LYS 64 2HD LYS 64 -4.726 10.852 -10.767
568 HD3 LYS 64 1HD LYS 64 -3.798 10.760 -9.270
569 HE2 LYS 64 2HE LYS 64 -2.571 12.773 -9.915
570 HE3 LYS 64 1HE LYS 64 -3.483 12.840 -11.421
571 HZ1 LYS 64 1HZ LYS 64 -4.372 14.345 -9.778
572 HZ2 LYS 64 2HZ LYS 64 -4.614 13.099 -8.693
573 HZ3 LYS 64 3HZ LYS 64 -5.499 13.148 -10.145
Start of MODEL 2
1 H1 ALA 1 1HT ALA 1 19.400 6.151 9.717
2 H2 ALA 1 2HT ALA 1 17.989 5.760 8.890
3 H3 ALA 1 3HT ALA 1 19.401 4.857 8.654
4 HA ALA 1 HA ALA 1 19.371 4.068 10.893
5 HB1 ALA 1 1HB ALA 1 18.374 6.064 11.901
6 HB2 ALA 1 2HB ALA 1 17.524 4.599 12.388
7 HB3 ALA 1 3HB ALA 1 16.825 5.657 11.164
8 H ARG 2 H ARG 2 18.040 3.705 8.061
9 HA ARG 2 HA ARG 2 16.974 2.130 6.971
10 HB2 ARG 2 2HB ARG 2 17.256 0.594 9.557
11 HB3 ARG 2 1HB ARG 2 16.487 -0.114 8.157
12 HG2 ARG 2 2HG ARG 2 18.729 -0.884 8.262
13 HG3 ARG 2 1HG ARG 2 18.609 0.224 6.899
14 HD2 ARG 2 2HD ARG 2 20.658 0.598 8.122
15 HD3 ARG 2 1HD ARG 2 19.588 1.992 8.302
16 HE ARG 2 HE ARG 2 18.968 0.609 10.466
17 HH11 ARG 2 1HH1 ARG 2 22.143 1.421 9.142
18 HH12 ARG 2 2HH1 ARG 2 22.922 1.358 10.665
19 HH21 ARG 2 1HH2 ARG 2 20.049 0.574 12.532
20 HH22 ARG 2 2HH2 ARG 2 21.726 0.876 12.591
21 H LYS 3 H LYS 3 15.004 0.355 7.572
22 HA LYS 3 HA LYS 3 12.902 0.060 7.716
23 HB2 LYS 3 2HB LYS 3 12.957 0.912 10.048
24 HB3 LYS 3 1HB LYS 3 12.681 2.538 9.443
25 HG2 LYS 3 2HG LYS 3 10.498 1.885 8.613
26 HG3 LYS 3 1HG LYS 3 10.774 0.224 9.144
27 HD2 LYS 3 2HD LYS 3 10.962 1.018 11.459
28 HD3 LYS 3 1HD LYS 3 10.634 2.663 10.914
29 HE2 LYS 3 2HE LYS 3 8.442 1.964 10.093
30 HE3 LYS 3 1HE LYS 3 8.778 0.310 10.597
31 HZ1 LYS 3 1HZ LYS 3 7.402 1.439 12.194
32 HZ2 LYS 3 2HZ LYS 3 8.556 2.654 12.406
33 HZ3 LYS 3 3HZ LYS 3 8.882 1.067 12.882
34 H SER 4 H SER 4 13.445 0.528 5.565
35 HA SER 4 HA SER 4 11.678 2.595 4.448
36 HB2 SER 4 2HB SER 4 13.849 0.947 3.110
37 HB3 SER 4 1HB SER 4 12.968 2.300 2.397
38 HG SER 4 HG SER 4 15.139 2.657 3.285
39 H CYS 5 H CYS 5 11.967 -0.517 5.385
40 HA CYS 5 HA CYS 5 10.073 -1.596 3.445
41 HB2 CYS 5 2HB CYS 5 12.108 -3.020 5.164
42 HB3 CYS 5 1HB CYS 5 10.948 -3.801 4.100
43 H CYS 6 H CYS 6 8.513 -3.073 4.435
44 HA CYS 6 HA CYS 6 7.899 -2.391 7.188
45 HB2 CYS 6 2HB CYS 6 6.225 -3.226 4.859
46 HB3 CYS 6 1HB CYS 6 5.602 -3.027 6.496
47 H LEU 7 H LEU 7 7.609 -3.997 8.538
48 HA LEU 7 HA LEU 7 8.052 -6.745 7.595
49 HB2 LEU 7 2HB LEU 7 8.516 -5.562 10.345
50 HB3 LEU 7 1HB LEU 7 8.678 -7.260 9.972
51 HG LEU 7 HG LEU 7 10.846 -6.344 10.124
52 HD11 LEU 7 1HD1 LEU 7 10.610 -7.967 8.395
53 HD12 LEU 7 2HD1 LEU 7 11.812 -6.758 7.940
54 HD13 LEU 7 3HD1 LEU 7 10.200 -6.714 7.226
55 HD21 LEU 7 1HD2 LEU 7 11.664 -4.464 8.751
56 HD22 LEU 7 2HD2 LEU 7 10.362 -3.975 9.837
57 HD23 LEU 7 3HD2 LEU 7 10.032 -4.227 8.124
58 H LYS 8 H LYS 8 5.716 -4.654 8.714
59 HA LYS 8 HA LYS 8 3.978 -6.906 9.395
60 HB2 LYS 8 2HB LYS 8 3.892 -4.148 10.688
61 HB3 LYS 8 1HB LYS 8 2.696 -5.398 10.911
62 HG2 LYS 8 2HG LYS 8 4.022 -5.404 12.866
63 HG3 LYS 8 1HG LYS 8 4.526 -6.813 11.945
64 HD2 LYS 8 2HD LYS 8 6.473 -5.736 12.850
65 HD3 LYS 8 1HD LYS 8 6.468 -5.474 11.103
66 HE2 LYS 8 2HE LYS 8 5.521 -3.220 11.489
67 HE3 LYS 8 1HE LYS 8 5.585 -3.512 13.222
68 HZ1 LYS 8 1HZ LYS 8 7.472 -2.234 12.522
69 HZ2 LYS 8 2HZ LYS 8 7.916 -3.349 11.380
70 HZ3 LYS 8 3HZ LYS 8 8.025 -3.742 13.025
71 H TYR 9 H TYR 9 1.686 -6.397 8.949
72 HA TYR 9 HA TYR 9 1.380 -4.377 6.850
73 HB2 TYR 9 2HB TYR 9 -0.477 -6.822 7.063
74 HB3 TYR 9 1HB TYR 9 -0.197 -5.715 5.781
75 HD1 TYR 9 1HD TYR 9 1.433 -6.060 4.160
76 HD2 TYR 9 2HD TYR 9 1.225 -8.599 7.528
77 HE1 TYR 9 1HE TYR 9 2.928 -7.679 3.030
78 HE2 TYR 9 2HE TYR 9 2.698 -10.216 6.431
79 HH TYR 9 HH TYR 9 4.426 -9.488 3.591
80 H THR 10 H THR 10 -0.645 -3.238 7.013
81 HA THR 10 HA THR 10 -1.515 -2.783 9.624
82 HB THR 10 HB THR 10 -1.564 -0.963 8.016
83 HG1 THR 10 1HG THR 10 -4.244 -1.000 8.126
84 HG21 THR 10 1HG2 THR 10 -3.151 -0.921 6.127
85 HG22 THR 10 2HG2 THR 10 -3.590 -2.602 6.479
86 HG23 THR 10 3HG2 THR 10 -1.949 -2.196 5.976
87 H LYS 11 H LYS 11 -3.329 -3.436 10.642
88 HA LYS 11 HA LYS 11 -4.666 -5.746 9.464
89 HB2 LYS 11 2HB LYS 11 -5.446 -6.215 11.735
90 HB3 LYS 11 1HB LYS 11 -3.697 -6.070 11.674
91 HG2 LYS 11 2HG LYS 11 -3.943 -3.726 12.517
92 HG3 LYS 11 1HG LYS 11 -5.665 -4.046 12.736
93 HD2 LYS 11 2HD LYS 11 -3.384 -5.524 14.054
94 HD3 LYS 11 1HD LYS 11 -4.440 -4.342 14.821
95 HE2 LYS 11 2HE LYS 11 -6.354 -5.808 14.498
96 HE3 LYS 11 1HE LYS 11 -5.344 -6.968 13.638
97 HZ1 LYS 11 1HZ LYS 11 -4.054 -7.271 15.650
98 HZ2 LYS 11 2HZ LYS 11 -5.673 -7.638 15.914
99 HZ3 LYS 11 3HZ LYS 11 -5.039 -6.186 16.485
100 H ARG 12 H ARG 12 -5.068 -2.540 9.685
101 HA ARG 12 HA ARG 12 -7.977 -2.763 9.555
102 HB2 ARG 12 2HB ARG 12 -7.178 -1.413 11.447
103 HB3 ARG 12 1HB ARG 12 -6.286 -0.383 10.338
104 HG2 ARG 12 2HG ARG 12 -8.381 0.316 9.308
105 HG3 ARG 12 1HG ARG 12 -9.273 -0.720 10.421
106 HD2 ARG 12 2HD ARG 12 -8.352 0.563 12.308
107 HD3 ARG 12 1HD ARG 12 -7.527 1.621 11.163
108 HE ARG 12 HE ARG 12 -10.217 1.528 10.499
109 HH11 ARG 12 1HH1 ARG 12 -8.142 2.797 13.071
110 HH12 ARG 12 2HH1 ARG 12 -9.219 4.040 13.500
111 HH21 ARG 12 1HH2 ARG 12 -11.705 3.247 11.127
112 HH22 ARG 12 2HH2 ARG 12 -11.272 4.290 12.389
113 HA PRO 13 HA PRO 13 -7.276 -1.699 5.274
114 HB2 PRO 13 2HB PRO 13 -9.884 -1.106 4.657
115 HB3 PRO 13 1HB PRO 13 -9.234 -2.745 4.717
116 HG2 PRO 13 2HG PRO 13 -10.829 -1.263 6.757
117 HG3 PRO 13 1HG PRO 13 -10.920 -2.968 6.278
118 HD2 PRO 13 2HD PRO 13 -9.689 -2.140 8.531
119 HD3 PRO 13 1HD PRO 13 -9.147 -3.566 7.627
120 H LEU 14 H LEU 14 -7.051 0.166 4.117
121 HA LEU 14 HA LEU 14 -7.594 2.694 5.494
122 HB2 LEU 14 2HB LEU 14 -5.231 2.078 4.914
123 HB3 LEU 14 1HB LEU 14 -5.703 2.019 3.236
124 HG LEU 14 HG LEU 14 -6.193 4.438 3.327
125 HD11 LEU 14 1HD1 LEU 14 -5.413 5.722 5.241
126 HD12 LEU 14 2HD1 LEU 14 -4.975 4.244 6.073
127 HD13 LEU 14 3HD1 LEU 14 -6.676 4.593 5.737
128 HD21 LEU 14 1HD2 LEU 14 -3.428 3.612 4.197
129 HD22 LEU 14 2HD2 LEU 14 -3.855 5.135 3.417
130 HD23 LEU 14 3HD2 LEU 14 -4.048 3.618 2.550
131 HA PRO 15 HA PRO 15 -10.647 3.228 2.193
132 HB2 PRO 15 2HB PRO 15 -10.478 6.113 2.837
133 HB3 PRO 15 1HB PRO 15 -11.885 5.047 2.870
134 HG2 PRO 15 2HG PRO 15 -10.767 5.925 5.141
135 HG3 PRO 15 1HG PRO 15 -11.428 4.287 5.011
136 HD2 PRO 15 2HD PRO 15 -8.583 5.196 4.890
137 HD3 PRO 15 1HD PRO 15 -9.283 3.780 5.706
138 H LEU 16 H LEU 16 -10.356 3.567 0.119
139 HA LEU 16 HA LEU 16 -7.865 4.271 -0.952
140 HB2 LEU 16 2HB LEU 16 -9.143 2.660 -2.035
141 HB3 LEU 16 1HB LEU 16 -10.530 3.761 -2.222
142 HG LEU 16 HG LEU 16 -9.040 5.032 -3.775
143 HD11 LEU 16 1HD1 LEU 16 -7.102 3.785 -4.692
144 HD12 LEU 16 2HD1 LEU 16 -7.314 2.597 -3.412
145 HD13 LEU 16 3HD1 LEU 16 -6.890 4.252 -3.000
146 HD21 LEU 16 1HD2 LEU 16 -9.677 2.176 -4.363
147 HD22 LEU 16 2HD2 LEU 16 -9.393 3.462 -5.569
148 HD23 LEU 16 3HD2 LEU 16 -10.757 3.583 -4.452
149 H LYS 17 H LYS 17 -10.814 5.998 -0.567
150 HA LYS 17 HA LYS 17 -10.359 8.174 -2.296
151 HB2 LYS 17 2HB LYS 17 -11.895 8.103 0.295
152 HB3 LYS 17 1HB LYS 17 -11.979 9.392 -0.891
153 HG2 LYS 17 2HG LYS 17 -12.930 7.815 -2.513
154 HG3 LYS 17 1HG LYS 17 -12.844 6.534 -1.298
155 HD2 LYS 17 2HD LYS 17 -14.325 7.789 0.162
156 HD3 LYS 17 1HD LYS 17 -14.396 9.109 -1.000
157 HE2 LYS 17 2HE LYS 17 -15.428 7.595 -2.628
158 HE3 LYS 17 1HE LYS 17 -15.362 6.289 -1.443
159 HZ1 LYS 17 1HZ LYS 17 -17.537 7.291 -1.494
160 HZ2 LYS 17 2HZ LYS 17 -16.896 8.817 -1.180
161 HZ3 LYS 17 3HZ LYS 17 -16.829 7.621 0.002
162 H ARG 18 H ARG 18 -8.695 7.288 0.418
163 HA ARG 18 HA ARG 18 -7.821 10.059 0.947
164 HB2 ARG 18 2HB ARG 18 -9.274 9.056 2.698
165 HB3 ARG 18 1HB ARG 18 -8.022 7.852 2.985
166 HG2 ARG 18 2HG ARG 18 -6.516 9.552 3.722
167 HG3 ARG 18 1HG ARG 18 -7.665 10.812 3.248
168 HD2 ARG 18 2HD ARG 18 -7.921 10.533 5.604
169 HD3 ARG 18 1HD ARG 18 -9.274 9.791 4.743
170 HE ARG 18 HE ARG 18 -7.206 7.946 5.368
171 HH11 ARG 18 1HH1 ARG 18 -10.175 9.501 6.495
172 HH12 ARG 18 2HH1 ARG 18 -10.477 8.372 7.731
173 HH21 ARG 18 1HH2 ARG 18 -7.632 6.347 7.144
174 HH22 ARG 18 2HH2 ARG 18 -9.015 6.566 8.079
175 H ILE 19 H ILE 19 -6.767 7.618 -0.622
176 HA ILE 19 HA ILE 19 -4.090 7.462 0.587
177 HB ILE 19 HB ILE 19 -5.226 5.746 -1.655
178 HG12 ILE 19 2HG1 ILE 19 -4.809 4.994 1.219
179 HG13 ILE 19 1HG1 ILE 19 -6.396 5.417 0.616
180 HG21 ILE 19 1HG2 ILE 19 -2.748 5.436 0.069
181 HG22 ILE 19 2HG2 ILE 19 -2.761 5.875 -1.635
182 HG23 ILE 19 3HG2 ILE 19 -3.296 4.276 -1.126
183 HD11 ILE 19 1HD1 ILE 19 -6.174 3.512 -1.011
184 HD12 ILE 19 2HD1 ILE 19 -6.168 3.025 0.691
185 HD13 ILE 19 3HD1 ILE 19 -4.667 3.131 -0.242
186 H LYS 20 H LYS 20 -2.461 8.491 -0.420
187 HA LYS 20 HA LYS 20 -3.016 10.013 -2.797
188 HB2 LYS 20 2HB LYS 20 -0.451 9.771 -1.194
189 HB3 LYS 20 1HB LYS 20 -0.735 10.910 -2.489
190 HG2 LYS 20 2HG LYS 20 -2.132 10.800 0.110
191 HG3 LYS 20 1HG LYS 20 -0.936 11.987 -0.413
192 HD2 LYS 20 2HD LYS 20 -3.647 11.481 -1.539
193 HD3 LYS 20 1HD LYS 20 -3.188 12.871 -0.595
194 HE2 LYS 20 2HE LYS 20 -2.058 12.240 -3.346
195 HE3 LYS 20 1HE LYS 20 -3.231 13.494 -2.968
196 HZ1 LYS 20 1HZ LYS 20 -1.552 14.552 -1.546
197 HZ2 LYS 20 2HZ LYS 20 -1.013 14.455 -3.118
198 HZ3 LYS 20 3HZ LYS 20 -0.423 13.403 -1.950
199 H SER 21 H SER 21 -0.858 7.357 -1.820
200 HA SER 21 HA SER 21 -0.757 6.202 -4.360
201 HB2 SER 21 2HB SER 21 1.611 6.768 -4.912
202 HB3 SER 21 1HB SER 21 0.551 8.175 -4.978
203 HG SER 21 HG SER 21 2.616 7.554 -3.288
204 H TYR 22 H TYR 22 1.149 4.582 -4.356
205 HA TYR 22 HA TYR 22 1.864 3.805 -1.612
206 HB2 TYR 22 2HB TYR 22 1.495 1.469 -2.145
207 HB3 TYR 22 1HB TYR 22 0.005 2.372 -2.319
208 HD1 TYR 22 1HD TYR 22 -1.171 2.279 -4.287
209 HD2 TYR 22 2HD TYR 22 2.806 0.847 -4.272
210 HE1 TYR 22 1HE TYR 22 -1.489 1.340 -6.526
211 HE2 TYR 22 2HE TYR 22 2.490 -0.090 -6.521
212 HH TYR 22 HH TYR 22 -0.196 0.748 -8.382
213 H THR 23 H THR 23 3.546 2.194 -1.619
214 HA THR 23 HA THR 23 5.343 2.422 -3.894
215 HB THR 23 HB THR 23 6.077 2.499 -0.957
216 HG1 THR 23 1HG THR 23 5.405 4.369 -2.563
217 HG21 THR 23 1HG2 THR 23 7.658 1.119 -2.250
218 HG22 THR 23 2HG2 THR 23 8.422 2.618 -1.704
219 HG23 THR 23 3HG2 THR 23 7.894 2.439 -3.385
220 H ILE 24 H ILE 24 6.099 0.537 -4.599
221 HA ILE 24 HA ILE 24 4.956 -1.834 -3.495
222 HB ILE 24 HB ILE 24 6.789 -1.475 -5.879
223 HG12 ILE 24 2HG1 ILE 24 3.786 -1.847 -5.747
224 HG13 ILE 24 1HG1 ILE 24 4.613 -0.340 -6.122
225 HG21 ILE 24 1HG2 ILE 24 5.155 -3.875 -5.024
226 HG22 ILE 24 2HG2 ILE 24 6.915 -3.749 -4.989
227 HG23 ILE 24 3HG2 ILE 24 6.061 -3.739 -6.531
228 HD11 ILE 24 1HD1 ILE 24 4.699 -2.862 -7.766
229 HD12 ILE 24 2HD1 ILE 24 5.517 -1.347 -8.159
230 HD13 ILE 24 3HD1 ILE 24 3.756 -1.418 -8.128
231 H GLN 25 H GLN 25 5.936 -2.497 -1.659
232 HA GLN 25 HA GLN 25 8.810 -2.740 -1.584
233 HB2 GLN 25 2HB GLN 25 7.789 -2.217 0.493
234 HB3 GLN 25 1HB GLN 25 6.589 -3.489 0.313
235 HG2 GLN 25 2HG GLN 25 8.325 -5.159 0.528
236 HG3 GLN 25 1HG GLN 25 9.518 -3.877 0.741
237 HE21 GLN 25 1HE2 GLN 25 8.582 -6.048 2.509
238 HE22 GLN 25 2HE2 GLN 25 8.145 -5.275 3.980
239 H SER 26 H SER 26 9.749 -4.415 -2.464
240 HA SER 26 HA SER 26 8.111 -6.750 -2.938
241 HB2 SER 26 2HB SER 26 9.017 -5.643 -4.940
242 HB3 SER 26 1HB SER 26 10.649 -5.858 -4.315
243 HG SER 26 HG SER 26 10.226 -7.452 -5.727
244 H ASN 27 H ASN 27 9.125 -8.801 -2.659
245 HA ASN 27 HA ASN 27 10.489 -9.041 -0.196
246 HB2 ASN 27 2HB ASN 27 8.617 -10.375 -1.290
247 HB3 ASN 27 1HB ASN 27 9.858 -11.085 -2.297
248 HD21 ASN 27 1HD2 ASN 27 8.003 -12.043 -0.373
249 HD22 ASN 27 2HD2 ASN 27 8.876 -13.014 0.753
250 H GLU 28 H GLU 28 11.501 -8.286 -3.215
251 HA GLU 28 HA GLU 28 13.860 -9.823 -3.606
252 HB2 GLU 28 2HB GLU 28 13.083 -7.086 -4.606
253 HB3 GLU 28 1HB GLU 28 14.414 -8.050 -5.223
254 HG2 GLU 28 2HG GLU 28 12.912 -9.693 -6.079
255 HG3 GLU 28 1HG GLU 28 11.539 -8.918 -5.289
256 H ALA 29 H ALA 29 13.189 -6.595 -2.265
257 HA ALA 29 HA ALA 29 15.966 -6.472 -1.301
258 HB1 ALA 29 1HB ALA 29 15.721 -4.060 -1.223
259 HB2 ALA 29 2HB ALA 29 14.031 -4.195 -1.704
260 HB3 ALA 29 3HB ALA 29 15.307 -4.664 -2.828
261 H CYS 30 H CYS 30 12.657 -6.469 -0.299
262 HA CYS 30 HA CYS 30 13.467 -5.884 2.452
263 HB2 CYS 30 2HB CYS 30 10.761 -5.846 1.151
264 HB3 CYS 30 1HB CYS 30 11.111 -5.413 2.821
265 H ASN 31 H ASN 31 12.452 -7.224 4.135
266 HA ASN 31 HA ASN 31 12.908 -9.948 3.685
267 HB2 ASN 31 2HB ASN 31 13.081 -8.919 5.922
268 HB3 ASN 31 1HB ASN 31 11.340 -8.675 5.946
269 HD21 ASN 31 1HD2 ASN 31 11.086 -9.937 7.816
270 HD22 ASN 31 2HD2 ASN 31 11.239 -11.640 7.793
271 H ILE 32 H ILE 32 9.926 -8.104 3.638
272 HA ILE 32 HA ILE 32 8.592 -10.463 2.510
273 HB ILE 32 HB ILE 32 6.495 -9.888 3.646
274 HG12 ILE 32 2HG1 ILE 32 8.083 -7.718 5.042
275 HG13 ILE 32 1HG1 ILE 32 6.871 -7.446 3.799
276 HG21 ILE 32 1HG2 ILE 32 8.793 -10.013 5.534
277 HG22 ILE 32 2HG2 ILE 32 8.011 -11.419 4.787
278 HG23 ILE 32 3HG2 ILE 32 7.128 -10.409 5.963
279 HD11 ILE 32 1HD1 ILE 32 6.385 -8.650 6.513
280 HD12 ILE 32 2HD1 ILE 32 5.159 -8.377 5.273
281 HD13 ILE 32 3HD1 ILE 32 5.989 -7.007 6.018
282 H LYS 33 H LYS 33 6.450 -9.643 1.480
283 HA LYS 33 HA LYS 33 7.119 -7.265 0.001
284 HB2 LYS 33 2HB LYS 33 6.728 -9.267 -1.345
285 HB3 LYS 33 1HB LYS 33 5.152 -9.485 -0.602
286 HG2 LYS 33 2HG LYS 33 4.393 -7.389 -1.609
287 HG3 LYS 33 1HG LYS 33 5.977 -7.176 -2.337
288 HD2 LYS 33 2HD LYS 33 5.695 -9.238 -3.596
289 HD3 LYS 33 1HD LYS 33 4.104 -9.476 -2.864
290 HE2 LYS 33 2HE LYS 33 3.332 -7.386 -3.859
291 HE3 LYS 33 1HE LYS 33 4.927 -7.127 -4.565
292 HZ1 LYS 33 1HZ LYS 33 3.119 -9.390 -5.183
293 HZ2 LYS 33 2HZ LYS 33 4.636 -9.101 -5.890
294 HZ3 LYS 33 3HZ LYS 33 3.372 -8.028 -6.145
295 H ALA 34 H ALA 34 6.023 -5.408 0.864
296 HA ALA 34 HA ALA 34 3.252 -5.771 1.665
297 HB1 ALA 34 1HB ALA 34 4.561 -5.866 3.765
298 HB2 ALA 34 2HB ALA 34 3.633 -4.388 3.702
299 HB3 ALA 34 3HB ALA 34 5.357 -4.357 3.347
300 H ILE 35 H ILE 35 2.181 -4.413 0.315
301 HA ILE 35 HA ILE 35 3.512 -2.247 -0.959
302 HB ILE 35 HB ILE 35 0.540 -2.823 -0.791
303 HG12 ILE 35 2HG1 ILE 35 1.906 -4.592 -1.810
304 HG13 ILE 35 1HG1 ILE 35 0.812 -3.860 -2.994
305 HG21 ILE 35 1HG2 ILE 35 0.350 -1.302 -2.773
306 HG22 ILE 35 2HG2 ILE 35 2.061 -0.953 -2.646
307 HG23 ILE 35 3HG2 ILE 35 0.979 -0.451 -1.368
308 HD11 ILE 35 1HD1 ILE 35 2.928 -4.298 -3.985
309 HD12 ILE 35 2HD1 ILE 35 3.791 -3.455 -2.690
310 HD13 ILE 35 3HD1 ILE 35 2.763 -2.555 -3.814
311 H ILE 36 H ILE 36 3.745 -0.249 -0.355
312 HA ILE 36 HA ILE 36 2.872 0.361 2.347
313 HB ILE 36 HB ILE 36 5.051 1.512 0.586
314 HG12 ILE 36 2HG1 ILE 36 5.404 -0.226 3.000
315 HG13 ILE 36 1HG1 ILE 36 5.083 -0.951 1.430
316 HG21 ILE 36 1HG2 ILE 36 4.227 3.099 2.303
317 HG22 ILE 36 2HG2 ILE 36 5.855 2.531 2.680
318 HG23 ILE 36 3HG2 ILE 36 4.466 1.865 3.543
319 HD11 ILE 36 1HD1 ILE 36 7.078 0.018 0.553
320 HD12 ILE 36 2HD1 ILE 36 7.407 -0.948 1.981
321 HD13 ILE 36 3HD1 ILE 36 7.428 0.834 2.093
322 H PHE 37 H PHE 37 1.098 1.507 2.384
323 HA PHE 37 HA PHE 37 0.262 3.208 0.214
324 HB2 PHE 37 2HB PHE 37 -0.968 2.092 2.696
325 HB3 PHE 37 1HB PHE 37 -1.746 3.432 1.847
326 HD1 PHE 37 1HD PHE 37 0.021 0.591 0.360
327 HD2 PHE 37 2HD PHE 37 -3.682 2.360 1.193
328 HE1 PHE 37 1HE PHE 37 -1.148 -1.074 -1.155
329 HE2 PHE 37 2HE PHE 37 -4.827 0.758 -0.263
330 HZ PHE 37 HZ PHE 37 -3.546 -0.953 -1.432
331 H THR 38 H THR 38 0.047 5.282 0.369
332 HA THR 38 HA THR 38 0.787 6.550 2.908
333 HB THR 38 HB THR 38 1.362 7.545 0.102
334 HG1 THR 38 1HG THR 38 2.590 5.896 1.738
335 HG21 THR 38 1HG2 THR 38 0.890 9.361 1.652
336 HG22 THR 38 2HG2 THR 38 2.613 9.338 1.262
337 HG23 THR 38 3HG2 THR 38 2.027 8.694 2.812
338 H THR 39 H THR 39 -0.707 8.104 3.730
339 HA THR 39 HA THR 39 -3.135 8.237 2.217
340 HB THR 39 HB THR 39 -3.896 9.470 4.285
341 HG1 THR 39 1HG THR 39 -2.597 9.007 6.136
342 HG21 THR 39 1HG2 THR 39 -4.449 7.151 3.913
343 HG22 THR 39 2HG2 THR 39 -4.110 7.431 5.621
344 HG23 THR 39 3HG2 THR 39 -2.900 6.654 4.600
345 H LYS 40 H LYS 40 -4.201 10.464 2.448
346 HA LYS 40 HA LYS 40 -2.570 12.392 1.231
347 HB2 LYS 40 2HB LYS 40 -5.097 12.811 2.739
348 HB3 LYS 40 1HB LYS 40 -4.502 13.876 1.458
349 HG2 LYS 40 2HG LYS 40 -4.767 11.566 -0.020
350 HG3 LYS 40 1HG LYS 40 -5.774 11.201 1.313
351 HD2 LYS 40 2HD LYS 40 -7.311 12.898 0.896
352 HD3 LYS 40 1HD LYS 40 -6.193 13.719 -0.209
353 HE2 LYS 40 2HE LYS 40 -6.312 11.915 -1.773
354 HE3 LYS 40 1HE LYS 40 -7.322 10.965 -0.702
355 HZ1 LYS 40 1HZ LYS 40 -9.045 12.642 -0.938
356 HZ2 LYS 40 2HZ LYS 40 -8.608 11.979 -2.409
357 HZ3 LYS 40 3HZ LYS 40 -8.089 13.523 -2.016
358 H LYS 41 H LYS 41 -2.999 11.454 4.473
359 HA LYS 41 HA LYS 41 -2.039 13.863 5.682
360 HB2 LYS 41 2HB LYS 41 -3.363 11.974 6.838
361 HB3 LYS 41 1HB LYS 41 -1.908 11.055 6.717
362 HG2 LYS 41 2HG LYS 41 -2.136 12.047 8.960
363 HG3 LYS 41 1HG LYS 41 -0.664 12.538 8.123
364 HD2 LYS 41 2HD LYS 41 -1.739 14.667 7.502
365 HD3 LYS 41 1HD LYS 41 -3.202 14.171 8.356
366 HE2 LYS 41 2HE LYS 41 -1.850 15.697 9.703
367 HE3 LYS 41 1HE LYS 41 -1.949 14.105 10.452
368 HZ1 LYS 41 1HZ LYS 41 0.364 15.106 8.857
369 HZ2 LYS 41 2HZ LYS 41 0.252 13.606 9.618
370 HZ3 LYS 41 3HZ LYS 41 0.293 15.017 10.526
371 H GLY 42 H GLY 42 -0.781 11.292 3.924
372 HA2 GLY 42 2HA GLY 42 1.332 11.077 3.065
373 HA3 GLY 42 1HA GLY 42 1.874 12.333 4.150
374 H ARG 43 H ARG 43 0.210 9.765 5.654
375 HA ARG 43 HA ARG 43 2.576 8.925 7.082
376 HB2 ARG 43 2HB ARG 43 -0.182 7.783 7.050
377 HB3 ARG 43 1HB ARG 43 1.085 7.226 8.127
378 HG2 ARG 43 2HG ARG 43 1.141 9.562 9.073
379 HG3 ARG 43 1HG ARG 43 -0.299 9.906 8.110
380 HD2 ARG 43 2HD ARG 43 -0.047 7.736 10.194
381 HD3 ARG 43 1HD ARG 43 -0.879 9.271 10.409
382 HE ARG 43 HE ARG 43 -2.404 8.528 8.617
383 HH11 ARG 43 1HH1 ARG 43 -0.608 6.026 10.381
384 HH12 ARG 43 2HH1 ARG 43 -1.803 4.844 10.211
385 HH21 ARG 43 1HH2 ARG 43 -4.058 6.881 8.380
386 HH22 ARG 43 2HH2 ARG 43 -3.808 5.340 9.053
387 H LYS 44 H LYS 44 3.147 6.584 7.330
388 HA LYS 44 HA LYS 44 3.096 5.205 4.750
389 HB2 LYS 44 2HB LYS 44 4.881 4.880 7.177
390 HB3 LYS 44 1HB LYS 44 4.900 3.782 5.810
391 HG2 LYS 44 2HG LYS 44 5.562 6.724 5.698
392 HG3 LYS 44 1HG LYS 44 6.738 5.409 5.745
393 HD2 LYS 44 2HD LYS 44 5.760 4.522 3.641
394 HD3 LYS 44 1HD LYS 44 4.692 5.922 3.581
395 HE2 LYS 44 2HE LYS 44 6.594 6.286 2.134
396 HE3 LYS 44 1HE LYS 44 6.653 7.391 3.500
397 HZ1 LYS 44 1HZ LYS 44 8.225 4.866 3.324
398 HZ2 LYS 44 2HZ LYS 44 8.362 6.063 4.526
399 HZ3 LYS 44 3HZ LYS 44 8.819 6.387 2.968
400 H ILE 45 H ILE 45 1.467 3.825 4.592
401 HA ILE 45 HA ILE 45 0.690 2.295 6.961
402 HB ILE 45 HB ILE 45 -0.920 2.844 4.437
403 HG12 ILE 45 2HG1 ILE 45 -2.547 4.004 6.070
404 HG13 ILE 45 1HG1 ILE 45 -1.236 3.951 7.236
405 HG21 ILE 45 1HG2 ILE 45 -1.723 1.323 6.903
406 HG22 ILE 45 2HG2 ILE 45 -1.430 0.656 5.295
407 HG23 ILE 45 3HG2 ILE 45 -2.797 1.739 5.570
408 HD11 ILE 45 1HD1 ILE 45 -1.449 6.110 6.184
409 HD12 ILE 45 2HD1 ILE 45 -1.188 5.379 4.599
410 HD13 ILE 45 3HD1 ILE 45 0.108 5.369 5.799
411 H CYS 46 H CYS 46 1.774 0.467 6.873
412 HA CYS 46 HA CYS 46 2.655 -0.743 4.416
413 HB2 CYS 46 2HB CYS 46 2.632 -1.735 7.257
414 HB3 CYS 46 1HB CYS 46 3.565 -2.479 5.977
415 H ALA 47 H ALA 47 1.207 -1.883 3.154
416 HA ALA 47 HA ALA 47 -0.972 -3.188 4.611
417 HB1 ALA 47 1HB ALA 47 -1.047 -2.029 1.837
418 HB2 ALA 47 2HB ALA 47 -1.717 -1.269 3.282
419 HB3 ALA 47 3HB ALA 47 -2.389 -2.789 2.692
420 H ASN 48 H ASN 48 -1.699 -5.146 3.926
421 HA ASN 48 HA ASN 48 0.296 -6.825 2.773
422 HB2 ASN 48 2HB ASN 48 -0.870 -7.691 4.606
423 HB3 ASN 48 1HB ASN 48 -2.446 -7.320 3.974
424 HD21 ASN 48 1HD2 ASN 48 0.296 -8.870 2.331
425 HD22 ASN 48 2HD2 ASN 48 -0.575 -10.342 2.065
426 HA PRO 49 HA PRO 49 -1.249 -6.080 -1.404
427 HB2 PRO 49 2HB PRO 49 0.385 -7.941 -2.549
428 HB3 PRO 49 1HB PRO 49 0.818 -6.245 -2.320
429 HG2 PRO 49 2HG PRO 49 1.590 -8.638 -0.741
430 HG3 PRO 49 1HG PRO 49 2.509 -7.156 -1.057
431 HD2 PRO 49 2HD PRO 49 1.331 -7.643 1.328
432 HD3 PRO 49 1HD PRO 49 1.501 -6.009 0.670
433 H ASN 50 H ASN 50 -1.040 -9.087 0.315
434 HA ASN 50 HA ASN 50 -2.378 -10.595 -1.623
435 HB2 ASN 50 2HB ASN 50 -2.107 -11.090 1.330
436 HB3 ASN 50 1HB ASN 50 -2.738 -12.210 0.120
437 HD21 ASN 50 1HD2 ASN 50 -0.328 -12.207 1.909
438 HD22 ASN 50 2HD2 ASN 50 0.979 -12.566 0.849
439 H GLU 51 H GLU 51 -3.416 -8.205 0.588
440 HA GLU 51 HA GLU 51 -6.057 -9.271 0.972
441 HB2 GLU 51 2HB GLU 51 -5.087 -6.464 1.454
442 HB3 GLU 51 1HB GLU 51 -6.572 -7.173 2.060
443 HG2 GLU 51 2HG GLU 51 -4.906 -8.882 3.212
444 HG3 GLU 51 1HG GLU 51 -3.786 -7.626 2.785
445 H LYS 52 H LYS 52 -7.791 -8.893 -0.187
446 HA LYS 52 HA LYS 52 -7.493 -8.124 -2.838
447 HB2 LYS 52 2HB LYS 52 -9.224 -9.685 -2.005
448 HB3 LYS 52 1HB LYS 52 -10.053 -8.334 -1.252
449 HG2 LYS 52 2HG LYS 52 -10.492 -7.354 -3.426
450 HG3 LYS 52 1HG LYS 52 -9.579 -8.645 -4.209
451 HD2 LYS 52 2HD LYS 52 -11.193 -10.293 -3.314
452 HD3 LYS 52 1HD LYS 52 -12.114 -8.971 -2.600
453 HE2 LYS 52 2HE LYS 52 -11.568 -9.347 -5.546
454 HE3 LYS 52 1HE LYS 52 -13.082 -9.734 -4.735
455 HZ1 LYS 52 1HZ LYS 52 -13.318 -7.400 -4.166
456 HZ2 LYS 52 2HZ LYS 52 -13.210 -7.612 -5.823
457 HZ3 LYS 52 3HZ LYS 52 -11.884 -7.018 -4.976
458 H TRP 53 H TRP 53 -8.452 -6.220 -0.024
459 HA TRP 53 HA TRP 53 -9.495 -4.062 -1.525
460 HB2 TRP 53 2HB TRP 53 -9.466 -2.708 0.467
461 HB3 TRP 53 1HB TRP 53 -9.958 -4.328 0.930
462 HD1 TRP 53 HD TRP 53 -8.189 -5.703 2.512
463 HE1 TRP 53 1HE TRP 53 -6.299 -4.888 4.024
464 HE3 TRP 53 3HE TRP 53 -7.649 -0.962 0.679
465 HZ2 TRP 53 2HZ TRP 53 -4.763 -2.572 4.409
466 HZ3 TRP 53 3HZ TRP 53 -5.935 0.480 1.676
467 HH2 TRP 53 HH TRP 53 -4.523 -0.307 3.506
468 H VAL 54 H VAL 54 -6.301 -4.946 -0.590
469 HA VAL 54 HA VAL 54 -5.015 -2.470 -1.185
470 HB VAL 54 HB VAL 54 -3.909 -5.281 -0.883
471 HG11 VAL 54 1HG1 VAL 54 -2.424 -2.662 -1.012
472 HG12 VAL 54 2HG1 VAL 54 -2.376 -3.930 -2.239
473 HG13 VAL 54 3HG1 VAL 54 -1.708 -4.223 -0.626
474 HG21 VAL 54 1HG2 VAL 54 -3.918 -2.923 0.972
475 HG22 VAL 54 2HG2 VAL 54 -3.175 -4.492 1.294
476 HG23 VAL 54 3HG2 VAL 54 -4.926 -4.358 1.120
477 H GLN 55 H GLN 55 -5.489 -5.507 -2.818
478 HA GLN 55 HA GLN 55 -3.994 -5.008 -5.113
479 HB2 GLN 55 2HB GLN 55 -6.459 -6.671 -4.840
480 HB3 GLN 55 1HB GLN 55 -5.230 -6.825 -6.107
481 HG2 GLN 55 2HG GLN 55 -3.579 -7.195 -4.297
482 HG3 GLN 55 1HG GLN 55 -4.933 -7.288 -3.176
483 HE21 GLN 55 1HE2 GLN 55 -3.005 -9.136 -3.757
484 HE22 GLN 55 2HE2 GLN 55 -3.722 -10.553 -4.385
485 H LYS 56 H LYS 56 -7.348 -4.508 -4.267
486 HA LYS 56 HA LYS 56 -8.430 -3.474 -6.598
487 HB2 LYS 56 2HB LYS 56 -9.676 -4.284 -4.678
488 HB3 LYS 56 1HB LYS 56 -9.015 -3.010 -3.688
489 HG2 LYS 56 2HG LYS 56 -10.251 -1.365 -4.940
490 HG3 LYS 56 1HG LYS 56 -10.872 -2.636 -6.010
491 HD2 LYS 56 2HD LYS 56 -11.902 -3.756 -4.095
492 HD3 LYS 56 1HD LYS 56 -11.286 -2.514 -3.025
493 HE2 LYS 56 2HE LYS 56 -12.659 -0.843 -4.121
494 HE3 LYS 56 1HE LYS 56 -13.215 -2.049 -5.286
495 HZ1 LYS 56 1HZ LYS 56 -14.273 -3.255 -3.524
496 HZ2 LYS 56 2HZ LYS 56 -14.811 -1.669 -3.504
497 HZ3 LYS 56 3HZ LYS 56 -13.689 -2.186 -2.354
498 H ALA 57 H ALA 57 -6.986 -1.866 -3.778
499 HA ALA 57 HA ALA 57 -7.241 0.798 -4.685
500 HB1 ALA 57 1HB ALA 57 -5.598 1.345 -2.961
501 HB2 ALA 57 2HB ALA 57 -5.198 -0.351 -2.764
502 HB3 ALA 57 3HB ALA 57 -6.811 0.228 -2.328
503 H MET 58 H MET 58 -4.628 -1.518 -5.013
504 HA MET 58 HA MET 58 -2.831 0.236 -6.093
505 HB2 MET 58 2HB MET 58 -2.953 -2.746 -6.478
506 HB3 MET 58 1HB MET 58 -1.643 -1.758 -7.104
507 HG2 MET 58 2HG MET 58 -1.245 -0.974 -4.756
508 HG3 MET 58 1HG MET 58 -2.408 -2.189 -4.232
509 HE1 MET 58 1HE MET 58 -0.544 -5.498 -5.257
510 HE2 MET 58 2HE MET 58 -1.745 -4.647 -6.232
511 HE3 MET 58 3HE MET 58 -1.986 -4.837 -4.486
512 H LYS 59 H LYS 59 -5.283 -1.639 -7.699
513 HA LYS 59 HA LYS 59 -4.422 -1.080 -10.334
514 HB2 LYS 59 2HB LYS 59 -7.203 -1.743 -9.334
515 HB3 LYS 59 1HB LYS 59 -6.683 -1.808 -11.012
516 HG2 LYS 59 2HG LYS 59 -5.075 -3.570 -10.450
517 HG3 LYS 59 1HG LYS 59 -5.586 -3.492 -8.771
518 HD2 LYS 59 2HD LYS 59 -7.847 -4.161 -9.436
519 HD3 LYS 59 1HD LYS 59 -7.322 -4.267 -11.122
520 HE2 LYS 59 2HE LYS 59 -5.691 -6.000 -10.466
521 HE3 LYS 59 1HE LYS 59 -6.267 -5.888 -8.807
522 HZ1 LYS 59 1HZ LYS 59 -8.474 -6.647 -9.605
523 HZ2 LYS 59 2HZ LYS 59 -7.256 -7.756 -9.933
524 HZ3 LYS 59 3HZ LYS 59 -7.844 -6.796 -11.158
525 H HIS 60 H HIS 60 -6.576 0.611 -8.112
526 HA HIS 60 HA HIS 60 -7.366 2.603 -9.985
527 HB2 HIS 60 2HB HIS 60 -8.836 2.069 -8.165
528 HB3 HIS 60 1HB HIS 60 -7.572 2.397 -6.986
529 HD1 HIS 60 1HD HIS 60 -9.977 4.218 -9.337
530 HD2 HIS 60 2HD HIS 60 -7.375 4.983 -6.211
531 HE1 HIS 60 1HE HIS 60 -10.422 6.578 -8.697
532 HE2 HIS 60 2HE HIS 60 -8.919 7.028 -6.742
533 H LEU 61 H LEU 61 -4.884 2.348 -7.527
534 HA LEU 61 HA LEU 61 -4.096 5.085 -7.761
535 HB2 LEU 61 2HB LEU 61 -2.817 2.734 -6.423
536 HB3 LEU 61 1HB LEU 61 -2.139 4.353 -6.356
537 HG LEU 61 HG LEU 61 -4.881 3.608 -5.316
538 HD11 LEU 61 1HD1 LEU 61 -2.289 4.029 -3.831
539 HD12 LEU 61 2HD1 LEU 61 -3.155 2.491 -4.020
540 HD13 LEU 61 3HD1 LEU 61 -3.880 3.806 -3.105
541 HD21 LEU 61 1HD2 LEU 61 -3.186 6.076 -4.989
542 HD22 LEU 61 2HD2 LEU 61 -4.729 5.777 -4.190
543 HD23 LEU 61 3HD2 LEU 61 -4.669 5.961 -5.945
544 H ASP 62 H ASP 62 -2.928 2.093 -9.234
545 HA ASP 62 HA ASP 62 -0.635 3.416 -10.401
546 HB2 ASP 62 2HB ASP 62 -0.578 0.988 -9.952
547 HB3 ASP 62 1HB ASP 62 -1.915 0.766 -11.075
548 H LYS 63 H LYS 63 -3.913 2.719 -11.313
549 HA LYS 63 HA LYS 63 -3.428 4.040 -13.839
550 HB2 LYS 63 2HB LYS 63 -5.735 2.272 -13.089
551 HB3 LYS 63 1HB LYS 63 -5.421 2.942 -14.681
552 HG2 LYS 63 2HG LYS 63 -3.363 1.608 -14.819
553 HG3 LYS 63 1HG LYS 63 -3.709 0.939 -13.237
554 HD2 LYS 63 2HD LYS 63 -5.525 0.632 -15.632
555 HD3 LYS 63 1HD LYS 63 -4.319 -0.549 -15.161
556 HE2 LYS 63 2HE LYS 63 -6.481 -1.282 -14.361
557 HE3 LYS 63 1HE LYS 63 -5.502 -0.825 -12.978
558 HZ1 LYS 63 1HZ LYS 63 -7.603 0.952 -14.156
559 HZ2 LYS 63 2HZ LYS 63 -6.779 1.128 -12.693
560 HZ3 LYS 63 3HZ LYS 63 -7.837 -0.131 -12.887
561 H LYS 64 H LYS 64 -3.558 6.033 -12.684
562 HA LYS 64 HA LYS 64 -6.193 6.670 -11.603
563 HB2 LYS 64 2HB LYS 64 -4.216 6.872 -10.121
564 HB3 LYS 64 1HB LYS 64 -3.547 8.076 -11.208
565 HG2 LYS 64 2HG LYS 64 -5.526 9.495 -10.776
566 HG3 LYS 64 1HG LYS 64 -6.081 8.307 -9.596
567 HD2 LYS 64 2HD LYS 64 -3.493 9.865 -9.489
568 HD3 LYS 64 1HD LYS 64 -4.918 10.132 -8.490
569 HE2 LYS 64 2HE LYS 64 -4.639 7.916 -7.496
570 HE3 LYS 64 1HE LYS 64 -3.230 7.635 -8.522
571 HZ1 LYS 64 1HZ LYS 64 -2.175 9.564 -7.453
572 HZ2 LYS 64 2HZ LYS 64 -2.472 8.334 -6.383
573 HZ3 LYS 64 3HZ LYS 64 -3.474 9.686 -6.387
Start of MODEL 3
1 H1 ALA 1 1HT ALA 1 9.673 8.732 9.271
2 H2 ALA 1 2HT ALA 1 8.959 9.375 7.881
3 H3 ALA 1 3HT ALA 1 10.559 9.772 8.296
4 HA ALA 1 HA ALA 1 9.617 7.081 7.617
5 HB1 ALA 1 1HB ALA 1 10.853 7.353 5.532
6 HB2 ALA 1 2HB ALA 1 11.253 9.015 5.977
7 HB3 ALA 1 3HB ALA 1 9.579 8.560 5.664
8 H ARG 2 H ARG 2 10.730 5.875 9.020
9 HA ARG 2 HA ARG 2 13.565 6.475 9.425
10 HB2 ARG 2 2HB ARG 2 12.298 6.382 11.492
11 HB3 ARG 2 1HB ARG 2 11.619 4.829 11.054
12 HG2 ARG 2 2HG ARG 2 13.355 4.606 12.756
13 HG3 ARG 2 1HG ARG 2 13.796 3.779 11.267
14 HD2 ARG 2 2HD ARG 2 15.235 5.643 10.642
15 HD3 ARG 2 1HD ARG 2 14.775 6.510 12.109
16 HE ARG 2 HE ARG 2 15.692 4.313 13.168
17 HH11 ARG 2 1HH1 ARG 2 17.098 6.149 10.480
18 HH12 ARG 2 2HH1 ARG 2 18.700 5.740 10.869
19 HH21 ARG 2 1HH2 ARG 2 17.914 3.744 13.680
20 HH22 ARG 2 2HH2 ARG 2 19.172 4.337 12.703
21 H LYS 3 H LYS 3 11.306 3.852 8.695
22 HA LYS 3 HA LYS 3 13.575 2.372 7.596
23 HB2 LYS 3 2HB LYS 3 12.305 0.298 8.096
24 HB3 LYS 3 1HB LYS 3 12.690 1.235 9.529
25 HG2 LYS 3 2HG LYS 3 10.386 2.123 9.522
26 HG3 LYS 3 1HG LYS 3 10.018 1.084 8.144
27 HD2 LYS 3 2HD LYS 3 9.248 0.031 10.189
28 HD3 LYS 3 1HD LYS 3 10.612 -0.884 9.543
29 HE2 LYS 3 2HE LYS 3 12.109 0.226 11.132
30 HE3 LYS 3 1HE LYS 3 10.755 1.162 11.758
31 HZ1 LYS 3 1HZ LYS 3 9.734 -0.927 12.469
32 HZ2 LYS 3 2HZ LYS 3 11.255 -0.699 13.160
33 HZ3 LYS 3 3HZ LYS 3 11.078 -1.772 11.880
34 H SER 4 H SER 4 13.376 1.485 5.583
35 HA SER 4 HA SER 4 11.394 2.768 3.913
36 HB2 SER 4 2HB SER 4 13.750 1.023 3.185
37 HB3 SER 4 1HB SER 4 12.782 1.984 2.063
38 HG SER 4 HG SER 4 14.877 2.842 3.007
39 H CYS 5 H CYS 5 11.869 -0.256 5.398
40 HA CYS 5 HA CYS 5 10.006 -1.517 3.531
41 HB2 CYS 5 2HB CYS 5 12.100 -2.813 5.267
42 HB3 CYS 5 1HB CYS 5 10.984 -3.634 4.191
43 H CYS 6 H CYS 6 8.546 -3.051 4.468
44 HA CYS 6 HA CYS 6 7.851 -2.464 7.225
45 HB2 CYS 6 2HB CYS 6 6.237 -3.294 4.847
46 HB3 CYS 6 1HB CYS 6 5.598 -3.182 6.482
47 H LEU 7 H LEU 7 7.465 -4.164 8.523
48 HA LEU 7 HA LEU 7 7.995 -6.845 7.440
49 HB2 LEU 7 2HB LEU 7 8.567 -5.796 10.226
50 HB3 LEU 7 1HB LEU 7 8.693 -7.477 9.780
51 HG LEU 7 HG LEU 7 10.518 -6.823 8.165
52 HD11 LEU 7 1HD1 LEU 7 11.665 -4.693 8.488
53 HD12 LEU 7 2HD1 LEU 7 10.385 -4.173 9.587
54 HD13 LEU 7 3HD1 LEU 7 10.022 -4.470 7.887
55 HD21 LEU 7 1HD2 LEU 7 11.031 -7.807 10.313
56 HD22 LEU 7 2HD2 LEU 7 10.972 -6.220 11.079
57 HD23 LEU 7 3HD2 LEU 7 12.229 -6.580 9.899
58 H LYS 8 H LYS 8 5.573 -4.960 8.216
59 HA LYS 8 HA LYS 8 3.938 -7.113 9.243
60 HB2 LYS 8 2HB LYS 8 2.745 -5.480 10.594
61 HB3 LYS 8 1HB LYS 8 4.420 -5.641 11.126
62 HG2 LYS 8 2HG LYS 8 4.983 -3.560 9.999
63 HG3 LYS 8 1HG LYS 8 3.342 -3.427 9.373
64 HD2 LYS 8 2HD LYS 8 3.647 -1.958 11.289
65 HD3 LYS 8 1HD LYS 8 2.495 -3.233 11.672
66 HE2 LYS 8 2HE LYS 8 4.278 -4.463 12.851
67 HE3 LYS 8 1HE LYS 8 5.410 -3.170 12.460
68 HZ1 LYS 8 1HZ LYS 8 2.960 -2.869 14.109
69 HZ2 LYS 8 2HZ LYS 8 4.056 -1.649 13.753
70 HZ3 LYS 8 3HZ LYS 8 4.536 -2.951 14.693
71 H TYR 9 H TYR 9 1.664 -6.671 8.760
72 HA TYR 9 HA TYR 9 1.195 -4.756 6.582
73 HB2 TYR 9 2HB TYR 9 -0.465 -7.329 6.847
74 HB3 TYR 9 1HB TYR 9 -0.313 -6.202 5.568
75 HD1 TYR 9 1HD TYR 9 1.318 -6.320 3.955
76 HD2 TYR 9 2HD TYR 9 1.372 -9.024 7.191
77 HE1 TYR 9 1HE TYR 9 2.913 -7.756 2.717
78 HE2 TYR 9 2HE TYR 9 2.957 -10.477 5.991
79 HH TYR 9 HH TYR 9 4.535 -9.404 3.154
80 H THR 10 H THR 10 -0.700 -3.513 6.924
81 HA THR 10 HA THR 10 -1.648 -3.398 9.547
82 HB THR 10 HB THR 10 -1.565 -1.367 8.181
83 HG1 THR 10 1HG THR 10 -4.278 -1.401 8.320
84 HG21 THR 10 1HG2 THR 10 -3.153 -1.002 6.320
85 HG22 THR 10 2HG2 THR 10 -3.684 -2.683 6.469
86 HG23 THR 10 3HG2 THR 10 -2.028 -2.318 5.988
87 H LYS 11 H LYS 11 -3.470 -4.155 10.413
88 HA LYS 11 HA LYS 11 -4.856 -6.287 9.011
89 HB2 LYS 11 2HB LYS 11 -4.058 -6.513 11.341
90 HB3 LYS 11 1HB LYS 11 -5.119 -5.203 11.816
91 HG2 LYS 11 2HG LYS 11 -7.047 -6.578 11.173
92 HG3 LYS 11 1HG LYS 11 -5.938 -7.902 10.784
93 HD2 LYS 11 2HD LYS 11 -5.082 -7.835 13.077
94 HD3 LYS 11 1HD LYS 11 -6.236 -6.561 13.463
95 HE2 LYS 11 2HE LYS 11 -8.074 -8.089 12.929
96 HE3 LYS 11 1HE LYS 11 -6.898 -9.356 12.573
97 HZ1 LYS 11 1HZ LYS 11 -6.119 -9.180 14.865
98 HZ2 LYS 11 2HZ LYS 11 -7.737 -9.625 14.763
99 HZ3 LYS 11 3HZ LYS 11 -7.330 -8.037 15.190
100 H ARG 12 H ARG 12 -5.183 -3.049 9.945
101 HA ARG 12 HA ARG 12 -8.063 -2.930 9.616
102 HB2 ARG 12 2HB ARG 12 -7.046 -1.757 11.486
103 HB3 ARG 12 1HB ARG 12 -5.991 -0.886 10.390
104 HG2 ARG 12 2HG ARG 12 -7.916 0.280 9.455
105 HG3 ARG 12 1HG ARG 12 -8.988 -0.610 10.543
106 HD2 ARG 12 2HD ARG 12 -7.835 0.326 12.471
107 HD3 ARG 12 1HD ARG 12 -6.730 1.189 11.408
108 HE ARG 12 HE ARG 12 -9.179 2.036 10.640
109 HH11 ARG 12 1HH1 ARG 12 -7.490 1.932 13.760
110 HH12 ARG 12 2HH1 ARG 12 -8.217 3.329 14.373
111 HH21 ARG 12 1HH2 ARG 12 -10.196 3.990 11.509
112 HH22 ARG 12 2HH2 ARG 12 -9.763 4.526 13.068
113 HA PRO 13 HA PRO 13 -7.346 -1.811 5.338
114 HB2 PRO 13 2HB PRO 13 -9.948 -1.225 4.735
115 HB3 PRO 13 1HB PRO 13 -9.318 -2.872 4.807
116 HG2 PRO 13 2HG PRO 13 -10.873 -1.349 6.857
117 HG3 PRO 13 1HG PRO 13 -11.027 -3.048 6.367
118 HD2 PRO 13 2HD PRO 13 -9.738 -2.281 8.616
119 HD3 PRO 13 1HD PRO 13 -9.252 -3.714 7.691
120 H LEU 14 H LEU 14 -7.045 0.095 4.297
121 HA LEU 14 HA LEU 14 -7.612 2.577 5.748
122 HB2 LEU 14 2HB LEU 14 -5.241 1.936 5.106
123 HB3 LEU 14 1HB LEU 14 -5.741 2.008 3.440
124 HG LEU 14 HG LEU 14 -6.176 4.432 3.713
125 HD11 LEU 14 1HD1 LEU 14 -5.261 5.568 5.665
126 HD12 LEU 14 2HD1 LEU 14 -4.876 4.021 6.402
127 HD13 LEU 14 3HD1 LEU 14 -6.566 4.477 6.140
128 HD21 LEU 14 1HD2 LEU 14 -3.415 3.456 4.413
129 HD22 LEU 14 2HD2 LEU 14 -3.815 5.047 3.764
130 HD23 LEU 14 3HD2 LEU 14 -4.097 3.606 2.796
131 HA PRO 15 HA PRO 15 -10.609 3.213 2.417
132 HB2 PRO 15 2HB PRO 15 -10.605 6.068 3.053
133 HB3 PRO 15 1HB PRO 15 -11.908 4.895 3.252
134 HG2 PRO 15 2HG PRO 15 -10.600 5.996 5.354
135 HG3 PRO 15 1HG PRO 15 -11.284 4.363 5.394
136 HD2 PRO 15 2HD PRO 15 -8.451 5.228 5.001
137 HD3 PRO 15 1HD PRO 15 -9.100 3.860 5.936
138 H LEU 16 H LEU 16 -10.311 3.609 0.345
139 HA LEU 16 HA LEU 16 -7.860 4.482 -0.727
140 HB2 LEU 16 2HB LEU 16 -9.193 2.884 -1.860
141 HB3 LEU 16 1HB LEU 16 -10.528 4.041 -2.036
142 HG LEU 16 HG LEU 16 -8.923 5.362 -3.439
143 HD11 LEU 16 1HD1 LEU 16 -7.026 4.068 -4.396
144 HD12 LEU 16 2HD1 LEU 16 -7.348 2.819 -3.201
145 HD13 LEU 16 3HD1 LEU 16 -6.849 4.415 -2.675
146 HD21 LEU 16 1HD2 LEU 16 -9.718 2.602 -4.260
147 HD22 LEU 16 2HD2 LEU 16 -9.298 3.940 -5.364
148 HD23 LEU 16 3HD2 LEU 16 -10.699 4.082 -4.292
149 H LYS 17 H LYS 17 -10.835 6.063 -0.151
150 HA LYS 17 HA LYS 17 -10.466 8.361 -1.717
151 HB2 LYS 17 2HB LYS 17 -12.035 8.024 0.835
152 HB3 LYS 17 1HB LYS 17 -12.125 9.435 -0.205
153 HG2 LYS 17 2HG LYS 17 -12.956 8.061 -2.026
154 HG3 LYS 17 1HG LYS 17 -12.839 6.625 -1.015
155 HD2 LYS 17 2HD LYS 17 -14.464 7.609 0.538
156 HD3 LYS 17 1HD LYS 17 -14.576 9.034 -0.498
157 HE2 LYS 17 2HE LYS 17 -16.439 7.522 -0.926
158 HE3 LYS 17 1HE LYS 17 -15.383 7.630 -2.333
159 HZ1 LYS 17 1HZ LYS 17 -14.382 5.524 -1.696
160 HZ2 LYS 17 2HZ LYS 17 -16.050 5.347 -1.863
161 HZ3 LYS 17 3HZ LYS 17 -15.375 5.441 -0.335
162 H ARG 18 H ARG 18 -8.693 7.359 0.850
163 HA ARG 18 HA ARG 18 -7.766 10.119 1.409
164 HB2 ARG 18 2HB ARG 18 -7.886 7.856 3.405
165 HB3 ARG 18 1HB ARG 18 -7.244 9.465 3.718
166 HG2 ARG 18 2HG ARG 18 -9.488 10.397 3.231
167 HG3 ARG 18 1HG ARG 18 -10.089 8.753 3.055
168 HD2 ARG 18 2HD ARG 18 -9.423 8.276 5.353
169 HD3 ARG 18 1HD ARG 18 -8.859 9.942 5.531
170 HE ARG 18 HE ARG 18 -11.601 9.531 4.710
171 HH11 ARG 18 1HH1 ARG 18 -9.384 10.336 7.361
172 HH12 ARG 18 2HH1 ARG 18 -10.600 10.949 8.373
173 HH21 ARG 18 1HH2 ARG 18 -13.290 10.387 6.149
174 HH22 ARG 18 2HH2 ARG 18 -12.827 10.964 7.688
175 H ILE 19 H ILE 19 -6.894 7.679 -0.284
176 HA ILE 19 HA ILE 19 -4.118 7.547 0.666
177 HB ILE 19 HB ILE 19 -5.472 5.709 -1.351
178 HG12 ILE 19 2HG1 ILE 19 -4.758 5.130 1.501
179 HG13 ILE 19 1HG1 ILE 19 -6.406 5.504 1.020
180 HG21 ILE 19 1HG2 ILE 19 -2.837 5.500 0.142
181 HG22 ILE 19 2HG2 ILE 19 -3.010 5.819 -1.584
182 HG23 ILE 19 3HG2 ILE 19 -3.503 4.264 -0.908
183 HD11 ILE 19 1HD1 ILE 19 -6.330 3.494 -0.474
184 HD12 ILE 19 2HD1 ILE 19 -6.103 3.109 1.239
185 HD13 ILE 19 3HD1 ILE 19 -4.734 3.175 0.136
186 H LYS 20 H LYS 20 -2.534 8.309 -0.646
187 HA LYS 20 HA LYS 20 -3.353 9.750 -3.014
188 HB2 LYS 20 2HB LYS 20 -0.705 9.690 -1.565
189 HB3 LYS 20 1HB LYS 20 -1.066 10.722 -2.923
190 HG2 LYS 20 2HG LYS 20 -2.319 10.767 -0.250
191 HG3 LYS 20 1HG LYS 20 -1.241 11.979 -0.951
192 HD2 LYS 20 2HD LYS 20 -3.983 11.201 -1.775
193 HD3 LYS 20 1HD LYS 20 -3.514 12.726 -1.054
194 HE2 LYS 20 2HE LYS 20 -2.608 11.805 -3.814
195 HE3 LYS 20 1HE LYS 20 -3.824 13.032 -3.498
196 HZ1 LYS 20 1HZ LYS 20 -2.140 14.402 -2.444
197 HZ2 LYS 20 2HZ LYS 20 -1.676 14.016 -4.006
198 HZ3 LYS 20 3HZ LYS 20 -0.956 13.230 -2.714
199 H SER 21 H SER 21 -1.052 7.170 -2.067
200 HA SER 21 HA SER 21 -0.982 5.981 -4.600
201 HB2 SER 21 2HB SER 21 0.263 8.070 -5.163
202 HB3 SER 21 1HB SER 21 1.392 7.737 -3.858
203 HG SER 21 HG SER 21 0.963 6.307 -6.246
204 H TYR 22 H TYR 22 1.012 4.408 -4.559
205 HA TYR 22 HA TYR 22 1.713 3.686 -1.783
206 HB2 TYR 22 2HB TYR 22 1.393 1.327 -2.267
207 HB3 TYR 22 1HB TYR 22 -0.109 2.207 -2.470
208 HD1 TYR 22 1HD TYR 22 -1.267 2.068 -4.447
209 HD2 TYR 22 2HD TYR 22 2.724 0.677 -4.362
210 HE1 TYR 22 1HE TYR 22 -1.561 1.075 -6.667
211 HE2 TYR 22 2HE TYR 22 2.443 -0.313 -6.595
212 HH TYR 22 HH TYR 22 -0.234 0.435 -8.523
213 H THR 23 H THR 23 3.446 2.185 -1.663
214 HA THR 23 HA THR 23 5.415 2.548 -3.798
215 HB THR 23 HB THR 23 5.853 2.234 -0.814
216 HG1 THR 23 1HG THR 23 6.504 4.483 -2.380
217 HG21 THR 23 1HG2 THR 23 7.606 1.211 -2.136
218 HG22 THR 23 2HG2 THR 23 8.223 2.664 -1.332
219 HG23 THR 23 3HG2 THR 23 7.824 2.696 -3.057
220 H ILE 24 H ILE 24 6.423 0.655 -4.486
221 HA ILE 24 HA ILE 24 5.245 -1.825 -3.551
222 HB ILE 24 HB ILE 24 7.101 -1.307 -5.893
223 HG12 ILE 24 2HG1 ILE 24 4.134 -1.902 -5.818
224 HG13 ILE 24 1HG1 ILE 24 4.841 -0.326 -6.145
225 HG21 ILE 24 1HG2 ILE 24 5.633 -3.835 -5.109
226 HG22 ILE 24 2HG2 ILE 24 7.374 -3.586 -5.040
227 HG23 ILE 24 3HG2 ILE 24 6.551 -3.604 -6.599
228 HD11 ILE 24 1HD1 ILE 24 5.153 -2.800 -7.839
229 HD12 ILE 24 2HD1 ILE 24 5.860 -1.222 -8.184
230 HD13 ILE 24 3HD1 ILE 24 4.106 -1.425 -8.187
231 H GLN 25 H GLN 25 6.176 -2.651 -1.801
232 HA GLN 25 HA GLN 25 9.037 -2.595 -1.468
233 HB2 GLN 25 2HB GLN 25 7.761 -2.287 0.504
234 HB3 GLN 25 1HB GLN 25 6.743 -3.672 0.160
235 HG2 GLN 25 2HG GLN 25 8.578 -5.157 0.564
236 HG3 GLN 25 1HG GLN 25 9.643 -3.780 0.839
237 HE21 GLN 25 1HE2 GLN 25 8.732 -6.003 2.546
238 HE22 GLN 25 2HE2 GLN 25 8.159 -5.245 3.992
239 H SER 26 H SER 26 10.293 -4.092 -2.362
240 HA SER 26 HA SER 26 9.119 -6.575 -3.315
241 HB2 SER 26 2HB SER 26 11.827 -5.338 -3.851
242 HB3 SER 26 1HB SER 26 11.167 -6.769 -4.642
243 HG SER 26 HG SER 26 9.763 -5.562 -5.732
244 H ASN 27 H ASN 27 9.784 -8.622 -2.615
245 HA ASN 27 HA ASN 27 10.688 -8.977 -0.050
246 HB2 ASN 27 2HB ASN 27 9.174 -10.418 -1.303
247 HB3 ASN 27 1HB ASN 27 10.489 -10.890 -2.372
248 HD21 ASN 27 1HD2 ASN 27 9.031 -11.214 0.707
249 HD22 ASN 27 2HD2 ASN 27 9.988 -12.530 1.239
250 H GLU 28 H GLU 28 12.502 -8.662 -2.994
251 HA GLU 28 HA GLU 28 14.853 -9.976 -2.051
252 HB2 GLU 28 2HB GLU 28 14.572 -7.879 -4.177
253 HB3 GLU 28 1HB GLU 28 16.066 -8.717 -3.808
254 HG2 GLU 28 2HG GLU 28 14.938 -10.845 -4.401
255 HG3 GLU 28 1HG GLU 28 13.534 -9.904 -4.896
256 H ALA 29 H ALA 29 13.727 -6.662 -1.878
257 HA ALA 29 HA ALA 29 16.258 -5.829 -0.676
258 HB1 ALA 29 1HB ALA 29 15.432 -3.557 -0.943
259 HB2 ALA 29 2HB ALA 29 13.873 -4.175 -1.489
260 HB3 ALA 29 3HB ALA 29 15.316 -4.440 -2.466
261 H CYS 30 H CYS 30 13.107 -6.711 0.220
262 HA CYS 30 HA CYS 30 13.574 -5.663 2.919
263 HB2 CYS 30 2HB CYS 30 10.969 -5.799 1.432
264 HB3 CYS 30 1HB CYS 30 11.197 -5.218 3.070
265 H ASN 31 H ASN 31 12.219 -6.861 4.510
266 HA ASN 31 HA ASN 31 12.716 -9.588 4.507
267 HB2 ASN 31 2HB ASN 31 12.291 -8.314 6.544
268 HB3 ASN 31 1HB ASN 31 10.624 -8.053 6.052
269 HD21 ASN 31 1HD2 ASN 31 9.817 -9.047 7.905
270 HD22 ASN 31 2HD2 ASN 31 9.897 -10.749 8.128
271 H ILE 32 H ILE 32 9.758 -7.880 3.680
272 HA ILE 32 HA ILE 32 8.660 -10.324 2.477
273 HB ILE 32 HB ILE 32 6.428 -9.735 3.376
274 HG12 ILE 32 2HG1 ILE 32 7.935 -7.612 4.927
275 HG13 ILE 32 1HG1 ILE 32 6.775 -7.325 3.642
276 HG21 ILE 32 1HG2 ILE 32 8.516 -9.984 5.501
277 HG22 ILE 32 2HG2 ILE 32 7.832 -11.333 4.587
278 HG23 ILE 32 3HG2 ILE 32 6.809 -10.399 5.700
279 HD11 ILE 32 1HD1 ILE 32 6.179 -8.555 6.323
280 HD12 ILE 32 2HD1 ILE 32 5.006 -8.262 5.041
281 HD13 ILE 32 3HD1 ILE 32 5.813 -6.904 5.824
282 H LYS 33 H LYS 33 6.601 -9.592 1.218
283 HA LYS 33 HA LYS 33 7.131 -7.042 -0.101
284 HB2 LYS 33 2HB LYS 33 6.918 -9.001 -1.600
285 HB3 LYS 33 1HB LYS 33 5.333 -9.350 -0.926
286 HG2 LYS 33 2HG LYS 33 4.492 -7.216 -1.792
287 HG3 LYS 33 1HG LYS 33 6.081 -6.864 -2.455
288 HD2 LYS 33 2HD LYS 33 5.896 -8.855 -3.905
289 HD3 LYS 33 1HD LYS 33 4.287 -9.160 -3.245
290 HE2 LYS 33 2HE LYS 33 3.513 -7.007 -4.090
291 HE3 LYS 33 1HE LYS 33 5.128 -6.661 -4.708
292 HZ1 LYS 33 1HZ LYS 33 3.344 -8.859 -5.634
293 HZ2 LYS 33 2HZ LYS 33 4.894 -8.582 -6.188
294 HZ3 LYS 33 3HZ LYS 33 3.692 -7.429 -6.456
295 H ALA 34 H ALA 34 6.045 -5.402 0.851
296 HA ALA 34 HA ALA 34 3.251 -5.843 1.540
297 HB1 ALA 34 1HB ALA 34 4.517 -5.892 3.673
298 HB2 ALA 34 2HB ALA 34 3.572 -4.424 3.567
299 HB3 ALA 34 3HB ALA 34 5.301 -4.378 3.255
300 H ILE 35 H ILE 35 2.125 -4.467 0.278
301 HA ILE 35 HA ILE 35 3.451 -2.316 -1.021
302 HB ILE 35 HB ILE 35 0.506 -3.017 -0.878
303 HG12 ILE 35 2HG1 ILE 35 2.067 -4.630 -1.933
304 HG13 ILE 35 1HG1 ILE 35 0.841 -4.014 -3.068
305 HG21 ILE 35 1HG2 ILE 35 0.220 -1.453 -2.798
306 HG22 ILE 35 2HG2 ILE 35 1.910 -1.016 -2.680
307 HG23 ILE 35 3HG2 ILE 35 0.816 -0.601 -1.377
308 HD11 ILE 35 1HD1 ILE 35 2.953 -4.242 -4.105
309 HD12 ILE 35 2HD1 ILE 35 3.765 -3.292 -2.844
310 HD13 ILE 35 3HD1 ILE 35 2.620 -2.519 -3.946
311 H ILE 36 H ILE 36 3.631 -0.326 -0.442
312 HA ILE 36 HA ILE 36 2.731 0.275 2.254
313 HB ILE 36 HB ILE 36 4.946 1.413 0.551
314 HG12 ILE 36 2HG1 ILE 36 5.303 -0.173 3.018
315 HG13 ILE 36 1HG1 ILE 36 4.957 -1.044 1.516
316 HG21 ILE 36 1HG2 ILE 36 4.065 3.020 2.221
317 HG22 ILE 36 2HG2 ILE 36 5.686 2.466 2.654
318 HG23 ILE 36 3HG2 ILE 36 4.275 1.807 3.480
319 HD11 ILE 36 1HD1 ILE 36 6.940 -0.099 0.540
320 HD12 ILE 36 2HD1 ILE 36 7.322 -0.956 2.026
321 HD13 ILE 36 3HD1 ILE 36 7.288 0.823 2.016
322 H PHE 37 H PHE 37 0.994 1.401 2.237
323 HA PHE 37 HA PHE 37 0.134 3.073 0.062
324 HB2 PHE 37 2HB PHE 37 -0.976 2.123 2.659
325 HB3 PHE 37 1HB PHE 37 -1.783 3.433 1.781
326 HD1 PHE 37 1HD PHE 37 -0.110 0.618 0.182
327 HD2 PHE 37 2HD PHE 37 -3.772 2.219 1.453
328 HE1 PHE 37 1HE PHE 37 -1.327 -1.075 -1.192
329 HE2 PHE 37 2HE PHE 37 -4.997 0.568 0.116
330 HZ PHE 37 HZ PHE 37 -3.772 -1.073 -1.207
331 H THR 38 H THR 38 0.037 5.192 0.087
332 HA THR 38 HA THR 38 0.980 6.504 2.512
333 HB THR 38 HB THR 38 1.397 7.439 -0.351
334 HG1 THR 38 1HG THR 38 2.562 5.586 0.996
335 HG21 THR 38 1HG2 THR 38 1.274 9.227 1.310
336 HG22 THR 38 2HG2 THR 38 2.935 9.061 0.707
337 HG23 THR 38 3HG2 THR 38 2.482 8.415 2.292
338 H THR 39 H THR 39 -0.402 7.979 3.337
339 HA THR 39 HA THR 39 -2.970 8.218 2.038
340 HB THR 39 HB THR 39 -3.533 9.526 4.149
341 HG1 THR 39 1HG THR 39 -1.786 8.472 5.737
342 HG21 THR 39 1HG2 THR 39 -4.227 7.214 3.837
343 HG22 THR 39 2HG2 THR 39 -3.738 7.481 5.511
344 HG23 THR 39 3HG2 THR 39 -2.648 6.660 4.398
345 H LYS 40 H LYS 40 -4.035 10.472 2.299
346 HA LYS 40 HA LYS 40 -2.493 12.370 0.892
347 HB2 LYS 40 2HB LYS 40 -4.879 12.938 2.606
348 HB3 LYS 40 1HB LYS 40 -4.350 13.899 1.224
349 HG2 LYS 40 2HG LYS 40 -4.837 11.596 -0.105
350 HG3 LYS 40 1HG LYS 40 -5.768 11.292 1.317
351 HD2 LYS 40 2HD LYS 40 -7.139 13.223 1.008
352 HD3 LYS 40 1HD LYS 40 -6.103 13.742 -0.332
353 HE2 LYS 40 2HE LYS 40 -6.711 11.813 -1.618
354 HE3 LYS 40 1HE LYS 40 -7.688 11.186 -0.308
355 HZ1 LYS 40 1HZ LYS 40 -9.123 13.156 -0.506
356 HZ2 LYS 40 2HZ LYS 40 -9.071 12.264 -1.931
357 HZ3 LYS 40 3HZ LYS 40 -8.202 13.697 -1.811
358 H LYS 41 H LYS 41 -2.735 11.551 4.181
359 HA LYS 41 HA LYS 41 -1.585 13.947 5.283
360 HB2 LYS 41 2HB LYS 41 -1.776 11.134 6.408
361 HB3 LYS 41 1HB LYS 41 -1.146 12.494 7.299
362 HG2 LYS 41 2HG LYS 41 -3.368 12.065 8.059
363 HG3 LYS 41 1HG LYS 41 -3.424 13.553 7.122
364 HD2 LYS 41 2HD LYS 41 -4.319 12.297 5.211
365 HD3 LYS 41 1HD LYS 41 -4.227 10.804 6.143
366 HE2 LYS 41 2HE LYS 41 -5.912 13.216 6.826
367 HE3 LYS 41 1HE LYS 41 -6.501 11.713 6.124
368 HZ1 LYS 41 1HZ LYS 41 -5.261 12.000 8.822
369 HZ2 LYS 41 2HZ LYS 41 -5.807 10.546 8.139
370 HZ3 LYS 41 3HZ LYS 41 -6.884 11.783 8.495
371 H GLY 42 H GLY 42 -0.554 11.359 3.471
372 HA2 GLY 42 2HA GLY 42 1.455 10.989 2.501
373 HA3 GLY 42 1HA GLY 42 2.145 12.251 3.485
374 H ARG 43 H ARG 43 0.466 9.862 5.252
375 HA ARG 43 HA ARG 43 2.794 8.944 6.585
376 HB2 ARG 43 2HB ARG 43 0.570 9.306 7.597
377 HB3 ARG 43 1HB ARG 43 -0.044 8.024 6.562
378 HG2 ARG 43 2HG ARG 43 1.428 6.448 7.596
379 HG3 ARG 43 1HG ARG 43 2.046 7.723 8.663
380 HD2 ARG 43 2HD ARG 43 -0.197 7.993 9.630
381 HD3 ARG 43 1HD ARG 43 -0.814 6.734 8.557
382 HE ARG 43 HE ARG 43 1.385 5.905 10.179
383 HH11 ARG 43 1HH1 ARG 43 -2.137 6.246 10.104
384 HH12 ARG 43 2HH1 ARG 43 -2.434 5.073 11.288
385 HH21 ARG 43 1HH2 ARG 43 0.998 4.269 11.814
386 HH22 ARG 43 2HH2 ARG 43 -0.577 3.922 12.311
387 H LYS 44 H LYS 44 3.608 6.753 6.545
388 HA LYS 44 HA LYS 44 2.983 5.237 4.121
389 HB2 LYS 44 2HB LYS 44 5.277 5.008 6.089
390 HB3 LYS 44 1HB LYS 44 5.029 3.902 4.751
391 HG2 LYS 44 2HG LYS 44 5.490 6.861 4.473
392 HG3 LYS 44 1HG LYS 44 6.736 5.625 4.294
393 HD2 LYS 44 2HD LYS 44 5.470 4.631 2.438
394 HD3 LYS 44 1HD LYS 44 4.238 5.882 2.613
395 HE2 LYS 44 2HE LYS 44 5.891 7.600 2.085
396 HE3 LYS 44 1HE LYS 44 7.139 6.365 1.938
397 HZ1 LYS 44 1HZ LYS 44 5.972 5.438 0.039
398 HZ2 LYS 44 2HZ LYS 44 6.267 7.069 -0.183
399 HZ3 LYS 44 3HZ LYS 44 4.707 6.553 0.220
400 H ILE 45 H ILE 45 1.516 3.747 4.275
401 HA ILE 45 HA ILE 45 1.088 2.326 6.812
402 HB ILE 45 HB ILE 45 -0.798 2.598 4.446
403 HG12 ILE 45 2HG1 ILE 45 -2.273 3.873 6.187
404 HG13 ILE 45 1HG1 ILE 45 -0.768 4.022 7.097
405 HG21 ILE 45 1HG2 ILE 45 -1.269 1.295 7.113
406 HG22 ILE 45 2HG2 ILE 45 -1.137 0.502 5.545
407 HG23 ILE 45 3HG2 ILE 45 -2.502 1.567 5.883
408 HD11 ILE 45 1HD1 ILE 45 -1.302 5.996 5.846
409 HD12 ILE 45 2HD1 ILE 45 -1.248 5.068 4.348
410 HD13 ILE 45 3HD1 ILE 45 0.223 5.266 5.309
411 H CYS 46 H CYS 46 1.732 0.306 6.821
412 HA CYS 46 HA CYS 46 2.667 -1.013 4.401
413 HB2 CYS 46 2HB CYS 46 2.551 -2.035 7.231
414 HB3 CYS 46 1HB CYS 46 3.550 -2.669 5.947
415 H ALA 47 H ALA 47 1.155 -2.094 3.163
416 HA ALA 47 HA ALA 47 -1.028 -3.397 4.633
417 HB1 ALA 47 1HB ALA 47 -1.143 -2.158 1.890
418 HB2 ALA 47 2HB ALA 47 -1.787 -1.442 3.367
419 HB3 ALA 47 3HB ALA 47 -2.473 -2.941 2.745
420 H ASN 48 H ASN 48 -1.789 -5.411 3.876
421 HA ASN 48 HA ASN 48 0.173 -7.008 2.580
422 HB2 ASN 48 2HB ASN 48 -0.962 -7.993 4.362
423 HB3 ASN 48 1HB ASN 48 -2.547 -7.562 3.799
424 HD21 ASN 48 1HD2 ASN 48 0.126 -9.040 1.970
425 HD22 ASN 48 2HD2 ASN 48 -0.750 -10.494 1.625
426 HA PRO 49 HA PRO 49 -1.361 -5.977 -1.541
427 HB2 PRO 49 2HB PRO 49 0.257 -7.828 -2.770
428 HB3 PRO 49 1HB PRO 49 0.681 -6.139 -2.488
429 HG2 PRO 49 2HG PRO 49 1.474 -8.571 -0.986
430 HG3 PRO 49 1HG PRO 49 2.382 -7.074 -1.251
431 HD2 PRO 49 2HD PRO 49 1.229 -7.644 1.110
432 HD3 PRO 49 1HD PRO 49 1.346 -5.992 0.506
433 H ASN 50 H ASN 50 -1.247 -9.087 0.023
434 HA ASN 50 HA ASN 50 -2.700 -10.332 -2.048
435 HB2 ASN 50 2HB ASN 50 -2.041 -11.324 0.717
436 HB3 ASN 50 1HB ASN 50 -2.836 -12.238 -0.570
437 HD21 ASN 50 1HD2 ASN 50 -0.223 -12.428 0.822
438 HD22 ASN 50 2HD2 ASN 50 0.946 -12.619 -0.427
439 H GLU 51 H GLU 51 -3.642 -8.066 0.087
440 HA GLU 51 HA GLU 51 -6.201 -9.291 0.690
441 HB2 GLU 51 2HB GLU 51 -5.259 -6.527 1.421
442 HB3 GLU 51 1HB GLU 51 -6.740 -7.284 1.965
443 HG2 GLU 51 2HG GLU 51 -5.028 -9.111 2.872
444 HG3 GLU 51 1HG GLU 51 -3.953 -7.754 2.706
445 H LYS 52 H LYS 52 -8.044 -8.842 -0.218
446 HA LYS 52 HA LYS 52 -8.214 -7.980 -2.831
447 HB2 LYS 52 2HB LYS 52 -9.905 -9.382 -1.709
448 HB3 LYS 52 1HB LYS 52 -10.400 -7.998 -0.750
449 HG2 LYS 52 2HG LYS 52 -11.104 -6.836 -2.794
450 HG3 LYS 52 1HG LYS 52 -10.642 -8.245 -3.743
451 HD2 LYS 52 2HD LYS 52 -13.040 -8.259 -3.376
452 HD3 LYS 52 1HD LYS 52 -12.301 -9.590 -2.494
453 HE2 LYS 52 2HE LYS 52 -12.416 -8.306 -0.425
454 HE3 LYS 52 1HE LYS 52 -13.089 -6.931 -1.296
455 HZ1 LYS 52 1HZ LYS 52 -14.804 -8.182 -0.184
456 HZ2 LYS 52 2HZ LYS 52 -14.368 -9.595 -0.975
457 HZ3 LYS 52 3HZ LYS 52 -15.013 -8.305 -1.849
458 H TRP 53 H TRP 53 -8.725 -6.109 0.153
459 HA TRP 53 HA TRP 53 -9.774 -3.843 -1.166
460 HB2 TRP 53 2HB TRP 53 -9.539 -2.601 0.898
461 HB3 TRP 53 1HB TRP 53 -10.087 -4.217 1.293
462 HD1 TRP 53 HD TRP 53 -8.262 -5.803 2.619
463 HE1 TRP 53 1HE TRP 53 -6.229 -5.165 4.075
464 HE3 TRP 53 3HE TRP 53 -7.689 -0.940 1.163
465 HZ2 TRP 53 2HZ TRP 53 -4.630 -2.938 4.551
466 HZ3 TRP 53 3HZ TRP 53 -5.881 0.368 2.165
467 HH2 TRP 53 HH TRP 53 -4.378 -0.606 3.829
468 H VAL 54 H VAL 54 -6.551 -4.841 -0.413
469 HA VAL 54 HA VAL 54 -5.232 -2.417 -1.075
470 HB VAL 54 HB VAL 54 -4.191 -5.265 -0.894
471 HG11 VAL 54 1HG1 VAL 54 -2.635 -2.692 -1.131
472 HG12 VAL 54 2HG1 VAL 54 -2.709 -3.973 -2.339
473 HG13 VAL 54 3HG1 VAL 54 -1.940 -4.257 -0.765
474 HG21 VAL 54 1HG2 VAL 54 -3.976 -2.939 0.990
475 HG22 VAL 54 2HG2 VAL 54 -3.266 -4.533 1.229
476 HG23 VAL 54 3HG2 VAL 54 -5.022 -4.339 1.194
477 H GLN 55 H GLN 55 -5.958 -5.389 -2.735
478 HA GLN 55 HA GLN 55 -4.574 -4.800 -5.092
479 HB2 GLN 55 2HB GLN 55 -6.900 -6.652 -4.687
480 HB3 GLN 55 1HB GLN 55 -5.832 -6.643 -6.095
481 HG2 GLN 55 2HG GLN 55 -3.924 -6.959 -4.536
482 HG3 GLN 55 1HG GLN 55 -5.098 -7.210 -3.255
483 HE21 GLN 55 1HE2 GLN 55 -3.105 -8.893 -4.209
484 HE22 GLN 55 2HE2 GLN 55 -3.826 -10.324 -4.812
485 H LYS 56 H LYS 56 -7.806 -4.091 -3.975
486 HA LYS 56 HA LYS 56 -8.899 -3.051 -6.349
487 HB2 LYS 56 2HB LYS 56 -10.280 -3.687 -4.455
488 HB3 LYS 56 1HB LYS 56 -9.442 -2.550 -3.427
489 HG2 LYS 56 2HG LYS 56 -10.337 -0.707 -4.675
490 HG3 LYS 56 1HG LYS 56 -11.168 -1.828 -5.767
491 HD2 LYS 56 2HD LYS 56 -12.511 -2.664 -3.958
492 HD3 LYS 56 1HD LYS 56 -11.593 -1.712 -2.788
493 HE2 LYS 56 2HE LYS 56 -13.318 -0.592 -4.998
494 HE3 LYS 56 1HE LYS 56 -13.782 -0.710 -3.302
495 HZ1 LYS 56 1HZ LYS 56 -11.553 0.889 -4.410
496 HZ2 LYS 56 2HZ LYS 56 -11.891 0.754 -2.763
497 HZ3 LYS 56 3HZ LYS 56 -13.004 1.498 -3.807
498 H ALA 57 H ALA 57 -7.271 -1.589 -3.565
499 HA ALA 57 HA ALA 57 -7.346 1.089 -4.432
500 HB1 ALA 57 1HB ALA 57 -5.603 1.467 -2.761
501 HB2 ALA 57 2HB ALA 57 -5.387 -0.271 -2.587
502 HB3 ALA 57 3HB ALA 57 -6.918 0.492 -2.107
503 H MET 58 H MET 58 -4.853 -1.382 -4.796
504 HA MET 58 HA MET 58 -3.005 0.275 -5.924
505 HB2 MET 58 2HB MET 58 -3.246 -2.703 -6.262
506 HB3 MET 58 1HB MET 58 -1.903 -1.773 -6.908
507 HG2 MET 58 2HG MET 58 -1.522 -0.956 -4.550
508 HG3 MET 58 1HG MET 58 -2.658 -2.203 -4.037
509 HE1 MET 58 1HE MET 58 -0.700 -5.438 -5.168
510 HE2 MET 58 2HE MET 58 -1.933 -4.600 -6.120
511 HE3 MET 58 3HE MET 58 -2.173 -4.868 -4.381
512 H LYS 59 H LYS 59 -5.656 -1.374 -7.437
513 HA LYS 59 HA LYS 59 -4.802 -1.158 -10.091
514 HB2 LYS 59 2HB LYS 59 -6.552 -2.666 -9.236
515 HB3 LYS 59 1HB LYS 59 -7.574 -1.282 -8.901
516 HG2 LYS 59 2HG LYS 59 -7.607 -0.765 -11.306
517 HG3 LYS 59 1HG LYS 59 -6.625 -2.203 -11.599
518 HD2 LYS 59 2HD LYS 59 -9.387 -2.150 -10.382
519 HD3 LYS 59 1HD LYS 59 -8.974 -2.662 -12.016
520 HE2 LYS 59 2HE LYS 59 -7.585 -4.483 -11.060
521 HE3 LYS 59 1HE LYS 59 -8.075 -3.978 -9.450
522 HZ1 LYS 59 1HZ LYS 59 -9.394 -5.821 -10.177
523 HZ2 LYS 59 2HZ LYS 59 -9.861 -5.036 -11.570
524 HZ3 LYS 59 3HZ LYS 59 -10.398 -4.471 -10.073
525 H HIS 60 H HIS 60 -6.695 0.849 -7.919
526 HA HIS 60 HA HIS 60 -7.302 2.850 -9.828
527 HB2 HIS 60 2HB HIS 60 -8.792 2.493 -7.995
528 HB3 HIS 60 1HB HIS 60 -7.492 2.700 -6.832
529 HD1 HIS 60 1HD HIS 60 -9.513 4.758 -9.326
530 HD2 HIS 60 2HD HIS 60 -7.195 5.197 -5.927
531 HE1 HIS 60 1HE HIS 60 -9.734 7.168 -8.684
532 HE2 HIS 60 2HE HIS 60 -8.032 7.458 -6.874
533 H LEU 61 H LEU 61 -4.917 2.524 -7.253
534 HA LEU 61 HA LEU 61 -3.898 5.170 -7.500
535 HB2 LEU 61 2HB LEU 61 -2.731 2.739 -6.187
536 HB3 LEU 61 1HB LEU 61 -2.090 4.362 -6.031
537 HG LEU 61 HG LEU 61 -4.834 3.496 -5.122
538 HD11 LEU 61 1HD1 LEU 61 -2.315 3.988 -3.546
539 HD12 LEU 61 2HD1 LEU 61 -3.135 2.434 -3.787
540 HD13 LEU 61 3HD1 LEU 61 -3.918 3.712 -2.872
541 HD21 LEU 61 1HD2 LEU 61 -3.302 6.060 -4.697
542 HD22 LEU 61 2HD2 LEU 61 -4.847 5.656 -3.955
543 HD23 LEU 61 3HD2 LEU 61 -4.741 5.864 -5.702
544 H ASP 62 H ASP 62 -3.138 2.215 -9.178
545 HA ASP 62 HA ASP 62 -0.526 3.036 -10.020
546 HB2 ASP 62 2HB ASP 62 -1.231 0.659 -9.988
547 HB3 ASP 62 1HB ASP 62 -2.397 1.021 -11.255
548 H LYS 63 H LYS 63 -3.741 3.494 -11.165
549 HA LYS 63 HA LYS 63 -2.740 4.910 -13.456
550 HB2 LYS 63 2HB LYS 63 -5.161 4.828 -14.262
551 HB3 LYS 63 1HB LYS 63 -4.333 3.283 -14.184
552 HG2 LYS 63 2HG LYS 63 -5.440 2.805 -12.045
553 HG3 LYS 63 1HG LYS 63 -6.277 4.352 -12.144
554 HD2 LYS 63 2HD LYS 63 -7.425 3.622 -14.157
555 HD3 LYS 63 1HD LYS 63 -6.520 2.104 -14.146
556 HE2 LYS 63 2HE LYS 63 -7.541 1.489 -12.009
557 HE3 LYS 63 1HE LYS 63 -8.399 3.019 -11.960
558 HZ1 LYS 63 1HZ LYS 63 -8.784 0.922 -14.039
559 HZ2 LYS 63 2HZ LYS 63 -9.616 2.395 -13.932
560 HZ3 LYS 63 3HZ LYS 63 -9.814 1.216 -12.752
561 H LYS 64 H LYS 64 -2.094 6.649 -12.272
562 HA LYS 64 HA LYS 64 -4.262 8.273 -11.163
563 HB2 LYS 64 2HB LYS 64 -2.703 7.412 -9.433
564 HB3 LYS 64 1HB LYS 64 -1.383 8.235 -10.247
565 HG2 LYS 64 2HG LYS 64 -2.133 9.517 -8.339
566 HG3 LYS 64 1HG LYS 64 -2.508 10.390 -9.831
567 HD2 LYS 64 2HD LYS 64 -4.808 9.552 -9.725
568 HD3 LYS 64 1HD LYS 64 -4.419 8.702 -8.225
569 HE2 LYS 64 2HE LYS 64 -3.888 10.865 -7.194
570 HE3 LYS 64 1HE LYS 64 -4.340 11.664 -8.701
571 HZ1 LYS 64 1HZ LYS 64 -6.153 11.702 -7.131
572 HZ2 LYS 64 2HZ LYS 64 -6.138 10.029 -7.010
573 HZ3 LYS 64 3HZ LYS 64 -6.582 10.773 -8.455
Start of MODEL 4
1 H1 ALA 1 1HT ALA 1 16.666 5.367 12.082
2 H2 ALA 1 2HT ALA 1 15.884 4.918 13.487
3 H3 ALA 1 3HT ALA 1 15.034 5.721 12.251
4 HA ALA 1 HA ALA 1 16.247 3.047 12.061
5 HB1 ALA 1 1HB ALA 1 14.226 3.048 13.444
6 HB2 ALA 1 2HB ALA 1 13.955 2.220 11.910
7 HB3 ALA 1 3HB ALA 1 13.345 3.856 12.146
8 H ARG 2 H ARG 2 17.055 2.905 10.063
9 HA ARG 2 HA ARG 2 15.491 4.061 7.893
10 HB2 ARG 2 2HB ARG 2 17.597 3.991 6.549
11 HB3 ARG 2 1HB ARG 2 17.682 5.065 7.932
12 HG2 ARG 2 2HG ARG 2 19.037 3.478 9.126
13 HG3 ARG 2 1HG ARG 2 18.841 2.284 7.841
14 HD2 ARG 2 2HD ARG 2 20.148 4.987 7.549
15 HD3 ARG 2 1HD ARG 2 20.998 3.454 7.710
16 HE ARG 2 HE ARG 2 19.902 2.770 5.609
17 HH11 ARG 2 1HH1 ARG 2 20.226 6.252 6.251
18 HH12 ARG 2 2HH1 ARG 2 20.283 6.648 4.591
19 HH21 ARG 2 1HH2 ARG 2 19.981 3.387 3.352
20 HH22 ARG 2 2HH2 ARG 2 20.136 5.033 2.939
21 H LYS 3 H LYS 3 14.367 2.658 6.807
22 HA LYS 3 HA LYS 3 15.520 0.019 6.274
23 HB2 LYS 3 2HB LYS 3 12.695 0.368 7.310
24 HB3 LYS 3 1HB LYS 3 13.440 -1.135 6.815
25 HG2 LYS 3 2HG LYS 3 15.038 -0.923 8.677
26 HG3 LYS 3 1HG LYS 3 14.213 0.550 9.186
27 HD2 LYS 3 2HD LYS 3 12.128 -0.743 9.449
28 HD3 LYS 3 1HD LYS 3 13.007 -2.209 9.005
29 HE2 LYS 3 2HE LYS 3 13.528 -0.446 11.394
30 HE3 LYS 3 1HE LYS 3 12.800 -2.051 11.414
31 HZ1 LYS 3 1HZ LYS 3 15.107 -2.202 12.019
32 HZ2 LYS 3 2HZ LYS 3 15.587 -1.368 10.664
33 HZ3 LYS 3 3HZ LYS 3 14.948 -2.905 10.495
34 H SER 4 H SER 4 12.677 2.108 5.795
35 HA SER 4 HA SER 4 11.430 2.657 4.018
36 HB2 SER 4 2HB SER 4 13.753 1.611 2.362
37 HB3 SER 4 1HB SER 4 12.455 2.654 1.774
38 HG SER 4 HG SER 4 13.517 3.719 3.966
39 H CYS 5 H CYS 5 11.676 -0.088 5.183
40 HA CYS 5 HA CYS 5 10.036 -1.527 3.231
41 HB2 CYS 5 2HB CYS 5 12.214 -2.686 4.983
42 HB3 CYS 5 1HB CYS 5 11.090 -3.623 4.009
43 H CYS 6 H CYS 6 8.587 -3.025 4.294
44 HA CYS 6 HA CYS 6 8.013 -2.343 7.070
45 HB2 CYS 6 2HB CYS 6 6.313 -3.238 4.784
46 HB3 CYS 6 1HB CYS 6 5.728 -3.101 6.439
47 H LEU 7 H LEU 7 7.639 -4.012 8.439
48 HA LEU 7 HA LEU 7 8.293 -6.719 7.483
49 HB2 LEU 7 2HB LEU 7 8.530 -5.573 10.265
50 HB3 LEU 7 1HB LEU 7 9.057 -7.160 9.750
51 HG LEU 7 HG LEU 7 10.254 -4.521 8.908
52 HD11 LEU 7 1HD1 LEU 7 11.321 -6.710 10.670
53 HD12 LEU 7 2HD1 LEU 7 10.798 -5.107 11.185
54 HD13 LEU 7 3HD1 LEU 7 12.211 -5.279 10.145
55 HD21 LEU 7 1HD2 LEU 7 11.049 -7.336 8.162
56 HD22 LEU 7 2HD2 LEU 7 11.974 -5.879 7.799
57 HD23 LEU 7 3HD2 LEU 7 10.383 -6.113 7.080
58 H LYS 8 H LYS 8 5.781 -4.777 8.360
59 HA LYS 8 HA LYS 8 4.154 -6.996 9.255
60 HB2 LYS 8 2HB LYS 8 3.070 -5.525 10.823
61 HB3 LYS 8 1HB LYS 8 4.783 -5.669 11.218
62 HG2 LYS 8 2HG LYS 8 5.142 -3.477 10.076
63 HG3 LYS 8 1HG LYS 8 3.401 -3.346 9.866
64 HD2 LYS 8 2HD LYS 8 4.071 -2.058 11.805
65 HD3 LYS 8 1HD LYS 8 3.139 -3.462 12.332
66 HE2 LYS 8 2HE LYS 8 5.198 -4.638 12.897
67 HE3 LYS 8 1HE LYS 8 6.154 -3.283 12.307
68 HZ1 LYS 8 1HZ LYS 8 4.292 -3.261 14.606
69 HZ2 LYS 8 2HZ LYS 8 5.154 -1.916 14.038
70 HZ3 LYS 8 3HZ LYS 8 5.984 -3.255 14.664
71 H TYR 9 H TYR 9 1.851 -6.454 8.905
72 HA TYR 9 HA TYR 9 1.424 -4.509 6.745
73 HB2 TYR 9 2HB TYR 9 -0.358 -6.951 7.150
74 HB3 TYR 9 1HB TYR 9 -0.179 -5.906 5.797
75 HD1 TYR 9 1HD TYR 9 1.427 -6.255 4.111
76 HD2 TYR 9 2HD TYR 9 1.400 -8.710 7.565
77 HE1 TYR 9 1HE TYR 9 2.901 -7.869 2.972
78 HE2 TYR 9 2HE TYR 9 2.871 -10.322 6.453
79 HH TYR 9 HH TYR 9 4.448 -9.633 3.486
80 H THR 10 H THR 10 -0.623 -3.432 6.944
81 HA THR 10 HA THR 10 -1.388 -2.897 9.587
82 HB THR 10 HB THR 10 -1.534 -1.105 7.956
83 HG1 THR 10 1HG THR 10 -4.162 -1.042 8.149
84 HG21 THR 10 1HG2 THR 10 -3.207 -1.125 6.136
85 HG22 THR 10 2HG2 THR 10 -3.598 -2.808 6.534
86 HG23 THR 10 3HG2 THR 10 -1.985 -2.379 5.958
87 H LYS 11 H LYS 11 -3.165 -3.513 10.708
88 HA LYS 11 HA LYS 11 -4.624 -5.789 9.630
89 HB2 LYS 11 2HB LYS 11 -3.509 -5.852 11.902
90 HB3 LYS 11 1HB LYS 11 -4.652 -4.635 12.430
91 HG2 LYS 11 2HG LYS 11 -6.491 -6.169 12.113
92 HG3 LYS 11 1HG LYS 11 -5.395 -7.388 11.457
93 HD2 LYS 11 2HD LYS 11 -4.173 -7.389 13.608
94 HD3 LYS 11 1HD LYS 11 -5.354 -6.252 14.253
95 HE2 LYS 11 2HE LYS 11 -7.130 -7.885 13.891
96 HE3 LYS 11 1HE LYS 11 -5.957 -9.014 13.217
97 HZ1 LYS 11 1HZ LYS 11 -4.826 -9.066 15.354
98 HZ2 LYS 11 2HZ LYS 11 -6.423 -9.520 15.540
99 HZ3 LYS 11 3HZ LYS 11 -5.934 -7.975 16.001
100 H ARG 12 H ARG 12 -4.865 -2.519 9.716
101 HA ARG 12 HA ARG 12 -7.805 -2.524 9.765
102 HB2 ARG 12 2HB ARG 12 -6.694 -1.080 11.473
103 HB3 ARG 12 1HB ARG 12 -5.926 -0.186 10.170
104 HG2 ARG 12 2HG ARG 12 -7.804 1.091 10.863
105 HG3 ARG 12 1HG ARG 12 -8.241 0.352 9.321
106 HD2 ARG 12 2HD ARG 12 -10.096 0.148 10.865
107 HD3 ARG 12 1HD ARG 12 -9.413 -1.456 10.572
108 HE ARG 12 HE ARG 12 -8.330 -0.055 12.831
109 HH11 ARG 12 1HH1 ARG 12 -10.765 -2.440 11.804
110 HH12 ARG 12 2HH1 ARG 12 -11.024 -3.010 13.386
111 HH21 ARG 12 1HH2 ARG 12 -8.724 -0.878 14.968
112 HH22 ARG 12 2HH2 ARG 12 -9.831 -2.121 15.216
113 HA PRO 13 HA PRO 13 -7.131 -1.705 5.318
114 HB2 PRO 13 2HB PRO 13 -10.083 -1.488 5.424
115 HB3 PRO 13 1HB PRO 13 -9.073 -2.498 4.380
116 HG2 PRO 13 2HG PRO 13 -10.482 -3.562 6.380
117 HG3 PRO 13 1HG PRO 13 -8.861 -4.163 5.980
118 HD2 PRO 13 2HD PRO 13 -9.720 -2.361 8.210
119 HD3 PRO 13 1HD PRO 13 -8.532 -3.691 8.188
120 H LEU 14 H LEU 14 -7.047 0.245 4.288
121 HA LEU 14 HA LEU 14 -8.004 2.644 5.663
122 HB2 LEU 14 2HB LEU 14 -6.378 2.294 3.157
123 HB3 LEU 14 1HB LEU 14 -6.766 3.821 3.899
124 HG LEU 14 HG LEU 14 -5.008 1.689 5.107
125 HD11 LEU 14 1HD1 LEU 14 -4.087 2.722 3.096
126 HD12 LEU 14 2HD1 LEU 14 -3.200 3.251 4.521
127 HD13 LEU 14 3HD1 LEU 14 -4.395 4.319 3.762
128 HD21 LEU 14 1HD2 LEU 14 -6.139 3.088 6.790
129 HD22 LEU 14 2HD2 LEU 14 -5.595 4.533 5.936
130 HD23 LEU 14 3HD2 LEU 14 -4.415 3.468 6.693
131 HA PRO 15 HA PRO 15 -11.095 3.094 2.377
132 HB2 PRO 15 2HB PRO 15 -11.034 5.984 2.778
133 HB3 PRO 15 1HB PRO 15 -12.350 4.864 3.140
134 HG2 PRO 15 2HG PRO 15 -10.936 6.147 5.074
135 HG3 PRO 15 1HG PRO 15 -11.654 4.544 5.310
136 HD2 PRO 15 2HD PRO 15 -8.819 5.282 4.690
137 HD3 PRO 15 1HD PRO 15 -9.449 4.054 5.811
138 H LEU 16 H LEU 16 -10.695 3.391 0.255
139 HA LEU 16 HA LEU 16 -8.137 4.173 -0.579
140 HB2 LEU 16 2HB LEU 16 -9.253 2.522 -1.820
141 HB3 LEU 16 1HB LEU 16 -10.607 3.638 -2.157
142 HG LEU 16 HG LEU 16 -9.021 4.926 -3.542
143 HD11 LEU 16 1HD1 LEU 16 -6.877 3.834 -4.151
144 HD12 LEU 16 2HD1 LEU 16 -7.168 2.648 -2.887
145 HD13 LEU 16 3HD1 LEU 16 -6.935 4.350 -2.470
146 HD21 LEU 16 1HD2 LEU 16 -9.284 2.022 -4.164
147 HD22 LEU 16 2HD2 LEU 16 -8.956 3.336 -5.330
148 HD23 LEU 16 3HD2 LEU 16 -10.480 3.308 -4.435
149 H LYS 17 H LYS 17 -11.081 5.883 -0.328
150 HA LYS 17 HA LYS 17 -10.599 8.090 -1.977
151 HB2 LYS 17 2HB LYS 17 -11.988 8.152 0.701
152 HB3 LYS 17 1HB LYS 17 -12.161 9.336 -0.581
153 HG2 LYS 17 2HG LYS 17 -13.106 6.478 -0.597
154 HG3 LYS 17 1HG LYS 17 -14.096 7.923 -0.484
155 HD2 LYS 17 2HD LYS 17 -13.415 8.582 -2.728
156 HD3 LYS 17 1HD LYS 17 -12.397 7.141 -2.857
157 HE2 LYS 17 2HE LYS 17 -14.424 5.748 -2.521
158 HE3 LYS 17 1HE LYS 17 -15.392 7.214 -2.517
159 HZ1 LYS 17 1HZ LYS 17 -13.732 6.269 -4.795
160 HZ2 LYS 17 2HZ LYS 17 -14.733 7.647 -4.780
161 HZ3 LYS 17 3HZ LYS 17 -15.402 6.113 -4.637
162 H ARG 18 H ARG 18 -8.802 7.101 0.659
163 HA ARG 18 HA ARG 18 -7.810 9.866 1.173
164 HB2 ARG 18 2HB ARG 18 -8.000 7.590 3.123
165 HB3 ARG 18 1HB ARG 18 -7.101 9.063 3.425
166 HG2 ARG 18 2HG ARG 18 -9.190 10.343 3.225
167 HG3 ARG 18 1HG ARG 18 -10.066 8.822 2.987
168 HD2 ARG 18 2HD ARG 18 -9.362 8.029 5.143
169 HD3 ARG 18 1HD ARG 18 -8.357 9.454 5.383
170 HE ARG 18 HE ARG 18 -11.078 10.121 4.939
171 HH11 ARG 18 1HH1 ARG 18 -8.827 8.929 7.384
172 HH12 ARG 18 2HH1 ARG 18 -9.703 9.555 8.701
173 HH21 ARG 18 1HH2 ARG 18 -12.283 10.979 6.751
174 HH22 ARG 18 2HH2 ARG 18 -11.710 10.741 8.342
175 H ILE 19 H ILE 19 -6.868 7.456 -0.555
176 HA ILE 19 HA ILE 19 -4.140 7.412 0.534
177 HB ILE 19 HB ILE 19 -5.335 5.500 -1.507
178 HG12 ILE 19 2HG1 ILE 19 -4.764 4.983 1.396
179 HG13 ILE 19 1HG1 ILE 19 -6.374 5.451 0.829
180 HG21 ILE 19 1HG2 ILE 19 -2.788 5.403 0.155
181 HG22 ILE 19 2HG2 ILE 19 -2.872 5.683 -1.583
182 HG23 ILE 19 3HG2 ILE 19 -3.342 4.125 -0.908
183 HD11 ILE 19 1HD1 ILE 19 -6.435 3.436 -0.563
184 HD12 ILE 19 2HD1 ILE 19 -6.165 3.023 1.128
185 HD13 ILE 19 3HD1 ILE 19 -4.838 3.022 -0.060
186 H LYS 20 H LYS 20 -2.516 8.300 -0.597
187 HA LYS 20 HA LYS 20 -3.156 9.758 -3.000
188 HB2 LYS 20 2HB LYS 20 -0.551 9.672 -1.445
189 HB3 LYS 20 1HB LYS 20 -0.932 10.778 -2.744
190 HG2 LYS 20 2HG LYS 20 -2.239 10.640 -0.095
191 HG3 LYS 20 1HG LYS 20 -1.113 11.868 -0.680
192 HD2 LYS 20 2HD LYS 20 -3.847 11.236 -1.706
193 HD3 LYS 20 1HD LYS 20 -3.428 12.626 -0.759
194 HE2 LYS 20 2HE LYS 20 -2.307 12.141 -3.538
195 HE3 LYS 20 1HE LYS 20 -3.580 13.287 -3.134
196 HZ1 LYS 20 1HZ LYS 20 -1.939 14.427 -1.648
197 HZ2 LYS 20 2HZ LYS 20 -1.487 14.440 -3.274
198 HZ3 LYS 20 3HZ LYS 20 -0.751 13.384 -2.221
199 H SER 21 H SER 21 -0.912 7.166 -1.955
200 HA SER 21 HA SER 21 -0.700 5.977 -4.475
201 HB2 SER 21 2HB SER 21 1.709 6.553 -4.912
202 HB3 SER 21 1HB SER 21 0.596 7.897 -5.153
203 HG SER 21 HG SER 21 1.558 8.942 -3.627
204 H TYR 22 H TYR 22 1.288 4.431 -4.439
205 HA TYR 22 HA TYR 22 1.919 3.628 -1.689
206 HB2 TYR 22 2HB TYR 22 1.539 1.315 -2.222
207 HB3 TYR 22 1HB TYR 22 0.068 2.235 -2.435
208 HD1 TYR 22 1HD TYR 22 -1.107 2.082 -4.393
209 HD2 TYR 22 2HD TYR 22 2.904 0.755 -4.412
210 HE1 TYR 22 1HE TYR 22 -1.417 1.169 -6.637
211 HE2 TYR 22 2HE TYR 22 2.602 -0.152 -6.683
212 HH TYR 22 HH TYR 22 -0.112 0.614 -8.568
213 H THR 23 H THR 23 3.620 2.041 -1.628
214 HA THR 23 HA THR 23 5.593 2.343 -3.785
215 HB THR 23 HB THR 23 6.060 1.838 -0.835
216 HG1 THR 23 1HG THR 23 5.868 4.134 -2.345
217 HG21 THR 23 1HG2 THR 23 7.731 0.803 -2.261
218 HG22 THR 23 2HG2 THR 23 8.441 2.158 -1.371
219 HG23 THR 23 3HG2 THR 23 8.021 2.338 -3.083
220 H ILE 24 H ILE 24 6.331 0.416 -4.644
221 HA ILE 24 HA ILE 24 5.046 -2.012 -3.733
222 HB ILE 24 HB ILE 24 6.868 -1.555 -6.116
223 HG12 ILE 24 2HG1 ILE 24 3.859 -1.810 -5.965
224 HG13 ILE 24 1HG1 ILE 24 4.745 -0.315 -6.245
225 HG21 ILE 24 1HG2 ILE 24 5.132 -3.931 -5.408
226 HG22 ILE 24 2HG2 ILE 24 6.896 -3.889 -5.375
227 HG23 ILE 24 3HG2 ILE 24 6.035 -3.738 -6.907
228 HD11 ILE 24 1HD1 ILE 24 4.698 -2.714 -8.066
229 HD12 ILE 24 2HD1 ILE 24 5.585 -1.217 -8.355
230 HD13 ILE 24 3HD1 ILE 24 3.825 -1.201 -8.312
231 H GLN 25 H GLN 25 6.001 -2.896 -2.029
232 HA GLN 25 HA GLN 25 8.900 -3.041 -1.891
233 HB2 GLN 25 2HB GLN 25 7.944 -2.399 0.165
234 HB3 GLN 25 1HB GLN 25 6.697 -3.622 0.096
235 HG2 GLN 25 2HG GLN 25 8.384 -5.346 0.411
236 HG3 GLN 25 1HG GLN 25 9.618 -4.092 0.512
237 HE21 GLN 25 1HE2 GLN 25 8.620 -6.099 2.435
238 HE22 GLN 25 2HE2 GLN 25 8.240 -5.219 3.864
239 H SER 26 H SER 26 9.882 -4.728 -2.689
240 HA SER 26 HA SER 26 8.423 -7.227 -3.055
241 HB2 SER 26 2HB SER 26 9.525 -6.261 -5.051
242 HB3 SER 26 1HB SER 26 11.067 -6.262 -4.197
243 HG SER 26 HG SER 26 10.928 -8.059 -5.527
244 H ASN 27 H ASN 27 9.478 -9.215 -2.336
245 HA ASN 27 HA ASN 27 10.864 -8.804 0.159
246 HB2 ASN 27 2HB ASN 27 10.746 -11.247 0.505
247 HB3 ASN 27 1HB ASN 27 9.175 -10.568 0.092
248 HD21 ASN 27 1HD2 ASN 27 8.176 -11.213 -1.769
249 HD22 ASN 27 2HD2 ASN 27 8.802 -12.453 -2.774
250 H GLU 28 H GLU 28 11.922 -8.685 -2.795
251 HA GLU 28 HA GLU 28 14.320 -10.210 -2.711
252 HB2 GLU 28 2HB GLU 28 13.584 -7.767 -4.299
253 HB3 GLU 28 1HB GLU 28 14.981 -8.793 -4.594
254 HG2 GLU 28 2HG GLU 28 13.566 -10.645 -5.157
255 HG3 GLU 28 1HG GLU 28 12.129 -9.733 -4.707
256 H ALA 29 H ALA 29 13.548 -6.785 -2.062
257 HA ALA 29 HA ALA 29 16.256 -6.414 -0.973
258 HB1 ALA 29 1HB ALA 29 15.883 -4.019 -1.231
259 HB2 ALA 29 2HB ALA 29 14.236 -4.323 -1.778
260 HB3 ALA 29 3HB ALA 29 15.605 -4.865 -2.752
261 H CYS 30 H CYS 30 12.977 -6.618 -0.080
262 HA CYS 30 HA CYS 30 13.618 -5.701 2.637
263 HB2 CYS 30 2HB CYS 30 10.956 -5.865 1.235
264 HB3 CYS 30 1HB CYS 30 11.232 -5.258 2.860
265 H ASN 31 H ASN 31 12.449 -7.044 4.333
266 HA ASN 31 HA ASN 31 12.981 -9.768 3.808
267 HB2 ASN 31 2HB ASN 31 11.569 -8.526 6.175
268 HB3 ASN 31 1HB ASN 31 11.955 -10.237 6.058
269 HD21 ASN 31 1HD2 ASN 31 12.857 -8.332 8.006
270 HD22 ASN 31 2HD2 ASN 31 14.584 -8.293 7.908
271 H ILE 32 H ILE 32 9.973 -8.010 3.712
272 HA ILE 32 HA ILE 32 8.715 -10.467 2.674
273 HB ILE 32 HB ILE 32 6.580 -9.878 3.723
274 HG12 ILE 32 2HG1 ILE 32 8.074 -7.586 5.021
275 HG13 ILE 32 1HG1 ILE 32 6.902 -7.425 3.721
276 HG21 ILE 32 1HG2 ILE 32 8.836 -9.850 5.684
277 HG22 ILE 32 2HG2 ILE 32 8.087 -11.305 5.012
278 HG23 ILE 32 3HG2 ILE 32 7.157 -10.237 6.086
279 HD11 ILE 32 1HD1 ILE 32 6.338 -8.464 6.488
280 HD12 ILE 32 2HD1 ILE 32 5.158 -8.290 5.188
281 HD13 ILE 32 3HD1 ILE 32 5.932 -6.859 5.872
282 H LYS 33 H LYS 33 6.558 -9.775 1.520
283 HA LYS 33 HA LYS 33 7.109 -7.351 0.002
284 HB2 LYS 33 2HB LYS 33 6.796 -9.411 -1.326
285 HB3 LYS 33 1HB LYS 33 5.221 -9.654 -0.581
286 HG2 LYS 33 2HG LYS 33 4.417 -7.584 -1.586
287 HG3 LYS 33 1HG LYS 33 5.999 -7.322 -2.304
288 HD2 LYS 33 2HD LYS 33 5.777 -9.389 -3.567
289 HD3 LYS 33 1HD LYS 33 4.174 -9.647 -2.874
290 HE2 LYS 33 2HE LYS 33 3.420 -7.519 -3.852
291 HE3 LYS 33 1HE LYS 33 5.013 -7.284 -4.564
292 HZ1 LYS 33 1HZ LYS 33 3.141 -9.500 -5.173
293 HZ2 LYS 33 2HZ LYS 33 4.677 -9.276 -5.878
294 HZ3 LYS 33 3HZ LYS 33 3.460 -8.166 -6.157
295 H ALA 34 H ALA 34 6.079 -5.608 0.767
296 HA ALA 34 HA ALA 34 3.304 -5.844 1.597
297 HB1 ALA 34 1HB ALA 34 4.589 -5.995 3.706
298 HB2 ALA 34 2HB ALA 34 3.710 -4.479 3.624
299 HB3 ALA 34 3HB ALA 34 5.437 -4.510 3.295
300 H ILE 35 H ILE 35 2.306 -4.449 0.276
301 HA ILE 35 HA ILE 35 3.648 -2.293 -1.037
302 HB ILE 35 HB ILE 35 0.665 -2.765 -0.685
303 HG12 ILE 35 2HG1 ILE 35 1.804 -4.627 -1.791
304 HG13 ILE 35 1HG1 ILE 35 0.712 -3.797 -2.902
305 HG21 ILE 35 1HG2 ILE 35 0.390 -1.311 -2.696
306 HG22 ILE 35 2HG2 ILE 35 2.108 -0.981 -2.657
307 HG23 ILE 35 3HG2 ILE 35 1.087 -0.463 -1.325
308 HD11 ILE 35 1HD1 ILE 35 2.686 -4.412 -4.021
309 HD12 ILE 35 2HD1 ILE 35 3.726 -3.643 -2.804
310 HD13 ILE 35 3HD1 ILE 35 2.691 -2.664 -3.863
311 H ILE 36 H ILE 36 4.031 -0.248 -0.301
312 HA ILE 36 HA ILE 36 2.928 0.375 2.330
313 HB ILE 36 HB ILE 36 5.090 1.922 0.847
314 HG12 ILE 36 2HG1 ILE 36 6.603 0.977 2.726
315 HG13 ILE 36 1HG1 ILE 36 5.350 -0.239 2.924
316 HG21 ILE 36 1HG2 ILE 36 3.936 3.300 2.408
317 HG22 ILE 36 2HG2 ILE 36 5.577 2.936 2.959
318 HG23 ILE 36 3HG2 ILE 36 4.197 2.097 3.687
319 HD11 ILE 36 1HD1 ILE 36 5.664 -0.906 0.614
320 HD12 ILE 36 2HD1 ILE 36 7.153 -1.029 1.570
321 HD13 ILE 36 3HD1 ILE 36 6.918 0.336 0.465
322 H PHE 37 H PHE 37 1.146 1.402 2.302
323 HA PHE 37 HA PHE 37 0.249 3.058 0.134
324 HB2 PHE 37 2HB PHE 37 -0.880 2.044 2.703
325 HB3 PHE 37 1HB PHE 37 -1.681 3.346 1.832
326 HD1 PHE 37 1HD PHE 37 -0.002 0.283 0.549
327 HD2 PHE 37 2HD PHE 37 -3.557 2.434 1.105
328 HE1 PHE 37 1HE PHE 37 -1.241 -1.387 -0.857
329 HE2 PHE 37 2HE PHE 37 -4.796 0.801 -0.276
330 HZ PHE 37 HZ PHE 37 -3.622 -1.098 -1.244
331 H THR 38 H THR 38 0.022 5.194 0.218
332 HA THR 38 HA THR 38 0.827 6.517 2.704
333 HB THR 38 HB THR 38 1.220 7.582 -0.102
334 HG1 THR 38 1HG THR 38 2.549 5.749 1.274
335 HG21 THR 38 1HG2 THR 38 1.006 9.268 1.606
336 HG22 THR 38 2HG2 THR 38 2.703 9.199 1.091
337 HG23 THR 38 3HG2 THR 38 2.182 8.453 2.614
338 H THR 39 H THR 39 -0.670 7.924 3.507
339 HA THR 39 HA THR 39 -3.166 8.079 2.064
340 HB THR 39 HB THR 39 -3.931 9.280 4.159
341 HG1 THR 39 1HG THR 39 -2.523 8.812 5.991
342 HG21 THR 39 1HG2 THR 39 -4.441 6.920 3.794
343 HG22 THR 39 2HG2 THR 39 -4.059 7.200 5.492
344 HG23 THR 39 3HG2 THR 39 -2.863 6.464 4.429
345 H LYS 40 H LYS 40 -4.309 10.302 2.315
346 HA LYS 40 HA LYS 40 -2.751 12.231 0.998
347 HB2 LYS 40 2HB LYS 40 -5.286 12.685 2.515
348 HB3 LYS 40 1HB LYS 40 -4.684 13.707 1.214
349 HG2 LYS 40 2HG LYS 40 -4.957 11.422 -0.208
350 HG3 LYS 40 1HG LYS 40 -6.001 11.056 1.119
351 HD2 LYS 40 2HD LYS 40 -7.413 12.917 0.736
352 HD3 LYS 40 1HD LYS 40 -6.277 13.564 -0.459
353 HE2 LYS 40 2HE LYS 40 -6.668 11.651 -1.898
354 HE3 LYS 40 1HE LYS 40 -7.778 10.968 -0.718
355 HZ1 LYS 40 1HZ LYS 40 -9.230 12.890 -1.036
356 HZ2 LYS 40 2HZ LYS 40 -8.939 12.083 -2.495
357 HZ3 LYS 40 3HZ LYS 40 -8.144 13.522 -2.166
358 H LYS 41 H LYS 41 -3.124 11.473 4.290
359 HA LYS 41 HA LYS 41 -2.067 13.953 5.312
360 HB2 LYS 41 2HB LYS 41 -2.361 11.216 6.560
361 HB3 LYS 41 1HB LYS 41 -1.794 12.609 7.432
362 HG2 LYS 41 2HG LYS 41 -4.402 12.239 6.165
363 HG3 LYS 41 1HG LYS 41 -4.114 12.138 7.903
364 HD2 LYS 41 2HD LYS 41 -3.871 14.608 6.139
365 HD3 LYS 41 1HD LYS 41 -5.101 14.314 7.360
366 HE2 LYS 41 2HE LYS 41 -3.335 14.315 9.103
367 HE3 LYS 41 1HE LYS 41 -2.141 14.646 7.863
368 HZ1 LYS 41 1HZ LYS 41 -3.187 16.757 7.409
369 HZ2 LYS 41 2HZ LYS 41 -2.847 16.645 9.051
370 HZ3 LYS 41 3HZ LYS 41 -4.424 16.422 8.511
371 H GLY 42 H GLY 42 -0.928 11.378 3.629
372 HA2 GLY 42 2HA GLY 42 1.136 10.997 2.811
373 HA3 GLY 42 1HA GLY 42 1.754 12.270 3.826
374 H ARG 43 H ARG 43 -0.033 9.915 5.555
375 HA ARG 43 HA ARG 43 2.208 8.981 6.970
376 HB2 ARG 43 2HB ARG 43 -0.010 9.174 7.960
377 HB3 ARG 43 1HB ARG 43 -0.622 8.054 6.737
378 HG2 ARG 43 2HG ARG 43 0.748 6.305 7.594
379 HG3 ARG 43 1HG ARG 43 1.418 7.397 8.814
380 HD2 ARG 43 2HD ARG 43 -1.503 6.610 8.619
381 HD3 ARG 43 1HD ARG 43 -0.347 5.831 9.692
382 HE ARG 43 HE ARG 43 -0.468 8.664 10.054
383 HH11 ARG 43 1HH1 ARG 43 -2.034 5.599 10.962
384 HH12 ARG 43 2HH1 ARG 43 -2.613 6.203 12.443
385 HH21 ARG 43 1HH2 ARG 43 -1.261 9.441 12.068
386 HH22 ARG 43 2HH2 ARG 43 -2.178 8.445 13.101
387 H LYS 44 H LYS 44 3.194 6.938 6.826
388 HA LYS 44 HA LYS 44 2.723 5.436 4.375
389 HB2 LYS 44 2HB LYS 44 4.910 5.208 6.466
390 HB3 LYS 44 1HB LYS 44 4.809 4.226 5.020
391 HG2 LYS 44 2HG LYS 44 5.194 7.220 5.085
392 HG3 LYS 44 1HG LYS 44 6.444 6.017 4.775
393 HD2 LYS 44 2HD LYS 44 5.201 5.266 2.779
394 HD3 LYS 44 1HD LYS 44 3.989 6.507 3.081
395 HE2 LYS 44 2HE LYS 44 5.550 7.239 1.371
396 HE3 LYS 44 1HE LYS 44 5.714 8.238 2.812
397 HZ1 LYS 44 1HZ LYS 44 7.472 5.978 2.065
398 HZ2 LYS 44 2HZ LYS 44 7.698 6.953 3.420
399 HZ3 LYS 44 3HZ LYS 44 7.855 7.594 1.866
400 H ILE 45 H ILE 45 1.467 3.733 4.417
401 HA ILE 45 HA ILE 45 1.007 2.321 6.964
402 HB ILE 45 HB ILE 45 -0.929 2.479 4.621
403 HG12 ILE 45 2HG1 ILE 45 -2.431 3.802 6.242
404 HG13 ILE 45 1HG1 ILE 45 -0.977 4.034 7.224
405 HG21 ILE 45 1HG2 ILE 45 -1.292 1.336 7.374
406 HG22 ILE 45 2HG2 ILE 45 -1.150 0.441 5.861
407 HG23 ILE 45 3HG2 ILE 45 -2.553 1.468 6.147
408 HD11 ILE 45 1HD1 ILE 45 -1.503 5.934 5.883
409 HD12 ILE 45 2HD1 ILE 45 -1.427 4.947 4.419
410 HD13 ILE 45 3HD1 ILE 45 0.032 5.222 5.376
411 H CYS 46 H CYS 46 1.719 0.281 6.894
412 HA CYS 46 HA CYS 46 2.668 -0.851 4.381
413 HB2 CYS 46 2HB CYS 46 2.667 -1.954 7.186
414 HB3 CYS 46 1HB CYS 46 3.617 -2.580 5.851
415 H ALA 47 H ALA 47 1.193 -1.974 3.111
416 HA ALA 47 HA ALA 47 -0.927 -3.351 4.608
417 HB1 ALA 47 1HB ALA 47 -1.150 -2.090 1.884
418 HB2 ALA 47 2HB ALA 47 -1.775 -1.406 3.381
419 HB3 ALA 47 3HB ALA 47 -2.435 -2.919 2.764
420 H ASN 48 H ASN 48 -1.609 -5.384 3.940
421 HA ASN 48 HA ASN 48 0.327 -6.866 2.594
422 HB2 ASN 48 2HB ASN 48 -0.708 -8.005 4.322
423 HB3 ASN 48 1HB ASN 48 -2.305 -7.505 3.847
424 HD21 ASN 48 1HD2 ASN 48 0.344 -9.582 2.787
425 HD22 ASN 48 2HD2 ASN 48 -0.767 -10.620 1.892
426 HA PRO 49 HA PRO 49 -0.899 -6.088 -1.564
427 HB2 PRO 49 2HB PRO 49 0.771 -8.425 -2.131
428 HB3 PRO 49 1HB PRO 49 0.957 -6.766 -2.692
429 HG2 PRO 49 2HG PRO 49 2.530 -7.993 -0.826
430 HG3 PRO 49 1HG PRO 49 2.350 -6.246 -0.943
431 HD2 PRO 49 2HD PRO 49 1.290 -8.114 1.055
432 HD3 PRO 49 1HD PRO 49 1.514 -6.363 1.136
433 H ASN 50 H ASN 50 -1.199 -9.032 0.195
434 HA ASN 50 HA ASN 50 -2.641 -10.250 -1.906
435 HB2 ASN 50 2HB ASN 50 -1.904 -11.344 0.789
436 HB3 ASN 50 1HB ASN 50 -3.044 -12.147 -0.291
437 HD21 ASN 50 1HD2 ASN 50 0.376 -11.215 0.084
438 HD22 ASN 50 2HD2 ASN 50 0.917 -12.242 -1.169
439 H GLU 51 H GLU 51 -3.538 -7.946 0.135
440 HA GLU 51 HA GLU 51 -6.118 -9.019 0.894
441 HB2 GLU 51 2HB GLU 51 -5.110 -6.194 1.256
442 HB3 GLU 51 1HB GLU 51 -6.550 -6.889 1.975
443 HG2 GLU 51 2HG GLU 51 -4.849 -8.591 3.085
444 HG3 GLU 51 1HG GLU 51 -3.732 -7.431 2.469
445 H LYS 52 H LYS 52 -7.986 -8.649 -0.034
446 HA LYS 52 HA LYS 52 -8.159 -8.009 -2.717
447 HB2 LYS 52 2HB LYS 52 -9.823 -9.343 -1.490
448 HB3 LYS 52 1HB LYS 52 -10.342 -7.897 -0.641
449 HG2 LYS 52 2HG LYS 52 -11.125 -6.915 -2.693
450 HG3 LYS 52 1HG LYS 52 -10.525 -8.289 -3.617
451 HD2 LYS 52 2HD LYS 52 -12.063 -9.759 -2.350
452 HD3 LYS 52 1HD LYS 52 -12.683 -8.338 -1.514
453 HE2 LYS 52 2HE LYS 52 -14.143 -8.982 -3.355
454 HE3 LYS 52 1HE LYS 52 -13.423 -7.396 -3.630
455 HZ1 LYS 52 1HZ LYS 52 -13.386 -8.752 -5.621
456 HZ2 LYS 52 2HZ LYS 52 -12.470 -9.941 -4.855
457 HZ3 LYS 52 3HZ LYS 52 -11.820 -8.421 -5.119
458 H TRP 53 H TRP 53 -8.647 -5.897 0.091
459 HA TRP 53 HA TRP 53 -9.669 -3.745 -1.438
460 HB2 TRP 53 2HB TRP 53 -9.415 -2.349 0.530
461 HB3 TRP 53 1HB TRP 53 -10.045 -3.912 1.011
462 HD1 TRP 53 HD TRP 53 -8.218 -5.547 2.426
463 HE1 TRP 53 1HE TRP 53 -6.311 -4.877 3.921
464 HE3 TRP 53 3HE TRP 53 -7.607 -0.694 0.863
465 HZ2 TRP 53 2HZ TRP 53 -4.697 -2.627 4.417
466 HZ3 TRP 53 3HZ TRP 53 -5.832 0.636 1.914
467 HH2 TRP 53 HH TRP 53 -4.409 -0.306 3.656
468 H VAL 54 H VAL 54 -6.509 -4.866 -0.749
469 HA VAL 54 HA VAL 54 -5.155 -2.482 -1.490
470 HB VAL 54 HB VAL 54 -4.139 -5.328 -1.126
471 HG11 VAL 54 1HG1 VAL 54 -2.554 -2.788 -1.550
472 HG12 VAL 54 2HG1 VAL 54 -2.635 -4.156 -2.663
473 HG13 VAL 54 3HG1 VAL 54 -1.879 -4.341 -1.079
474 HG21 VAL 54 1HG2 VAL 54 -3.874 -2.870 0.588
475 HG22 VAL 54 2HG2 VAL 54 -3.221 -4.470 0.957
476 HG23 VAL 54 3HG2 VAL 54 -4.964 -4.217 0.888
477 H GLN 55 H GLN 55 -6.164 -5.415 -3.119
478 HA GLN 55 HA GLN 55 -4.886 -5.056 -5.630
479 HB2 GLN 55 2HB GLN 55 -7.719 -6.061 -5.210
480 HB3 GLN 55 1HB GLN 55 -6.679 -6.398 -6.577
481 HG2 GLN 55 2HG GLN 55 -6.258 -7.362 -3.763
482 HG3 GLN 55 1HG GLN 55 -6.942 -8.309 -5.074
483 HE21 GLN 55 1HE2 GLN 55 -4.714 -8.852 -3.486
484 HE22 GLN 55 2HE2 GLN 55 -3.305 -8.981 -4.444
485 H LYS 56 H LYS 56 -8.023 -4.031 -4.421
486 HA LYS 56 HA LYS 56 -8.961 -2.598 -6.606
487 HB2 LYS 56 2HB LYS 56 -10.350 -3.387 -4.779
488 HB3 LYS 56 1HB LYS 56 -9.508 -2.337 -3.657
489 HG2 LYS 56 2HG LYS 56 -10.386 -0.399 -4.789
490 HG3 LYS 56 1HG LYS 56 -11.202 -1.444 -5.963
491 HD2 LYS 56 2HD LYS 56 -12.510 -2.450 -4.161
492 HD3 LYS 56 1HD LYS 56 -11.681 -1.433 -2.987
493 HE2 LYS 56 2HE LYS 56 -12.614 0.561 -4.007
494 HE3 LYS 56 1HE LYS 56 -13.376 -0.409 -5.263
495 HZ1 LYS 56 1HZ LYS 56 -14.753 -1.455 -3.590
496 HZ2 LYS 56 2HZ LYS 56 -14.923 0.213 -3.522
497 HZ3 LYS 56 3HZ LYS 56 -14.008 -0.572 -2.354
498 H ALA 57 H ALA 57 -7.111 -1.588 -3.778
499 HA ALA 57 HA ALA 57 -7.078 1.167 -4.424
500 HB1 ALA 57 1HB ALA 57 -5.360 1.355 -2.705
501 HB2 ALA 57 2HB ALA 57 -5.204 -0.395 -2.626
502 HB3 ALA 57 3HB ALA 57 -6.718 0.403 -2.144
503 H MET 58 H MET 58 -4.674 -1.402 -4.878
504 HA MET 58 HA MET 58 -2.730 0.184 -5.869
505 HB2 MET 58 2HB MET 58 -3.197 -2.732 -6.305
506 HB3 MET 58 1HB MET 58 -1.819 -1.969 -7.054
507 HG2 MET 58 2HG MET 58 -1.223 -1.161 -4.702
508 HG3 MET 58 1HG MET 58 -2.431 -2.307 -4.138
509 HE1 MET 58 1HE MET 58 -0.812 -5.696 -5.331
510 HE2 MET 58 2HE MET 58 -2.014 -4.768 -6.236
511 HE3 MET 58 3HE MET 58 -2.196 -4.991 -4.485
512 H LYS 59 H LYS 59 -5.277 -1.385 -7.690
513 HA LYS 59 HA LYS 59 -4.332 -0.704 -10.240
514 HB2 LYS 59 2HB LYS 59 -7.175 -1.087 -9.299
515 HB3 LYS 59 1HB LYS 59 -6.664 -1.047 -10.983
516 HG2 LYS 59 2HG LYS 59 -5.312 -3.026 -10.647
517 HG3 LYS 59 1HG LYS 59 -5.747 -3.050 -8.938
518 HD2 LYS 59 2HD LYS 59 -8.104 -3.353 -9.561
519 HD3 LYS 59 1HD LYS 59 -7.638 -3.365 -11.265
520 HE2 LYS 59 2HE LYS 59 -6.256 -5.334 -10.882
521 HE3 LYS 59 1HE LYS 59 -6.678 -5.309 -9.173
522 HZ1 LYS 59 1HZ LYS 59 -8.968 -5.687 -9.770
523 HZ2 LYS 59 2HZ LYS 59 -7.978 -6.901 -10.377
524 HZ3 LYS 59 3HZ LYS 59 -8.584 -5.714 -11.412
525 H HIS 60 H HIS 60 -6.495 0.997 -8.025
526 HA HIS 60 HA HIS 60 -7.040 3.155 -9.752
527 HB2 HIS 60 2HB HIS 60 -8.572 2.675 -8.010
528 HB3 HIS 60 1HB HIS 60 -7.313 2.737 -6.788
529 HD1 HIS 60 1HD HIS 60 -9.288 5.073 -9.082
530 HD2 HIS 60 2HD HIS 60 -7.049 5.117 -5.601
531 HE1 HIS 60 1HE HIS 60 -9.613 7.369 -8.109
532 HE2 HIS 60 2HE HIS 60 -8.436 7.278 -5.885
533 H LEU 61 H LEU 61 -4.690 2.671 -7.203
534 HA LEU 61 HA LEU 61 -3.650 5.318 -7.314
535 HB2 LEU 61 2HB LEU 61 -2.499 2.795 -6.165
536 HB3 LEU 61 1HB LEU 61 -1.860 4.406 -5.891
537 HG LEU 61 HG LEU 61 -4.612 3.493 -5.066
538 HD11 LEU 61 1HD1 LEU 61 -2.100 3.806 -3.439
539 HD12 LEU 61 2HD1 LEU 61 -2.974 2.299 -3.795
540 HD13 LEU 61 3HD1 LEU 61 -3.721 3.535 -2.802
541 HD21 LEU 61 1HD2 LEU 61 -3.058 5.999 -4.433
542 HD22 LEU 61 2HD2 LEU 61 -4.616 5.552 -3.739
543 HD23 LEU 61 3HD2 LEU 61 -4.489 5.894 -5.463
544 H ASP 62 H ASP 62 -3.034 2.424 -9.090
545 HA ASP 62 HA ASP 62 -0.485 3.191 -10.118
546 HB2 ASP 62 2HB ASP 62 -1.188 0.840 -10.154
547 HB3 ASP 62 1HB ASP 62 -2.546 1.239 -11.191
548 H LYS 63 H LYS 63 -3.807 3.880 -10.967
549 HA LYS 63 HA LYS 63 -3.007 4.926 -13.532
550 HB2 LYS 63 2HB LYS 63 -5.796 5.096 -12.375
551 HB3 LYS 63 1HB LYS 63 -5.328 5.135 -14.067
552 HG2 LYS 63 2HG LYS 63 -5.351 2.775 -12.202
553 HG3 LYS 63 1HG LYS 63 -6.324 3.019 -13.649
554 HD2 LYS 63 2HD LYS 63 -4.394 2.729 -15.061
555 HD3 LYS 63 1HD LYS 63 -3.315 2.753 -13.663
556 HE2 LYS 63 2HE LYS 63 -4.482 0.703 -12.821
557 HE3 LYS 63 1HE LYS 63 -5.359 0.648 -14.344
558 HZ1 LYS 63 1HZ LYS 63 -2.415 0.557 -14.074
559 HZ2 LYS 63 2HZ LYS 63 -3.261 0.396 -15.519
560 HZ3 LYS 63 3HZ LYS 63 -3.380 -0.796 -14.332
561 H LYS 64 H LYS 64 -2.574 5.997 -10.663
562 HA LYS 64 HA LYS 64 -3.591 8.703 -10.943
563 HB2 LYS 64 2HB LYS 64 -3.862 7.516 -8.769
564 HB3 LYS 64 1HB LYS 64 -2.125 7.344 -8.665
565 HG2 LYS 64 2HG LYS 64 -2.881 9.139 -7.227
566 HG3 LYS 64 1HG LYS 64 -1.878 9.774 -8.526
567 HD2 LYS 64 2HD LYS 64 -3.825 11.198 -8.130
568 HD3 LYS 64 1HD LYS 64 -3.884 10.481 -9.739
569 HE2 LYS 64 2HE LYS 64 -5.466 8.810 -8.936
570 HE3 LYS 64 1HE LYS 64 -5.396 9.488 -7.313
571 HZ1 LYS 64 1HZ LYS 64 -6.348 10.935 -9.728
572 HZ2 LYS 64 2HZ LYS 64 -6.331 11.545 -8.182
573 HZ3 LYS 64 3HZ LYS 64 -7.341 10.259 -8.553
Start of MODEL 5
1 H1 ALA 1 1HT ALA 1 14.114 6.944 12.166
2 H2 ALA 1 2HT ALA 1 14.135 6.860 10.466
3 H3 ALA 1 3HT ALA 1 14.718 5.580 11.369
4 HA ALA 1 HA ALA 1 12.579 5.076 12.191
5 HB1 ALA 1 1HB ALA 1 11.657 7.361 10.442
6 HB2 ALA 1 2HB ALA 1 11.668 7.354 12.204
7 HB3 ALA 1 3HB ALA 1 10.608 6.249 11.324
8 H ARG 2 H ARG 2 12.771 3.195 11.203
9 HA ARG 2 HA ARG 2 13.282 2.988 8.409
10 HB2 ARG 2 2HB ARG 2 14.291 1.467 10.064
11 HB3 ARG 2 1HB ARG 2 12.699 0.847 10.454
12 HG2 ARG 2 2HG ARG 2 12.486 -0.006 8.154
13 HG3 ARG 2 1HG ARG 2 14.094 0.612 7.801
14 HD2 ARG 2 2HD ARG 2 13.429 -1.458 9.884
15 HD3 ARG 2 1HD ARG 2 14.176 -1.767 8.314
16 HE ARG 2 HE ARG 2 15.710 0.123 9.716
17 HH11 ARG 2 1HH1 ARG 2 14.928 -3.332 9.860
18 HH12 ARG 2 2HH1 ARG 2 16.409 -3.757 10.588
19 HH21 ARG 2 1HH2 ARG 2 17.707 -0.482 10.713
20 HH22 ARG 2 2HH2 ARG 2 17.997 -2.119 11.100
21 H LYS 3 H LYS 3 11.578 3.749 7.331
22 HA LYS 3 HA LYS 3 9.112 2.180 7.489
23 HB2 LYS 3 2HB LYS 3 7.850 4.263 6.909
24 HB3 LYS 3 1HB LYS 3 8.608 4.296 8.492
25 HG2 LYS 3 2HG LYS 3 10.432 5.668 7.558
26 HG3 LYS 3 1HG LYS 3 9.609 5.665 5.998
27 HD2 LYS 3 2HD LYS 3 7.677 6.773 7.009
28 HD3 LYS 3 1HD LYS 3 8.476 6.747 8.579
29 HE2 LYS 3 2HE LYS 3 10.277 8.148 7.664
30 HE3 LYS 3 1HE LYS 3 9.445 8.186 6.109
31 HZ1 LYS 3 1HZ LYS 3 9.021 10.175 7.396
32 HZ2 LYS 3 2HZ LYS 3 8.390 9.285 8.672
33 HZ3 LYS 3 3HZ LYS 3 7.586 9.319 7.202
34 H SER 4 H SER 4 11.694 2.601 5.716
35 HA SER 4 HA SER 4 10.542 2.894 3.100
36 HB2 SER 4 2HB SER 4 13.258 1.838 3.930
37 HB3 SER 4 1HB SER 4 12.788 2.281 2.288
38 HG SER 4 HG SER 4 13.196 4.235 2.733
39 H CYS 5 H CYS 5 11.105 0.374 5.347
40 HA CYS 5 HA CYS 5 9.994 -1.579 3.497
41 HB2 CYS 5 2HB CYS 5 12.299 -1.986 5.398
42 HB3 CYS 5 1HB CYS 5 11.400 -3.305 4.671
43 H CYS 6 H CYS 6 8.589 -2.983 4.439
44 HA CYS 6 HA CYS 6 7.888 -2.470 7.214
45 HB2 CYS 6 2HB CYS 6 6.309 -3.292 4.815
46 HB3 CYS 6 1HB CYS 6 5.654 -3.269 6.452
47 H LEU 7 H LEU 7 7.375 -4.272 8.436
48 HA LEU 7 HA LEU 7 7.876 -6.895 7.253
49 HB2 LEU 7 2HB LEU 7 8.958 -7.664 9.332
50 HB3 LEU 7 1HB LEU 7 9.855 -6.381 8.565
51 HG LEU 7 HG LEU 7 8.083 -5.962 10.995
52 HD11 LEU 7 1HD1 LEU 7 9.911 -7.503 11.482
53 HD12 LEU 7 2HD1 LEU 7 10.164 -5.943 12.271
54 HD13 LEU 7 3HD1 LEU 7 11.065 -6.353 10.809
55 HD21 LEU 7 1HD2 LEU 7 9.372 -3.881 11.228
56 HD22 LEU 7 2HD2 LEU 7 8.534 -3.924 9.679
57 HD23 LEU 7 3HD2 LEU 7 10.256 -4.274 9.751
58 H LYS 8 H LYS 8 5.676 -4.973 8.272
59 HA LYS 8 HA LYS 8 3.978 -7.051 9.419
60 HB2 LYS 8 2HB LYS 8 4.130 -4.144 10.288
61 HB3 LYS 8 1HB LYS 8 2.971 -5.329 10.850
62 HG2 LYS 8 2HG LYS 8 4.680 -6.566 11.992
63 HG3 LYS 8 1HG LYS 8 5.940 -5.558 11.274
64 HD2 LYS 8 2HD LYS 8 5.497 -4.907 13.599
65 HD3 LYS 8 1HD LYS 8 5.101 -3.616 12.474
66 HE2 LYS 8 2HE LYS 8 3.390 -3.809 14.198
67 HE3 LYS 8 1HE LYS 8 2.725 -4.212 12.624
68 HZ1 LYS 8 1HZ LYS 8 2.952 -6.558 13.186
69 HZ2 LYS 8 2HZ LYS 8 1.992 -5.761 14.303
70 HZ3 LYS 8 3HZ LYS 8 3.586 -6.142 14.700
71 H TYR 9 H TYR 9 1.720 -6.522 8.940
72 HA TYR 9 HA TYR 9 1.345 -4.553 6.790
73 HB2 TYR 9 2HB TYR 9 -0.475 -6.998 7.126
74 HB3 TYR 9 1HB TYR 9 -0.331 -5.875 5.836
75 HD1 TYR 9 1HD TYR 9 1.310 -6.047 4.140
76 HD2 TYR 9 2HD TYR 9 1.240 -8.826 7.334
77 HE1 TYR 9 1HE TYR 9 2.757 -7.563 2.856
78 HE2 TYR 9 2HE TYR 9 2.699 -10.333 6.063
79 HH TYR 9 HH TYR 9 4.286 -9.318 3.207
80 H THR 10 H THR 10 -0.766 -3.497 6.908
81 HA THR 10 HA THR 10 -1.507 -2.880 9.535
82 HB THR 10 HB THR 10 -1.679 -1.154 7.847
83 HG1 THR 10 1HG THR 10 -4.308 -1.101 8.080
84 HG21 THR 10 1HG2 THR 10 -3.368 -1.235 6.049
85 HG22 THR 10 2HG2 THR 10 -3.774 -2.893 6.522
86 HG23 THR 10 3HG2 THR 10 -2.165 -2.515 5.905
87 H LYS 11 H LYS 11 -3.380 -3.297 10.612
88 HA LYS 11 HA LYS 11 -4.696 -5.784 9.872
89 HB2 LYS 11 2HB LYS 11 -4.665 -4.235 12.449
90 HB3 LYS 11 1HB LYS 11 -5.483 -5.775 12.219
91 HG2 LYS 11 2HG LYS 11 -3.362 -6.867 11.754
92 HG3 LYS 11 1HG LYS 11 -2.520 -5.325 11.901
93 HD2 LYS 11 2HD LYS 11 -4.063 -6.691 14.107
94 HD3 LYS 11 1HD LYS 11 -2.314 -6.732 13.925
95 HE2 LYS 11 2HE LYS 11 -2.244 -4.281 14.142
96 HE3 LYS 11 1HE LYS 11 -3.991 -4.257 14.370
97 HZ1 LYS 11 1HZ LYS 11 -2.033 -5.602 16.150
98 HZ2 LYS 11 2HZ LYS 11 -3.697 -5.624 16.336
99 HZ3 LYS 11 3HZ LYS 11 -2.868 -4.166 16.479
100 H ARG 12 H ARG 12 -5.208 -2.531 9.533
101 HA ARG 12 HA ARG 12 -8.055 -3.051 9.208
102 HB2 ARG 12 2HB ARG 12 -8.660 -0.865 10.045
103 HB3 ARG 12 1HB ARG 12 -7.693 -1.700 11.249
104 HG2 ARG 12 2HG ARG 12 -5.746 -0.379 10.590
105 HG3 ARG 12 1HG ARG 12 -6.742 0.466 9.396
106 HD2 ARG 12 2HD ARG 12 -7.181 0.440 12.377
107 HD3 ARG 12 1HD ARG 12 -6.534 1.787 11.439
108 HE ARG 12 HE ARG 12 -8.956 1.167 10.301
109 HH11 ARG 12 1HH1 ARG 12 -7.862 2.209 13.487
110 HH12 ARG 12 2HH1 ARG 12 -9.301 3.017 13.886
111 HH21 ARG 12 1HH2 ARG 12 -10.937 2.249 10.828
112 HH22 ARG 12 2HH2 ARG 12 -11.122 3.043 12.321
113 HA PRO 13 HA PRO 13 -7.187 -1.527 5.168
114 HB2 PRO 13 2HB PRO 13 -9.717 -1.163 4.309
115 HB3 PRO 13 1HB PRO 13 -9.006 -2.769 4.513
116 HG2 PRO 13 2HG PRO 13 -10.827 -1.259 6.341
117 HG3 PRO 13 1HG PRO 13 -10.876 -2.968 5.862
118 HD2 PRO 13 2HD PRO 13 -9.836 -2.142 8.222
119 HD3 PRO 13 1HD PRO 13 -9.230 -3.564 7.353
120 H LEU 14 H LEU 14 -7.124 0.379 4.075
121 HA LEU 14 HA LEU 14 -7.984 2.790 5.467
122 HB2 LEU 14 2HB LEU 14 -6.178 2.358 3.102
123 HB3 LEU 14 1HB LEU 14 -6.565 3.921 3.765
124 HG LEU 14 HG LEU 14 -5.005 1.768 5.196
125 HD11 LEU 14 1HD1 LEU 14 -3.917 2.653 3.179
126 HD12 LEU 14 2HD1 LEU 14 -3.068 3.167 4.628
127 HD13 LEU 14 3HD1 LEU 14 -4.136 4.289 3.780
128 HD21 LEU 14 1HD2 LEU 14 -6.157 3.345 6.709
129 HD22 LEU 14 2HD2 LEU 14 -5.459 4.691 5.798
130 HD23 LEU 14 3HD2 LEU 14 -4.408 3.607 6.706
131 HA PRO 15 HA PRO 15 -10.877 3.139 1.961
132 HB2 PRO 15 2HB PRO 15 -11.174 5.979 2.507
133 HB3 PRO 15 1HB PRO 15 -12.356 4.697 2.768
134 HG2 PRO 15 2HG PRO 15 -11.137 6.070 4.801
135 HG3 PRO 15 1HG PRO 15 -11.757 4.421 4.963
136 HD2 PRO 15 2HD PRO 15 -8.950 5.359 4.554
137 HD3 PRO 15 1HD PRO 15 -9.572 4.023 5.552
138 H LEU 16 H LEU 16 -10.389 3.620 -0.144
139 HA LEU 16 HA LEU 16 -7.895 4.663 -0.937
140 HB2 LEU 16 2HB LEU 16 -9.083 3.214 -2.415
141 HB3 LEU 16 1HB LEU 16 -10.449 4.365 -2.488
142 HG LEU 16 HG LEU 16 -8.784 5.899 -3.581
143 HD11 LEU 16 1HD1 LEU 16 -6.838 4.864 -4.625
144 HD12 LEU 16 2HD1 LEU 16 -7.180 3.362 -3.768
145 HD13 LEU 16 3HD1 LEU 16 -6.742 4.812 -2.867
146 HD21 LEU 16 1HD2 LEU 16 -9.517 3.316 -4.878
147 HD22 LEU 16 2HD2 LEU 16 -9.049 4.812 -5.721
148 HD23 LEU 16 3HD2 LEU 16 -10.501 4.783 -4.720
149 H LYS 17 H LYS 17 -10.892 6.142 -0.403
150 HA LYS 17 HA LYS 17 -10.588 8.643 -1.585
151 HB2 LYS 17 2HB LYS 17 -12.004 7.937 0.986
152 HB3 LYS 17 1HB LYS 17 -12.224 9.420 0.073
153 HG2 LYS 17 2HG LYS 17 -13.139 8.179 -1.801
154 HG3 LYS 17 1HG LYS 17 -12.827 6.656 -0.970
155 HD2 LYS 17 2HD LYS 17 -15.180 7.280 -0.789
156 HD3 LYS 17 1HD LYS 17 -14.414 7.308 0.794
157 HE2 LYS 17 2HE LYS 17 -14.198 9.754 0.635
158 HE3 LYS 17 1HE LYS 17 -14.960 9.712 -0.954
159 HZ1 LYS 17 1HZ LYS 17 -16.956 8.818 0.090
160 HZ2 LYS 17 2HZ LYS 17 -16.523 10.304 0.748
161 HZ3 LYS 17 3HZ LYS 17 -16.210 8.897 1.605
162 H ARG 18 H ARG 18 -8.711 7.306 0.888
163 HA ARG 18 HA ARG 18 -7.737 9.983 1.721
164 HB2 ARG 18 2HB ARG 18 -8.180 7.564 3.470
165 HB3 ARG 18 1HB ARG 18 -6.998 8.777 3.906
166 HG2 ARG 18 2HG ARG 18 -9.090 9.095 5.099
167 HG3 ARG 18 1HG ARG 18 -8.774 10.461 4.039
168 HD2 ARG 18 2HD ARG 18 -10.356 9.504 2.409
169 HD3 ARG 18 1HD ARG 18 -10.672 8.176 3.516
170 HE ARG 18 HE ARG 18 -11.563 9.783 5.069
171 HH11 ARG 18 1HH1 ARG 18 -11.190 10.950 1.721
172 HH12 ARG 18 2HH1 ARG 18 -12.460 12.063 1.825
173 HH21 ARG 18 1HH2 ARG 18 -13.301 11.368 5.196
174 HH22 ARG 18 2HH2 ARG 18 -13.698 12.314 3.838
175 H ILE 19 H ILE 19 -6.858 7.669 -0.225
176 HA ILE 19 HA ILE 19 -4.094 7.423 0.784
177 HB ILE 19 HB ILE 19 -5.487 5.701 -1.300
178 HG12 ILE 19 2HG1 ILE 19 -4.787 4.994 1.543
179 HG13 ILE 19 1HG1 ILE 19 -6.407 5.497 1.043
180 HG21 ILE 19 1HG2 ILE 19 -2.834 5.324 0.143
181 HG22 ILE 19 2HG2 ILE 19 -3.025 5.781 -1.549
182 HG23 ILE 19 3HG2 ILE 19 -3.543 4.191 -0.984
183 HD11 ILE 19 1HD1 ILE 19 -6.530 3.538 -0.442
184 HD12 ILE 19 2HD1 ILE 19 -6.218 3.060 1.222
185 HD13 ILE 19 3HD1 ILE 19 -4.921 3.092 0.010
186 H LYS 20 H LYS 20 -2.512 8.350 -0.390
187 HA LYS 20 HA LYS 20 -3.256 9.807 -2.779
188 HB2 LYS 20 2HB LYS 20 -0.640 9.820 -1.263
189 HB3 LYS 20 1HB LYS 20 -1.038 10.890 -2.584
190 HG2 LYS 20 2HG LYS 20 -2.310 10.776 0.090
191 HG3 LYS 20 1HG LYS 20 -1.278 12.056 -0.568
192 HD2 LYS 20 2HD LYS 20 -4.010 11.227 -1.461
193 HD3 LYS 20 1HD LYS 20 -3.597 12.698 -0.611
194 HE2 LYS 20 2HE LYS 20 -2.284 13.547 -2.399
195 HE3 LYS 20 1HE LYS 20 -2.527 12.091 -3.383
196 HZ1 LYS 20 1HZ LYS 20 -4.593 14.074 -2.567
197 HZ2 LYS 20 2HZ LYS 20 -4.907 12.689 -3.474
198 HZ3 LYS 20 3HZ LYS 20 -3.928 13.907 -4.099
199 H SER 21 H SER 21 -1.003 7.209 -1.844
200 HA SER 21 HA SER 21 -0.813 6.123 -4.421
201 HB2 SER 21 2HB SER 21 1.591 6.790 -4.858
202 HB3 SER 21 1HB SER 21 0.431 8.107 -5.035
203 HG SER 21 HG SER 21 2.399 7.677 -3.126
204 H TYR 22 H TYR 22 1.196 4.540 -4.465
205 HA TYR 22 HA TYR 22 1.897 3.705 -1.729
206 HB2 TYR 22 2HB TYR 22 1.462 1.385 -2.219
207 HB3 TYR 22 1HB TYR 22 -0.006 2.319 -2.428
208 HD1 TYR 22 1HD TYR 22 -1.181 2.160 -4.406
209 HD2 TYR 22 2HD TYR 22 2.788 0.707 -4.323
210 HE1 TYR 22 1HE TYR 22 -1.497 1.127 -6.610
211 HE2 TYR 22 2HE TYR 22 2.473 -0.312 -6.543
212 HH TYR 22 HH TYR 22 -0.148 0.433 -8.503
213 H THR 23 H THR 23 3.522 2.065 -1.701
214 HA THR 23 HA THR 23 5.493 2.297 -3.882
215 HB THR 23 HB THR 23 5.990 1.919 -0.916
216 HG1 THR 23 1HG THR 23 5.294 4.044 -1.655
217 HG21 THR 23 1HG2 THR 23 7.636 0.836 -2.354
218 HG22 THR 23 2HG2 THR 23 8.355 2.198 -1.484
219 HG23 THR 23 3HG2 THR 23 7.926 2.353 -3.196
220 H ILE 24 H ILE 24 6.089 0.285 -4.719
221 HA ILE 24 HA ILE 24 4.916 -2.050 -3.492
222 HB ILE 24 HB ILE 24 6.610 -1.836 -6.007
223 HG12 ILE 24 2HG1 ILE 24 3.621 -2.155 -5.654
224 HG13 ILE 24 1HG1 ILE 24 4.452 -0.697 -6.186
225 HG21 ILE 24 1HG2 ILE 24 5.032 -4.176 -4.930
226 HG22 ILE 24 2HG2 ILE 24 6.789 -4.055 -5.013
227 HG23 ILE 24 3HG2 ILE 24 5.840 -4.115 -6.499
228 HD11 ILE 24 1HD1 ILE 24 4.382 -3.323 -7.653
229 HD12 ILE 24 2HD1 ILE 24 5.201 -1.856 -8.192
230 HD13 ILE 24 3HD1 ILE 24 3.441 -1.884 -8.046
231 H GLN 25 H GLN 25 5.933 -2.868 -1.817
232 HA GLN 25 HA GLN 25 8.819 -2.791 -1.694
233 HB2 GLN 25 2HB GLN 25 7.811 -2.324 0.369
234 HB3 GLN 25 1HB GLN 25 6.678 -3.656 0.237
235 HG2 GLN 25 2HG GLN 25 8.496 -5.233 0.509
236 HG3 GLN 25 1HG GLN 25 9.633 -3.891 0.639
237 HE21 GLN 25 1HE2 GLN 25 8.777 -6.035 2.501
238 HE22 GLN 25 2HE2 GLN 25 8.367 -5.215 3.961
239 H SER 26 H SER 26 9.927 -4.281 -2.563
240 HA SER 26 HA SER 26 8.712 -6.823 -3.114
241 HB2 SER 26 2HB SER 26 10.793 -7.104 -4.537
242 HB3 SER 26 1HB SER 26 9.743 -5.762 -5.002
243 HG SER 26 HG SER 26 11.891 -5.152 -4.980
244 H ASN 27 H ASN 27 9.580 -8.752 -2.348
245 HA ASN 27 HA ASN 27 10.984 -8.569 0.122
246 HB2 ASN 27 2HB ASN 27 10.853 -11.067 0.192
247 HB3 ASN 27 1HB ASN 27 9.306 -10.264 -0.003
248 HD21 ASN 27 1HD2 ASN 27 8.264 -11.890 -0.929
249 HD22 ASN 27 2HD2 ASN 27 8.686 -12.490 -2.498
250 H GLU 28 H GLU 28 11.942 -8.406 -2.878
251 HA GLU 28 HA GLU 28 14.453 -9.667 -2.976
252 HB2 GLU 28 2HB GLU 28 13.231 -8.866 -4.914
253 HB3 GLU 28 1HB GLU 28 13.283 -7.229 -4.296
254 HG2 GLU 28 2HG GLU 28 15.748 -7.325 -4.473
255 HG3 GLU 28 1HG GLU 28 15.561 -8.887 -5.287
256 H ALA 29 H ALA 29 13.290 -6.411 -2.095
257 HA ALA 29 HA ALA 29 15.997 -5.653 -1.259
258 HB1 ALA 29 1HB ALA 29 15.232 -3.348 -1.385
259 HB2 ALA 29 2HB ALA 29 13.588 -3.899 -1.710
260 HB3 ALA 29 3HB ALA 29 14.866 -4.203 -2.884
261 H CYS 30 H CYS 30 12.802 -6.175 0.001
262 HA CYS 30 HA CYS 30 13.772 -5.458 2.696
263 HB2 CYS 30 2HB CYS 30 10.937 -5.444 1.646
264 HB3 CYS 30 1HB CYS 30 11.417 -4.947 3.253
265 H ASN 31 H ASN 31 12.493 -6.848 4.395
266 HA ASN 31 HA ASN 31 13.086 -9.503 3.689
267 HB2 ASN 31 2HB ASN 31 12.094 -10.196 5.912
268 HB3 ASN 31 1HB ASN 31 13.400 -9.027 5.982
269 HD21 ASN 31 1HD2 ASN 31 12.759 -8.430 8.013
270 HD22 ASN 31 2HD2 ASN 31 11.379 -7.449 8.337
271 H ILE 32 H ILE 32 9.930 -7.965 3.898
272 HA ILE 32 HA ILE 32 8.847 -10.399 2.604
273 HB ILE 32 HB ILE 32 6.673 -9.954 3.628
274 HG12 ILE 32 2HG1 ILE 32 8.024 -7.627 5.031
275 HG13 ILE 32 1HG1 ILE 32 6.872 -7.479 3.714
276 HG21 ILE 32 1HG2 ILE 32 8.894 -9.866 5.628
277 HG22 ILE 32 2HG2 ILE 32 8.248 -11.336 4.878
278 HG23 ILE 32 3HG2 ILE 32 7.242 -10.377 5.985
279 HD11 ILE 32 1HD1 ILE 32 6.308 -8.640 6.431
280 HD12 ILE 32 2HD1 ILE 32 5.142 -8.490 5.115
281 HD13 ILE 32 3HD1 ILE 32 5.826 -7.044 5.858
282 H LYS 33 H LYS 33 6.631 -9.758 1.482
283 HA LYS 33 HA LYS 33 7.127 -7.321 -0.031
284 HB2 LYS 33 2HB LYS 33 6.811 -9.419 -1.338
285 HB3 LYS 33 1HB LYS 33 5.224 -9.612 -0.604
286 HG2 LYS 33 2HG LYS 33 4.486 -7.525 -1.640
287 HG3 LYS 33 1HG LYS 33 6.074 -7.324 -2.361
288 HD2 LYS 33 2HD LYS 33 5.752 -9.477 -3.567
289 HD3 LYS 33 1HD LYS 33 4.121 -9.548 -2.903
290 HE2 LYS 33 2HE LYS 33 3.539 -7.458 -3.992
291 HE3 LYS 33 1HE LYS 33 5.181 -7.301 -4.608
292 HZ1 LYS 33 1HZ LYS 33 3.242 -9.435 -5.337
293 HZ2 LYS 33 2HZ LYS 33 4.824 -9.310 -5.924
294 HZ3 LYS 33 3HZ LYS 33 3.680 -8.129 -6.282
295 H ALA 34 H ALA 34 6.048 -5.599 0.746
296 HA ALA 34 HA ALA 34 3.280 -5.886 1.602
297 HB1 ALA 34 1HB ALA 34 4.585 -6.051 3.700
298 HB2 ALA 34 2HB ALA 34 3.687 -4.547 3.653
299 HB3 ALA 34 3HB ALA 34 5.415 -4.549 3.297
300 H ILE 35 H ILE 35 2.283 -4.496 0.236
301 HA ILE 35 HA ILE 35 3.614 -2.330 -1.028
302 HB ILE 35 HB ILE 35 0.632 -2.775 -0.671
303 HG12 ILE 35 2HG1 ILE 35 1.785 -4.656 -1.716
304 HG13 ILE 35 1HG1 ILE 35 0.689 -3.864 -2.857
305 HG21 ILE 35 1HG2 ILE 35 0.389 -1.335 -2.708
306 HG22 ILE 35 2HG2 ILE 35 2.109 -1.040 -2.669
307 HG23 ILE 35 3HG2 ILE 35 1.099 -0.473 -1.352
308 HD11 ILE 35 1HD1 ILE 35 2.701 -4.486 -3.957
309 HD12 ILE 35 2HD1 ILE 35 3.700 -3.676 -2.734
310 HD13 ILE 35 3HD1 ILE 35 2.671 -2.733 -3.821
311 H ILE 36 H ILE 36 3.923 -0.240 -0.332
312 HA ILE 36 HA ILE 36 2.823 0.342 2.303
313 HB ILE 36 HB ILE 36 5.009 1.891 0.867
314 HG12 ILE 36 2HG1 ILE 36 6.454 0.958 2.806
315 HG13 ILE 36 1HG1 ILE 36 5.200 -0.266 2.946
316 HG21 ILE 36 1HG2 ILE 36 3.805 3.263 2.408
317 HG22 ILE 36 2HG2 ILE 36 5.429 2.892 3.005
318 HG23 ILE 36 3HG2 ILE 36 4.029 2.047 3.683
319 HD11 ILE 36 1HD1 ILE 36 5.604 -0.946 0.673
320 HD12 ILE 36 2HD1 ILE 36 7.076 -1.013 1.666
321 HD13 ILE 36 3HD1 ILE 36 6.829 0.324 0.530
322 H PHE 37 H PHE 37 1.050 1.376 2.296
323 HA PHE 37 HA PHE 37 0.196 3.076 0.150
324 HB2 PHE 37 2HB PHE 37 -0.981 1.971 2.659
325 HB3 PHE 37 1HB PHE 37 -1.753 3.344 1.864
326 HD1 PHE 37 1HD PHE 37 -0.073 0.535 0.262
327 HD2 PHE 37 2HD PHE 37 -3.705 2.358 1.205
328 HE1 PHE 37 1HE PHE 37 -1.289 -1.046 -1.317
329 HE2 PHE 37 2HE PHE 37 -4.921 0.837 -0.317
330 HZ PHE 37 HZ PHE 37 -3.686 -0.856 -1.567
331 H THR 38 H THR 38 0.111 5.206 0.255
332 HA THR 38 HA THR 38 0.924 6.425 2.786
333 HB THR 38 HB THR 38 1.351 7.538 -0.005
334 HG1 THR 38 1HG THR 38 2.607 5.660 1.382
335 HG21 THR 38 1HG2 THR 38 1.189 9.205 1.744
336 HG22 THR 38 2HG2 THR 38 2.866 9.094 1.200
337 HG23 THR 38 3HG2 THR 38 2.349 8.340 2.730
338 H THR 39 H THR 39 -0.481 7.910 3.615
339 HA THR 39 HA THR 39 -2.984 8.134 2.185
340 HB THR 39 HB THR 39 -3.784 9.203 4.326
341 HG1 THR 39 1HG THR 39 -2.406 8.654 6.170
342 HG21 THR 39 1HG2 THR 39 -4.243 6.857 3.853
343 HG22 THR 39 2HG2 THR 39 -3.913 7.075 5.572
344 HG23 THR 39 3HG2 THR 39 -2.672 6.403 4.514
345 H LYS 40 H LYS 40 -4.067 10.387 2.587
346 HA LYS 40 HA LYS 40 -2.479 12.335 1.294
347 HB2 LYS 40 2HB LYS 40 -4.852 12.891 3.000
348 HB3 LYS 40 1HB LYS 40 -4.312 13.840 1.614
349 HG2 LYS 40 2HG LYS 40 -4.834 11.542 0.309
350 HG3 LYS 40 1HG LYS 40 -5.793 11.282 1.731
351 HD2 LYS 40 2HD LYS 40 -7.032 13.319 1.394
352 HD3 LYS 40 1HD LYS 40 -5.976 13.677 0.006
353 HE2 LYS 40 2HE LYS 40 -6.754 11.779 -1.184
354 HE3 LYS 40 1HE LYS 40 -7.714 11.235 0.176
355 HZ1 LYS 40 1HZ LYS 40 -9.074 13.213 -0.029
356 HZ2 LYS 40 2HZ LYS 40 -9.084 12.340 -1.472
357 HZ3 LYS 40 3HZ LYS 40 -8.166 13.745 -1.350
358 H LYS 41 H LYS 41 -2.726 11.353 4.497
359 HA LYS 41 HA LYS 41 -1.713 13.734 5.745
360 HB2 LYS 41 2HB LYS 41 -1.930 10.870 6.724
361 HB3 LYS 41 1HB LYS 41 -1.364 12.190 7.717
362 HG2 LYS 41 2HG LYS 41 -3.655 11.715 8.309
363 HG3 LYS 41 1HG LYS 41 -3.598 13.256 7.476
364 HD2 LYS 41 2HD LYS 41 -4.417 12.222 5.434
365 HD3 LYS 41 1HD LYS 41 -4.377 10.633 6.196
366 HE2 LYS 41 2HE LYS 41 -6.653 11.538 6.152
367 HE3 LYS 41 1HE LYS 41 -6.078 11.344 7.801
368 HZ1 LYS 41 1HZ LYS 41 -6.140 13.904 6.291
369 HZ2 LYS 41 2HZ LYS 41 -5.614 13.720 7.883
370 HZ3 LYS 41 3HZ LYS 41 -7.220 13.447 7.503
371 H GLY 42 H GLY 42 -0.562 11.230 3.870
372 HA2 GLY 42 2HA GLY 42 1.469 10.925 2.956
373 HA3 GLY 42 1HA GLY 42 2.096 12.195 3.970
374 H ARG 43 H ARG 43 0.493 9.736 5.656
375 HA ARG 43 HA ARG 43 2.981 8.849 6.814
376 HB2 ARG 43 2HB ARG 43 0.218 7.815 7.196
377 HB3 ARG 43 1HB ARG 43 1.603 7.355 8.182
378 HG2 ARG 43 2HG ARG 43 1.775 9.831 8.780
379 HG3 ARG 43 1HG ARG 43 0.168 9.998 8.063
380 HD2 ARG 43 2HD ARG 43 0.947 8.226 10.370
381 HD3 ARG 43 1HD ARG 43 -0.011 9.691 10.462
382 HE ARG 43 HE ARG 43 -1.632 8.427 9.007
383 HH11 ARG 43 1HH1 ARG 43 0.532 6.745 11.286
384 HH12 ARG 43 2HH1 ARG 43 -0.572 5.516 11.651
385 HH21 ARG 43 1HH2 ARG 43 -3.172 6.698 9.526
386 HH22 ARG 43 2HH2 ARG 43 -2.717 5.496 10.639
387 H LYS 44 H LYS 44 3.535 6.542 6.986
388 HA LYS 44 HA LYS 44 2.996 5.225 4.438
389 HB2 LYS 44 2HB LYS 44 5.299 4.882 6.373
390 HB3 LYS 44 1HB LYS 44 5.074 3.921 4.923
391 HG2 LYS 44 2HG LYS 44 5.519 6.909 5.002
392 HG3 LYS 44 1HG LYS 44 6.726 5.695 4.568
393 HD2 LYS 44 2HD LYS 44 5.348 5.017 2.648
394 HD3 LYS 44 1HD LYS 44 4.134 6.215 3.089
395 HE2 LYS 44 2HE LYS 44 5.518 7.014 1.267
396 HE3 LYS 44 1HE LYS 44 5.770 7.997 2.707
397 HZ1 LYS 44 1HZ LYS 44 7.567 5.839 1.720
398 HZ2 LYS 44 2HZ LYS 44 7.831 6.741 3.115
399 HZ3 LYS 44 3HZ LYS 44 7.861 7.477 1.606
400 H ILE 45 H ILE 45 1.581 3.689 4.469
401 HA ILE 45 HA ILE 45 1.102 2.190 6.947
402 HB ILE 45 HB ILE 45 -0.729 2.546 4.543
403 HG12 ILE 45 2HG1 ILE 45 -2.259 3.767 6.252
404 HG13 ILE 45 1HG1 ILE 45 -0.833 3.842 7.283
405 HG21 ILE 45 1HG2 ILE 45 -1.239 1.153 7.162
406 HG22 ILE 45 2HG2 ILE 45 -1.063 0.403 5.576
407 HG23 ILE 45 3HG2 ILE 45 -2.452 1.435 5.913
408 HD11 ILE 45 1HD1 ILE 45 -1.302 5.882 6.105
409 HD12 ILE 45 2HD1 ILE 45 -1.102 5.050 4.568
410 HD13 ILE 45 3HD1 ILE 45 0.284 5.217 5.657
411 H CYS 46 H CYS 46 1.575 0.100 6.876
412 HA CYS 46 HA CYS 46 2.653 -1.009 4.408
413 HB2 CYS 46 2HB CYS 46 2.514 -2.176 7.186
414 HB3 CYS 46 1HB CYS 46 3.534 -2.727 5.860
415 H ALA 47 H ALA 47 1.175 -2.010 3.105
416 HA ALA 47 HA ALA 47 -1.070 -3.295 4.495
417 HB1 ALA 47 1HB ALA 47 -1.075 -2.026 1.765
418 HB2 ALA 47 2HB ALA 47 -1.741 -1.308 3.234
419 HB3 ALA 47 3HB ALA 47 -2.450 -2.780 2.573
420 H ASN 48 H ASN 48 -1.678 -5.347 3.919
421 HA ASN 48 HA ASN 48 0.237 -6.803 2.538
422 HB2 ASN 48 2HB ASN 48 -0.742 -8.006 4.251
423 HB3 ASN 48 1HB ASN 48 -2.366 -7.497 3.837
424 HD21 ASN 48 1HD2 ASN 48 0.308 -9.488 2.688
425 HD22 ASN 48 2HD2 ASN 48 -0.795 -10.514 1.802
426 HA PRO 49 HA PRO 49 -1.128 -5.989 -1.557
427 HB2 PRO 49 2HB PRO 49 0.380 -7.966 -2.707
428 HB3 PRO 49 1HB PRO 49 0.962 -6.337 -2.392
429 HG2 PRO 49 2HG PRO 49 1.437 -8.851 -0.880
430 HG3 PRO 49 1HG PRO 49 2.488 -7.438 -1.086
431 HD2 PRO 49 2HD PRO 49 1.126 -7.946 1.204
432 HD3 PRO 49 1HD PRO 49 1.529 -6.309 0.662
433 H ASN 50 H ASN 50 -1.312 -9.035 0.098
434 HA ASN 50 HA ASN 50 -2.698 -10.320 -1.958
435 HB2 ASN 50 2HB ASN 50 -2.376 -11.073 0.927
436 HB3 ASN 50 1HB ASN 50 -3.099 -12.089 -0.316
437 HD21 ASN 50 1HD2 ASN 50 -0.694 -12.340 1.340
438 HD22 ASN 50 2HD2 ASN 50 0.589 -12.663 0.239
439 H GLU 51 H GLU 51 -3.593 -7.947 0.295
440 HA GLU 51 HA GLU 51 -6.210 -8.939 0.901
441 HB2 GLU 51 2HB GLU 51 -5.194 -6.116 1.234
442 HB3 GLU 51 1HB GLU 51 -6.625 -6.807 1.974
443 HG2 GLU 51 2HG GLU 51 -4.871 -8.479 3.094
444 HG3 GLU 51 1HG GLU 51 -3.800 -7.305 2.453
445 H LYS 52 H LYS 52 -8.021 -8.584 -0.138
446 HA LYS 52 HA LYS 52 -7.980 -7.851 -2.813
447 HB2 LYS 52 2HB LYS 52 -9.666 -9.342 -1.875
448 HB3 LYS 52 1HB LYS 52 -10.351 -8.009 -0.956
449 HG2 LYS 52 2HG LYS 52 -10.945 -6.878 -3.036
450 HG3 LYS 52 1HG LYS 52 -10.247 -8.213 -3.953
451 HD2 LYS 52 2HD LYS 52 -11.871 -9.737 -2.989
452 HD3 LYS 52 1HD LYS 52 -12.551 -8.424 -2.028
453 HE2 LYS 52 2HE LYS 52 -13.133 -7.229 -4.072
454 HE3 LYS 52 1HE LYS 52 -12.472 -8.548 -5.036
455 HZ1 LYS 52 1HZ LYS 52 -14.783 -8.710 -3.186
456 HZ2 LYS 52 2HZ LYS 52 -14.121 -10.012 -4.024
457 HZ3 LYS 52 3HZ LYS 52 -14.841 -8.756 -4.870
458 H TRP 53 H TRP 53 -8.713 -5.896 0.036
459 HA TRP 53 HA TRP 53 -9.762 -3.719 -1.456
460 HB2 TRP 53 2HB TRP 53 -9.630 -2.375 0.557
461 HB3 TRP 53 1HB TRP 53 -10.137 -3.987 1.023
462 HD1 TRP 53 HD TRP 53 -8.281 -5.469 2.441
463 HE1 TRP 53 1HE TRP 53 -6.337 -4.740 3.874
464 HE3 TRP 53 3HE TRP 53 -7.811 -0.657 0.768
465 HZ2 TRP 53 2HZ TRP 53 -4.754 -2.431 4.283
466 HZ3 TRP 53 3HZ TRP 53 -6.035 0.738 1.735
467 HH2 TRP 53 HH TRP 53 -4.537 -0.133 3.458
468 H VAL 54 H VAL 54 -6.572 -4.698 -0.540
469 HA VAL 54 HA VAL 54 -5.207 -2.308 -1.234
470 HB VAL 54 HB VAL 54 -4.211 -5.161 -0.925
471 HG11 VAL 54 1HG1 VAL 54 -2.607 -2.616 -1.189
472 HG12 VAL 54 2HG1 VAL 54 -2.687 -3.899 -2.393
473 HG13 VAL 54 3HG1 VAL 54 -1.947 -4.203 -0.818
474 HG21 VAL 54 1HG2 VAL 54 -3.979 -2.760 0.859
475 HG22 VAL 54 2HG2 VAL 54 -3.349 -4.378 1.194
476 HG23 VAL 54 3HG2 VAL 54 -5.089 -4.102 1.091
477 H GLN 55 H GLN 55 -5.881 -5.332 -2.827
478 HA GLN 55 HA GLN 55 -4.450 -4.806 -5.173
479 HB2 GLN 55 2HB GLN 55 -6.832 -6.607 -4.832
480 HB3 GLN 55 1HB GLN 55 -5.680 -6.655 -6.166
481 HG2 GLN 55 2HG GLN 55 -3.881 -6.967 -4.469
482 HG3 GLN 55 1HG GLN 55 -5.150 -7.190 -3.275
483 HE21 GLN 55 1HE2 GLN 55 -3.115 -8.892 -4.059
484 HE22 GLN 55 2HE2 GLN 55 -3.797 -10.339 -4.679
485 H LYS 56 H LYS 56 -7.735 -4.103 -4.164
486 HA LYS 56 HA LYS 56 -8.758 -3.135 -6.603
487 HB2 LYS 56 2HB LYS 56 -10.105 -3.857 -4.652
488 HB3 LYS 56 1HB LYS 56 -9.496 -2.486 -3.751
489 HG2 LYS 56 2HG LYS 56 -10.567 -0.975 -5.303
490 HG3 LYS 56 1HG LYS 56 -11.170 -2.359 -6.231
491 HD2 LYS 56 2HD LYS 56 -12.368 -3.149 -4.243
492 HD3 LYS 56 1HD LYS 56 -11.810 -1.734 -3.348
493 HE2 LYS 56 2HE LYS 56 -12.998 -0.283 -4.941
494 HE3 LYS 56 1HE LYS 56 -13.558 -1.716 -5.801
495 HZ1 LYS 56 1HZ LYS 56 -14.721 -2.415 -3.815
496 HZ2 LYS 56 2HZ LYS 56 -15.243 -0.882 -4.283
497 HZ3 LYS 56 3HZ LYS 56 -14.184 -1.052 -2.981
498 H ALA 57 H ALA 57 -7.188 -1.631 -3.806
499 HA ALA 57 HA ALA 57 -7.346 1.023 -4.734
500 HB1 ALA 57 1HB ALA 57 -5.616 1.510 -3.059
501 HB2 ALA 57 2HB ALA 57 -5.388 -0.212 -2.781
502 HB3 ALA 57 3HB ALA 57 -6.935 0.578 -2.379
503 H MET 58 H MET 58 -4.820 -1.432 -4.951
504 HA MET 58 HA MET 58 -2.957 0.172 -6.190
505 HB2 MET 58 2HB MET 58 -3.180 -2.829 -6.306
506 HB3 MET 58 1HB MET 58 -1.830 -1.939 -6.989
507 HG2 MET 58 2HG MET 58 -1.443 -0.992 -4.692
508 HG3 MET 58 1HG MET 58 -2.651 -2.133 -4.110
509 HE1 MET 58 1HE MET 58 -0.902 -5.566 -4.905
510 HE2 MET 58 2HE MET 58 -2.042 -4.727 -5.961
511 HE3 MET 58 3HE MET 58 -2.348 -4.821 -4.217
512 H LYS 59 H LYS 59 -5.488 -1.804 -7.570
513 HA LYS 59 HA LYS 59 -4.854 -1.654 -10.249
514 HB2 LYS 59 2HB LYS 59 -6.624 -3.005 -9.214
515 HB3 LYS 59 1HB LYS 59 -7.540 -1.554 -8.869
516 HG2 LYS 59 2HG LYS 59 -7.712 -1.151 -11.309
517 HG3 LYS 59 1HG LYS 59 -6.900 -2.694 -11.586
518 HD2 LYS 59 2HD LYS 59 -9.529 -2.302 -10.129
519 HD3 LYS 59 1HD LYS 59 -9.336 -2.957 -11.751
520 HE2 LYS 59 2HE LYS 59 -8.090 -4.859 -10.837
521 HE3 LYS 59 1HE LYS 59 -8.233 -4.183 -9.219
522 HZ1 LYS 59 1HZ LYS 59 -10.632 -4.459 -9.342
523 HZ2 LYS 59 2HZ LYS 59 -9.838 -5.911 -9.635
524 HZ3 LYS 59 3HZ LYS 59 -10.501 -5.069 -10.918
525 H HIS 60 H HIS 60 -6.747 0.541 -8.194
526 HA HIS 60 HA HIS 60 -7.233 2.412 -10.246
527 HB2 HIS 60 2HB HIS 60 -8.753 2.196 -8.399
528 HB3 HIS 60 1HB HIS 60 -7.463 2.528 -7.249
529 HD1 HIS 60 1HD HIS 60 -9.589 4.263 -9.866
530 HD2 HIS 60 2HD HIS 60 -7.076 5.120 -6.707
531 HE1 HIS 60 1HE HIS 60 -9.809 6.719 -9.545
532 HE2 HIS 60 2HE HIS 60 -8.491 7.201 -7.474
533 H LEU 61 H LEU 61 -4.901 2.250 -7.588
534 HA LEU 61 HA LEU 61 -3.823 4.836 -8.060
535 HB2 LEU 61 2HB LEU 61 -2.830 2.535 -6.422
536 HB3 LEU 61 1HB LEU 61 -2.023 4.090 -6.475
537 HG LEU 61 HG LEU 61 -4.841 3.620 -5.486
538 HD11 LEU 61 1HD1 LEU 61 -2.271 4.096 -3.961
539 HD12 LEU 61 2HD1 LEU 61 -3.189 2.593 -4.010
540 HD13 LEU 61 3HD1 LEU 61 -3.889 4.024 -3.265
541 HD21 LEU 61 1HD2 LEU 61 -3.060 6.051 -5.389
542 HD22 LEU 61 2HD2 LEU 61 -4.637 5.909 -4.620
543 HD23 LEU 61 3HD2 LEU 61 -4.512 5.874 -6.379
544 H ASP 62 H ASP 62 -3.054 1.717 -9.445
545 HA ASP 62 HA ASP 62 -0.378 2.422 -10.181
546 HB2 ASP 62 2HB ASP 62 -1.079 0.069 -10.039
547 HB3 ASP 62 1HB ASP 62 -2.242 0.325 -11.326
548 H LYS 63 H LYS 63 -3.510 2.858 -11.570
549 HA LYS 63 HA LYS 63 -2.294 3.902 -13.967
550 HB2 LYS 63 2HB LYS 63 -4.514 3.668 -14.995
551 HB3 LYS 63 1HB LYS 63 -3.888 2.160 -14.354
552 HG2 LYS 63 2HG LYS 63 -5.343 2.592 -12.313
553 HG3 LYS 63 1HG LYS 63 -6.090 3.892 -13.247
554 HD2 LYS 63 2HD LYS 63 -7.448 1.929 -13.501
555 HD3 LYS 63 1HD LYS 63 -6.602 2.196 -15.029
556 HE2 LYS 63 2HE LYS 63 -4.858 0.516 -14.241
557 HE3 LYS 63 1HE LYS 63 -5.896 0.211 -12.864
558 HZ1 LYS 63 1HZ LYS 63 -6.179 -1.396 -14.623
559 HZ2 LYS 63 2HZ LYS 63 -6.636 -0.188 -15.687
560 HZ3 LYS 63 3HZ LYS 63 -7.624 -0.547 -14.365
561 H LYS 64 H LYS 64 -3.042 5.033 -11.134
562 HA LYS 64 HA LYS 64 -4.391 7.489 -11.950
563 HB2 LYS 64 2HB LYS 64 -4.917 6.190 -9.773
564 HB3 LYS 64 1HB LYS 64 -3.342 6.674 -9.214
565 HG2 LYS 64 2HG LYS 64 -5.610 8.600 -9.840
566 HG3 LYS 64 1HG LYS 64 -5.295 7.947 -8.251
567 HD2 LYS 64 2HD LYS 64 -4.345 10.086 -8.161
568 HD3 LYS 64 1HD LYS 64 -2.959 9.066 -8.517
569 HE2 LYS 64 2HE LYS 64 -2.881 11.065 -9.870
570 HE3 LYS 64 1HE LYS 64 -3.180 9.674 -10.904
571 HZ1 LYS 64 1HZ LYS 64 -4.599 11.538 -11.501
572 HZ2 LYS 64 2HZ LYS 64 -5.232 11.593 -9.945
573 HZ3 LYS 64 3HZ LYS 64 -5.549 10.273 -10.922
Start of MODEL 6
1 H1 ALA 1 1HT ALA 1 16.008 6.909 9.905
2 H2 ALA 1 2HT ALA 1 17.632 7.218 9.590
3 H3 ALA 1 3HT ALA 1 17.141 6.896 11.171
4 HA ALA 1 HA ALA 1 18.252 5.024 10.152
5 HB1 ALA 1 1HB ALA 1 16.489 4.596 11.818
6 HB2 ALA 1 2HB ALA 1 16.567 3.333 10.590
7 HB3 ALA 1 3HB ALA 1 15.298 4.549 10.514
8 H ARG 2 H ARG 2 18.450 3.618 8.424
9 HA ARG 2 HA ARG 2 16.925 4.441 6.067
10 HB2 ARG 2 2HB ARG 2 19.409 4.820 6.027
11 HB3 ARG 2 1HB ARG 2 19.635 3.093 6.195
12 HG2 ARG 2 2HG ARG 2 19.981 3.697 3.902
13 HG3 ARG 2 1HG ARG 2 18.481 2.783 4.008
14 HD2 ARG 2 2HD ARG 2 18.613 5.801 3.955
15 HD3 ARG 2 1HD ARG 2 18.413 4.814 2.516
16 HE ARG 2 HE ARG 2 16.349 3.978 3.592
17 HH11 ARG 2 1HH1 ARG 2 17.591 7.164 4.588
18 HH12 ARG 2 2HH1 ARG 2 16.064 7.837 4.848
19 HH21 ARG 2 1HH2 ARG 2 14.216 4.943 3.977
20 HH22 ARG 2 2HH2 ARG 2 14.101 6.553 4.513
21 H LYS 3 H LYS 3 15.192 3.035 6.555
22 HA LYS 3 HA LYS 3 15.892 0.222 6.156
23 HB2 LYS 3 2HB LYS 3 13.649 1.280 7.874
24 HB3 LYS 3 1HB LYS 3 13.913 -0.417 7.505
25 HG2 LYS 3 2HG LYS 3 16.112 -0.260 8.624
26 HG3 LYS 3 1HG LYS 3 15.724 1.400 9.077
27 HD2 LYS 3 2HD LYS 3 13.754 0.604 10.291
28 HD3 LYS 3 1HD LYS 3 14.150 -1.057 9.843
29 HE2 LYS 3 2HE LYS 3 16.325 -0.789 10.999
30 HE3 LYS 3 1HE LYS 3 15.798 0.807 11.530
31 HZ1 LYS 3 1HZ LYS 3 13.934 -0.290 12.716
32 HZ2 LYS 3 2HZ LYS 3 15.459 -0.838 13.223
33 HZ3 LYS 3 3HZ LYS 3 14.537 -1.778 12.191
34 H SER 4 H SER 4 12.893 2.122 6.186
35 HA SER 4 HA SER 4 11.206 2.363 4.713
36 HB2 SER 4 2HB SER 4 13.340 1.728 2.656
37 HB3 SER 4 1HB SER 4 11.797 2.527 2.335
38 HG SER 4 HG SER 4 12.426 4.249 3.542
39 H CYS 5 H CYS 5 11.710 -0.252 5.876
40 HA CYS 5 HA CYS 5 10.287 -1.895 3.912
41 HB2 CYS 5 2HB CYS 5 12.423 -2.829 5.840
42 HB3 CYS 5 1HB CYS 5 11.431 -3.883 4.847
43 H CYS 6 H CYS 6 8.699 -3.247 4.776
44 HA CYS 6 HA CYS 6 7.947 -2.761 7.558
45 HB2 CYS 6 2HB CYS 6 6.381 -3.501 5.108
46 HB3 CYS 6 1HB CYS 6 5.692 -3.355 6.723
47 H LEU 7 H LEU 7 7.516 -4.593 8.767
48 HA LEU 7 HA LEU 7 8.027 -7.151 7.444
49 HB2 LEU 7 2HB LEU 7 8.522 -6.395 10.334
50 HB3 LEU 7 1HB LEU 7 8.587 -8.031 9.739
51 HG LEU 7 HG LEU 7 10.480 -7.348 8.244
52 HD11 LEU 7 1HD1 LEU 7 11.701 -5.298 8.723
53 HD12 LEU 7 2HD1 LEU 7 10.430 -4.796 9.842
54 HD13 LEU 7 3HD1 LEU 7 10.075 -4.957 8.123
55 HD21 LEU 7 1HD2 LEU 7 10.862 -8.493 10.336
56 HD22 LEU 7 2HD2 LEU 7 10.865 -6.957 11.203
57 HD23 LEU 7 3HD2 LEU 7 12.138 -7.315 10.032
58 H LYS 8 H LYS 8 5.588 -5.289 8.689
59 HA LYS 8 HA LYS 8 3.918 -7.630 8.885
60 HB2 LYS 8 2HB LYS 8 2.675 -6.632 10.650
61 HB3 LYS 8 1HB LYS 8 4.337 -6.846 11.192
62 HG2 LYS 8 2HG LYS 8 4.715 -4.428 10.771
63 HG3 LYS 8 1HG LYS 8 3.026 -4.271 10.300
64 HD2 LYS 8 2HD LYS 8 4.045 -5.127 13.014
65 HD3 LYS 8 1HD LYS 8 3.380 -3.546 12.617
66 HE2 LYS 8 2HE LYS 8 1.899 -6.184 12.532
67 HE3 LYS 8 1HE LYS 8 1.727 -4.937 13.756
68 HZ1 LYS 8 1HZ LYS 8 -0.066 -4.813 12.207
69 HZ2 LYS 8 2HZ LYS 8 0.958 -4.686 10.882
70 HZ3 LYS 8 3HZ LYS 8 0.877 -3.441 12.008
71 H TYR 9 H TYR 9 1.638 -6.960 8.578
72 HA TYR 9 HA TYR 9 1.433 -4.701 6.710
73 HB2 TYR 9 2HB TYR 9 -0.493 -7.111 6.735
74 HB3 TYR 9 1HB TYR 9 -0.234 -5.880 5.549
75 HD1 TYR 9 1HD TYR 9 1.387 -6.086 3.907
76 HD2 TYR 9 2HD TYR 9 1.168 -8.945 7.007
77 HE1 TYR 9 1HE TYR 9 2.863 -7.587 2.618
78 HE2 TYR 9 2HE TYR 9 2.623 -10.463 5.743
79 HH TYR 9 HH TYR 9 4.346 -9.429 2.992
80 H THR 10 H THR 10 -0.604 -3.481 6.936
81 HA THR 10 HA THR 10 -1.523 -3.236 9.577
82 HB THR 10 HB THR 10 -1.527 -1.257 8.152
83 HG1 THR 10 1HG THR 10 -4.202 -1.269 8.218
84 HG21 THR 10 1HG2 THR 10 -3.102 -1.021 6.258
85 HG22 THR 10 2HG2 THR 10 -3.571 -2.710 6.455
86 HG23 THR 10 3HG2 THR 10 -1.921 -2.295 5.976
87 H LYS 11 H LYS 11 -3.322 -4.051 10.539
88 HA LYS 11 HA LYS 11 -4.800 -6.032 9.016
89 HB2 LYS 11 2HB LYS 11 -5.764 -6.710 11.185
90 HB3 LYS 11 1HB LYS 11 -4.010 -6.782 11.164
91 HG2 LYS 11 2HG LYS 11 -3.964 -4.630 12.381
92 HG3 LYS 11 1HG LYS 11 -5.732 -4.677 12.456
93 HD2 LYS 11 2HD LYS 11 -5.630 -6.806 13.629
94 HD3 LYS 11 1HD LYS 11 -3.869 -6.775 13.541
95 HE2 LYS 11 2HE LYS 11 -3.879 -4.710 14.886
96 HE3 LYS 11 1HE LYS 11 -5.634 -4.822 15.006
97 HZ1 LYS 11 1HZ LYS 11 -3.718 -6.856 15.942
98 HZ2 LYS 11 2HZ LYS 11 -5.384 -6.962 16.093
99 HZ3 LYS 11 3HZ LYS 11 -4.515 -5.788 16.962
100 H ARG 12 H ARG 12 -5.058 -2.849 9.624
101 HA ARG 12 HA ARG 12 -7.991 -2.903 9.497
102 HB2 ARG 12 2HB ARG 12 -7.068 -1.636 11.380
103 HB3 ARG 12 1HB ARG 12 -6.115 -0.652 10.272
104 HG2 ARG 12 2HG ARG 12 -8.022 0.623 10.962
105 HG3 ARG 12 1HG ARG 12 -8.269 0.158 9.277
106 HD2 ARG 12 2HD ARG 12 -9.651 -1.799 10.167
107 HD3 ARG 12 1HD ARG 12 -9.498 -1.045 11.734
108 HE ARG 12 HE ARG 12 -10.467 0.952 10.186
109 HH11 ARG 12 1HH1 ARG 12 -11.549 -2.316 10.983
110 HH12 ARG 12 2HH1 ARG 12 -13.190 -2.006 10.722
111 HH21 ARG 12 1HH2 ARG 12 -12.715 1.412 9.849
112 HH22 ARG 12 2HH2 ARG 12 -13.900 0.199 10.086
113 HA PRO 13 HA PRO 13 -7.243 -1.771 5.222
114 HB2 PRO 13 2HB PRO 13 -9.869 -1.160 4.613
115 HB3 PRO 13 1HB PRO 13 -9.182 -2.779 4.554
116 HG2 PRO 13 2HG PRO 13 -10.856 -1.515 6.660
117 HG3 PRO 13 1HG PRO 13 -10.836 -3.193 6.101
118 HD2 PRO 13 2HD PRO 13 -9.694 -2.357 8.401
119 HD3 PRO 13 1HD PRO 13 -9.080 -3.755 7.524
120 H LEU 14 H LEU 14 -6.828 0.098 4.260
121 HA LEU 14 HA LEU 14 -7.299 2.607 5.700
122 HB2 LEU 14 2HB LEU 14 -5.066 1.538 4.694
123 HB3 LEU 14 1HB LEU 14 -5.683 2.207 3.216
124 HG LEU 14 HG LEU 14 -4.710 3.639 5.660
125 HD11 LEU 14 1HD1 LEU 14 -3.869 3.654 2.807
126 HD12 LEU 14 2HD1 LEU 14 -3.028 2.910 4.170
127 HD13 LEU 14 3HD1 LEU 14 -3.205 4.668 4.077
128 HD21 LEU 14 1HD2 LEU 14 -6.636 4.928 4.986
129 HD22 LEU 14 2HD2 LEU 14 -6.081 4.907 3.287
130 HD23 LEU 14 3HD2 LEU 14 -5.111 5.698 4.538
131 HA PRO 15 HA PRO 15 -10.585 3.079 2.529
132 HB2 PRO 15 2HB PRO 15 -10.389 5.939 3.323
133 HB3 PRO 15 1HB PRO 15 -11.816 4.899 3.245
134 HG2 PRO 15 2HG PRO 15 -10.770 5.575 5.597
135 HG3 PRO 15 1HG PRO 15 -11.385 3.939 5.317
136 HD2 PRO 15 2HD PRO 15 -8.570 4.921 5.366
137 HD3 PRO 15 1HD PRO 15 -9.249 3.410 6.008
138 H LEU 16 H LEU 16 -10.374 3.500 0.436
139 HA LEU 16 HA LEU 16 -7.921 4.352 -0.688
140 HB2 LEU 16 2HB LEU 16 -9.228 2.777 -1.851
141 HB3 LEU 16 1HB LEU 16 -10.617 3.890 -1.948
142 HG LEU 16 HG LEU 16 -9.106 5.270 -3.394
143 HD11 LEU 16 1HD1 LEU 16 -7.198 4.069 -4.403
144 HD12 LEU 16 2HD1 LEU 16 -7.436 2.776 -3.237
145 HD13 LEU 16 3HD1 LEU 16 -6.971 4.391 -2.689
146 HD21 LEU 16 1HD2 LEU 16 -9.810 2.480 -4.203
147 HD22 LEU 16 2HD2 LEU 16 -9.473 3.837 -5.311
148 HD23 LEU 16 3HD2 LEU 16 -10.850 3.921 -4.204
149 H LYS 17 H LYS 17 -10.866 5.898 -0.013
150 HA LYS 17 HA LYS 17 -10.659 8.235 -1.513
151 HB2 LYS 17 2HB LYS 17 -11.919 7.863 1.197
152 HB3 LYS 17 1HB LYS 17 -12.251 9.182 0.078
153 HG2 LYS 17 2HG LYS 17 -13.117 7.595 -1.540
154 HG3 LYS 17 1HG LYS 17 -12.781 6.269 -0.434
155 HD2 LYS 17 2HD LYS 17 -14.319 7.334 1.207
156 HD3 LYS 17 1HD LYS 17 -14.716 8.540 -0.017
157 HE2 LYS 17 2HE LYS 17 -15.108 5.568 -0.270
158 HE3 LYS 17 1HE LYS 17 -16.380 6.754 0.040
159 HZ1 LYS 17 1HZ LYS 17 -14.706 6.580 -2.418
160 HZ2 LYS 17 2HZ LYS 17 -15.887 7.734 -2.142
161 HZ3 LYS 17 3HZ LYS 17 -16.314 6.120 -2.289
162 H ARG 18 H ARG 18 -8.679 7.174 0.917
163 HA ARG 18 HA ARG 18 -7.792 9.928 1.567
164 HB2 ARG 18 2HB ARG 18 -8.946 8.756 3.470
165 HB3 ARG 18 1HB ARG 18 -7.699 7.528 3.402
166 HG2 ARG 18 2HG ARG 18 -7.306 9.072 5.211
167 HG3 ARG 18 1HG ARG 18 -6.014 9.191 4.013
168 HD2 ARG 18 2HD ARG 18 -6.670 11.403 4.752
169 HD3 ARG 18 1HD ARG 18 -7.108 11.191 3.067
170 HE ARG 18 HE ARG 18 -9.250 10.501 4.809
171 HH11 ARG 18 1HH1 ARG 18 -7.617 13.378 3.461
172 HH12 ARG 18 2HH1 ARG 18 -9.033 14.293 3.426
173 HH21 ARG 18 1HH2 ARG 18 -11.166 11.830 4.781
174 HH22 ARG 18 2HH2 ARG 18 -11.078 13.423 4.217
175 H ILE 19 H ILE 19 -6.932 7.499 -0.280
176 HA ILE 19 HA ILE 19 -4.113 7.401 0.569
177 HB ILE 19 HB ILE 19 -5.515 5.554 -1.396
178 HG12 ILE 19 2HG1 ILE 19 -4.756 5.009 1.467
179 HG13 ILE 19 1HG1 ILE 19 -6.399 5.379 0.956
180 HG21 ILE 19 1HG2 ILE 19 -2.829 5.344 0.020
181 HG22 ILE 19 2HG2 ILE 19 -3.060 5.697 -1.690
182 HG23 ILE 19 3HG2 ILE 19 -3.516 4.125 -1.044
183 HD11 ILE 19 1HD1 ILE 19 -6.375 3.348 -0.456
184 HD12 ILE 19 2HD1 ILE 19 -6.079 2.987 1.242
185 HD13 ILE 19 3HD1 ILE 19 -4.743 3.038 0.090
186 H LYS 20 H LYS 20 -2.639 8.318 -0.708
187 HA LYS 20 HA LYS 20 -3.535 9.595 -3.138
188 HB2 LYS 20 2HB LYS 20 -0.852 9.770 -1.744
189 HB3 LYS 20 1HB LYS 20 -1.308 10.709 -3.142
190 HG2 LYS 20 2HG LYS 20 -2.461 10.819 -0.435
191 HG3 LYS 20 1HG LYS 20 -1.511 12.064 -1.261
192 HD2 LYS 20 2HD LYS 20 -4.255 11.067 -1.891
193 HD3 LYS 20 1HD LYS 20 -3.835 12.660 -1.302
194 HE2 LYS 20 2HE LYS 20 -3.021 11.599 -4.032
195 HE3 LYS 20 1HE LYS 20 -4.316 12.756 -3.738
196 HZ1 LYS 20 1HZ LYS 20 -2.674 14.298 -2.868
197 HZ2 LYS 20 2HZ LYS 20 -2.286 13.856 -4.443
198 HZ3 LYS 20 3HZ LYS 20 -1.425 13.208 -3.166
199 H SER 21 H SER 21 -1.122 7.157 -2.090
200 HA SER 21 HA SER 21 -1.066 5.790 -4.489
201 HB2 SER 21 2HB SER 21 1.273 6.437 -5.176
202 HB3 SER 21 1HB SER 21 0.032 7.644 -5.510
203 HG SER 21 HG SER 21 1.079 8.949 -4.335
204 H TYR 22 H TYR 22 1.027 4.378 -4.527
205 HA TYR 22 HA TYR 22 1.950 3.792 -1.790
206 HB2 TYR 22 2HB TYR 22 1.674 1.416 -2.206
207 HB3 TYR 22 1HB TYR 22 0.131 2.237 -2.291
208 HD1 TYR 22 1HD TYR 22 -1.178 2.063 -4.173
209 HD2 TYR 22 2HD TYR 22 2.822 0.711 -4.383
210 HE1 TYR 22 1HE TYR 22 -1.649 1.022 -6.335
211 HE2 TYR 22 2HE TYR 22 2.374 -0.339 -6.563
212 HH TYR 22 HH TYR 22 -0.485 0.316 -8.312
213 H THR 23 H THR 23 3.739 2.315 -1.829
214 HA THR 23 HA THR 23 5.342 2.479 -4.251
215 HB THR 23 HB THR 23 6.250 4.130 -2.641
216 HG1 THR 23 1HG THR 23 7.708 2.585 -3.906
217 HG21 THR 23 1HG2 THR 23 6.501 1.784 -0.763
218 HG22 THR 23 2HG2 THR 23 5.429 3.174 -0.584
219 HG23 THR 23 3HG2 THR 23 7.175 3.393 -0.469
220 H ILE 24 H ILE 24 6.742 0.612 -4.526
221 HA ILE 24 HA ILE 24 5.459 -1.711 -3.361
222 HB ILE 24 HB ILE 24 7.271 -1.482 -5.776
223 HG12 ILE 24 2HG1 ILE 24 4.277 -1.917 -5.563
224 HG13 ILE 24 1HG1 ILE 24 5.065 -0.433 -6.082
225 HG21 ILE 24 1HG2 ILE 24 5.737 -3.874 -4.735
226 HG22 ILE 24 2HG2 ILE 24 7.491 -3.682 -4.731
227 HG23 ILE 24 3HG2 ILE 24 6.621 -3.810 -6.259
228 HD11 ILE 24 1HD1 ILE 24 5.164 -3.086 -7.503
229 HD12 ILE 24 2HD1 ILE 24 5.959 -1.603 -8.033
230 HD13 ILE 24 3HD1 ILE 24 4.199 -1.685 -7.970
231 H GLN 25 H GLN 25 6.383 -2.672 -1.705
232 HA GLN 25 HA GLN 25 9.259 -2.605 -1.384
233 HB2 GLN 25 2HB GLN 25 8.157 -2.220 0.664
234 HB3 GLN 25 1HB GLN 25 6.994 -3.503 0.413
235 HG2 GLN 25 2HG GLN 25 8.760 -5.149 0.688
236 HG3 GLN 25 1HG GLN 25 9.918 -3.850 0.953
237 HE21 GLN 25 1HE2 GLN 25 8.893 -6.077 2.651
238 HE22 GLN 25 2HE2 GLN 25 8.426 -5.319 4.125
239 H SER 26 H SER 26 10.444 -4.118 -2.245
240 HA SER 26 HA SER 26 9.197 -6.558 -3.099
241 HB2 SER 26 2HB SER 26 11.407 -6.870 -4.248
242 HB3 SER 26 1HB SER 26 10.552 -5.403 -4.724
243 HG SER 26 HG SER 26 12.687 -4.953 -4.352
244 H ASN 27 H ASN 27 9.870 -8.573 -2.375
245 HA ASN 27 HA ASN 27 11.048 -8.592 0.242
246 HB2 ASN 27 2HB ASN 27 10.662 -11.055 0.210
247 HB3 ASN 27 1HB ASN 27 9.220 -10.087 -0.042
248 HD21 ASN 27 1HD2 ASN 27 8.133 -11.676 -1.017
249 HD22 ASN 27 2HD2 ASN 27 8.544 -12.232 -2.590
250 H GLU 28 H GLU 28 12.237 -8.419 -2.676
251 HA GLU 28 HA GLU 28 14.523 -10.059 -2.616
252 HB2 GLU 28 2HB GLU 28 13.566 -9.006 -4.628
253 HB3 GLU 28 1HB GLU 28 13.953 -7.424 -3.977
254 HG2 GLU 28 2HG GLU 28 16.326 -8.044 -4.027
255 HG3 GLU 28 1HG GLU 28 15.874 -9.572 -4.793
256 H ALA 29 H ALA 29 13.773 -6.694 -1.721
257 HA ALA 29 HA ALA 29 16.442 -6.356 -0.565
258 HB1 ALA 29 1HB ALA 29 15.937 -3.988 -0.538
259 HB2 ALA 29 2HB ALA 29 14.297 -4.317 -1.095
260 HB3 ALA 29 3HB ALA 29 15.668 -4.674 -2.143
261 H CYS 30 H CYS 30 13.095 -6.587 0.358
262 HA CYS 30 HA CYS 30 13.854 -6.018 3.152
263 HB2 CYS 30 2HB CYS 30 11.146 -5.812 1.838
264 HB3 CYS 30 1HB CYS 30 11.529 -5.388 3.496
265 H ASN 31 H ASN 31 12.398 -7.275 4.705
266 HA ASN 31 HA ASN 31 12.774 -10.017 4.350
267 HB2 ASN 31 2HB ASN 31 10.793 -8.650 6.191
268 HB3 ASN 31 1HB ASN 31 11.144 -10.367 6.215
269 HD21 ASN 31 1HD2 ASN 31 11.859 -10.349 8.284
270 HD22 ASN 31 2HD2 ASN 31 13.322 -9.637 8.822
271 H ILE 32 H ILE 32 9.757 -8.193 4.035
272 HA ILE 32 HA ILE 32 8.616 -10.481 2.554
273 HB ILE 32 HB ILE 32 6.416 -9.887 3.450
274 HG12 ILE 32 2HG1 ILE 32 7.878 -7.764 5.042
275 HG13 ILE 32 1HG1 ILE 32 6.833 -7.446 3.668
276 HG21 ILE 32 1HG2 ILE 32 8.485 -10.045 5.598
277 HG22 ILE 32 2HG2 ILE 32 7.828 -11.443 4.734
278 HG23 ILE 32 3HG2 ILE 32 6.781 -10.477 5.802
279 HD11 ILE 32 1HD1 ILE 32 6.003 -8.665 6.287
280 HD12 ILE 32 2HD1 ILE 32 4.935 -8.341 4.918
281 HD13 ILE 32 3HD1 ILE 32 5.714 -7.004 5.771
282 H LYS 33 H LYS 33 6.605 -9.633 1.300
283 HA LYS 33 HA LYS 33 7.303 -7.139 -0.028
284 HB2 LYS 33 2HB LYS 33 6.998 -9.125 -1.491
285 HB3 LYS 33 1HB LYS 33 5.385 -9.351 -0.833
286 HG2 LYS 33 2HG LYS 33 4.710 -7.177 -1.748
287 HG3 LYS 33 1HG LYS 33 6.317 -6.975 -2.433
288 HD2 LYS 33 2HD LYS 33 5.977 -8.990 -3.791
289 HD3 LYS 33 1HD LYS 33 4.358 -9.166 -3.107
290 HE2 LYS 33 2HE LYS 33 3.753 -6.962 -4.010
291 HE3 LYS 33 1HE LYS 33 5.357 -6.818 -4.718
292 HZ1 LYS 33 1HZ LYS 33 3.327 -8.870 -5.413
293 HZ2 LYS 33 2HZ LYS 33 4.887 -8.785 -6.052
294 HZ3 LYS 33 3HZ LYS 33 3.782 -7.559 -6.367
295 H ALA 34 H ALA 34 6.318 -5.482 0.952
296 HA ALA 34 HA ALA 34 3.486 -5.748 1.630
297 HB1 ALA 34 1HB ALA 34 4.747 -5.949 3.748
298 HB2 ALA 34 2HB ALA 34 3.866 -4.430 3.691
299 HB3 ALA 34 3HB ALA 34 5.599 -4.451 3.386
300 H ILE 35 H ILE 35 2.548 -4.388 0.253
301 HA ILE 35 HA ILE 35 3.903 -2.206 -0.949
302 HB ILE 35 HB ILE 35 0.955 -2.853 -0.765
303 HG12 ILE 35 2HG1 ILE 35 2.310 -4.594 -1.795
304 HG13 ILE 35 1HG1 ILE 35 1.246 -3.838 -2.983
305 HG21 ILE 35 1HG2 ILE 35 0.673 -1.361 -2.728
306 HG22 ILE 35 2HG2 ILE 35 2.364 -0.919 -2.613
307 HG23 ILE 35 3HG2 ILE 35 1.262 -0.489 -1.321
308 HD11 ILE 35 1HD1 ILE 35 3.416 -4.286 -3.923
309 HD12 ILE 35 2HD1 ILE 35 4.203 -3.395 -2.620
310 HD13 ILE 35 3HD1 ILE 35 3.189 -2.538 -3.778
311 H ILE 36 H ILE 36 4.092 -0.081 -0.282
312 HA ILE 36 HA ILE 36 2.856 0.442 2.289
313 HB ILE 36 HB ILE 36 5.142 1.968 0.988
314 HG12 ILE 36 2HG1 ILE 36 6.417 1.050 3.063
315 HG13 ILE 36 1HG1 ILE 36 5.135 -0.153 3.094
316 HG21 ILE 36 1HG2 ILE 36 3.858 3.405 2.400
317 HG22 ILE 36 2HG2 ILE 36 5.428 3.008 3.136
318 HG23 ILE 36 3HG2 ILE 36 3.961 2.220 3.719
319 HD11 ILE 36 1HD1 ILE 36 5.722 -0.852 0.874
320 HD12 ILE 36 2HD1 ILE 36 7.111 -0.942 1.977
321 HD13 ILE 36 3HD1 ILE 36 6.973 0.395 0.820
322 H PHE 37 H PHE 37 1.100 1.402 2.183
323 HA PHE 37 HA PHE 37 0.207 3.098 0.054
324 HB2 PHE 37 2HB PHE 37 -0.858 2.025 2.623
325 HB3 PHE 37 1HB PHE 37 -1.694 3.366 1.832
326 HD1 PHE 37 1HD PHE 37 -0.012 0.661 0.098
327 HD2 PHE 37 2HD PHE 37 -3.672 2.188 1.426
328 HE1 PHE 37 1HE PHE 37 -1.255 -0.980 -1.395
329 HE2 PHE 37 2HE PHE 37 -4.901 0.607 0.001
330 HZ PHE 37 HZ PHE 37 -3.688 -0.960 -1.401
331 H THR 38 H THR 38 0.025 5.219 0.122
332 HA THR 38 HA THR 38 0.876 6.524 2.577
333 HB THR 38 HB THR 38 1.415 7.453 -0.259
334 HG1 THR 38 1HG THR 38 2.640 5.726 1.375
335 HG21 THR 38 1HG2 THR 38 1.152 9.274 1.316
336 HG22 THR 38 2HG2 THR 38 2.859 9.131 0.880
337 HG23 THR 38 3HG2 THR 38 2.258 8.511 2.441
338 H THR 39 H THR 39 -0.474 8.070 3.320
339 HA THR 39 HA THR 39 -3.048 8.226 2.042
340 HB THR 39 HB THR 39 -3.621 9.579 4.078
341 HG1 THR 39 1HG THR 39 -2.021 9.148 5.807
342 HG21 THR 39 1HG2 THR 39 -4.116 7.226 3.921
343 HG22 THR 39 2HG2 THR 39 -3.638 7.627 5.579
344 HG23 THR 39 3HG2 THR 39 -2.504 6.814 4.491
345 H LYS 40 H LYS 40 -4.123 10.431 2.188
346 HA LYS 40 HA LYS 40 -2.669 12.347 0.716
347 HB2 LYS 40 2HB LYS 40 -5.037 12.850 2.457
348 HB3 LYS 40 1HB LYS 40 -4.567 13.819 1.056
349 HG2 LYS 40 2HG LYS 40 -5.032 11.481 -0.222
350 HG3 LYS 40 1HG LYS 40 -5.934 11.187 1.222
351 HD2 LYS 40 2HD LYS 40 -7.329 13.127 0.902
352 HD3 LYS 40 1HD LYS 40 -6.328 13.595 -0.489
353 HE2 LYS 40 2HE LYS 40 -6.972 11.593 -1.672
354 HE3 LYS 40 1HE LYS 40 -7.935 11.063 -0.307
355 HZ1 LYS 40 1HZ LYS 40 -9.320 13.089 -0.608
356 HZ2 LYS 40 2HZ LYS 40 -9.358 12.065 -1.944
357 HZ3 LYS 40 3HZ LYS 40 -8.438 13.461 -1.988
358 H LYS 41 H LYS 41 -2.924 11.684 4.097
359 HA LYS 41 HA LYS 41 -1.796 14.178 4.956
360 HB2 LYS 41 2HB LYS 41 -2.075 11.511 6.339
361 HB3 LYS 41 1HB LYS 41 -1.258 12.856 7.097
362 HG2 LYS 41 2HG LYS 41 -3.492 12.735 7.977
363 HG3 LYS 41 1HG LYS 41 -3.398 14.143 6.935
364 HD2 LYS 41 2HD LYS 41 -4.510 12.895 5.151
365 HD3 LYS 41 1HD LYS 41 -4.572 11.470 6.183
366 HE2 LYS 41 2HE LYS 41 -5.869 14.120 6.804
367 HE3 LYS 41 1HE LYS 41 -6.720 12.717 6.183
368 HZ1 LYS 41 1HZ LYS 41 -5.332 12.894 8.817
369 HZ2 LYS 41 2HZ LYS 41 -6.066 11.519 8.212
370 HZ3 LYS 41 3HZ LYS 41 -6.991 12.885 8.534
371 H GLY 42 H GLY 42 -0.723 11.357 3.520
372 HA2 GLY 42 2HA GLY 42 1.288 11.071 2.510
373 HA3 GLY 42 1HA GLY 42 1.933 12.409 3.425
374 H ARG 43 H ARG 43 0.339 10.035 5.299
375 HA ARG 43 HA ARG 43 2.804 9.199 6.518
376 HB2 ARG 43 2HB ARG 43 0.003 8.261 6.868
377 HB3 ARG 43 1HB ARG 43 1.342 7.604 7.796
378 HG2 ARG 43 2HG ARG 43 1.746 9.934 8.666
379 HG3 ARG 43 1HG ARG 43 0.246 10.420 7.867
380 HD2 ARG 43 2HD ARG 43 -0.130 9.896 10.239
381 HD3 ARG 43 1HD ARG 43 -1.001 8.781 9.192
382 HE ARG 43 HE ARG 43 1.550 7.755 9.852
383 HH11 ARG 43 1HH1 ARG 43 -1.659 8.206 11.308
384 HH12 ARG 43 2HH1 ARG 43 -1.504 6.879 12.356
385 HH21 ARG 43 1HH2 ARG 43 1.737 5.971 11.282
386 HH22 ARG 43 2HH2 ARG 43 0.462 5.574 12.366
387 H LYS 44 H LYS 44 3.363 6.914 6.838
388 HA LYS 44 HA LYS 44 3.113 5.409 4.337
389 HB2 LYS 44 2HB LYS 44 4.986 5.111 6.687
390 HB3 LYS 44 1HB LYS 44 5.013 4.100 5.256
391 HG2 LYS 44 2HG LYS 44 5.540 7.066 5.314
392 HG3 LYS 44 1HG LYS 44 6.776 5.811 5.256
393 HD2 LYS 44 2HD LYS 44 5.795 5.037 3.099
394 HD3 LYS 44 1HD LYS 44 4.688 6.410 3.150
395 HE2 LYS 44 2HE LYS 44 6.585 6.920 1.729
396 HE3 LYS 44 1HE LYS 44 6.618 7.932 3.173
397 HZ1 LYS 44 1HZ LYS 44 8.248 5.478 2.752
398 HZ2 LYS 44 2HZ LYS 44 8.292 6.448 4.124
399 HZ3 LYS 44 3HZ LYS 44 8.806 7.058 2.639
400 H ILE 45 H ILE 45 1.815 3.663 4.286
401 HA ILE 45 HA ILE 45 1.169 2.320 6.819
402 HB ILE 45 HB ILE 45 -0.673 2.616 4.418
403 HG12 ILE 45 2HG1 ILE 45 -2.210 3.799 6.150
404 HG13 ILE 45 1HG1 ILE 45 -0.750 3.978 7.126
405 HG21 ILE 45 1HG2 ILE 45 -1.160 1.250 7.053
406 HG22 ILE 45 2HG2 ILE 45 -0.985 0.485 5.475
407 HG23 ILE 45 3HG2 ILE 45 -2.381 1.512 5.805
408 HD11 ILE 45 1HD1 ILE 45 -1.292 5.971 5.928
409 HD12 ILE 45 2HD1 ILE 45 -1.271 5.107 4.405
410 HD13 ILE 45 3HD1 ILE 45 0.240 5.312 5.314
411 H CYS 46 H CYS 46 1.816 0.286 6.840
412 HA CYS 46 HA CYS 46 2.824 -1.021 4.442
413 HB2 CYS 46 2HB CYS 46 2.571 -2.017 7.279
414 HB3 CYS 46 1HB CYS 46 3.579 -2.760 6.056
415 H ALA 47 H ALA 47 1.308 -2.004 3.121
416 HA ALA 47 HA ALA 47 -0.959 -3.278 4.496
417 HB1 ALA 47 1HB ALA 47 -0.937 -2.038 1.750
418 HB2 ALA 47 2HB ALA 47 -1.612 -1.299 3.202
419 HB3 ALA 47 3HB ALA 47 -2.320 -2.779 2.555
420 H ASN 48 H ASN 48 -1.737 -5.257 3.730
421 HA ASN 48 HA ASN 48 0.240 -6.879 2.485
422 HB2 ASN 48 2HB ASN 48 -0.892 -7.917 4.227
423 HB3 ASN 48 1HB ASN 48 -2.485 -7.483 3.687
424 HD21 ASN 48 1HD2 ASN 48 0.177 -8.918 1.859
425 HD22 ASN 48 2HD2 ASN 48 -0.668 -10.377 1.439
426 HA PRO 49 HA PRO 49 -1.113 -5.808 -1.641
427 HB2 PRO 49 2HB PRO 49 0.483 -7.657 -2.863
428 HB3 PRO 49 1HB PRO 49 0.997 -6.030 -2.434
429 HG2 PRO 49 2HG PRO 49 1.463 -8.607 -1.014
430 HG3 PRO 49 1HG PRO 49 2.553 -7.222 -1.203
431 HD2 PRO 49 2HD PRO 49 1.261 -7.687 1.081
432 HD3 PRO 49 1HD PRO 49 1.517 -6.031 0.507
433 H ASN 50 H ASN 50 -1.213 -8.872 -0.140
434 HA ASN 50 HA ASN 50 -2.549 -10.206 -2.253
435 HB2 ASN 50 2HB ASN 50 -2.244 -11.026 0.633
436 HB3 ASN 50 1HB ASN 50 -2.955 -12.009 -0.641
437 HD21 ASN 50 1HD2 ASN 50 -1.052 -11.230 -2.695
438 HD22 ASN 50 2HD2 ASN 50 0.432 -11.990 -2.270
439 H GLU 51 H GLU 51 -3.533 -7.999 0.181
440 HA GLU 51 HA GLU 51 -6.115 -9.161 0.600
441 HB2 GLU 51 2HB GLU 51 -5.214 -6.388 1.352
442 HB3 GLU 51 1HB GLU 51 -6.654 -7.206 1.922
443 HG2 GLU 51 2HG GLU 51 -4.926 -8.988 2.801
444 HG3 GLU 51 1HG GLU 51 -3.830 -7.671 2.504
445 H LYS 52 H LYS 52 -7.958 -8.753 -0.302
446 HA LYS 52 HA LYS 52 -8.169 -7.852 -2.883
447 HB2 LYS 52 2HB LYS 52 -9.831 -9.275 -1.878
448 HB3 LYS 52 1HB LYS 52 -10.269 -8.022 -0.732
449 HG2 LYS 52 2HG LYS 52 -11.093 -6.633 -2.582
450 HG3 LYS 52 1HG LYS 52 -10.673 -7.923 -3.710
451 HD2 LYS 52 2HD LYS 52 -12.232 -9.419 -2.633
452 HD3 LYS 52 1HD LYS 52 -12.594 -8.196 -1.414
453 HE2 LYS 52 2HE LYS 52 -13.490 -6.733 -3.160
454 HE3 LYS 52 1HE LYS 52 -13.130 -7.962 -4.372
455 HZ1 LYS 52 1HZ LYS 52 -15.018 -8.283 -2.098
456 HZ2 LYS 52 2HZ LYS 52 -14.657 -9.452 -3.257
457 HZ3 LYS 52 3HZ LYS 52 -15.429 -8.028 -3.720
458 H TRP 53 H TRP 53 -8.685 -6.013 0.108
459 HA TRP 53 HA TRP 53 -9.777 -3.753 -1.196
460 HB2 TRP 53 2HB TRP 53 -9.521 -2.524 0.876
461 HB3 TRP 53 1HB TRP 53 -10.065 -4.149 1.251
462 HD1 TRP 53 HD TRP 53 -8.242 -5.767 2.542
463 HE1 TRP 53 1HE TRP 53 -6.192 -5.156 3.962
464 HE3 TRP 53 3HE TRP 53 -7.609 -0.900 1.106
465 HZ2 TRP 53 2HZ TRP 53 -4.538 -2.982 4.429
466 HZ3 TRP 53 3HZ TRP 53 -5.751 0.364 2.094
467 HH2 TRP 53 HH TRP 53 -4.250 -0.653 3.718
468 H VAL 54 H VAL 54 -6.557 -4.786 -0.592
469 HA VAL 54 HA VAL 54 -5.257 -2.321 -1.179
470 HB VAL 54 HB VAL 54 -4.213 -5.173 -1.062
471 HG11 VAL 54 1HG1 VAL 54 -2.654 -2.602 -1.283
472 HG12 VAL 54 2HG1 VAL 54 -2.807 -3.841 -2.527
473 HG13 VAL 54 3HG1 VAL 54 -1.976 -4.203 -1.005
474 HG21 VAL 54 1HG2 VAL 54 -3.938 -2.866 0.832
475 HG22 VAL 54 2HG2 VAL 54 -3.233 -4.465 1.042
476 HG23 VAL 54 3HG2 VAL 54 -4.990 -4.258 1.059
477 H GLN 55 H GLN 55 -6.043 -5.250 -2.922
478 HA GLN 55 HA GLN 55 -4.671 -4.540 -5.276
479 HB2 GLN 55 2HB GLN 55 -6.959 -6.469 -5.004
480 HB3 GLN 55 1HB GLN 55 -5.765 -6.417 -6.306
481 HG2 GLN 55 2HG GLN 55 -4.012 -6.678 -4.515
482 HG3 GLN 55 1HG GLN 55 -5.331 -7.085 -3.428
483 HE21 GLN 55 1HE2 GLN 55 -3.135 -8.584 -4.182
484 HE22 GLN 55 2HE2 GLN 55 -3.675 -10.012 -4.956
485 H LYS 56 H LYS 56 -7.959 -4.172 -4.110
486 HA LYS 56 HA LYS 56 -9.249 -3.062 -6.314
487 HB2 LYS 56 2HB LYS 56 -10.344 -3.868 -4.276
488 HB3 LYS 56 1HB LYS 56 -9.574 -2.595 -3.352
489 HG2 LYS 56 2HG LYS 56 -10.813 -0.937 -4.624
490 HG3 LYS 56 1HG LYS 56 -11.617 -2.242 -5.514
491 HD2 LYS 56 2HD LYS 56 -12.535 -3.115 -3.462
492 HD3 LYS 56 1HD LYS 56 -11.702 -1.875 -2.523
493 HE2 LYS 56 2HE LYS 56 -13.007 -0.149 -3.742
494 HE3 LYS 56 1HE LYS 56 -13.877 -1.438 -4.569
495 HZ1 LYS 56 1HZ LYS 56 -14.718 -2.205 -2.461
496 HZ2 LYS 56 2HZ LYS 56 -15.098 -0.581 -2.642
497 HZ3 LYS 56 3HZ LYS 56 -13.836 -1.065 -1.624
498 H ALA 57 H ALA 57 -7.272 -1.684 -3.737
499 HA ALA 57 HA ALA 57 -7.581 1.042 -4.497
500 HB1 ALA 57 1HB ALA 57 -5.709 1.475 -2.993
501 HB2 ALA 57 2HB ALA 57 -5.368 -0.244 -2.861
502 HB3 ALA 57 3HB ALA 57 -6.888 0.422 -2.234
503 H MET 58 H MET 58 -5.190 -1.409 -5.200
504 HA MET 58 HA MET 58 -3.329 0.189 -6.507
505 HB2 MET 58 2HB MET 58 -3.969 -2.690 -7.016
506 HB3 MET 58 1HB MET 58 -2.618 -1.846 -7.747
507 HG2 MET 58 2HG MET 58 -1.763 -1.377 -5.477
508 HG3 MET 58 1HG MET 58 -3.077 -2.359 -4.839
509 HE1 MET 58 1HE MET 58 0.087 -2.913 -4.389
510 HE2 MET 58 2HE MET 58 0.076 -4.673 -4.463
511 HE3 MET 58 3HE MET 58 -1.207 -3.827 -3.602
512 H LYS 59 H LYS 59 -6.114 -1.459 -7.866
513 HA LYS 59 HA LYS 59 -5.600 -0.870 -10.525
514 HB2 LYS 59 2HB LYS 59 -7.235 -2.518 -9.817
515 HB3 LYS 59 1HB LYS 59 -8.192 -1.282 -9.035
516 HG2 LYS 59 2HG LYS 59 -8.839 -0.364 -11.122
517 HG3 LYS 59 1HG LYS 59 -7.706 -1.408 -11.997
518 HD2 LYS 59 2HD LYS 59 -8.928 -3.383 -11.266
519 HD3 LYS 59 1HD LYS 59 -10.024 -2.381 -10.323
520 HE2 LYS 59 2HE LYS 59 -9.707 -2.202 -13.314
521 HE3 LYS 59 1HE LYS 59 -10.939 -3.169 -12.514
522 HZ1 LYS 59 1HZ LYS 59 -10.649 -0.215 -12.283
523 HZ2 LYS 59 2HZ LYS 59 -11.830 -1.154 -11.528
524 HZ3 LYS 59 3HZ LYS 59 -11.793 -1.040 -13.198
525 H HIS 60 H HIS 60 -7.230 0.995 -8.066
526 HA HIS 60 HA HIS 60 -7.860 3.162 -9.794
527 HB2 HIS 60 2HB HIS 60 -9.254 2.723 -7.888
528 HB3 HIS 60 1HB HIS 60 -7.874 2.821 -6.804
529 HD1 HIS 60 1HD HIS 60 -10.164 5.010 -8.873
530 HD2 HIS 60 2HD HIS 60 -7.323 5.287 -5.885
531 HE1 HIS 60 1HE HIS 60 -10.283 7.397 -8.071
532 HE2 HIS 60 2HE HIS 60 -8.453 7.586 -6.355
533 H LEU 61 H LEU 61 -5.311 2.522 -7.427
534 HA LEU 61 HA LEU 61 -4.141 5.143 -7.514
535 HB2 LEU 61 2HB LEU 61 -3.104 2.562 -6.407
536 HB3 LEU 61 1HB LEU 61 -2.342 4.119 -6.169
537 HG LEU 61 HG LEU 61 -5.097 3.371 -5.192
538 HD11 LEU 61 1HD1 LEU 61 -2.489 3.628 -3.703
539 HD12 LEU 61 2HD1 LEU 61 -3.324 2.119 -4.076
540 HD13 LEU 61 3HD1 LEU 61 -4.068 3.293 -2.987
541 HD21 LEU 61 1HD2 LEU 61 -3.368 5.786 -4.664
542 HD22 LEU 61 2HD2 LEU 61 -4.911 5.439 -3.886
543 HD23 LEU 61 3HD2 LEU 61 -4.853 5.770 -5.619
544 H ASP 62 H ASP 62 -3.478 2.170 -9.269
545 HA ASP 62 HA ASP 62 -0.804 2.894 -10.012
546 HB2 ASP 62 2HB ASP 62 -1.561 0.541 -9.929
547 HB3 ASP 62 1HB ASP 62 -2.684 0.891 -11.240
548 H LYS 63 H LYS 63 -3.932 3.475 -11.277
549 HA LYS 63 HA LYS 63 -2.677 4.829 -13.479
550 HB2 LYS 63 2HB LYS 63 -4.709 4.440 -14.820
551 HB3 LYS 63 1HB LYS 63 -3.945 2.945 -14.317
552 HG2 LYS 63 2HG LYS 63 -5.662 2.965 -12.388
553 HG3 LYS 63 1HG LYS 63 -6.503 4.173 -13.361
554 HD2 LYS 63 2HD LYS 63 -7.464 2.074 -13.903
555 HD3 LYS 63 1HD LYS 63 -6.422 2.515 -15.260
556 HE2 LYS 63 2HE LYS 63 -4.623 1.103 -14.292
557 HE3 LYS 63 1HE LYS 63 -5.738 0.632 -13.012
558 HZ1 LYS 63 1HZ LYS 63 -5.628 -1.029 -14.750
559 HZ2 LYS 63 2HZ LYS 63 -6.092 0.094 -15.906
560 HZ3 LYS 63 3HZ LYS 63 -7.173 -0.365 -14.716
561 H LYS 64 H LYS 64 -2.399 6.555 -12.243
562 HA LYS 64 HA LYS 64 -4.758 7.994 -11.336
563 HB2 LYS 64 2HB LYS 64 -3.114 9.290 -9.928
564 HB3 LYS 64 1HB LYS 64 -3.269 7.590 -9.515
565 HG2 LYS 64 2HG LYS 64 -1.189 7.146 -10.808
566 HG3 LYS 64 1HG LYS 64 -1.042 8.885 -11.073
567 HD2 LYS 64 2HD LYS 64 -0.877 9.251 -8.676
568 HD3 LYS 64 1HD LYS 64 -1.085 7.523 -8.380
569 HE2 LYS 64 2HE LYS 64 0.975 7.103 -9.698
570 HE3 LYS 64 1HE LYS 64 1.192 8.841 -9.859
571 HZ1 LYS 64 1HZ LYS 64 1.353 8.986 -7.432
572 HZ2 LYS 64 2HZ LYS 64 2.524 7.947 -8.069
573 HZ3 LYS 64 3HZ LYS 64 1.166 7.307 -7.333
Start of MODEL 7
1 H1 ALA 1 1HT ALA 1 20.158 5.371 4.949
2 H2 ALA 1 2HT ALA 1 19.000 5.883 3.840
3 H3 ALA 1 3HT ALA 1 20.499 5.325 3.302
4 HA ALA 1 HA ALA 1 20.082 3.151 4.098
5 HB1 ALA 1 1HB ALA 1 18.645 3.763 5.979
6 HB2 ALA 1 2HB ALA 1 17.904 2.526 4.968
7 HB3 ALA 1 3HB ALA 1 17.358 4.200 4.848
8 H ARG 2 H ARG 2 17.722 5.305 2.515
9 HA ARG 2 HA ARG 2 16.464 5.146 0.690
10 HB2 ARG 2 2HB ARG 2 18.829 3.633 -0.444
11 HB3 ARG 2 1HB ARG 2 17.522 4.315 -1.389
12 HG2 ARG 2 2HG ARG 2 18.199 6.566 -0.589
13 HG3 ARG 2 1HG ARG 2 19.572 5.814 0.221
14 HD2 ARG 2 2HD ARG 2 18.992 5.749 -2.739
15 HD3 ARG 2 1HD ARG 2 20.247 6.698 -1.952
16 HE ARG 2 HE ARG 2 20.661 4.041 -1.259
17 HH11 ARG 2 1HH1 ARG 2 20.788 6.021 -4.191
18 HH12 ARG 2 2HH1 ARG 2 21.879 4.999 -4.993
19 HH21 ARG 2 1HH2 ARG 2 22.166 2.689 -2.336
20 HH22 ARG 2 2HH2 ARG 2 22.709 3.079 -3.909
21 H LYS 3 H LYS 3 14.965 3.810 1.850
22 HA LYS 3 HA LYS 3 14.350 1.432 0.431
23 HB2 LYS 3 2HB LYS 3 14.485 -0.111 2.341
24 HB3 LYS 3 1HB LYS 3 16.068 0.467 1.843
25 HG2 LYS 3 2HG LYS 3 16.090 2.049 3.699
26 HG3 LYS 3 1HG LYS 3 14.490 1.510 4.195
27 HD2 LYS 3 2HD LYS 3 16.974 -0.208 4.097
28 HD3 LYS 3 1HD LYS 3 16.296 0.512 5.555
29 HE2 LYS 3 2HE LYS 3 14.225 -0.792 5.202
30 HE3 LYS 3 1HE LYS 3 14.938 -1.515 3.768
31 HZ1 LYS 3 1HZ LYS 3 15.144 -2.973 5.674
32 HZ2 LYS 3 2HZ LYS 3 15.982 -1.792 6.532
33 HZ3 LYS 3 3HZ LYS 3 16.660 -2.464 5.137
34 H SER 4 H SER 4 12.330 0.614 1.010
35 HA SER 4 HA SER 4 10.908 1.867 3.180
36 HB2 SER 4 2HB SER 4 9.818 1.607 0.356
37 HB3 SER 4 1HB SER 4 8.920 2.192 1.755
38 HG SER 4 HG SER 4 11.081 3.604 1.707
39 H CYS 5 H CYS 5 10.940 0.050 4.341
40 HA CYS 5 HA CYS 5 9.747 -2.326 3.143
41 HB2 CYS 5 2HB CYS 5 12.145 -2.278 4.973
42 HB3 CYS 5 1HB CYS 5 11.330 -3.714 4.376
43 H CYS 6 H CYS 6 8.280 -3.224 4.306
44 HA CYS 6 HA CYS 6 7.886 -2.477 7.096
45 HB2 CYS 6 2HB CYS 6 6.070 -3.381 4.911
46 HB3 CYS 6 1HB CYS 6 5.546 -3.214 6.589
47 H LEU 7 H LEU 7 7.550 -4.138 8.491
48 HA LEU 7 HA LEU 7 8.219 -6.818 7.509
49 HB2 LEU 7 2HB LEU 7 8.505 -5.653 10.293
50 HB3 LEU 7 1HB LEU 7 8.831 -7.320 9.891
51 HG LEU 7 HG LEU 7 10.682 -6.504 8.374
52 HD11 LEU 7 1HD1 LEU 7 11.588 -4.260 8.732
53 HD12 LEU 7 2HD1 LEU 7 10.193 -3.864 9.735
54 HD13 LEU 7 3HD1 LEU 7 9.975 -4.216 8.023
55 HD21 LEU 7 1HD2 LEU 7 11.142 -7.402 10.580
56 HD22 LEU 7 2HD2 LEU 7 10.888 -5.808 11.292
57 HD23 LEU 7 3HD2 LEU 7 12.248 -6.078 10.202
58 H LYS 8 H LYS 8 5.771 -4.893 8.729
59 HA LYS 8 HA LYS 8 4.082 -7.227 9.309
60 HB2 LYS 8 2HB LYS 8 4.015 -4.507 10.603
61 HB3 LYS 8 1HB LYS 8 2.868 -5.791 10.940
62 HG2 LYS 8 2HG LYS 8 4.756 -7.146 11.813
63 HG3 LYS 8 1HG LYS 8 5.809 -5.757 11.562
64 HD2 LYS 8 2HD LYS 8 3.373 -5.767 13.362
65 HD3 LYS 8 1HD LYS 8 5.014 -6.058 13.912
66 HE2 LYS 8 2HE LYS 8 4.483 -3.793 14.429
67 HE3 LYS 8 1HE LYS 8 5.603 -3.771 13.075
68 HZ1 LYS 8 1HZ LYS 8 2.654 -3.375 12.886
69 HZ2 LYS 8 2HZ LYS 8 3.728 -3.227 11.595
70 HZ3 LYS 8 3HZ LYS 8 3.800 -2.162 12.869
71 H TYR 9 H TYR 9 1.821 -6.814 8.785
72 HA TYR 9 HA TYR 9 1.456 -4.675 6.806
73 HB2 TYR 9 2HB TYR 9 -0.519 -7.035 7.036
74 HB3 TYR 9 1HB TYR 9 -0.205 -5.913 5.788
75 HD1 TYR 9 1HD TYR 9 1.319 -6.264 4.095
76 HD2 TYR 9 2HD TYR 9 1.172 -8.931 7.378
77 HE1 TYR 9 1HE TYR 9 2.697 -7.873 2.835
78 HE2 TYR 9 2HE TYR 9 2.536 -10.557 6.145
79 HH TYR 9 HH TYR 9 4.143 -9.784 3.220
80 H THR 10 H THR 10 -0.672 -3.544 7.025
81 HA THR 10 HA THR 10 -1.193 -2.972 9.713
82 HB THR 10 HB THR 10 -1.400 -1.208 8.029
83 HG1 THR 10 1HG THR 10 -3.199 -0.280 8.906
84 HG21 THR 10 1HG2 THR 10 -3.317 -1.140 6.481
85 HG22 THR 10 2HG2 THR 10 -3.811 -2.746 7.023
86 HG23 THR 10 3HG2 THR 10 -2.287 -2.534 6.161
87 H LYS 11 H LYS 11 -3.055 -3.228 10.892
88 HA LYS 11 HA LYS 11 -4.524 -5.692 10.326
89 HB2 LYS 11 2HB LYS 11 -3.374 -5.079 12.572
90 HB3 LYS 11 1HB LYS 11 -4.657 -3.917 12.786
91 HG2 LYS 11 2HG LYS 11 -5.072 -6.907 12.556
92 HG3 LYS 11 1HG LYS 11 -4.925 -6.042 14.076
93 HD2 LYS 11 2HD LYS 11 -6.962 -4.763 13.479
94 HD3 LYS 11 1HD LYS 11 -7.093 -5.708 12.000
95 HE2 LYS 11 2HE LYS 11 -7.183 -6.802 14.815
96 HE3 LYS 11 1HE LYS 11 -8.569 -6.581 13.751
97 HZ1 LYS 11 1HZ LYS 11 -7.808 -8.880 13.754
98 HZ2 LYS 11 2HZ LYS 11 -6.276 -8.415 13.289
99 HZ3 LYS 11 3HZ LYS 11 -7.561 -8.227 12.222
100 H ARG 12 H ARG 12 -4.803 -2.291 10.003
101 HA ARG 12 HA ARG 12 -7.709 -2.509 9.892
102 HB2 ARG 12 2HB ARG 12 -6.847 -1.028 11.707
103 HB3 ARG 12 1HB ARG 12 -6.094 -0.022 10.477
104 HG2 ARG 12 2HG ARG 12 -8.173 0.983 11.175
105 HG3 ARG 12 1HG ARG 12 -8.325 0.404 9.511
106 HD2 ARG 12 2HD ARG 12 -9.388 -1.660 10.352
107 HD3 ARG 12 1HD ARG 12 -9.304 -1.004 11.986
108 HE ARG 12 HE ARG 12 -10.637 0.772 10.279
109 HH11 ARG 12 1HH1 ARG 12 -11.036 -2.343 11.883
110 HH12 ARG 12 2HH1 ARG 12 -12.731 -2.280 11.956
111 HH21 ARG 12 1HH2 ARG 12 -12.978 0.894 10.343
112 HH22 ARG 12 2HH2 ARG 12 -13.882 -0.357 11.048
113 HA PRO 13 HA PRO 13 -7.005 -1.835 5.439
114 HB2 PRO 13 2HB PRO 13 -9.951 -1.414 5.666
115 HB3 PRO 13 1HB PRO 13 -9.039 -2.400 4.514
116 HG2 PRO 13 2HG PRO 13 -10.333 -3.573 6.485
117 HG3 PRO 13 1HG PRO 13 -8.699 -4.103 6.044
118 HD2 PRO 13 2HD PRO 13 -9.573 -2.412 8.350
119 HD3 PRO 13 1HD PRO 13 -8.357 -3.713 8.289
120 H LEU 14 H LEU 14 -6.633 0.027 4.419
121 HA LEU 14 HA LEU 14 -7.434 2.554 5.618
122 HB2 LEU 14 2HB LEU 14 -5.041 2.072 4.980
123 HB3 LEU 14 1HB LEU 14 -5.563 1.945 3.322
124 HG LEU 14 HG LEU 14 -6.207 4.314 3.365
125 HD11 LEU 14 1HD1 LEU 14 -5.469 5.707 5.224
126 HD12 LEU 14 2HD1 LEU 14 -4.938 4.271 6.098
127 HD13 LEU 14 3HD1 LEU 14 -6.650 4.518 5.766
128 HD21 LEU 14 1HD2 LEU 14 -3.377 3.699 4.193
129 HD22 LEU 14 2HD2 LEU 14 -3.915 5.153 3.351
130 HD23 LEU 14 3HD2 LEU 14 -4.030 3.580 2.566
131 HA PRO 15 HA PRO 15 -10.497 2.903 2.298
132 HB2 PRO 15 2HB PRO 15 -10.491 5.791 2.817
133 HB3 PRO 15 1HB PRO 15 -11.807 4.627 2.996
134 HG2 PRO 15 2HG PRO 15 -10.616 5.758 5.134
135 HG3 PRO 15 1HG PRO 15 -11.225 4.095 5.161
136 HD2 PRO 15 2HD PRO 15 -8.429 5.084 4.807
137 HD3 PRO 15 1HD PRO 15 -9.033 3.720 5.784
138 H LEU 16 H LEU 16 -10.225 3.230 0.199
139 HA LEU 16 HA LEU 16 -7.792 4.117 -0.895
140 HB2 LEU 16 2HB LEU 16 -9.075 2.474 -2.013
141 HB3 LEU 16 1HB LEU 16 -10.464 3.561 -2.144
142 HG LEU 16 HG LEU 16 -9.075 4.931 -3.663
143 HD11 LEU 16 1HD1 LEU 16 -7.059 3.827 -4.642
144 HD12 LEU 16 2HD1 LEU 16 -7.173 2.626 -3.360
145 HD13 LEU 16 3HD1 LEU 16 -6.874 4.303 -2.950
146 HD21 LEU 16 1HD2 LEU 16 -9.522 2.063 -4.352
147 HD22 LEU 16 2HD2 LEU 16 -9.324 3.408 -5.511
148 HD23 LEU 16 3HD2 LEU 16 -10.692 3.401 -4.389
149 H LYS 17 H LYS 17 -10.788 5.587 -0.320
150 HA LYS 17 HA LYS 17 -10.586 7.903 -1.866
151 HB2 LYS 17 2HB LYS 17 -12.020 7.448 0.742
152 HB3 LYS 17 1HB LYS 17 -12.276 8.838 -0.310
153 HG2 LYS 17 2HG LYS 17 -13.028 7.355 -2.104
154 HG3 LYS 17 1HG LYS 17 -12.768 5.960 -1.065
155 HD2 LYS 17 2HD LYS 17 -14.678 8.218 -0.478
156 HD3 LYS 17 1HD LYS 17 -15.150 6.684 -1.206
157 HE2 LYS 17 2HE LYS 17 -14.388 5.503 0.802
158 HE3 LYS 17 1HE LYS 17 -13.897 7.034 1.523
159 HZ1 LYS 17 1HZ LYS 17 -16.672 6.320 0.753
160 HZ2 LYS 17 2HZ LYS 17 -16.205 7.744 1.527
161 HZ3 LYS 17 3HZ LYS 17 -16.063 6.265 2.314
162 H ARG 18 H ARG 18 -8.647 6.977 0.633
163 HA ARG 18 HA ARG 18 -7.829 9.779 1.275
164 HB2 ARG 18 2HB ARG 18 -7.799 7.419 3.152
165 HB3 ARG 18 1HB ARG 18 -7.155 9.010 3.514
166 HG2 ARG 18 2HG ARG 18 -9.426 9.937 3.279
167 HG3 ARG 18 1HG ARG 18 -10.033 8.302 3.004
168 HD2 ARG 18 2HD ARG 18 -9.169 7.623 5.193
169 HD3 ARG 18 1HD ARG 18 -8.589 9.265 5.465
170 HE ARG 18 HE ARG 18 -11.408 9.028 4.893
171 HH11 ARG 18 1HH1 ARG 18 -8.937 9.206 7.417
172 HH12 ARG 18 2HH1 ARG 18 -10.020 9.649 8.653
173 HH21 ARG 18 1HH2 ARG 18 -12.900 9.654 6.579
174 HH22 ARG 18 2HH2 ARG 18 -12.311 9.916 8.162
175 H ILE 19 H ILE 19 -6.800 7.456 -0.562
176 HA ILE 19 HA ILE 19 -4.063 7.393 0.520
177 HB ILE 19 HB ILE 19 -5.207 5.637 -1.686
178 HG12 ILE 19 2HG1 ILE 19 -4.688 4.905 1.164
179 HG13 ILE 19 1HG1 ILE 19 -6.309 5.294 0.629
180 HG21 ILE 19 1HG2 ILE 19 -2.713 5.425 0.031
181 HG22 ILE 19 2HG2 ILE 19 -2.733 5.841 -1.685
182 HG23 ILE 19 3HG2 ILE 19 -3.232 4.231 -1.146
183 HD11 ILE 19 1HD1 ILE 19 -6.105 3.399 -1.013
184 HD12 ILE 19 2HD1 ILE 19 -6.027 2.903 0.677
185 HD13 ILE 19 3HD1 ILE 19 -4.556 3.042 -0.289
186 H LYS 20 H LYS 20 -2.474 8.405 -0.576
187 HA LYS 20 HA LYS 20 -3.189 9.902 -2.947
188 HB2 LYS 20 2HB LYS 20 -0.582 9.858 -1.406
189 HB3 LYS 20 1HB LYS 20 -0.973 10.953 -2.711
190 HG2 LYS 20 2HG LYS 20 -2.250 10.801 -0.048
191 HG3 LYS 20 1HG LYS 20 -1.198 12.078 -0.669
192 HD2 LYS 20 2HD LYS 20 -3.923 11.305 -1.604
193 HD3 LYS 20 1HD LYS 20 -3.511 12.765 -0.742
194 HE2 LYS 20 2HE LYS 20 -2.532 12.106 -3.534
195 HE3 LYS 20 1HE LYS 20 -3.756 13.296 -3.124
196 HZ1 LYS 20 1HZ LYS 20 -2.052 14.527 -1.871
197 HZ2 LYS 20 2HZ LYS 20 -1.652 14.342 -3.495
198 HZ3 LYS 20 3HZ LYS 20 -0.894 13.399 -2.352
199 H SER 21 H SER 21 -0.850 7.407 -1.944
200 HA SER 21 HA SER 21 -0.627 6.231 -4.493
201 HB2 SER 21 2HB SER 21 1.703 7.991 -3.619
202 HB3 SER 21 1HB SER 21 1.800 6.792 -4.897
203 HG SER 21 HG SER 21 -0.288 8.491 -5.228
204 H TYR 22 H TYR 22 1.318 4.660 -4.416
205 HA TYR 22 HA TYR 22 1.947 3.873 -1.647
206 HB2 TYR 22 2HB TYR 22 1.596 1.543 -2.182
207 HB3 TYR 22 1HB TYR 22 0.108 2.444 -2.400
208 HD1 TYR 22 1HD TYR 22 -1.033 2.289 -4.396
209 HD2 TYR 22 2HD TYR 22 2.975 0.950 -4.278
210 HE1 TYR 22 1HE TYR 22 -1.290 1.308 -6.627
211 HE2 TYR 22 2HE TYR 22 2.737 -0.023 -6.514
212 HH TYR 22 HH TYR 22 0.147 0.668 -8.543
213 H THR 23 H THR 23 3.622 2.243 -1.590
214 HA THR 23 HA THR 23 5.657 2.673 -3.659
215 HB THR 23 HB THR 23 5.962 2.190 -0.693
216 HG1 THR 23 1HG THR 23 6.386 4.418 -2.375
217 HG21 THR 23 1HG2 THR 23 7.720 1.061 -1.953
218 HG22 THR 23 2HG2 THR 23 8.386 2.430 -1.054
219 HG23 THR 23 3HG2 THR 23 8.116 2.552 -2.800
220 H ILE 24 H ILE 24 6.601 0.832 -4.484
221 HA ILE 24 HA ILE 24 5.222 -1.646 -3.910
222 HB ILE 24 HB ILE 24 7.376 -1.077 -5.974
223 HG12 ILE 24 2HG1 ILE 24 4.381 -1.191 -6.325
224 HG13 ILE 24 1HG1 ILE 24 5.311 0.304 -6.275
225 HG21 ILE 24 1HG2 ILE 24 5.414 -3.366 -5.717
226 HG22 ILE 24 2HG2 ILE 24 7.151 -3.449 -5.419
227 HG23 ILE 24 3HG2 ILE 24 6.545 -3.132 -7.046
228 HD11 ILE 24 1HD1 ILE 24 5.556 -1.880 -8.339
229 HD12 ILE 24 2HD1 ILE 24 6.494 -0.388 -8.305
230 HD13 ILE 24 3HD1 ILE 24 4.749 -0.326 -8.556
231 H GLN 25 H GLN 25 5.992 -2.716 -2.189
232 HA GLN 25 HA GLN 25 8.867 -2.826 -1.779
233 HB2 GLN 25 2HB GLN 25 7.746 -2.293 0.220
234 HB3 GLN 25 1HB GLN 25 6.545 -3.545 0.047
235 HG2 GLN 25 2HG GLN 25 8.286 -5.223 0.372
236 HG3 GLN 25 1HG GLN 25 9.459 -3.926 0.592
237 HE21 GLN 25 1HE2 GLN 25 8.480 -6.032 2.381
238 HE22 GLN 25 2HE2 GLN 25 7.991 -5.230 3.821
239 H SER 26 H SER 26 9.938 -4.401 -2.584
240 HA SER 26 HA SER 26 8.560 -6.859 -3.255
241 HB2 SER 26 2HB SER 26 9.793 -5.711 -5.059
242 HB3 SER 26 1HB SER 26 11.269 -5.804 -4.103
243 HG SER 26 HG SER 26 9.761 -8.041 -4.965
244 H ASN 27 H ASN 27 9.344 -8.846 -2.467
245 HA ASN 27 HA ASN 27 10.707 -8.626 0.058
246 HB2 ASN 27 2HB ASN 27 10.292 -11.006 0.397
247 HB3 ASN 27 1HB ASN 27 8.823 -10.226 -0.162
248 HD21 ASN 27 1HD2 ASN 27 8.022 -10.753 -2.223
249 HD22 ASN 27 2HD2 ASN 27 8.647 -12.110 -3.079
250 H GLU 28 H GLU 28 11.829 -8.637 -2.939
251 HA GLU 28 HA GLU 28 14.098 -10.326 -2.720
252 HB2 GLU 28 2HB GLU 28 13.738 -7.829 -4.382
253 HB3 GLU 28 1HB GLU 28 14.952 -9.073 -4.631
254 HG2 GLU 28 2HG GLU 28 11.974 -9.379 -4.965
255 HG3 GLU 28 1HG GLU 28 13.169 -9.277 -6.252
256 H ALA 29 H ALA 29 13.406 -6.944 -2.012
257 HA ALA 29 HA ALA 29 16.118 -6.598 -0.917
258 HB1 ALA 29 1HB ALA 29 15.713 -4.197 -1.087
259 HB2 ALA 29 2HB ALA 29 14.073 -4.509 -1.654
260 HB3 ALA 29 3HB ALA 29 15.452 -4.994 -2.639
261 H CYS 30 H CYS 30 12.749 -6.584 -0.066
262 HA CYS 30 HA CYS 30 13.428 -5.828 2.690
263 HB2 CYS 30 2HB CYS 30 10.748 -5.928 1.316
264 HB3 CYS 30 1HB CYS 30 11.076 -5.322 2.934
265 H ASN 31 H ASN 31 12.211 -7.080 4.332
266 HA ASN 31 HA ASN 31 12.709 -9.814 3.979
267 HB2 ASN 31 2HB ASN 31 11.044 -8.451 6.106
268 HB3 ASN 31 1HB ASN 31 11.504 -10.148 6.138
269 HD21 ASN 31 1HD2 ASN 31 12.142 -8.013 8.016
270 HD22 ASN 31 2HD2 ASN 31 13.859 -7.927 8.085
271 H ILE 32 H ILE 32 9.748 -7.984 3.602
272 HA ILE 32 HA ILE 32 8.508 -10.399 2.458
273 HB ILE 32 HB ILE 32 6.340 -9.843 3.457
274 HG12 ILE 32 2HG1 ILE 32 7.813 -7.624 4.902
275 HG13 ILE 32 1HG1 ILE 32 6.659 -7.398 3.594
276 HG21 ILE 32 1HG2 ILE 32 8.559 -9.939 5.441
277 HG22 ILE 32 2HG2 ILE 32 7.785 -11.341 4.704
278 HG23 ILE 32 3HG2 ILE 32 6.870 -10.297 5.820
279 HD11 ILE 32 1HD1 ILE 32 6.057 -8.568 6.301
280 HD12 ILE 32 2HD1 ILE 32 4.895 -8.329 4.995
281 HD13 ILE 32 3HD1 ILE 32 5.663 -6.938 5.758
282 H LYS 33 H LYS 33 6.387 -9.657 1.315
283 HA LYS 33 HA LYS 33 6.939 -7.223 -0.191
284 HB2 LYS 33 2HB LYS 33 6.591 -9.286 -1.517
285 HB3 LYS 33 1HB LYS 33 5.037 -9.533 -0.735
286 HG2 LYS 33 2HG LYS 33 4.224 -7.436 -1.748
287 HG3 LYS 33 1HG LYS 33 5.775 -7.247 -2.550
288 HD2 LYS 33 2HD LYS 33 5.424 -9.335 -3.768
289 HD3 LYS 33 1HD LYS 33 3.881 -9.567 -2.940
290 HE2 LYS 33 2HE LYS 33 3.012 -7.533 -3.936
291 HE3 LYS 33 1HE LYS 33 4.562 -7.216 -4.704
292 HZ1 LYS 33 1HZ LYS 33 2.720 -9.476 -5.281
293 HZ2 LYS 33 2HZ LYS 33 4.244 -9.304 -5.980
294 HZ3 LYS 33 3HZ LYS 33 3.031 -8.171 -6.276
295 H ALA 34 H ALA 34 6.001 -5.518 0.838
296 HA ALA 34 HA ALA 34 3.197 -5.741 1.607
297 HB1 ALA 34 1HB ALA 34 4.493 -6.006 3.687
298 HB2 ALA 34 2HB ALA 34 3.652 -4.458 3.669
299 HB3 ALA 34 3HB ALA 34 5.374 -4.525 3.320
300 H ILE 35 H ILE 35 2.297 -4.336 0.231
301 HA ILE 35 HA ILE 35 3.722 -2.186 -0.961
302 HB ILE 35 HB ILE 35 0.726 -2.603 -0.761
303 HG12 ILE 35 2HG1 ILE 35 1.872 -4.500 -1.774
304 HG13 ILE 35 1HG1 ILE 35 0.902 -3.643 -2.972
305 HG21 ILE 35 1HG2 ILE 35 0.601 -1.148 -2.784
306 HG22 ILE 35 2HG2 ILE 35 2.326 -0.858 -2.653
307 HG23 ILE 35 3HG2 ILE 35 1.248 -0.305 -1.386
308 HD11 ILE 35 1HD1 ILE 35 2.985 -4.341 -3.903
309 HD12 ILE 35 2HD1 ILE 35 3.901 -3.515 -2.631
310 HD13 ILE 35 3HD1 ILE 35 2.972 -2.578 -3.807
311 H ILE 36 H ILE 36 3.986 -0.073 -0.294
312 HA ILE 36 HA ILE 36 2.860 0.473 2.339
313 HB ILE 36 HB ILE 36 5.085 2.023 0.969
314 HG12 ILE 36 2HG1 ILE 36 6.539 0.981 2.855
315 HG13 ILE 36 1HG1 ILE 36 5.256 -0.216 2.976
316 HG21 ILE 36 1HG2 ILE 36 3.892 3.369 2.540
317 HG22 ILE 36 2HG2 ILE 36 5.522 2.974 3.122
318 HG23 ILE 36 3HG2 ILE 36 4.122 2.128 3.790
319 HD11 ILE 36 1HD1 ILE 36 5.626 -0.819 0.676
320 HD12 ILE 36 2HD1 ILE 36 7.097 -0.955 1.663
321 HD13 ILE 36 3HD1 ILE 36 6.876 0.430 0.573
322 H PHE 37 H PHE 37 1.128 1.499 2.299
323 HA PHE 37 HA PHE 37 0.268 3.233 0.137
324 HB2 PHE 37 2HB PHE 37 -0.932 2.107 2.636
325 HB3 PHE 37 1HB PHE 37 -1.738 3.408 1.757
326 HD1 PHE 37 1HD PHE 37 0.116 0.614 0.260
327 HD2 PHE 37 2HD PHE 37 -3.640 2.239 1.183
328 HE1 PHE 37 1HE PHE 37 -0.996 -1.080 -1.221
329 HE2 PHE 37 2HE PHE 37 -4.742 0.593 -0.257
330 HZ PHE 37 HZ PHE 37 -3.420 -1.056 -1.454
331 H THR 38 H THR 38 0.045 5.332 0.287
332 HA THR 38 HA THR 38 0.772 6.547 2.840
333 HB THR 38 HB THR 38 1.436 7.619 0.078
334 HG1 THR 38 1HG THR 38 2.560 5.757 1.471
335 HG21 THR 38 1HG2 THR 38 1.059 9.353 1.721
336 HG22 THR 38 2HG2 THR 38 2.797 9.253 1.371
337 HG23 THR 38 3HG2 THR 38 2.126 8.551 2.859
338 H THR 39 H THR 39 -0.681 8.007 3.610
339 HA THR 39 HA THR 39 -3.135 8.225 2.135
340 HB THR 39 HB THR 39 -3.890 9.494 4.198
341 HG1 THR 39 1HG THR 39 -2.481 8.862 6.045
342 HG21 THR 39 1HG2 THR 39 -4.445 7.170 3.862
343 HG22 THR 39 2HG2 THR 39 -4.091 7.466 5.564
344 HG23 THR 39 3HG2 THR 39 -2.890 6.680 4.536
345 H LYS 40 H LYS 40 -4.263 10.463 2.436
346 HA LYS 40 HA LYS 40 -2.721 12.385 1.043
347 HB2 LYS 40 2HB LYS 40 -5.228 12.860 2.607
348 HB3 LYS 40 1HB LYS 40 -4.681 13.806 1.229
349 HG2 LYS 40 2HG LYS 40 -5.008 11.480 -0.099
350 HG3 LYS 40 1HG LYS 40 -5.923 11.098 1.312
351 HD2 LYS 40 2HD LYS 40 -7.477 12.863 0.972
352 HD3 LYS 40 1HD LYS 40 -6.462 13.524 -0.323
353 HE2 LYS 40 2HE LYS 40 -6.843 11.595 -1.688
354 HE3 LYS 40 1HE LYS 40 -7.753 10.805 -0.411
355 HZ1 LYS 40 1HZ LYS 40 -9.395 12.567 -0.572
356 HZ2 LYS 40 2HZ LYS 40 -9.203 11.736 -2.042
357 HZ3 LYS 40 3HZ LYS 40 -8.537 13.283 -1.838
358 H LYS 41 H LYS 41 -3.162 11.610 4.315
359 HA LYS 41 HA LYS 41 -2.059 14.067 5.345
360 HB2 LYS 41 2HB LYS 41 -2.437 11.356 6.622
361 HB3 LYS 41 1HB LYS 41 -1.895 12.762 7.489
362 HG2 LYS 41 2HG LYS 41 -4.449 12.334 6.140
363 HG3 LYS 41 1HG LYS 41 -4.225 12.390 7.889
364 HD2 LYS 41 2HD LYS 41 -3.510 14.778 7.652
365 HD3 LYS 41 1HD LYS 41 -3.868 14.686 5.929
366 HE2 LYS 41 2HE LYS 41 -6.209 14.160 6.469
367 HE3 LYS 41 1HE LYS 41 -5.819 14.318 8.181
368 HZ1 LYS 41 1HZ LYS 41 -5.196 16.646 7.750
369 HZ2 LYS 41 2HZ LYS 41 -6.792 16.341 7.394
370 HZ3 LYS 41 3HZ LYS 41 -5.683 16.475 6.141
371 H GLY 42 H GLY 42 -0.936 11.389 3.775
372 HA2 GLY 42 2HA GLY 42 1.146 11.023 2.972
373 HA3 GLY 42 1HA GLY 42 1.739 12.316 3.981
374 H ARG 43 H ARG 43 -0.070 10.007 5.713
375 HA ARG 43 HA ARG 43 2.146 9.054 7.164
376 HB2 ARG 43 2HB ARG 43 -0.118 9.353 8.077
377 HB3 ARG 43 1HB ARG 43 -0.683 8.143 6.923
378 HG2 ARG 43 2HG ARG 43 0.596 6.461 7.955
379 HG3 ARG 43 1HG ARG 43 1.308 7.629 9.079
380 HD2 ARG 43 2HD ARG 43 -0.876 8.022 10.091
381 HD3 ARG 43 1HD ARG 43 -1.633 6.934 8.925
382 HE ARG 43 HE ARG 43 0.113 5.307 10.037
383 HH11 ARG 43 1HH1 ARG 43 -2.086 7.572 11.634
384 HH12 ARG 43 2HH1 ARG 43 -2.263 6.585 13.024
385 HH21 ARG 43 1HH2 ARG 43 -0.154 3.994 11.959
386 HH22 ARG 43 2HH2 ARG 43 -1.154 4.573 13.209
387 H LYS 44 H LYS 44 3.021 6.910 7.124
388 HA LYS 44 HA LYS 44 2.663 5.491 4.593
389 HB2 LYS 44 2HB LYS 44 4.752 5.162 6.761
390 HB3 LYS 44 1HB LYS 44 4.722 4.284 5.236
391 HG2 LYS 44 2HG LYS 44 5.003 7.268 5.513
392 HG3 LYS 44 1HG LYS 44 6.331 6.141 5.220
393 HD2 LYS 44 2HD LYS 44 5.356 5.509 3.096
394 HD3 LYS 44 1HD LYS 44 3.941 6.514 3.412
395 HE2 LYS 44 2HE LYS 44 5.328 8.500 3.406
396 HE3 LYS 44 1HE LYS 44 6.766 7.516 3.148
397 HZ1 LYS 44 1HZ LYS 44 4.475 7.670 1.251
398 HZ2 LYS 44 2HZ LYS 44 5.943 6.864 1.020
399 HZ3 LYS 44 3HZ LYS 44 5.924 8.536 1.124
400 H ILE 45 H ILE 45 1.473 3.765 4.489
401 HA ILE 45 HA ILE 45 0.782 2.297 6.948
402 HB ILE 45 HB ILE 45 -0.882 2.656 4.431
403 HG12 ILE 45 2HG1 ILE 45 -2.577 3.754 6.070
404 HG13 ILE 45 1HG1 ILE 45 -1.215 3.863 7.178
405 HG21 ILE 45 1HG2 ILE 45 -1.585 1.127 6.921
406 HG22 ILE 45 2HG2 ILE 45 -1.261 0.464 5.321
407 HG23 ILE 45 3HG2 ILE 45 -2.685 1.466 5.591
408 HD11 ILE 45 1HD1 ILE 45 -1.606 5.933 6.047
409 HD12 ILE 45 2HD1 ILE 45 -1.382 5.143 4.483
410 HD13 ILE 45 3HD1 ILE 45 -0.037 5.258 5.616
411 H CYS 46 H CYS 46 1.465 0.241 6.921
412 HA CYS 46 HA CYS 46 2.565 -0.897 4.470
413 HB2 CYS 46 2HB CYS 46 2.428 -1.977 7.283
414 HB3 CYS 46 1HB CYS 46 3.390 -2.665 5.988
415 H ALA 47 H ALA 47 1.190 -1.998 3.143
416 HA ALA 47 HA ALA 47 -1.100 -3.253 4.483
417 HB1 ALA 47 1HB ALA 47 -1.016 -2.082 1.714
418 HB2 ALA 47 2HB ALA 47 -1.711 -1.304 3.133
419 HB3 ALA 47 3HB ALA 47 -2.414 -2.798 2.515
420 H ASN 48 H ASN 48 -1.728 -5.265 3.933
421 HA ASN 48 HA ASN 48 0.155 -6.963 2.702
422 HB2 ASN 48 2HB ASN 48 -1.029 -7.822 4.528
423 HB3 ASN 48 1HB ASN 48 -2.594 -7.360 3.923
424 HD21 ASN 48 1HD2 ASN 48 -0.014 -8.941 2.213
425 HD22 ASN 48 2HD2 ASN 48 -0.856 -10.415 1.865
426 HA PRO 49 HA PRO 49 -1.312 -5.991 -1.448
427 HB2 PRO 49 2HB PRO 49 0.319 -7.781 -2.685
428 HB3 PRO 49 1HB PRO 49 0.793 -6.135 -2.280
429 HG2 PRO 49 2HG PRO 49 1.396 -8.684 -0.847
430 HG3 PRO 49 1HG PRO 49 2.412 -7.247 -1.069
431 HD2 PRO 49 2HD PRO 49 1.183 -7.771 1.243
432 HD3 PRO 49 1HD PRO 49 1.411 -6.111 0.665
433 H ASN 50 H ASN 50 -1.160 -9.196 0.016
434 HA ASN 50 HA ASN 50 -2.563 -10.419 -1.957
435 HB2 ASN 50 2HB ASN 50 -2.388 -11.206 0.934
436 HB3 ASN 50 1HB ASN 50 -2.786 -12.231 -0.456
437 HD21 ASN 50 1HD2 ASN 50 -1.203 -12.324 -2.030
438 HD22 ASN 50 2HD2 ASN 50 0.478 -12.453 -1.673
439 H GLU 51 H GLU 51 -3.569 -8.112 0.357
440 HA GLU 51 HA GLU 51 -6.215 -9.160 0.730
441 HB2 GLU 51 2HB GLU 51 -5.226 -6.385 1.369
442 HB3 GLU 51 1HB GLU 51 -6.741 -7.084 1.891
443 HG2 GLU 51 2HG GLU 51 -5.105 -8.881 2.975
444 HG3 GLU 51 1HG GLU 51 -3.993 -7.551 2.799
445 H LYS 52 H LYS 52 -7.977 -8.716 -0.305
446 HA LYS 52 HA LYS 52 -7.989 -7.923 -2.941
447 HB2 LYS 52 2HB LYS 52 -9.741 -9.278 -1.956
448 HB3 LYS 52 1HB LYS 52 -10.248 -7.941 -0.942
449 HG2 LYS 52 2HG LYS 52 -10.894 -6.691 -2.961
450 HG3 LYS 52 1HG LYS 52 -10.442 -8.089 -3.942
451 HD2 LYS 52 2HD LYS 52 -12.065 -9.452 -2.774
452 HD3 LYS 52 1HD LYS 52 -12.493 -8.088 -1.747
453 HE2 LYS 52 2HE LYS 52 -13.255 -6.853 -3.731
454 HE3 LYS 52 1HE LYS 52 -12.857 -8.246 -4.736
455 HZ1 LYS 52 1HZ LYS 52 -14.859 -8.206 -2.547
456 HZ2 LYS 52 2HZ LYS 52 -14.494 -9.548 -3.497
457 HZ3 LYS 52 3HZ LYS 52 -15.208 -8.195 -4.180
458 H TRP 53 H TRP 53 -8.632 -5.962 -0.048
459 HA TRP 53 HA TRP 53 -9.550 -3.729 -1.499
460 HB2 TRP 53 2HB TRP 53 -9.362 -2.391 0.505
461 HB3 TRP 53 1HB TRP 53 -9.991 -3.963 0.945
462 HD1 TRP 53 HD TRP 53 -8.308 -5.557 2.459
463 HE1 TRP 53 1HE TRP 53 -6.333 -4.945 3.961
464 HE3 TRP 53 3HE TRP 53 -7.423 -0.802 0.795
465 HZ2 TRP 53 2HZ TRP 53 -4.638 -2.781 4.420
466 HZ3 TRP 53 3HZ TRP 53 -5.588 0.464 1.837
467 HH2 TRP 53 HH TRP 53 -4.232 -0.503 3.608
468 H VAL 54 H VAL 54 -6.373 -4.757 -0.568
469 HA VAL 54 HA VAL 54 -4.987 -2.385 -1.282
470 HB VAL 54 HB VAL 54 -4.001 -5.244 -0.979
471 HG11 VAL 54 1HG1 VAL 54 -2.408 -2.693 -1.190
472 HG12 VAL 54 2HG1 VAL 54 -2.434 -3.999 -2.374
473 HG13 VAL 54 3HG1 VAL 54 -1.755 -4.250 -0.749
474 HG21 VAL 54 1HG2 VAL 54 -3.854 -2.882 0.867
475 HG22 VAL 54 2HG2 VAL 54 -3.168 -4.477 1.171
476 HG23 VAL 54 3HG2 VAL 54 -4.919 -4.271 1.048
477 H GLN 55 H GLN 55 -5.769 -5.381 -2.889
478 HA GLN 55 HA GLN 55 -4.287 -4.898 -5.214
479 HB2 GLN 55 2HB GLN 55 -6.697 -6.652 -4.842
480 HB3 GLN 55 1HB GLN 55 -5.580 -6.724 -6.210
481 HG2 GLN 55 2HG GLN 55 -3.747 -7.053 -4.564
482 HG3 GLN 55 1HG GLN 55 -4.981 -7.241 -3.331
483 HE21 GLN 55 1HE2 GLN 55 -2.990 -8.968 -4.159
484 HE22 GLN 55 2HE2 GLN 55 -3.676 -10.415 -4.748
485 H LYS 56 H LYS 56 -7.553 -4.047 -4.241
486 HA LYS 56 HA LYS 56 -8.450 -3.037 -6.727
487 HB2 LYS 56 2HB LYS 56 -9.968 -3.651 -4.841
488 HB3 LYS 56 1HB LYS 56 -9.282 -2.338 -3.909
489 HG2 LYS 56 2HG LYS 56 -10.068 -0.731 -5.525
490 HG3 LYS 56 1HG LYS 56 -10.772 -2.038 -6.483
491 HD2 LYS 56 2HD LYS 56 -12.239 -2.616 -4.627
492 HD3 LYS 56 1HD LYS 56 -11.531 -1.325 -3.647
493 HE2 LYS 56 2HE LYS 56 -12.313 0.330 -5.280
494 HE3 LYS 56 1HE LYS 56 -13.031 -0.957 -6.243
495 HZ1 LYS 56 1HZ LYS 56 -14.522 -1.439 -4.372
496 HZ2 LYS 56 2HZ LYS 56 -14.672 0.158 -4.882
497 HZ3 LYS 56 3HZ LYS 56 -13.829 -0.186 -3.482
498 H ALA 57 H ALA 57 -7.023 -1.633 -3.805
499 HA ALA 57 HA ALA 57 -7.051 1.039 -4.565
500 HB1 ALA 57 1HB ALA 57 -5.353 1.379 -2.848
501 HB2 ALA 57 2HB ALA 57 -5.054 -0.345 -2.767
502 HB3 ALA 57 3HB ALA 57 -6.621 0.297 -2.265
503 H MET 58 H MET 58 -4.503 -1.380 -4.930
504 HA MET 58 HA MET 58 -2.684 0.313 -6.061
505 HB2 MET 58 2HB MET 58 -2.906 -2.665 -6.356
506 HB3 MET 58 1HB MET 58 -1.572 -1.752 -7.036
507 HG2 MET 58 2HG MET 58 -1.116 -0.904 -4.715
508 HG3 MET 58 1HG MET 58 -2.305 -2.073 -4.141
509 HE1 MET 58 1HE MET 58 -0.552 -5.450 -5.132
510 HE2 MET 58 2HE MET 58 -1.765 -4.590 -6.085
511 HE3 MET 58 3HE MET 58 -1.962 -4.747 -4.334
512 H LYS 59 H LYS 59 -5.255 -1.521 -7.618
513 HA LYS 59 HA LYS 59 -4.345 -1.093 -10.226
514 HB2 LYS 59 2HB LYS 59 -5.846 -2.923 -9.542
515 HB3 LYS 59 1HB LYS 59 -7.084 -1.743 -9.143
516 HG2 LYS 59 2HG LYS 59 -7.326 -1.133 -11.431
517 HG3 LYS 59 1HG LYS 59 -5.949 -2.137 -11.902
518 HD2 LYS 59 2HD LYS 59 -8.032 -3.268 -12.434
519 HD3 LYS 59 1HD LYS 59 -7.188 -4.131 -11.155
520 HE2 LYS 59 2HE LYS 59 -8.668 -3.060 -9.493
521 HE3 LYS 59 1HE LYS 59 -9.502 -2.232 -10.809
522 HZ1 LYS 59 1HZ LYS 59 -10.717 -4.205 -10.146
523 HZ2 LYS 59 2HZ LYS 59 -9.349 -5.154 -10.405
524 HZ3 LYS 59 3HZ LYS 59 -10.109 -4.412 -11.702
525 H HIS 60 H HIS 60 -6.517 0.631 -8.026
526 HA HIS 60 HA HIS 60 -7.340 2.529 -9.965
527 HB2 HIS 60 2HB HIS 60 -8.774 2.011 -8.103
528 HB3 HIS 60 1HB HIS 60 -7.516 2.428 -6.956
529 HD1 HIS 60 1HD HIS 60 -9.850 4.070 -9.449
530 HD2 HIS 60 2HD HIS 60 -7.528 4.973 -6.167
531 HE1 HIS 60 1HE HIS 60 -10.451 6.445 -8.864
532 HE2 HIS 60 2HE HIS 60 -8.775 7.059 -7.096
533 H LEU 61 H LEU 61 -4.815 2.429 -7.516
534 HA LEU 61 HA LEU 61 -4.044 5.164 -7.834
535 HB2 LEU 61 2HB LEU 61 -2.694 2.841 -6.495
536 HB3 LEU 61 1HB LEU 61 -2.049 4.470 -6.476
537 HG LEU 61 HG LEU 61 -4.756 3.726 -5.351
538 HD11 LEU 61 1HD1 LEU 61 -2.117 4.125 -3.946
539 HD12 LEU 61 2HD1 LEU 61 -3.006 2.599 -4.104
540 HD13 LEU 61 3HD1 LEU 61 -3.687 3.924 -3.170
541 HD21 LEU 61 1HD2 LEU 61 -3.028 6.171 -5.065
542 HD22 LEU 61 2HD2 LEU 61 -4.567 5.905 -4.251
543 HD23 LEU 61 3HD2 LEU 61 -4.514 6.077 -6.011
544 H ASP 62 H ASP 62 -3.150 2.213 -9.426
545 HA ASP 62 HA ASP 62 -0.701 3.206 -10.524
546 HB2 ASP 62 2HB ASP 62 -1.187 0.769 -10.331
547 HB3 ASP 62 1HB ASP 62 -2.466 0.946 -11.521
548 H LYS 63 H LYS 63 -3.985 3.679 -11.207
549 HA LYS 63 HA LYS 63 -3.557 4.523 -13.934
550 HB2 LYS 63 2HB LYS 63 -6.097 4.493 -12.300
551 HB3 LYS 63 1HB LYS 63 -5.981 4.750 -14.035
552 HG2 LYS 63 2HG LYS 63 -5.117 2.479 -14.308
553 HG3 LYS 63 1HG LYS 63 -5.238 2.233 -12.570
554 HD2 LYS 63 2HD LYS 63 -7.677 2.671 -12.742
555 HD3 LYS 63 1HD LYS 63 -7.495 2.743 -14.496
556 HE2 LYS 63 2HE LYS 63 -6.540 0.439 -14.425
557 HE3 LYS 63 1HE LYS 63 -6.897 0.406 -12.699
558 HZ1 LYS 63 1HZ LYS 63 -8.642 -0.676 -13.973
559 HZ2 LYS 63 2HZ LYS 63 -8.897 0.718 -14.875
560 HZ3 LYS 63 3HZ LYS 63 -9.254 0.711 -13.228
561 H LYS 64 H LYS 64 -2.973 5.838 -11.072
562 HA LYS 64 HA LYS 64 -4.202 8.432 -11.563
563 HB2 LYS 64 2HB LYS 64 -4.433 7.391 -9.302
564 HB3 LYS 64 1HB LYS 64 -2.685 7.425 -9.149
565 HG2 LYS 64 2HG LYS 64 -2.752 9.884 -9.351
566 HG3 LYS 64 1HG LYS 64 -4.507 9.794 -9.393
567 HD2 LYS 64 2HD LYS 64 -4.536 8.779 -7.184
568 HD3 LYS 64 1HD LYS 64 -2.773 8.812 -7.128
569 HE2 LYS 64 2HE LYS 64 -4.607 11.201 -7.296
570 HE3 LYS 64 1HE LYS 64 -3.694 10.680 -5.880
571 HZ1 LYS 64 1HZ LYS 64 -1.630 11.113 -7.148
572 HZ2 LYS 64 2HZ LYS 64 -2.588 12.487 -7.016
573 HZ3 LYS 64 3HZ LYS 64 -2.550 11.633 -8.451
Start of MODEL 8
1 H1 ALA 1 1HT ALA 1 17.086 5.972 11.752
2 H2 ALA 1 2HT ALA 1 18.100 6.414 10.485
3 H3 ALA 1 3HT ALA 1 18.680 5.413 11.712
4 HA ALA 1 HA ALA 1 18.197 4.195 9.701
5 HB1 ALA 1 1HB ALA 1 17.896 3.044 11.851
6 HB2 ALA 1 2HB ALA 1 16.719 2.491 10.659
7 HB3 ALA 1 3HB ALA 1 16.228 3.614 11.923
8 H ARG 2 H ARG 2 16.776 3.737 8.030
9 HA ARG 2 HA ARG 2 14.534 5.619 7.855
10 HB2 ARG 2 2HB ARG 2 16.287 5.952 6.166
11 HB3 ARG 2 1HB ARG 2 16.111 4.282 5.646
12 HG2 ARG 2 2HG ARG 2 13.795 4.759 4.961
13 HG3 ARG 2 1HG ARG 2 14.021 6.434 5.461
14 HD2 ARG 2 2HD ARG 2 15.571 5.012 3.312
15 HD3 ARG 2 1HD ARG 2 14.258 6.158 3.056
16 HE ARG 2 HE ARG 2 16.560 7.065 4.579
17 HH11 ARG 2 1HH1 ARG 2 14.759 7.128 1.525
18 HH12 ARG 2 2HH1 ARG 2 15.657 8.428 0.897
19 HH21 ARG 2 1HH2 ARG 2 17.785 8.863 3.662
20 HH22 ARG 2 2HH2 ARG 2 17.371 9.397 2.102
21 H LYS 3 H LYS 3 12.530 4.880 7.178
22 HA LYS 3 HA LYS 3 12.330 1.990 7.015
23 HB2 LYS 3 2HB LYS 3 11.224 2.832 9.023
24 HB3 LYS 3 1HB LYS 3 10.259 3.920 8.051
25 HG2 LYS 3 2HG LYS 3 9.090 2.093 7.032
26 HG3 LYS 3 1HG LYS 3 10.155 0.924 7.799
27 HD2 LYS 3 2HD LYS 3 8.438 2.822 9.397
28 HD3 LYS 3 1HD LYS 3 7.838 1.265 8.842
29 HE2 LYS 3 2HE LYS 3 8.623 1.156 11.166
30 HE3 LYS 3 1HE LYS 3 9.580 0.121 10.119
31 HZ1 LYS 3 1HZ LYS 3 10.427 2.824 11.061
32 HZ2 LYS 3 2HZ LYS 3 11.397 1.689 10.244
33 HZ3 LYS 3 3HZ LYS 3 10.842 1.378 11.781
34 H SER 4 H SER 4 12.619 1.828 4.883
35 HA SER 4 HA SER 4 10.538 3.008 3.224
36 HB2 SER 4 2HB SER 4 12.134 2.440 1.346
37 HB3 SER 4 1HB SER 4 12.715 3.678 2.464
38 HG SER 4 HG SER 4 14.179 1.934 1.824
39 H CYS 5 H CYS 5 11.163 0.372 4.919
40 HA CYS 5 HA CYS 5 9.625 -1.342 3.133
41 HB2 CYS 5 2HB CYS 5 12.051 -2.193 4.729
42 HB3 CYS 5 1HB CYS 5 10.979 -3.270 3.851
43 H CYS 6 H CYS 6 8.335 -2.858 4.284
44 HA CYS 6 HA CYS 6 7.894 -2.238 7.113
45 HB2 CYS 6 2HB CYS 6 6.116 -3.171 4.910
46 HB3 CYS 6 1HB CYS 6 5.610 -3.067 6.595
47 H LEU 7 H LEU 7 7.455 -3.988 8.491
48 HA LEU 7 HA LEU 7 8.109 -6.652 7.420
49 HB2 LEU 7 2HB LEU 7 8.505 -5.646 10.257
50 HB3 LEU 7 1HB LEU 7 8.819 -7.273 9.718
51 HG LEU 7 HG LEU 7 10.606 -6.278 8.198
52 HD11 LEU 7 1HD1 LEU 7 11.535 -4.125 8.841
53 HD12 LEU 7 2HD1 LEU 7 10.189 -3.869 9.948
54 HD13 LEU 7 3HD1 LEU 7 9.895 -3.971 8.211
55 HD21 LEU 7 1HD2 LEU 7 11.141 -7.493 10.233
56 HD22 LEU 7 2HD2 LEU 7 10.934 -6.015 11.175
57 HD23 LEU 7 3HD2 LEU 7 12.246 -6.138 10.003
58 H LYS 8 H LYS 8 5.616 -4.812 8.253
59 HA LYS 8 HA LYS 8 4.018 -7.031 9.312
60 HB2 LYS 8 2HB LYS 8 3.984 -4.148 10.229
61 HB3 LYS 8 1HB LYS 8 2.802 -5.360 10.678
62 HG2 LYS 8 2HG LYS 8 4.450 -6.623 11.875
63 HG3 LYS 8 1HG LYS 8 5.740 -5.582 11.281
64 HD2 LYS 8 2HD LYS 8 5.104 -5.055 13.601
65 HD3 LYS 8 1HD LYS 8 4.832 -3.696 12.509
66 HE2 LYS 8 2HE LYS 8 2.463 -4.248 12.423
67 HE3 LYS 8 1HE LYS 8 2.723 -5.626 13.491
68 HZ1 LYS 8 1HZ LYS 8 1.904 -3.696 14.710
69 HZ2 LYS 8 2HZ LYS 8 3.214 -2.774 14.192
70 HZ3 LYS 8 3HZ LYS 8 3.444 -4.086 15.211
71 H TYR 9 H TYR 9 1.687 -6.636 8.947
72 HA TYR 9 HA TYR 9 1.118 -4.827 6.694
73 HB2 TYR 9 2HB TYR 9 -0.432 -7.440 7.049
74 HB3 TYR 9 1HB TYR 9 -0.353 -6.344 5.742
75 HD1 TYR 9 1HD TYR 9 1.280 -6.428 4.075
76 HD2 TYR 9 2HD TYR 9 1.500 -9.047 7.387
77 HE1 TYR 9 1HE TYR 9 2.886 -7.825 2.850
78 HE2 TYR 9 2HE TYR 9 3.130 -10.451 6.181
79 HH TYR 9 HH TYR 9 4.616 -9.391 3.307
80 H THR 10 H THR 10 -0.836 -3.752 6.901
81 HA THR 10 HA THR 10 -1.874 -3.497 9.503
82 HB THR 10 HB THR 10 -1.792 -1.540 8.042
83 HG1 THR 10 1HG THR 10 -4.488 -1.545 8.097
84 HG21 THR 10 1HG2 THR 10 -3.287 -1.309 6.098
85 HG22 THR 10 2HG2 THR 10 -3.862 -2.963 6.351
86 HG23 THR 10 3HG2 THR 10 -2.188 -2.678 5.906
87 H LYS 11 H LYS 11 -3.766 -4.286 10.373
88 HA LYS 11 HA LYS 11 -5.213 -6.181 8.714
89 HB2 LYS 11 2HB LYS 11 -5.092 -5.894 11.719
90 HB3 LYS 11 1HB LYS 11 -6.319 -6.868 10.934
91 HG2 LYS 11 2HG LYS 11 -4.515 -8.296 11.678
92 HG3 LYS 11 1HG LYS 11 -4.557 -8.257 9.921
93 HD2 LYS 11 2HD LYS 11 -2.709 -6.591 9.976
94 HD3 LYS 11 1HD LYS 11 -2.652 -6.774 11.730
95 HE2 LYS 11 2HE LYS 11 -2.175 -8.960 9.697
96 HE3 LYS 11 1HE LYS 11 -0.937 -8.130 10.629
97 HZ1 LYS 11 1HZ LYS 11 -1.469 -10.258 11.587
98 HZ2 LYS 11 2HZ LYS 11 -3.093 -9.850 11.736
99 HZ3 LYS 11 3HZ LYS 11 -1.924 -9.035 12.654
100 H ARG 12 H ARG 12 -5.434 -3.065 9.540
101 HA ARG 12 HA ARG 12 -8.351 -3.095 9.324
102 HB2 ARG 12 2HB ARG 12 -7.509 -1.869 11.295
103 HB3 ARG 12 1HB ARG 12 -6.531 -0.849 10.248
104 HG2 ARG 12 2HG ARG 12 -8.567 -0.003 9.178
105 HG3 ARG 12 1HG ARG 12 -9.532 -1.016 10.244
106 HD2 ARG 12 2HD ARG 12 -8.700 0.225 12.178
107 HD3 ARG 12 1HD ARG 12 -7.704 1.224 11.113
108 HE ARG 12 HE ARG 12 -10.274 1.363 10.160
109 HH11 ARG 12 1HH1 ARG 12 -8.593 2.328 13.120
110 HH12 ARG 12 2HH1 ARG 12 -9.633 3.614 13.473
111 HH21 ARG 12 1HH2 ARG 12 -11.707 3.187 10.632
112 HH22 ARG 12 2HH2 ARG 12 -11.462 4.123 12.023
113 HA PRO 13 HA PRO 13 -7.592 -1.816 5.121
114 HB2 PRO 13 2HB PRO 13 -10.182 -1.272 4.444
115 HB3 PRO 13 1HB PRO 13 -9.524 -2.902 4.528
116 HG2 PRO 13 2HG PRO 13 -11.163 -1.430 6.544
117 HG3 PRO 13 1HG PRO 13 -11.277 -3.126 6.027
118 HD2 PRO 13 2HD PRO 13 -10.065 -2.369 8.325
119 HD3 PRO 13 1HD PRO 13 -9.537 -3.784 7.390
120 H LEU 14 H LEU 14 -7.099 0.110 4.269
121 HA LEU 14 HA LEU 14 -7.719 2.581 5.691
122 HB2 LEU 14 2HB LEU 14 -5.352 1.918 5.023
123 HB3 LEU 14 1HB LEU 14 -5.857 2.036 3.362
124 HG LEU 14 HG LEU 14 -6.260 4.454 3.684
125 HD11 LEU 14 1HD1 LEU 14 -5.352 5.545 5.664
126 HD12 LEU 14 2HD1 LEU 14 -4.981 3.983 6.372
127 HD13 LEU 14 3HD1 LEU 14 -6.664 4.450 6.106
128 HD21 LEU 14 1HD2 LEU 14 -3.508 3.459 4.395
129 HD22 LEU 14 2HD2 LEU 14 -3.898 5.050 3.741
130 HD23 LEU 14 3HD2 LEU 14 -4.171 3.605 2.772
131 HA PRO 15 HA PRO 15 -10.750 3.491 2.464
132 HB2 PRO 15 2HB PRO 15 -10.355 6.325 3.227
133 HB3 PRO 15 1HB PRO 15 -11.834 5.360 3.258
134 HG2 PRO 15 2HG PRO 15 -10.606 6.057 5.529
135 HG3 PRO 15 1HG PRO 15 -11.384 4.478 5.344
136 HD2 PRO 15 2HD PRO 15 -8.480 5.182 5.179
137 HD3 PRO 15 1HD PRO 15 -9.277 3.796 5.964
138 H LEU 16 H LEU 16 -10.478 3.947 0.366
139 HA LEU 16 HA LEU 16 -7.914 4.401 -0.652
140 HB2 LEU 16 2HB LEU 16 -9.302 3.052 -1.884
141 HB3 LEU 16 1HB LEU 16 -10.592 4.294 -1.984
142 HG LEU 16 HG LEU 16 -8.891 5.522 -3.389
143 HD11 LEU 16 1HD1 LEU 16 -7.152 4.076 -4.419
144 HD12 LEU 16 2HD1 LEU 16 -7.554 2.836 -3.243
145 HD13 LEU 16 3HD1 LEU 16 -6.897 4.369 -2.696
146 HD21 LEU 16 1HD2 LEU 16 -9.961 2.873 -4.258
147 HD22 LEU 16 2HD2 LEU 16 -9.445 4.197 -5.334
148 HD23 LEU 16 3HD2 LEU 16 -10.799 4.437 -4.223
149 H LYS 17 H LYS 17 -10.645 6.527 -0.297
150 HA LYS 17 HA LYS 17 -9.592 8.586 -1.889
151 HB2 LYS 17 2HB LYS 17 -11.671 8.738 0.289
152 HB3 LYS 17 1HB LYS 17 -11.244 10.077 -0.757
153 HG2 LYS 17 2HG LYS 17 -11.945 8.753 -2.721
154 HG3 LYS 17 1HG LYS 17 -12.430 7.448 -1.637
155 HD2 LYS 17 2HD LYS 17 -14.054 8.926 -0.562
156 HD3 LYS 17 1HD LYS 17 -13.542 10.255 -1.597
157 HE2 LYS 17 2HE LYS 17 -15.606 9.279 -2.427
158 HE3 LYS 17 1HE LYS 17 -14.291 9.001 -3.563
159 HZ1 LYS 17 1HZ LYS 17 -15.691 7.058 -3.261
160 HZ2 LYS 17 2HZ LYS 17 -15.333 6.994 -1.620
161 HZ3 LYS 17 3HZ LYS 17 -14.127 6.718 -2.770
162 H ARG 18 H ARG 18 -8.510 7.457 0.943
163 HA ARG 18 HA ARG 18 -7.328 10.093 1.741
164 HB2 ARG 18 2HB ARG 18 -7.347 7.498 3.284
165 HB3 ARG 18 1HB ARG 18 -6.678 9.017 3.838
166 HG2 ARG 18 2HG ARG 18 -8.956 9.975 3.829
167 HG3 ARG 18 1HG ARG 18 -9.575 8.398 3.340
168 HD2 ARG 18 2HD ARG 18 -8.670 7.385 5.355
169 HD3 ARG 18 1HD ARG 18 -7.984 8.932 5.834
170 HE ARG 18 HE ARG 18 -10.741 9.183 5.426
171 HH11 ARG 18 1HH1 ARG 18 -8.416 7.820 7.732
172 HH12 ARG 18 2HH1 ARG 18 -9.446 7.975 9.070
173 HH21 ARG 18 1HH2 ARG 18 -12.158 9.368 7.283
174 HH22 ARG 18 2HH2 ARG 18 -11.619 8.868 8.813
175 H ILE 19 H ILE 19 -6.604 7.751 -0.255
176 HA ILE 19 HA ILE 19 -3.811 7.467 0.607
177 HB ILE 19 HB ILE 19 -5.296 5.757 -1.420
178 HG12 ILE 19 2HG1 ILE 19 -4.634 5.104 1.432
179 HG13 ILE 19 1HG1 ILE 19 -6.254 5.556 0.933
180 HG21 ILE 19 1HG2 ILE 19 -2.689 5.378 0.071
181 HG22 ILE 19 2HG2 ILE 19 -2.840 5.737 -1.655
182 HG23 ILE 19 3HG2 ILE 19 -3.421 4.197 -1.003
183 HD11 ILE 19 1HD1 ILE 19 -6.232 3.560 -0.601
184 HD12 ILE 19 2HD1 ILE 19 -6.108 3.162 1.119
185 HD13 ILE 19 3HD1 ILE 19 -4.681 3.152 0.080
186 H LYS 20 H LYS 20 -2.321 8.397 -0.612
187 HA LYS 20 HA LYS 20 -3.112 9.777 -3.001
188 HB2 LYS 20 2HB LYS 20 -0.420 9.660 -1.627
189 HB3 LYS 20 1HB LYS 20 -0.801 10.687 -2.986
190 HG2 LYS 20 2HG LYS 20 -1.950 10.792 -0.267
191 HG3 LYS 20 1HG LYS 20 -0.866 11.968 -1.018
192 HD2 LYS 20 2HD LYS 20 -3.707 11.312 -1.688
193 HD3 LYS 20 1HD LYS 20 -3.096 12.809 -1.034
194 HE2 LYS 20 2HE LYS 20 -2.436 11.810 -3.832
195 HE3 LYS 20 1HE LYS 20 -3.563 13.103 -3.454
196 HZ1 LYS 20 1HZ LYS 20 -1.694 14.393 -2.535
197 HZ2 LYS 20 2HZ LYS 20 -1.435 13.983 -4.142
198 HZ3 LYS 20 3HZ LYS 20 -0.629 13.140 -2.933
199 H SER 21 H SER 21 -0.861 7.132 -2.061
200 HA SER 21 HA SER 21 -0.919 5.858 -4.537
201 HB2 SER 21 2HB SER 21 1.463 6.367 -5.191
202 HB3 SER 21 1HB SER 21 0.371 7.744 -5.356
203 HG SER 21 HG SER 21 1.618 8.771 -4.060
204 H TYR 22 H TYR 22 1.035 4.192 -4.532
205 HA TYR 22 HA TYR 22 1.758 3.563 -1.753
206 HB2 TYR 22 2HB TYR 22 1.440 1.196 -2.213
207 HB3 TYR 22 1HB TYR 22 -0.066 2.076 -2.389
208 HD1 TYR 22 1HD TYR 22 -1.324 1.777 -4.288
209 HD2 TYR 22 2HD TYR 22 2.751 0.633 -4.404
210 HE1 TYR 22 1HE TYR 22 -1.681 0.728 -6.473
211 HE2 TYR 22 2HE TYR 22 2.414 -0.408 -6.600
212 HH TYR 22 HH TYR 22 -0.355 0.116 -8.464
213 H THR 23 H THR 23 3.505 2.028 -1.635
214 HA THR 23 HA THR 23 5.461 2.502 -3.768
215 HB THR 23 HB THR 23 5.950 2.101 -0.797
216 HG1 THR 23 1HG THR 23 5.811 4.340 -2.485
217 HG21 THR 23 1HG2 THR 23 7.774 1.229 -2.184
218 HG22 THR 23 2HG2 THR 23 8.291 2.674 -1.311
219 HG23 THR 23 3HG2 THR 23 7.883 2.773 -3.026
220 H ILE 24 H ILE 24 6.400 0.723 -4.632
221 HA ILE 24 HA ILE 24 5.300 -1.833 -3.910
222 HB ILE 24 HB ILE 24 7.222 -1.101 -6.139
223 HG12 ILE 24 2HG1 ILE 24 4.233 -1.596 -6.194
224 HG13 ILE 24 1HG1 ILE 24 5.002 -0.023 -6.332
225 HG21 ILE 24 1HG2 ILE 24 5.643 -3.639 -5.667
226 HG22 ILE 24 2HG2 ILE 24 7.394 -3.469 -5.527
227 HG23 ILE 24 3HG2 ILE 24 6.612 -3.287 -7.098
228 HD11 ILE 24 1HD1 ILE 24 5.258 -2.301 -8.285
229 HD12 ILE 24 2HD1 ILE 24 6.044 -0.730 -8.434
230 HD13 ILE 24 3HD1 ILE 24 4.285 -0.841 -8.501
231 H GLN 25 H GLN 25 6.163 -2.697 -2.183
232 HA GLN 25 HA GLN 25 9.032 -2.736 -1.779
233 HB2 GLN 25 2HB GLN 25 7.822 -2.211 0.187
234 HB3 GLN 25 1HB GLN 25 6.679 -3.509 -0.027
235 HG2 GLN 25 2HG GLN 25 8.390 -5.124 0.438
236 HG3 GLN 25 1HG GLN 25 9.579 -3.836 0.597
237 HE21 GLN 25 1HE2 GLN 25 8.571 -5.833 2.481
238 HE22 GLN 25 2HE2 GLN 25 8.075 -4.967 3.882
239 H SER 26 H SER 26 10.205 -4.372 -2.406
240 HA SER 26 HA SER 26 8.876 -6.901 -3.040
241 HB2 SER 26 2HB SER 26 9.963 -5.796 -4.963
242 HB3 SER 26 1HB SER 26 11.484 -5.749 -4.069
243 HG SER 26 HG SER 26 11.529 -7.498 -5.423
244 H ASN 27 H ASN 27 9.881 -8.879 -2.312
245 HA ASN 27 HA ASN 27 10.960 -8.838 0.260
246 HB2 ASN 27 2HB ASN 27 9.575 -10.612 -0.880
247 HB3 ASN 27 1HB ASN 27 11.024 -11.072 -1.770
248 HD21 ASN 27 1HD2 ASN 27 9.358 -11.144 1.176
249 HD22 ASN 27 2HD2 ASN 27 10.442 -12.160 2.030
250 H GLU 28 H GLU 28 12.427 -8.255 -2.677
251 HA GLU 28 HA GLU 28 14.933 -9.571 -2.436
252 HB2 GLU 28 2HB GLU 28 14.219 -7.072 -3.948
253 HB3 GLU 28 1HB GLU 28 15.615 -8.100 -4.239
254 HG2 GLU 28 2HG GLU 28 14.206 -9.910 -4.924
255 HG3 GLU 28 1HG GLU 28 12.764 -9.002 -4.488
256 H ALA 29 H ALA 29 13.875 -6.244 -1.714
257 HA ALA 29 HA ALA 29 16.484 -5.751 -0.445
258 HB1 ALA 29 1HB ALA 29 16.065 -3.378 -0.785
259 HB2 ALA 29 2HB ALA 29 14.477 -3.742 -1.463
260 HB3 ALA 29 3HB ALA 29 15.935 -4.254 -2.310
261 H CYS 30 H CYS 30 13.311 -6.396 0.283
262 HA CYS 30 HA CYS 30 13.525 -5.062 2.892
263 HB2 CYS 30 2HB CYS 30 11.066 -5.710 1.294
264 HB3 CYS 30 1HB CYS 30 11.096 -4.889 2.844
265 H ASN 31 H ASN 31 12.180 -6.270 4.567
266 HA ASN 31 HA ASN 31 13.068 -8.942 4.673
267 HB2 ASN 31 2HB ASN 31 12.653 -7.595 6.707
268 HB3 ASN 31 1HB ASN 31 10.933 -7.592 6.344
269 HD21 ASN 31 1HD2 ASN 31 10.401 -8.618 8.287
270 HD22 ASN 31 2HD2 ASN 31 10.753 -10.284 8.559
271 H ILE 32 H ILE 32 9.977 -7.515 3.799
272 HA ILE 32 HA ILE 32 9.071 -10.124 2.783
273 HB ILE 32 HB ILE 32 6.803 -9.745 3.665
274 HG12 ILE 32 2HG1 ILE 32 8.005 -7.351 5.075
275 HG13 ILE 32 1HG1 ILE 32 6.875 -7.284 3.731
276 HG21 ILE 32 1HG2 ILE 32 8.906 -9.559 5.768
277 HG22 ILE 32 2HG2 ILE 32 8.340 -11.063 5.029
278 HG23 ILE 32 3HG2 ILE 32 7.245 -10.104 6.057
279 HD11 ILE 32 1HD1 ILE 32 6.316 -8.399 6.468
280 HD12 ILE 32 2HD1 ILE 32 5.173 -8.334 5.123
281 HD13 ILE 32 3HD1 ILE 32 5.778 -6.841 5.844
282 H LYS 33 H LYS 33 6.932 -9.662 1.504
283 HA LYS 33 HA LYS 33 7.233 -7.162 0.037
284 HB2 LYS 33 2HB LYS 33 7.071 -9.208 -1.326
285 HB3 LYS 33 1HB LYS 33 5.546 -9.613 -0.543
286 HG2 LYS 33 2HG LYS 33 4.559 -7.547 -1.466
287 HG3 LYS 33 1HG LYS 33 6.067 -7.226 -2.307
288 HD2 LYS 33 2HD LYS 33 5.830 -9.284 -3.572
289 HD3 LYS 33 1HD LYS 33 4.353 -9.669 -2.682
290 HE2 LYS 33 2HE LYS 33 3.309 -7.634 -3.562
291 HE3 LYS 33 1HE LYS 33 4.777 -7.279 -4.468
292 HZ1 LYS 33 1HZ LYS 33 3.041 -9.659 -4.836
293 HZ2 LYS 33 2HZ LYS 33 4.449 -9.325 -5.711
294 HZ3 LYS 33 3HZ LYS 33 3.097 -8.317 -5.842
295 H ALA 34 H ALA 34 6.128 -5.551 0.965
296 HA ALA 34 HA ALA 34 3.330 -5.956 1.661
297 HB1 ALA 34 1HB ALA 34 4.527 -6.077 3.814
298 HB2 ALA 34 2HB ALA 34 3.626 -4.573 3.698
299 HB3 ALA 34 3HB ALA 34 5.365 -4.569 3.427
300 H ILE 35 H ILE 35 2.309 -4.543 0.372
301 HA ILE 35 HA ILE 35 3.747 -2.392 -0.826
302 HB ILE 35 HB ILE 35 0.803 -3.082 -0.860
303 HG12 ILE 35 2HG1 ILE 35 2.269 -4.787 -1.781
304 HG13 ILE 35 1HG1 ILE 35 1.294 -4.066 -3.054
305 HG21 ILE 35 1HG2 ILE 35 0.624 -1.580 -2.820
306 HG22 ILE 35 2HG2 ILE 35 2.308 -1.122 -2.600
307 HG23 ILE 35 3HG2 ILE 35 1.114 -0.705 -1.382
308 HD11 ILE 35 1HD1 ILE 35 3.535 -4.468 -3.804
309 HD12 ILE 35 2HD1 ILE 35 4.200 -3.547 -2.457
310 HD13 ILE 35 3HD1 ILE 35 3.266 -2.724 -3.713
311 H ILE 36 H ILE 36 3.862 -0.294 -0.265
312 HA ILE 36 HA ILE 36 2.722 0.299 2.342
313 HB ILE 36 HB ILE 36 4.847 1.856 0.842
314 HG12 ILE 36 2HG1 ILE 36 6.347 0.980 2.784
315 HG13 ILE 36 1HG1 ILE 36 5.123 -0.273 2.942
316 HG21 ILE 36 1HG2 ILE 36 3.646 3.252 2.347
317 HG22 ILE 36 2HG2 ILE 36 5.294 2.940 2.917
318 HG23 ILE 36 3HG2 ILE 36 3.930 2.099 3.666
319 HD11 ILE 36 1HD1 ILE 36 5.516 -0.934 0.659
320 HD12 ILE 36 2HD1 ILE 36 6.996 -0.981 1.636
321 HD13 ILE 36 3HD1 ILE 36 6.711 0.360 0.513
322 H PHE 37 H PHE 37 0.911 1.258 2.290
323 HA PHE 37 HA PHE 37 -0.005 2.961 0.128
324 HB2 PHE 37 2HB PHE 37 -1.144 1.883 2.680
325 HB3 PHE 37 1HB PHE 37 -1.952 3.217 1.848
326 HD1 PHE 37 1HD PHE 37 -0.228 0.563 0.128
327 HD2 PHE 37 2HD PHE 37 -3.933 1.974 1.474
328 HE1 PHE 37 1HE PHE 37 -1.427 -1.097 -1.385
329 HE2 PHE 37 2HE PHE 37 -5.119 0.380 0.033
330 HZ PHE 37 HZ PHE 37 -3.858 -1.142 -1.392
331 H THR 38 H THR 38 0.280 5.034 0.085
332 HA THR 38 HA THR 38 1.054 6.274 2.613
333 HB THR 38 HB THR 38 1.583 7.277 -0.204
334 HG1 THR 38 1HG THR 38 2.639 5.279 0.989
335 HG21 THR 38 1HG2 THR 38 1.521 9.025 1.474
336 HG22 THR 38 2HG2 THR 38 3.204 8.767 0.979
337 HG23 THR 38 3HG2 THR 38 2.598 8.112 2.511
338 H THR 39 H THR 39 -0.231 7.855 3.417
339 HA THR 39 HA THR 39 -2.754 8.260 2.066
340 HB THR 39 HB THR 39 -3.302 9.580 4.153
341 HG1 THR 39 1HG THR 39 -1.713 8.608 5.859
342 HG21 THR 39 1HG2 THR 39 -4.078 7.304 3.880
343 HG22 THR 39 2HG2 THR 39 -3.581 7.547 5.556
344 HG23 THR 39 3HG2 THR 39 -2.528 6.684 4.431
345 H LYS 40 H LYS 40 -3.647 10.579 2.365
346 HA LYS 40 HA LYS 40 -2.013 12.360 0.886
347 HB2 LYS 40 2HB LYS 40 -4.307 13.117 2.646
348 HB3 LYS 40 1HB LYS 40 -3.753 13.999 1.230
349 HG2 LYS 40 2HG LYS 40 -4.484 11.665 0.003
350 HG3 LYS 40 1HG LYS 40 -5.390 11.555 1.459
351 HD2 LYS 40 2HD LYS 40 -6.588 13.563 1.107
352 HD3 LYS 40 1HD LYS 40 -5.495 13.978 -0.231
353 HE2 LYS 40 2HE LYS 40 -6.283 12.167 -1.543
354 HE3 LYS 40 1HE LYS 40 -7.269 11.573 -0.220
355 HZ1 LYS 40 1HZ LYS 40 -8.598 13.590 -0.349
356 HZ2 LYS 40 2HZ LYS 40 -8.601 12.757 -1.811
357 HZ3 LYS 40 3HZ LYS 40 -7.672 14.154 -1.639
358 H LYS 41 H LYS 41 -2.301 11.673 4.204
359 HA LYS 41 HA LYS 41 -0.994 14.040 5.148
360 HB2 LYS 41 2HB LYS 41 -1.396 11.334 6.454
361 HB3 LYS 41 1HB LYS 41 -0.671 12.705 7.258
362 HG2 LYS 41 2HG LYS 41 -2.918 12.490 8.011
363 HG3 LYS 41 1HG LYS 41 -2.832 13.920 6.998
364 HD2 LYS 41 2HD LYS 41 -3.852 12.683 5.153
365 HD3 LYS 41 1HD LYS 41 -3.874 11.213 6.132
366 HE2 LYS 41 2HE LYS 41 -5.358 12.324 7.747
367 HE3 LYS 41 1HE LYS 41 -5.337 13.779 6.754
368 HZ1 LYS 41 1HZ LYS 41 -7.308 12.431 6.454
369 HZ2 LYS 41 2HZ LYS 41 -6.387 11.139 5.910
370 HZ3 LYS 41 3HZ LYS 41 -6.469 12.594 5.013
371 H GLY 42 H GLY 42 -0.144 11.227 3.551
372 HA2 GLY 42 2HA GLY 42 1.845 10.708 2.637
373 HA3 GLY 42 1HA GLY 42 2.595 11.949 3.606
374 H ARG 43 H ARG 43 0.643 9.842 5.344
375 HA ARG 43 HA ARG 43 2.814 8.678 6.802
376 HB2 ARG 43 2HB ARG 43 -0.094 8.057 6.722
377 HB3 ARG 43 1HB ARG 43 1.017 7.325 7.877
378 HG2 ARG 43 2HG ARG 43 1.504 9.571 8.766
379 HG3 ARG 43 1HG ARG 43 0.311 10.255 7.655
380 HD2 ARG 43 2HD ARG 43 -1.427 8.911 8.717
381 HD3 ARG 43 1HD ARG 43 -0.227 8.209 9.800
382 HE ARG 43 HE ARG 43 -0.111 10.981 10.032
383 HH11 ARG 43 1HH1 ARG 43 -2.318 8.310 10.794
384 HH12 ARG 43 2HH1 ARG 43 -3.038 9.087 12.117
385 HH21 ARG 43 1HH2 ARG 43 -1.117 12.049 11.877
386 HH22 ARG 43 2HH2 ARG 43 -2.353 11.271 12.750
387 H LYS 44 H LYS 44 3.397 6.478 6.876
388 HA LYS 44 HA LYS 44 2.888 5.088 4.361
389 HB2 LYS 44 2HB LYS 44 5.060 4.669 6.410
390 HB3 LYS 44 1HB LYS 44 4.947 3.857 4.856
391 HG2 LYS 44 2HG LYS 44 5.405 6.807 5.308
392 HG3 LYS 44 1HG LYS 44 6.608 5.635 4.766
393 HD2 LYS 44 2HD LYS 44 5.357 5.280 2.708
394 HD3 LYS 44 1HD LYS 44 4.081 6.359 3.268
395 HE2 LYS 44 2HE LYS 44 5.497 7.529 1.709
396 HE3 LYS 44 1HE LYS 44 5.696 8.212 3.316
397 HZ1 LYS 44 1HZ LYS 44 7.561 6.335 1.962
398 HZ2 LYS 44 2HZ LYS 44 7.729 6.863 3.534
399 HZ3 LYS 44 3HZ LYS 44 7.823 7.979 2.264
400 H ILE 45 H ILE 45 1.391 3.610 4.426
401 HA ILE 45 HA ILE 45 0.869 2.144 6.902
402 HB ILE 45 HB ILE 45 -0.895 2.502 4.451
403 HG12 ILE 45 2HG1 ILE 45 -2.434 3.739 6.220
404 HG13 ILE 45 1HG1 ILE 45 -0.939 3.816 7.147
405 HG21 ILE 45 1HG2 ILE 45 -1.516 1.122 7.061
406 HG22 ILE 45 2HG2 ILE 45 -1.295 0.359 5.486
407 HG23 ILE 45 3HG2 ILE 45 -2.674 1.423 5.768
408 HD11 ILE 45 1HD1 ILE 45 -1.419 5.857 5.981
409 HD12 ILE 45 2HD1 ILE 45 -1.312 4.993 4.443
410 HD13 ILE 45 3HD1 ILE 45 0.110 5.128 5.478
411 H CYS 46 H CYS 46 1.467 0.111 6.902
412 HA CYS 46 HA CYS 46 2.530 -1.101 4.473
413 HB2 CYS 46 2HB CYS 46 2.459 -2.121 7.305
414 HB3 CYS 46 1HB CYS 46 3.493 -2.703 6.013
415 H ALA 47 H ALA 47 1.067 -2.140 3.213
416 HA ALA 47 HA ALA 47 -1.057 -3.594 4.632
417 HB1 ALA 47 1HB ALA 47 -1.278 -2.202 1.967
418 HB2 ALA 47 2HB ALA 47 -1.910 -1.592 3.495
419 HB3 ALA 47 3HB ALA 47 -2.560 -3.077 2.804
420 H ASN 48 H ASN 48 -1.640 -5.628 3.927
421 HA ASN 48 HA ASN 48 0.287 -6.955 2.446
422 HB2 ASN 48 2HB ASN 48 -0.705 -8.208 4.146
423 HB3 ASN 48 1HB ASN 48 -2.312 -7.756 3.670
424 HD21 ASN 48 1HD2 ASN 48 0.431 -9.657 2.486
425 HD22 ASN 48 2HD2 ASN 48 -0.646 -10.682 1.546
426 HA PRO 49 HA PRO 49 -1.099 -5.971 -1.614
427 HB2 PRO 49 2HB PRO 49 0.481 -7.826 -2.855
428 HB3 PRO 49 1HB PRO 49 1.021 -6.214 -2.398
429 HG2 PRO 49 2HG PRO 49 1.448 -8.818 -1.026
430 HG3 PRO 49 1HG PRO 49 2.548 -7.438 -1.183
431 HD2 PRO 49 2HD PRO 49 1.214 -7.943 1.091
432 HD3 PRO 49 1HD PRO 49 1.545 -6.288 0.559
433 H ASN 50 H ASN 50 -1.240 -9.031 -0.068
434 HA ASN 50 HA ASN 50 -2.579 -10.261 -2.223
435 HB2 ASN 50 2HB ASN 50 -2.020 -11.345 0.533
436 HB3 ASN 50 1HB ASN 50 -2.955 -12.203 -0.686
437 HD21 ASN 50 1HD2 ASN 50 -0.195 -10.237 -1.562
438 HD22 ASN 50 2HD2 ASN 50 0.844 -11.545 -1.980
439 H GLU 51 H GLU 51 -3.565 -8.081 0.043
440 HA GLU 51 HA GLU 51 -6.128 -9.260 0.679
441 HB2 GLU 51 2HB GLU 51 -5.231 -6.422 1.175
442 HB3 GLU 51 1HB GLU 51 -6.623 -7.226 1.879
443 HG2 GLU 51 2HG GLU 51 -4.828 -8.897 2.865
444 HG3 GLU 51 1HG GLU 51 -3.784 -7.665 2.276
445 H LYS 52 H LYS 52 -8.017 -8.903 -0.261
446 HA LYS 52 HA LYS 52 -8.003 -8.047 -2.912
447 HB2 LYS 52 2HB LYS 52 -9.599 -9.704 -2.014
448 HB3 LYS 52 1HB LYS 52 -10.396 -8.432 -1.106
449 HG2 LYS 52 2HG LYS 52 -11.640 -9.003 -3.129
450 HG3 LYS 52 1HG LYS 52 -11.054 -7.338 -3.175
451 HD2 LYS 52 2HD LYS 52 -9.220 -7.983 -4.629
452 HD3 LYS 52 1HD LYS 52 -9.686 -9.679 -4.529
453 HE2 LYS 52 2HE LYS 52 -11.342 -7.448 -5.717
454 HE3 LYS 52 1HE LYS 52 -10.388 -8.612 -6.631
455 HZ1 LYS 52 1HZ LYS 52 -12.732 -9.274 -4.901
456 HZ2 LYS 52 2HZ LYS 52 -11.794 -10.379 -5.751
457 HZ3 LYS 52 3HZ LYS 52 -12.699 -9.247 -6.587
458 H TRP 53 H TRP 53 -8.785 -6.288 0.029
459 HA TRP 53 HA TRP 53 -9.995 -4.093 -1.320
460 HB2 TRP 53 2HB TRP 53 -9.856 -2.826 0.749
461 HB3 TRP 53 1HB TRP 53 -10.279 -4.475 1.162
462 HD1 TRP 53 HD TRP 53 -8.312 -5.921 2.465
463 HE1 TRP 53 1HE TRP 53 -6.358 -5.142 3.879
464 HE3 TRP 53 3HE TRP 53 -8.118 -1.032 0.973
465 HZ2 TRP 53 2HZ TRP 53 -4.884 -2.795 4.332
466 HZ3 TRP 53 3HZ TRP 53 -6.388 0.403 1.946
467 HH2 TRP 53 HH TRP 53 -4.800 -0.458 3.594
468 H VAL 54 H VAL 54 -6.743 -4.884 -0.399
469 HA VAL 54 HA VAL 54 -5.469 -2.477 -1.056
470 HB VAL 54 HB VAL 54 -4.442 -5.331 -0.903
471 HG11 VAL 54 1HG1 VAL 54 -2.816 -2.800 -1.188
472 HG12 VAL 54 2HG1 VAL 54 -3.041 -4.049 -2.416
473 HG13 VAL 54 3HG1 VAL 54 -2.188 -4.421 -0.912
474 HG21 VAL 54 1HG2 VAL 54 -4.110 -2.970 0.916
475 HG22 VAL 54 2HG2 VAL 54 -3.445 -4.585 1.176
476 HG23 VAL 54 3HG2 VAL 54 -5.192 -4.330 1.187
477 H GLN 55 H GLN 55 -6.137 -5.416 -2.835
478 HA GLN 55 HA GLN 55 -4.737 -4.673 -5.128
479 HB2 GLN 55 2HB GLN 55 -6.995 -6.642 -4.911
480 HB3 GLN 55 1HB GLN 55 -5.825 -6.535 -6.233
481 HG2 GLN 55 2HG GLN 55 -4.030 -6.804 -4.503
482 HG3 GLN 55 1HG GLN 55 -5.306 -7.223 -3.372
483 HE21 GLN 55 1HE2 GLN 55 -3.128 -8.709 -4.170
484 HE22 GLN 55 2HE2 GLN 55 -3.663 -10.139 -4.941
485 H LYS 56 H LYS 56 -8.053 -4.129 -4.109
486 HA LYS 56 HA LYS 56 -8.944 -3.019 -6.574
487 HB2 LYS 56 2HB LYS 56 -9.989 -2.555 -3.779
488 HB3 LYS 56 1HB LYS 56 -10.772 -1.986 -5.242
489 HG2 LYS 56 2HG LYS 56 -11.053 -4.315 -5.965
490 HG3 LYS 56 1HG LYS 56 -10.324 -4.847 -4.446
491 HD2 LYS 56 2HD LYS 56 -12.092 -3.696 -3.201
492 HD3 LYS 56 1HD LYS 56 -12.818 -3.178 -4.716
493 HE2 LYS 56 2HE LYS 56 -13.166 -5.525 -5.346
494 HE3 LYS 56 1HE LYS 56 -12.451 -6.031 -3.819
495 HZ1 LYS 56 1HZ LYS 56 -14.820 -6.065 -3.635
496 HZ2 LYS 56 2HZ LYS 56 -14.949 -4.454 -4.138
497 HZ3 LYS 56 3HZ LYS 56 -14.225 -4.840 -2.668
498 H ALA 57 H ALA 57 -7.546 -1.648 -3.630
499 HA ALA 57 HA ALA 57 -7.671 1.053 -4.395
500 HB1 ALA 57 1HB ALA 57 -5.818 1.403 -2.806
501 HB2 ALA 57 2HB ALA 57 -5.616 -0.333 -2.636
502 HB3 ALA 57 3HB ALA 57 -7.119 0.470 -2.093
503 H MET 58 H MET 58 -5.298 -1.444 -4.947
504 HA MET 58 HA MET 58 -3.370 0.033 -6.227
505 HB2 MET 58 2HB MET 58 -4.155 -2.816 -6.666
506 HB3 MET 58 1HB MET 58 -2.773 -2.068 -7.442
507 HG2 MET 58 2HG MET 58 -1.848 -1.590 -5.215
508 HG3 MET 58 1HG MET 58 -3.215 -2.431 -4.511
509 HE1 MET 58 1HE MET 58 -0.036 -3.231 -4.227
510 HE2 MET 58 2HE MET 58 -0.206 -4.981 -4.154
511 HE3 MET 58 3HE MET 58 -1.333 -3.941 -3.268
512 H LYS 59 H LYS 59 -6.345 -1.350 -7.590
513 HA LYS 59 HA LYS 59 -5.642 -1.025 -10.262
514 HB2 LYS 59 2HB LYS 59 -7.495 -2.418 -9.412
515 HB3 LYS 59 1HB LYS 59 -8.361 -0.972 -8.933
516 HG2 LYS 59 2HG LYS 59 -8.511 -0.290 -11.278
517 HG3 LYS 59 1HG LYS 59 -7.637 -1.749 -11.750
518 HD2 LYS 59 2HD LYS 59 -10.306 -1.700 -10.313
519 HD3 LYS 59 1HD LYS 59 -10.089 -1.992 -12.037
520 HE2 LYS 59 2HE LYS 59 -8.958 -3.721 -9.820
521 HE3 LYS 59 1HE LYS 59 -10.413 -4.067 -10.729
522 HZ1 LYS 59 1HZ LYS 59 -8.480 -5.264 -11.555
523 HZ2 LYS 59 2HZ LYS 59 -7.699 -3.830 -11.948
524 HZ3 LYS 59 3HZ LYS 59 -9.121 -4.273 -12.737
525 H HIS 60 H HIS 60 -7.156 1.056 -7.880
526 HA HIS 60 HA HIS 60 -7.586 3.228 -9.647
527 HB2 HIS 60 2HB HIS 60 -9.011 2.917 -7.729
528 HB3 HIS 60 1HB HIS 60 -7.628 2.968 -6.646
529 HD1 HIS 60 1HD HIS 60 -9.702 5.239 -8.864
530 HD2 HIS 60 2HD HIS 60 -6.952 5.407 -5.791
531 HE1 HIS 60 1HE HIS 60 -9.628 7.654 -8.194
532 HE2 HIS 60 2HE HIS 60 -7.662 7.762 -6.664
533 H LEU 61 H LEU 61 -5.198 2.539 -7.128
534 HA LEU 61 HA LEU 61 -3.794 5.018 -7.403
535 HB2 LEU 61 2HB LEU 61 -2.895 2.423 -6.165
536 HB3 LEU 61 1HB LEU 61 -2.119 3.976 -5.938
537 HG LEU 61 HG LEU 61 -4.917 3.304 -5.037
538 HD11 LEU 61 1HD1 LEU 61 -2.356 3.472 -3.457
539 HD12 LEU 61 2HD1 LEU 61 -3.261 2.003 -3.837
540 HD13 LEU 61 3HD1 LEU 61 -3.977 3.231 -2.796
541 HD21 LEU 61 1HD2 LEU 61 -3.149 5.687 -4.466
542 HD22 LEU 61 2HD2 LEU 61 -4.729 5.380 -3.747
543 HD23 LEU 61 3HD2 LEU 61 -4.594 5.687 -5.478
544 H ASP 62 H ASP 62 -3.542 2.015 -9.095
545 HA ASP 62 HA ASP 62 -0.872 2.330 -10.046
546 HB2 ASP 62 2HB ASP 62 -1.918 0.145 -10.058
547 HB3 ASP 62 1HB ASP 62 -3.223 0.728 -11.073
548 H LYS 63 H LYS 63 -3.984 3.446 -11.044
549 HA LYS 63 HA LYS 63 -2.814 4.620 -13.384
550 HB2 LYS 63 2HB LYS 63 -5.227 5.306 -13.911
551 HB3 LYS 63 1HB LYS 63 -4.850 3.589 -13.950
552 HG2 LYS 63 2HG LYS 63 -5.777 3.366 -11.690
553 HG3 LYS 63 1HG LYS 63 -6.222 5.068 -11.735
554 HD2 LYS 63 2HD LYS 63 -7.733 4.674 -13.554
555 HD3 LYS 63 1HD LYS 63 -7.173 3.003 -13.704
556 HE2 LYS 63 2HE LYS 63 -8.024 2.490 -11.477
557 HE3 LYS 63 1HE LYS 63 -8.538 4.161 -11.273
558 HZ1 LYS 63 1HZ LYS 63 -9.561 2.278 -13.315
559 HZ2 LYS 63 2HZ LYS 63 -10.085 3.867 -13.083
560 HZ3 LYS 63 3HZ LYS 63 -10.357 2.701 -11.889
561 H LYS 64 H LYS 64 -4.445 5.576 -10.356
562 HA LYS 64 HA LYS 64 -2.772 7.615 -9.742
563 HB2 LYS 64 2HB LYS 64 -3.767 8.730 -11.759
564 HB3 LYS 64 1HB LYS 64 -5.313 8.663 -10.886
565 HG2 LYS 64 2HG LYS 64 -4.497 10.115 -9.180
566 HG3 LYS 64 1HG LYS 64 -2.863 10.065 -9.844
567 HD2 LYS 64 2HD LYS 64 -3.706 11.154 -11.890
568 HD3 LYS 64 1HD LYS 64 -5.297 11.282 -11.133
569 HE2 LYS 64 2HE LYS 64 -4.385 12.648 -9.364
570 HE3 LYS 64 1HE LYS 64 -2.760 12.462 -10.011
571 HZ1 LYS 64 1HZ LYS 64 -3.515 13.590 -12.023
572 HZ2 LYS 64 2HZ LYS 64 -3.663 14.565 -10.646
573 HZ3 LYS 64 3HZ LYS 64 -5.024 13.848 -11.353
Start of MODEL 9
1 H1 ALA 1 1HT ALA 1 8.725 9.342 9.907
2 H2 ALA 1 2HT ALA 1 8.582 8.417 8.504
3 H3 ALA 1 3HT ALA 1 9.846 9.496 8.655
4 HA ALA 1 HA ALA 1 10.809 8.215 10.418
5 HB1 ALA 1 1HB ALA 1 8.738 7.257 11.314
6 HB2 ALA 1 2HB ALA 1 9.892 5.986 10.907
7 HB3 ALA 1 3HB ALA 1 8.533 6.318 9.835
8 H ARG 2 H ARG 2 12.607 7.588 9.402
9 HA ARG 2 HA ARG 2 12.404 6.738 6.676
10 HB2 ARG 2 2HB ARG 2 14.864 7.082 8.389
11 HB3 ARG 2 1HB ARG 2 14.878 6.686 6.681
12 HG2 ARG 2 2HG ARG 2 13.706 8.826 6.232
13 HG3 ARG 2 1HG ARG 2 13.878 9.229 7.941
14 HD2 ARG 2 2HD ARG 2 16.123 8.681 6.000
15 HD3 ARG 2 1HD ARG 2 15.646 10.262 6.606
16 HE ARG 2 HE ARG 2 16.172 8.866 8.849
17 HH11 ARG 2 1HH1 ARG 2 18.034 9.439 5.896
18 HH12 ARG 2 2HH1 ARG 2 19.544 9.394 6.671
19 HH21 ARG 2 1HH2 ARG 2 18.284 8.799 9.904
20 HH22 ARG 2 2HH2 ARG 2 19.696 9.027 8.980
21 H LYS 3 H LYS 3 11.586 4.838 6.467
22 HA LYS 3 HA LYS 3 13.327 2.653 6.968
23 HB2 LYS 3 2HB LYS 3 11.456 1.205 7.875
24 HB3 LYS 3 1HB LYS 3 12.038 2.425 8.982
25 HG2 LYS 3 2HG LYS 3 10.072 3.822 8.417
26 HG3 LYS 3 1HG LYS 3 9.481 2.518 7.386
27 HD2 LYS 3 2HD LYS 3 9.348 1.016 9.281
28 HD3 LYS 3 1HD LYS 3 10.073 2.229 10.336
29 HE2 LYS 3 2HE LYS 3 7.665 2.108 10.674
30 HE3 LYS 3 1HE LYS 3 8.115 3.675 9.997
31 HZ1 LYS 3 1HZ LYS 3 6.155 2.808 8.927
32 HZ2 LYS 3 2HZ LYS 3 6.942 1.381 8.530
33 HZ3 LYS 3 3HZ LYS 3 7.406 2.825 7.820
34 H SER 4 H SER 4 13.265 1.224 5.344
35 HA SER 4 HA SER 4 11.681 2.115 3.074
36 HB2 SER 4 2HB SER 4 14.141 1.931 2.832
37 HB3 SER 4 1HB SER 4 14.032 0.211 3.192
38 HG SER 4 HG SER 4 14.094 0.464 0.989
39 H CYS 5 H CYS 5 11.975 -0.524 5.280
40 HA CYS 5 HA CYS 5 10.188 -2.108 3.584
41 HB2 CYS 5 2HB CYS 5 12.201 -3.032 5.616
42 HB3 CYS 5 1HB CYS 5 11.121 -4.071 4.699
43 H CYS 6 H CYS 6 8.540 -3.266 4.559
44 HA CYS 6 HA CYS 6 7.847 -2.553 7.290
45 HB2 CYS 6 2HB CYS 6 6.228 -3.416 4.918
46 HB3 CYS 6 1HB CYS 6 5.558 -3.220 6.535
47 H LEU 7 H LEU 7 7.644 -4.268 8.637
48 HA LEU 7 HA LEU 7 8.096 -6.955 7.524
49 HB2 LEU 7 2HB LEU 7 8.448 -5.968 10.368
50 HB3 LEU 7 1HB LEU 7 8.639 -7.630 9.875
51 HG LEU 7 HG LEU 7 10.564 -6.879 8.426
52 HD11 LEU 7 1HD1 LEU 7 11.624 -4.761 8.928
53 HD12 LEU 7 2HD1 LEU 7 10.269 -4.313 9.962
54 HD13 LEU 7 3HD1 LEU 7 10.022 -4.526 8.227
55 HD21 LEU 7 1HD2 LEU 7 10.921 -7.956 10.565
56 HD22 LEU 7 2HD2 LEU 7 10.781 -6.403 11.392
57 HD23 LEU 7 3HD2 LEU 7 12.130 -6.704 10.294
58 H LYS 8 H LYS 8 5.726 -4.983 8.446
59 HA LYS 8 HA LYS 8 3.986 -7.175 9.304
60 HB2 LYS 8 2HB LYS 8 3.954 -4.345 10.343
61 HB3 LYS 8 1HB LYS 8 2.848 -5.625 10.809
62 HG2 LYS 8 2HG LYS 8 4.732 -6.853 11.817
63 HG3 LYS 8 1HG LYS 8 5.811 -5.536 11.373
64 HD2 LYS 8 2HD LYS 8 3.441 -5.344 13.242
65 HD3 LYS 8 1HD LYS 8 5.135 -5.363 13.710
66 HE2 LYS 8 2HE LYS 8 5.506 -3.257 12.510
67 HE3 LYS 8 1HE LYS 8 3.819 -3.244 12.008
68 HZ1 LYS 8 1HZ LYS 8 3.165 -3.071 14.329
69 HZ2 LYS 8 2HZ LYS 8 4.195 -1.813 13.901
70 HZ3 LYS 8 3HZ LYS 8 4.772 -3.095 14.818
71 H TYR 9 H TYR 9 1.719 -6.636 8.865
72 HA TYR 9 HA TYR 9 1.345 -4.644 6.763
73 HB2 TYR 9 2HB TYR 9 -0.440 -7.166 6.967
74 HB3 TYR 9 1HB TYR 9 -0.240 -6.005 5.724
75 HD1 TYR 9 1HD TYR 9 1.258 -6.242 4.027
76 HD2 TYR 9 2HD TYR 9 1.452 -8.847 7.347
77 HE1 TYR 9 1HE TYR 9 2.771 -7.731 2.763
78 HE2 TYR 9 2HE TYR 9 2.962 -10.343 6.111
79 HH TYR 9 HH TYR 9 4.404 -9.409 3.141
80 H THR 10 H THR 10 -0.676 -3.509 7.013
81 HA THR 10 HA THR 10 -1.440 -3.155 9.673
82 HB THR 10 HB THR 10 -1.481 -1.275 8.132
83 HG1 THR 10 1HG THR 10 -4.153 -1.196 8.432
84 HG21 THR 10 1HG2 THR 10 -3.185 -1.073 6.365
85 HG22 THR 10 2HG2 THR 10 -3.701 -2.735 6.681
86 HG23 THR 10 3HG2 THR 10 -2.067 -2.399 6.076
87 H LYS 11 H LYS 11 -3.267 -3.819 10.740
88 HA LYS 11 HA LYS 11 -4.695 -6.062 9.585
89 HB2 LYS 11 2HB LYS 11 -4.865 -4.771 12.305
90 HB3 LYS 11 1HB LYS 11 -5.722 -6.232 11.845
91 HG2 LYS 11 2HG LYS 11 -3.628 -7.403 11.535
92 HG3 LYS 11 1HG LYS 11 -2.720 -5.940 11.892
93 HD2 LYS 11 2HD LYS 11 -4.571 -7.391 13.793
94 HD3 LYS 11 1HD LYS 11 -2.810 -7.452 13.832
95 HE2 LYS 11 2HE LYS 11 -4.536 -5.010 14.283
96 HE3 LYS 11 1HE LYS 11 -3.661 -5.905 15.511
97 HZ1 LYS 11 1HZ LYS 11 -2.481 -3.931 14.884
98 HZ2 LYS 11 2HZ LYS 11 -2.449 -4.379 13.275
99 HZ3 LYS 11 3HZ LYS 11 -1.581 -5.277 14.412
100 H ARG 12 H ARG 12 -5.046 -2.741 10.091
101 HA ARG 12 HA ARG 12 -7.928 -2.855 9.658
102 HB2 ARG 12 2HB ARG 12 -7.265 -1.515 11.543
103 HB3 ARG 12 1HB ARG 12 -6.131 -0.609 10.554
104 HG2 ARG 12 2HG ARG 12 -7.996 0.330 9.281
105 HG3 ARG 12 1HG ARG 12 -9.131 -0.592 10.264
106 HD2 ARG 12 2HD ARG 12 -8.426 0.575 12.243
107 HD3 ARG 12 1HD ARG 12 -7.182 1.436 11.331
108 HE ARG 12 HE ARG 12 -9.510 2.019 10.064
109 HH11 ARG 12 1HH1 ARG 12 -8.414 2.295 13.405
110 HH12 ARG 12 2HH1 ARG 12 -9.288 3.734 13.727
111 HH21 ARG 12 1HH2 ARG 12 -10.684 4.035 10.506
112 HH22 ARG 12 2HH2 ARG 12 -10.557 4.739 12.063
113 HA PRO 13 HA PRO 13 -7.111 -1.841 5.343
114 HB2 PRO 13 2HB PRO 13 -10.025 -1.278 5.444
115 HB3 PRO 13 1HB PRO 13 -9.124 -2.321 4.338
116 HG2 PRO 13 2HG PRO 13 -10.641 -3.377 6.242
117 HG3 PRO 13 1HG PRO 13 -9.064 -4.083 5.837
118 HD2 PRO 13 2HD PRO 13 -9.817 -2.335 8.147
119 HD3 PRO 13 1HD PRO 13 -8.764 -3.770 8.097
120 H LEU 14 H LEU 14 -6.827 0.091 4.322
121 HA LEU 14 HA LEU 14 -7.581 2.550 5.723
122 HB2 LEU 14 2HB LEU 14 -5.165 2.142 5.110
123 HB3 LEU 14 1HB LEU 14 -5.654 2.066 3.437
124 HG LEU 14 HG LEU 14 -6.345 4.429 3.560
125 HD11 LEU 14 1HD1 LEU 14 -5.623 5.784 5.454
126 HD12 LEU 14 2HD1 LEU 14 -5.085 4.333 6.299
127 HD13 LEU 14 3HD1 LEU 14 -6.799 4.574 5.962
128 HD21 LEU 14 1HD2 LEU 14 -3.511 3.830 4.366
129 HD22 LEU 14 2HD2 LEU 14 -4.069 5.307 3.579
130 HD23 LEU 14 3HD2 LEU 14 -4.162 3.763 2.735
131 HA PRO 15 HA PRO 15 -10.619 2.924 2.402
132 HB2 PRO 15 2HB PRO 15 -10.784 5.769 3.068
133 HB3 PRO 15 1HB PRO 15 -12.032 4.539 3.165
134 HG2 PRO 15 2HG PRO 15 -10.919 5.604 5.386
135 HG3 PRO 15 1HG PRO 15 -11.473 3.923 5.316
136 HD2 PRO 15 2HD PRO 15 -8.704 5.021 5.116
137 HD3 PRO 15 1HD PRO 15 -9.289 3.561 5.947
138 H LEU 16 H LEU 16 -10.405 3.428 0.342
139 HA LEU 16 HA LEU 16 -7.911 4.204 -0.655
140 HB2 LEU 16 2HB LEU 16 -9.203 2.648 -1.819
141 HB3 LEU 16 1HB LEU 16 -10.545 3.807 -1.982
142 HG LEU 16 HG LEU 16 -9.029 5.095 -3.455
143 HD11 LEU 16 1HD1 LEU 16 -7.063 3.905 -4.371
144 HD12 LEU 16 2HD1 LEU 16 -7.291 2.655 -3.147
145 HD13 LEU 16 3HD1 LEU 16 -6.901 4.300 -2.664
146 HD21 LEU 16 1HD2 LEU 16 -9.646 2.268 -4.152
147 HD22 LEU 16 2HD2 LEU 16 -9.327 3.591 -5.311
148 HD23 LEU 16 3HD2 LEU 16 -10.721 3.684 -4.224
149 H LYS 17 H LYS 17 -10.840 5.990 -0.262
150 HA LYS 17 HA LYS 17 -10.173 8.166 -1.905
151 HB2 LYS 17 2HB LYS 17 -12.059 8.014 0.433
152 HB3 LYS 17 1HB LYS 17 -11.903 9.431 -0.603
153 HG2 LYS 17 2HG LYS 17 -12.572 8.149 -2.523
154 HG3 LYS 17 1HG LYS 17 -12.641 6.676 -1.561
155 HD2 LYS 17 2HD LYS 17 -14.438 7.667 -0.217
156 HD3 LYS 17 1HD LYS 17 -14.350 9.130 -1.193
157 HE2 LYS 17 2HE LYS 17 -16.177 7.655 -1.928
158 HE3 LYS 17 1HE LYS 17 -14.962 7.902 -3.180
159 HZ1 LYS 17 1HZ LYS 17 -14.046 5.725 -2.706
160 HZ2 LYS 17 2HZ LYS 17 -15.680 5.592 -3.021
161 HZ3 LYS 17 3HZ LYS 17 -15.140 5.487 -1.437
162 H ARG 18 H ARG 18 -8.711 7.230 0.826
163 HA ARG 18 HA ARG 18 -7.733 10.002 1.404
164 HB2 ARG 18 2HB ARG 18 -7.719 7.616 3.278
165 HB3 ARG 18 1HB ARG 18 -6.847 9.098 3.588
166 HG2 ARG 18 2HG ARG 18 -8.829 9.043 4.892
167 HG3 ARG 18 1HG ARG 18 -9.031 10.292 3.674
168 HD2 ARG 18 2HD ARG 18 -10.430 8.747 2.366
169 HD3 ARG 18 1HD ARG 18 -10.161 7.507 3.598
170 HE ARG 18 HE ARG 18 -11.187 9.836 4.784
171 HH11 ARG 18 1HH1 ARG 18 -12.299 7.156 2.753
172 HH12 ARG 18 2HH1 ARG 18 -13.882 7.179 3.374
173 HH21 ARG 18 1HH2 ARG 18 -13.352 9.860 5.603
174 HH22 ARG 18 2HH2 ARG 18 -14.500 8.746 5.014
175 H ILE 19 H ILE 19 -6.839 7.603 -0.426
176 HA ILE 19 HA ILE 19 -4.044 7.526 0.483
177 HB ILE 19 HB ILE 19 -5.376 5.686 -1.533
178 HG12 ILE 19 2HG1 ILE 19 -4.717 5.120 1.327
179 HG13 ILE 19 1HG1 ILE 19 -6.359 5.493 0.835
180 HG21 ILE 19 1HG2 ILE 19 -2.782 5.510 0.022
181 HG22 ILE 19 2HG2 ILE 19 -2.918 5.783 -1.719
182 HG23 ILE 19 3HG2 ILE 19 -3.418 4.244 -1.009
183 HD11 ILE 19 1HD1 ILE 19 -6.227 3.482 -0.694
184 HD12 ILE 19 2HD1 ILE 19 -6.096 3.104 1.032
185 HD13 ILE 19 3HD1 ILE 19 -4.667 3.176 -0.011
186 H LYS 20 H LYS 20 -2.515 8.352 -0.796
187 HA LYS 20 HA LYS 20 -3.329 9.611 -3.283
188 HB2 LYS 20 2HB LYS 20 -0.732 9.855 -1.761
189 HB3 LYS 20 1HB LYS 20 -1.124 10.743 -3.208
190 HG2 LYS 20 2HG LYS 20 -2.399 10.935 -0.551
191 HG3 LYS 20 1HG LYS 20 -1.455 12.166 -1.403
192 HD2 LYS 20 2HD LYS 20 -4.155 11.076 -2.057
193 HD3 LYS 20 1HD LYS 20 -3.775 12.695 -1.530
194 HE2 LYS 20 2HE LYS 20 -2.862 11.561 -4.198
195 HE3 LYS 20 1HE LYS 20 -4.190 12.693 -3.972
196 HZ1 LYS 20 1HZ LYS 20 -2.615 14.313 -3.109
197 HZ2 LYS 20 2HZ LYS 20 -2.158 13.829 -4.647
198 HZ3 LYS 20 3HZ LYS 20 -1.340 13.233 -3.308
199 H SER 21 H SER 21 -0.917 7.253 -2.099
200 HA SER 21 HA SER 21 -0.678 6.010 -4.629
201 HB2 SER 21 2HB SER 21 1.642 7.733 -3.670
202 HB3 SER 21 1HB SER 21 1.743 6.563 -4.977
203 HG SER 21 HG SER 21 -0.323 8.288 -5.288
204 H TYR 22 H TYR 22 1.215 4.396 -4.462
205 HA TYR 22 HA TYR 22 1.755 3.673 -1.669
206 HB2 TYR 22 2HB TYR 22 1.387 1.334 -2.155
207 HB3 TYR 22 1HB TYR 22 -0.080 2.246 -2.451
208 HD1 TYR 22 1HD TYR 22 -1.129 2.099 -4.497
209 HD2 TYR 22 2HD TYR 22 2.806 0.604 -4.159
210 HE1 TYR 22 1HE TYR 22 -1.343 1.054 -6.692
211 HE2 TYR 22 2HE TYR 22 2.617 -0.435 -6.379
212 HH TYR 22 HH TYR 22 0.294 0.344 -8.555
213 H THR 23 H THR 23 3.482 2.144 -1.494
214 HA THR 23 HA THR 23 5.448 2.498 -3.613
215 HB THR 23 HB THR 23 5.911 2.159 -0.645
216 HG1 THR 23 1HG THR 23 5.970 4.376 -2.403
217 HG21 THR 23 1HG2 THR 23 7.655 1.136 -2.027
218 HG22 THR 23 2HG2 THR 23 8.281 2.537 -1.150
219 HG23 THR 23 3HG2 THR 23 7.899 2.657 -2.877
220 H ILE 24 H ILE 24 6.316 0.628 -4.421
221 HA ILE 24 HA ILE 24 5.191 -1.845 -3.456
222 HB ILE 24 HB ILE 24 7.064 -1.388 -5.812
223 HG12 ILE 24 2HG1 ILE 24 4.068 -1.792 -5.747
224 HG13 ILE 24 1HG1 ILE 24 4.871 -0.252 -6.056
225 HG21 ILE 24 1HG2 ILE 24 5.408 -3.794 -5.033
226 HG22 ILE 24 2HG2 ILE 24 7.165 -3.673 -4.955
227 HG23 ILE 24 3HG2 ILE 24 6.344 -3.632 -6.514
228 HD11 ILE 24 1HD1 ILE 24 5.035 -2.725 -7.772
229 HD12 ILE 24 2HD1 ILE 24 5.853 -1.196 -8.092
230 HD13 ILE 24 3HD1 ILE 24 4.090 -1.276 -8.117
231 H GLN 25 H GLN 25 6.136 -2.813 -1.847
232 HA GLN 25 HA GLN 25 8.982 -2.577 -1.452
233 HB2 GLN 25 2HB GLN 25 7.857 -2.367 0.551
234 HB3 GLN 25 1HB GLN 25 6.696 -3.624 0.235
235 HG2 GLN 25 2HG GLN 25 8.460 -5.284 0.532
236 HG3 GLN 25 1HG GLN 25 9.604 -3.981 0.857
237 HE21 GLN 25 1HE2 GLN 25 8.542 -6.221 2.502
238 HE22 GLN 25 2HE2 GLN 25 8.004 -5.487 3.961
239 H SER 26 H SER 26 10.304 -3.922 -2.332
240 HA SER 26 HA SER 26 9.289 -6.301 -3.567
241 HB2 SER 26 2HB SER 26 11.594 -6.448 -4.540
242 HB3 SER 26 1HB SER 26 10.752 -4.947 -4.915
243 HG SER 26 HG SER 26 11.985 -3.874 -3.426
244 H ASN 27 H ASN 27 9.731 -8.383 -2.954
245 HA ASN 27 HA ASN 27 10.549 -8.850 -0.317
246 HB2 ASN 27 2HB ASN 27 8.843 -10.025 -1.810
247 HB3 ASN 27 1HB ASN 27 10.221 -10.779 -2.590
248 HD21 ASN 27 1HD2 ASN 27 7.934 -11.732 -1.042
249 HD22 ASN 27 2HD2 ASN 27 8.600 -12.718 0.200
250 H GLU 28 H GLU 28 12.248 -8.367 -3.230
251 HA GLU 28 HA GLU 28 14.566 -9.867 -2.718
252 HB2 GLU 28 2HB GLU 28 13.854 -9.035 -4.916
253 HB3 GLU 28 1HB GLU 28 14.044 -7.386 -4.366
254 HG2 GLU 28 2HG GLU 28 16.269 -9.374 -4.584
255 HG3 GLU 28 1HG GLU 28 15.792 -8.273 -5.879
256 H ALA 29 H ALA 29 13.577 -6.492 -2.038
257 HA ALA 29 HA ALA 29 16.132 -5.964 -0.733
258 HB1 ALA 29 1HB ALA 29 15.394 -3.651 -0.633
259 HB2 ALA 29 2HB ALA 29 13.793 -4.121 -1.209
260 HB3 ALA 29 3HB ALA 29 15.196 -4.289 -2.265
261 H CYS 30 H CYS 30 12.848 -6.583 0.067
262 HA CYS 30 HA CYS 30 13.428 -6.088 2.906
263 HB2 CYS 30 2HB CYS 30 10.820 -6.019 1.403
264 HB3 CYS 30 1HB CYS 30 11.040 -5.678 3.117
265 H ASN 31 H ASN 31 12.146 -7.623 4.353
266 HA ASN 31 HA ASN 31 12.725 -10.232 3.350
267 HB2 ASN 31 2HB ASN 31 12.162 -11.128 5.568
268 HB3 ASN 31 1HB ASN 31 13.221 -9.738 5.710
269 HD21 ASN 31 1HD2 ASN 31 10.118 -11.056 6.379
270 HD22 ASN 31 2HD2 ASN 31 9.544 -9.802 7.402
271 H ILE 32 H ILE 32 9.922 -8.345 3.432
272 HA ILE 32 HA ILE 32 8.433 -10.593 2.239
273 HB ILE 32 HB ILE 32 6.330 -9.838 3.305
274 HG12 ILE 32 2HG1 ILE 32 8.096 -8.002 4.927
275 HG13 ILE 32 1HG1 ILE 32 6.956 -7.495 3.689
276 HG21 ILE 32 1HG2 ILE 32 8.494 -10.431 5.247
277 HG22 ILE 32 2HG2 ILE 32 7.559 -11.643 4.355
278 HG23 ILE 32 3HG2 ILE 32 6.763 -10.608 5.572
279 HD11 ILE 32 1HD1 ILE 32 6.272 -8.855 6.286
280 HD12 ILE 32 2HD1 ILE 32 5.118 -8.344 5.052
281 HD13 ILE 32 3HD1 ILE 32 6.071 -7.140 5.919
282 H LYS 33 H LYS 33 6.396 -9.660 1.118
283 HA LYS 33 HA LYS 33 7.103 -7.103 -0.052
284 HB2 LYS 33 2HB LYS 33 6.777 -8.881 -1.707
285 HB3 LYS 33 1HB LYS 33 5.209 -9.267 -1.026
286 HG2 LYS 33 2HG LYS 33 4.385 -7.038 -1.694
287 HG3 LYS 33 1HG LYS 33 5.955 -6.706 -2.415
288 HD2 LYS 33 2HD LYS 33 5.672 -8.514 -3.983
289 HD3 LYS 33 1HD LYS 33 4.158 -8.988 -3.216
290 HE2 LYS 33 2HE LYS 33 3.180 -6.828 -3.824
291 HE3 LYS 33 1HE LYS 33 4.696 -6.360 -4.597
292 HZ1 LYS 33 1HZ LYS 33 3.006 -8.669 -5.410
293 HZ2 LYS 33 2HZ LYS 33 4.418 -8.157 -6.162
294 HZ3 LYS 33 3HZ LYS 33 3.051 -7.170 -6.191
295 H ALA 34 H ALA 34 6.074 -5.462 0.931
296 HA ALA 34 HA ALA 34 3.269 -5.788 1.685
297 HB1 ALA 34 1HB ALA 34 4.594 -5.962 3.775
298 HB2 ALA 34 2HB ALA 34 3.708 -4.450 3.750
299 HB3 ALA 34 3HB ALA 34 5.426 -4.469 3.378
300 H ILE 35 H ILE 35 2.206 -4.365 0.423
301 HA ILE 35 HA ILE 35 3.577 -2.214 -0.857
302 HB ILE 35 HB ILE 35 0.612 -2.810 -0.668
303 HG12 ILE 35 2HG1 ILE 35 1.975 -4.574 -1.680
304 HG13 ILE 35 1HG1 ILE 35 0.863 -3.857 -2.856
305 HG21 ILE 35 1HG2 ILE 35 0.388 -1.331 -2.672
306 HG22 ILE 35 2HG2 ILE 35 2.085 -0.939 -2.538
307 HG23 ILE 35 3HG2 ILE 35 0.981 -0.468 -1.260
308 HD11 ILE 35 1HD1 ILE 35 2.944 -4.294 -3.871
309 HD12 ILE 35 2HD1 ILE 35 3.844 -3.444 -2.598
310 HD13 ILE 35 3HD1 ILE 35 2.795 -2.552 -3.717
311 H ILE 36 H ILE 36 3.863 -0.172 -0.166
312 HA ILE 36 HA ILE 36 2.690 0.440 2.434
313 HB ILE 36 HB ILE 36 4.909 1.958 1.021
314 HG12 ILE 36 2HG1 ILE 36 6.340 0.964 2.942
315 HG13 ILE 36 1HG1 ILE 36 5.059 -0.230 3.074
316 HG21 ILE 36 1HG2 ILE 36 3.717 3.340 2.570
317 HG22 ILE 36 2HG2 ILE 36 5.341 2.949 3.162
318 HG23 ILE 36 3HG2 ILE 36 3.936 2.121 3.843
319 HD11 ILE 36 1HD1 ILE 36 5.464 -0.870 0.779
320 HD12 ILE 36 2HD1 ILE 36 6.908 -1.020 1.796
321 HD13 ILE 36 3HD1 ILE 36 6.734 0.357 0.688
322 H PHE 37 H PHE 37 0.926 1.460 2.348
323 HA PHE 37 HA PHE 37 0.080 3.148 0.158
324 HB2 PHE 37 2HB PHE 37 -1.068 2.142 2.717
325 HB3 PHE 37 1HB PHE 37 -1.894 3.426 1.816
326 HD1 PHE 37 1HD PHE 37 -0.079 0.616 0.335
327 HD2 PHE 37 2HD PHE 37 -3.821 2.208 1.365
328 HE1 PHE 37 1HE PHE 37 -1.198 -1.108 -1.073
329 HE2 PHE 37 2HE PHE 37 -4.951 0.519 -0.017
330 HZ PHE 37 HZ PHE 37 -3.632 -1.132 -1.233
331 H THR 38 H THR 38 -0.014 5.269 0.173
332 HA THR 38 HA THR 38 0.751 6.573 2.666
333 HB THR 38 HB THR 38 1.410 7.533 -0.137
334 HG1 THR 38 1HG THR 38 2.468 5.592 1.071
335 HG21 THR 38 1HG2 THR 38 1.159 9.293 1.514
336 HG22 THR 38 2HG2 THR 38 2.872 9.120 1.084
337 HG23 THR 38 3HG2 THR 38 2.253 8.461 2.609
338 H THR 39 H THR 39 -0.588 8.157 3.326
339 HA THR 39 HA THR 39 -3.072 8.451 1.888
340 HB THR 39 HB THR 39 -3.692 9.828 3.927
341 HG1 THR 39 1HG THR 39 -1.853 8.696 5.469
342 HG21 THR 39 1HG2 THR 39 -4.367 7.494 3.701
343 HG22 THR 39 2HG2 THR 39 -3.947 7.851 5.377
344 HG23 THR 39 3HG2 THR 39 -2.815 6.972 4.347
345 H LYS 40 H LYS 40 -4.024 10.797 2.057
346 HA LYS 40 HA LYS 40 -2.322 12.548 0.590
347 HB2 LYS 40 2HB LYS 40 -4.730 13.442 2.139
348 HB3 LYS 40 1HB LYS 40 -4.155 14.070 0.604
349 HG2 LYS 40 2HG LYS 40 -4.855 11.590 -0.270
350 HG3 LYS 40 1HG LYS 40 -5.752 11.642 1.195
351 HD2 LYS 40 2HD LYS 40 -6.981 13.575 0.583
352 HD3 LYS 40 1HD LYS 40 -5.985 13.794 -0.862
353 HE2 LYS 40 2HE LYS 40 -6.761 11.655 -1.728
354 HE3 LYS 40 1HE LYS 40 -7.762 11.430 -0.307
355 HZ1 LYS 40 1HZ LYS 40 -8.990 13.466 -0.931
356 HZ2 LYS 40 2HZ LYS 40 -9.102 12.267 -2.109
357 HZ3 LYS 40 3HZ LYS 40 -8.074 13.565 -2.347
358 H LYS 41 H LYS 41 -2.905 11.910 3.853
359 HA LYS 41 HA LYS 41 -1.747 14.270 5.008
360 HB2 LYS 41 2HB LYS 41 -2.121 11.496 6.161
361 HB3 LYS 41 1HB LYS 41 -1.778 12.942 7.080
362 HG2 LYS 41 2HG LYS 41 -3.889 13.887 6.336
363 HG3 LYS 41 1HG LYS 41 -4.155 12.367 5.470
364 HD2 LYS 41 2HD LYS 41 -4.091 11.132 7.585
365 HD3 LYS 41 1HD LYS 41 -3.843 12.648 8.457
366 HE2 LYS 41 2HE LYS 41 -6.262 11.923 6.803
367 HE3 LYS 41 1HE LYS 41 -6.184 11.928 8.562
368 HZ1 LYS 41 1HZ LYS 41 -5.858 14.308 6.805
369 HZ2 LYS 41 2HZ LYS 41 -5.778 14.320 8.491
370 HZ3 LYS 41 3HZ LYS 41 -7.219 13.923 7.710
371 H GLY 42 H GLY 42 -0.645 11.579 3.362
372 HA2 GLY 42 2HA GLY 42 1.420 11.060 2.677
373 HA3 GLY 42 1HA GLY 42 2.051 12.338 3.682
374 H ARG 43 H ARG 43 0.058 10.201 5.350
375 HA ARG 43 HA ARG 43 2.188 9.081 6.920
376 HB2 ARG 43 2HB ARG 43 -0.677 8.286 6.674
377 HB3 ARG 43 1HB ARG 43 0.424 7.629 7.877
378 HG2 ARG 43 2HG ARG 43 0.693 9.916 8.810
379 HG3 ARG 43 1HG ARG 43 -0.505 10.493 7.648
380 HD2 ARG 43 2HD ARG 43 -1.522 10.075 9.846
381 HD3 ARG 43 1HD ARG 43 -2.181 8.996 8.615
382 HE ARG 43 HE ARG 43 -0.236 7.494 9.651
383 HH11 ARG 43 1HH1 ARG 43 -2.754 9.385 11.290
384 HH12 ARG 43 2HH1 ARG 43 -2.837 8.349 12.632
385 HH21 ARG 43 1HH2 ARG 43 -0.347 6.106 11.481
386 HH22 ARG 43 2HH2 ARG 43 -1.424 6.444 12.760
387 H LYS 44 H LYS 44 2.797 6.859 7.059
388 HA LYS 44 HA LYS 44 2.537 5.442 4.501
389 HB2 LYS 44 2HB LYS 44 4.625 5.208 6.674
390 HB3 LYS 44 1HB LYS 44 4.592 4.238 5.211
391 HG2 LYS 44 2HG LYS 44 4.877 7.244 5.281
392 HG3 LYS 44 1HG LYS 44 6.209 6.104 5.089
393 HD2 LYS 44 2HD LYS 44 5.211 5.287 3.022
394 HD3 LYS 44 1HD LYS 44 3.851 6.389 3.228
395 HE2 LYS 44 2HE LYS 44 5.349 8.298 3.059
396 HE3 LYS 44 1HE LYS 44 6.732 7.216 2.906
397 HZ1 LYS 44 1HZ LYS 44 4.453 7.235 1.020
398 HZ2 LYS 44 2HZ LYS 44 5.908 6.421 0.841
399 HZ3 LYS 44 3HZ LYS 44 5.873 8.106 0.740
400 H ILE 45 H ILE 45 1.356 3.697 4.437
401 HA ILE 45 HA ILE 45 0.717 2.282 6.937
402 HB ILE 45 HB ILE 45 -1.089 2.601 4.517
403 HG12 ILE 45 2HG1 ILE 45 -2.614 3.884 6.217
404 HG13 ILE 45 1HG1 ILE 45 -1.137 4.034 7.167
405 HG21 ILE 45 1HG2 ILE 45 -1.640 1.309 7.172
406 HG22 ILE 45 2HG2 ILE 45 -1.462 0.508 5.610
407 HG23 ILE 45 3HG2 ILE 45 -2.833 1.579 5.904
408 HD11 ILE 45 1HD1 ILE 45 -1.603 6.028 5.903
409 HD12 ILE 45 2HD1 ILE 45 -1.537 5.102 4.401
410 HD13 ILE 45 3HD1 ILE 45 -0.091 5.276 5.396
411 H CYS 46 H CYS 46 1.677 0.356 6.857
412 HA CYS 46 HA CYS 46 2.527 -0.900 4.377
413 HB2 CYS 46 2HB CYS 46 2.536 -1.929 7.207
414 HB3 CYS 46 1HB CYS 46 3.463 -2.637 5.907
415 H ALA 47 H ALA 47 1.064 -2.016 3.153
416 HA ALA 47 HA ALA 47 -1.086 -3.360 4.634
417 HB1 ALA 47 1HB ALA 47 -1.217 -2.166 1.878
418 HB2 ALA 47 2HB ALA 47 -1.861 -1.431 3.350
419 HB3 ALA 47 3HB ALA 47 -2.536 -2.946 2.753
420 H ASN 48 H ASN 48 -1.798 -5.373 3.949
421 HA ASN 48 HA ASN 48 0.152 -7.013 2.701
422 HB2 ASN 48 2HB ASN 48 -1.049 -8.004 4.443
423 HB3 ASN 48 1HB ASN 48 -2.611 -7.511 3.848
424 HD21 ASN 48 1HD2 ASN 48 0.040 -9.067 2.103
425 HD22 ASN 48 2HD2 ASN 48 -0.900 -10.484 1.701
426 HA PRO 49 HA PRO 49 -1.185 -5.977 -1.458
427 HB2 PRO 49 2HB PRO 49 0.437 -7.814 -2.654
428 HB3 PRO 49 1HB PRO 49 0.934 -6.170 -2.255
429 HG2 PRO 49 2HG PRO 49 1.433 -8.720 -0.796
430 HG3 PRO 49 1HG PRO 49 2.506 -7.324 -1.002
431 HD2 PRO 49 2HD PRO 49 1.225 -7.763 1.291
432 HD3 PRO 49 1HD PRO 49 1.460 -6.117 0.683
433 H ASN 50 H ASN 50 -1.215 -9.034 0.089
434 HA ASN 50 HA ASN 50 -2.682 -10.178 -2.053
435 HB2 ASN 50 2HB ASN 50 -1.826 -11.397 0.552
436 HB3 ASN 50 1HB ASN 50 -2.912 -12.227 -0.559
437 HD21 ASN 50 1HD2 ASN 50 0.401 -11.124 -0.054
438 HD22 ASN 50 2HD2 ASN 50 1.060 -11.965 -1.373
439 H GLU 51 H GLU 51 -3.571 -8.056 0.194
440 HA GLU 51 HA GLU 51 -6.170 -9.229 0.724
441 HB2 GLU 51 2HB GLU 51 -5.222 -6.440 1.394
442 HB3 GLU 51 1HB GLU 51 -6.707 -7.192 1.936
443 HG2 GLU 51 2HG GLU 51 -5.121 -8.964 3.046
444 HG3 GLU 51 1HG GLU 51 -3.935 -7.773 2.613
445 H LYS 52 H LYS 52 -7.942 -8.817 -0.286
446 HA LYS 52 HA LYS 52 -8.016 -7.961 -2.899
447 HB2 LYS 52 2HB LYS 52 -9.733 -9.379 -1.900
448 HB3 LYS 52 1HB LYS 52 -10.272 -8.054 -0.889
449 HG2 LYS 52 2HG LYS 52 -10.994 -6.830 -2.871
450 HG3 LYS 52 1HG LYS 52 -10.451 -8.167 -3.888
451 HD2 LYS 52 2HD LYS 52 -12.021 -9.666 -2.754
452 HD3 LYS 52 1HD LYS 52 -12.560 -8.334 -1.732
453 HE2 LYS 52 2HE LYS 52 -14.138 -8.689 -3.538
454 HE3 LYS 52 1HE LYS 52 -13.326 -7.138 -3.734
455 HZ1 LYS 52 1HZ LYS 52 -12.680 -9.637 -5.208
456 HZ2 LYS 52 2HZ LYS 52 -11.856 -8.214 -5.397
457 HZ3 LYS 52 3HZ LYS 52 -13.479 -8.309 -5.838
458 H TRP 53 H TRP 53 -8.689 -6.049 0.035
459 HA TRP 53 HA TRP 53 -9.619 -3.783 -1.372
460 HB2 TRP 53 2HB TRP 53 -9.441 -2.500 0.677
461 HB3 TRP 53 1HB TRP 53 -10.052 -4.089 1.075
462 HD1 TRP 53 HD TRP 53 -8.327 -5.707 2.522
463 HE1 TRP 53 1HE TRP 53 -6.411 -5.108 4.050
464 HE3 TRP 53 3HE TRP 53 -7.527 -0.892 0.984
465 HZ2 TRP 53 2HZ TRP 53 -4.727 -2.912 4.572
466 HZ3 TRP 53 3HZ TRP 53 -5.727 0.377 2.062
467 HH2 TRP 53 HH TRP 53 -4.357 -0.609 3.817
468 H VAL 54 H VAL 54 -6.461 -4.875 -0.539
469 HA VAL 54 HA VAL 54 -5.091 -2.446 -1.092
470 HB VAL 54 HB VAL 54 -4.078 -5.299 -0.868
471 HG11 VAL 54 1HG1 VAL 54 -2.490 -2.735 -1.023
472 HG12 VAL 54 2HG1 VAL 54 -2.516 -4.005 -2.246
473 HG13 VAL 54 3HG1 VAL 54 -1.829 -4.309 -0.639
474 HG21 VAL 54 1HG2 VAL 54 -3.939 -2.968 1.009
475 HG22 VAL 54 2HG2 VAL 54 -3.258 -4.573 1.297
476 HG23 VAL 54 3HG2 VAL 54 -5.006 -4.358 1.168
477 H GLN 55 H GLN 55 -5.727 -5.407 -2.818
478 HA GLN 55 HA GLN 55 -4.266 -4.782 -5.120
479 HB2 GLN 55 2HB GLN 55 -6.653 -6.589 -4.850
480 HB3 GLN 55 1HB GLN 55 -5.483 -6.595 -6.177
481 HG2 GLN 55 2HG GLN 55 -3.703 -6.959 -4.485
482 HG3 GLN 55 1HG GLN 55 -4.972 -7.195 -3.298
483 HE21 GLN 55 1HE2 GLN 55 -2.934 -8.868 -4.147
484 HE22 GLN 55 2HE2 GLN 55 -3.611 -10.308 -4.761
485 H LYS 56 H LYS 56 -7.574 -4.245 -4.122
486 HA LYS 56 HA LYS 56 -8.690 -3.116 -6.418
487 HB2 LYS 56 2HB LYS 56 -9.968 -3.859 -4.479
488 HB3 LYS 56 1HB LYS 56 -9.203 -2.637 -3.485
489 HG2 LYS 56 2HG LYS 56 -10.240 -0.904 -4.805
490 HG3 LYS 56 1HG LYS 56 -11.031 -2.138 -5.802
491 HD2 LYS 56 2HD LYS 56 -12.167 -2.988 -3.831
492 HD3 LYS 56 1HD LYS 56 -11.380 -1.766 -2.832
493 HE2 LYS 56 2HE LYS 56 -12.483 -0.009 -4.161
494 HE3 LYS 56 1HE LYS 56 -13.298 -1.253 -5.106
495 HZ1 LYS 56 1HZ LYS 56 -14.350 -2.027 -3.043
496 HZ2 LYS 56 2HZ LYS 56 -14.733 -0.418 -3.375
497 HZ3 LYS 56 3HZ LYS 56 -13.597 -0.778 -2.200
498 H ALA 57 H ALA 57 -7.026 -1.688 -3.632
499 HA ALA 57 HA ALA 57 -7.187 0.991 -4.488
500 HB1 ALA 57 1HB ALA 57 -5.451 1.419 -2.810
501 HB2 ALA 57 2HB ALA 57 -5.223 -0.311 -2.600
502 HB3 ALA 57 3HB ALA 57 -6.768 0.453 -2.157
503 H MET 58 H MET 58 -4.645 -1.435 -4.809
504 HA MET 58 HA MET 58 -2.788 0.214 -5.935
505 HB2 MET 58 2HB MET 58 -3.040 -2.768 -6.255
506 HB3 MET 58 1HB MET 58 -1.697 -1.845 -6.912
507 HG2 MET 58 2HG MET 58 -1.276 -1.015 -4.568
508 HG3 MET 58 1HG MET 58 -2.446 -2.209 -4.021
509 HE1 MET 58 1HE MET 58 -0.602 -5.543 -5.024
510 HE2 MET 58 2HE MET 58 -1.821 -4.702 -5.994
511 HE3 MET 58 3HE MET 58 -2.045 -4.889 -4.244
512 H LYS 59 H LYS 59 -5.378 -1.500 -7.483
513 HA LYS 59 HA LYS 59 -4.518 -0.912 -10.108
514 HB2 LYS 59 2HB LYS 59 -7.261 -1.558 -9.050
515 HB3 LYS 59 1HB LYS 59 -6.902 -1.383 -10.760
516 HG2 LYS 59 2HG LYS 59 -5.272 -3.228 -10.579
517 HG3 LYS 59 1HG LYS 59 -5.718 -3.421 -8.888
518 HD2 LYS 59 2HD LYS 59 -7.635 -3.686 -11.205
519 HD3 LYS 59 1HD LYS 59 -6.842 -5.041 -10.411
520 HE2 LYS 59 2HE LYS 59 -7.930 -4.418 -8.301
521 HE3 LYS 59 1HE LYS 59 -8.719 -3.064 -9.109
522 HZ1 LYS 59 1HZ LYS 59 -10.168 -4.982 -8.906
523 HZ2 LYS 59 2HZ LYS 59 -9.113 -5.928 -9.809
524 HZ3 LYS 59 3HZ LYS 59 -9.889 -4.621 -10.523
525 H HIS 60 H HIS 60 -6.683 0.767 -7.870
526 HA HIS 60 HA HIS 60 -7.373 2.792 -9.705
527 HB2 HIS 60 2HB HIS 60 -8.836 2.287 -7.926
528 HB3 HIS 60 1HB HIS 60 -7.574 2.540 -6.716
529 HD1 HIS 60 1HD HIS 60 -9.901 4.424 -9.031
530 HD2 HIS 60 2HD HIS 60 -7.326 5.111 -5.873
531 HE1 HIS 60 1HE HIS 60 -10.344 6.798 -8.332
532 HE2 HIS 60 2HE HIS 60 -8.921 7.123 -6.276
533 H LEU 61 H LEU 61 -4.832 2.439 -7.342
534 HA LEU 61 HA LEU 61 -4.007 5.166 -7.507
535 HB2 LEU 61 2HB LEU 61 -2.626 2.745 -6.382
536 HB3 LEU 61 1HB LEU 61 -2.023 4.384 -6.222
537 HG LEU 61 HG LEU 61 -4.693 3.451 -5.152
538 HD11 LEU 61 1HD1 LEU 61 -2.074 3.859 -3.716
539 HD12 LEU 61 2HD1 LEU 61 -2.963 2.332 -3.935
540 HD13 LEU 61 3HD1 LEU 61 -3.645 3.616 -2.959
541 HD21 LEU 61 1HD2 LEU 61 -3.128 5.987 -4.731
542 HD22 LEU 61 2HD2 LEU 61 -4.626 5.558 -3.900
543 HD23 LEU 61 3HD2 LEU 61 -4.631 5.834 -5.645
544 H ASP 62 H ASP 62 -3.279 2.349 -9.370
545 HA ASP 62 HA ASP 62 -0.915 3.551 -10.595
546 HB2 ASP 62 2HB ASP 62 -0.949 1.146 -10.238
547 HB3 ASP 62 1HB ASP 62 -2.440 1.050 -11.180
548 H LYS 63 H LYS 63 -4.290 2.995 -11.316
549 HA LYS 63 HA LYS 63 -3.992 4.885 -13.410
550 HB2 LYS 63 2HB LYS 63 -5.804 3.683 -14.787
551 HB3 LYS 63 1HB LYS 63 -4.162 3.096 -14.872
552 HG2 LYS 63 2HG LYS 63 -6.231 1.821 -13.090
553 HG3 LYS 63 1HG LYS 63 -6.036 1.406 -14.798
554 HD2 LYS 63 2HD LYS 63 -3.680 0.807 -14.367
555 HD3 LYS 63 1HD LYS 63 -3.905 1.213 -12.669
556 HE2 LYS 63 2HE LYS 63 -5.522 -0.574 -12.426
557 HE3 LYS 63 1HE LYS 63 -5.419 -0.936 -14.149
558 HZ1 LYS 63 1HZ LYS 63 -3.168 -1.236 -12.194
559 HZ2 LYS 63 2HZ LYS 63 -3.104 -1.538 -13.844
560 HZ3 LYS 63 3HZ LYS 63 -4.070 -2.486 -12.891
561 H LYS 64 H LYS 64 -4.571 6.318 -12.169
562 HA LYS 64 HA LYS 64 -7.290 6.346 -11.109
563 HB2 LYS 64 2HB LYS 64 -6.390 8.381 -9.820
564 HB3 LYS 64 1HB LYS 64 -5.770 6.797 -9.371
565 HG2 LYS 64 2HG LYS 64 -3.787 7.213 -10.774
566 HG3 LYS 64 1HG LYS 64 -4.373 8.849 -11.088
567 HD2 LYS 64 2HD LYS 64 -4.213 9.351 -8.717
568 HD3 LYS 64 1HD LYS 64 -3.726 7.688 -8.377
569 HE2 LYS 64 2HE LYS 64 -2.206 9.680 -10.062
570 HE3 LYS 64 1HE LYS 64 -1.780 9.165 -8.432
571 HZ1 LYS 64 1HZ LYS 64 -1.431 6.886 -9.300
572 HZ2 LYS 64 2HZ LYS 64 -0.478 7.997 -10.110
573 HZ3 LYS 64 3HZ LYS 64 -1.857 7.409 -10.840
Start of MODEL 10
1 H1 ALA 1 1HT ALA 1 13.894 7.832 2.736
2 H2 ALA 1 2HT ALA 1 12.819 6.671 3.332
3 H3 ALA 1 3HT ALA 1 14.352 6.213 2.877
4 HA ALA 1 HA ALA 1 15.309 7.442 4.702
5 HB1 ALA 1 1HB ALA 1 13.617 9.226 4.766
6 HB2 ALA 1 2HB ALA 1 13.839 8.477 6.349
7 HB3 ALA 1 3HB ALA 1 12.437 8.061 5.372
8 H ARG 2 H ARG 2 15.796 6.181 6.462
9 HA ARG 2 HA ARG 2 15.830 4.429 7.849
10 HB2 ARG 2 2HB ARG 2 12.825 4.320 7.385
11 HB3 ARG 2 1HB ARG 2 13.688 3.433 8.632
12 HG2 ARG 2 2HG ARG 2 13.658 6.435 8.437
13 HG3 ARG 2 1HG ARG 2 12.514 5.499 9.400
14 HD2 ARG 2 2HD ARG 2 15.514 5.407 9.716
15 HD3 ARG 2 1HD ARG 2 14.433 6.384 10.703
16 HE ARG 2 HE ARG 2 13.451 3.824 10.798
17 HH11 ARG 2 1HH1 ARG 2 16.453 5.404 11.787
18 HH12 ARG 2 2HH1 ARG 2 16.738 4.349 13.086
19 HH21 ARG 2 1HH2 ARG 2 13.802 2.437 12.521
20 HH22 ARG 2 2HH2 ARG 2 15.183 2.583 13.534
21 H LYS 3 H LYS 3 13.191 3.204 5.953
22 HA LYS 3 HA LYS 3 14.680 1.645 4.128
23 HB2 LYS 3 2HB LYS 3 13.346 0.264 6.484
24 HB3 LYS 3 1HB LYS 3 13.557 -0.537 4.945
25 HG2 LYS 3 2HG LYS 3 15.810 0.525 6.647
26 HG3 LYS 3 1HG LYS 3 15.255 -1.153 6.644
27 HD2 LYS 3 2HD LYS 3 15.797 -1.327 4.260
28 HD3 LYS 3 1HD LYS 3 16.330 0.354 4.254
29 HE2 LYS 3 2HE LYS 3 18.109 -0.196 5.829
30 HE3 LYS 3 1HE LYS 3 17.548 -1.866 5.895
31 HZ1 LYS 3 1HZ LYS 3 18.168 -2.159 3.597
32 HZ2 LYS 3 2HZ LYS 3 19.465 -1.508 4.401
33 HZ3 LYS 3 3HZ LYS 3 18.542 -0.539 3.410
34 H SER 4 H SER 4 13.293 1.008 2.492
35 HA SER 4 HA SER 4 10.565 2.005 2.691
36 HB2 SER 4 2HB SER 4 12.078 0.775 0.352
37 HB3 SER 4 1HB SER 4 10.520 1.598 0.263
38 HG SER 4 HG SER 4 13.032 2.663 0.948
39 H CYS 5 H CYS 5 11.476 -0.221 4.241
40 HA CYS 5 HA CYS 5 10.018 -2.486 3.091
41 HB2 CYS 5 2HB CYS 5 12.300 -2.530 5.076
42 HB3 CYS 5 1HB CYS 5 11.459 -3.932 4.438
43 H CYS 6 H CYS 6 8.469 -3.334 4.277
44 HA CYS 6 HA CYS 6 7.986 -2.426 7.005
45 HB2 CYS 6 2HB CYS 6 6.237 -3.401 4.799
46 HB3 CYS 6 1HB CYS 6 5.656 -3.151 6.449
47 H LEU 7 H LEU 7 7.704 -4.027 8.477
48 HA LEU 7 HA LEU 7 8.237 -6.749 7.568
49 HB2 LEU 7 2HB LEU 7 8.542 -5.522 10.323
50 HB3 LEU 7 1HB LEU 7 8.754 -7.223 9.989
51 HG LEU 7 HG LEU 7 10.683 -6.610 8.488
52 HD11 LEU 7 1HD1 LEU 7 11.731 -4.423 8.732
53 HD12 LEU 7 2HD1 LEU 7 10.361 -3.872 9.697
54 HD13 LEU 7 3HD1 LEU 7 10.128 -4.304 8.002
55 HD21 LEU 7 1HD2 LEU 7 11.046 -7.414 10.743
56 HD22 LEU 7 2HD2 LEU 7 10.886 -5.775 11.372
57 HD23 LEU 7 3HD2 LEU 7 12.244 -6.188 10.323
58 H LYS 8 H LYS 8 5.830 -4.715 8.756
59 HA LYS 8 HA LYS 8 4.105 -7.019 9.314
60 HB2 LYS 8 2HB LYS 8 3.998 -4.284 10.584
61 HB3 LYS 8 1HB LYS 8 2.845 -5.574 10.870
62 HG2 LYS 8 2HG LYS 8 4.677 -6.934 11.838
63 HG3 LYS 8 1HG LYS 8 5.765 -5.562 11.627
64 HD2 LYS 8 2HD LYS 8 3.245 -5.563 13.296
65 HD3 LYS 8 1HD LYS 8 4.884 -5.699 13.931
66 HE2 LYS 8 2HE LYS 8 5.391 -3.459 13.061
67 HE3 LYS 8 1HE LYS 8 3.764 -3.349 12.391
68 HZ1 LYS 8 1HZ LYS 8 2.858 -3.413 14.608
69 HZ2 LYS 8 2HZ LYS 8 3.987 -2.189 14.504
70 HZ3 LYS 8 3HZ LYS 8 4.380 -3.620 15.294
71 H TYR 9 H TYR 9 1.816 -6.521 8.899
72 HA TYR 9 HA TYR 9 1.437 -4.550 6.758
73 HB2 TYR 9 2HB TYR 9 -0.388 -7.008 7.118
74 HB3 TYR 9 1HB TYR 9 -0.208 -5.910 5.815
75 HD1 TYR 9 1HD TYR 9 1.333 -6.175 4.133
76 HD2 TYR 9 2HD TYR 9 1.403 -8.788 7.457
77 HE1 TYR 9 1HE TYR 9 2.796 -7.718 2.878
78 HE2 TYR 9 2HE TYR 9 2.871 -10.342 6.224
79 HH TYR 9 HH TYR 9 4.400 -9.414 3.334
80 H THR 10 H THR 10 -0.578 -3.367 6.964
81 HA THR 10 HA THR 10 -1.293 -2.896 9.619
82 HB THR 10 HB THR 10 -1.370 -1.055 8.037
83 HG1 THR 10 1HG THR 10 -4.019 -0.935 8.360
84 HG21 THR 10 1HG2 THR 10 -3.127 -0.917 6.301
85 HG22 THR 10 2HG2 THR 10 -3.569 -2.602 6.633
86 HG23 THR 10 3HG2 THR 10 -1.957 -2.196 6.019
87 H LYS 11 H LYS 11 -3.124 -3.379 10.690
88 HA LYS 11 HA LYS 11 -4.557 -5.726 9.733
89 HB2 LYS 11 2HB LYS 11 -4.704 -4.335 12.407
90 HB3 LYS 11 1HB LYS 11 -5.310 -5.942 12.018
91 HG2 LYS 11 2HG LYS 11 -3.029 -6.702 11.605
92 HG3 LYS 11 1HG LYS 11 -2.425 -5.096 12.012
93 HD2 LYS 11 2HD LYS 11 -3.455 -5.352 14.258
94 HD3 LYS 11 1HD LYS 11 -3.884 -7.005 13.823
95 HE2 LYS 11 2HE LYS 11 -1.096 -5.862 13.958
96 HE3 LYS 11 1HE LYS 11 -1.825 -6.972 15.116
97 HZ1 LYS 11 1HZ LYS 11 -1.957 -8.635 13.360
98 HZ2 LYS 11 2HZ LYS 11 -0.368 -8.117 13.588
99 HZ3 LYS 11 3HZ LYS 11 -1.243 -7.577 12.258
100 H ARG 12 H ARG 12 -4.882 -2.382 10.043
101 HA ARG 12 HA ARG 12 -7.790 -2.509 9.795
102 HB2 ARG 12 2HB ARG 12 -6.954 -1.168 11.676
103 HB3 ARG 12 1HB ARG 12 -5.986 -0.205 10.573
104 HG2 ARG 12 2HG ARG 12 -8.006 0.654 9.530
105 HG3 ARG 12 1HG ARG 12 -8.997 -0.339 10.594
106 HD2 ARG 12 2HD ARG 12 -8.074 0.834 12.538
107 HD3 ARG 12 1HD ARG 12 -7.097 1.833 11.475
108 HE ARG 12 HE ARG 12 -9.942 1.910 10.967
109 HH11 ARG 12 1HH1 ARG 12 -7.221 3.415 12.680
110 HH12 ARG 12 2HH1 ARG 12 -8.012 4.886 12.929
111 HH21 ARG 12 1HH2 ARG 12 -11.013 3.931 11.309
112 HH22 ARG 12 2HH2 ARG 12 -10.232 5.213 12.134
113 HA PRO 13 HA PRO 13 -6.986 -1.552 5.494
114 HB2 PRO 13 2HB PRO 13 -9.565 -1.217 4.736
115 HB3 PRO 13 1HB PRO 13 -8.856 -2.808 5.020
116 HG2 PRO 13 2HG PRO 13 -10.563 -1.147 6.829
117 HG3 PRO 13 1HG PRO 13 -10.662 -2.885 6.492
118 HD2 PRO 13 2HD PRO 13 -9.499 -1.915 8.715
119 HD3 PRO 13 1HD PRO 13 -8.917 -3.390 7.914
120 H LEU 14 H LEU 14 -7.280 0.240 4.053
121 HA LEU 14 HA LEU 14 -7.964 2.789 5.357
122 HB2 LEU 14 2HB LEU 14 -6.214 2.216 2.974
123 HB3 LEU 14 1HB LEU 14 -6.615 3.808 3.560
124 HG LEU 14 HG LEU 14 -4.971 1.769 5.057
125 HD11 LEU 14 1HD1 LEU 14 -3.895 2.579 3.021
126 HD12 LEU 14 2HD1 LEU 14 -3.099 3.253 4.437
127 HD13 LEU 14 3HD1 LEU 14 -4.221 4.240 3.496
128 HD21 LEU 14 1HD2 LEU 14 -6.162 3.353 6.519
129 HD22 LEU 14 2HD2 LEU 14 -5.524 4.692 5.565
130 HD23 LEU 14 3HD2 LEU 14 -4.419 3.687 6.491
131 HA PRO 15 HA PRO 15 -11.033 2.943 2.044
132 HB2 PRO 15 2HB PRO 15 -11.202 5.823 2.546
133 HB3 PRO 15 1HB PRO 15 -12.449 4.600 2.795
134 HG2 PRO 15 2HG PRO 15 -11.226 5.882 4.852
135 HG3 PRO 15 1HG PRO 15 -11.837 4.225 4.977
136 HD2 PRO 15 2HD PRO 15 -9.035 5.189 4.580
137 HD3 PRO 15 1HD PRO 15 -9.647 3.838 5.563
138 H LEU 16 H LEU 16 -10.656 3.378 -0.086
139 HA LEU 16 HA LEU 16 -8.124 4.290 -0.902
140 HB2 LEU 16 2HB LEU 16 -9.255 2.686 -2.216
141 HB3 LEU 16 1HB LEU 16 -10.642 3.779 -2.449
142 HG LEU 16 HG LEU 16 -9.094 5.185 -3.785
143 HD11 LEU 16 1HD1 LEU 16 -6.986 4.169 -4.544
144 HD12 LEU 16 2HD1 LEU 16 -7.248 2.824 -3.434
145 HD13 LEU 16 3HD1 LEU 16 -6.986 4.450 -2.808
146 HD21 LEU 16 1HD2 LEU 16 -9.475 2.332 -4.564
147 HD22 LEU 16 2HD2 LEU 16 -9.162 3.692 -5.678
148 HD23 LEU 16 3HD2 LEU 16 -10.637 3.669 -4.701
149 H LYS 17 H LYS 17 -11.126 5.807 -0.547
150 HA LYS 17 HA LYS 17 -10.827 8.246 -1.863
151 HB2 LYS 17 2HB LYS 17 -12.126 7.705 0.803
152 HB3 LYS 17 1HB LYS 17 -12.368 9.146 -0.165
153 HG2 LYS 17 2HG LYS 17 -13.428 7.878 -1.886
154 HG3 LYS 17 1HG LYS 17 -13.062 6.361 -1.065
155 HD2 LYS 17 2HD LYS 17 -14.457 7.093 0.824
156 HD3 LYS 17 1HD LYS 17 -14.851 8.571 -0.052
157 HE2 LYS 17 2HE LYS 17 -15.845 7.220 -1.847
158 HE3 LYS 17 1HE LYS 17 -15.453 5.756 -0.951
159 HZ1 LYS 17 1HZ LYS 17 -17.743 6.369 -0.593
160 HZ2 LYS 17 2HZ LYS 17 -17.306 7.899 -0.052
161 HZ3 LYS 17 3HZ LYS 17 -16.901 6.545 0.844
162 H ARG 18 H ARG 18 -8.868 7.027 0.597
163 HA ARG 18 HA ARG 18 -8.103 9.760 1.515
164 HB2 ARG 18 2HB ARG 18 -8.017 7.239 3.169
165 HB3 ARG 18 1HB ARG 18 -7.626 8.861 3.710
166 HG2 ARG 18 2HG ARG 18 -10.342 7.895 2.842
167 HG3 ARG 18 1HG ARG 18 -9.820 8.136 4.501
168 HD2 ARG 18 2HD ARG 18 -10.053 10.277 2.380
169 HD3 ARG 18 1HD ARG 18 -11.208 9.982 3.675
170 HE ARG 18 HE ARG 18 -8.481 10.547 4.481
171 HH11 ARG 18 1HH1 ARG 18 -11.755 11.810 3.979
172 HH12 ARG 18 2HH1 ARG 18 -11.503 13.217 4.913
173 HH21 ARG 18 1HH2 ARG 18 -8.160 12.488 5.767
174 HH22 ARG 18 2HH2 ARG 18 -9.426 13.615 5.916
175 H ILE 19 H ILE 19 -7.017 7.521 -0.451
176 HA ILE 19 HA ILE 19 -4.300 7.396 0.670
177 HB ILE 19 HB ILE 19 -5.506 5.629 -1.495
178 HG12 ILE 19 2HG1 ILE 19 -4.964 4.927 1.384
179 HG13 ILE 19 1HG1 ILE 19 -6.564 5.394 0.796
180 HG21 ILE 19 1HG2 ILE 19 -2.941 5.360 0.132
181 HG22 ILE 19 2HG2 ILE 19 -3.024 5.794 -1.571
182 HG23 ILE 19 3HG2 ILE 19 -3.526 4.193 -1.042
183 HD11 ILE 19 1HD1 ILE 19 -6.517 3.439 -0.729
184 HD12 ILE 19 2HD1 ILE 19 -6.350 2.969 0.963
185 HD13 ILE 19 3HD1 ILE 19 -4.949 3.036 -0.125
186 H LYS 20 H LYS 20 -2.727 8.407 -0.404
187 HA LYS 20 HA LYS 20 -3.423 9.885 -2.775
188 HB2 LYS 20 2HB LYS 20 -0.797 9.895 -1.251
189 HB3 LYS 20 1HB LYS 20 -1.256 11.024 -2.498
190 HG2 LYS 20 2HG LYS 20 -2.464 10.737 0.178
191 HG3 LYS 20 1HG LYS 20 -1.452 12.045 -0.423
192 HD2 LYS 20 2HD LYS 20 -4.225 11.305 -1.315
193 HD3 LYS 20 1HD LYS 20 -3.808 12.649 -0.307
194 HE2 LYS 20 2HE LYS 20 -4.177 13.629 -2.443
195 HE3 LYS 20 1HE LYS 20 -2.440 13.612 -2.201
196 HZ1 LYS 20 1HZ LYS 20 -3.115 12.987 -4.439
197 HZ2 LYS 20 2HZ LYS 20 -3.960 11.670 -3.876
198 HZ3 LYS 20 3HZ LYS 20 -2.276 11.740 -3.724
199 H SER 21 H SER 21 -1.107 7.295 -1.810
200 HA SER 21 HA SER 21 -0.903 6.158 -4.349
201 HB2 SER 21 2HB SER 21 1.478 6.814 -4.848
202 HB3 SER 21 1HB SER 21 0.313 8.124 -5.046
203 HG SER 21 HG SER 21 2.346 7.754 -3.231
204 H TYR 22 H TYR 22 1.163 4.618 -4.385
205 HA TYR 22 HA TYR 22 1.889 3.829 -1.640
206 HB2 TYR 22 2HB TYR 22 1.387 1.531 -2.027
207 HB3 TYR 22 1HB TYR 22 -0.049 2.448 -2.419
208 HD1 TYR 22 1HD TYR 22 -1.043 2.179 -4.509
209 HD2 TYR 22 2HD TYR 22 2.867 0.710 -3.917
210 HE1 TYR 22 1HE TYR 22 -1.156 0.969 -6.661
211 HE2 TYR 22 2HE TYR 22 2.768 -0.475 -6.041
212 HH TYR 22 HH TYR 22 0.352 -0.008 -8.359
213 H THR 23 H THR 23 3.564 2.174 -1.646
214 HA THR 23 HA THR 23 5.517 2.474 -3.836
215 HB THR 23 HB THR 23 6.010 2.081 -0.870
216 HG1 THR 23 1HG THR 23 6.058 4.286 -2.581
217 HG21 THR 23 1HG2 THR 23 7.685 0.979 -2.254
218 HG22 THR 23 2HG2 THR 23 8.393 2.368 -1.418
219 HG23 THR 23 3HG2 THR 23 7.979 2.476 -3.137
220 H ILE 24 H ILE 24 6.368 0.549 -4.634
221 HA ILE 24 HA ILE 24 5.134 -1.913 -3.718
222 HB ILE 24 HB ILE 24 7.032 -1.456 -6.049
223 HG12 ILE 24 2HG1 ILE 24 4.054 -1.889 -6.018
224 HG13 ILE 24 1HG1 ILE 24 4.832 -0.318 -6.286
225 HG21 ILE 24 1HG2 ILE 24 5.365 -3.871 -5.308
226 HG22 ILE 24 2HG2 ILE 24 7.124 -3.760 -5.230
227 HG23 ILE 24 3HG2 ILE 24 6.297 -3.702 -6.790
228 HD11 ILE 24 1HD1 ILE 24 4.998 -2.764 -8.051
229 HD12 ILE 24 2HD1 ILE 24 5.840 -1.239 -8.344
230 HD13 ILE 24 3HD1 ILE 24 4.076 -1.298 -8.374
231 H GLN 25 H GLN 25 6.073 -2.868 -2.052
232 HA GLN 25 HA GLN 25 8.967 -2.853 -1.783
233 HB2 GLN 25 2HB GLN 25 7.904 -2.422 0.249
234 HB3 GLN 25 1HB GLN 25 6.704 -3.675 0.047
235 HG2 GLN 25 2HG GLN 25 8.451 -5.359 0.350
236 HG3 GLN 25 1HG GLN 25 9.623 -4.064 0.600
237 HE21 GLN 25 1HE2 GLN 25 8.593 -6.203 2.371
238 HE22 GLN 25 2HE2 GLN 25 8.088 -5.408 3.810
239 H SER 26 H SER 26 10.085 -4.422 -2.722
240 HA SER 26 HA SER 26 8.696 -6.903 -3.235
241 HB2 SER 26 2HB SER 26 10.586 -7.394 -4.767
242 HB3 SER 26 1HB SER 26 9.719 -5.921 -5.204
243 HG SER 26 HG SER 26 12.097 -5.936 -5.189
244 H ASN 27 H ASN 27 9.644 -8.932 -2.658
245 HA ASN 27 HA ASN 27 10.820 -8.916 -0.093
246 HB2 ASN 27 2HB ASN 27 9.008 -10.379 -1.150
247 HB3 ASN 27 1HB ASN 27 10.307 -11.174 -2.008
248 HD21 ASN 27 1HD2 ASN 27 8.327 -12.012 -0.105
249 HD22 ASN 27 2HD2 ASN 27 9.190 -12.833 1.149
250 H GLU 28 H GLU 28 12.178 -8.276 -2.934
251 HA GLU 28 HA GLU 28 14.476 -9.973 -3.108
252 HB2 GLU 28 2HB GLU 28 14.134 -7.143 -4.053
253 HB3 GLU 28 1HB GLU 28 15.345 -8.296 -4.584
254 HG2 GLU 28 2HG GLU 28 13.639 -9.644 -5.618
255 HG3 GLU 28 1HG GLU 28 12.387 -8.543 -5.024
256 H ALA 29 H ALA 29 13.834 -6.730 -1.842
257 HA ALA 29 HA ALA 29 16.473 -6.714 -0.566
258 HB1 ALA 29 1HB ALA 29 16.255 -4.294 -0.466
259 HB2 ALA 29 2HB ALA 29 14.631 -4.401 -1.144
260 HB3 ALA 29 3HB ALA 29 16.025 -4.870 -2.118
261 H CYS 30 H CYS 30 13.081 -6.639 0.028
262 HA CYS 30 HA CYS 30 13.519 -6.011 2.855
263 HB2 CYS 30 2HB CYS 30 10.985 -6.090 1.232
264 HB3 CYS 30 1HB CYS 30 11.146 -5.536 2.896
265 H ASN 31 H ASN 31 12.145 -7.293 4.376
266 HA ASN 31 HA ASN 31 12.733 -10.018 4.062
267 HB2 ASN 31 2HB ASN 31 11.549 -10.364 6.194
268 HB3 ASN 31 1HB ASN 31 12.653 -9.001 6.281
269 HD21 ASN 31 1HD2 ASN 31 10.224 -9.717 7.814
270 HD22 ASN 31 2HD2 ASN 31 9.203 -8.335 7.735
271 H ILE 32 H ILE 32 9.854 -8.186 3.459
272 HA ILE 32 HA ILE 32 8.519 -10.586 2.391
273 HB ILE 32 HB ILE 32 6.371 -9.877 3.389
274 HG12 ILE 32 2HG1 ILE 32 8.025 -7.787 4.827
275 HG13 ILE 32 1HG1 ILE 32 6.830 -7.476 3.578
276 HG21 ILE 32 1HG2 ILE 32 8.550 -10.179 5.403
277 HG22 ILE 32 2HG2 ILE 32 7.671 -11.508 4.613
278 HG23 ILE 32 3HG2 ILE 32 6.836 -10.414 5.735
279 HD11 ILE 32 1HD1 ILE 32 6.284 -8.635 6.303
280 HD12 ILE 32 2HD1 ILE 32 5.075 -8.313 5.061
281 HD13 ILE 32 3HD1 ILE 32 5.964 -6.977 5.793
282 H LYS 33 H LYS 33 6.430 -9.764 1.229
283 HA LYS 33 HA LYS 33 7.089 -7.312 -0.118
284 HB2 LYS 33 2HB LYS 33 6.651 -9.188 -1.645
285 HB3 LYS 33 1HB LYS 33 5.090 -9.469 -0.883
286 HG2 LYS 33 2HG LYS 33 4.302 -7.290 -1.655
287 HG3 LYS 33 1HG LYS 33 5.863 -6.988 -2.399
288 HD2 LYS 33 2HD LYS 33 5.516 -8.869 -3.913
289 HD3 LYS 33 1HD LYS 33 3.964 -9.212 -3.139
290 HE2 LYS 33 2HE LYS 33 3.141 -7.007 -3.800
291 HE3 LYS 33 1HE LYS 33 4.689 -6.642 -4.557
292 HZ1 LYS 33 1HZ LYS 33 2.812 -8.796 -5.387
293 HZ2 LYS 33 2HZ LYS 33 4.276 -8.430 -6.145
294 HZ3 LYS 33 3HZ LYS 33 3.016 -7.318 -6.145
295 H ALA 34 H ALA 34 6.078 -5.570 0.807
296 HA ALA 34 HA ALA 34 3.301 -5.823 1.649
297 HB1 ALA 34 1HB ALA 34 4.640 -6.023 3.722
298 HB2 ALA 34 2HB ALA 34 3.792 -4.487 3.695
299 HB3 ALA 34 3HB ALA 34 5.503 -4.548 3.300
300 H ILE 35 H ILE 35 2.271 -4.385 0.397
301 HA ILE 35 HA ILE 35 3.653 -2.277 -0.928
302 HB ILE 35 HB ILE 35 0.683 -2.761 -0.590
303 HG12 ILE 35 2HG1 ILE 35 1.900 -4.595 -1.648
304 HG13 ILE 35 1HG1 ILE 35 0.785 -3.834 -2.787
305 HG21 ILE 35 1HG2 ILE 35 0.420 -1.309 -2.590
306 HG22 ILE 35 2HG2 ILE 35 2.139 -0.977 -2.548
307 HG23 ILE 35 3HG2 ILE 35 1.115 -0.437 -1.230
308 HD11 ILE 35 1HD1 ILE 35 2.804 -4.393 -3.869
309 HD12 ILE 35 2HD1 ILE 35 3.789 -3.559 -2.650
310 HD13 ILE 35 3HD1 ILE 35 2.740 -2.641 -3.748
311 H ILE 36 H ILE 36 3.907 -0.147 -0.323
312 HA ILE 36 HA ILE 36 2.896 0.455 2.352
313 HB ILE 36 HB ILE 36 5.066 1.969 0.853
314 HG12 ILE 36 2HG1 ILE 36 6.604 0.946 2.674
315 HG13 ILE 36 1HG1 ILE 36 5.335 -0.251 2.876
316 HG21 ILE 36 1HG2 ILE 36 3.945 3.312 2.484
317 HG22 ILE 36 2HG2 ILE 36 5.602 2.924 2.984
318 HG23 ILE 36 3HG2 ILE 36 4.239 2.072 3.720
319 HD11 ILE 36 1HD1 ILE 36 5.585 -0.888 0.564
320 HD12 ILE 36 2HD1 ILE 36 7.106 -1.016 1.472
321 HD13 ILE 36 3HD1 ILE 36 6.830 0.355 0.382
322 H PHE 37 H PHE 37 1.118 1.520 2.324
323 HA PHE 37 HA PHE 37 0.292 3.186 0.139
324 HB2 PHE 37 2HB PHE 37 -0.885 2.085 2.631
325 HB3 PHE 37 1HB PHE 37 -1.672 3.445 1.827
326 HD1 PHE 37 1HD PHE 37 -0.001 0.446 0.439
327 HD2 PHE 37 2HD PHE 37 -3.536 2.614 0.959
328 HE1 PHE 37 1HE PHE 37 -1.201 -1.139 -1.099
329 HE2 PHE 37 2HE PHE 37 -4.746 1.057 -0.558
330 HZ PHE 37 HZ PHE 37 -3.549 -0.804 -1.569
331 H THR 38 H THR 38 0.081 5.294 0.239
332 HA THR 38 HA THR 38 0.854 6.592 2.739
333 HB THR 38 HB THR 38 1.176 7.708 -0.068
334 HG1 THR 38 1HG THR 38 2.559 5.861 1.174
335 HG21 THR 38 1HG2 THR 38 0.959 9.373 1.681
336 HG22 THR 38 2HG2 THR 38 2.636 9.330 1.105
337 HG23 THR 38 3HG2 THR 38 2.193 8.568 2.639
338 H THR 39 H THR 39 -0.645 8.005 3.556
339 HA THR 39 HA THR 39 -3.186 8.091 2.142
340 HB THR 39 HB THR 39 -3.966 9.113 4.349
341 HG1 THR 39 1HG THR 39 -2.391 8.145 6.035
342 HG21 THR 39 1HG2 THR 39 -4.497 6.815 3.741
343 HG22 THR 39 2HG2 THR 39 -4.111 6.903 5.459
344 HG23 THR 39 3HG2 THR 39 -2.923 6.276 4.317
345 H LYS 40 H LYS 40 -4.404 10.278 2.672
346 HA LYS 40 HA LYS 40 -2.922 12.309 1.409
347 HB2 LYS 40 2HB LYS 40 -5.324 12.692 3.134
348 HB3 LYS 40 1HB LYS 40 -4.830 13.761 1.826
349 HG2 LYS 40 2HG LYS 40 -5.229 11.465 0.386
350 HG3 LYS 40 1HG LYS 40 -6.248 11.165 1.756
351 HD2 LYS 40 2HD LYS 40 -7.521 13.192 1.396
352 HD3 LYS 40 1HD LYS 40 -6.394 13.618 0.089
353 HE2 LYS 40 2HE LYS 40 -7.040 11.674 -1.162
354 HE3 LYS 40 1HE LYS 40 -8.152 11.187 0.103
355 HZ1 LYS 40 1HZ LYS 40 -9.406 13.270 -0.280
356 HZ2 LYS 40 2HZ LYS 40 -9.350 12.303 -1.660
357 HZ3 LYS 40 3HZ LYS 40 -8.362 13.646 -1.546
358 H LYS 41 H LYS 41 -3.015 11.207 4.593
359 HA LYS 41 HA LYS 41 -2.159 13.568 6.015
360 HB2 LYS 41 2HB LYS 41 -1.685 10.642 6.690
361 HB3 LYS 41 1HB LYS 41 -1.559 11.992 7.782
362 HG2 LYS 41 2HG LYS 41 -3.965 12.320 7.651
363 HG3 LYS 41 1HG LYS 41 -3.989 10.957 6.512
364 HD2 LYS 41 2HD LYS 41 -3.065 9.464 8.199
365 HD3 LYS 41 1HD LYS 41 -2.970 10.793 9.347
366 HE2 LYS 41 2HE LYS 41 -5.399 10.990 9.320
367 HE3 LYS 41 1HE LYS 41 -5.498 9.672 8.151
368 HZ1 LYS 41 1HZ LYS 41 -4.481 9.491 10.934
369 HZ2 LYS 41 2HZ LYS 41 -4.461 8.213 9.846
370 HZ3 LYS 41 3HZ LYS 41 -5.922 8.866 10.375
371 H GLY 42 H GLY 42 -0.878 11.321 3.848
372 HA2 GLY 42 2HA GLY 42 1.162 11.157 2.860
373 HA3 GLY 42 1HA GLY 42 1.735 12.429 3.911
374 H ARG 43 H ARG 43 0.251 9.885 5.517
375 HA ARG 43 HA ARG 43 2.742 9.083 6.749
376 HB2 ARG 43 2HB ARG 43 -0.055 8.128 7.091
377 HB3 ARG 43 1HB ARG 43 1.288 7.623 8.118
378 HG2 ARG 43 2HG ARG 43 0.125 10.407 7.866
379 HG3 ARG 43 1HG ARG 43 -0.025 9.331 9.257
380 HD2 ARG 43 2HD ARG 43 2.547 10.516 8.200
381 HD3 ARG 43 1HD ARG 43 1.662 11.072 9.611
382 HE ARG 43 HE ARG 43 2.091 8.507 10.220
383 HH11 ARG 43 1HH1 ARG 43 4.324 10.937 8.960
384 HH12 ARG 43 2HH1 ARG 43 5.659 10.378 9.851
385 HH21 ARG 43 1HH2 ARG 43 3.959 7.744 11.458
386 HH22 ARG 43 2HH2 ARG 43 5.449 8.536 11.297
387 H LYS 44 H LYS 44 3.325 6.791 6.981
388 HA LYS 44 HA LYS 44 2.838 5.390 4.465
389 HB2 LYS 44 2HB LYS 44 5.115 5.093 6.434
390 HB3 LYS 44 1HB LYS 44 4.930 4.164 4.956
391 HG2 LYS 44 2HG LYS 44 5.282 7.154 5.113
392 HG3 LYS 44 1HG LYS 44 6.530 5.990 4.657
393 HD2 LYS 44 2HD LYS 44 5.233 5.325 2.711
394 HD3 LYS 44 1HD LYS 44 3.917 6.391 3.184
395 HE2 LYS 44 2HE LYS 44 5.225 7.399 1.426
396 HE3 LYS 44 1HE LYS 44 5.379 8.304 2.928
397 HZ1 LYS 44 1HZ LYS 44 7.358 6.335 1.957
398 HZ2 LYS 44 2HZ LYS 44 7.526 7.351 3.294
399 HZ3 LYS 44 3HZ LYS 44 7.483 7.992 1.730
400 H ILE 45 H ILE 45 1.486 3.867 4.479
401 HA ILE 45 HA ILE 45 0.952 2.360 6.941
402 HB ILE 45 HB ILE 45 -0.841 2.689 4.514
403 HG12 ILE 45 2HG1 ILE 45 -2.392 3.951 6.135
404 HG13 ILE 45 1HG1 ILE 45 -1.001 4.044 7.221
405 HG21 ILE 45 1HG2 ILE 45 -1.364 1.347 7.147
406 HG22 ILE 45 2HG2 ILE 45 -1.195 0.579 5.572
407 HG23 ILE 45 3HG2 ILE 45 -2.578 1.624 5.899
408 HD11 ILE 45 1HD1 ILE 45 -1.401 6.071 5.986
409 HD12 ILE 45 2HD1 ILE 45 -1.195 5.183 4.475
410 HD13 ILE 45 3HD1 ILE 45 0.174 5.359 5.577
411 H CYS 46 H CYS 46 1.831 0.436 6.861
412 HA CYS 46 HA CYS 46 2.684 -0.807 4.390
413 HB2 CYS 46 2HB CYS 46 2.677 -1.813 7.232
414 HB3 CYS 46 1HB CYS 46 3.561 -2.557 5.918
415 H ALA 47 H ALA 47 1.277 -2.014 3.187
416 HA ALA 47 HA ALA 47 -0.976 -3.188 4.661
417 HB1 ALA 47 1HB ALA 47 -1.008 -2.082 1.864
418 HB2 ALA 47 2HB ALA 47 -1.651 -1.275 3.296
419 HB3 ALA 47 3HB ALA 47 -2.373 -2.785 2.733
420 H ASN 48 H ASN 48 -1.713 -5.183 4.092
421 HA ASN 48 HA ASN 48 0.137 -6.933 2.846
422 HB2 ASN 48 2HB ASN 48 -1.081 -7.805 4.669
423 HB3 ASN 48 1HB ASN 48 -2.627 -7.305 4.037
424 HD21 ASN 48 1HD2 ASN 48 -0.046 -8.952 2.300
425 HD22 ASN 48 2HD2 ASN 48 -0.996 -10.383 1.987
426 HA PRO 49 HA PRO 49 -1.292 -5.947 -1.295
427 HB2 PRO 49 2HB PRO 49 0.270 -7.841 -2.501
428 HB3 PRO 49 1HB PRO 49 0.803 -6.200 -2.147
429 HG2 PRO 49 2HG PRO 49 1.312 -8.727 -0.643
430 HG3 PRO 49 1HG PRO 49 2.387 -7.343 -0.911
431 HD2 PRO 49 2HD PRO 49 1.164 -7.735 1.422
432 HD3 PRO 49 1HD PRO 49 1.413 -6.105 0.781
433 H ASN 50 H ASN 50 -1.319 -8.970 0.298
434 HA ASN 50 HA ASN 50 -2.790 -10.254 -1.755
435 HB2 ASN 50 2HB ASN 50 -2.143 -11.203 1.027
436 HB3 ASN 50 1HB ASN 50 -3.167 -12.101 -0.086
437 HD21 ASN 50 1HD2 ASN 50 0.150 -10.996 0.494
438 HD22 ASN 50 2HD2 ASN 50 0.843 -12.033 -0.666
439 H GLU 51 H GLU 51 -3.658 -7.962 0.438
440 HA GLU 51 HA GLU 51 -6.318 -8.970 0.994
441 HB2 GLU 51 2HB GLU 51 -5.239 -6.185 1.435
442 HB3 GLU 51 1HB GLU 51 -6.730 -6.837 2.084
443 HG2 GLU 51 2HG GLU 51 -5.130 -8.579 3.256
444 HG3 GLU 51 1HG GLU 51 -3.943 -7.418 2.739
445 H LYS 52 H LYS 52 -8.113 -8.506 -0.108
446 HA LYS 52 HA LYS 52 -7.861 -7.712 -2.760
447 HB2 LYS 52 2HB LYS 52 -9.655 -9.202 -1.974
448 HB3 LYS 52 1HB LYS 52 -10.397 -7.862 -1.119
449 HG2 LYS 52 2HG LYS 52 -10.804 -6.709 -3.221
450 HG3 LYS 52 1HG LYS 52 -9.991 -7.999 -4.099
451 HD2 LYS 52 2HD LYS 52 -11.703 -9.586 -3.288
452 HD3 LYS 52 1HD LYS 52 -12.526 -8.247 -2.488
453 HE2 LYS 52 2HE LYS 52 -12.867 -7.138 -4.616
454 HE3 LYS 52 1HE LYS 52 -11.963 -8.402 -5.442
455 HZ1 LYS 52 1HZ LYS 52 -14.551 -8.787 -4.018
456 HZ2 LYS 52 2HZ LYS 52 -13.644 -9.984 -4.778
457 HZ3 LYS 52 3HZ LYS 52 -14.308 -8.749 -5.694
458 H TRP 53 H TRP 53 -8.665 -5.776 0.089
459 HA TRP 53 HA TRP 53 -9.600 -3.565 -1.399
460 HB2 TRP 53 2HB TRP 53 -9.385 -2.187 0.591
461 HB3 TRP 53 1HB TRP 53 -9.998 -3.753 1.065
462 HD1 TRP 53 HD TRP 53 -8.301 -5.317 2.570
463 HE1 TRP 53 1HE TRP 53 -6.343 -4.677 4.049
464 HE3 TRP 53 3HE TRP 53 -7.430 -0.596 0.793
465 HZ2 TRP 53 2HZ TRP 53 -4.616 -2.490 4.444
466 HZ3 TRP 53 3HZ TRP 53 -5.592 0.692 1.782
467 HH2 TRP 53 HH TRP 53 -4.214 -0.236 3.576
468 H VAL 54 H VAL 54 -6.438 -4.650 -0.543
469 HA VAL 54 HA VAL 54 -5.043 -2.298 -1.329
470 HB VAL 54 HB VAL 54 -4.064 -5.150 -0.948
471 HG11 VAL 54 1HG1 VAL 54 -2.521 -2.597 -1.293
472 HG12 VAL 54 2HG1 VAL 54 -2.521 -3.965 -2.398
473 HG13 VAL 54 3HG1 VAL 54 -1.805 -4.116 -0.779
474 HG21 VAL 54 1HG2 VAL 54 -3.888 -2.735 0.833
475 HG22 VAL 54 2HG2 VAL 54 -3.197 -4.323 1.172
476 HG23 VAL 54 3HG2 VAL 54 -4.948 -4.120 1.071
477 H GLN 55 H GLN 55 -5.816 -5.367 -2.790
478 HA GLN 55 HA GLN 55 -4.413 -4.980 -5.177
479 HB2 GLN 55 2HB GLN 55 -6.797 -6.734 -4.667
480 HB3 GLN 55 1HB GLN 55 -5.705 -6.854 -6.054
481 HG2 GLN 55 2HG GLN 55 -3.827 -7.103 -4.469
482 HG3 GLN 55 1HG GLN 55 -5.003 -7.192 -3.172
483 HE21 GLN 55 1HE2 GLN 55 -3.048 -9.020 -3.937
484 HE22 GLN 55 2HE2 GLN 55 -3.800 -10.481 -4.369
485 H LYS 56 H LYS 56 -7.627 -4.066 -4.144
486 HA LYS 56 HA LYS 56 -8.640 -3.100 -6.630
487 HB2 LYS 56 2HB LYS 56 -9.967 -3.616 -4.603
488 HB3 LYS 56 1HB LYS 56 -9.246 -2.208 -3.827
489 HG2 LYS 56 2HG LYS 56 -10.115 -0.836 -5.702
490 HG3 LYS 56 1HG LYS 56 -10.980 -2.267 -6.266
491 HD2 LYS 56 2HD LYS 56 -11.257 -0.935 -3.614
492 HD3 LYS 56 1HD LYS 56 -12.413 -0.827 -4.957
493 HE2 LYS 56 2HE LYS 56 -12.784 -3.269 -4.772
494 HE3 LYS 56 1HE LYS 56 -11.661 -3.323 -3.414
495 HZ1 LYS 56 1HZ LYS 56 -14.244 -1.864 -3.488
496 HZ2 LYS 56 2HZ LYS 56 -13.161 -1.858 -2.180
497 HZ3 LYS 56 3HZ LYS 56 -13.930 -3.279 -2.657
498 H ALA 57 H ALA 57 -7.113 -1.567 -3.818
499 HA ALA 57 HA ALA 57 -7.098 1.042 -4.773
500 HB1 ALA 57 1HB ALA 57 -5.422 1.477 -3.043
501 HB2 ALA 57 2HB ALA 57 -5.196 -0.249 -2.809
502 HB3 ALA 57 3HB ALA 57 -6.755 0.494 -2.426
503 H MET 58 H MET 58 -4.583 -1.457 -5.006
504 HA MET 58 HA MET 58 -2.686 0.167 -6.081
505 HB2 MET 58 2HB MET 58 -3.000 -2.806 -6.413
506 HB3 MET 58 1HB MET 58 -1.608 -1.938 -7.046
507 HG2 MET 58 2HG MET 58 -1.217 -1.098 -4.700
508 HG3 MET 58 1HG MET 58 -2.458 -2.228 -4.173
509 HE1 MET 58 1HE MET 58 -0.726 -5.659 -5.020
510 HE2 MET 58 2HE MET 58 -1.894 -4.799 -6.037
511 HE3 MET 58 3HE MET 58 -2.151 -4.922 -4.287
512 H LYS 59 H LYS 59 -5.094 -1.708 -7.836
513 HA LYS 59 HA LYS 59 -4.172 -1.066 -10.408
514 HB2 LYS 59 2HB LYS 59 -6.985 -1.703 -9.508
515 HB3 LYS 59 1HB LYS 59 -6.442 -1.675 -11.179
516 HG2 LYS 59 2HG LYS 59 -4.891 -3.495 -10.706
517 HG3 LYS 59 1HG LYS 59 -5.431 -3.523 -9.027
518 HD2 LYS 59 2HD LYS 59 -7.717 -4.049 -9.818
519 HD3 LYS 59 1HD LYS 59 -7.102 -4.090 -11.471
520 HE2 LYS 59 2HE LYS 59 -5.570 -5.904 -10.864
521 HE3 LYS 59 1HE LYS 59 -6.177 -5.848 -9.209
522 HZ1 LYS 59 1HZ LYS 59 -8.372 -6.506 -10.053
523 HZ2 LYS 59 2HZ LYS 59 -7.188 -7.629 -10.429
524 HZ3 LYS 59 3HZ LYS 59 -7.743 -6.581 -11.625
525 H HIS 60 H HIS 60 -6.369 0.602 -8.215
526 HA HIS 60 HA HIS 60 -7.113 2.544 -10.141
527 HB2 HIS 60 2HB HIS 60 -8.656 2.050 -8.372
528 HB3 HIS 60 1HB HIS 60 -7.443 2.387 -7.147
529 HD1 HIS 60 1HD HIS 60 -9.678 4.183 -9.647
530 HD2 HIS 60 2HD HIS 60 -7.310 4.943 -6.345
531 HE1 HIS 60 1HE HIS 60 -10.114 6.557 -9.086
532 HE2 HIS 60 2HE HIS 60 -9.069 6.793 -6.842
533 H LEU 61 H LEU 61 -4.674 2.364 -7.623
534 HA LEU 61 HA LEU 61 -3.938 5.098 -7.818
535 HB2 LEU 61 2HB LEU 61 -2.533 2.757 -6.550
536 HB3 LEU 61 1HB LEU 61 -1.943 4.408 -6.453
537 HG LEU 61 HG LEU 61 -4.619 3.474 -5.391
538 HD11 LEU 61 1HD1 LEU 61 -2.044 4.050 -3.927
539 HD12 LEU 61 2HD1 LEU 61 -2.888 2.490 -4.051
540 HD13 LEU 61 3HD1 LEU 61 -3.619 3.819 -3.178
541 HD21 LEU 61 1HD2 LEU 61 -3.160 6.097 -5.090
542 HD22 LEU 61 2HD2 LEU 61 -4.655 5.656 -4.268
543 HD23 LEU 61 3HD2 LEU 61 -4.638 5.832 -6.019
544 H ASP 62 H ASP 62 -2.787 2.224 -9.498
545 HA ASP 62 HA ASP 62 -0.579 3.610 -10.682
546 HB2 ASP 62 2HB ASP 62 -1.956 1.032 -11.388
547 HB3 ASP 62 1HB ASP 62 -0.723 1.711 -12.450
548 H LYS 63 H LYS 63 -3.912 3.485 -11.334
549 HA LYS 63 HA LYS 63 -3.523 4.618 -13.970
550 HB2 LYS 63 2HB LYS 63 -6.078 3.751 -12.616
551 HB3 LYS 63 1HB LYS 63 -5.894 4.184 -14.311
552 HG2 LYS 63 2HG LYS 63 -4.424 2.269 -14.655
553 HG3 LYS 63 1HG LYS 63 -4.582 1.843 -12.951
554 HD2 LYS 63 2HD LYS 63 -7.062 1.673 -13.346
555 HD3 LYS 63 1HD LYS 63 -6.716 1.811 -15.071
556 HE2 LYS 63 2HE LYS 63 -5.705 -0.323 -13.193
557 HE3 LYS 63 1HE LYS 63 -6.920 -0.526 -14.447
558 HZ1 LYS 63 1HZ LYS 63 -4.051 0.135 -14.896
559 HZ2 LYS 63 2HZ LYS 63 -5.194 -0.064 -16.114
560 HZ3 LYS 63 3HZ LYS 63 -4.777 -1.357 -15.115
561 H LYS 64 H LYS 64 -3.202 5.899 -11.205
562 HA LYS 64 HA LYS 64 -5.091 8.099 -11.551
563 HB2 LYS 64 2HB LYS 64 -5.273 6.886 -9.387
564 HB3 LYS 64 1HB LYS 64 -3.596 7.283 -9.048
565 HG2 LYS 64 2HG LYS 64 -4.135 9.640 -9.024
566 HG3 LYS 64 1HG LYS 64 -5.813 9.285 -9.428
567 HD2 LYS 64 2HD LYS 64 -5.975 7.967 -7.327
568 HD3 LYS 64 1HD LYS 64 -4.337 8.481 -6.918
569 HE2 LYS 64 2HE LYS 64 -5.961 9.890 -5.789
570 HE3 LYS 64 1HE LYS 64 -5.084 10.830 -6.997
571 HZ1 LYS 64 1HZ LYS 64 -7.432 11.315 -7.062
572 HZ2 LYS 64 2HZ LYS 64 -7.808 9.692 -7.321
573 HZ3 LYS 64 3HZ LYS 64 -6.979 10.579 -8.497
Start of MODEL 11
1 H1 ALA 1 1HT ALA 1 15.999 -0.050 13.098
2 H2 ALA 1 2HT ALA 1 16.953 1.026 12.201
3 H3 ALA 1 3HT ALA 1 15.929 -0.011 11.410
4 HA ALA 1 HA ALA 1 14.014 1.098 12.298
5 HB1 ALA 1 1HB ALA 1 16.059 2.933 13.550
6 HB2 ALA 1 2HB ALA 1 15.017 1.808 14.424
7 HB3 ALA 1 3HB ALA 1 14.313 3.180 13.562
8 H ARG 2 H ARG 2 13.176 2.977 11.208
9 HA ARG 2 HA ARG 2 12.873 4.232 9.414
10 HB2 ARG 2 2HB ARG 2 15.803 4.937 9.713
11 HB3 ARG 2 1HB ARG 2 14.650 5.806 8.711
12 HG2 ARG 2 2HG ARG 2 13.348 6.363 10.717
13 HG3 ARG 2 1HG ARG 2 14.544 5.523 11.705
14 HD2 ARG 2 2HD ARG 2 16.268 7.087 10.891
15 HD3 ARG 2 1HD ARG 2 15.037 7.934 9.962
16 HE ARG 2 HE ARG 2 14.541 7.663 12.793
17 HH11 ARG 2 1HH1 ARG 2 15.738 9.747 10.181
18 HH12 ARG 2 2HH1 ARG 2 15.631 11.172 11.090
19 HH21 ARG 2 1HH2 ARG 2 14.424 9.698 14.045
20 HH22 ARG 2 2HH2 ARG 2 14.886 11.157 13.282
21 H LYS 3 H LYS 3 12.341 2.571 8.136
22 HA LYS 3 HA LYS 3 14.258 1.939 6.004
23 HB2 LYS 3 2HB LYS 3 12.560 -0.059 7.508
24 HB3 LYS 3 1HB LYS 3 13.410 -0.413 6.019
25 HG2 LYS 3 2HG LYS 3 14.708 0.418 8.614
26 HG3 LYS 3 1HG LYS 3 14.562 -1.242 8.041
27 HD2 LYS 3 2HD LYS 3 16.029 0.975 6.599
28 HD3 LYS 3 1HD LYS 3 16.787 -0.251 7.608
29 HE2 LYS 3 2HE LYS 3 15.944 -1.995 6.121
30 HE3 LYS 3 1HE LYS 3 15.179 -0.782 5.102
31 HZ1 LYS 3 1HZ LYS 3 18.099 -1.083 5.575
32 HZ2 LYS 3 2HZ LYS 3 17.395 0.136 4.646
33 HZ3 LYS 3 3HZ LYS 3 17.280 -1.470 4.171
34 H SER 4 H SER 4 13.277 1.485 4.028
35 HA SER 4 HA SER 4 10.546 2.442 3.759
36 HB2 SER 4 2HB SER 4 12.618 1.675 1.681
37 HB3 SER 4 1HB SER 4 11.082 2.485 1.364
38 HG SER 4 HG SER 4 12.590 3.726 3.281
39 H CYS 5 H CYS 5 11.604 -0.212 4.822
40 HA CYS 5 HA CYS 5 9.917 -1.967 3.209
41 HB2 CYS 5 2HB CYS 5 12.271 -2.705 4.965
42 HB3 CYS 5 1HB CYS 5 11.257 -3.840 4.093
43 H CYS 6 H CYS 6 8.515 -3.247 4.367
44 HA CYS 6 HA CYS 6 8.064 -2.484 7.138
45 HB2 CYS 6 2HB CYS 6 6.294 -3.434 4.945
46 HB3 CYS 6 1HB CYS 6 5.742 -3.178 6.603
47 H LEU 7 H LEU 7 7.623 -4.132 8.550
48 HA LEU 7 HA LEU 7 8.013 -6.898 7.598
49 HB2 LEU 7 2HB LEU 7 8.596 -5.729 10.326
50 HB3 LEU 7 1HB LEU 7 8.843 -7.394 9.857
51 HG LEU 7 HG LEU 7 10.352 -5.015 8.775
52 HD11 LEU 7 1HD1 LEU 7 11.215 -7.224 10.635
53 HD12 LEU 7 2HD1 LEU 7 10.937 -5.540 11.074
54 HD13 LEU 7 3HD1 LEU 7 12.252 -5.955 9.978
55 HD21 LEU 7 1HD2 LEU 7 10.118 -6.766 7.091
56 HD22 LEU 7 2HD2 LEU 7 10.705 -7.965 8.238
57 HD23 LEU 7 3HD2 LEU 7 11.778 -6.682 7.677
58 H LYS 8 H LYS 8 5.726 -4.817 8.281
59 HA LYS 8 HA LYS 8 4.000 -6.666 9.708
60 HB2 LYS 8 2HB LYS 8 4.869 -5.036 11.289
61 HB3 LYS 8 1HB LYS 8 4.489 -3.733 10.186
62 HG2 LYS 8 2HG LYS 8 2.887 -3.733 11.931
63 HG3 LYS 8 1HG LYS 8 2.127 -4.259 10.425
64 HD2 LYS 8 2HD LYS 8 1.326 -5.637 12.270
65 HD3 LYS 8 1HD LYS 8 2.312 -6.603 11.176
66 HE2 LYS 8 2HE LYS 8 2.809 -7.097 13.518
67 HE3 LYS 8 1HE LYS 8 4.209 -6.414 12.698
68 HZ1 LYS 8 1HZ LYS 8 2.344 -4.890 14.431
69 HZ2 LYS 8 2HZ LYS 8 3.756 -4.287 13.741
70 HZ3 LYS 8 3HZ LYS 8 3.832 -5.478 14.927
71 H TYR 9 H TYR 9 1.830 -6.412 9.017
72 HA TYR 9 HA TYR 9 1.346 -4.518 6.842
73 HB2 TYR 9 2HB TYR 9 -0.346 -7.027 7.319
74 HB3 TYR 9 1HB TYR 9 -0.285 -5.957 5.986
75 HD1 TYR 9 1HD TYR 9 1.202 -6.157 4.233
76 HD2 TYR 9 2HD TYR 9 1.599 -8.706 7.589
77 HE1 TYR 9 1HE TYR 9 2.679 -7.617 2.935
78 HE2 TYR 9 2HE TYR 9 3.108 -10.176 6.296
79 HH TYR 9 HH TYR 9 4.367 -9.178 3.258
80 H THR 10 H THR 10 -0.669 -3.429 7.003
81 HA THR 10 HA THR 10 -1.365 -2.736 9.616
82 HB THR 10 HB THR 10 -1.440 -1.057 7.895
83 HG1 THR 10 1HG THR 10 -4.022 -0.751 8.134
84 HG21 THR 10 1HG2 THR 10 -3.147 -1.059 6.125
85 HG22 THR 10 2HG2 THR 10 -3.664 -2.674 6.630
86 HG23 THR 10 3HG2 THR 10 -2.034 -2.412 5.993
87 H LYS 11 H LYS 11 -3.127 -3.120 10.814
88 HA LYS 11 HA LYS 11 -4.762 -5.431 10.162
89 HB2 LYS 11 2HB LYS 11 -5.561 -5.191 12.487
90 HB3 LYS 11 1HB LYS 11 -3.808 -5.268 12.402
91 HG2 LYS 11 2HG LYS 11 -3.698 -2.825 12.614
92 HG3 LYS 11 1HG LYS 11 -5.453 -2.762 12.723
93 HD2 LYS 11 2HD LYS 11 -5.345 -4.120 14.769
94 HD3 LYS 11 1HD LYS 11 -3.583 -4.137 14.642
95 HE2 LYS 11 2HE LYS 11 -3.538 -1.702 14.813
96 HE3 LYS 11 1HE LYS 11 -5.296 -1.672 14.913
97 HZ1 LYS 11 1HZ LYS 11 -3.441 -2.869 16.903
98 HZ2 LYS 11 2HZ LYS 11 -5.129 -2.959 16.966
99 HZ3 LYS 11 3HZ LYS 11 -4.386 -1.474 17.075
100 H ARG 12 H ARG 12 -4.883 -2.124 9.758
101 HA ARG 12 HA ARG 12 -7.821 -2.059 9.745
102 HB2 ARG 12 2HB ARG 12 -6.842 -0.546 11.405
103 HB3 ARG 12 1HB ARG 12 -5.857 0.200 10.159
104 HG2 ARG 12 2HG ARG 12 -7.895 0.981 9.030
105 HG3 ARG 12 1HG ARG 12 -8.866 0.269 10.317
106 HD2 ARG 12 2HD ARG 12 -7.757 1.741 11.947
107 HD3 ARG 12 1HD ARG 12 -6.815 2.462 10.643
108 HE ARG 12 HE ARG 12 -9.586 2.573 10.106
109 HH11 ARG 12 1HH1 ARG 12 -7.031 4.221 11.890
110 HH12 ARG 12 2HH1 ARG 12 -7.858 5.698 12.018
111 HH21 ARG 12 1HH2 ARG 12 -10.742 4.632 10.253
112 HH22 ARG 12 2HH2 ARG 12 -10.027 5.937 11.053
113 HA PRO 13 HA PRO 13 -7.191 -1.470 5.281
114 HB2 PRO 13 2HB PRO 13 -10.111 -1.081 5.369
115 HB3 PRO 13 1HB PRO 13 -9.170 -2.239 4.426
116 HG2 PRO 13 2HG PRO 13 -10.671 -3.003 6.514
117 HG3 PRO 13 1HG PRO 13 -9.137 -3.794 6.116
118 HD2 PRO 13 2HD PRO 13 -9.745 -1.814 8.271
119 HD3 PRO 13 1HD PRO 13 -8.663 -3.236 8.264
120 H LEU 14 H LEU 14 -7.457 0.379 3.943
121 HA LEU 14 HA LEU 14 -8.207 2.867 5.329
122 HB2 LEU 14 2HB LEU 14 -6.414 2.408 2.954
123 HB3 LEU 14 1HB LEU 14 -6.813 3.963 3.630
124 HG LEU 14 HG LEU 14 -5.222 1.819 5.036
125 HD11 LEU 14 1HD1 LEU 14 -4.119 2.726 3.064
126 HD12 LEU 14 2HD1 LEU 14 -3.313 3.278 4.530
127 HD13 LEU 14 3HD1 LEU 14 -4.392 4.362 3.647
128 HD21 LEU 14 1HD2 LEU 14 -6.408 3.331 6.575
129 HD22 LEU 14 2HD2 LEU 14 -5.741 4.718 5.708
130 HD23 LEU 14 3HD2 LEU 14 -4.667 3.638 6.591
131 HA PRO 15 HA PRO 15 -11.140 3.260 1.909
132 HB2 PRO 15 2HB PRO 15 -11.041 6.147 2.068
133 HB3 PRO 15 1HB PRO 15 -12.336 5.077 2.577
134 HG2 PRO 15 2HG PRO 15 -10.777 6.542 4.319
135 HG3 PRO 15 1HG PRO 15 -11.688 5.089 4.754
136 HD2 PRO 15 2HD PRO 15 -8.782 5.417 4.223
137 HD3 PRO 15 1HD PRO 15 -9.628 4.311 5.326
138 H LEU 16 H LEU 16 -10.732 3.502 -0.255
139 HA LEU 16 HA LEU 16 -8.102 3.815 -1.100
140 HB2 LEU 16 2HB LEU 16 -9.417 2.512 -2.417
141 HB3 LEU 16 1HB LEU 16 -10.682 3.771 -2.577
142 HG LEU 16 HG LEU 16 -8.964 4.996 -3.922
143 HD11 LEU 16 1HD1 LEU 16 -7.151 3.608 -4.910
144 HD12 LEU 16 2HD1 LEU 16 -7.555 2.361 -3.727
145 HD13 LEU 16 3HD1 LEU 16 -6.966 3.920 -3.181
146 HD21 LEU 16 1HD2 LEU 16 -9.908 2.333 -4.878
147 HD22 LEU 16 2HD2 LEU 16 -9.401 3.704 -5.898
148 HD23 LEU 16 3HD2 LEU 16 -10.797 3.875 -4.831
149 H LYS 17 H LYS 17 -10.749 6.106 -1.108
150 HA LYS 17 HA LYS 17 -9.506 8.049 -2.691
151 HB2 LYS 17 2HB LYS 17 -11.624 8.338 -0.580
152 HB3 LYS 17 1HB LYS 17 -11.056 9.670 -1.556
153 HG2 LYS 17 2HG LYS 17 -13.116 8.889 -2.429
154 HG3 LYS 17 1HG LYS 17 -11.833 8.467 -3.568
155 HD2 LYS 17 2HD LYS 17 -11.896 6.169 -2.750
156 HD3 LYS 17 1HD LYS 17 -13.140 6.607 -1.580
157 HE2 LYS 17 2HE LYS 17 -13.387 6.734 -4.591
158 HE3 LYS 17 1HE LYS 17 -14.147 5.558 -3.529
159 HZ1 LYS 17 1HZ LYS 17 -15.689 7.301 -4.172
160 HZ2 LYS 17 2HZ LYS 17 -14.702 8.480 -3.500
161 HZ3 LYS 17 3HZ LYS 17 -15.431 7.325 -2.513
162 H ARG 18 H ARG 18 -8.854 7.029 0.429
163 HA ARG 18 HA ARG 18 -7.888 9.682 1.347
164 HB2 ARG 18 2HB ARG 18 -9.195 8.121 2.894
165 HB3 ARG 18 1HB ARG 18 -7.783 7.068 2.839
166 HG2 ARG 18 2HG ARG 18 -6.422 8.883 3.786
167 HG3 ARG 18 1HG ARG 18 -7.882 9.861 3.918
168 HD2 ARG 18 2HD ARG 18 -8.857 8.152 5.402
169 HD3 ARG 18 1HD ARG 18 -7.349 7.236 5.306
170 HE ARG 18 HE ARG 18 -7.111 9.986 6.113
171 HH11 ARG 18 1HH1 ARG 18 -7.389 6.624 7.322
172 HH12 ARG 18 2HH1 ARG 18 -6.706 6.998 8.826
173 HH21 ARG 18 1HH2 ARG 18 -6.248 10.439 8.208
174 HH22 ARG 18 2HH2 ARG 18 -6.064 9.209 9.370
175 H ILE 19 H ILE 19 -6.716 7.489 -0.562
176 HA ILE 19 HA ILE 19 -4.030 7.351 0.600
177 HB ILE 19 HB ILE 19 -5.234 5.613 -1.568
178 HG12 ILE 19 2HG1 ILE 19 -4.759 4.878 1.321
179 HG13 ILE 19 1HG1 ILE 19 -6.329 5.415 0.717
180 HG21 ILE 19 1HG2 ILE 19 -2.717 5.351 0.107
181 HG22 ILE 19 2HG2 ILE 19 -2.775 5.761 -1.607
182 HG23 ILE 19 3HG2 ILE 19 -3.286 4.167 -1.062
183 HD11 ILE 19 1HD1 ILE 19 -6.296 3.529 -0.871
184 HD12 ILE 19 2HD1 ILE 19 -6.243 2.993 0.820
185 HD13 ILE 19 3HD1 ILE 19 -4.795 2.999 -0.189
186 H LYS 20 H LYS 20 -2.649 8.613 -0.341
187 HA LYS 20 HA LYS 20 -3.244 10.001 -2.745
188 HB2 LYS 20 2HB LYS 20 -0.645 9.912 -1.182
189 HB3 LYS 20 1HB LYS 20 -1.011 11.047 -2.458
190 HG2 LYS 20 2HG LYS 20 -2.355 10.829 0.176
191 HG3 LYS 20 1HG LYS 20 -1.250 12.098 -0.357
192 HD2 LYS 20 2HD LYS 20 -4.024 11.496 -1.362
193 HD3 LYS 20 1HD LYS 20 -3.517 12.892 -0.460
194 HE2 LYS 20 2HE LYS 20 -2.511 12.270 -3.247
195 HE3 LYS 20 1HE LYS 20 -3.744 13.473 -2.866
196 HZ1 LYS 20 1HZ LYS 20 -2.060 14.712 -1.612
197 HZ2 LYS 20 2HZ LYS 20 -1.510 14.402 -3.185
198 HZ3 LYS 20 3HZ LYS 20 -0.946 13.492 -1.906
199 H SER 21 H SER 21 -0.945 7.378 -1.801
200 HA SER 21 HA SER 21 -0.786 6.274 -4.376
201 HB2 SER 21 2HB SER 21 0.506 8.373 -4.829
202 HB3 SER 21 1HB SER 21 1.593 7.972 -3.509
203 HG SER 21 HG SER 21 1.383 6.932 -6.062
204 H TYR 22 H TYR 22 1.162 4.625 -4.352
205 HA TYR 22 HA TYR 22 1.852 3.825 -1.605
206 HB2 TYR 22 2HB TYR 22 1.423 1.504 -2.085
207 HB3 TYR 22 1HB TYR 22 -0.047 2.419 -2.342
208 HD1 TYR 22 1HD TYR 22 -1.185 2.187 -4.335
209 HD2 TYR 22 2HD TYR 22 2.819 0.844 -4.170
210 HE1 TYR 22 1HE TYR 22 -1.435 1.126 -6.539
211 HE2 TYR 22 2HE TYR 22 2.573 -0.197 -6.385
212 HH TYR 22 HH TYR 22 0.027 0.502 -8.399
213 H THR 23 H THR 23 3.546 2.264 -1.541
214 HA THR 23 HA THR 23 5.487 2.560 -3.730
215 HB THR 23 HB THR 23 5.996 2.090 -0.784
216 HG1 THR 23 1HG THR 23 6.357 4.445 -2.366
217 HG21 THR 23 1HG2 THR 23 7.673 1.121 -2.244
218 HG22 THR 23 2HG2 THR 23 8.354 2.496 -1.359
219 HG23 THR 23 3HG2 THR 23 7.900 2.667 -3.063
220 H ILE 24 H ILE 24 6.259 0.628 -4.554
221 HA ILE 24 HA ILE 24 5.033 -1.797 -3.575
222 HB ILE 24 HB ILE 24 6.852 -1.355 -5.962
223 HG12 ILE 24 2HG1 ILE 24 3.865 -1.762 -5.790
224 HG13 ILE 24 1HG1 ILE 24 4.673 -0.235 -6.143
225 HG21 ILE 24 1HG2 ILE 24 5.243 -3.793 -5.165
226 HG22 ILE 24 2HG2 ILE 24 7.003 -3.655 -5.134
227 HG23 ILE 24 3HG2 ILE 24 6.141 -3.602 -6.673
228 HD11 ILE 24 1HD1 ILE 24 4.747 -2.719 -7.843
229 HD12 ILE 24 2HD1 ILE 24 5.557 -1.192 -8.202
230 HD13 ILE 24 3HD1 ILE 24 3.797 -1.269 -8.161
231 H GLN 25 H GLN 25 5.978 -2.694 -1.881
232 HA GLN 25 HA GLN 25 8.859 -2.722 -1.681
233 HB2 GLN 25 2HB GLN 25 7.826 -2.335 0.384
234 HB3 GLN 25 1HB GLN 25 6.642 -3.600 0.203
235 HG2 GLN 25 2HG GLN 25 8.399 -5.260 0.422
236 HG3 GLN 25 1HG GLN 25 9.581 -3.963 0.608
237 HE21 GLN 25 1HE2 GLN 25 8.683 -6.112 2.422
238 HE22 GLN 25 2HE2 GLN 25 8.278 -5.320 3.890
239 H SER 26 H SER 26 9.953 -4.196 -2.604
240 HA SER 26 HA SER 26 8.665 -6.649 -3.453
241 HB2 SER 26 2HB SER 26 9.904 -5.396 -5.133
242 HB3 SER 26 1HB SER 26 11.356 -5.456 -4.135
243 HG SER 26 HG SER 26 10.953 -7.067 -5.923
244 H ASN 27 H ASN 27 9.250 -8.659 -2.694
245 HA ASN 27 HA ASN 27 10.516 -8.890 -0.203
246 HB2 ASN 27 2HB ASN 27 8.587 -10.189 -1.254
247 HB3 ASN 27 1HB ASN 27 9.786 -10.995 -2.239
248 HD21 ASN 27 1HD2 ASN 27 7.850 -11.906 -0.279
249 HD22 ASN 27 2HD2 ASN 27 8.762 -12.803 0.869
250 H GLU 28 H GLU 28 11.670 -8.588 -3.348
251 HA GLU 28 HA GLU 28 13.997 -10.222 -3.233
252 HB2 GLU 28 2HB GLU 28 13.431 -7.752 -4.865
253 HB3 GLU 28 1HB GLU 28 14.733 -8.897 -5.151
254 HG2 GLU 28 2HG GLU 28 13.114 -10.641 -5.637
255 HG3 GLU 28 1HG GLU 28 11.801 -9.520 -5.288
256 H ALA 29 H ALA 29 13.248 -6.892 -2.391
257 HA ALA 29 HA ALA 29 16.029 -6.475 -1.526
258 HB1 ALA 29 1HB ALA 29 15.575 -4.085 -1.636
259 HB2 ALA 29 2HB ALA 29 13.894 -4.412 -2.064
260 HB3 ALA 29 3HB ALA 29 15.190 -4.865 -3.170
261 H CYS 30 H CYS 30 12.755 -6.608 -0.395
262 HA CYS 30 HA CYS 30 13.633 -5.874 2.327
263 HB2 CYS 30 2HB CYS 30 10.878 -5.895 1.110
264 HB3 CYS 30 1HB CYS 30 11.289 -5.391 2.743
265 H ASN 31 H ASN 31 12.694 -7.157 4.029
266 HA ASN 31 HA ASN 31 13.133 -9.878 3.635
267 HB2 ASN 31 2HB ASN 31 11.590 -8.568 5.884
268 HB3 ASN 31 1HB ASN 31 12.136 -10.232 5.885
269 HD21 ASN 31 1HD2 ASN 31 13.422 -9.963 7.677
270 HD22 ASN 31 2HD2 ASN 31 14.866 -9.021 7.672
271 H ILE 32 H ILE 32 10.136 -8.097 3.492
272 HA ILE 32 HA ILE 32 8.795 -10.506 2.460
273 HB ILE 32 HB ILE 32 6.729 -9.989 3.683
274 HG12 ILE 32 2HG1 ILE 32 8.271 -7.742 4.995
275 HG13 ILE 32 1HG1 ILE 32 7.019 -7.531 3.779
276 HG21 ILE 32 1HG2 ILE 32 9.063 -9.989 5.525
277 HG22 ILE 32 2HG2 ILE 32 8.351 -11.438 4.801
278 HG23 ILE 32 3HG2 ILE 32 7.419 -10.469 5.968
279 HD11 ILE 32 1HD1 ILE 32 6.642 -8.714 6.523
280 HD12 ILE 32 2HD1 ILE 32 5.379 -8.508 5.307
281 HD13 ILE 32 3HD1 ILE 32 6.164 -7.095 6.010
282 H LYS 33 H LYS 33 6.562 -9.701 1.489
283 HA LYS 33 HA LYS 33 7.097 -7.204 0.049
284 HB2 LYS 33 2HB LYS 33 6.691 -9.167 -1.398
285 HB3 LYS 33 1HB LYS 33 5.154 -9.444 -0.589
286 HG2 LYS 33 2HG LYS 33 4.401 -7.201 -1.395
287 HG3 LYS 33 1HG LYS 33 5.899 -7.083 -2.298
288 HD2 LYS 33 2HD LYS 33 5.313 -9.031 -3.615
289 HD3 LYS 33 1HD LYS 33 3.837 -9.252 -2.663
290 HE2 LYS 33 2HE LYS 33 3.062 -7.027 -3.420
291 HE3 LYS 33 1HE LYS 33 4.507 -6.891 -4.417
292 HZ1 LYS 33 1HZ LYS 33 2.364 -8.933 -4.721
293 HZ2 LYS 33 2HZ LYS 33 3.740 -8.840 -5.682
294 HZ3 LYS 33 3HZ LYS 33 2.599 -7.603 -5.707
295 H ALA 34 H ALA 34 6.045 -5.477 0.857
296 HA ALA 34 HA ALA 34 3.281 -5.758 1.723
297 HB1 ALA 34 1HB ALA 34 4.595 -5.940 3.812
298 HB2 ALA 34 2HB ALA 34 3.696 -4.425 3.763
299 HB3 ALA 34 3HB ALA 34 5.419 -4.435 3.405
300 H ILE 35 H ILE 35 2.271 -4.336 0.401
301 HA ILE 35 HA ILE 35 3.674 -2.215 -0.876
302 HB ILE 35 HB ILE 35 0.684 -2.654 -0.609
303 HG12 ILE 35 2HG1 ILE 35 1.849 -4.536 -1.621
304 HG13 ILE 35 1HG1 ILE 35 0.824 -3.722 -2.803
305 HG21 ILE 35 1HG2 ILE 35 0.498 -1.214 -2.637
306 HG22 ILE 35 2HG2 ILE 35 2.223 -0.912 -2.550
307 HG23 ILE 35 3HG2 ILE 35 1.172 -0.357 -1.259
308 HD11 ILE 35 1HD1 ILE 35 2.877 -4.371 -3.802
309 HD12 ILE 35 2HD1 ILE 35 3.830 -3.557 -2.548
310 HD13 ILE 35 3HD1 ILE 35 2.858 -2.614 -3.690
311 H ILE 36 H ILE 36 3.939 -0.100 -0.249
312 HA ILE 36 HA ILE 36 2.884 0.491 2.402
313 HB ILE 36 HB ILE 36 5.049 2.012 0.904
314 HG12 ILE 36 2HG1 ILE 36 6.561 1.052 2.793
315 HG13 ILE 36 1HG1 ILE 36 5.293 -0.149 2.990
316 HG21 ILE 36 1HG2 ILE 36 3.916 3.429 2.446
317 HG22 ILE 36 2HG2 ILE 36 5.545 3.032 3.027
318 HG23 ILE 36 3HG2 ILE 36 4.144 2.236 3.741
319 HD11 ILE 36 1HD1 ILE 36 5.612 -0.830 0.699
320 HD12 ILE 36 2HD1 ILE 36 7.105 -0.927 1.654
321 HD13 ILE 36 3HD1 ILE 36 6.851 0.419 0.526
322 H PHE 37 H PHE 37 1.117 1.490 2.377
323 HA PHE 37 HA PHE 37 0.211 3.192 0.210
324 HB2 PHE 37 2HB PHE 37 -0.936 2.017 2.699
325 HB3 PHE 37 1HB PHE 37 -1.761 3.363 1.909
326 HD1 PHE 37 1HD PHE 37 -0.005 0.484 0.394
327 HD2 PHE 37 2HD PHE 37 -3.654 2.390 1.167
328 HE1 PHE 37 1HE PHE 37 -1.215 -1.140 -1.151
329 HE2 PHE 37 2HE PHE 37 -4.835 0.816 -0.323
330 HZ PHE 37 HZ PHE 37 -3.590 -0.932 -1.466
331 H THR 38 H THR 38 0.008 5.297 0.331
332 HA THR 38 HA THR 38 0.758 6.548 2.866
333 HB THR 38 HB THR 38 1.193 7.641 0.069
334 HG1 THR 38 1HG THR 38 2.482 5.795 1.111
335 HG21 THR 38 1HG2 THR 38 0.834 9.351 1.736
336 HG22 THR 38 2HG2 THR 38 2.535 9.345 1.264
337 HG23 THR 38 3HG2 THR 38 2.012 8.615 2.805
338 H THR 39 H THR 39 -0.769 7.878 3.712
339 HA THR 39 HA THR 39 -3.234 8.128 2.221
340 HB THR 39 HB THR 39 -4.029 9.222 4.371
341 HG1 THR 39 1HG THR 39 -2.619 8.480 6.187
342 HG21 THR 39 1HG2 THR 39 -4.578 6.909 3.851
343 HG22 THR 39 2HG2 THR 39 -4.240 7.066 5.572
344 HG23 THR 39 3HG2 THR 39 -3.028 6.370 4.497
345 H LYS 40 H LYS 40 -4.345 10.394 2.620
346 HA LYS 40 HA LYS 40 -2.686 12.333 1.391
347 HB2 LYS 40 2HB LYS 40 -5.096 12.969 3.021
348 HB3 LYS 40 1HB LYS 40 -4.496 13.866 1.640
349 HG2 LYS 40 2HG LYS 40 -5.132 11.575 0.323
350 HG3 LYS 40 1HG LYS 40 -6.075 11.361 1.756
351 HD2 LYS 40 2HD LYS 40 -7.254 13.450 1.455
352 HD3 LYS 40 1HD LYS 40 -6.221 13.779 0.045
353 HE2 LYS 40 2HE LYS 40 -7.055 11.843 -1.074
354 HE3 LYS 40 1HE LYS 40 -8.055 11.435 0.298
355 HZ1 LYS 40 1HZ LYS 40 -9.300 13.489 -0.017
356 HZ2 LYS 40 2HZ LYS 40 -9.384 12.534 -1.387
357 HZ3 LYS 40 3HZ LYS 40 -8.383 13.892 -1.358
358 H LYS 41 H LYS 41 -3.085 11.364 4.624
359 HA LYS 41 HA LYS 41 -2.020 13.728 5.878
360 HB2 LYS 41 2HB LYS 41 -2.163 10.858 6.900
361 HB3 LYS 41 1HB LYS 41 -1.751 12.261 7.851
362 HG2 LYS 41 2HG LYS 41 -4.282 11.844 6.477
363 HG3 LYS 41 1HG LYS 41 -4.043 11.473 8.189
364 HD2 LYS 41 2HD LYS 41 -3.452 13.870 8.548
365 HD3 LYS 41 1HD LYS 41 -3.818 14.184 6.849
366 HE2 LYS 41 2HE LYS 41 -6.120 13.477 7.212
367 HE3 LYS 41 1HE LYS 41 -5.761 13.139 8.904
368 HZ1 LYS 41 1HZ LYS 41 -5.584 15.800 7.604
369 HZ2 LYS 41 2HZ LYS 41 -5.295 15.487 9.230
370 HZ3 LYS 41 3HZ LYS 41 -6.835 15.291 8.594
371 H GLY 42 H GLY 42 -0.861 11.234 3.998
372 HA2 GLY 42 2HA GLY 42 1.205 10.883 3.165
373 HA3 GLY 42 1HA GLY 42 1.821 12.129 4.217
374 H ARG 43 H ARG 43 0.014 9.739 5.825
375 HA ARG 43 HA ARG 43 2.189 8.764 7.297
376 HB2 ARG 43 2HB ARG 43 -0.084 8.936 8.171
377 HB3 ARG 43 1HB ARG 43 -0.625 7.829 6.909
378 HG2 ARG 43 2HG ARG 43 0.695 6.075 7.818
379 HG3 ARG 43 1HG ARG 43 1.321 7.159 9.071
380 HD2 ARG 43 2HD ARG 43 -0.893 7.348 10.051
381 HD3 ARG 43 1HD ARG 43 -1.587 6.389 8.739
382 HE ARG 43 HE ARG 43 0.267 4.744 9.733
383 HH11 ARG 43 1HH1 ARG 43 -2.278 6.568 11.374
384 HH12 ARG 43 2HH1 ARG 43 -2.533 5.380 12.567
385 HH21 ARG 43 1HH2 ARG 43 -0.098 3.124 11.398
386 HH22 ARG 43 2HH2 ARG 43 -1.292 3.409 12.582
387 H LYS 44 H LYS 44 3.064 6.621 7.207
388 HA LYS 44 HA LYS 44 2.769 5.359 4.592
389 HB2 LYS 44 2HB LYS 44 4.967 5.086 6.661
390 HB3 LYS 44 1HB LYS 44 4.931 4.261 5.110
391 HG2 LYS 44 2HG LYS 44 5.062 7.250 5.508
392 HG3 LYS 44 1HG LYS 44 6.413 6.208 5.061
393 HD2 LYS 44 2HD LYS 44 5.277 5.603 2.984
394 HD3 LYS 44 1HD LYS 44 3.886 6.575 3.441
395 HE2 LYS 44 2HE LYS 44 5.262 8.588 3.401
396 HE3 LYS 44 1HE LYS 44 6.671 7.623 2.966
397 HZ1 LYS 44 1HZ LYS 44 4.211 7.734 1.290
398 HZ2 LYS 44 2HZ LYS 44 5.673 7.068 0.889
399 HZ3 LYS 44 3HZ LYS 44 5.568 8.731 1.036
400 H ILE 45 H ILE 45 1.351 3.821 4.573
401 HA ILE 45 HA ILE 45 0.880 2.225 6.991
402 HB ILE 45 HB ILE 45 -0.907 2.541 4.555
403 HG12 ILE 45 2HG1 ILE 45 -2.504 3.729 6.207
404 HG13 ILE 45 1HG1 ILE 45 -1.093 3.889 7.259
405 HG21 ILE 45 1HG2 ILE 45 -1.444 1.183 7.178
406 HG22 ILE 45 2HG2 ILE 45 -1.213 0.414 5.608
407 HG23 ILE 45 3HG2 ILE 45 -2.628 1.424 5.895
408 HD11 ILE 45 1HD1 ILE 45 -1.582 5.884 6.033
409 HD12 ILE 45 2HD1 ILE 45 -1.419 5.007 4.510
410 HD13 ILE 45 3HD1 ILE 45 -0.012 5.224 5.556
411 H CYS 46 H CYS 46 1.732 0.279 6.899
412 HA CYS 46 HA CYS 46 2.637 -0.883 4.386
413 HB2 CYS 46 2HB CYS 46 2.704 -1.939 7.208
414 HB3 CYS 46 1HB CYS 46 3.616 -2.608 5.872
415 H ALA 47 H ALA 47 1.149 -1.957 3.168
416 HA ALA 47 HA ALA 47 -0.977 -3.320 4.673
417 HB1 ALA 47 1HB ALA 47 -1.197 -2.055 1.951
418 HB2 ALA 47 2HB ALA 47 -1.781 -1.345 3.456
419 HB3 ALA 47 3HB ALA 47 -2.490 -2.840 2.854
420 H ASN 48 H ASN 48 -1.586 -5.350 4.141
421 HA ASN 48 HA ASN 48 0.224 -6.866 2.703
422 HB2 ASN 48 2HB ASN 48 -0.777 -7.997 4.454
423 HB3 ASN 48 1HB ASN 48 -2.388 -7.467 4.031
424 HD21 ASN 48 1HD2 ASN 48 0.234 -9.559 2.888
425 HD22 ASN 48 2HD2 ASN 48 -0.921 -10.601 2.082
426 HA PRO 49 HA PRO 49 -1.198 -5.997 -1.371
427 HB2 PRO 49 2HB PRO 49 0.447 -7.839 -2.561
428 HB3 PRO 49 1HB PRO 49 0.929 -6.196 -2.164
429 HG2 PRO 49 2HG PRO 49 1.466 -8.737 -0.708
430 HG3 PRO 49 1HG PRO 49 2.497 -7.311 -0.912
431 HD2 PRO 49 2HD PRO 49 1.186 -7.838 1.365
432 HD3 PRO 49 1HD PRO 49 1.489 -6.181 0.819
433 H ASN 50 H ASN 50 -1.209 -9.009 0.270
434 HA ASN 50 HA ASN 50 -2.613 -10.275 -1.799
435 HB2 ASN 50 2HB ASN 50 -2.019 -11.279 0.963
436 HB3 ASN 50 1HB ASN 50 -2.988 -12.181 -0.195
437 HD21 ASN 50 1HD2 ASN 50 0.282 -11.122 0.613
438 HD22 ASN 50 2HD2 ASN 50 1.040 -12.055 -0.588
439 H GLU 51 H GLU 51 -3.569 -8.048 0.473
440 HA GLU 51 HA GLU 51 -6.192 -9.133 0.952
441 HB2 GLU 51 2HB GLU 51 -5.246 -6.309 1.470
442 HB3 GLU 51 1HB GLU 51 -6.739 -7.022 2.045
443 HG2 GLU 51 2HG GLU 51 -5.105 -8.730 3.249
444 HG3 GLU 51 1HG GLU 51 -3.962 -7.514 2.825
445 H LYS 52 H LYS 52 -7.960 -8.758 -0.095
446 HA LYS 52 HA LYS 52 -7.931 -8.013 -2.753
447 HB2 LYS 52 2HB LYS 52 -9.613 -9.464 -1.725
448 HB3 LYS 52 1HB LYS 52 -10.268 -8.096 -0.849
449 HG2 LYS 52 2HG LYS 52 -10.922 -7.054 -2.951
450 HG3 LYS 52 1HG LYS 52 -10.244 -8.422 -3.840
451 HD2 LYS 52 2HD LYS 52 -11.798 -9.924 -2.657
452 HD3 LYS 52 1HD LYS 52 -12.500 -8.521 -1.849
453 HE2 LYS 52 2HE LYS 52 -13.157 -7.600 -3.986
454 HE3 LYS 52 1HE LYS 52 -12.417 -8.966 -4.821
455 HZ1 LYS 52 1HZ LYS 52 -14.717 -9.087 -2.955
456 HZ2 LYS 52 2HZ LYS 52 -13.992 -10.425 -3.681
457 HZ3 LYS 52 3HZ LYS 52 -14.778 -9.279 -4.628
458 H TRP 53 H TRP 53 -8.679 -6.023 0.102
459 HA TRP 53 HA TRP 53 -9.679 -3.859 -1.418
460 HB2 TRP 53 2HB TRP 53 -9.588 -2.480 0.532
461 HB3 TRP 53 1HB TRP 53 -10.108 -4.074 1.045
462 HD1 TRP 53 HD TRP 53 -8.315 -5.478 2.602
463 HE1 TRP 53 1HE TRP 53 -6.395 -4.678 4.094
464 HE3 TRP 53 3HE TRP 53 -7.749 -0.744 0.749
465 HZ2 TRP 53 2HZ TRP 53 -4.834 -2.376 4.449
466 HZ3 TRP 53 3HZ TRP 53 -6.008 0.685 1.726
467 HH2 TRP 53 HH TRP 53 -4.584 -0.109 3.538
468 H VAL 54 H VAL 54 -6.505 -4.824 -0.482
469 HA VAL 54 HA VAL 54 -5.156 -2.420 -1.183
470 HB VAL 54 HB VAL 54 -4.129 -5.253 -0.805
471 HG11 VAL 54 1HG1 VAL 54 -2.571 -2.683 -1.080
472 HG12 VAL 54 2HG1 VAL 54 -2.581 -4.012 -2.239
473 HG13 VAL 54 3HG1 VAL 54 -1.889 -4.239 -0.627
474 HG21 VAL 54 1HG2 VAL 54 -4.010 -2.834 0.973
475 HG22 VAL 54 2HG2 VAL 54 -3.327 -4.425 1.331
476 HG23 VAL 54 3HG2 VAL 54 -5.072 -4.220 1.184
477 H GLN 55 H GLN 55 -5.774 -5.491 -2.744
478 HA GLN 55 HA GLN 55 -4.296 -4.961 -5.058
479 HB2 GLN 55 2HB GLN 55 -6.654 -6.805 -4.763
480 HB3 GLN 55 1HB GLN 55 -5.468 -6.828 -6.068
481 HG2 GLN 55 2HG GLN 55 -3.712 -7.094 -4.300
482 HG3 GLN 55 1HG GLN 55 -5.028 -7.388 -3.175
483 HE21 GLN 55 1HE2 GLN 55 -2.896 -8.999 -3.939
484 HE22 GLN 55 2HE2 GLN 55 -3.512 -10.450 -4.621
485 H LYS 56 H LYS 56 -7.667 -4.396 -4.198
486 HA LYS 56 HA LYS 56 -8.548 -3.431 -6.680
487 HB2 LYS 56 2HB LYS 56 -9.993 -4.189 -4.721
488 HB3 LYS 56 1HB LYS 56 -9.529 -2.708 -3.925
489 HG2 LYS 56 2HG LYS 56 -10.560 -1.378 -5.603
490 HG3 LYS 56 1HG LYS 56 -10.954 -2.819 -6.549
491 HD2 LYS 56 2HD LYS 56 -12.365 -3.609 -4.683
492 HD3 LYS 56 1HD LYS 56 -12.006 -2.124 -3.802
493 HE2 LYS 56 2HE LYS 56 -13.027 -0.807 -5.603
494 HE3 LYS 56 1HE LYS 56 -13.381 -2.285 -6.485
495 HZ1 LYS 56 1HZ LYS 56 -14.862 -2.970 -4.748
496 HZ2 LYS 56 2HZ LYS 56 -15.318 -1.454 -5.275
497 HZ3 LYS 56 3HZ LYS 56 -14.527 -1.635 -3.797
498 H ALA 57 H ALA 57 -6.990 -1.950 -3.890
499 HA ALA 57 HA ALA 57 -7.298 0.729 -4.757
500 HB1 ALA 57 1HB ALA 57 -5.650 1.293 -3.035
501 HB2 ALA 57 2HB ALA 57 -5.294 -0.402 -2.772
502 HB3 ALA 57 3HB ALA 57 -6.911 0.230 -2.400
503 H MET 58 H MET 58 -4.690 -1.602 -4.978
504 HA MET 58 HA MET 58 -2.793 0.092 -5.928
505 HB2 MET 58 2HB MET 58 -2.957 -2.872 -6.349
506 HB3 MET 58 1HB MET 58 -1.596 -1.917 -6.910
507 HG2 MET 58 2HG MET 58 -1.329 -1.133 -4.529
508 HG3 MET 58 1HG MET 58 -2.500 -2.372 -4.088
509 HE1 MET 58 1HE MET 58 -0.546 -5.636 -5.101
510 HE2 MET 58 2HE MET 58 -1.689 -4.776 -6.142
511 HE3 MET 58 3HE MET 58 -2.052 -5.017 -4.420
512 H LYS 59 H LYS 59 -5.186 -1.668 -7.809
513 HA LYS 59 HA LYS 59 -4.031 -1.067 -10.285
514 HB2 LYS 59 2HB LYS 59 -6.934 -1.613 -9.634
515 HB3 LYS 59 1HB LYS 59 -6.194 -1.692 -11.228
516 HG2 LYS 59 2HG LYS 59 -4.748 -3.535 -10.433
517 HG3 LYS 59 1HG LYS 59 -5.573 -3.482 -8.880
518 HD2 LYS 59 2HD LYS 59 -6.507 -5.263 -10.198
519 HD3 LYS 59 1HD LYS 59 -7.708 -3.977 -10.067
520 HE2 LYS 59 2HE LYS 59 -7.110 -3.176 -12.300
521 HE3 LYS 59 1HE LYS 59 -5.864 -4.419 -12.413
522 HZ1 LYS 59 1HZ LYS 59 -7.646 -6.095 -12.263
523 HZ2 LYS 59 2HZ LYS 59 -7.835 -5.083 -13.596
524 HZ3 LYS 59 3HZ LYS 59 -8.789 -4.866 -12.244
525 H HIS 60 H HIS 60 -6.343 0.608 -8.215
526 HA HIS 60 HA HIS 60 -6.907 2.622 -10.138
527 HB2 HIS 60 2HB HIS 60 -8.544 2.042 -8.497
528 HB3 HIS 60 1HB HIS 60 -7.420 2.389 -7.186
529 HD1 HIS 60 1HD HIS 60 -9.497 4.159 -9.844
530 HD2 HIS 60 2HD HIS 60 -7.378 4.959 -6.386
531 HE1 HIS 60 1HE HIS 60 -10.015 6.541 -9.319
532 HE2 HIS 60 2HE HIS 60 -8.848 7.004 -7.148
533 H LEU 61 H LEU 61 -4.784 2.349 -7.359
534 HA LEU 61 HA LEU 61 -3.879 5.036 -7.418
535 HB2 LEU 61 2HB LEU 61 -2.687 2.561 -6.204
536 HB3 LEU 61 1HB LEU 61 -2.057 4.176 -5.929
537 HG LEU 61 HG LEU 61 -4.834 3.255 -5.161
538 HD11 LEU 61 1HD1 LEU 61 -2.387 3.646 -3.442
539 HD12 LEU 61 2HD1 LEU 61 -3.145 2.100 -3.845
540 HD13 LEU 61 3HD1 LEU 61 -4.018 3.281 -2.878
541 HD21 LEU 61 1HD2 LEU 61 -3.298 5.765 -4.510
542 HD22 LEU 61 2HD2 LEU 61 -4.867 5.323 -3.848
543 HD23 LEU 61 3HD2 LEU 61 -4.702 5.652 -5.573
544 H ASP 62 H ASP 62 -3.020 2.218 -9.182
545 HA ASP 62 HA ASP 62 -0.480 3.082 -10.159
546 HB2 ASP 62 2HB ASP 62 -1.168 0.723 -10.224
547 HB3 ASP 62 1HB ASP 62 -2.503 1.128 -11.291
548 H LYS 63 H LYS 63 -3.749 3.896 -10.839
549 HA LYS 63 HA LYS 63 -3.206 4.789 -13.509
550 HB2 LYS 63 2HB LYS 63 -5.740 5.226 -11.919
551 HB3 LYS 63 1HB LYS 63 -5.548 5.304 -13.666
552 HG2 LYS 63 2HG LYS 63 -5.419 2.848 -11.928
553 HG3 LYS 63 1HG LYS 63 -6.672 3.267 -13.095
554 HD2 LYS 63 2HD LYS 63 -5.102 2.993 -14.923
555 HD3 LYS 63 1HD LYS 63 -3.784 2.734 -13.779
556 HE2 LYS 63 2HE LYS 63 -4.521 0.582 -14.654
557 HE3 LYS 63 1HE LYS 63 -4.930 0.712 -12.945
558 HZ1 LYS 63 1HZ LYS 63 -6.784 1.183 -15.187
559 HZ2 LYS 63 2HZ LYS 63 -7.194 1.262 -13.559
560 HZ3 LYS 63 3HZ LYS 63 -6.740 -0.209 -14.264
561 H LYS 64 H LYS 64 -2.333 5.976 -10.687
562 HA LYS 64 HA LYS 64 -2.884 8.768 -11.339
563 HB2 LYS 64 2HB LYS 64 -1.722 7.550 -8.820
564 HB3 LYS 64 1HB LYS 64 -1.967 9.264 -9.084
565 HG2 LYS 64 2HG LYS 64 -4.396 8.863 -9.225
566 HG3 LYS 64 1HG LYS 64 -4.110 7.155 -8.874
567 HD2 LYS 64 2HD LYS 64 -3.090 7.757 -6.736
568 HD3 LYS 64 1HD LYS 64 -3.327 9.464 -7.099
569 HE2 LYS 64 2HE LYS 64 -5.763 9.092 -7.142
570 HE3 LYS 64 1HE LYS 64 -5.495 7.399 -6.742
571 HZ1 LYS 64 1HZ LYS 64 -4.774 9.721 -5.021
572 HZ2 LYS 64 2HZ LYS 64 -4.477 8.127 -4.626
573 HZ3 LYS 64 3HZ LYS 64 -6.053 8.676 -4.767
Start of MODEL 12
1 H1 ALA 1 1HT ALA 1 13.812 5.837 13.124
2 H2 ALA 1 2HT ALA 1 14.759 7.188 12.783
3 H3 ALA 1 3HT ALA 1 15.380 5.926 13.728
4 HA ALA 1 HA ALA 1 16.258 5.845 11.484
5 HB1 ALA 1 1HB ALA 1 16.000 3.782 12.770
6 HB2 ALA 1 2HB ALA 1 15.719 3.514 11.052
7 HB3 ALA 1 3HB ALA 1 14.351 3.609 12.161
8 H ARG 2 H ARG 2 15.803 5.357 9.224
9 HA ARG 2 HA ARG 2 13.141 6.268 8.424
10 HB2 ARG 2 2HB ARG 2 15.743 6.286 6.857
11 HB3 ARG 2 1HB ARG 2 14.186 6.650 6.149
12 HG2 ARG 2 2HG ARG 2 15.291 8.715 6.555
13 HG3 ARG 2 1HG ARG 2 14.008 8.567 7.750
14 HD2 ARG 2 2HD ARG 2 15.670 7.814 9.398
15 HD3 ARG 2 1HD ARG 2 16.941 8.024 8.197
16 HE ARG 2 HE ARG 2 15.240 10.283 8.896
17 HH11 ARG 2 1HH1 ARG 2 18.449 8.795 8.939
18 HH12 ARG 2 2HH1 ARG 2 19.258 10.195 9.472
19 HH21 ARG 2 1HH2 ARG 2 16.360 12.225 9.653
20 HH22 ARG 2 2HH2 ARG 2 18.038 12.163 9.900
21 H LYS 3 H LYS 3 11.832 4.660 7.937
22 HA LYS 3 HA LYS 3 13.071 2.272 6.817
23 HB2 LYS 3 2HB LYS 3 10.520 2.493 8.411
24 HB3 LYS 3 1HB LYS 3 11.081 1.023 7.623
25 HG2 LYS 3 2HG LYS 3 13.108 1.080 8.970
26 HG3 LYS 3 1HG LYS 3 12.525 2.522 9.798
27 HD2 LYS 3 2HD LYS 3 10.597 1.250 10.622
28 HD3 LYS 3 1HD LYS 3 11.194 -0.185 9.786
29 HE2 LYS 3 2HE LYS 3 12.639 1.314 11.968
30 HE3 LYS 3 1HE LYS 3 11.788 -0.217 12.165
31 HZ1 LYS 3 1HZ LYS 3 13.366 -1.232 10.617
32 HZ2 LYS 3 2HZ LYS 3 14.184 -0.543 11.908
33 HZ3 LYS 3 3HZ LYS 3 14.170 0.224 10.422
34 H SER 4 H SER 4 12.605 1.662 4.914
35 HA SER 4 HA SER 4 10.297 2.822 3.533
36 HB2 SER 4 2HB SER 4 12.866 1.701 2.392
37 HB3 SER 4 1HB SER 4 11.591 2.545 1.505
38 HG SER 4 HG SER 4 12.549 3.887 3.670
39 H CYS 5 H CYS 5 11.405 0.152 5.089
40 HA CYS 5 HA CYS 5 9.915 -1.716 3.403
41 HB2 CYS 5 2HB CYS 5 12.159 -2.245 5.347
42 HB3 CYS 5 1HB CYS 5 11.234 -3.481 4.516
43 H CYS 6 H CYS 6 8.471 -3.054 4.404
44 HA CYS 6 HA CYS 6 7.785 -2.413 7.149
45 HB2 CYS 6 2HB CYS 6 6.161 -3.344 4.812
46 HB3 CYS 6 1HB CYS 6 5.542 -3.151 6.447
47 H LEU 7 H LEU 7 7.361 -4.104 8.470
48 HA LEU 7 HA LEU 7 7.928 -6.810 7.467
49 HB2 LEU 7 2HB LEU 7 8.570 -5.675 10.208
50 HB3 LEU 7 1HB LEU 7 8.692 -7.363 9.797
51 HG LEU 7 HG LEU 7 10.470 -6.723 8.121
52 HD11 LEU 7 1HD1 LEU 7 11.624 -4.607 8.412
53 HD12 LEU 7 2HD1 LEU 7 10.393 -4.082 9.562
54 HD13 LEU 7 3HD1 LEU 7 9.963 -4.366 7.874
55 HD21 LEU 7 1HD2 LEU 7 10.985 -7.716 10.274
56 HD22 LEU 7 2HD2 LEU 7 10.996 -6.122 11.024
57 HD23 LEU 7 3HD2 LEU 7 12.209 -6.539 9.811
58 H LYS 8 H LYS 8 5.596 -4.794 8.439
59 HA LYS 8 HA LYS 8 3.915 -6.925 9.445
60 HB2 LYS 8 2HB LYS 8 4.655 -5.516 11.330
61 HB3 LYS 8 1HB LYS 8 4.142 -4.082 10.464
62 HG2 LYS 8 2HG LYS 8 1.857 -4.883 10.503
63 HG3 LYS 8 1HG LYS 8 2.354 -6.294 11.432
64 HD2 LYS 8 2HD LYS 8 2.630 -3.407 12.313
65 HD3 LYS 8 1HD LYS 8 1.385 -4.519 12.874
66 HE2 LYS 8 2HE LYS 8 4.366 -4.824 13.306
67 HE3 LYS 8 1HE LYS 8 3.197 -4.287 14.502
68 HZ1 LYS 8 1HZ LYS 8 2.098 -6.486 14.287
69 HZ2 LYS 8 2HZ LYS 8 3.692 -6.599 14.822
70 HZ3 LYS 8 3HZ LYS 8 3.330 -6.972 13.245
71 H TYR 9 H TYR 9 1.780 -6.662 8.708
72 HA TYR 9 HA TYR 9 1.329 -4.579 6.681
73 HB2 TYR 9 2HB TYR 9 -0.430 -7.091 6.977
74 HB3 TYR 9 1HB TYR 9 -0.259 -5.974 5.687
75 HD1 TYR 9 1HD TYR 9 1.235 -6.249 3.990
76 HD2 TYR 9 2HD TYR 9 1.490 -8.754 7.381
77 HE1 TYR 9 1HE TYR 9 2.777 -7.735 2.766
78 HE2 TYR 9 2HE TYR 9 3.029 -10.254 6.180
79 HH TYR 9 HH TYR 9 4.406 -9.327 3.172
80 H THR 10 H THR 10 -0.717 -3.427 6.902
81 HA THR 10 HA THR 10 -1.552 -3.105 9.552
82 HB THR 10 HB THR 10 -1.719 -1.195 8.055
83 HG1 THR 10 1HG THR 10 -4.340 -1.202 8.238
84 HG21 THR 10 1HG2 THR 10 -3.364 -1.110 6.216
85 HG22 THR 10 2HG2 THR 10 -3.769 -2.803 6.509
86 HG23 THR 10 3HG2 THR 10 -2.155 -2.360 5.942
87 H LYS 11 H LYS 11 -3.339 -3.796 10.569
88 HA LYS 11 HA LYS 11 -4.603 -6.167 9.435
89 HB2 LYS 11 2HB LYS 11 -3.541 -6.172 11.709
90 HB3 LYS 11 1HB LYS 11 -4.762 -5.032 12.232
91 HG2 LYS 11 2HG LYS 11 -6.485 -6.700 11.865
92 HG3 LYS 11 1HG LYS 11 -5.268 -7.837 11.269
93 HD2 LYS 11 2HD LYS 11 -4.119 -7.711 13.435
94 HD3 LYS 11 1HD LYS 11 -5.382 -6.636 14.033
95 HE2 LYS 11 2HE LYS 11 -7.036 -8.403 13.657
96 HE3 LYS 11 1HE LYS 11 -5.758 -9.467 13.076
97 HZ1 LYS 11 1HZ LYS 11 -6.249 -9.943 15.356
98 HZ2 LYS 11 2HZ LYS 11 -5.981 -8.341 15.816
99 HZ3 LYS 11 3HZ LYS 11 -4.708 -9.285 15.240
100 H ARG 12 H ARG 12 -5.162 -2.921 9.582
101 HA ARG 12 HA ARG 12 -8.050 -3.337 9.367
102 HB2 ARG 12 2HB ARG 12 -8.444 -1.120 10.298
103 HB3 ARG 12 1HB ARG 12 -7.489 -2.063 11.424
104 HG2 ARG 12 2HG ARG 12 -5.465 -0.888 10.685
105 HG3 ARG 12 1HG ARG 12 -6.439 0.063 9.567
106 HD2 ARG 12 2HD ARG 12 -7.747 0.903 11.491
107 HD3 ARG 12 1HD ARG 12 -6.652 0.023 12.564
108 HE ARG 12 HE ARG 12 -5.530 1.950 10.697
109 HH11 ARG 12 1HH1 ARG 12 -6.310 1.134 14.048
110 HH12 ARG 12 2HH1 ARG 12 -5.379 2.388 14.721
111 HH21 ARG 12 1HH2 ARG 12 -4.305 3.646 11.564
112 HH22 ARG 12 2HH2 ARG 12 -4.167 3.910 13.245
113 HA PRO 13 HA PRO 13 -7.390 -1.883 5.242
114 HB2 PRO 13 2HB PRO 13 -9.961 -1.147 4.674
115 HB3 PRO 13 1HB PRO 13 -9.388 -2.819 4.649
116 HG2 PRO 13 2HG PRO 13 -10.859 -1.356 6.800
117 HG3 PRO 13 1HG PRO 13 -11.116 -3.008 6.202
118 HD2 PRO 13 2HD PRO 13 -9.804 -2.498 8.480
119 HD3 PRO 13 1HD PRO 13 -9.325 -3.840 7.415
120 H LEU 14 H LEU 14 -6.934 -0.009 4.280
121 HA LEU 14 HA LEU 14 -7.346 2.525 5.722
122 HB2 LEU 14 2HB LEU 14 -5.099 1.440 4.723
123 HB3 LEU 14 1HB LEU 14 -5.730 2.082 3.244
124 HG LEU 14 HG LEU 14 -4.780 3.590 5.655
125 HD11 LEU 14 1HD1 LEU 14 -3.860 3.471 2.828
126 HD12 LEU 14 2HD1 LEU 14 -3.063 2.777 4.248
127 HD13 LEU 14 3HD1 LEU 14 -3.215 4.529 4.075
128 HD21 LEU 14 1HD2 LEU 14 -6.665 4.871 4.864
129 HD22 LEU 14 2HD2 LEU 14 -6.075 4.743 3.185
130 HD23 LEU 14 3HD2 LEU 14 -5.125 5.604 4.394
131 HA PRO 15 HA PRO 15 -10.535 3.030 2.493
132 HB2 PRO 15 2HB PRO 15 -10.449 5.882 3.274
133 HB3 PRO 15 1HB PRO 15 -11.826 4.781 3.236
134 HG2 PRO 15 2HG PRO 15 -10.734 5.572 5.552
135 HG3 PRO 15 1HG PRO 15 -11.386 3.935 5.335
136 HD2 PRO 15 2HD PRO 15 -8.558 4.877 5.358
137 HD3 PRO 15 1HD PRO 15 -9.259 3.381 6.012
138 H LEU 16 H LEU 16 -10.234 3.476 0.394
139 HA LEU 16 HA LEU 16 -7.760 4.375 -0.573
140 HB2 LEU 16 2HB LEU 16 -9.013 2.803 -1.818
141 HB3 LEU 16 1HB LEU 16 -10.367 3.949 -1.991
142 HG LEU 16 HG LEU 16 -8.751 5.315 -3.330
143 HD11 LEU 16 1HD1 LEU 16 -6.804 4.092 -4.255
144 HD12 LEU 16 2HD1 LEU 16 -7.124 2.798 -3.114
145 HD13 LEU 16 3HD1 LEU 16 -6.680 4.389 -2.517
146 HD21 LEU 16 1HD2 LEU 16 -9.448 2.555 -4.240
147 HD22 LEU 16 2HD2 LEU 16 -9.050 3.951 -5.281
148 HD23 LEU 16 3HD2 LEU 16 -10.480 3.990 -4.230
149 H LYS 17 H LYS 17 -10.708 5.954 -0.048
150 HA LYS 17 HA LYS 17 -10.288 8.304 -1.507
151 HB2 LYS 17 2HB LYS 17 -11.946 7.827 0.960
152 HB3 LYS 17 1HB LYS 17 -12.019 9.295 -0.007
153 HG2 LYS 17 2HG LYS 17 -12.703 8.002 -1.953
154 HG3 LYS 17 1HG LYS 17 -12.625 6.518 -1.008
155 HD2 LYS 17 2HD LYS 17 -14.444 8.855 -0.430
156 HD3 LYS 17 1HD LYS 17 -14.919 7.396 -1.298
157 HE2 LYS 17 2HE LYS 17 -14.375 6.068 0.696
158 HE3 LYS 17 1HE LYS 17 -13.953 7.549 1.554
159 HZ1 LYS 17 1HZ LYS 17 -16.613 6.921 0.413
160 HZ2 LYS 17 2HZ LYS 17 -16.228 8.316 1.270
161 HZ3 LYS 17 3HZ LYS 17 -16.219 6.810 2.036
162 H ARG 18 H ARG 18 -8.577 7.189 1.037
163 HA ARG 18 HA ARG 18 -7.668 9.927 1.841
164 HB2 ARG 18 2HB ARG 18 -7.571 7.379 3.479
165 HB3 ARG 18 1HB ARG 18 -6.905 8.925 3.965
166 HG2 ARG 18 2HG ARG 18 -9.826 8.341 3.509
167 HG3 ARG 18 1HG ARG 18 -9.027 8.422 5.078
168 HD2 ARG 18 2HD ARG 18 -8.415 10.785 4.560
169 HD3 ARG 18 1HD ARG 18 -9.379 10.663 3.089
170 HE ARG 18 HE ARG 18 -10.880 9.897 5.356
171 HH11 ARG 18 1HH1 ARG 18 -9.707 12.757 3.652
172 HH12 ARG 18 2HH1 ARG 18 -10.858 13.804 4.323
173 HH21 ARG 18 1HH2 ARG 18 -12.471 11.343 6.280
174 HH22 ARG 18 2HH2 ARG 18 -12.444 12.990 5.855
175 H ILE 19 H ILE 19 -6.791 7.604 -0.161
176 HA ILE 19 HA ILE 19 -3.984 7.486 0.704
177 HB ILE 19 HB ILE 19 -5.373 5.738 -1.354
178 HG12 ILE 19 2HG1 ILE 19 -4.589 5.019 1.457
179 HG13 ILE 19 1HG1 ILE 19 -6.248 5.403 1.016
180 HG21 ILE 19 1HG2 ILE 19 -2.689 5.485 0.035
181 HG22 ILE 19 2HG2 ILE 19 -2.934 5.887 -1.662
182 HG23 ILE 19 3HG2 ILE 19 -3.377 4.292 -1.053
183 HD11 ILE 19 1HD1 ILE 19 -6.192 3.465 -0.570
184 HD12 ILE 19 2HD1 ILE 19 -5.906 3.003 1.112
185 HD13 ILE 19 3HD1 ILE 19 -4.576 3.166 -0.053
186 H LYS 20 H LYS 20 -2.462 8.339 -0.584
187 HA LYS 20 HA LYS 20 -3.342 9.735 -2.979
188 HB2 LYS 20 2HB LYS 20 -0.677 9.838 -1.557
189 HB3 LYS 20 1HB LYS 20 -1.146 10.863 -2.886
190 HG2 LYS 20 2HG LYS 20 -2.294 10.811 -0.156
191 HG3 LYS 20 1HG LYS 20 -1.330 12.085 -0.912
192 HD2 LYS 20 2HD LYS 20 -4.088 11.169 -1.591
193 HD3 LYS 20 1HD LYS 20 -3.634 12.689 -0.881
194 HE2 LYS 20 2HE LYS 20 -2.380 13.394 -2.854
195 HE3 LYS 20 1HE LYS 20 -2.782 11.887 -3.688
196 HZ1 LYS 20 1HZ LYS 20 -4.664 14.040 -2.867
197 HZ2 LYS 20 2HZ LYS 20 -5.128 12.584 -3.600
198 HZ3 LYS 20 3HZ LYS 20 -4.165 13.677 -4.424
199 H SER 21 H SER 21 -0.912 7.309 -1.979
200 HA SER 21 HA SER 21 -0.805 6.163 -4.591
201 HB2 SER 21 2HB SER 21 1.619 7.733 -3.611
202 HB3 SER 21 1HB SER 21 1.598 6.673 -5.011
203 HG SER 21 HG SER 21 1.386 8.852 -5.569
204 H TYR 22 H TYR 22 1.035 4.459 -4.581
205 HA TYR 22 HA TYR 22 1.695 3.600 -1.848
206 HB2 TYR 22 2HB TYR 22 1.267 1.315 -2.397
207 HB3 TYR 22 1HB TYR 22 -0.197 2.236 -2.673
208 HD1 TYR 22 1HD TYR 22 -1.294 2.016 -4.681
209 HD2 TYR 22 2HD TYR 22 2.730 0.744 -4.490
210 HE1 TYR 22 1HE TYR 22 -1.511 1.008 -6.896
211 HE2 TYR 22 2HE TYR 22 2.548 -0.248 -6.728
212 HH TYR 22 HH TYR 22 -0.030 0.409 -8.781
213 H THR 23 H THR 23 3.338 1.913 -1.902
214 HA THR 23 HA THR 23 5.230 2.237 -4.105
215 HB THR 23 HB THR 23 5.857 2.154 -1.147
216 HG1 THR 23 1HG THR 23 5.181 4.125 -2.679
217 HG21 THR 23 1HG2 THR 23 7.509 0.953 -2.482
218 HG22 THR 23 2HG2 THR 23 8.195 2.446 -1.832
219 HG23 THR 23 3HG2 THR 23 7.708 2.353 -3.533
220 H ILE 24 H ILE 24 5.964 0.304 -4.866
221 HA ILE 24 HA ILE 24 4.980 -2.124 -3.687
222 HB ILE 24 HB ILE 24 6.834 -1.727 -6.056
223 HG12 ILE 24 2HG1 ILE 24 3.847 -2.234 -5.987
224 HG13 ILE 24 1HG1 ILE 24 4.611 -0.699 -6.374
225 HG21 ILE 24 1HG2 ILE 24 5.284 -4.167 -5.157
226 HG22 ILE 24 2HG2 ILE 24 7.037 -3.968 -5.094
227 HG23 ILE 24 3HG2 ILE 24 6.212 -4.039 -6.651
228 HD11 ILE 24 1HD1 ILE 24 4.862 -3.248 -7.956
229 HD12 ILE 24 2HD1 ILE 24 5.636 -1.713 -8.348
230 HD13 ILE 24 3HD1 ILE 24 3.878 -1.849 -8.380
231 H GLN 25 H GLN 25 5.996 -2.954 -1.995
232 HA GLN 25 HA GLN 25 8.864 -2.625 -1.674
233 HB2 GLN 25 2HB GLN 25 7.749 -2.303 0.326
234 HB3 GLN 25 1HB GLN 25 6.661 -3.653 0.126
235 HG2 GLN 25 2HG GLN 25 8.543 -5.169 0.495
236 HG3 GLN 25 1HG GLN 25 9.597 -3.776 0.733
237 HE21 GLN 25 1HE2 GLN 25 8.707 -5.975 2.500
238 HE22 GLN 25 2HE2 GLN 25 8.127 -5.211 3.936
239 H SER 26 H SER 26 10.313 -4.173 -2.011
240 HA SER 26 HA SER 26 9.243 -6.610 -3.166
241 HB2 SER 26 2HB SER 26 11.452 -6.866 -4.233
242 HB3 SER 26 1HB SER 26 10.727 -5.309 -4.610
243 HG SER 26 HG SER 26 12.037 -4.386 -2.971
244 H ASN 27 H ASN 27 9.923 -8.619 -2.438
245 HA ASN 27 HA ASN 27 10.950 -8.687 0.255
246 HB2 ASN 27 2HB ASN 27 10.768 -11.193 0.066
247 HB3 ASN 27 1HB ASN 27 9.260 -10.339 -0.235
248 HD21 ASN 27 1HD2 ASN 27 8.355 -10.432 -2.244
249 HD22 ASN 27 2HD2 ASN 27 8.906 -11.466 -3.491
250 H GLU 28 H GLU 28 12.343 -8.392 -2.641
251 HA GLU 28 HA GLU 28 14.740 -9.871 -2.233
252 HB2 GLU 28 2HB GLU 28 14.159 -7.502 -4.006
253 HB3 GLU 28 1HB GLU 28 15.629 -8.464 -4.075
254 HG2 GLU 28 2HG GLU 28 14.322 -10.434 -4.675
255 HG3 GLU 28 1HG GLU 28 12.843 -9.484 -4.573
256 H ALA 29 H ALA 29 13.795 -6.486 -1.718
257 HA ALA 29 HA ALA 29 16.375 -5.926 -0.455
258 HB1 ALA 29 1HB ALA 29 15.713 -3.585 -0.585
259 HB2 ALA 29 2HB ALA 29 14.129 -4.059 -1.188
260 HB3 ALA 29 3HB ALA 29 15.564 -4.371 -2.161
261 H CYS 30 H CYS 30 13.027 -6.340 0.325
262 HA CYS 30 HA CYS 30 13.583 -5.554 3.099
263 HB2 CYS 30 2HB CYS 30 10.950 -5.670 1.637
264 HB3 CYS 30 1HB CYS 30 11.215 -5.052 3.259
265 H ASN 31 H ASN 31 12.226 -6.881 4.679
266 HA ASN 31 HA ASN 31 12.752 -9.613 4.419
267 HB2 ASN 31 2HB ASN 31 10.798 -8.198 6.233
268 HB3 ASN 31 1HB ASN 31 11.075 -9.929 6.303
269 HD21 ASN 31 1HD2 ASN 31 11.831 -9.823 8.387
270 HD22 ASN 31 2HD2 ASN 31 13.383 -9.160 8.769
271 H ILE 32 H ILE 32 9.813 -7.863 3.730
272 HA ILE 32 HA ILE 32 8.705 -10.295 2.499
273 HB ILE 32 HB ILE 32 6.467 -9.683 3.371
274 HG12 ILE 32 2HG1 ILE 32 7.983 -7.585 4.949
275 HG13 ILE 32 1HG1 ILE 32 6.835 -7.278 3.656
276 HG21 ILE 32 1HG2 ILE 32 8.552 -9.980 5.481
277 HG22 ILE 32 2HG2 ILE 32 7.806 -11.312 4.580
278 HG23 ILE 32 3HG2 ILE 32 6.838 -10.333 5.703
279 HD11 ILE 32 1HD1 ILE 32 6.221 -8.516 6.327
280 HD12 ILE 32 2HD1 ILE 32 5.052 -8.220 5.037
281 HD13 ILE 32 3HD1 ILE 32 5.855 -6.863 5.828
282 H LYS 33 H LYS 33 6.673 -9.598 1.226
283 HA LYS 33 HA LYS 33 7.164 -7.055 -0.096
284 HB2 LYS 33 2HB LYS 33 6.988 -9.031 -1.555
285 HB3 LYS 33 1HB LYS 33 5.416 -9.409 -0.870
286 HG2 LYS 33 2HG LYS 33 4.458 -7.418 -1.832
287 HG3 LYS 33 1HG LYS 33 6.040 -6.888 -2.390
288 HD2 LYS 33 2HD LYS 33 6.207 -8.890 -3.819
289 HD3 LYS 33 1HD LYS 33 4.588 -9.371 -3.308
290 HE2 LYS 33 2HE LYS 33 3.638 -7.392 -4.304
291 HE3 LYS 33 1HE LYS 33 5.242 -6.775 -4.695
292 HZ1 LYS 33 1HZ LYS 33 4.062 -9.268 -5.817
293 HZ2 LYS 33 2HZ LYS 33 5.569 -8.618 -6.168
294 HZ3 LYS 33 3HZ LYS 33 4.185 -7.795 -6.627
295 H ALA 34 H ALA 34 6.030 -5.412 0.692
296 HA ALA 34 HA ALA 34 3.252 -5.804 1.456
297 HB1 ALA 34 1HB ALA 34 4.518 -5.911 3.578
298 HB2 ALA 34 2HB ALA 34 3.586 -4.429 3.499
299 HB3 ALA 34 3HB ALA 34 5.315 -4.394 3.183
300 H ILE 35 H ILE 35 2.199 -4.420 0.177
301 HA ILE 35 HA ILE 35 3.527 -2.264 -1.142
302 HB ILE 35 HB ILE 35 0.539 -2.743 -0.840
303 HG12 ILE 35 2HG1 ILE 35 1.732 -4.622 -1.868
304 HG13 ILE 35 1HG1 ILE 35 0.648 -3.846 -3.035
305 HG21 ILE 35 1HG2 ILE 35 0.314 -1.319 -2.883
306 HG22 ILE 35 2HG2 ILE 35 2.035 -0.994 -2.811
307 HG23 ILE 35 3HG2 ILE 35 0.991 -0.456 -1.510
308 HD11 ILE 35 1HD1 ILE 35 2.677 -4.512 -4.038
309 HD12 ILE 35 2HD1 ILE 35 3.638 -3.676 -2.813
310 HD13 ILE 35 3HD1 ILE 35 2.672 -2.743 -3.975
311 H ILE 36 H ILE 36 3.894 -0.234 -0.433
312 HA ILE 36 HA ILE 36 2.810 0.416 2.187
313 HB ILE 36 HB ILE 36 4.957 1.938 0.658
314 HG12 ILE 36 2HG1 ILE 36 6.465 1.063 2.580
315 HG13 ILE 36 1HG1 ILE 36 5.213 -0.145 2.817
316 HG21 ILE 36 1HG2 ILE 36 3.781 3.365 2.170
317 HG22 ILE 36 2HG2 ILE 36 5.422 3.026 2.756
318 HG23 ILE 36 3HG2 ILE 36 4.040 2.209 3.489
319 HD11 ILE 36 1HD1 ILE 36 5.541 -0.906 0.556
320 HD12 ILE 36 2HD1 ILE 36 7.037 -0.937 1.517
321 HD13 ILE 36 3HD1 ILE 36 6.763 0.354 0.336
322 H PHE 37 H PHE 37 1.068 1.450 2.219
323 HA PHE 37 HA PHE 37 0.120 3.111 0.046
324 HB2 PHE 37 2HB PHE 37 -1.003 2.072 2.629
325 HB3 PHE 37 1HB PHE 37 -1.825 3.334 1.714
326 HD1 PHE 37 1HD PHE 37 -0.035 0.496 0.291
327 HD2 PHE 37 2HD PHE 37 -3.741 2.157 1.248
328 HE1 PHE 37 1HE PHE 37 -1.208 -1.261 -1.129
329 HE2 PHE 37 2HE PHE 37 -4.903 0.476 -0.112
330 HZ PHE 37 HZ PHE 37 -3.631 -1.220 -1.290
331 H THR 38 H THR 38 0.056 5.225 0.132
332 HA THR 38 HA THR 38 0.948 6.459 2.631
333 HB THR 38 HB THR 38 1.390 7.497 -0.182
334 HG1 THR 38 1HG THR 38 2.583 5.591 1.185
335 HG21 THR 38 1HG2 THR 38 1.282 9.221 1.518
336 HG22 THR 38 2HG2 THR 38 2.965 9.037 0.983
337 HG23 THR 38 3HG2 THR 38 2.420 8.342 2.522
338 H THR 39 H THR 39 -0.363 8.019 3.463
339 HA THR 39 HA THR 39 -2.918 8.325 2.156
340 HB THR 39 HB THR 39 -3.474 9.604 4.257
341 HG1 THR 39 1HG THR 39 -1.965 8.985 6.028
342 HG21 THR 39 1HG2 THR 39 -4.153 7.311 3.965
343 HG22 THR 39 2HG2 THR 39 -3.674 7.562 5.643
344 HG23 THR 39 3HG2 THR 39 -2.586 6.733 4.518
345 H LYS 40 H LYS 40 -3.890 10.603 2.489
346 HA LYS 40 HA LYS 40 -2.333 12.456 1.032
347 HB2 LYS 40 2HB LYS 40 -4.656 13.161 2.784
348 HB3 LYS 40 1HB LYS 40 -4.170 13.981 1.300
349 HG2 LYS 40 2HG LYS 40 -4.788 11.544 0.238
350 HG3 LYS 40 1HG LYS 40 -5.684 11.477 1.713
351 HD2 LYS 40 2HD LYS 40 -6.926 13.490 1.189
352 HD3 LYS 40 1HD LYS 40 -5.930 13.686 -0.262
353 HE2 LYS 40 2HE LYS 40 -6.747 11.658 -1.199
354 HE3 LYS 40 1HE LYS 40 -7.656 11.287 0.257
355 HZ1 LYS 40 1HZ LYS 40 -9.070 13.195 -0.155
356 HZ2 LYS 40 2HZ LYS 40 -9.050 12.199 -1.500
357 HZ3 LYS 40 3HZ LYS 40 -8.166 13.622 -1.504
358 H LYS 41 H LYS 41 -2.610 11.704 4.364
359 HA LYS 41 HA LYS 41 -1.336 14.096 5.328
360 HB2 LYS 41 2HB LYS 41 -1.758 11.393 6.632
361 HB3 LYS 41 1HB LYS 41 -0.930 12.708 7.428
362 HG2 LYS 41 2HG LYS 41 -3.162 12.610 8.264
363 HG3 LYS 41 1HG LYS 41 -3.034 14.046 7.258
364 HD2 LYS 41 2HD LYS 41 -4.153 12.833 5.433
365 HD3 LYS 41 1HD LYS 41 -4.273 11.408 6.462
366 HE2 LYS 41 2HE LYS 41 -5.541 14.103 6.988
367 HE3 LYS 41 1HE LYS 41 -6.381 12.650 6.457
368 HZ1 LYS 41 1HZ LYS 41 -5.022 13.065 9.069
369 HZ2 LYS 41 2HZ LYS 41 -5.691 11.596 8.587
370 HZ3 LYS 41 3HZ LYS 41 -6.669 12.950 8.811
371 H GLY 42 H GLY 42 -0.408 11.431 3.611
372 HA2 GLY 42 2HA GLY 42 1.594 10.947 2.704
373 HA3 GLY 42 1HA GLY 42 2.310 12.217 3.658
374 H ARG 43 H ARG 43 0.494 9.928 5.463
375 HA ARG 43 HA ARG 43 2.756 8.971 6.853
376 HB2 ARG 43 2HB ARG 43 0.516 9.405 7.814
377 HB3 ARG 43 1HB ARG 43 -0.102 8.098 6.806
378 HG2 ARG 43 2HG ARG 43 1.294 6.524 7.921
379 HG3 ARG 43 1HG ARG 43 1.984 7.817 8.920
380 HD2 ARG 43 2HD ARG 43 -0.248 8.239 9.876
381 HD3 ARG 43 1HD ARG 43 -0.912 6.918 8.919
382 HE ARG 43 HE ARG 43 1.198 5.892 10.389
383 HH11 ARG 43 1HH1 ARG 43 -1.952 7.346 11.122
384 HH12 ARG 43 2HH1 ARG 43 -2.171 6.450 12.564
385 HH21 ARG 43 1HH2 ARG 43 0.891 4.713 12.356
386 HH22 ARG 43 2HH2 ARG 43 -0.516 4.949 13.291
387 H LYS 44 H LYS 44 3.553 6.800 6.816
388 HA LYS 44 HA LYS 44 2.953 5.373 4.353
389 HB2 LYS 44 2HB LYS 44 5.195 4.946 6.345
390 HB3 LYS 44 1HB LYS 44 5.001 4.083 4.829
391 HG2 LYS 44 2HG LYS 44 5.585 7.030 5.160
392 HG3 LYS 44 1HG LYS 44 6.702 5.788 4.590
393 HD2 LYS 44 2HD LYS 44 5.217 5.392 2.658
394 HD3 LYS 44 1HD LYS 44 4.162 6.679 3.220
395 HE2 LYS 44 2HE LYS 44 5.581 7.577 1.496
396 HE3 LYS 44 1HE LYS 44 6.058 8.258 3.047
397 HZ1 LYS 44 1HZ LYS 44 7.437 6.034 1.643
398 HZ2 LYS 44 2HZ LYS 44 7.910 6.682 3.121
399 HZ3 LYS 44 3HZ LYS 44 7.973 7.624 1.728
400 H ILE 45 H ILE 45 1.549 3.781 4.388
401 HA ILE 45 HA ILE 45 1.105 2.291 6.878
402 HB ILE 45 HB ILE 45 -0.784 2.601 4.521
403 HG12 ILE 45 2HG1 ILE 45 -2.277 3.827 6.266
404 HG13 ILE 45 1HG1 ILE 45 -0.788 4.004 7.200
405 HG21 ILE 45 1HG2 ILE 45 -1.218 1.284 7.195
406 HG22 ILE 45 2HG2 ILE 45 -1.082 0.485 5.630
407 HG23 ILE 45 3HG2 ILE 45 -2.466 1.524 5.974
408 HD11 ILE 45 1HD1 ILE 45 -1.345 5.980 5.984
409 HD12 ILE 45 2HD1 ILE 45 -1.355 5.096 4.476
410 HD13 ILE 45 3HD1 ILE 45 0.169 5.295 5.357
411 H CYS 46 H CYS 46 1.578 0.198 6.786
412 HA CYS 46 HA CYS 46 2.581 -0.922 4.288
413 HB2 CYS 46 2HB CYS 46 2.498 -1.991 7.087
414 HB3 CYS 46 1HB CYS 46 3.477 -2.644 5.786
415 H ALA 47 H ALA 47 1.140 -2.081 3.017
416 HA ALA 47 HA ALA 47 -1.086 -3.328 4.466
417 HB1 ALA 47 1HB ALA 47 -1.096 -2.244 1.659
418 HB2 ALA 47 2HB ALA 47 -1.788 -1.444 3.069
419 HB3 ALA 47 3HB ALA 47 -2.463 -2.974 2.506
420 H ASN 48 H ASN 48 -1.762 -5.367 3.902
421 HA ASN 48 HA ASN 48 0.146 -7.111 2.725
422 HB2 ASN 48 2HB ASN 48 -1.165 -7.971 4.480
423 HB3 ASN 48 1HB ASN 48 -2.681 -7.486 3.766
424 HD21 ASN 48 1HD2 ASN 48 0.023 -9.104 2.207
425 HD22 ASN 48 2HD2 ASN 48 -0.861 -10.542 1.798
426 HA PRO 49 HA PRO 49 -0.939 -6.166 -1.486
427 HB2 PRO 49 2HB PRO 49 0.756 -8.545 -1.992
428 HB3 PRO 49 1HB PRO 49 0.879 -6.912 -2.660
429 HG2 PRO 49 2HG PRO 49 2.584 -7.811 -0.819
430 HG3 PRO 49 1HG PRO 49 2.054 -6.129 -0.802
431 HD2 PRO 49 2HD PRO 49 1.229 -8.409 0.883
432 HD3 PRO 49 1HD PRO 49 1.450 -6.702 1.323
433 H ASN 50 H ASN 50 -1.257 -9.370 0.068
434 HA ASN 50 HA ASN 50 -2.626 -10.521 -1.965
435 HB2 ASN 50 2HB ASN 50 -2.689 -11.162 0.958
436 HB3 ASN 50 1HB ASN 50 -3.257 -12.204 -0.341
437 HD21 ASN 50 1HD2 ASN 50 -1.717 -12.534 -1.909
438 HD22 ASN 50 2HD2 ASN 50 -0.066 -12.970 -1.527
439 H GLU 51 H GLU 51 -3.642 -8.096 0.252
440 HA GLU 51 HA GLU 51 -6.259 -9.121 0.627
441 HB2 GLU 51 2HB GLU 51 -5.277 -6.351 1.232
442 HB3 GLU 51 1HB GLU 51 -6.769 -7.075 1.797
443 HG2 GLU 51 2HG GLU 51 -5.126 -8.899 2.826
444 HG3 GLU 51 1HG GLU 51 -3.994 -7.626 2.502
445 H LYS 52 H LYS 52 -8.072 -8.740 -0.312
446 HA LYS 52 HA LYS 52 -8.281 -7.955 -2.936
447 HB2 LYS 52 2HB LYS 52 -9.869 -9.430 -1.908
448 HB3 LYS 52 1HB LYS 52 -10.339 -8.236 -0.735
449 HG2 LYS 52 2HG LYS 52 -10.905 -7.929 -3.680
450 HG3 LYS 52 1HG LYS 52 -11.983 -8.797 -2.592
451 HD2 LYS 52 2HD LYS 52 -12.180 -6.714 -1.237
452 HD3 LYS 52 1HD LYS 52 -11.174 -5.889 -2.428
453 HE2 LYS 52 2HE LYS 52 -13.540 -5.452 -2.814
454 HE3 LYS 52 1HE LYS 52 -12.837 -6.351 -4.156
455 HZ1 LYS 52 1HZ LYS 52 -14.484 -7.503 -1.964
456 HZ2 LYS 52 2HZ LYS 52 -13.827 -8.380 -3.246
457 HZ3 LYS 52 3HZ LYS 52 -14.991 -7.210 -3.531
458 H TRP 53 H TRP 53 -8.754 -5.997 -0.023
459 HA TRP 53 HA TRP 53 -9.760 -3.773 -1.471
460 HB2 TRP 53 2HB TRP 53 -9.470 -2.426 0.535
461 HB3 TRP 53 1HB TRP 53 -10.123 -3.992 0.975
462 HD1 TRP 53 HD TRP 53 -8.385 -5.673 2.375
463 HE1 TRP 53 1HE TRP 53 -6.422 -5.108 3.861
464 HE3 TRP 53 3HE TRP 53 -7.554 -0.854 0.862
465 HZ2 TRP 53 2HZ TRP 53 -4.708 -2.948 4.368
466 HZ3 TRP 53 3HZ TRP 53 -5.716 0.378 1.914
467 HH2 TRP 53 HH TRP 53 -4.322 -0.647 3.632
468 H VAL 54 H VAL 54 -6.598 -4.916 -0.790
469 HA VAL 54 HA VAL 54 -5.223 -2.540 -1.543
470 HB VAL 54 HB VAL 54 -4.231 -5.397 -1.232
471 HG11 VAL 54 1HG1 VAL 54 -2.608 -2.867 -1.576
472 HG12 VAL 54 2HG1 VAL 54 -2.738 -4.181 -2.740
473 HG13 VAL 54 3HG1 VAL 54 -1.960 -4.444 -1.174
474 HG21 VAL 54 1HG2 VAL 54 -3.965 -2.994 0.556
475 HG22 VAL 54 2HG2 VAL 54 -3.294 -4.597 0.861
476 HG23 VAL 54 3HG2 VAL 54 -5.041 -4.366 0.819
477 H GLN 55 H GLN 55 -6.176 -5.513 -3.146
478 HA GLN 55 HA GLN 55 -4.910 -5.196 -5.667
479 HB2 GLN 55 2HB GLN 55 -7.734 -6.222 -5.232
480 HB3 GLN 55 1HB GLN 55 -6.694 -6.572 -6.592
481 HG2 GLN 55 2HG GLN 55 -6.245 -7.476 -3.762
482 HG3 GLN 55 1HG GLN 55 -6.940 -8.449 -5.047
483 HE21 GLN 55 1HE2 GLN 55 -4.666 -8.920 -3.456
484 HE22 GLN 55 2HE2 GLN 55 -3.288 -9.053 -4.463
485 H LYS 56 H LYS 56 -8.016 -4.102 -4.463
486 HA LYS 56 HA LYS 56 -8.906 -2.798 -6.788
487 HB2 LYS 56 2HB LYS 56 -10.221 -3.722 -4.763
488 HB3 LYS 56 1HB LYS 56 -9.754 -2.259 -3.940
489 HG2 LYS 56 2HG LYS 56 -11.356 -2.363 -6.472
490 HG3 LYS 56 1HG LYS 56 -12.054 -2.307 -4.860
491 HD2 LYS 56 2HD LYS 56 -10.920 -0.185 -4.484
492 HD3 LYS 56 1HD LYS 56 -10.290 -0.250 -6.136
493 HE2 LYS 56 2HE LYS 56 -12.582 -0.268 -7.016
494 HE3 LYS 56 1HE LYS 56 -13.219 -0.208 -5.376
495 HZ1 LYS 56 1HZ LYS 56 -11.582 1.884 -6.687
496 HZ2 LYS 56 2HZ LYS 56 -12.177 1.941 -5.099
497 HZ3 LYS 56 3HZ LYS 56 -13.230 1.950 -6.412
498 H ALA 57 H ALA 57 -7.270 -1.673 -3.815
499 HA ALA 57 HA ALA 57 -7.265 1.072 -4.443
500 HB1 ALA 57 1HB ALA 57 -5.473 1.279 -2.782
501 HB2 ALA 57 2HB ALA 57 -5.285 -0.470 -2.726
502 HB3 ALA 57 3HB ALA 57 -6.794 0.291 -2.185
503 H MET 58 H MET 58 -4.843 -1.443 -5.011
504 HA MET 58 HA MET 58 -3.031 0.213 -6.236
505 HB2 MET 58 2HB MET 58 -3.383 -2.760 -6.427
506 HB3 MET 58 1HB MET 58 -2.076 -1.975 -7.280
507 HG2 MET 58 2HG MET 58 -1.417 -1.015 -4.997
508 HG3 MET 58 1HG MET 58 -2.539 -2.189 -4.321
509 HE1 MET 58 1HE MET 58 -0.821 -5.566 -5.400
510 HE2 MET 58 2HE MET 58 -2.076 -4.730 -6.326
511 HE3 MET 58 3HE MET 58 -2.207 -4.867 -4.565
512 H LYS 59 H LYS 59 -5.771 -1.505 -7.540
513 HA LYS 59 HA LYS 59 -5.292 -1.192 -10.245
514 HB2 LYS 59 2HB LYS 59 -7.042 -2.615 -9.267
515 HB3 LYS 59 1HB LYS 59 -7.878 -1.192 -8.679
516 HG2 LYS 59 2HG LYS 59 -8.292 -0.501 -10.981
517 HG3 LYS 59 1HG LYS 59 -7.453 -1.950 -11.552
518 HD2 LYS 59 2HD LYS 59 -9.086 -3.352 -10.363
519 HD3 LYS 59 1HD LYS 59 -9.936 -1.905 -9.829
520 HE2 LYS 59 2HE LYS 59 -11.061 -2.889 -11.737
521 HE3 LYS 59 1HE LYS 59 -10.381 -1.324 -12.171
522 HZ1 LYS 59 1HZ LYS 59 -9.175 -3.963 -12.799
523 HZ2 LYS 59 2HZ LYS 59 -8.509 -2.496 -13.221
524 HZ3 LYS 59 3HZ LYS 59 -9.977 -2.968 -13.887
525 H HIS 60 H HIS 60 -6.925 0.916 -7.908
526 HA HIS 60 HA HIS 60 -7.524 2.961 -9.767
527 HB2 HIS 60 2HB HIS 60 -8.864 2.747 -7.813
528 HB3 HIS 60 1HB HIS 60 -7.450 2.814 -6.773
529 HD1 HIS 60 1HD HIS 60 -9.392 5.109 -9.131
530 HD2 HIS 60 2HD HIS 60 -6.958 5.242 -5.793
531 HE1 HIS 60 1HE HIS 60 -9.416 7.511 -8.407
532 HE2 HIS 60 2HE HIS 60 -7.697 7.624 -6.561
533 H LEU 61 H LEU 61 -4.999 2.551 -7.341
534 HA LEU 61 HA LEU 61 -3.863 5.114 -7.755
535 HB2 LEU 61 2HB LEU 61 -2.748 2.677 -6.404
536 HB3 LEU 61 1HB LEU 61 -2.025 4.271 -6.331
537 HG LEU 61 HG LEU 61 -4.755 3.545 -5.265
538 HD11 LEU 61 1HD1 LEU 61 -2.155 4.026 -3.828
539 HD12 LEU 61 2HD1 LEU 61 -3.068 2.503 -3.930
540 HD13 LEU 61 3HD1 LEU 61 -3.740 3.878 -3.071
541 HD21 LEU 61 1HD2 LEU 61 -3.160 6.096 -5.040
542 HD22 LEU 61 2HD2 LEU 61 -4.673 5.757 -4.206
543 HD23 LEU 61 3HD2 LEU 61 -4.647 5.875 -5.965
544 H ASP 62 H ASP 62 -3.339 2.054 -9.348
545 HA ASP 62 HA ASP 62 -0.770 2.762 -10.424
546 HB2 ASP 62 2HB ASP 62 -1.546 0.418 -10.249
547 HB3 ASP 62 1HB ASP 62 -2.798 0.760 -11.432
548 H LYS 63 H LYS 63 -4.065 3.262 -11.286
549 HA LYS 63 HA LYS 63 -3.411 4.114 -13.950
550 HB2 LYS 63 2HB LYS 63 -6.076 3.980 -12.544
551 HB3 LYS 63 1HB LYS 63 -5.826 4.269 -14.261
552 HG2 LYS 63 2HG LYS 63 -4.886 2.053 -14.530
553 HG3 LYS 63 1HG LYS 63 -5.024 1.768 -12.795
554 HD2 LYS 63 2HD LYS 63 -7.493 2.090 -13.018
555 HD3 LYS 63 1HD LYS 63 -7.271 2.152 -14.769
556 HE2 LYS 63 2HE LYS 63 -6.529 -0.150 -12.967
557 HE3 LYS 63 1HE LYS 63 -7.945 -0.086 -14.001
558 HZ1 LYS 63 1HZ LYS 63 -5.128 -0.022 -14.943
559 HZ2 LYS 63 2HZ LYS 63 -6.464 0.050 -15.930
560 HZ3 LYS 63 3HZ LYS 63 -6.148 -1.353 -15.051
561 H LYS 64 H LYS 64 -3.267 5.469 -10.994
562 HA LYS 64 HA LYS 64 -3.463 8.097 -12.125
563 HB2 LYS 64 2HB LYS 64 -5.651 7.734 -11.020
564 HB3 LYS 64 1HB LYS 64 -4.829 7.325 -9.531
565 HG2 LYS 64 2HG LYS 64 -5.631 9.522 -9.236
566 HG3 LYS 64 1HG LYS 64 -3.909 9.685 -9.528
567 HD2 LYS 64 2HD LYS 64 -6.091 10.156 -11.594
568 HD3 LYS 64 1HD LYS 64 -5.305 11.420 -10.669
569 HE2 LYS 64 2HE LYS 64 -4.062 9.659 -12.815
570 HE3 LYS 64 1HE LYS 64 -4.419 11.349 -12.869
571 HZ1 LYS 64 1HZ LYS 64 -2.043 10.949 -12.438
572 HZ2 LYS 64 2HZ LYS 64 -2.417 10.224 -10.976
573 HZ3 LYS 64 3HZ LYS 64 -2.785 11.840 -11.215
Start of MODEL 13
1 H1 ALA 1 1HT ALA 1 17.101 6.721 7.749
2 H2 ALA 1 2HT ALA 1 16.172 6.647 6.323
3 H3 ALA 1 3HT ALA 1 17.842 6.697 6.226
4 HA ALA 1 HA ALA 1 18.027 4.553 7.216
5 HB1 ALA 1 1HB ALA 1 16.053 4.671 8.652
6 HB2 ALA 1 2HB ALA 1 15.989 3.245 7.617
7 HB3 ALA 1 3HB ALA 1 15.011 4.660 7.228
8 H ARG 2 H ARG 2 18.363 2.944 5.678
9 HA ARG 2 HA ARG 2 17.343 3.641 3.042
10 HB2 ARG 2 2HB ARG 2 18.980 2.106 2.094
11 HB3 ARG 2 1HB ARG 2 19.747 3.247 3.183
12 HG2 ARG 2 2HG ARG 2 19.892 1.531 4.897
13 HG3 ARG 2 1HG ARG 2 19.059 0.394 3.837
14 HD2 ARG 2 2HD ARG 2 21.464 0.018 3.747
15 HD3 ARG 2 1HD ARG 2 20.857 0.589 2.198
16 HE ARG 2 HE ARG 2 21.916 2.585 4.000
17 HH11 ARG 2 1HH1 ARG 2 22.543 0.470 1.231
18 HH12 ARG 2 2HH1 ARG 2 23.864 1.367 0.651
19 HH21 ARG 2 1HH2 ARG 2 23.777 3.822 3.204
20 HH22 ARG 2 2HH2 ARG 2 24.591 3.296 1.802
21 H LYS 3 H LYS 3 16.280 1.745 5.469
22 HA LYS 3 HA LYS 3 15.287 -0.333 3.714
23 HB2 LYS 3 2HB LYS 3 14.833 0.072 6.676
24 HB3 LYS 3 1HB LYS 3 14.040 -1.173 5.744
25 HG2 LYS 3 2HG LYS 3 15.826 -2.202 6.905
26 HG3 LYS 3 1HG LYS 3 16.318 -2.095 5.224
27 HD2 LYS 3 2HD LYS 3 17.698 -0.150 5.743
28 HD3 LYS 3 1HD LYS 3 17.155 -0.217 7.423
29 HE2 LYS 3 2HE LYS 3 18.111 -2.477 7.618
30 HE3 LYS 3 1HE LYS 3 18.708 -2.348 5.970
31 HZ1 LYS 3 1HZ LYS 3 19.493 -0.645 8.261
32 HZ2 LYS 3 2HZ LYS 3 20.070 -0.438 6.697
33 HZ3 LYS 3 3HZ LYS 3 20.422 -1.848 7.550
34 H SER 4 H SER 4 13.698 0.150 2.461
35 HA SER 4 HA SER 4 11.507 1.820 3.458
36 HB2 SER 4 2HB SER 4 12.543 2.442 1.259
37 HB3 SER 4 1HB SER 4 12.173 0.830 0.652
38 HG SER 4 HG SER 4 9.989 1.297 1.065
39 H CYS 5 H CYS 5 11.808 -0.575 4.641
40 HA CYS 5 HA CYS 5 10.068 -2.490 3.250
41 HB2 CYS 5 2HB CYS 5 12.154 -3.030 5.360
42 HB3 CYS 5 1HB CYS 5 11.219 -4.218 4.467
43 H CYS 6 H CYS 6 8.479 -3.434 4.432
44 HA CYS 6 HA CYS 6 8.005 -2.532 7.153
45 HB2 CYS 6 2HB CYS 6 6.219 -3.468 4.948
46 HB3 CYS 6 1HB CYS 6 5.651 -3.204 6.597
47 H LEU 7 H LEU 7 7.457 -4.119 8.580
48 HA LEU 7 HA LEU 7 8.144 -6.873 7.821
49 HB2 LEU 7 2HB LEU 7 8.219 -5.492 10.516
50 HB3 LEU 7 1HB LEU 7 8.504 -7.195 10.282
51 HG LEU 7 HG LEU 7 10.572 -6.644 8.994
52 HD11 LEU 7 1HD1 LEU 7 11.505 -4.396 9.077
53 HD12 LEU 7 2HD1 LEU 7 10.025 -3.801 9.832
54 HD13 LEU 7 3HD1 LEU 7 9.988 -4.421 8.180
55 HD21 LEU 7 1HD2 LEU 7 10.691 -7.149 11.352
56 HD22 LEU 7 2HD2 LEU 7 10.395 -5.457 11.748
57 HD23 LEU 7 3HD2 LEU 7 11.883 -5.920 10.930
58 H LYS 8 H LYS 8 5.625 -4.813 8.660
59 HA LYS 8 HA LYS 8 3.887 -7.063 9.346
60 HB2 LYS 8 2HB LYS 8 3.887 -4.315 10.594
61 HB3 LYS 8 1HB LYS 8 2.700 -5.568 10.910
62 HG2 LYS 8 2HG LYS 8 4.449 -6.970 11.894
63 HG3 LYS 8 1HG LYS 8 5.642 -5.718 11.554
64 HD2 LYS 8 2HD LYS 8 3.245 -5.422 13.375
65 HD3 LYS 8 1HD LYS 8 4.905 -5.685 13.902
66 HE2 LYS 8 2HE LYS 8 3.863 -3.276 12.394
67 HE3 LYS 8 1HE LYS 8 4.286 -3.343 14.098
68 HZ1 LYS 8 1HZ LYS 8 6.079 -2.355 12.894
69 HZ2 LYS 8 2HZ LYS 8 6.170 -3.612 11.800
70 HZ3 LYS 8 3HZ LYS 8 6.601 -3.860 13.415
71 H TYR 9 H TYR 9 1.712 -6.702 8.708
72 HA TYR 9 HA TYR 9 1.300 -4.570 6.728
73 HB2 TYR 9 2HB TYR 9 -0.477 -7.080 6.934
74 HB3 TYR 9 1HB TYR 9 -0.301 -5.911 5.690
75 HD1 TYR 9 1HD TYR 9 1.384 -6.007 4.080
76 HD2 TYR 9 2HD TYR 9 1.224 -8.896 7.159
77 HE1 TYR 9 1HE TYR 9 2.893 -7.465 2.782
78 HE2 TYR 9 2HE TYR 9 2.733 -10.368 5.878
79 HH TYR 9 HH TYR 9 4.438 -9.251 3.164
80 H THR 10 H THR 10 -0.696 -3.370 6.984
81 HA THR 10 HA THR 10 -1.522 -3.110 9.653
82 HB THR 10 HB THR 10 -1.525 -1.145 8.195
83 HG1 THR 10 1HG THR 10 -4.220 -1.084 8.456
84 HG21 THR 10 1HG2 THR 10 -3.182 -0.846 6.398
85 HG22 THR 10 2HG2 THR 10 -3.728 -2.509 6.632
86 HG23 THR 10 3HG2 THR 10 -2.083 -2.180 6.069
87 H LYS 11 H LYS 11 -3.359 -3.831 10.673
88 HA LYS 11 HA LYS 11 -4.739 -6.030 9.369
89 HB2 LYS 11 2HB LYS 11 -3.827 -6.292 11.670
90 HB3 LYS 11 1HB LYS 11 -4.909 -5.027 12.226
91 HG2 LYS 11 2HG LYS 11 -6.831 -6.428 11.680
92 HG3 LYS 11 1HG LYS 11 -5.751 -7.686 11.079
93 HD2 LYS 11 2HD LYS 11 -4.739 -7.857 13.318
94 HD3 LYS 11 1HD LYS 11 -5.861 -6.630 13.904
95 HE2 LYS 11 2HE LYS 11 -6.624 -9.306 12.750
96 HE3 LYS 11 1HE LYS 11 -6.586 -8.917 14.461
97 HZ1 LYS 11 1HZ LYS 11 -8.817 -8.784 13.591
98 HZ2 LYS 11 2HZ LYS 11 -8.385 -7.633 12.447
99 HZ3 LYS 11 3HZ LYS 11 -8.330 -7.277 14.095
100 H ARG 12 H ARG 12 -5.115 -2.767 10.036
101 HA ARG 12 HA ARG 12 -8.019 -2.900 9.690
102 HB2 ARG 12 2HB ARG 12 -7.214 -1.625 11.634
103 HB3 ARG 12 1HB ARG 12 -6.267 -0.598 10.570
104 HG2 ARG 12 2HG ARG 12 -8.329 0.194 9.511
105 HG3 ARG 12 1HG ARG 12 -9.266 -0.832 10.594
106 HD2 ARG 12 2HD ARG 12 -8.381 0.388 12.517
107 HD3 ARG 12 1HD ARG 12 -7.440 1.416 11.434
108 HE ARG 12 HE ARG 12 -10.172 1.436 10.724
109 HH11 ARG 12 1HH1 ARG 12 -7.949 2.797 13.104
110 HH12 ARG 12 2HH1 ARG 12 -8.898 4.177 13.410
111 HH21 ARG 12 1HH2 ARG 12 -11.455 3.300 11.122
112 HH22 ARG 12 2HH2 ARG 12 -10.951 4.476 12.243
113 HA PRO 13 HA PRO 13 -7.242 -1.837 5.362
114 HB2 PRO 13 2HB PRO 13 -10.173 -1.336 5.517
115 HB3 PRO 13 1HB PRO 13 -9.259 -2.304 4.356
116 HG2 PRO 13 2HG PRO 13 -10.692 -3.489 6.245
117 HG3 PRO 13 1HG PRO 13 -9.096 -4.114 5.795
118 HD2 PRO 13 2HD PRO 13 -9.885 -2.506 8.193
119 HD3 PRO 13 1HD PRO 13 -8.747 -3.871 8.037
120 H LEU 14 H LEU 14 -6.798 0.077 4.477
121 HA LEU 14 HA LEU 14 -7.519 2.570 5.798
122 HB2 LEU 14 2HB LEU 14 -5.152 2.010 5.117
123 HB3 LEU 14 1HB LEU 14 -5.691 1.982 3.461
124 HG LEU 14 HG LEU 14 -6.223 4.389 3.630
125 HD11 LEU 14 1HD1 LEU 14 -5.306 5.658 5.509
126 HD12 LEU 14 2HD1 LEU 14 -4.863 4.157 6.311
127 HD13 LEU 14 3HD1 LEU 14 -6.566 4.551 6.053
128 HD21 LEU 14 1HD2 LEU 14 -3.406 3.581 4.317
129 HD22 LEU 14 2HD2 LEU 14 -3.891 5.107 3.570
130 HD23 LEU 14 3HD2 LEU 14 -4.123 3.584 2.709
131 HA PRO 15 HA PRO 15 -10.644 3.124 2.557
132 HB2 PRO 15 2HB PRO 15 -10.567 5.993 3.228
133 HB3 PRO 15 1HB PRO 15 -11.922 4.867 3.332
134 HG2 PRO 15 2HG PRO 15 -10.716 5.810 5.531
135 HG3 PRO 15 1HG PRO 15 -11.335 4.152 5.452
136 HD2 PRO 15 2HD PRO 15 -8.519 5.131 5.174
137 HD3 PRO 15 1HD PRO 15 -9.151 3.712 6.044
138 H LEU 16 H LEU 16 -10.409 3.518 0.464
139 HA LEU 16 HA LEU 16 -7.965 4.371 -0.623
140 HB2 LEU 16 2HB LEU 16 -9.234 2.751 -1.744
141 HB3 LEU 16 1HB LEU 16 -10.624 3.855 -1.907
142 HG LEU 16 HG LEU 16 -9.067 5.195 -3.368
143 HD11 LEU 16 1HD1 LEU 16 -7.179 3.881 -4.342
144 HD12 LEU 16 2HD1 LEU 16 -7.440 2.693 -3.083
145 HD13 LEU 16 3HD1 LEU 16 -6.962 4.320 -2.636
146 HD21 LEU 16 1HD2 LEU 16 -9.815 2.404 -4.134
147 HD22 LEU 16 2HD2 LEU 16 -9.458 3.749 -5.255
148 HD23 LEU 16 3HD2 LEU 16 -10.836 3.858 -4.154
149 H LYS 17 H LYS 17 -10.904 6.016 -0.052
150 HA LYS 17 HA LYS 17 -10.457 8.295 -1.650
151 HB2 LYS 17 2HB LYS 17 -12.070 8.029 0.888
152 HB3 LYS 17 1HB LYS 17 -12.119 9.415 -0.191
153 HG2 LYS 17 2HG LYS 17 -12.913 6.600 -0.923
154 HG3 LYS 17 1HG LYS 17 -14.020 7.917 -0.541
155 HD2 LYS 17 2HD LYS 17 -13.160 9.180 -2.461
156 HD3 LYS 17 1HD LYS 17 -12.065 7.851 -2.847
157 HE2 LYS 17 2HE LYS 17 -13.978 6.370 -3.189
158 HE3 LYS 17 1HE LYS 17 -15.074 7.686 -2.782
159 HZ1 LYS 17 1HZ LYS 17 -13.227 7.616 -5.112
160 HZ2 LYS 17 2HZ LYS 17 -14.246 8.904 -4.720
161 HZ3 LYS 17 3HZ LYS 17 -14.894 7.412 -5.161
162 H ARG 18 H ARG 18 -8.775 7.230 0.931
163 HA ARG 18 HA ARG 18 -7.794 9.952 1.583
164 HB2 ARG 18 2HB ARG 18 -7.990 7.541 3.383
165 HB3 ARG 18 1HB ARG 18 -7.131 9.019 3.820
166 HG2 ARG 18 2HG ARG 18 -9.194 10.275 3.672
167 HG3 ARG 18 1HG ARG 18 -10.042 8.829 3.118
168 HD2 ARG 18 2HD ARG 18 -10.454 9.293 5.496
169 HD3 ARG 18 1HD ARG 18 -9.650 7.754 5.231
170 HE ARG 18 HE ARG 18 -7.574 8.839 5.913
171 HH11 ARG 18 1HH1 ARG 18 -10.554 10.509 6.811
172 HH12 ARG 18 2HH1 ARG 18 -9.935 11.130 8.272
173 HH21 ARG 18 1HH2 ARG 18 -6.739 9.665 7.926
174 HH22 ARG 18 2HH2 ARG 18 -7.702 10.650 8.915
175 H ILE 19 H ILE 19 -6.959 7.592 -0.291
176 HA ILE 19 HA ILE 19 -4.143 7.408 0.567
177 HB ILE 19 HB ILE 19 -5.558 5.643 -1.469
178 HG12 ILE 19 2HG1 ILE 19 -4.811 4.986 1.347
179 HG13 ILE 19 1HG1 ILE 19 -6.465 5.385 0.914
180 HG21 ILE 19 1HG2 ILE 19 -2.913 5.342 -0.014
181 HG22 ILE 19 2HG2 ILE 19 -3.100 5.738 -1.723
182 HG23 ILE 19 3HG2 ILE 19 -3.603 4.161 -1.113
183 HD11 ILE 19 1HD1 ILE 19 -6.416 3.408 -0.655
184 HD12 ILE 19 2HD1 ILE 19 -6.197 2.980 1.054
185 HD13 ILE 19 3HD1 ILE 19 -4.832 3.059 -0.051
186 H LYS 20 H LYS 20 -2.636 8.245 -0.731
187 HA LYS 20 HA LYS 20 -3.501 9.594 -3.154
188 HB2 LYS 20 2HB LYS 20 -0.868 9.755 -1.677
189 HB3 LYS 20 1HB LYS 20 -1.290 10.727 -3.063
190 HG2 LYS 20 2HG LYS 20 -2.513 10.787 -0.368
191 HG3 LYS 20 1HG LYS 20 -1.558 12.043 -1.168
192 HD2 LYS 20 2HD LYS 20 -4.269 11.030 -1.857
193 HD3 LYS 20 1HD LYS 20 -3.877 12.621 -1.232
194 HE2 LYS 20 2HE LYS 20 -2.592 13.177 -3.231
195 HE3 LYS 20 1HE LYS 20 -2.979 11.611 -3.946
196 HZ1 LYS 20 1HZ LYS 20 -4.889 13.792 -3.296
197 HZ2 LYS 20 2HZ LYS 20 -5.336 12.297 -3.921
198 HZ3 LYS 20 3HZ LYS 20 -4.403 13.335 -4.838
199 H SER 21 H SER 21 -1.084 7.168 -2.132
200 HA SER 21 HA SER 21 -0.888 6.017 -4.729
201 HB2 SER 21 2HB SER 21 1.478 7.647 -3.704
202 HB3 SER 21 1HB SER 21 1.506 6.574 -5.091
203 HG SER 21 HG SER 21 1.256 8.583 -5.867
204 H TYR 22 H TYR 22 1.014 4.313 -4.611
205 HA TYR 22 HA TYR 22 1.618 3.629 -1.824
206 HB2 TYR 22 2HB TYR 22 1.338 1.283 -2.303
207 HB3 TYR 22 1HB TYR 22 -0.166 2.128 -2.587
208 HD1 TYR 22 1HD TYR 22 -1.273 1.806 -4.577
209 HD2 TYR 22 2HD TYR 22 2.801 0.702 -4.374
210 HE1 TYR 22 1HE TYR 22 -1.472 0.696 -6.768
211 HE2 TYR 22 2HE TYR 22 2.640 -0.395 -6.568
212 HH TYR 22 HH TYR 22 0.016 0.060 -8.630
213 H THR 23 H THR 23 3.351 2.154 -1.641
214 HA THR 23 HA THR 23 5.458 2.667 -3.618
215 HB THR 23 HB THR 23 5.672 2.181 -0.644
216 HG1 THR 23 1HG THR 23 5.998 4.572 -2.151
217 HG21 THR 23 1HG2 THR 23 7.619 1.396 -1.865
218 HG22 THR 23 2HG2 THR 23 8.041 2.836 -0.932
219 HG23 THR 23 3HG2 THR 23 7.775 2.951 -2.676
220 H ILE 24 H ILE 24 6.368 0.846 -4.448
221 HA ILE 24 HA ILE 24 5.371 -1.718 -3.588
222 HB ILE 24 HB ILE 24 7.289 -1.021 -5.837
223 HG12 ILE 24 2HG1 ILE 24 4.354 -1.760 -5.909
224 HG13 ILE 24 1HG1 ILE 24 5.005 -0.149 -6.177
225 HG21 ILE 24 1HG2 ILE 24 5.922 -3.649 -5.205
226 HG22 ILE 24 2HG2 ILE 24 7.647 -3.313 -5.052
227 HG23 ILE 24 3HG2 ILE 24 6.886 -3.320 -6.643
228 HD11 ILE 24 1HD1 ILE 24 5.517 -2.568 -7.894
229 HD12 ILE 24 2HD1 ILE 24 6.139 -0.939 -8.190
230 HD13 ILE 24 3HD1 ILE 24 4.403 -1.256 -8.258
231 H GLN 25 H GLN 25 6.324 -2.698 -1.956
232 HA GLN 25 HA GLN 25 9.137 -2.284 -1.435
233 HB2 GLN 25 2HB GLN 25 7.889 -2.269 0.517
234 HB3 GLN 25 1HB GLN 25 6.874 -3.608 0.073
235 HG2 GLN 25 2HG GLN 25 8.739 -5.126 0.457
236 HG3 GLN 25 1HG GLN 25 9.760 -3.749 0.887
237 HE21 GLN 25 1HE2 GLN 25 8.716 -6.106 2.502
238 HE22 GLN 25 2HE2 GLN 25 8.029 -5.369 3.886
239 H SER 26 H SER 26 10.546 -3.442 -2.419
240 HA SER 26 HA SER 26 9.786 -5.896 -3.621
241 HB2 SER 26 2HB SER 26 12.230 -5.738 -4.436
242 HB3 SER 26 1HB SER 26 11.091 -4.526 -5.018
243 HG SER 26 HG SER 26 12.377 -3.128 -4.239
244 H ASN 27 H ASN 27 10.242 -7.825 -2.859
245 HA ASN 27 HA ASN 27 11.249 -7.941 -0.165
246 HB2 ASN 27 2HB ASN 27 10.308 -10.175 -0.080
247 HB3 ASN 27 1HB ASN 27 9.134 -8.974 -0.575
248 HD21 ASN 27 1HD2 ASN 27 8.988 -11.672 -0.881
249 HD22 ASN 27 2HD2 ASN 27 8.969 -12.022 -2.585
250 H GLU 28 H GLU 28 12.907 -7.796 -2.723
251 HA GLU 28 HA GLU 28 14.624 -10.061 -2.522
252 HB2 GLU 28 2HB GLU 28 15.303 -7.300 -3.572
253 HB3 GLU 28 1HB GLU 28 16.142 -8.798 -3.904
254 HG2 GLU 28 2HG GLU 28 13.335 -8.155 -4.759
255 HG3 GLU 28 1HG GLU 28 14.771 -8.089 -5.772
256 H ALA 29 H ALA 29 14.674 -6.722 -1.353
257 HA ALA 29 HA ALA 29 16.897 -7.296 0.470
258 HB1 ALA 29 1HB ALA 29 16.997 -4.888 0.815
259 HB2 ALA 29 2HB ALA 29 15.542 -4.677 -0.157
260 HB3 ALA 29 3HB ALA 29 17.024 -5.258 -0.910
261 H CYS 30 H CYS 30 13.508 -6.906 0.447
262 HA CYS 30 HA CYS 30 13.452 -6.398 3.343
263 HB2 CYS 30 2HB CYS 30 11.159 -6.408 1.375
264 HB3 CYS 30 1HB CYS 30 11.143 -5.833 3.027
265 H ASN 31 H ASN 31 12.403 -7.844 4.689
266 HA ASN 31 HA ASN 31 12.566 -10.567 4.108
267 HB2 ASN 31 2HB ASN 31 10.815 -9.248 6.194
268 HB3 ASN 31 1HB ASN 31 11.114 -10.975 6.103
269 HD21 ASN 31 1HD2 ASN 31 12.398 -7.869 6.992
270 HD22 ASN 31 2HD2 ASN 31 13.814 -8.484 7.745
271 H ILE 32 H ILE 32 9.776 -8.450 3.919
272 HA ILE 32 HA ILE 32 8.320 -10.614 2.554
273 HB ILE 32 HB ILE 32 6.237 -9.822 3.542
274 HG12 ILE 32 2HG1 ILE 32 7.946 -7.779 4.998
275 HG13 ILE 32 1HG1 ILE 32 6.827 -7.425 3.694
276 HG21 ILE 32 1HG2 ILE 32 8.369 -10.066 5.591
277 HG22 ILE 32 2HG2 ILE 32 7.598 -11.450 4.796
278 HG23 ILE 32 3HG2 ILE 32 6.652 -10.387 5.878
279 HD11 ILE 32 1HD1 ILE 32 6.096 -8.518 6.400
280 HD12 ILE 32 2HD1 ILE 32 4.965 -8.147 5.099
281 HD13 ILE 32 3HD1 ILE 32 5.891 -6.851 5.857
282 H LYS 33 H LYS 33 6.508 -9.675 1.231
283 HA LYS 33 HA LYS 33 7.348 -7.184 0.067
284 HB2 LYS 33 2HB LYS 33 6.975 -9.000 -1.537
285 HB3 LYS 33 1HB LYS 33 5.338 -9.225 -0.929
286 HG2 LYS 33 2HG LYS 33 4.745 -6.965 -1.688
287 HG3 LYS 33 1HG LYS 33 6.373 -6.757 -2.319
288 HD2 LYS 33 2HD LYS 33 6.008 -8.649 -3.852
289 HD3 LYS 33 1HD LYS 33 4.372 -8.829 -3.215
290 HE2 LYS 33 2HE LYS 33 3.817 -6.568 -3.980
291 HE3 LYS 33 1HE LYS 33 5.451 -6.377 -4.607
292 HZ1 LYS 33 1HZ LYS 33 3.461 -8.373 -5.548
293 HZ2 LYS 33 2HZ LYS 33 5.026 -8.174 -6.160
294 HZ3 LYS 33 3HZ LYS 33 3.876 -6.957 -6.341
295 H ALA 34 H ALA 34 6.201 -5.419 0.840
296 HA ALA 34 HA ALA 34 3.400 -5.776 1.549
297 HB1 ALA 34 1HB ALA 34 4.650 -5.823 3.688
298 HB2 ALA 34 2HB ALA 34 3.719 -4.351 3.561
299 HB3 ALA 34 3HB ALA 34 5.450 -4.319 3.255
300 H ILE 35 H ILE 35 2.262 -4.329 0.412
301 HA ILE 35 HA ILE 35 3.674 -2.222 -0.952
302 HB ILE 35 HB ILE 35 0.741 -2.975 -0.909
303 HG12 ILE 35 2HG1 ILE 35 2.223 -4.616 -1.894
304 HG13 ILE 35 1HG1 ILE 35 1.193 -3.907 -3.148
305 HG21 ILE 35 1HG2 ILE 35 0.481 -1.473 -2.853
306 HG22 ILE 35 2HG2 ILE 35 2.146 -0.951 -2.661
307 HG23 ILE 35 3HG2 ILE 35 0.970 -0.590 -1.412
308 HD11 ILE 35 1HD1 ILE 35 3.427 -4.241 -3.943
309 HD12 ILE 35 2HD1 ILE 35 4.099 -3.370 -2.572
310 HD13 ILE 35 3HD1 ILE 35 3.150 -2.502 -3.786
311 H ILE 36 H ILE 36 3.852 -0.166 -0.318
312 HA ILE 36 HA ILE 36 2.621 0.355 2.262
313 HB ILE 36 HB ILE 36 4.862 1.977 1.010
314 HG12 ILE 36 2HG1 ILE 36 6.272 0.878 2.882
315 HG13 ILE 36 1HG1 ILE 36 5.019 -0.354 2.900
316 HG21 ILE 36 1HG2 ILE 36 3.606 3.192 2.609
317 HG22 ILE 36 2HG2 ILE 36 5.215 2.773 3.210
318 HG23 ILE 36 3HG2 ILE 36 3.799 1.871 3.781
319 HD11 ILE 36 1HD1 ILE 36 5.500 -0.840 0.585
320 HD12 ILE 36 2HD1 ILE 36 6.923 -0.989 1.627
321 HD13 ILE 36 3HD1 ILE 36 6.726 0.442 0.599
322 H PHE 37 H PHE 37 0.890 1.379 2.196
323 HA PHE 37 HA PHE 37 0.013 3.046 0.022
324 HB2 PHE 37 2HB PHE 37 -1.086 2.004 2.586
325 HB3 PHE 37 1HB PHE 37 -1.919 3.322 1.744
326 HD1 PHE 37 1HD PHE 37 -0.157 0.545 0.152
327 HD2 PHE 37 2HD PHE 37 -3.850 2.172 1.249
328 HE1 PHE 37 1HE PHE 37 -1.336 -1.115 -1.338
329 HE2 PHE 37 2HE PHE 37 -5.031 0.570 -0.193
330 HZ PHE 37 HZ PHE 37 -3.780 -1.060 -1.477
331 H THR 38 H THR 38 -0.021 5.165 0.011
332 HA THR 38 HA THR 38 0.848 6.474 2.474
333 HB THR 38 HB THR 38 1.288 7.457 -0.368
334 HG1 THR 38 1HG THR 38 2.395 5.501 0.810
335 HG21 THR 38 1HG2 THR 38 1.210 9.202 1.310
336 HG22 THR 38 2HG2 THR 38 2.890 8.988 0.777
337 HG23 THR 38 3HG2 THR 38 2.337 8.325 2.326
338 H THR 39 H THR 39 -0.481 8.033 3.255
339 HA THR 39 HA THR 39 -3.046 8.286 1.955
340 HB THR 39 HB THR 39 -3.626 9.526 4.063
341 HG1 THR 39 1HG THR 39 -2.094 8.979 5.800
342 HG21 THR 39 1HG2 THR 39 -4.208 7.203 3.802
343 HG22 THR 39 2HG2 THR 39 -3.628 7.455 5.459
344 HG23 THR 39 3HG2 THR 39 -2.581 6.719 4.254
345 H LYS 40 H LYS 40 -4.053 10.569 2.250
346 HA LYS 40 HA LYS 40 -2.469 12.419 0.823
347 HB2 LYS 40 2HB LYS 40 -4.802 13.133 2.543
348 HB3 LYS 40 1HB LYS 40 -4.296 13.954 1.070
349 HG2 LYS 40 2HG LYS 40 -4.926 11.516 0.001
350 HG3 LYS 40 1HG LYS 40 -5.847 11.468 1.460
351 HD2 LYS 40 2HD LYS 40 -7.036 13.492 0.938
352 HD3 LYS 40 1HD LYS 40 -6.020 13.682 -0.510
353 HE2 LYS 40 2HE LYS 40 -6.864 11.637 -1.429
354 HE3 LYS 40 1HE LYS 40 -7.833 11.347 -0.003
355 HZ1 LYS 40 1HZ LYS 40 -9.135 13.338 -0.505
356 HZ2 LYS 40 2HZ LYS 40 -9.176 12.241 -1.767
357 HZ3 LYS 40 3HZ LYS 40 -8.224 13.621 -1.900
358 H LYS 41 H LYS 41 -2.782 11.624 4.126
359 HA LYS 41 HA LYS 41 -1.578 14.003 5.198
360 HB2 LYS 41 2HB LYS 41 -1.950 11.235 6.361
361 HB3 LYS 41 1HB LYS 41 -1.155 12.524 7.228
362 HG2 LYS 41 2HG LYS 41 -3.404 12.295 8.036
363 HG3 LYS 41 1HG LYS 41 -3.275 13.810 7.151
364 HD2 LYS 41 2HD LYS 41 -4.397 12.815 5.252
365 HD3 LYS 41 1HD LYS 41 -4.431 11.245 6.058
366 HE2 LYS 41 2HE LYS 41 -6.599 12.354 6.279
367 HE3 LYS 41 1HE LYS 41 -5.811 12.176 7.837
368 HZ1 LYS 41 1HZ LYS 41 -5.134 14.507 7.720
369 HZ2 LYS 41 2HZ LYS 41 -6.798 14.349 7.603
370 HZ3 LYS 41 3HZ LYS 41 -5.905 14.687 6.231
371 H GLY 42 H GLY 42 -0.559 11.383 3.421
372 HA2 GLY 42 2HA GLY 42 1.466 10.988 2.515
373 HA3 GLY 42 1HA GLY 42 2.135 12.254 3.506
374 H ARG 43 H ARG 43 0.418 9.822 5.262
375 HA ARG 43 HA ARG 43 2.797 8.941 6.524
376 HB2 ARG 43 2HB ARG 43 0.645 9.249 7.693
377 HB3 ARG 43 1HB ARG 43 -0.028 7.971 6.679
378 HG2 ARG 43 2HG ARG 43 1.522 6.398 7.550
379 HG3 ARG 43 1HG ARG 43 2.265 7.649 8.555
380 HD2 ARG 43 2HD ARG 43 0.161 7.866 9.806
381 HD3 ARG 43 1HD ARG 43 -0.574 6.614 8.799
382 HE ARG 43 HE ARG 43 1.812 5.675 9.961
383 HH11 ARG 43 1HH1 ARG 43 -1.548 6.377 10.863
384 HH12 ARG 43 2HH1 ARG 43 -1.588 5.244 12.130
385 HH21 ARG 43 1HH2 ARG 43 1.739 4.110 11.731
386 HH22 ARG 43 2HH2 ARG 43 0.307 3.935 12.617
387 H LYS 44 H LYS 44 3.575 6.784 6.511
388 HA LYS 44 HA LYS 44 2.966 5.279 4.107
389 HB2 LYS 44 2HB LYS 44 5.225 5.127 6.104
390 HB3 LYS 44 1HB LYS 44 5.030 3.984 4.790
391 HG2 LYS 44 2HG LYS 44 5.436 6.960 4.472
392 HG3 LYS 44 1HG LYS 44 6.680 5.728 4.255
393 HD2 LYS 44 2HD LYS 44 5.357 4.734 2.428
394 HD3 LYS 44 1HD LYS 44 4.135 5.984 2.636
395 HE2 LYS 44 2HE LYS 44 5.786 7.684 2.040
396 HE3 LYS 44 1HE LYS 44 7.006 6.419 1.851
397 HZ1 LYS 44 1HZ LYS 44 4.501 6.614 0.258
398 HZ2 LYS 44 2HZ LYS 44 5.735 5.475 0.035
399 HZ3 LYS 44 3HZ LYS 44 6.027 7.078 -0.278
400 H ILE 45 H ILE 45 1.471 3.797 4.243
401 HA ILE 45 HA ILE 45 0.982 2.383 6.764
402 HB ILE 45 HB ILE 45 -0.817 2.721 4.341
403 HG12 ILE 45 2HG1 ILE 45 -2.355 3.923 6.094
404 HG13 ILE 45 1HG1 ILE 45 -0.891 3.998 7.061
405 HG21 ILE 45 1HG2 ILE 45 -1.391 1.289 6.920
406 HG22 ILE 45 2HG2 ILE 45 -1.213 0.573 5.319
407 HG23 ILE 45 3HG2 ILE 45 -2.581 1.629 5.664
408 HD11 ILE 45 1HD1 ILE 45 -1.344 6.051 5.897
409 HD12 ILE 45 2HD1 ILE 45 -1.213 5.198 4.354
410 HD13 ILE 45 3HD1 ILE 45 0.195 5.336 5.408
411 H CYS 46 H CYS 46 1.734 0.413 6.776
412 HA CYS 46 HA CYS 46 2.668 -0.900 4.362
413 HB2 CYS 46 2HB CYS 46 2.593 -1.841 7.224
414 HB3 CYS 46 1HB CYS 46 3.514 -2.615 5.949
415 H ALA 47 H ALA 47 1.150 -1.896 3.066
416 HA ALA 47 HA ALA 47 -0.997 -3.222 4.505
417 HB1 ALA 47 1HB ALA 47 -1.077 -1.964 1.771
418 HB2 ALA 47 2HB ALA 47 -1.761 -1.274 3.241
419 HB3 ALA 47 3HB ALA 47 -2.417 -2.772 2.581
420 H ASN 48 H ASN 48 -1.594 -5.187 3.877
421 HA ASN 48 HA ASN 48 0.298 -6.842 2.653
422 HB2 ASN 48 2HB ASN 48 -0.890 -7.758 4.402
423 HB3 ASN 48 1HB ASN 48 -2.459 -7.295 3.830
424 HD21 ASN 48 1HD2 ASN 48 0.170 -8.849 2.072
425 HD22 ASN 48 2HD2 ASN 48 -0.718 -10.313 1.759
426 HA PRO 49 HA PRO 49 -1.012 -5.922 -1.526
427 HB2 PRO 49 2HB PRO 49 0.663 -7.814 -2.635
428 HB3 PRO 49 1HB PRO 49 1.102 -6.140 -2.326
429 HG2 PRO 49 2HG PRO 49 1.685 -8.593 -0.771
430 HG3 PRO 49 1HG PRO 49 2.686 -7.153 -1.009
431 HD2 PRO 49 2HD PRO 49 1.385 -7.618 1.276
432 HD3 PRO 49 1HD PRO 49 1.604 -5.977 0.656
433 H ASN 50 H ASN 50 -1.033 -8.944 0.126
434 HA ASN 50 HA ASN 50 -2.510 -10.157 -1.979
435 HB2 ASN 50 2HB ASN 50 -1.685 -11.344 0.670
436 HB3 ASN 50 1HB ASN 50 -2.725 -12.153 -0.500
437 HD21 ASN 50 1HD2 ASN 50 0.547 -11.084 0.137
438 HD22 ASN 50 2HD2 ASN 50 1.271 -11.934 -1.154
439 H GLU 51 H GLU 51 -3.414 -7.953 0.194
440 HA GLU 51 HA GLU 51 -5.918 -9.223 0.824
441 HB2 GLU 51 2HB GLU 51 -5.150 -6.358 1.350
442 HB3 GLU 51 1HB GLU 51 -6.627 -7.138 1.888
443 HG2 GLU 51 2HG GLU 51 -4.934 -8.799 3.042
444 HG3 GLU 51 1HG GLU 51 -3.857 -7.457 2.756
445 H LYS 52 H LYS 52 -7.760 -8.962 -0.052
446 HA LYS 52 HA LYS 52 -7.944 -8.341 -2.742
447 HB2 LYS 52 2HB LYS 52 -9.415 -9.889 -1.559
448 HB3 LYS 52 1HB LYS 52 -10.136 -8.550 -0.686
449 HG2 LYS 52 2HG LYS 52 -11.071 -7.685 -2.748
450 HG3 LYS 52 1HG LYS 52 -10.295 -8.980 -3.665
451 HD2 LYS 52 2HD LYS 52 -11.540 -10.635 -2.421
452 HD3 LYS 52 1HD LYS 52 -12.317 -9.379 -1.461
453 HE2 LYS 52 2HE LYS 52 -13.329 -8.492 -3.530
454 HE3 LYS 52 1HE LYS 52 -12.570 -9.799 -4.437
455 HZ1 LYS 52 1HZ LYS 52 -14.586 -10.111 -2.280
456 HZ2 LYS 52 2HZ LYS 52 -13.817 -11.383 -3.078
457 HZ3 LYS 52 3HZ LYS 52 -14.855 -10.356 -3.920
458 H TRP 53 H TRP 53 -8.628 -6.261 0.067
459 HA TRP 53 HA TRP 53 -9.875 -4.222 -1.489
460 HB2 TRP 53 2HB TRP 53 -9.767 -2.777 0.462
461 HB3 TRP 53 1HB TRP 53 -10.190 -4.390 1.004
462 HD1 TRP 53 HD TRP 53 -8.274 -5.696 2.445
463 HE1 TRP 53 1HE TRP 53 -6.307 -4.805 3.831
464 HE3 TRP 53 3HE TRP 53 -8.035 -0.946 0.597
465 HZ2 TRP 53 2HZ TRP 53 -4.858 -2.452 4.124
466 HZ3 TRP 53 3HZ TRP 53 -6.314 0.562 1.499
467 HH2 TRP 53 HH TRP 53 -4.763 -0.177 3.221
468 H VAL 54 H VAL 54 -6.617 -5.017 -0.746
469 HA VAL 54 HA VAL 54 -5.439 -2.540 -1.442
470 HB VAL 54 HB VAL 54 -4.239 -5.335 -1.227
471 HG11 VAL 54 1HG1 VAL 54 -2.787 -2.691 -1.387
472 HG12 VAL 54 2HG1 VAL 54 -2.866 -3.865 -2.685
473 HG13 VAL 54 3HG1 VAL 54 -2.050 -4.270 -1.162
474 HG21 VAL 54 1HG2 VAL 54 -4.126 -2.982 0.633
475 HG22 VAL 54 2HG2 VAL 54 -3.387 -4.558 0.909
476 HG23 VAL 54 3HG2 VAL 54 -5.147 -4.397 0.844
477 H GLN 55 H GLN 55 -6.228 -5.494 -3.183
478 HA GLN 55 HA GLN 55 -4.968 -4.966 -5.647
479 HB2 GLN 55 2HB GLN 55 -7.692 -6.229 -5.297
480 HB3 GLN 55 1HB GLN 55 -6.609 -6.422 -6.656
481 HG2 GLN 55 2HG GLN 55 -6.151 -7.438 -3.868
482 HG3 GLN 55 1HG GLN 55 -6.695 -8.393 -5.233
483 HE21 GLN 55 1HE2 GLN 55 -4.507 -8.807 -3.596
484 HE22 GLN 55 2HE2 GLN 55 -3.048 -8.786 -4.475
485 H LYS 56 H LYS 56 -8.179 -4.181 -4.433
486 HA LYS 56 HA LYS 56 -9.197 -2.818 -6.656
487 HB2 LYS 56 2HB LYS 56 -9.836 -2.377 -3.741
488 HB3 LYS 56 1HB LYS 56 -10.815 -1.847 -5.098
489 HG2 LYS 56 2HG LYS 56 -11.189 -4.183 -5.736
490 HG3 LYS 56 1HG LYS 56 -10.202 -4.705 -4.371
491 HD2 LYS 56 2HD LYS 56 -11.762 -3.618 -2.837
492 HD3 LYS 56 1HD LYS 56 -12.756 -3.123 -4.211
493 HE2 LYS 56 2HE LYS 56 -13.105 -5.482 -4.790
494 HE3 LYS 56 1HE LYS 56 -12.129 -5.961 -3.401
495 HZ1 LYS 56 1HZ LYS 56 -14.487 -6.085 -2.941
496 HZ2 LYS 56 2HZ LYS 56 -14.676 -4.454 -3.303
497 HZ3 LYS 56 3HZ LYS 56 -13.774 -4.942 -1.942
498 H ALA 57 H ALA 57 -7.411 -1.673 -3.840
499 HA ALA 57 HA ALA 57 -7.508 1.083 -4.490
500 HB1 ALA 57 1HB ALA 57 -5.655 1.331 -2.899
501 HB2 ALA 57 2HB ALA 57 -5.448 -0.416 -2.843
502 HB3 ALA 57 3HB ALA 57 -6.940 0.321 -2.240
503 H MET 58 H MET 58 -5.165 -1.413 -5.280
504 HA MET 58 HA MET 58 -3.257 0.158 -6.514
505 HB2 MET 58 2HB MET 58 -4.086 -2.628 -7.287
506 HB3 MET 58 1HB MET 58 -2.644 -1.821 -7.869
507 HG2 MET 58 2HG MET 58 -1.857 -1.698 -5.521
508 HG3 MET 58 1HG MET 58 -3.270 -2.633 -5.060
509 HE1 MET 58 1HE MET 58 -0.351 -3.605 -4.411
510 HE2 MET 58 2HE MET 58 -0.354 -5.309 -4.890
511 HE3 MET 58 3HE MET 58 -1.724 -4.660 -4.022
512 H LYS 59 H LYS 59 -6.201 -1.200 -7.826
513 HA LYS 59 HA LYS 59 -5.788 -0.563 -10.526
514 HB2 LYS 59 2HB LYS 59 -8.400 -0.596 -8.991
515 HB3 LYS 59 1HB LYS 59 -8.238 -0.677 -10.740
516 HG2 LYS 59 2HG LYS 59 -7.166 -2.841 -10.585
517 HG3 LYS 59 1HG LYS 59 -7.138 -2.737 -8.832
518 HD2 LYS 59 2HD LYS 59 -8.910 -4.216 -9.438
519 HD3 LYS 59 1HD LYS 59 -9.640 -2.728 -8.868
520 HE2 LYS 59 2HE LYS 59 -9.320 -3.551 -11.772
521 HE3 LYS 59 1HE LYS 59 -10.792 -3.687 -10.832
522 HZ1 LYS 59 1HZ LYS 59 -9.468 -1.196 -11.781
523 HZ2 LYS 59 2HZ LYS 59 -10.728 -1.178 -10.643
524 HZ3 LYS 59 3HZ LYS 59 -10.967 -1.796 -12.169
525 H HIS 60 H HIS 60 -7.155 1.317 -7.914
526 HA HIS 60 HA HIS 60 -7.679 3.595 -9.535
527 HB2 HIS 60 2HB HIS 60 -9.064 3.158 -7.643
528 HB3 HIS 60 1HB HIS 60 -7.664 3.095 -6.578
529 HD1 HIS 60 1HD HIS 60 -9.684 5.610 -8.622
530 HD2 HIS 60 2HD HIS 60 -7.037 5.460 -5.446
531 HE1 HIS 60 1HE HIS 60 -9.629 7.933 -7.717
532 HE2 HIS 60 2HE HIS 60 -8.077 7.836 -5.742
533 H LEU 61 H LEU 61 -5.146 2.634 -7.332
534 HA LEU 61 HA LEU 61 -3.837 5.176 -7.299
535 HB2 LEU 61 2HB LEU 61 -2.895 2.491 -6.360
536 HB3 LEU 61 1HB LEU 61 -2.114 4.022 -6.023
537 HG LEU 61 HG LEU 61 -4.881 3.252 -5.106
538 HD11 LEU 61 1HD1 LEU 61 -2.289 3.352 -3.574
539 HD12 LEU 61 2HD1 LEU 61 -3.184 1.899 -4.035
540 HD13 LEU 61 3HD1 LEU 61 -3.888 3.043 -2.893
541 HD21 LEU 61 1HD2 LEU 61 -3.150 5.635 -4.425
542 HD22 LEU 61 2HD2 LEU 61 -4.698 5.242 -3.679
543 HD23 LEU 61 3HD2 LEU 61 -4.628 5.663 -5.386
544 H ASP 62 H ASP 62 -3.321 2.202 -9.203
545 HA ASP 62 HA ASP 62 -0.605 2.974 -9.818
546 HB2 ASP 62 2HB ASP 62 -1.283 0.596 -9.709
547 HB3 ASP 62 1HB ASP 62 -2.292 0.869 -11.130
548 H LYS 63 H LYS 63 -3.662 3.276 -11.396
549 HA LYS 63 HA LYS 63 -2.287 4.988 -13.205
550 HB2 LYS 63 2HB LYS 63 -3.885 4.469 -15.089
551 HB3 LYS 63 1HB LYS 63 -2.751 3.204 -14.702
552 HG2 LYS 63 2HG LYS 63 -5.629 3.215 -13.793
553 HG3 LYS 63 1HG LYS 63 -5.045 2.482 -15.288
554 HD2 LYS 63 2HD LYS 63 -3.585 0.998 -13.988
555 HD3 LYS 63 1HD LYS 63 -4.168 1.736 -12.495
556 HE2 LYS 63 2HE LYS 63 -5.284 -0.384 -12.907
557 HE3 LYS 63 1HE LYS 63 -6.428 0.950 -12.985
558 HZ1 LYS 63 1HZ LYS 63 -5.207 -0.408 -15.329
559 HZ2 LYS 63 2HZ LYS 63 -6.344 0.829 -15.412
560 HZ3 LYS 63 3HZ LYS 63 -6.764 -0.666 -14.778
561 H LYS 64 H LYS 64 -2.616 6.547 -11.979
562 HA LYS 64 HA LYS 64 -5.336 7.417 -11.430
563 HB2 LYS 64 2HB LYS 64 -4.154 8.993 -9.828
564 HB3 LYS 64 1HB LYS 64 -4.016 7.282 -9.451
565 HG2 LYS 64 2HG LYS 64 -1.763 7.275 -10.505
566 HG3 LYS 64 1HG LYS 64 -1.911 9.011 -10.750
567 HD2 LYS 64 2HD LYS 64 -1.973 7.605 -8.078
568 HD3 LYS 64 1HD LYS 64 -0.572 8.422 -8.763
569 HE2 LYS 64 2HE LYS 64 -1.833 10.535 -8.756
570 HE3 LYS 64 1HE LYS 64 -3.205 9.696 -8.027
571 HZ1 LYS 64 1HZ LYS 64 -0.504 9.938 -6.830
572 HZ2 LYS 64 2HZ LYS 64 -1.803 9.166 -6.110
573 HZ3 LYS 64 3HZ LYS 64 -1.844 10.838 -6.366
Start of MODEL 14
1 H1 ALA 1 1HT ALA 1 13.623 -0.697 10.767
2 H2 ALA 1 2HT ALA 1 14.477 0.598 10.137
3 H3 ALA 1 3HT ALA 1 13.096 0.025 9.352
4 HA ALA 1 HA ALA 1 11.714 0.653 11.181
5 HB1 ALA 1 1HB ALA 1 14.240 1.780 12.390
6 HB2 ALA 1 2HB ALA 1 13.394 0.330 12.936
7 HB3 ALA 1 3HB ALA 1 12.620 1.908 13.061
8 H ARG 2 H ARG 2 13.285 1.771 8.641
9 HA ARG 2 HA ARG 2 12.269 4.484 8.968
10 HB2 ARG 2 2HB ARG 2 14.590 3.545 7.275
11 HB3 ARG 2 1HB ARG 2 13.973 5.182 7.318
12 HG2 ARG 2 2HG ARG 2 14.587 5.344 9.692
13 HG3 ARG 2 1HG ARG 2 15.236 3.708 9.621
14 HD2 ARG 2 2HD ARG 2 17.025 5.329 9.389
15 HD3 ARG 2 1HD ARG 2 16.822 4.427 7.890
16 HE ARG 2 HE ARG 2 15.331 6.859 7.955
17 HH11 ARG 2 1HH1 ARG 2 18.510 5.489 7.277
18 HH12 ARG 2 2HH1 ARG 2 18.985 6.750 6.230
19 HH21 ARG 2 1HH2 ARG 2 15.991 8.589 6.503
20 HH22 ARG 2 2HH2 ARG 2 17.528 8.532 5.786
21 H LYS 3 H LYS 3 11.743 5.426 6.718
22 HA LYS 3 HA LYS 3 9.855 3.628 5.579
23 HB2 LYS 3 2HB LYS 3 10.517 6.488 4.873
24 HB3 LYS 3 1HB LYS 3 9.349 5.542 3.971
25 HG2 LYS 3 2HG LYS 3 8.189 6.955 5.526
26 HG3 LYS 3 1HG LYS 3 8.034 5.277 6.047
27 HD2 LYS 3 2HD LYS 3 9.789 5.654 7.718
28 HD3 LYS 3 1HD LYS 3 9.928 7.331 7.179
29 HE2 LYS 3 2HE LYS 3 7.591 7.723 7.815
30 HE3 LYS 3 1HE LYS 3 7.456 6.051 8.336
31 HZ1 LYS 3 1HZ LYS 3 7.848 7.541 10.182
32 HZ2 LYS 3 2HZ LYS 3 9.300 8.057 9.499
33 HZ3 LYS 3 3HZ LYS 3 9.125 6.450 10.002
34 H SER 4 H SER 4 10.769 2.051 4.627
35 HA SER 4 HA SER 4 11.798 2.414 1.967
36 HB2 SER 4 2HB SER 4 13.464 1.016 4.068
37 HB3 SER 4 1HB SER 4 13.855 1.101 2.354
38 HG SER 4 HG SER 4 13.417 3.538 3.596
39 H CYS 5 H CYS 5 11.477 0.150 4.703
40 HA CYS 5 HA CYS 5 9.928 -1.620 3.004
41 HB2 CYS 5 2HB CYS 5 12.184 -2.448 4.839
42 HB3 CYS 5 1HB CYS 5 11.114 -3.541 3.974
43 H CYS 6 H CYS 6 8.522 -2.937 4.219
44 HA CYS 6 HA CYS 6 8.056 -2.153 6.986
45 HB2 CYS 6 2HB CYS 6 6.247 -3.181 4.822
46 HB3 CYS 6 1HB CYS 6 5.761 -2.974 6.499
47 H LEU 7 H LEU 7 7.652 -3.848 8.405
48 HA LEU 7 HA LEU 7 8.380 -6.504 7.418
49 HB2 LEU 7 2HB LEU 7 8.847 -5.331 10.174
50 HB3 LEU 7 1HB LEU 7 9.135 -7.003 9.756
51 HG LEU 7 HG LEU 7 10.871 -6.182 8.103
52 HD11 LEU 7 1HD1 LEU 7 11.834 -3.966 8.418
53 HD12 LEU 7 2HD1 LEU 7 10.534 -3.562 9.541
54 HD13 LEU 7 3HD1 LEU 7 10.168 -3.884 7.847
55 HD21 LEU 7 1HD2 LEU 7 11.515 -7.138 10.216
56 HD22 LEU 7 2HD2 LEU 7 11.300 -5.583 11.019
57 HD23 LEU 7 3HD2 LEU 7 12.580 -5.790 9.825
58 H LYS 8 H LYS 8 5.910 -4.630 8.659
59 HA LYS 8 HA LYS 8 4.346 -7.034 9.214
60 HB2 LYS 8 2HB LYS 8 4.179 -4.408 10.682
61 HB3 LYS 8 1HB LYS 8 3.064 -5.740 10.922
62 HG2 LYS 8 2HG LYS 8 5.043 -7.101 11.677
63 HG3 LYS 8 1HG LYS 8 5.991 -5.624 11.616
64 HD2 LYS 8 2HD LYS 8 3.547 -6.077 13.357
65 HD3 LYS 8 1HD LYS 8 5.208 -6.173 13.900
66 HE2 LYS 8 2HE LYS 8 4.353 -4.067 14.604
67 HE3 LYS 8 1HE LYS 8 5.451 -3.741 13.274
68 HZ1 LYS 8 1HZ LYS 8 2.476 -3.814 13.060
69 HZ2 LYS 8 2HZ LYS 8 3.532 -3.380 11.827
70 HZ3 LYS 8 3HZ LYS 8 3.402 -2.427 13.175
71 H TYR 9 H TYR 9 2.008 -6.595 8.922
72 HA TYR 9 HA TYR 9 1.516 -4.592 6.815
73 HB2 TYR 9 2HB TYR 9 -0.269 -7.035 7.249
74 HB3 TYR 9 1HB TYR 9 -0.132 -5.959 5.916
75 HD1 TYR 9 1HD TYR 9 1.417 -6.253 4.181
76 HD2 TYR 9 2HD TYR 9 1.475 -8.809 7.554
77 HE1 TYR 9 1HE TYR 9 2.838 -7.824 2.943
78 HE2 TYR 9 2HE TYR 9 2.896 -10.405 6.343
79 HH TYR 9 HH TYR 9 4.426 -9.641 3.411
80 H THR 10 H THR 10 -0.558 -3.553 6.976
81 HA THR 10 HA THR 10 -1.252 -2.920 9.601
82 HB THR 10 HB THR 10 -1.429 -1.188 7.932
83 HG1 THR 10 1HG THR 10 -4.041 -1.088 8.198
84 HG21 THR 10 1HG2 THR 10 -3.136 -1.227 6.159
85 HG22 THR 10 2HG2 THR 10 -3.593 -2.867 6.639
86 HG23 THR 10 3HG2 THR 10 -1.982 -2.549 5.986
87 H LYS 11 H LYS 11 -2.922 -3.449 10.814
88 HA LYS 11 HA LYS 11 -4.457 -5.814 10.108
89 HB2 LYS 11 2HB LYS 11 -5.195 -5.717 12.462
90 HB3 LYS 11 1HB LYS 11 -3.445 -5.751 12.303
91 HG2 LYS 11 2HG LYS 11 -3.380 -3.305 12.658
92 HG3 LYS 11 1HG LYS 11 -5.130 -3.309 12.871
93 HD2 LYS 11 2HD LYS 11 -3.153 -4.815 14.584
94 HD3 LYS 11 1HD LYS 11 -3.905 -3.282 15.013
95 HE2 LYS 11 2HE LYS 11 -6.105 -4.345 14.939
96 HE3 LYS 11 1HE LYS 11 -5.354 -5.876 14.496
97 HZ1 LYS 11 1HZ LYS 11 -4.196 -5.869 16.626
98 HZ2 LYS 11 2HZ LYS 11 -5.869 -5.773 16.830
99 HZ3 LYS 11 3HZ LYS 11 -4.941 -4.396 17.026
100 H ARG 12 H ARG 12 -4.785 -2.582 9.704
101 HA ARG 12 HA ARG 12 -7.720 -2.686 9.734
102 HB2 ARG 12 2HB ARG 12 -6.970 -1.232 11.523
103 HB3 ARG 12 1HB ARG 12 -5.877 -0.394 10.437
104 HG2 ARG 12 2HG ARG 12 -7.801 0.993 10.855
105 HG3 ARG 12 1HG ARG 12 -7.829 0.454 9.181
106 HD2 ARG 12 2HD ARG 12 -9.434 -1.331 9.839
107 HD3 ARG 12 1HD ARG 12 -9.455 -0.655 11.463
108 HE ARG 12 HE ARG 12 -10.012 1.369 9.615
109 HH11 ARG 12 1HH1 ARG 12 -11.555 -1.494 11.013
110 HH12 ARG 12 2HH1 ARG 12 -13.139 -0.918 10.777
111 HH21 ARG 12 1HH2 ARG 12 -12.201 2.141 9.260
112 HH22 ARG 12 2HH2 ARG 12 -13.520 1.193 9.740
113 HA PRO 13 HA PRO 13 -7.068 -1.859 5.294
114 HB2 PRO 13 2HB PRO 13 -9.985 -1.296 5.582
115 HB3 PRO 13 1HB PRO 13 -9.148 -2.285 4.378
116 HG2 PRO 13 2HG PRO 13 -10.490 -3.456 6.320
117 HG3 PRO 13 1HG PRO 13 -8.902 -4.074 5.828
118 HD2 PRO 13 2HD PRO 13 -9.633 -2.419 8.206
119 HD3 PRO 13 1HD PRO 13 -8.509 -3.794 8.098
120 H LEU 14 H LEU 14 -7.275 0.039 4.000
121 HA LEU 14 HA LEU 14 -7.711 2.511 5.524
122 HB2 LEU 14 2HB LEU 14 -5.327 1.964 5.006
123 HB3 LEU 14 1HB LEU 14 -5.744 1.931 3.313
124 HG LEU 14 HG LEU 14 -6.289 4.338 3.449
125 HD11 LEU 14 1HD1 LEU 14 -5.538 5.600 5.398
126 HD12 LEU 14 2HD1 LEU 14 -5.127 4.101 6.223
127 HD13 LEU 14 3HD1 LEU 14 -6.812 4.464 5.840
128 HD21 LEU 14 1HD2 LEU 14 -3.530 3.526 4.333
129 HD22 LEU 14 2HD2 LEU 14 -3.955 5.050 3.552
130 HD23 LEU 14 3HD2 LEU 14 -4.130 3.528 2.682
131 HA PRO 15 HA PRO 15 -10.654 3.047 2.132
132 HB2 PRO 15 2HB PRO 15 -10.726 5.897 2.863
133 HB3 PRO 15 1HB PRO 15 -12.036 4.714 2.905
134 HG2 PRO 15 2HG PRO 15 -10.936 5.687 5.159
135 HG3 PRO 15 1HG PRO 15 -11.511 4.014 5.046
136 HD2 PRO 15 2HD PRO 15 -8.718 5.075 4.869
137 HD3 PRO 15 1HD PRO 15 -9.329 3.634 5.715
138 H LEU 16 H LEU 16 -10.322 3.514 0.065
139 HA LEU 16 HA LEU 16 -7.833 4.485 -0.816
140 HB2 LEU 16 2HB LEU 16 -8.994 2.839 -2.086
141 HB3 LEU 16 1HB LEU 16 -10.360 3.942 -2.340
142 HG LEU 16 HG LEU 16 -8.800 5.324 -3.677
143 HD11 LEU 16 1HD1 LEU 16 -6.687 4.300 -4.391
144 HD12 LEU 16 2HD1 LEU 16 -6.964 2.967 -3.274
145 HD13 LEU 16 3HD1 LEU 16 -6.705 4.598 -2.657
146 HD21 LEU 16 1HD2 LEU 16 -9.132 2.463 -4.438
147 HD22 LEU 16 2HD2 LEU 16 -8.838 3.836 -5.541
148 HD23 LEU 16 3HD2 LEU 16 -10.322 3.761 -4.566
149 H LYS 17 H LYS 17 -10.873 5.968 -0.391
150 HA LYS 17 HA LYS 17 -10.531 8.356 -1.805
151 HB2 LYS 17 2HB LYS 17 -12.002 7.880 0.781
152 HB3 LYS 17 1HB LYS 17 -12.144 9.347 -0.172
153 HG2 LYS 17 2HG LYS 17 -13.043 8.036 -2.039
154 HG3 LYS 17 1HG LYS 17 -12.914 6.575 -1.066
155 HD2 LYS 17 2HD LYS 17 -14.616 8.990 -0.414
156 HD3 LYS 17 1HD LYS 17 -15.194 7.472 -1.097
157 HE2 LYS 17 2HE LYS 17 -14.438 6.289 0.932
158 HE3 LYS 17 1HE LYS 17 -13.900 7.821 1.612
159 HZ1 LYS 17 1HZ LYS 17 -16.717 7.162 0.899
160 HZ2 LYS 17 2HZ LYS 17 -16.197 8.606 1.570
161 HZ3 LYS 17 3HZ LYS 17 -16.076 7.182 2.451
162 H ARG 18 H ARG 18 -8.688 7.234 0.681
163 HA ARG 18 HA ARG 18 -7.798 9.972 1.467
164 HB2 ARG 18 2HB ARG 18 -7.820 7.513 3.214
165 HB3 ARG 18 1HB ARG 18 -7.266 9.113 3.683
166 HG2 ARG 18 2HG ARG 18 -9.545 9.964 3.432
167 HG3 ARG 18 1HG ARG 18 -10.073 8.350 2.943
168 HD2 ARG 18 2HD ARG 18 -9.350 7.473 5.116
169 HD3 ARG 18 1HD ARG 18 -8.869 9.096 5.601
170 HE ARG 18 HE ARG 18 -11.529 9.145 4.768
171 HH11 ARG 18 1HH1 ARG 18 -9.580 7.850 7.424
172 HH12 ARG 18 2HH1 ARG 18 -10.808 7.940 8.585
173 HH21 ARG 18 1HH2 ARG 18 -13.260 9.265 6.370
174 HH22 ARG 18 2HH2 ARG 18 -12.947 8.776 7.976
175 H ILE 19 H ILE 19 -6.881 7.634 -0.437
176 HA ILE 19 HA ILE 19 -4.129 7.456 0.595
177 HB ILE 19 HB ILE 19 -5.392 5.672 -1.516
178 HG12 ILE 19 2HG1 ILE 19 -4.825 5.024 1.357
179 HG13 ILE 19 1HG1 ILE 19 -6.443 5.414 0.805
180 HG21 ILE 19 1HG2 ILE 19 -2.836 5.436 0.109
181 HG22 ILE 19 2HG2 ILE 19 -2.920 5.802 -1.614
182 HG23 ILE 19 3HG2 ILE 19 -3.431 4.223 -1.011
183 HD11 ILE 19 1HD1 ILE 19 -6.351 3.426 -0.692
184 HD12 ILE 19 2HD1 ILE 19 -6.100 2.989 1.000
185 HD13 ILE 19 3HD1 ILE 19 -4.736 3.131 -0.108
186 H LYS 20 H LYS 20 -2.587 8.423 -0.513
187 HA LYS 20 HA LYS 20 -3.271 9.877 -2.905
188 HB2 LYS 20 2HB LYS 20 -0.700 9.824 -1.308
189 HB3 LYS 20 1HB LYS 20 -1.014 10.878 -2.661
190 HG2 LYS 20 2HG LYS 20 -2.384 10.872 -0.047
191 HG3 LYS 20 1HG LYS 20 -1.280 12.091 -0.694
192 HD2 LYS 20 2HD LYS 20 -4.000 11.332 -1.627
193 HD3 LYS 20 1HD LYS 20 -3.544 12.859 -0.898
194 HE2 LYS 20 2HE LYS 20 -2.583 11.908 -3.632
195 HE3 LYS 20 1HE LYS 20 -3.756 13.184 -3.350
196 HZ1 LYS 20 1HZ LYS 20 -2.021 14.483 -2.266
197 HZ2 LYS 20 2HZ LYS 20 -1.566 14.065 -3.824
198 HZ3 LYS 20 3HZ LYS 20 -0.898 13.257 -2.528
199 H SER 21 H SER 21 -1.012 7.294 -1.943
200 HA SER 21 HA SER 21 -0.829 6.183 -4.509
201 HB2 SER 21 2HB SER 21 0.405 8.327 -4.949
202 HB3 SER 21 1HB SER 21 1.525 7.914 -3.659
203 HG SER 21 HG SER 21 1.069 6.344 -5.982
204 H TYR 22 H TYR 22 1.182 4.641 -4.476
205 HA TYR 22 HA TYR 22 1.854 3.839 -1.731
206 HB2 TYR 22 2HB TYR 22 1.487 1.512 -2.249
207 HB3 TYR 22 1HB TYR 22 -0.004 2.405 -2.474
208 HD1 TYR 22 1HD TYR 22 -1.149 2.224 -4.462
209 HD2 TYR 22 2HD TYR 22 2.870 0.921 -4.350
210 HE1 TYR 22 1HE TYR 22 -1.393 1.238 -6.691
211 HE2 TYR 22 2HE TYR 22 2.631 -0.054 -6.591
212 HH TYR 22 HH TYR 22 -0.011 0.621 -8.573
213 H THR 23 H THR 23 3.566 2.322 -1.677
214 HA THR 23 HA THR 23 5.496 2.649 -3.860
215 HB THR 23 HB THR 23 5.952 2.348 -0.878
216 HG1 THR 23 1HG THR 23 6.548 4.487 -2.648
217 HG21 THR 23 1HG2 THR 23 7.629 1.169 -2.196
218 HG22 THR 23 2HG2 THR 23 8.339 2.565 -1.370
219 HG23 THR 23 3HG2 THR 23 7.981 2.640 -3.104
220 H ILE 24 H ILE 24 6.322 0.738 -4.696
221 HA ILE 24 HA ILE 24 5.071 -1.703 -3.790
222 HB ILE 24 HB ILE 24 6.953 -1.235 -6.127
223 HG12 ILE 24 2HG1 ILE 24 3.950 -1.586 -6.048
224 HG13 ILE 24 1HG1 ILE 24 4.794 -0.071 -6.356
225 HG21 ILE 24 1HG2 ILE 24 5.285 -3.664 -5.425
226 HG22 ILE 24 2HG2 ILE 24 7.045 -3.554 -5.350
227 HG23 ILE 24 3HG2 ILE 24 6.220 -3.459 -6.906
228 HD11 ILE 24 1HD1 ILE 24 4.844 -2.532 -8.091
229 HD12 ILE 24 2HD1 ILE 24 5.726 -1.042 -8.410
230 HD13 ILE 24 3HD1 ILE 24 3.962 -1.041 -8.420
231 H GLN 25 H GLN 25 5.977 -2.698 -2.143
232 HA GLN 25 HA GLN 25 8.863 -2.706 -1.866
233 HB2 GLN 25 2HB GLN 25 7.799 -2.229 0.171
234 HB3 GLN 25 1HB GLN 25 6.618 -3.501 -0.004
235 HG2 GLN 25 2HG GLN 25 8.318 -5.163 0.340
236 HG3 GLN 25 1HG GLN 25 9.543 -3.901 0.452
237 HE21 GLN 25 1HE2 GLN 25 8.545 -5.928 2.391
238 HE22 GLN 25 2HE2 GLN 25 8.161 -5.023 3.805
239 H SER 26 H SER 26 9.972 -4.240 -2.730
240 HA SER 26 HA SER 26 8.643 -6.683 -3.419
241 HB2 SER 26 2HB SER 26 10.769 -7.184 -4.639
242 HB3 SER 26 1HB SER 26 9.982 -5.697 -5.168
243 HG SER 26 HG SER 26 11.485 -4.513 -4.175
244 H ASN 27 H ASN 27 9.048 -8.608 -2.489
245 HA ASN 27 HA ASN 27 10.158 -8.658 0.099
246 HB2 ASN 27 2HB ASN 27 8.161 -9.739 -0.513
247 HB3 ASN 27 1HB ASN 27 8.937 -10.640 -1.806
248 HD21 ASN 27 1HD2 ASN 27 8.046 -12.338 -0.955
249 HD22 ASN 27 2HD2 ASN 27 8.663 -13.207 0.410
250 H GLU 28 H GLU 28 11.442 -8.839 -2.910
251 HA GLU 28 HA GLU 28 13.561 -10.685 -2.532
252 HB2 GLU 28 2HB GLU 28 13.254 -8.362 -4.442
253 HB3 GLU 28 1HB GLU 28 14.625 -9.453 -4.468
254 HG2 GLU 28 2HG GLU 28 13.019 -10.005 -6.201
255 HG3 GLU 28 1HG GLU 28 13.146 -11.312 -5.031
256 H ALA 29 H ALA 29 13.235 -7.179 -2.177
257 HA ALA 29 HA ALA 29 15.960 -7.009 -1.111
258 HB1 ALA 29 1HB ALA 29 15.749 -4.602 -1.422
259 HB2 ALA 29 2HB ALA 29 14.064 -4.801 -1.904
260 HB3 ALA 29 3HB ALA 29 15.352 -5.459 -2.913
261 H CYS 30 H CYS 30 12.637 -6.726 -0.137
262 HA CYS 30 HA CYS 30 13.496 -5.771 2.498
263 HB2 CYS 30 2HB CYS 30 10.768 -5.797 1.232
264 HB3 CYS 30 1HB CYS 30 11.149 -5.157 2.823
265 H ASN 31 H ASN 31 12.223 -6.700 4.335
266 HA ASN 31 HA ASN 31 12.612 -9.450 4.509
267 HB2 ASN 31 2HB ASN 31 12.593 -8.038 6.492
268 HB3 ASN 31 1HB ASN 31 10.906 -7.643 6.226
269 HD21 ASN 31 1HD2 ASN 31 13.119 -10.185 7.179
270 HD22 ASN 31 2HD2 ASN 31 11.943 -11.149 7.987
271 H ILE 32 H ILE 32 9.647 -7.693 3.804
272 HA ILE 32 HA ILE 32 8.420 -10.243 2.985
273 HB ILE 32 HB ILE 32 6.222 -9.479 3.820
274 HG12 ILE 32 2HG1 ILE 32 7.777 -7.230 5.110
275 HG13 ILE 32 1HG1 ILE 32 6.659 -7.064 3.765
276 HG21 ILE 32 1HG2 ILE 32 8.356 -9.541 5.885
277 HG22 ILE 32 2HG2 ILE 32 7.542 -10.957 5.210
278 HG23 ILE 32 3HG2 ILE 32 6.634 -9.798 6.213
279 HD11 ILE 32 1HD1 ILE 32 5.964 -7.958 6.551
280 HD12 ILE 32 2HD1 ILE 32 4.829 -7.794 5.211
281 HD13 ILE 32 3HD1 ILE 32 5.646 -6.370 5.855
282 H LYS 33 H LYS 33 6.356 -9.719 1.687
283 HA LYS 33 HA LYS 33 6.998 -7.587 -0.102
284 HB2 LYS 33 2HB LYS 33 6.382 -9.838 -1.069
285 HB3 LYS 33 1HB LYS 33 4.802 -9.661 -0.336
286 HG2 LYS 33 2HG LYS 33 4.316 -7.747 -1.717
287 HG3 LYS 33 1HG LYS 33 5.933 -7.802 -2.399
288 HD2 LYS 33 2HD LYS 33 5.483 -10.044 -3.309
289 HD3 LYS 33 1HD LYS 33 3.845 -9.965 -2.664
290 HE2 LYS 33 2HE LYS 33 3.351 -8.056 -4.064
291 HE3 LYS 33 1HE LYS 33 5.007 -8.030 -4.665
292 HZ1 LYS 33 1HZ LYS 33 3.038 -10.219 -5.085
293 HZ2 LYS 33 2HZ LYS 33 4.629 -10.207 -5.647
294 HZ3 LYS 33 3HZ LYS 33 3.525 -9.074 -6.233
295 H ALA 34 H ALA 34 6.061 -5.643 0.773
296 HA ALA 34 HA ALA 34 3.251 -5.747 1.595
297 HB1 ALA 34 1HB ALA 34 4.552 -5.952 3.688
298 HB2 ALA 34 2HB ALA 34 3.701 -4.420 3.615
299 HB3 ALA 34 3HB ALA 34 5.425 -4.478 3.284
300 H ILE 35 H ILE 35 2.407 -4.448 0.108
301 HA ILE 35 HA ILE 35 3.724 -2.225 -1.060
302 HB ILE 35 HB ILE 35 0.735 -2.679 -0.779
303 HG12 ILE 35 2HG1 ILE 35 1.862 -4.555 -1.844
304 HG13 ILE 35 1HG1 ILE 35 0.866 -3.693 -3.011
305 HG21 ILE 35 1HG2 ILE 35 0.527 -1.194 -2.791
306 HG22 ILE 35 2HG2 ILE 35 2.246 -0.888 -2.709
307 HG23 ILE 35 3HG2 ILE 35 1.206 -0.360 -1.403
308 HD11 ILE 35 1HD1 ILE 35 2.929 -4.363 -3.995
309 HD12 ILE 35 2HD1 ILE 35 3.867 -3.547 -2.730
310 HD13 ILE 35 3HD1 ILE 35 2.912 -2.601 -3.873
311 H ILE 36 H ILE 36 3.929 -0.089 -0.398
312 HA ILE 36 HA ILE 36 2.878 0.446 2.279
313 HB ILE 36 HB ILE 36 5.016 2.024 0.805
314 HG12 ILE 36 2HG1 ILE 36 6.527 1.064 2.689
315 HG13 ILE 36 1HG1 ILE 36 5.290 -0.180 2.826
316 HG21 ILE 36 1HG2 ILE 36 3.853 3.382 2.394
317 HG22 ILE 36 2HG2 ILE 36 5.505 3.027 2.928
318 HG23 ILE 36 3HG2 ILE 36 4.143 2.171 3.660
319 HD11 ILE 36 1HD1 ILE 36 5.647 -0.769 0.512
320 HD12 ILE 36 2HD1 ILE 36 7.136 -0.867 1.477
321 HD13 ILE 36 3HD1 ILE 36 6.860 0.512 0.398
322 H PHE 37 H PHE 37 1.078 1.467 2.287
323 HA PHE 37 HA PHE 37 0.202 3.181 0.137
324 HB2 PHE 37 2HB PHE 37 -0.967 2.024 2.624
325 HB3 PHE 37 1HB PHE 37 -1.783 3.361 1.803
326 HD1 PHE 37 1HD PHE 37 0.024 0.569 0.255
327 HD2 PHE 37 2HD PHE 37 -3.684 2.283 1.161
328 HE1 PHE 37 1HE PHE 37 -1.126 -1.072 -1.286
329 HE2 PHE 37 2HE PHE 37 -4.828 0.697 -0.334
330 HZ PHE 37 HZ PHE 37 -3.534 -0.972 -1.549
331 H THR 38 H THR 38 0.003 5.296 0.287
332 HA THR 38 HA THR 38 0.714 6.516 2.848
333 HB THR 38 HB THR 38 1.357 7.578 0.080
334 HG1 THR 38 1HG THR 38 2.512 5.782 1.533
335 HG21 THR 38 1HG2 THR 38 0.924 9.335 1.697
336 HG22 THR 38 2HG2 THR 38 2.650 9.277 1.319
337 HG23 THR 38 3HG2 THR 38 2.023 8.590 2.841
338 H THR 39 H THR 39 -0.756 8.065 3.640
339 HA THR 39 HA THR 39 -3.174 8.250 2.130
340 HB THR 39 HB THR 39 -3.916 9.454 4.232
341 HG1 THR 39 1HG THR 39 -2.562 8.880 6.050
342 HG21 THR 39 1HG2 THR 39 -4.462 7.121 3.808
343 HG22 THR 39 2HG2 THR 39 -4.131 7.379 5.523
344 HG23 THR 39 3HG2 THR 39 -2.912 6.629 4.490
345 H LYS 40 H LYS 40 -4.237 10.493 2.417
346 HA LYS 40 HA LYS 40 -2.612 12.439 1.167
347 HB2 LYS 40 2HB LYS 40 -5.120 12.942 2.715
348 HB3 LYS 40 1HB LYS 40 -4.541 13.888 1.344
349 HG2 LYS 40 2HG LYS 40 -4.888 11.559 0.035
350 HG3 LYS 40 1HG LYS 40 -5.864 11.230 1.419
351 HD2 LYS 40 2HD LYS 40 -7.327 13.039 1.021
352 HD3 LYS 40 1HD LYS 40 -6.277 13.666 -0.259
353 HE2 LYS 40 2HE LYS 40 -6.643 11.588 -1.533
354 HE3 LYS 40 1HE LYS 40 -7.746 11.042 -0.286
355 HZ1 LYS 40 1HZ LYS 40 -9.175 12.923 -0.765
356 HZ2 LYS 40 2HZ LYS 40 -8.909 11.996 -2.144
357 HZ3 LYS 40 3HZ LYS 40 -8.103 13.454 -1.958
358 H LYS 41 H LYS 41 -3.132 11.446 4.351
359 HA LYS 41 HA LYS 41 -2.258 13.744 5.776
360 HB2 LYS 41 2HB LYS 41 -3.620 11.779 6.711
361 HB3 LYS 41 1HB LYS 41 -2.220 10.830 6.479
362 HG2 LYS 41 2HG LYS 41 -2.354 11.287 8.806
363 HG3 LYS 41 1HG LYS 41 -0.974 12.134 8.150
364 HD2 LYS 41 2HD LYS 41 -3.640 13.443 8.727
365 HD3 LYS 41 1HD LYS 41 -2.326 13.373 9.885
366 HE2 LYS 41 2HE LYS 41 -0.923 14.630 8.193
367 HE3 LYS 41 1HE LYS 41 -2.388 14.803 7.233
368 HZ1 LYS 41 1HZ LYS 41 -2.028 16.738 8.565
369 HZ2 LYS 41 2HZ LYS 41 -2.007 15.821 9.969
370 HZ3 LYS 41 3HZ LYS 41 -3.432 15.954 9.090
371 H GLY 42 H GLY 42 -0.893 11.287 3.902
372 HA2 GLY 42 2HA GLY 42 1.225 11.082 3.102
373 HA3 GLY 42 1HA GLY 42 1.745 12.314 4.227
374 H ARG 43 H ARG 43 0.034 9.726 5.629
375 HA ARG 43 HA ARG 43 2.373 8.832 7.062
376 HB2 ARG 43 2HB ARG 43 -0.441 7.853 7.040
377 HB3 ARG 43 1HB ARG 43 0.790 7.224 8.133
378 HG2 ARG 43 2HG ARG 43 1.028 9.496 9.092
379 HG3 ARG 43 1HG ARG 43 -0.269 10.047 8.030
380 HD2 ARG 43 2HD ARG 43 -1.786 8.409 9.103
381 HD3 ARG 43 1HD ARG 43 -0.479 7.952 10.189
382 HE ARG 43 HE ARG 43 -0.605 10.599 10.535
383 HH11 ARG 43 1HH1 ARG 43 -3.095 8.084 10.721
384 HH12 ARG 43 2HH1 ARG 43 -4.065 8.928 11.821
385 HH21 ARG 43 1HH2 ARG 43 -1.965 11.788 12.025
386 HH22 ARG 43 2HH2 ARG 43 -3.409 11.096 12.578
387 H LYS 44 H LYS 44 2.781 6.414 7.305
388 HA LYS 44 HA LYS 44 2.713 5.220 4.630
389 HB2 LYS 44 2HB LYS 44 4.789 4.894 6.806
390 HB3 LYS 44 1HB LYS 44 4.815 4.081 5.247
391 HG2 LYS 44 2HG LYS 44 4.973 7.061 5.675
392 HG3 LYS 44 1HG LYS 44 6.327 5.998 5.295
393 HD2 LYS 44 2HD LYS 44 5.323 5.444 3.153
394 HD3 LYS 44 1HD LYS 44 3.903 6.410 3.541
395 HE2 LYS 44 2HE LYS 44 5.293 8.411 3.641
396 HE3 LYS 44 1HE LYS 44 6.713 7.446 3.248
397 HZ1 LYS 44 1HZ LYS 44 4.327 7.639 1.517
398 HZ2 LYS 44 2HZ LYS 44 5.798 6.947 1.106
399 HZ3 LYS 44 3HZ LYS 44 5.668 8.629 1.318
400 H ILE 45 H ILE 45 1.267 3.753 4.544
401 HA ILE 45 HA ILE 45 0.684 2.121 6.902
402 HB ILE 45 HB ILE 45 -1.031 2.575 4.436
403 HG12 ILE 45 2HG1 ILE 45 -2.618 3.740 6.161
404 HG13 ILE 45 1HG1 ILE 45 -1.200 3.790 7.191
405 HG21 ILE 45 1HG2 ILE 45 -1.674 1.115 6.985
406 HG22 ILE 45 2HG2 ILE 45 -1.421 0.401 5.391
407 HG23 ILE 45 3HG2 ILE 45 -2.814 1.444 5.681
408 HD11 ILE 45 1HD1 ILE 45 -1.589 5.890 6.067
409 HD12 ILE 45 2HD1 ILE 45 -1.411 5.088 4.501
410 HD13 ILE 45 3HD1 ILE 45 -0.040 5.177 5.611
411 H CYS 46 H CYS 46 1.690 0.260 6.799
412 HA CYS 46 HA CYS 46 2.618 -0.904 4.327
413 HB2 CYS 46 2HB CYS 46 2.601 -1.927 7.150
414 HB3 CYS 46 1HB CYS 46 3.586 -2.598 5.870
415 H ALA 47 H ALA 47 1.174 -1.992 3.056
416 HA ALA 47 HA ALA 47 -0.949 -3.403 4.507
417 HB1 ALA 47 1HB ALA 47 -1.165 -2.080 1.813
418 HB2 ALA 47 2HB ALA 47 -1.775 -1.420 3.327
419 HB3 ALA 47 3HB ALA 47 -2.453 -2.916 2.680
420 H ASN 48 H ASN 48 -1.396 -5.423 4.036
421 HA ASN 48 HA ASN 48 0.373 -6.924 2.533
422 HB2 ASN 48 2HB ASN 48 -0.590 -8.056 4.320
423 HB3 ASN 48 1HB ASN 48 -2.210 -7.528 3.930
424 HD21 ASN 48 1HD2 ASN 48 0.371 -9.647 2.852
425 HD22 ASN 48 2HD2 ASN 48 -0.767 -10.668 1.982
426 HA PRO 49 HA PRO 49 -1.299 -6.092 -1.474
427 HB2 PRO 49 2HB PRO 49 0.297 -7.878 -2.777
428 HB3 PRO 49 1HB PRO 49 0.777 -6.229 -2.395
429 HG2 PRO 49 2HG PRO 49 1.485 -8.770 -1.018
430 HG3 PRO 49 1HG PRO 49 2.442 -7.293 -1.251
431 HD2 PRO 49 2HD PRO 49 1.261 -7.937 1.092
432 HD3 PRO 49 1HD PRO 49 1.541 -6.264 0.577
433 H ASN 50 H ASN 50 -1.155 -9.199 0.152
434 HA ASN 50 HA ASN 50 -2.590 -10.518 -1.828
435 HB2 ASN 50 2HB ASN 50 -2.216 -11.240 1.056
436 HB3 ASN 50 1HB ASN 50 -2.945 -12.255 -0.193
437 HD21 ASN 50 1HD2 ASN 50 -0.553 -12.509 1.457
438 HD22 ASN 50 2HD2 ASN 50 0.754 -12.867 0.389
439 H GLU 51 H GLU 51 -3.487 -8.143 0.417
440 HA GLU 51 HA GLU 51 -6.125 -9.146 0.861
441 HB2 GLU 51 2HB GLU 51 -5.107 -6.357 1.395
442 HB3 GLU 51 1HB GLU 51 -6.623 -7.032 1.953
443 HG2 GLU 51 2HG GLU 51 -4.942 -8.802 3.069
444 HG3 GLU 51 1HG GLU 51 -3.877 -7.441 2.895
445 H LYS 52 H LYS 52 -7.868 -8.688 -0.162
446 HA LYS 52 HA LYS 52 -7.561 -8.015 -2.855
447 HB2 LYS 52 2HB LYS 52 -9.222 -9.593 -1.977
448 HB3 LYS 52 1HB LYS 52 -10.110 -8.252 -1.270
449 HG2 LYS 52 2HG LYS 52 -10.455 -7.321 -3.505
450 HG3 LYS 52 1HG LYS 52 -9.595 -8.683 -4.202
451 HD2 LYS 52 2HD LYS 52 -12.128 -8.885 -2.571
452 HD3 LYS 52 1HD LYS 52 -12.029 -8.984 -4.328
453 HE2 LYS 52 2HE LYS 52 -10.627 -10.984 -4.145
454 HE3 LYS 52 1HE LYS 52 -10.691 -10.891 -2.390
455 HZ1 LYS 52 1HZ LYS 52 -13.057 -11.276 -2.471
456 HZ2 LYS 52 2HZ LYS 52 -12.242 -12.491 -3.284
457 HZ3 LYS 52 3HZ LYS 52 -13.026 -11.297 -4.171
458 H TRP 53 H TRP 53 -8.565 -6.074 -0.073
459 HA TRP 53 HA TRP 53 -9.629 -3.941 -1.606
460 HB2 TRP 53 2HB TRP 53 -9.509 -2.544 0.390
461 HB3 TRP 53 1HB TRP 53 -10.059 -4.135 0.862
462 HD1 TRP 53 HD TRP 53 -8.260 -5.631 2.351
463 HE1 TRP 53 1HE TRP 53 -6.295 -4.881 3.826
464 HE3 TRP 53 3HE TRP 53 -7.685 -0.842 0.642
465 HZ2 TRP 53 2HZ TRP 53 -4.733 -2.619 4.240
466 HZ3 TRP 53 3HZ TRP 53 -5.926 0.539 1.636
467 HH2 TRP 53 HH TRP 53 -4.477 -0.325 3.399
468 H VAL 54 H VAL 54 -6.425 -4.788 -0.600
469 HA VAL 54 HA VAL 54 -5.093 -2.392 -1.292
470 HB VAL 54 HB VAL 54 -4.055 -5.240 -1.041
471 HG11 VAL 54 1HG1 VAL 54 -2.494 -2.660 -1.168
472 HG12 VAL 54 2HG1 VAL 54 -2.528 -3.902 -2.420
473 HG13 VAL 54 3HG1 VAL 54 -1.818 -4.251 -0.840
474 HG21 VAL 54 1HG2 VAL 54 -3.936 -2.914 0.853
475 HG22 VAL 54 2HG2 VAL 54 -3.246 -4.516 1.125
476 HG23 VAL 54 3HG2 VAL 54 -4.995 -4.310 0.997
477 H GLN 55 H GLN 55 -5.804 -5.383 -2.926
478 HA GLN 55 HA GLN 55 -4.309 -4.882 -5.218
479 HB2 GLN 55 2HB GLN 55 -6.783 -6.573 -4.996
480 HB3 GLN 55 1HB GLN 55 -5.543 -6.681 -6.249
481 HG2 GLN 55 2HG GLN 55 -3.898 -7.040 -4.359
482 HG3 GLN 55 1HG GLN 55 -5.300 -7.304 -3.340
483 HE21 GLN 55 1HE2 GLN 55 -3.215 -9.013 -3.937
484 HE22 GLN 55 2HE2 GLN 55 -3.811 -10.401 -4.727
485 H LYS 56 H LYS 56 -7.666 -4.231 -4.380
486 HA LYS 56 HA LYS 56 -8.522 -3.085 -6.819
487 HB2 LYS 56 2HB LYS 56 -9.438 -2.500 -4.002
488 HB3 LYS 56 1HB LYS 56 -10.273 -1.983 -5.456
489 HG2 LYS 56 2HG LYS 56 -10.713 -4.280 -6.064
490 HG3 LYS 56 1HG LYS 56 -9.780 -4.849 -4.677
491 HD2 LYS 56 2HD LYS 56 -11.342 -3.731 -3.174
492 HD3 LYS 56 1HD LYS 56 -12.271 -3.170 -4.566
493 HE2 LYS 56 2HE LYS 56 -12.774 -5.467 -5.178
494 HE3 LYS 56 1HE LYS 56 -11.784 -6.058 -3.852
495 HZ1 LYS 56 1HZ LYS 56 -14.122 -6.102 -3.277
496 HZ2 LYS 56 2HZ LYS 56 -14.252 -4.440 -3.550
497 HZ3 LYS 56 3HZ LYS 56 -13.292 -5.027 -2.293
498 H ALA 57 H ALA 57 -7.076 -1.690 -3.906
499 HA ALA 57 HA ALA 57 -7.169 1.009 -4.676
500 HB1 ALA 57 1HB ALA 57 -5.506 1.385 -2.924
501 HB2 ALA 57 2HB ALA 57 -5.217 -0.334 -2.791
502 HB3 ALA 57 3HB ALA 57 -6.798 0.324 -2.348
503 H MET 58 H MET 58 -4.605 -1.435 -4.981
504 HA MET 58 HA MET 58 -2.765 0.275 -6.020
505 HB2 MET 58 2HB MET 58 -2.956 -2.699 -6.360
506 HB3 MET 58 1HB MET 58 -1.612 -1.757 -6.992
507 HG2 MET 58 2HG MET 58 -1.224 -0.933 -4.663
508 HG3 MET 58 1HG MET 58 -2.421 -2.105 -4.121
509 HE1 MET 58 1HE MET 58 -0.659 -5.480 -5.061
510 HE2 MET 58 2HE MET 58 -1.842 -4.615 -6.049
511 HE3 MET 58 3HE MET 58 -2.087 -4.765 -4.300
512 H LYS 59 H LYS 59 -5.157 -1.681 -7.726
513 HA LYS 59 HA LYS 59 -4.268 -1.092 -10.296
514 HB2 LYS 59 2HB LYS 59 -7.064 -1.739 -9.330
515 HB3 LYS 59 1HB LYS 59 -6.527 -1.797 -11.010
516 HG2 LYS 59 2HG LYS 59 -4.943 -3.529 -10.491
517 HG3 LYS 59 1HG LYS 59 -5.342 -3.423 -8.783
518 HD2 LYS 59 2HD LYS 59 -7.650 -4.151 -9.348
519 HD3 LYS 59 1HD LYS 59 -7.122 -4.392 -11.022
520 HE2 LYS 59 2HE LYS 59 -5.387 -5.954 -10.229
521 HE3 LYS 59 1HE LYS 59 -5.949 -5.710 -8.586
522 HZ1 LYS 59 1HZ LYS 59 -8.081 -6.696 -9.225
523 HZ2 LYS 59 2HZ LYS 59 -6.787 -7.733 -9.468
524 HZ3 LYS 59 3HZ LYS 59 -7.486 -6.983 -10.787
525 H HIS 60 H HIS 60 -6.324 0.698 -8.060
526 HA HIS 60 HA HIS 60 -7.033 2.633 -10.011
527 HB2 HIS 60 2HB HIS 60 -8.529 2.349 -8.153
528 HB3 HIS 60 1HB HIS 60 -7.229 2.612 -6.999
529 HD1 HIS 60 1HD HIS 60 -9.241 4.552 -9.582
530 HD2 HIS 60 2HD HIS 60 -6.963 5.106 -6.181
531 HE1 HIS 60 1HE HIS 60 -9.446 7.005 -9.055
532 HE2 HIS 60 2HE HIS 60 -7.827 7.370 -7.172
533 H LEU 61 H LEU 61 -4.717 2.582 -7.347
534 HA LEU 61 HA LEU 61 -3.759 5.218 -7.747
535 HB2 LEU 61 2HB LEU 61 -2.529 2.880 -6.321
536 HB3 LEU 61 1HB LEU 61 -1.937 4.526 -6.222
537 HG LEU 61 HG LEU 61 -4.681 3.652 -5.329
538 HD11 LEU 61 1HD1 LEU 61 -2.183 4.178 -3.727
539 HD12 LEU 61 2HD1 LEU 61 -2.989 2.623 -3.946
540 HD13 LEU 61 3HD1 LEU 61 -3.801 3.917 -3.070
541 HD21 LEU 61 1HD2 LEU 61 -3.145 6.218 -4.941
542 HD22 LEU 61 2HD2 LEU 61 -4.707 5.839 -4.217
543 HD23 LEU 61 3HD2 LEU 61 -4.567 5.999 -5.967
544 H ASP 62 H ASP 62 -2.926 2.223 -9.214
545 HA ASP 62 HA ASP 62 -0.384 3.006 -10.253
546 HB2 ASP 62 2HB ASP 62 -0.986 0.642 -10.008
547 HB3 ASP 62 1HB ASP 62 -2.336 0.858 -11.104
548 H LYS 63 H LYS 63 -3.612 3.689 -11.070
549 HA LYS 63 HA LYS 63 -2.896 4.519 -13.748
550 HB2 LYS 63 2HB LYS 63 -5.625 4.124 -12.522
551 HB3 LYS 63 1HB LYS 63 -5.300 4.481 -14.214
552 HG2 LYS 63 2HG LYS 63 -4.163 2.366 -14.478
553 HG3 LYS 63 1HG LYS 63 -4.369 2.018 -12.765
554 HD2 LYS 63 2HD LYS 63 -6.847 2.122 -13.129
555 HD3 LYS 63 1HD LYS 63 -6.527 2.245 -14.863
556 HE2 LYS 63 2HE LYS 63 -5.312 0.099 -14.773
557 HE3 LYS 63 1HE LYS 63 -5.653 0.005 -13.047
558 HZ1 LYS 63 1HZ LYS 63 -7.189 -1.327 -14.343
559 HZ2 LYS 63 2HZ LYS 63 -7.726 0.019 -15.179
560 HZ3 LYS 63 3HZ LYS 63 -8.008 -0.099 -13.538
561 H LYS 64 H LYS 64 -4.823 5.556 -10.918
562 HA LYS 64 HA LYS 64 -4.255 8.355 -11.532
563 HB2 LYS 64 2HB LYS 64 -6.581 7.537 -12.269
564 HB3 LYS 64 1HB LYS 64 -6.926 7.264 -10.579
565 HG2 LYS 64 2HG LYS 64 -6.306 9.950 -11.832
566 HG3 LYS 64 1HG LYS 64 -7.912 9.355 -11.455
567 HD2 LYS 64 2HD LYS 64 -7.288 9.316 -9.058
568 HD3 LYS 64 1HD LYS 64 -5.706 9.964 -9.481
569 HE2 LYS 64 2HE LYS 64 -8.365 11.322 -9.957
570 HE3 LYS 64 1HE LYS 64 -7.199 11.733 -8.704
571 HZ1 LYS 64 1HZ LYS 64 -5.613 12.321 -10.453
572 HZ2 LYS 64 2HZ LYS 64 -7.001 13.239 -10.554
573 HZ3 LYS 64 3HZ LYS 64 -6.762 11.981 -11.643
Start of MODEL 15
1 H1 ALA 1 1HT ALA 1 12.645 9.104 8.170
2 H2 ALA 1 2HT ALA 1 11.923 9.120 9.700
3 H3 ALA 1 3HT ALA 1 11.146 9.824 8.367
4 HA ALA 1 HA ALA 1 11.749 6.959 8.583
5 HB1 ALA 1 1HB ALA 1 10.036 7.614 10.193
6 HB2 ALA 1 2HB ALA 1 9.344 6.659 8.883
7 HB3 ALA 1 3HB ALA 1 9.125 8.411 8.909
8 H ARG 2 H ARG 2 11.422 5.879 6.749
9 HA ARG 2 HA ARG 2 10.305 7.353 4.436
10 HB2 ARG 2 2HB ARG 2 12.554 5.334 4.443
11 HB3 ARG 2 1HB ARG 2 11.823 6.012 3.003
12 HG2 ARG 2 2HG ARG 2 12.634 8.208 3.577
13 HG3 ARG 2 1HG ARG 2 13.245 7.604 5.116
14 HD2 ARG 2 2HD ARG 2 14.166 6.693 2.395
15 HD3 ARG 2 1HD ARG 2 15.029 7.818 3.442
16 HE ARG 2 HE ARG 2 14.511 5.473 4.879
17 HH11 ARG 2 1HH1 ARG 2 16.521 6.526 2.159
18 HH12 ARG 2 2HH1 ARG 2 17.768 5.428 2.481
19 HH21 ARG 2 1HH2 ARG 2 16.220 3.932 5.297
20 HH22 ARG 2 2HH2 ARG 2 17.583 3.901 4.303
21 H LYS 3 H LYS 3 10.925 4.225 5.907
22 HA LYS 3 HA LYS 3 10.033 2.236 5.791
23 HB2 LYS 3 2HB LYS 3 7.462 3.750 5.366
24 HB3 LYS 3 1HB LYS 3 7.565 2.044 5.767
25 HG2 LYS 3 2HG LYS 3 8.667 2.616 7.880
26 HG3 LYS 3 1HG LYS 3 8.533 4.329 7.470
27 HD2 LYS 3 2HD LYS 3 6.105 4.094 7.372
28 HD3 LYS 3 1HD LYS 3 6.250 2.399 7.835
29 HE2 LYS 3 2HE LYS 3 7.296 3.075 9.940
30 HE3 LYS 3 1HE LYS 3 7.143 4.767 9.470
31 HZ1 LYS 3 1HZ LYS 3 4.732 4.497 9.437
32 HZ2 LYS 3 2HZ LYS 3 5.361 4.103 10.947
33 HZ3 LYS 3 3HZ LYS 3 4.884 2.886 9.895
34 H SER 4 H SER 4 11.297 1.962 3.930
35 HA SER 4 HA SER 4 9.728 1.597 1.511
36 HB2 SER 4 2HB SER 4 12.704 1.299 1.996
37 HB3 SER 4 1HB SER 4 11.891 1.307 0.425
38 HG SER 4 HG SER 4 11.043 3.410 1.551
39 H CYS 5 H CYS 5 10.780 0.021 4.274
40 HA CYS 5 HA CYS 5 9.944 -2.528 3.183
41 HB2 CYS 5 2HB CYS 5 12.336 -2.150 5.007
42 HB3 CYS 5 1HB CYS 5 11.638 -3.690 4.536
43 H CYS 6 H CYS 6 8.440 -3.365 4.389
44 HA CYS 6 HA CYS 6 7.999 -2.438 7.127
45 HB2 CYS 6 2HB CYS 6 6.243 -3.458 4.964
46 HB3 CYS 6 1HB CYS 6 5.653 -3.176 6.609
47 H LEU 7 H LEU 7 7.488 -4.026 8.617
48 HA LEU 7 HA LEU 7 8.212 -6.776 7.861
49 HB2 LEU 7 2HB LEU 7 8.110 -5.460 10.573
50 HB3 LEU 7 1HB LEU 7 8.556 -7.126 10.282
51 HG LEU 7 HG LEU 7 10.098 -4.715 9.312
52 HD11 LEU 7 1HD1 LEU 7 11.757 -5.383 10.973
53 HD12 LEU 7 2HD1 LEU 7 10.684 -6.667 11.532
54 HD13 LEU 7 3HD1 LEU 7 10.218 -4.975 11.728
55 HD21 LEU 7 1HD2 LEU 7 10.346 -6.624 7.810
56 HD22 LEU 7 2HD2 LEU 7 10.739 -7.667 9.178
57 HD23 LEU 7 3HD2 LEU 7 11.828 -6.359 8.717
58 H LYS 8 H LYS 8 5.631 -4.763 8.890
59 HA LYS 8 HA LYS 8 3.941 -7.105 9.258
60 HB2 LYS 8 2HB LYS 8 2.671 -5.830 10.859
61 HB3 LYS 8 1HB LYS 8 4.332 -5.998 11.424
62 HG2 LYS 8 2HG LYS 8 4.790 -3.693 10.664
63 HG3 LYS 8 1HG LYS 8 3.118 -3.546 10.131
64 HD2 LYS 8 2HD LYS 8 4.034 -4.022 12.973
65 HD3 LYS 8 1HD LYS 8 3.484 -2.480 12.314
66 HE2 LYS 8 2HE LYS 8 1.824 -5.001 12.529
67 HE3 LYS 8 1HE LYS 8 1.748 -3.633 13.626
68 HZ1 LYS 8 1HZ LYS 8 -0.009 -3.648 11.946
69 HZ2 LYS 8 2HZ LYS 8 1.118 -3.471 10.714
70 HZ3 LYS 8 3HZ LYS 8 0.917 -2.247 11.856
71 H TYR 9 H TYR 9 1.707 -6.589 8.761
72 HA TYR 9 HA TYR 9 1.377 -4.410 6.815
73 HB2 TYR 9 2HB TYR 9 -0.489 -6.851 6.992
74 HB3 TYR 9 1HB TYR 9 -0.285 -5.673 5.756
75 HD1 TYR 9 1HD TYR 9 1.199 -5.939 4.022
76 HD2 TYR 9 2HD TYR 9 1.336 -8.592 7.293
77 HE1 TYR 9 1HE TYR 9 2.669 -7.442 2.736
78 HE2 TYR 9 2HE TYR 9 2.796 -10.111 6.022
79 HH TYR 9 HH TYR 9 4.209 -9.153 3.042
80 H THR 10 H THR 10 -0.676 -3.268 7.073
81 HA THR 10 HA THR 10 -1.462 -2.950 9.736
82 HB THR 10 HB THR 10 -1.626 -1.038 8.297
83 HG1 THR 10 1HG THR 10 -4.272 -1.119 8.359
84 HG21 THR 10 1HG2 THR 10 -3.208 -0.924 6.404
85 HG22 THR 10 2HG2 THR 10 -3.569 -2.640 6.616
86 HG23 THR 10 3HG2 THR 10 -1.938 -2.112 6.156
87 H LYS 11 H LYS 11 -3.213 -3.680 10.816
88 HA LYS 11 HA LYS 11 -4.573 -5.959 9.650
89 HB2 LYS 11 2HB LYS 11 -5.398 -6.425 11.876
90 HB3 LYS 11 1HB LYS 11 -3.670 -6.118 11.923
91 HG2 LYS 11 2HG LYS 11 -4.167 -3.800 12.720
92 HG3 LYS 11 1HG LYS 11 -5.869 -4.236 12.771
93 HD2 LYS 11 2HD LYS 11 -4.944 -4.459 14.987
94 HD3 LYS 11 1HD LYS 11 -5.318 -6.065 14.359
95 HE2 LYS 11 2HE LYS 11 -2.942 -6.344 13.729
96 HE3 LYS 11 1HE LYS 11 -2.595 -4.757 14.413
97 HZ1 LYS 11 1HZ LYS 11 -2.021 -6.489 15.927
98 HZ2 LYS 11 2HZ LYS 11 -3.551 -7.156 15.832
99 HZ3 LYS 11 3HZ LYS 11 -3.347 -5.650 16.582
100 H ARG 12 H ARG 12 -5.079 -2.717 9.694
101 HA ARG 12 HA ARG 12 -7.967 -3.103 9.441
102 HB2 ARG 12 2HB ARG 12 -8.322 -0.784 10.167
103 HB3 ARG 12 1HB ARG 12 -7.496 -1.725 11.400
104 HG2 ARG 12 2HG ARG 12 -5.382 -0.664 10.828
105 HG3 ARG 12 1HG ARG 12 -6.165 0.194 9.498
106 HD2 ARG 12 2HD ARG 12 -6.855 0.509 12.420
107 HD3 ARG 12 1HD ARG 12 -5.869 1.630 11.475
108 HE ARG 12 HE ARG 12 -8.511 1.068 10.444
109 HH11 ARG 12 1HH1 ARG 12 -6.559 3.262 12.414
110 HH12 ARG 12 2HH1 ARG 12 -7.642 4.565 12.280
111 HH21 ARG 12 1HH2 ARG 12 -9.992 2.854 10.280
112 HH22 ARG 12 2HH2 ARG 12 -9.637 4.336 11.048
113 HA PRO 13 HA PRO 13 -7.298 -1.774 5.215
114 HB2 PRO 13 2HB PRO 13 -10.180 -1.090 5.321
115 HB3 PRO 13 1HB PRO 13 -9.325 -2.168 4.209
116 HG2 PRO 13 2HG PRO 13 -10.903 -3.153 6.107
117 HG3 PRO 13 1HG PRO 13 -9.371 -3.946 5.697
118 HD2 PRO 13 2HD PRO 13 -10.013 -2.154 8.003
119 HD3 PRO 13 1HD PRO 13 -9.069 -3.667 7.956
120 H LEU 14 H LEU 14 -7.089 0.123 4.151
121 HA LEU 14 HA LEU 14 -7.466 2.615 5.666
122 HB2 LEU 14 2HB LEU 14 -5.228 1.569 4.622
123 HB3 LEU 14 1HB LEU 14 -5.879 2.223 3.161
124 HG LEU 14 HG LEU 14 -4.916 3.704 5.576
125 HD11 LEU 14 1HD1 LEU 14 -4.030 3.629 2.733
126 HD12 LEU 14 2HD1 LEU 14 -3.213 2.916 4.126
127 HD13 LEU 14 3HD1 LEU 14 -3.366 4.667 3.992
128 HD21 LEU 14 1HD2 LEU 14 -6.853 4.921 4.801
129 HD22 LEU 14 2HD2 LEU 14 -6.224 4.901 3.131
130 HD23 LEU 14 3HD2 LEU 14 -5.330 5.732 4.409
131 HA PRO 15 HA PRO 15 -10.699 3.098 2.389
132 HB2 PRO 15 2HB PRO 15 -10.526 5.972 3.130
133 HB3 PRO 15 1HB PRO 15 -11.948 4.928 3.051
134 HG2 PRO 15 2HG PRO 15 -10.973 5.650 5.400
135 HG3 PRO 15 1HG PRO 15 -11.532 3.988 5.144
136 HD2 PRO 15 2HD PRO 15 -8.751 5.070 5.160
137 HD3 PRO 15 1HD PRO 15 -9.370 3.579 5.910
138 H LEU 16 H LEU 16 -10.420 3.442 0.288
139 HA LEU 16 HA LEU 16 -7.923 4.231 -0.733
140 HB2 LEU 16 2HB LEU 16 -9.093 2.583 -1.883
141 HB3 LEU 16 1HB LEU 16 -10.519 3.639 -2.090
142 HG LEU 16 HG LEU 16 -9.042 4.967 -3.594
143 HD11 LEU 16 1HD1 LEU 16 -7.026 3.824 -4.449
144 HD12 LEU 16 2HD1 LEU 16 -7.213 2.603 -3.198
145 HD13 LEU 16 3HD1 LEU 16 -6.874 4.276 -2.755
146 HD21 LEU 16 1HD2 LEU 16 -9.539 2.086 -4.190
147 HD22 LEU 16 2HD2 LEU 16 -9.242 3.363 -5.395
148 HD23 LEU 16 3HD2 LEU 16 -10.666 3.451 -4.337
149 H LYS 17 H LYS 17 -10.886 5.893 -0.427
150 HA LYS 17 HA LYS 17 -10.379 8.049 -2.150
151 HB2 LYS 17 2HB LYS 17 -12.107 7.943 0.315
152 HB3 LYS 17 1HB LYS 17 -12.146 9.229 -0.882
153 HG2 LYS 17 2HG LYS 17 -12.847 7.632 -2.590
154 HG3 LYS 17 1HG LYS 17 -12.794 6.334 -1.399
155 HD2 LYS 17 2HD LYS 17 -14.530 7.472 -0.096
156 HD3 LYS 17 1HD LYS 17 -14.579 8.765 -1.294
157 HE2 LYS 17 2HE LYS 17 -15.262 7.160 -3.011
158 HE3 LYS 17 1HE LYS 17 -15.197 5.860 -1.822
159 HZ1 LYS 17 1HZ LYS 17 -17.455 6.655 -2.172
160 HZ2 LYS 17 2HZ LYS 17 -17.017 8.207 -1.701
161 HZ3 LYS 17 3HZ LYS 17 -16.961 6.948 -0.592
162 H ARG 18 H ARG 18 -8.800 7.214 0.591
163 HA ARG 18 HA ARG 18 -7.976 10.025 1.144
164 HB2 ARG 18 2HB ARG 18 -7.944 7.821 3.209
165 HB3 ARG 18 1HB ARG 18 -7.676 9.535 3.479
166 HG2 ARG 18 2HG ARG 18 -10.057 9.908 2.699
167 HG3 ARG 18 1HG ARG 18 -10.256 8.162 2.773
168 HD2 ARG 18 2HD ARG 18 -11.078 9.015 4.817
169 HD3 ARG 18 1HD ARG 18 -9.500 8.312 5.184
170 HE ARG 18 HE ARG 18 -9.203 11.026 4.544
171 HH11 ARG 18 1HH1 ARG 18 -10.328 8.987 7.196
172 HH12 ARG 18 2HH1 ARG 18 -10.162 10.206 8.381
173 HH21 ARG 18 1HH2 ARG 18 -9.077 12.691 6.127
174 HH22 ARG 18 2HH2 ARG 18 -9.467 12.371 7.756
175 H ILE 19 H ILE 19 -6.870 7.621 -0.480
176 HA ILE 19 HA ILE 19 -4.152 7.561 0.657
177 HB ILE 19 HB ILE 19 -5.328 5.738 -1.484
178 HG12 ILE 19 2HG1 ILE 19 -4.783 5.065 1.397
179 HG13 ILE 19 1HG1 ILE 19 -6.397 5.462 0.836
180 HG21 ILE 19 1HG2 ILE 19 -2.775 5.548 0.146
181 HG22 ILE 19 2HG2 ILE 19 -2.874 5.907 -1.574
182 HG23 ILE 19 3HG2 ILE 19 -3.340 4.317 -0.953
183 HD11 ILE 19 1HD1 ILE 19 -6.251 3.525 -0.734
184 HD12 ILE 19 2HD1 ILE 19 -6.104 3.059 0.963
185 HD13 ILE 19 3HD1 ILE 19 -4.690 3.185 -0.104
186 H LYS 20 H LYS 20 -2.475 8.381 -0.548
187 HA LYS 20 HA LYS 20 -3.175 9.840 -2.952
188 HB2 LYS 20 2HB LYS 20 -0.619 9.889 -1.335
189 HB3 LYS 20 1HB LYS 20 -0.965 10.916 -2.702
190 HG2 LYS 20 2HG LYS 20 -2.348 10.890 -0.091
191 HG3 LYS 20 1HG LYS 20 -1.289 12.145 -0.744
192 HD2 LYS 20 2HD LYS 20 -3.962 11.262 -1.686
193 HD3 LYS 20 1HD LYS 20 -3.585 12.801 -0.936
194 HE2 LYS 20 2HE LYS 20 -2.556 11.936 -3.670
195 HE3 LYS 20 1HE LYS 20 -3.821 13.119 -3.388
196 HZ1 LYS 20 1HZ LYS 20 -2.166 14.511 -2.234
197 HZ2 LYS 20 2HZ LYS 20 -1.774 14.215 -3.830
198 HZ3 LYS 20 3HZ LYS 20 -0.955 13.388 -2.606
199 H SER 21 H SER 21 -0.922 7.267 -1.882
200 HA SER 21 HA SER 21 -0.652 6.152 -4.446
201 HB2 SER 21 2HB SER 21 1.762 6.696 -4.784
202 HB3 SER 21 1HB SER 21 0.712 8.109 -4.923
203 HG SER 21 HG SER 21 2.321 8.760 -3.679
204 H TYR 22 H TYR 22 1.247 4.493 -4.369
205 HA TYR 22 HA TYR 22 1.834 3.686 -1.615
206 HB2 TYR 22 2HB TYR 22 1.434 1.372 -2.150
207 HB3 TYR 22 1HB TYR 22 -0.035 2.297 -2.388
208 HD1 TYR 22 1HD TYR 22 -1.161 2.144 -4.382
209 HD2 TYR 22 2HD TYR 22 2.827 0.766 -4.252
210 HE1 TYR 22 1HE TYR 22 -1.415 1.182 -6.617
211 HE2 TYR 22 2HE TYR 22 2.581 -0.189 -6.503
212 HH TYR 22 HH TYR 22 -0.147 0.533 -8.451
213 H THR 23 H THR 23 3.514 2.118 -1.532
214 HA THR 23 HA THR 23 5.514 2.480 -3.650
215 HB THR 23 HB THR 23 5.926 2.048 -0.689
216 HG1 THR 23 1HG THR 23 5.219 4.180 -1.899
217 HG21 THR 23 1HG2 THR 23 7.679 1.099 -2.100
218 HG22 THR 23 2HG2 THR 23 8.298 2.481 -1.180
219 HG23 THR 23 3HG2 THR 23 7.902 2.649 -2.901
220 H ILE 24 H ILE 24 6.269 0.572 -4.528
221 HA ILE 24 HA ILE 24 5.091 -1.871 -3.536
222 HB ILE 24 HB ILE 24 6.840 -1.417 -5.974
223 HG12 ILE 24 2HG1 ILE 24 3.860 -1.849 -5.713
224 HG13 ILE 24 1HG1 ILE 24 4.648 -0.317 -6.075
225 HG21 ILE 24 1HG2 ILE 24 5.279 -3.864 -5.119
226 HG22 ILE 24 2HG2 ILE 24 7.037 -3.716 -5.159
227 HG23 ILE 24 3HG2 ILE 24 6.111 -3.667 -6.662
228 HD11 ILE 24 1HD1 ILE 24 4.702 -2.781 -7.798
229 HD12 ILE 24 2HD1 ILE 24 5.475 -1.241 -8.170
230 HD13 ILE 24 3HD1 ILE 24 3.713 -1.345 -8.074
231 H GLN 25 H GLN 25 6.051 -2.760 -1.885
232 HA GLN 25 HA GLN 25 8.938 -2.800 -1.681
233 HB2 GLN 25 2HB GLN 25 7.856 -2.333 0.341
234 HB3 GLN 25 1HB GLN 25 6.699 -3.627 0.185
235 HG2 GLN 25 2HG GLN 25 8.534 -5.228 0.446
236 HG3 GLN 25 1HG GLN 25 9.632 -3.871 0.704
237 HE21 GLN 25 1HE2 GLN 25 8.787 -6.054 2.461
238 HE22 GLN 25 2HE2 GLN 25 8.248 -5.312 3.903
239 H SER 26 H SER 26 10.009 -4.374 -2.619
240 HA SER 26 HA SER 26 8.619 -6.879 -3.120
241 HB2 SER 26 2HB SER 26 9.658 -5.764 -5.070
242 HB3 SER 26 1HB SER 26 11.222 -5.843 -4.258
243 HG SER 26 HG SER 26 10.293 -7.591 -5.830
244 H ASN 27 H ASN 27 9.567 -8.819 -2.523
245 HA ASN 27 HA ASN 27 11.014 -8.646 -0.052
246 HB2 ASN 27 2HB ASN 27 10.741 -11.108 0.095
247 HB3 ASN 27 1HB ASN 27 9.222 -10.279 -0.193
248 HD21 ASN 27 1HD2 ASN 27 8.169 -10.563 -2.155
249 HD22 ASN 27 2HD2 ASN 27 8.620 -11.790 -3.262
250 H GLU 28 H GLU 28 12.000 -8.536 -3.123
251 HA GLU 28 HA GLU 28 14.416 -10.015 -2.988
252 HB2 GLU 28 2HB GLU 28 13.602 -7.665 -4.700
253 HB3 GLU 28 1HB GLU 28 15.094 -8.571 -4.906
254 HG2 GLU 28 2HG GLU 28 12.325 -9.719 -5.129
255 HG3 GLU 28 1HG GLU 28 13.353 -9.254 -6.483
256 H ALA 29 H ALA 29 13.454 -6.764 -2.063
257 HA ALA 29 HA ALA 29 16.209 -6.197 -1.179
258 HB1 ALA 29 1HB ALA 29 15.588 -3.833 -1.213
259 HB2 ALA 29 2HB ALA 29 13.951 -4.270 -1.701
260 HB3 ALA 29 3HB ALA 29 15.306 -4.593 -2.781
261 H CYS 30 H CYS 30 12.920 -6.517 -0.137
262 HA CYS 30 HA CYS 30 13.684 -5.845 2.630
263 HB2 CYS 30 2HB CYS 30 10.951 -5.921 1.355
264 HB3 CYS 30 1HB CYS 30 11.350 -5.365 2.977
265 H ASN 31 H ASN 31 12.355 -7.210 4.229
266 HA ASN 31 HA ASN 31 12.994 -9.920 3.678
267 HB2 ASN 31 2HB ASN 31 13.041 -8.925 5.981
268 HB3 ASN 31 1HB ASN 31 11.286 -8.845 5.947
269 HD21 ASN 31 1HD2 ASN 31 10.092 -10.736 6.336
270 HD22 ASN 31 2HD2 ASN 31 10.820 -12.209 6.797
271 H ILE 32 H ILE 32 9.960 -8.137 3.737
272 HA ILE 32 HA ILE 32 8.666 -10.457 2.433
273 HB ILE 32 HB ILE 32 6.535 -9.853 3.476
274 HG12 ILE 32 2HG1 ILE 32 8.095 -7.719 4.958
275 HG13 ILE 32 1HG1 ILE 32 6.939 -7.417 3.667
276 HG21 ILE 32 1HG2 ILE 32 8.764 -10.035 5.439
277 HG22 ILE 32 2HG2 ILE 32 7.993 -11.415 4.654
278 HG23 ILE 32 3HG2 ILE 32 7.071 -10.410 5.798
279 HD11 ILE 32 1HD1 ILE 32 6.330 -8.641 6.347
280 HD12 ILE 32 2HD1 ILE 32 5.157 -8.344 5.064
281 HD13 ILE 32 3HD1 ILE 32 5.972 -6.988 5.849
282 H LYS 33 H LYS 33 6.534 -9.643 1.363
283 HA LYS 33 HA LYS 33 7.091 -7.172 -0.091
284 HB2 LYS 33 2HB LYS 33 6.786 -9.171 -1.508
285 HB3 LYS 33 1HB LYS 33 5.244 -9.495 -0.734
286 HG2 LYS 33 2HG LYS 33 4.322 -7.440 -1.667
287 HG3 LYS 33 1HG LYS 33 5.879 -7.064 -2.395
288 HD2 LYS 33 2HD LYS 33 5.740 -9.061 -3.781
289 HD3 LYS 33 1HD LYS 33 4.204 -9.495 -3.032
290 HE2 LYS 33 2HE LYS 33 3.194 -7.442 -3.899
291 HE3 LYS 33 1HE LYS 33 4.733 -6.985 -4.627
292 HZ1 LYS 33 1HZ LYS 33 3.127 -9.385 -5.338
293 HZ2 LYS 33 2HZ LYS 33 4.604 -8.943 -6.027
294 HZ3 LYS 33 3HZ LYS 33 3.260 -7.966 -6.252
295 H ALA 34 H ALA 34 6.076 -5.475 0.782
296 HA ALA 34 HA ALA 34 3.303 -5.744 1.633
297 HB1 ALA 34 1HB ALA 34 4.645 -5.931 3.708
298 HB2 ALA 34 2HB ALA 34 3.765 -4.415 3.678
299 HB3 ALA 34 3HB ALA 34 5.482 -4.439 3.300
300 H ILE 35 H ILE 35 2.283 -4.354 0.321
301 HA ILE 35 HA ILE 35 3.619 -2.187 -0.946
302 HB ILE 35 HB ILE 35 0.653 -2.745 -0.659
303 HG12 ILE 35 2HG1 ILE 35 1.910 -4.557 -1.706
304 HG13 ILE 35 1HG1 ILE 35 0.816 -3.787 -2.861
305 HG21 ILE 35 1HG2 ILE 35 0.386 -1.283 -2.669
306 HG22 ILE 35 2HG2 ILE 35 2.092 -0.909 -2.591
307 HG23 ILE 35 3HG2 ILE 35 1.030 -0.418 -1.281
308 HD11 ILE 35 1HD1 ILE 35 2.870 -4.313 -3.911
309 HD12 ILE 35 2HD1 ILE 35 3.812 -3.479 -2.658
310 HD13 ILE 35 3HD1 ILE 35 2.772 -2.563 -3.762
311 H ILE 36 H ILE 36 3.981 -0.172 -0.177
312 HA ILE 36 HA ILE 36 2.829 0.426 2.434
313 HB ILE 36 HB ILE 36 5.005 2.008 1.014
314 HG12 ILE 36 2HG1 ILE 36 6.523 0.989 2.852
315 HG13 ILE 36 1HG1 ILE 36 5.270 -0.232 3.011
316 HG21 ILE 36 1HG2 ILE 36 3.826 3.311 2.633
317 HG22 ILE 36 2HG2 ILE 36 5.471 2.939 3.168
318 HG23 ILE 36 3HG2 ILE 36 4.102 2.055 3.860
319 HD11 ILE 36 1HD1 ILE 36 5.598 -0.838 0.698
320 HD12 ILE 36 2HD1 ILE 36 7.106 -0.934 1.640
321 HD13 ILE 36 3HD1 ILE 36 6.810 0.441 0.559
322 H PHE 37 H PHE 37 1.036 1.461 2.366
323 HA PHE 37 HA PHE 37 0.206 3.127 0.188
324 HB2 PHE 37 2HB PHE 37 -0.953 2.132 2.750
325 HB3 PHE 37 1HB PHE 37 -1.751 3.423 1.854
326 HD1 PHE 37 1HD PHE 37 -0.029 0.426 0.551
327 HD2 PHE 37 2HD PHE 37 -3.648 2.425 1.186
328 HE1 PHE 37 1HE PHE 37 -1.231 -1.270 -0.876
329 HE2 PHE 37 2HE PHE 37 -4.847 0.784 -0.202
330 HZ PHE 37 HZ PHE 37 -3.635 -1.047 -1.223
331 H THR 38 H THR 38 0.004 5.273 0.273
332 HA THR 38 HA THR 38 0.822 6.552 2.769
333 HB THR 38 HB THR 38 1.376 7.604 -0.025
334 HG1 THR 38 1HG THR 38 2.592 5.765 1.499
335 HG21 THR 38 1HG2 THR 38 1.136 9.277 1.732
336 HG22 THR 38 2HG2 THR 38 2.824 9.181 1.200
337 HG23 THR 38 3HG2 THR 38 2.314 8.428 2.719
338 H THR 39 H THR 39 -0.551 8.150 3.498
339 HA THR 39 HA THR 39 -3.060 8.340 2.057
340 HB THR 39 HB THR 39 -3.793 9.561 4.131
341 HG1 THR 39 1HG THR 39 -2.369 8.886 5.964
342 HG21 THR 39 1HG2 THR 39 -4.335 7.257 3.699
343 HG22 THR 39 2HG2 THR 39 -4.035 7.480 5.424
344 HG23 THR 39 3HG2 THR 39 -2.802 6.736 4.396
345 H LYS 40 H LYS 40 -4.149 10.560 2.384
346 HA LYS 40 HA LYS 40 -2.575 12.502 1.066
347 HB2 LYS 40 2HB LYS 40 -5.042 13.010 2.665
348 HB3 LYS 40 1HB LYS 40 -4.491 13.959 1.284
349 HG2 LYS 40 2HG LYS 40 -4.897 11.579 -0.010
350 HG3 LYS 40 1HG LYS 40 -5.872 11.337 1.386
351 HD2 LYS 40 2HD LYS 40 -7.265 13.217 0.949
352 HD3 LYS 40 1HD LYS 40 -6.175 13.723 -0.352
353 HE2 LYS 40 2HE LYS 40 -6.673 11.770 -1.634
354 HE3 LYS 40 1HE LYS 40 -7.691 11.122 -0.366
355 HZ1 LYS 40 1HZ LYS 40 -9.170 13.047 -0.678
356 HZ2 LYS 40 2HZ LYS 40 -9.020 12.108 -2.066
357 HZ3 LYS 40 3HZ LYS 40 -8.205 13.577 -1.951
358 H LYS 41 H LYS 41 -2.871 11.599 4.318
359 HA LYS 41 HA LYS 41 -1.833 14.040 5.442
360 HB2 LYS 41 2HB LYS 41 -2.090 11.242 6.593
361 HB3 LYS 41 1HB LYS 41 -1.391 12.573 7.483
362 HG2 LYS 41 2HG LYS 41 -3.647 12.223 8.217
363 HG3 LYS 41 1HG LYS 41 -3.569 13.748 7.353
364 HD2 LYS 41 2HD LYS 41 -4.516 12.659 5.367
365 HD3 LYS 41 1HD LYS 41 -4.586 11.128 6.245
366 HE2 LYS 41 2HE LYS 41 -6.764 12.239 6.249
367 HE3 LYS 41 1HE LYS 41 -6.105 12.120 7.873
368 HZ1 LYS 41 1HZ LYS 41 -6.043 14.550 6.160
369 HZ2 LYS 41 2HZ LYS 41 -5.401 14.456 7.708
370 HZ3 LYS 41 3HZ LYS 41 -7.041 14.302 7.476
371 H GLY 42 H GLY 42 -0.685 11.531 3.609
372 HA2 GLY 42 2HA GLY 42 1.388 11.176 2.777
373 HA3 GLY 42 1HA GLY 42 1.990 12.442 3.821
374 H ARG 43 H ARG 43 0.206 10.040 5.366
375 HA ARG 43 HA ARG 43 2.534 9.093 6.791
376 HB2 ARG 43 2HB ARG 43 -0.344 8.319 6.976
377 HB3 ARG 43 1HB ARG 43 0.904 7.776 8.099
378 HG2 ARG 43 2HG ARG 43 1.307 10.153 8.702
379 HG3 ARG 43 1HG ARG 43 -0.042 10.606 7.665
380 HD2 ARG 43 2HD ARG 43 -1.532 9.206 9.072
381 HD3 ARG 43 1HD ARG 43 -0.163 8.863 10.123
382 HE ARG 43 HE ARG 43 -0.505 11.643 9.785
383 HH11 ARG 43 1HH1 ARG 43 -1.750 8.887 11.612
384 HH12 ARG 43 2HH1 ARG 43 -2.435 9.837 12.850
385 HH21 ARG 43 1HH2 ARG 43 -1.441 12.954 11.506
386 HH22 ARG 43 2HH2 ARG 43 -2.266 12.197 12.779
387 H LYS 44 H LYS 44 3.094 6.863 7.005
388 HA LYS 44 HA LYS 44 2.726 5.443 4.480
389 HB2 LYS 44 2HB LYS 44 4.779 5.226 6.651
390 HB3 LYS 44 1HB LYS 44 4.766 4.206 5.210
391 HG2 LYS 44 2HG LYS 44 5.093 7.210 5.258
392 HG3 LYS 44 1HG LYS 44 6.409 6.047 5.083
393 HD2 LYS 44 2HD LYS 44 5.370 5.228 3.003
394 HD3 LYS 44 1HD LYS 44 4.090 6.423 3.185
395 HE2 LYS 44 2HE LYS 44 5.672 8.230 2.970
396 HE3 LYS 44 1HE LYS 44 7.023 7.095 2.932
397 HZ1 LYS 44 1HZ LYS 44 6.187 6.209 0.877
398 HZ2 LYS 44 2HZ LYS 44 6.432 7.861 0.720
399 HZ3 LYS 44 3HZ LYS 44 4.854 7.257 0.908
400 H ILE 45 H ILE 45 1.356 3.827 4.494
401 HA ILE 45 HA ILE 45 0.833 2.374 7.000
402 HB ILE 45 HB ILE 45 -1.032 2.657 4.622
403 HG12 ILE 45 2HG1 ILE 45 -2.544 3.942 6.270
404 HG13 ILE 45 1HG1 ILE 45 -1.099 4.119 7.283
405 HG21 ILE 45 1HG2 ILE 45 -1.491 1.416 7.321
406 HG22 ILE 45 2HG2 ILE 45 -1.344 0.583 5.771
407 HG23 ILE 45 3HG2 ILE 45 -2.726 1.636 6.079
408 HD11 ILE 45 1HD1 ILE 45 -1.608 6.082 5.987
409 HD12 ILE 45 2HD1 ILE 45 -1.519 5.152 4.509
410 HD13 ILE 45 3HD1 ILE 45 -0.053 5.389 5.473
411 H CYS 46 H CYS 46 1.834 0.471 6.880
412 HA CYS 46 HA CYS 46 2.592 -0.779 4.396
413 HB2 CYS 46 2HB CYS 46 2.618 -1.831 7.224
414 HB3 CYS 46 1HB CYS 46 3.497 -2.553 5.897
415 H ALA 47 H ALA 47 1.092 -1.849 3.152
416 HA ALA 47 HA ALA 47 -1.082 -3.156 4.631
417 HB1 ALA 47 1HB ALA 47 -1.218 -1.947 1.879
418 HB2 ALA 47 2HB ALA 47 -1.843 -1.211 3.356
419 HB3 ALA 47 3HB ALA 47 -2.543 -2.714 2.754
420 H ASN 48 H ASN 48 -1.858 -5.124 3.926
421 HA ASN 48 HA ASN 48 0.078 -6.810 2.718
422 HB2 ASN 48 2HB ASN 48 -1.105 -7.697 4.514
423 HB3 ASN 48 1HB ASN 48 -2.674 -7.279 3.890
424 HD21 ASN 48 1HD2 ASN 48 0.040 -8.873 2.240
425 HD22 ASN 48 2HD2 ASN 48 -0.868 -10.341 1.946
426 HA PRO 49 HA PRO 49 -1.342 -5.976 -1.459
427 HB2 PRO 49 2HB PRO 49 0.321 -7.814 -2.615
428 HB3 PRO 49 1HB PRO 49 0.786 -6.155 -2.257
429 HG2 PRO 49 2HG PRO 49 1.353 -8.654 -0.729
430 HG3 PRO 49 1HG PRO 49 2.384 -7.237 -0.990
431 HD2 PRO 49 2HD PRO 49 1.118 -7.661 1.323
432 HD3 PRO 49 1HD PRO 49 1.359 -6.025 0.689
433 H ASN 50 H ASN 50 -1.311 -8.927 0.246
434 HA ASN 50 HA ASN 50 -2.636 -10.442 -1.767
435 HB2 ASN 50 2HB ASN 50 -2.328 -11.088 1.161
436 HB3 ASN 50 1HB ASN 50 -2.923 -12.167 -0.093
437 HD21 ASN 50 1HD2 ASN 50 -0.968 -11.237 -2.079
438 HD22 ASN 50 2HD2 ASN 50 0.536 -11.910 -1.601
439 H GLU 51 H GLU 51 -3.650 -8.055 0.371
440 HA GLU 51 HA GLU 51 -6.216 -9.204 0.929
441 HB2 GLU 51 2HB GLU 51 -5.326 -6.366 1.375
442 HB3 GLU 51 1HB GLU 51 -6.808 -7.092 1.974
443 HG2 GLU 51 2HG GLU 51 -5.145 -8.788 3.143
444 HG3 GLU 51 1HG GLU 51 -4.024 -7.539 2.703
445 H LYS 52 H LYS 52 -8.020 -8.923 0.002
446 HA LYS 52 HA LYS 52 -8.257 -8.356 -2.690
447 HB2 LYS 52 2HB LYS 52 -9.809 -9.738 -1.391
448 HB3 LYS 52 1HB LYS 52 -10.385 -8.317 -0.551
449 HG2 LYS 52 2HG LYS 52 -11.343 -7.464 -2.620
450 HG3 LYS 52 1HG LYS 52 -10.715 -8.866 -3.493
451 HD2 LYS 52 2HD LYS 52 -12.049 -10.353 -2.095
452 HD3 LYS 52 1HD LYS 52 -12.667 -8.971 -1.191
453 HE2 LYS 52 2HE LYS 52 -13.721 -8.129 -3.229
454 HE3 LYS 52 1HE LYS 52 -13.081 -9.495 -4.131
455 HZ1 LYS 52 1HZ LYS 52 -14.948 -9.713 -1.838
456 HZ2 LYS 52 2HZ LYS 52 -14.436 -10.990 -2.817
457 HZ3 LYS 52 3HZ LYS 52 -15.409 -9.765 -3.446
458 H TRP 53 H TRP 53 -8.725 -6.150 0.047
459 HA TRP 53 HA TRP 53 -9.838 -4.068 -1.568
460 HB2 TRP 53 2HB TRP 53 -9.697 -2.604 0.370
461 HB3 TRP 53 1HB TRP 53 -10.248 -4.184 0.894
462 HD1 TRP 53 HD TRP 53 -8.448 -5.643 2.421
463 HE1 TRP 53 1HE TRP 53 -6.534 -4.867 3.892
464 HE3 TRP 53 3HE TRP 53 -7.862 -0.904 0.582
465 HZ2 TRP 53 2HZ TRP 53 -4.940 -2.577 4.255
466 HZ3 TRP 53 3HZ TRP 53 -6.100 0.502 1.556
467 HH2 TRP 53 HH TRP 53 -4.673 -0.319 3.353
468 H VAL 54 H VAL 54 -6.614 -4.897 -0.535
469 HA VAL 54 HA VAL 54 -5.319 -2.510 -1.330
470 HB VAL 54 HB VAL 54 -4.228 -5.314 -0.913
471 HG11 VAL 54 1HG1 VAL 54 -2.704 -2.736 -1.316
472 HG12 VAL 54 2HG1 VAL 54 -2.714 -4.114 -2.409
473 HG13 VAL 54 3HG1 VAL 54 -1.993 -4.246 -0.794
474 HG21 VAL 54 1HG2 VAL 54 -4.107 -2.843 0.792
475 HG22 VAL 54 2HG2 VAL 54 -3.383 -4.406 1.171
476 HG23 VAL 54 3HG2 VAL 54 -5.137 -4.244 1.072
477 H GLN 55 H GLN 55 -6.078 -5.503 -2.895
478 HA GLN 55 HA GLN 55 -4.505 -5.015 -5.161
479 HB2 GLN 55 2HB GLN 55 -6.891 -6.825 -4.935
480 HB3 GLN 55 1HB GLN 55 -5.648 -6.879 -6.188
481 HG2 GLN 55 2HG GLN 55 -3.979 -7.113 -4.301
482 HG3 GLN 55 1HG GLN 55 -5.367 -7.443 -3.273
483 HE21 GLN 55 1HE2 GLN 55 -3.173 -8.999 -3.858
484 HE22 GLN 55 2HE2 GLN 55 -3.673 -10.465 -4.602
485 H LYS 56 H LYS 56 -7.794 -4.119 -4.329
486 HA LYS 56 HA LYS 56 -8.337 -3.036 -6.926
487 HB2 LYS 56 2HB LYS 56 -9.670 -2.525 -4.263
488 HB3 LYS 56 1HB LYS 56 -10.165 -1.729 -5.746
489 HG2 LYS 56 2HG LYS 56 -10.652 -3.960 -6.714
490 HG3 LYS 56 1HG LYS 56 -10.271 -4.673 -5.144
491 HD2 LYS 56 2HD LYS 56 -12.053 -3.437 -4.085
492 HD3 LYS 56 1HD LYS 56 -12.372 -2.548 -5.573
493 HE2 LYS 56 2HE LYS 56 -14.028 -4.294 -5.258
494 HE3 LYS 56 1HE LYS 56 -13.036 -4.641 -6.667
495 HZ1 LYS 56 1HZ LYS 56 -11.748 -6.190 -5.272
496 HZ2 LYS 56 2HZ LYS 56 -13.373 -6.587 -5.427
497 HZ3 LYS 56 3HZ LYS 56 -12.834 -5.893 -3.992
498 H ALA 57 H ALA 57 -7.155 -1.760 -3.867
499 HA ALA 57 HA ALA 57 -7.073 0.932 -4.549
500 HB1 ALA 57 1HB ALA 57 -5.421 1.180 -2.767
501 HB2 ALA 57 2HB ALA 57 -5.231 -0.563 -2.665
502 HB3 ALA 57 3HB ALA 57 -6.780 0.208 -2.240
503 H MET 58 H MET 58 -4.555 -1.565 -4.894
504 HA MET 58 HA MET 58 -2.658 0.107 -5.845
505 HB2 MET 58 2HB MET 58 -2.986 -2.833 -6.289
506 HB3 MET 58 1HB MET 58 -1.602 -1.978 -6.940
507 HG2 MET 58 2HG MET 58 -1.205 -1.168 -4.557
508 HG3 MET 58 1HG MET 58 -2.388 -2.376 -4.078
509 HE1 MET 58 1HE MET 58 -0.592 -5.691 -5.165
510 HE2 MET 58 2HE MET 58 -1.765 -4.792 -6.138
511 HE3 MET 58 3HE MET 58 -2.038 -5.027 -4.400
512 H LYS 59 H LYS 59 -5.097 -1.608 -7.673
513 HA LYS 59 HA LYS 59 -4.180 -0.883 -10.242
514 HB2 LYS 59 2HB LYS 59 -6.966 -1.506 -9.278
515 HB3 LYS 59 1HB LYS 59 -6.508 -1.375 -10.968
516 HG2 LYS 59 2HG LYS 59 -5.024 -3.264 -10.749
517 HG3 LYS 59 1HG LYS 59 -5.368 -3.357 -9.016
518 HD2 LYS 59 2HD LYS 59 -7.707 -3.849 -9.497
519 HD3 LYS 59 1HD LYS 59 -7.389 -3.712 -11.228
520 HE2 LYS 59 2HE LYS 59 -7.451 -6.044 -10.488
521 HE3 LYS 59 1HE LYS 59 -5.865 -5.589 -11.119
522 HZ1 LYS 59 1HZ LYS 59 -6.606 -5.757 -8.255
523 HZ2 LYS 59 2HZ LYS 59 -5.098 -5.317 -8.859
524 HZ3 LYS 59 3HZ LYS 59 -5.665 -6.879 -9.107
525 H HIS 60 H HIS 60 -6.374 0.704 -7.969
526 HA HIS 60 HA HIS 60 -7.185 2.742 -9.757
527 HB2 HIS 60 2HB HIS 60 -8.599 2.038 -7.926
528 HB3 HIS 60 1HB HIS 60 -7.358 2.437 -6.755
529 HD1 HIS 60 1HD HIS 60 -10.000 3.978 -8.905
530 HD2 HIS 60 2HD HIS 60 -7.271 5.035 -6.000
531 HE1 HIS 60 1HE HIS 60 -10.631 6.304 -8.272
532 HE2 HIS 60 2HE HIS 60 -9.207 6.771 -6.262
533 H LEU 61 H LEU 61 -4.683 2.430 -7.322
534 HA LEU 61 HA LEU 61 -3.846 5.160 -7.512
535 HB2 LEU 61 2HB LEU 61 -2.575 2.761 -6.226
536 HB3 LEU 61 1HB LEU 61 -1.956 4.396 -6.092
537 HG LEU 61 HG LEU 61 -4.683 3.528 -5.125
538 HD11 LEU 61 1HD1 LEU 61 -2.124 3.936 -3.583
539 HD12 LEU 61 2HD1 LEU 61 -2.996 2.407 -3.825
540 HD13 LEU 61 3HD1 LEU 61 -3.728 3.700 -2.890
541 HD21 LEU 61 1HD2 LEU 61 -3.089 6.049 -4.690
542 HD22 LEU 61 2HD2 LEU 61 -4.628 5.671 -3.921
543 HD23 LEU 61 3HD2 LEU 61 -4.548 5.903 -5.669
544 H ASP 62 H ASP 62 -2.973 2.190 -9.140
545 HA ASP 62 HA ASP 62 -0.496 3.195 -10.235
546 HB2 ASP 62 2HB ASP 62 -0.969 0.763 -9.993
547 HB3 ASP 62 1HB ASP 62 -2.269 0.915 -11.160
548 H LYS 63 H LYS 63 -3.838 3.089 -11.152
549 HA LYS 63 HA LYS 63 -3.319 4.533 -13.606
550 HB2 LYS 63 2HB LYS 63 -5.775 3.092 -12.585
551 HB3 LYS 63 1HB LYS 63 -5.683 3.903 -14.143
552 HG2 LYS 63 2HG LYS 63 -3.863 2.362 -14.798
553 HG3 LYS 63 1HG LYS 63 -4.042 1.534 -13.262
554 HD2 LYS 63 2HD LYS 63 -6.217 1.804 -15.333
555 HD3 LYS 63 1HD LYS 63 -5.196 0.381 -15.129
556 HE2 LYS 63 2HE LYS 63 -6.071 0.093 -12.854
557 HE3 LYS 63 1HE LYS 63 -7.069 1.530 -13.056
558 HZ1 LYS 63 1HZ LYS 63 -7.305 -0.955 -14.678
559 HZ2 LYS 63 2HZ LYS 63 -8.256 0.417 -14.836
560 HZ3 LYS 63 3HZ LYS 63 -8.338 -0.507 -13.435
561 H LYS 64 H LYS 64 -2.890 5.799 -11.321
562 HA LYS 64 HA LYS 64 -4.772 7.019 -9.796
563 HB2 LYS 64 2HB LYS 64 -2.354 7.028 -9.422
564 HB3 LYS 64 1HB LYS 64 -2.153 8.165 -10.740
565 HG2 LYS 64 2HG LYS 64 -3.395 9.846 -9.488
566 HG3 LYS 64 1HG LYS 64 -3.640 8.688 -8.173
567 HD2 LYS 64 2HD LYS 64 -1.205 8.501 -7.904
568 HD3 LYS 64 1HD LYS 64 -0.983 9.690 -9.186
569 HE2 LYS 64 2HE LYS 64 -2.156 11.353 -7.849
570 HE3 LYS 64 1HE LYS 64 -2.404 10.161 -6.570
571 HZ1 LYS 64 1HZ LYS 64 0.214 11.173 -7.531
572 HZ2 LYS 64 2HZ LYS 64 0.028 10.001 -6.349
573 HZ3 LYS 64 3HZ LYS 64 -0.514 11.574 -6.078
Start of MODEL 16
1 H1 ALA 1 1HT ALA 1 14.912 9.354 4.733
2 H2 ALA 1 2HT ALA 1 15.577 9.388 3.192
3 H3 ALA 1 3HT ALA 1 16.575 9.196 4.545
4 HA ALA 1 HA ALA 1 14.522 7.293 3.645
5 HB1 ALA 1 1HB ALA 1 16.393 5.844 3.036
6 HB2 ALA 1 2HB ALA 1 17.533 7.111 3.489
7 HB3 ALA 1 3HB ALA 1 16.438 7.353 2.127
8 H ARG 2 H ARG 2 13.655 6.519 5.467
9 HA ARG 2 HA ARG 2 15.456 5.440 7.499
10 HB2 ARG 2 2HB ARG 2 13.024 7.155 8.088
11 HB3 ARG 2 1HB ARG 2 13.866 6.202 9.292
12 HG2 ARG 2 2HG ARG 2 15.067 8.470 7.715
13 HG3 ARG 2 1HG ARG 2 14.480 8.582 9.374
14 HD2 ARG 2 2HD ARG 2 16.150 6.916 10.069
15 HD3 ARG 2 1HD ARG 2 16.717 6.794 8.407
16 HE ARG 2 HE ARG 2 16.849 9.459 9.125
17 HH11 ARG 2 1HH1 ARG 2 18.381 6.435 10.147
18 HH12 ARG 2 2HH1 ARG 2 19.847 7.177 10.593
19 HH21 ARG 2 1HH2 ARG 2 18.851 10.450 9.721
20 HH22 ARG 2 2HH2 ARG 2 20.136 9.519 10.333
21 H LYS 3 H LYS 3 15.083 3.369 7.424
22 HA LYS 3 HA LYS 3 14.145 1.356 7.184
23 HB2 LYS 3 2HB LYS 3 13.101 1.956 9.347
24 HB3 LYS 3 1HB LYS 3 11.747 2.675 8.484
25 HG2 LYS 3 2HG LYS 3 11.145 0.480 7.592
26 HG3 LYS 3 1HG LYS 3 12.517 -0.239 8.428
27 HD2 LYS 3 2HD LYS 3 10.448 -0.623 9.671
28 HD3 LYS 3 1HD LYS 3 11.539 0.411 10.586
29 HE2 LYS 3 2HE LYS 3 10.250 2.378 9.906
30 HE3 LYS 3 1HE LYS 3 9.191 1.355 8.932
31 HZ1 LYS 3 1HZ LYS 3 8.211 1.889 11.083
32 HZ2 LYS 3 2HZ LYS 3 9.517 1.200 11.877
33 HZ3 LYS 3 3HZ LYS 3 8.492 0.239 10.949
34 H SER 4 H SER 4 14.147 1.155 5.022
35 HA SER 4 HA SER 4 12.133 2.312 3.379
36 HB2 SER 4 2HB SER 4 13.376 1.077 1.570
37 HB3 SER 4 1HB SER 4 14.345 2.209 2.511
38 HG SER 4 HG SER 4 14.721 -0.393 2.140
39 H CYS 5 H CYS 5 12.362 -0.605 5.100
40 HA CYS 5 HA CYS 5 10.316 -1.816 3.373
41 HB2 CYS 5 2HB CYS 5 12.236 -3.229 5.221
42 HB3 CYS 5 1HB CYS 5 11.046 -3.990 4.209
43 H CYS 6 H CYS 6 8.712 -3.044 4.429
44 HA CYS 6 HA CYS 6 8.152 -2.282 7.187
45 HB2 CYS 6 2HB CYS 6 6.453 -3.093 4.863
46 HB3 CYS 6 1HB CYS 6 5.831 -2.943 6.506
47 H LEU 7 H LEU 7 7.764 -3.967 8.548
48 HA LEU 7 HA LEU 7 8.072 -6.641 7.391
49 HB2 LEU 7 2HB LEU 7 9.942 -5.744 8.863
50 HB3 LEU 7 1HB LEU 7 8.804 -5.790 10.194
51 HG LEU 7 HG LEU 7 8.610 -8.236 9.923
52 HD11 LEU 7 1HD1 LEU 7 10.255 -9.381 8.458
53 HD12 LEU 7 2HD1 LEU 7 10.710 -7.797 7.817
54 HD13 LEU 7 3HD1 LEU 7 9.085 -8.410 7.556
55 HD21 LEU 7 1HD2 LEU 7 10.851 -8.779 10.757
56 HD22 LEU 7 2HD2 LEU 7 10.229 -7.301 11.491
57 HD23 LEU 7 3HD2 LEU 7 11.430 -7.209 10.202
58 H LYS 8 H LYS 8 5.822 -4.694 8.194
59 HA LYS 8 HA LYS 8 4.151 -6.639 9.548
60 HB2 LYS 8 2HB LYS 8 3.143 -4.819 10.782
61 HB3 LYS 8 1HB LYS 8 4.840 -5.006 11.230
62 HG2 LYS 8 2HG LYS 8 5.418 -3.089 9.821
63 HG3 LYS 8 1HG LYS 8 3.734 -2.930 9.328
64 HD2 LYS 8 2HD LYS 8 4.772 -2.646 12.146
65 HD3 LYS 8 1HD LYS 8 4.377 -1.302 11.074
66 HE2 LYS 8 2HE LYS 8 2.046 -2.105 10.977
67 HE3 LYS 8 1HE LYS 8 2.460 -3.409 12.085
68 HZ1 LYS 8 1HZ LYS 8 1.460 -1.622 13.288
69 HZ2 LYS 8 2HZ LYS 8 2.572 -0.499 12.696
70 HZ3 LYS 8 3HZ LYS 8 3.066 -1.722 13.733
71 H TYR 9 H TYR 9 1.886 -6.109 9.143
72 HA TYR 9 HA TYR 9 1.386 -4.374 6.839
73 HB2 TYR 9 2HB TYR 9 -0.316 -6.841 7.378
74 HB3 TYR 9 1HB TYR 9 -0.203 -5.838 5.990
75 HD1 TYR 9 1HD TYR 9 1.463 -6.118 4.314
76 HD2 TYR 9 2HD TYR 9 1.394 -8.614 7.731
77 HE1 TYR 9 1HE TYR 9 2.924 -7.724 3.153
78 HE2 TYR 9 2HE TYR 9 2.851 -10.232 6.591
79 HH TYR 9 HH TYR 9 4.428 -9.539 3.630
80 H THR 10 H THR 10 -0.583 -3.280 7.045
81 HA THR 10 HA THR 10 -1.437 -2.700 9.664
82 HB THR 10 HB THR 10 -1.492 -0.967 7.971
83 HG1 THR 10 1HG THR 10 -4.118 -0.860 8.096
84 HG21 THR 10 1HG2 THR 10 -3.112 -1.001 6.121
85 HG22 THR 10 2HG2 THR 10 -3.566 -2.654 6.556
86 HG23 THR 10 3HG2 THR 10 -1.922 -2.290 6.006
87 H LYS 11 H LYS 11 -3.414 -3.275 10.707
88 HA LYS 11 HA LYS 11 -4.764 -5.527 9.436
89 HB2 LYS 11 2HB LYS 11 -5.768 -6.138 11.563
90 HB3 LYS 11 1HB LYS 11 -4.050 -5.943 11.775
91 HG2 LYS 11 2HG LYS 11 -6.131 -3.915 12.591
92 HG3 LYS 11 1HG LYS 11 -5.427 -5.115 13.665
93 HD2 LYS 11 2HD LYS 11 -3.208 -4.096 13.229
94 HD3 LYS 11 1HD LYS 11 -4.018 -2.853 12.270
95 HE2 LYS 11 2HE LYS 11 -3.599 -2.021 14.513
96 HE3 LYS 11 1HE LYS 11 -5.332 -2.202 14.248
97 HZ1 LYS 11 1HZ LYS 11 -3.598 -4.118 15.726
98 HZ2 LYS 11 2HZ LYS 11 -5.249 -4.303 15.456
99 HZ3 LYS 11 3HZ LYS 11 -4.699 -3.039 16.416
100 H ARG 12 H ARG 12 -5.121 -2.308 9.592
101 HA ARG 12 HA ARG 12 -8.003 -2.596 9.233
102 HB2 ARG 12 2HB ARG 12 -8.291 -0.233 9.826
103 HB3 ARG 12 1HB ARG 12 -7.539 -1.127 11.132
104 HG2 ARG 12 2HG ARG 12 -5.352 -0.181 10.491
105 HG3 ARG 12 1HG ARG 12 -6.158 0.699 9.184
106 HD2 ARG 12 2HD ARG 12 -7.491 1.924 10.744
107 HD3 ARG 12 1HD ARG 12 -6.854 0.988 12.093
108 HE ARG 12 HE ARG 12 -4.659 2.075 10.968
109 HH11 ARG 12 1HH1 ARG 12 -7.722 3.522 12.022
110 HH12 ARG 12 2HH1 ARG 12 -7.005 4.942 12.621
111 HH21 ARG 12 1HH2 ARG 12 -3.676 4.061 11.782
112 HH22 ARG 12 2HH2 ARG 12 -4.675 5.259 12.476
113 HA PRO 13 HA PRO 13 -7.143 -1.465 5.059
114 HB2 PRO 13 2HB PRO 13 -9.739 -1.245 4.254
115 HB3 PRO 13 1HB PRO 13 -8.916 -2.797 4.423
116 HG2 PRO 13 2HG PRO 13 -10.843 -1.459 6.259
117 HG3 PRO 13 1HG PRO 13 -10.679 -3.176 5.864
118 HD2 PRO 13 2HD PRO 13 -9.733 -2.055 8.159
119 HD3 PRO 13 1HD PRO 13 -9.030 -3.501 7.414
120 H LEU 14 H LEU 14 -7.113 0.440 3.948
121 HA LEU 14 HA LEU 14 -7.998 2.813 5.365
122 HB2 LEU 14 2HB LEU 14 -6.303 2.425 2.911
123 HB3 LEU 14 1HB LEU 14 -6.719 3.981 3.576
124 HG LEU 14 HG LEU 14 -5.055 1.893 4.974
125 HD11 LEU 14 1HD1 LEU 14 -4.032 2.814 2.941
126 HD12 LEU 14 2HD1 LEU 14 -3.190 3.382 4.377
127 HD13 LEU 14 3HD1 LEU 14 -4.327 4.443 3.540
128 HD21 LEU 14 1HD2 LEU 14 -6.241 3.396 6.510
129 HD22 LEU 14 2HD2 LEU 14 -5.662 4.784 5.589
130 HD23 LEU 14 3HD2 LEU 14 -4.516 3.777 6.475
131 HA PRO 15 HA PRO 15 -11.105 3.273 2.087
132 HB2 PRO 15 2HB PRO 15 -10.968 6.176 2.485
133 HB3 PRO 15 1HB PRO 15 -12.330 5.096 2.790
134 HG2 PRO 15 2HG PRO 15 -10.954 6.309 4.784
135 HG3 PRO 15 1HG PRO 15 -11.712 4.718 4.973
136 HD2 PRO 15 2HD PRO 15 -8.843 5.408 4.489
137 HD3 PRO 15 1HD PRO 15 -9.548 4.151 5.529
138 H LEU 16 H LEU 16 -10.705 3.535 -0.011
139 HA LEU 16 HA LEU 16 -8.113 4.174 -0.889
140 HB2 LEU 16 2HB LEU 16 -9.323 2.533 -2.032
141 HB3 LEU 16 1HB LEU 16 -10.658 3.663 -2.355
142 HG LEU 16 HG LEU 16 -9.143 4.852 -3.882
143 HD11 LEU 16 1HD1 LEU 16 -7.043 3.752 -4.552
144 HD12 LEU 16 2HD1 LEU 16 -7.273 2.572 -3.263
145 HD13 LEU 16 3HD1 LEU 16 -7.010 4.265 -2.862
146 HD21 LEU 16 1HD2 LEU 16 -9.456 1.930 -4.323
147 HD22 LEU 16 2HD2 LEU 16 -9.218 3.182 -5.582
148 HD23 LEU 16 3HD2 LEU 16 -10.667 3.209 -4.565
149 H LYS 17 H LYS 17 -11.023 5.937 -0.727
150 HA LYS 17 HA LYS 17 -10.367 8.117 -2.345
151 HB2 LYS 17 2HB LYS 17 -12.184 7.966 0.059
152 HB3 LYS 17 1HB LYS 17 -12.086 9.356 -1.011
153 HG2 LYS 17 2HG LYS 17 -12.835 8.001 -2.881
154 HG3 LYS 17 1HG LYS 17 -12.885 6.573 -1.855
155 HD2 LYS 17 2HD LYS 17 -14.608 7.638 -0.471
156 HD3 LYS 17 1HD LYS 17 -14.537 9.075 -1.498
157 HE2 LYS 17 2HE LYS 17 -15.249 7.755 -3.419
158 HE3 LYS 17 1HE LYS 17 -15.279 6.303 -2.421
159 HZ1 LYS 17 1HZ LYS 17 -17.467 7.250 -2.741
160 HZ2 LYS 17 2HZ LYS 17 -16.994 8.695 -2.021
161 HZ3 LYS 17 3HZ LYS 17 -17.047 7.267 -1.106
162 H ARG 18 H ARG 18 -8.813 7.130 0.397
163 HA ARG 18 HA ARG 18 -7.943 9.916 1.026
164 HB2 ARG 18 2HB ARG 18 -9.255 8.681 2.905
165 HB3 ARG 18 1HB ARG 18 -7.855 7.639 3.000
166 HG2 ARG 18 2HG ARG 18 -6.435 9.561 3.491
167 HG3 ARG 18 1HG ARG 18 -7.851 10.603 3.409
168 HD2 ARG 18 2HD ARG 18 -8.842 9.406 5.273
169 HD3 ARG 18 1HD ARG 18 -7.421 8.352 5.359
170 HE ARG 18 HE ARG 18 -7.078 11.236 5.557
171 HH11 ARG 18 1HH1 ARG 18 -7.040 8.097 7.249
172 HH12 ARG 18 2HH1 ARG 18 -6.104 8.681 8.543
173 HH21 ARG 18 1HH2 ARG 18 -5.803 11.995 7.381
174 HH22 ARG 18 2HH2 ARG 18 -5.417 10.903 8.635
175 H ILE 19 H ILE 19 -6.864 7.554 -0.711
176 HA ILE 19 HA ILE 19 -4.199 7.483 0.508
177 HB ILE 19 HB ILE 19 -5.290 5.615 -1.627
178 HG12 ILE 19 2HG1 ILE 19 -4.865 5.020 1.291
179 HG13 ILE 19 1HG1 ILE 19 -6.445 5.490 0.642
180 HG21 ILE 19 1HG2 ILE 19 -2.819 5.485 0.148
181 HG22 ILE 19 2HG2 ILE 19 -2.814 5.789 -1.584
182 HG23 ILE 19 3HG2 ILE 19 -3.321 4.222 -0.960
183 HD11 ILE 19 1HD1 ILE 19 -6.383 3.512 -0.818
184 HD12 ILE 19 2HD1 ILE 19 -6.249 3.062 0.879
185 HD13 ILE 19 3HD1 ILE 19 -4.829 3.094 -0.188
186 H LYS 20 H LYS 20 -2.526 8.365 -0.540
187 HA LYS 20 HA LYS 20 -3.086 9.906 -2.906
188 HB2 LYS 20 2HB LYS 20 -0.539 9.717 -1.261
189 HB3 LYS 20 1HB LYS 20 -0.838 10.875 -2.534
190 HG2 LYS 20 2HG LYS 20 -2.248 10.684 0.060
191 HG3 LYS 20 1HG LYS 20 -1.110 11.931 -0.463
192 HD2 LYS 20 2HD LYS 20 -3.817 11.325 -1.584
193 HD3 LYS 20 1HD LYS 20 -3.387 12.720 -0.626
194 HE2 LYS 20 2HE LYS 20 -2.245 12.134 -3.369
195 HE3 LYS 20 1HE LYS 20 -3.484 13.325 -3.015
196 HZ1 LYS 20 1HZ LYS 20 -1.902 14.550 -1.662
197 HZ2 LYS 20 2HZ LYS 20 -1.253 14.293 -3.200
198 HZ3 LYS 20 3HZ LYS 20 -0.726 13.371 -1.916
199 H SER 21 H SER 21 -0.918 7.240 -1.908
200 HA SER 21 HA SER 21 -0.791 6.050 -4.416
201 HB2 SER 21 2HB SER 21 1.574 6.598 -4.992
202 HB3 SER 21 1HB SER 21 0.505 7.996 -5.110
203 HG SER 21 HG SER 21 2.364 8.544 -4.097
204 H TYR 22 H TYR 22 1.152 4.467 -4.398
205 HA TYR 22 HA TYR 22 1.846 3.713 -1.638
206 HB2 TYR 22 2HB TYR 22 1.510 1.383 -2.182
207 HB3 TYR 22 1HB TYR 22 0.010 2.273 -2.358
208 HD1 TYR 22 1HD TYR 22 -1.181 2.119 -4.310
209 HD2 TYR 22 2HD TYR 22 2.846 0.843 -4.347
210 HE1 TYR 22 1HE TYR 22 -1.486 1.210 -6.550
211 HE2 TYR 22 2HE TYR 22 2.545 -0.071 -6.612
212 HH TYR 22 HH TYR 22 -0.204 0.635 -8.497
213 H THR 23 H THR 23 3.557 2.213 -1.553
214 HA THR 23 HA THR 23 5.498 2.519 -3.734
215 HB THR 23 HB THR 23 5.979 2.085 -0.780
216 HG1 THR 23 1HG THR 23 5.257 4.241 -1.634
217 HG21 THR 23 1HG2 THR 23 7.661 1.043 -2.188
218 HG22 THR 23 2HG2 THR 23 8.360 2.430 -1.341
219 HG23 THR 23 3HG2 THR 23 7.921 2.560 -3.052
220 H ILE 24 H ILE 24 6.112 0.597 -4.621
221 HA ILE 24 HA ILE 24 4.977 -1.813 -3.555
222 HB ILE 24 HB ILE 24 6.804 -1.408 -5.937
223 HG12 ILE 24 2HG1 ILE 24 3.805 -1.778 -5.795
224 HG13 ILE 24 1HG1 ILE 24 4.642 -0.276 -6.174
225 HG21 ILE 24 1HG2 ILE 24 5.181 -3.825 -5.106
226 HG22 ILE 24 2HG2 ILE 24 6.941 -3.692 -5.077
227 HG23 ILE 24 3HG2 ILE 24 6.081 -3.666 -6.617
228 HD11 ILE 24 1HD1 ILE 24 4.678 -2.797 -7.819
229 HD12 ILE 24 2HD1 ILE 24 5.532 -1.304 -8.206
230 HD13 ILE 24 3HD1 ILE 24 3.774 -1.323 -8.170
231 H GLN 25 H GLN 25 5.958 -2.688 -1.851
232 HA GLN 25 HA GLN 25 8.839 -2.574 -1.662
233 HB2 GLN 25 2HB GLN 25 7.826 -2.235 0.421
234 HB3 GLN 25 1HB GLN 25 6.669 -3.527 0.226
235 HG2 GLN 25 2HG GLN 25 8.432 -5.154 0.468
236 HG3 GLN 25 1HG GLN 25 9.618 -3.860 0.626
237 HE21 GLN 25 1HE2 GLN 25 8.682 -6.019 2.491
238 HE22 GLN 25 2HE2 GLN 25 8.302 -5.180 3.939
239 H SER 26 H SER 26 9.977 -3.992 -2.629
240 HA SER 26 HA SER 26 8.752 -6.451 -3.419
241 HB2 SER 26 2HB SER 26 10.063 -5.264 -5.096
242 HB3 SER 26 1HB SER 26 11.471 -5.306 -4.028
243 HG SER 26 HG SER 26 11.193 -7.064 -5.731
244 H ASN 27 H ASN 27 9.263 -8.340 -2.641
245 HA ASN 27 HA ASN 27 10.679 -8.401 -0.156
246 HB2 ASN 27 2HB ASN 27 9.846 -10.679 0.003
247 HB3 ASN 27 1HB ASN 27 8.571 -9.506 -0.265
248 HD21 ASN 27 1HD2 ASN 27 8.337 -12.095 -0.635
249 HD22 ASN 27 2HD2 ASN 27 8.087 -12.439 -2.324
250 H GLU 28 H GLU 28 11.582 -8.511 -3.236
251 HA GLU 28 HA GLU 28 13.647 -10.459 -3.162
252 HB2 GLU 28 2HB GLU 28 13.418 -7.897 -4.754
253 HB3 GLU 28 1HB GLU 28 14.513 -9.228 -5.098
254 HG2 GLU 28 2HG GLU 28 12.659 -10.675 -5.630
255 HG3 GLU 28 1HG GLU 28 11.515 -9.425 -5.143
256 H ALA 29 H ALA 29 13.243 -7.108 -2.221
257 HA ALA 29 HA ALA 29 16.043 -6.939 -1.323
258 HB1 ALA 29 1HB ALA 29 15.753 -4.523 -1.338
259 HB2 ALA 29 2HB ALA 29 14.059 -4.713 -1.776
260 HB3 ALA 29 3HB ALA 29 15.323 -5.207 -2.903
261 H CYS 30 H CYS 30 12.743 -6.802 -0.249
262 HA CYS 30 HA CYS 30 13.594 -6.202 2.495
263 HB2 CYS 30 2HB CYS 30 10.865 -6.210 1.217
264 HB3 CYS 30 1HB CYS 30 11.214 -5.778 2.886
265 H ASN 31 H ASN 31 12.304 -7.492 4.177
266 HA ASN 31 HA ASN 31 12.752 -10.259 3.678
267 HB2 ASN 31 2HB ASN 31 11.398 -8.900 6.014
268 HB3 ASN 31 1HB ASN 31 11.737 -10.620 5.938
269 HD21 ASN 31 1HD2 ASN 31 13.042 -10.569 7.712
270 HD22 ASN 31 2HD2 ASN 31 14.610 -9.842 7.714
271 H ILE 32 H ILE 32 9.919 -8.224 3.750
272 HA ILE 32 HA ILE 32 8.387 -10.517 2.722
273 HB ILE 32 HB ILE 32 6.377 -9.752 3.855
274 HG12 ILE 32 2HG1 ILE 32 8.080 -7.566 5.075
275 HG13 ILE 32 1HG1 ILE 32 6.902 -7.326 3.793
276 HG21 ILE 32 1HG2 ILE 32 8.686 -9.815 5.738
277 HG22 ILE 32 2HG2 ILE 32 7.864 -11.248 5.103
278 HG23 ILE 32 3HG2 ILE 32 7.004 -10.131 6.188
279 HD11 ILE 32 1HD1 ILE 32 6.322 -8.271 6.589
280 HD12 ILE 32 2HD1 ILE 32 5.125 -8.054 5.314
281 HD13 ILE 32 3HD1 ILE 32 6.009 -6.663 5.944
282 H LYS 33 H LYS 33 6.386 -9.699 1.567
283 HA LYS 33 HA LYS 33 7.162 -7.379 0.078
284 HB2 LYS 33 2HB LYS 33 6.707 -9.421 -1.231
285 HB3 LYS 33 1HB LYS 33 5.081 -9.486 -0.564
286 HG2 LYS 33 2HG LYS 33 4.517 -7.399 -1.685
287 HG3 LYS 33 1HG LYS 33 6.160 -7.275 -2.301
288 HD2 LYS 33 2HD LYS 33 5.858 -9.356 -3.550
289 HD3 LYS 33 1HD LYS 33 4.216 -9.488 -2.922
290 HE2 LYS 33 2HE LYS 33 3.630 -7.385 -4.023
291 HE3 LYS 33 1HE LYS 33 5.274 -7.247 -4.636
292 HZ1 LYS 33 1HZ LYS 33 3.391 -9.454 -5.310
293 HZ2 LYS 33 2HZ LYS 33 4.948 -9.236 -5.940
294 HZ3 LYS 33 3HZ LYS 33 3.733 -8.117 -6.276
295 H ALA 34 H ALA 34 6.144 -5.531 0.947
296 HA ALA 34 HA ALA 34 3.332 -5.736 1.731
297 HB1 ALA 34 1HB ALA 34 4.654 -5.905 3.834
298 HB2 ALA 34 2HB ALA 34 3.729 -4.424 3.779
299 HB3 ALA 34 3HB ALA 34 5.453 -4.386 3.441
300 H ILE 35 H ILE 35 2.388 -4.412 0.302
301 HA ILE 35 HA ILE 35 3.696 -2.231 -0.957
302 HB ILE 35 HB ILE 35 0.712 -2.719 -0.645
303 HG12 ILE 35 2HG1 ILE 35 1.869 -4.596 -1.685
304 HG13 ILE 35 1HG1 ILE 35 0.824 -3.780 -2.848
305 HG21 ILE 35 1HG2 ILE 35 0.467 -1.291 -2.687
306 HG22 ILE 35 2HG2 ILE 35 2.181 -0.955 -2.623
307 HG23 ILE 35 3HG2 ILE 35 1.139 -0.418 -1.320
308 HD11 ILE 35 1HD1 ILE 35 2.867 -4.414 -3.884
309 HD12 ILE 35 2HD1 ILE 35 3.834 -3.595 -2.644
310 HD13 ILE 35 3HD1 ILE 35 2.830 -2.661 -3.764
311 H ILE 36 H ILE 36 4.019 -0.148 -0.249
312 HA ILE 36 HA ILE 36 2.901 0.448 2.380
313 HB ILE 36 HB ILE 36 5.062 2.010 0.920
314 HG12 ILE 36 2HG1 ILE 36 6.548 1.096 2.836
315 HG13 ILE 36 1HG1 ILE 36 5.306 -0.132 3.011
316 HG21 ILE 36 1HG2 ILE 36 3.870 3.399 2.449
317 HG22 ILE 36 2HG2 ILE 36 5.507 3.055 3.029
318 HG23 ILE 36 3HG2 ILE 36 4.124 2.208 3.745
319 HD11 ILE 36 1HD1 ILE 36 5.678 -0.825 0.734
320 HD12 ILE 36 2HD1 ILE 36 7.174 -0.862 1.703
321 HD13 ILE 36 3HD1 ILE 36 6.879 0.461 0.564
322 H PHE 37 H PHE 37 1.122 1.449 2.334
323 HA PHE 37 HA PHE 37 0.257 3.121 0.169
324 HB2 PHE 37 2HB PHE 37 -0.876 1.990 2.671
325 HB3 PHE 37 1HB PHE 37 -1.694 3.342 1.883
326 HD1 PHE 37 1HD PHE 37 -0.010 0.323 0.503
327 HD2 PHE 37 2HD PHE 37 -3.548 2.517 0.996
328 HE1 PHE 37 1HE PHE 37 -1.226 -1.261 -1.026
329 HE2 PHE 37 2HE PHE 37 -4.757 0.964 -0.502
330 HZ PHE 37 HZ PHE 37 -3.567 -0.918 -1.499
331 H THR 38 H THR 38 0.046 5.233 0.300
332 HA THR 38 HA THR 38 0.758 6.459 2.841
333 HB THR 38 HB THR 38 1.404 7.530 0.076
334 HG1 THR 38 1HG THR 38 2.593 5.743 1.671
335 HG21 THR 38 1HG2 THR 38 1.024 9.234 1.783
336 HG22 THR 38 2HG2 THR 38 2.740 9.166 1.336
337 HG23 THR 38 3HG2 THR 38 2.174 8.441 2.849
338 H THR 39 H THR 39 -0.741 7.910 3.583
339 HA THR 39 HA THR 39 -3.146 8.047 1.998
340 HB THR 39 HB THR 39 -4.034 9.107 4.131
341 HG1 THR 39 1HG THR 39 -2.497 8.158 5.907
342 HG21 THR 39 1HG2 THR 39 -4.509 6.790 3.546
343 HG22 THR 39 2HG2 THR 39 -4.248 6.937 5.284
344 HG23 THR 39 3HG2 THR 39 -2.976 6.277 4.252
345 H LYS 40 H LYS 40 -4.308 10.250 2.350
346 HA LYS 40 HA LYS 40 -2.685 12.259 1.229
347 HB2 LYS 40 2HB LYS 40 -5.208 12.662 2.757
348 HB3 LYS 40 1HB LYS 40 -4.596 13.752 1.519
349 HG2 LYS 40 2HG LYS 40 -4.921 11.481 -0.013
350 HG3 LYS 40 1HG LYS 40 -6.017 11.169 1.280
351 HD2 LYS 40 2HD LYS 40 -7.306 13.110 0.898
352 HD3 LYS 40 1HD LYS 40 -6.115 13.710 -0.269
353 HE2 LYS 40 2HE LYS 40 -6.586 11.811 -1.721
354 HE3 LYS 40 1HE LYS 40 -7.781 11.220 -0.576
355 HZ1 LYS 40 1HZ LYS 40 -9.006 13.312 -0.903
356 HZ2 LYS 40 2HZ LYS 40 -8.887 12.407 -2.313
357 HZ3 LYS 40 3HZ LYS 40 -7.920 13.773 -2.090
358 H LYS 41 H LYS 41 -3.078 11.135 4.364
359 HA LYS 41 HA LYS 41 -2.296 13.442 5.886
360 HB2 LYS 41 2HB LYS 41 -3.592 11.436 6.766
361 HB3 LYS 41 1HB LYS 41 -2.148 10.493 6.542
362 HG2 LYS 41 2HG LYS 41 -2.414 11.111 8.881
363 HG3 LYS 41 1HG LYS 41 -0.959 11.839 8.193
364 HD2 LYS 41 2HD LYS 41 -2.130 13.953 7.913
365 HD3 LYS 41 1HD LYS 41 -3.613 13.217 8.522
366 HE2 LYS 41 2HE LYS 41 -2.569 12.859 10.676
367 HE3 LYS 41 1HE LYS 41 -1.045 13.514 10.074
368 HZ1 LYS 41 1HZ LYS 41 -2.153 15.632 9.718
369 HZ2 LYS 41 2HZ LYS 41 -2.254 15.168 11.328
370 HZ3 LYS 41 3HZ LYS 41 -3.602 15.006 10.321
371 H GLY 42 H GLY 42 -0.886 11.161 3.873
372 HA2 GLY 42 2HA GLY 42 1.225 10.987 3.059
373 HA3 GLY 42 1HA GLY 42 1.712 12.250 4.163
374 H ARG 43 H ARG 43 0.115 9.672 5.685
375 HA ARG 43 HA ARG 43 2.482 8.929 7.057
376 HB2 ARG 43 2HB ARG 43 0.225 9.190 8.073
377 HB3 ARG 43 1HB ARG 43 -0.292 7.806 7.107
378 HG2 ARG 43 2HG ARG 43 1.287 6.410 8.185
379 HG3 ARG 43 1HG ARG 43 1.903 7.783 9.117
380 HD2 ARG 43 2HD ARG 43 -0.336 7.997 10.191
381 HD3 ARG 43 1HD ARG 43 -0.854 6.562 9.302
382 HE ARG 43 HE ARG 43 1.428 5.843 10.618
383 HH11 ARG 43 1HH1 ARG 43 -1.788 6.948 11.599
384 HH12 ARG 43 2HH1 ARG 43 -1.770 6.151 13.105
385 HH21 ARG 43 1HH2 ARG 43 1.450 4.714 12.705
386 HH22 ARG 43 2HH2 ARG 43 0.126 4.876 13.745
387 H LYS 44 H LYS 44 3.335 6.759 7.061
388 HA LYS 44 HA LYS 44 2.960 5.364 4.530
389 HB2 LYS 44 2HB LYS 44 5.014 4.925 6.712
390 HB3 LYS 44 1HB LYS 44 5.006 4.152 5.137
391 HG2 LYS 44 2HG LYS 44 5.376 7.102 5.649
392 HG3 LYS 44 1HG LYS 44 6.647 5.951 5.257
393 HD2 LYS 44 2HD LYS 44 5.624 5.539 3.079
394 HD3 LYS 44 1HD LYS 44 4.310 6.650 3.471
395 HE2 LYS 44 2HE LYS 44 5.924 8.480 3.679
396 HE3 LYS 44 1HE LYS 44 7.233 7.370 3.284
397 HZ1 LYS 44 1HZ LYS 44 6.363 7.096 1.088
398 HZ2 LYS 44 2HZ LYS 44 6.482 8.733 1.420
399 HZ3 LYS 44 3HZ LYS 44 4.968 8.010 1.463
400 H ILE 45 H ILE 45 1.485 3.808 4.507
401 HA ILE 45 HA ILE 45 0.938 2.299 6.961
402 HB ILE 45 HB ILE 45 -0.824 2.660 4.502
403 HG12 ILE 45 2HG1 ILE 45 -2.443 3.818 6.095
404 HG13 ILE 45 1HG1 ILE 45 -1.118 3.875 7.268
405 HG21 ILE 45 1HG2 ILE 45 -1.403 1.205 7.060
406 HG22 ILE 45 2HG2 ILE 45 -1.159 0.495 5.468
407 HG23 ILE 45 3HG2 ILE 45 -2.573 1.502 5.774
408 HD11 ILE 45 1HD1 ILE 45 -1.475 5.965 6.127
409 HD12 ILE 45 2HD1 ILE 45 -1.200 5.172 4.576
410 HD13 ILE 45 3HD1 ILE 45 0.116 5.289 5.742
411 H CYS 46 H CYS 46 1.831 0.355 6.896
412 HA CYS 46 HA CYS 46 2.753 -0.799 4.396
413 HB2 CYS 46 2HB CYS 46 2.846 -1.852 7.222
414 HB3 CYS 46 1HB CYS 46 3.804 -2.461 5.889
415 H ALA 47 H ALA 47 1.288 -1.904 3.190
416 HA ALA 47 HA ALA 47 -0.833 -3.265 4.694
417 HB1 ALA 47 1HB ALA 47 -1.019 -2.030 1.959
418 HB2 ALA 47 2HB ALA 47 -1.638 -1.320 3.450
419 HB3 ALA 47 3HB ALA 47 -2.323 -2.828 2.841
420 H ASN 48 H ASN 48 -1.470 -5.307 4.105
421 HA ASN 48 HA ASN 48 0.428 -6.790 2.701
422 HB2 ASN 48 2HB ASN 48 -0.539 -7.884 4.505
423 HB3 ASN 48 1HB ASN 48 -2.163 -7.452 4.040
424 HD21 ASN 48 1HD2 ASN 48 0.557 -9.462 3.045
425 HD22 ASN 48 2HD2 ASN 48 -0.544 -10.550 2.179
426 HA PRO 49 HA PRO 49 -1.145 -6.101 -1.379
427 HB2 PRO 49 2HB PRO 49 0.486 -7.938 -2.576
428 HB3 PRO 49 1HB PRO 49 0.966 -6.281 -2.230
429 HG2 PRO 49 2HG PRO 49 1.588 -8.786 -0.746
430 HG3 PRO 49 1HG PRO 49 2.587 -7.342 -0.999
431 HD2 PRO 49 2HD PRO 49 1.334 -7.867 1.329
432 HD3 PRO 49 1HD PRO 49 1.632 -6.216 0.752
433 H ASN 50 H ASN 50 -1.043 -9.112 0.349
434 HA ASN 50 HA ASN 50 -2.386 -10.571 -1.618
435 HB2 ASN 50 2HB ASN 50 -2.009 -11.203 1.306
436 HB3 ASN 50 1HB ASN 50 -2.590 -12.308 0.060
437 HD21 ASN 50 1HD2 ASN 50 -0.152 -12.280 1.789
438 HD22 ASN 50 2HD2 ASN 50 1.163 -12.474 0.676
439 H GLU 51 H GLU 51 -3.395 -8.119 0.384
440 HA GLU 51 HA GLU 51 -6.001 -9.170 1.030
441 HB2 GLU 51 2HB GLU 51 -4.929 -6.386 1.442
442 HB3 GLU 51 1HB GLU 51 -6.431 -7.024 2.089
443 HG2 GLU 51 2HG GLU 51 -4.809 -8.795 3.256
444 HG3 GLU 51 1HG GLU 51 -3.652 -7.638 2.750
445 H LYS 52 H LYS 52 -7.813 -8.758 0.065
446 HA LYS 52 HA LYS 52 -7.948 -8.166 -2.628
447 HB2 LYS 52 2HB LYS 52 -9.620 -9.417 -1.402
448 HB3 LYS 52 1HB LYS 52 -10.115 -7.970 -0.541
449 HG2 LYS 52 2HG LYS 52 -10.818 -6.980 -2.691
450 HG3 LYS 52 1HG LYS 52 -10.407 -8.495 -3.494
451 HD2 LYS 52 2HD LYS 52 -12.460 -8.139 -1.306
452 HD3 LYS 52 1HD LYS 52 -12.806 -8.380 -3.015
453 HE2 LYS 52 2HE LYS 52 -11.711 -10.591 -2.894
454 HE3 LYS 52 1HE LYS 52 -11.410 -10.320 -1.184
455 HZ1 LYS 52 1HZ LYS 52 -13.812 -10.181 -0.838
456 HZ2 LYS 52 2HZ LYS 52 -13.317 -11.664 -1.417
457 HZ3 LYS 52 3HZ LYS 52 -14.084 -10.573 -2.462
458 H TRP 53 H TRP 53 -8.484 -6.022 0.156
459 HA TRP 53 HA TRP 53 -9.484 -3.874 -1.396
460 HB2 TRP 53 2HB TRP 53 -9.270 -2.453 0.554
461 HB3 TRP 53 1HB TRP 53 -9.846 -4.021 1.078
462 HD1 TRP 53 HD TRP 53 -7.980 -5.568 2.482
463 HE1 TRP 53 1HE TRP 53 -6.036 -4.852 3.937
464 HE3 TRP 53 3HE TRP 53 -7.491 -0.736 0.853
465 HZ2 TRP 53 2HZ TRP 53 -4.469 -2.542 4.383
466 HZ3 TRP 53 3HZ TRP 53 -5.734 0.653 1.858
467 HH2 TRP 53 HH TRP 53 -4.253 -0.233 3.586
468 H VAL 54 H VAL 54 -6.272 -4.838 -0.490
469 HA VAL 54 HA VAL 54 -4.964 -2.474 -1.335
470 HB VAL 54 HB VAL 54 -3.904 -5.284 -0.915
471 HG11 VAL 54 1HG1 VAL 54 -2.424 -2.717 -1.423
472 HG12 VAL 54 2HG1 VAL 54 -2.429 -4.131 -2.464
473 HG13 VAL 54 3HG1 VAL 54 -1.650 -4.194 -0.869
474 HG21 VAL 54 1HG2 VAL 54 -3.728 -2.795 0.761
475 HG22 VAL 54 2HG2 VAL 54 -2.988 -4.351 1.138
476 HG23 VAL 54 3HG2 VAL 54 -4.744 -4.195 1.087
477 H GLN 55 H GLN 55 -5.653 -5.557 -2.821
478 HA GLN 55 HA GLN 55 -4.223 -5.107 -5.183
479 HB2 GLN 55 2HB GLN 55 -6.630 -6.871 -4.822
480 HB3 GLN 55 1HB GLN 55 -5.414 -7.000 -6.099
481 HG2 GLN 55 2HG GLN 55 -3.709 -7.225 -4.275
482 HG3 GLN 55 1HG GLN 55 -5.050 -7.421 -3.162
483 HE21 GLN 55 1HE2 GLN 55 -2.985 -9.130 -3.700
484 HE22 GLN 55 2HE2 GLN 55 -3.590 -10.603 -4.342
485 H LYS 56 H LYS 56 -7.461 -4.317 -4.144
486 HA LYS 56 HA LYS 56 -8.541 -3.384 -6.583
487 HB2 LYS 56 2HB LYS 56 -9.921 -4.069 -4.670
488 HB3 LYS 56 1HB LYS 56 -9.184 -2.825 -3.685
489 HG2 LYS 56 2HG LYS 56 -11.392 -2.177 -4.338
490 HG3 LYS 56 1HG LYS 56 -10.188 -1.119 -5.080
491 HD2 LYS 56 2HD LYS 56 -10.377 -2.358 -7.170
492 HD3 LYS 56 1HD LYS 56 -11.576 -3.430 -6.442
493 HE2 LYS 56 2HE LYS 56 -13.053 -1.495 -6.093
494 HE3 LYS 56 1HE LYS 56 -11.850 -0.454 -6.851
495 HZ1 LYS 56 1HZ LYS 56 -12.109 -1.748 -8.899
496 HZ2 LYS 56 2HZ LYS 56 -13.580 -1.082 -8.409
497 HZ3 LYS 56 3HZ LYS 56 -13.247 -2.715 -8.152
498 H ALA 57 H ALA 57 -7.079 -1.818 -3.739
499 HA ALA 57 HA ALA 57 -7.270 0.830 -4.587
500 HB1 ALA 57 1HB ALA 57 -5.577 1.299 -2.864
501 HB2 ALA 57 2HB ALA 57 -5.273 -0.419 -2.687
502 HB3 ALA 57 3HB ALA 57 -6.863 0.239 -2.268
503 H MET 58 H MET 58 -4.704 -1.521 -4.983
504 HA MET 58 HA MET 58 -2.815 0.201 -5.889
505 HB2 MET 58 2HB MET 58 -3.030 -2.745 -6.396
506 HB3 MET 58 1HB MET 58 -1.675 -1.821 -7.020
507 HG2 MET 58 2HG MET 58 -1.289 -1.063 -4.627
508 HG3 MET 58 1HG MET 58 -2.447 -2.299 -4.158
509 HE1 MET 58 1HE MET 58 -0.565 -5.563 -5.311
510 HE2 MET 58 2HE MET 58 -1.761 -4.668 -6.263
511 HE3 MET 58 3HE MET 58 -2.023 -4.949 -4.533
512 H LYS 59 H LYS 59 -5.241 -1.495 -7.781
513 HA LYS 59 HA LYS 59 -4.212 -0.769 -10.289
514 HB2 LYS 59 2HB LYS 59 -7.058 -1.390 -9.489
515 HB3 LYS 59 1HB LYS 59 -6.448 -1.315 -11.138
516 HG2 LYS 59 2HG LYS 59 -4.951 -3.181 -10.670
517 HG3 LYS 59 1HG LYS 59 -5.561 -3.261 -9.019
518 HD2 LYS 59 2HD LYS 59 -6.622 -4.957 -10.372
519 HD3 LYS 59 1HD LYS 59 -7.817 -3.743 -9.916
520 HE2 LYS 59 2HE LYS 59 -7.621 -2.712 -12.120
521 HE3 LYS 59 1HE LYS 59 -6.380 -3.879 -12.572
522 HZ1 LYS 59 1HZ LYS 59 -8.046 -5.639 -12.271
523 HZ2 LYS 59 2HZ LYS 59 -8.503 -4.541 -13.459
524 HZ3 LYS 59 3HZ LYS 59 -9.232 -4.475 -11.961
525 H HIS 60 H HIS 60 -6.477 0.773 -8.056
526 HA HIS 60 HA HIS 60 -7.160 2.806 -9.894
527 HB2 HIS 60 2HB HIS 60 -8.721 2.077 -8.220
528 HB3 HIS 60 1HB HIS 60 -7.586 2.504 -6.939
529 HD1 HIS 60 1HD HIS 60 -9.770 4.142 -9.608
530 HD2 HIS 60 2HD HIS 60 -7.741 5.036 -6.122
531 HE1 HIS 60 1HE HIS 60 -10.464 6.477 -9.052
532 HE2 HIS 60 2HE HIS 60 -9.170 7.066 -6.961
533 H LEU 61 H LEU 61 -4.865 2.532 -7.233
534 HA LEU 61 HA LEU 61 -4.082 5.269 -7.247
535 HB2 LEU 61 2HB LEU 61 -2.723 2.800 -6.207
536 HB3 LEU 61 1HB LEU 61 -2.117 4.428 -5.938
537 HG LEU 61 HG LEU 61 -4.815 3.444 -5.005
538 HD11 LEU 61 1HD1 LEU 61 -2.243 3.772 -3.473
539 HD12 LEU 61 2HD1 LEU 61 -3.079 2.248 -3.841
540 HD13 LEU 61 3HD1 LEU 61 -3.829 3.431 -2.786
541 HD21 LEU 61 1HD2 LEU 61 -3.238 5.931 -4.380
542 HD22 LEU 61 2HD2 LEU 61 -4.778 5.481 -3.649
543 HD23 LEU 61 3HD2 LEU 61 -4.703 5.856 -5.368
544 H ASP 62 H ASP 62 -3.261 2.561 -9.137
545 HA ASP 62 HA ASP 62 -0.831 3.527 -10.266
546 HB2 ASP 62 2HB ASP 62 -1.439 1.166 -10.327
547 HB3 ASP 62 1HB ASP 62 -2.889 1.535 -11.242
548 H LYS 63 H LYS 63 -4.223 3.996 -10.881
549 HA LYS 63 HA LYS 63 -3.759 5.260 -13.432
550 HB2 LYS 63 2HB LYS 63 -6.403 5.182 -11.973
551 HB3 LYS 63 1HB LYS 63 -6.122 5.331 -13.699
552 HG2 LYS 63 2HG LYS 63 -5.789 2.893 -11.980
553 HG3 LYS 63 1HG LYS 63 -6.947 3.145 -13.284
554 HD2 LYS 63 2HD LYS 63 -5.188 3.125 -14.911
555 HD3 LYS 63 1HD LYS 63 -3.959 3.086 -13.647
556 HE2 LYS 63 2HE LYS 63 -4.891 0.897 -12.892
557 HE3 LYS 63 1HE LYS 63 -5.964 0.938 -14.286
558 HZ1 LYS 63 1HZ LYS 63 -3.008 0.973 -14.392
559 HZ2 LYS 63 2HZ LYS 63 -4.035 0.957 -15.743
560 HZ3 LYS 63 3HZ LYS 63 -3.983 -0.368 -14.715
561 H LYS 64 H LYS 64 -4.578 5.972 -10.153
562 HA LYS 64 HA LYS 64 -4.530 7.734 -8.853
563 HB2 LYS 64 2HB LYS 64 -2.405 8.395 -9.927
564 HB3 LYS 64 1HB LYS 64 -3.308 9.256 -11.166
565 HG2 LYS 64 2HG LYS 64 -4.186 10.788 -9.475
566 HG3 LYS 64 1HG LYS 64 -3.313 9.914 -8.222
567 HD2 LYS 64 2HD LYS 64 -2.113 11.939 -8.851
568 HD3 LYS 64 1HD LYS 64 -1.193 10.505 -9.304
569 HE2 LYS 64 2HE LYS 64 -1.941 10.738 -11.609
570 HE3 LYS 64 1HE LYS 64 -2.922 12.135 -11.162
571 HZ1 LYS 64 1HZ LYS 64 0.035 11.993 -10.924
572 HZ2 LYS 64 2HZ LYS 64 -0.934 13.328 -10.593
573 HZ3 LYS 64 3HZ LYS 64 -0.811 12.758 -12.169
Start of MODEL 17
1 H1 ALA 1 1HT ALA 1 12.812 4.326 9.274
2 H2 ALA 1 2HT ALA 1 13.195 5.233 10.621
3 H3 ALA 1 3HT ALA 1 13.937 5.586 9.132
4 HA ALA 1 HA ALA 1 11.075 5.852 9.785
5 HB1 ALA 1 1HB ALA 1 13.139 8.003 9.335
6 HB2 ALA 1 2HB ALA 1 12.456 7.539 10.891
7 HB3 ALA 1 3HB ALA 1 11.423 8.252 9.654
8 H ARG 2 H ARG 2 13.017 4.814 7.357
9 HA ARG 2 HA ARG 2 12.085 6.453 5.214
10 HB2 ARG 2 2HB ARG 2 13.317 3.698 5.211
11 HB3 ARG 2 1HB ARG 2 12.925 4.600 3.764
12 HG2 ARG 2 2HG ARG 2 14.545 6.321 4.431
13 HG3 ARG 2 1HG ARG 2 14.942 5.362 5.861
14 HD2 ARG 2 2HD ARG 2 15.657 3.515 4.469
15 HD3 ARG 2 1HD ARG 2 15.192 4.391 3.017
16 HE ARG 2 HE ARG 2 17.011 5.948 4.422
17 HH11 ARG 2 1HH1 ARG 2 16.985 2.827 2.715
18 HH12 ARG 2 2HH1 ARG 2 18.595 2.928 2.213
19 HH21 ARG 2 1HH2 ARG 2 19.236 6.076 3.707
20 HH22 ARG 2 2HH2 ARG 2 19.907 4.819 2.781
21 H LYS 3 H LYS 3 11.278 3.274 6.493
22 HA LYS 3 HA LYS 3 9.632 1.836 6.144
23 HB2 LYS 3 2HB LYS 3 8.055 4.368 5.669
24 HB3 LYS 3 1HB LYS 3 7.310 2.776 5.720
25 HG2 LYS 3 2HG LYS 3 8.211 2.484 8.018
26 HG3 LYS 3 1HG LYS 3 8.801 4.142 7.950
27 HD2 LYS 3 2HD LYS 3 6.579 4.980 7.694
28 HD3 LYS 3 1HD LYS 3 5.920 3.342 7.592
29 HE2 LYS 3 2HE LYS 3 6.753 2.936 9.885
30 HE3 LYS 3 1HE LYS 3 7.277 4.619 9.961
31 HZ1 LYS 3 1HZ LYS 3 4.962 5.303 9.680
32 HZ2 LYS 3 2HZ LYS 3 5.127 4.278 11.010
33 HZ3 LYS 3 3HZ LYS 3 4.478 3.691 9.576
34 H SER 4 H SER 4 11.375 2.360 4.071
35 HA SER 4 HA SER 4 9.950 2.077 1.596
36 HB2 SER 4 2HB SER 4 12.834 1.452 2.292
37 HB3 SER 4 1HB SER 4 12.173 1.720 0.679
38 HG SER 4 HG SER 4 11.495 3.840 1.698
39 H CYS 5 H CYS 5 11.232 0.161 4.171
40 HA CYS 5 HA CYS 5 10.049 -2.218 2.985
41 HB2 CYS 5 2HB CYS 5 12.575 -2.112 4.666
42 HB3 CYS 5 1HB CYS 5 11.730 -3.579 4.211
43 H CYS 6 H CYS 6 8.646 -3.178 4.237
44 HA CYS 6 HA CYS 6 8.276 -2.281 6.984
45 HB2 CYS 6 2HB CYS 6 6.457 -3.262 4.851
46 HB3 CYS 6 1HB CYS 6 5.931 -3.075 6.525
47 H LEU 7 H LEU 7 7.738 -3.842 8.469
48 HA LEU 7 HA LEU 7 8.317 -6.627 7.719
49 HB2 LEU 7 2HB LEU 7 8.643 -5.252 10.388
50 HB3 LEU 7 1HB LEU 7 8.958 -6.947 10.081
51 HG LEU 7 HG LEU 7 10.491 -4.632 8.886
52 HD11 LEU 7 1HD1 LEU 7 12.315 -5.403 10.304
53 HD12 LEU 7 2HD1 LEU 7 11.256 -6.626 11.006
54 HD13 LEU 7 3HD1 LEU 7 10.918 -4.914 11.263
55 HD21 LEU 7 1HD2 LEU 7 10.426 -6.544 7.372
56 HD22 LEU 7 2HD2 LEU 7 10.928 -7.610 8.681
57 HD23 LEU 7 3HD2 LEU 7 12.031 -6.369 8.085
58 H LYS 8 H LYS 8 5.901 -4.526 8.482
59 HA LYS 8 HA LYS 8 4.195 -6.670 9.555
60 HB2 LYS 8 2HB LYS 8 3.977 -3.723 10.079
61 HB3 LYS 8 1HB LYS 8 2.855 -4.934 10.652
62 HG2 LYS 8 2HG LYS 8 4.681 -5.891 12.038
63 HG3 LYS 8 1HG LYS 8 5.722 -4.565 11.503
64 HD2 LYS 8 2HD LYS 8 3.107 -4.275 12.995
65 HD3 LYS 8 1HD LYS 8 4.715 -4.057 13.687
66 HE2 LYS 8 2HE LYS 8 5.108 -2.163 12.181
67 HE3 LYS 8 1HE LYS 8 3.530 -2.404 11.444
68 HZ1 LYS 8 1HZ LYS 8 2.514 -1.922 13.594
69 HZ2 LYS 8 2HZ LYS 8 3.430 -0.649 12.999
70 HZ3 LYS 8 3HZ LYS 8 4.043 -1.590 14.253
71 H TYR 9 H TYR 9 1.932 -6.373 8.978
72 HA TYR 9 HA TYR 9 1.418 -4.603 6.686
73 HB2 TYR 9 2HB TYR 9 -0.225 -7.140 7.133
74 HB3 TYR 9 1HB TYR 9 -0.074 -6.107 5.781
75 HD1 TYR 9 1HD TYR 9 1.603 -6.353 4.162
76 HD2 TYR 9 2HD TYR 9 1.477 -8.887 7.541
77 HE1 TYR 9 1HE TYR 9 3.065 -7.961 2.995
78 HE2 TYR 9 2HE TYR 9 2.939 -10.500 6.430
79 HH TYR 9 HH TYR 9 4.584 -9.824 3.503
80 H THR 10 H THR 10 -0.433 -3.352 7.057
81 HA THR 10 HA THR 10 -1.629 -3.495 9.597
82 HB THR 10 HB THR 10 -1.475 -1.310 8.396
83 HG1 THR 10 1HG THR 10 -4.136 -1.292 8.341
84 HG21 THR 10 1HG2 THR 10 -2.984 -0.846 6.490
85 HG22 THR 10 2HG2 THR 10 -3.454 -2.548 6.468
86 HG23 THR 10 3HG2 THR 10 -1.789 -2.088 6.109
87 H LYS 11 H LYS 11 -3.714 -4.269 10.036
88 HA LYS 11 HA LYS 11 -4.835 -5.893 7.873
89 HB2 LYS 11 2HB LYS 11 -4.023 -6.887 10.222
90 HB3 LYS 11 1HB LYS 11 -5.585 -6.309 10.769
91 HG2 LYS 11 2HG LYS 11 -5.254 -8.229 8.450
92 HG3 LYS 11 1HG LYS 11 -5.455 -8.731 10.119
93 HD2 LYS 11 2HD LYS 11 -7.441 -6.983 8.691
94 HD3 LYS 11 1HD LYS 11 -7.519 -8.742 8.642
95 HE2 LYS 11 2HE LYS 11 -7.551 -7.071 11.154
96 HE3 LYS 11 1HE LYS 11 -8.976 -7.759 10.376
97 HZ1 LYS 11 1HZ LYS 11 -6.707 -9.322 11.530
98 HZ2 LYS 11 2HZ LYS 11 -8.036 -9.969 10.719
99 HZ3 LYS 11 3HZ LYS 11 -8.259 -9.181 12.172
100 H ARG 12 H ARG 12 -5.057 -3.079 9.462
101 HA ARG 12 HA ARG 12 -7.946 -2.797 9.303
102 HB2 ARG 12 2HB ARG 12 -6.825 -1.888 11.276
103 HB3 ARG 12 1HB ARG 12 -5.767 -0.933 10.254
104 HG2 ARG 12 2HG ARG 12 -7.623 0.445 9.553
105 HG3 ARG 12 1HG ARG 12 -8.751 -0.589 10.429
106 HD2 ARG 12 2HD ARG 12 -8.240 1.424 11.719
107 HD3 ARG 12 1HD ARG 12 -7.673 -0.041 12.522
108 HE ARG 12 HE ARG 12 -5.837 1.577 10.916
109 HH11 ARG 12 1HH1 ARG 12 -6.730 0.175 14.068
110 HH12 ARG 12 2HH1 ARG 12 -5.257 0.587 14.814
111 HH21 ARG 12 1HH2 ARG 12 -3.806 2.157 12.005
112 HH22 ARG 12 2HH2 ARG 12 -3.582 1.723 13.635
113 HA PRO 13 HA PRO 13 -7.148 -1.407 5.138
114 HB2 PRO 13 2HB PRO 13 -9.715 -1.366 4.315
115 HB3 PRO 13 1HB PRO 13 -8.797 -2.864 4.508
116 HG2 PRO 13 2HG PRO 13 -10.838 -1.650 6.310
117 HG3 PRO 13 1HG PRO 13 -10.567 -3.351 5.909
118 HD2 PRO 13 2HD PRO 13 -9.710 -2.142 8.223
119 HD3 PRO 13 1HD PRO 13 -8.976 -3.597 7.520
120 H LEU 14 H LEU 14 -6.989 0.505 4.245
121 HA LEU 14 HA LEU 14 -8.085 2.887 5.499
122 HB2 LEU 14 2HB LEU 14 -6.359 2.510 3.063
123 HB3 LEU 14 1HB LEU 14 -6.782 4.048 3.761
124 HG LEU 14 HG LEU 14 -5.070 1.956 5.103
125 HD11 LEU 14 1HD1 LEU 14 -4.064 2.895 3.068
126 HD12 LEU 14 2HD1 LEU 14 -3.230 3.476 4.504
127 HD13 LEU 14 3HD1 LEU 14 -4.384 4.519 3.663
128 HD21 LEU 14 1HD2 LEU 14 -6.257 3.453 6.656
129 HD22 LEU 14 2HD2 LEU 14 -5.652 4.843 5.754
130 HD23 LEU 14 3HD2 LEU 14 -4.523 3.805 6.615
131 HA PRO 15 HA PRO 15 -11.060 3.233 2.061
132 HB2 PRO 15 2HB PRO 15 -11.067 6.135 2.473
133 HB3 PRO 15 1HB PRO 15 -12.381 4.992 2.752
134 HG2 PRO 15 2HG PRO 15 -11.127 6.261 4.781
135 HG3 PRO 15 1HG PRO 15 -11.787 4.626 4.939
136 HD2 PRO 15 2HD PRO 15 -8.952 5.477 4.474
137 HD3 PRO 15 1HD PRO 15 -9.597 4.220 5.558
138 H LEU 16 H LEU 16 -10.612 3.550 -0.050
139 HA LEU 16 HA LEU 16 -8.027 4.247 -0.902
140 HB2 LEU 16 2HB LEU 16 -9.207 2.682 -2.133
141 HB3 LEU 16 1HB LEU 16 -10.586 3.793 -2.379
142 HG LEU 16 HG LEU 16 -8.976 5.090 -3.786
143 HD11 LEU 16 1HD1 LEU 16 -6.996 3.836 -4.588
144 HD12 LEU 16 2HD1 LEU 16 -7.310 2.621 -3.357
145 HD13 LEU 16 3HD1 LEU 16 -6.886 4.271 -2.888
146 HD21 LEU 16 1HD2 LEU 16 -9.640 2.257 -4.472
147 HD22 LEU 16 2HD2 LEU 16 -9.207 3.541 -5.631
148 HD23 LEU 16 3HD2 LEU 16 -10.654 3.703 -4.616
149 H LYS 17 H LYS 17 -10.961 5.982 -0.730
150 HA LYS 17 HA LYS 17 -10.305 8.201 -2.302
151 HB2 LYS 17 2HB LYS 17 -12.218 7.959 0.024
152 HB3 LYS 17 1HB LYS 17 -12.111 9.359 -1.035
153 HG2 LYS 17 2HG LYS 17 -12.773 8.040 -2.935
154 HG3 LYS 17 1HG LYS 17 -12.762 6.568 -1.975
155 HD2 LYS 17 2HD LYS 17 -14.578 7.467 -0.589
156 HD3 LYS 17 1HD LYS 17 -14.576 8.948 -1.547
157 HE2 LYS 17 2HE LYS 17 -15.173 7.675 -3.535
158 HE3 LYS 17 1HE LYS 17 -15.139 6.177 -2.606
159 HZ1 LYS 17 1HZ LYS 17 -17.392 6.970 -2.891
160 HZ2 LYS 17 2HZ LYS 17 -17.010 8.448 -2.168
161 HZ3 LYS 17 3HZ LYS 17 -16.969 7.027 -1.271
162 H ARG 18 H ARG 18 -8.861 7.208 0.506
163 HA ARG 18 HA ARG 18 -8.033 9.986 1.194
164 HB2 ARG 18 2HB ARG 18 -8.189 7.649 3.113
165 HB3 ARG 18 1HB ARG 18 -7.712 9.293 3.517
166 HG2 ARG 18 2HG ARG 18 -9.982 10.056 2.882
167 HG3 ARG 18 1HG ARG 18 -10.427 8.376 2.603
168 HD2 ARG 18 2HD ARG 18 -9.841 7.898 4.981
169 HD3 ARG 18 1HD ARG 18 -9.573 9.625 5.208
170 HE ARG 18 HE ARG 18 -12.134 8.951 4.097
171 HH11 ARG 18 1HH1 ARG 18 -10.388 9.528 7.127
172 HH12 ARG 18 2HH1 ARG 18 -11.796 9.889 8.016
173 HH21 ARG 18 1HH2 ARG 18 -14.046 9.391 5.324
174 HH22 ARG 18 2HH2 ARG 18 -13.932 9.780 6.970
175 H ILE 19 H ILE 19 -6.913 7.613 -0.497
176 HA ILE 19 HA ILE 19 -4.224 7.541 0.699
177 HB ILE 19 HB ILE 19 -5.382 5.699 -1.433
178 HG12 ILE 19 2HG1 ILE 19 -4.896 5.083 1.464
179 HG13 ILE 19 1HG1 ILE 19 -6.486 5.565 0.856
180 HG21 ILE 19 1HG2 ILE 19 -2.863 5.473 0.273
181 HG22 ILE 19 2HG2 ILE 19 -2.895 5.835 -1.444
182 HG23 ILE 19 3HG2 ILE 19 -3.428 4.261 -0.860
183 HD11 ILE 19 1HD1 ILE 19 -6.361 3.587 -0.682
184 HD12 ILE 19 2HD1 ILE 19 -6.396 3.148 1.039
185 HD13 ILE 19 3HD1 ILE 19 -4.909 3.112 0.092
186 H LYS 20 H LYS 20 -2.533 8.344 -0.483
187 HA LYS 20 HA LYS 20 -3.214 9.808 -2.891
188 HB2 LYS 20 2HB LYS 20 -0.670 9.850 -1.250
189 HB3 LYS 20 1HB LYS 20 -0.984 10.882 -2.623
190 HG2 LYS 20 2HG LYS 20 -2.372 10.849 -0.022
191 HG3 LYS 20 1HG LYS 20 -1.335 12.121 -0.692
192 HD2 LYS 20 2HD LYS 20 -4.012 11.201 -1.631
193 HD3 LYS 20 1HD LYS 20 -3.648 12.742 -0.881
194 HE2 LYS 20 2HE LYS 20 -2.566 11.899 -3.595
195 HE3 LYS 20 1HE LYS 20 -3.899 13.014 -3.344
196 HZ1 LYS 20 1HZ LYS 20 -2.398 14.501 -2.200
197 HZ2 LYS 20 2HZ LYS 20 -1.848 14.174 -3.761
198 HZ3 LYS 20 3HZ LYS 20 -1.098 13.444 -2.436
199 H SER 21 H SER 21 -0.967 7.255 -1.816
200 HA SER 21 HA SER 21 -0.736 6.078 -4.325
201 HB2 SER 21 2HB SER 21 1.667 6.728 -4.795
202 HB3 SER 21 1HB SER 21 0.503 8.035 -5.034
203 HG SER 21 HG SER 21 2.119 8.891 -3.913
204 H TYR 22 H TYR 22 1.279 4.558 -4.290
205 HA TYR 22 HA TYR 22 1.987 3.802 -1.532
206 HB2 TYR 22 2HB TYR 22 1.553 1.466 -1.976
207 HB3 TYR 22 1HB TYR 22 0.080 2.385 -2.220
208 HD1 TYR 22 1HD TYR 22 -1.057 2.220 -4.216
209 HD2 TYR 22 2HD TYR 22 2.900 0.752 -4.033
210 HE1 TYR 22 1HE TYR 22 -1.323 1.192 -6.424
211 HE2 TYR 22 2HE TYR 22 2.644 -0.265 -6.241
212 HH TYR 22 HH TYR 22 0.161 0.533 -8.256
213 H THR 23 H THR 23 3.643 2.112 -1.564
214 HA THR 23 HA THR 23 5.541 2.431 -3.779
215 HB THR 23 HB THR 23 6.071 2.099 -0.813
216 HG1 THR 23 1HG THR 23 7.076 4.216 -2.342
217 HG21 THR 23 1HG2 THR 23 7.707 0.854 -2.123
218 HG22 THR 23 2HG2 THR 23 8.473 2.274 -1.391
219 HG23 THR 23 3HG2 THR 23 8.040 2.279 -3.106
220 H ILE 24 H ILE 24 6.220 0.518 -4.652
221 HA ILE 24 HA ILE 24 5.033 -1.912 -3.648
222 HB ILE 24 HB ILE 24 6.905 -1.489 -6.005
223 HG12 ILE 24 2HG1 ILE 24 3.906 -1.854 -5.926
224 HG13 ILE 24 1HG1 ILE 24 4.752 -0.347 -6.283
225 HG21 ILE 24 1HG2 ILE 24 5.245 -3.901 -5.231
226 HG22 ILE 24 2HG2 ILE 24 7.002 -3.782 -5.157
227 HG23 ILE 24 3HG2 ILE 24 6.180 -3.740 -6.717
228 HD11 ILE 24 1HD1 ILE 24 4.846 -2.867 -7.924
229 HD12 ILE 24 2HD1 ILE 24 5.684 -1.361 -8.300
230 HD13 ILE 24 3HD1 ILE 24 3.921 -1.416 -8.303
231 H GLN 25 H GLN 25 5.995 -2.850 -1.992
232 HA GLN 25 HA GLN 25 8.860 -2.682 -1.731
233 HB2 GLN 25 2HB GLN 25 7.783 -2.387 0.308
234 HB3 GLN 25 1HB GLN 25 6.680 -3.718 0.106
235 HG2 GLN 25 2HG GLN 25 8.510 -5.274 0.382
236 HG3 GLN 25 1HG GLN 25 9.631 -3.921 0.550
237 HE21 GLN 25 1HE2 GLN 25 8.797 -6.080 2.421
238 HE22 GLN 25 2HE2 GLN 25 8.355 -5.250 3.856
239 H SER 26 H SER 26 10.068 -4.034 -2.647
240 HA SER 26 HA SER 26 9.004 -6.507 -3.622
241 HB2 SER 26 2HB SER 26 10.442 -5.119 -5.058
242 HB3 SER 26 1HB SER 26 11.757 -5.287 -3.899
243 HG SER 26 HG SER 26 12.026 -6.797 -5.494
244 H ASN 27 H ASN 27 9.291 -8.349 -2.641
245 HA ASN 27 HA ASN 27 10.585 -8.418 -0.097
246 HB2 ASN 27 2HB ASN 27 9.724 -10.646 0.065
247 HB3 ASN 27 1HB ASN 27 8.473 -9.524 -0.428
248 HD21 ASN 27 1HD2 ASN 27 8.378 -12.174 -0.658
249 HD22 ASN 27 2HD2 ASN 27 8.355 -12.616 -2.343
250 H GLU 28 H GLU 28 11.624 -8.662 -3.152
251 HA GLU 28 HA GLU 28 13.685 -10.590 -2.869
252 HB2 GLU 28 2HB GLU 28 13.446 -8.218 -4.727
253 HB3 GLU 28 1HB GLU 28 14.599 -9.533 -4.905
254 HG2 GLU 28 2HG GLU 28 12.772 -11.103 -5.257
255 HG3 GLU 28 1HG GLU 28 11.600 -9.812 -5.020
256 H ALA 29 H ALA 29 13.329 -7.128 -2.263
257 HA ALA 29 HA ALA 29 16.128 -6.964 -1.355
258 HB1 ALA 29 1HB ALA 29 15.911 -4.546 -1.577
259 HB2 ALA 29 2HB ALA 29 14.207 -4.728 -1.994
260 HB3 ALA 29 3HB ALA 29 15.449 -5.351 -3.078
261 H CYS 30 H CYS 30 12.835 -6.641 -0.266
262 HA CYS 30 HA CYS 30 13.742 -5.919 2.451
263 HB2 CYS 30 2HB CYS 30 10.933 -5.991 1.344
264 HB3 CYS 30 1HB CYS 30 11.442 -5.316 2.873
265 H ASN 31 H ASN 31 12.397 -7.089 4.176
266 HA ASN 31 HA ASN 31 12.911 -9.856 3.935
267 HB2 ASN 31 2HB ASN 31 12.919 -8.608 6.085
268 HB3 ASN 31 1HB ASN 31 11.187 -8.382 5.947
269 HD21 ASN 31 1HD2 ASN 31 12.813 -9.646 8.003
270 HD22 ASN 31 2HD2 ASN 31 12.200 -11.236 8.216
271 H ILE 32 H ILE 32 9.838 -8.065 4.001
272 HA ILE 32 HA ILE 32 8.539 -10.461 2.868
273 HB ILE 32 HB ILE 32 6.442 -9.752 3.919
274 HG12 ILE 32 2HG1 ILE 32 8.033 -7.451 5.083
275 HG13 ILE 32 1HG1 ILE 32 6.840 -7.312 3.799
276 HG21 ILE 32 1HG2 ILE 32 8.720 -9.678 5.843
277 HG22 ILE 32 2HG2 ILE 32 7.964 -11.154 5.224
278 HG23 ILE 32 3HG2 ILE 32 7.044 -10.047 6.268
279 HD11 ILE 32 1HD1 ILE 32 6.294 -8.219 6.619
280 HD12 ILE 32 2HD1 ILE 32 5.100 -8.046 5.335
281 HD13 ILE 32 3HD1 ILE 32 5.939 -6.625 5.950
282 H LYS 33 H LYS 33 6.424 -9.737 1.706
283 HA LYS 33 HA LYS 33 7.116 -7.495 0.047
284 HB2 LYS 33 2HB LYS 33 6.633 -9.574 -1.177
285 HB3 LYS 33 1HB LYS 33 5.066 -9.680 -0.391
286 HG2 LYS 33 2HG LYS 33 4.349 -7.638 -1.499
287 HG3 LYS 33 1HG LYS 33 5.927 -7.491 -2.257
288 HD2 LYS 33 2HD LYS 33 5.590 -9.579 -3.445
289 HD3 LYS 33 1HD LYS 33 4.030 -9.797 -2.644
290 HE2 LYS 33 2HE LYS 33 3.175 -7.792 -3.702
291 HE3 LYS 33 1HE LYS 33 4.745 -7.481 -4.438
292 HZ1 LYS 33 1HZ LYS 33 3.035 -9.849 -4.991
293 HZ2 LYS 33 2HZ LYS 33 4.524 -9.502 -5.694
294 HZ3 LYS 33 3HZ LYS 33 3.200 -8.519 -5.993
295 H ALA 34 H ALA 34 6.158 -5.639 0.961
296 HA ALA 34 HA ALA 34 3.350 -5.810 1.747
297 HB1 ALA 34 1HB ALA 34 4.668 -5.997 3.804
298 HB2 ALA 34 2HB ALA 34 3.800 -4.464 3.757
299 HB3 ALA 34 3HB ALA 34 5.525 -4.516 3.395
300 H ILE 35 H ILE 35 2.386 -4.451 0.390
301 HA ILE 35 HA ILE 35 3.699 -2.274 -0.905
302 HB ILE 35 HB ILE 35 0.727 -2.739 -0.513
303 HG12 ILE 35 2HG1 ILE 35 1.852 -4.601 -1.610
304 HG13 ILE 35 1HG1 ILE 35 0.761 -3.780 -2.728
305 HG21 ILE 35 1HG2 ILE 35 0.426 -1.281 -2.504
306 HG22 ILE 35 2HG2 ILE 35 2.148 -0.951 -2.498
307 HG23 ILE 35 3HG2 ILE 35 1.155 -0.429 -1.152
308 HD11 ILE 35 1HD1 ILE 35 2.779 -4.404 -3.843
309 HD12 ILE 35 2HD1 ILE 35 3.774 -3.584 -2.629
310 HD13 ILE 35 3HD1 ILE 35 2.734 -2.643 -3.697
311 H ILE 36 H ILE 36 4.013 -0.165 -0.212
312 HA ILE 36 HA ILE 36 2.916 0.392 2.442
313 HB ILE 36 HB ILE 36 5.114 1.976 1.073
314 HG12 ILE 36 2HG1 ILE 36 6.609 0.830 2.880
315 HG13 ILE 36 1HG1 ILE 36 5.342 -0.385 2.911
316 HG21 ILE 36 1HG2 ILE 36 3.952 3.193 2.792
317 HG22 ILE 36 2HG2 ILE 36 5.602 2.784 3.288
318 HG23 ILE 36 3HG2 ILE 36 4.238 1.868 3.934
319 HD11 ILE 36 1HD1 ILE 36 5.711 -0.826 0.573
320 HD12 ILE 36 2HD1 ILE 36 7.202 -0.981 1.531
321 HD13 ILE 36 3HD1 ILE 36 6.923 0.467 0.543
322 H PHE 37 H PHE 37 1.147 1.465 2.393
323 HA PHE 37 HA PHE 37 0.333 3.169 0.248
324 HB2 PHE 37 2HB PHE 37 -0.818 2.048 2.735
325 HB3 PHE 37 1HB PHE 37 -1.610 3.419 1.955
326 HD1 PHE 37 1HD PHE 37 -0.014 0.303 0.648
327 HD2 PHE 37 2HD PHE 37 -3.400 2.726 0.958
328 HE1 PHE 37 1HE PHE 37 -1.245 -1.241 -0.887
329 HE2 PHE 37 2HE PHE 37 -4.660 1.202 -0.577
330 HZ PHE 37 HZ PHE 37 -3.544 -0.770 -1.476
331 H THR 38 H THR 38 0.086 5.292 0.365
332 HA THR 38 HA THR 38 0.786 6.574 2.900
333 HB THR 38 HB THR 38 1.313 7.663 0.118
334 HG1 THR 38 1HG THR 38 2.556 5.838 1.509
335 HG21 THR 38 1HG2 THR 38 0.958 9.358 1.815
336 HG22 THR 38 2HG2 THR 38 2.662 9.324 1.361
337 HG23 THR 38 3HG2 THR 38 2.112 8.578 2.880
338 H THR 39 H THR 39 -0.732 8.101 3.654
339 HA THR 39 HA THR 39 -3.166 8.154 2.127
340 HB THR 39 HB THR 39 -3.988 9.314 4.233
341 HG1 THR 39 1HG THR 39 -2.494 8.560 6.048
342 HG21 THR 39 1HG2 THR 39 -4.473 6.965 3.762
343 HG22 THR 39 2HG2 THR 39 -4.167 7.192 5.484
344 HG23 THR 39 3HG2 THR 39 -2.920 6.492 4.451
345 H LYS 40 H LYS 40 -4.333 10.377 2.403
346 HA LYS 40 HA LYS 40 -2.758 12.345 1.148
347 HB2 LYS 40 2HB LYS 40 -5.260 12.778 2.712
348 HB3 LYS 40 1HB LYS 40 -4.670 13.834 1.428
349 HG2 LYS 40 2HG LYS 40 -4.961 11.532 -0.006
350 HG3 LYS 40 1HG LYS 40 -6.070 11.227 1.287
351 HD2 LYS 40 2HD LYS 40 -7.369 13.153 0.829
352 HD3 LYS 40 1HD LYS 40 -6.164 13.723 -0.341
353 HE2 LYS 40 2HE LYS 40 -6.580 11.765 -1.725
354 HE3 LYS 40 1HE LYS 40 -7.819 11.220 -0.602
355 HZ1 LYS 40 1HZ LYS 40 -9.090 13.235 -1.100
356 HZ2 LYS 40 2HZ LYS 40 -8.779 12.342 -2.492
357 HZ3 LYS 40 3HZ LYS 40 -7.896 13.734 -2.190
358 H LYS 41 H LYS 41 -3.122 11.416 4.370
359 HA LYS 41 HA LYS 41 -2.276 13.836 5.669
360 HB2 LYS 41 2HB LYS 41 -3.529 11.842 6.729
361 HB3 LYS 41 1HB LYS 41 -2.044 10.982 6.582
362 HG2 LYS 41 2HG LYS 41 -2.300 11.822 8.868
363 HG3 LYS 41 1HG LYS 41 -0.870 12.475 8.067
364 HD2 LYS 41 2HD LYS 41 -2.111 14.558 7.594
365 HD3 LYS 41 1HD LYS 41 -3.515 13.895 8.432
366 HE2 LYS 41 2HE LYS 41 -2.199 13.741 10.498
367 HE3 LYS 41 1HE LYS 41 -0.801 14.383 9.644
368 HZ1 LYS 41 1HZ LYS 41 -2.031 16.418 9.244
369 HZ2 LYS 41 2HZ LYS 41 -1.888 16.114 10.888
370 HZ3 LYS 41 3HZ LYS 41 -3.356 15.831 10.095
371 H GLY 42 H GLY 42 -0.928 11.351 3.854
372 HA2 GLY 42 2HA GLY 42 1.171 11.185 2.982
373 HA3 GLY 42 1HA GLY 42 1.689 12.468 4.041
374 H ARG 43 H ARG 43 0.099 9.919 5.622
375 HA ARG 43 HA ARG 43 2.555 9.069 6.901
376 HB2 ARG 43 2HB ARG 43 -0.276 8.172 7.215
377 HB3 ARG 43 1HB ARG 43 1.055 7.505 8.148
378 HG2 ARG 43 2HG ARG 43 1.468 9.813 9.049
379 HG3 ARG 43 1HG ARG 43 0.006 10.329 8.205
380 HD2 ARG 43 2HD ARG 43 -1.334 8.776 9.472
381 HD3 ARG 43 1HD ARG 43 0.105 8.112 10.237
382 HE ARG 43 HE ARG 43 0.003 10.853 10.734
383 HH11 ARG 43 1HH1 ARG 43 -1.796 7.900 11.595
384 HH12 ARG 43 2HH1 ARG 43 -2.267 8.462 13.120
385 HH21 ARG 43 1HH2 ARG 43 -0.652 11.618 12.883
386 HH22 ARG 43 2HH2 ARG 43 -1.589 10.604 13.867
387 H LYS 44 H LYS 44 3.138 6.790 7.100
388 HA LYS 44 HA LYS 44 2.711 5.404 4.565
389 HB2 LYS 44 2HB LYS 44 4.854 5.082 6.656
390 HB3 LYS 44 1HB LYS 44 4.748 4.146 5.175
391 HG2 LYS 44 2HG LYS 44 5.163 7.129 5.341
392 HG3 LYS 44 1HG LYS 44 6.411 5.922 5.010
393 HD2 LYS 44 2HD LYS 44 5.239 5.253 2.983
394 HD3 LYS 44 1HD LYS 44 3.965 6.426 3.317
395 HE2 LYS 44 2HE LYS 44 5.577 8.233 3.144
396 HE3 LYS 44 1HE LYS 44 6.864 7.071 2.816
397 HZ1 LYS 44 1HZ LYS 44 4.440 7.384 1.161
398 HZ2 LYS 44 2HZ LYS 44 5.766 6.444 0.788
399 HZ3 LYS 44 3HZ LYS 44 5.884 8.139 0.781
400 H ILE 45 H ILE 45 1.470 3.743 4.546
401 HA ILE 45 HA ILE 45 0.902 2.278 7.029
402 HB ILE 45 HB ILE 45 -0.953 2.609 4.638
403 HG12 ILE 45 2HG1 ILE 45 -2.468 3.892 6.257
404 HG13 ILE 45 1HG1 ILE 45 -1.072 4.003 7.335
405 HG21 ILE 45 1HG2 ILE 45 -1.437 1.331 7.306
406 HG22 ILE 45 2HG2 ILE 45 -1.274 0.519 5.750
407 HG23 ILE 45 3HG2 ILE 45 -2.655 1.572 6.056
408 HD11 ILE 45 1HD1 ILE 45 -1.471 6.023 6.086
409 HD12 ILE 45 2HD1 ILE 45 -1.308 5.133 4.573
410 HD13 ILE 45 3HD1 ILE 45 0.084 5.306 5.648
411 H CYS 46 H CYS 46 1.999 0.436 6.893
412 HA CYS 46 HA CYS 46 2.767 -0.808 4.408
413 HB2 CYS 46 2HB CYS 46 2.839 -1.911 7.220
414 HB3 CYS 46 1HB CYS 46 3.757 -2.532 5.880
415 H ALA 47 H ALA 47 1.314 -1.983 3.241
416 HA ALA 47 HA ALA 47 -0.846 -3.256 4.766
417 HB1 ALA 47 1HB ALA 47 -0.970 -2.139 1.975
418 HB2 ALA 47 2HB ALA 47 -1.612 -1.363 3.423
419 HB3 ALA 47 3HB ALA 47 -2.293 -2.891 2.865
420 H ASN 48 H ASN 48 -1.561 -5.249 4.164
421 HA ASN 48 HA ASN 48 0.321 -6.953 2.886
422 HB2 ASN 48 2HB ASN 48 -0.833 -7.878 4.672
423 HB3 ASN 48 1HB ASN 48 -2.408 -7.364 4.138
424 HD21 ASN 48 1HD2 ASN 48 0.156 -9.008 2.314
425 HD22 ASN 48 2HD2 ASN 48 -0.815 -10.426 2.007
426 HA PRO 49 HA PRO 49 -1.171 -5.958 -1.240
427 HB2 PRO 49 2HB PRO 49 0.330 -7.903 -2.456
428 HB3 PRO 49 1HB PRO 49 0.887 -6.259 -2.154
429 HG2 PRO 49 2HG PRO 49 1.444 -8.765 -0.641
430 HG3 PRO 49 1HG PRO 49 2.486 -7.360 -0.924
431 HD2 PRO 49 2HD PRO 49 1.292 -7.789 1.434
432 HD3 PRO 49 1HD PRO 49 1.558 -6.156 0.802
433 H ASN 50 H ASN 50 -1.244 -9.029 0.368
434 HA ASN 50 HA ASN 50 -2.703 -10.291 -1.684
435 HB2 ASN 50 2HB ASN 50 -2.198 -11.125 1.155
436 HB3 ASN 50 1HB ASN 50 -2.975 -12.127 -0.068
437 HD21 ASN 50 1HD2 ASN 50 -0.413 -12.337 1.419
438 HD22 ASN 50 2HD2 ASN 50 0.792 -12.616 0.215
439 H GLU 51 H GLU 51 -3.530 -7.959 0.570
440 HA GLU 51 HA GLU 51 -6.115 -8.993 1.221
441 HB2 GLU 51 2HB GLU 51 -5.080 -6.199 1.610
442 HB3 GLU 51 1HB GLU 51 -6.537 -6.870 2.322
443 HG2 GLU 51 2HG GLU 51 -4.895 -8.612 3.376
444 HG3 GLU 51 1HG GLU 51 -3.709 -7.449 2.861
445 H LYS 52 H LYS 52 -7.928 -8.624 0.310
446 HA LYS 52 HA LYS 52 -8.245 -8.055 -2.330
447 HB2 LYS 52 2HB LYS 52 -9.858 -9.204 -0.858
448 HB3 LYS 52 1HB LYS 52 -10.273 -7.662 -0.146
449 HG2 LYS 52 2HG LYS 52 -11.087 -6.888 -2.320
450 HG3 LYS 52 1HG LYS 52 -10.697 -8.465 -3.008
451 HD2 LYS 52 2HD LYS 52 -12.220 -9.523 -1.390
452 HD3 LYS 52 1HD LYS 52 -12.632 -7.925 -0.771
453 HE2 LYS 52 2HE LYS 52 -13.455 -7.307 -3.008
454 HE3 LYS 52 1HE LYS 52 -13.104 -8.944 -3.559
455 HZ1 LYS 52 1HZ LYS 52 -14.956 -8.237 -1.375
456 HZ2 LYS 52 2HZ LYS 52 -14.692 -9.798 -1.959
457 HZ3 LYS 52 3HZ LYS 52 -15.436 -8.641 -2.944
458 H TRP 53 H TRP 53 -8.578 -5.738 0.386
459 HA TRP 53 HA TRP 53 -9.579 -3.639 -1.247
460 HB2 TRP 53 2HB TRP 53 -9.284 -2.151 0.641
461 HB3 TRP 53 1HB TRP 53 -9.858 -3.687 1.257
462 HD1 TRP 53 HD TRP 53 -7.910 -5.228 2.566
463 HE1 TRP 53 1HE TRP 53 -5.862 -4.446 3.920
464 HE3 TRP 53 3HE TRP 53 -7.562 -0.413 0.869
465 HZ2 TRP 53 2HZ TRP 53 -4.342 -2.134 4.259
466 HZ3 TRP 53 3HZ TRP 53 -5.778 1.011 1.770
467 HH2 TRP 53 HH TRP 53 -4.202 0.169 3.430
468 H VAL 54 H VAL 54 -6.365 -4.651 -0.361
469 HA VAL 54 HA VAL 54 -4.985 -2.360 -1.285
470 HB VAL 54 HB VAL 54 -4.007 -5.208 -0.883
471 HG11 VAL 54 1HG1 VAL 54 -2.495 -2.665 -1.346
472 HG12 VAL 54 2HG1 VAL 54 -2.497 -4.081 -2.385
473 HG13 VAL 54 3HG1 VAL 54 -1.742 -4.146 -0.772
474 HG21 VAL 54 1HG2 VAL 54 -3.759 -2.771 0.854
475 HG22 VAL 54 2HG2 VAL 54 -3.075 -4.364 1.197
476 HG23 VAL 54 3HG2 VAL 54 -4.823 -4.143 1.144
477 H GLN 55 H GLN 55 -5.872 -5.424 -2.676
478 HA GLN 55 HA GLN 55 -4.481 -5.078 -5.076
479 HB2 GLN 55 2HB GLN 55 -6.838 -6.838 -4.481
480 HB3 GLN 55 1HB GLN 55 -5.803 -6.964 -5.912
481 HG2 GLN 55 2HG GLN 55 -3.859 -7.182 -4.411
482 HG3 GLN 55 1HG GLN 55 -4.963 -7.241 -3.055
483 HE21 GLN 55 1HE2 GLN 55 -3.031 -9.048 -3.900
484 HE22 GLN 55 2HE2 GLN 55 -3.779 -10.548 -4.232
485 H LYS 56 H LYS 56 -7.680 -4.109 -4.051
486 HA LYS 56 HA LYS 56 -8.525 -3.164 -6.626
487 HB2 LYS 56 2HB LYS 56 -9.448 -2.369 -3.858
488 HB3 LYS 56 1HB LYS 56 -10.192 -1.822 -5.347
489 HG2 LYS 56 2HG LYS 56 -10.798 -4.149 -5.869
490 HG3 LYS 56 1HG LYS 56 -10.086 -4.657 -4.332
491 HD2 LYS 56 2HD LYS 56 -11.637 -3.239 -3.115
492 HD3 LYS 56 1HD LYS 56 -12.317 -2.654 -4.631
493 HE2 LYS 56 2HE LYS 56 -13.057 -4.941 -5.158
494 HE3 LYS 56 1HE LYS 56 -12.401 -5.492 -3.617
495 HZ1 LYS 56 1HZ LYS 56 -14.815 -5.084 -3.510
496 HZ2 LYS 56 2HZ LYS 56 -14.558 -3.460 -3.894
497 HZ3 LYS 56 3HZ LYS 56 -13.964 -4.083 -2.465
498 H ALA 57 H ALA 57 -7.192 -1.633 -3.725
499 HA ALA 57 HA ALA 57 -7.123 0.992 -4.604
500 HB1 ALA 57 1HB ALA 57 -5.461 1.391 -2.862
501 HB2 ALA 57 2HB ALA 57 -5.205 -0.333 -2.666
502 HB3 ALA 57 3HB ALA 57 -6.777 0.377 -2.269
503 H MET 58 H MET 58 -4.626 -1.500 -4.903
504 HA MET 58 HA MET 58 -2.734 0.143 -5.992
505 HB2 MET 58 2HB MET 58 -3.064 -2.820 -6.262
506 HB3 MET 58 1HB MET 58 -1.693 -1.998 -6.982
507 HG2 MET 58 2HG MET 58 -1.223 -1.089 -4.657
508 HG3 MET 58 1HG MET 58 -2.423 -2.235 -4.079
509 HE1 MET 58 1HE MET 58 -0.718 -5.644 -5.015
510 HE2 MET 58 2HE MET 58 -1.858 -4.783 -6.054
511 HE3 MET 58 3HE MET 58 -2.153 -4.906 -4.307
512 H LYS 59 H LYS 59 -5.340 -1.528 -7.598
513 HA LYS 59 HA LYS 59 -4.389 -1.037 -10.231
514 HB2 LYS 59 2HB LYS 59 -7.217 -1.542 -9.273
515 HB3 LYS 59 1HB LYS 59 -6.686 -1.604 -10.949
516 HG2 LYS 59 2HG LYS 59 -5.199 -3.468 -10.420
517 HG3 LYS 59 1HG LYS 59 -5.697 -3.386 -8.734
518 HD2 LYS 59 2HD LYS 59 -8.012 -3.904 -9.424
519 HD3 LYS 59 1HD LYS 59 -7.461 -4.044 -11.094
520 HE2 LYS 59 2HE LYS 59 -5.934 -5.850 -10.438
521 HE3 LYS 59 1HE LYS 59 -6.495 -5.717 -8.773
522 HZ1 LYS 59 1HZ LYS 59 -8.724 -6.370 -9.537
523 HZ2 LYS 59 2HZ LYS 59 -7.579 -7.530 -9.928
524 HZ3 LYS 59 3HZ LYS 59 -8.162 -6.494 -11.107
525 H HIS 60 H HIS 60 -6.454 0.734 -8.017
526 HA HIS 60 HA HIS 60 -7.140 2.776 -9.869
527 HB2 HIS 60 2HB HIS 60 -8.609 2.301 -8.042
528 HB3 HIS 60 1HB HIS 60 -7.324 2.552 -6.869
529 HD1 HIS 60 1HD HIS 60 -9.686 4.435 -9.128
530 HD2 HIS 60 2HD HIS 60 -7.003 5.111 -6.066
531 HE1 HIS 60 1HE HIS 60 -10.081 6.809 -8.438
532 HE2 HIS 60 2HE HIS 60 -8.299 7.278 -6.722
533 H LEU 61 H LEU 61 -4.718 2.450 -7.331
534 HA LEU 61 HA LEU 61 -3.800 5.144 -7.537
535 HB2 LEU 61 2HB LEU 61 -2.613 2.732 -6.190
536 HB3 LEU 61 1HB LEU 61 -1.953 4.350 -6.059
537 HG LEU 61 HG LEU 61 -4.715 3.547 -5.134
538 HD11 LEU 61 1HD1 LEU 61 -2.175 3.959 -3.546
539 HD12 LEU 61 2HD1 LEU 61 -3.018 2.423 -3.796
540 HD13 LEU 61 3HD1 LEU 61 -3.783 3.704 -2.876
541 HD21 LEU 61 1HD2 LEU 61 -3.083 6.042 -4.681
542 HD22 LEU 61 2HD2 LEU 61 -4.662 5.708 -3.967
543 HD23 LEU 61 3HD2 LEU 61 -4.511 5.922 -5.714
544 H ASP 62 H ASP 62 -2.828 2.122 -9.060
545 HA ASP 62 HA ASP 62 -0.334 3.231 -10.016
546 HB2 ASP 62 2HB ASP 62 -0.646 0.774 -9.589
547 HB3 ASP 62 1HB ASP 62 -1.782 0.751 -10.915
548 H LYS 63 H LYS 63 -3.598 2.885 -11.165
549 HA LYS 63 HA LYS 63 -2.748 3.921 -13.711
550 HB2 LYS 63 2HB LYS 63 -5.289 2.488 -13.019
551 HB3 LYS 63 1HB LYS 63 -4.846 3.045 -14.626
552 HG2 LYS 63 2HG LYS 63 -2.885 1.550 -14.577
553 HG3 LYS 63 1HG LYS 63 -3.390 0.968 -13.007
554 HD2 LYS 63 2HD LYS 63 -5.107 0.725 -15.486
555 HD3 LYS 63 1HD LYS 63 -3.987 -0.519 -14.968
556 HE2 LYS 63 2HE LYS 63 -6.220 -1.123 -14.251
557 HE3 LYS 63 1HE LYS 63 -5.266 -0.721 -12.836
558 HZ1 LYS 63 1HZ LYS 63 -7.189 1.139 -14.133
559 HZ2 LYS 63 2HZ LYS 63 -6.418 1.375 -12.657
560 HZ3 LYS 63 3HZ LYS 63 -7.583 0.168 -12.842
561 H LYS 64 H LYS 64 -2.663 6.085 -12.705
562 HA LYS 64 HA LYS 64 -5.203 7.272 -13.072
563 HB2 LYS 64 2HB LYS 64 -4.883 8.740 -10.994
564 HB3 LYS 64 1HB LYS 64 -5.376 7.079 -10.736
565 HG2 LYS 64 2HG LYS 64 -3.825 7.448 -9.038
566 HG3 LYS 64 1HG LYS 64 -2.858 6.651 -10.269
567 HD2 LYS 64 2HD LYS 64 -2.061 8.896 -10.997
568 HD3 LYS 64 1HD LYS 64 -2.970 9.604 -9.663
569 HE2 LYS 64 2HE LYS 64 -0.656 9.359 -9.002
570 HE3 LYS 64 1HE LYS 64 -1.645 8.215 -8.097
571 HZ1 LYS 64 1HZ LYS 64 -0.943 6.453 -9.600
572 HZ2 LYS 64 2HZ LYS 64 0.421 7.207 -8.983
573 HZ3 LYS 64 3HZ LYS 64 -0.101 7.569 -10.530
Start of MODEL 18
1 H1 ALA 1 1HT ALA 1 10.676 1.428 12.908
2 H2 ALA 1 2HT ALA 1 10.981 0.792 11.386
3 H3 ALA 1 3HT ALA 1 9.971 2.124 11.544
4 HA ALA 1 HA ALA 1 11.758 3.498 12.293
5 HB1 ALA 1 1HB ALA 1 13.500 1.079 11.781
6 HB2 ALA 1 2HB ALA 1 13.092 1.731 13.367
7 HB3 ALA 1 3HB ALA 1 14.063 2.684 12.240
8 H ARG 2 H ARG 2 12.682 1.074 9.842
9 HA ARG 2 HA ARG 2 13.207 3.088 7.878
10 HB2 ARG 2 2HB ARG 2 14.453 0.922 8.047
11 HB3 ARG 2 1HB ARG 2 12.980 0.071 7.631
12 HG2 ARG 2 2HG ARG 2 13.001 1.066 5.416
13 HG3 ARG 2 1HG ARG 2 14.431 2.016 5.835
14 HD2 ARG 2 2HD ARG 2 15.680 -0.064 6.224
15 HD3 ARG 2 1HD ARG 2 14.263 -0.998 5.766
16 HE ARG 2 HE ARG 2 14.852 0.727 3.661
17 HH11 ARG 2 1HH1 ARG 2 16.382 -2.007 5.288
18 HH12 ARG 2 2HH1 ARG 2 17.220 -2.549 3.917
19 HH21 ARG 2 1HH2 ARG 2 15.994 -0.039 1.756
20 HH22 ARG 2 2HH2 ARG 2 16.982 -1.412 1.863
21 H LYS 3 H LYS 3 11.720 3.962 6.582
22 HA LYS 3 HA LYS 3 8.956 3.115 6.827
23 HB2 LYS 3 2HB LYS 3 10.201 5.353 5.266
24 HB3 LYS 3 1HB LYS 3 8.475 5.141 5.511
25 HG2 LYS 3 2HG LYS 3 8.815 5.512 7.926
26 HG3 LYS 3 1HG LYS 3 10.540 5.743 7.630
27 HD2 LYS 3 2HD LYS 3 8.303 7.442 6.499
28 HD3 LYS 3 1HD LYS 3 9.389 7.900 7.813
29 HE2 LYS 3 2HE LYS 3 11.302 7.753 6.258
30 HE3 LYS 3 1HE LYS 3 10.203 7.311 4.957
31 HZ1 LYS 3 1HZ LYS 3 10.758 9.640 4.861
32 HZ2 LYS 3 2HZ LYS 3 10.229 9.878 6.427
33 HZ3 LYS 3 3HZ LYS 3 9.118 9.494 5.231
34 H SER 4 H SER 4 11.553 2.780 4.648
35 HA SER 4 HA SER 4 10.030 2.425 2.263
36 HB2 SER 4 2HB SER 4 12.890 1.689 2.853
37 HB3 SER 4 1HB SER 4 12.162 1.912 1.260
38 HG SER 4 HG SER 4 12.699 3.900 1.466
39 H CYS 5 H CYS 5 10.895 0.364 4.890
40 HA CYS 5 HA CYS 5 9.882 -1.904 3.370
41 HB2 CYS 5 2HB CYS 5 12.285 -1.987 5.205
42 HB3 CYS 5 1HB CYS 5 11.498 -3.398 4.525
43 H CYS 6 H CYS 6 8.420 -3.035 4.410
44 HA CYS 6 HA CYS 6 7.926 -2.450 7.224
45 HB2 CYS 6 2HB CYS 6 6.174 -3.300 4.959
46 HB3 CYS 6 1HB CYS 6 5.629 -3.191 6.632
47 H LEU 7 H LEU 7 7.461 -4.200 8.521
48 HA LEU 7 HA LEU 7 7.997 -6.865 7.402
49 HB2 LEU 7 2HB LEU 7 8.573 -5.837 10.200
50 HB3 LEU 7 1HB LEU 7 8.707 -7.507 9.722
51 HG LEU 7 HG LEU 7 10.546 -6.826 8.135
52 HD11 LEU 7 1HD1 LEU 7 11.681 -4.702 8.488
53 HD12 LEU 7 2HD1 LEU 7 10.408 -4.201 9.600
54 HD13 LEU 7 3HD1 LEU 7 10.038 -4.464 7.896
55 HD21 LEU 7 1HD2 LEU 7 11.023 -7.840 10.278
56 HD22 LEU 7 2HD2 LEU 7 10.967 -6.261 11.061
57 HD23 LEU 7 3HD2 LEU 7 12.232 -6.618 9.886
58 H LYS 8 H LYS 8 5.570 -4.990 8.123
59 HA LYS 8 HA LYS 8 3.957 -7.085 9.315
60 HB2 LYS 8 2HB LYS 8 2.820 -5.381 10.609
61 HB3 LYS 8 1HB LYS 8 4.513 -5.515 11.098
62 HG2 LYS 8 2HG LYS 8 5.004 -3.515 9.697
63 HG3 LYS 8 1HG LYS 8 3.295 -3.397 9.324
64 HD2 LYS 8 2HD LYS 8 4.468 -3.217 12.100
65 HD3 LYS 8 1HD LYS 8 3.996 -1.842 11.111
66 HE2 LYS 8 2HE LYS 8 1.686 -2.661 11.078
67 HE3 LYS 8 1HE LYS 8 2.168 -4.042 12.060
68 HZ1 LYS 8 1HZ LYS 8 1.169 -2.313 13.382
69 HZ2 LYS 8 2HZ LYS 8 2.343 -1.204 12.903
70 HZ3 LYS 8 3HZ LYS 8 2.772 -2.556 13.820
71 H TYR 9 H TYR 9 1.667 -6.697 8.842
72 HA TYR 9 HA TYR 9 1.132 -4.772 6.683
73 HB2 TYR 9 2HB TYR 9 -0.534 -7.352 6.942
74 HB3 TYR 9 1HB TYR 9 -0.395 -6.198 5.689
75 HD1 TYR 9 1HD TYR 9 1.225 -6.272 4.047
76 HD2 TYR 9 2HD TYR 9 1.283 -9.066 7.203
77 HE1 TYR 9 1HE TYR 9 2.766 -7.684 2.753
78 HE2 TYR 9 2HE TYR 9 2.827 -10.496 5.932
79 HH TYR 9 HH TYR 9 4.366 -9.363 3.095
80 H THR 10 H THR 10 -0.845 -3.636 6.966
81 HA THR 10 HA THR 10 -1.549 -3.238 9.643
82 HB THR 10 HB THR 10 -1.599 -1.367 8.111
83 HG1 THR 10 1HG THR 10 -4.237 -1.182 8.393
84 HG21 THR 10 1HG2 THR 10 -3.304 -1.146 6.347
85 HG22 THR 10 2HG2 THR 10 -3.858 -2.786 6.689
86 HG23 THR 10 3HG2 THR 10 -2.230 -2.509 6.056
87 H LYS 11 H LYS 11 -3.346 -3.730 10.784
88 HA LYS 11 HA LYS 11 -4.919 -5.999 9.916
89 HB2 LYS 11 2HB LYS 11 -4.882 -4.450 12.509
90 HB3 LYS 11 1HB LYS 11 -5.845 -5.884 12.217
91 HG2 LYS 11 2HG LYS 11 -2.834 -5.783 12.128
92 HG3 LYS 11 1HG LYS 11 -3.789 -6.337 13.502
93 HD2 LYS 11 2HD LYS 11 -4.756 -8.108 12.062
94 HD3 LYS 11 1HD LYS 11 -3.723 -7.561 10.741
95 HE2 LYS 11 2HE LYS 11 -1.744 -8.070 12.046
96 HE3 LYS 11 1HE LYS 11 -2.743 -8.545 13.414
97 HZ1 LYS 11 1HZ LYS 11 -1.973 -10.465 12.171
98 HZ2 LYS 11 2HZ LYS 11 -2.724 -9.902 10.763
99 HZ3 LYS 11 3HZ LYS 11 -3.643 -10.342 12.099
100 H ARG 12 H ARG 12 -5.197 -2.623 9.970
101 HA ARG 12 HA ARG 12 -8.109 -2.806 9.644
102 HB2 ARG 12 2HB ARG 12 -7.501 -1.393 11.532
103 HB3 ARG 12 1HB ARG 12 -6.429 -0.446 10.511
104 HG2 ARG 12 2HG ARG 12 -8.344 0.348 9.218
105 HG3 ARG 12 1HG ARG 12 -9.425 -0.625 10.214
106 HD2 ARG 12 2HD ARG 12 -8.771 0.673 12.187
107 HD3 ARG 12 1HD ARG 12 -7.662 1.611 11.201
108 HE ARG 12 HE ARG 12 -9.913 2.039 9.898
109 HH11 ARG 12 1HH1 ARG 12 -9.396 2.112 13.421
110 HH12 ARG 12 2HH1 ARG 12 -10.549 3.341 13.678
111 HH21 ARG 12 1HH2 ARG 12 -11.474 3.749 10.313
112 HH22 ARG 12 2HH2 ARG 12 -11.744 4.276 11.902
113 HA PRO 13 HA PRO 13 -7.242 -1.851 5.336
114 HB2 PRO 13 2HB PRO 13 -10.170 -1.383 5.316
115 HB3 PRO 13 1HB PRO 13 -9.200 -2.440 4.292
116 HG2 PRO 13 2HG PRO 13 -10.763 -3.444 6.200
117 HG3 PRO 13 1HG PRO 13 -9.176 -4.149 5.846
118 HD2 PRO 13 2HD PRO 13 -9.987 -2.366 8.110
119 HD3 PRO 13 1HD PRO 13 -8.887 -3.768 8.077
120 H LEU 14 H LEU 14 -6.826 0.011 4.383
121 HA LEU 14 HA LEU 14 -7.602 2.526 5.630
122 HB2 LEU 14 2HB LEU 14 -5.203 1.977 5.078
123 HB3 LEU 14 1HB LEU 14 -5.656 1.918 3.396
124 HG LEU 14 HG LEU 14 -6.215 4.327 3.504
125 HD11 LEU 14 1HD1 LEU 14 -5.426 5.630 5.405
126 HD12 LEU 14 2HD1 LEU 14 -4.963 4.158 6.241
127 HD13 LEU 14 3HD1 LEU 14 -6.673 4.488 5.921
128 HD21 LEU 14 1HD2 LEU 14 -3.434 3.536 4.335
129 HD22 LEU 14 2HD2 LEU 14 -3.882 5.060 3.568
130 HD23 LEU 14 3HD2 LEU 14 -4.070 3.540 2.695
131 HA PRO 15 HA PRO 15 -10.622 2.969 2.257
132 HB2 PRO 15 2HB PRO 15 -10.603 5.843 2.911
133 HB3 PRO 15 1HB PRO 15 -11.945 4.698 2.986
134 HG2 PRO 15 2HG PRO 15 -10.824 5.673 5.221
135 HG3 PRO 15 1HG PRO 15 -11.413 4.005 5.126
136 HD2 PRO 15 2HD PRO 15 -8.612 5.036 4.920
137 HD3 PRO 15 1HD PRO 15 -9.239 3.617 5.795
138 H LEU 16 H LEU 16 -10.358 3.415 0.137
139 HA LEU 16 HA LEU 16 -7.860 4.269 -0.845
140 HB2 LEU 16 2HB LEU 16 -9.173 2.720 -2.093
141 HB3 LEU 16 1HB LEU 16 -10.491 3.882 -2.254
142 HG LEU 16 HG LEU 16 -8.929 5.265 -3.603
143 HD11 LEU 16 1HD1 LEU 16 -6.924 4.154 -4.522
144 HD12 LEU 16 2HD1 LEU 16 -7.188 2.821 -3.400
145 HD13 LEU 16 3HD1 LEU 16 -6.828 4.428 -2.786
146 HD21 LEU 16 1HD2 LEU 16 -9.504 2.478 -4.520
147 HD22 LEU 16 2HD2 LEU 16 -9.152 3.878 -5.567
148 HD23 LEU 16 3HD2 LEU 16 -10.592 3.880 -4.543
149 H LYS 17 H LYS 17 -10.851 5.852 -0.347
150 HA LYS 17 HA LYS 17 -10.514 8.244 -1.747
151 HB2 LYS 17 2HB LYS 17 -11.895 7.760 0.884
152 HB3 LYS 17 1HB LYS 17 -12.045 9.219 -0.084
153 HG2 LYS 17 2HG LYS 17 -13.076 7.958 -1.874
154 HG3 LYS 17 1HG LYS 17 -12.864 6.459 -0.972
155 HD2 LYS 17 2HD LYS 17 -15.163 7.316 -0.764
156 HD3 LYS 17 1HD LYS 17 -14.333 7.297 0.789
157 HE2 LYS 17 2HE LYS 17 -13.880 9.685 0.593
158 HE3 LYS 17 1HE LYS 17 -14.649 9.716 -0.993
159 HZ1 LYS 17 1HZ LYS 17 -16.724 9.110 0.071
160 HZ2 LYS 17 2HZ LYS 17 -16.121 10.524 0.730
161 HZ3 LYS 17 3HZ LYS 17 -15.978 9.069 1.580
162 H ARG 18 H ARG 18 -8.623 7.093 0.711
163 HA ARG 18 HA ARG 18 -7.861 9.828 1.635
164 HB2 ARG 18 2HB ARG 18 -9.089 8.195 3.241
165 HB3 ARG 18 1HB ARG 18 -7.576 7.315 3.241
166 HG2 ARG 18 2HG ARG 18 -7.753 8.710 5.187
167 HG3 ARG 18 1HG ARG 18 -6.450 9.296 4.142
168 HD2 ARG 18 2HD ARG 18 -7.779 11.089 3.345
169 HD3 ARG 18 1HD ARG 18 -9.245 10.412 4.050
170 HE ARG 18 HE ARG 18 -7.418 10.841 6.082
171 HH11 ARG 18 1HH1 ARG 18 -9.189 12.862 3.738
172 HH12 ARG 18 2HH1 ARG 18 -9.473 14.118 4.829
173 HH21 ARG 18 1HH2 ARG 18 -7.845 12.561 7.583
174 HH22 ARG 18 2HH2 ARG 18 -8.681 13.961 7.084
175 H ILE 19 H ILE 19 -6.834 7.504 -0.331
176 HA ILE 19 HA ILE 19 -4.062 7.396 0.661
177 HB ILE 19 HB ILE 19 -5.334 5.655 -1.485
178 HG12 ILE 19 2HG1 ILE 19 -4.746 4.956 1.361
179 HG13 ILE 19 1HG1 ILE 19 -6.371 5.356 0.836
180 HG21 ILE 19 1HG2 ILE 19 -2.776 5.381 0.120
181 HG22 ILE 19 2HG2 ILE 19 -2.867 5.783 -1.600
182 HG23 ILE 19 3HG2 ILE 19 -3.380 4.196 -1.025
183 HD11 ILE 19 1HD1 ILE 19 -6.210 3.425 -0.766
184 HD12 ILE 19 2HD1 ILE 19 -6.121 2.962 0.943
185 HD13 ILE 19 3HD1 ILE 19 -4.670 3.049 -0.050
186 H LYS 20 H LYS 20 -2.492 8.360 -0.515
187 HA LYS 20 HA LYS 20 -3.268 9.718 -2.932
188 HB2 LYS 20 2HB LYS 20 -0.653 9.839 -1.433
189 HB3 LYS 20 1HB LYS 20 -1.074 10.861 -2.783
190 HG2 LYS 20 2HG LYS 20 -2.298 10.771 -0.101
191 HG3 LYS 20 1HG LYS 20 -1.357 12.080 -0.809
192 HD2 LYS 20 2HD LYS 20 -4.126 11.145 -1.559
193 HD3 LYS 20 1HD LYS 20 -3.697 12.590 -0.729
194 HE2 LYS 20 2HE LYS 20 -4.220 13.245 -2.998
195 HE3 LYS 20 1HE LYS 20 -2.520 13.522 -2.669
196 HZ1 LYS 20 1HZ LYS 20 -2.863 12.668 -4.853
197 HZ2 LYS 20 2HZ LYS 20 -3.679 11.312 -4.314
198 HZ3 LYS 20 3HZ LYS 20 -2.016 11.520 -4.024
199 H SER 21 H SER 21 -0.871 7.236 -1.865
200 HA SER 21 HA SER 21 -0.602 6.176 -4.499
201 HB2 SER 21 2HB SER 21 1.778 7.632 -3.296
202 HB3 SER 21 1HB SER 21 1.791 6.683 -4.775
203 HG SER 21 HG SER 21 -0.107 8.419 -5.121
204 H TYR 22 H TYR 22 1.218 4.466 -4.398
205 HA TYR 22 HA TYR 22 1.783 3.620 -1.656
206 HB2 TYR 22 2HB TYR 22 1.351 1.313 -2.188
207 HB3 TYR 22 1HB TYR 22 -0.099 2.251 -2.475
208 HD1 TYR 22 1HD TYR 22 -1.166 2.095 -4.516
209 HD2 TYR 22 2HD TYR 22 2.793 0.646 -4.215
210 HE1 TYR 22 1HE TYR 22 -1.373 1.064 -6.724
211 HE2 TYR 22 2HE TYR 22 2.609 -0.369 -6.441
212 HH TYR 22 HH TYR 22 0.188 0.399 -8.553
213 H THR 23 H THR 23 3.464 2.036 -1.575
214 HA THR 23 HA THR 23 5.476 2.392 -3.691
215 HB THR 23 HB THR 23 5.888 1.914 -0.729
216 HG1 THR 23 1HG THR 23 5.763 4.141 -2.341
217 HG21 THR 23 1HG2 THR 23 7.610 0.885 -2.108
218 HG22 THR 23 2HG2 THR 23 8.277 2.266 -1.222
219 HG23 THR 23 3HG2 THR 23 7.890 2.413 -2.944
220 H ILE 24 H ILE 24 6.216 0.534 -4.591
221 HA ILE 24 HA ILE 24 5.000 -1.947 -3.773
222 HB ILE 24 HB ILE 24 6.986 -1.407 -6.004
223 HG12 ILE 24 2HG1 ILE 24 3.993 -1.773 -6.102
224 HG13 ILE 24 1HG1 ILE 24 4.820 -0.224 -6.266
225 HG21 ILE 24 1HG2 ILE 24 5.256 -3.830 -5.454
226 HG22 ILE 24 2HG2 ILE 24 7.012 -3.750 -5.283
227 HG23 ILE 24 3HG2 ILE 24 6.271 -3.599 -6.877
228 HD11 ILE 24 1HD1 ILE 24 5.009 -2.579 -8.140
229 HD12 ILE 24 2HD1 ILE 24 5.901 -1.066 -8.306
230 HD13 ILE 24 3HD1 ILE 24 4.142 -1.067 -8.422
231 H GLN 25 H GLN 25 5.883 -2.795 -1.980
232 HA GLN 25 HA GLN 25 8.743 -2.786 -1.720
233 HB2 GLN 25 2HB GLN 25 7.667 -2.294 0.301
234 HB3 GLN 25 1HB GLN 25 6.546 -3.631 0.176
235 HG2 GLN 25 2HG GLN 25 8.365 -5.187 0.506
236 HG3 GLN 25 1HG GLN 25 9.496 -3.838 0.605
237 HE21 GLN 25 1HE2 GLN 25 8.666 -5.919 2.506
238 HE22 GLN 25 2HE2 GLN 25 8.237 -5.087 3.953
239 H SER 26 H SER 26 9.884 -4.238 -2.445
240 HA SER 26 HA SER 26 8.744 -6.804 -3.211
241 HB2 SER 26 2HB SER 26 10.784 -6.921 -4.651
242 HB3 SER 26 1HB SER 26 9.761 -5.534 -4.993
243 HG SER 26 HG SER 26 11.451 -4.734 -3.137
244 H ASN 27 H ASN 27 9.669 -8.715 -2.443
245 HA ASN 27 HA ASN 27 11.047 -8.409 0.031
246 HB2 ASN 27 2HB ASN 27 10.902 -10.893 0.257
247 HB3 ASN 27 1HB ASN 27 9.365 -10.065 0.077
248 HD21 ASN 27 1HD2 ASN 27 8.295 -11.776 -0.644
249 HD22 ASN 27 2HD2 ASN 27 8.597 -12.475 -2.191
250 H GLU 28 H GLU 28 12.099 -8.542 -3.023
251 HA GLU 28 HA GLU 28 14.555 -9.908 -2.618
252 HB2 GLU 28 2HB GLU 28 15.295 -8.783 -4.694
253 HB3 GLU 28 1HB GLU 28 13.728 -9.551 -4.882
254 HG2 GLU 28 2HG GLU 28 12.648 -7.379 -4.605
255 HG3 GLU 28 1HG GLU 28 14.225 -6.621 -4.435
256 H ALA 29 H ALA 29 13.405 -6.667 -2.012
257 HA ALA 29 HA ALA 29 16.101 -5.868 -1.168
258 HB1 ALA 29 1HB ALA 29 15.377 -3.558 -1.418
259 HB2 ALA 29 2HB ALA 29 13.752 -4.102 -1.833
260 HB3 ALA 29 3HB ALA 29 15.105 -4.464 -2.906
261 H CYS 30 H CYS 30 12.814 -6.297 -0.046
262 HA CYS 30 HA CYS 30 13.641 -5.387 2.632
263 HB2 CYS 30 2HB CYS 30 10.885 -5.435 1.412
264 HB3 CYS 30 1HB CYS 30 11.271 -4.909 3.040
265 H ASN 31 H ASN 31 12.363 -6.503 4.390
266 HA ASN 31 HA ASN 31 12.955 -9.214 4.432
267 HB2 ASN 31 2HB ASN 31 10.953 -7.720 6.122
268 HB3 ASN 31 1HB ASN 31 11.605 -9.310 6.495
269 HD21 ASN 31 1HD2 ASN 31 13.736 -9.472 7.199
270 HD22 ASN 31 2HD2 ASN 31 14.633 -8.112 7.734
271 H ILE 32 H ILE 32 9.845 -7.645 3.785
272 HA ILE 32 HA ILE 32 8.880 -10.200 2.720
273 HB ILE 32 HB ILE 32 6.640 -9.807 3.645
274 HG12 ILE 32 2HG1 ILE 32 7.868 -7.436 5.074
275 HG13 ILE 32 1HG1 ILE 32 6.750 -7.338 3.723
276 HG21 ILE 32 1HG2 ILE 32 8.767 -9.667 5.744
277 HG22 ILE 32 2HG2 ILE 32 8.182 -11.149 4.971
278 HG23 ILE 32 3HG2 ILE 32 7.110 -10.208 6.027
279 HD11 ILE 32 1HD1 ILE 32 6.153 -8.481 6.440
280 HD12 ILE 32 2HD1 ILE 32 5.020 -8.386 5.091
281 HD13 ILE 32 3HD1 ILE 32 5.640 -6.908 5.834
282 H LYS 33 H LYS 33 6.710 -9.673 1.545
283 HA LYS 33 HA LYS 33 7.105 -7.261 -0.053
284 HB2 LYS 33 2HB LYS 33 6.880 -9.412 -1.254
285 HB3 LYS 33 1HB LYS 33 5.326 -9.672 -0.482
286 HG2 LYS 33 2HG LYS 33 4.453 -7.662 -1.612
287 HG3 LYS 33 1HG LYS 33 6.007 -7.470 -2.418
288 HD2 LYS 33 2HD LYS 33 5.753 -9.669 -3.443
289 HD3 LYS 33 1HD LYS 33 4.189 -9.864 -2.650
290 HE2 LYS 33 2HE LYS 33 3.370 -7.877 -3.860
291 HE3 LYS 33 1HE LYS 33 4.927 -7.755 -4.681
292 HZ1 LYS 33 1HZ LYS 33 3.004 -9.990 -4.855
293 HZ2 LYS 33 2HZ LYS 33 4.511 -10.001 -5.598
294 HZ3 LYS 33 3HZ LYS 33 3.334 -8.875 -6.068
295 H ALA 34 H ALA 34 6.030 -5.562 0.816
296 HA ALA 34 HA ALA 34 3.239 -5.898 1.582
297 HB1 ALA 34 1HB ALA 34 4.503 -6.070 3.702
298 HB2 ALA 34 2HB ALA 34 3.580 -4.579 3.648
299 HB3 ALA 34 3HB ALA 34 5.314 -4.552 3.342
300 H ILE 35 H ILE 35 2.288 -4.539 0.175
301 HA ILE 35 HA ILE 35 3.582 -2.319 -1.023
302 HB ILE 35 HB ILE 35 0.605 -2.854 -0.740
303 HG12 ILE 35 2HG1 ILE 35 1.817 -4.685 -1.824
304 HG13 ILE 35 1HG1 ILE 35 0.731 -3.872 -2.951
305 HG21 ILE 35 1HG2 ILE 35 0.369 -1.379 -2.744
306 HG22 ILE 35 2HG2 ILE 35 2.083 -1.032 -2.654
307 HG23 ILE 35 3HG2 ILE 35 1.022 -0.535 -1.347
308 HD11 ILE 35 1HD1 ILE 35 2.771 -4.419 -4.033
309 HD12 ILE 35 2HD1 ILE 35 3.739 -3.595 -2.793
310 HD13 ILE 35 3HD1 ILE 35 2.679 -2.674 -3.875
311 H ILE 36 H ILE 36 3.876 -0.272 -0.276
312 HA ILE 36 HA ILE 36 2.730 0.279 2.350
313 HB ILE 36 HB ILE 36 4.897 1.894 0.955
314 HG12 ILE 36 2HG1 ILE 36 6.375 0.946 2.858
315 HG13 ILE 36 1HG1 ILE 36 5.146 -0.301 2.995
316 HG21 ILE 36 1HG2 ILE 36 3.662 3.204 2.516
317 HG22 ILE 36 2HG2 ILE 36 5.298 2.864 3.111
318 HG23 ILE 36 3HG2 ILE 36 3.917 1.977 3.771
319 HD11 ILE 36 1HD1 ILE 36 5.543 -0.932 0.702
320 HD12 ILE 36 2HD1 ILE 36 7.020 -0.991 1.689
321 HD13 ILE 36 3HD1 ILE 36 6.741 0.363 0.579
322 H PHE 37 H PHE 37 0.961 1.301 2.343
323 HA PHE 37 HA PHE 37 0.078 3.011 0.187
324 HB2 PHE 37 2HB PHE 37 -1.080 1.927 2.719
325 HB3 PHE 37 1HB PHE 37 -1.885 3.260 1.877
326 HD1 PHE 37 1HD PHE 37 -0.097 0.568 0.227
327 HD2 PHE 37 2HD PHE 37 -3.848 2.042 1.388
328 HE1 PHE 37 1HE PHE 37 -1.223 -1.077 -1.296
329 HE2 PHE 37 2HE PHE 37 -4.975 0.445 -0.087
330 HZ PHE 37 HZ PHE 37 -3.656 -1.109 -1.432
331 H THR 38 H THR 38 -0.105 5.105 0.264
332 HA THR 38 HA THR 38 0.893 6.415 2.678
333 HB THR 38 HB THR 38 1.215 7.352 -0.189
334 HG1 THR 38 1HG THR 38 2.475 5.470 1.152
335 HG21 THR 38 1HG2 THR 38 1.205 9.126 1.433
336 HG22 THR 38 2HG2 THR 38 2.851 8.904 0.841
337 HG23 THR 38 3HG2 THR 38 2.363 8.281 2.439
338 H THR 39 H THR 39 -0.461 7.976 3.493
339 HA THR 39 HA THR 39 -3.028 8.210 2.181
340 HB THR 39 HB THR 39 -3.641 9.469 4.277
341 HG1 THR 39 1HG THR 39 -2.137 8.744 6.036
342 HG21 THR 39 1HG2 THR 39 -4.269 7.159 3.925
343 HG22 THR 39 2HG2 THR 39 -3.839 7.401 5.612
344 HG23 THR 39 3HG2 THR 39 -2.698 6.621 4.517
345 H LYS 40 H LYS 40 -4.063 10.462 2.540
346 HA LYS 40 HA LYS 40 -2.585 12.337 1.030
347 HB2 LYS 40 2HB LYS 40 -4.871 12.939 2.828
348 HB3 LYS 40 1HB LYS 40 -4.413 13.847 1.387
349 HG2 LYS 40 2HG LYS 40 -4.954 11.456 0.196
350 HG3 LYS 40 1HG LYS 40 -5.865 11.276 1.655
351 HD2 LYS 40 2HD LYS 40 -7.186 13.232 1.231
352 HD3 LYS 40 1HD LYS 40 -6.123 13.606 -0.144
353 HE2 LYS 40 2HE LYS 40 -6.811 11.664 -1.322
354 HE3 LYS 40 1HE LYS 40 -7.786 11.120 0.032
355 HZ1 LYS 40 1HZ LYS 40 -9.236 13.003 -0.257
356 HZ2 LYS 40 2HZ LYS 40 -9.126 12.138 -1.694
357 HZ3 LYS 40 3HZ LYS 40 -8.305 13.613 -1.520
358 H LYS 41 H LYS 41 -2.531 11.650 4.343
359 HA LYS 41 HA LYS 41 -1.235 14.149 5.006
360 HB2 LYS 41 2HB LYS 41 -1.810 11.649 6.591
361 HB3 LYS 41 1HB LYS 41 -0.716 12.876 7.204
362 HG2 LYS 41 2HG LYS 41 -2.940 13.100 8.148
363 HG3 LYS 41 1HG LYS 41 -2.513 14.513 7.192
364 HD2 LYS 41 2HD LYS 41 -3.872 13.635 5.335
365 HD3 LYS 41 1HD LYS 41 -4.298 12.239 6.322
366 HE2 LYS 41 2HE LYS 41 -6.073 13.906 6.342
367 HE3 LYS 41 1HE LYS 41 -5.375 13.700 7.945
368 HZ1 LYS 41 1HZ LYS 41 -4.750 15.910 6.058
369 HZ2 LYS 41 2HZ LYS 41 -4.097 15.723 7.612
370 HZ3 LYS 41 3HZ LYS 41 -5.745 16.010 7.413
371 H GLY 42 H GLY 42 -0.465 11.413 3.434
372 HA2 GLY 42 2HA GLY 42 1.487 10.863 2.460
373 HA3 GLY 42 1HA GLY 42 2.252 12.168 3.325
374 H ARG 43 H ARG 43 0.508 10.008 5.246
375 HA ARG 43 HA ARG 43 2.863 9.053 6.586
376 HB2 ARG 43 2HB ARG 43 0.000 8.272 6.825
377 HB3 ARG 43 1HB ARG 43 1.266 7.765 7.943
378 HG2 ARG 43 2HG ARG 43 1.617 10.159 8.533
379 HG3 ARG 43 1HG ARG 43 0.266 10.580 7.481
380 HD2 ARG 43 2HD ARG 43 -1.191 9.129 8.836
381 HD3 ARG 43 1HD ARG 43 0.160 8.821 9.920
382 HE ARG 43 HE ARG 43 -0.174 11.578 9.712
383 HH11 ARG 43 1HH1 ARG 43 -1.904 8.793 11.010
384 HH12 ARG 43 2HH1 ARG 43 -2.712 9.703 12.213
385 HH21 ARG 43 1HH2 ARG 43 -1.314 12.808 11.324
386 HH22 ARG 43 2HH2 ARG 43 -2.388 12.005 12.390
387 H LYS 44 H LYS 44 3.313 6.752 6.900
388 HA LYS 44 HA LYS 44 2.801 5.284 4.417
389 HB2 LYS 44 2HB LYS 44 5.085 4.995 6.378
390 HB3 LYS 44 1HB LYS 44 4.871 4.025 4.931
391 HG2 LYS 44 2HG LYS 44 5.371 7.005 5.034
392 HG3 LYS 44 1HG LYS 44 6.526 5.764 4.542
393 HD2 LYS 44 2HD LYS 44 5.056 5.169 2.653
394 HD3 LYS 44 1HD LYS 44 3.920 6.416 3.148
395 HE2 LYS 44 2HE LYS 44 5.263 7.225 1.326
396 HE3 LYS 44 1HE LYS 44 5.657 8.114 2.793
397 HZ1 LYS 44 1HZ LYS 44 7.229 5.858 1.680
398 HZ2 LYS 44 2HZ LYS 44 7.677 6.756 3.023
399 HZ3 LYS 44 3HZ LYS 44 7.642 7.447 1.482
400 H ILE 45 H ILE 45 1.509 3.659 4.464
401 HA ILE 45 HA ILE 45 0.929 2.263 6.985
402 HB ILE 45 HB ILE 45 -0.810 2.533 4.505
403 HG12 ILE 45 2HG1 ILE 45 -2.415 3.788 6.139
404 HG13 ILE 45 1HG1 ILE 45 -1.008 3.920 7.176
405 HG21 ILE 45 1HG2 ILE 45 -1.431 1.220 7.139
406 HG22 ILE 45 2HG2 ILE 45 -1.192 0.424 5.583
407 HG23 ILE 45 3HG2 ILE 45 -2.591 1.471 5.833
408 HD11 ILE 45 1HD1 ILE 45 -1.407 5.929 5.948
409 HD12 ILE 45 2HD1 ILE 45 -1.255 5.053 4.424
410 HD13 ILE 45 3HD1 ILE 45 0.144 5.212 5.495
411 H CYS 46 H CYS 46 1.504 0.186 6.977
412 HA CYS 46 HA CYS 46 2.583 -1.028 4.540
413 HB2 CYS 46 2HB CYS 46 2.505 -2.075 7.371
414 HB3 CYS 46 1HB CYS 46 3.493 -2.691 6.054
415 H ALA 47 H ALA 47 1.195 -2.121 3.245
416 HA ALA 47 HA ALA 47 -1.047 -3.436 4.606
417 HB1 ALA 47 1HB ALA 47 -1.064 -2.172 1.875
418 HB2 ALA 47 2HB ALA 47 -1.745 -1.461 3.336
419 HB3 ALA 47 3HB ALA 47 -2.427 -2.949 2.680
420 H ASN 48 H ASN 48 -1.729 -5.420 3.905
421 HA ASN 48 HA ASN 48 0.172 -7.081 2.626
422 HB2 ASN 48 2HB ASN 48 -1.015 -7.993 4.420
423 HB3 ASN 48 1HB ASN 48 -2.580 -7.531 3.816
424 HD21 ASN 48 1HD2 ASN 48 0.096 -9.133 2.095
425 HD22 ASN 48 2HD2 ASN 48 -0.819 -10.558 1.759
426 HA PRO 49 HA PRO 49 -1.327 -6.058 -1.498
427 HB2 PRO 49 2HB PRO 49 0.265 -7.942 -2.717
428 HB3 PRO 49 1HB PRO 49 0.730 -6.271 -2.429
429 HG2 PRO 49 2HG PRO 49 1.442 -8.730 -0.926
430 HG3 PRO 49 1HG PRO 49 2.391 -7.256 -1.172
431 HD2 PRO 49 2HD PRO 49 1.172 -7.829 1.170
432 HD3 PRO 49 1HD PRO 49 1.383 -6.168 0.603
433 H ASN 50 H ASN 50 -1.307 -9.096 0.089
434 HA ASN 50 HA ASN 50 -2.659 -10.496 -1.949
435 HB2 ASN 50 2HB ASN 50 -2.557 -11.204 0.988
436 HB3 ASN 50 1HB ASN 50 -3.152 -12.201 -0.340
437 HD21 ASN 50 1HD2 ASN 50 -0.982 -11.437 -2.176
438 HD22 ASN 50 2HD2 ASN 50 0.407 -12.265 -1.571
439 H GLU 51 H GLU 51 -3.648 -8.160 0.352
440 HA GLU 51 HA GLU 51 -6.280 -9.207 0.704
441 HB2 GLU 51 2HB GLU 51 -5.298 -6.456 1.397
442 HB3 GLU 51 1HB GLU 51 -6.796 -7.192 1.932
443 HG2 GLU 51 2HG GLU 51 -5.094 -9.013 2.886
444 HG3 GLU 51 1HG GLU 51 -4.031 -7.643 2.748
445 H LYS 52 H LYS 52 -8.033 -8.762 -0.297
446 HA LYS 52 HA LYS 52 -8.078 -7.887 -2.900
447 HB2 LYS 52 2HB LYS 52 -9.786 -9.308 -1.932
448 HB3 LYS 52 1HB LYS 52 -10.303 -8.011 -0.875
449 HG2 LYS 52 2HG LYS 52 -11.075 -6.735 -2.798
450 HG3 LYS 52 1HG LYS 52 -10.540 -8.032 -3.875
451 HD2 LYS 52 2HD LYS 52 -12.077 -9.585 -2.808
452 HD3 LYS 52 1HD LYS 52 -12.567 -8.334 -1.665
453 HE2 LYS 52 2HE LYS 52 -13.473 -7.009 -3.489
454 HE3 LYS 52 1HE LYS 52 -12.941 -8.217 -4.653
455 HZ1 LYS 52 1HZ LYS 52 -14.906 -8.692 -2.481
456 HZ2 LYS 52 2HZ LYS 52 -14.435 -9.806 -3.664
457 HZ3 LYS 52 3HZ LYS 52 -15.287 -8.430 -4.100
458 H TRP 53 H TRP 53 -8.730 -6.009 0.055
459 HA TRP 53 HA TRP 53 -9.689 -3.739 -1.327
460 HB2 TRP 53 2HB TRP 53 -9.475 -2.467 0.733
461 HB3 TRP 53 1HB TRP 53 -10.095 -4.057 1.112
462 HD1 TRP 53 HD TRP 53 -8.387 -5.716 2.525
463 HE1 TRP 53 1HE TRP 53 -6.401 -5.138 4.027
464 HE3 TRP 53 3HE TRP 53 -7.539 -0.895 1.025
465 HZ2 TRP 53 2HZ TRP 53 -4.703 -2.993 4.533
466 HZ3 TRP 53 3HZ TRP 53 -5.705 0.334 2.071
467 HH2 TRP 53 HH TRP 53 -4.309 -0.691 3.797
468 H VAL 54 H VAL 54 -6.506 -4.804 -0.511
469 HA VAL 54 HA VAL 54 -5.142 -2.396 -1.106
470 HB VAL 54 HB VAL 54 -4.163 -5.269 -0.961
471 HG11 VAL 54 1HG1 VAL 54 -2.546 -2.725 -1.095
472 HG12 VAL 54 2HG1 VAL 54 -2.625 -3.959 -2.348
473 HG13 VAL 54 3HG1 VAL 54 -1.894 -4.320 -0.776
474 HG21 VAL 54 1HG2 VAL 54 -3.941 -2.987 0.975
475 HG22 VAL 54 2HG2 VAL 54 -3.276 -4.606 1.199
476 HG23 VAL 54 3HG2 VAL 54 -5.024 -4.365 1.122
477 H GLN 55 H GLN 55 -5.934 -5.313 -2.844
478 HA GLN 55 HA GLN 55 -4.466 -4.720 -5.138
479 HB2 GLN 55 2HB GLN 55 -6.887 -6.483 -4.912
480 HB3 GLN 55 1HB GLN 55 -5.689 -6.513 -6.209
481 HG2 GLN 55 2HG GLN 55 -3.956 -6.891 -4.426
482 HG3 GLN 55 1HG GLN 55 -5.292 -7.177 -3.324
483 HE21 GLN 55 1HE2 GLN 55 -3.229 -8.870 -4.031
484 HE22 GLN 55 2HE2 GLN 55 -3.881 -10.250 -4.813
485 H LYS 56 H LYS 56 -7.808 -4.121 -4.206
486 HA LYS 56 HA LYS 56 -8.739 -2.989 -6.594
487 HB2 LYS 56 2HB LYS 56 -9.604 -2.551 -3.758
488 HB3 LYS 56 1HB LYS 56 -10.460 -1.917 -5.158
489 HG2 LYS 56 2HG LYS 56 -10.895 -4.127 -5.971
490 HG3 LYS 56 1HG LYS 56 -9.902 -4.832 -4.695
491 HD2 LYS 56 2HD LYS 56 -12.218 -5.043 -4.139
492 HD3 LYS 56 1HD LYS 56 -11.397 -3.915 -3.042
493 HE2 LYS 56 2HE LYS 56 -13.601 -3.044 -3.645
494 HE3 LYS 56 1HE LYS 56 -12.337 -2.020 -4.311
495 HZ1 LYS 56 1HZ LYS 56 -12.677 -3.155 -6.480
496 HZ2 LYS 56 2HZ LYS 56 -14.082 -2.420 -5.920
497 HZ3 LYS 56 3HZ LYS 56 -13.890 -4.073 -5.786
498 H ALA 57 H ALA 57 -7.048 -1.648 -3.830
499 HA ALA 57 HA ALA 57 -7.259 1.099 -4.601
500 HB1 ALA 57 1HB ALA 57 -5.553 1.491 -2.896
501 HB2 ALA 57 2HB ALA 57 -5.254 -0.236 -2.771
502 HB3 ALA 57 3HB ALA 57 -6.815 0.423 -2.270
503 H MET 58 H MET 58 -4.789 -1.349 -4.957
504 HA MET 58 HA MET 58 -2.919 0.290 -6.097
505 HB2 MET 58 2HB MET 58 -3.180 -2.698 -6.378
506 HB3 MET 58 1HB MET 58 -1.823 -1.784 -7.025
507 HG2 MET 58 2HG MET 58 -1.397 -0.954 -4.701
508 HG3 MET 58 1HG MET 58 -2.618 -2.096 -4.141
509 HE1 MET 58 1HE MET 58 -0.890 -5.507 -5.040
510 HE2 MET 58 2HE MET 58 -2.047 -4.646 -6.064
511 HE3 MET 58 3HE MET 58 -2.324 -4.773 -4.315
512 H LYS 59 H LYS 59 -5.501 -1.491 -7.624
513 HA LYS 59 HA LYS 59 -4.719 -1.082 -10.292
514 HB2 LYS 59 2HB LYS 59 -7.509 -1.225 -9.139
515 HB3 LYS 59 1HB LYS 59 -7.133 -1.311 -10.855
516 HG2 LYS 59 2HG LYS 59 -5.877 -3.366 -10.465
517 HG3 LYS 59 1HG LYS 59 -6.261 -3.270 -8.746
518 HD2 LYS 59 2HD LYS 59 -8.642 -3.441 -9.264
519 HD3 LYS 59 1HD LYS 59 -8.269 -3.506 -10.987
520 HE2 LYS 59 2HE LYS 59 -7.406 -5.507 -8.901
521 HE3 LYS 59 1HE LYS 59 -8.698 -5.737 -10.076
522 HZ1 LYS 59 1HZ LYS 59 -6.664 -6.812 -10.782
523 HZ2 LYS 59 2HZ LYS 59 -5.813 -5.369 -10.713
524 HZ3 LYS 59 3HZ LYS 59 -7.041 -5.567 -11.855
525 H HIS 60 H HIS 60 -6.625 0.924 -8.111
526 HA HIS 60 HA HIS 60 -7.140 2.933 -10.038
527 HB2 HIS 60 2HB HIS 60 -8.703 2.583 -8.289
528 HB3 HIS 60 1HB HIS 60 -7.448 2.768 -7.063
529 HD1 HIS 60 1HD HIS 60 -9.250 4.912 -9.713
530 HD2 HIS 60 2HD HIS 60 -7.296 5.246 -6.077
531 HE1 HIS 60 1HE HIS 60 -9.520 7.299 -9.052
532 HE2 HIS 60 2HE HIS 60 -8.304 7.519 -6.855
533 H LEU 61 H LEU 61 -4.820 2.569 -7.417
534 HA LEU 61 HA LEU 61 -3.767 5.200 -7.659
535 HB2 LEU 61 2HB LEU 61 -2.628 2.743 -6.357
536 HB3 LEU 61 1HB LEU 61 -1.951 4.350 -6.205
537 HG LEU 61 HG LEU 61 -4.714 3.558 -5.273
538 HD11 LEU 61 1HD1 LEU 61 -2.172 3.960 -3.706
539 HD12 LEU 61 2HD1 LEU 61 -3.046 2.434 -3.946
540 HD13 LEU 61 3HD1 LEU 61 -3.783 3.736 -3.029
541 HD21 LEU 61 1HD2 LEU 61 -3.097 6.065 -4.834
542 HD22 LEU 61 2HD2 LEU 61 -4.656 5.706 -4.093
543 HD23 LEU 61 3HD2 LEU 61 -4.542 5.928 -5.837
544 H ASP 62 H ASP 62 -2.932 2.145 -9.173
545 HA ASP 62 HA ASP 62 -0.398 3.063 -10.206
546 HB2 ASP 62 2HB ASP 62 -0.842 0.673 -9.791
547 HB3 ASP 62 1HB ASP 62 -2.126 0.713 -10.972
548 H LYS 63 H LYS 63 -3.710 2.996 -11.320
549 HA LYS 63 HA LYS 63 -2.835 3.841 -13.917
550 HB2 LYS 63 2HB LYS 63 -5.578 3.037 -12.985
551 HB3 LYS 63 1HB LYS 63 -5.179 3.495 -14.634
552 HG2 LYS 63 2HG LYS 63 -3.618 1.586 -14.753
553 HG3 LYS 63 1HG LYS 63 -4.096 1.122 -13.125
554 HD2 LYS 63 2HD LYS 63 -5.951 1.279 -15.510
555 HD3 LYS 63 1HD LYS 63 -5.287 -0.202 -14.826
556 HE2 LYS 63 2HE LYS 63 -6.449 0.252 -12.724
557 HE3 LYS 63 1HE LYS 63 -7.091 1.748 -13.390
558 HZ1 LYS 63 1HZ LYS 63 -7.692 -0.993 -14.366
559 HZ2 LYS 63 2HZ LYS 63 -8.241 0.439 -15.066
560 HZ3 LYS 63 3HZ LYS 63 -8.727 0.043 -13.527
561 H LYS 64 H LYS 64 -2.170 5.810 -13.185
562 HA LYS 64 HA LYS 64 -4.342 7.671 -12.805
563 HB2 LYS 64 2HB LYS 64 -2.584 9.172 -11.577
564 HB3 LYS 64 1HB LYS 64 -3.365 7.860 -10.732
565 HG2 LYS 64 2HG LYS 64 -1.069 7.852 -10.091
566 HG3 LYS 64 1HG LYS 64 -1.323 6.466 -11.131
567 HD2 LYS 64 2HD LYS 64 0.784 7.475 -11.662
568 HD3 LYS 64 1HD LYS 64 -0.324 7.774 -13.001
569 HE2 LYS 64 2HE LYS 64 -0.731 10.043 -12.146
570 HE3 LYS 64 1HE LYS 64 0.369 9.731 -10.806
571 HZ1 LYS 64 1HZ LYS 64 2.175 9.459 -12.411
572 HZ2 LYS 64 2HZ LYS 64 1.456 10.968 -12.572
573 HZ3 LYS 64 3HZ LYS 64 1.112 9.755 -13.681
Start of MODEL 19
1 H1 ALA 1 1HT ALA 1 9.446 1.583 10.610
2 H2 ALA 1 2HT ALA 1 8.855 2.595 9.414
3 H3 ALA 1 3HT ALA 1 8.049 2.485 10.909
4 HA ALA 1 HA ALA 1 9.313 4.518 10.770
5 HB1 ALA 1 1HB ALA 1 10.544 4.257 12.851
6 HB2 ALA 1 2HB ALA 1 10.484 2.503 12.691
7 HB3 ALA 1 3HB ALA 1 8.996 3.419 12.945
8 H ARG 2 H ARG 2 10.946 5.510 9.784
9 HA ARG 2 HA ARG 2 12.910 5.971 8.816
10 HB2 ARG 2 2HB ARG 2 13.888 3.477 10.206
11 HB3 ARG 2 1HB ARG 2 14.895 4.343 9.083
12 HG2 ARG 2 2HG ARG 2 15.564 4.928 11.292
13 HG3 ARG 2 1HG ARG 2 14.767 6.325 10.605
14 HD2 ARG 2 2HD ARG 2 13.375 4.378 12.441
15 HD3 ARG 2 1HD ARG 2 14.288 5.759 13.036
16 HE ARG 2 HE ARG 2 12.402 6.625 11.162
17 HH11 ARG 2 1HH1 ARG 2 12.558 5.301 14.446
18 HH12 ARG 2 2HH1 ARG 2 11.155 6.061 14.988
19 HH21 ARG 2 1HH2 ARG 2 10.423 7.678 11.921
20 HH22 ARG 2 2HH2 ARG 2 9.900 7.422 13.517
21 H LYS 3 H LYS 3 12.375 2.531 8.507
22 HA LYS 3 HA LYS 3 13.565 2.248 5.971
23 HB2 LYS 3 2HB LYS 3 11.443 0.532 7.250
24 HB3 LYS 3 1HB LYS 3 12.488 0.069 5.924
25 HG2 LYS 3 2HG LYS 3 14.426 0.177 7.415
26 HG3 LYS 3 1HG LYS 3 13.375 0.678 8.745
27 HD2 LYS 3 2HD LYS 3 12.122 -1.431 8.514
28 HD3 LYS 3 1HD LYS 3 13.223 -1.934 7.233
29 HE2 LYS 3 2HE LYS 3 13.996 -1.331 10.084
30 HE3 LYS 3 1HE LYS 3 13.788 -2.937 9.408
31 HZ1 LYS 3 1HZ LYS 3 16.113 -2.263 9.501
32 HZ2 LYS 3 2HZ LYS 3 15.818 -0.948 8.521
33 HZ3 LYS 3 3HZ LYS 3 15.645 -2.509 7.902
34 H SER 4 H SER 4 12.617 1.976 3.952
35 HA SER 4 HA SER 4 9.929 3.056 3.579
36 HB2 SER 4 2HB SER 4 12.098 2.374 1.568
37 HB3 SER 4 1HB SER 4 10.547 3.122 1.180
38 HG SER 4 HG SER 4 12.365 4.242 3.034
39 H CYS 5 H CYS 5 11.153 0.353 4.452
40 HA CYS 5 HA CYS 5 9.429 -1.400 2.845
41 HB2 CYS 5 2HB CYS 5 11.846 -2.072 4.529
42 HB3 CYS 5 1HB CYS 5 10.851 -3.228 3.665
43 H CYS 6 H CYS 6 8.237 -2.924 4.090
44 HA CYS 6 HA CYS 6 7.805 -2.126 6.853
45 HB2 CYS 6 2HB CYS 6 6.030 -3.199 4.725
46 HB3 CYS 6 1HB CYS 6 5.538 -3.106 6.416
47 H LEU 7 H LEU 7 7.382 -3.700 8.320
48 HA LEU 7 HA LEU 7 8.615 -6.290 7.753
49 HB2 LEU 7 2HB LEU 7 8.061 -4.942 10.389
50 HB3 LEU 7 1HB LEU 7 9.041 -6.368 10.120
51 HG LEU 7 HG LEU 7 9.695 -3.567 9.204
52 HD11 LEU 7 1HD1 LEU 7 10.915 -5.254 11.365
53 HD12 LEU 7 2HD1 LEU 7 9.933 -3.802 11.582
54 HD13 LEU 7 3HD1 LEU 7 11.517 -3.691 10.815
55 HD21 LEU 7 1HD2 LEU 7 11.291 -6.114 8.944
56 HD22 LEU 7 2HD2 LEU 7 11.869 -4.496 8.551
57 HD23 LEU 7 3HD2 LEU 7 10.551 -5.204 7.628
58 H LYS 8 H LYS 8 5.664 -4.679 8.806
59 HA LYS 8 HA LYS 8 4.325 -7.246 9.008
60 HB2 LYS 8 2HB LYS 8 2.981 -6.320 10.814
61 HB3 LYS 8 1HB LYS 8 4.679 -6.434 11.284
62 HG2 LYS 8 2HG LYS 8 4.920 -4.032 10.875
63 HG3 LYS 8 1HG LYS 8 3.220 -3.935 10.412
64 HD2 LYS 8 2HD LYS 8 4.272 -4.761 13.124
65 HD3 LYS 8 1HD LYS 8 3.615 -3.176 12.728
66 HE2 LYS 8 2HE LYS 8 1.450 -4.226 12.195
67 HE3 LYS 8 1HE LYS 8 2.110 -5.800 12.628
68 HZ1 LYS 8 1HZ LYS 8 0.851 -4.867 14.450
69 HZ2 LYS 8 2HZ LYS 8 1.791 -3.483 14.451
70 HZ3 LYS 8 3HZ LYS 8 2.479 -4.963 14.879
71 H TYR 9 H TYR 9 1.936 -6.937 8.736
72 HA TYR 9 HA TYR 9 1.364 -4.722 6.868
73 HB2 TYR 9 2HB TYR 9 -0.426 -7.211 7.045
74 HB3 TYR 9 1HB TYR 9 -0.220 -6.030 5.827
75 HD1 TYR 9 1HD TYR 9 1.274 -6.215 4.124
76 HD2 TYR 9 2HD TYR 9 1.406 -8.982 7.309
77 HE1 TYR 9 1HE TYR 9 2.748 -7.675 2.789
78 HE2 TYR 9 2HE TYR 9 2.877 -10.456 5.992
79 HH TYR 9 HH TYR 9 4.333 -9.401 3.086
80 H THR 10 H THR 10 -0.583 -3.517 7.286
81 HA THR 10 HA THR 10 -1.433 -3.480 9.960
82 HB THR 10 HB THR 10 -1.444 -1.414 8.567
83 HG1 THR 10 1HG THR 10 -3.048 -0.687 9.703
84 HG21 THR 10 1HG2 THR 10 -3.221 -1.060 6.894
85 HG22 THR 10 2HG2 THR 10 -3.752 -2.728 7.106
86 HG23 THR 10 3HG2 THR 10 -2.157 -2.391 6.428
87 H LYS 11 H LYS 11 -3.470 -4.098 10.782
88 HA LYS 11 HA LYS 11 -4.716 -6.213 9.220
89 HB2 LYS 11 2HB LYS 11 -5.759 -6.977 11.280
90 HB3 LYS 11 1HB LYS 11 -4.025 -6.833 11.472
91 HG2 LYS 11 2HG LYS 11 -4.402 -4.669 12.639
92 HG3 LYS 11 1HG LYS 11 -6.138 -4.966 12.527
93 HD2 LYS 11 2HD LYS 11 -5.798 -7.109 13.741
94 HD3 LYS 11 1HD LYS 11 -4.099 -6.685 13.942
95 HE2 LYS 11 2HE LYS 11 -5.280 -6.117 15.961
96 HE3 LYS 11 1HE LYS 11 -4.811 -4.634 15.140
97 HZ1 LYS 11 1HZ LYS 11 -7.501 -5.880 15.056
98 HZ2 LYS 11 2HZ LYS 11 -7.063 -4.468 14.246
99 HZ3 LYS 11 3HZ LYS 11 -7.079 -4.499 15.925
100 H ARG 12 H ARG 12 -5.186 -3.002 9.667
101 HA ARG 12 HA ARG 12 -8.072 -3.308 9.304
102 HB2 ARG 12 2HB ARG 12 -7.616 -2.039 11.329
103 HB3 ARG 12 1HB ARG 12 -6.582 -0.930 10.428
104 HG2 ARG 12 2HG ARG 12 -8.508 -0.259 9.067
105 HG3 ARG 12 1HG ARG 12 -9.534 -1.324 10.022
106 HD2 ARG 12 2HD ARG 12 -9.080 -0.008 12.000
107 HD3 ARG 12 1HD ARG 12 -7.967 1.016 11.085
108 HE ARG 12 HE ARG 12 -10.535 0.857 9.899
109 HH11 ARG 12 1HH1 ARG 12 -8.732 2.479 12.450
110 HH12 ARG 12 2HH1 ARG 12 -9.638 3.906 12.435
111 HH21 ARG 12 1HH2 ARG 12 -11.826 2.807 9.832
112 HH22 ARG 12 2HH2 ARG 12 -11.475 4.099 10.886
113 HA PRO 13 HA PRO 13 -7.320 -1.869 5.127
114 HB2 PRO 13 2HB PRO 13 -10.233 -1.309 5.256
115 HB3 PRO 13 1HB PRO 13 -9.322 -2.256 4.076
116 HG2 PRO 13 2HG PRO 13 -10.840 -3.468 5.885
117 HG3 PRO 13 1HG PRO 13 -9.258 -4.130 5.429
118 HD2 PRO 13 2HD PRO 13 -10.026 -2.584 7.872
119 HD3 PRO 13 1HD PRO 13 -8.964 -4.003 7.698
120 H LEU 14 H LEU 14 -7.063 0.046 4.173
121 HA LEU 14 HA LEU 14 -7.490 2.527 5.707
122 HB2 LEU 14 2HB LEU 14 -5.256 1.471 4.623
123 HB3 LEU 14 1HB LEU 14 -5.916 2.178 3.190
124 HG LEU 14 HG LEU 14 -4.952 3.597 5.655
125 HD11 LEU 14 1HD1 LEU 14 -3.974 3.555 2.838
126 HD12 LEU 14 2HD1 LEU 14 -3.235 2.755 4.223
127 HD13 LEU 14 3HD1 LEU 14 -3.318 4.519 4.152
128 HD21 LEU 14 1HD2 LEU 14 -6.789 4.910 4.848
129 HD22 LEU 14 2HD2 LEU 14 -6.171 4.805 3.175
130 HD23 LEU 14 3HD2 LEU 14 -5.233 5.630 4.422
131 HA PRO 15 HA PRO 15 -10.718 3.177 2.486
132 HB2 PRO 15 2HB PRO 15 -10.362 6.049 3.133
133 HB3 PRO 15 1HB PRO 15 -11.839 5.080 3.139
134 HG2 PRO 15 2HG PRO 15 -10.716 5.842 5.435
135 HG3 PRO 15 1HG PRO 15 -11.435 4.235 5.270
136 HD2 PRO 15 2HD PRO 15 -8.593 5.066 5.204
137 HD3 PRO 15 1HD PRO 15 -9.311 3.638 5.978
138 H LEU 16 H LEU 16 -10.468 3.483 0.378
139 HA LEU 16 HA LEU 16 -7.943 4.065 -0.714
140 HB2 LEU 16 2HB LEU 16 -9.257 2.508 -1.791
141 HB3 LEU 16 1HB LEU 16 -10.622 3.635 -1.970
142 HG LEU 16 HG LEU 16 -9.147 4.894 -3.533
143 HD11 LEU 16 1HD1 LEU 16 -7.200 3.627 -4.461
144 HD12 LEU 16 2HD1 LEU 16 -7.388 2.495 -3.131
145 HD13 LEU 16 3HD1 LEU 16 -6.987 4.167 -2.787
146 HD21 LEU 16 1HD2 LEU 16 -9.762 2.033 -4.126
147 HD22 LEU 16 2HD2 LEU 16 -9.453 3.309 -5.332
148 HD23 LEU 16 3HD2 LEU 16 -10.842 3.438 -4.231
149 H LYS 17 H LYS 17 -10.805 5.902 -0.372
150 HA LYS 17 HA LYS 17 -10.119 8.025 -2.087
151 HB2 LYS 17 2HB LYS 17 -12.026 8.009 0.259
152 HB3 LYS 17 1HB LYS 17 -11.896 9.310 -0.917
153 HG2 LYS 17 2HG LYS 17 -12.725 6.465 -1.515
154 HG3 LYS 17 1HG LYS 17 -13.800 7.860 -1.404
155 HD2 LYS 17 2HD LYS 17 -12.670 8.886 -3.313
156 HD3 LYS 17 1HD LYS 17 -11.556 7.527 -3.408
157 HE2 LYS 17 2HE LYS 17 -13.303 7.308 -5.077
158 HE3 LYS 17 1HE LYS 17 -13.431 6.025 -3.882
159 HZ1 LYS 17 1HZ LYS 17 -15.572 6.953 -4.447
160 HZ2 LYS 17 2HZ LYS 17 -15.103 8.484 -3.965
161 HZ3 LYS 17 3HZ LYS 17 -15.239 7.233 -2.827
162 H ARG 18 H ARG 18 -8.664 7.120 0.651
163 HA ARG 18 HA ARG 18 -7.758 9.908 1.319
164 HB2 ARG 18 2HB ARG 18 -9.050 8.595 3.112
165 HB3 ARG 18 1HB ARG 18 -7.664 7.518 3.154
166 HG2 ARG 18 2HG ARG 18 -6.244 9.402 3.817
167 HG3 ARG 18 1HG ARG 18 -7.667 10.444 3.814
168 HD2 ARG 18 2HD ARG 18 -8.697 8.954 5.511
169 HD3 ARG 18 1HD ARG 18 -7.188 8.042 5.569
170 HE ARG 18 HE ARG 18 -6.982 10.871 5.999
171 HH11 ARG 18 1HH1 ARG 18 -7.154 7.662 7.530
172 HH12 ARG 18 2HH1 ARG 18 -6.665 8.222 9.051
173 HH21 ARG 18 1HH2 ARG 18 -6.311 11.626 8.128
174 HH22 ARG 18 2HH2 ARG 18 -6.154 10.497 9.387
175 H ILE 19 H ILE 19 -6.755 7.566 -0.504
176 HA ILE 19 HA ILE 19 -4.012 7.465 0.559
177 HB ILE 19 HB ILE 19 -5.282 5.597 -1.474
178 HG12 ILE 19 2HG1 ILE 19 -4.639 5.024 1.406
179 HG13 ILE 19 1HG1 ILE 19 -6.266 5.441 0.887
180 HG21 ILE 19 1HG2 ILE 19 -2.682 5.447 0.085
181 HG22 ILE 19 2HG2 ILE 19 -2.825 5.731 -1.649
182 HG23 ILE 19 3HG2 ILE 19 -3.303 4.179 -0.959
183 HD11 ILE 19 1HD1 ILE 19 -6.199 3.468 -0.627
184 HD12 ILE 19 2HD1 ILE 19 -6.041 3.045 1.089
185 HD13 ILE 19 3HD1 ILE 19 -4.638 3.079 0.021
186 H LYS 20 H LYS 20 -2.393 8.271 -0.658
187 HA LYS 20 HA LYS 20 -3.107 9.701 -3.065
188 HB2 LYS 20 2HB LYS 20 -0.502 9.668 -1.525
189 HB3 LYS 20 1HB LYS 20 -0.861 10.720 -2.868
190 HG2 LYS 20 2HG LYS 20 -2.161 10.694 -0.211
191 HG3 LYS 20 1HG LYS 20 -1.090 11.927 -0.882
192 HD2 LYS 20 2HD LYS 20 -3.842 11.165 -1.750
193 HD3 LYS 20 1HD LYS 20 -3.355 12.670 -1.006
194 HE2 LYS 20 2HE LYS 20 -2.440 11.792 -3.768
195 HE3 LYS 20 1HE LYS 20 -3.622 13.049 -3.426
196 HZ1 LYS 20 1HZ LYS 20 -1.898 14.321 -2.297
197 HZ2 LYS 20 2HZ LYS 20 -1.430 13.971 -3.883
198 HZ3 LYS 20 3HZ LYS 20 -0.768 13.140 -2.581
199 H SER 21 H SER 21 -0.840 7.135 -2.007
200 HA SER 21 HA SER 21 -0.681 5.938 -4.537
201 HB2 SER 21 2HB SER 21 1.722 6.487 -5.004
202 HB3 SER 21 1HB SER 21 0.652 7.880 -5.158
203 HG SER 21 HG SER 21 2.452 7.254 -3.068
204 H TYR 22 H TYR 22 1.258 4.319 -4.470
205 HA TYR 22 HA TYR 22 1.856 3.599 -1.703
206 HB2 TYR 22 2HB TYR 22 1.372 1.279 -2.114
207 HB3 TYR 22 1HB TYR 22 -0.051 2.228 -2.477
208 HD1 TYR 22 1HD TYR 22 -1.067 2.040 -4.552
209 HD2 TYR 22 2HD TYR 22 2.811 0.447 -4.042
210 HE1 TYR 22 1HE TYR 22 -1.232 0.912 -6.732
211 HE2 TYR 22 2HE TYR 22 2.659 -0.670 -6.210
212 HH TYR 22 HH TYR 22 0.231 0.007 -8.471
213 H THR 23 H THR 23 3.501 1.890 -1.660
214 HA THR 23 HA THR 23 5.543 2.346 -3.724
215 HB THR 23 HB THR 23 5.845 1.711 -0.787
216 HG1 THR 23 1HG THR 23 6.248 4.076 -2.300
217 HG21 THR 23 1HG2 THR 23 7.614 0.717 -2.126
218 HG22 THR 23 2HG2 THR 23 8.260 2.038 -1.144
219 HG23 THR 23 3HG2 THR 23 7.963 2.276 -2.871
220 H ILE 24 H ILE 24 6.258 0.521 -4.746
221 HA ILE 24 HA ILE 24 5.081 -2.027 -4.072
222 HB ILE 24 HB ILE 24 7.110 -1.349 -6.235
223 HG12 ILE 24 2HG1 ILE 24 4.149 -1.855 -6.439
224 HG13 ILE 24 1HG1 ILE 24 4.880 -0.245 -6.504
225 HG21 ILE 24 1HG2 ILE 24 5.466 -3.858 -5.817
226 HG22 ILE 24 2HG2 ILE 24 7.211 -3.717 -5.613
227 HG23 ILE 24 3HG2 ILE 24 6.496 -3.535 -7.213
228 HD11 ILE 24 1HD1 ILE 24 5.259 -2.501 -8.472
229 HD12 ILE 24 2HD1 ILE 24 6.046 -0.923 -8.572
230 HD13 ILE 24 3HD1 ILE 24 4.292 -1.047 -8.720
231 H GLN 25 H GLN 25 5.908 -3.000 -2.338
232 HA GLN 25 HA GLN 25 8.797 -3.087 -2.001
233 HB2 GLN 25 2HB GLN 25 7.692 -2.398 -0.030
234 HB3 GLN 25 1HB GLN 25 6.510 -3.682 -0.111
235 HG2 GLN 25 2HG GLN 25 8.238 -5.310 0.338
236 HG3 GLN 25 1HG GLN 25 9.428 -4.015 0.416
237 HE21 GLN 25 1HE2 GLN 25 8.488 -5.933 2.395
238 HE22 GLN 25 2HE2 GLN 25 8.032 -5.013 3.787
239 H SER 26 H SER 26 9.850 -4.775 -2.684
240 HA SER 26 HA SER 26 8.446 -7.302 -2.998
241 HB2 SER 26 2HB SER 26 10.450 -7.841 -4.458
242 HB3 SER 26 1HB SER 26 9.429 -6.531 -5.057
243 HG SER 26 HG SER 26 11.023 -5.289 -4.933
244 H ASN 27 H ASN 27 9.556 -9.230 -2.230
245 HA ASN 27 HA ASN 27 10.842 -8.627 0.274
246 HB2 ASN 27 2HB ASN 27 10.610 -11.000 0.884
247 HB3 ASN 27 1HB ASN 27 9.096 -10.351 0.282
248 HD21 ASN 27 1HD2 ASN 27 8.239 -11.146 -1.621
249 HD22 ASN 27 2HD2 ASN 27 8.878 -12.551 -2.371
250 H GLU 28 H GLU 28 12.018 -8.818 -2.677
251 HA GLU 28 HA GLU 28 14.389 -10.327 -2.216
252 HB2 GLU 28 2HB GLU 28 13.838 -8.136 -4.219
253 HB3 GLU 28 1HB GLU 28 15.268 -9.156 -4.217
254 HG2 GLU 28 2HG GLU 28 12.426 -10.050 -4.637
255 HG3 GLU 28 1HG GLU 28 13.667 -9.891 -5.878
256 H ALA 29 H ALA 29 13.619 -6.846 -2.063
257 HA ALA 29 HA ALA 29 16.257 -6.366 -0.879
258 HB1 ALA 29 1HB ALA 29 15.844 -3.998 -1.319
259 HB2 ALA 29 2HB ALA 29 14.231 -4.391 -1.912
260 HB3 ALA 29 3HB ALA 29 15.657 -4.962 -2.785
261 H CYS 30 H CYS 30 12.870 -6.298 -0.120
262 HA CYS 30 HA CYS 30 13.449 -5.192 2.548
263 HB2 CYS 30 2HB CYS 30 10.825 -5.636 1.146
264 HB3 CYS 30 1HB CYS 30 11.062 -4.828 2.677
265 H ASN 31 H ASN 31 12.269 -6.326 4.343
266 HA ASN 31 HA ASN 31 12.885 -9.021 4.470
267 HB2 ASN 31 2HB ASN 31 10.815 -7.514 6.077
268 HB3 ASN 31 1HB ASN 31 11.342 -9.145 6.446
269 HD21 ASN 31 1HD2 ASN 31 12.148 -8.627 8.421
270 HD22 ASN 31 2HD2 ASN 31 13.552 -7.654 8.660
271 H ILE 32 H ILE 32 9.710 -7.594 3.881
272 HA ILE 32 HA ILE 32 8.801 -10.194 2.819
273 HB ILE 32 HB ILE 32 6.556 -9.745 3.720
274 HG12 ILE 32 2HG1 ILE 32 7.815 -7.324 5.042
275 HG13 ILE 32 1HG1 ILE 32 6.690 -7.275 3.693
276 HG21 ILE 32 1HG2 ILE 32 8.703 -9.531 5.795
277 HG22 ILE 32 2HG2 ILE 32 8.102 -11.038 5.098
278 HG23 ILE 32 3HG2 ILE 32 7.040 -10.039 6.115
279 HD11 ILE 32 1HD1 ILE 32 6.096 -8.293 6.461
280 HD12 ILE 32 2HD1 ILE 32 4.958 -8.239 5.114
281 HD13 ILE 32 3HD1 ILE 32 5.598 -6.741 5.791
282 H LYS 33 H LYS 33 6.629 -9.713 1.585
283 HA LYS 33 HA LYS 33 7.028 -7.349 -0.070
284 HB2 LYS 33 2HB LYS 33 6.754 -9.465 -1.279
285 HB3 LYS 33 1HB LYS 33 5.265 -9.790 -0.406
286 HG2 LYS 33 2HG LYS 33 4.236 -7.827 -1.455
287 HG3 LYS 33 1HG LYS 33 5.723 -7.538 -2.345
288 HD2 LYS 33 2HD LYS 33 5.531 -9.676 -3.446
289 HD3 LYS 33 1HD LYS 33 4.078 -10.054 -2.519
290 HE2 LYS 33 2HE LYS 33 2.924 -8.158 -3.541
291 HE3 LYS 33 1HE LYS 33 4.374 -7.759 -4.461
292 HZ1 LYS 33 1HZ LYS 33 2.858 -10.310 -4.714
293 HZ2 LYS 33 2HZ LYS 33 4.180 -9.823 -5.644
294 HZ3 LYS 33 3HZ LYS 33 2.731 -8.977 -5.754
295 H ALA 34 H ALA 34 5.976 -5.615 0.720
296 HA ALA 34 HA ALA 34 3.217 -5.916 1.573
297 HB1 ALA 34 1HB ALA 34 4.520 -6.047 3.643
298 HB2 ALA 34 2HB ALA 34 3.607 -4.539 3.566
299 HB3 ALA 34 3HB ALA 34 5.336 -4.541 3.223
300 H ILE 35 H ILE 35 2.193 -4.543 0.290
301 HA ILE 35 HA ILE 35 3.493 -2.378 -1.015
302 HB ILE 35 HB ILE 35 0.532 -2.927 -0.646
303 HG12 ILE 35 2HG1 ILE 35 1.757 -4.724 -1.776
304 HG13 ILE 35 1HG1 ILE 35 0.617 -3.938 -2.873
305 HG21 ILE 35 1HG2 ILE 35 0.207 -1.451 -2.610
306 HG22 ILE 35 2HG2 ILE 35 1.920 -1.079 -2.593
307 HG23 ILE 35 3HG2 ILE 35 0.910 -0.590 -1.245
308 HD11 ILE 35 1HD1 ILE 35 2.627 -4.443 -4.006
309 HD12 ILE 35 2HD1 ILE 35 3.620 -3.624 -2.782
310 HD13 ILE 35 3HD1 ILE 35 2.533 -2.697 -3.835
311 H ILE 36 H ILE 36 3.843 -0.339 -0.303
312 HA ILE 36 HA ILE 36 2.792 0.277 2.352
313 HB ILE 36 HB ILE 36 4.930 1.857 0.875
314 HG12 ILE 36 2HG1 ILE 36 6.489 0.830 2.660
315 HG13 ILE 36 1HG1 ILE 36 5.245 -0.397 2.842
316 HG21 ILE 36 1HG2 ILE 36 3.821 3.151 2.527
317 HG22 ILE 36 2HG2 ILE 36 5.468 2.736 3.047
318 HG23 ILE 36 3HG2 ILE 36 4.091 1.880 3.738
319 HD11 ILE 36 1HD1 ILE 36 5.506 -0.972 0.488
320 HD12 ILE 36 2HD1 ILE 36 7.006 -1.124 1.415
321 HD13 ILE 36 3HD1 ILE 36 6.753 0.277 0.364
322 H PHE 37 H PHE 37 1.039 1.342 2.360
323 HA PHE 37 HA PHE 37 0.145 3.017 0.191
324 HB2 PHE 37 2HB PHE 37 -0.982 2.054 2.790
325 HB3 PHE 37 1HB PHE 37 -1.778 3.343 1.882
326 HD1 PHE 37 1HD PHE 37 -0.063 0.474 0.455
327 HD2 PHE 37 2HD PHE 37 -3.739 2.213 1.416
328 HE1 PHE 37 1HE PHE 37 -1.246 -1.232 -0.960
329 HE2 PHE 37 2HE PHE 37 -4.929 0.561 0.046
330 HZ PHE 37 HZ PHE 37 -3.676 -1.156 -1.141
331 H THR 38 H THR 38 -0.029 5.143 0.257
332 HA THR 38 HA THR 38 0.897 6.447 2.699
333 HB THR 38 HB THR 38 1.373 7.399 -0.139
334 HG1 THR 38 1HG THR 38 2.583 5.560 1.374
335 HG21 THR 38 1HG2 THR 38 1.265 9.160 1.523
336 HG22 THR 38 2HG2 THR 38 2.933 8.958 0.978
337 HG23 THR 38 3HG2 THR 38 2.402 8.310 2.549
338 H THR 39 H THR 39 -0.467 8.019 3.451
339 HA THR 39 HA THR 39 -2.975 8.233 2.039
340 HB THR 39 HB THR 39 -3.651 9.533 4.117
341 HG1 THR 39 1HG THR 39 -2.231 8.836 5.949
342 HG21 THR 39 1HG2 THR 39 -4.322 7.259 3.745
343 HG22 THR 39 2HG2 THR 39 -3.937 7.476 5.452
344 HG23 THR 39 3HG2 THR 39 -2.788 6.660 4.380
345 H LYS 40 H LYS 40 -4.029 10.491 2.310
346 HA LYS 40 HA LYS 40 -2.451 12.355 0.884
347 HB2 LYS 40 2HB LYS 40 -4.871 12.953 2.527
348 HB3 LYS 40 1HB LYS 40 -4.329 13.869 1.121
349 HG2 LYS 40 2HG LYS 40 -4.773 11.509 -0.138
350 HG3 LYS 40 1HG LYS 40 -5.714 11.247 1.284
351 HD2 LYS 40 2HD LYS 40 -7.128 13.133 0.875
352 HD3 LYS 40 1HD LYS 40 -6.058 13.620 -0.452
353 HE2 LYS 40 2HE LYS 40 -6.610 11.700 -1.723
354 HE3 LYS 40 1HE LYS 40 -7.546 11.018 -0.402
355 HZ1 LYS 40 1HZ LYS 40 -9.097 12.836 -0.610
356 HZ2 LYS 40 2HZ LYS 40 -8.960 12.004 -2.063
357 HZ3 LYS 40 3HZ LYS 40 -8.213 13.503 -1.889
358 H LYS 41 H LYS 41 -2.721 11.587 4.162
359 HA LYS 41 HA LYS 41 -1.630 14.025 5.266
360 HB2 LYS 41 2HB LYS 41 -1.630 11.211 6.412
361 HB3 LYS 41 1HB LYS 41 -1.329 12.686 7.283
362 HG2 LYS 41 2HG LYS 41 -3.855 12.096 5.958
363 HG3 LYS 41 1HG LYS 41 -3.572 11.548 7.605
364 HD2 LYS 41 2HD LYS 41 -4.877 13.577 7.742
365 HD3 LYS 41 1HD LYS 41 -3.238 14.025 8.195
366 HE2 LYS 41 2HE LYS 41 -2.898 15.039 6.027
367 HE3 LYS 41 1HE LYS 41 -4.467 14.452 5.457
368 HZ1 LYS 41 1HZ LYS 41 -3.983 16.402 7.644
369 HZ2 LYS 41 2HZ LYS 41 -5.491 15.864 7.109
370 HZ3 LYS 41 3HZ LYS 41 -4.520 16.759 6.086
371 H GLY 42 H GLY 42 -0.558 11.376 3.508
372 HA2 GLY 42 2HA GLY 42 1.484 10.986 2.609
373 HA3 GLY 42 1HA GLY 42 2.141 12.288 3.572
374 H ARG 43 H ARG 43 0.349 9.997 5.347
375 HA ARG 43 HA ARG 43 2.621 9.073 6.761
376 HB2 ARG 43 2HB ARG 43 0.445 9.566 7.777
377 HB3 ARG 43 1HB ARG 43 -0.267 8.317 6.759
378 HG2 ARG 43 2HG ARG 43 0.991 6.636 7.831
379 HG3 ARG 43 1HG ARG 43 1.846 7.843 8.810
380 HD2 ARG 43 2HD ARG 43 -1.124 7.259 8.912
381 HD3 ARG 43 1HD ARG 43 0.051 6.723 10.109
382 HE ARG 43 HE ARG 43 0.016 9.565 9.675
383 HH11 ARG 43 1HH1 ARG 43 -1.394 6.934 11.587
384 HH12 ARG 43 2HH1 ARG 43 -1.851 7.946 12.869
385 HH21 ARG 43 1HH2 ARG 43 -0.624 10.930 11.400
386 HH22 ARG 43 2HH2 ARG 43 -1.412 10.289 12.763
387 H LYS 44 H LYS 44 3.410 6.927 6.758
388 HA LYS 44 HA LYS 44 2.816 5.363 4.367
389 HB2 LYS 44 2HB LYS 44 4.974 5.054 6.469
390 HB3 LYS 44 1HB LYS 44 4.809 4.035 5.054
391 HG2 LYS 44 2HG LYS 44 5.382 7.003 5.016
392 HG3 LYS 44 1HG LYS 44 6.570 5.723 4.775
393 HD2 LYS 44 2HD LYS 44 5.309 4.976 2.785
394 HD3 LYS 44 1HD LYS 44 4.180 6.309 3.024
395 HE2 LYS 44 2HE LYS 44 5.816 6.881 1.316
396 HE3 LYS 44 1HE LYS 44 6.020 7.905 2.732
397 HZ1 LYS 44 1HZ LYS 44 7.666 5.515 2.095
398 HZ2 LYS 44 2HZ LYS 44 7.904 6.522 3.414
399 HZ3 LYS 44 3HZ LYS 44 8.131 7.107 1.845
400 H ILE 45 H ILE 45 1.472 3.723 4.446
401 HA ILE 45 HA ILE 45 0.941 2.376 7.011
402 HB ILE 45 HB ILE 45 -0.931 2.606 4.629
403 HG12 ILE 45 2HG1 ILE 45 -2.446 3.892 6.296
404 HG13 ILE 45 1HG1 ILE 45 -0.980 4.094 7.270
405 HG21 ILE 45 1HG2 ILE 45 -1.395 1.349 7.326
406 HG22 ILE 45 2HG2 ILE 45 -1.256 0.529 5.770
407 HG23 ILE 45 3HG2 ILE 45 -2.633 1.582 6.092
408 HD11 ILE 45 1HD1 ILE 45 -1.536 6.028 5.955
409 HD12 ILE 45 2HD1 ILE 45 -1.439 5.076 4.486
410 HD13 ILE 45 3HD1 ILE 45 0.022 5.352 5.447
411 H CYS 46 H CYS 46 1.606 0.326 7.011
412 HA CYS 46 HA CYS 46 2.518 -0.933 4.569
413 HB2 CYS 46 2HB CYS 46 2.410 -1.938 7.400
414 HB3 CYS 46 1HB CYS 46 3.349 -2.647 6.094
415 H ALA 47 H ALA 47 1.078 -2.048 3.297
416 HA ALA 47 HA ALA 47 -1.153 -3.341 4.702
417 HB1 ALA 47 1HB ALA 47 -1.194 -2.128 1.944
418 HB2 ALA 47 2HB ALA 47 -1.879 -1.397 3.394
419 HB3 ALA 47 3HB ALA 47 -2.543 -2.907 2.769
420 H ASN 48 H ASN 48 -1.812 -5.359 4.050
421 HA ASN 48 HA ASN 48 0.130 -7.005 2.786
422 HB2 ASN 48 2HB ASN 48 -1.030 -7.927 4.601
423 HB3 ASN 48 1HB ASN 48 -2.602 -7.498 3.982
424 HD21 ASN 48 1HD2 ASN 48 0.048 -9.072 2.216
425 HD22 ASN 48 2HD2 ASN 48 -0.853 -10.521 1.929
426 HA PRO 49 HA PRO 49 -1.354 -6.148 -1.371
427 HB2 PRO 49 2HB PRO 49 0.267 -8.032 -2.527
428 HB3 PRO 49 1HB PRO 49 0.697 -6.339 -2.298
429 HG2 PRO 49 2HG PRO 49 1.501 -8.727 -0.725
430 HG3 PRO 49 1HG PRO 49 2.373 -7.214 -1.006
431 HD2 PRO 49 2HD PRO 49 1.174 -7.808 1.339
432 HD3 PRO 49 1HD PRO 49 1.352 -6.149 0.752
433 H ASN 50 H ASN 50 -1.272 -9.254 0.263
434 HA ASN 50 HA ASN 50 -2.622 -10.610 -1.782
435 HB2 ASN 50 2HB ASN 50 -2.511 -11.279 1.151
436 HB3 ASN 50 1HB ASN 50 -3.046 -12.312 -0.179
437 HD21 ASN 50 1HD2 ASN 50 -0.899 -12.510 1.778
438 HD22 ASN 50 2HD2 ASN 50 0.538 -12.833 0.869
439 H GLU 51 H GLU 51 -3.592 -8.290 0.553
440 HA GLU 51 HA GLU 51 -6.261 -9.267 0.867
441 HB2 GLU 51 2HB GLU 51 -5.257 -6.481 1.441
442 HB3 GLU 51 1HB GLU 51 -6.726 -7.223 2.031
443 HG2 GLU 51 2HG GLU 51 -5.100 -8.949 3.178
444 HG3 GLU 51 1HG GLU 51 -3.942 -7.743 2.707
445 H LYS 52 H LYS 52 -7.985 -8.744 -0.265
446 HA LYS 52 HA LYS 52 -7.522 -7.899 -2.895
447 HB2 LYS 52 2HB LYS 52 -10.168 -8.316 -1.500
448 HB3 LYS 52 1HB LYS 52 -9.913 -8.220 -3.239
449 HG2 LYS 52 2HG LYS 52 -8.855 -10.364 -1.394
450 HG3 LYS 52 1HG LYS 52 -10.160 -10.539 -2.567
451 HD2 LYS 52 2HD LYS 52 -8.596 -10.153 -4.405
452 HD3 LYS 52 1HD LYS 52 -7.289 -9.861 -3.260
453 HE2 LYS 52 2HE LYS 52 -7.495 -12.158 -2.448
454 HE3 LYS 52 1HE LYS 52 -8.790 -12.463 -3.597
455 HZ1 LYS 52 1HZ LYS 52 -6.674 -13.291 -4.387
456 HZ2 LYS 52 2HZ LYS 52 -5.968 -11.774 -4.296
457 HZ3 LYS 52 3HZ LYS 52 -7.200 -12.084 -5.410
458 H TRP 53 H TRP 53 -8.658 -6.200 -0.059
459 HA TRP 53 HA TRP 53 -9.655 -3.965 -1.463
460 HB2 TRP 53 2HB TRP 53 -9.579 -2.693 0.598
461 HB3 TRP 53 1HB TRP 53 -10.123 -4.317 0.968
462 HD1 TRP 53 HD TRP 53 -8.418 -5.845 2.481
463 HE1 TRP 53 1HE TRP 53 -6.541 -5.188 4.052
464 HE3 TRP 53 3HE TRP 53 -7.660 -1.038 0.893
465 HZ2 TRP 53 2HZ TRP 53 -4.879 -2.940 4.570
466 HZ3 TRP 53 3HZ TRP 53 -5.892 0.275 1.977
467 HH2 TRP 53 HH TRP 53 -4.537 -0.661 3.775
468 H VAL 54 H VAL 54 -6.464 -4.897 -0.503
469 HA VAL 54 HA VAL 54 -5.139 -2.458 -1.049
470 HB VAL 54 HB VAL 54 -4.123 -5.314 -0.875
471 HG11 VAL 54 1HG1 VAL 54 -2.523 -2.761 -1.025
472 HG12 VAL 54 2HG1 VAL 54 -2.576 -4.018 -2.255
473 HG13 VAL 54 3HG1 VAL 54 -1.859 -4.346 -0.671
474 HG21 VAL 54 1HG2 VAL 54 -3.958 -3.003 1.031
475 HG22 VAL 54 2HG2 VAL 54 -3.272 -4.607 1.290
476 HG23 VAL 54 3HG2 VAL 54 -5.024 -4.396 1.182
477 H GLN 55 H GLN 55 -5.808 -5.373 -2.811
478 HA GLN 55 HA GLN 55 -4.273 -4.816 -5.055
479 HB2 GLN 55 2HB GLN 55 -6.745 -6.499 -4.909
480 HB3 GLN 55 1HB GLN 55 -5.488 -6.578 -6.149
481 HG2 GLN 55 2HG GLN 55 -3.858 -7.003 -4.301
482 HG3 GLN 55 1HG GLN 55 -5.244 -7.222 -3.244
483 HE21 GLN 55 1HE2 GLN 55 -3.236 -8.982 -3.858
484 HE22 GLN 55 2HE2 GLN 55 -3.872 -10.360 -4.634
485 H LYS 56 H LYS 56 -7.676 -4.209 -4.315
486 HA LYS 56 HA LYS 56 -8.482 -3.036 -6.748
487 HB2 LYS 56 2HB LYS 56 -9.403 -2.380 -3.951
488 HB3 LYS 56 1HB LYS 56 -10.239 -1.937 -5.427
489 HG2 LYS 56 2HG LYS 56 -10.641 -4.300 -5.904
490 HG3 LYS 56 1HG LYS 56 -9.763 -4.736 -4.433
491 HD2 LYS 56 2HD LYS 56 -11.352 -3.463 -3.102
492 HD3 LYS 56 1HD LYS 56 -12.217 -3.023 -4.575
493 HE2 LYS 56 2HE LYS 56 -12.742 -5.373 -4.966
494 HE3 LYS 56 1HE LYS 56 -11.854 -5.819 -3.508
495 HZ1 LYS 56 1HZ LYS 56 -14.229 -5.702 -3.098
496 HZ2 LYS 56 2HZ LYS 56 -14.266 -4.062 -3.544
497 HZ3 LYS 56 3HZ LYS 56 -13.406 -4.557 -2.194
498 H ALA 57 H ALA 57 -7.056 -1.687 -3.823
499 HA ALA 57 HA ALA 57 -7.181 1.033 -4.513
500 HB1 ALA 57 1HB ALA 57 -5.422 1.359 -2.838
501 HB2 ALA 57 2HB ALA 57 -5.202 -0.375 -2.706
502 HB3 ALA 57 3HB ALA 57 -6.739 0.383 -2.210
503 H MET 58 H MET 58 -4.722 -1.392 -5.043
504 HA MET 58 HA MET 58 -2.803 0.308 -5.954
505 HB2 MET 58 2HB MET 58 -3.149 -2.618 -6.592
506 HB3 MET 58 1HB MET 58 -1.755 -1.692 -7.133
507 HG2 MET 58 2HG MET 58 -1.350 -1.095 -4.714
508 HG3 MET 58 1HG MET 58 -2.587 -2.274 -4.299
509 HE1 MET 58 1HE MET 58 -0.845 -5.603 -5.454
510 HE2 MET 58 2HE MET 58 -2.058 -4.663 -6.347
511 HE3 MET 58 3HE MET 58 -2.238 -4.940 -4.604
512 H LYS 59 H LYS 59 -5.315 -1.254 -7.828
513 HA LYS 59 HA LYS 59 -4.422 -0.275 -10.331
514 HB2 LYS 59 2HB LYS 59 -7.164 -1.147 -9.427
515 HB3 LYS 59 1HB LYS 59 -6.870 -0.530 -11.039
516 HG2 LYS 59 2HG LYS 59 -6.924 -2.948 -11.069
517 HG3 LYS 59 1HG LYS 59 -5.299 -2.392 -11.442
518 HD2 LYS 59 2HD LYS 59 -4.608 -2.882 -9.160
519 HD3 LYS 59 1HD LYS 59 -6.250 -3.383 -8.764
520 HE2 LYS 59 2HE LYS 59 -4.447 -4.690 -10.800
521 HE3 LYS 59 1HE LYS 59 -4.805 -5.304 -9.190
522 HZ1 LYS 59 1HZ LYS 59 -7.155 -5.469 -9.842
523 HZ2 LYS 59 2HZ LYS 59 -6.158 -6.391 -10.844
524 HZ3 LYS 59 3HZ LYS 59 -6.753 -4.931 -11.390
525 H HIS 60 H HIS 60 -6.695 1.073 -7.992
526 HA HIS 60 HA HIS 60 -7.383 3.281 -9.599
527 HB2 HIS 60 2HB HIS 60 -8.848 2.541 -7.850
528 HB3 HIS 60 1HB HIS 60 -7.586 2.756 -6.643
529 HD1 HIS 60 1HD HIS 60 -9.949 4.771 -8.838
530 HD2 HIS 60 2HD HIS 60 -7.389 5.238 -5.631
531 HE1 HIS 60 1HE HIS 60 -10.401 7.081 -7.980
532 HE2 HIS 60 2HE HIS 60 -8.830 7.391 -6.055
533 H LEU 61 H LEU 61 -4.860 2.676 -7.289
534 HA LEU 61 HA LEU 61 -4.032 5.385 -7.120
535 HB2 LEU 61 2HB LEU 61 -2.649 2.837 -6.323
536 HB3 LEU 61 1HB LEU 61 -2.014 4.443 -6.000
537 HG LEU 61 HG LEU 61 -4.660 3.416 -4.964
538 HD11 LEU 61 1HD1 LEU 61 -2.008 3.683 -3.561
539 HD12 LEU 61 2HD1 LEU 61 -2.892 2.183 -3.927
540 HD13 LEU 61 3HD1 LEU 61 -3.558 3.341 -2.797
541 HD21 LEU 61 1HD2 LEU 61 -3.084 5.901 -4.325
542 HD22 LEU 61 2HD2 LEU 61 -4.567 5.393 -3.522
543 HD23 LEU 61 3HD2 LEU 61 -4.605 5.836 -5.224
544 H ASP 62 H ASP 62 -3.146 2.724 -9.249
545 HA ASP 62 HA ASP 62 -0.926 4.230 -10.290
546 HB2 ASP 62 2HB ASP 62 -2.189 1.682 -11.160
547 HB3 ASP 62 1HB ASP 62 -0.952 2.472 -12.142
548 H LYS 63 H LYS 63 -4.259 3.829 -11.206
549 HA LYS 63 HA LYS 63 -3.668 5.878 -13.093
550 HB2 LYS 63 2HB LYS 63 -5.379 5.070 -14.732
551 HB3 LYS 63 1HB LYS 63 -3.923 4.114 -14.622
552 HG2 LYS 63 2HG LYS 63 -6.447 3.346 -13.202
553 HG3 LYS 63 1HG LYS 63 -6.152 2.942 -14.889
554 HD2 LYS 63 2HD LYS 63 -4.110 1.740 -14.229
555 HD3 LYS 63 1HD LYS 63 -4.425 2.154 -12.542
556 HE2 LYS 63 2HE LYS 63 -5.156 -0.120 -13.017
557 HE3 LYS 63 1HE LYS 63 -6.521 0.916 -12.625
558 HZ1 LYS 63 1HZ LYS 63 -5.719 0.102 -15.370
559 HZ2 LYS 63 2HZ LYS 63 -7.029 1.089 -14.985
560 HZ3 LYS 63 3HZ LYS 63 -7.028 -0.497 -14.492
561 H LYS 64 H LYS 64 -4.257 7.434 -12.004
562 HA LYS 64 HA LYS 64 -7.119 7.811 -11.780
563 HB2 LYS 64 2HB LYS 64 -6.788 9.058 -9.625
564 HB3 LYS 64 1HB LYS 64 -6.425 7.348 -9.497
565 HG2 LYS 64 2HG LYS 64 -4.018 7.886 -9.664
566 HG3 LYS 64 1HG LYS 64 -4.432 9.599 -9.703
567 HD2 LYS 64 2HD LYS 64 -5.529 9.339 -7.503
568 HD3 LYS 64 1HD LYS 64 -5.000 7.656 -7.470
569 HE2 LYS 64 2HE LYS 64 -3.244 10.104 -7.544
570 HE3 LYS 64 1HE LYS 64 -3.483 9.023 -6.175
571 HZ1 LYS 64 1HZ LYS 64 -2.469 7.218 -7.574
572 HZ2 LYS 64 2HZ LYS 64 -1.431 8.456 -7.215
573 HZ3 LYS 64 3HZ LYS 64 -2.118 8.380 -8.743
Start of MODEL 20
1 H1 ALA 1 1HT ALA 1 19.187 6.104 10.536
2 H2 ALA 1 2HT ALA 1 17.542 6.494 10.756
3 H3 ALA 1 3HT ALA 1 18.367 7.021 9.388
4 HA ALA 1 HA ALA 1 18.602 4.867 8.553
5 HB1 ALA 1 1HB ALA 1 18.790 3.654 10.664
6 HB2 ALA 1 2HB ALA 1 17.505 2.969 9.667
7 HB3 ALA 1 3HB ALA 1 17.105 4.013 11.027
8 H ARG 2 H ARG 2 17.368 5.307 6.896
9 HA ARG 2 HA ARG 2 14.609 6.093 7.249
10 HB2 ARG 2 2HB ARG 2 16.055 7.261 5.625
11 HB3 ARG 2 1HB ARG 2 16.307 5.751 4.771
12 HG2 ARG 2 2HG ARG 2 13.919 5.661 4.227
13 HG3 ARG 2 1HG ARG 2 13.674 7.184 5.075
14 HD2 ARG 2 2HD ARG 2 13.866 7.567 2.690
15 HD3 ARG 2 1HD ARG 2 15.231 8.287 3.545
16 HE ARG 2 HE ARG 2 15.640 5.621 2.561
17 HH11 ARG 2 1HH1 ARG 2 16.017 9.091 1.862
18 HH12 ARG 2 2HH1 ARG 2 17.231 8.866 0.705
19 HH21 ARG 2 1HH2 ARG 2 17.312 5.324 0.910
20 HH22 ARG 2 2HH2 ARG 2 17.964 6.682 0.132
21 H LYS 3 H LYS 3 13.156 4.524 7.423
22 HA LYS 3 HA LYS 3 13.644 2.091 5.877
23 HB2 LYS 3 2HB LYS 3 12.360 2.210 8.605
24 HB3 LYS 3 1HB LYS 3 12.558 0.775 7.611
25 HG2 LYS 3 2HG LYS 3 15.001 1.022 7.779
26 HG3 LYS 3 1HG LYS 3 14.772 2.430 8.814
27 HD2 LYS 3 2HD LYS 3 15.212 0.513 10.206
28 HD3 LYS 3 1HD LYS 3 13.530 0.989 10.410
29 HE2 LYS 3 2HE LYS 3 12.858 -0.787 8.813
30 HE3 LYS 3 1HE LYS 3 14.545 -1.271 8.683
31 HZ1 LYS 3 1HZ LYS 3 12.882 -1.339 11.128
32 HZ2 LYS 3 2HZ LYS 3 14.513 -1.739 11.078
33 HZ3 LYS 3 3HZ LYS 3 13.385 -2.670 10.241
34 H SER 4 H SER 4 12.335 2.285 4.237
35 HA SER 4 HA SER 4 9.547 2.936 4.782
36 HB2 SER 4 2HB SER 4 10.714 4.406 3.122
37 HB3 SER 4 1HB SER 4 11.063 2.984 2.143
38 HG SER 4 HG SER 4 8.837 2.639 1.989
39 H CYS 5 H CYS 5 10.927 0.466 5.329
40 HA CYS 5 HA CYS 5 9.491 -1.363 3.535
41 HB2 CYS 5 2HB CYS 5 11.906 -1.875 5.293
42 HB3 CYS 5 1HB CYS 5 11.037 -3.120 4.422
43 H CYS 6 H CYS 6 8.306 -2.993 4.555
44 HA CYS 6 HA CYS 6 7.659 -2.470 7.340
45 HB2 CYS 6 2HB CYS 6 6.032 -3.499 5.050
46 HB3 CYS 6 1HB CYS 6 5.464 -3.348 6.709
47 H LEU 7 H LEU 7 7.219 -4.223 8.602
48 HA LEU 7 HA LEU 7 8.338 -6.790 7.714
49 HB2 LEU 7 2HB LEU 7 8.199 -5.622 10.509
50 HB3 LEU 7 1HB LEU 7 8.717 -7.247 10.155
51 HG LEU 7 HG LEU 7 10.657 -6.262 8.874
52 HD11 LEU 7 1HD1 LEU 7 11.302 -3.951 9.301
53 HD12 LEU 7 2HD1 LEU 7 9.771 -3.675 10.135
54 HD13 LEU 7 3HD1 LEU 7 9.782 -4.048 8.410
55 HD21 LEU 7 1HD2 LEU 7 10.919 -7.110 11.125
56 HD22 LEU 7 2HD2 LEU 7 10.438 -5.549 11.790
57 HD23 LEU 7 3HD2 LEU 7 11.938 -5.691 10.875
58 H LYS 8 H LYS 8 5.556 -5.129 8.785
59 HA LYS 8 HA LYS 8 4.080 -7.656 9.035
60 HB2 LYS 8 2HB LYS 8 3.610 -5.172 10.684
61 HB3 LYS 8 1HB LYS 8 2.734 -6.689 10.816
62 HG2 LYS 8 2HG LYS 8 4.822 -7.762 11.624
63 HG3 LYS 8 1HG LYS 8 5.615 -6.187 11.572
64 HD2 LYS 8 2HD LYS 8 3.237 -6.961 13.269
65 HD3 LYS 8 1HD LYS 8 4.878 -6.668 13.833
66 HE2 LYS 8 2HE LYS 8 4.699 -4.322 13.111
67 HE3 LYS 8 1HE LYS 8 3.066 -4.632 12.537
68 HZ1 LYS 8 1HZ LYS 8 2.455 -5.215 14.852
69 HZ2 LYS 8 2HZ LYS 8 2.984 -3.614 14.690
70 HZ3 LYS 8 3HZ LYS 8 4.011 -4.765 15.331
71 H TYR 9 H TYR 9 1.729 -7.256 8.581
72 HA TYR 9 HA TYR 9 1.347 -4.960 6.788
73 HB2 TYR 9 2HB TYR 9 -0.509 -7.434 6.742
74 HB3 TYR 9 1HB TYR 9 -0.259 -6.167 5.616
75 HD1 TYR 9 1HD TYR 9 1.219 -6.314 3.894
76 HD2 TYR 9 2HD TYR 9 1.375 -9.165 7.009
77 HE1 TYR 9 1HE TYR 9 2.717 -7.717 2.532
78 HE2 TYR 9 2HE TYR 9 2.866 -10.579 5.670
79 HH TYR 9 HH TYR 9 4.323 -9.421 2.800
80 H THR 10 H THR 10 -0.682 -3.788 7.038
81 HA THR 10 HA THR 10 -1.527 -3.552 9.692
82 HB THR 10 HB THR 10 -1.493 -1.580 8.234
83 HG1 THR 10 1HG THR 10 -4.118 -1.403 8.410
84 HG21 THR 10 1HG2 THR 10 -3.126 -1.278 6.419
85 HG22 THR 10 2HG2 THR 10 -3.700 -2.930 6.664
86 HG23 THR 10 3HG2 THR 10 -2.053 -2.638 6.101
87 H LYS 11 H LYS 11 -3.414 -4.251 10.663
88 HA LYS 11 HA LYS 11 -4.876 -6.362 9.321
89 HB2 LYS 11 2HB LYS 11 -6.042 -6.668 11.462
90 HB3 LYS 11 1HB LYS 11 -4.307 -6.603 11.720
91 HG2 LYS 11 2HG LYS 11 -4.485 -4.308 12.509
92 HG3 LYS 11 1HG LYS 11 -6.216 -4.310 12.182
93 HD2 LYS 11 2HD LYS 11 -6.499 -6.119 13.836
94 HD3 LYS 11 1HD LYS 11 -4.766 -6.059 14.170
95 HE2 LYS 11 2HE LYS 11 -4.979 -3.745 14.926
96 HE3 LYS 11 1HE LYS 11 -6.701 -3.772 14.554
97 HZ1 LYS 11 1HZ LYS 11 -5.335 -5.443 16.606
98 HZ2 LYS 11 2HZ LYS 11 -6.971 -5.521 16.239
99 HZ3 LYS 11 3HZ LYS 11 -6.334 -4.127 16.912
100 H ARG 12 H ARG 12 -5.155 -3.044 9.975
101 HA ARG 12 HA ARG 12 -8.034 -2.920 9.549
102 HB2 ARG 12 2HB ARG 12 -7.051 -1.749 11.440
103 HB3 ARG 12 1HB ARG 12 -5.991 -0.869 10.363
104 HG2 ARG 12 2HG ARG 12 -7.935 0.261 9.387
105 HG3 ARG 12 1HG ARG 12 -8.994 -0.615 10.501
106 HD2 ARG 12 2HD ARG 12 -7.763 0.326 12.394
107 HD3 ARG 12 1HD ARG 12 -6.744 1.222 11.274
108 HE ARG 12 HE ARG 12 -9.373 1.916 10.757
109 HH11 ARG 12 1HH1 ARG 12 -7.022 2.179 13.389
110 HH12 ARG 12 2HH1 ARG 12 -7.671 3.606 14.038
111 HH21 ARG 12 1HH2 ARG 12 -10.292 3.894 11.646
112 HH22 ARG 12 2HH2 ARG 12 -9.588 4.620 13.003
113 HA PRO 13 HA PRO 13 -7.180 -1.830 5.290
114 HB2 PRO 13 2HB PRO 13 -9.763 -1.125 4.664
115 HB3 PRO 13 1HB PRO 13 -9.177 -2.789 4.675
116 HG2 PRO 13 2HG PRO 13 -10.753 -1.322 6.738
117 HG3 PRO 13 1HG PRO 13 -10.884 -3.009 6.211
118 HD2 PRO 13 2HD PRO 13 -9.659 -2.257 8.503
119 HD3 PRO 13 1HD PRO 13 -9.174 -3.696 7.592
120 H LEU 14 H LEU 14 -6.993 0.113 4.159
121 HA LEU 14 HA LEU 14 -7.457 2.572 5.688
122 HB2 LEU 14 2HB LEU 14 -5.099 2.016 5.036
123 HB3 LEU 14 1HB LEU 14 -5.600 1.988 3.368
124 HG LEU 14 HG LEU 14 -6.127 4.405 3.533
125 HD11 LEU 14 1HD1 LEU 14 -5.245 5.667 5.419
126 HD12 LEU 14 2HD1 LEU 14 -4.805 4.174 6.227
127 HD13 LEU 14 3HD1 LEU 14 -6.509 4.549 5.951
128 HD21 LEU 14 1HD2 LEU 14 -3.325 3.585 4.255
129 HD22 LEU 14 2HD2 LEU 14 -3.794 5.115 3.511
130 HD23 LEU 14 3HD2 LEU 14 -4.023 3.597 2.640
131 HA PRO 15 HA PRO 15 -10.640 3.230 2.544
132 HB2 PRO 15 2HB PRO 15 -10.390 6.064 3.397
133 HB3 PRO 15 1HB PRO 15 -11.825 5.038 3.336
134 HG2 PRO 15 2HG PRO 15 -10.718 5.662 5.673
135 HG3 PRO 15 1HG PRO 15 -11.367 4.038 5.381
136 HD2 PRO 15 2HD PRO 15 -8.527 4.978 5.350
137 HD3 PRO 15 1HD PRO 15 -9.221 3.482 6.028
138 H LEU 16 H LEU 16 -10.466 3.734 0.481
139 HA LEU 16 HA LEU 16 -7.985 4.402 -0.656
140 HB2 LEU 16 2HB LEU 16 -9.381 2.933 -1.805
141 HB3 LEU 16 1HB LEU 16 -10.716 4.107 -1.844
142 HG LEU 16 HG LEU 16 -9.272 5.398 -3.406
143 HD11 LEU 16 1HD1 LEU 16 -7.388 4.213 -4.443
144 HD12 LEU 16 2HD1 LEU 16 -7.580 2.902 -3.282
145 HD13 LEU 16 3HD1 LEU 16 -7.098 4.504 -2.730
146 HD21 LEU 16 1HD2 LEU 16 -9.987 2.580 -4.062
147 HD22 LEU 16 2HD2 LEU 16 -9.709 3.889 -5.240
148 HD23 LEU 16 3HD2 LEU 16 -11.041 4.014 -4.078
149 H LYS 17 H LYS 17 -10.762 6.303 0.031
150 HA LYS 17 HA LYS 17 -10.268 8.569 -1.574
151 HB2 LYS 17 2HB LYS 17 -11.523 8.466 1.156
152 HB3 LYS 17 1HB LYS 17 -11.642 9.798 0.022
153 HG2 LYS 17 2HG LYS 17 -12.861 8.377 -1.523
154 HG3 LYS 17 1HG LYS 17 -12.733 7.029 -0.387
155 HD2 LYS 17 2HD LYS 17 -13.927 8.359 1.297
156 HD3 LYS 17 1HD LYS 17 -14.083 9.669 0.125
157 HE2 LYS 17 2HE LYS 17 -15.332 8.185 -1.343
158 HE3 LYS 17 1HE LYS 17 -15.186 6.895 -0.153
159 HZ1 LYS 17 1HZ LYS 17 -17.317 8.016 -0.016
160 HZ2 LYS 17 2HZ LYS 17 -16.549 9.485 0.294
161 HZ3 LYS 17 3HZ LYS 17 -16.432 8.224 1.411
162 H ARG 18 H ARG 18 -8.482 7.333 0.884
163 HA ARG 18 HA ARG 18 -7.385 9.970 1.756
164 HB2 ARG 18 2HB ARG 18 -7.571 7.353 3.234
165 HB3 ARG 18 1HB ARG 18 -6.718 8.771 3.844
166 HG2 ARG 18 2HG ARG 18 -8.797 9.992 3.969
167 HG3 ARG 18 1HG ARG 18 -9.634 8.668 3.155
168 HD2 ARG 18 2HD ARG 18 -10.000 8.695 5.604
169 HD3 ARG 18 1HD ARG 18 -9.270 7.211 5.010
170 HE ARG 18 HE ARG 18 -7.224 8.924 5.799
171 HH11 ARG 18 1HH1 ARG 18 -9.942 7.234 7.293
172 HH12 ARG 18 2HH1 ARG 18 -9.144 6.898 8.748
173 HH21 ARG 18 1HH2 ARG 18 -6.097 8.465 7.826
174 HH22 ARG 18 2HH2 ARG 18 -6.907 7.625 9.059
175 H ILE 19 H ILE 19 -6.643 7.770 -0.365
176 HA ILE 19 HA ILE 19 -3.867 7.361 0.513
177 HB ILE 19 HB ILE 19 -5.397 5.707 -1.521
178 HG12 ILE 19 2HG1 ILE 19 -4.726 4.988 1.326
179 HG13 ILE 19 1HG1 ILE 19 -6.332 5.472 0.852
180 HG21 ILE 19 1HG2 ILE 19 -2.771 5.261 -0.078
181 HG22 ILE 19 2HG2 ILE 19 -2.943 5.692 -1.776
182 HG23 ILE 19 3HG2 ILE 19 -3.513 4.122 -1.198
183 HD11 ILE 19 1HD1 ILE 19 -6.342 3.509 -0.730
184 HD12 ILE 19 2HD1 ILE 19 -6.228 3.089 0.985
185 HD13 ILE 19 3HD1 ILE 19 -4.801 3.068 -0.051
186 H LYS 20 H LYS 20 -2.409 8.358 -0.655
187 HA LYS 20 HA LYS 20 -3.202 9.711 -3.059
188 HB2 LYS 20 2HB LYS 20 -0.495 9.660 -1.723
189 HB3 LYS 20 1HB LYS 20 -0.926 10.670 -3.078
190 HG2 LYS 20 2HG LYS 20 -1.966 10.777 -0.314
191 HG3 LYS 20 1HG LYS 20 -0.979 11.982 -1.152
192 HD2 LYS 20 2HD LYS 20 -3.848 11.230 -1.620
193 HD3 LYS 20 1HD LYS 20 -3.235 12.760 -1.054
194 HE2 LYS 20 2HE LYS 20 -2.774 11.648 -3.825
195 HE3 LYS 20 1HE LYS 20 -3.899 12.941 -3.426
196 HZ1 LYS 20 1HZ LYS 20 -1.934 14.268 -2.700
197 HZ2 LYS 20 2HZ LYS 20 -1.942 13.867 -4.317
198 HZ3 LYS 20 3HZ LYS 20 -0.919 13.041 -3.287
199 H SER 21 H SER 21 -1.033 7.017 -2.112
200 HA SER 21 HA SER 21 -0.960 5.847 -4.650
201 HB2 SER 21 2HB SER 21 1.446 6.326 -5.160
202 HB3 SER 21 1HB SER 21 0.414 7.753 -5.298
203 HG SER 21 HG SER 21 1.238 7.585 -2.801
204 H TYR 22 H TYR 22 0.944 4.160 -4.623
205 HA TYR 22 HA TYR 22 1.582 3.446 -1.861
206 HB2 TYR 22 2HB TYR 22 1.220 1.095 -2.332
207 HB3 TYR 22 1HB TYR 22 -0.257 1.986 -2.615
208 HD1 TYR 22 1HD TYR 22 -1.368 1.733 -4.622
209 HD2 TYR 22 2HD TYR 22 2.651 0.429 -4.392
210 HE1 TYR 22 1HE TYR 22 -1.588 0.652 -6.824
211 HE2 TYR 22 2HE TYR 22 2.439 -0.649 -6.589
212 HH TYR 22 HH TYR 22 -0.207 -0.090 -8.663
213 H THR 23 H THR 23 3.356 2.045 -1.690
214 HA THR 23 HA THR 23 5.301 2.380 -3.861
215 HB THR 23 HB THR 23 5.796 2.198 -0.869
216 HG1 THR 23 1HG THR 23 5.086 4.248 -2.358
217 HG21 THR 23 1HG2 THR 23 7.601 1.218 -2.219
218 HG22 THR 23 2HG2 THR 23 8.138 2.711 -1.435
219 HG23 THR 23 3HG2 THR 23 7.715 2.711 -3.149
220 H ILE 24 H ILE 24 6.341 0.531 -4.501
221 HA ILE 24 HA ILE 24 5.208 -1.936 -3.540
222 HB ILE 24 HB ILE 24 7.088 -1.396 -5.858
223 HG12 ILE 24 2HG1 ILE 24 4.120 -2.002 -5.823
224 HG13 ILE 24 1HG1 ILE 24 4.834 -0.430 -6.153
225 HG21 ILE 24 1HG2 ILE 24 5.632 -3.940 -5.096
226 HG22 ILE 24 2HG2 ILE 24 7.373 -3.668 -5.004
227 HG23 ILE 24 3HG2 ILE 24 6.565 -3.700 -6.573
228 HD11 ILE 24 1HD1 ILE 24 5.158 -2.913 -7.825
229 HD12 ILE 24 2HD1 ILE 24 5.870 -1.333 -8.170
230 HD13 ILE 24 3HD1 ILE 24 4.119 -1.535 -8.195
231 H GLN 25 H GLN 25 6.135 -2.735 -1.793
232 HA GLN 25 HA GLN 25 8.956 -2.433 -1.346
233 HB2 GLN 25 2HB GLN 25 7.577 -2.219 0.552
234 HB3 GLN 25 1HB GLN 25 6.704 -3.694 0.192
235 HG2 GLN 25 2HG GLN 25 8.656 -4.997 0.693
236 HG3 GLN 25 1HG GLN 25 9.572 -3.524 1.003
237 HE21 GLN 25 1HE2 GLN 25 8.806 -5.807 2.689
238 HE22 GLN 25 2HE2 GLN 25 8.095 -5.110 4.098
239 H SER 26 H SER 26 10.331 -3.766 -2.191
240 HA SER 26 HA SER 26 9.425 -6.328 -3.145
241 HB2 SER 26 2HB SER 26 10.782 -4.922 -4.640
242 HB3 SER 26 1HB SER 26 12.089 -4.927 -3.454
243 HG SER 26 HG SER 26 11.004 -7.280 -4.579
244 H ASN 27 H ASN 27 10.067 -8.251 -2.300
245 HA ASN 27 HA ASN 27 10.900 -8.396 0.360
246 HB2 ASN 27 2HB ASN 27 9.365 -9.870 -1.022
247 HB3 ASN 27 1HB ASN 27 10.807 -10.519 -1.774
248 HD21 ASN 27 1HD2 ASN 27 8.725 -11.726 -0.259
249 HD22 ASN 27 2HD2 ASN 27 9.482 -12.513 1.073
250 H GLU 28 H GLU 28 12.573 -7.973 -2.561
251 HA GLU 28 HA GLU 28 14.955 -9.388 -1.970
252 HB2 GLU 28 2HB GLU 28 14.484 -7.041 -3.809
253 HB3 GLU 28 1HB GLU 28 15.949 -8.008 -3.750
254 HG2 GLU 28 2HG GLU 28 13.213 -9.002 -4.509
255 HG3 GLU 28 1HG GLU 28 14.529 -8.639 -5.623
256 H ALA 29 H ALA 29 13.890 -6.044 -1.475
257 HA ALA 29 HA ALA 29 16.442 -5.444 -0.144
258 HB1 ALA 29 1HB ALA 29 15.934 -3.094 -0.523
259 HB2 ALA 29 2HB ALA 29 14.366 -3.529 -1.206
260 HB3 ALA 29 3HB ALA 29 15.849 -4.002 -2.032
261 H CYS 30 H CYS 30 13.330 -6.277 0.647
262 HA CYS 30 HA CYS 30 13.571 -4.998 3.280
263 HB2 CYS 30 2HB CYS 30 11.031 -5.381 1.704
264 HB3 CYS 30 1HB CYS 30 11.149 -4.654 3.291
265 H ASN 31 H ASN 31 12.082 -6.210 4.886
266 HA ASN 31 HA ASN 31 12.849 -8.911 4.960
267 HB2 ASN 31 2HB ASN 31 10.674 -7.516 6.535
268 HB3 ASN 31 1HB ASN 31 11.172 -9.171 6.835
269 HD21 ASN 31 1HD2 ASN 31 11.838 -8.755 8.901
270 HD22 ASN 31 2HD2 ASN 31 13.227 -7.820 9.302
271 H ILE 32 H ILE 32 9.746 -7.509 4.083
272 HA ILE 32 HA ILE 32 8.954 -10.106 2.921
273 HB ILE 32 HB ILE 32 6.638 -9.745 3.671
274 HG12 ILE 32 2HG1 ILE 32 7.733 -7.338 5.157
275 HG13 ILE 32 1HG1 ILE 32 6.705 -7.271 3.736
276 HG21 ILE 32 1HG2 ILE 32 8.601 -9.538 5.919
277 HG22 ILE 32 2HG2 ILE 32 8.133 -11.039 5.108
278 HG23 ILE 32 3HG2 ILE 32 6.947 -10.139 6.076
279 HD11 ILE 32 1HD1 ILE 32 5.945 -8.393 6.420
280 HD12 ILE 32 2HD1 ILE 32 4.901 -8.322 4.999
281 HD13 ILE 32 3HD1 ILE 32 5.455 -6.834 5.762
282 H LYS 33 H LYS 33 6.856 -9.618 1.527
283 HA LYS 33 HA LYS 33 7.355 -7.134 0.100
284 HB2 LYS 33 2HB LYS 33 7.242 -9.153 -1.315
285 HB3 LYS 33 1HB LYS 33 5.645 -9.518 -0.671
286 HG2 LYS 33 2HG LYS 33 4.769 -7.460 -1.649
287 HG3 LYS 33 1HG LYS 33 6.365 -7.075 -2.274
288 HD2 LYS 33 2HD LYS 33 6.315 -9.113 -3.648
289 HD3 LYS 33 1HD LYS 33 4.698 -9.476 -3.035
290 HE2 LYS 33 2HE LYS 33 3.861 -7.382 -3.961
291 HE3 LYS 33 1HE LYS 33 5.473 -6.988 -4.555
292 HZ1 LYS 33 1HZ LYS 33 3.824 -9.299 -5.431
293 HZ2 LYS 33 2HZ LYS 33 5.355 -8.920 -6.009
294 HZ3 LYS 33 3HZ LYS 33 4.054 -7.886 -6.293
295 H ALA 34 H ALA 34 6.117 -5.445 0.843
296 HA ALA 34 HA ALA 34 3.332 -5.992 1.493
297 HB1 ALA 34 1HB ALA 34 4.531 -5.937 3.665
298 HB2 ALA 34 2HB ALA 34 3.494 -4.535 3.494
299 HB3 ALA 34 3HB ALA 34 5.228 -4.383 3.244
300 H ILE 35 H ILE 35 2.174 -4.709 0.204
301 HA ILE 35 HA ILE 35 3.404 -2.479 -1.061
302 HB ILE 35 HB ILE 35 0.508 -3.375 -1.060
303 HG12 ILE 35 2HG1 ILE 35 2.134 -4.886 -2.080
304 HG13 ILE 35 1HG1 ILE 35 1.055 -4.219 -3.320
305 HG21 ILE 35 1HG2 ILE 35 0.174 -1.795 -2.946
306 HG22 ILE 35 2HG2 ILE 35 1.825 -1.243 -2.764
307 HG23 ILE 35 3HG2 ILE 35 0.668 -0.927 -1.491
308 HD11 ILE 35 1HD1 ILE 35 3.289 -4.361 -4.102
309 HD12 ILE 35 2HD1 ILE 35 3.904 -3.489 -2.703
310 HD13 ILE 35 3HD1 ILE 35 2.893 -2.652 -3.890
311 H ILE 36 H ILE 36 3.520 -0.527 -0.492
312 HA ILE 36 HA ILE 36 2.578 0.067 2.181
313 HB ILE 36 HB ILE 36 4.723 1.276 0.447
314 HG12 ILE 36 2HG1 ILE 36 5.115 -0.344 2.907
315 HG13 ILE 36 1HG1 ILE 36 4.848 -1.154 1.364
316 HG21 ILE 36 1HG2 ILE 36 3.826 2.876 2.096
317 HG22 ILE 36 2HG2 ILE 36 5.448 2.351 2.542
318 HG23 ILE 36 3HG2 ILE 36 4.045 1.676 3.374
319 HD11 ILE 36 1HD1 ILE 36 6.788 -0.120 0.465
320 HD12 ILE 36 2HD1 ILE 36 7.180 -0.943 1.978
321 HD13 ILE 36 3HD1 ILE 36 7.039 0.822 1.943
322 H PHE 37 H PHE 37 0.795 1.126 2.177
323 HA PHE 37 HA PHE 37 -0.072 2.858 0.049
324 HB2 PHE 37 2HB PHE 37 -1.202 1.772 2.579
325 HB3 PHE 37 1HB PHE 37 -1.990 3.158 1.798
326 HD1 PHE 37 1HD PHE 37 -0.308 0.540 -0.017
327 HD2 PHE 37 2HD PHE 37 -4.003 1.958 1.351
328 HE1 PHE 37 1HE PHE 37 -1.493 -1.017 -1.603
329 HE2 PHE 37 2HE PHE 37 -5.192 0.448 -0.181
330 HZ PHE 37 HZ PHE 37 -3.922 -1.031 -1.658
331 H THR 38 H THR 38 0.130 4.904 0.020
332 HA THR 38 HA THR 38 1.057 6.143 2.493
333 HB THR 38 HB THR 38 1.562 7.053 -0.354
334 HG1 THR 38 1HG THR 38 2.626 5.104 1.020
335 HG21 THR 38 1HG2 THR 38 1.567 8.860 1.235
336 HG22 THR 38 2HG2 THR 38 3.245 8.531 0.758
337 HG23 THR 38 3HG2 THR 38 2.615 7.965 2.317
338 H THR 39 H THR 39 -0.159 7.740 3.327
339 HA THR 39 HA THR 39 -2.676 8.266 2.029
340 HB THR 39 HB THR 39 -3.138 9.567 4.158
341 HG1 THR 39 1HG THR 39 -1.570 8.484 5.824
342 HG21 THR 39 1HG2 THR 39 -3.997 7.328 3.792
343 HG22 THR 39 2HG2 THR 39 -3.534 7.520 5.479
344 HG23 THR 39 3HG2 THR 39 -2.486 6.632 4.370
345 H LYS 40 H LYS 40 -3.455 10.619 2.439
346 HA LYS 40 HA LYS 40 -1.855 12.328 0.833
347 HB2 LYS 40 2HB LYS 40 -3.931 13.254 2.744
348 HB3 LYS 40 1HB LYS 40 -3.508 13.982 1.200
349 HG2 LYS 40 2HG LYS 40 -4.478 11.633 0.238
350 HG3 LYS 40 1HG LYS 40 -5.184 11.620 1.818
351 HD2 LYS 40 2HD LYS 40 -6.243 13.756 1.504
352 HD3 LYS 40 1HD LYS 40 -5.435 13.863 -0.077
353 HE2 LYS 40 2HE LYS 40 -6.593 11.968 -0.879
354 HE3 LYS 40 1HE LYS 40 -7.350 11.707 0.682
355 HZ1 LYS 40 1HZ LYS 40 -8.514 13.811 0.475
356 HZ2 LYS 40 2HZ LYS 40 -8.827 12.856 -0.906
357 HZ3 LYS 40 3HZ LYS 40 -7.742 14.119 -0.992
358 H LYS 41 H LYS 41 -1.941 11.759 4.209
359 HA LYS 41 HA LYS 41 -0.386 14.078 4.860
360 HB2 LYS 41 2HB LYS 41 -1.095 11.583 6.413
361 HB3 LYS 41 1HB LYS 41 -0.006 12.795 7.058
362 HG2 LYS 41 2HG LYS 41 -2.242 13.107 7.961
363 HG3 LYS 41 1HG LYS 41 -1.805 14.464 6.944
364 HD2 LYS 41 2HD LYS 41 -3.149 13.516 5.111
365 HD3 LYS 41 1HD LYS 41 -3.592 12.161 6.148
366 HE2 LYS 41 2HE LYS 41 -5.375 13.821 6.068
367 HE3 LYS 41 1HE LYS 41 -4.710 13.706 7.692
368 HZ1 LYS 41 1HZ LYS 41 -4.090 15.822 5.694
369 HZ2 LYS 41 2HZ LYS 41 -3.427 15.749 7.244
370 HZ3 LYS 41 3HZ LYS 41 -5.075 15.993 7.043
371 H GLY 42 H GLY 42 0.127 11.080 3.506
372 HA2 GLY 42 2HA GLY 42 1.988 10.436 2.414
373 HA3 GLY 42 1HA GLY 42 2.900 11.668 3.237
374 H ARG 43 H ARG 43 1.028 9.719 5.270
375 HA ARG 43 HA ARG 43 3.276 8.501 6.517
376 HB2 ARG 43 2HB ARG 43 0.348 8.058 6.744
377 HB3 ARG 43 1HB ARG 43 1.510 7.215 7.766
378 HG2 ARG 43 2HG ARG 43 2.278 9.405 8.631
379 HG3 ARG 43 1HG ARG 43 1.052 10.204 7.647
380 HD2 ARG 43 2HD ARG 43 0.339 9.949 9.989
381 HD3 ARG 43 1HD ARG 43 -0.709 9.070 8.887
382 HE ARG 43 HE ARG 43 1.052 7.184 9.625
383 HH11 ARG 43 1HH1 ARG 43 -0.774 9.485 11.622
384 HH12 ARG 43 2HH1 ARG 43 -0.995 8.394 12.913
385 HH21 ARG 43 1HH2 ARG 43 0.731 5.698 11.408
386 HH22 ARG 43 2HH2 ARG 43 -0.125 6.204 12.781
387 H LYS 44 H LYS 44 3.710 6.234 6.688
388 HA LYS 44 HA LYS 44 3.110 4.826 4.203
389 HB2 LYS 44 2HB LYS 44 5.236 4.303 6.297
390 HB3 LYS 44 1HB LYS 44 5.027 3.379 4.816
391 HG2 LYS 44 2HG LYS 44 5.735 6.314 4.964
392 HG3 LYS 44 1HG LYS 44 6.868 5.000 4.648
393 HD2 LYS 44 2HD LYS 44 5.641 4.436 2.605
394 HD3 LYS 44 1HD LYS 44 4.484 5.718 2.935
395 HE2 LYS 44 2HE LYS 44 6.104 6.444 1.278
396 HE3 LYS 44 1HE LYS 44 6.256 7.388 2.750
397 HZ1 LYS 44 1HZ LYS 44 8.051 5.105 2.025
398 HZ2 LYS 44 2HZ LYS 44 8.254 6.148 3.338
399 HZ3 LYS 44 3HZ LYS 44 8.391 6.717 1.774
400 H ILE 45 H ILE 45 1.490 3.473 4.260
401 HA ILE 45 HA ILE 45 0.862 2.058 6.731
402 HB ILE 45 HB ILE 45 -0.881 2.535 4.291
403 HG12 ILE 45 2HG1 ILE 45 -2.359 3.796 6.074
404 HG13 ILE 45 1HG1 ILE 45 -0.898 3.751 7.043
405 HG21 ILE 45 1HG2 ILE 45 -1.566 1.107 6.863
406 HG22 ILE 45 2HG2 ILE 45 -1.397 0.384 5.263
407 HG23 ILE 45 3HG2 ILE 45 -2.717 1.509 5.589
408 HD11 ILE 45 1HD1 ILE 45 -1.226 5.869 5.935
409 HD12 ILE 45 2HD1 ILE 45 -1.121 5.055 4.374
410 HD13 ILE 45 3HD1 ILE 45 0.279 5.077 5.447
411 H CYS 46 H CYS 46 1.649 0.169 6.760
412 HA CYS 46 HA CYS 46 2.608 -1.278 4.473
413 HB2 CYS 46 2HB CYS 46 2.222 -2.187 7.314
414 HB3 CYS 46 1HB CYS 46 3.288 -2.917 6.124
415 H ALA 47 H ALA 47 1.054 -2.196 3.108
416 HA ALA 47 HA ALA 47 -1.177 -3.519 4.464
417 HB1 ALA 47 1HB ALA 47 -1.160 -2.244 1.736
418 HB2 ALA 47 2HB ALA 47 -1.853 -1.534 3.192
419 HB3 ALA 47 3HB ALA 47 -2.536 -3.018 2.525
420 H ASN 48 H ASN 48 -1.828 -5.503 3.769
421 HA ASN 48 HA ASN 48 0.122 -7.094 2.465
422 HB2 ASN 48 2HB ASN 48 -1.025 -8.121 4.220
423 HB3 ASN 48 1HB ASN 48 -2.605 -7.654 3.652
424 HD21 ASN 48 1HD2 ASN 48 0.029 -9.113 1.812
425 HD22 ASN 48 2HD2 ASN 48 -0.862 -10.544 1.417
426 HA PRO 49 HA PRO 49 -1.275 -6.007 -1.681
427 HB2 PRO 49 2HB PRO 49 0.249 -7.965 -2.889
428 HB3 PRO 49 1HB PRO 49 0.774 -6.310 -2.584
429 HG2 PRO 49 2HG PRO 49 1.345 -8.799 -1.071
430 HG3 PRO 49 1HG PRO 49 2.377 -7.380 -1.317
431 HD2 PRO 49 2HD PRO 49 1.145 -7.839 1.016
432 HD3 PRO 49 1HD PRO 49 1.359 -6.200 0.405
433 H ASN 50 H ASN 50 -1.382 -9.142 -0.164
434 HA ASN 50 HA ASN 50 -2.721 -10.404 -2.284
435 HB2 ASN 50 2HB ASN 50 -2.566 -11.263 0.602
436 HB3 ASN 50 1HB ASN 50 -3.039 -12.233 -0.798
437 HD21 ASN 50 1HD2 ASN 50 -0.853 -12.430 1.173
438 HD22 ASN 50 2HD2 ASN 50 0.597 -12.608 0.261
439 H GLU 51 H GLU 51 -3.692 -8.197 0.154
440 HA GLU 51 HA GLU 51 -6.313 -9.274 0.587
441 HB2 GLU 51 2HB GLU 51 -5.314 -6.516 1.269
442 HB3 GLU 51 1HB GLU 51 -6.781 -7.275 1.869
443 HG2 GLU 51 2HG GLU 51 -5.101 -9.065 2.849
444 HG3 GLU 51 1HG GLU 51 -3.965 -7.831 2.434
445 H LYS 52 H LYS 52 -8.124 -8.798 -0.349
446 HA LYS 52 HA LYS 52 -8.211 -7.876 -2.951
447 HB2 LYS 52 2HB LYS 52 -9.903 -9.347 -2.001
448 HB3 LYS 52 1HB LYS 52 -10.459 -8.062 -0.946
449 HG2 LYS 52 2HG LYS 52 -11.165 -6.765 -2.897
450 HG3 LYS 52 1HG LYS 52 -10.601 -8.063 -3.948
451 HD2 LYS 52 2HD LYS 52 -12.207 -9.597 -2.907
452 HD3 LYS 52 1HD LYS 52 -12.771 -8.290 -1.863
453 HE2 LYS 52 2HE LYS 52 -14.257 -8.605 -3.776
454 HE3 LYS 52 1HE LYS 52 -13.485 -7.021 -3.808
455 HZ1 LYS 52 1HZ LYS 52 -13.489 -8.046 -5.977
456 HZ2 LYS 52 2HZ LYS 52 -12.662 -9.386 -5.398
457 HZ3 LYS 52 3HZ LYS 52 -11.901 -7.881 -5.436
458 H TRP 53 H TRP 53 -8.781 -6.054 0.047
459 HA TRP 53 HA TRP 53 -9.844 -3.787 -1.266
460 HB2 TRP 53 2HB TRP 53 -9.605 -2.561 0.787
461 HB3 TRP 53 1HB TRP 53 -10.138 -4.183 1.189
462 HD1 TRP 53 HD TRP 53 -8.301 -5.760 2.501
463 HE1 TRP 53 1HE TRP 53 -6.274 -5.124 3.917
464 HE3 TRP 53 3HE TRP 53 -7.741 -0.903 1.027
465 HZ2 TRP 53 2HZ TRP 53 -4.648 -2.900 4.379
466 HZ3 TRP 53 3HZ TRP 53 -5.920 0.402 2.006
467 HH2 TRP 53 HH TRP 53 -4.399 -0.573 3.653
468 H VAL 54 H VAL 54 -6.641 -4.844 -0.583
469 HA VAL 54 HA VAL 54 -5.325 -2.399 -1.145
470 HB VAL 54 HB VAL 54 -4.277 -5.257 -1.116
471 HG11 VAL 54 1HG1 VAL 54 -2.735 -2.675 -1.066
472 HG12 VAL 54 2HG1 VAL 54 -2.834 -3.755 -2.453
473 HG13 VAL 54 3HG1 VAL 54 -2.049 -4.286 -0.961
474 HG21 VAL 54 1HG2 VAL 54 -4.093 -3.065 0.924
475 HG22 VAL 54 2HG2 VAL 54 -3.387 -4.676 1.059
476 HG23 VAL 54 3HG2 VAL 54 -5.140 -4.480 1.025
477 H GLN 55 H GLN 55 -6.088 -5.328 -2.895
478 HA GLN 55 HA GLN 55 -4.718 -4.670 -5.242
479 HB2 GLN 55 2HB GLN 55 -7.029 -6.543 -4.902
480 HB3 GLN 55 1HB GLN 55 -5.916 -6.498 -6.273
481 HG2 GLN 55 2HG GLN 55 -4.060 -6.825 -4.635
482 HG3 GLN 55 1HG GLN 55 -5.292 -7.151 -3.426
483 HE21 GLN 55 1HE2 GLN 55 -3.240 -8.776 -4.334
484 HE22 GLN 55 2HE2 GLN 55 -3.910 -10.181 -5.040
485 H LYS 56 H LYS 56 -8.057 -4.139 -4.179
486 HA LYS 56 HA LYS 56 -9.135 -3.098 -6.535
487 HB2 LYS 56 2HB LYS 56 -10.465 -3.757 -4.540
488 HB3 LYS 56 1HB LYS 56 -9.749 -2.425 -3.658
489 HG2 LYS 56 2HG LYS 56 -10.733 -0.837 -5.185
490 HG3 LYS 56 1HG LYS 56 -11.463 -2.167 -6.093
491 HD2 LYS 56 2HD LYS 56 -12.750 -2.809 -4.136
492 HD3 LYS 56 1HD LYS 56 -12.008 -1.504 -3.200
493 HE2 LYS 56 2HE LYS 56 -12.976 0.140 -4.737
494 HE3 LYS 56 1HE LYS 56 -13.736 -1.147 -5.662
495 HZ1 LYS 56 1HZ LYS 56 -15.023 -1.719 -3.653
496 HZ2 LYS 56 2HZ LYS 56 -15.290 -0.128 -4.155
497 HZ3 LYS 56 3HZ LYS 56 -14.297 -0.437 -2.839
498 H ALA 57 H ALA 57 -7.450 -1.628 -3.802
499 HA ALA 57 HA ALA 57 -7.645 1.052 -4.663
500 HB1 ALA 57 1HB ALA 57 -5.863 1.500 -3.041
501 HB2 ALA 57 2HB ALA 57 -5.611 -0.227 -2.835
502 HB3 ALA 57 3HB ALA 57 -7.147 0.523 -2.337
503 H MET 58 H MET 58 -5.194 -1.432 -5.147
504 HA MET 58 HA MET 58 -3.161 0.025 -6.207
505 HB2 MET 58 2HB MET 58 -4.048 -2.683 -7.158
506 HB3 MET 58 1HB MET 58 -2.524 -1.937 -7.583
507 HG2 MET 58 2HG MET 58 -1.977 -1.890 -5.187
508 HG3 MET 58 1HG MET 58 -3.450 -2.798 -4.884
509 HE1 MET 58 1HE MET 58 -0.732 -5.643 -4.545
510 HE2 MET 58 2HE MET 58 -2.206 -4.998 -3.855
511 HE3 MET 58 3HE MET 58 -0.769 -3.973 -3.947
512 H LYS 59 H LYS 59 -5.842 -1.451 -7.928
513 HA LYS 59 HA LYS 59 -5.216 -0.709 -10.509
514 HB2 LYS 59 2HB LYS 59 -7.933 -1.029 -9.233
515 HB3 LYS 59 1HB LYS 59 -7.595 -1.070 -10.959
516 HG2 LYS 59 2HG LYS 59 -6.284 -3.081 -10.691
517 HG3 LYS 59 1HG LYS 59 -6.506 -3.014 -8.938
518 HD2 LYS 59 2HD LYS 59 -8.929 -3.259 -9.265
519 HD3 LYS 59 1HD LYS 59 -8.674 -3.358 -11.005
520 HE2 LYS 59 2HE LYS 59 -7.588 -5.272 -8.944
521 HE3 LYS 59 1HE LYS 59 -8.957 -5.581 -10.007
522 HZ1 LYS 59 1HZ LYS 59 -6.930 -6.600 -10.835
523 HZ2 LYS 59 2HZ LYS 59 -6.157 -5.109 -10.905
524 HZ3 LYS 59 3HZ LYS 59 -7.479 -5.432 -11.908
525 H HIS 60 H HIS 60 -7.267 0.919 -8.084
526 HA HIS 60 HA HIS 60 -8.018 3.033 -9.735
527 HB2 HIS 60 2HB HIS 60 -9.268 2.272 -7.777
528 HB3 HIS 60 1HB HIS 60 -7.940 2.758 -6.737
529 HD1 HIS 60 1HD HIS 60 -10.728 4.142 -8.843
530 HD2 HIS 60 2HD HIS 60 -7.895 5.317 -6.091
531 HE1 HIS 60 1HE HIS 60 -11.367 6.478 -8.266
532 HE2 HIS 60 2HE HIS 60 -9.797 7.117 -6.407
533 H LEU 61 H LEU 61 -5.361 2.582 -7.527
534 HA LEU 61 HA LEU 61 -4.398 5.278 -7.633
535 HB2 LEU 61 2HB LEU 61 -3.052 2.710 -6.791
536 HB3 LEU 61 1HB LEU 61 -2.403 4.316 -6.523
537 HG LEU 61 HG LEU 61 -5.012 3.342 -5.355
538 HD11 LEU 61 1HD1 LEU 61 -2.282 3.485 -4.082
539 HD12 LEU 61 2HD1 LEU 61 -3.226 2.019 -4.437
540 HD13 LEU 61 3HD1 LEU 61 -3.796 3.169 -3.237
541 HD21 LEU 61 1HD2 LEU 61 -3.314 5.767 -4.753
542 HD22 LEU 61 2HD2 LEU 61 -4.771 5.291 -3.886
543 HD23 LEU 61 3HD2 LEU 61 -4.874 5.770 -5.577
544 H ASP 62 H ASP 62 -4.031 2.459 -9.590
545 HA ASP 62 HA ASP 62 -1.551 3.121 -10.832
546 HB2 ASP 62 2HB ASP 62 -2.264 0.829 -10.753
547 HB3 ASP 62 1HB ASP 62 -3.751 1.211 -11.605
548 H LYS 63 H LYS 63 -4.905 3.827 -11.595
549 HA LYS 63 HA LYS 63 -3.798 5.407 -13.718
550 HB2 LYS 63 2HB LYS 63 -5.884 5.377 -15.045
551 HB3 LYS 63 1HB LYS 63 -5.171 3.793 -14.850
552 HG2 LYS 63 2HG LYS 63 -7.566 4.827 -13.334
553 HG3 LYS 63 1HG LYS 63 -7.619 3.845 -14.794
554 HD2 LYS 63 2HD LYS 63 -6.263 2.947 -12.258
555 HD3 LYS 63 1HD LYS 63 -7.963 2.664 -12.565
556 HE2 LYS 63 2HE LYS 63 -6.579 0.715 -13.032
557 HE3 LYS 63 1HE LYS 63 -7.418 1.244 -14.476
558 HZ1 LYS 63 1HZ LYS 63 -4.465 1.537 -13.877
559 HZ2 LYS 63 2HZ LYS 63 -5.223 2.211 -15.240
560 HZ3 LYS 63 3HZ LYS 63 -5.215 0.578 -14.977
561 H LYS 64 H LYS 64 -3.326 6.844 -12.255
562 HA LYS 64 HA LYS 64 -5.272 8.836 -11.739
563 HB2 LYS 64 2HB LYS 64 -5.754 7.226 -9.931
564 HB3 LYS 64 1HB LYS 64 -4.078 7.162 -9.480
565 HG2 LYS 64 2HG LYS 64 -5.818 9.630 -9.225
566 HG3 LYS 64 1HG LYS 64 -5.587 8.455 -7.935
567 HD2 LYS 64 2HD LYS 64 -3.434 10.129 -9.235
568 HD3 LYS 64 1HD LYS 64 -4.146 10.404 -7.640
569 HE2 LYS 64 2HE LYS 64 -3.259 8.271 -6.859
570 HE3 LYS 64 1HE LYS 64 -2.624 7.927 -8.463
571 HZ1 LYS 64 1HZ LYS 64 -1.190 9.858 -8.248
572 HZ2 LYS 64 2HZ LYS 64 -0.911 8.735 -7.019
573 HZ3 LYS 64 3HZ LYS 64 -1.779 10.135 -6.694