NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
505309 |
2epu   |
cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 93 H GLY 93 14.815 -1.128 -24.587
2 HA2 GLY 93 1HA GLY 93 14.597 -3.873 -24.149
3 HA3 GLY 93 2HA GLY 93 15.950 -3.089 -24.952
4 H SER 94 H SER 94 14.705 -3.272 -21.612
5 HA SER 94 HA SER 94 17.302 -3.150 -20.467
6 HB2 SER 94 1HB SER 94 16.203 -3.520 -18.351
7 HB3 SER 94 2HB SER 94 15.189 -2.445 -19.313
8 HG SER 94 HG SER 94 14.177 -4.597 -19.969
9 H SER 95 H SER 95 18.458 -4.778 -19.363
10 HA SER 95 HA SER 95 18.969 -7.103 -20.632
11 HB2 SER 95 1HB SER 95 19.163 -6.386 -17.722
12 HB3 SER 95 2HB SER 95 19.602 -8.005 -18.265
13 HG SER 95 HG SER 95 20.683 -5.590 -19.296
14 H GLY 96 H GLY 96 16.705 -6.821 -17.889
15 HA2 GLY 96 1HA GLY 96 14.543 -7.904 -18.000
16 HA3 GLY 96 2HA GLY 96 15.285 -9.171 -18.965
17 H SER 97 H SER 97 16.327 -7.693 -15.907
18 HA SER 97 HA SER 97 16.627 -10.369 -14.782
19 HB2 SER 97 1HB SER 97 17.445 -7.708 -13.595
20 HB3 SER 97 2HB SER 97 17.932 -9.307 -13.034
21 HG SER 97 HG SER 97 19.288 -9.495 -14.680
22 H SER 98 H SER 98 14.982 -11.219 -13.709
23 HA SER 98 HA SER 98 13.477 -9.534 -11.846
24 HB2 SER 98 1HB SER 98 11.359 -10.713 -12.602
25 HB3 SER 98 2HB SER 98 12.026 -9.544 -13.741
26 HG SER 98 HG SER 98 12.732 -12.265 -13.902
27 H GLY 99 H GLY 99 11.982 -10.979 -10.467
28 HA2 GLY 99 1HA GLY 99 11.718 -12.754 -9.026
29 HA3 GLY 99 2HA GLY 99 12.665 -13.725 -10.143
30 H THR 100 H THR 100 12.941 -11.297 -7.579
31 HA THR 100 HA THR 100 15.717 -12.077 -7.115
32 HB THR 100 HB THR 100 15.702 -10.221 -5.434
33 HG1 THR 100 1HG THR 100 13.184 -10.415 -5.472
34 HG21 THR 100 3HG2 THR 100 14.826 -8.655 -7.651
35 HG22 THR 100 1HG2 THR 100 15.677 -10.073 -8.264
36 HG23 THR 100 2HG2 THR 100 16.474 -8.991 -7.122
37 H GLY 101 H GLY 101 12.549 -12.525 -5.805
38 HA2 GLY 101 1HA GLY 101 12.669 -14.659 -4.349
39 HA3 GLY 101 2HA GLY 101 13.666 -13.639 -3.322
40 H GLN 102 H GLN 102 12.709 -11.897 -2.205
41 HA GLN 102 HA GLN 102 9.884 -11.414 -2.391
42 HB2 GLN 102 1HB GLN 102 10.357 -13.577 -0.942
43 HB3 GLN 102 2HB GLN 102 10.727 -12.389 0.301
44 HG2 GLN 102 1HG GLN 102 8.466 -11.372 -0.181
45 HG3 GLN 102 2HG GLN 102 8.129 -12.810 -1.142
46 HE21 GLN 102 1HE2 GLN 102 7.706 -11.455 1.794
47 HE22 GLN 102 2HE2 GLN 102 7.503 -12.875 2.755
48 H LYS 103 H LYS 103 9.737 -9.295 -2.150
49 HA LYS 103 HA LYS 103 11.705 -7.899 -0.489
50 HB2 LYS 103 1HB LYS 103 9.848 -7.003 -2.682
51 HB3 LYS 103 2HB LYS 103 10.643 -5.847 -1.622
52 HG2 LYS 103 1HG LYS 103 12.788 -7.223 -2.347
53 HG3 LYS 103 2HG LYS 103 11.777 -7.565 -3.753
54 HD2 LYS 103 1HD LYS 103 12.770 -5.634 -4.461
55 HD3 LYS 103 2HD LYS 103 11.364 -4.953 -3.639
56 HE2 LYS 103 1HE LYS 103 13.179 -3.688 -2.866
57 HE3 LYS 103 2HE LYS 103 12.846 -4.833 -1.568
58 HZ1 LYS 103 3HZ LYS 103 15.027 -4.967 -3.572
59 HZ2 LYS 103 1HZ LYS 103 14.630 -6.253 -2.547
60 HZ3 LYS 103 2HZ LYS 103 15.175 -4.790 -1.896
61 HA PRO 104 HA PRO 104 8.864 -6.896 2.703
62 HB2 PRO 104 1HB PRO 104 9.662 -4.392 3.381
63 HB3 PRO 104 2HB PRO 104 10.603 -5.837 3.767
64 HG2 PRO 104 1HG PRO 104 10.961 -3.887 1.524
65 HG3 PRO 104 2HG PRO 104 12.188 -4.630 2.567
66 HD2 PRO 104 1HD PRO 104 11.676 -5.516 0.060
67 HD3 PRO 104 2HD PRO 104 12.196 -6.599 1.368
68 H PHE 105 H PHE 105 8.856 -5.238 -0.243
69 HA PHE 105 HA PHE 105 6.142 -4.322 0.217
70 HB2 PHE 105 1HB PHE 105 8.185 -2.361 -0.828
71 HB3 PHE 105 2HB PHE 105 6.508 -2.043 -0.393
72 HD1 PHE 105 2HD PHE 105 5.836 -2.162 2.019
73 HD2 PHE 105 1HD PHE 105 9.903 -2.228 0.763
74 HE1 PHE 105 2HE PHE 105 6.544 -1.534 4.290
75 HE2 PHE 105 1HE PHE 105 10.617 -1.601 3.033
76 HZ PHE 105 HZ PHE 105 8.937 -1.252 4.799
77 H GLU 106 H GLU 106 5.171 -5.387 -1.388
78 HA GLU 106 HA GLU 106 6.296 -5.114 -4.098
79 HB2 GLU 106 1HB GLU 106 6.427 -7.438 -3.060
80 HB3 GLU 106 2HB GLU 106 4.672 -7.475 -3.162
81 HG2 GLU 106 1HG GLU 106 4.675 -7.527 -5.476
82 HG3 GLU 106 2HG GLU 106 6.313 -6.884 -5.587
83 H CYS 107 H CYS 107 4.852 -4.789 -5.791
84 HA CYS 107 HA CYS 107 2.281 -3.683 -4.977
85 HB2 CYS 107 1HB CYS 107 3.896 -2.471 -6.520
86 HB3 CYS 107 2HB CYS 107 3.482 -3.665 -7.746
87 H THR 108 H THR 108 1.522 -5.917 -4.487
88 HA THR 108 HA THR 108 1.186 -8.061 -6.028
89 HB THR 108 HB THR 108 0.089 -7.933 -3.881
90 HG1 THR 108 1HG THR 108 -2.130 -8.636 -4.688
91 HG21 THR 108 3HG2 THR 108 -1.673 -5.892 -5.224
92 HG22 THR 108 1HG2 THR 108 -0.684 -5.692 -3.778
93 HG23 THR 108 2HG2 THR 108 -2.125 -6.709 -3.728
94 H HIS 109 H HIS 109 -0.467 -4.993 -6.537
95 HA HIS 109 HA HIS 109 -2.389 -5.611 -8.366
96 HB2 HIS 109 1HB HIS 109 -0.502 -3.255 -8.319
97 HB3 HIS 109 2HB HIS 109 -1.872 -3.362 -9.422
98 HD2 HIS 109 2HD HIS 109 -1.215 -1.656 -6.275
99 HE1 HIS 109 1HE HIS 109 -5.245 -2.921 -5.878
100 HE2 HIS 109 2HE HIS 109 -3.464 -1.353 -5.034
101 H CYS 110 H CYS 110 0.974 -4.782 -9.228
102 HA CYS 110 HA CYS 110 0.598 -6.292 -11.730
103 HB2 CYS 110 1HB CYS 110 2.365 -4.870 -12.695
104 HB3 CYS 110 2HB CYS 110 0.995 -3.917 -12.133
105 H GLY 111 H GLY 111 2.890 -5.532 -9.136
106 HA2 GLY 111 1HA GLY 111 3.976 -7.625 -8.237
107 HA3 GLY 111 2HA GLY 111 4.425 -7.935 -9.907
108 H LYS 112 H LYS 112 4.474 -4.647 -9.038
109 HA LYS 112 HA LYS 112 7.308 -4.499 -9.411
110 HB2 LYS 112 1HB LYS 112 5.491 -2.754 -10.025
111 HB3 LYS 112 2HB LYS 112 5.618 -2.254 -8.343
112 HG2 LYS 112 1HG LYS 112 7.092 -0.819 -9.338
113 HG3 LYS 112 2HG LYS 112 8.174 -2.136 -8.881
114 HD2 LYS 112 1HD LYS 112 8.140 -3.020 -11.109
115 HD3 LYS 112 2HD LYS 112 6.881 -1.882 -11.593
116 HE2 LYS 112 1HE LYS 112 8.334 -0.095 -11.656
117 HE3 LYS 112 2HE LYS 112 9.460 -0.835 -10.518
118 HZ1 LYS 112 3HZ LYS 112 10.599 -1.100 -12.454
119 HZ2 LYS 112 1HZ LYS 112 9.208 -1.230 -13.408
120 HZ3 LYS 112 2HZ LYS 112 9.717 -2.543 -12.472
121 H SER 113 H SER 113 8.762 -4.934 -7.902
122 HA SER 113 HA SER 113 8.014 -4.828 -5.086
123 HB2 SER 113 1HB SER 113 10.053 -6.062 -4.667
124 HB3 SER 113 2HB SER 113 9.213 -6.814 -6.024
125 HG SER 113 HG SER 113 10.634 -5.564 -7.400
126 H PHE 114 H PHE 114 9.469 -3.843 -3.511
127 HA PHE 114 HA PHE 114 11.242 -1.760 -4.498
128 HB2 PHE 114 1HB PHE 114 8.816 -1.156 -2.794
129 HB3 PHE 114 2HB PHE 114 10.120 -0.017 -3.117
130 HD1 PHE 114 2HD PHE 114 7.379 -1.941 -4.665
131 HD2 PHE 114 1HD PHE 114 10.210 1.203 -5.134
132 HE1 PHE 114 2HE PHE 114 6.231 -1.218 -6.718
133 HE2 PHE 114 1HE PHE 114 9.067 1.931 -7.187
134 HZ PHE 114 HZ PHE 114 7.075 0.719 -7.983
135 H ARG 115 H ARG 115 12.255 -0.565 -2.576
136 HA ARG 115 HA ARG 115 13.109 -2.590 -0.668
137 HB2 ARG 115 1HB ARG 115 14.154 0.115 -1.461
138 HB3 ARG 115 2HB ARG 115 14.737 -0.693 -0.011
139 HG2 ARG 115 1HG ARG 115 14.751 -2.218 -2.557
140 HG3 ARG 115 2HG ARG 115 15.955 -0.947 -2.335
141 HD2 ARG 115 1HD ARG 115 15.463 -3.140 -0.331
142 HD3 ARG 115 2HD ARG 115 16.662 -3.254 -1.618
143 HE ARG 115 HE ARG 115 16.929 -0.901 0.011
144 HH11 ARG 115 2HH1 ARG 115 17.768 -4.262 -0.330
145 HH12 ARG 115 1HH1 ARG 115 19.192 -4.141 0.649
146 HH21 ARG 115 2HH2 ARG 115 18.801 -0.728 1.303
147 HH22 ARG 115 1HH2 ARG 115 19.778 -2.130 1.578
148 H ALA 116 H ALA 116 11.680 0.652 -0.675
149 HA ALA 116 HA ALA 116 10.965 0.254 2.158
150 HB1 ALA 116 3HB ALA 116 11.481 2.845 0.705
151 HB2 ALA 116 1HB ALA 116 10.944 2.703 2.379
152 HB3 ALA 116 2HB ALA 116 12.529 2.089 1.905
153 H LYS 117 H LYS 117 8.920 1.141 2.848
154 HA LYS 117 HA LYS 117 6.765 0.416 1.257
155 HB2 LYS 117 1HB LYS 117 6.772 0.765 3.756
156 HB3 LYS 117 2HB LYS 117 6.671 2.494 3.447
157 HG2 LYS 117 1HG LYS 117 4.474 1.785 3.881
158 HG3 LYS 117 2HG LYS 117 4.569 2.005 2.132
159 HD2 LYS 117 1HD LYS 117 4.867 -0.393 1.831
160 HD3 LYS 117 2HD LYS 117 4.835 -0.631 3.580
161 HE2 LYS 117 1HE LYS 117 2.557 0.022 3.712
162 HE3 LYS 117 2HE LYS 117 2.563 0.622 2.054
163 HZ1 LYS 117 3HZ LYS 117 3.063 -1.760 1.406
164 HZ2 LYS 117 1HZ LYS 117 1.498 -1.441 1.964
165 HZ3 LYS 117 2HZ LYS 117 2.624 -2.185 2.983
166 H GLY 118 H GLY 118 7.786 3.747 2.057
167 HA2 GLY 118 1HA GLY 118 6.071 5.213 0.554
168 HA3 GLY 118 2HA GLY 118 7.764 5.645 0.740
169 H ASN 119 H ASN 119 9.234 4.186 -0.740
170 HA ASN 119 HA ASN 119 9.058 4.961 -3.304
171 HB2 ASN 119 1HB ASN 119 10.090 2.342 -2.218
172 HB3 ASN 119 2HB ASN 119 10.284 2.801 -3.907
173 HD21 ASN 119 1HD2 ASN 119 12.091 3.799 -4.399
174 HD22 ASN 119 2HD2 ASN 119 13.094 4.688 -3.309
175 H LEU 120 H LEU 120 7.682 1.904 -2.098
176 HA LEU 120 HA LEU 120 6.476 1.164 -4.540
177 HB2 LEU 120 1HB LEU 120 6.803 -0.548 -2.976
178 HB3 LEU 120 2HB LEU 120 6.036 0.370 -1.682
179 HG LEU 120 HG LEU 120 3.853 0.022 -2.714
180 HD11 LEU 120 1HD1 LEU 120 5.124 -1.842 -4.685
181 HD12 LEU 120 2HD1 LEU 120 4.890 -0.135 -5.060
182 HD13 LEU 120 3HD1 LEU 120 3.500 -1.154 -4.689
183 HD21 LEU 120 3HD2 LEU 120 5.553 -2.393 -2.169
184 HD22 LEU 120 1HD2 LEU 120 3.829 -2.525 -2.518
185 HD23 LEU 120 2HD2 LEU 120 4.376 -1.607 -1.115
186 H VAL 121 H VAL 121 5.095 2.651 -1.612
187 HA VAL 121 HA VAL 121 2.476 2.902 -2.311
188 HB VAL 121 HB VAL 121 4.146 5.025 -0.956
189 HG11 VAL 121 1HG1 VAL 121 1.159 4.598 -0.918
190 HG12 VAL 121 2HG1 VAL 121 2.048 5.817 -0.002
191 HG13 VAL 121 3HG1 VAL 121 2.003 5.895 -1.764
192 HG21 VAL 121 3HG2 VAL 121 3.263 2.411 -0.128
193 HG22 VAL 121 1HG2 VAL 121 4.316 3.555 0.704
194 HG23 VAL 121 2HG2 VAL 121 2.567 3.660 0.904
195 H THR 122 H THR 122 5.097 5.115 -3.238
196 HA THR 122 HA THR 122 3.521 6.938 -4.677
197 HB THR 122 HB THR 122 6.441 6.231 -4.803
198 HG1 THR 122 1HG THR 122 5.773 7.516 -3.063
199 HG21 THR 122 3HG2 THR 122 4.958 8.210 -6.530
200 HG22 THR 122 1HG2 THR 122 5.924 6.837 -7.065
201 HG23 THR 122 2HG2 THR 122 6.706 8.221 -6.300
202 H HIS 123 H HIS 123 5.003 3.890 -5.599
203 HA HIS 123 HA HIS 123 4.601 4.158 -8.396
204 HB2 HIS 123 1HB HIS 123 6.183 2.542 -7.866
205 HB3 HIS 123 2HB HIS 123 5.215 1.876 -6.555
206 HD1 HIS 123 1HD HIS 123 5.590 1.772 -10.288
207 HD2 HIS 123 2HD HIS 123 3.443 -0.135 -7.285
208 HE1 HIS 123 1HE HIS 123 4.519 -0.221 -11.387
209 H GLN 124 H GLN 124 2.760 2.502 -5.846
210 HA GLN 124 HA GLN 124 0.770 1.359 -7.375
211 HB2 GLN 124 1HB GLN 124 0.091 2.653 -4.759
212 HB3 GLN 124 2HB GLN 124 -0.462 1.117 -5.412
213 HG2 GLN 124 1HG GLN 124 2.095 0.506 -5.196
214 HG3 GLN 124 2HG GLN 124 2.048 1.780 -3.978
215 HE21 GLN 124 1HE2 GLN 124 1.630 -1.460 -4.536
216 HE22 GLN 124 2HE2 GLN 124 0.742 -1.873 -3.113
217 H ARG 125 H ARG 125 1.182 4.698 -6.434
218 HA ARG 125 HA ARG 125 -1.354 5.714 -6.874
219 HB2 ARG 125 1HB ARG 125 1.252 7.064 -7.597
220 HB3 ARG 125 2HB ARG 125 -0.284 7.859 -7.281
221 HG2 ARG 125 1HG ARG 125 -0.198 6.967 -4.961
222 HG3 ARG 125 2HG ARG 125 1.421 6.356 -5.310
223 HD2 ARG 125 1HD ARG 125 2.315 8.500 -5.518
224 HD3 ARG 125 2HD ARG 125 0.731 9.237 -5.754
225 HE ARG 125 HE ARG 125 1.096 8.014 -3.171
226 HH11 ARG 125 2HH1 ARG 125 1.469 10.908 -5.070
227 HH12 ARG 125 1HH1 ARG 125 1.459 11.966 -3.698
228 HH21 ARG 125 2HH2 ARG 125 1.081 9.396 -1.357
229 HH22 ARG 125 1HH2 ARG 125 1.239 11.105 -1.586
230 H ILE 126 H ILE 126 0.878 4.417 -9.134
231 HA ILE 126 HA ILE 126 -0.093 5.763 -11.457
232 HB ILE 126 HB ILE 126 1.293 4.366 -12.723
233 HG12 ILE 126 1HG1 ILE 126 1.103 2.400 -10.435
234 HG13 ILE 126 2HG1 ILE 126 0.476 2.203 -12.068
235 HG21 ILE 126 1HG2 ILE 126 2.273 5.382 -10.225
236 HG22 ILE 126 2HG2 ILE 126 3.191 3.954 -10.702
237 HG23 ILE 126 3HG2 ILE 126 3.067 5.329 -11.799
238 HD11 ILE 126 3HD1 ILE 126 2.367 0.919 -12.142
239 HD12 ILE 126 1HD1 ILE 126 2.979 2.458 -12.748
240 HD13 ILE 126 2HD1 ILE 126 3.271 1.990 -11.072
241 H HIS 127 H HIS 127 -0.992 2.876 -9.716
242 HA HIS 127 HA HIS 127 -2.669 1.834 -11.805
243 HB2 HIS 127 1HB HIS 127 -2.362 1.119 -8.886
244 HB3 HIS 127 2HB HIS 127 -3.463 0.282 -9.976
245 HD1 HIS 127 1HD HIS 127 -2.277 -0.960 -12.050
246 HD2 HIS 127 2HD HIS 127 0.211 0.212 -8.936
247 HE1 HIS 127 1HE HIS 127 -0.154 -2.273 -12.356
248 H THR 128 H THR 128 -3.281 3.329 -8.629
249 HA THR 128 HA THR 128 -5.935 3.382 -8.399
250 HB THR 128 HB THR 128 -5.834 5.609 -7.390
251 HG1 THR 128 1HG THR 128 -3.858 6.786 -7.526
252 HG21 THR 128 3HG2 THR 128 -3.240 4.291 -6.669
253 HG22 THR 128 1HG2 THR 128 -4.775 3.491 -6.332
254 HG23 THR 128 2HG2 THR 128 -4.425 5.065 -5.618
255 H GLY 129 H GLY 129 -7.720 4.476 -9.201
256 HA2 GLY 129 1HA GLY 129 -7.589 5.209 -11.960
257 HA3 GLY 129 2HA GLY 129 -9.010 5.289 -10.929
258 H GLU 130 H GLU 130 -8.478 7.074 -9.050
259 HA GLU 130 HA GLU 130 -8.903 9.529 -10.160
260 HB2 GLU 130 1HB GLU 130 -7.451 8.953 -7.572
261 HB3 GLU 130 2HB GLU 130 -8.147 10.505 -8.016
262 HG2 GLU 130 1HG GLU 130 -10.367 9.335 -8.185
263 HG3 GLU 130 2HG GLU 130 -9.590 7.932 -7.454
264 H LYS 131 H LYS 131 -7.624 11.392 -10.524
265 HA LYS 131 HA LYS 131 -4.735 10.958 -10.773
266 HB2 LYS 131 1HB LYS 131 -6.013 10.577 -12.973
267 HB3 LYS 131 2HB LYS 131 -6.293 12.313 -12.964
268 HG2 LYS 131 1HG LYS 131 -3.506 11.344 -12.628
269 HG3 LYS 131 2HG LYS 131 -4.244 11.242 -14.228
270 HD2 LYS 131 1HD LYS 131 -4.145 13.756 -12.565
271 HD3 LYS 131 2HD LYS 131 -2.968 13.348 -13.816
272 HE2 LYS 131 1HE LYS 131 -5.000 13.115 -15.367
273 HE3 LYS 131 2HE LYS 131 -5.888 13.976 -14.111
274 HZ1 LYS 131 3HZ LYS 131 -3.561 15.407 -14.539
275 HZ2 LYS 131 1HZ LYS 131 -5.132 15.847 -14.989
276 HZ3 LYS 131 2HZ LYS 131 -4.142 15.013 -16.078
277 H SER 132 H SER 132 -3.612 12.586 -9.931
278 HA SER 132 HA SER 132 -5.006 15.132 -9.450
279 HB2 SER 132 1HB SER 132 -3.308 15.495 -7.668
280 HB3 SER 132 2HB SER 132 -4.271 14.042 -7.403
281 HG SER 132 HG SER 132 -2.527 12.841 -8.304
282 H GLY 133 H GLY 133 -1.962 13.724 -10.576
283 HA2 GLY 133 1HA GLY 133 -0.346 14.553 -11.979
284 HA3 GLY 133 2HA GLY 133 -1.541 15.724 -12.516
285 HA PRO 134 HA PRO 134 1.843 17.517 -9.585
286 HB2 PRO 134 1HB PRO 134 3.815 18.133 -11.346
287 HB3 PRO 134 2HB PRO 134 3.756 16.601 -10.468
288 HG2 PRO 134 1HG PRO 134 2.910 17.210 -13.274
289 HG3 PRO 134 2HG PRO 134 3.810 15.813 -12.655
290 HD2 PRO 134 1HD PRO 134 1.159 15.713 -13.201
291 HD3 PRO 134 2HD PRO 134 1.903 14.760 -11.901
292 H SER 135 H SER 135 3.085 19.742 -10.185
293 HA SER 135 HA SER 135 0.991 21.448 -11.329
294 HB2 SER 135 1HB SER 135 2.058 21.727 -8.938
295 HB3 SER 135 2HB SER 135 3.344 22.539 -9.831
296 HG SER 135 HG SER 135 2.064 24.201 -9.703
297 H SER 136 H SER 136 4.554 21.296 -11.237
298 HA SER 136 HA SER 136 4.633 21.961 -14.074
299 HB2 SER 136 1HB SER 136 6.008 23.616 -11.946
300 HB3 SER 136 2HB SER 136 6.336 23.745 -13.674
301 HG SER 136 HG SER 136 3.824 23.990 -13.628
302 H GLY 137 H GLY 137 7.083 22.048 -14.760
303 HA2 GLY 137 1HA GLY 137 8.357 19.693 -13.515
304 HA3 GLY 137 2HA GLY 137 8.503 20.121 -15.213
Start of MODEL 2
1 H1 GLY 93 H GLY 93 -2.298 -20.960 -17.055
2 HA2 GLY 93 1HA GLY 93 -1.843 -22.989 -16.019
3 HA3 GLY 93 2HA GLY 93 -0.304 -23.041 -16.865
4 H SER 94 H SER 94 1.179 -23.351 -15.325
5 HA SER 94 HA SER 94 1.159 -22.805 -12.688
6 HB2 SER 94 1HB SER 94 3.047 -23.951 -13.543
7 HB3 SER 94 2HB SER 94 3.454 -22.629 -14.636
8 HG SER 94 HG SER 94 3.903 -22.881 -11.889
9 H SER 95 H SER 95 1.095 -21.085 -11.394
10 HA SER 95 HA SER 95 0.463 -18.556 -12.137
11 HB2 SER 95 1HB SER 95 0.689 -19.636 -9.764
12 HB3 SER 95 2HB SER 95 2.293 -18.904 -9.785
13 HG SER 95 HG SER 95 -0.048 -17.427 -10.364
14 H GLY 96 H GLY 96 3.779 -19.620 -11.353
15 HA2 GLY 96 1HA GLY 96 5.558 -18.984 -12.927
16 HA3 GLY 96 2HA GLY 96 4.756 -17.427 -13.076
17 H SER 97 H SER 97 7.139 -19.194 -11.465
18 HA SER 97 HA SER 97 7.379 -17.112 -9.393
19 HB2 SER 97 1HB SER 97 7.082 -19.638 -8.780
20 HB3 SER 97 2HB SER 97 8.787 -19.757 -9.214
21 HG SER 97 HG SER 97 7.767 -18.928 -6.935
22 H SER 98 H SER 98 9.014 -15.744 -9.590
23 HA SER 98 HA SER 98 10.828 -15.751 -11.696
24 HB2 SER 98 1HB SER 98 10.319 -13.722 -10.448
25 HB3 SER 98 2HB SER 98 11.059 -14.398 -8.997
26 HG SER 98 HG SER 98 12.270 -12.939 -10.699
27 H GLY 99 H GLY 99 11.483 -16.535 -8.274
28 HA2 GLY 99 1HA GLY 99 13.105 -18.763 -8.847
29 HA3 GLY 99 2HA GLY 99 14.138 -17.356 -8.644
30 H THR 100 H THR 100 14.010 -16.190 -6.607
31 HA THR 100 HA THR 100 12.668 -17.391 -4.372
32 HB THR 100 HB THR 100 14.627 -18.908 -4.650
33 HG1 THR 100 1HG THR 100 14.710 -17.289 -2.302
34 HG21 THR 100 3HG2 THR 100 16.785 -18.201 -4.673
35 HG22 THR 100 1HG2 THR 100 16.465 -16.839 -3.601
36 HG23 THR 100 2HG2 THR 100 16.052 -16.731 -5.312
37 H GLY 101 H GLY 101 12.969 -16.187 -2.387
38 HA2 GLY 101 1HA GLY 101 13.703 -14.320 -1.148
39 HA3 GLY 101 2HA GLY 101 14.396 -13.646 -2.615
40 H GLN 102 H GLN 102 12.394 -12.725 -0.455
41 HA GLN 102 HA GLN 102 10.435 -11.639 -2.366
42 HB2 GLN 102 1HB GLN 102 8.697 -11.766 -0.707
43 HB3 GLN 102 2HB GLN 102 9.421 -13.360 -0.880
44 HG2 GLN 102 1HG GLN 102 10.908 -12.510 1.129
45 HG3 GLN 102 2HG GLN 102 9.512 -11.467 1.401
46 HE21 GLN 102 1HE2 GLN 102 9.783 -12.933 3.419
47 HE22 GLN 102 2HE2 GLN 102 8.787 -14.345 3.431
48 H LYS 103 H LYS 103 9.765 -9.508 -2.028
49 HA LYS 103 HA LYS 103 11.642 -7.916 -0.453
50 HB2 LYS 103 1HB LYS 103 9.758 -7.295 -2.710
51 HB3 LYS 103 2HB LYS 103 10.425 -6.006 -1.716
52 HG2 LYS 103 1HG LYS 103 12.308 -7.985 -2.879
53 HG3 LYS 103 2HG LYS 103 11.583 -6.786 -3.953
54 HD2 LYS 103 1HD LYS 103 12.488 -4.987 -2.704
55 HD3 LYS 103 2HD LYS 103 12.939 -6.049 -1.368
56 HE2 LYS 103 1HE LYS 103 14.965 -5.747 -2.423
57 HE3 LYS 103 2HE LYS 103 14.396 -7.238 -3.173
58 HZ1 LYS 103 3HZ LYS 103 14.815 -4.631 -4.342
59 HZ2 LYS 103 1HZ LYS 103 13.361 -5.367 -4.796
60 HZ3 LYS 103 2HZ LYS 103 14.831 -6.158 -5.068
61 HA PRO 104 HA PRO 104 8.763 -6.919 2.711
62 HB2 PRO 104 1HB PRO 104 9.583 -4.415 3.367
63 HB3 PRO 104 2HB PRO 104 10.501 -5.867 3.784
64 HG2 PRO 104 1HG PRO 104 10.912 -3.952 1.521
65 HG3 PRO 104 2HG PRO 104 12.116 -4.696 2.589
66 HD2 PRO 104 1HD PRO 104 11.626 -5.609 0.087
67 HD3 PRO 104 2HD PRO 104 12.115 -6.680 1.416
68 H PHE 105 H PHE 105 8.826 -5.281 -0.252
69 HA PHE 105 HA PHE 105 6.117 -4.321 0.168
70 HB2 PHE 105 1HB PHE 105 8.211 -2.426 -0.899
71 HB3 PHE 105 2HB PHE 105 6.534 -2.064 -0.504
72 HD1 PHE 105 2HD PHE 105 5.813 -2.063 1.885
73 HD2 PHE 105 1HD PHE 105 9.903 -2.332 0.734
74 HE1 PHE 105 2HE PHE 105 6.492 -1.392 4.152
75 HE2 PHE 105 1HE PHE 105 10.588 -1.662 3.000
76 HZ PHE 105 HZ PHE 105 8.882 -1.190 4.713
77 H GLU 106 H GLU 106 5.170 -5.466 -1.407
78 HA GLU 106 HA GLU 106 6.295 -5.242 -4.122
79 HB2 GLU 106 1HB GLU 106 6.386 -7.546 -2.994
80 HB3 GLU 106 2HB GLU 106 4.638 -7.573 -3.180
81 HG2 GLU 106 1HG GLU 106 4.776 -7.578 -5.522
82 HG3 GLU 106 2HG GLU 106 6.475 -7.110 -5.503
83 H CYS 107 H CYS 107 4.921 -4.737 -5.769
84 HA CYS 107 HA CYS 107 2.314 -3.714 -4.994
85 HB2 CYS 107 1HB CYS 107 3.890 -2.410 -6.448
86 HB3 CYS 107 2HB CYS 107 3.644 -3.616 -7.707
87 H THR 108 H THR 108 1.482 -5.906 -4.573
88 HA THR 108 HA THR 108 1.208 -8.035 -6.174
89 HB THR 108 HB THR 108 0.077 -7.908 -4.020
90 HG1 THR 108 1HG THR 108 -0.924 -9.511 -5.009
91 HG21 THR 108 3HG2 THR 108 -0.802 -5.504 -4.632
92 HG22 THR 108 1HG2 THR 108 -1.703 -6.537 -3.524
93 HG23 THR 108 2HG2 THR 108 -2.206 -6.400 -5.209
94 H HIS 109 H HIS 109 -0.472 -4.966 -6.614
95 HA HIS 109 HA HIS 109 -2.364 -5.509 -8.475
96 HB2 HIS 109 1HB HIS 109 -0.410 -3.200 -8.548
97 HB3 HIS 109 2HB HIS 109 -1.926 -3.267 -9.443
98 HD2 HIS 109 2HD HIS 109 -0.624 -2.374 -5.938
99 HE1 HIS 109 1HE HIS 109 -4.860 -2.176 -5.810
100 HE2 HIS 109 2HE HIS 109 -2.713 -1.588 -4.631
101 H CYS 110 H CYS 110 1.004 -4.702 -9.343
102 HA CYS 110 HA CYS 110 0.616 -6.218 -11.840
103 HB2 CYS 110 1HB CYS 110 2.370 -4.797 -12.822
104 HB3 CYS 110 2HB CYS 110 1.011 -3.840 -12.242
105 H GLY 111 H GLY 111 2.896 -5.473 -9.236
106 HA2 GLY 111 1HA GLY 111 3.983 -7.581 -8.362
107 HA3 GLY 111 2HA GLY 111 4.457 -7.851 -10.032
108 H LYS 112 H LYS 112 4.482 -4.578 -9.200
109 HA LYS 112 HA LYS 112 7.314 -4.409 -9.488
110 HB2 LYS 112 1HB LYS 112 5.504 -2.671 -10.124
111 HB3 LYS 112 2HB LYS 112 5.584 -2.187 -8.435
112 HG2 LYS 112 1HG LYS 112 7.077 -0.731 -9.355
113 HG3 LYS 112 2HG LYS 112 8.159 -2.057 -8.923
114 HD2 LYS 112 1HD LYS 112 8.157 -2.875 -11.176
115 HD3 LYS 112 2HD LYS 112 6.895 -1.731 -11.642
116 HE2 LYS 112 1HE LYS 112 8.338 0.052 -11.677
117 HE3 LYS 112 2HE LYS 112 9.430 -0.670 -10.497
118 HZ1 LYS 112 3HZ LYS 112 10.406 -2.009 -12.107
119 HZ2 LYS 112 1HZ LYS 112 10.198 -0.534 -12.909
120 HZ3 LYS 112 2HZ LYS 112 9.132 -1.814 -13.203
121 H SER 113 H SER 113 8.737 -4.867 -7.955
122 HA SER 113 HA SER 113 7.942 -4.753 -5.151
123 HB2 SER 113 1HB SER 113 9.840 -6.104 -4.685
124 HB3 SER 113 2HB SER 113 9.166 -6.740 -6.186
125 HG SER 113 HG SER 113 11.450 -6.467 -6.276
126 H PHE 114 H PHE 114 9.498 -3.859 -3.563
127 HA PHE 114 HA PHE 114 11.285 -1.790 -4.529
128 HB2 PHE 114 1HB PHE 114 8.864 -1.137 -2.837
129 HB3 PHE 114 2HB PHE 114 10.195 -0.027 -3.149
130 HD1 PHE 114 2HD PHE 114 7.414 -1.876 -4.713
131 HD2 PHE 114 1HD PHE 114 10.330 1.191 -5.167
132 HE1 PHE 114 2HE PHE 114 6.295 -1.121 -6.771
133 HE2 PHE 114 1HE PHE 114 9.216 1.951 -7.224
134 HZ PHE 114 HZ PHE 114 7.196 0.794 -8.030
135 H ARG 115 H ARG 115 12.266 -0.596 -2.562
136 HA ARG 115 HA ARG 115 13.089 -2.656 -0.673
137 HB2 ARG 115 1HB ARG 115 14.756 -1.231 -1.900
138 HB3 ARG 115 2HB ARG 115 14.169 0.148 -0.981
139 HG2 ARG 115 1HG ARG 115 14.971 -0.735 1.051
140 HG3 ARG 115 2HG ARG 115 15.247 -2.325 0.336
141 HD2 ARG 115 1HD ARG 115 16.958 -1.283 -1.146
142 HD3 ARG 115 2HD ARG 115 16.746 0.223 -0.254
143 HE ARG 115 HE ARG 115 17.391 -2.057 1.388
144 HH11 ARG 115 2HH1 ARG 115 18.638 0.591 -0.496
145 HH12 ARG 115 1HH1 ARG 115 20.159 0.636 0.333
146 HH21 ARG 115 2HH2 ARG 115 19.390 -2.009 2.487
147 HH22 ARG 115 1HH2 ARG 115 20.586 -0.845 2.029
148 H ALA 116 H ALA 116 11.662 0.583 -0.678
149 HA ALA 116 HA ALA 116 10.924 0.176 2.148
150 HB1 ALA 116 3HB ALA 116 10.795 2.741 2.170
151 HB2 ALA 116 1HB ALA 116 12.389 1.987 2.190
152 HB3 ALA 116 2HB ALA 116 11.750 2.661 0.690
153 H LYS 117 H LYS 117 8.886 1.114 2.819
154 HA LYS 117 HA LYS 117 6.739 0.419 1.199
155 HB2 LYS 117 1HB LYS 117 6.628 0.687 3.661
156 HB3 LYS 117 2HB LYS 117 6.739 2.431 3.457
157 HG2 LYS 117 1HG LYS 117 4.473 2.073 3.747
158 HG3 LYS 117 2HG LYS 117 4.637 2.176 1.992
159 HD2 LYS 117 1HD LYS 117 4.673 -0.274 1.862
160 HD3 LYS 117 2HD LYS 117 4.490 -0.366 3.615
161 HE2 LYS 117 1HE LYS 117 2.310 -0.616 2.953
162 HE3 LYS 117 2HE LYS 117 2.385 1.134 3.152
163 HZ1 LYS 117 3HZ LYS 117 2.833 -0.223 0.554
164 HZ2 LYS 117 1HZ LYS 117 2.596 1.430 0.829
165 HZ3 LYS 117 2HZ LYS 117 1.319 0.344 1.053
166 H GLY 118 H GLY 118 7.737 3.741 2.062
167 HA2 GLY 118 1HA GLY 118 6.081 5.232 0.534
168 HA3 GLY 118 2HA GLY 118 7.776 5.645 0.746
169 H ASN 119 H ASN 119 9.260 4.220 -0.729
170 HA ASN 119 HA ASN 119 9.109 5.003 -3.291
171 HB2 ASN 119 1HB ASN 119 10.198 2.469 -2.108
172 HB3 ASN 119 2HB ASN 119 10.272 2.732 -3.848
173 HD21 ASN 119 1HD2 ASN 119 11.388 4.632 -4.607
174 HD22 ASN 119 2HD2 ASN 119 12.698 5.276 -3.683
175 H LEU 120 H LEU 120 7.690 1.967 -2.090
176 HA LEU 120 HA LEU 120 6.526 1.222 -4.557
177 HB2 LEU 120 1HB LEU 120 6.808 -0.508 -3.022
178 HB3 LEU 120 2HB LEU 120 6.089 0.418 -1.706
179 HG LEU 120 HG LEU 120 3.877 0.139 -2.725
180 HD11 LEU 120 1HD1 LEU 120 4.873 -0.091 -5.072
181 HD12 LEU 120 2HD1 LEU 120 3.483 -1.096 -4.665
182 HD13 LEU 120 3HD1 LEU 120 5.103 -1.792 -4.664
183 HD21 LEU 120 3HD2 LEU 120 5.463 -2.372 -2.228
184 HD22 LEU 120 1HD2 LEU 120 3.707 -2.339 -2.393
185 HD23 LEU 120 2HD2 LEU 120 4.485 -1.465 -1.073
186 H VAL 121 H VAL 121 5.151 2.770 -1.663
187 HA VAL 121 HA VAL 121 2.526 3.008 -2.376
188 HB VAL 121 HB VAL 121 4.204 5.125 -1.024
189 HG11 VAL 121 1HG1 VAL 121 2.393 6.400 -0.875
190 HG12 VAL 121 2HG1 VAL 121 1.549 5.273 -1.938
191 HG13 VAL 121 3HG1 VAL 121 1.466 5.067 -0.188
192 HG21 VAL 121 3HG2 VAL 121 3.990 3.996 0.920
193 HG22 VAL 121 1HG2 VAL 121 2.376 3.407 0.522
194 HG23 VAL 121 2HG2 VAL 121 3.797 2.606 -0.149
195 H THR 122 H THR 122 5.148 5.235 -3.279
196 HA THR 122 HA THR 122 3.596 7.039 -4.752
197 HB THR 122 HB THR 122 6.512 6.314 -4.861
198 HG1 THR 122 1HG THR 122 5.407 8.853 -4.318
199 HG21 THR 122 3HG2 THR 122 5.049 8.293 -6.607
200 HG22 THR 122 1HG2 THR 122 6.002 6.905 -7.130
201 HG23 THR 122 2HG2 THR 122 6.797 8.286 -6.374
202 H HIS 123 H HIS 123 5.006 3.952 -5.620
203 HA HIS 123 HA HIS 123 4.629 4.208 -8.431
204 HB2 HIS 123 1HB HIS 123 6.210 2.595 -7.882
205 HB3 HIS 123 2HB HIS 123 5.234 1.937 -6.572
206 HD1 HIS 123 1HD HIS 123 5.640 1.805 -10.299
207 HD2 HIS 123 2HD HIS 123 3.447 -0.064 -7.305
208 HE1 HIS 123 1HE HIS 123 4.568 -0.188 -11.395
209 H GLN 124 H GLN 124 2.785 2.588 -5.861
210 HA GLN 124 HA GLN 124 0.792 1.429 -7.374
211 HB2 GLN 124 1HB GLN 124 0.116 2.763 -4.777
212 HB3 GLN 124 2HB GLN 124 -0.441 1.219 -5.408
213 HG2 GLN 124 1HG GLN 124 2.109 0.597 -5.181
214 HG3 GLN 124 2HG GLN 124 2.077 1.896 -3.990
215 HE21 GLN 124 1HE2 GLN 124 1.587 1.332 -2.000
216 HE22 GLN 124 2HE2 GLN 124 0.719 -0.084 -1.525
217 H ARG 125 H ARG 125 1.213 4.781 -6.482
218 HA ARG 125 HA ARG 125 -1.320 5.797 -6.935
219 HB2 ARG 125 1HB ARG 125 1.297 7.122 -7.670
220 HB3 ARG 125 2HB ARG 125 -0.238 7.933 -7.387
221 HG2 ARG 125 1HG ARG 125 -0.196 7.222 -5.056
222 HG3 ARG 125 2HG ARG 125 1.332 6.385 -5.336
223 HD2 ARG 125 1HD ARG 125 2.010 8.403 -4.417
224 HD3 ARG 125 2HD ARG 125 2.177 8.686 -6.149
225 HE ARG 125 HE ARG 125 -0.381 9.482 -5.156
226 HH11 ARG 125 2HH1 ARG 125 2.949 10.451 -5.466
227 HH12 ARG 125 1HH1 ARG 125 2.597 12.146 -5.409
228 HH21 ARG 125 2HH2 ARG 125 -0.857 11.712 -5.081
229 HH22 ARG 125 1HH2 ARG 125 0.432 12.862 -5.190
230 H ILE 126 H ILE 126 0.911 4.466 -9.178
231 HA ILE 126 HA ILE 126 -0.068 5.777 -11.519
232 HB ILE 126 HB ILE 126 1.328 4.376 -12.766
233 HG12 ILE 126 1HG1 ILE 126 1.144 2.430 -10.461
234 HG13 ILE 126 2HG1 ILE 126 0.517 2.217 -12.092
235 HG21 ILE 126 1HG2 ILE 126 3.221 3.989 -10.730
236 HG22 ILE 126 2HG2 ILE 126 3.104 5.343 -11.853
237 HG23 ILE 126 3HG2 ILE 126 2.302 5.427 -10.285
238 HD11 ILE 126 3HD1 ILE 126 2.412 0.936 -12.151
239 HD12 ILE 126 1HD1 ILE 126 3.016 2.470 -12.778
240 HD13 ILE 126 2HD1 ILE 126 3.314 2.026 -11.097
241 H HIS 127 H HIS 127 -0.970 2.934 -9.719
242 HA HIS 127 HA HIS 127 -2.661 1.877 -11.805
243 HB2 HIS 127 1HB HIS 127 -2.269 1.117 -8.908
244 HB3 HIS 127 2HB HIS 127 -3.392 0.287 -9.981
245 HD1 HIS 127 1HD HIS 127 -2.249 -0.903 -12.112
246 HD2 HIS 127 2HD HIS 127 0.307 0.231 -9.039
247 HE1 HIS 127 1HE HIS 127 -0.123 -2.191 -12.495
248 H THR 128 H THR 128 -3.181 3.373 -8.617
249 HA THR 128 HA THR 128 -5.819 3.383 -8.266
250 HB THR 128 HB THR 128 -5.719 5.633 -7.311
251 HG1 THR 128 1HG THR 128 -4.147 6.259 -9.157
252 HG21 THR 128 3HG2 THR 128 -3.901 5.274 -5.718
253 HG22 THR 128 1HG2 THR 128 -3.191 4.064 -6.786
254 HG23 THR 128 2HG2 THR 128 -4.759 3.767 -6.036
255 H GLY 129 H GLY 129 -7.664 4.397 -9.019
256 HA2 GLY 129 1HA GLY 129 -7.355 5.901 -11.544
257 HA3 GLY 129 2HA GLY 129 -8.594 4.673 -11.332
258 H GLU 130 H GLU 130 -7.428 7.603 -9.661
259 HA GLU 130 HA GLU 130 -10.243 8.305 -9.157
260 HB2 GLU 130 1HB GLU 130 -9.408 9.688 -7.300
261 HB3 GLU 130 2HB GLU 130 -8.962 7.998 -7.111
262 HG2 GLU 130 1HG GLU 130 -6.985 8.967 -6.577
263 HG3 GLU 130 2HG GLU 130 -6.761 8.803 -8.318
264 H LYS 131 H LYS 131 -9.153 8.836 -11.664
265 HA LYS 131 HA LYS 131 -9.404 11.729 -11.719
266 HB2 LYS 131 1HB LYS 131 -6.981 11.377 -11.516
267 HB3 LYS 131 2HB LYS 131 -7.013 10.323 -12.924
268 HG2 LYS 131 1HG LYS 131 -7.684 12.177 -14.332
269 HG3 LYS 131 2HG LYS 131 -7.743 13.245 -12.928
270 HD2 LYS 131 1HD LYS 131 -5.314 12.759 -12.564
271 HD3 LYS 131 2HD LYS 131 -5.316 11.895 -14.103
272 HE2 LYS 131 1HE LYS 131 -5.970 13.917 -15.268
273 HE3 LYS 131 2HE LYS 131 -6.083 14.790 -13.741
274 HZ1 LYS 131 3HZ LYS 131 -3.964 15.326 -14.016
275 HZ2 LYS 131 1HZ LYS 131 -3.805 14.310 -15.359
276 HZ3 LYS 131 2HZ LYS 131 -3.551 13.700 -13.802
277 H SER 132 H SER 132 -10.245 12.512 -13.626
278 HA SER 132 HA SER 132 -10.959 10.474 -15.634
279 HB2 SER 132 1HB SER 132 -12.868 11.414 -14.278
280 HB3 SER 132 2HB SER 132 -12.526 12.984 -15.005
281 HG SER 132 HG SER 132 -13.528 10.646 -16.196
282 H GLY 133 H GLY 133 -9.499 10.751 -17.227
283 HA2 GLY 133 1HA GLY 133 -8.123 11.846 -18.742
284 HA3 GLY 133 2HA GLY 133 -9.654 12.585 -19.185
285 HA PRO 134 HA PRO 134 -6.799 16.020 -18.070
286 HB2 PRO 134 1HB PRO 134 -7.659 17.667 -20.050
287 HB3 PRO 134 2HB PRO 134 -6.405 16.445 -20.294
288 HG2 PRO 134 1HG PRO 134 -9.320 16.328 -20.967
289 HG3 PRO 134 2HG PRO 134 -7.927 15.795 -21.927
290 HD2 PRO 134 1HD PRO 134 -9.460 14.074 -20.505
291 HD3 PRO 134 2HD PRO 134 -7.723 13.815 -20.764
292 H SER 135 H SER 135 -7.275 17.928 -17.001
293 HA SER 135 HA SER 135 -10.140 18.447 -16.539
294 HB2 SER 135 1HB SER 135 -9.543 19.207 -14.289
295 HB3 SER 135 2HB SER 135 -8.979 17.556 -14.548
296 HG SER 135 HG SER 135 -6.903 18.497 -15.055
297 H SER 136 H SER 136 -7.117 19.741 -17.514
298 HA SER 136 HA SER 136 -8.346 22.232 -18.260
299 HB2 SER 136 1HB SER 136 -7.090 23.718 -16.921
300 HB3 SER 136 2HB SER 136 -7.643 22.475 -15.798
301 HG SER 136 HG SER 136 -5.575 22.435 -15.336
302 H GLY 137 H GLY 137 -7.505 22.839 -20.144
303 HA2 GLY 137 1HA GLY 137 -5.647 23.428 -21.535
304 HA3 GLY 137 2HA GLY 137 -4.690 22.203 -20.715
Start of MODEL 3
1 H1 GLY 93 H GLY 93 18.914 -7.617 15.567
2 HA2 GLY 93 1HA GLY 93 17.532 -9.438 15.983
3 HA3 GLY 93 2HA GLY 93 16.408 -8.433 15.080
4 H SER 94 H SER 94 17.227 -11.462 15.309
5 HA SER 94 HA SER 94 17.289 -11.958 12.405
6 HB2 SER 94 1HB SER 94 18.430 -13.997 12.800
7 HB3 SER 94 2HB SER 94 19.214 -12.823 13.857
8 HG SER 94 HG SER 94 18.429 -13.814 15.567
9 H SER 95 H SER 95 16.127 -13.913 11.682
10 HA SER 95 HA SER 95 13.666 -14.308 13.256
11 HB2 SER 95 1HB SER 95 13.055 -13.180 11.257
12 HB3 SER 95 2HB SER 95 14.105 -14.198 10.272
13 HG SER 95 HG SER 95 12.699 -15.866 10.482
14 H GLY 96 H GLY 96 15.977 -15.873 11.069
15 HA2 GLY 96 1HA GLY 96 16.655 -18.061 10.912
16 HA3 GLY 96 2HA GLY 96 16.002 -18.288 12.527
17 H SER 97 H SER 97 14.591 -17.602 9.324
18 HA SER 97 HA SER 97 12.886 -19.976 9.682
19 HB2 SER 97 1HB SER 97 12.024 -17.321 8.507
20 HB3 SER 97 2HB SER 97 11.020 -18.764 8.650
21 HG SER 97 HG SER 97 10.528 -17.999 10.538
22 H SER 98 H SER 98 12.759 -21.321 7.983
23 HA SER 98 HA SER 98 14.503 -20.898 5.752
24 HB2 SER 98 1HB SER 98 14.148 -23.135 6.752
25 HB3 SER 98 2HB SER 98 12.471 -23.098 6.208
26 HG SER 98 HG SER 98 13.489 -22.737 4.037
27 H GLY 99 H GLY 99 14.020 -20.408 3.661
28 HA2 GLY 99 1HA GLY 99 12.596 -20.121 1.794
29 HA3 GLY 99 2HA GLY 99 11.211 -20.161 2.875
30 H THR 100 H THR 100 14.157 -18.177 2.969
31 HA THR 100 HA THR 100 12.428 -15.795 2.993
32 HB THR 100 HB THR 100 14.349 -14.621 4.040
33 HG1 THR 100 1HG THR 100 15.856 -16.361 3.162
34 HG21 THR 100 3HG2 THR 100 13.345 -17.104 5.431
35 HG22 THR 100 1HG2 THR 100 12.652 -15.484 5.503
36 HG23 THR 100 2HG2 THR 100 14.222 -15.806 6.240
37 H GLY 101 H GLY 101 12.416 -14.583 1.222
38 HA2 GLY 101 1HA GLY 101 14.632 -13.592 -0.112
39 HA3 GLY 101 2HA GLY 101 14.174 -15.060 -0.964
40 H GLN 102 H GLN 102 12.865 -11.974 0.207
41 HA GLN 102 HA GLN 102 11.601 -11.458 -2.301
42 HB2 GLN 102 1HB GLN 102 9.303 -11.515 -1.618
43 HB3 GLN 102 2HB GLN 102 10.013 -13.083 -1.258
44 HG2 GLN 102 1HG GLN 102 10.137 -12.585 1.063
45 HG3 GLN 102 2HG GLN 102 9.708 -10.898 0.782
46 HE21 GLN 102 1HE2 GLN 102 8.101 -11.498 2.465
47 HE22 GLN 102 2HE2 GLN 102 6.590 -12.147 1.934
48 H LYS 103 H LYS 103 10.576 -9.356 -2.372
49 HA LYS 103 HA LYS 103 11.958 -7.445 -0.762
50 HB2 LYS 103 1HB LYS 103 10.027 -7.352 -3.024
51 HB3 LYS 103 2HB LYS 103 10.166 -5.914 -2.021
52 HG2 LYS 103 1HG LYS 103 11.616 -5.912 -4.041
53 HG3 LYS 103 2HG LYS 103 12.485 -5.696 -2.520
54 HD2 LYS 103 1HD LYS 103 12.759 -8.287 -2.633
55 HD3 LYS 103 2HD LYS 103 12.417 -8.060 -4.350
56 HE2 LYS 103 1HE LYS 103 14.686 -6.927 -2.733
57 HE3 LYS 103 2HE LYS 103 14.770 -7.998 -4.131
58 HZ1 LYS 103 3HZ LYS 103 14.497 -5.126 -4.025
59 HZ2 LYS 103 1HZ LYS 103 13.460 -5.879 -5.129
60 HZ3 LYS 103 2HZ LYS 103 15.131 -6.110 -5.247
61 HA PRO 104 HA PRO 104 9.106 -6.977 2.557
62 HB2 PRO 104 1HB PRO 104 9.710 -4.437 3.303
63 HB3 PRO 104 2HB PRO 104 10.772 -5.812 3.629
64 HG2 PRO 104 1HG PRO 104 10.931 -3.772 1.444
65 HG3 PRO 104 2HG PRO 104 12.232 -4.444 2.444
66 HD2 PRO 104 1HD PRO 104 11.751 -5.292 -0.082
67 HD3 PRO 104 2HD PRO 104 12.379 -6.368 1.183
68 H PHE 105 H PHE 105 8.934 -5.194 -0.323
69 HA PHE 105 HA PHE 105 6.159 -4.516 0.216
70 HB2 PHE 105 1HB PHE 105 8.032 -2.397 -0.840
71 HB3 PHE 105 2HB PHE 105 6.347 -2.206 -0.369
72 HD1 PHE 105 2HD PHE 105 5.723 -2.333 2.034
73 HD2 PHE 105 1HD PHE 105 9.777 -2.244 0.740
74 HE1 PHE 105 2HE PHE 105 6.430 -1.692 4.302
75 HE2 PHE 105 1HE PHE 105 10.490 -1.604 3.006
76 HZ PHE 105 HZ PHE 105 8.816 -1.326 4.790
77 H GLU 106 H GLU 106 5.156 -5.517 -1.399
78 HA GLU 106 HA GLU 106 6.247 -5.206 -4.119
79 HB2 GLU 106 1HB GLU 106 6.314 -7.554 -2.985
80 HB3 GLU 106 2HB GLU 106 4.589 -7.577 -3.328
81 HG2 GLU 106 1HG GLU 106 5.038 -7.280 -5.698
82 HG3 GLU 106 2HG GLU 106 6.769 -7.210 -5.371
83 H CYS 107 H CYS 107 4.802 -4.807 -5.775
84 HA CYS 107 HA CYS 107 2.217 -3.771 -4.921
85 HB2 CYS 107 1HB CYS 107 3.769 -2.459 -6.411
86 HB3 CYS 107 2HB CYS 107 3.460 -3.647 -7.673
87 H THR 108 H THR 108 1.488 -6.029 -4.497
88 HA THR 108 HA THR 108 1.174 -8.129 -6.102
89 HB THR 108 HB THR 108 0.082 -7.996 -3.916
90 HG1 THR 108 1HG THR 108 -1.733 -9.205 -4.504
91 HG21 THR 108 3HG2 THR 108 -1.944 -6.808 -3.538
92 HG22 THR 108 1HG2 THR 108 -2.109 -6.411 -5.248
93 HG23 THR 108 2HG2 THR 108 -0.828 -5.669 -4.290
94 H HIS 109 H HIS 109 -0.532 -5.073 -6.506
95 HA HIS 109 HA HIS 109 -2.457 -5.635 -8.333
96 HB2 HIS 109 1HB HIS 109 -0.538 -3.299 -8.388
97 HB3 HIS 109 2HB HIS 109 -2.034 -3.380 -9.313
98 HD2 HIS 109 2HD HIS 109 -0.824 -2.252 -5.900
99 HE1 HIS 109 1HE HIS 109 -5.049 -2.539 -5.640
100 HE2 HIS 109 2HE HIS 109 -2.955 -1.638 -4.568
101 H CYS 110 H CYS 110 0.891 -4.794 -9.243
102 HA CYS 110 HA CYS 110 0.474 -6.277 -11.754
103 HB2 CYS 110 1HB CYS 110 2.244 -4.848 -12.719
104 HB3 CYS 110 2HB CYS 110 0.871 -3.907 -12.146
105 H GLY 111 H GLY 111 2.827 -5.542 -9.205
106 HA2 GLY 111 1HA GLY 111 3.899 -7.691 -8.367
107 HA3 GLY 111 2HA GLY 111 4.365 -7.916 -10.046
108 H LYS 112 H LYS 112 4.416 -4.664 -9.300
109 HA LYS 112 HA LYS 112 7.235 -4.487 -9.537
110 HB2 LYS 112 1HB LYS 112 5.413 -2.742 -10.129
111 HB3 LYS 112 2HB LYS 112 5.516 -2.283 -8.434
112 HG2 LYS 112 1HG LYS 112 6.990 -0.811 -9.376
113 HG3 LYS 112 2HG LYS 112 8.077 -2.131 -8.938
114 HD2 LYS 112 1HD LYS 112 8.099 -2.952 -11.181
115 HD3 LYS 112 2HD LYS 112 6.810 -1.845 -11.658
116 HE2 LYS 112 1HE LYS 112 8.208 -0.013 -11.673
117 HE3 LYS 112 2HE LYS 112 9.345 -0.740 -10.539
118 HZ1 LYS 112 3HZ LYS 112 9.898 -0.545 -13.078
119 HZ2 LYS 112 1HZ LYS 112 9.023 -1.991 -13.167
120 HZ3 LYS 112 2HZ LYS 112 10.394 -1.891 -12.182
121 H SER 113 H SER 113 8.671 -4.963 -8.022
122 HA SER 113 HA SER 113 7.894 -4.901 -5.212
123 HB2 SER 113 1HB SER 113 9.768 -6.275 -4.782
124 HB3 SER 113 2HB SER 113 9.137 -6.854 -6.323
125 HG SER 113 HG SER 113 11.373 -5.170 -5.883
126 H PHE 114 H PHE 114 9.257 -3.904 -3.606
127 HA PHE 114 HA PHE 114 11.102 -1.852 -4.546
128 HB2 PHE 114 1HB PHE 114 8.662 -1.247 -2.863
129 HB3 PHE 114 2HB PHE 114 9.983 -0.118 -3.148
130 HD1 PHE 114 2HD PHE 114 7.215 -1.954 -4.741
131 HD2 PHE 114 1HD PHE 114 10.144 1.105 -5.168
132 HE1 PHE 114 2HE PHE 114 6.106 -1.183 -6.798
133 HE2 PHE 114 1HE PHE 114 9.038 1.881 -7.225
134 HZ PHE 114 HZ PHE 114 7.017 0.736 -8.043
135 H ARG 115 H ARG 115 12.240 -0.785 -2.696
136 HA ARG 115 HA ARG 115 12.960 -2.818 -0.750
137 HB2 ARG 115 1HB ARG 115 14.532 -1.207 -2.137
138 HB3 ARG 115 2HB ARG 115 14.220 -0.111 -0.797
139 HG2 ARG 115 1HG ARG 115 16.146 -1.157 -0.113
140 HG3 ARG 115 2HG ARG 115 14.909 -2.140 0.674
141 HD2 ARG 115 1HD ARG 115 15.041 -3.762 -1.155
142 HD3 ARG 115 2HD ARG 115 16.276 -2.778 -1.938
143 HE ARG 115 HE ARG 115 17.828 -3.564 -0.430
144 HH11 ARG 115 2HH1 ARG 115 14.624 -4.462 0.594
145 HH12 ARG 115 1HH1 ARG 115 15.180 -5.541 1.830
146 HH21 ARG 115 2HH2 ARG 115 18.573 -4.982 1.194
147 HH22 ARG 115 1HH2 ARG 115 17.427 -5.835 2.171
148 H ALA 116 H ALA 116 11.707 0.495 -0.793
149 HA ALA 116 HA ALA 116 11.054 0.211 2.067
150 HB1 ALA 116 3HB ALA 116 10.944 2.911 0.935
151 HB2 ALA 116 1HB ALA 116 11.664 2.336 2.439
152 HB3 ALA 116 2HB ALA 116 12.547 2.176 0.921
153 H LYS 117 H LYS 117 9.027 1.046 2.797
154 HA LYS 117 HA LYS 117 6.830 0.303 1.256
155 HB2 LYS 117 1HB LYS 117 6.794 0.500 3.714
156 HB3 LYS 117 2HB LYS 117 6.897 2.250 3.570
157 HG2 LYS 117 1HG LYS 117 4.641 1.839 3.954
158 HG3 LYS 117 2HG LYS 117 4.739 2.082 2.208
159 HD2 LYS 117 1HD LYS 117 5.023 -0.688 3.253
160 HD3 LYS 117 2HD LYS 117 3.416 0.043 3.267
161 HE2 LYS 117 1HE LYS 117 4.106 0.683 0.785
162 HE3 LYS 117 2HE LYS 117 5.142 -0.731 0.975
163 HZ1 LYS 117 3HZ LYS 117 3.331 -2.123 1.246
164 HZ2 LYS 117 1HZ LYS 117 2.783 -1.047 0.060
165 HZ3 LYS 117 2HZ LYS 117 2.278 -0.867 1.665
166 H GLY 118 H GLY 118 7.944 3.604 2.041
167 HA2 GLY 118 1HA GLY 118 6.118 5.088 0.643
168 HA3 GLY 118 2HA GLY 118 7.806 5.546 0.812
169 H ASN 119 H ASN 119 9.257 4.075 -0.723
170 HA ASN 119 HA ASN 119 9.041 4.938 -3.266
171 HB2 ASN 119 1HB ASN 119 10.191 2.414 -2.135
172 HB3 ASN 119 2HB ASN 119 10.173 2.644 -3.881
173 HD21 ASN 119 1HD2 ASN 119 11.678 3.436 -0.937
174 HD22 ASN 119 2HD2 ASN 119 12.858 4.531 -1.565
175 H LEU 120 H LEU 120 7.632 1.901 -2.064
176 HA LEU 120 HA LEU 120 6.410 1.194 -4.522
177 HB2 LEU 120 1HB LEU 120 6.743 -0.567 -3.032
178 HB3 LEU 120 2HB LEU 120 6.057 0.328 -1.677
179 HG LEU 120 HG LEU 120 3.819 0.057 -2.631
180 HD11 LEU 120 1HD1 LEU 120 4.736 -0.090 -5.015
181 HD12 LEU 120 2HD1 LEU 120 3.369 -1.121 -4.595
182 HD13 LEU 120 3HD1 LEU 120 4.994 -1.801 -4.671
183 HD21 LEU 120 3HD2 LEU 120 5.486 -2.396 -2.167
184 HD22 LEU 120 1HD2 LEU 120 3.749 -2.492 -2.459
185 HD23 LEU 120 2HD2 LEU 120 4.361 -1.598 -1.067
186 H VAL 121 H VAL 121 5.114 2.666 -1.552
187 HA VAL 121 HA VAL 121 2.471 2.916 -2.181
188 HB VAL 121 HB VAL 121 4.187 5.008 -0.836
189 HG11 VAL 121 1HG1 VAL 121 1.309 4.866 -1.408
190 HG12 VAL 121 2HG1 VAL 121 1.722 5.258 0.263
191 HG13 VAL 121 3HG1 VAL 121 2.331 6.259 -1.055
192 HG21 VAL 121 3HG2 VAL 121 2.544 3.570 0.972
193 HG22 VAL 121 1HG2 VAL 121 3.394 2.398 -0.035
194 HG23 VAL 121 2HG2 VAL 121 4.305 3.601 0.878
195 H THR 122 H THR 122 5.080 5.114 -3.167
196 HA THR 122 HA THR 122 3.459 6.952 -4.551
197 HB THR 122 HB THR 122 6.384 6.278 -4.721
198 HG1 THR 122 1HG THR 122 5.285 8.801 -4.131
199 HG21 THR 122 3HG2 THR 122 6.605 8.288 -6.201
200 HG22 THR 122 1HG2 THR 122 4.856 8.255 -6.413
201 HG23 THR 122 2HG2 THR 122 5.837 6.899 -6.970
202 H HIS 123 H HIS 123 4.924 3.913 -5.503
203 HA HIS 123 HA HIS 123 4.534 4.191 -8.296
204 HB2 HIS 123 1HB HIS 123 6.075 2.537 -7.748
205 HB3 HIS 123 2HB HIS 123 5.068 1.884 -6.460
206 HD1 HIS 123 1HD HIS 123 5.530 1.786 -10.179
207 HD2 HIS 123 2HD HIS 123 3.236 -0.058 -7.247
208 HE1 HIS 123 1HE HIS 123 4.425 -0.165 -11.318
209 H GLN 124 H GLN 124 2.631 2.590 -5.759
210 HA GLN 124 HA GLN 124 0.628 1.484 -7.293
211 HB2 GLN 124 1HB GLN 124 -0.046 2.833 -4.703
212 HB3 GLN 124 2HB GLN 124 -0.633 1.303 -5.342
213 HG2 GLN 124 1HG GLN 124 1.904 0.627 -5.089
214 HG3 GLN 124 2HG GLN 124 1.877 1.917 -3.887
215 HE21 GLN 124 1HE2 GLN 124 2.092 0.656 -2.103
216 HE22 GLN 124 2HE2 GLN 124 0.900 -0.480 -1.579
217 H ARG 125 H ARG 125 1.110 4.825 -6.386
218 HA ARG 125 HA ARG 125 -1.389 5.903 -6.866
219 HB2 ARG 125 1HB ARG 125 1.305 7.116 -7.514
220 HB3 ARG 125 2HB ARG 125 -0.207 8.007 -7.401
221 HG2 ARG 125 1HG ARG 125 -0.392 7.363 -5.038
222 HG3 ARG 125 2HG ARG 125 1.156 6.523 -5.164
223 HD2 ARG 125 1HD ARG 125 2.357 8.463 -5.263
224 HD3 ARG 125 2HD ARG 125 1.043 9.365 -6.017
225 HE ARG 125 HE ARG 125 0.067 8.934 -3.565
226 HH11 ARG 125 2HH1 ARG 125 3.172 10.081 -4.643
227 HH12 ARG 125 1HH1 ARG 125 3.443 11.060 -3.239
228 HH21 ARG 125 2HH2 ARG 125 0.413 10.218 -1.712
229 HH22 ARG 125 1HH2 ARG 125 1.874 11.136 -1.572
230 H ILE 126 H ILE 126 0.889 4.596 -9.107
231 HA ILE 126 HA ILE 126 -0.070 5.898 -11.448
232 HB ILE 126 HB ILE 126 1.314 4.481 -12.684
233 HG12 ILE 126 1HG1 ILE 126 1.058 2.518 -10.401
234 HG13 ILE 126 2HG1 ILE 126 0.446 2.334 -12.041
235 HG21 ILE 126 1HG2 ILE 126 3.115 5.375 -11.747
236 HG22 ILE 126 2HG2 ILE 126 2.279 5.510 -10.201
237 HG23 ILE 126 3HG2 ILE 126 3.158 4.035 -10.601
238 HD11 ILE 126 3HD1 ILE 126 2.955 2.534 -12.698
239 HD12 ILE 126 1HD1 ILE 126 3.230 2.080 -11.016
240 HD13 ILE 126 2HD1 ILE 126 2.316 1.011 -12.082
241 H HIS 127 H HIS 127 -0.926 2.941 -9.757
242 HA HIS 127 HA HIS 127 -2.603 1.896 -11.808
243 HB2 HIS 127 1HB HIS 127 -2.333 1.305 -8.864
244 HB3 HIS 127 2HB HIS 127 -3.512 0.482 -9.881
245 HD1 HIS 127 1HD HIS 127 -2.467 -0.941 -11.909
246 HD2 HIS 127 2HD HIS 127 0.188 0.258 -8.947
247 HE1 HIS 127 1HE HIS 127 -0.431 -2.387 -12.206
248 H THR 128 H THR 128 -3.330 3.495 -8.706
249 HA THR 128 HA THR 128 -5.994 3.599 -8.618
250 HB THR 128 HB THR 128 -5.900 5.838 -7.635
251 HG1 THR 128 1HG THR 128 -4.109 7.106 -7.833
252 HG21 THR 128 3HG2 THR 128 -4.523 5.326 -5.798
253 HG22 THR 128 1HG2 THR 128 -3.398 4.400 -6.789
254 HG23 THR 128 2HG2 THR 128 -5.003 3.758 -6.444
255 H GLY 129 H GLY 129 -7.711 4.659 -9.565
256 HA2 GLY 129 1HA GLY 129 -7.131 5.839 -12.196
257 HA3 GLY 129 2HA GLY 129 -8.661 5.120 -11.714
258 H GLU 130 H GLU 130 -6.597 7.941 -11.435
259 HA GLU 130 HA GLU 130 -8.973 9.511 -10.710
260 HB2 GLU 130 1HB GLU 130 -7.726 10.838 -9.148
261 HB3 GLU 130 2HB GLU 130 -7.509 9.147 -8.718
262 HG2 GLU 130 1HG GLU 130 -5.319 9.126 -9.719
263 HG3 GLU 130 2HG GLU 130 -5.535 10.776 -10.301
264 H LYS 131 H LYS 131 -8.589 11.900 -11.093
265 HA LYS 131 HA LYS 131 -6.722 12.407 -13.293
266 HB2 LYS 131 1HB LYS 131 -8.871 11.837 -14.332
267 HB3 LYS 131 2HB LYS 131 -9.671 13.074 -13.371
268 HG2 LYS 131 1HG LYS 131 -8.718 14.809 -14.575
269 HG3 LYS 131 2HG LYS 131 -7.412 13.795 -15.192
270 HD2 LYS 131 1HD LYS 131 -9.173 12.507 -16.461
271 HD3 LYS 131 2HD LYS 131 -10.312 13.777 -16.007
272 HE2 LYS 131 1HE LYS 131 -9.558 14.401 -18.133
273 HE3 LYS 131 2HE LYS 131 -8.625 15.405 -17.024
274 HZ1 LYS 131 3HZ LYS 131 -7.691 12.926 -18.364
275 HZ2 LYS 131 1HZ LYS 131 -6.799 13.795 -17.219
276 HZ3 LYS 131 2HZ LYS 131 -7.188 14.505 -18.704
277 H SER 132 H SER 132 -6.031 14.537 -13.478
278 HA SER 132 HA SER 132 -6.423 16.138 -11.081
279 HB2 SER 132 1HB SER 132 -4.565 16.594 -13.428
280 HB3 SER 132 2HB SER 132 -4.540 17.468 -11.896
281 HG SER 132 HG SER 132 -4.109 14.678 -12.208
282 H GLY 133 H GLY 133 -7.620 17.935 -10.972
283 HA2 GLY 133 1HA GLY 133 -8.023 19.856 -12.901
284 HA3 GLY 133 2HA GLY 133 -9.289 18.668 -13.174
285 HA PRO 134 HA PRO 134 -10.789 21.776 -10.058
286 HB2 PRO 134 1HB PRO 134 -13.160 22.238 -11.297
287 HB3 PRO 134 2HB PRO 134 -11.683 23.125 -11.689
288 HG2 PRO 134 1HG PRO 134 -12.933 20.803 -13.108
289 HG3 PRO 134 2HG PRO 134 -12.216 22.276 -13.788
290 HD2 PRO 134 1HD PRO 134 -10.893 19.915 -13.708
291 HD3 PRO 134 2HD PRO 134 -10.064 21.479 -13.573
292 H SER 135 H SER 135 -11.617 20.878 -8.288
293 HA SER 135 HA SER 135 -13.565 18.690 -8.591
294 HB2 SER 135 1HB SER 135 -12.826 17.877 -6.412
295 HB3 SER 135 2HB SER 135 -11.440 18.049 -7.488
296 HG SER 135 HG SER 135 -12.248 19.835 -5.437
297 H SER 136 H SER 136 -15.216 18.529 -6.893
298 HA SER 136 HA SER 136 -15.976 21.175 -5.839
299 HB2 SER 136 1HB SER 136 -18.315 20.623 -6.255
300 HB3 SER 136 2HB SER 136 -17.396 20.492 -7.754
301 HG SER 136 HG SER 136 -17.737 18.221 -6.142
302 H GLY 137 H GLY 137 -14.448 19.386 -4.356
303 HA2 GLY 137 1HA GLY 137 -15.673 19.308 -1.914
304 HA3 GLY 137 2HA GLY 137 -16.124 17.782 -2.660
Start of MODEL 4
1 H1 GLY 93 H GLY 93 18.094 -15.193 -17.494
2 HA2 GLY 93 1HA GLY 93 18.382 -14.173 -20.211
3 HA3 GLY 93 2HA GLY 93 17.111 -13.758 -19.071
4 H SER 94 H SER 94 19.035 -12.149 -20.774
5 HA SER 94 HA SER 94 20.390 -10.618 -18.670
6 HB2 SER 94 1HB SER 94 20.812 -10.970 -21.598
7 HB3 SER 94 2HB SER 94 21.254 -9.414 -20.895
8 HG SER 94 HG SER 94 22.802 -10.350 -19.739
9 H SER 95 H SER 95 18.509 -9.958 -21.631
10 HA SER 95 HA SER 95 17.860 -7.300 -20.778
11 HB2 SER 95 1HB SER 95 18.042 -7.667 -23.135
12 HB3 SER 95 2HB SER 95 16.897 -9.007 -23.079
13 HG SER 95 HG SER 95 16.407 -6.394 -23.398
14 H GLY 96 H GLY 96 16.704 -7.313 -18.894
15 HA2 GLY 96 1HA GLY 96 13.907 -7.916 -19.102
16 HA3 GLY 96 2HA GLY 96 14.752 -9.031 -18.039
17 H SER 97 H SER 97 13.319 -5.959 -18.340
18 HA SER 97 HA SER 97 14.620 -4.601 -16.228
19 HB2 SER 97 1HB SER 97 12.820 -3.009 -16.355
20 HB3 SER 97 2HB SER 97 13.189 -3.529 -17.999
21 HG SER 97 HG SER 97 10.861 -3.578 -16.851
22 H SER 98 H SER 98 11.624 -6.503 -16.352
23 HA SER 98 HA SER 98 10.843 -6.154 -13.691
24 HB2 SER 98 1HB SER 98 9.508 -8.211 -14.006
25 HB3 SER 98 2HB SER 98 9.351 -7.113 -15.377
26 HG SER 98 HG SER 98 10.934 -8.408 -16.454
27 H GLY 99 H GLY 99 11.297 -7.200 -11.801
28 HA2 GLY 99 1HA GLY 99 13.565 -9.091 -11.897
29 HA3 GLY 99 2HA GLY 99 13.292 -7.949 -10.589
30 H THR 100 H THR 100 13.683 -10.625 -10.071
31 HA THR 100 HA THR 100 11.075 -11.344 -8.948
32 HB THR 100 HB THR 100 12.859 -13.384 -10.284
33 HG1 THR 100 1HG THR 100 11.967 -12.501 -12.019
34 HG21 THR 100 3HG2 THR 100 11.658 -14.638 -8.802
35 HG22 THR 100 1HG2 THR 100 10.483 -14.572 -10.114
36 HG23 THR 100 2HG2 THR 100 10.326 -13.484 -8.735
37 H GLY 101 H GLY 101 11.203 -11.871 -6.857
38 HA2 GLY 101 1HA GLY 101 13.143 -13.434 -5.631
39 HA3 GLY 101 2HA GLY 101 13.682 -11.768 -5.476
40 H GLN 102 H GLN 102 13.315 -11.172 -3.442
41 HA GLN 102 HA GLN 102 10.583 -11.379 -2.421
42 HB2 GLN 102 1HB GLN 102 12.277 -13.233 -1.580
43 HB3 GLN 102 2HB GLN 102 12.803 -11.942 -0.509
44 HG2 GLN 102 1HG GLN 102 10.239 -11.733 -0.014
45 HG3 GLN 102 2HG GLN 102 10.210 -13.395 -0.601
46 HE21 GLN 102 1HE2 GLN 102 9.439 -13.029 1.905
47 HE22 GLN 102 2HE2 GLN 102 10.642 -13.560 3.025
48 H LYS 103 H LYS 103 9.960 -9.392 -1.936
49 HA LYS 103 HA LYS 103 11.917 -7.560 -0.714
50 HB2 LYS 103 1HB LYS 103 10.059 -7.135 -3.003
51 HB3 LYS 103 2HB LYS 103 10.310 -5.792 -1.895
52 HG2 LYS 103 1HG LYS 103 11.934 -5.370 -3.440
53 HG3 LYS 103 2HG LYS 103 12.842 -6.351 -2.287
54 HD2 LYS 103 1HD LYS 103 12.514 -8.322 -3.660
55 HD3 LYS 103 2HD LYS 103 11.507 -7.403 -4.782
56 HE2 LYS 103 1HE LYS 103 14.387 -6.749 -4.186
57 HE3 LYS 103 2HE LYS 103 13.872 -7.764 -5.531
58 HZ1 LYS 103 3HZ LYS 103 14.255 -5.375 -6.087
59 HZ2 LYS 103 1HZ LYS 103 12.912 -4.988 -5.133
60 HZ3 LYS 103 2HZ LYS 103 12.723 -5.957 -6.506
61 HA PRO 104 HA PRO 104 9.019 -7.032 2.548
62 HB2 PRO 104 1HB PRO 104 9.675 -4.529 3.370
63 HB3 PRO 104 2HB PRO 104 10.696 -5.939 3.677
64 HG2 PRO 104 1HG PRO 104 10.944 -3.847 1.549
65 HG3 PRO 104 2HG PRO 104 12.210 -4.579 2.552
66 HD2 PRO 104 1HD PRO 104 11.750 -5.348 -0.003
67 HD3 PRO 104 2HD PRO 104 12.329 -6.472 1.243
68 H PHE 105 H PHE 105 8.903 -5.240 -0.308
69 HA PHE 105 HA PHE 105 6.161 -4.439 0.251
70 HB2 PHE 105 1HB PHE 105 8.103 -2.425 -0.881
71 HB3 PHE 105 2HB PHE 105 6.441 -2.152 -0.369
72 HD1 PHE 105 2HD PHE 105 5.875 -2.146 2.034
73 HD2 PHE 105 1HD PHE 105 9.899 -2.388 0.667
74 HE1 PHE 105 2HE PHE 105 6.671 -1.499 4.271
75 HE2 PHE 105 1HE PHE 105 10.701 -1.742 2.901
76 HZ PHE 105 HZ PHE 105 9.086 -1.295 4.706
77 H GLU 106 H GLU 106 5.184 -5.579 -1.307
78 HA GLU 106 HA GLU 106 6.188 -5.273 -4.061
79 HB2 GLU 106 1HB GLU 106 6.332 -7.599 -2.926
80 HB3 GLU 106 2HB GLU 106 4.590 -7.650 -3.156
81 HG2 GLU 106 1HG GLU 106 4.842 -7.461 -5.535
82 HG3 GLU 106 2HG GLU 106 6.581 -7.225 -5.370
83 H CYS 107 H CYS 107 4.744 -4.749 -5.636
84 HA CYS 107 HA CYS 107 2.161 -3.777 -4.749
85 HB2 CYS 107 1HB CYS 107 3.683 -2.493 -6.304
86 HB3 CYS 107 2HB CYS 107 3.312 -3.690 -7.541
87 H THR 108 H THR 108 1.349 -5.955 -4.275
88 HA THR 108 HA THR 108 1.018 -8.120 -5.793
89 HB THR 108 HB THR 108 -0.095 -7.896 -3.635
90 HG1 THR 108 1HG THR 108 -1.745 -8.582 -5.847
91 HG21 THR 108 3HG2 THR 108 -0.922 -5.611 -3.858
92 HG22 THR 108 1HG2 THR 108 -2.239 -6.708 -3.445
93 HG23 THR 108 2HG2 THR 108 -2.059 -6.130 -5.101
94 H HIS 109 H HIS 109 -0.701 -5.076 -6.307
95 HA HIS 109 HA HIS 109 -2.581 -5.695 -8.155
96 HB2 HIS 109 1HB HIS 109 -0.689 -3.348 -8.088
97 HB3 HIS 109 2HB HIS 109 -2.005 -3.461 -9.253
98 HD2 HIS 109 2HD HIS 109 -1.536 -1.611 -6.205
99 HE1 HIS 109 1HE HIS 109 -5.504 -3.054 -5.795
100 HE2 HIS 109 2HE HIS 109 -3.819 -1.350 -5.019
101 H CYS 110 H CYS 110 0.785 -4.882 -9.024
102 HA CYS 110 HA CYS 110 0.415 -6.441 -11.497
103 HB2 CYS 110 1HB CYS 110 2.197 -5.026 -12.475
104 HB3 CYS 110 2HB CYS 110 0.791 -4.090 -11.979
105 H GLY 111 H GLY 111 2.708 -5.605 -8.927
106 HA2 GLY 111 1HA GLY 111 3.820 -7.655 -7.975
107 HA3 GLY 111 2HA GLY 111 4.249 -8.024 -9.639
108 H LYS 112 H LYS 112 4.296 -4.707 -8.849
109 HA LYS 112 HA LYS 112 7.117 -4.550 -9.294
110 HB2 LYS 112 1HB LYS 112 5.283 -2.824 -9.892
111 HB3 LYS 112 2HB LYS 112 5.436 -2.301 -8.220
112 HG2 LYS 112 1HG LYS 112 6.888 -0.869 -9.243
113 HG3 LYS 112 2HG LYS 112 7.986 -2.184 -8.818
114 HD2 LYS 112 1HD LYS 112 7.954 -3.041 -11.033
115 HD3 LYS 112 2HD LYS 112 6.604 -1.997 -11.488
116 HE2 LYS 112 1HE LYS 112 7.947 -0.077 -11.495
117 HE3 LYS 112 2HE LYS 112 9.229 -0.863 -10.574
118 HZ1 LYS 112 3HZ LYS 112 9.993 -1.975 -12.413
119 HZ2 LYS 112 1HZ LYS 112 9.484 -0.523 -13.116
120 HZ3 LYS 112 2HZ LYS 112 8.512 -1.903 -13.229
121 H SER 113 H SER 113 8.603 -4.979 -7.812
122 HA SER 113 HA SER 113 7.931 -4.836 -4.983
123 HB2 SER 113 1HB SER 113 10.082 -5.971 -4.630
124 HB3 SER 113 2HB SER 113 9.107 -6.828 -5.823
125 HG SER 113 HG SER 113 10.505 -6.332 -7.342
126 H PHE 114 H PHE 114 9.474 -3.850 -3.460
127 HA PHE 114 HA PHE 114 11.177 -1.747 -4.508
128 HB2 PHE 114 1HB PHE 114 8.772 -1.145 -2.775
129 HB3 PHE 114 2HB PHE 114 10.065 0.001 -3.117
130 HD1 PHE 114 2HD PHE 114 7.286 -1.911 -4.593
131 HD2 PHE 114 1HD PHE 114 10.163 1.171 -5.175
132 HE1 PHE 114 2HE PHE 114 6.114 -1.207 -6.639
133 HE2 PHE 114 1HE PHE 114 8.996 1.880 -7.221
134 HZ PHE 114 HZ PHE 114 6.969 0.690 -7.957
135 H ARG 115 H ARG 115 12.292 -0.567 -2.680
136 HA ARG 115 HA ARG 115 13.227 -2.538 -0.780
137 HB2 ARG 115 1HB ARG 115 14.123 0.171 -1.662
138 HB3 ARG 115 2HB ARG 115 14.679 -0.434 -0.107
139 HG2 ARG 115 1HG ARG 115 15.312 -2.556 -1.503
140 HG3 ARG 115 2HG ARG 115 15.279 -1.417 -2.850
141 HD2 ARG 115 1HD ARG 115 16.859 -0.990 -0.321
142 HD3 ARG 115 2HD ARG 115 17.523 -1.716 -1.784
143 HE ARG 115 HE ARG 115 16.299 0.875 -2.153
144 HH11 ARG 115 2HH1 ARG 115 19.223 -0.887 -1.472
145 HH12 ARG 115 1HH1 ARG 115 20.269 0.392 -1.991
146 HH21 ARG 115 2HH2 ARG 115 17.666 2.566 -2.840
147 HH22 ARG 115 1HH2 ARG 115 19.383 2.356 -2.769
148 H ALA 116 H ALA 116 11.628 0.625 -0.684
149 HA ALA 116 HA ALA 116 10.940 0.094 2.134
150 HB1 ALA 116 3HB ALA 116 10.773 2.617 2.329
151 HB2 ALA 116 1HB ALA 116 12.396 1.946 2.164
152 HB3 ALA 116 2HB ALA 116 11.604 2.692 0.775
153 H LYS 117 H LYS 117 8.891 1.029 2.856
154 HA LYS 117 HA LYS 117 6.738 0.293 1.260
155 HB2 LYS 117 1HB LYS 117 6.560 0.500 3.681
156 HB3 LYS 117 2HB LYS 117 6.807 2.238 3.574
157 HG2 LYS 117 1HG LYS 117 4.549 2.208 3.752
158 HG3 LYS 117 2HG LYS 117 4.685 2.067 1.997
159 HD2 LYS 117 1HD LYS 117 4.699 -0.438 3.594
160 HD3 LYS 117 2HD LYS 117 3.168 0.426 3.433
161 HE2 LYS 117 1HE LYS 117 4.788 -0.023 0.982
162 HE3 LYS 117 2HE LYS 117 3.944 -1.405 1.679
163 HZ1 LYS 117 3HZ LYS 117 2.894 0.644 0.087
164 HZ2 LYS 117 1HZ LYS 117 2.173 0.758 1.614
165 HZ3 LYS 117 2HZ LYS 117 2.087 -0.690 0.744
166 H GLY 118 H GLY 118 7.666 3.635 2.126
167 HA2 GLY 118 1HA GLY 118 5.971 5.100 0.627
168 HA3 GLY 118 2HA GLY 118 7.664 5.537 0.805
169 H ASN 119 H ASN 119 9.165 4.278 -0.721
170 HA ASN 119 HA ASN 119 8.928 5.016 -3.268
171 HB2 ASN 119 1HB ASN 119 10.157 2.575 -2.064
172 HB3 ASN 119 2HB ASN 119 10.099 2.704 -3.820
173 HD21 ASN 119 1HD2 ASN 119 11.802 3.590 -4.714
174 HD22 ASN 119 2HD2 ASN 119 12.874 4.725 -3.972
175 H LEU 120 H LEU 120 7.529 2.014 -1.988
176 HA LEU 120 HA LEU 120 6.367 1.205 -4.449
177 HB2 LEU 120 1HB LEU 120 6.721 -0.495 -2.882
178 HB3 LEU 120 2HB LEU 120 5.958 0.422 -1.585
179 HG LEU 120 HG LEU 120 3.767 0.057 -2.625
180 HD11 LEU 120 1HD1 LEU 120 4.827 -0.181 -4.957
181 HD12 LEU 120 2HD1 LEU 120 3.431 -1.181 -4.561
182 HD13 LEU 120 3HD1 LEU 120 5.052 -1.874 -4.519
183 HD21 LEU 120 3HD2 LEU 120 3.658 -2.405 -2.242
184 HD22 LEU 120 1HD2 LEU 120 4.443 -1.505 -0.944
185 HD23 LEU 120 2HD2 LEU 120 5.417 -2.411 -2.103
186 H VAL 121 H VAL 121 5.024 2.769 -1.550
187 HA VAL 121 HA VAL 121 2.380 2.953 -2.217
188 HB VAL 121 HB VAL 121 4.031 5.132 -0.930
189 HG11 VAL 121 1HG1 VAL 121 2.144 6.257 -0.423
190 HG12 VAL 121 2HG1 VAL 121 1.508 5.419 -1.840
191 HG13 VAL 121 3HG1 VAL 121 1.193 4.785 -0.224
192 HG21 VAL 121 3HG2 VAL 121 4.328 3.561 0.645
193 HG22 VAL 121 1HG2 VAL 121 2.645 3.886 1.062
194 HG23 VAL 121 2HG2 VAL 121 3.047 2.535 0.001
195 H THR 122 H THR 122 4.971 5.161 -3.231
196 HA THR 122 HA THR 122 3.358 6.944 -4.683
197 HB THR 122 HB THR 122 6.282 6.261 -4.829
198 HG1 THR 122 1HG THR 122 6.468 8.086 -3.695
199 HG21 THR 122 3HG2 THR 122 6.522 8.200 -6.383
200 HG22 THR 122 1HG2 THR 122 4.770 8.199 -6.580
201 HG23 THR 122 2HG2 THR 122 5.716 6.805 -7.101
202 H HIS 123 H HIS 123 4.816 3.874 -5.543
203 HA HIS 123 HA HIS 123 4.414 4.073 -8.344
204 HB2 HIS 123 1HB HIS 123 5.969 2.446 -7.778
205 HB3 HIS 123 2HB HIS 123 4.998 1.834 -6.443
206 HD1 HIS 123 1HD HIS 123 5.395 1.583 -10.159
207 HD2 HIS 123 2HD HIS 123 3.147 -0.138 -7.118
208 HE1 HIS 123 1HE HIS 123 4.277 -0.416 -11.198
209 H GLN 124 H GLN 124 2.549 2.510 -5.753
210 HA GLN 124 HA GLN 124 0.544 1.347 -7.236
211 HB2 GLN 124 1HB GLN 124 -0.131 2.772 -4.688
212 HB3 GLN 124 2HB GLN 124 -0.701 1.214 -5.272
213 HG2 GLN 124 1HG GLN 124 1.755 0.472 -4.985
214 HG3 GLN 124 2HG GLN 124 1.895 1.903 -3.966
215 HE21 GLN 124 1HE2 GLN 124 2.181 -0.834 -3.173
216 HE22 GLN 124 2HE2 GLN 124 0.963 -1.149 -1.989
217 H ARG 125 H ARG 125 0.965 4.721 -6.388
218 HA ARG 125 HA ARG 125 -1.534 5.758 -6.901
219 HB2 ARG 125 1HB ARG 125 1.096 7.020 -7.695
220 HB3 ARG 125 2HB ARG 125 -0.425 7.861 -7.425
221 HG2 ARG 125 1HG ARG 125 -0.373 7.296 -5.082
222 HG3 ARG 125 2HG ARG 125 1.081 6.323 -5.320
223 HD2 ARG 125 1HD ARG 125 1.901 8.336 -4.483
224 HD3 ARG 125 2HD ARG 125 2.130 8.487 -6.225
225 HE ARG 125 HE ARG 125 -0.346 9.581 -5.201
226 HH11 ARG 125 2HH1 ARG 125 2.975 10.181 -6.056
227 HH12 ARG 125 1HH1 ARG 125 2.752 11.887 -6.255
228 HH21 ARG 125 2HH2 ARG 125 -0.652 11.826 -5.460
229 HH22 ARG 125 1HH2 ARG 125 0.689 12.822 -5.914
230 H ILE 126 H ILE 126 0.758 4.432 -9.128
231 HA ILE 126 HA ILE 126 -0.231 5.640 -11.498
232 HB ILE 126 HB ILE 126 1.135 4.173 -12.699
233 HG12 ILE 126 1HG1 ILE 126 0.908 2.300 -10.339
234 HG13 ILE 126 2HG1 ILE 126 0.272 2.054 -11.962
235 HG21 ILE 126 1HG2 ILE 126 2.931 5.125 -11.811
236 HG22 ILE 126 2HG2 ILE 126 2.127 5.276 -10.250
237 HG23 ILE 126 3HG2 ILE 126 3.015 3.804 -10.646
238 HD11 ILE 126 3HD1 ILE 126 2.139 0.727 -11.982
239 HD12 ILE 126 1HD1 ILE 126 2.772 2.226 -12.663
240 HD13 ILE 126 2HD1 ILE 126 3.069 1.831 -10.969
241 H HIS 127 H HIS 127 -1.148 2.814 -9.653
242 HA HIS 127 HA HIS 127 -2.853 1.723 -11.689
243 HB2 HIS 127 1HB HIS 127 -2.519 1.121 -8.750
244 HB3 HIS 127 2HB HIS 127 -3.675 0.274 -9.774
245 HD1 HIS 127 1HD HIS 127 -2.593 -1.107 -11.810
246 HD2 HIS 127 2HD HIS 127 0.031 0.147 -8.842
247 HE1 HIS 127 1HE HIS 127 -0.518 -2.494 -12.117
248 H THR 128 H THR 128 -3.411 3.413 -8.607
249 HA THR 128 HA THR 128 -6.075 3.495 -8.364
250 HB THR 128 HB THR 128 -5.936 5.762 -7.454
251 HG1 THR 128 1HG THR 128 -3.580 6.586 -7.584
252 HG21 THR 128 3HG2 THR 128 -3.352 4.495 -6.649
253 HG22 THR 128 1HG2 THR 128 -4.865 3.643 -6.344
254 HG23 THR 128 2HG2 THR 128 -4.596 5.241 -5.646
255 H GLY 129 H GLY 129 -4.260 5.609 -10.583
256 HA2 GLY 129 1HA GLY 129 -4.949 6.856 -12.386
257 HA3 GLY 129 2HA GLY 129 -6.046 5.516 -12.687
258 H GLU 130 H GLU 130 -5.878 8.045 -10.179
259 HA GLU 130 HA GLU 130 -8.713 8.352 -10.138
260 HB2 GLU 130 1HB GLU 130 -6.922 8.831 -8.283
261 HB3 GLU 130 2HB GLU 130 -6.850 10.419 -9.034
262 HG2 GLU 130 1HG GLU 130 -9.259 9.101 -7.810
263 HG3 GLU 130 2HG GLU 130 -8.372 10.493 -7.191
264 H LYS 131 H LYS 131 -6.130 9.817 -11.907
265 HA LYS 131 HA LYS 131 -8.078 11.565 -13.243
266 HB2 LYS 131 1HB LYS 131 -6.439 13.368 -13.360
267 HB3 LYS 131 2HB LYS 131 -6.768 12.943 -11.686
268 HG2 LYS 131 1HG LYS 131 -4.466 11.635 -13.028
269 HG3 LYS 131 2HG LYS 131 -4.315 13.333 -12.569
270 HD2 LYS 131 1HD LYS 131 -5.389 11.420 -10.559
271 HD3 LYS 131 2HD LYS 131 -3.659 11.379 -10.909
272 HE2 LYS 131 1HE LYS 131 -3.734 12.906 -9.189
273 HE3 LYS 131 2HE LYS 131 -3.832 13.967 -10.594
274 HZ1 LYS 131 3HZ LYS 131 -5.534 14.043 -8.537
275 HZ2 LYS 131 1HZ LYS 131 -6.376 13.020 -9.589
276 HZ3 LYS 131 2HZ LYS 131 -5.920 14.567 -10.098
277 H SER 132 H SER 132 -7.441 12.207 -15.415
278 HA SER 132 HA SER 132 -6.816 10.202 -17.111
279 HB2 SER 132 1HB SER 132 -6.238 11.872 -18.788
280 HB3 SER 132 2HB SER 132 -7.585 12.457 -17.812
281 HG SER 132 HG SER 132 -5.535 13.823 -18.281
282 H GLY 133 H GLY 133 -5.168 8.817 -16.947
283 HA2 GLY 133 1HA GLY 133 -2.638 9.433 -15.854
284 HA3 GLY 133 2HA GLY 133 -3.030 7.996 -16.786
285 HA PRO 134 HA PRO 134 -0.235 11.050 -19.139
286 HB2 PRO 134 1HB PRO 134 2.109 9.700 -18.902
287 HB3 PRO 134 2HB PRO 134 1.592 10.937 -17.750
288 HG2 PRO 134 1HG PRO 134 1.411 7.956 -17.538
289 HG3 PRO 134 2HG PRO 134 1.892 9.138 -16.307
290 HD2 PRO 134 1HD PRO 134 -0.580 8.037 -16.382
291 HD3 PRO 134 2HD PRO 134 -0.288 9.690 -15.804
292 H SER 135 H SER 135 -1.394 7.945 -19.254
293 HA SER 135 HA SER 135 -0.056 7.251 -21.762
294 HB2 SER 135 1HB SER 135 -1.777 5.717 -19.828
295 HB3 SER 135 2HB SER 135 -1.485 5.110 -21.458
296 HG SER 135 HG SER 135 0.017 4.432 -19.719
297 H SER 136 H SER 136 -0.926 8.128 -23.520
298 HA SER 136 HA SER 136 -3.638 8.990 -23.667
299 HB2 SER 136 1HB SER 136 -1.408 8.782 -25.682
300 HB3 SER 136 2HB SER 136 -3.033 9.279 -26.154
301 HG SER 136 HG SER 136 -2.747 11.144 -25.197
302 H GLY 137 H GLY 137 -1.840 6.271 -25.074
303 HA2 GLY 137 1HA GLY 137 -3.644 5.134 -26.748
304 HA3 GLY 137 2HA GLY 137 -2.610 4.182 -25.693
Start of MODEL 5
1 H1 GLY 93 H GLY 93 26.329 -26.343 -9.768
2 HA2 GLY 93 1HA GLY 93 26.402 -24.454 -11.175
3 HA3 GLY 93 2HA GLY 93 27.179 -25.432 -12.411
4 H SER 94 H SER 94 24.139 -24.510 -10.962
5 HA SER 94 HA SER 94 22.486 -26.164 -12.579
6 HB2 SER 94 1HB SER 94 20.640 -24.763 -11.774
7 HB3 SER 94 2HB SER 94 21.712 -25.203 -10.444
8 HG SER 94 HG SER 94 21.527 -22.725 -11.799
9 H SER 95 H SER 95 21.269 -25.646 -14.402
10 HA SER 95 HA SER 95 22.530 -23.784 -16.195
11 HB2 SER 95 1HB SER 95 21.526 -26.082 -16.789
12 HB3 SER 95 2HB SER 95 19.964 -25.263 -16.752
13 HG SER 95 HG SER 95 21.173 -23.700 -18.232
14 H GLY 96 H GLY 96 19.369 -24.053 -14.606
15 HA2 GLY 96 1HA GLY 96 19.033 -21.160 -14.953
16 HA3 GLY 96 2HA GLY 96 17.764 -22.218 -15.553
17 H SER 97 H SER 97 18.936 -20.514 -12.893
18 HA SER 97 HA SER 97 17.822 -22.104 -10.804
19 HB2 SER 97 1HB SER 97 18.596 -19.177 -10.848
20 HB3 SER 97 2HB SER 97 18.184 -20.091 -9.397
21 HG SER 97 HG SER 97 20.330 -20.281 -9.473
22 H SER 98 H SER 98 16.043 -21.403 -9.401
23 HA SER 98 HA SER 98 13.919 -20.040 -10.924
24 HB2 SER 98 1HB SER 98 12.311 -21.570 -10.139
25 HB3 SER 98 2HB SER 98 13.698 -22.583 -10.540
26 HG SER 98 HG SER 98 13.909 -23.085 -8.506
27 H GLY 99 H GLY 99 13.141 -18.260 -10.010
28 HA2 GLY 99 1HA GLY 99 12.096 -17.524 -7.794
29 HA3 GLY 99 2HA GLY 99 13.705 -17.814 -7.150
30 H THR 100 H THR 100 12.061 -15.343 -7.325
31 HA THR 100 HA THR 100 13.962 -13.690 -8.858
32 HB THR 100 HB THR 100 11.780 -13.515 -9.872
33 HG1 THR 100 1HG THR 100 12.090 -11.183 -8.279
34 HG21 THR 100 3HG2 THR 100 10.018 -13.951 -8.556
35 HG22 THR 100 1HG2 THR 100 10.114 -12.256 -8.079
36 HG23 THR 100 2HG2 THR 100 10.890 -13.496 -7.092
37 H GLY 101 H GLY 101 12.697 -14.432 -5.798
38 HA2 GLY 101 1HA GLY 101 13.799 -13.625 -3.828
39 HA3 GLY 101 2HA GLY 101 14.105 -12.110 -4.665
40 H GLN 102 H GLN 102 13.064 -12.092 -2.132
41 HA GLN 102 HA GLN 102 10.291 -11.222 -2.612
42 HB2 GLN 102 1HB GLN 102 9.848 -11.820 -0.217
43 HB3 GLN 102 2HB GLN 102 10.167 -13.194 -1.267
44 HG2 GLN 102 1HG GLN 102 12.390 -11.962 0.298
45 HG3 GLN 102 2HG GLN 102 11.264 -13.073 1.076
46 HE21 GLN 102 1HE2 GLN 102 11.704 -15.158 0.960
47 HE22 GLN 102 2HE2 GLN 102 12.810 -15.900 -0.140
48 H LYS 103 H LYS 103 9.710 -9.247 -1.865
49 HA LYS 103 HA LYS 103 11.766 -7.715 -0.409
50 HB2 LYS 103 1HB LYS 103 9.892 -6.862 -2.609
51 HB3 LYS 103 2HB LYS 103 10.685 -5.699 -1.555
52 HG2 LYS 103 1HG LYS 103 12.836 -7.054 -2.301
53 HG3 LYS 103 2HG LYS 103 11.816 -7.405 -3.698
54 HD2 LYS 103 1HD LYS 103 12.776 -5.463 -4.417
55 HD3 LYS 103 2HD LYS 103 11.380 -4.794 -3.569
56 HE2 LYS 103 1HE LYS 103 13.095 -3.506 -2.726
57 HE3 LYS 103 2HE LYS 103 12.986 -4.783 -1.516
58 HZ1 LYS 103 3HZ LYS 103 14.734 -5.824 -3.267
59 HZ2 LYS 103 1HZ LYS 103 15.172 -4.969 -1.874
60 HZ3 LYS 103 2HZ LYS 103 15.116 -4.179 -3.369
61 HA PRO 104 HA PRO 104 8.837 -6.834 2.739
62 HB2 PRO 104 1HB PRO 104 9.546 -4.312 3.451
63 HB3 PRO 104 2HB PRO 104 10.523 -5.732 3.844
64 HG2 PRO 104 1HG PRO 104 10.863 -3.754 1.623
65 HG3 PRO 104 2HG PRO 104 12.093 -4.468 2.682
66 HD2 PRO 104 1HD PRO 104 11.654 -5.349 0.160
67 HD3 PRO 104 2HD PRO 104 12.182 -6.426 1.468
68 H PHE 105 H PHE 105 8.818 -5.178 -0.200
69 HA PHE 105 HA PHE 105 6.080 -4.321 0.235
70 HB2 PHE 105 1HB PHE 105 8.069 -2.323 -0.836
71 HB3 PHE 105 2HB PHE 105 6.394 -2.042 -0.373
72 HD1 PHE 105 2HD PHE 105 5.765 -2.130 2.043
73 HD2 PHE 105 1HD PHE 105 9.814 -2.175 0.732
74 HE1 PHE 105 2HE PHE 105 6.499 -1.474 4.297
75 HE2 PHE 105 1HE PHE 105 10.554 -1.519 2.985
76 HZ PHE 105 HZ PHE 105 8.896 -1.167 4.771
77 H GLU 106 H GLU 106 5.148 -5.436 -1.362
78 HA GLU 106 HA GLU 106 6.270 -5.150 -4.072
79 HB2 GLU 106 1HB GLU 106 6.480 -7.460 -3.014
80 HB3 GLU 106 2HB GLU 106 4.728 -7.559 -3.121
81 HG2 GLU 106 1HG GLU 106 4.742 -7.622 -5.437
82 HG3 GLU 106 2HG GLU 106 6.362 -6.934 -5.543
83 H CYS 107 H CYS 107 4.838 -4.822 -5.753
84 HA CYS 107 HA CYS 107 2.235 -3.798 -4.963
85 HB2 CYS 107 1HB CYS 107 3.850 -2.630 -6.574
86 HB3 CYS 107 2HB CYS 107 3.364 -3.840 -7.757
87 H THR 108 H THR 108 1.528 -6.032 -4.402
88 HA THR 108 HA THR 108 1.231 -8.218 -5.914
89 HB THR 108 HB THR 108 0.207 -8.110 -3.732
90 HG1 THR 108 1HG THR 108 -1.846 -9.077 -4.293
91 HG21 THR 108 3HG2 THR 108 -1.188 -6.495 -3.071
92 HG22 THR 108 1HG2 THR 108 -2.260 -6.766 -4.444
93 HG23 THR 108 2HG2 THR 108 -0.865 -5.700 -4.612
94 H HIS 109 H HIS 109 -0.321 -5.153 -6.515
95 HA HIS 109 HA HIS 109 -2.363 -5.858 -8.235
96 HB2 HIS 109 1HB HIS 109 -0.553 -3.456 -8.147
97 HB3 HIS 109 2HB HIS 109 -1.816 -3.601 -9.365
98 HD2 HIS 109 2HD HIS 109 -1.467 -1.928 -6.131
99 HE1 HIS 109 1HE HIS 109 -5.512 -3.206 -6.169
100 HE2 HIS 109 2HE HIS 109 -3.831 -1.653 -5.118
101 H CYS 110 H CYS 110 0.967 -4.986 -9.177
102 HA CYS 110 HA CYS 110 0.560 -6.523 -11.658
103 HB2 CYS 110 1HB CYS 110 2.295 -5.073 -12.667
104 HB3 CYS 110 2HB CYS 110 0.890 -4.161 -12.125
105 H GLY 111 H GLY 111 2.893 -5.682 -9.128
106 HA2 GLY 111 1HA GLY 111 4.043 -7.756 -8.244
107 HA3 GLY 111 2HA GLY 111 4.480 -8.043 -9.922
108 H LYS 112 H LYS 112 4.446 -4.758 -9.077
109 HA LYS 112 HA LYS 112 7.274 -4.535 -9.455
110 HB2 LYS 112 1HB LYS 112 5.413 -2.847 -10.085
111 HB3 LYS 112 2HB LYS 112 5.519 -2.330 -8.408
112 HG2 LYS 112 1HG LYS 112 6.952 -0.859 -9.416
113 HG3 LYS 112 2HG LYS 112 8.070 -2.137 -8.933
114 HD2 LYS 112 1HD LYS 112 8.091 -3.046 -11.147
115 HD3 LYS 112 2HD LYS 112 6.788 -1.970 -11.657
116 HE2 LYS 112 1HE LYS 112 8.166 -0.120 -11.726
117 HE3 LYS 112 2HE LYS 112 9.325 -0.811 -10.591
118 HZ1 LYS 112 3HZ LYS 112 10.400 -1.920 -12.220
119 HZ2 LYS 112 1HZ LYS 112 9.770 -0.683 -13.188
120 HZ3 LYS 112 2HZ LYS 112 9.004 -2.189 -13.137
121 H SER 113 H SER 113 8.741 -4.917 -7.944
122 HA SER 113 HA SER 113 7.996 -4.801 -5.128
123 HB2 SER 113 1HB SER 113 10.126 -5.931 -4.716
124 HB3 SER 113 2HB SER 113 9.223 -6.776 -5.974
125 HG SER 113 HG SER 113 11.672 -5.834 -6.123
126 H PHE 114 H PHE 114 9.370 -3.730 -3.564
127 HA PHE 114 HA PHE 114 11.109 -1.623 -4.575
128 HB2 PHE 114 1HB PHE 114 8.666 -1.062 -2.881
129 HB3 PHE 114 2HB PHE 114 9.936 0.108 -3.225
130 HD1 PHE 114 2HD PHE 114 7.236 -1.908 -4.724
131 HD2 PHE 114 1HD PHE 114 10.000 1.283 -5.273
132 HE1 PHE 114 2HE PHE 114 6.066 -1.253 -6.787
133 HE2 PHE 114 1HE PHE 114 8.833 1.943 -7.336
134 HZ PHE 114 HZ PHE 114 6.864 0.674 -8.096
135 H ARG 115 H ARG 115 12.115 -0.395 -2.690
136 HA ARG 115 HA ARG 115 13.027 -2.363 -0.758
137 HB2 ARG 115 1HB ARG 115 13.946 0.411 -1.491
138 HB3 ARG 115 2HB ARG 115 14.599 -0.452 -0.105
139 HG2 ARG 115 1HG ARG 115 15.129 -2.329 -1.763
140 HG3 ARG 115 2HG ARG 115 14.847 -1.116 -3.014
141 HD2 ARG 115 1HD ARG 115 16.493 0.297 -1.501
142 HD3 ARG 115 2HD ARG 115 17.024 -1.307 -0.997
143 HE ARG 115 HE ARG 115 16.881 -0.957 -3.851
144 HH11 ARG 115 2HH1 ARG 115 18.857 -0.616 -1.005
145 HH12 ARG 115 1HH1 ARG 115 20.352 -0.680 -1.877
146 HH21 ARG 115 2HH2 ARG 115 18.843 -1.043 -5.010
147 HH22 ARG 115 1HH2 ARG 115 20.344 -0.923 -4.155
148 H ALA 116 H ALA 116 11.541 0.863 -0.741
149 HA ALA 116 HA ALA 116 10.789 0.409 2.074
150 HB1 ALA 116 3HB ALA 116 10.628 2.917 2.207
151 HB2 ALA 116 1HB ALA 116 12.256 2.270 1.996
152 HB3 ALA 116 2HB ALA 116 11.400 2.973 0.622
153 H LYS 117 H LYS 117 8.703 1.060 2.746
154 HA LYS 117 HA LYS 117 6.596 0.366 1.116
155 HB2 LYS 117 1HB LYS 117 6.517 0.616 3.601
156 HB3 LYS 117 2HB LYS 117 6.459 2.360 3.385
157 HG2 LYS 117 1HG LYS 117 4.240 1.923 3.612
158 HG3 LYS 117 2HG LYS 117 4.395 1.759 1.861
159 HD2 LYS 117 1HD LYS 117 4.201 -0.530 1.923
160 HD3 LYS 117 2HD LYS 117 4.823 -0.645 3.570
161 HE2 LYS 117 1HE LYS 117 2.672 0.532 4.278
162 HE3 LYS 117 2HE LYS 117 2.080 0.177 2.656
163 HZ1 LYS 117 3HZ LYS 117 3.230 -2.097 3.992
164 HZ2 LYS 117 1HZ LYS 117 1.760 -1.956 3.168
165 HZ3 LYS 117 2HZ LYS 117 1.873 -1.471 4.784
166 H GLY 118 H GLY 118 7.450 3.715 2.031
167 HA2 GLY 118 1HA GLY 118 5.719 5.158 0.540
168 HA3 GLY 118 2HA GLY 118 7.397 5.639 0.746
169 H ASN 119 H ASN 119 8.915 4.238 -0.756
170 HA ASN 119 HA ASN 119 8.710 5.076 -3.310
171 HB2 ASN 119 1HB ASN 119 9.961 2.633 -2.122
172 HB3 ASN 119 2HB ASN 119 9.941 2.808 -3.875
173 HD21 ASN 119 1HD2 ASN 119 11.126 4.110 -0.875
174 HD22 ASN 119 2HD2 ASN 119 12.361 5.104 -1.563
175 H LEU 120 H LEU 120 7.512 1.915 -2.182
176 HA LEU 120 HA LEU 120 6.348 1.154 -4.628
177 HB2 LEU 120 1HB LEU 120 6.719 -0.565 -3.094
178 HB3 LEU 120 2HB LEU 120 5.941 0.317 -1.781
179 HG LEU 120 HG LEU 120 3.755 -0.076 -2.816
180 HD11 LEU 120 1HD1 LEU 120 3.436 -1.291 -4.775
181 HD12 LEU 120 2HD1 LEU 120 5.078 -1.933 -4.760
182 HD13 LEU 120 3HD1 LEU 120 4.798 -0.238 -5.159
183 HD21 LEU 120 3HD2 LEU 120 4.305 -1.671 -1.196
184 HD22 LEU 120 1HD2 LEU 120 5.519 -2.432 -2.225
185 HD23 LEU 120 2HD2 LEU 120 3.804 -2.626 -2.593
186 H VAL 121 H VAL 121 4.924 2.652 -1.735
187 HA VAL 121 HA VAL 121 2.283 2.762 -2.438
188 HB VAL 121 HB VAL 121 3.877 4.937 -1.076
189 HG11 VAL 121 1HG1 VAL 121 0.897 4.477 -1.160
190 HG12 VAL 121 2HG1 VAL 121 1.720 5.664 -0.146
191 HG13 VAL 121 3HG1 VAL 121 1.771 5.817 -1.903
192 HG21 VAL 121 3HG2 VAL 121 4.113 3.248 0.414
193 HG22 VAL 121 1HG2 VAL 121 2.488 3.745 0.885
194 HG23 VAL 121 2HG2 VAL 121 2.711 2.368 -0.195
195 H THR 122 H THR 122 4.783 5.139 -3.313
196 HA THR 122 HA THR 122 3.151 6.861 -4.788
197 HB THR 122 HB THR 122 6.098 6.275 -4.905
198 HG1 THR 122 1HG THR 122 6.211 8.079 -3.728
199 HG21 THR 122 3HG2 THR 122 6.282 8.272 -6.406
200 HG22 THR 122 1HG2 THR 122 4.537 8.188 -6.640
201 HG23 THR 122 2HG2 THR 122 5.562 6.854 -7.169
202 H HIS 123 H HIS 123 4.777 3.883 -5.702
203 HA HIS 123 HA HIS 123 4.392 4.113 -8.496
204 HB2 HIS 123 1HB HIS 123 5.989 2.527 -7.958
205 HB3 HIS 123 2HB HIS 123 5.043 1.873 -6.624
206 HD1 HIS 123 1HD HIS 123 5.393 1.689 -10.357
207 HD2 HIS 123 2HD HIS 123 3.309 -0.190 -7.293
208 HE1 HIS 123 1HE HIS 123 4.355 -0.350 -11.401
209 H GLN 124 H GLN 124 2.553 2.398 -5.979
210 HA GLN 124 HA GLN 124 0.611 1.219 -7.532
211 HB2 GLN 124 1HB GLN 124 -0.131 2.514 -4.931
212 HB3 GLN 124 2HB GLN 124 -0.657 0.970 -5.589
213 HG2 GLN 124 1HG GLN 124 1.909 0.397 -5.336
214 HG3 GLN 124 2HG GLN 124 1.818 1.663 -4.113
215 HE21 GLN 124 1HE2 GLN 124 1.561 -1.570 -4.625
216 HE22 GLN 124 2HE2 GLN 124 0.615 -2.008 -3.247
217 H ARG 125 H ARG 125 0.868 4.566 -6.507
218 HA ARG 125 HA ARG 125 -1.658 5.522 -7.025
219 HB2 ARG 125 1HB ARG 125 0.954 6.903 -7.670
220 HB3 ARG 125 2HB ARG 125 -0.606 7.692 -7.481
221 HG2 ARG 125 1HG ARG 125 -0.669 6.897 -5.134
222 HG3 ARG 125 2HG ARG 125 0.961 6.255 -5.351
223 HD2 ARG 125 1HD ARG 125 0.860 8.506 -4.267
224 HD3 ARG 125 2HD ARG 125 1.850 8.435 -5.724
225 HE ARG 125 HE ARG 125 -0.637 9.878 -5.369
226 HH11 ARG 125 2HH1 ARG 125 1.731 8.632 -7.596
227 HH12 ARG 125 1HH1 ARG 125 1.290 9.716 -8.874
228 HH21 ARG 125 2HH2 ARG 125 -1.226 11.310 -7.043
229 HH22 ARG 125 1HH2 ARG 125 -0.391 11.240 -8.558
230 H ILE 126 H ILE 126 0.639 4.279 -9.253
231 HA ILE 126 HA ILE 126 -0.317 5.595 -11.593
232 HB ILE 126 HB ILE 126 1.089 4.191 -12.835
233 HG12 ILE 126 1HG1 ILE 126 0.910 2.258 -10.518
234 HG13 ILE 126 2HG1 ILE 126 0.288 2.029 -12.149
235 HG21 ILE 126 1HG2 ILE 126 2.040 5.209 -10.307
236 HG22 ILE 126 2HG2 ILE 126 3.001 3.832 -10.844
237 HG23 ILE 126 3HG2 ILE 126 2.811 5.237 -11.893
238 HD11 ILE 126 3HD1 ILE 126 2.193 0.767 -12.207
239 HD12 ILE 126 1HD1 ILE 126 2.793 2.306 -12.823
240 HD13 ILE 126 2HD1 ILE 126 3.081 1.856 -11.142
241 H HIS 127 H HIS 127 -1.143 2.626 -9.917
242 HA HIS 127 HA HIS 127 -2.800 1.586 -12.004
243 HB2 HIS 127 1HB HIS 127 -2.557 0.901 -9.071
244 HB3 HIS 127 2HB HIS 127 -3.615 0.039 -10.184
245 HD1 HIS 127 1HD HIS 127 -2.377 -1.246 -12.179
246 HD2 HIS 127 2HD HIS 127 0.051 0.075 -9.078
247 HE1 HIS 127 1HE HIS 127 -0.222 -2.519 -12.423
248 H THR 128 H THR 128 -3.676 2.723 -8.736
249 HA THR 128 HA THR 128 -6.414 3.099 -9.469
250 HB THR 128 HB THR 128 -5.879 2.508 -7.181
251 HG1 THR 128 1HG THR 128 -7.730 3.808 -7.463
252 HG21 THR 128 3HG2 THR 128 -3.679 3.612 -7.056
253 HG22 THR 128 1HG2 THR 128 -4.707 4.029 -5.686
254 HG23 THR 128 2HG2 THR 128 -4.483 5.181 -7.003
255 H GLY 129 H GLY 129 -3.700 5.291 -8.781
256 HA2 GLY 129 1HA GLY 129 -3.514 7.579 -9.062
257 HA3 GLY 129 2HA GLY 129 -4.146 7.194 -10.656
258 H GLU 130 H GLU 130 -5.850 6.929 -7.572
259 HA GLU 130 HA GLU 130 -7.737 8.970 -8.550
260 HB2 GLU 130 1HB GLU 130 -8.180 6.510 -6.867
261 HB3 GLU 130 2HB GLU 130 -9.368 7.801 -6.973
262 HG2 GLU 130 1HG GLU 130 -9.024 7.397 -9.567
263 HG3 GLU 130 2HG GLU 130 -8.553 5.798 -8.996
264 H LYS 131 H LYS 131 -5.408 9.708 -7.170
265 HA LYS 131 HA LYS 131 -5.982 10.103 -4.389
266 HB2 LYS 131 1HB LYS 131 -3.680 10.014 -5.667
267 HB3 LYS 131 2HB LYS 131 -3.957 11.739 -5.862
268 HG2 LYS 131 1HG LYS 131 -4.396 11.606 -3.263
269 HG3 LYS 131 2HG LYS 131 -3.377 10.172 -3.410
270 HD2 LYS 131 1HD LYS 131 -1.762 11.747 -3.057
271 HD3 LYS 131 2HD LYS 131 -1.871 11.836 -4.817
272 HE2 LYS 131 1HE LYS 131 -3.516 13.598 -3.023
273 HE3 LYS 131 2HE LYS 131 -1.882 14.037 -3.519
274 HZ1 LYS 131 3HZ LYS 131 -2.705 13.682 -5.868
275 HZ2 LYS 131 1HZ LYS 131 -3.301 15.046 -5.062
276 HZ3 LYS 131 2HZ LYS 131 -4.270 13.670 -5.225
277 H SER 132 H SER 132 -5.713 12.329 -7.165
278 HA SER 132 HA SER 132 -7.269 14.304 -5.647
279 HB2 SER 132 1HB SER 132 -6.408 15.969 -7.188
280 HB3 SER 132 2HB SER 132 -5.062 15.015 -6.565
281 HG SER 132 HG SER 132 -4.631 14.470 -8.537
282 H GLY 133 H GLY 133 -9.170 15.149 -6.417
283 HA2 GLY 133 1HA GLY 133 -10.131 14.463 -9.061
284 HA3 GLY 133 2HA GLY 133 -10.985 13.666 -7.748
285 HA PRO 134 HA PRO 134 -13.528 17.163 -7.052
286 HB2 PRO 134 1HB PRO 134 -13.507 17.500 -4.358
287 HB3 PRO 134 2HB PRO 134 -14.328 16.150 -5.150
288 HG2 PRO 134 1HG PRO 134 -11.644 16.221 -3.826
289 HG3 PRO 134 2HG PRO 134 -12.908 14.982 -3.726
290 HD2 PRO 134 1HD PRO 134 -10.733 14.718 -5.317
291 HD3 PRO 134 2HD PRO 134 -12.315 14.035 -5.742
292 H SER 135 H SER 135 -10.244 17.369 -6.464
293 HA SER 135 HA SER 135 -10.048 19.919 -5.243
294 HB2 SER 135 1HB SER 135 -8.156 18.171 -6.784
295 HB3 SER 135 2HB SER 135 -7.695 19.825 -6.382
296 HG SER 135 HG SER 135 -7.720 17.645 -4.809
297 H SER 136 H SER 136 -10.928 21.675 -6.123
298 HA SER 136 HA SER 136 -10.720 22.058 -9.031
299 HB2 SER 136 1HB SER 136 -12.626 23.481 -8.909
300 HB3 SER 136 2HB SER 136 -13.004 22.081 -7.906
301 HG SER 136 HG SER 136 -13.343 23.481 -6.387
302 H GLY 137 H GLY 137 -10.110 24.113 -9.863
303 HA2 GLY 137 1HA GLY 137 -9.475 26.453 -8.866
304 HA3 GLY 137 2HA GLY 137 -8.210 25.494 -8.111
Start of MODEL 6
1 H1 GLY 93 H GLY 93 -0.710 -16.839 -13.561
2 HA2 GLY 93 1HA GLY 93 1.801 -16.753 -12.867
3 HA3 GLY 93 2HA GLY 93 1.382 -18.265 -12.077
4 H SER 94 H SER 94 1.248 -16.662 -15.247
5 HA SER 94 HA SER 94 1.417 -19.288 -16.538
6 HB2 SER 94 1HB SER 94 0.811 -16.553 -17.688
7 HB3 SER 94 2HB SER 94 0.869 -18.047 -18.623
8 HG SER 94 HG SER 94 -0.768 -17.970 -16.361
9 H SER 95 H SER 95 2.838 -16.051 -17.033
10 HA SER 95 HA SER 95 5.225 -17.325 -18.150
11 HB2 SER 95 1HB SER 95 4.032 -14.586 -18.330
12 HB3 SER 95 2HB SER 95 5.764 -14.782 -18.598
13 HG SER 95 HG SER 95 3.624 -15.951 -20.033
14 H GLY 96 H GLY 96 4.425 -14.715 -15.849
15 HA2 GLY 96 1HA GLY 96 5.435 -14.931 -13.595
16 HA3 GLY 96 2HA GLY 96 6.921 -15.386 -14.415
17 H SER 97 H SER 97 7.721 -13.594 -12.999
18 HA SER 97 HA SER 97 7.473 -11.037 -14.437
19 HB2 SER 97 1HB SER 97 7.448 -11.536 -11.465
20 HB3 SER 97 2HB SER 97 7.905 -9.969 -12.133
21 HG SER 97 HG SER 97 5.427 -11.315 -12.330
22 H SER 98 H SER 98 9.340 -9.660 -14.334
23 HA SER 98 HA SER 98 11.767 -11.048 -14.708
24 HB2 SER 98 1HB SER 98 11.266 -8.902 -15.814
25 HB3 SER 98 2HB SER 98 11.327 -8.085 -14.252
26 HG SER 98 HG SER 98 13.538 -8.902 -14.118
27 H GLY 99 H GLY 99 12.984 -11.939 -13.186
28 HA2 GLY 99 1HA GLY 99 14.481 -11.750 -11.351
29 HA3 GLY 99 2HA GLY 99 13.514 -10.419 -10.734
30 H THR 100 H THR 100 14.483 -12.963 -9.492
31 HA THR 100 HA THR 100 11.866 -13.865 -8.492
32 HB THR 100 HB THR 100 14.251 -15.639 -9.049
33 HG1 THR 100 1HG THR 100 12.526 -14.872 -10.731
34 HG21 THR 100 3HG2 THR 100 11.897 -17.109 -8.457
35 HG22 THR 100 1HG2 THR 100 12.131 -15.928 -7.168
36 HG23 THR 100 2HG2 THR 100 13.416 -17.070 -7.562
37 H GLY 101 H GLY 101 11.666 -13.573 -6.373
38 HA2 GLY 101 1HA GLY 101 13.476 -14.341 -4.416
39 HA3 GLY 101 2HA GLY 101 13.821 -12.654 -4.766
40 H GLN 102 H GLN 102 13.092 -11.632 -2.990
41 HA GLN 102 HA GLN 102 10.248 -11.481 -2.592
42 HB2 GLN 102 1HB GLN 102 11.279 -13.491 -1.218
43 HB3 GLN 102 2HB GLN 102 11.755 -12.204 -0.119
44 HG2 GLN 102 1HG GLN 102 9.231 -11.513 -0.365
45 HG3 GLN 102 2HG GLN 102 9.047 -13.209 -0.809
46 HE21 GLN 102 1HE2 GLN 102 7.808 -12.222 1.409
47 HE22 GLN 102 2HE2 GLN 102 8.542 -12.873 2.831
48 H LYS 103 H LYS 103 9.647 -9.549 -1.750
49 HA LYS 103 HA LYS 103 11.755 -7.836 -0.618
50 HB2 LYS 103 1HB LYS 103 9.797 -7.213 -2.810
51 HB3 LYS 103 2HB LYS 103 10.448 -5.929 -1.799
52 HG2 LYS 103 1HG LYS 103 11.893 -5.905 -3.582
53 HG3 LYS 103 2HG LYS 103 12.750 -6.949 -2.445
54 HD2 LYS 103 1HD LYS 103 11.693 -8.911 -3.606
55 HD3 LYS 103 2HD LYS 103 11.106 -7.783 -4.830
56 HE2 LYS 103 1HE LYS 103 13.140 -8.770 -5.623
57 HE3 LYS 103 2HE LYS 103 13.460 -7.083 -5.224
58 HZ1 LYS 103 3HZ LYS 103 14.596 -9.460 -4.109
59 HZ2 LYS 103 1HZ LYS 103 13.995 -8.424 -2.914
60 HZ3 LYS 103 2HZ LYS 103 15.143 -7.861 -4.022
61 HA PRO 104 HA PRO 104 8.947 -6.960 2.643
62 HB2 PRO 104 1HB PRO 104 9.673 -4.425 3.285
63 HB3 PRO 104 2HB PRO 104 10.672 -5.834 3.661
64 HG2 PRO 104 1HG PRO 104 10.914 -3.891 1.396
65 HG3 PRO 104 2HG PRO 104 12.187 -4.584 2.417
66 HD2 PRO 104 1HD PRO 104 11.652 -5.507 -0.072
67 HD3 PRO 104 2HD PRO 104 12.237 -6.560 1.232
68 H PHE 105 H PHE 105 8.904 -5.174 -0.273
69 HA PHE 105 HA PHE 105 6.141 -4.393 0.227
70 HB2 PHE 105 1HB PHE 105 8.125 -2.389 -0.856
71 HB3 PHE 105 2HB PHE 105 6.441 -2.107 -0.426
72 HD1 PHE 105 2HD PHE 105 5.761 -2.097 1.953
73 HD2 PHE 105 1HD PHE 105 9.843 -2.322 0.770
74 HE1 PHE 105 2HE PHE 105 6.450 -1.430 4.218
75 HE2 PHE 105 1HE PHE 105 10.540 -1.657 3.034
76 HZ PHE 105 HZ PHE 105 8.842 -1.209 4.762
77 H GLU 106 H GLU 106 5.163 -5.493 -1.351
78 HA GLU 106 HA GLU 106 6.234 -5.226 -4.083
79 HB2 GLU 106 1HB GLU 106 6.320 -7.548 -2.938
80 HB3 GLU 106 2HB GLU 106 4.581 -7.573 -3.195
81 HG2 GLU 106 1HG GLU 106 4.866 -7.417 -5.567
82 HG3 GLU 106 2HG GLU 106 6.603 -7.177 -5.386
83 H CYS 107 H CYS 107 4.830 -4.698 -5.695
84 HA CYS 107 HA CYS 107 2.263 -3.643 -4.875
85 HB2 CYS 107 1HB CYS 107 3.893 -2.517 -6.496
86 HB3 CYS 107 2HB CYS 107 3.354 -3.699 -7.684
87 H THR 108 H THR 108 1.402 -5.794 -4.327
88 HA THR 108 HA THR 108 1.022 -7.979 -5.840
89 HB THR 108 HB THR 108 0.006 -7.872 -3.672
90 HG1 THR 108 1HG THR 108 -1.048 -9.296 -5.076
91 HG21 THR 108 3HG2 THR 108 -0.800 -5.814 -3.168
92 HG22 THR 108 1HG2 THR 108 -2.318 -6.513 -3.728
93 HG23 THR 108 2HG2 THR 108 -1.355 -5.510 -4.813
94 H HIS 109 H HIS 109 -0.357 -4.841 -6.452
95 HA HIS 109 HA HIS 109 -2.439 -5.466 -8.173
96 HB2 HIS 109 1HB HIS 109 -0.538 -3.123 -8.134
97 HB3 HIS 109 2HB HIS 109 -1.900 -3.218 -9.247
98 HD2 HIS 109 2HD HIS 109 -1.199 -1.707 -5.945
99 HE1 HIS 109 1HE HIS 109 -5.338 -2.631 -5.835
100 HE2 HIS 109 2HE HIS 109 -3.477 -1.290 -4.793
101 H CYS 110 H CYS 110 0.984 -4.909 -8.971
102 HA CYS 110 HA CYS 110 0.522 -6.335 -11.509
103 HB2 CYS 110 1HB CYS 110 2.295 -4.942 -12.512
104 HB3 CYS 110 2HB CYS 110 0.936 -3.973 -11.952
105 H GLY 111 H GLY 111 2.844 -5.584 -8.943
106 HA2 GLY 111 1HA GLY 111 3.920 -7.690 -8.053
107 HA3 GLY 111 2HA GLY 111 4.363 -7.994 -9.726
108 H LYS 112 H LYS 112 4.458 -4.709 -9.039
109 HA LYS 112 HA LYS 112 7.282 -4.586 -9.343
110 HB2 LYS 112 1HB LYS 112 5.477 -2.837 -9.981
111 HB3 LYS 112 2HB LYS 112 5.608 -2.315 -8.306
112 HG2 LYS 112 1HG LYS 112 7.089 -0.903 -9.331
113 HG3 LYS 112 2HG LYS 112 8.162 -2.215 -8.838
114 HD2 LYS 112 1HD LYS 112 8.173 -3.134 -11.038
115 HD3 LYS 112 2HD LYS 112 6.879 -2.053 -11.560
116 HE2 LYS 112 1HE LYS 112 8.289 -0.178 -11.537
117 HE3 LYS 112 2HE LYS 112 9.510 -1.001 -10.568
118 HZ1 LYS 112 3HZ LYS 112 10.311 -0.914 -12.774
119 HZ2 LYS 112 1HZ LYS 112 8.850 -1.473 -13.418
120 HZ3 LYS 112 2HZ LYS 112 9.828 -2.515 -12.514
121 H SER 113 H SER 113 8.730 -5.018 -7.827
122 HA SER 113 HA SER 113 7.984 -4.870 -5.015
123 HB2 SER 113 1HB SER 113 10.027 -6.100 -4.582
124 HB3 SER 113 2HB SER 113 9.172 -6.873 -5.916
125 HG SER 113 HG SER 113 11.647 -5.980 -5.900
126 H PHE 114 H PHE 114 9.532 -3.925 -3.457
127 HA PHE 114 HA PHE 114 11.279 -1.842 -4.469
128 HB2 PHE 114 1HB PHE 114 8.878 -1.203 -2.743
129 HB3 PHE 114 2HB PHE 114 10.180 -0.076 -3.110
130 HD1 PHE 114 2HD PHE 114 7.435 -2.048 -4.603
131 HD2 PHE 114 1HD PHE 114 10.205 1.142 -5.119
132 HE1 PHE 114 2HE PHE 114 6.253 -1.357 -6.647
133 HE2 PHE 114 1HE PHE 114 9.027 1.839 -7.163
134 HZ PHE 114 HZ PHE 114 7.049 0.588 -7.931
135 H ARG 115 H ARG 115 12.170 -0.562 -2.462
136 HA ARG 115 HA ARG 115 13.101 -2.601 -0.591
137 HB2 ARG 115 1HB ARG 115 14.080 0.166 -1.279
138 HB3 ARG 115 2HB ARG 115 14.723 -0.750 0.077
139 HG2 ARG 115 1HG ARG 115 16.238 -1.272 -1.551
140 HG3 ARG 115 2HG ARG 115 15.090 -2.599 -1.740
141 HD2 ARG 115 1HD ARG 115 15.377 -1.905 -3.922
142 HD3 ARG 115 2HD ARG 115 13.939 -1.005 -3.441
143 HE ARG 115 HE ARG 115 16.410 0.414 -3.027
144 HH11 ARG 115 2HH1 ARG 115 13.852 -0.317 -5.272
145 HH12 ARG 115 1HH1 ARG 115 14.105 1.107 -6.226
146 HH21 ARG 115 2HH2 ARG 115 16.753 2.292 -4.274
147 HH22 ARG 115 1HH2 ARG 115 15.757 2.590 -5.658
148 H ALA 116 H ALA 116 11.613 0.617 -0.579
149 HA ALA 116 HA ALA 116 10.868 0.170 2.239
150 HB1 ALA 116 3HB ALA 116 10.675 2.759 2.225
151 HB2 ALA 116 1HB ALA 116 12.266 2.007 2.356
152 HB3 ALA 116 2HB ALA 116 11.720 2.653 0.808
153 H LYS 117 H LYS 117 8.823 1.145 2.910
154 HA LYS 117 HA LYS 117 6.683 0.399 1.293
155 HB2 LYS 117 1HB LYS 117 6.603 0.706 3.768
156 HB3 LYS 117 2HB LYS 117 6.625 2.447 3.517
157 HG2 LYS 117 1HG LYS 117 4.380 1.961 3.841
158 HG3 LYS 117 2HG LYS 117 4.531 2.070 2.086
159 HD2 LYS 117 1HD LYS 117 4.708 -0.381 1.968
160 HD3 LYS 117 2HD LYS 117 4.507 -0.468 3.720
161 HE2 LYS 117 1HE LYS 117 2.363 -0.872 2.938
162 HE3 LYS 117 2HE LYS 117 2.326 0.854 3.297
163 HZ1 LYS 117 3HZ LYS 117 1.363 0.694 1.208
164 HZ2 LYS 117 1HZ LYS 117 2.456 -0.479 0.667
165 HZ3 LYS 117 2HZ LYS 117 2.959 1.126 0.849
166 H GLY 118 H GLY 118 7.710 3.725 2.103
167 HA2 GLY 118 1HA GLY 118 6.016 5.191 0.568
168 HA3 GLY 118 2HA GLY 118 7.704 5.627 0.793
169 H ASN 119 H ASN 119 9.202 4.144 -0.652
170 HA ASN 119 HA ASN 119 9.097 4.929 -3.218
171 HB2 ASN 119 1HB ASN 119 10.168 2.429 -1.971
172 HB3 ASN 119 2HB ASN 119 10.200 2.584 -3.725
173 HD21 ASN 119 1HD2 ASN 119 11.232 4.088 -0.722
174 HD22 ASN 119 2HD2 ASN 119 12.604 4.902 -1.386
175 H LEU 120 H LEU 120 7.640 1.900 -2.042
176 HA LEU 120 HA LEU 120 6.486 1.182 -4.522
177 HB2 LEU 120 1HB LEU 120 6.747 -0.561 -2.998
178 HB3 LEU 120 2HB LEU 120 6.023 0.360 -1.681
179 HG LEU 120 HG LEU 120 3.818 0.091 -2.696
180 HD11 LEU 120 1HD1 LEU 120 5.013 -1.792 -4.695
181 HD12 LEU 120 2HD1 LEU 120 4.827 -0.075 -5.053
182 HD13 LEU 120 3HD1 LEU 120 3.410 -1.055 -4.677
183 HD21 LEU 120 3HD2 LEU 120 5.463 -2.355 -2.154
184 HD22 LEU 120 1HD2 LEU 120 3.748 -2.474 -2.547
185 HD23 LEU 120 2HD2 LEU 120 4.265 -1.569 -1.124
186 H VAL 121 H VAL 121 5.075 2.673 -1.612
187 HA VAL 121 HA VAL 121 2.468 2.948 -2.344
188 HB VAL 121 HB VAL 121 4.137 5.064 -0.977
189 HG11 VAL 121 1HG1 VAL 121 2.311 6.320 -0.885
190 HG12 VAL 121 2HG1 VAL 121 1.436 5.122 -1.842
191 HG13 VAL 121 3HG1 VAL 121 1.442 5.012 -0.081
192 HG21 VAL 121 3HG2 VAL 121 3.911 3.939 0.978
193 HG22 VAL 121 1HG2 VAL 121 2.339 3.272 0.538
194 HG23 VAL 121 2HG2 VAL 121 3.814 2.551 -0.106
195 H THR 122 H THR 122 5.121 5.132 -3.248
196 HA THR 122 HA THR 122 3.579 6.967 -4.708
197 HB THR 122 HB THR 122 6.493 6.230 -4.800
198 HG1 THR 122 1HG THR 122 5.516 8.802 -4.293
199 HG21 THR 122 3HG2 THR 122 5.054 8.228 -6.545
200 HG22 THR 122 1HG2 THR 122 5.997 6.834 -7.071
201 HG23 THR 122 2HG2 THR 122 6.801 8.203 -6.304
202 H HIS 123 H HIS 123 5.009 3.890 -5.593
203 HA HIS 123 HA HIS 123 4.648 4.158 -8.400
204 HB2 HIS 123 1HB HIS 123 6.207 2.527 -7.866
205 HB3 HIS 123 2HB HIS 123 5.237 1.885 -6.544
206 HD1 HIS 123 1HD HIS 123 5.659 1.691 -10.258
207 HD2 HIS 123 2HD HIS 123 3.383 -0.074 -7.264
208 HE1 HIS 123 1HE HIS 123 4.551 -0.293 -11.336
209 H GLN 124 H GLN 124 2.770 2.529 -5.860
210 HA GLN 124 HA GLN 124 0.785 1.388 -7.391
211 HB2 GLN 124 1HB GLN 124 0.089 2.736 -4.806
212 HB3 GLN 124 2HB GLN 124 -0.476 1.196 -5.440
213 HG2 GLN 124 1HG GLN 124 2.066 0.551 -5.183
214 HG3 GLN 124 2HG GLN 124 2.031 1.852 -3.993
215 HE21 GLN 124 1HE2 GLN 124 1.867 1.034 -2.040
216 HE22 GLN 124 2HE2 GLN 124 0.842 -0.272 -1.562
217 H ARG 125 H ARG 125 1.203 4.740 -6.481
218 HA ARG 125 HA ARG 125 -1.309 5.776 -6.971
219 HB2 ARG 125 1HB ARG 125 1.340 7.056 -7.673
220 HB3 ARG 125 2HB ARG 125 -0.190 7.898 -7.465
221 HG2 ARG 125 1HG ARG 125 -0.243 7.276 -5.121
222 HG3 ARG 125 2HG ARG 125 1.254 6.362 -5.316
223 HD2 ARG 125 1HD ARG 125 1.959 8.391 -4.414
224 HD3 ARG 125 2HD ARG 125 2.259 8.575 -6.142
225 HE ARG 125 HE ARG 125 -0.297 9.564 -5.217
226 HH11 ARG 125 2HH1 ARG 125 3.034 10.295 -5.916
227 HH12 ARG 125 1HH1 ARG 125 2.757 11.995 -6.105
228 HH21 ARG 125 2HH2 ARG 125 -0.674 11.800 -5.463
229 HH22 ARG 125 1HH2 ARG 125 0.648 12.850 -5.846
230 H ILE 126 H ILE 126 1.004 4.519 -9.213
231 HA ILE 126 HA ILE 126 0.044 5.790 -11.558
232 HB ILE 126 HB ILE 126 1.411 4.343 -12.785
233 HG12 ILE 126 1HG1 ILE 126 1.172 2.414 -10.469
234 HG13 ILE 126 2HG1 ILE 126 0.518 2.214 -12.091
235 HG21 ILE 126 1HG2 ILE 126 3.271 3.913 -10.726
236 HG22 ILE 126 2HG2 ILE 126 3.204 5.263 -11.858
237 HG23 ILE 126 3HG2 ILE 126 2.388 5.379 -10.299
238 HD11 ILE 126 3HD1 ILE 126 3.028 2.403 -12.794
239 HD12 ILE 126 1HD1 ILE 126 3.311 1.920 -11.122
240 HD13 ILE 126 2HD1 ILE 126 2.369 0.882 -12.192
241 H HIS 127 H HIS 127 -0.895 2.906 -9.811
242 HA HIS 127 HA HIS 127 -2.577 1.866 -11.882
243 HB2 HIS 127 1HB HIS 127 -2.331 1.241 -8.938
244 HB3 HIS 127 2HB HIS 127 -3.456 0.406 -10.005
245 HD1 HIS 127 1HD HIS 127 -2.336 -1.001 -11.982
246 HD2 HIS 127 2HD HIS 127 0.238 0.295 -8.989
247 HE1 HIS 127 1HE HIS 127 -0.251 -2.384 -12.242
248 H THR 128 H THR 128 -3.234 3.461 -8.763
249 HA THR 128 HA THR 128 -5.894 3.585 -8.615
250 HB THR 128 HB THR 128 -5.763 5.831 -7.649
251 HG1 THR 128 1HG THR 128 -4.075 6.441 -9.343
252 HG21 THR 128 3HG2 THR 128 -4.496 5.251 -5.810
253 HG22 THR 128 1HG2 THR 128 -3.220 4.521 -6.784
254 HG23 THR 128 2HG2 THR 128 -4.749 3.673 -6.556
255 H GLY 129 H GLY 129 -7.625 4.672 -9.514
256 HA2 GLY 129 1HA GLY 129 -7.113 6.444 -11.791
257 HA3 GLY 129 2HA GLY 129 -8.056 4.990 -12.079
258 H GLU 130 H GLU 130 -7.949 7.834 -9.942
259 HA GLU 130 HA GLU 130 -10.894 7.788 -9.895
260 HB2 GLU 130 1HB GLU 130 -10.786 8.998 -7.797
261 HB3 GLU 130 2HB GLU 130 -9.818 7.534 -7.688
262 HG2 GLU 130 1HG GLU 130 -7.849 8.671 -7.566
263 HG3 GLU 130 2HG GLU 130 -8.457 10.046 -8.486
264 H LYS 131 H LYS 131 -9.741 8.845 -12.131
265 HA LYS 131 HA LYS 131 -9.425 11.699 -11.859
266 HB2 LYS 131 1HB LYS 131 -9.449 9.800 -14.192
267 HB3 LYS 131 2HB LYS 131 -9.460 11.542 -14.437
268 HG2 LYS 131 1HG LYS 131 -7.387 11.572 -12.931
269 HG3 LYS 131 2HG LYS 131 -7.324 9.832 -13.220
270 HD2 LYS 131 1HD LYS 131 -5.938 10.729 -14.874
271 HD3 LYS 131 2HD LYS 131 -7.466 10.443 -15.711
272 HE2 LYS 131 1HE LYS 131 -8.056 12.762 -15.548
273 HE3 LYS 131 2HE LYS 131 -6.667 13.091 -14.514
274 HZ1 LYS 131 3HZ LYS 131 -5.193 12.791 -16.290
275 HZ2 LYS 131 1HZ LYS 131 -6.455 13.712 -16.939
276 HZ3 LYS 131 2HZ LYS 131 -6.362 12.056 -17.269
277 H SER 132 H SER 132 -11.819 11.139 -10.779
278 HA SER 132 HA SER 132 -13.891 11.541 -12.785
279 HB2 SER 132 1HB SER 132 -15.467 11.139 -11.037
280 HB3 SER 132 2HB SER 132 -14.162 9.977 -10.805
281 HG SER 132 HG SER 132 -13.750 10.857 -8.947
282 H GLY 133 H GLY 133 -15.337 13.318 -12.762
283 HA2 GLY 133 1HA GLY 133 -15.995 15.437 -11.695
284 HA3 GLY 133 2HA GLY 133 -14.289 15.701 -11.362
285 HA PRO 134 HA PRO 134 -15.665 17.683 -15.441
286 HB2 PRO 134 1HB PRO 134 -15.485 20.275 -14.654
287 HB3 PRO 134 2HB PRO 134 -16.971 19.328 -14.511
288 HG2 PRO 134 1HG PRO 134 -14.919 19.960 -12.424
289 HG3 PRO 134 2HG PRO 134 -16.687 19.975 -12.295
290 HD2 PRO 134 1HD PRO 134 -15.178 17.923 -11.379
291 HD3 PRO 134 2HD PRO 134 -16.813 17.690 -12.028
292 H SER 135 H SER 135 -13.873 17.387 -16.632
293 HA SER 135 HA SER 135 -11.270 18.197 -15.713
294 HB2 SER 135 1HB SER 135 -12.168 17.107 -18.392
295 HB3 SER 135 2HB SER 135 -10.490 17.331 -17.898
296 HG SER 135 HG SER 135 -10.639 15.439 -17.022
297 H SER 136 H SER 136 -10.396 20.135 -15.955
298 HA SER 136 HA SER 136 -10.948 21.723 -18.325
299 HB2 SER 136 1HB SER 136 -12.635 22.238 -16.376
300 HB3 SER 136 2HB SER 136 -11.271 23.124 -15.695
301 HG SER 136 HG SER 136 -11.813 24.661 -17.005
302 H GLY 137 H GLY 137 -9.053 22.425 -19.036
303 HA2 GLY 137 1HA GLY 137 -7.228 24.052 -18.163
304 HA3 GLY 137 2HA GLY 137 -6.838 22.690 -17.123
Start of MODEL 7
1 H1 GLY 93 H GLY 93 4.155 -5.812 -23.047
2 HA2 GLY 93 1HA GLY 93 2.085 -6.602 -21.531
3 HA3 GLY 93 2HA GLY 93 2.372 -8.037 -22.504
4 H SER 94 H SER 94 3.904 -9.436 -21.876
5 HA SER 94 HA SER 94 5.377 -8.801 -19.441
6 HB2 SER 94 1HB SER 94 4.023 -10.969 -19.844
7 HB3 SER 94 2HB SER 94 5.396 -11.471 -20.831
8 HG SER 94 HG SER 94 6.129 -12.126 -18.961
9 H SER 95 H SER 95 7.629 -9.144 -19.230
10 HA SER 95 HA SER 95 9.084 -8.766 -21.752
11 HB2 SER 95 1HB SER 95 9.282 -7.025 -19.943
12 HB3 SER 95 2HB SER 95 10.084 -8.239 -18.946
13 HG SER 95 HG SER 95 11.836 -7.700 -19.953
14 H GLY 96 H GLY 96 9.447 -10.431 -18.617
15 HA2 GLY 96 1HA GLY 96 9.972 -12.765 -18.485
16 HA3 GLY 96 2HA GLY 96 10.758 -12.640 -20.052
17 H SER 97 H SER 97 11.101 -12.259 -16.631
18 HA SER 97 HA SER 97 13.924 -12.513 -16.760
19 HB2 SER 97 1HB SER 97 14.541 -10.322 -15.815
20 HB3 SER 97 2HB SER 97 13.802 -10.149 -17.406
21 HG SER 97 HG SER 97 11.878 -9.544 -16.401
22 H SER 98 H SER 98 14.874 -12.827 -14.712
23 HA SER 98 HA SER 98 12.940 -13.059 -12.499
24 HB2 SER 98 1HB SER 98 13.484 -15.283 -13.183
25 HB3 SER 98 2HB SER 98 15.203 -14.903 -13.280
26 HG SER 98 HG SER 98 13.917 -14.536 -10.829
27 H GLY 99 H GLY 99 13.366 -11.667 -10.926
28 HA2 GLY 99 1HA GLY 99 16.160 -10.811 -10.527
29 HA3 GLY 99 2HA GLY 99 14.746 -9.860 -10.098
30 H THR 100 H THR 100 15.332 -9.575 -7.961
31 HA THR 100 HA THR 100 16.324 -11.396 -6.171
32 HB THR 100 HB THR 100 15.047 -10.100 -4.395
33 HG1 THR 100 1HG THR 100 13.936 -9.054 -6.732
34 HG21 THR 100 3HG2 THR 100 16.365 -8.057 -6.067
35 HG22 THR 100 1HG2 THR 100 17.320 -9.500 -5.726
36 HG23 THR 100 2HG2 THR 100 16.679 -8.532 -4.398
37 H GLY 101 H GLY 101 14.976 -12.178 -4.163
38 HA2 GLY 101 1HA GLY 101 13.041 -14.063 -5.228
39 HA3 GLY 101 2HA GLY 101 13.707 -14.055 -3.602
40 H GLN 102 H GLN 102 13.031 -11.920 -2.374
41 HA GLN 102 HA GLN 102 10.273 -11.184 -2.966
42 HB2 GLN 102 1HB GLN 102 10.544 -13.263 -1.346
43 HB3 GLN 102 2HB GLN 102 10.851 -12.004 -0.157
44 HG2 GLN 102 1HG GLN 102 8.654 -10.970 -1.106
45 HG3 GLN 102 2HG GLN 102 8.360 -12.615 -1.670
46 HE21 GLN 102 1HE2 GLN 102 6.621 -12.931 -0.312
47 HE22 GLN 102 2HE2 GLN 102 6.793 -13.117 1.397
48 H LYS 103 H LYS 103 9.542 -9.318 -1.800
49 HA LYS 103 HA LYS 103 11.685 -7.776 -0.503
50 HB2 LYS 103 1HB LYS 103 9.777 -6.836 -2.644
51 HB3 LYS 103 2HB LYS 103 10.698 -5.734 -1.630
52 HG2 LYS 103 1HG LYS 103 12.721 -7.201 -2.486
53 HG3 LYS 103 2HG LYS 103 11.610 -7.513 -3.822
54 HD2 LYS 103 1HD LYS 103 12.638 -5.633 -4.614
55 HD3 LYS 103 2HD LYS 103 11.317 -4.884 -3.714
56 HE2 LYS 103 1HE LYS 103 13.218 -3.688 -3.060
57 HE3 LYS 103 2HE LYS 103 12.939 -4.822 -1.740
58 HZ1 LYS 103 3HZ LYS 103 15.246 -4.513 -3.268
59 HZ2 LYS 103 1HZ LYS 103 14.605 -6.030 -3.655
60 HZ3 LYS 103 2HZ LYS 103 14.955 -5.646 -2.046
61 HA PRO 104 HA PRO 104 8.788 -6.885 2.673
62 HB2 PRO 104 1HB PRO 104 9.569 -4.396 3.425
63 HB3 PRO 104 2HB PRO 104 10.507 -5.849 3.791
64 HG2 PRO 104 1HG PRO 104 10.896 -3.843 1.602
65 HG3 PRO 104 2HG PRO 104 12.108 -4.609 2.646
66 HD2 PRO 104 1HD PRO 104 11.638 -5.434 0.110
67 HD3 PRO 104 2HD PRO 104 12.140 -6.547 1.398
68 H PHE 105 H PHE 105 8.853 -5.106 -0.217
69 HA PHE 105 HA PHE 105 6.127 -4.191 0.246
70 HB2 PHE 105 1HB PHE 105 8.185 -2.265 -0.833
71 HB3 PHE 105 2HB PHE 105 6.524 -1.921 -0.360
72 HD1 PHE 105 2HD PHE 105 5.904 -1.888 2.030
73 HD2 PHE 105 1HD PHE 105 9.944 -2.302 0.756
74 HE1 PHE 105 2HE PHE 105 6.674 -1.271 4.284
75 HE2 PHE 105 1HE PHE 105 10.721 -1.687 3.008
76 HZ PHE 105 HZ PHE 105 9.085 -1.170 4.775
77 H GLU 106 H GLU 106 5.155 -5.295 -1.340
78 HA GLU 106 HA GLU 106 6.262 -5.045 -4.060
79 HB2 GLU 106 1HB GLU 106 6.315 -7.365 -2.979
80 HB3 GLU 106 2HB GLU 106 4.563 -7.350 -3.126
81 HG2 GLU 106 1HG GLU 106 4.631 -7.390 -5.449
82 HG3 GLU 106 2HG GLU 106 6.308 -6.851 -5.503
83 H CYS 107 H CYS 107 4.775 -4.834 -5.778
84 HA CYS 107 HA CYS 107 2.266 -3.577 -4.967
85 HB2 CYS 107 1HB CYS 107 3.858 -2.442 -6.556
86 HB3 CYS 107 2HB CYS 107 3.481 -3.698 -7.731
87 H THR 108 H THR 108 1.407 -5.738 -4.385
88 HA THR 108 HA THR 108 0.988 -7.936 -5.838
89 HB THR 108 HB THR 108 -0.080 -7.717 -3.695
90 HG1 THR 108 1HG THR 108 -1.071 -9.145 -5.252
91 HG21 THR 108 3HG2 THR 108 -0.769 -5.230 -4.361
92 HG22 THR 108 1HG2 THR 108 -1.611 -6.133 -3.102
93 HG23 THR 108 2HG2 THR 108 -2.297 -6.032 -4.724
94 H HIS 109 H HIS 109 -0.575 -4.836 -6.439
95 HA HIS 109 HA HIS 109 -2.529 -5.473 -8.234
96 HB2 HIS 109 1HB HIS 109 -0.697 -3.138 -7.958
97 HB3 HIS 109 2HB HIS 109 -1.673 -3.251 -9.419
98 HD2 HIS 109 2HD HIS 109 -2.136 -1.047 -6.853
99 HE1 HIS 109 1HE HIS 109 -5.835 -3.108 -6.597
100 HE2 HIS 109 2HE HIS 109 -4.588 -0.995 -6.031
101 H CYS 110 H CYS 110 0.864 -4.784 -9.098
102 HA CYS 110 HA CYS 110 0.443 -6.335 -11.569
103 HB2 CYS 110 1HB CYS 110 2.239 -4.971 -12.576
104 HB3 CYS 110 2HB CYS 110 0.873 -3.988 -12.059
105 H GLY 111 H GLY 111 2.803 -5.496 -9.053
106 HA2 GLY 111 1HA GLY 111 3.833 -7.624 -8.100
107 HA3 GLY 111 2HA GLY 111 4.310 -7.931 -9.763
108 H LYS 112 H LYS 112 4.387 -4.646 -9.133
109 HA LYS 112 HA LYS 112 7.194 -4.482 -9.404
110 HB2 LYS 112 1HB LYS 112 5.352 -2.732 -9.952
111 HB3 LYS 112 2HB LYS 112 5.526 -2.259 -8.267
112 HG2 LYS 112 1HG LYS 112 6.938 -0.804 -9.385
113 HG3 LYS 112 2HG LYS 112 8.033 -2.058 -8.799
114 HD2 LYS 112 1HD LYS 112 8.151 -3.073 -10.947
115 HD3 LYS 112 2HD LYS 112 6.823 -2.083 -11.557
116 HE2 LYS 112 1HE LYS 112 8.165 -0.112 -11.485
117 HE3 LYS 112 2HE LYS 112 9.447 -0.947 -10.609
118 HZ1 LYS 112 3HZ LYS 112 9.059 -2.398 -12.915
119 HZ2 LYS 112 1HZ LYS 112 10.355 -1.365 -12.571
120 HZ3 LYS 112 2HZ LYS 112 9.007 -0.781 -13.408
121 H SER 113 H SER 113 8.697 -4.862 -7.928
122 HA SER 113 HA SER 113 7.972 -4.812 -5.096
123 HB2 SER 113 1HB SER 113 10.039 -6.054 -4.726
124 HB3 SER 113 2HB SER 113 9.099 -6.825 -6.003
125 HG SER 113 HG SER 113 10.962 -4.906 -6.775
126 H PHE 114 H PHE 114 9.501 -3.885 -3.540
127 HA PHE 114 HA PHE 114 11.305 -1.839 -4.533
128 HB2 PHE 114 1HB PHE 114 8.913 -1.148 -2.813
129 HB3 PHE 114 2HB PHE 114 10.236 -0.050 -3.192
130 HD1 PHE 114 2HD PHE 114 7.396 -1.920 -4.614
131 HD2 PHE 114 1HD PHE 114 10.329 1.097 -5.258
132 HE1 PHE 114 2HE PHE 114 6.222 -1.218 -6.659
133 HE2 PHE 114 1HE PHE 114 9.158 1.804 -7.303
134 HZ PHE 114 HZ PHE 114 7.102 0.645 -8.007
135 H ARG 115 H ARG 115 12.354 -0.667 -2.620
136 HA ARG 115 HA ARG 115 13.170 -2.704 -0.714
137 HB2 ARG 115 1HB ARG 115 14.221 0.065 -1.308
138 HB3 ARG 115 2HB ARG 115 14.882 -0.982 -0.059
139 HG2 ARG 115 1HG ARG 115 15.106 -2.687 -2.033
140 HG3 ARG 115 2HG ARG 115 15.044 -1.225 -3.020
141 HD2 ARG 115 1HD ARG 115 16.926 -1.538 -0.696
142 HD3 ARG 115 2HD ARG 115 17.347 -2.042 -2.332
143 HE ARG 115 HE ARG 115 16.589 0.497 -2.717
144 HH11 ARG 115 2HH1 ARG 115 18.728 -0.952 -0.383
145 HH12 ARG 115 1HH1 ARG 115 19.732 0.453 -0.238
146 HH21 ARG 115 2HH2 ARG 115 17.904 2.352 -2.535
147 HH22 ARG 115 1HH2 ARG 115 19.262 2.331 -1.461
148 H ALA 116 H ALA 116 11.790 0.563 -0.684
149 HA ALA 116 HA ALA 116 11.039 0.130 2.135
150 HB1 ALA 116 3HB ALA 116 11.542 2.763 0.753
151 HB2 ALA 116 1HB ALA 116 11.108 2.538 2.448
152 HB3 ALA 116 2HB ALA 116 12.659 1.950 1.849
153 H LYS 117 H LYS 117 9.004 1.046 2.820
154 HA LYS 117 HA LYS 117 6.848 0.376 1.215
155 HB2 LYS 117 1HB LYS 117 6.923 0.799 3.745
156 HB3 LYS 117 2HB LYS 117 6.694 2.497 3.348
157 HG2 LYS 117 1HG LYS 117 4.536 2.195 2.674
158 HG3 LYS 117 2HG LYS 117 4.806 0.521 2.185
159 HD2 LYS 117 1HD LYS 117 4.841 -0.198 4.482
160 HD3 LYS 117 2HD LYS 117 4.763 1.472 5.048
161 HE2 LYS 117 1HE LYS 117 2.564 1.526 3.625
162 HE3 LYS 117 2HE LYS 117 2.635 -0.224 3.821
163 HZ1 LYS 117 3HZ LYS 117 1.941 -0.056 5.908
164 HZ2 LYS 117 1HZ LYS 117 1.601 1.574 5.608
165 HZ3 LYS 117 2HZ LYS 117 3.086 1.131 6.287
166 H GLY 118 H GLY 118 7.685 3.725 2.136
167 HA2 GLY 118 1HA GLY 118 6.086 5.187 0.566
168 HA3 GLY 118 2HA GLY 118 7.775 5.619 0.790
169 H ASN 119 H ASN 119 9.158 3.832 -0.635
170 HA ASN 119 HA ASN 119 9.102 4.729 -3.217
171 HB2 ASN 119 1HB ASN 119 10.161 2.253 -1.933
172 HB3 ASN 119 2HB ASN 119 10.140 2.327 -3.693
173 HD21 ASN 119 1HD2 ASN 119 11.632 3.514 -4.732
174 HD22 ASN 119 2HD2 ASN 119 12.860 4.443 -3.949
175 H LEU 120 H LEU 120 7.520 1.802 -1.966
176 HA LEU 120 HA LEU 120 6.352 1.098 -4.469
177 HB2 LEU 120 1HB LEU 120 6.644 -0.680 -2.991
178 HB3 LEU 120 2HB LEU 120 5.958 0.214 -1.636
179 HG LEU 120 HG LEU 120 3.725 -0.009 -2.632
180 HD11 LEU 120 1HD1 LEU 120 3.289 -1.170 -4.600
181 HD12 LEU 120 2HD1 LEU 120 4.886 -1.915 -4.631
182 HD13 LEU 120 3HD1 LEU 120 4.707 -0.200 -4.998
183 HD21 LEU 120 3HD2 LEU 120 4.658 -1.701 -1.046
184 HD22 LEU 120 1HD2 LEU 120 5.098 -2.685 -2.443
185 HD23 LEU 120 2HD2 LEU 120 3.403 -2.320 -2.120
186 H VAL 121 H VAL 121 5.072 2.600 -1.510
187 HA VAL 121 HA VAL 121 2.430 2.885 -2.166
188 HB VAL 121 HB VAL 121 4.157 4.934 -0.771
189 HG11 VAL 121 1HG1 VAL 121 1.768 5.303 0.329
190 HG12 VAL 121 2HG1 VAL 121 2.276 6.169 -1.123
191 HG13 VAL 121 3HG1 VAL 121 1.237 4.750 -1.259
192 HG21 VAL 121 3HG2 VAL 121 2.462 3.455 0.976
193 HG22 VAL 121 1HG2 VAL 121 3.378 2.321 -0.017
194 HG23 VAL 121 2HG2 VAL 121 4.224 3.530 0.948
195 H THR 122 H THR 122 5.108 4.999 -3.130
196 HA THR 122 HA THR 122 3.522 6.893 -4.507
197 HB THR 122 HB THR 122 6.448 6.208 -4.601
198 HG1 THR 122 1HG THR 122 6.454 7.719 -3.131
199 HG21 THR 122 3HG2 THR 122 5.938 6.850 -6.863
200 HG22 THR 122 1HG2 THR 122 6.738 8.205 -6.067
201 HG23 THR 122 2HG2 THR 122 4.990 8.228 -6.306
202 H HIS 123 H HIS 123 4.956 3.839 -5.436
203 HA HIS 123 HA HIS 123 4.642 4.161 -8.244
204 HB2 HIS 123 1HB HIS 123 6.192 2.517 -7.674
205 HB3 HIS 123 2HB HIS 123 5.153 1.828 -6.430
206 HD1 HIS 123 1HD HIS 123 5.732 1.807 -10.133
207 HD2 HIS 123 2HD HIS 123 3.356 -0.108 -7.313
208 HE1 HIS 123 1HE HIS 123 4.677 -0.128 -11.345
209 H GLN 124 H GLN 124 2.709 2.517 -5.757
210 HA GLN 124 HA GLN 124 0.742 1.413 -7.342
211 HB2 GLN 124 1HB GLN 124 0.014 2.715 -4.742
212 HB3 GLN 124 2HB GLN 124 -0.548 1.190 -5.414
213 HG2 GLN 124 1HG GLN 124 1.966 0.502 -5.127
214 HG3 GLN 124 2HG GLN 124 1.960 1.807 -3.942
215 HE21 GLN 124 1HE2 GLN 124 1.923 0.859 -2.025
216 HE22 GLN 124 2HE2 GLN 124 0.814 -0.368 -1.528
217 H ARG 125 H ARG 125 1.193 4.744 -6.396
218 HA ARG 125 HA ARG 125 -1.313 5.808 -6.894
219 HB2 ARG 125 1HB ARG 125 1.370 7.067 -7.497
220 HB3 ARG 125 2HB ARG 125 -0.155 7.930 -7.351
221 HG2 ARG 125 1HG ARG 125 -0.318 7.219 -5.007
222 HG3 ARG 125 2HG ARG 125 1.238 6.401 -5.163
223 HD2 ARG 125 1HD ARG 125 2.411 8.391 -5.337
224 HD3 ARG 125 2HD ARG 125 0.992 9.299 -5.855
225 HE ARG 125 HE ARG 125 1.795 8.716 -3.141
226 HH11 ARG 125 2HH1 ARG 125 -0.780 9.712 -5.261
227 HH12 ARG 125 1HH1 ARG 125 -1.688 10.489 -4.007
228 HH21 ARG 125 2HH2 ARG 125 0.608 9.735 -1.481
229 HH22 ARG 125 1HH2 ARG 125 -0.897 10.502 -1.857
230 H ILE 126 H ILE 126 0.973 4.498 -9.105
231 HA ILE 126 HA ILE 126 0.042 5.845 -11.447
232 HB ILE 126 HB ILE 126 1.482 4.488 -12.680
233 HG12 ILE 126 1HG1 ILE 126 1.253 2.469 -10.441
234 HG13 ILE 126 2HG1 ILE 126 0.627 2.313 -12.078
235 HG21 ILE 126 1HG2 ILE 126 2.380 5.478 -10.155
236 HG22 ILE 126 2HG2 ILE 126 3.295 4.030 -10.573
237 HG23 ILE 126 3HG2 ILE 126 3.248 5.395 -11.688
238 HD11 ILE 126 3HD1 ILE 126 3.416 2.059 -11.081
239 HD12 ILE 126 1HD1 ILE 126 2.513 1.028 -12.190
240 HD13 ILE 126 2HD1 ILE 126 3.137 2.583 -12.742
241 H HIS 127 H HIS 127 -0.908 2.992 -9.699
242 HA HIS 127 HA HIS 127 -2.505 1.905 -11.832
243 HB2 HIS 127 1HB HIS 127 -2.223 1.228 -8.906
244 HB3 HIS 127 2HB HIS 127 -3.373 0.407 -9.958
245 HD1 HIS 127 1HD HIS 127 -2.297 -0.958 -11.991
246 HD2 HIS 127 2HD HIS 127 0.344 0.289 -9.036
247 HE1 HIS 127 1HE HIS 127 -0.216 -2.329 -12.327
248 H THR 128 H THR 128 -3.218 3.452 -8.704
249 HA THR 128 HA THR 128 -5.885 3.491 -8.567
250 HB THR 128 HB THR 128 -5.822 5.721 -7.563
251 HG1 THR 128 1HG THR 128 -4.446 6.860 -8.873
252 HG21 THR 128 3HG2 THR 128 -3.238 4.542 -6.677
253 HG22 THR 128 1HG2 THR 128 -4.690 3.552 -6.542
254 HG23 THR 128 2HG2 THR 128 -4.606 5.111 -5.721
255 H GLY 129 H GLY 129 -7.393 3.724 -10.082
256 HA2 GLY 129 1HA GLY 129 -6.922 5.369 -12.418
257 HA3 GLY 129 2HA GLY 129 -8.333 4.367 -12.112
258 H GLU 130 H GLU 130 -6.853 7.090 -10.351
259 HA GLU 130 HA GLU 130 -9.407 8.202 -9.721
260 HB2 GLU 130 1HB GLU 130 -6.625 9.352 -9.446
261 HB3 GLU 130 2HB GLU 130 -8.081 10.088 -8.790
262 HG2 GLU 130 1HG GLU 130 -8.385 7.800 -7.601
263 HG3 GLU 130 2HG GLU 130 -6.664 7.609 -7.932
264 H LYS 131 H LYS 131 -6.694 9.479 -11.657
265 HA LYS 131 HA LYS 131 -8.437 11.422 -12.908
266 HB2 LYS 131 1HB LYS 131 -5.516 10.792 -13.376
267 HB3 LYS 131 2HB LYS 131 -6.387 12.142 -14.090
268 HG2 LYS 131 1HG LYS 131 -6.512 13.293 -12.097
269 HG3 LYS 131 2HG LYS 131 -6.310 11.834 -11.123
270 HD2 LYS 131 1HD LYS 131 -4.002 11.743 -11.539
271 HD3 LYS 131 2HD LYS 131 -4.118 12.857 -12.904
272 HE2 LYS 131 1HE LYS 131 -4.417 14.712 -11.509
273 HE3 LYS 131 2HE LYS 131 -4.843 13.712 -10.121
274 HZ1 LYS 131 3HZ LYS 131 -2.154 13.620 -11.352
275 HZ2 LYS 131 1HZ LYS 131 -2.628 13.067 -9.825
276 HZ3 LYS 131 2HZ LYS 131 -2.544 14.728 -10.134
277 H SER 132 H SER 132 -9.228 8.782 -13.424
278 HA SER 132 HA SER 132 -8.266 7.878 -15.951
279 HB2 SER 132 1HB SER 132 -10.237 6.356 -15.880
280 HB3 SER 132 2HB SER 132 -9.275 6.300 -14.404
281 HG SER 132 HG SER 132 -10.958 8.111 -13.851
282 H GLY 133 H GLY 133 -9.694 7.642 -17.876
283 HA2 GLY 133 1HA GLY 133 -11.052 10.199 -18.368
284 HA3 GLY 133 2HA GLY 133 -10.428 9.113 -19.601
285 HA PRO 134 HA PRO 134 -15.056 8.390 -18.455
286 HB2 PRO 134 1HB PRO 134 -16.304 10.170 -20.081
287 HB3 PRO 134 2HB PRO 134 -15.867 10.540 -18.409
288 HG2 PRO 134 1HG PRO 134 -14.449 11.268 -20.943
289 HG3 PRO 134 2HG PRO 134 -14.758 12.263 -19.508
290 HD2 PRO 134 1HD PRO 134 -12.366 11.083 -19.974
291 HD3 PRO 134 2HD PRO 134 -12.999 11.344 -18.336
292 H SER 135 H SER 135 -16.559 7.329 -19.848
293 HA SER 135 HA SER 135 -15.325 6.032 -22.070
294 HB2 SER 135 1HB SER 135 -16.873 4.776 -20.717
295 HB3 SER 135 2HB SER 135 -18.156 5.952 -21.005
296 HG SER 135 HG SER 135 -18.362 4.106 -22.344
297 H SER 136 H SER 136 -17.921 8.420 -21.728
298 HA SER 136 HA SER 136 -19.133 9.549 -23.336
299 HB2 SER 136 1HB SER 136 -17.624 10.985 -24.729
300 HB3 SER 136 2HB SER 136 -17.231 11.001 -23.010
301 HG SER 136 HG SER 136 -15.915 9.563 -25.069
302 H GLY 137 H GLY 137 -19.126 6.868 -24.012
303 HA2 GLY 137 1HA GLY 137 -18.594 6.858 -26.912
304 HA3 GLY 137 2HA GLY 137 -18.742 5.423 -25.907
Start of MODEL 8
1 H1 GLY 93 H GLY 93 12.324 -15.242 -24.692
2 HA2 GLY 93 1HA GLY 93 11.360 -12.756 -25.946
3 HA3 GLY 93 2HA GLY 93 10.282 -13.701 -24.929
4 H SER 94 H SER 94 10.132 -11.685 -23.697
5 HA SER 94 HA SER 94 12.416 -11.365 -21.861
6 HB2 SER 94 1HB SER 94 10.538 -9.339 -23.042
7 HB3 SER 94 2HB SER 94 11.333 -9.020 -21.501
8 HG SER 94 HG SER 94 13.243 -8.922 -22.480
9 H SER 95 H SER 95 11.973 -11.058 -19.658
10 HA SER 95 HA SER 95 9.316 -12.018 -18.841
11 HB2 SER 95 1HB SER 95 10.476 -12.639 -16.693
12 HB3 SER 95 2HB SER 95 11.051 -13.514 -18.112
13 HG SER 95 HG SER 95 12.348 -11.138 -17.437
14 H GLY 96 H GLY 96 11.183 -9.255 -18.985
15 HA2 GLY 96 1HA GLY 96 10.598 -7.119 -18.273
16 HA3 GLY 96 2HA GLY 96 9.333 -7.827 -17.279
17 H SER 97 H SER 97 10.267 -6.053 -15.850
18 HA SER 97 HA SER 97 12.796 -6.552 -14.602
19 HB2 SER 97 1HB SER 97 11.819 -4.278 -14.782
20 HB3 SER 97 2HB SER 97 10.531 -4.765 -13.680
21 HG SER 97 HG SER 97 13.307 -4.764 -13.078
22 H SER 98 H SER 98 12.905 -8.500 -13.602
23 HA SER 98 HA SER 98 11.240 -8.836 -11.224
24 HB2 SER 98 1HB SER 98 10.541 -11.029 -11.732
25 HB3 SER 98 2HB SER 98 10.290 -10.139 -13.234
26 HG SER 98 HG SER 98 11.422 -12.261 -13.330
27 H GLY 99 H GLY 99 12.479 -9.278 -9.528
28 HA2 GLY 99 1HA GLY 99 15.187 -10.330 -10.026
29 HA3 GLY 99 2HA GLY 99 14.721 -9.356 -8.639
30 H THR 100 H THR 100 16.073 -11.468 -7.954
31 HA THR 100 HA THR 100 14.363 -13.769 -7.535
32 HB THR 100 HB THR 100 16.747 -14.112 -8.024
33 HG1 THR 100 1HG THR 100 15.369 -15.407 -6.361
34 HG21 THR 100 3HG2 THR 100 18.397 -13.029 -6.976
35 HG22 THR 100 1HG2 THR 100 17.752 -13.440 -5.387
36 HG23 THR 100 2HG2 THR 100 17.151 -12.020 -6.243
37 H GLY 101 H GLY 101 13.872 -14.640 -5.446
38 HA2 GLY 101 1HA GLY 101 13.264 -14.536 -3.227
39 HA3 GLY 101 2HA GLY 101 14.352 -13.166 -3.051
40 H GLN 102 H GLN 102 12.447 -12.621 -1.575
41 HA GLN 102 HA GLN 102 10.483 -11.068 -3.128
42 HB2 GLN 102 1HB GLN 102 8.878 -11.426 -1.288
43 HB3 GLN 102 2HB GLN 102 9.363 -12.934 -2.052
44 HG2 GLN 102 1HG GLN 102 10.684 -11.930 0.443
45 HG3 GLN 102 2HG GLN 102 9.205 -12.888 0.487
46 HE21 GLN 102 1HE2 GLN 102 9.348 -14.923 -0.913
47 HE22 GLN 102 2HE2 GLN 102 10.799 -15.847 -0.749
48 H LYS 103 H LYS 103 9.938 -9.023 -2.369
49 HA LYS 103 HA LYS 103 11.879 -7.879 -0.491
50 HB2 LYS 103 1HB LYS 103 10.337 -6.824 -2.805
51 HB3 LYS 103 2HB LYS 103 10.691 -5.705 -1.495
52 HG2 LYS 103 1HG LYS 103 13.093 -6.272 -1.725
53 HG3 LYS 103 2HG LYS 103 12.683 -7.264 -3.126
54 HD2 LYS 103 1HD LYS 103 11.516 -5.061 -3.948
55 HD3 LYS 103 2HD LYS 103 12.632 -4.297 -2.813
56 HE2 LYS 103 1HE LYS 103 13.671 -6.305 -4.760
57 HE3 LYS 103 2HE LYS 103 13.310 -4.672 -5.319
58 HZ1 LYS 103 3HZ LYS 103 15.623 -4.910 -4.632
59 HZ2 LYS 103 1HZ LYS 103 15.133 -5.351 -3.074
60 HZ3 LYS 103 2HZ LYS 103 14.810 -3.795 -3.654
61 HA PRO 104 HA PRO 104 8.927 -7.026 2.640
62 HB2 PRO 104 1HB PRO 104 9.634 -4.538 3.466
63 HB3 PRO 104 2HB PRO 104 10.602 -5.977 3.811
64 HG2 PRO 104 1HG PRO 104 10.976 -3.908 1.679
65 HG3 PRO 104 2HG PRO 104 12.190 -4.671 2.724
66 HD2 PRO 104 1HD PRO 104 11.781 -5.443 0.161
67 HD3 PRO 104 2HD PRO 104 12.289 -6.576 1.429
68 H PHE 105 H PHE 105 8.933 -5.277 -0.237
69 HA PHE 105 HA PHE 105 6.211 -4.368 0.251
70 HB2 PHE 105 1HB PHE 105 8.294 -2.463 -0.831
71 HB3 PHE 105 2HB PHE 105 6.607 -2.105 -0.475
72 HD1 PHE 105 2HD PHE 105 5.835 -2.030 1.879
73 HD2 PHE 105 1HD PHE 105 9.950 -2.403 0.855
74 HE1 PHE 105 2HE PHE 105 6.462 -1.335 4.155
75 HE2 PHE 105 1HE PHE 105 10.583 -1.710 3.129
76 HZ PHE 105 HZ PHE 105 8.838 -1.174 4.782
77 H GLU 106 H GLU 106 5.211 -5.481 -1.307
78 HA GLU 106 HA GLU 106 6.273 -5.262 -4.047
79 HB2 GLU 106 1HB GLU 106 6.355 -7.572 -2.882
80 HB3 GLU 106 2HB GLU 106 4.613 -7.589 -3.119
81 HG2 GLU 106 1HG GLU 106 4.869 -7.466 -5.493
82 HG3 GLU 106 2HG GLU 106 6.608 -7.223 -5.340
83 H CYS 107 H CYS 107 4.848 -4.786 -5.669
84 HA CYS 107 HA CYS 107 2.268 -3.746 -4.826
85 HB2 CYS 107 1HB CYS 107 3.845 -2.478 -6.344
86 HB3 CYS 107 2HB CYS 107 3.479 -3.665 -7.592
87 H THR 108 H THR 108 1.458 -5.945 -4.375
88 HA THR 108 HA THR 108 1.132 -8.081 -5.942
89 HB THR 108 HB THR 108 0.024 -7.948 -3.790
90 HG1 THR 108 1HG THR 108 -0.894 -9.187 -5.788
91 HG21 THR 108 3HG2 THR 108 -0.757 -5.684 -3.768
92 HG22 THR 108 1HG2 THR 108 -2.163 -6.736 -3.609
93 HG23 THR 108 2HG2 THR 108 -1.802 -5.974 -5.158
94 H HIS 109 H HIS 109 -0.561 -5.017 -6.396
95 HA HIS 109 HA HIS 109 -2.462 -5.581 -8.238
96 HB2 HIS 109 1HB HIS 109 -0.514 -3.270 -8.358
97 HB3 HIS 109 2HB HIS 109 -2.042 -3.349 -9.229
98 HD2 HIS 109 2HD HIS 109 -0.698 -2.205 -5.864
99 HE1 HIS 109 1HE HIS 109 -4.919 -2.381 -5.483
100 HE2 HIS 109 2HE HIS 109 -2.774 -1.524 -4.480
101 H CYS 110 H CYS 110 0.902 -4.792 -9.134
102 HA CYS 110 HA CYS 110 0.492 -6.325 -11.617
103 HB2 CYS 110 1HB CYS 110 2.286 -4.919 -12.595
104 HB3 CYS 110 2HB CYS 110 0.888 -3.978 -12.086
105 H GLY 111 H GLY 111 2.836 -5.527 -9.077
106 HA2 GLY 111 1HA GLY 111 3.914 -7.636 -8.173
107 HA3 GLY 111 2HA GLY 111 4.364 -7.933 -9.846
108 H LYS 112 H LYS 112 4.406 -4.648 -9.036
109 HA LYS 112 HA LYS 112 7.235 -4.487 -9.379
110 HB2 LYS 112 1HB LYS 112 5.389 -2.753 -9.978
111 HB3 LYS 112 2HB LYS 112 5.559 -2.241 -8.304
112 HG2 LYS 112 1HG LYS 112 7.010 -0.816 -9.349
113 HG3 LYS 112 2HG LYS 112 8.100 -2.131 -8.903
114 HD2 LYS 112 1HD LYS 112 8.090 -3.006 -11.106
115 HD3 LYS 112 2HD LYS 112 6.732 -1.984 -11.581
116 HE2 LYS 112 1HE LYS 112 8.095 -0.013 -11.444
117 HE3 LYS 112 2HE LYS 112 9.435 -0.932 -10.761
118 HZ1 LYS 112 3HZ LYS 112 8.390 -1.735 -13.377
119 HZ2 LYS 112 1HZ LYS 112 9.966 -1.832 -12.769
120 HZ3 LYS 112 2HZ LYS 112 9.352 -0.346 -13.295
121 H SER 113 H SER 113 8.686 -4.926 -7.867
122 HA SER 113 HA SER 113 7.936 -4.792 -5.051
123 HB2 SER 113 1HB SER 113 9.924 -6.078 -4.614
124 HB3 SER 113 2HB SER 113 9.109 -6.804 -6.000
125 HG SER 113 HG SER 113 11.196 -6.642 -6.612
126 H PHE 114 H PHE 114 9.396 -3.808 -3.486
127 HA PHE 114 HA PHE 114 11.219 -1.778 -4.490
128 HB2 PHE 114 1HB PHE 114 8.784 -1.101 -2.829
129 HB3 PHE 114 2HB PHE 114 10.119 0.006 -3.134
130 HD1 PHE 114 2HD PHE 114 7.344 -1.843 -4.703
131 HD2 PHE 114 1HD PHE 114 10.298 1.185 -5.176
132 HE1 PHE 114 2HE PHE 114 6.255 -1.110 -6.783
133 HE2 PHE 114 1HE PHE 114 9.212 1.924 -7.257
134 HZ PHE 114 HZ PHE 114 7.189 0.775 -8.064
135 H ARG 115 H ARG 115 12.347 -0.648 -2.657
136 HA ARG 115 HA ARG 115 13.153 -2.633 -0.718
137 HB2 ARG 115 1HB ARG 115 14.175 0.016 -1.622
138 HB3 ARG 115 2HB ARG 115 14.641 -0.543 -0.021
139 HG2 ARG 115 1HG ARG 115 15.020 -2.181 -2.513
140 HG3 ARG 115 2HG ARG 115 16.244 -1.084 -1.870
141 HD2 ARG 115 1HD ARG 115 16.228 -2.331 0.246
142 HD3 ARG 115 2HD ARG 115 15.032 -3.439 -0.427
143 HE ARG 115 HE ARG 115 17.020 -3.638 -2.205
144 HH11 ARG 115 2HH1 ARG 115 17.015 -3.746 1.274
145 HH12 ARG 115 1HH1 ARG 115 18.382 -4.805 1.374
146 HH21 ARG 115 2HH2 ARG 115 18.821 -5.034 -2.088
147 HH22 ARG 115 1HH2 ARG 115 19.409 -5.536 -0.539
148 H ALA 116 H ALA 116 11.753 0.632 -0.644
149 HA ALA 116 HA ALA 116 10.952 0.131 2.149
150 HB1 ALA 116 3HB ALA 116 11.564 2.760 0.807
151 HB2 ALA 116 1HB ALA 116 10.953 2.578 2.451
152 HB3 ALA 116 2HB ALA 116 12.544 1.945 2.026
153 H LYS 117 H LYS 117 8.907 1.036 2.823
154 HA LYS 117 HA LYS 117 6.775 0.396 1.176
155 HB2 LYS 117 1HB LYS 117 6.761 0.729 3.691
156 HB3 LYS 117 2HB LYS 117 6.647 2.456 3.378
157 HG2 LYS 117 1HG LYS 117 4.492 2.326 2.657
158 HG3 LYS 117 2HG LYS 117 4.672 0.674 2.062
159 HD2 LYS 117 1HD LYS 117 4.396 -0.249 4.181
160 HD3 LYS 117 2HD LYS 117 4.798 1.263 4.997
161 HE2 LYS 117 1HE LYS 117 2.347 0.963 3.284
162 HE3 LYS 117 2HE LYS 117 2.351 0.550 4.998
163 HZ1 LYS 117 3HZ LYS 117 3.439 3.155 4.359
164 HZ2 LYS 117 1HZ LYS 117 2.385 2.695 5.600
165 HZ3 LYS 117 2HZ LYS 117 1.786 2.980 4.044
166 H GLY 118 H GLY 118 7.593 3.729 2.167
167 HA2 GLY 118 1HA GLY 118 6.026 5.231 0.617
168 HA3 GLY 118 2HA GLY 118 7.720 5.639 0.840
169 H ASN 119 H ASN 119 9.201 4.200 -0.645
170 HA ASN 119 HA ASN 119 9.043 5.029 -3.204
171 HB2 ASN 119 1HB ASN 119 10.234 2.589 -1.967
172 HB3 ASN 119 2HB ASN 119 10.191 2.687 -3.725
173 HD21 ASN 119 1HD2 ASN 119 10.842 5.029 -4.477
174 HD22 ASN 119 2HD2 ASN 119 12.330 5.592 -3.804
175 H LEU 120 H LEU 120 7.657 1.978 -2.009
176 HA LEU 120 HA LEU 120 6.506 1.236 -4.492
177 HB2 LEU 120 1HB LEU 120 6.866 -0.500 -2.962
178 HB3 LEU 120 2HB LEU 120 6.075 0.375 -1.652
179 HG LEU 120 HG LEU 120 3.903 0.011 -2.723
180 HD11 LEU 120 1HD1 LEU 120 3.601 -1.171 -4.701
181 HD12 LEU 120 2HD1 LEU 120 5.232 -1.841 -4.666
182 HD13 LEU 120 3HD1 LEU 120 4.987 -0.138 -5.052
183 HD21 LEU 120 3HD2 LEU 120 5.481 -2.540 -2.400
184 HD22 LEU 120 1HD2 LEU 120 3.729 -2.367 -2.288
185 HD23 LEU 120 2HD2 LEU 120 4.768 -1.605 -1.084
186 H VAL 121 H VAL 121 5.107 2.669 -1.548
187 HA VAL 121 HA VAL 121 2.477 2.865 -2.229
188 HB VAL 121 HB VAL 121 4.096 5.034 -0.885
189 HG11 VAL 121 1HG1 VAL 121 2.175 6.080 -0.281
190 HG12 VAL 121 2HG1 VAL 121 1.609 5.366 -1.792
191 HG13 VAL 121 3HG1 VAL 121 1.238 4.587 -0.254
192 HG21 VAL 121 3HG2 VAL 121 4.450 3.201 0.466
193 HG22 VAL 121 1HG2 VAL 121 2.973 3.866 1.166
194 HG23 VAL 121 2HG2 VAL 121 2.887 2.480 0.079
195 H THR 122 H THR 122 5.063 5.089 -3.205
196 HA THR 122 HA THR 122 3.431 6.899 -4.616
197 HB THR 122 HB THR 122 6.366 6.263 -4.745
198 HG1 THR 122 1HG THR 122 4.713 8.226 -3.637
199 HG21 THR 122 3HG2 THR 122 5.828 6.843 -7.011
200 HG22 THR 122 1HG2 THR 122 6.589 8.243 -6.256
201 HG23 THR 122 2HG2 THR 122 4.840 8.204 -6.480
202 H HIS 123 H HIS 123 4.981 3.888 -5.547
203 HA HIS 123 HA HIS 123 4.612 4.132 -8.338
204 HB2 HIS 123 1HB HIS 123 6.146 2.485 -7.784
205 HB3 HIS 123 2HB HIS 123 5.157 1.861 -6.467
206 HD1 HIS 123 1HD HIS 123 5.595 1.653 -10.182
207 HD2 HIS 123 2HD HIS 123 3.307 -0.096 -7.187
208 HE1 HIS 123 1HE HIS 123 4.482 -0.329 -11.257
209 H GLN 124 H GLN 124 2.685 2.515 -5.827
210 HA GLN 124 HA GLN 124 0.711 1.396 -7.385
211 HB2 GLN 124 1HB GLN 124 -0.001 2.753 -4.807
212 HB3 GLN 124 2HB GLN 124 -0.587 1.225 -5.452
213 HG2 GLN 124 1HG GLN 124 1.900 0.486 -5.160
214 HG3 GLN 124 2HG GLN 124 1.952 1.829 -4.021
215 HE21 GLN 124 1HE2 GLN 124 2.328 -0.863 -3.325
216 HE22 GLN 124 2HE2 GLN 124 1.035 -1.339 -2.283
217 H ARG 125 H ARG 125 1.101 4.743 -6.406
218 HA ARG 125 HA ARG 125 -1.380 5.795 -6.958
219 HB2 ARG 125 1HB ARG 125 1.276 7.077 -7.627
220 HB3 ARG 125 2HB ARG 125 -0.253 7.915 -7.398
221 HG2 ARG 125 1HG ARG 125 -0.297 7.240 -5.064
222 HG3 ARG 125 2HG ARG 125 1.208 6.345 -5.284
223 HD2 ARG 125 1HD ARG 125 2.022 8.304 -4.426
224 HD3 ARG 125 2HD ARG 125 2.079 8.670 -6.149
225 HE ARG 125 HE ARG 125 0.312 9.835 -4.173
226 HH11 ARG 125 2HH1 ARG 125 0.998 9.336 -7.549
227 HH12 ARG 125 1HH1 ARG 125 0.051 10.688 -8.075
228 HH21 ARG 125 2HH2 ARG 125 -0.938 11.618 -4.853
229 HH22 ARG 125 1HH2 ARG 125 -1.049 11.986 -6.541
230 H ILE 126 H ILE 126 0.884 4.430 -9.148
231 HA ILE 126 HA ILE 126 -0.009 5.751 -11.513
232 HB ILE 126 HB ILE 126 1.372 4.301 -12.724
233 HG12 ILE 126 1HG1 ILE 126 1.110 2.384 -10.402
234 HG13 ILE 126 2HG1 ILE 126 0.487 2.171 -12.034
235 HG21 ILE 126 1HG2 ILE 126 3.241 3.889 -10.697
236 HG22 ILE 126 2HG2 ILE 126 3.123 5.282 -11.770
237 HG23 ILE 126 3HG2 ILE 126 2.324 5.310 -10.198
238 HD11 ILE 126 3HD1 ILE 126 3.271 1.915 -11.017
239 HD12 ILE 126 1HD1 ILE 126 2.351 0.843 -12.072
240 HD13 ILE 126 2HD1 ILE 126 3.000 2.357 -12.702
241 H HIS 127 H HIS 127 -0.968 2.867 -9.779
242 HA HIS 127 HA HIS 127 -2.635 1.848 -11.879
243 HB2 HIS 127 1HB HIS 127 -2.401 1.159 -8.947
244 HB3 HIS 127 2HB HIS 127 -3.492 0.328 -10.053
245 HD1 HIS 127 1HD HIS 127 -2.265 -0.924 -12.111
246 HD2 HIS 127 2HD HIS 127 0.140 0.180 -8.909
247 HE1 HIS 127 1HE HIS 127 -0.161 -2.282 -12.351
248 H THR 128 H THR 128 -3.271 3.416 -8.746
249 HA THR 128 HA THR 128 -5.930 3.510 -8.557
250 HB THR 128 HB THR 128 -5.810 5.741 -7.575
251 HG1 THR 128 1HG THR 128 -4.388 6.679 -9.138
252 HG21 THR 128 3HG2 THR 128 -4.692 3.591 -6.542
253 HG22 THR 128 1HG2 THR 128 -4.506 5.165 -5.770
254 HG23 THR 128 2HG2 THR 128 -3.210 4.517 -6.776
255 H GLY 129 H GLY 129 -7.686 4.465 -9.497
256 HA2 GLY 129 1HA GLY 129 -7.452 5.242 -12.231
257 HA3 GLY 129 2HA GLY 129 -8.922 5.266 -11.267
258 H GLU 130 H GLU 130 -9.669 7.168 -10.486
259 HA GLU 130 HA GLU 130 -9.904 9.415 -10.221
260 HB2 GLU 130 1HB GLU 130 -6.971 9.023 -9.809
261 HB3 GLU 130 2HB GLU 130 -7.593 10.662 -9.946
262 HG2 GLU 130 1HG GLU 130 -7.484 10.110 -7.639
263 HG3 GLU 130 2HG GLU 130 -9.183 10.146 -8.106
264 H LYS 131 H LYS 131 -9.990 8.452 -12.827
265 HA LYS 131 HA LYS 131 -8.730 10.644 -14.343
266 HB2 LYS 131 1HB LYS 131 -7.873 8.393 -14.936
267 HB3 LYS 131 2HB LYS 131 -9.507 7.905 -15.363
268 HG2 LYS 131 1HG LYS 131 -8.502 8.421 -17.399
269 HG3 LYS 131 2HG LYS 131 -9.470 9.847 -17.018
270 HD2 LYS 131 1HD LYS 131 -7.425 10.906 -16.074
271 HD3 LYS 131 2HD LYS 131 -6.496 9.515 -16.637
272 HE2 LYS 131 1HE LYS 131 -6.986 10.008 -18.912
273 HE3 LYS 131 2HE LYS 131 -8.185 11.217 -18.457
274 HZ1 LYS 131 3HZ LYS 131 -5.324 11.479 -17.743
275 HZ2 LYS 131 1HZ LYS 131 -6.520 12.675 -17.720
276 HZ3 LYS 131 2HZ LYS 131 -5.952 12.077 -19.196
277 H SER 132 H SER 132 -10.359 12.127 -14.331
278 HA SER 132 HA SER 132 -13.054 11.818 -14.367
279 HB2 SER 132 1HB SER 132 -11.239 13.891 -15.508
280 HB3 SER 132 2HB SER 132 -12.943 13.956 -15.958
281 HG SER 132 HG SER 132 -13.395 13.900 -13.662
282 H GLY 133 H GLY 133 -14.657 11.381 -15.821
283 HA2 GLY 133 1HA GLY 133 -15.656 10.762 -17.810
284 HA3 GLY 133 2HA GLY 133 -14.171 11.200 -18.643
285 HA PRO 134 HA PRO 134 -14.742 6.469 -17.944
286 HB2 PRO 134 1HB PRO 134 -16.135 5.775 -20.168
287 HB3 PRO 134 2HB PRO 134 -16.914 6.173 -18.632
288 HG2 PRO 134 1HG PRO 134 -16.518 7.886 -21.055
289 HG3 PRO 134 2HG PRO 134 -17.952 7.719 -20.026
290 HD2 PRO 134 1HD PRO 134 -16.235 9.801 -19.805
291 HD3 PRO 134 2HD PRO 134 -17.115 9.137 -18.413
292 H SER 135 H SER 135 -13.331 5.045 -18.888
293 HA SER 135 HA SER 135 -12.123 5.790 -21.457
294 HB2 SER 135 1HB SER 135 -9.871 5.219 -20.514
295 HB3 SER 135 2HB SER 135 -10.592 6.665 -19.808
296 HG SER 135 HG SER 135 -10.161 5.656 -18.005
297 H SER 136 H SER 136 -10.879 4.014 -22.440
298 HA SER 136 HA SER 136 -12.224 1.469 -21.942
299 HB2 SER 136 1HB SER 136 -10.596 2.513 -24.261
300 HB3 SER 136 2HB SER 136 -11.115 0.831 -24.145
301 HG SER 136 HG SER 136 -12.880 3.049 -24.029
302 H GLY 137 H GLY 137 -8.911 2.657 -22.533
303 HA2 GLY 137 1HA GLY 137 -7.576 0.267 -21.966
304 HA3 GLY 137 2HA GLY 137 -6.877 1.873 -21.820
Start of MODEL 9
1 H1 GLY 93 H GLY 93 14.521 -22.932 -17.385
2 HA2 GLY 93 1HA GLY 93 16.793 -22.577 -18.460
3 HA3 GLY 93 2HA GLY 93 15.629 -23.417 -19.475
4 H SER 94 H SER 94 15.293 -22.619 -21.439
5 HA SER 94 HA SER 94 16.710 -20.634 -22.625
6 HB2 SER 94 1HB SER 94 13.998 -21.766 -23.205
7 HB3 SER 94 2HB SER 94 14.583 -20.404 -24.159
8 HG SER 94 HG SER 94 15.330 -22.123 -25.241
9 H SER 95 H SER 95 13.402 -20.213 -21.357
10 HA SER 95 HA SER 95 13.827 -17.310 -21.369
11 HB2 SER 95 1HB SER 95 11.358 -19.031 -21.316
12 HB3 SER 95 2HB SER 95 11.290 -17.327 -20.869
13 HG SER 95 HG SER 95 11.239 -18.352 -23.291
14 H GLY 96 H GLY 96 15.056 -17.061 -19.506
15 HA2 GLY 96 1HA GLY 96 13.542 -17.008 -17.056
16 HA3 GLY 96 2HA GLY 96 14.821 -18.213 -17.053
17 H SER 97 H SER 97 14.160 -14.763 -17.422
18 HA SER 97 HA SER 97 16.953 -14.069 -17.157
19 HB2 SER 97 1HB SER 97 14.409 -12.555 -17.579
20 HB3 SER 97 2HB SER 97 15.816 -11.690 -16.959
21 HG SER 97 HG SER 97 16.863 -12.921 -18.865
22 H SER 98 H SER 98 14.001 -13.553 -15.232
23 HA SER 98 HA SER 98 15.715 -13.083 -12.884
24 HB2 SER 98 1HB SER 98 13.981 -11.741 -11.946
25 HB3 SER 98 2HB SER 98 14.138 -11.233 -13.627
26 HG SER 98 HG SER 98 12.125 -12.803 -12.429
27 H GLY 99 H GLY 99 15.218 -14.096 -10.918
28 HA2 GLY 99 1HA GLY 99 13.631 -16.555 -11.242
29 HA3 GLY 99 2HA GLY 99 14.928 -16.328 -10.078
30 H THR 100 H THR 100 13.807 -16.823 -8.244
31 HA THR 100 HA THR 100 11.217 -16.140 -7.579
32 HB THR 100 HB THR 100 11.967 -16.282 -5.180
33 HG1 THR 100 1HG THR 100 14.454 -16.290 -6.486
34 HG21 THR 100 3HG2 THR 100 12.964 -18.694 -5.562
35 HG22 THR 100 1HG2 THR 100 12.479 -18.385 -7.229
36 HG23 THR 100 2HG2 THR 100 11.279 -18.338 -5.938
37 H GLY 101 H GLY 101 10.750 -14.641 -5.571
38 HA2 GLY 101 1HA GLY 101 12.216 -12.138 -5.630
39 HA3 GLY 101 2HA GLY 101 10.593 -12.060 -6.301
40 H GLN 102 H GLN 102 12.345 -11.534 -3.581
41 HA GLN 102 HA GLN 102 9.942 -11.691 -1.909
42 HB2 GLN 102 1HB GLN 102 11.283 -12.492 -0.005
43 HB3 GLN 102 2HB GLN 102 11.268 -13.646 -1.333
44 HG2 GLN 102 1HG GLN 102 13.486 -12.610 -2.037
45 HG3 GLN 102 2HG GLN 102 13.496 -11.849 -0.447
46 HE21 GLN 102 1HE2 GLN 102 15.442 -13.051 -0.072
47 HE22 GLN 102 2HE2 GLN 102 15.354 -14.707 0.414
48 H LYS 103 H LYS 103 9.525 -9.591 -1.606
49 HA LYS 103 HA LYS 103 11.678 -7.926 -0.491
50 HB2 LYS 103 1HB LYS 103 9.907 -7.376 -2.817
51 HB3 LYS 103 2HB LYS 103 10.260 -6.034 -1.737
52 HG2 LYS 103 1HG LYS 103 11.956 -5.796 -3.236
53 HG3 LYS 103 2HG LYS 103 12.738 -6.859 -2.064
54 HD2 LYS 103 1HD LYS 103 11.888 -8.787 -3.511
55 HD3 LYS 103 2HD LYS 103 11.558 -7.562 -4.739
56 HE2 LYS 103 1HE LYS 103 13.845 -6.972 -4.896
57 HE3 LYS 103 2HE LYS 103 14.251 -7.870 -3.434
58 HZ1 LYS 103 3HZ LYS 103 13.637 -8.902 -6.124
59 HZ2 LYS 103 1HZ LYS 103 13.414 -9.885 -4.766
60 HZ3 LYS 103 2HZ LYS 103 14.947 -9.264 -5.117
61 HA PRO 104 HA PRO 104 8.853 -6.924 2.718
62 HB2 PRO 104 1HB PRO 104 9.665 -4.412 3.352
63 HB3 PRO 104 2HB PRO 104 10.602 -5.855 3.756
64 HG2 PRO 104 1HG PRO 104 10.955 -3.942 1.480
65 HG3 PRO 104 2HG PRO 104 12.184 -4.674 2.528
66 HD2 PRO 104 1HD PRO 104 11.655 -5.596 0.037
67 HD3 PRO 104 2HD PRO 104 12.178 -6.660 1.359
68 H PHE 105 H PHE 105 8.902 -5.200 -0.224
69 HA PHE 105 HA PHE 105 6.176 -4.283 0.241
70 HB2 PHE 105 1HB PHE 105 8.271 -2.402 -0.855
71 HB3 PHE 105 2HB PHE 105 6.589 -2.030 -0.492
72 HD1 PHE 105 2HD PHE 105 5.832 -1.928 1.865
73 HD2 PHE 105 1HD PHE 105 9.937 -2.352 0.823
74 HE1 PHE 105 2HE PHE 105 6.477 -1.225 4.133
75 HE2 PHE 105 1HE PHE 105 10.589 -1.651 3.089
76 HZ PHE 105 HZ PHE 105 8.858 -1.085 4.748
77 H GLU 106 H GLU 106 5.197 -5.443 -1.304
78 HA GLU 106 HA GLU 106 6.251 -5.223 -4.047
79 HB2 GLU 106 1HB GLU 106 6.391 -7.522 -2.907
80 HB3 GLU 106 2HB GLU 106 4.641 -7.567 -3.063
81 HG2 GLU 106 1HG GLU 106 4.746 -7.558 -5.414
82 HG3 GLU 106 2HG GLU 106 6.451 -7.109 -5.411
83 H CYS 107 H CYS 107 4.836 -4.708 -5.649
84 HA CYS 107 HA CYS 107 2.240 -3.717 -4.812
85 HB2 CYS 107 1HB CYS 107 3.789 -2.430 -6.331
86 HB3 CYS 107 2HB CYS 107 3.460 -3.631 -7.575
87 H THR 108 H THR 108 1.479 -5.943 -4.353
88 HA THR 108 HA THR 108 1.162 -8.081 -5.904
89 HB THR 108 HB THR 108 0.045 -7.925 -3.752
90 HG1 THR 108 1HG THR 108 -1.696 -9.154 -4.325
91 HG21 THR 108 3HG2 THR 108 -2.296 -6.478 -4.842
92 HG22 THR 108 1HG2 THR 108 -0.860 -5.513 -4.504
93 HG23 THR 108 2HG2 THR 108 -1.608 -6.461 -3.218
94 H HIS 109 H HIS 109 -0.566 -5.040 -6.384
95 HA HIS 109 HA HIS 109 -2.452 -5.636 -8.230
96 HB2 HIS 109 1HB HIS 109 -0.528 -3.303 -8.307
97 HB3 HIS 109 2HB HIS 109 -2.005 -3.404 -9.260
98 HD2 HIS 109 2HD HIS 109 -0.872 -2.115 -5.901
99 HE1 HIS 109 1HE HIS 109 -5.085 -2.539 -5.632
100 HE2 HIS 109 2HE HIS 109 -3.027 -1.515 -4.602
101 H CYS 110 H CYS 110 0.886 -4.764 -9.153
102 HA CYS 110 HA CYS 110 0.504 -6.323 -11.623
103 HB2 CYS 110 1HB CYS 110 2.294 -4.914 -12.593
104 HB3 CYS 110 2HB CYS 110 0.905 -3.967 -12.070
105 H GLY 111 H GLY 111 2.833 -5.532 -9.067
106 HA2 GLY 111 1HA GLY 111 3.916 -7.622 -8.146
107 HA3 GLY 111 2HA GLY 111 4.345 -7.956 -9.817
108 H LYS 112 H LYS 112 4.409 -4.661 -8.908
109 HA LYS 112 HA LYS 112 7.239 -4.519 -9.350
110 HB2 LYS 112 1HB LYS 112 5.401 -2.771 -9.925
111 HB3 LYS 112 2HB LYS 112 5.592 -2.262 -8.252
112 HG2 LYS 112 1HG LYS 112 7.040 -0.844 -9.310
113 HG3 LYS 112 2HG LYS 112 8.127 -2.167 -8.879
114 HD2 LYS 112 1HD LYS 112 7.985 -3.077 -11.102
115 HD3 LYS 112 2HD LYS 112 6.750 -1.897 -11.550
116 HE2 LYS 112 1HE LYS 112 8.266 -0.147 -11.619
117 HE3 LYS 112 2HE LYS 112 9.419 -0.971 -10.571
118 HZ1 LYS 112 3HZ LYS 112 9.116 -1.105 -13.437
119 HZ2 LYS 112 1HZ LYS 112 9.310 -2.614 -12.696
120 HZ3 LYS 112 2HZ LYS 112 10.475 -1.408 -12.477
121 H SER 113 H SER 113 8.714 -4.959 -7.862
122 HA SER 113 HA SER 113 8.009 -4.823 -5.034
123 HB2 SER 113 1HB SER 113 9.935 -6.164 -4.621
124 HB3 SER 113 2HB SER 113 9.183 -6.827 -6.072
125 HG SER 113 HG SER 113 10.981 -6.445 -7.066
126 H PHE 114 H PHE 114 9.489 -3.842 -3.492
127 HA PHE 114 HA PHE 114 11.308 -1.821 -4.526
128 HB2 PHE 114 1HB PHE 114 8.909 -1.134 -2.816
129 HB3 PHE 114 2HB PHE 114 10.241 -0.032 -3.155
130 HD1 PHE 114 2HD PHE 114 7.419 -1.870 -4.649
131 HD2 PHE 114 1HD PHE 114 10.382 1.133 -5.210
132 HE1 PHE 114 2HE PHE 114 6.284 -1.140 -6.706
133 HE2 PHE 114 1HE PHE 114 9.251 1.869 -7.268
134 HZ PHE 114 HZ PHE 114 7.200 0.731 -8.019
135 H ARG 115 H ARG 115 12.394 -0.641 -2.652
136 HA ARG 115 HA ARG 115 13.262 -2.649 -0.752
137 HB2 ARG 115 1HB ARG 115 14.234 0.077 -1.540
138 HB3 ARG 115 2HB ARG 115 14.812 -0.672 -0.058
139 HG2 ARG 115 1HG ARG 115 14.937 -2.211 -2.605
140 HG3 ARG 115 2HG ARG 115 16.129 -0.947 -2.293
141 HD2 ARG 115 1HD ARG 115 15.562 -2.980 -0.184
142 HD3 ARG 115 2HD ARG 115 16.578 -3.421 -1.556
143 HE ARG 115 HE ARG 115 17.639 -1.077 -0.660
144 HH11 ARG 115 2HH1 ARG 115 16.914 -4.154 0.797
145 HH12 ARG 115 1HH1 ARG 115 18.198 -4.056 1.956
146 HH21 ARG 115 2HH2 ARG 115 19.333 -0.935 0.861
147 HH22 ARG 115 1HH2 ARG 115 19.573 -2.224 1.992
148 H ALA 116 H ALA 116 11.792 0.579 -0.667
149 HA ALA 116 HA ALA 116 11.073 0.086 2.150
150 HB1 ALA 116 3HB ALA 116 11.123 2.844 1.020
151 HB2 ALA 116 1HB ALA 116 11.393 2.297 2.676
152 HB3 ALA 116 2HB ALA 116 12.644 2.063 1.454
153 H LYS 117 H LYS 117 9.068 1.355 2.816
154 HA LYS 117 HA LYS 117 6.882 0.483 1.256
155 HB2 LYS 117 1HB LYS 117 6.947 0.903 3.771
156 HB3 LYS 117 2HB LYS 117 6.757 2.609 3.391
157 HG2 LYS 117 1HG LYS 117 4.589 2.367 2.736
158 HG3 LYS 117 2HG LYS 117 4.818 0.699 2.207
159 HD2 LYS 117 1HD LYS 117 4.554 -0.151 4.331
160 HD3 LYS 117 2HD LYS 117 5.060 1.350 5.109
161 HE2 LYS 117 1HE LYS 117 2.863 2.266 3.962
162 HE3 LYS 117 2HE LYS 117 2.403 0.565 4.021
163 HZ1 LYS 117 3HZ LYS 117 3.415 1.112 6.509
164 HZ2 LYS 117 1HZ LYS 117 1.781 0.946 6.101
165 HZ3 LYS 117 2HZ LYS 117 2.495 2.479 6.127
166 H GLY 118 H GLY 118 7.694 3.849 2.138
167 HA2 GLY 118 1HA GLY 118 6.069 5.289 0.581
168 HA3 GLY 118 2HA GLY 118 7.761 5.727 0.765
169 H ASN 119 H ASN 119 9.222 4.217 -0.703
170 HA ASN 119 HA ASN 119 9.046 4.994 -3.276
171 HB2 ASN 119 1HB ASN 119 10.207 2.558 -2.005
172 HB3 ASN 119 2HB ASN 119 10.144 2.622 -3.764
173 HD21 ASN 119 1HD2 ASN 119 11.116 4.570 -0.970
174 HD22 ASN 119 2HD2 ASN 119 12.510 5.261 -1.720
175 H LEU 120 H LEU 120 7.671 1.949 -2.040
176 HA LEU 120 HA LEU 120 6.448 1.219 -4.490
177 HB2 LEU 120 1HB LEU 120 6.797 -0.545 -3.023
178 HB3 LEU 120 2HB LEU 120 6.156 0.347 -1.645
179 HG LEU 120 HG LEU 120 3.884 0.097 -2.575
180 HD11 LEU 120 1HD1 LEU 120 5.010 -1.869 -4.535
181 HD12 LEU 120 2HD1 LEU 120 4.802 -0.170 -4.959
182 HD13 LEU 120 3HD1 LEU 120 3.405 -1.138 -4.487
183 HD21 LEU 120 3HD2 LEU 120 3.662 -2.304 -2.112
184 HD22 LEU 120 1HD2 LEU 120 4.695 -1.497 -0.932
185 HD23 LEU 120 2HD2 LEU 120 5.415 -2.478 -2.209
186 H VAL 121 H VAL 121 5.154 2.699 -1.525
187 HA VAL 121 HA VAL 121 2.499 2.895 -2.139
188 HB VAL 121 HB VAL 121 4.202 4.998 -0.795
189 HG11 VAL 121 1HG1 VAL 121 2.294 6.194 -1.234
190 HG12 VAL 121 2HG1 VAL 121 1.260 4.764 -1.212
191 HG13 VAL 121 3HG1 VAL 121 1.859 5.444 0.302
192 HG21 VAL 121 3HG2 VAL 121 2.830 3.827 1.188
193 HG22 VAL 121 1HG2 VAL 121 2.964 2.462 0.080
194 HG23 VAL 121 2HG2 VAL 121 4.418 3.274 0.659
195 H THR 122 H THR 122 5.068 5.135 -3.139
196 HA THR 122 HA THR 122 3.405 6.936 -4.527
197 HB THR 122 HB THR 122 6.346 6.332 -4.685
198 HG1 THR 122 1HG THR 122 4.710 8.415 -3.685
199 HG21 THR 122 3HG2 THR 122 4.775 8.260 -6.392
200 HG22 THR 122 1HG2 THR 122 5.797 6.931 -6.938
201 HG23 THR 122 2HG2 THR 122 6.523 8.344 -6.171
202 H HIS 123 H HIS 123 4.968 3.941 -5.479
203 HA HIS 123 HA HIS 123 4.597 4.192 -8.267
204 HB2 HIS 123 1HB HIS 123 6.124 2.539 -7.721
205 HB3 HIS 123 2HB HIS 123 5.136 1.916 -6.403
206 HD1 HIS 123 1HD HIS 123 5.614 1.675 -10.101
207 HD2 HIS 123 2HD HIS 123 3.230 0.003 -7.138
208 HE1 HIS 123 1HE HIS 123 4.480 -0.293 -11.181
209 H GLN 124 H GLN 124 2.656 2.594 -5.756
210 HA GLN 124 HA GLN 124 0.683 1.469 -7.308
211 HB2 GLN 124 1HB GLN 124 -0.030 2.862 -4.749
212 HB3 GLN 124 2HB GLN 124 -0.627 1.332 -5.380
213 HG2 GLN 124 1HG GLN 124 1.914 0.648 -5.080
214 HG3 GLN 124 2HG GLN 124 1.850 1.930 -3.872
215 HE21 GLN 124 1HE2 GLN 124 2.094 0.549 -2.145
216 HE22 GLN 124 2HE2 GLN 124 0.859 -0.549 -1.642
217 H ARG 125 H ARG 125 1.081 4.826 -6.365
218 HA ARG 125 HA ARG 125 -1.389 5.885 -6.940
219 HB2 ARG 125 1HB ARG 125 1.282 7.134 -7.610
220 HB3 ARG 125 2HB ARG 125 -0.242 7.991 -7.421
221 HG2 ARG 125 1HG ARG 125 -0.326 7.357 -5.073
222 HG3 ARG 125 2HG ARG 125 1.183 6.459 -5.256
223 HD2 ARG 125 1HD ARG 125 2.013 8.423 -4.447
224 HD3 ARG 125 2HD ARG 125 2.034 8.790 -6.172
225 HE ARG 125 HE ARG 125 0.346 10.321 -5.845
226 HH11 ARG 125 2HH1 ARG 125 0.784 8.407 -2.970
227 HH12 ARG 125 1HH1 ARG 125 -0.229 9.414 -1.989
228 HH21 ARG 125 2HH2 ARG 125 -0.990 11.653 -4.564
229 HH22 ARG 125 1HH2 ARG 125 -1.238 11.259 -2.897
230 H ILE 126 H ILE 126 0.903 4.517 -9.114
231 HA ILE 126 HA ILE 126 0.020 5.798 -11.495
232 HB ILE 126 HB ILE 126 1.387 4.315 -12.682
233 HG12 ILE 126 1HG1 ILE 126 1.110 2.427 -10.336
234 HG13 ILE 126 2HG1 ILE 126 0.450 2.210 -11.953
235 HG21 ILE 126 1HG2 ILE 126 3.146 5.282 -11.728
236 HG22 ILE 126 2HG2 ILE 126 2.339 5.337 -10.162
237 HG23 ILE 126 3HG2 ILE 126 3.239 3.897 -10.640
238 HD11 ILE 126 3HD1 ILE 126 2.290 0.840 -11.992
239 HD12 ILE 126 1HD1 ILE 126 2.935 2.324 -12.691
240 HD13 ILE 126 2HD1 ILE 126 3.259 1.932 -11.002
241 H HIS 127 H HIS 127 -0.955 2.913 -9.755
242 HA HIS 127 HA HIS 127 -2.641 1.910 -11.843
243 HB2 HIS 127 1HB HIS 127 -2.410 1.236 -8.907
244 HB3 HIS 127 2HB HIS 127 -3.517 0.414 -10.002
245 HD1 HIS 127 1HD HIS 127 -2.316 -0.865 -12.062
246 HD2 HIS 127 2HD HIS 127 0.116 0.217 -8.872
247 HE1 HIS 127 1HE HIS 127 -0.234 -2.255 -12.301
248 H THR 128 H THR 128 -3.244 3.542 -8.738
249 HA THR 128 HA THR 128 -5.910 3.654 -8.547
250 HB THR 128 HB THR 128 -5.759 5.908 -7.597
251 HG1 THR 128 1HG THR 128 -3.385 6.688 -7.650
252 HG21 THR 128 3HG2 THR 128 -4.374 5.380 -5.785
253 HG22 THR 128 1HG2 THR 128 -3.247 4.472 -6.791
254 HG23 THR 128 2HG2 THR 128 -4.839 3.806 -6.430
255 H GLY 129 H GLY 129 -7.403 3.850 -10.088
256 HA2 GLY 129 1HA GLY 129 -6.936 5.492 -12.427
257 HA3 GLY 129 2HA GLY 129 -8.343 4.485 -12.120
258 H GLU 130 H GLU 130 -7.000 7.042 -10.073
259 HA GLU 130 HA GLU 130 -9.571 8.455 -10.327
260 HB2 GLU 130 1HB GLU 130 -7.630 8.177 -8.054
261 HB3 GLU 130 2HB GLU 130 -8.739 9.540 -8.115
262 HG2 GLU 130 1HG GLU 130 -9.887 8.024 -6.821
263 HG3 GLU 130 2HG GLU 130 -10.565 7.739 -8.423
264 H LYS 131 H LYS 131 -9.196 9.856 -11.981
265 HA LYS 131 HA LYS 131 -7.500 12.114 -11.419
266 HB2 LYS 131 1HB LYS 131 -6.065 10.295 -12.573
267 HB3 LYS 131 2HB LYS 131 -6.975 10.703 -14.021
268 HG2 LYS 131 1HG LYS 131 -5.711 12.917 -12.501
269 HG3 LYS 131 2HG LYS 131 -4.672 11.852 -13.450
270 HD2 LYS 131 1HD LYS 131 -7.129 12.918 -14.741
271 HD3 LYS 131 2HD LYS 131 -5.778 14.026 -14.491
272 HE2 LYS 131 1HE LYS 131 -5.294 13.185 -16.577
273 HE3 LYS 131 2HE LYS 131 -4.374 12.093 -15.543
274 HZ1 LYS 131 3HZ LYS 131 -7.086 11.529 -16.613
275 HZ2 LYS 131 1HZ LYS 131 -6.126 10.473 -15.705
276 HZ3 LYS 131 2HZ LYS 131 -5.646 10.924 -17.262
277 H SER 132 H SER 132 -8.136 13.950 -12.497
278 HA SER 132 HA SER 132 -10.419 13.640 -14.337
279 HB2 SER 132 1HB SER 132 -11.206 14.562 -12.244
280 HB3 SER 132 2HB SER 132 -9.931 15.779 -12.252
281 HG SER 132 HG SER 132 -12.164 15.568 -13.976
282 H GLY 133 H GLY 133 -9.493 13.914 -16.297
283 HA2 GLY 133 1HA GLY 133 -8.557 16.553 -16.978
284 HA3 GLY 133 2HA GLY 133 -7.300 15.328 -17.054
285 HA PRO 134 HA PRO 134 -9.270 15.470 -21.214
286 HB2 PRO 134 1HB PRO 134 -6.936 15.172 -22.568
287 HB3 PRO 134 2HB PRO 134 -7.534 16.742 -22.019
288 HG2 PRO 134 1HG PRO 134 -5.477 14.958 -20.774
289 HG3 PRO 134 2HG PRO 134 -5.451 16.719 -20.987
290 HD2 PRO 134 1HD PRO 134 -6.088 15.545 -18.631
291 HD3 PRO 134 2HD PRO 134 -6.798 17.086 -19.153
292 H SER 135 H SER 135 -7.563 13.217 -19.360
293 HA SER 135 HA SER 135 -7.062 10.984 -19.605
294 HB2 SER 135 1HB SER 135 -9.611 11.242 -19.224
295 HB3 SER 135 2HB SER 135 -9.762 10.794 -20.923
296 HG SER 135 HG SER 135 -9.701 8.842 -20.122
297 H SER 136 H SER 136 -5.821 12.287 -21.634
298 HA SER 136 HA SER 136 -6.490 11.441 -24.235
299 HB2 SER 136 1HB SER 136 -3.811 12.247 -23.077
300 HB3 SER 136 2HB SER 136 -4.139 12.048 -24.798
301 HG SER 136 HG SER 136 -4.713 14.066 -24.687
302 H GLY 137 H GLY 137 -4.016 10.190 -21.986
303 HA2 GLY 137 1HA GLY 137 -4.518 7.485 -22.814
304 HA3 GLY 137 2HA GLY 137 -3.002 8.114 -23.442
Start of MODEL 10
1 H1 GLY 93 H GLY 93 35.287 -23.365 4.685
2 HA2 GLY 93 1HA GLY 93 32.868 -23.177 4.650
3 HA3 GLY 93 2HA GLY 93 33.516 -21.651 5.232
4 H SER 94 H SER 94 32.921 -23.240 2.092
5 HA SER 94 HA SER 94 32.391 -20.716 0.820
6 HB2 SER 94 1HB SER 94 33.378 -22.928 -0.200
7 HB3 SER 94 2HB SER 94 31.680 -23.346 -0.429
8 HG SER 94 HG SER 94 32.614 -20.831 -1.259
9 H SER 95 H SER 95 30.577 -19.688 1.396
10 HA SER 95 HA SER 95 28.036 -21.023 0.916
11 HB2 SER 95 1HB SER 95 28.462 -21.400 3.315
12 HB3 SER 95 2HB SER 95 28.652 -19.663 3.551
13 HG SER 95 HG SER 95 26.499 -19.381 3.004
14 H GLY 96 H GLY 96 26.945 -19.730 -0.399
15 HA2 GLY 96 1HA GLY 96 27.393 -16.821 -0.193
16 HA3 GLY 96 2HA GLY 96 26.902 -17.659 -1.658
17 H SER 97 H SER 97 24.943 -16.928 -2.168
18 HA SER 97 HA SER 97 22.748 -17.409 -0.363
19 HB2 SER 97 1HB SER 97 21.954 -15.171 -0.162
20 HB3 SER 97 2HB SER 97 23.663 -15.121 0.268
21 HG SER 97 HG SER 97 22.558 -14.450 -2.261
22 H SER 98 H SER 98 20.929 -17.879 -1.458
23 HA SER 98 HA SER 98 20.822 -18.572 -4.055
24 HB2 SER 98 1HB SER 98 18.333 -18.093 -3.963
25 HB3 SER 98 2HB SER 98 18.960 -19.087 -2.648
26 HG SER 98 HG SER 98 19.194 -16.765 -1.677
27 H GLY 99 H GLY 99 19.881 -15.351 -2.847
28 HA2 GLY 99 1HA GLY 99 20.864 -13.495 -4.249
29 HA3 GLY 99 2HA GLY 99 20.160 -14.352 -5.612
30 H THR 100 H THR 100 18.209 -13.734 -6.261
31 HA THR 100 HA THR 100 16.778 -11.747 -4.713
32 HB THR 100 HB THR 100 15.224 -11.721 -6.698
33 HG1 THR 100 1HG THR 100 17.163 -13.158 -8.132
34 HG21 THR 100 3HG2 THR 100 17.031 -10.111 -6.530
35 HG22 THR 100 1HG2 THR 100 16.857 -10.635 -8.204
36 HG23 THR 100 2HG2 THR 100 18.167 -11.275 -7.212
37 H GLY 101 H GLY 101 14.277 -11.965 -4.778
38 HA2 GLY 101 1HA GLY 101 12.995 -14.440 -4.789
39 HA3 GLY 101 2HA GLY 101 13.583 -14.176 -3.154
40 H GLN 102 H GLN 102 12.527 -12.776 -1.825
41 HA GLN 102 HA GLN 102 10.157 -11.444 -2.961
42 HB2 GLN 102 1HB GLN 102 9.114 -11.729 -0.723
43 HB3 GLN 102 2HB GLN 102 9.468 -13.253 -1.524
44 HG2 GLN 102 1HG GLN 102 10.197 -13.708 0.587
45 HG3 GLN 102 2HG GLN 102 11.686 -13.115 -0.147
46 HE21 GLN 102 1HE2 GLN 102 8.889 -12.076 1.745
47 HE22 GLN 102 2HE2 GLN 102 9.725 -10.859 2.643
48 H LYS 103 H LYS 103 9.444 -9.495 -1.822
49 HA LYS 103 HA LYS 103 11.668 -8.070 -0.517
50 HB2 LYS 103 1HB LYS 103 9.972 -7.274 -2.827
51 HB3 LYS 103 2HB LYS 103 10.397 -6.020 -1.669
52 HG2 LYS 103 1HG LYS 103 12.091 -5.845 -3.212
53 HG3 LYS 103 2HG LYS 103 12.817 -6.897 -1.995
54 HD2 LYS 103 1HD LYS 103 11.883 -8.824 -3.446
55 HD3 LYS 103 2HD LYS 103 11.750 -7.597 -4.708
56 HE2 LYS 103 1HE LYS 103 14.227 -7.082 -4.067
57 HE3 LYS 103 2HE LYS 103 14.189 -8.706 -3.383
58 HZ1 LYS 103 3HZ LYS 103 13.077 -9.012 -5.846
59 HZ2 LYS 103 1HZ LYS 103 14.673 -9.387 -5.430
60 HZ3 LYS 103 2HZ LYS 103 14.311 -7.888 -6.125
61 HA PRO 104 HA PRO 104 8.902 -6.942 2.696
62 HB2 PRO 104 1HB PRO 104 9.706 -4.417 3.285
63 HB3 PRO 104 2HB PRO 104 10.660 -5.848 3.691
64 HG2 PRO 104 1HG PRO 104 10.962 -3.963 1.386
65 HG3 PRO 104 2HG PRO 104 12.214 -4.673 2.422
66 HD2 PRO 104 1HD PRO 104 11.650 -5.631 -0.047
67 HD3 PRO 104 2HD PRO 104 12.202 -6.674 1.280
68 H PHE 105 H PHE 105 8.956 -5.144 -0.232
69 HA PHE 105 HA PHE 105 6.199 -4.306 0.227
70 HB2 PHE 105 1HB PHE 105 8.237 -2.355 -0.847
71 HB3 PHE 105 2HB PHE 105 6.561 -2.031 -0.416
72 HD1 PHE 105 2HD PHE 105 5.884 -1.988 1.959
73 HD2 PHE 105 1HD PHE 105 9.959 -2.344 0.781
74 HE1 PHE 105 2HE PHE 105 6.591 -1.338 4.224
75 HE2 PHE 105 1HE PHE 105 10.673 -1.696 3.045
76 HZ PHE 105 HZ PHE 105 8.988 -1.190 4.769
77 H GLU 106 H GLU 106 5.237 -5.428 -1.352
78 HA GLU 106 HA GLU 106 6.312 -5.143 -4.081
79 HB2 GLU 106 1HB GLU 106 6.497 -7.460 -3.016
80 HB3 GLU 106 2HB GLU 106 4.744 -7.532 -3.126
81 HG2 GLU 106 1HG GLU 106 4.768 -7.551 -5.454
82 HG3 GLU 106 2HG GLU 106 6.422 -6.948 -5.534
83 H CYS 107 H CYS 107 4.887 -4.674 -5.703
84 HA CYS 107 HA CYS 107 2.288 -3.690 -4.866
85 HB2 CYS 107 1HB CYS 107 3.849 -2.423 -6.409
86 HB3 CYS 107 2HB CYS 107 3.471 -3.621 -7.643
87 H THR 108 H THR 108 1.577 -5.945 -4.390
88 HA THR 108 HA THR 108 1.261 -8.078 -5.948
89 HB THR 108 HB THR 108 0.183 -7.914 -3.761
90 HG1 THR 108 1HG THR 108 -0.607 -9.561 -5.052
91 HG21 THR 108 3HG2 THR 108 -2.198 -6.548 -4.900
92 HG22 THR 108 1HG2 THR 108 -0.802 -5.554 -4.486
93 HG23 THR 108 2HG2 THR 108 -1.576 -6.547 -3.250
94 H HIS 109 H HIS 109 -0.488 -5.048 -6.392
95 HA HIS 109 HA HIS 109 -2.413 -5.659 -8.198
96 HB2 HIS 109 1HB HIS 109 -0.595 -3.304 -7.930
97 HB3 HIS 109 2HB HIS 109 -1.643 -3.400 -9.341
98 HD2 HIS 109 2HD HIS 109 -1.976 -1.289 -6.652
99 HE1 HIS 109 1HE HIS 109 -5.674 -3.346 -6.349
100 HE2 HIS 109 2HE HIS 109 -4.394 -1.266 -5.734
101 H CYS 110 H CYS 110 0.912 -4.784 -9.162
102 HA CYS 110 HA CYS 110 0.492 -6.323 -11.639
103 HB2 CYS 110 1HB CYS 110 2.265 -4.902 -12.627
104 HB3 CYS 110 2HB CYS 110 0.874 -3.966 -12.087
105 H GLY 111 H GLY 111 2.863 -5.532 -9.122
106 HA2 GLY 111 1HA GLY 111 3.964 -7.630 -8.233
107 HA3 GLY 111 2HA GLY 111 4.378 -7.940 -9.913
108 H LYS 112 H LYS 112 4.426 -4.657 -8.947
109 HA LYS 112 HA LYS 112 7.259 -4.501 -9.408
110 HB2 LYS 112 1HB LYS 112 5.444 -2.763 -10.017
111 HB3 LYS 112 2HB LYS 112 5.562 -2.262 -8.335
112 HG2 LYS 112 1HG LYS 112 7.047 -0.821 -9.278
113 HG3 LYS 112 2HG LYS 112 8.134 -2.160 -8.902
114 HD2 LYS 112 1HD LYS 112 8.067 -2.943 -11.155
115 HD3 LYS 112 2HD LYS 112 6.765 -1.825 -11.566
116 HE2 LYS 112 1HE LYS 112 8.178 0.023 -11.536
117 HE3 LYS 112 2HE LYS 112 9.394 -0.802 -10.563
118 HZ1 LYS 112 3HZ LYS 112 10.441 -1.272 -12.441
119 HZ2 LYS 112 1HZ LYS 112 9.182 -0.641 -13.379
120 HZ3 LYS 112 2HZ LYS 112 9.147 -2.262 -12.897
121 H SER 113 H SER 113 8.720 -4.959 -7.912
122 HA SER 113 HA SER 113 8.015 -4.849 -5.091
123 HB2 SER 113 1HB SER 113 9.982 -6.124 -4.687
124 HB3 SER 113 2HB SER 113 9.280 -6.785 -6.163
125 HG SER 113 HG SER 113 11.512 -6.457 -6.407
126 H PHE 114 H PHE 114 9.573 -3.903 -3.539
127 HA PHE 114 HA PHE 114 11.261 -1.767 -4.537
128 HB2 PHE 114 1HB PHE 114 8.843 -1.213 -2.808
129 HB3 PHE 114 2HB PHE 114 10.135 -0.055 -3.107
130 HD1 PHE 114 2HD PHE 114 7.402 -1.961 -4.684
131 HD2 PHE 114 1HD PHE 114 10.227 1.194 -5.110
132 HE1 PHE 114 2HE PHE 114 6.249 -1.209 -6.723
133 HE2 PHE 114 1HE PHE 114 9.078 1.952 -7.149
134 HZ PHE 114 HZ PHE 114 7.087 0.750 -7.959
135 H ARG 115 H ARG 115 12.180 -0.512 -2.544
136 HA ARG 115 HA ARG 115 13.173 -2.552 -0.715
137 HB2 ARG 115 1HB ARG 115 14.565 -0.743 -2.023
138 HB3 ARG 115 2HB ARG 115 14.106 0.290 -0.676
139 HG2 ARG 115 1HG ARG 115 16.139 -0.535 0.014
140 HG3 ARG 115 2HG ARG 115 15.011 -1.650 0.789
141 HD2 ARG 115 1HD ARG 115 15.315 -3.060 -1.362
142 HD3 ARG 115 2HD ARG 115 16.764 -2.084 -1.599
143 HE ARG 115 HE ARG 115 16.558 -3.289 1.010
144 HH11 ARG 115 2HH1 ARG 115 17.665 -3.678 -2.267
145 HH12 ARG 115 1HH1 ARG 115 18.859 -4.866 -1.861
146 HH21 ARG 115 2HH2 ARG 115 18.126 -4.852 1.558
147 HH22 ARG 115 1HH2 ARG 115 19.120 -5.534 0.315
148 H ALA 116 H ALA 116 11.668 0.664 -0.573
149 HA ALA 116 HA ALA 116 10.948 0.112 2.232
150 HB1 ALA 116 3HB ALA 116 10.680 2.660 2.334
151 HB2 ALA 116 1HB ALA 116 12.316 2.002 2.290
152 HB3 ALA 116 2HB ALA 116 11.598 2.681 0.829
153 H LYS 117 H LYS 117 8.933 1.477 2.876
154 HA LYS 117 HA LYS 117 6.754 0.511 1.325
155 HB2 LYS 117 1HB LYS 117 6.646 0.766 3.775
156 HB3 LYS 117 2HB LYS 117 6.763 2.511 3.594
157 HG2 LYS 117 1HG LYS 117 4.515 2.317 3.809
158 HG3 LYS 117 2HG LYS 117 4.642 2.128 2.059
159 HD2 LYS 117 1HD LYS 117 4.853 -0.397 2.590
160 HD3 LYS 117 2HD LYS 117 4.176 0.041 4.160
161 HE2 LYS 117 1HE LYS 117 2.914 0.649 1.488
162 HE3 LYS 117 2HE LYS 117 2.459 -0.688 2.543
163 HZ1 LYS 117 3HZ LYS 117 1.763 0.856 4.216
164 HZ2 LYS 117 1HZ LYS 117 1.008 1.275 2.761
165 HZ3 LYS 117 2HZ LYS 117 2.327 2.175 3.319
166 H GLY 118 H GLY 118 7.920 3.811 2.021
167 HA2 GLY 118 1HA GLY 118 6.124 5.284 0.563
168 HA3 GLY 118 2HA GLY 118 7.816 5.722 0.744
169 H ASN 119 H ASN 119 9.263 4.175 -0.724
170 HA ASN 119 HA ASN 119 9.099 4.970 -3.295
171 HB2 ASN 119 1HB ASN 119 10.836 3.425 -2.057
172 HB3 ASN 119 2HB ASN 119 9.925 2.131 -2.829
173 HD21 ASN 119 1HD2 ASN 119 12.403 2.182 -3.559
174 HD22 ASN 119 2HD2 ASN 119 12.633 2.891 -5.117
175 H LEU 120 H LEU 120 7.669 1.953 -2.057
176 HA LEU 120 HA LEU 120 6.463 1.202 -4.499
177 HB2 LEU 120 1HB LEU 120 6.757 -0.505 -2.931
178 HB3 LEU 120 2HB LEU 120 6.022 0.437 -1.635
179 HG LEU 120 HG LEU 120 3.822 0.127 -2.641
180 HD11 LEU 120 1HD1 LEU 120 4.825 -0.061 -4.997
181 HD12 LEU 120 2HD1 LEU 120 3.423 -1.056 -4.605
182 HD13 LEU 120 3HD1 LEU 120 5.036 -1.770 -4.617
183 HD21 LEU 120 3HD2 LEU 120 3.760 -2.426 -2.442
184 HD22 LEU 120 1HD2 LEU 120 4.314 -1.506 -1.043
185 HD23 LEU 120 2HD2 LEU 120 5.485 -2.310 -2.089
186 H VAL 121 H VAL 121 5.103 2.740 -1.588
187 HA VAL 121 HA VAL 121 2.487 3.019 -2.296
188 HB VAL 121 HB VAL 121 4.187 5.120 -0.944
189 HG11 VAL 121 1HG1 VAL 121 1.211 4.769 -0.698
190 HG12 VAL 121 2HG1 VAL 121 2.205 6.117 -0.142
191 HG13 VAL 121 3HG1 VAL 121 1.945 5.864 -1.869
192 HG21 VAL 121 3HG2 VAL 121 2.368 3.427 0.628
193 HG22 VAL 121 1HG2 VAL 121 3.748 2.590 -0.083
194 HG23 VAL 121 2HG2 VAL 121 4.008 3.969 0.985
195 H THR 122 H THR 122 5.137 5.202 -3.216
196 HA THR 122 HA THR 122 3.597 7.036 -4.672
197 HB THR 122 HB THR 122 6.504 6.279 -4.790
198 HG1 THR 122 1HG THR 122 5.496 8.848 -4.267
199 HG21 THR 122 3HG2 THR 122 6.002 6.878 -7.057
200 HG22 THR 122 1HG2 THR 122 6.805 8.254 -6.301
201 HG23 THR 122 2HG2 THR 122 5.056 8.271 -6.535
202 H HIS 123 H HIS 123 4.970 3.936 -5.553
203 HA HIS 123 HA HIS 123 4.589 4.203 -8.362
204 HB2 HIS 123 1HB HIS 123 6.144 2.563 -7.840
205 HB3 HIS 123 2HB HIS 123 5.184 1.931 -6.506
206 HD1 HIS 123 1HD HIS 123 5.563 1.727 -10.224
207 HD2 HIS 123 2HD HIS 123 3.311 -0.018 -7.200
208 HE1 HIS 123 1HE HIS 123 4.432 -0.252 -11.286
209 H GLN 124 H GLN 124 2.733 2.586 -5.797
210 HA GLN 124 HA GLN 124 0.723 1.454 -7.297
211 HB2 GLN 124 1HB GLN 124 0.068 2.825 -4.712
212 HB3 GLN 124 2HB GLN 124 -0.522 1.289 -5.331
213 HG2 GLN 124 1HG GLN 124 2.013 0.613 -5.101
214 HG3 GLN 124 2HG GLN 124 2.010 1.921 -3.920
215 HE21 GLN 124 1HE2 GLN 124 1.415 -1.321 -4.430
216 HE22 GLN 124 2HE2 GLN 124 0.552 -1.666 -2.974
217 H ARG 125 H ARG 125 1.121 4.808 -6.339
218 HA ARG 125 HA ARG 125 -1.373 5.850 -6.838
219 HB2 ARG 125 1HB ARG 125 1.294 7.099 -7.523
220 HB3 ARG 125 2HB ARG 125 -0.230 7.967 -7.389
221 HG2 ARG 125 1HG ARG 125 -0.368 7.311 -5.021
222 HG3 ARG 125 2HG ARG 125 1.201 6.517 -5.173
223 HD2 ARG 125 1HD ARG 125 2.343 8.496 -5.314
224 HD3 ARG 125 2HD ARG 125 0.973 9.361 -6.009
225 HE ARG 125 HE ARG 125 1.563 8.993 -3.205
226 HH11 ARG 125 2HH1 ARG 125 -0.846 9.802 -5.584
227 HH12 ARG 125 1HH1 ARG 125 -1.848 10.668 -4.466
228 HH21 ARG 125 2HH2 ARG 125 0.254 10.130 -1.723
229 HH22 ARG 125 1HH2 ARG 125 -1.220 10.854 -2.270
230 H ILE 126 H ILE 126 0.838 4.478 -9.077
231 HA ILE 126 HA ILE 126 -0.120 5.782 -11.427
232 HB ILE 126 HB ILE 126 1.235 4.331 -12.663
233 HG12 ILE 126 1HG1 ILE 126 1.054 2.420 -10.327
234 HG13 ILE 126 2HG1 ILE 126 0.353 2.205 -11.927
235 HG21 ILE 126 1HG2 ILE 126 2.998 5.329 -11.749
236 HG22 ILE 126 2HG2 ILE 126 2.246 5.335 -10.154
237 HG23 ILE 126 3HG2 ILE 126 3.158 3.925 -10.694
238 HD11 ILE 126 3HD1 ILE 126 2.211 0.866 -12.033
239 HD12 ILE 126 1HD1 ILE 126 2.819 2.369 -12.728
240 HD13 ILE 126 2HD1 ILE 126 3.188 1.959 -11.053
241 H HIS 127 H HIS 127 -1.013 2.890 -9.662
242 HA HIS 127 HA HIS 127 -2.714 1.829 -11.699
243 HB2 HIS 127 1HB HIS 127 -2.443 1.244 -8.750
244 HB3 HIS 127 2HB HIS 127 -3.579 0.394 -9.793
245 HD1 HIS 127 1HD HIS 127 -2.474 -1.032 -11.770
246 HD2 HIS 127 2HD HIS 127 0.121 0.290 -8.807
247 HE1 HIS 127 1HE HIS 127 -0.394 -2.420 -12.030
248 H THR 128 H THR 128 -3.362 3.457 -8.595
249 HA THR 128 HA THR 128 -6.023 3.575 -8.445
250 HB THR 128 HB THR 128 -5.897 5.809 -7.472
251 HG1 THR 128 1HG THR 128 -3.539 5.894 -8.968
252 HG21 THR 128 3HG2 THR 128 -4.949 3.742 -6.301
253 HG22 THR 128 1HG2 THR 128 -4.454 5.316 -5.680
254 HG23 THR 128 2HG2 THR 128 -3.359 4.389 -6.706
255 H GLY 129 H GLY 129 -7.565 3.869 -9.910
256 HA2 GLY 129 1HA GLY 129 -7.233 4.976 -12.443
257 HA3 GLY 129 2HA GLY 129 -8.781 4.768 -11.637
258 H GLU 130 H GLU 130 -9.669 6.493 -10.449
259 HA GLU 130 HA GLU 130 -10.242 8.680 -10.169
260 HB2 GLU 130 1HB GLU 130 -7.240 8.864 -9.918
261 HB3 GLU 130 2HB GLU 130 -8.314 10.220 -9.606
262 HG2 GLU 130 1HG GLU 130 -8.526 7.588 -8.174
263 HG3 GLU 130 2HG GLU 130 -7.558 8.940 -7.589
264 H LYS 131 H LYS 131 -10.188 7.857 -12.825
265 HA LYS 131 HA LYS 131 -10.022 10.381 -14.153
266 HB2 LYS 131 1HB LYS 131 -7.624 9.356 -14.125
267 HB3 LYS 131 2HB LYS 131 -8.257 8.276 -15.361
268 HG2 LYS 131 1HG LYS 131 -8.696 10.079 -16.836
269 HG3 LYS 131 2HG LYS 131 -8.397 11.272 -15.570
270 HD2 LYS 131 1HD LYS 131 -6.110 10.990 -15.661
271 HD3 LYS 131 2HD LYS 131 -6.232 9.354 -16.311
272 HE2 LYS 131 1HE LYS 131 -7.170 11.698 -17.918
273 HE3 LYS 131 2HE LYS 131 -5.455 11.293 -17.854
274 HZ1 LYS 131 3HZ LYS 131 -6.053 9.036 -18.607
275 HZ2 LYS 131 1HZ LYS 131 -6.442 10.232 -19.739
276 HZ3 LYS 131 2HZ LYS 131 -7.658 9.538 -18.790
277 H SER 132 H SER 132 -11.954 10.292 -15.101
278 HA SER 132 HA SER 132 -12.824 7.789 -16.353
279 HB2 SER 132 1HB SER 132 -15.065 8.866 -16.423
280 HB3 SER 132 2HB SER 132 -14.413 8.760 -14.788
281 HG SER 132 HG SER 132 -13.932 10.922 -14.848
282 H GLY 133 H GLY 133 -12.076 7.646 -18.384
283 HA2 GLY 133 1HA GLY 133 -12.368 8.127 -20.679
284 HA3 GLY 133 2HA GLY 133 -12.849 9.762 -20.251
285 HA PRO 134 HA PRO 134 -8.166 9.261 -21.294
286 HB2 PRO 134 1HB PRO 134 -8.176 9.508 -23.998
287 HB3 PRO 134 2HB PRO 134 -8.241 7.944 -23.175
288 HG2 PRO 134 1HG PRO 134 -10.467 9.550 -24.370
289 HG3 PRO 134 2HG PRO 134 -10.171 7.804 -24.465
290 HD2 PRO 134 1HD PRO 134 -11.975 8.884 -22.759
291 HD3 PRO 134 2HD PRO 134 -11.060 7.411 -22.376
292 H SER 135 H SER 135 -7.080 11.128 -21.164
293 HA SER 135 HA SER 135 -8.469 13.612 -21.675
294 HB2 SER 135 1HB SER 135 -5.954 12.810 -20.294
295 HB3 SER 135 2HB SER 135 -6.057 14.461 -20.904
296 HG SER 135 HG SER 135 -6.928 13.771 -18.654
297 H SER 136 H SER 136 -8.632 13.380 -23.991
298 HA SER 136 HA SER 136 -7.883 13.486 -26.170
299 HB2 SER 136 1HB SER 136 -8.054 15.837 -25.441
300 HB3 SER 136 2HB SER 136 -6.370 15.792 -24.917
301 HG SER 136 HG SER 136 -6.124 16.524 -26.904
302 H GLY 137 H GLY 137 -6.413 11.549 -24.807
303 HA2 GLY 137 1HA GLY 137 -3.622 11.855 -24.954
304 HA3 GLY 137 2HA GLY 137 -4.481 10.322 -24.968
Start of MODEL 11
1 H1 GLY 93 H GLY 93 29.670 -23.206 -13.910
2 HA2 GLY 93 1HA GLY 93 27.526 -22.584 -13.104
3 HA3 GLY 93 2HA GLY 93 28.150 -21.109 -13.827
4 H SER 94 H SER 94 25.381 -21.980 -13.501
5 HA SER 94 HA SER 94 24.586 -21.803 -16.323
6 HB2 SER 94 1HB SER 94 24.211 -24.109 -15.767
7 HB3 SER 94 2HB SER 94 23.436 -23.674 -14.244
8 HG SER 94 HG SER 94 22.459 -23.086 -16.845
9 H SER 95 H SER 95 23.541 -21.491 -12.946
10 HA SER 95 HA SER 95 21.178 -20.120 -13.287
11 HB2 SER 95 1HB SER 95 21.676 -19.079 -11.045
12 HB3 SER 95 2HB SER 95 21.837 -20.834 -11.090
13 HG SER 95 HG SER 95 24.044 -20.621 -11.136
14 H GLY 96 H GLY 96 20.793 -17.758 -12.755
15 HA2 GLY 96 1HA GLY 96 22.846 -15.872 -13.430
16 HA3 GLY 96 2HA GLY 96 21.704 -16.110 -14.744
17 H SER 97 H SER 97 19.354 -15.894 -14.103
18 HA SER 97 HA SER 97 18.812 -13.346 -13.217
19 HB2 SER 97 1HB SER 97 17.248 -14.938 -14.434
20 HB3 SER 97 2HB SER 97 16.894 -15.654 -12.862
21 HG SER 97 HG SER 97 15.745 -13.569 -13.918
22 H SER 98 H SER 98 19.739 -12.701 -11.327
23 HA SER 98 HA SER 98 18.771 -14.030 -8.883
24 HB2 SER 98 1HB SER 98 20.885 -13.626 -7.799
25 HB3 SER 98 2HB SER 98 21.209 -14.444 -9.327
26 HG SER 98 HG SER 98 21.457 -11.669 -8.785
27 H GLY 99 H GLY 99 17.274 -12.697 -8.078
28 HA2 GLY 99 1HA GLY 99 17.867 -10.276 -6.879
29 HA3 GLY 99 2HA GLY 99 17.283 -9.878 -8.487
30 H THR 100 H THR 100 15.180 -11.081 -9.075
31 HA THR 100 HA THR 100 13.196 -10.273 -7.224
32 HB THR 100 HB THR 100 12.755 -10.288 -9.628
33 HG1 THR 100 1HG THR 100 10.744 -11.728 -9.411
34 HG21 THR 100 3HG2 THR 100 12.373 -12.405 -10.814
35 HG22 THR 100 1HG2 THR 100 12.889 -13.296 -9.384
36 HG23 THR 100 2HG2 THR 100 14.037 -12.272 -10.246
37 H GLY 101 H GLY 101 12.009 -11.392 -5.757
38 HA2 GLY 101 1HA GLY 101 11.650 -14.165 -5.669
39 HA3 GLY 101 2HA GLY 101 13.049 -13.781 -4.677
40 H GLN 102 H GLN 102 12.382 -11.482 -3.443
41 HA GLN 102 HA GLN 102 9.744 -11.425 -2.402
42 HB2 GLN 102 1HB GLN 102 10.923 -13.520 -1.355
43 HB3 GLN 102 2HB GLN 102 11.716 -12.325 -0.338
44 HG2 GLN 102 1HG GLN 102 8.764 -12.197 -0.592
45 HG3 GLN 102 2HG GLN 102 9.463 -13.496 0.372
46 HE21 GLN 102 1HE2 GLN 102 8.005 -10.758 0.790
47 HE22 GLN 102 2HE2 GLN 102 8.871 -10.082 2.123
48 H LYS 103 H LYS 103 9.355 -9.539 -1.352
49 HA LYS 103 HA LYS 103 11.606 -7.970 -0.350
50 HB2 LYS 103 1HB LYS 103 9.827 -7.212 -2.632
51 HB3 LYS 103 2HB LYS 103 10.415 -5.954 -1.553
52 HG2 LYS 103 1HG LYS 103 12.063 -5.902 -3.110
53 HG3 LYS 103 2HG LYS 103 12.735 -7.130 -2.034
54 HD2 LYS 103 1HD LYS 103 11.918 -8.893 -3.453
55 HD3 LYS 103 2HD LYS 103 11.057 -7.734 -4.468
56 HE2 LYS 103 1HE LYS 103 12.971 -8.141 -5.701
57 HE3 LYS 103 2HE LYS 103 13.403 -6.681 -4.812
58 HZ1 LYS 103 3HZ LYS 103 14.949 -7.763 -3.620
59 HZ2 LYS 103 1HZ LYS 103 14.917 -8.872 -4.897
60 HZ3 LYS 103 2HZ LYS 103 14.036 -9.181 -3.487
61 HA PRO 104 HA PRO 104 8.826 -6.805 2.840
62 HB2 PRO 104 1HB PRO 104 9.684 -4.296 3.424
63 HB3 PRO 104 2HB PRO 104 10.600 -5.747 3.848
64 HG2 PRO 104 1HG PRO 104 10.970 -3.882 1.536
65 HG3 PRO 104 2HG PRO 104 12.194 -4.615 2.589
66 HD2 PRO 104 1HD PRO 104 11.633 -5.573 0.119
67 HD3 PRO 104 2HD PRO 104 12.146 -6.622 1.456
68 H PHE 105 H PHE 105 8.783 -5.295 -0.170
69 HA PHE 105 HA PHE 105 6.101 -4.312 0.279
70 HB2 PHE 105 1HB PHE 105 8.163 -2.386 -0.794
71 HB3 PHE 105 2HB PHE 105 6.487 -2.047 -0.373
72 HD1 PHE 105 2HD PHE 105 5.806 -2.165 2.051
73 HD2 PHE 105 1HD PHE 105 9.871 -2.190 0.790
74 HE1 PHE 105 2HE PHE 105 6.508 -1.502 4.314
75 HE2 PHE 105 1HE PHE 105 10.580 -1.529 3.051
76 HZ PHE 105 HZ PHE 105 8.898 -1.182 4.816
77 H GLU 106 H GLU 106 5.164 -5.466 -1.296
78 HA GLU 106 HA GLU 106 6.279 -5.222 -4.013
79 HB2 GLU 106 1HB GLU 106 6.360 -7.531 -2.872
80 HB3 GLU 106 2HB GLU 106 4.617 -7.557 -3.099
81 HG2 GLU 106 1HG GLU 106 4.832 -7.496 -5.456
82 HG3 GLU 106 2HG GLU 106 6.553 -7.129 -5.355
83 H CYS 107 H CYS 107 4.863 -4.849 -5.696
84 HA CYS 107 HA CYS 107 2.271 -3.778 -4.906
85 HB2 CYS 107 1HB CYS 107 3.854 -2.499 -6.391
86 HB3 CYS 107 2HB CYS 107 3.564 -3.710 -7.636
87 H THR 108 H THR 108 1.486 -5.997 -4.454
88 HA THR 108 HA THR 108 1.200 -8.133 -6.030
89 HB THR 108 HB THR 108 0.078 -7.969 -3.866
90 HG1 THR 108 1HG THR 108 -0.937 -9.604 -4.760
91 HG21 THR 108 3HG2 THR 108 -2.063 -6.819 -3.636
92 HG22 THR 108 1HG2 THR 108 -1.951 -6.250 -5.300
93 HG23 THR 108 2HG2 THR 108 -0.795 -5.683 -4.095
94 H HIS 109 H HIS 109 -0.508 -5.082 -6.493
95 HA HIS 109 HA HIS 109 -2.399 -5.665 -8.345
96 HB2 HIS 109 1HB HIS 109 -0.484 -3.328 -8.343
97 HB3 HIS 109 2HB HIS 109 -1.912 -3.420 -9.369
98 HD2 HIS 109 2HD HIS 109 -0.958 -2.109 -5.980
99 HE1 HIS 109 1HE HIS 109 -5.163 -2.661 -5.855
100 HE2 HIS 109 2HE HIS 109 -3.174 -1.568 -4.761
101 H CYS 110 H CYS 110 0.950 -4.802 -9.232
102 HA CYS 110 HA CYS 110 0.577 -6.331 -11.723
103 HB2 CYS 110 1HB CYS 110 2.320 -4.902 -12.704
104 HB3 CYS 110 2HB CYS 110 0.966 -3.946 -12.113
105 H GLY 111 H GLY 111 2.882 -5.555 -9.144
106 HA2 GLY 111 1HA GLY 111 3.970 -7.660 -8.253
107 HA3 GLY 111 2HA GLY 111 4.431 -7.945 -9.924
108 H LYS 112 H LYS 112 4.448 -4.667 -9.031
109 HA LYS 112 HA LYS 112 7.284 -4.494 -9.375
110 HB2 LYS 112 1HB LYS 112 5.465 -2.760 -10.002
111 HB3 LYS 112 2HB LYS 112 5.561 -2.271 -8.315
112 HG2 LYS 112 1HG LYS 112 7.035 -0.814 -9.281
113 HG3 LYS 112 2HG LYS 112 8.122 -2.122 -8.809
114 HD2 LYS 112 1HD LYS 112 8.275 -2.936 -11.006
115 HD3 LYS 112 2HD LYS 112 6.857 -2.025 -11.532
116 HE2 LYS 112 1HE LYS 112 8.077 0.059 -11.293
117 HE3 LYS 112 2HE LYS 112 9.480 -0.808 -10.671
118 HZ1 LYS 112 3HZ LYS 112 9.921 -0.400 -12.924
119 HZ2 LYS 112 1HZ LYS 112 8.370 -0.868 -13.414
120 HZ3 LYS 112 2HZ LYS 112 9.468 -2.029 -12.862
121 H SER 113 H SER 113 8.735 -4.902 -7.856
122 HA SER 113 HA SER 113 7.955 -4.792 -5.044
123 HB2 SER 113 1HB SER 113 9.965 -6.064 -4.599
124 HB3 SER 113 2HB SER 113 9.119 -6.811 -5.954
125 HG SER 113 HG SER 113 11.083 -6.662 -6.771
126 H PHE 114 H PHE 114 9.482 -3.864 -3.470
127 HA PHE 114 HA PHE 114 11.284 -1.815 -4.459
128 HB2 PHE 114 1HB PHE 114 8.863 -1.139 -2.776
129 HB3 PHE 114 2HB PHE 114 10.195 -0.034 -3.101
130 HD1 PHE 114 2HD PHE 114 7.438 -1.926 -4.667
131 HD2 PHE 114 1HD PHE 114 10.307 1.186 -5.110
132 HE1 PHE 114 2HE PHE 114 6.321 -1.195 -6.734
133 HE2 PHE 114 1HE PHE 114 9.194 1.923 -7.176
134 HZ PHE 114 HZ PHE 114 7.199 0.732 -7.992
135 H ARG 115 H ARG 115 12.243 -0.588 -2.490
136 HA ARG 115 HA ARG 115 13.054 -2.632 -0.572
137 HB2 ARG 115 1HB ARG 115 14.204 -0.046 -1.523
138 HB3 ARG 115 2HB ARG 115 14.658 -0.628 0.073
139 HG2 ARG 115 1HG ARG 115 15.441 -2.726 -0.922
140 HG3 ARG 115 2HG ARG 115 15.009 -2.115 -2.521
141 HD2 ARG 115 1HD ARG 115 16.986 -0.816 -0.650
142 HD3 ARG 115 2HD ARG 115 17.417 -1.874 -1.993
143 HE ARG 115 HE ARG 115 15.797 0.248 -2.913
144 HH11 ARG 115 2HH1 ARG 115 19.017 -0.426 -1.771
145 HH12 ARG 115 1HH1 ARG 115 19.744 0.872 -2.660
146 HH21 ARG 115 2HH2 ARG 115 16.743 1.960 -4.087
147 HH22 ARG 115 1HH2 ARG 115 18.449 2.229 -3.976
148 H ALA 116 H ALA 116 11.650 0.612 -0.655
149 HA ALA 116 HA ALA 116 10.958 0.307 2.195
150 HB1 ALA 116 3HB ALA 116 11.003 2.706 2.413
151 HB2 ALA 116 1HB ALA 116 12.532 2.158 1.726
152 HB3 ALA 116 2HB ALA 116 11.311 2.894 0.687
153 H LYS 117 H LYS 117 8.922 1.301 2.862
154 HA LYS 117 HA LYS 117 6.760 0.480 1.282
155 HB2 LYS 117 1HB LYS 117 6.690 0.747 3.748
156 HB3 LYS 117 2HB LYS 117 6.738 2.493 3.539
157 HG2 LYS 117 1HG LYS 117 4.493 2.102 3.846
158 HG3 LYS 117 2HG LYS 117 4.621 2.121 2.086
159 HD2 LYS 117 1HD LYS 117 4.355 -0.169 1.912
160 HD3 LYS 117 2HD LYS 117 4.904 -0.462 3.564
161 HE2 LYS 117 1HE LYS 117 2.345 0.993 2.955
162 HE3 LYS 117 2HE LYS 117 2.418 -0.764 3.088
163 HZ1 LYS 117 3HZ LYS 117 3.482 0.941 5.244
164 HZ2 LYS 117 1HZ LYS 117 2.934 -0.657 5.323
165 HZ3 LYS 117 2HZ LYS 117 1.825 0.609 5.156
166 H GLY 118 H GLY 118 7.858 3.794 2.032
167 HA2 GLY 118 1HA GLY 118 6.077 5.257 0.561
168 HA3 GLY 118 2HA GLY 118 7.763 5.709 0.757
169 H ASN 119 H ASN 119 9.219 4.134 -0.708
170 HA ASN 119 HA ASN 119 9.071 4.964 -3.278
171 HB2 ASN 119 1HB ASN 119 10.082 2.326 -2.213
172 HB3 ASN 119 2HB ASN 119 10.312 2.828 -3.885
173 HD21 ASN 119 1HD2 ASN 119 12.509 2.309 -2.510
174 HD22 ASN 119 2HD2 ASN 119 13.345 3.757 -2.075
175 H LEU 120 H LEU 120 7.660 1.928 -2.066
176 HA LEU 120 HA LEU 120 6.474 1.183 -4.520
177 HB2 LEU 120 1HB LEU 120 6.767 -0.540 -2.976
178 HB3 LEU 120 2HB LEU 120 6.043 0.390 -1.665
179 HG LEU 120 HG LEU 120 3.834 0.101 -2.688
180 HD11 LEU 120 1HD1 LEU 120 5.067 -1.834 -4.617
181 HD12 LEU 120 2HD1 LEU 120 4.838 -0.136 -5.032
182 HD13 LEU 120 3HD1 LEU 120 3.446 -1.139 -4.624
183 HD21 LEU 120 3HD2 LEU 120 4.395 -1.496 -1.035
184 HD22 LEU 120 1HD2 LEU 120 5.446 -2.380 -2.141
185 HD23 LEU 120 2HD2 LEU 120 3.698 -2.402 -2.379
186 H VAL 121 H VAL 121 5.141 2.773 -1.632
187 HA VAL 121 HA VAL 121 2.505 3.007 -2.325
188 HB VAL 121 HB VAL 121 4.202 5.122 -0.992
189 HG11 VAL 121 1HG1 VAL 121 2.384 6.404 -1.150
190 HG12 VAL 121 2HG1 VAL 121 1.391 5.062 -1.724
191 HG13 VAL 121 3HG1 VAL 121 1.634 5.303 0.006
192 HG21 VAL 121 3HG2 VAL 121 3.544 2.549 -0.141
193 HG22 VAL 121 1HG2 VAL 121 4.175 3.868 0.846
194 HG23 VAL 121 2HG2 VAL 121 2.434 3.615 0.721
195 H THR 122 H THR 122 5.146 5.180 -3.288
196 HA THR 122 HA THR 122 3.577 6.990 -4.756
197 HB THR 122 HB THR 122 6.497 6.281 -4.852
198 HG1 THR 122 1HG THR 122 5.320 7.701 -3.211
199 HG21 THR 122 3HG2 THR 122 6.761 8.264 -6.370
200 HG22 THR 122 1HG2 THR 122 5.018 8.220 -6.627
201 HG23 THR 122 2HG2 THR 122 6.016 6.854 -7.123
202 H HIS 123 H HIS 123 5.013 3.908 -5.602
203 HA HIS 123 HA HIS 123 4.658 4.136 -8.413
204 HB2 HIS 123 1HB HIS 123 6.212 2.508 -7.843
205 HB3 HIS 123 2HB HIS 123 5.228 1.884 -6.523
206 HD1 HIS 123 1HD HIS 123 5.627 1.688 -10.249
207 HD2 HIS 123 2HD HIS 123 3.429 -0.116 -7.220
208 HE1 HIS 123 1HE HIS 123 4.536 -0.313 -11.311
209 H GLN 124 H GLN 124 2.768 2.546 -5.856
210 HA GLN 124 HA GLN 124 0.781 1.403 -7.391
211 HB2 GLN 124 1HB GLN 124 0.089 2.746 -4.803
212 HB3 GLN 124 2HB GLN 124 -0.475 1.207 -5.438
213 HG2 GLN 124 1HG GLN 124 2.071 0.569 -5.184
214 HG3 GLN 124 2HG GLN 124 2.027 1.862 -3.986
215 HE21 GLN 124 1HE2 GLN 124 2.128 0.772 -2.125
216 HE22 GLN 124 2HE2 GLN 124 1.005 -0.441 -1.624
217 H ARG 125 H ARG 125 1.224 4.752 -6.495
218 HA ARG 125 HA ARG 125 -1.296 5.789 -6.983
219 HB2 ARG 125 1HB ARG 125 1.349 7.087 -7.664
220 HB3 ARG 125 2HB ARG 125 -0.184 7.917 -7.427
221 HG2 ARG 125 1HG ARG 125 -0.213 7.195 -5.091
222 HG3 ARG 125 2HG ARG 125 1.331 6.375 -5.331
223 HD2 ARG 125 1HD ARG 125 1.846 8.454 -4.337
224 HD3 ARG 125 2HD ARG 125 2.260 8.616 -6.043
225 HE ARG 125 HE ARG 125 -0.309 9.536 -5.857
226 HH11 ARG 125 2HH1 ARG 125 2.725 10.328 -4.344
227 HH12 ARG 125 1HH1 ARG 125 2.323 11.998 -4.115
228 HH21 ARG 125 2HH2 ARG 125 -0.848 11.732 -5.562
229 HH22 ARG 125 1HH2 ARG 125 0.291 12.795 -4.808
230 H ILE 126 H ILE 126 0.917 4.395 -9.185
231 HA ILE 126 HA ILE 126 0.010 5.734 -11.544
232 HB ILE 126 HB ILE 126 1.388 4.293 -12.770
233 HG12 ILE 126 1HG1 ILE 126 1.149 2.376 -10.448
234 HG13 ILE 126 2HG1 ILE 126 0.537 2.155 -12.083
235 HG21 ILE 126 1HG2 ILE 126 3.269 3.896 -10.738
236 HG22 ILE 126 2HG2 ILE 126 3.155 5.266 -11.843
237 HG23 ILE 126 3HG2 ILE 126 2.357 5.331 -10.272
238 HD11 ILE 126 3HD1 ILE 126 3.316 1.921 -11.050
239 HD12 ILE 126 1HD1 ILE 126 2.412 0.846 -12.116
240 HD13 ILE 126 2HD1 ILE 126 3.053 2.368 -12.736
241 H HIS 127 H HIS 127 -0.924 2.855 -9.794
242 HA HIS 127 HA HIS 127 -2.635 1.868 -11.893
243 HB2 HIS 127 1HB HIS 127 -2.323 1.053 -8.999
244 HB3 HIS 127 2HB HIS 127 -3.368 0.227 -10.151
245 HD1 HIS 127 1HD HIS 127 -2.031 -0.780 -12.313
246 HD2 HIS 127 2HD HIS 127 0.221 0.110 -8.937
247 HE1 HIS 127 1HE HIS 127 0.125 -2.045 -12.590
248 H THR 128 H THR 128 -3.081 3.470 -8.761
249 HA THR 128 HA THR 128 -5.741 3.465 -8.378
250 HB THR 128 HB THR 128 -5.599 5.724 -7.426
251 HG1 THR 128 1HG THR 128 -2.982 5.776 -8.559
252 HG21 THR 128 3HG2 THR 128 -4.807 4.201 -5.883
253 HG22 THR 128 1HG2 THR 128 -3.420 5.277 -6.040
254 HG23 THR 128 2HG2 THR 128 -3.438 3.732 -6.890
255 H GLY 129 H GLY 129 -7.572 4.353 -9.222
256 HA2 GLY 129 1HA GLY 129 -7.260 5.693 -11.827
257 HA3 GLY 129 2HA GLY 129 -8.671 4.774 -11.322
258 H GLU 130 H GLU 130 -6.793 7.626 -10.291
259 HA GLU 130 HA GLU 130 -9.357 8.997 -9.816
260 HB2 GLU 130 1HB GLU 130 -6.850 9.008 -8.148
261 HB3 GLU 130 2HB GLU 130 -8.040 10.297 -8.035
262 HG2 GLU 130 1HG GLU 130 -8.237 8.477 -6.323
263 HG3 GLU 130 2HG GLU 130 -9.703 8.828 -7.237
264 H LYS 131 H LYS 131 -8.015 9.087 -12.255
265 HA LYS 131 HA LYS 131 -7.295 11.925 -12.347
266 HB2 LYS 131 1HB LYS 131 -5.608 9.625 -13.186
267 HB3 LYS 131 2HB LYS 131 -5.613 11.040 -14.230
268 HG2 LYS 131 1HG LYS 131 -5.207 11.476 -11.326
269 HG3 LYS 131 2HG LYS 131 -3.887 10.754 -12.248
270 HD2 LYS 131 1HD LYS 131 -3.370 12.956 -12.535
271 HD3 LYS 131 2HD LYS 131 -4.459 12.743 -13.907
272 HE2 LYS 131 1HE LYS 131 -4.967 14.783 -12.645
273 HE3 LYS 131 2HE LYS 131 -6.306 13.637 -12.605
274 HZ1 LYS 131 3HZ LYS 131 -4.707 13.065 -10.417
275 HZ2 LYS 131 1HZ LYS 131 -6.245 13.771 -10.410
276 HZ3 LYS 131 2HZ LYS 131 -4.865 14.749 -10.448
277 H SER 132 H SER 132 -7.575 12.901 -14.439
278 HA SER 132 HA SER 132 -9.705 11.596 -15.957
279 HB2 SER 132 1HB SER 132 -10.140 13.806 -16.903
280 HB3 SER 132 2HB SER 132 -10.073 13.905 -15.144
281 HG SER 132 HG SER 132 -8.145 14.906 -15.256
282 H GLY 133 H GLY 133 -9.636 11.320 -18.196
283 HA2 GLY 133 1HA GLY 133 -7.553 12.159 -19.881
284 HA3 GLY 133 2HA GLY 133 -7.159 10.556 -19.280
285 HA PRO 134 HA PRO 134 -10.418 10.615 -22.833
286 HB2 PRO 134 1HB PRO 134 -8.825 10.616 -25.031
287 HB3 PRO 134 2HB PRO 134 -9.468 12.096 -24.311
288 HG2 PRO 134 1HG PRO 134 -6.757 10.864 -24.006
289 HG3 PRO 134 2HG PRO 134 -7.192 12.567 -24.241
290 HD2 PRO 134 1HD PRO 134 -6.560 11.547 -21.814
291 HD3 PRO 134 2HD PRO 134 -7.728 12.867 -22.019
292 H SER 135 H SER 135 -10.677 8.490 -21.995
293 HA SER 135 HA SER 135 -8.808 6.421 -22.759
294 HB2 SER 135 1HB SER 135 -9.865 6.223 -20.593
295 HB3 SER 135 2HB SER 135 -11.469 6.312 -21.321
296 HG SER 135 HG SER 135 -11.166 4.314 -22.220
297 H SER 136 H SER 136 -8.800 5.740 -24.796
298 HA SER 136 HA SER 136 -10.952 6.017 -26.598
299 HB2 SER 136 1HB SER 136 -8.611 5.855 -27.339
300 HB3 SER 136 2HB SER 136 -8.545 4.185 -26.773
301 HG SER 136 HG SER 136 -8.972 4.297 -29.011
302 H GLY 137 H GLY 137 -9.675 3.161 -24.896
303 HA2 GLY 137 1HA GLY 137 -11.457 1.272 -25.908
304 HA3 GLY 137 2HA GLY 137 -10.666 1.167 -24.342
Start of MODEL 12
1 H1 GLY 93 H GLY 93 6.420 -8.346 -20.684
2 HA2 GLY 93 1HA GLY 93 9.346 -8.337 -20.268
3 HA3 GLY 93 2HA GLY 93 8.188 -8.860 -19.054
4 H SER 94 H SER 94 9.083 -10.902 -18.825
5 HA SER 94 HA SER 94 8.816 -12.664 -21.173
6 HB2 SER 94 1HB SER 94 10.789 -12.688 -18.898
7 HB3 SER 94 2HB SER 94 10.482 -14.134 -19.860
8 HG SER 94 HG SER 94 10.990 -11.773 -21.243
9 H SER 95 H SER 95 8.425 -14.999 -20.547
10 HA SER 95 HA SER 95 6.281 -15.055 -18.548
11 HB2 SER 95 1HB SER 95 5.479 -17.047 -19.683
12 HB3 SER 95 2HB SER 95 5.759 -15.778 -20.875
13 HG SER 95 HG SER 95 7.553 -17.893 -20.262
14 H GLY 96 H GLY 96 6.500 -16.109 -16.683
15 HA2 GLY 96 1HA GLY 96 7.313 -17.535 -15.072
16 HA3 GLY 96 2HA GLY 96 8.010 -18.493 -16.370
17 H SER 97 H SER 97 8.576 -15.217 -15.074
18 HA SER 97 HA SER 97 11.316 -15.178 -15.608
19 HB2 SER 97 1HB SER 97 11.427 -13.235 -14.206
20 HB3 SER 97 2HB SER 97 9.863 -13.198 -15.020
21 HG SER 97 HG SER 97 10.431 -13.364 -12.365
22 H SER 98 H SER 98 13.074 -15.935 -14.586
23 HA SER 98 HA SER 98 13.040 -18.053 -12.870
24 HB2 SER 98 1HB SER 98 15.117 -15.912 -13.292
25 HB3 SER 98 2HB SER 98 15.397 -17.258 -12.187
26 HG SER 98 HG SER 98 14.611 -17.614 -14.885
27 H GLY 99 H GLY 99 13.423 -14.637 -11.934
28 HA2 GLY 99 1HA GLY 99 12.272 -13.759 -10.011
29 HA3 GLY 99 2HA GLY 99 12.367 -15.354 -9.280
30 H THR 100 H THR 100 13.150 -12.926 -8.033
31 HA THR 100 HA THR 100 16.056 -13.364 -7.789
32 HB THR 100 HB THR 100 15.607 -11.157 -8.738
33 HG1 THR 100 1HG THR 100 16.877 -10.044 -7.284
34 HG21 THR 100 3HG2 THR 100 13.335 -11.130 -7.286
35 HG22 THR 100 1HG2 THR 100 14.082 -9.678 -7.952
36 HG23 THR 100 2HG2 THR 100 14.363 -10.122 -6.268
37 H GLY 101 H GLY 101 13.001 -13.081 -6.186
38 HA2 GLY 101 1HA GLY 101 13.372 -14.470 -3.971
39 HA3 GLY 101 2HA GLY 101 14.243 -13.006 -3.541
40 H GLN 102 H GLN 102 13.096 -11.682 -2.318
41 HA GLN 102 HA GLN 102 10.449 -10.874 -3.051
42 HB2 GLN 102 1HB GLN 102 10.345 -13.141 -1.692
43 HB3 GLN 102 2HB GLN 102 10.561 -12.066 -0.317
44 HG2 GLN 102 1HG GLN 102 8.594 -10.743 -1.355
45 HG3 GLN 102 2HG GLN 102 8.285 -12.236 -2.241
46 HE21 GLN 102 1HE2 GLN 102 6.414 -11.242 -0.530
47 HE22 GLN 102 2HE2 GLN 102 6.283 -12.262 0.859
48 H LYS 103 H LYS 103 9.737 -9.035 -1.917
49 HA LYS 103 HA LYS 103 11.744 -7.834 -0.125
50 HB2 LYS 103 1HB LYS 103 10.392 -6.734 -2.534
51 HB3 LYS 103 2HB LYS 103 10.639 -5.637 -1.181
52 HG2 LYS 103 1HG LYS 103 12.981 -5.873 -1.286
53 HG3 LYS 103 2HG LYS 103 12.867 -7.270 -2.359
54 HD2 LYS 103 1HD LYS 103 11.777 -5.717 -4.039
55 HD3 LYS 103 2HD LYS 103 12.275 -4.387 -2.990
56 HE2 LYS 103 1HE LYS 103 14.040 -4.486 -4.463
57 HE3 LYS 103 2HE LYS 103 14.623 -5.517 -3.157
58 HZ1 LYS 103 3HZ LYS 103 14.928 -7.050 -4.718
59 HZ2 LYS 103 1HZ LYS 103 14.047 -6.185 -5.874
60 HZ3 LYS 103 2HZ LYS 103 13.246 -7.212 -4.795
61 HA PRO 104 HA PRO 104 8.570 -7.007 2.789
62 HB2 PRO 104 1HB PRO 104 9.223 -4.535 3.701
63 HB3 PRO 104 2HB PRO 104 10.157 -5.982 4.096
64 HG2 PRO 104 1HG PRO 104 10.696 -3.886 2.028
65 HG3 PRO 104 2HG PRO 104 11.826 -4.669 3.148
66 HD2 PRO 104 1HD PRO 104 11.607 -5.403 0.551
67 HD3 PRO 104 2HD PRO 104 12.015 -6.556 1.839
68 H PHE 105 H PHE 105 8.780 -5.247 -0.063
69 HA PHE 105 HA PHE 105 6.050 -4.277 0.276
70 HB2 PHE 105 1HB PHE 105 8.207 -2.458 -0.803
71 HB3 PHE 105 2HB PHE 105 6.529 -2.048 -0.463
72 HD1 PHE 105 2HD PHE 105 5.753 -1.844 1.866
73 HD2 PHE 105 1HD PHE 105 9.853 -2.467 0.909
74 HE1 PHE 105 2HE PHE 105 6.388 -1.119 4.130
75 HE2 PHE 105 1HE PHE 105 10.495 -1.744 3.171
76 HZ PHE 105 HZ PHE 105 8.762 -1.067 4.785
77 H GLU 106 H GLU 106 5.072 -5.393 -1.292
78 HA GLU 106 HA GLU 106 6.233 -5.263 -3.996
79 HB2 GLU 106 1HB GLU 106 6.338 -7.542 -2.845
80 HB3 GLU 106 2HB GLU 106 4.586 -7.576 -2.990
81 HG2 GLU 106 1HG GLU 106 4.659 -7.675 -5.318
82 HG3 GLU 106 2HG GLU 106 6.333 -7.127 -5.379
83 H CYS 107 H CYS 107 4.851 -4.847 -5.676
84 HA CYS 107 HA CYS 107 2.232 -3.816 -4.925
85 HB2 CYS 107 1HB CYS 107 3.842 -2.515 -6.372
86 HB3 CYS 107 2HB CYS 107 3.561 -3.708 -7.636
87 H THR 108 H THR 108 1.522 -6.090 -4.511
88 HA THR 108 HA THR 108 1.277 -8.179 -6.167
89 HB THR 108 HB THR 108 0.203 -8.178 -3.990
90 HG1 THR 108 1HG THR 108 -1.982 -8.581 -5.701
91 HG21 THR 108 3HG2 THR 108 -0.688 -5.946 -3.897
92 HG22 THR 108 1HG2 THR 108 -2.023 -7.083 -3.714
93 HG23 THR 108 2HG2 THR 108 -1.763 -6.269 -5.257
94 H HIS 109 H HIS 109 -0.418 -5.125 -6.527
95 HA HIS 109 HA HIS 109 -2.382 -5.680 -8.330
96 HB2 HIS 109 1HB HIS 109 -0.477 -3.330 -8.389
97 HB3 HIS 109 2HB HIS 109 -2.000 -3.409 -9.271
98 HD2 HIS 109 2HD HIS 109 -0.693 -2.345 -5.866
99 HE1 HIS 109 1HE HIS 109 -4.912 -2.621 -5.508
100 HE2 HIS 109 2HE HIS 109 -2.788 -1.750 -4.471
101 H CYS 110 H CYS 110 0.966 -4.841 -9.241
102 HA CYS 110 HA CYS 110 0.528 -6.278 -11.777
103 HB2 CYS 110 1HB CYS 110 2.293 -4.826 -12.731
104 HB3 CYS 110 2HB CYS 110 0.906 -3.907 -12.154
105 H GLY 111 H GLY 111 2.868 -5.590 -9.209
106 HA2 GLY 111 1HA GLY 111 3.968 -7.738 -8.424
107 HA3 GLY 111 2HA GLY 111 4.430 -7.928 -10.109
108 H LYS 112 H LYS 112 4.437 -4.692 -9.175
109 HA LYS 112 HA LYS 112 7.274 -4.506 -9.439
110 HB2 LYS 112 1HB LYS 112 5.463 -2.765 -10.067
111 HB3 LYS 112 2HB LYS 112 5.522 -2.309 -8.370
112 HG2 LYS 112 1HG LYS 112 7.003 -0.826 -9.300
113 HG3 LYS 112 2HG LYS 112 8.085 -2.125 -8.791
114 HD2 LYS 112 1HD LYS 112 8.245 -2.974 -11.004
115 HD3 LYS 112 2HD LYS 112 6.920 -1.950 -11.563
116 HE2 LYS 112 1HE LYS 112 8.230 -0.008 -11.452
117 HE3 LYS 112 2HE LYS 112 9.447 -0.782 -10.439
118 HZ1 LYS 112 3HZ LYS 112 10.214 -2.054 -12.264
119 HZ2 LYS 112 1HZ LYS 112 10.092 -0.458 -12.813
120 HZ3 LYS 112 2HZ LYS 112 8.912 -1.592 -13.240
121 H SER 113 H SER 113 8.689 -4.964 -7.900
122 HA SER 113 HA SER 113 7.859 -4.913 -5.103
123 HB2 SER 113 1HB SER 113 9.924 -6.135 -4.659
124 HB3 SER 113 2HB SER 113 9.046 -6.904 -5.981
125 HG SER 113 HG SER 113 11.529 -6.039 -5.998
126 H PHE 114 H PHE 114 9.284 -3.969 -3.473
127 HA PHE 114 HA PHE 114 11.106 -1.891 -4.373
128 HB2 PHE 114 1HB PHE 114 8.625 -1.280 -2.754
129 HB3 PHE 114 2HB PHE 114 9.955 -0.154 -3.004
130 HD1 PHE 114 2HD PHE 114 7.254 -2.011 -4.694
131 HD2 PHE 114 1HD PHE 114 10.147 1.096 -4.996
132 HE1 PHE 114 2HE PHE 114 6.202 -1.239 -6.779
133 HE2 PHE 114 1HE PHE 114 9.098 1.874 -7.082
134 HZ PHE 114 HZ PHE 114 7.124 0.705 -7.977
135 H ARG 115 H ARG 115 12.232 -0.845 -2.522
136 HA ARG 115 HA ARG 115 12.885 -2.866 -0.544
137 HB2 ARG 115 1HB ARG 115 14.505 -1.288 -1.904
138 HB3 ARG 115 2HB ARG 115 14.166 -0.167 -0.592
139 HG2 ARG 115 1HG ARG 115 15.262 -1.434 0.964
140 HG3 ARG 115 2HG ARG 115 14.989 -2.942 0.088
141 HD2 ARG 115 1HD ARG 115 16.567 -2.039 -1.677
142 HD3 ARG 115 2HD ARG 115 16.980 -0.772 -0.522
143 HE ARG 115 HE ARG 115 17.804 -3.525 -0.446
144 HH11 ARG 115 2HH1 ARG 115 17.261 -0.642 1.430
145 HH12 ARG 115 1HH1 ARG 115 18.353 -1.102 2.694
146 HH21 ARG 115 2HH2 ARG 115 19.245 -4.141 1.212
147 HH22 ARG 115 1HH2 ARG 115 19.482 -3.092 2.568
148 H ALA 116 H ALA 116 11.647 0.449 -0.637
149 HA ALA 116 HA ALA 116 10.895 0.167 2.200
150 HB1 ALA 116 3HB ALA 116 11.127 2.517 2.483
151 HB2 ALA 116 1HB ALA 116 12.586 1.944 1.675
152 HB3 ALA 116 2HB ALA 116 11.330 2.769 0.749
153 H LYS 117 H LYS 117 8.903 1.255 2.844
154 HA LYS 117 HA LYS 117 6.717 0.545 1.264
155 HB2 LYS 117 1HB LYS 117 6.616 0.883 3.709
156 HB3 LYS 117 2HB LYS 117 6.814 2.614 3.468
157 HG2 LYS 117 1HG LYS 117 4.559 2.531 3.673
158 HG3 LYS 117 2HG LYS 117 4.687 2.272 1.931
159 HD2 LYS 117 1HD LYS 117 4.791 -0.243 2.577
160 HD3 LYS 117 2HD LYS 117 4.091 0.300 4.104
161 HE2 LYS 117 1HE LYS 117 2.220 -0.229 2.841
162 HE3 LYS 117 2HE LYS 117 2.366 1.512 2.609
163 HZ1 LYS 117 3HZ LYS 117 2.283 1.038 0.449
164 HZ2 LYS 117 1HZ LYS 117 2.582 -0.609 0.690
165 HZ3 LYS 117 2HZ LYS 117 3.873 0.480 0.604
166 H GLY 118 H GLY 118 7.781 3.868 2.038
167 HA2 GLY 118 1HA GLY 118 6.174 5.353 0.462
168 HA3 GLY 118 2HA GLY 118 7.880 5.728 0.660
169 H ASN 119 H ASN 119 9.308 4.167 -0.766
170 HA ASN 119 HA ASN 119 9.181 4.896 -3.354
171 HB2 ASN 119 1HB ASN 119 10.865 3.329 -2.045
172 HB3 ASN 119 2HB ASN 119 9.954 2.053 -2.847
173 HD21 ASN 119 1HD2 ASN 119 12.735 2.932 -3.175
174 HD22 ASN 119 2HD2 ASN 119 12.911 3.305 -4.853
175 H LEU 120 H LEU 120 7.644 1.972 -2.034
176 HA LEU 120 HA LEU 120 6.462 1.176 -4.484
177 HB2 LEU 120 1HB LEU 120 6.709 -0.512 -2.893
178 HB3 LEU 120 2HB LEU 120 6.005 0.469 -1.610
179 HG LEU 120 HG LEU 120 3.792 0.200 -2.607
180 HD11 LEU 120 1HD1 LEU 120 3.359 -1.001 -4.546
181 HD12 LEU 120 2HD1 LEU 120 4.937 -1.786 -4.532
182 HD13 LEU 120 3HD1 LEU 120 4.806 -0.081 -4.959
183 HD21 LEU 120 3HD2 LEU 120 5.334 -2.338 -2.105
184 HD22 LEU 120 1HD2 LEU 120 3.578 -2.271 -2.257
185 HD23 LEU 120 2HD2 LEU 120 4.383 -1.404 -0.949
186 H VAL 121 H VAL 121 5.126 2.813 -1.618
187 HA VAL 121 HA VAL 121 2.514 3.117 -2.334
188 HB VAL 121 HB VAL 121 4.231 5.253 -1.062
189 HG11 VAL 121 1HG1 VAL 121 2.408 6.504 -0.821
190 HG12 VAL 121 2HG1 VAL 121 1.589 5.407 -1.935
191 HG13 VAL 121 3HG1 VAL 121 1.482 5.141 -0.194
192 HG21 VAL 121 3HG2 VAL 121 4.475 3.675 0.522
193 HG22 VAL 121 1HG2 VAL 121 2.817 4.099 0.950
194 HG23 VAL 121 2HG2 VAL 121 3.131 2.710 -0.090
195 H THR 122 H THR 122 5.198 5.235 -3.309
196 HA THR 122 HA THR 122 3.692 7.051 -4.818
197 HB THR 122 HB THR 122 6.583 6.233 -4.923
198 HG1 THR 122 1HG THR 122 6.788 8.426 -4.179
199 HG21 THR 122 3HG2 THR 122 5.173 8.209 -6.715
200 HG22 THR 122 1HG2 THR 122 6.080 6.779 -7.205
201 HG23 THR 122 2HG2 THR 122 6.921 8.155 -6.490
202 H HIS 123 H HIS 123 5.039 3.914 -5.631
203 HA HIS 123 HA HIS 123 4.632 4.110 -8.439
204 HB2 HIS 123 1HB HIS 123 6.185 2.477 -7.851
205 HB3 HIS 123 2HB HIS 123 5.189 1.860 -6.536
206 HD1 HIS 123 1HD HIS 123 5.608 1.664 -10.258
207 HD2 HIS 123 2HD HIS 123 3.357 -0.108 -7.248
208 HE1 HIS 123 1HE HIS 123 4.494 -0.319 -11.330
209 H GLN 124 H GLN 124 2.776 2.592 -5.816
210 HA GLN 124 HA GLN 124 0.743 1.441 -7.279
211 HB2 GLN 124 1HB GLN 124 0.114 2.866 -4.719
212 HB3 GLN 124 2HB GLN 124 -0.477 1.315 -5.299
213 HG2 GLN 124 1HG GLN 124 2.025 0.606 -5.060
214 HG3 GLN 124 2HG GLN 124 2.098 1.985 -3.964
215 HE21 GLN 124 1HE2 GLN 124 2.074 1.228 -1.972
216 HE22 GLN 124 2HE2 GLN 124 0.991 0.033 -1.352
217 H ARG 125 H ARG 125 1.247 4.807 -6.486
218 HA ARG 125 HA ARG 125 -1.262 5.873 -6.948
219 HB2 ARG 125 1HB ARG 125 1.385 7.098 -7.745
220 HB3 ARG 125 2HB ARG 125 -0.126 7.964 -7.499
221 HG2 ARG 125 1HG ARG 125 -0.106 7.372 -5.144
222 HG3 ARG 125 2HG ARG 125 1.378 6.446 -5.377
223 HD2 ARG 125 1HD ARG 125 2.044 8.530 -4.490
224 HD3 ARG 125 2HD ARG 125 2.429 8.588 -6.210
225 HE ARG 125 HE ARG 125 -0.101 9.667 -5.938
226 HH11 ARG 125 2HH1 ARG 125 3.118 10.370 -4.812
227 HH12 ARG 125 1HH1 ARG 125 2.853 12.080 -4.722
228 HH21 ARG 125 2HH2 ARG 125 -0.461 11.917 -5.823
229 HH22 ARG 125 1HH2 ARG 125 0.817 12.958 -5.297
230 H ILE 126 H ILE 126 0.962 4.483 -9.189
231 HA ILE 126 HA ILE 126 -0.044 5.719 -11.550
232 HB ILE 126 HB ILE 126 1.324 4.274 -12.770
233 HG12 ILE 126 1HG1 ILE 126 1.127 2.374 -10.428
234 HG13 ILE 126 2HG1 ILE 126 0.471 2.144 -12.045
235 HG21 ILE 126 1HG2 ILE 126 2.331 5.374 -10.335
236 HG22 ILE 126 2HG2 ILE 126 3.207 3.891 -10.709
237 HG23 ILE 126 3HG2 ILE 126 3.140 5.197 -11.892
238 HD11 ILE 126 3HD1 ILE 126 3.277 1.913 -11.085
239 HD12 ILE 126 1HD1 ILE 126 2.340 0.825 -12.109
240 HD13 ILE 126 2HD1 ILE 126 2.966 2.336 -12.769
241 H HIS 127 H HIS 127 -0.940 2.913 -9.678
242 HA HIS 127 HA HIS 127 -2.656 1.801 -11.700
243 HB2 HIS 127 1HB HIS 127 -2.273 1.199 -8.767
244 HB3 HIS 127 2HB HIS 127 -3.446 0.350 -9.770
245 HD1 HIS 127 1HD HIS 127 -2.300 -0.852 -11.969
246 HD2 HIS 127 2HD HIS 127 0.179 0.054 -8.761
247 HE1 HIS 127 1HE HIS 127 -0.253 -2.280 -12.277
248 H THR 128 H THR 128 -3.204 3.437 -8.584
249 HA THR 128 HA THR 128 -5.859 3.516 -8.322
250 HB THR 128 HB THR 128 -5.728 5.749 -7.364
251 HG1 THR 128 1HG THR 128 -3.455 5.888 -8.985
252 HG21 THR 128 3HG2 THR 128 -4.637 3.703 -6.256
253 HG22 THR 128 1HG2 THR 128 -4.203 5.298 -5.644
254 HG23 THR 128 2HG2 THR 128 -3.103 4.438 -6.721
255 H GLY 129 H GLY 129 -7.645 4.407 -9.252
256 HA2 GLY 129 1HA GLY 129 -7.240 5.614 -11.900
257 HA3 GLY 129 2HA GLY 129 -8.716 4.844 -11.338
258 H GLU 130 H GLU 130 -6.640 7.668 -10.771
259 HA GLU 130 HA GLU 130 -8.982 9.362 -10.634
260 HB2 GLU 130 1HB GLU 130 -8.571 10.262 -8.456
261 HB3 GLU 130 2HB GLU 130 -8.656 8.513 -8.300
262 HG2 GLU 130 1HG GLU 130 -6.063 8.656 -8.554
263 HG3 GLU 130 2HG GLU 130 -6.308 10.326 -8.047
264 H LYS 131 H LYS 131 -8.573 11.396 -11.327
265 HA LYS 131 HA LYS 131 -5.751 12.136 -11.744
266 HB2 LYS 131 1HB LYS 131 -7.281 11.506 -13.791
267 HB3 LYS 131 2HB LYS 131 -7.906 13.135 -13.564
268 HG2 LYS 131 1HG LYS 131 -5.388 13.805 -13.596
269 HG3 LYS 131 2HG LYS 131 -5.187 12.248 -14.404
270 HD2 LYS 131 1HD LYS 131 -6.981 12.980 -16.014
271 HD3 LYS 131 2HD LYS 131 -6.872 14.585 -15.287
272 HE2 LYS 131 1HE LYS 131 -4.373 13.267 -16.231
273 HE3 LYS 131 2HE LYS 131 -5.473 13.947 -17.429
274 HZ1 LYS 131 3HZ LYS 131 -3.919 15.318 -15.348
275 HZ2 LYS 131 1HZ LYS 131 -5.374 16.006 -15.871
276 HZ3 LYS 131 2HZ LYS 131 -4.125 15.724 -16.977
277 H SER 132 H SER 132 -5.685 13.365 -9.846
278 HA SER 132 HA SER 132 -6.072 15.138 -8.451
279 HB2 SER 132 1HB SER 132 -6.309 16.467 -11.160
280 HB3 SER 132 2HB SER 132 -6.115 17.336 -9.638
281 HG SER 132 HG SER 132 -4.292 15.623 -10.943
282 H GLY 133 H GLY 133 -8.382 13.591 -8.837
283 HA2 GLY 133 1HA GLY 133 -10.546 15.558 -9.121
284 HA3 GLY 133 2HA GLY 133 -10.737 13.811 -9.144
285 HA PRO 134 HA PRO 134 -12.126 15.245 -4.994
286 HB2 PRO 134 1HB PRO 134 -14.225 13.528 -4.864
287 HB3 PRO 134 2HB PRO 134 -14.323 15.107 -5.654
288 HG2 PRO 134 1HG PRO 134 -13.923 12.401 -6.871
289 HG3 PRO 134 2HG PRO 134 -14.961 13.731 -7.417
290 HD2 PRO 134 1HD PRO 134 -12.547 13.216 -8.530
291 HD3 PRO 134 2HD PRO 134 -13.211 14.858 -8.407
292 H SER 135 H SER 135 -12.755 13.735 -3.076
293 HA SER 135 HA SER 135 -10.593 11.858 -2.775
294 HB2 SER 135 1HB SER 135 -11.236 13.342 -0.921
295 HB3 SER 135 2HB SER 135 -12.829 12.587 -0.866
296 HG SER 135 HG SER 135 -11.491 11.651 0.684
297 H SER 136 H SER 136 -10.692 9.668 -2.662
298 HA SER 136 HA SER 136 -12.865 8.356 -3.930
299 HB2 SER 136 1HB SER 136 -11.622 6.291 -3.487
300 HB3 SER 136 2HB SER 136 -10.539 7.545 -4.091
301 HG SER 136 HG SER 136 -10.911 7.051 -1.330
302 H GLY 137 H GLY 137 -14.616 7.370 -3.116
303 HA2 GLY 137 1HA GLY 137 -15.697 7.887 -0.674
304 HA3 GLY 137 2HA GLY 137 -16.064 6.430 -1.585
Start of MODEL 13
1 H1 GLY 93 H GLY 93 7.813 -8.218 -21.830
2 HA2 GLY 93 1HA GLY 93 7.988 -7.185 -19.170
3 HA3 GLY 93 2HA GLY 93 6.380 -7.802 -19.519
4 H SER 94 H SER 94 9.784 -8.787 -19.922
5 HA SER 94 HA SER 94 9.184 -11.564 -19.906
6 HB2 SER 94 1HB SER 94 11.299 -10.282 -20.786
7 HB3 SER 94 2HB SER 94 11.886 -10.513 -19.139
8 HG SER 94 HG SER 94 10.804 -12.734 -20.418
9 H SER 95 H SER 95 10.255 -13.059 -18.269
10 HA SER 95 HA SER 95 9.996 -11.986 -15.542
11 HB2 SER 95 1HB SER 95 7.931 -13.180 -16.058
12 HB3 SER 95 2HB SER 95 8.851 -14.599 -16.559
13 HG SER 95 HG SER 95 8.121 -14.842 -14.431
14 H GLY 96 H GLY 96 11.655 -12.465 -14.250
15 HA2 GLY 96 1HA GLY 96 13.901 -13.902 -15.229
16 HA3 GLY 96 2HA GLY 96 13.699 -13.289 -13.594
17 H SER 97 H SER 97 14.828 -15.830 -14.495
18 HA SER 97 HA SER 97 12.863 -17.790 -13.588
19 HB2 SER 97 1HB SER 97 14.499 -19.472 -14.307
20 HB3 SER 97 2HB SER 97 14.191 -18.312 -15.599
21 HG SER 97 HG SER 97 16.234 -17.875 -15.572
22 H SER 98 H SER 98 16.082 -16.578 -12.734
23 HA SER 98 HA SER 98 15.658 -17.614 -10.014
24 HB2 SER 98 1HB SER 98 18.157 -17.818 -11.697
25 HB3 SER 98 2HB SER 98 18.175 -18.005 -9.943
26 HG SER 98 HG SER 98 17.711 -20.007 -10.389
27 H GLY 99 H GLY 99 16.416 -16.338 -8.338
28 HA2 GLY 99 1HA GLY 99 17.965 -14.481 -7.714
29 HA3 GLY 99 2HA GLY 99 17.365 -13.657 -9.146
30 H THR 100 H THR 100 14.716 -13.883 -9.055
31 HA THR 100 HA THR 100 13.917 -11.976 -7.188
32 HB THR 100 HB THR 100 12.674 -12.448 -9.268
33 HG1 THR 100 1HG THR 100 10.600 -12.224 -8.297
34 HG21 THR 100 3HG2 THR 100 12.667 -15.094 -8.266
35 HG22 THR 100 1HG2 THR 100 11.991 -14.504 -9.784
36 HG23 THR 100 2HG2 THR 100 10.989 -14.557 -8.333
37 H GLY 101 H GLY 101 13.070 -12.048 -5.170
38 HA2 GLY 101 1HA GLY 101 12.597 -14.714 -3.994
39 HA3 GLY 101 2HA GLY 101 13.540 -13.498 -3.145
40 H GLN 102 H GLN 102 12.516 -11.923 -2.000
41 HA GLN 102 HA GLN 102 9.726 -11.353 -2.348
42 HB2 GLN 102 1HB GLN 102 10.024 -13.557 -0.926
43 HB3 GLN 102 2HB GLN 102 10.371 -12.416 0.367
44 HG2 GLN 102 1HG GLN 102 8.158 -11.290 -0.394
45 HG3 GLN 102 2HG GLN 102 7.836 -12.855 -1.139
46 HE21 GLN 102 1HE2 GLN 102 8.284 -11.136 1.849
47 HE22 GLN 102 2HE2 GLN 102 7.661 -12.368 2.887
48 H LYS 103 H LYS 103 9.845 -9.209 -2.246
49 HA LYS 103 HA LYS 103 11.698 -7.909 -0.424
50 HB2 LYS 103 1HB LYS 103 10.055 -7.074 -2.758
51 HB3 LYS 103 2HB LYS 103 10.435 -5.842 -1.561
52 HG2 LYS 103 1HG LYS 103 12.216 -5.575 -2.939
53 HG3 LYS 103 2HG LYS 103 12.876 -6.816 -1.871
54 HD2 LYS 103 1HD LYS 103 11.357 -7.704 -4.266
55 HD3 LYS 103 2HD LYS 103 12.972 -7.037 -4.514
56 HE2 LYS 103 1HE LYS 103 12.362 -9.244 -2.557
57 HE3 LYS 103 2HE LYS 103 12.867 -9.532 -4.222
58 HZ1 LYS 103 3HZ LYS 103 14.633 -9.497 -2.374
59 HZ2 LYS 103 1HZ LYS 103 14.481 -7.814 -2.454
60 HZ3 LYS 103 2HZ LYS 103 14.962 -8.685 -3.821
61 HA PRO 104 HA PRO 104 8.852 -6.857 2.745
62 HB2 PRO 104 1HB PRO 104 9.606 -4.330 3.387
63 HB3 PRO 104 2HB PRO 104 10.573 -5.753 3.792
64 HG2 PRO 104 1HG PRO 104 10.894 -3.829 1.521
65 HG3 PRO 104 2HG PRO 104 12.135 -4.536 2.572
66 HD2 PRO 104 1HD PRO 104 11.635 -5.466 0.078
67 HD3 PRO 104 2HD PRO 104 12.176 -6.520 1.400
68 H PHE 105 H PHE 105 8.924 -5.042 -0.165
69 HA PHE 105 HA PHE 105 6.151 -4.242 0.254
70 HB2 PHE 105 1HB PHE 105 8.170 -2.243 -0.765
71 HB3 PHE 105 2HB PHE 105 6.487 -1.955 -0.340
72 HD1 PHE 105 2HD PHE 105 5.795 -1.959 2.031
73 HD2 PHE 105 1HD PHE 105 9.882 -2.231 0.874
74 HE1 PHE 105 2HE PHE 105 6.478 -1.333 4.310
75 HE2 PHE 105 1HE PHE 105 10.572 -1.605 3.151
76 HZ PHE 105 HZ PHE 105 8.869 -1.155 4.873
77 H GLU 106 H GLU 106 5.254 -5.382 -1.354
78 HA GLU 106 HA GLU 106 6.373 -5.039 -4.059
79 HB2 GLU 106 1HB GLU 106 6.547 -7.370 -2.984
80 HB3 GLU 106 2HB GLU 106 4.804 -7.459 -3.199
81 HG2 GLU 106 1HG GLU 106 4.989 -7.357 -5.548
82 HG3 GLU 106 2HG GLU 106 6.684 -6.881 -5.466
83 H CYS 107 H CYS 107 4.939 -4.715 -5.747
84 HA CYS 107 HA CYS 107 2.336 -3.693 -4.951
85 HB2 CYS 107 1HB CYS 107 3.943 -2.499 -6.541
86 HB3 CYS 107 2HB CYS 107 3.485 -3.706 -7.739
87 H THR 108 H THR 108 1.535 -5.865 -4.417
88 HA THR 108 HA THR 108 1.271 -8.057 -5.968
89 HB THR 108 HB THR 108 0.273 -8.010 -3.778
90 HG1 THR 108 1HG THR 108 -0.777 -9.181 -5.762
91 HG21 THR 108 3HG2 THR 108 -2.181 -6.599 -4.434
92 HG22 THR 108 1HG2 THR 108 -0.763 -5.557 -4.543
93 HG23 THR 108 2HG2 THR 108 -1.114 -6.415 -3.043
94 H HIS 109 H HIS 109 -0.197 -4.965 -6.544
95 HA HIS 109 HA HIS 109 -2.297 -5.624 -8.230
96 HB2 HIS 109 1HB HIS 109 -0.426 -3.252 -8.317
97 HB3 HIS 109 2HB HIS 109 -1.898 -3.374 -9.275
98 HD2 HIS 109 2HD HIS 109 -0.793 -2.151 -5.867
99 HE1 HIS 109 1HE HIS 109 -5.009 -2.575 -5.668
100 HE2 HIS 109 2HE HIS 109 -2.964 -1.582 -4.583
101 H CYS 110 H CYS 110 1.014 -4.741 -9.232
102 HA CYS 110 HA CYS 110 0.555 -6.243 -11.724
103 HB2 CYS 110 1HB CYS 110 2.321 -4.821 -12.717
104 HB3 CYS 110 2HB CYS 110 0.950 -3.880 -12.138
105 H GLY 111 H GLY 111 2.941 -5.520 -9.204
106 HA2 GLY 111 1HA GLY 111 4.031 -7.656 -8.380
107 HA3 GLY 111 2HA GLY 111 4.456 -7.903 -10.067
108 H LYS 112 H LYS 112 4.512 -4.644 -9.148
109 HA LYS 112 HA LYS 112 7.348 -4.495 -9.509
110 HB2 LYS 112 1HB LYS 112 5.531 -2.747 -10.121
111 HB3 LYS 112 2HB LYS 112 5.658 -2.253 -8.438
112 HG2 LYS 112 1HG LYS 112 7.145 -0.819 -9.401
113 HG3 LYS 112 2HG LYS 112 8.223 -2.156 -8.994
114 HD2 LYS 112 1HD LYS 112 8.154 -2.980 -11.242
115 HD3 LYS 112 2HD LYS 112 6.887 -1.830 -11.678
116 HE2 LYS 112 1HE LYS 112 8.342 -0.040 -11.712
117 HE3 LYS 112 2HE LYS 112 9.492 -0.819 -10.626
118 HZ1 LYS 112 3HZ LYS 112 9.515 -0.762 -13.426
119 HZ2 LYS 112 1HZ LYS 112 9.302 -2.369 -12.942
120 HZ3 LYS 112 2HZ LYS 112 10.632 -1.486 -12.383
121 H SER 113 H SER 113 8.782 -4.967 -7.991
122 HA SER 113 HA SER 113 8.023 -4.849 -5.180
123 HB2 SER 113 1HB SER 113 9.973 -6.162 -4.741
124 HB3 SER 113 2HB SER 113 9.227 -6.837 -6.189
125 HG SER 113 HG SER 113 10.757 -5.678 -7.425
126 H PHE 114 H PHE 114 9.483 -3.884 -3.597
127 HA PHE 114 HA PHE 114 11.281 -1.818 -4.582
128 HB2 PHE 114 1HB PHE 114 8.875 -1.203 -2.856
129 HB3 PHE 114 2HB PHE 114 10.186 -0.075 -3.181
130 HD1 PHE 114 2HD PHE 114 7.480 -2.026 -4.781
131 HD2 PHE 114 1HD PHE 114 10.207 1.223 -5.129
132 HE1 PHE 114 2HE PHE 114 6.324 -1.279 -6.820
133 HE2 PHE 114 1HE PHE 114 9.054 1.977 -7.168
134 HZ PHE 114 HZ PHE 114 7.110 0.724 -8.017
135 H ARG 115 H ARG 115 12.311 -0.643 -2.653
136 HA ARG 115 HA ARG 115 13.193 -2.691 -0.788
137 HB2 ARG 115 1HB ARG 115 14.649 -0.935 -2.104
138 HB3 ARG 115 2HB ARG 115 14.232 0.113 -0.755
139 HG2 ARG 115 1HG ARG 115 15.375 -1.202 0.783
140 HG3 ARG 115 2HG ARG 115 15.382 -2.608 -0.282
141 HD2 ARG 115 1HD ARG 115 17.596 -1.573 -0.135
142 HD3 ARG 115 2HD ARG 115 16.947 -1.494 -1.772
143 HE ARG 115 HE ARG 115 16.891 0.795 -1.611
144 HH11 ARG 115 2HH1 ARG 115 17.410 -0.582 1.544
145 HH12 ARG 115 1HH1 ARG 115 17.761 0.940 2.294
146 HH21 ARG 115 2HH2 ARG 115 17.351 2.805 -0.635
147 HH22 ARG 115 1HH2 ARG 115 17.726 2.866 1.054
148 H ALA 116 H ALA 116 11.742 0.545 -0.689
149 HA ALA 116 HA ALA 116 11.031 0.051 2.130
150 HB1 ALA 116 3HB ALA 116 11.684 2.613 0.702
151 HB2 ALA 116 1HB ALA 116 10.853 2.581 2.257
152 HB3 ALA 116 2HB ALA 116 12.477 1.908 2.110
153 H LYS 117 H LYS 117 9.025 1.309 2.805
154 HA LYS 117 HA LYS 117 6.834 0.432 1.258
155 HB2 LYS 117 1HB LYS 117 6.934 0.882 3.779
156 HB3 LYS 117 2HB LYS 117 6.688 2.575 3.371
157 HG2 LYS 117 1HG LYS 117 4.523 2.257 2.743
158 HG3 LYS 117 2HG LYS 117 4.797 0.588 2.239
159 HD2 LYS 117 1HD LYS 117 4.612 -0.231 4.394
160 HD3 LYS 117 2HD LYS 117 5.022 1.321 5.128
161 HE2 LYS 117 1HE LYS 117 2.778 2.068 3.955
162 HE3 LYS 117 2HE LYS 117 2.422 0.344 4.058
163 HZ1 LYS 117 3HZ LYS 117 2.040 2.181 6.034
164 HZ2 LYS 117 1HZ LYS 117 3.461 1.394 6.508
165 HZ3 LYS 117 2HZ LYS 117 2.052 0.500 6.231
166 H GLY 118 H GLY 118 7.728 3.793 2.087
167 HA2 GLY 118 1HA GLY 118 6.061 5.228 0.542
168 HA3 GLY 118 2HA GLY 118 7.752 5.671 0.725
169 H ASN 119 H ASN 119 9.232 4.212 -0.743
170 HA ASN 119 HA ASN 119 9.062 4.962 -3.311
171 HB2 ASN 119 1HB ASN 119 10.789 3.407 -2.046
172 HB3 ASN 119 2HB ASN 119 9.900 2.128 -2.867
173 HD21 ASN 119 1HD2 ASN 119 9.297 3.334 -5.252
174 HD22 ASN 119 2HD2 ASN 119 10.754 3.642 -6.128
175 H LEU 120 H LEU 120 7.673 1.916 -2.092
176 HA LEU 120 HA LEU 120 6.451 1.202 -4.544
177 HB2 LEU 120 1HB LEU 120 6.806 -0.556 -3.056
178 HB3 LEU 120 2HB LEU 120 6.111 0.330 -1.700
179 HG LEU 120 HG LEU 120 3.877 0.028 -2.640
180 HD11 LEU 120 1HD1 LEU 120 4.787 -0.083 -5.033
181 HD12 LEU 120 2HD1 LEU 120 3.428 -1.125 -4.616
182 HD13 LEU 120 3HD1 LEU 120 5.056 -1.795 -4.707
183 HD21 LEU 120 3HD2 LEU 120 4.402 -1.642 -1.109
184 HD22 LEU 120 1HD2 LEU 120 5.597 -2.381 -2.175
185 HD23 LEU 120 2HD2 LEU 120 3.877 -2.547 -2.529
186 H VAL 121 H VAL 121 5.109 2.603 -1.556
187 HA VAL 121 HA VAL 121 2.474 2.839 -2.200
188 HB VAL 121 HB VAL 121 4.150 4.941 -0.820
189 HG11 VAL 121 1HG1 VAL 121 2.043 5.668 0.201
190 HG12 VAL 121 2HG1 VAL 121 2.013 5.850 -1.554
191 HG13 VAL 121 3HG1 VAL 121 1.165 4.505 -0.791
192 HG21 VAL 121 3HG2 VAL 121 3.595 2.323 -0.054
193 HG22 VAL 121 1HG2 VAL 121 4.188 3.626 0.976
194 HG23 VAL 121 2HG2 VAL 121 2.457 3.311 0.862
195 H THR 122 H THR 122 5.072 5.053 -3.169
196 HA THR 122 HA THR 122 3.423 6.892 -4.536
197 HB THR 122 HB THR 122 6.364 6.284 -4.670
198 HG1 THR 122 1HG THR 122 6.021 7.579 -2.985
199 HG21 THR 122 3HG2 THR 122 4.807 8.225 -6.374
200 HG22 THR 122 1HG2 THR 122 5.862 6.921 -6.917
201 HG23 THR 122 2HG2 THR 122 6.548 8.335 -6.117
202 H HIS 123 H HIS 123 4.966 3.897 -5.502
203 HA HIS 123 HA HIS 123 4.610 4.201 -8.297
204 HB2 HIS 123 1HB HIS 123 6.173 2.570 -7.777
205 HB3 HIS 123 2HB HIS 123 5.195 1.901 -6.474
206 HD1 HIS 123 1HD HIS 123 5.641 1.775 -10.190
207 HD2 HIS 123 2HD HIS 123 3.372 -0.066 -7.237
208 HE1 HIS 123 1HE HIS 123 4.560 -0.201 -11.308
209 H GLN 124 H GLN 124 2.711 2.518 -5.809
210 HA GLN 124 HA GLN 124 0.752 1.393 -7.387
211 HB2 GLN 124 1HB GLN 124 0.019 2.682 -4.782
212 HB3 GLN 124 2HB GLN 124 -0.530 1.153 -5.455
213 HG2 GLN 124 1HG GLN 124 2.018 0.523 -5.185
214 HG3 GLN 124 2HG GLN 124 1.950 1.789 -3.959
215 HE21 GLN 124 1HE2 GLN 124 2.116 0.564 -2.164
216 HE22 GLN 124 2HE2 GLN 124 0.962 -0.631 -1.690
217 H ARG 125 H ARG 125 1.127 4.727 -6.387
218 HA ARG 125 HA ARG 125 -1.386 5.751 -6.896
219 HB2 ARG 125 1HB ARG 125 1.243 7.095 -7.544
220 HB3 ARG 125 2HB ARG 125 -0.299 7.896 -7.275
221 HG2 ARG 125 1HG ARG 125 -0.303 7.146 -4.961
222 HG3 ARG 125 2HG ARG 125 1.224 6.301 -5.225
223 HD2 ARG 125 1HD ARG 125 1.971 8.264 -4.300
224 HD3 ARG 125 2HD ARG 125 2.040 8.659 -6.017
225 HE ARG 125 HE ARG 125 0.349 10.182 -5.708
226 HH11 ARG 125 2HH1 ARG 125 0.622 8.154 -2.891
227 HH12 ARG 125 1HH1 ARG 125 -0.459 9.113 -1.935
228 HH21 ARG 125 2HH2 ARG 125 -1.076 11.453 -4.460
229 HH22 ARG 125 1HH2 ARG 125 -1.425 10.989 -2.829
230 H ILE 126 H ILE 126 0.882 4.446 -9.109
231 HA ILE 126 HA ILE 126 -0.025 5.811 -11.448
232 HB ILE 126 HB ILE 126 1.380 4.410 -12.688
233 HG12 ILE 126 1HG1 ILE 126 1.145 2.440 -10.408
234 HG13 ILE 126 2HG1 ILE 126 0.534 2.251 -12.048
235 HG21 ILE 126 1HG2 ILE 126 3.247 3.985 -10.653
236 HG22 ILE 126 2HG2 ILE 126 3.124 5.385 -11.717
237 HG23 ILE 126 3HG2 ILE 126 2.313 5.395 -10.151
238 HD11 ILE 126 3HD1 ILE 126 3.045 2.495 -12.699
239 HD12 ILE 126 1HD1 ILE 126 3.317 2.022 -11.022
240 HD13 ILE 126 2HD1 ILE 126 2.420 0.957 -12.105
241 H HIS 127 H HIS 127 -0.956 2.898 -9.756
242 HA HIS 127 HA HIS 127 -2.593 1.875 -11.880
243 HB2 HIS 127 1HB HIS 127 -2.357 1.162 -8.955
244 HB3 HIS 127 2HB HIS 127 -3.449 0.336 -10.062
245 HD1 HIS 127 1HD HIS 127 -2.190 -0.829 -12.184
246 HD2 HIS 127 2HD HIS 127 0.153 0.130 -8.889
247 HE1 HIS 127 1HE HIS 127 -0.091 -2.191 -12.433
248 H THR 128 H THR 128 -3.277 3.394 -8.731
249 HA THR 128 HA THR 128 -5.949 3.452 -8.593
250 HB THR 128 HB THR 128 -5.863 5.645 -7.528
251 HG1 THR 128 1HG THR 128 -3.172 5.782 -8.461
252 HG21 THR 128 3HG2 THR 128 -4.871 3.535 -6.451
253 HG22 THR 128 1HG2 THR 128 -4.448 5.092 -5.741
254 HG23 THR 128 2HG2 THR 128 -3.301 4.260 -6.791
255 H GLY 129 H GLY 129 -7.685 4.629 -9.416
256 HA2 GLY 129 1HA GLY 129 -7.153 6.400 -11.695
257 HA3 GLY 129 2HA GLY 129 -8.182 4.998 -11.948
258 H GLU 130 H GLU 130 -7.850 7.892 -9.915
259 HA GLU 130 HA GLU 130 -10.765 7.903 -9.556
260 HB2 GLU 130 1HB GLU 130 -10.268 9.625 -7.784
261 HB3 GLU 130 2HB GLU 130 -9.640 8.015 -7.461
262 HG2 GLU 130 1HG GLU 130 -7.428 8.741 -8.248
263 HG3 GLU 130 2HG GLU 130 -8.070 10.364 -8.499
264 H LYS 131 H LYS 131 -11.750 8.998 -11.128
265 HA LYS 131 HA LYS 131 -11.998 10.519 -12.864
266 HB2 LYS 131 1HB LYS 131 -12.104 12.893 -11.761
267 HB3 LYS 131 2HB LYS 131 -13.282 11.662 -11.323
268 HG2 LYS 131 1HG LYS 131 -12.666 12.528 -9.276
269 HG3 LYS 131 2HG LYS 131 -11.638 11.100 -9.411
270 HD2 LYS 131 1HD LYS 131 -10.173 12.763 -8.687
271 HD3 LYS 131 2HD LYS 131 -9.903 12.709 -10.430
272 HE2 LYS 131 1HE LYS 131 -10.111 14.963 -10.148
273 HE3 LYS 131 2HE LYS 131 -11.803 14.547 -10.418
274 HZ1 LYS 131 3HZ LYS 131 -12.348 15.061 -8.320
275 HZ2 LYS 131 1HZ LYS 131 -10.917 15.963 -8.331
276 HZ3 LYS 131 2HZ LYS 131 -10.932 14.410 -7.662
277 H SER 132 H SER 132 -9.340 9.700 -12.864
278 HA SER 132 HA SER 132 -7.523 11.884 -12.785
279 HB2 SER 132 1HB SER 132 -6.921 9.429 -12.614
280 HB3 SER 132 2HB SER 132 -7.178 9.325 -14.355
281 HG SER 132 HG SER 132 -5.470 11.295 -13.308
282 H GLY 133 H GLY 133 -8.762 10.032 -15.579
283 HA2 GLY 133 1HA GLY 133 -9.524 12.222 -17.122
284 HA3 GLY 133 2HA GLY 133 -7.838 11.898 -17.498
285 HA PRO 134 HA PRO 134 -10.952 8.971 -19.700
286 HB2 PRO 134 1HB PRO 134 -11.374 10.336 -22.008
287 HB3 PRO 134 2HB PRO 134 -12.416 10.501 -20.590
288 HG2 PRO 134 1HG PRO 134 -10.196 12.278 -21.526
289 HG3 PRO 134 2HG PRO 134 -11.793 12.720 -20.896
290 HD2 PRO 134 1HD PRO 134 -9.552 12.810 -19.378
291 HD3 PRO 134 2HD PRO 134 -11.148 12.426 -18.703
292 H SER 135 H SER 135 -8.957 7.780 -19.762
293 HA SER 135 HA SER 135 -7.510 8.109 -22.307
294 HB2 SER 135 1HB SER 135 -5.450 7.476 -21.256
295 HB3 SER 135 2HB SER 135 -6.163 8.751 -20.267
296 HG SER 135 HG SER 135 -6.026 5.980 -19.756
297 H SER 136 H SER 136 -9.787 6.521 -22.034
298 HA SER 136 HA SER 136 -9.604 3.909 -21.331
299 HB2 SER 136 1HB SER 136 -11.525 5.149 -22.523
300 HB3 SER 136 2HB SER 136 -10.739 4.651 -24.021
301 HG SER 136 HG SER 136 -12.103 3.139 -22.136
302 H GLY 137 H GLY 137 -8.711 5.097 -24.581
303 HA2 GLY 137 1HA GLY 137 -7.644 2.772 -25.604
304 HA3 GLY 137 2HA GLY 137 -7.089 4.380 -26.044
Start of MODEL 14
1 H1 GLY 93 H GLY 93 22.530 0.149 -7.519
2 HA2 GLY 93 1HA GLY 93 21.118 -1.748 -7.163
3 HA3 GLY 93 2HA GLY 93 19.981 -1.075 -8.322
4 H SER 94 H SER 94 20.233 -3.471 -8.951
5 HA SER 94 HA SER 94 22.598 -4.008 -10.556
6 HB2 SER 94 1HB SER 94 21.303 -5.699 -9.043
7 HB3 SER 94 2HB SER 94 20.212 -5.826 -10.422
8 HG SER 94 HG SER 94 21.641 -7.255 -11.041
9 H SER 95 H SER 95 22.491 -4.593 -12.786
10 HA SER 95 HA SER 95 21.006 -2.829 -14.371
11 HB2 SER 95 1HB SER 95 22.283 -5.433 -15.241
12 HB3 SER 95 2HB SER 95 21.862 -4.074 -16.283
13 HG SER 95 HG SER 95 23.533 -3.582 -14.101
14 H GLY 96 H GLY 96 20.599 -6.350 -13.950
15 HA2 GLY 96 1HA GLY 96 17.743 -6.128 -14.056
16 HA3 GLY 96 2HA GLY 96 18.410 -6.784 -15.543
17 H SER 97 H SER 97 16.698 -7.964 -13.382
18 HA SER 97 HA SER 97 18.098 -10.488 -13.229
19 HB2 SER 97 1HB SER 97 17.518 -8.829 -10.787
20 HB3 SER 97 2HB SER 97 17.582 -10.588 -10.690
21 HG SER 97 HG SER 97 19.671 -9.113 -11.880
22 H SER 98 H SER 98 16.729 -12.221 -13.043
23 HA SER 98 HA SER 98 13.865 -11.579 -13.134
24 HB2 SER 98 1HB SER 98 13.550 -13.634 -14.339
25 HB3 SER 98 2HB SER 98 14.918 -12.797 -15.073
26 HG SER 98 HG SER 98 15.970 -14.570 -14.707
27 H GLY 99 H GLY 99 15.080 -11.595 -10.621
28 HA2 GLY 99 1HA GLY 99 13.721 -13.913 -9.417
29 HA3 GLY 99 2HA GLY 99 15.363 -13.520 -8.928
30 H THR 100 H THR 100 12.607 -13.509 -7.584
31 HA THR 100 HA THR 100 12.793 -10.778 -6.487
32 HB THR 100 HB THR 100 10.333 -12.533 -6.630
33 HG1 THR 100 1HG THR 100 11.254 -11.326 -8.589
34 HG21 THR 100 3HG2 THR 100 10.949 -10.420 -4.882
35 HG22 THR 100 1HG2 THR 100 9.377 -11.174 -5.144
36 HG23 THR 100 2HG2 THR 100 9.842 -9.755 -6.083
37 H GLY 101 H GLY 101 13.619 -10.749 -4.506
38 HA2 GLY 101 1HA GLY 101 13.568 -13.161 -2.872
39 HA3 GLY 101 2HA GLY 101 14.481 -11.696 -2.541
40 H GLN 102 H GLN 102 11.034 -12.519 -2.966
41 HA GLN 102 HA GLN 102 9.200 -11.634 -1.880
42 HB2 GLN 102 1HB GLN 102 9.094 -12.388 0.442
43 HB3 GLN 102 2HB GLN 102 9.795 -13.629 -0.587
44 HG2 GLN 102 1HG GLN 102 11.887 -13.403 0.325
45 HG3 GLN 102 2HG GLN 102 11.601 -11.741 0.840
46 HE21 GLN 102 1HE2 GLN 102 12.365 -12.230 2.913
47 HE22 GLN 102 2HE2 GLN 102 11.409 -13.119 4.045
48 H LYS 103 H LYS 103 10.698 -9.504 -2.522
49 HA LYS 103 HA LYS 103 11.832 -7.831 -0.748
50 HB2 LYS 103 1HB LYS 103 9.992 -7.367 -3.038
51 HB3 LYS 103 2HB LYS 103 10.327 -6.000 -1.984
52 HG2 LYS 103 1HG LYS 103 11.963 -5.748 -3.561
53 HG3 LYS 103 2HG LYS 103 12.817 -6.707 -2.350
54 HD2 LYS 103 1HD LYS 103 12.424 -8.728 -3.608
55 HD3 LYS 103 2HD LYS 103 11.419 -7.853 -4.766
56 HE2 LYS 103 1HE LYS 103 13.611 -6.392 -5.010
57 HE3 LYS 103 2HE LYS 103 14.376 -7.874 -4.439
58 HZ1 LYS 103 3HZ LYS 103 12.820 -8.886 -6.303
59 HZ2 LYS 103 1HZ LYS 103 14.369 -8.300 -6.647
60 HZ3 LYS 103 2HZ LYS 103 13.013 -7.340 -6.962
61 HA PRO 104 HA PRO 104 9.034 -6.966 2.531
62 HB2 PRO 104 1HB PRO 104 9.928 -4.513 3.275
63 HB3 PRO 104 2HB PRO 104 10.817 -6.003 3.612
64 HG2 PRO 104 1HG PRO 104 11.233 -4.003 1.424
65 HG3 PRO 104 2HG PRO 104 12.438 -4.821 2.435
66 HD2 PRO 104 1HD PRO 104 11.878 -5.614 -0.092
67 HD3 PRO 104 2HD PRO 104 12.365 -6.753 1.180
68 H PHE 105 H PHE 105 9.032 -5.276 -0.380
69 HA PHE 105 HA PHE 105 6.376 -4.240 0.149
70 HB2 PHE 105 1HB PHE 105 8.511 -2.373 -0.894
71 HB3 PHE 105 2HB PHE 105 6.844 -1.973 -0.492
72 HD1 PHE 105 2HD PHE 105 6.119 -2.074 1.911
73 HD2 PHE 105 1HD PHE 105 10.201 -2.303 0.726
74 HE1 PHE 105 2HE PHE 105 6.812 -1.478 4.195
75 HE2 PHE 105 1HE PHE 105 10.900 -1.708 3.009
76 HZ PHE 105 HZ PHE 105 9.205 -1.293 4.747
77 H GLU 106 H GLU 106 5.361 -5.316 -1.433
78 HA GLU 106 HA GLU 106 6.389 -4.991 -4.174
79 HB2 GLU 106 1HB GLU 106 6.521 -7.346 -3.080
80 HB3 GLU 106 2HB GLU 106 4.783 -7.386 -3.342
81 HG2 GLU 106 1HG GLU 106 5.099 -7.100 -5.720
82 HG3 GLU 106 2HG GLU 106 6.840 -6.946 -5.494
83 H CYS 107 H CYS 107 4.878 -4.660 -5.806
84 HA CYS 107 HA CYS 107 2.323 -3.610 -4.877
85 HB2 CYS 107 1HB CYS 107 3.846 -2.338 -6.454
86 HB3 CYS 107 2HB CYS 107 3.433 -3.528 -7.684
87 H THR 108 H THR 108 1.564 -5.824 -4.392
88 HA THR 108 HA THR 108 1.214 -7.976 -5.914
89 HB THR 108 HB THR 108 0.131 -7.786 -3.744
90 HG1 THR 108 1HG THR 108 -1.531 -8.446 -5.950
91 HG21 THR 108 3HG2 THR 108 -2.161 -6.281 -4.925
92 HG22 THR 108 1HG2 THR 108 -0.739 -5.390 -4.386
93 HG23 THR 108 2HG2 THR 108 -1.636 -6.393 -3.245
94 H HIS 109 H HIS 109 -0.510 -4.934 -6.403
95 HA HIS 109 HA HIS 109 -2.422 -5.561 -8.221
96 HB2 HIS 109 1HB HIS 109 -0.562 -3.202 -8.086
97 HB3 HIS 109 2HB HIS 109 -1.787 -3.316 -9.346
98 HD2 HIS 109 2HD HIS 109 -1.611 -1.382 -6.373
99 HE1 HIS 109 1HE HIS 109 -5.502 -3.046 -6.069
100 HE2 HIS 109 2HE HIS 109 -3.957 -1.211 -5.299
101 H CYS 110 H CYS 110 0.917 -4.702 -9.149
102 HA CYS 110 HA CYS 110 0.521 -6.251 -11.624
103 HB2 CYS 110 1HB CYS 110 2.312 -4.834 -12.597
104 HB3 CYS 110 2HB CYS 110 0.905 -3.904 -12.095
105 H GLY 111 H GLY 111 2.881 -5.427 -9.104
106 HA2 GLY 111 1HA GLY 111 3.974 -7.520 -8.183
107 HA3 GLY 111 2HA GLY 111 4.399 -7.845 -9.857
108 H LYS 112 H LYS 112 4.448 -4.548 -9.027
109 HA LYS 112 HA LYS 112 7.264 -4.375 -9.464
110 HB2 LYS 112 1HB LYS 112 5.425 -2.637 -10.006
111 HB3 LYS 112 2HB LYS 112 5.584 -2.160 -8.321
112 HG2 LYS 112 1HG LYS 112 7.021 -0.695 -9.330
113 HG3 LYS 112 2HG LYS 112 8.125 -2.006 -8.910
114 HD2 LYS 112 1HD LYS 112 8.100 -2.847 -11.138
115 HD3 LYS 112 2HD LYS 112 6.767 -1.781 -11.590
116 HE2 LYS 112 1HE LYS 112 8.139 0.132 -11.518
117 HE3 LYS 112 2HE LYS 112 9.416 -0.718 -10.648
118 HZ1 LYS 112 3HZ LYS 112 10.294 -1.451 -12.542
119 HZ2 LYS 112 1HZ LYS 112 9.316 -0.319 -13.333
120 HZ3 LYS 112 2HZ LYS 112 8.797 -1.921 -13.175
121 H SER 113 H SER 113 8.764 -4.829 -8.006
122 HA SER 113 HA SER 113 8.108 -4.743 -5.166
123 HB2 SER 113 1HB SER 113 10.148 -5.992 -4.821
124 HB3 SER 113 2HB SER 113 9.268 -6.727 -6.161
125 HG SER 113 HG SER 113 10.737 -5.051 -7.366
126 H PHE 114 H PHE 114 9.628 -3.781 -3.634
127 HA PHE 114 HA PHE 114 11.377 -1.700 -4.663
128 HB2 PHE 114 1HB PHE 114 9.009 -1.087 -2.882
129 HB3 PHE 114 2HB PHE 114 10.307 0.045 -3.247
130 HD1 PHE 114 2HD PHE 114 7.455 -1.803 -4.654
131 HD2 PHE 114 1HD PHE 114 10.389 1.209 -5.316
132 HE1 PHE 114 2HE PHE 114 6.244 -1.071 -6.667
133 HE2 PHE 114 1HE PHE 114 9.182 1.946 -7.329
134 HZ PHE 114 HZ PHE 114 7.108 0.805 -8.008
135 H ARG 115 H ARG 115 12.258 -0.419 -2.619
136 HA ARG 115 HA ARG 115 13.265 -2.488 -0.818
137 HB2 ARG 115 1HB ARG 115 14.216 0.215 -1.668
138 HB3 ARG 115 2HB ARG 115 14.760 -0.427 -0.124
139 HG2 ARG 115 1HG ARG 115 16.431 -1.196 -1.449
140 HG3 ARG 115 2HG ARG 115 15.306 -2.546 -1.610
141 HD2 ARG 115 1HD ARG 115 14.509 -1.717 -3.708
142 HD3 ARG 115 2HD ARG 115 15.412 -0.215 -3.516
143 HE ARG 115 HE ARG 115 17.012 -2.626 -3.549
144 HH11 ARG 115 2HH1 ARG 115 15.637 -0.013 -5.394
145 HH12 ARG 115 1HH1 ARG 115 16.771 -0.162 -6.695
146 HH21 ARG 115 2HH2 ARG 115 18.511 -2.832 -5.256
147 HH22 ARG 115 1HH2 ARG 115 18.404 -1.766 -6.616
148 H ALA 116 H ALA 116 11.738 0.711 -0.706
149 HA ALA 116 HA ALA 116 11.056 0.196 2.116
150 HB1 ALA 116 3HB ALA 116 11.099 2.550 2.532
151 HB2 ALA 116 1HB ALA 116 12.609 2.110 1.733
152 HB3 ALA 116 2HB ALA 116 11.325 2.902 0.819
153 H LYS 117 H LYS 117 8.997 1.039 2.850
154 HA LYS 117 HA LYS 117 6.843 0.289 1.273
155 HB2 LYS 117 1HB LYS 117 6.765 0.534 3.732
156 HB3 LYS 117 2HB LYS 117 6.832 2.281 3.548
157 HG2 LYS 117 1HG LYS 117 4.576 1.792 3.912
158 HG3 LYS 117 2HG LYS 117 4.706 2.062 2.172
159 HD2 LYS 117 1HD LYS 117 4.641 -0.275 1.724
160 HD3 LYS 117 2HD LYS 117 4.827 -0.671 3.434
161 HE2 LYS 117 1HE LYS 117 2.574 -0.950 3.236
162 HE3 LYS 117 2HE LYS 117 2.612 0.768 3.626
163 HZ1 LYS 117 3HZ LYS 117 1.166 0.176 1.714
164 HZ2 LYS 117 1HZ LYS 117 2.549 -0.286 0.854
165 HZ3 LYS 117 2HZ LYS 117 2.354 1.321 1.343
166 H GLY 118 H GLY 118 7.807 3.631 2.093
167 HA2 GLY 118 1HA GLY 118 6.038 5.067 0.614
168 HA3 GLY 118 2HA GLY 118 7.718 5.546 0.807
169 H ASN 119 H ASN 119 9.154 3.887 -0.663
170 HA ASN 119 HA ASN 119 9.019 4.768 -3.230
171 HB2 ASN 119 1HB ASN 119 10.081 2.205 -2.078
172 HB3 ASN 119 2HB ASN 119 10.167 2.507 -3.811
173 HD21 ASN 119 1HD2 ASN 119 12.010 2.519 -1.249
174 HD22 ASN 119 2HD2 ASN 119 13.049 3.862 -1.571
175 H LEU 120 H LEU 120 7.621 1.708 -2.058
176 HA LEU 120 HA LEU 120 6.412 1.008 -4.513
177 HB2 LEU 120 1HB LEU 120 6.700 -0.754 -3.029
178 HB3 LEU 120 2HB LEU 120 6.041 0.156 -1.671
179 HG LEU 120 HG LEU 120 3.794 -0.095 -2.569
180 HD11 LEU 120 1HD1 LEU 120 3.279 -1.205 -4.556
181 HD12 LEU 120 2HD1 LEU 120 4.892 -1.902 -4.695
182 HD13 LEU 120 3HD1 LEU 120 4.650 -0.179 -4.980
183 HD21 LEU 120 3HD2 LEU 120 5.515 -2.394 -1.921
184 HD22 LEU 120 1HD2 LEU 120 3.968 -2.786 -2.672
185 HD23 LEU 120 2HD2 LEU 120 4.011 -1.852 -1.176
186 H VAL 121 H VAL 121 5.092 2.530 -1.581
187 HA VAL 121 HA VAL 121 2.452 2.775 -2.257
188 HB VAL 121 HB VAL 121 4.122 4.897 -0.901
189 HG11 VAL 121 1HG1 VAL 121 2.148 5.835 -0.073
190 HG12 VAL 121 2HG1 VAL 121 1.785 5.501 -1.767
191 HG13 VAL 121 3HG1 VAL 121 1.187 4.422 -0.506
192 HG21 VAL 121 3HG2 VAL 121 3.289 2.257 -0.078
193 HG22 VAL 121 1HG2 VAL 121 4.373 3.395 0.722
194 HG23 VAL 121 2HG2 VAL 121 2.633 3.496 0.991
195 H THR 122 H THR 122 5.034 5.089 -3.075
196 HA THR 122 HA THR 122 3.477 6.897 -4.514
197 HB THR 122 HB THR 122 6.395 6.187 -4.662
198 HG1 THR 122 1HG THR 122 6.291 8.582 -4.010
199 HG21 THR 122 3HG2 THR 122 5.886 6.832 -6.910
200 HG22 THR 122 1HG2 THR 122 6.653 8.211 -6.123
201 HG23 THR 122 2HG2 THR 122 4.905 8.189 -6.357
202 H HIS 123 H HIS 123 4.970 3.873 -5.504
203 HA HIS 123 HA HIS 123 4.569 4.182 -8.290
204 HB2 HIS 123 1HB HIS 123 6.119 2.531 -7.790
205 HB3 HIS 123 2HB HIS 123 5.147 1.869 -6.480
206 HD1 HIS 123 1HD HIS 123 5.551 1.756 -10.201
207 HD2 HIS 123 2HD HIS 123 3.291 -0.072 -7.232
208 HE1 HIS 123 1HE HIS 123 4.432 -0.201 -11.316
209 H GLN 124 H GLN 124 2.690 2.502 -5.782
210 HA GLN 124 HA GLN 124 0.693 1.413 -7.333
211 HB2 GLN 124 1HB GLN 124 0.024 2.701 -4.709
212 HB3 GLN 124 2HB GLN 124 -0.568 1.188 -5.382
213 HG2 GLN 124 1HG GLN 124 1.964 0.496 -5.160
214 HG3 GLN 124 2HG GLN 124 1.958 1.764 -3.936
215 HE21 GLN 124 1HE2 GLN 124 1.395 -1.458 -4.535
216 HE22 GLN 124 2HE2 GLN 124 0.508 -1.849 -3.105
217 H ARG 125 H ARG 125 1.103 4.737 -6.296
218 HA ARG 125 HA ARG 125 -1.398 5.791 -6.773
219 HB2 ARG 125 1HB ARG 125 1.228 7.118 -7.467
220 HB3 ARG 125 2HB ARG 125 -0.300 7.926 -7.142
221 HG2 ARG 125 1HG ARG 125 -0.233 7.030 -4.835
222 HG3 ARG 125 2HG ARG 125 1.361 6.358 -5.184
223 HD2 ARG 125 1HD ARG 125 2.321 8.491 -5.432
224 HD3 ARG 125 2HD ARG 125 0.746 9.274 -5.557
225 HE ARG 125 HE ARG 125 1.252 7.952 -3.039
226 HH11 ARG 125 2HH1 ARG 125 1.475 10.910 -4.861
227 HH12 ARG 125 1HH1 ARG 125 1.538 11.923 -3.456
228 HH21 ARG 125 2HH2 ARG 125 1.334 9.274 -1.183
229 HH22 ARG 125 1HH2 ARG 125 1.459 10.991 -1.365
230 H ILE 126 H ILE 126 0.796 4.443 -9.022
231 HA ILE 126 HA ILE 126 -0.123 5.840 -11.343
232 HB ILE 126 HB ILE 126 1.243 4.423 -12.612
233 HG12 ILE 126 1HG1 ILE 126 1.046 2.455 -10.326
234 HG13 ILE 126 2HG1 ILE 126 0.372 2.275 -11.942
235 HG21 ILE 126 1HG2 ILE 126 2.241 5.316 -10.036
236 HG22 ILE 126 2HG2 ILE 126 3.181 3.980 -10.698
237 HG23 ILE 126 3HG2 ILE 126 2.963 5.456 -11.639
238 HD11 ILE 126 3HD1 ILE 126 2.860 2.486 -12.688
239 HD12 ILE 126 1HD1 ILE 126 3.189 2.009 -11.023
240 HD13 ILE 126 2HD1 ILE 126 2.237 0.956 -12.071
241 H HIS 127 H HIS 127 -1.038 2.906 -9.667
242 HA HIS 127 HA HIS 127 -2.714 1.899 -11.755
243 HB2 HIS 127 1HB HIS 127 -2.479 1.231 -8.820
244 HB3 HIS 127 2HB HIS 127 -3.597 0.409 -9.904
245 HD1 HIS 127 1HD HIS 127 -2.505 -1.040 -11.828
246 HD2 HIS 127 2HD HIS 127 0.133 0.370 -8.945
247 HE1 HIS 127 1HE HIS 127 -0.406 -2.394 -12.118
248 H THR 128 H THR 128 -3.408 3.413 -8.602
249 HA THR 128 HA THR 128 -6.067 3.533 -8.484
250 HB THR 128 HB THR 128 -5.953 5.743 -7.446
251 HG1 THR 128 1HG THR 128 -4.228 6.382 -9.124
252 HG21 THR 128 3HG2 THR 128 -4.917 3.557 -6.422
253 HG22 THR 128 1HG2 THR 128 -4.704 5.111 -5.616
254 HG23 THR 128 2HG2 THR 128 -3.402 4.442 -6.601
255 H GLY 129 H GLY 129 -7.399 3.637 -10.202
256 HA2 GLY 129 1HA GLY 129 -7.041 4.989 -12.580
257 HA3 GLY 129 2HA GLY 129 -8.614 4.596 -11.902
258 H GLU 130 H GLU 130 -8.561 6.198 -9.613
259 HA GLU 130 HA GLU 130 -9.670 8.535 -10.369
260 HB2 GLU 130 1HB GLU 130 -7.883 8.091 -7.974
261 HB3 GLU 130 2HB GLU 130 -8.919 9.495 -8.184
262 HG2 GLU 130 1HG GLU 130 -10.233 8.174 -6.864
263 HG3 GLU 130 2HG GLU 130 -10.799 7.711 -8.467
264 H LYS 131 H LYS 131 -9.074 10.498 -11.109
265 HA LYS 131 HA LYS 131 -6.261 10.833 -11.851
266 HB2 LYS 131 1HB LYS 131 -7.142 12.669 -13.312
267 HB3 LYS 131 2HB LYS 131 -7.768 11.071 -13.697
268 HG2 LYS 131 1HG LYS 131 -9.867 11.555 -12.727
269 HG3 LYS 131 2HG LYS 131 -9.255 13.026 -11.967
270 HD2 LYS 131 1HD LYS 131 -8.897 13.999 -14.206
271 HD3 LYS 131 2HD LYS 131 -9.584 12.542 -14.929
272 HE2 LYS 131 1HE LYS 131 -11.402 13.965 -14.890
273 HE3 LYS 131 2HE LYS 131 -11.616 13.057 -13.395
274 HZ1 LYS 131 3HZ LYS 131 -11.864 15.573 -13.295
275 HZ2 LYS 131 1HZ LYS 131 -10.179 15.638 -13.433
276 HZ3 LYS 131 2HZ LYS 131 -10.890 14.846 -12.119
277 H SER 132 H SER 132 -4.985 12.356 -10.985
278 HA SER 132 HA SER 132 -6.234 14.372 -9.236
279 HB2 SER 132 1HB SER 132 -3.820 12.641 -8.749
280 HB3 SER 132 2HB SER 132 -4.020 14.181 -7.912
281 HG SER 132 HG SER 132 -6.081 13.368 -7.194
282 H GLY 133 H GLY 133 -5.691 16.425 -9.631
283 HA2 GLY 133 1HA GLY 133 -4.712 18.242 -10.635
284 HA3 GLY 133 2HA GLY 133 -3.196 17.383 -10.405
285 HA PRO 134 HA PRO 134 -4.388 17.810 -14.981
286 HB2 PRO 134 1HB PRO 134 -2.522 19.655 -15.677
287 HB3 PRO 134 2HB PRO 134 -4.145 20.090 -15.126
288 HG2 PRO 134 1HG PRO 134 -1.573 20.045 -13.595
289 HG3 PRO 134 2HG PRO 134 -2.863 21.261 -13.579
290 HD2 PRO 134 1HD PRO 134 -2.605 19.385 -11.643
291 HD3 PRO 134 2HD PRO 134 -4.182 20.025 -12.148
292 H SER 135 H SER 135 -2.966 17.279 -16.812
293 HA SER 135 HA SER 135 -1.125 15.230 -16.128
294 HB2 SER 135 1HB SER 135 -2.462 15.126 -18.179
295 HB3 SER 135 2HB SER 135 -1.644 16.559 -18.800
296 HG SER 135 HG SER 135 -0.723 14.647 -19.631
297 H SER 136 H SER 136 -0.707 18.450 -17.576
298 HA SER 136 HA SER 136 1.076 19.861 -17.658
299 HB2 SER 136 1HB SER 136 2.296 18.113 -15.510
300 HB3 SER 136 2HB SER 136 2.715 19.785 -15.883
301 HG SER 136 HG SER 136 0.329 20.120 -15.404
302 H GLY 137 H GLY 137 0.988 17.859 -19.555
303 HA2 GLY 137 1HA GLY 137 3.226 17.922 -20.957
304 HA3 GLY 137 2HA GLY 137 3.680 16.737 -19.741
Start of MODEL 15
1 H1 GLY 93 H GLY 93 25.490 -0.464 -13.936
2 HA2 GLY 93 1HA GLY 93 25.309 -1.684 -16.562
3 HA3 GLY 93 2HA GLY 93 26.714 -1.678 -15.506
4 H SER 94 H SER 94 23.375 -2.885 -15.180
5 HA SER 94 HA SER 94 24.373 -5.299 -13.922
6 HB2 SER 94 1HB SER 94 22.376 -4.208 -13.003
7 HB3 SER 94 2HB SER 94 21.539 -4.426 -14.541
8 HG SER 94 HG SER 94 22.619 -6.717 -13.428
9 H SER 95 H SER 95 25.191 -6.786 -15.254
10 HA SER 95 HA SER 95 24.415 -7.121 -17.956
11 HB2 SER 95 1HB SER 95 25.802 -9.178 -17.866
12 HB3 SER 95 2HB SER 95 26.637 -7.775 -17.200
13 HG SER 95 HG SER 95 25.922 -8.550 -15.102
14 H GLY 96 H GLY 96 23.740 -9.031 -15.029
15 HA2 GLY 96 1HA GLY 96 22.128 -10.966 -16.312
16 HA3 GLY 96 2HA GLY 96 22.137 -10.616 -14.590
17 H SER 97 H SER 97 19.797 -11.315 -15.797
18 HA SER 97 HA SER 97 18.303 -9.017 -16.635
19 HB2 SER 97 1HB SER 97 17.910 -11.556 -17.167
20 HB3 SER 97 2HB SER 97 17.000 -11.535 -15.657
21 HG SER 97 HG SER 97 15.516 -10.278 -16.544
22 H SER 98 H SER 98 16.220 -8.440 -15.502
23 HA SER 98 HA SER 98 16.637 -7.221 -13.111
24 HB2 SER 98 1HB SER 98 14.648 -6.683 -14.283
25 HB3 SER 98 2HB SER 98 14.093 -8.357 -14.269
26 HG SER 98 HG SER 98 13.007 -7.659 -12.593
27 H GLY 99 H GLY 99 16.650 -7.731 -10.986
28 HA2 GLY 99 1HA GLY 99 17.096 -10.393 -10.189
29 HA3 GLY 99 2HA GLY 99 16.803 -9.040 -9.107
30 H THR 100 H THR 100 15.822 -11.969 -9.419
31 HA THR 100 HA THR 100 12.946 -11.374 -9.175
32 HB THR 100 HB THR 100 14.279 -13.987 -9.914
33 HG1 THR 100 1HG THR 100 12.553 -12.358 -11.485
34 HG21 THR 100 3HG2 THR 100 12.171 -14.984 -10.027
35 HG22 THR 100 1HG2 THR 100 11.331 -13.435 -10.019
36 HG23 THR 100 2HG2 THR 100 12.089 -14.034 -8.544
37 H GLY 101 H GLY 101 12.568 -11.076 -7.050
38 HA2 GLY 101 1HA GLY 101 12.816 -13.331 -5.287
39 HA3 GLY 101 2HA GLY 101 13.915 -12.025 -4.872
40 H GLN 102 H GLN 102 12.350 -12.495 -2.905
41 HA GLN 102 HA GLN 102 9.859 -11.008 -3.129
42 HB2 GLN 102 1HB GLN 102 9.509 -11.726 -0.776
43 HB3 GLN 102 2HB GLN 102 9.764 -13.070 -1.881
44 HG2 GLN 102 1HG GLN 102 12.047 -13.303 -1.135
45 HG3 GLN 102 2HG GLN 102 11.880 -11.886 -0.099
46 HE21 GLN 102 1HE2 GLN 102 10.180 -14.945 -0.707
47 HE22 GLN 102 2HE2 GLN 102 9.939 -15.338 0.958
48 H LYS 103 H LYS 103 9.323 -9.378 -1.465
49 HA LYS 103 HA LYS 103 11.562 -7.997 -0.238
50 HB2 LYS 103 1HB LYS 103 10.089 -6.975 -2.611
51 HB3 LYS 103 2HB LYS 103 10.478 -5.819 -1.344
52 HG2 LYS 103 1HG LYS 103 12.834 -6.357 -1.542
53 HG3 LYS 103 2HG LYS 103 12.469 -7.577 -2.764
54 HD2 LYS 103 1HD LYS 103 11.926 -5.996 -4.366
55 HD3 LYS 103 2HD LYS 103 11.579 -4.750 -3.165
56 HE2 LYS 103 1HE LYS 103 13.907 -4.459 -2.698
57 HE3 LYS 103 2HE LYS 103 14.333 -5.857 -3.684
58 HZ1 LYS 103 3HZ LYS 103 14.786 -3.959 -4.977
59 HZ2 LYS 103 1HZ LYS 103 13.302 -3.237 -4.604
60 HZ3 LYS 103 2HZ LYS 103 13.351 -4.599 -5.605
61 HA PRO 104 HA PRO 104 8.614 -6.897 2.820
62 HB2 PRO 104 1HB PRO 104 9.427 -4.416 3.563
63 HB3 PRO 104 2HB PRO 104 10.323 -5.884 3.974
64 HG2 PRO 104 1HG PRO 104 10.818 -3.916 1.773
65 HG3 PRO 104 2HG PRO 104 11.982 -4.695 2.861
66 HD2 PRO 104 1HD PRO 104 11.568 -5.543 0.323
67 HD3 PRO 104 2HD PRO 104 12.008 -6.649 1.640
68 H PHE 105 H PHE 105 8.750 -5.237 -0.112
69 HA PHE 105 HA PHE 105 6.056 -4.217 0.282
70 HB2 PHE 105 1HB PHE 105 8.231 -2.398 -0.764
71 HB3 PHE 105 2HB PHE 105 6.549 -1.980 -0.457
72 HD1 PHE 105 2HD PHE 105 5.719 -1.864 1.882
73 HD2 PHE 105 1HD PHE 105 9.845 -2.355 0.958
74 HE1 PHE 105 2HE PHE 105 6.311 -1.162 4.164
75 HE2 PHE 105 1HE PHE 105 10.443 -1.654 3.239
76 HZ PHE 105 HZ PHE 105 8.675 -1.055 4.845
77 H GLU 106 H GLU 106 5.072 -5.330 -1.289
78 HA GLU 106 HA GLU 106 6.211 -5.163 -4.002
79 HB2 GLU 106 1HB GLU 106 6.281 -7.458 -2.871
80 HB3 GLU 106 2HB GLU 106 4.530 -7.464 -3.026
81 HG2 GLU 106 1HG GLU 106 4.614 -7.536 -5.354
82 HG3 GLU 106 2HG GLU 106 6.296 -7.010 -5.400
83 H CYS 107 H CYS 107 4.810 -4.761 -5.684
84 HA CYS 107 HA CYS 107 2.231 -3.651 -4.909
85 HB2 CYS 107 1HB CYS 107 3.852 -2.423 -6.410
86 HB3 CYS 107 2HB CYS 107 3.510 -3.630 -7.646
87 H THR 108 H THR 108 1.448 -5.881 -4.439
88 HA THR 108 HA THR 108 1.117 -8.018 -5.989
89 HB THR 108 HB THR 108 -0.017 -7.812 -3.837
90 HG1 THR 108 1HG THR 108 -2.161 -8.664 -4.665
91 HG21 THR 108 3HG2 THR 108 -1.762 -6.400 -3.385
92 HG22 THR 108 1HG2 THR 108 -2.315 -6.368 -5.058
93 HG23 THR 108 2HG2 THR 108 -0.903 -5.427 -4.578
94 H HIS 109 H HIS 109 -0.538 -4.946 -6.504
95 HA HIS 109 HA HIS 109 -2.424 -5.525 -8.363
96 HB2 HIS 109 1HB HIS 109 -0.471 -3.217 -8.428
97 HB3 HIS 109 2HB HIS 109 -1.945 -3.300 -9.388
98 HD2 HIS 109 2HD HIS 109 -0.800 -2.344 -5.845
99 HE1 HIS 109 1HE HIS 109 -5.038 -2.152 -5.908
100 HE2 HIS 109 2HE HIS 109 -2.946 -1.539 -4.646
101 H CYS 110 H CYS 110 0.938 -4.706 -9.244
102 HA CYS 110 HA CYS 110 0.562 -6.257 -11.720
103 HB2 CYS 110 1HB CYS 110 2.397 -4.876 -12.659
104 HB3 CYS 110 2HB CYS 110 1.001 -3.916 -12.177
105 H GLY 111 H GLY 111 2.873 -5.498 -9.138
106 HA2 GLY 111 1HA GLY 111 3.909 -7.614 -8.210
107 HA3 GLY 111 2HA GLY 111 4.367 -7.936 -9.876
108 H LYS 112 H LYS 112 4.448 -4.649 -8.947
109 HA LYS 112 HA LYS 112 7.292 -4.543 -9.316
110 HB2 LYS 112 1HB LYS 112 5.479 -2.775 -9.938
111 HB3 LYS 112 2HB LYS 112 5.656 -2.257 -8.266
112 HG2 LYS 112 1HG LYS 112 7.125 -0.868 -9.359
113 HG3 LYS 112 2HG LYS 112 8.188 -2.174 -8.828
114 HD2 LYS 112 1HD LYS 112 8.186 -3.160 -11.001
115 HD3 LYS 112 2HD LYS 112 6.905 -2.078 -11.553
116 HE2 LYS 112 1HE LYS 112 8.332 -0.238 -11.637
117 HE3 LYS 112 2HE LYS 112 9.518 -0.989 -10.570
118 HZ1 LYS 112 3HZ LYS 112 9.481 -0.985 -13.355
119 HZ2 LYS 112 1HZ LYS 112 9.209 -2.581 -12.864
120 HZ3 LYS 112 2HZ LYS 112 10.586 -1.756 -12.332
121 H SER 113 H SER 113 8.732 -4.962 -7.790
122 HA SER 113 HA SER 113 7.945 -4.826 -4.982
123 HB2 SER 113 1HB SER 113 9.924 -6.126 -4.521
124 HB3 SER 113 2HB SER 113 9.103 -6.854 -5.901
125 HG SER 113 HG SER 113 11.005 -6.675 -6.791
126 H PHE 114 H PHE 114 9.379 -3.845 -3.400
127 HA PHE 114 HA PHE 114 11.249 -1.846 -4.381
128 HB2 PHE 114 1HB PHE 114 8.790 -1.123 -2.773
129 HB3 PHE 114 2HB PHE 114 10.145 -0.037 -3.064
130 HD1 PHE 114 2HD PHE 114 7.360 -1.847 -4.652
131 HD2 PHE 114 1HD PHE 114 10.392 1.102 -5.128
132 HE1 PHE 114 2HE PHE 114 6.317 -1.120 -6.758
133 HE2 PHE 114 1HE PHE 114 9.354 1.834 -7.235
134 HZ PHE 114 HZ PHE 114 7.315 0.722 -8.053
135 H ARG 115 H ARG 115 12.385 -0.743 -2.556
136 HA ARG 115 HA ARG 115 13.099 -2.717 -0.571
137 HB2 ARG 115 1HB ARG 115 14.189 -0.054 -1.406
138 HB3 ARG 115 2HB ARG 115 14.681 -0.754 0.131
139 HG2 ARG 115 1HG ARG 115 15.251 -2.848 -1.258
140 HG3 ARG 115 2HG ARG 115 15.183 -1.754 -2.641
141 HD2 ARG 115 1HD ARG 115 16.970 -0.466 -1.857
142 HD3 ARG 115 2HD ARG 115 16.824 -1.101 -0.218
143 HE ARG 115 HE ARG 115 18.089 -2.920 -0.836
144 HH11 ARG 115 2HH1 ARG 115 17.138 -1.132 -3.667
145 HH12 ARG 115 1HH1 ARG 115 18.187 -2.008 -4.733
146 HH21 ARG 115 2HH2 ARG 115 19.474 -4.081 -2.228
147 HH22 ARG 115 1HH2 ARG 115 19.514 -3.686 -3.913
148 H ALA 116 H ALA 116 11.783 0.583 -0.572
149 HA ALA 116 HA ALA 116 10.917 0.144 2.213
150 HB1 ALA 116 3HB ALA 116 12.606 1.918 1.989
151 HB2 ALA 116 1HB ALA 116 11.535 2.781 0.885
152 HB3 ALA 116 2HB ALA 116 11.059 2.537 2.566
153 H LYS 117 H LYS 117 8.873 1.027 2.832
154 HA LYS 117 HA LYS 117 6.763 0.464 1.154
155 HB2 LYS 117 1HB LYS 117 6.786 0.912 3.694
156 HB3 LYS 117 2HB LYS 117 6.566 2.602 3.261
157 HG2 LYS 117 1HG LYS 117 4.429 2.287 2.543
158 HG3 LYS 117 2HG LYS 117 4.717 0.612 2.068
159 HD2 LYS 117 1HD LYS 117 3.439 0.275 3.935
160 HD3 LYS 117 2HD LYS 117 5.044 0.299 4.671
161 HE2 LYS 117 1HE LYS 117 3.493 2.838 4.384
162 HE3 LYS 117 2HE LYS 117 3.114 1.722 5.695
163 HZ1 LYS 117 3HZ LYS 117 5.267 1.945 6.579
164 HZ2 LYS 117 1HZ LYS 117 4.772 3.521 6.212
165 HZ3 LYS 117 2HZ LYS 117 5.858 2.717 5.195
166 H GLY 118 H GLY 118 7.676 3.787 2.098
167 HA2 GLY 118 1HA GLY 118 6.181 5.314 0.503
168 HA3 GLY 118 2HA GLY 118 7.888 5.665 0.735
169 H ASN 119 H ASN 119 9.326 4.143 -0.709
170 HA ASN 119 HA ASN 119 9.223 4.928 -3.285
171 HB2 ASN 119 1HB ASN 119 10.285 2.436 -2.018
172 HB3 ASN 119 2HB ASN 119 10.309 2.571 -3.773
173 HD21 ASN 119 1HD2 ASN 119 12.665 2.360 -3.184
174 HD22 ASN 119 2HD2 ASN 119 13.535 3.833 -2.937
175 H LEU 120 H LEU 120 7.727 1.941 -2.057
176 HA LEU 120 HA LEU 120 6.560 1.213 -4.537
177 HB2 LEU 120 1HB LEU 120 6.850 -0.526 -3.004
178 HB3 LEU 120 2HB LEU 120 6.112 0.389 -1.691
179 HG LEU 120 HG LEU 120 3.914 0.093 -2.700
180 HD11 LEU 120 1HD1 LEU 120 4.952 -0.050 -5.062
181 HD12 LEU 120 2HD1 LEU 120 3.511 -1.000 -4.701
182 HD13 LEU 120 3HD1 LEU 120 5.096 -1.774 -4.716
183 HD21 LEU 120 3HD2 LEU 120 5.592 -2.337 -2.186
184 HD22 LEU 120 1HD2 LEU 120 3.879 -2.477 -2.584
185 HD23 LEU 120 2HD2 LEU 120 4.380 -1.580 -1.150
186 H VAL 121 H VAL 121 5.176 2.681 -1.600
187 HA VAL 121 HA VAL 121 2.565 2.965 -2.298
188 HB VAL 121 HB VAL 121 4.270 5.053 -0.934
189 HG11 VAL 121 1HG1 VAL 121 2.186 6.016 -1.749
190 HG12 VAL 121 2HG1 VAL 121 1.271 4.726 -0.966
191 HG13 VAL 121 3HG1 VAL 121 2.171 5.888 0.010
192 HG21 VAL 121 3HG2 VAL 121 3.549 2.471 -0.123
193 HG22 VAL 121 1HG2 VAL 121 4.246 3.753 0.868
194 HG23 VAL 121 2HG2 VAL 121 2.495 3.566 0.771
195 H THR 122 H THR 122 5.212 5.133 -3.249
196 HA THR 122 HA THR 122 3.642 6.971 -4.686
197 HB THR 122 HB THR 122 6.559 6.257 -4.790
198 HG1 THR 122 1HG THR 122 5.346 8.756 -4.214
199 HG21 THR 122 3HG2 THR 122 5.108 8.245 -6.537
200 HG22 THR 122 1HG2 THR 122 6.035 6.841 -7.066
201 HG23 THR 122 2HG2 THR 122 6.857 8.208 -6.314
202 H HIS 123 H HIS 123 5.077 3.900 -5.579
203 HA HIS 123 HA HIS 123 4.705 4.166 -8.384
204 HB2 HIS 123 1HB HIS 123 6.266 2.535 -7.855
205 HB3 HIS 123 2HB HIS 123 5.302 1.895 -6.528
206 HD1 HIS 123 1HD HIS 123 5.710 1.695 -10.243
207 HD2 HIS 123 2HD HIS 123 3.445 -0.065 -7.237
208 HE1 HIS 123 1HE HIS 123 4.598 -0.291 -11.313
209 H GLN 124 H GLN 124 2.836 2.536 -5.837
210 HA GLN 124 HA GLN 124 0.846 1.400 -7.367
211 HB2 GLN 124 1HB GLN 124 0.160 2.730 -4.770
212 HB3 GLN 124 2HB GLN 124 -0.403 1.191 -5.410
213 HG2 GLN 124 1HG GLN 124 2.138 0.548 -5.168
214 HG3 GLN 124 2HG GLN 124 2.112 1.847 -3.976
215 HE21 GLN 124 1HE2 GLN 124 0.647 -1.215 -4.882
216 HE22 GLN 124 2HE2 GLN 124 0.136 -1.654 -3.291
217 H ARG 125 H ARG 125 1.264 4.746 -6.433
218 HA ARG 125 HA ARG 125 -1.257 5.774 -6.916
219 HB2 ARG 125 1HB ARG 125 1.379 7.091 -7.596
220 HB3 ARG 125 2HB ARG 125 -0.157 7.910 -7.348
221 HG2 ARG 125 1HG ARG 125 -0.174 7.170 -5.017
222 HG3 ARG 125 2HG ARG 125 1.374 6.361 -5.269
223 HD2 ARG 125 1HD ARG 125 1.794 8.476 -4.230
224 HD3 ARG 125 2HD ARG 125 2.347 8.563 -5.901
225 HE ARG 125 HE ARG 125 0.148 10.020 -4.710
226 HH11 ARG 125 2HH1 ARG 125 1.719 8.983 -7.639
227 HH12 ARG 125 1HH1 ARG 125 1.009 10.226 -8.615
228 HH21 ARG 125 2HH2 ARG 125 -0.794 11.661 -5.985
229 HH22 ARG 125 1HH2 ARG 125 -0.419 11.749 -7.673
230 H ILE 126 H ILE 126 0.927 4.370 -9.127
231 HA ILE 126 HA ILE 126 0.026 5.732 -11.480
232 HB ILE 126 HB ILE 126 1.394 4.289 -12.717
233 HG12 ILE 126 1HG1 ILE 126 1.201 2.368 -10.389
234 HG13 ILE 126 2HG1 ILE 126 0.516 2.156 -11.997
235 HG21 ILE 126 1HG2 ILE 126 2.382 5.250 -10.168
236 HG22 ILE 126 2HG2 ILE 126 3.320 3.885 -10.772
237 HG23 ILE 126 3HG2 ILE 126 3.121 5.327 -11.767
238 HD11 ILE 126 3HD1 ILE 126 2.380 0.829 -12.099
239 HD12 ILE 126 1HD1 ILE 126 2.992 2.340 -12.770
240 HD13 ILE 126 2HD1 ILE 126 3.341 1.913 -11.094
241 H HIS 127 H HIS 127 -0.943 2.882 -9.715
242 HA HIS 127 HA HIS 127 -2.634 1.869 -11.815
243 HB2 HIS 127 1HB HIS 127 -2.338 1.121 -8.902
244 HB3 HIS 127 2HB HIS 127 -3.431 0.300 -10.012
245 HD1 HIS 127 1HD HIS 127 -2.249 -0.963 -12.057
246 HD2 HIS 127 2HD HIS 127 0.253 0.248 -8.969
247 HE1 HIS 127 1HE HIS 127 -0.122 -2.268 -12.365
248 H THR 128 H THR 128 -3.182 3.392 -8.645
249 HA THR 128 HA THR 128 -5.837 3.467 -8.375
250 HB THR 128 HB THR 128 -5.696 5.695 -7.375
251 HG1 THR 128 1HG THR 128 -4.365 6.798 -8.777
252 HG21 THR 128 3HG2 THR 128 -3.095 4.424 -6.647
253 HG22 THR 128 1HG2 THR 128 -4.592 3.533 -6.374
254 HG23 THR 128 2HG2 THR 128 -4.345 5.101 -5.604
255 H GLY 129 H GLY 129 -7.504 3.879 -9.662
256 HA2 GLY 129 1HA GLY 129 -7.166 5.932 -11.762
257 HA3 GLY 129 2HA GLY 129 -8.060 4.441 -12.024
258 H GLU 130 H GLU 130 -8.048 6.914 -9.453
259 HA GLU 130 HA GLU 130 -10.962 7.154 -9.833
260 HB2 GLU 130 1HB GLU 130 -9.328 7.180 -7.301
261 HB3 GLU 130 2HB GLU 130 -10.966 7.815 -7.364
262 HG2 GLU 130 1HG GLU 130 -10.179 4.996 -8.062
263 HG3 GLU 130 2HG GLU 130 -10.861 5.511 -6.520
264 H LYS 131 H LYS 131 -11.778 9.142 -10.130
265 HA LYS 131 HA LYS 131 -10.348 11.508 -9.296
266 HB2 LYS 131 1HB LYS 131 -10.161 12.493 -11.512
267 HB3 LYS 131 2HB LYS 131 -9.267 10.980 -11.448
268 HG2 LYS 131 1HG LYS 131 -10.830 9.859 -12.765
269 HG3 LYS 131 2HG LYS 131 -12.074 11.080 -12.488
270 HD2 LYS 131 1HD LYS 131 -11.393 11.588 -14.633
271 HD3 LYS 131 2HD LYS 131 -10.379 12.670 -13.676
272 HE2 LYS 131 1HE LYS 131 -8.995 11.634 -15.324
273 HE3 LYS 131 2HE LYS 131 -8.585 10.936 -13.758
274 HZ1 LYS 131 3HZ LYS 131 -8.987 8.949 -14.612
275 HZ2 LYS 131 1HZ LYS 131 -9.470 9.627 -16.085
276 HZ3 LYS 131 2HZ LYS 131 -10.606 9.373 -14.858
277 H SER 132 H SER 132 -11.657 13.305 -9.138
278 HA SER 132 HA SER 132 -14.420 13.061 -10.097
279 HB2 SER 132 1HB SER 132 -13.609 13.797 -7.275
280 HB3 SER 132 2HB SER 132 -15.247 13.924 -7.917
281 HG SER 132 HG SER 132 -14.290 11.864 -6.753
282 H GLY 133 H GLY 133 -15.549 15.076 -10.291
283 HA2 GLY 133 1HA GLY 133 -15.708 17.407 -10.433
284 HA3 GLY 133 2HA GLY 133 -14.025 17.529 -9.943
285 HA PRO 134 HA PRO 134 -14.166 18.592 -14.417
286 HB2 PRO 134 1HB PRO 134 -12.312 20.565 -14.226
287 HB3 PRO 134 2HB PRO 134 -14.031 20.828 -13.908
288 HG2 PRO 134 1HG PRO 134 -11.792 20.386 -11.971
289 HG3 PRO 134 2HG PRO 134 -13.130 21.546 -11.888
290 HD2 PRO 134 1HD PRO 134 -13.131 19.220 -10.501
291 HD3 PRO 134 2HD PRO 134 -14.620 19.965 -11.118
292 H SER 135 H SER 135 -12.303 18.732 -15.974
293 HA SER 135 HA SER 135 -10.294 16.737 -15.223
294 HB2 SER 135 1HB SER 135 -11.429 17.668 -17.843
295 HB3 SER 135 2HB SER 135 -9.876 16.835 -17.798
296 HG SER 135 HG SER 135 -12.408 15.877 -16.980
297 H SER 136 H SER 136 -8.198 17.214 -15.015
298 HA SER 136 HA SER 136 -7.273 19.850 -15.951
299 HB2 SER 136 1HB SER 136 -5.761 19.878 -13.950
300 HB3 SER 136 2HB SER 136 -7.476 19.969 -13.549
301 HG SER 136 HG SER 136 -7.203 17.527 -13.409
302 H GLY 137 H GLY 137 -5.293 19.946 -16.924
303 HA2 GLY 137 1HA GLY 137 -3.488 19.174 -18.115
304 HA3 GLY 137 2HA GLY 137 -3.217 18.112 -16.740
Start of MODEL 16
1 H1 GLY 93 H GLY 93 -4.043 -23.483 -7.366
2 HA2 GLY 93 1HA GLY 93 -3.118 -21.238 -8.859
3 HA3 GLY 93 2HA GLY 93 -3.703 -20.742 -7.277
4 H SER 94 H SER 94 -1.272 -20.091 -7.422
5 HA SER 94 HA SER 94 0.180 -22.095 -5.875
6 HB2 SER 94 1HB SER 94 2.255 -21.671 -7.221
7 HB3 SER 94 2HB SER 94 0.991 -22.526 -8.105
8 HG SER 94 HG SER 94 0.388 -20.282 -8.815
9 H SER 95 H SER 95 0.809 -21.135 -4.071
10 HA SER 95 HA SER 95 1.453 -18.261 -4.152
11 HB2 SER 95 1HB SER 95 0.800 -18.160 -1.797
12 HB3 SER 95 2HB SER 95 -0.518 -18.817 -2.766
13 HG SER 95 HG SER 95 1.282 -20.222 -1.091
14 H GLY 96 H GLY 96 3.634 -18.336 -4.522
15 HA2 GLY 96 1HA GLY 96 5.571 -18.224 -2.833
16 HA3 GLY 96 2HA GLY 96 5.265 -19.946 -2.672
17 H SER 97 H SER 97 5.345 -17.839 -5.535
18 HA SER 97 HA SER 97 6.529 -19.656 -7.243
19 HB2 SER 97 1HB SER 97 6.418 -16.662 -7.190
20 HB3 SER 97 2HB SER 97 7.411 -17.469 -8.404
21 HG SER 97 HG SER 97 4.640 -17.423 -8.103
22 H SER 98 H SER 98 8.660 -19.925 -8.026
23 HA SER 98 HA SER 98 10.643 -19.991 -6.012
24 HB2 SER 98 1HB SER 98 12.045 -20.996 -7.621
25 HB3 SER 98 2HB SER 98 10.419 -21.491 -8.092
26 HG SER 98 HG SER 98 12.019 -19.455 -9.241
27 H GLY 99 H GLY 99 12.904 -19.070 -6.440
28 HA2 GLY 99 1HA GLY 99 13.655 -16.953 -7.895
29 HA3 GLY 99 2HA GLY 99 12.601 -16.192 -6.712
30 H THR 100 H THR 100 14.142 -15.018 -5.647
31 HA THR 100 HA THR 100 16.175 -16.588 -4.199
32 HB THR 100 HB THR 100 17.649 -14.621 -4.237
33 HG1 THR 100 1HG THR 100 15.996 -13.024 -4.504
34 HG21 THR 100 3HG2 THR 100 17.832 -14.567 -6.891
35 HG22 THR 100 1HG2 THR 100 16.736 -15.940 -6.739
36 HG23 THR 100 2HG2 THR 100 18.314 -15.978 -5.950
37 H GLY 101 H GLY 101 13.614 -14.306 -4.056
38 HA2 GLY 101 1HA GLY 101 12.866 -14.454 -1.521
39 HA3 GLY 101 2HA GLY 101 14.293 -13.443 -1.351
40 H GLN 102 H GLN 102 11.137 -13.200 -1.283
41 HA GLN 102 HA GLN 102 10.633 -11.086 -3.152
42 HB2 GLN 102 1HB GLN 102 8.456 -10.928 -2.115
43 HB3 GLN 102 2HB GLN 102 8.863 -12.624 -2.344
44 HG2 GLN 102 1HG GLN 102 9.613 -12.658 0.053
45 HG3 GLN 102 2HG GLN 102 8.909 -11.050 0.214
46 HE21 GLN 102 1HE2 GLN 102 8.306 -14.423 -0.010
47 HE22 GLN 102 2HE2 GLN 102 6.596 -14.359 0.231
48 H LYS 103 H LYS 103 9.980 -8.909 -2.529
49 HA LYS 103 HA LYS 103 11.789 -7.836 -0.519
50 HB2 LYS 103 1HB LYS 103 10.281 -6.737 -2.835
51 HB3 LYS 103 2HB LYS 103 10.640 -5.636 -1.512
52 HG2 LYS 103 1HG LYS 103 12.485 -5.299 -2.788
53 HG3 LYS 103 2HG LYS 103 13.065 -6.645 -1.804
54 HD2 LYS 103 1HD LYS 103 11.644 -7.258 -4.347
55 HD3 LYS 103 2HD LYS 103 13.300 -6.655 -4.436
56 HE2 LYS 103 1HE LYS 103 14.175 -8.516 -3.424
57 HE3 LYS 103 2HE LYS 103 12.694 -8.860 -2.532
58 HZ1 LYS 103 3HZ LYS 103 11.819 -10.018 -4.250
59 HZ2 LYS 103 1HZ LYS 103 13.450 -10.273 -4.620
60 HZ3 LYS 103 2HZ LYS 103 12.573 -9.080 -5.438
61 HA PRO 104 HA PRO 104 8.822 -6.972 2.595
62 HB2 PRO 104 1HB PRO 104 9.559 -4.504 3.453
63 HB3 PRO 104 2HB PRO 104 10.502 -5.960 3.791
64 HG2 PRO 104 1HG PRO 104 10.925 -3.876 1.685
65 HG3 PRO 104 2HG PRO 104 12.118 -4.667 2.731
66 HD2 PRO 104 1HD PRO 104 11.721 -5.406 0.157
67 HD3 PRO 104 2HD PRO 104 12.201 -6.560 1.418
68 H PHE 105 H PHE 105 8.882 -5.190 -0.261
69 HA PHE 105 HA PHE 105 6.167 -4.253 0.206
70 HB2 PHE 105 1HB PHE 105 8.237 -2.339 -0.870
71 HB3 PHE 105 2HB PHE 105 6.576 -1.985 -0.408
72 HD1 PHE 105 2HD PHE 105 5.940 -1.945 1.978
73 HD2 PHE 105 1HD PHE 105 9.986 -2.380 0.729
74 HE1 PHE 105 2HE PHE 105 6.699 -1.327 4.235
75 HE2 PHE 105 1HE PHE 105 10.752 -1.764 2.985
76 HZ PHE 105 HZ PHE 105 9.108 -1.235 4.741
77 H GLU 106 H GLU 106 5.196 -5.367 -1.376
78 HA GLU 106 HA GLU 106 6.282 -5.093 -4.102
79 HB2 GLU 106 1HB GLU 106 6.377 -7.420 -3.001
80 HB3 GLU 106 2HB GLU 106 4.631 -7.441 -3.202
81 HG2 GLU 106 1HG GLU 106 4.807 -7.349 -5.558
82 HG3 GLU 106 2HG GLU 106 6.527 -6.973 -5.482
83 H CYS 107 H CYS 107 4.827 -4.747 -5.774
84 HA CYS 107 HA CYS 107 2.270 -3.633 -4.936
85 HB2 CYS 107 1HB CYS 107 3.797 -2.381 -6.474
86 HB3 CYS 107 2HB CYS 107 3.528 -3.629 -7.686
87 H THR 108 H THR 108 1.306 -5.701 -4.433
88 HA THR 108 HA THR 108 0.981 -7.935 -5.867
89 HB THR 108 HB THR 108 -0.215 -7.561 -3.768
90 HG1 THR 108 1HG THR 108 -1.921 -8.247 -5.950
91 HG21 THR 108 3HG2 THR 108 -0.980 -5.289 -4.098
92 HG22 THR 108 1HG2 THR 108 -2.368 -6.331 -3.786
93 HG23 THR 108 2HG2 THR 108 -2.018 -5.798 -5.430
94 H HIS 109 H HIS 109 -0.615 -4.863 -6.583
95 HA HIS 109 HA HIS 109 -2.429 -5.503 -8.487
96 HB2 HIS 109 1HB HIS 109 -0.440 -3.230 -8.656
97 HB3 HIS 109 2HB HIS 109 -1.946 -3.334 -9.564
98 HD2 HIS 109 2HD HIS 109 -4.302 -3.299 -7.805
99 HE1 HIS 109 1HE HIS 109 -2.210 -1.167 -4.792
100 HE2 HIS 109 2HE HIS 109 -4.459 -1.975 -5.588
101 H CYS 110 H CYS 110 0.929 -4.662 -9.356
102 HA CYS 110 HA CYS 110 0.642 -6.377 -11.731
103 HB2 CYS 110 1HB CYS 110 2.470 -5.033 -12.711
104 HB3 CYS 110 2HB CYS 110 1.076 -4.047 -12.284
105 H GLY 111 H GLY 111 2.876 -5.462 -9.133
106 HA2 GLY 111 1HA GLY 111 3.905 -7.513 -8.066
107 HA3 GLY 111 2HA GLY 111 4.408 -7.922 -9.700
108 H LYS 112 H LYS 112 4.458 -4.590 -9.059
109 HA LYS 112 HA LYS 112 7.276 -4.438 -9.387
110 HB2 LYS 112 1HB LYS 112 5.456 -2.697 -9.989
111 HB3 LYS 112 2HB LYS 112 5.587 -2.197 -8.308
112 HG2 LYS 112 1HG LYS 112 7.066 -0.759 -9.269
113 HG3 LYS 112 2HG LYS 112 8.152 -2.096 -8.882
114 HD2 LYS 112 1HD LYS 112 8.192 -2.849 -11.107
115 HD3 LYS 112 2HD LYS 112 6.769 -1.899 -11.543
116 HE2 LYS 112 1HE LYS 112 8.051 0.159 -11.260
117 HE3 LYS 112 2HE LYS 112 9.468 -0.778 -10.790
118 HZ1 LYS 112 3HZ LYS 112 10.000 -0.873 -12.924
119 HZ2 LYS 112 1HZ LYS 112 8.555 -0.123 -13.383
120 HZ3 LYS 112 2HZ LYS 112 8.618 -1.805 -13.215
121 H SER 113 H SER 113 8.735 -4.899 -7.890
122 HA SER 113 HA SER 113 8.023 -4.775 -5.068
123 HB2 SER 113 1HB SER 113 10.104 -5.982 -4.679
124 HB3 SER 113 2HB SER 113 9.193 -6.773 -5.964
125 HG SER 113 HG SER 113 11.546 -5.249 -6.123
126 H PHE 114 H PHE 114 9.579 -3.838 -3.518
127 HA PHE 114 HA PHE 114 11.319 -1.748 -4.527
128 HB2 PHE 114 1HB PHE 114 8.909 -1.128 -2.809
129 HB3 PHE 114 2HB PHE 114 10.222 0.001 -3.123
130 HD1 PHE 114 2HD PHE 114 7.435 -1.856 -4.658
131 HD2 PHE 114 1HD PHE 114 10.352 1.203 -5.159
132 HE1 PHE 114 2HE PHE 114 6.295 -1.109 -6.705
133 HE2 PHE 114 1HE PHE 114 9.215 1.955 -7.208
134 HZ PHE 114 HZ PHE 114 7.185 0.798 -7.984
135 H ARG 115 H ARG 115 12.375 -0.563 -2.629
136 HA ARG 115 HA ARG 115 13.265 -2.586 -0.745
137 HB2 ARG 115 1HB ARG 115 14.779 -0.961 -2.048
138 HB3 ARG 115 2HB ARG 115 14.261 0.250 -0.883
139 HG2 ARG 115 1HG ARG 115 16.153 -0.461 0.144
140 HG3 ARG 115 2HG ARG 115 15.011 -1.614 0.838
141 HD2 ARG 115 1HD ARG 115 16.927 -2.838 0.119
142 HD3 ARG 115 2HD ARG 115 15.614 -3.193 -1.002
143 HE ARG 115 HE ARG 115 16.937 -1.128 -2.175
144 HH11 ARG 115 2HH1 ARG 115 17.882 -4.254 -0.970
145 HH12 ARG 115 1HH1 ARG 115 19.175 -4.447 -2.108
146 HH21 ARG 115 2HH2 ARG 115 18.636 -1.370 -3.678
147 HH22 ARG 115 1HH2 ARG 115 19.603 -2.805 -3.647
148 H ALA 116 H ALA 116 11.733 0.606 -0.688
149 HA ALA 116 HA ALA 116 11.002 0.111 2.125
150 HB1 ALA 116 3HB ALA 116 11.682 2.734 0.807
151 HB2 ALA 116 1HB ALA 116 10.999 2.578 2.426
152 HB3 ALA 116 2HB ALA 116 12.592 1.907 2.071
153 H LYS 117 H LYS 117 8.946 0.876 2.806
154 HA LYS 117 HA LYS 117 6.816 0.322 1.169
155 HB2 LYS 117 1HB LYS 117 6.881 0.717 3.714
156 HB3 LYS 117 2HB LYS 117 6.625 2.413 3.325
157 HG2 LYS 117 1HG LYS 117 4.480 2.076 2.624
158 HG3 LYS 117 2HG LYS 117 4.782 0.406 2.140
159 HD2 LYS 117 1HD LYS 117 3.515 0.090 4.033
160 HD3 LYS 117 2HD LYS 117 5.144 0.050 4.713
161 HE2 LYS 117 1HE LYS 117 4.933 2.128 5.681
162 HE3 LYS 117 2HE LYS 117 3.710 2.659 4.528
163 HZ1 LYS 117 3HZ LYS 117 3.137 1.957 7.009
164 HZ2 LYS 117 1HZ LYS 117 2.981 0.443 6.270
165 HZ3 LYS 117 2HZ LYS 117 2.050 1.748 5.730
166 H GLY 118 H GLY 118 7.640 3.652 2.166
167 HA2 GLY 118 1HA GLY 118 6.078 5.160 0.619
168 HA3 GLY 118 2HA GLY 118 7.775 5.562 0.839
169 H ASN 119 H ASN 119 9.274 4.242 -0.665
170 HA ASN 119 HA ASN 119 9.098 5.036 -3.215
171 HB2 ASN 119 1HB ASN 119 10.855 3.492 -1.971
172 HB3 ASN 119 2HB ASN 119 10.009 2.216 -2.841
173 HD21 ASN 119 1HD2 ASN 119 12.716 2.975 -3.199
174 HD22 ASN 119 2HD2 ASN 119 12.889 3.545 -4.821
175 H LEU 120 H LEU 120 7.728 1.969 -2.038
176 HA LEU 120 HA LEU 120 6.564 1.254 -4.525
177 HB2 LEU 120 1HB LEU 120 6.959 -0.499 -3.018
178 HB3 LEU 120 2HB LEU 120 6.157 0.345 -1.696
179 HG LEU 120 HG LEU 120 3.990 -0.037 -2.762
180 HD11 LEU 120 1HD1 LEU 120 3.697 -1.182 -4.765
181 HD12 LEU 120 2HD1 LEU 120 5.342 -1.816 -4.757
182 HD13 LEU 120 3HD1 LEU 120 5.057 -0.110 -5.099
183 HD21 LEU 120 3HD2 LEU 120 5.748 -2.428 -2.283
184 HD22 LEU 120 1HD2 LEU 120 4.017 -2.568 -2.593
185 HD23 LEU 120 2HD2 LEU 120 4.590 -1.678 -1.183
186 H VAL 121 H VAL 121 5.159 2.588 -1.535
187 HA VAL 121 HA VAL 121 2.530 2.784 -2.188
188 HB VAL 121 HB VAL 121 4.170 4.917 -0.811
189 HG11 VAL 121 1HG1 VAL 121 1.522 5.056 -1.688
190 HG12 VAL 121 2HG1 VAL 121 1.426 4.719 0.042
191 HG13 VAL 121 3HG1 VAL 121 2.323 6.124 -0.537
192 HG21 VAL 121 3HG2 VAL 121 2.958 3.738 1.200
193 HG22 VAL 121 1HG2 VAL 121 2.899 2.374 0.083
194 HG23 VAL 121 2HG2 VAL 121 4.452 3.077 0.535
195 H THR 122 H THR 122 5.091 5.027 -3.183
196 HA THR 122 HA THR 122 3.415 6.842 -4.548
197 HB THR 122 HB THR 122 6.359 6.260 -4.685
198 HG1 THR 122 1HG THR 122 5.224 8.771 -4.162
199 HG21 THR 122 3HG2 THR 122 4.799 8.171 -6.423
200 HG22 THR 122 1HG2 THR 122 5.822 6.835 -6.951
201 HG23 THR 122 2HG2 THR 122 6.545 8.252 -6.190
202 H HIS 123 H HIS 123 4.981 3.856 -5.512
203 HA HIS 123 HA HIS 123 4.601 4.135 -8.304
204 HB2 HIS 123 1HB HIS 123 6.173 2.514 -7.765
205 HB3 HIS 123 2HB HIS 123 5.187 1.841 -6.470
206 HD1 HIS 123 1HD HIS 123 5.700 1.694 -10.170
207 HD2 HIS 123 2HD HIS 123 3.335 -0.100 -7.263
208 HE1 HIS 123 1HE HIS 123 4.621 -0.275 -11.302
209 H GLN 124 H GLN 124 2.717 2.470 -5.792
210 HA GLN 124 HA GLN 124 0.754 1.324 -7.347
211 HB2 GLN 124 1HB GLN 124 0.037 2.651 -4.754
212 HB3 GLN 124 2HB GLN 124 -0.529 1.119 -5.407
213 HG2 GLN 124 1HG GLN 124 1.990 0.440 -5.140
214 HG3 GLN 124 2HG GLN 124 1.992 1.754 -3.965
215 HE21 GLN 124 1HE2 GLN 124 2.441 -0.959 -3.358
216 HE22 GLN 124 2HE2 GLN 124 1.160 -1.496 -2.331
217 H ARG 125 H ARG 125 1.117 4.673 -6.382
218 HA ARG 125 HA ARG 125 -1.397 5.683 -6.905
219 HB2 ARG 125 1HB ARG 125 1.254 6.999 -7.528
220 HB3 ARG 125 2HB ARG 125 -0.289 7.826 -7.364
221 HG2 ARG 125 1HG ARG 125 -0.406 7.091 -5.017
222 HG3 ARG 125 2HG ARG 125 1.181 6.340 -5.198
223 HD2 ARG 125 1HD ARG 125 1.326 8.552 -4.145
224 HD3 ARG 125 2HD ARG 125 2.174 8.499 -5.690
225 HE ARG 125 HE ARG 125 -0.297 9.424 -6.336
226 HH11 ARG 125 2HH1 ARG 125 2.138 10.398 -4.047
227 HH12 ARG 125 1HH1 ARG 125 1.707 12.076 -4.105
228 HH21 ARG 125 2HH2 ARG 125 -0.874 11.630 -6.421
229 HH22 ARG 125 1HH2 ARG 125 -0.007 12.775 -5.455
230 H ILE 126 H ILE 126 0.828 4.303 -9.095
231 HA ILE 126 HA ILE 126 -0.071 5.653 -11.455
232 HB ILE 126 HB ILE 126 1.336 4.241 -12.678
233 HG12 ILE 126 1HG1 ILE 126 1.160 2.298 -10.366
234 HG13 ILE 126 2HG1 ILE 126 0.461 2.094 -11.968
235 HG21 ILE 126 1HG2 ILE 126 2.279 5.193 -10.107
236 HG22 ILE 126 2HG2 ILE 126 3.241 3.844 -10.711
237 HG23 ILE 126 3HG2 ILE 126 3.037 5.293 -11.696
238 HD11 ILE 126 3HD1 ILE 126 3.304 1.887 -11.102
239 HD12 ILE 126 1HD1 ILE 126 2.341 0.780 -12.081
240 HD13 ILE 126 2HD1 ILE 126 2.919 2.296 -12.773
241 H HIS 127 H HIS 127 -1.006 2.782 -9.703
242 HA HIS 127 HA HIS 127 -2.638 1.711 -11.809
243 HB2 HIS 127 1HB HIS 127 -2.403 1.058 -8.870
244 HB3 HIS 127 2HB HIS 127 -3.493 0.208 -9.961
245 HD1 HIS 127 1HD HIS 127 -2.304 -1.132 -11.953
246 HD2 HIS 127 2HD HIS 127 0.181 0.163 -8.886
247 HE1 HIS 127 1HE HIS 127 -0.185 -2.463 -12.198
248 H THR 128 H THR 128 -3.312 3.320 -8.706
249 HA THR 128 HA THR 128 -5.982 3.374 -8.550
250 HB THR 128 HB THR 128 -5.895 5.614 -7.573
251 HG1 THR 128 1HG THR 128 -4.498 6.953 -8.418
252 HG21 THR 128 3HG2 THR 128 -4.948 3.557 -6.393
253 HG22 THR 128 1HG2 THR 128 -4.454 5.131 -5.771
254 HG23 THR 128 2HG2 THR 128 -3.356 4.202 -6.791
255 H GLY 129 H GLY 129 -7.731 4.471 -9.425
256 HA2 GLY 129 1HA GLY 129 -7.370 5.330 -12.173
257 HA3 GLY 129 2HA GLY 129 -8.901 5.098 -11.342
258 H GLU 130 H GLU 130 -6.060 7.245 -11.320
259 HA GLU 130 HA GLU 130 -7.888 9.477 -10.718
260 HB2 GLU 130 1HB GLU 130 -5.931 10.623 -9.725
261 HB3 GLU 130 2HB GLU 130 -6.337 9.128 -8.894
262 HG2 GLU 130 1HG GLU 130 -4.544 7.992 -10.177
263 HG3 GLU 130 2HG GLU 130 -4.092 9.557 -10.849
264 H LYS 131 H LYS 131 -4.916 8.590 -12.447
265 HA LYS 131 HA LYS 131 -5.255 10.932 -14.180
266 HB2 LYS 131 1HB LYS 131 -2.926 9.101 -13.638
267 HB3 LYS 131 2HB LYS 131 -2.937 10.205 -15.007
268 HG2 LYS 131 1HG LYS 131 -3.124 12.102 -13.528
269 HG3 LYS 131 2HG LYS 131 -3.250 11.034 -12.129
270 HD2 LYS 131 1HD LYS 131 -1.013 10.332 -12.332
271 HD3 LYS 131 2HD LYS 131 -0.875 10.976 -13.970
272 HE2 LYS 131 1HE LYS 131 -1.399 12.746 -11.601
273 HE3 LYS 131 2HE LYS 131 0.236 12.291 -12.079
274 HZ1 LYS 131 3HZ LYS 131 -1.748 13.775 -13.713
275 HZ2 LYS 131 1HZ LYS 131 -0.264 13.215 -14.303
276 HZ3 LYS 131 2HZ LYS 131 -0.302 14.376 -13.074
277 H SER 132 H SER 132 -4.343 7.498 -14.529
278 HA SER 132 HA SER 132 -5.241 7.519 -17.290
279 HB2 SER 132 1HB SER 132 -3.881 5.456 -15.560
280 HB3 SER 132 2HB SER 132 -4.486 5.072 -17.171
281 HG SER 132 HG SER 132 -2.489 6.947 -16.453
282 H GLY 133 H GLY 133 -7.457 7.688 -17.255
283 HA2 GLY 133 1HA GLY 133 -9.564 6.730 -17.362
284 HA3 GLY 133 2HA GLY 133 -8.892 5.259 -16.674
285 HA PRO 134 HA PRO 134 -9.803 8.085 -12.872
286 HB2 PRO 134 1HB PRO 134 -10.977 10.485 -13.355
287 HB3 PRO 134 2HB PRO 134 -9.223 10.264 -13.313
288 HG2 PRO 134 1HG PRO 134 -11.059 10.412 -15.674
289 HG3 PRO 134 2HG PRO 134 -9.468 11.162 -15.444
290 HD2 PRO 134 1HD PRO 134 -9.816 8.899 -16.889
291 HD3 PRO 134 2HD PRO 134 -8.338 9.221 -15.960
292 H SER 135 H SER 135 -11.738 8.366 -11.629
293 HA SER 135 HA SER 135 -14.080 7.227 -12.955
294 HB2 SER 135 1HB SER 135 -13.312 6.116 -10.914
295 HB3 SER 135 2HB SER 135 -13.476 7.624 -10.014
296 HG SER 135 HG SER 135 -15.741 7.542 -10.564
297 H SER 136 H SER 136 -16.233 8.059 -12.374
298 HA SER 136 HA SER 136 -16.743 10.585 -13.140
299 HB2 SER 136 1HB SER 136 -18.192 8.811 -11.201
300 HB3 SER 136 2HB SER 136 -18.788 10.441 -11.510
301 HG SER 136 HG SER 136 -18.417 9.598 -13.860
302 H GLY 137 H GLY 137 -16.522 9.683 -9.689
303 HA2 GLY 137 1HA GLY 137 -15.351 12.322 -9.154
304 HA3 GLY 137 2HA GLY 137 -16.792 11.846 -8.267
Start of MODEL 17
1 H1 GLY 93 H GLY 93 28.266 0.842 -17.906
2 HA2 GLY 93 1HA GLY 93 27.302 -1.300 -18.296
3 HA3 GLY 93 2HA GLY 93 27.555 -1.690 -16.601
4 H SER 94 H SER 94 25.350 -0.593 -18.924
5 HA SER 94 HA SER 94 23.568 1.038 -17.717
6 HB2 SER 94 1HB SER 94 21.757 -0.239 -18.928
7 HB3 SER 94 2HB SER 94 23.124 0.238 -19.934
8 HG SER 94 HG SER 94 22.314 -2.030 -20.073
9 H SER 95 H SER 95 22.438 1.054 -15.896
10 HA SER 95 HA SER 95 22.509 -1.142 -14.085
11 HB2 SER 95 1HB SER 95 21.413 0.276 -12.549
12 HB3 SER 95 2HB SER 95 22.393 1.367 -13.528
13 HG SER 95 HG SER 95 20.176 2.045 -13.198
14 H GLY 96 H GLY 96 20.892 -2.533 -13.436
15 HA2 GLY 96 1HA GLY 96 18.239 -2.572 -13.794
16 HA3 GLY 96 2HA GLY 96 18.805 -2.992 -15.404
17 H SER 97 H SER 97 18.531 -4.031 -12.089
18 HA SER 97 HA SER 97 19.248 -6.758 -12.946
19 HB2 SER 97 1HB SER 97 20.808 -5.471 -11.267
20 HB3 SER 97 2HB SER 97 19.564 -5.897 -10.092
21 HG SER 97 HG SER 97 20.720 -7.673 -10.004
22 H SER 98 H SER 98 17.516 -8.013 -12.976
23 HA SER 98 HA SER 98 15.004 -7.425 -12.033
24 HB2 SER 98 1HB SER 98 14.433 -9.720 -12.395
25 HB3 SER 98 2HB SER 98 15.658 -9.309 -13.595
26 HG SER 98 HG SER 98 17.079 -10.149 -11.671
27 H GLY 99 H GLY 99 13.750 -8.507 -10.296
28 HA2 GLY 99 1HA GLY 99 15.402 -8.919 -7.881
29 HA3 GLY 99 2HA GLY 99 13.938 -7.948 -7.852
30 H THR 100 H THR 100 14.901 -11.186 -9.001
31 HA THR 100 HA THR 100 12.420 -12.400 -8.776
32 HB THR 100 HB THR 100 13.708 -14.556 -8.498
33 HG1 THR 100 1HG THR 100 15.752 -12.686 -8.156
34 HG21 THR 100 3HG2 THR 100 14.978 -13.042 -10.725
35 HG22 THR 100 1HG2 THR 100 13.221 -13.176 -10.702
36 HG23 THR 100 2HG2 THR 100 14.216 -14.631 -10.733
37 H GLY 101 H GLY 101 14.870 -11.830 -6.315
38 HA2 GLY 101 1HA GLY 101 13.839 -13.496 -4.303
39 HA3 GLY 101 2HA GLY 101 14.826 -12.067 -4.034
40 H GLN 102 H GLN 102 12.814 -12.797 -2.276
41 HA GLN 102 HA GLN 102 10.410 -11.334 -2.841
42 HB2 GLN 102 1HB GLN 102 9.725 -11.946 -0.605
43 HB3 GLN 102 2HB GLN 102 10.441 -13.345 -1.394
44 HG2 GLN 102 1HG GLN 102 12.590 -12.752 -0.208
45 HG3 GLN 102 2HG GLN 102 11.641 -11.606 0.738
46 HE21 GLN 102 1HE2 GLN 102 12.869 -13.404 2.176
47 HE22 GLN 102 2HE2 GLN 102 11.804 -14.644 2.734
48 H LYS 103 H LYS 103 9.751 -9.376 -2.015
49 HA LYS 103 HA LYS 103 11.838 -7.775 -0.684
50 HB2 LYS 103 1HB LYS 103 9.894 -7.049 -2.857
51 HB3 LYS 103 2HB LYS 103 10.574 -5.811 -1.809
52 HG2 LYS 103 1HG LYS 103 11.965 -5.805 -3.671
53 HG3 LYS 103 2HG LYS 103 12.854 -6.759 -2.481
54 HD2 LYS 103 1HD LYS 103 11.909 -8.816 -3.538
55 HD3 LYS 103 2HD LYS 103 11.225 -7.790 -4.801
56 HE2 LYS 103 1HE LYS 103 13.259 -8.614 -5.667
57 HE3 LYS 103 2HE LYS 103 13.576 -6.944 -5.200
58 HZ1 LYS 103 3HZ LYS 103 14.666 -9.398 -4.128
59 HZ2 LYS 103 1HZ LYS 103 14.216 -8.260 -2.959
60 HZ3 LYS 103 2HZ LYS 103 15.329 -7.842 -4.162
61 HA PRO 104 HA PRO 104 9.033 -6.933 2.587
62 HB2 PRO 104 1HB PRO 104 9.750 -4.404 3.266
63 HB3 PRO 104 2HB PRO 104 10.754 -5.816 3.619
64 HG2 PRO 104 1HG PRO 104 10.986 -3.838 1.384
65 HG3 PRO 104 2HG PRO 104 12.264 -4.541 2.392
66 HD2 PRO 104 1HD PRO 104 11.729 -5.429 -0.109
67 HD3 PRO 104 2HD PRO 104 12.319 -6.499 1.178
68 H PHE 105 H PHE 105 8.941 -5.173 -0.323
69 HA PHE 105 HA PHE 105 6.192 -4.378 0.208
70 HB2 PHE 105 1HB PHE 105 8.165 -2.369 -0.882
71 HB3 PHE 105 2HB PHE 105 6.483 -2.090 -0.444
72 HD1 PHE 105 2HD PHE 105 5.817 -2.120 1.948
73 HD2 PHE 105 1HD PHE 105 9.891 -2.270 0.725
74 HE1 PHE 105 2HE PHE 105 6.517 -1.458 4.212
75 HE2 PHE 105 1HE PHE 105 10.598 -1.609 2.988
76 HZ PHE 105 HZ PHE 105 8.910 -1.201 4.734
77 H GLU 106 H GLU 106 5.216 -5.497 -1.362
78 HA GLU 106 HA GLU 106 6.246 -5.193 -4.106
79 HB2 GLU 106 1HB GLU 106 6.423 -7.517 -3.003
80 HB3 GLU 106 2HB GLU 106 4.676 -7.587 -3.184
81 HG2 GLU 106 1HG GLU 106 4.828 -7.476 -5.546
82 HG3 GLU 106 2HG GLU 106 6.543 -7.074 -5.481
83 H CYS 107 H CYS 107 4.789 -4.752 -5.714
84 HA CYS 107 HA CYS 107 2.200 -3.772 -4.837
85 HB2 CYS 107 1HB CYS 107 3.767 -2.524 -6.419
86 HB3 CYS 107 2HB CYS 107 3.298 -3.697 -7.645
87 H THR 108 H THR 108 1.545 -6.057 -4.356
88 HA THR 108 HA THR 108 1.208 -8.174 -5.933
89 HB THR 108 HB THR 108 0.196 -8.151 -3.749
90 HG1 THR 108 1HG THR 108 -1.723 -8.538 -5.822
91 HG21 THR 108 3HG2 THR 108 -0.775 -5.682 -4.412
92 HG22 THR 108 1HG2 THR 108 -1.272 -6.619 -3.004
93 HG23 THR 108 2HG2 THR 108 -2.229 -6.678 -4.484
94 H HIS 109 H HIS 109 -0.458 -5.118 -6.360
95 HA HIS 109 HA HIS 109 -2.473 -5.752 -8.101
96 HB2 HIS 109 1HB HIS 109 -0.677 -3.367 -7.870
97 HB3 HIS 109 2HB HIS 109 -1.820 -3.460 -9.206
98 HD2 HIS 109 2HD HIS 109 -1.917 -1.520 -6.292
99 HE1 HIS 109 1HE HIS 109 -5.693 -3.440 -6.066
100 HE2 HIS 109 2HE HIS 109 -4.304 -1.486 -5.296
101 H CYS 110 H CYS 110 0.875 -4.948 -9.030
102 HA CYS 110 HA CYS 110 0.414 -6.396 -11.556
103 HB2 CYS 110 1HB CYS 110 2.164 -4.934 -12.543
104 HB3 CYS 110 2HB CYS 110 0.751 -4.038 -11.995
105 H GLY 111 H GLY 111 2.775 -5.633 -9.028
106 HA2 GLY 111 1HA GLY 111 3.935 -7.711 -8.197
107 HA3 GLY 111 2HA GLY 111 4.328 -7.996 -9.886
108 H LYS 112 H LYS 112 4.346 -4.722 -8.899
109 HA LYS 112 HA LYS 112 7.173 -4.529 -9.386
110 HB2 LYS 112 1HB LYS 112 5.339 -2.813 -9.986
111 HB3 LYS 112 2HB LYS 112 5.448 -2.315 -8.302
112 HG2 LYS 112 1HG LYS 112 6.899 -0.846 -9.275
113 HG3 LYS 112 2HG LYS 112 8.008 -2.150 -8.840
114 HD2 LYS 112 1HD LYS 112 8.065 -2.967 -11.060
115 HD3 LYS 112 2HD LYS 112 6.685 -1.975 -11.538
116 HE2 LYS 112 1HE LYS 112 7.960 0.010 -11.449
117 HE3 LYS 112 2HE LYS 112 9.276 -0.784 -10.587
118 HZ1 LYS 112 3HZ LYS 112 9.911 -0.497 -12.853
119 HZ2 LYS 112 1HZ LYS 112 8.485 -1.212 -13.414
120 HZ3 LYS 112 2HZ LYS 112 9.637 -2.148 -12.604
121 H SER 113 H SER 113 8.655 -4.958 -7.902
122 HA SER 113 HA SER 113 7.968 -4.861 -5.075
123 HB2 SER 113 1HB SER 113 10.034 -6.046 -4.696
124 HB3 SER 113 2HB SER 113 9.214 -6.803 -6.062
125 HG SER 113 HG SER 113 11.267 -4.856 -6.292
126 H PHE 114 H PHE 114 9.548 -3.907 -3.538
127 HA PHE 114 HA PHE 114 11.196 -1.748 -4.547
128 HB2 PHE 114 1HB PHE 114 8.790 -1.213 -2.793
129 HB3 PHE 114 2HB PHE 114 10.062 -0.041 -3.127
130 HD1 PHE 114 2HD PHE 114 7.290 -1.962 -4.599
131 HD2 PHE 114 1HD PHE 114 10.139 1.146 -5.182
132 HE1 PHE 114 2HE PHE 114 6.092 -1.248 -6.626
133 HE2 PHE 114 1HE PHE 114 8.945 1.866 -7.209
134 HZ PHE 114 HZ PHE 114 6.919 0.668 -7.934
135 H ARG 115 H ARG 115 12.093 -0.472 -2.547
136 HA ARG 115 HA ARG 115 13.084 -2.506 -0.698
137 HB2 ARG 115 1HB ARG 115 14.048 0.207 -1.543
138 HB3 ARG 115 2HB ARG 115 14.641 -0.518 -0.055
139 HG2 ARG 115 1HG ARG 115 16.149 -0.927 -1.926
140 HG3 ARG 115 2HG ARG 115 15.477 -2.432 -1.294
141 HD2 ARG 115 1HD ARG 115 13.942 -2.596 -3.113
142 HD3 ARG 115 2HD ARG 115 14.341 -0.971 -3.669
143 HE ARG 115 HE ARG 115 16.711 -2.264 -3.798
144 HH11 ARG 115 2HH1 ARG 115 13.530 -2.976 -5.018
145 HH12 ARG 115 1HH1 ARG 115 14.111 -3.847 -6.398
146 HH21 ARG 115 2HH2 ARG 115 17.490 -3.409 -5.611
147 HH22 ARG 115 1HH2 ARG 115 16.364 -4.094 -6.733
148 H ALA 116 H ALA 116 11.588 0.709 -0.664
149 HA ALA 116 HA ALA 116 10.898 0.266 2.169
150 HB1 ALA 116 3HB ALA 116 12.387 2.111 2.071
151 HB2 ALA 116 1HB ALA 116 11.515 2.830 0.717
152 HB3 ALA 116 2HB ALA 116 10.772 2.774 2.316
153 H LYS 117 H LYS 117 8.851 1.146 2.881
154 HA LYS 117 HA LYS 117 6.692 0.408 1.302
155 HB2 LYS 117 1HB LYS 117 6.586 0.656 3.749
156 HB3 LYS 117 2HB LYS 117 6.720 2.401 3.576
157 HG2 LYS 117 1HG LYS 117 4.465 2.188 3.823
158 HG3 LYS 117 2HG LYS 117 4.593 2.089 2.065
159 HD2 LYS 117 1HD LYS 117 4.863 -0.494 2.610
160 HD3 LYS 117 2HD LYS 117 3.962 -0.028 4.054
161 HE2 LYS 117 1HE LYS 117 3.100 0.565 1.226
162 HE3 LYS 117 2HE LYS 117 2.522 -0.798 2.183
163 HZ1 LYS 117 3HZ LYS 117 2.013 1.180 3.857
164 HZ2 LYS 117 1HZ LYS 117 0.906 0.674 2.683
165 HZ3 LYS 117 2HZ LYS 117 1.874 2.032 2.402
166 H GLY 118 H GLY 118 7.815 3.717 2.033
167 HA2 GLY 118 1HA GLY 118 6.036 5.190 0.571
168 HA3 GLY 118 2HA GLY 118 7.729 5.627 0.747
169 H ASN 119 H ASN 119 9.194 4.171 -0.742
170 HA ASN 119 HA ASN 119 9.005 4.946 -3.305
171 HB2 ASN 119 1HB ASN 119 10.108 2.421 -2.120
172 HB3 ASN 119 2HB ASN 119 10.142 2.656 -3.865
173 HD21 ASN 119 1HD2 ASN 119 10.987 4.292 -0.841
174 HD22 ASN 119 2HD2 ASN 119 12.421 5.043 -1.447
175 H LEU 120 H LEU 120 7.570 1.942 -2.051
176 HA LEU 120 HA LEU 120 6.368 1.185 -4.501
177 HB2 LEU 120 1HB LEU 120 6.684 -0.530 -2.943
178 HB3 LEU 120 2HB LEU 120 5.948 0.400 -1.639
179 HG LEU 120 HG LEU 120 3.745 0.086 -2.658
180 HD11 LEU 120 1HD1 LEU 120 4.990 -1.823 -4.605
181 HD12 LEU 120 2HD1 LEU 120 4.751 -0.123 -5.006
182 HD13 LEU 120 3HD1 LEU 120 3.365 -1.137 -4.605
183 HD21 LEU 120 3HD2 LEU 120 5.370 -2.399 -2.158
184 HD22 LEU 120 1HD2 LEU 120 3.616 -2.405 -2.351
185 HD23 LEU 120 2HD2 LEU 120 4.354 -1.519 -1.016
186 H VAL 121 H VAL 121 5.041 2.733 -1.583
187 HA VAL 121 HA VAL 121 2.410 2.988 -2.251
188 HB VAL 121 HB VAL 121 4.132 5.091 -0.932
189 HG11 VAL 121 1HG1 VAL 121 1.804 5.619 0.128
190 HG12 VAL 121 2HG1 VAL 121 2.232 6.286 -1.449
191 HG13 VAL 121 3HG1 VAL 121 1.184 4.871 -1.344
192 HG21 VAL 121 3HG2 VAL 121 2.386 3.672 0.834
193 HG22 VAL 121 1HG2 VAL 121 3.358 2.521 -0.083
194 HG23 VAL 121 2HG2 VAL 121 4.146 3.783 0.864
195 H THR 122 H THR 122 5.029 5.189 -3.222
196 HA THR 122 HA THR 122 3.455 6.996 -4.673
197 HB THR 122 HB THR 122 6.365 6.259 -4.823
198 HG1 THR 122 1HG THR 122 5.353 8.830 -4.323
199 HG21 THR 122 3HG2 THR 122 6.648 8.193 -6.371
200 HG22 THR 122 1HG2 THR 122 4.896 8.242 -6.563
201 HG23 THR 122 2HG2 THR 122 5.802 6.825 -7.095
202 H HIS 123 H HIS 123 4.851 3.905 -5.556
203 HA HIS 123 HA HIS 123 4.420 4.146 -8.358
204 HB2 HIS 123 1HB HIS 123 5.998 2.524 -7.844
205 HB3 HIS 123 2HB HIS 123 5.059 1.890 -6.496
206 HD1 HIS 123 1HD HIS 123 5.419 1.654 -10.210
207 HD2 HIS 123 2HD HIS 123 3.171 -0.061 -7.166
208 HE1 HIS 123 1HE HIS 123 4.286 -0.335 -11.251
209 H GLN 124 H GLN 124 2.613 2.545 -5.750
210 HA GLN 124 HA GLN 124 0.591 1.381 -7.211
211 HB2 GLN 124 1HB GLN 124 -0.040 2.768 -4.629
212 HB3 GLN 124 2HB GLN 124 -0.620 1.218 -5.225
213 HG2 GLN 124 1HG GLN 124 1.911 0.556 -5.021
214 HG3 GLN 124 2HG GLN 124 1.940 1.897 -3.876
215 HE21 GLN 124 1HE2 GLN 124 1.127 -1.352 -4.386
216 HE22 GLN 124 2HE2 GLN 124 0.381 -1.658 -2.858
217 H ARG 125 H ARG 125 0.998 4.747 -6.317
218 HA ARG 125 HA ARG 125 -1.520 5.766 -6.778
219 HB2 ARG 125 1HB ARG 125 1.094 7.064 -7.568
220 HB3 ARG 125 2HB ARG 125 -0.433 7.890 -7.291
221 HG2 ARG 125 1HG ARG 125 -0.371 7.142 -4.938
222 HG3 ARG 125 2HG ARG 125 1.212 6.424 -5.241
223 HD2 ARG 125 1HD ARG 125 2.252 8.464 -5.434
224 HD3 ARG 125 2HD ARG 125 0.776 9.287 -5.934
225 HE ARG 125 HE ARG 125 0.726 8.330 -3.220
226 HH11 ARG 125 2HH1 ARG 125 1.601 10.958 -5.329
227 HH12 ARG 125 1HH1 ARG 125 1.535 12.156 -4.078
228 HH21 ARG 125 2HH2 ARG 125 0.636 9.898 -1.565
229 HH22 ARG 125 1HH2 ARG 125 0.987 11.551 -1.938
230 H ILE 126 H ILE 126 0.652 4.367 -9.029
231 HA ILE 126 HA ILE 126 -0.346 5.652 -11.378
232 HB ILE 126 HB ILE 126 1.013 4.212 -12.622
233 HG12 ILE 126 1HG1 ILE 126 0.893 2.314 -10.271
234 HG13 ILE 126 2HG1 ILE 126 0.168 2.080 -11.858
235 HG21 ILE 126 1HG2 ILE 126 2.976 3.844 -10.695
236 HG22 ILE 126 2HG2 ILE 126 2.765 5.254 -11.732
237 HG23 ILE 126 3HG2 ILE 126 2.048 5.230 -10.121
238 HD11 ILE 126 3HD1 ILE 126 3.017 1.868 -11.024
239 HD12 ILE 126 1HD1 ILE 126 2.040 0.767 -11.995
240 HD13 ILE 126 2HD1 ILE 126 2.625 2.278 -12.693
241 H HIS 127 H HIS 127 -1.206 2.802 -9.547
242 HA HIS 127 HA HIS 127 -2.912 1.684 -11.559
243 HB2 HIS 127 1HB HIS 127 -2.581 1.130 -8.610
244 HB3 HIS 127 2HB HIS 127 -3.731 0.261 -9.622
245 HD1 HIS 127 1HD HIS 127 -2.637 -1.143 -11.636
246 HD2 HIS 127 2HD HIS 127 -0.027 0.167 -8.681
247 HE1 HIS 127 1HE HIS 127 -0.555 -2.525 -11.918
248 H THR 128 H THR 128 -3.499 3.401 -8.496
249 HA THR 128 HA THR 128 -6.164 3.473 -8.272
250 HB THR 128 HB THR 128 -6.041 5.750 -7.382
251 HG1 THR 128 1HG THR 128 -3.781 6.673 -7.491
252 HG21 THR 128 3HG2 THR 128 -4.555 5.324 -5.598
253 HG22 THR 128 1HG2 THR 128 -3.503 4.331 -6.606
254 HG23 THR 128 2HG2 THR 128 -5.097 3.736 -6.139
255 H GLY 129 H GLY 129 -4.330 5.504 -10.544
256 HA2 GLY 129 1HA GLY 129 -5.030 6.791 -12.322
257 HA3 GLY 129 2HA GLY 129 -6.064 5.410 -12.657
258 H GLU 130 H GLU 130 -5.895 8.395 -10.746
259 HA GLU 130 HA GLU 130 -8.824 8.604 -11.006
260 HB2 GLU 130 1HB GLU 130 -8.826 9.868 -8.894
261 HB3 GLU 130 2HB GLU 130 -8.202 8.238 -8.682
262 HG2 GLU 130 1HG GLU 130 -5.951 9.043 -8.588
263 HG3 GLU 130 2HG GLU 130 -6.470 10.674 -9.008
264 H LYS 131 H LYS 131 -5.785 10.413 -10.800
265 HA LYS 131 HA LYS 131 -6.997 12.889 -11.609
266 HB2 LYS 131 1HB LYS 131 -4.677 13.729 -11.690
267 HB3 LYS 131 2HB LYS 131 -5.042 12.925 -10.169
268 HG2 LYS 131 1HG LYS 131 -3.012 12.007 -10.589
269 HG3 LYS 131 2HG LYS 131 -4.024 10.843 -11.449
270 HD2 LYS 131 1HD LYS 131 -2.340 11.339 -12.982
271 HD3 LYS 131 2HD LYS 131 -3.676 12.375 -13.491
272 HE2 LYS 131 1HE LYS 131 -2.614 14.182 -12.052
273 HE3 LYS 131 2HE LYS 131 -1.198 13.136 -11.965
274 HZ1 LYS 131 3HZ LYS 131 -1.181 13.153 -14.436
275 HZ2 LYS 131 1HZ LYS 131 -0.878 14.664 -13.737
276 HZ3 LYS 131 2HZ LYS 131 -2.397 14.329 -14.402
277 H SER 132 H SER 132 -7.016 13.833 -13.597
278 HA SER 132 HA SER 132 -7.265 12.440 -15.891
279 HB2 SER 132 1HB SER 132 -7.717 14.869 -15.668
280 HB3 SER 132 2HB SER 132 -5.982 15.178 -15.724
281 HG SER 132 HG SER 132 -6.190 15.169 -17.804
282 H GLY 133 H GLY 133 -6.002 11.112 -17.001
283 HA2 GLY 133 1HA GLY 133 -3.365 10.530 -16.486
284 HA3 GLY 133 2HA GLY 133 -4.144 10.234 -18.033
285 HA PRO 134 HA PRO 134 -0.662 13.359 -18.472
286 HB2 PRO 134 1HB PRO 134 0.817 11.909 -20.228
287 HB3 PRO 134 2HB PRO 134 1.006 11.779 -18.475
288 HG2 PRO 134 1HG PRO 134 -0.500 10.002 -20.355
289 HG3 PRO 134 2HG PRO 134 0.555 9.559 -19.000
290 HD2 PRO 134 1HD PRO 134 -2.145 9.553 -18.805
291 HD3 PRO 134 2HD PRO 134 -1.089 9.938 -17.431
292 H SER 135 H SER 135 -2.615 11.436 -20.634
293 HA SER 135 HA SER 135 -3.310 11.757 -22.799
294 HB2 SER 135 1HB SER 135 -4.480 13.523 -21.209
295 HB3 SER 135 2HB SER 135 -3.573 14.673 -22.191
296 HG SER 135 HG SER 135 -4.604 13.102 -23.935
297 H SER 136 H SER 136 -0.555 11.746 -22.729
298 HA SER 136 HA SER 136 0.561 14.038 -24.019
299 HB2 SER 136 1HB SER 136 1.527 11.294 -23.331
300 HB3 SER 136 2HB SER 136 2.432 12.233 -24.518
301 HG SER 136 HG SER 136 2.069 12.677 -21.789
302 H GLY 137 H GLY 137 0.137 10.692 -25.201
303 HA2 GLY 137 1HA GLY 137 -0.659 9.974 -27.262
304 HA3 GLY 137 2HA GLY 137 -0.891 11.653 -27.726
Start of MODEL 18
1 H1 GLY 93 H GLY 93 0.488 -16.342 -13.818
2 HA2 GLY 93 1HA GLY 93 -1.052 -18.439 -13.122
3 HA3 GLY 93 2HA GLY 93 -0.627 -18.836 -14.781
4 H SER 94 H SER 94 0.739 -20.511 -14.537
5 HA SER 94 HA SER 94 2.855 -20.376 -12.538
6 HB2 SER 94 1HB SER 94 3.324 -22.711 -13.209
7 HB3 SER 94 2HB SER 94 1.635 -22.484 -12.756
8 HG SER 94 HG SER 94 1.029 -22.753 -14.794
9 H SER 95 H SER 95 4.283 -18.854 -13.318
10 HA SER 95 HA SER 95 6.084 -19.763 -15.367
11 HB2 SER 95 1HB SER 95 5.857 -17.883 -16.868
12 HB3 SER 95 2HB SER 95 4.272 -18.632 -16.676
13 HG SER 95 HG SER 95 5.219 -16.180 -15.700
14 H GLY 96 H GLY 96 7.969 -19.467 -14.385
15 HA2 GLY 96 1HA GLY 96 9.066 -16.982 -13.796
16 HA3 GLY 96 2HA GLY 96 8.385 -17.593 -12.296
17 H SER 97 H SER 97 11.207 -17.126 -13.351
18 HA SER 97 HA SER 97 12.515 -19.581 -13.675
19 HB2 SER 97 1HB SER 97 13.366 -16.836 -12.854
20 HB3 SER 97 2HB SER 97 14.497 -18.170 -12.628
21 HG SER 97 HG SER 97 13.355 -17.204 -15.023
22 H SER 98 H SER 98 14.054 -20.571 -12.125
23 HA SER 98 HA SER 98 12.697 -21.097 -9.631
24 HB2 SER 98 1HB SER 98 13.723 -22.926 -10.951
25 HB3 SER 98 2HB SER 98 15.312 -22.211 -10.677
26 HG SER 98 HG SER 98 14.946 -23.823 -9.155
27 H GLY 99 H GLY 99 13.265 -20.427 -7.636
28 HA2 GLY 99 1HA GLY 99 14.538 -19.481 -5.946
29 HA3 GLY 99 2HA GLY 99 15.888 -19.378 -7.067
30 H THR 100 H THR 100 13.206 -17.733 -5.660
31 HA THR 100 HA THR 100 14.145 -15.234 -6.878
32 HB THR 100 HB THR 100 12.128 -15.978 -8.121
33 HG1 THR 100 1HG THR 100 10.903 -13.932 -7.526
34 HG21 THR 100 3HG2 THR 100 10.127 -16.461 -7.147
35 HG22 THR 100 1HG2 THR 100 10.387 -15.347 -5.805
36 HG23 THR 100 2HG2 THR 100 11.178 -16.924 -5.808
37 H GLY 101 H GLY 101 14.652 -13.832 -5.335
38 HA2 GLY 101 1HA GLY 101 14.151 -14.249 -2.605
39 HA3 GLY 101 2HA GLY 101 14.707 -12.742 -3.317
40 H GLN 102 H GLN 102 13.213 -12.267 -1.286
41 HA GLN 102 HA GLN 102 10.594 -11.547 -2.407
42 HB2 GLN 102 1HB GLN 102 9.481 -12.081 -0.341
43 HB3 GLN 102 2HB GLN 102 10.375 -13.498 -0.875
44 HG2 GLN 102 1HG GLN 102 12.230 -12.663 0.691
45 HG3 GLN 102 2HG GLN 102 10.975 -11.643 1.393
46 HE21 GLN 102 1HE2 GLN 102 10.217 -12.489 3.184
47 HE22 GLN 102 2HE2 GLN 102 9.916 -14.164 3.478
48 H LYS 103 H LYS 103 10.089 -9.463 -2.186
49 HA LYS 103 HA LYS 103 11.873 -7.770 -0.610
50 HB2 LYS 103 1HB LYS 103 9.910 -7.251 -2.824
51 HB3 LYS 103 2HB LYS 103 10.499 -5.932 -1.821
52 HG2 LYS 103 1HG LYS 103 12.497 -7.753 -3.047
53 HG3 LYS 103 2HG LYS 103 11.673 -6.590 -4.087
54 HD2 LYS 103 1HD LYS 103 12.475 -4.754 -2.827
55 HD3 LYS 103 2HD LYS 103 13.010 -5.799 -1.509
56 HE2 LYS 103 1HE LYS 103 14.518 -6.864 -3.357
57 HE3 LYS 103 2HE LYS 103 14.244 -5.335 -4.191
58 HZ1 LYS 103 3HZ LYS 103 14.975 -4.287 -1.992
59 HZ2 LYS 103 1HZ LYS 103 16.168 -4.972 -2.977
60 HZ3 LYS 103 2HZ LYS 103 15.609 -5.811 -1.619
61 HA PRO 104 HA PRO 104 8.989 -7.050 2.626
62 HB2 PRO 104 1HB PRO 104 9.693 -4.532 3.357
63 HB3 PRO 104 2HB PRO 104 10.687 -5.950 3.714
64 HG2 PRO 104 1HG PRO 104 10.974 -3.942 1.512
65 HG3 PRO 104 2HG PRO 104 12.226 -4.661 2.541
66 HD2 PRO 104 1HD PRO 104 11.749 -5.513 0.016
67 HD3 PRO 104 2HD PRO 104 12.308 -6.603 1.302
68 H PHE 105 H PHE 105 8.957 -5.270 -0.267
69 HA PHE 105 HA PHE 105 6.206 -4.453 0.229
70 HB2 PHE 105 1HB PHE 105 8.202 -2.468 -0.862
71 HB3 PHE 105 2HB PHE 105 6.524 -2.172 -0.420
72 HD1 PHE 105 2HD PHE 105 5.863 -2.154 1.964
73 HD2 PHE 105 1HD PHE 105 9.934 -2.414 0.750
74 HE1 PHE 105 2HE PHE 105 6.575 -1.492 4.224
75 HE2 PHE 105 1HE PHE 105 10.653 -1.753 3.008
76 HZ PHE 105 HZ PHE 105 8.973 -1.289 4.748
77 H GLU 106 H GLU 106 5.196 -5.507 -1.355
78 HA GLU 106 HA GLU 106 6.283 -5.271 -4.083
79 HB2 GLU 106 1HB GLU 106 6.359 -7.591 -2.958
80 HB3 GLU 106 2HB GLU 106 4.613 -7.600 -3.168
81 HG2 GLU 106 1HG GLU 106 4.809 -7.509 -5.529
82 HG3 GLU 106 2HG GLU 106 6.538 -7.178 -5.436
83 H CYS 107 H CYS 107 4.868 -4.790 -5.718
84 HA CYS 107 HA CYS 107 2.305 -3.708 -4.890
85 HB2 CYS 107 1HB CYS 107 3.912 -2.513 -6.449
86 HB3 CYS 107 2HB CYS 107 3.481 -3.706 -7.670
87 H THR 108 H THR 108 1.473 -5.895 -4.391
88 HA THR 108 HA THR 108 1.102 -8.041 -5.950
89 HB THR 108 HB THR 108 0.068 -7.931 -3.771
90 HG1 THR 108 1HG THR 108 -1.786 -9.030 -4.302
91 HG21 THR 108 3HG2 THR 108 -1.417 -6.373 -3.093
92 HG22 THR 108 1HG2 THR 108 -2.285 -6.385 -4.627
93 HG23 THR 108 2HG2 THR 108 -0.797 -5.453 -4.463
94 H HIS 109 H HIS 109 -0.397 -4.915 -6.447
95 HA HIS 109 HA HIS 109 -2.430 -5.476 -8.197
96 HB2 HIS 109 1HB HIS 109 -0.458 -3.186 -8.298
97 HB3 HIS 109 2HB HIS 109 -1.952 -3.246 -9.228
98 HD2 HIS 109 2HD HIS 109 -0.771 -1.828 -5.993
99 HE1 HIS 109 1HE HIS 109 -4.929 -2.481 -5.457
100 HE2 HIS 109 2HE HIS 109 -2.882 -1.293 -4.596
101 H CYS 110 H CYS 110 0.920 -4.726 -9.176
102 HA CYS 110 HA CYS 110 0.432 -6.259 -11.646
103 HB2 CYS 110 1HB CYS 110 2.196 -4.864 -12.682
104 HB3 CYS 110 2HB CYS 110 0.827 -3.909 -12.123
105 H GLY 111 H GLY 111 2.812 -5.496 -9.136
106 HA2 GLY 111 1HA GLY 111 3.904 -7.619 -8.283
107 HA3 GLY 111 2HA GLY 111 4.338 -7.883 -9.966
108 H LYS 112 H LYS 112 4.379 -4.614 -9.078
109 HA LYS 112 HA LYS 112 7.211 -4.450 -9.437
110 HB2 LYS 112 1HB LYS 112 5.380 -2.711 -10.037
111 HB3 LYS 112 2HB LYS 112 5.517 -2.218 -8.354
112 HG2 LYS 112 1HG LYS 112 6.960 -0.770 -9.413
113 HG3 LYS 112 2HG LYS 112 8.050 -2.047 -8.865
114 HD2 LYS 112 1HD LYS 112 8.112 -3.024 -11.047
115 HD3 LYS 112 2HD LYS 112 6.831 -1.954 -11.621
116 HE2 LYS 112 1HE LYS 112 8.231 -0.100 -11.667
117 HE3 LYS 112 2HE LYS 112 9.388 -0.823 -10.552
118 HZ1 LYS 112 3HZ LYS 112 10.298 -2.126 -12.208
119 HZ2 LYS 112 1HZ LYS 112 9.972 -0.687 -13.036
120 HZ3 LYS 112 2HZ LYS 112 8.939 -2.014 -13.210
121 H SER 113 H SER 113 8.674 -4.865 -7.931
122 HA SER 113 HA SER 113 7.918 -4.762 -5.113
123 HB2 SER 113 1HB SER 113 9.822 -6.112 -4.674
124 HB3 SER 113 2HB SER 113 9.131 -6.748 -6.167
125 HG SER 113 HG SER 113 10.791 -4.923 -6.951
126 H PHE 114 H PHE 114 9.382 -3.790 -3.542
127 HA PHE 114 HA PHE 114 11.197 -1.747 -4.539
128 HB2 PHE 114 1HB PHE 114 8.789 -1.085 -2.832
129 HB3 PHE 114 2HB PHE 114 10.108 0.028 -3.183
130 HD1 PHE 114 2HD PHE 114 7.288 -1.834 -4.645
131 HD2 PHE 114 1HD PHE 114 10.232 1.179 -5.250
132 HE1 PHE 114 2HE PHE 114 6.133 -1.122 -6.698
133 HE2 PHE 114 1HE PHE 114 9.081 1.897 -7.303
134 HZ PHE 114 HZ PHE 114 7.030 0.745 -8.030
135 H ARG 115 H ARG 115 12.278 -0.592 -2.660
136 HA ARG 115 HA ARG 115 13.150 -2.606 -0.776
137 HB2 ARG 115 1HB ARG 115 14.077 0.138 -1.537
138 HB3 ARG 115 2HB ARG 115 14.624 -0.570 -0.024
139 HG2 ARG 115 1HG ARG 115 15.903 -2.144 -1.057
140 HG3 ARG 115 2HG ARG 115 14.868 -2.207 -2.485
141 HD2 ARG 115 1HD ARG 115 16.777 -1.159 -3.280
142 HD3 ARG 115 2HD ARG 115 15.712 0.197 -2.913
143 HE ARG 115 HE ARG 115 17.462 -0.529 -0.749
144 HH11 ARG 115 2HH1 ARG 115 17.121 1.358 -3.655
145 HH12 ARG 115 1HH1 ARG 115 18.332 2.512 -3.204
146 HH21 ARG 115 2HH2 ARG 115 19.059 0.983 -0.144
147 HH22 ARG 115 1HH2 ARG 115 19.435 2.297 -1.207
148 H ALA 116 H ALA 116 11.693 0.634 -0.606
149 HA ALA 116 HA ALA 116 10.924 0.050 2.179
150 HB1 ALA 116 3HB ALA 116 12.412 1.939 2.075
151 HB2 ALA 116 1HB ALA 116 11.410 2.709 0.845
152 HB3 ALA 116 2HB ALA 116 10.793 2.505 2.485
153 H LYS 117 H LYS 117 8.903 1.340 2.839
154 HA LYS 117 HA LYS 117 6.736 0.441 1.260
155 HB2 LYS 117 1HB LYS 117 6.672 0.757 3.735
156 HB3 LYS 117 2HB LYS 117 6.685 2.496 3.477
157 HG2 LYS 117 1HG LYS 117 4.453 2.179 3.705
158 HG3 LYS 117 2HG LYS 117 4.592 1.919 1.964
159 HD2 LYS 117 1HD LYS 117 4.796 -0.522 2.411
160 HD3 LYS 117 2HD LYS 117 4.481 -0.193 4.116
161 HE2 LYS 117 1HE LYS 117 2.371 -0.718 3.370
162 HE3 LYS 117 2HE LYS 117 2.369 1.035 3.180
163 HZ1 LYS 117 3HZ LYS 117 3.094 -0.806 0.976
164 HZ2 LYS 117 1HZ LYS 117 2.712 0.839 0.876
165 HZ3 LYS 117 2HZ LYS 117 1.506 -0.289 1.244
166 H GLY 118 H GLY 118 7.712 3.782 2.073
167 HA2 GLY 118 1HA GLY 118 6.008 5.218 0.522
168 HA3 GLY 118 2HA GLY 118 7.686 5.683 0.761
169 H ASN 119 H ASN 119 9.136 3.959 -0.644
170 HA ASN 119 HA ASN 119 9.095 4.824 -3.225
171 HB2 ASN 119 1HB ASN 119 10.160 2.362 -1.922
172 HB3 ASN 119 2HB ASN 119 10.155 2.426 -3.682
173 HD21 ASN 119 1HD2 ASN 119 12.465 2.335 -3.502
174 HD22 ASN 119 2HD2 ASN 119 13.361 3.777 -3.182
175 H LEU 120 H LEU 120 7.596 1.819 -2.042
176 HA LEU 120 HA LEU 120 6.453 1.114 -4.537
177 HB2 LEU 120 1HB LEU 120 6.687 -0.662 -3.070
178 HB3 LEU 120 2HB LEU 120 6.046 0.252 -1.706
179 HG LEU 120 HG LEU 120 3.793 0.047 -2.604
180 HD11 LEU 120 1HD1 LEU 120 3.254 -1.015 -4.601
181 HD12 LEU 120 2HD1 LEU 120 4.835 -1.784 -4.734
182 HD13 LEU 120 3HD1 LEU 120 4.671 -0.051 -5.018
183 HD21 LEU 120 3HD2 LEU 120 4.120 -1.696 -1.165
184 HD22 LEU 120 1HD2 LEU 120 5.457 -2.366 -2.101
185 HD23 LEU 120 2HD2 LEU 120 3.796 -2.593 -2.649
186 H VAL 121 H VAL 121 5.088 2.640 -1.629
187 HA VAL 121 HA VAL 121 2.463 2.902 -2.348
188 HB VAL 121 HB VAL 121 4.164 4.961 -0.937
189 HG11 VAL 121 1HG1 VAL 121 1.756 5.417 0.066
190 HG12 VAL 121 2HG1 VAL 121 2.321 6.224 -1.399
191 HG13 VAL 121 3HG1 VAL 121 1.255 4.824 -1.517
192 HG21 VAL 121 3HG2 VAL 121 2.524 3.716 0.902
193 HG22 VAL 121 1HG2 VAL 121 3.036 2.400 -0.155
194 HG23 VAL 121 2HG2 VAL 121 4.241 3.399 0.657
195 H THR 122 H THR 122 5.112 5.112 -3.208
196 HA THR 122 HA THR 122 3.583 6.961 -4.651
197 HB THR 122 HB THR 122 6.490 6.206 -4.758
198 HG1 THR 122 1HG THR 122 5.486 8.772 -4.221
199 HG21 THR 122 3HG2 THR 122 5.070 8.234 -6.484
200 HG22 THR 122 1HG2 THR 122 5.982 6.826 -7.027
201 HG23 THR 122 2HG2 THR 122 6.818 8.174 -6.255
202 H HIS 123 H HIS 123 4.942 3.867 -5.563
203 HA HIS 123 HA HIS 123 4.586 4.176 -8.372
204 HB2 HIS 123 1HB HIS 123 6.132 2.523 -7.856
205 HB3 HIS 123 2HB HIS 123 5.154 1.873 -6.544
206 HD1 HIS 123 1HD HIS 123 5.577 1.728 -10.260
207 HD2 HIS 123 2HD HIS 123 3.280 -0.055 -7.293
208 HE1 HIS 123 1HE HIS 123 4.448 -0.228 -11.368
209 H GLN 124 H GLN 124 2.700 2.551 -5.836
210 HA GLN 124 HA GLN 124 0.696 1.444 -7.368
211 HB2 GLN 124 1HB GLN 124 0.028 2.778 -4.768
212 HB3 GLN 124 2HB GLN 124 -0.559 1.251 -5.413
213 HG2 GLN 124 1HG GLN 124 1.941 0.530 -5.167
214 HG3 GLN 124 2HG GLN 124 1.996 1.864 -4.016
215 HE21 GLN 124 1HE2 GLN 124 1.399 -1.370 -4.386
216 HE22 GLN 124 2HE2 GLN 124 0.516 -1.659 -2.929
217 H ARG 125 H ARG 125 1.144 4.783 -6.413
218 HA ARG 125 HA ARG 125 -1.356 5.847 -6.894
219 HB2 ARG 125 1HB ARG 125 1.302 7.114 -7.582
220 HB3 ARG 125 2HB ARG 125 -0.220 7.965 -7.357
221 HG2 ARG 125 1HG ARG 125 -0.270 7.262 -5.018
222 HG3 ARG 125 2HG ARG 125 1.258 6.408 -5.245
223 HD2 ARG 125 1HD ARG 125 1.735 8.520 -4.233
224 HD3 ARG 125 2HD ARG 125 2.290 8.579 -5.906
225 HE ARG 125 HE ARG 125 0.689 10.174 -6.359
226 HH11 ARG 125 2HH1 ARG 125 0.144 8.802 -3.206
227 HH12 ARG 125 1HH1 ARG 125 -1.031 9.990 -2.749
228 HH21 ARG 125 2HH2 ARG 125 -0.857 11.743 -5.769
229 HH22 ARG 125 1HH2 ARG 125 -1.601 11.661 -4.208
230 H ILE 126 H ILE 126 0.863 4.488 -9.132
231 HA ILE 126 HA ILE 126 -0.077 5.830 -11.471
232 HB ILE 126 HB ILE 126 1.296 4.406 -12.718
233 HG12 ILE 126 1HG1 ILE 126 1.076 2.455 -10.421
234 HG13 ILE 126 2HG1 ILE 126 0.430 2.263 -12.047
235 HG21 ILE 126 1HG2 ILE 126 3.073 5.357 -11.784
236 HG22 ILE 126 2HG2 ILE 126 2.278 5.407 -10.211
237 HG23 ILE 126 3HG2 ILE 126 3.182 3.973 -10.696
238 HD11 ILE 126 3HD1 ILE 126 3.233 2.012 -11.078
239 HD12 ILE 126 1HD1 ILE 126 2.300 0.940 -12.122
240 HD13 ILE 126 2HD1 ILE 126 2.926 2.463 -12.755
241 H HIS 127 H HIS 127 -1.018 2.964 -9.714
242 HA HIS 127 HA HIS 127 -2.691 1.912 -11.795
243 HB2 HIS 127 1HB HIS 127 -2.410 1.267 -8.859
244 HB3 HIS 127 2HB HIS 127 -3.557 0.443 -9.911
245 HD1 HIS 127 1HD HIS 127 -2.463 -0.928 -11.941
246 HD2 HIS 127 2HD HIS 127 0.139 0.285 -8.938
247 HE1 HIS 127 1HE HIS 127 -0.392 -2.324 -12.240
248 H THR 128 H THR 128 -3.322 3.522 -8.681
249 HA THR 128 HA THR 128 -5.986 3.619 -8.506
250 HB THR 128 HB THR 128 -5.857 5.873 -7.548
251 HG1 THR 128 1HG THR 128 -3.109 6.021 -8.099
252 HG21 THR 128 3HG2 THR 128 -4.838 3.707 -6.461
253 HG22 THR 128 1HG2 THR 128 -4.610 5.283 -5.704
254 HG23 THR 128 2HG2 THR 128 -3.317 4.574 -6.672
255 H GLY 129 H GLY 129 -7.682 4.242 -9.687
256 HA2 GLY 129 1HA GLY 129 -7.321 5.281 -12.315
257 HA3 GLY 129 2HA GLY 129 -8.859 5.013 -11.508
258 H GLU 130 H GLU 130 -6.471 7.312 -12.402
259 HA GLU 130 HA GLU 130 -8.249 9.472 -11.642
260 HB2 GLU 130 1HB GLU 130 -5.409 9.362 -10.609
261 HB3 GLU 130 2HB GLU 130 -6.506 10.726 -10.444
262 HG2 GLU 130 1HG GLU 130 -8.050 9.155 -9.197
263 HG3 GLU 130 2HG GLU 130 -6.697 8.025 -9.152
264 H LYS 131 H LYS 131 -8.298 10.928 -13.220
265 HA LYS 131 HA LYS 131 -5.919 11.278 -14.910
266 HB2 LYS 131 1HB LYS 131 -7.560 9.805 -16.054
267 HB3 LYS 131 2HB LYS 131 -8.757 11.089 -15.938
268 HG2 LYS 131 1HG LYS 131 -6.162 11.716 -17.236
269 HG3 LYS 131 2HG LYS 131 -7.320 10.714 -18.116
270 HD2 LYS 131 1HD LYS 131 -8.952 12.406 -18.108
271 HD3 LYS 131 2HD LYS 131 -8.116 13.322 -16.852
272 HE2 LYS 131 1HE LYS 131 -7.599 14.526 -18.755
273 HE3 LYS 131 2HE LYS 131 -6.199 13.466 -18.598
274 HZ1 LYS 131 3HZ LYS 131 -6.731 13.213 -20.798
275 HZ2 LYS 131 1HZ LYS 131 -8.397 13.362 -20.544
276 HZ3 LYS 131 2HZ LYS 131 -7.603 11.928 -20.127
277 H SER 132 H SER 132 -5.530 13.343 -15.620
278 HA SER 132 HA SER 132 -7.221 15.425 -14.422
279 HB2 SER 132 1HB SER 132 -5.263 16.897 -14.641
280 HB3 SER 132 2HB SER 132 -4.859 15.439 -13.735
281 HG SER 132 HG SER 132 -4.475 15.391 -16.496
282 H GLY 133 H GLY 133 -8.734 16.056 -15.839
283 HA2 GLY 133 1HA GLY 133 -7.807 17.019 -18.455
284 HA3 GLY 133 2HA GLY 133 -9.158 15.897 -18.398
285 HA PRO 134 HA PRO 134 -10.363 20.489 -17.624
286 HB2 PRO 134 1HB PRO 134 -10.882 21.312 -20.159
287 HB3 PRO 134 2HB PRO 134 -9.306 21.517 -19.386
288 HG2 PRO 134 1HG PRO 134 -10.208 19.419 -21.322
289 HG3 PRO 134 2HG PRO 134 -8.678 20.315 -21.275
290 HD2 PRO 134 1HD PRO 134 -8.914 17.784 -20.341
291 HD3 PRO 134 2HD PRO 134 -7.792 18.963 -19.632
292 H SER 135 H SER 135 -11.523 17.639 -18.806
293 HA SER 135 HA SER 135 -14.168 18.548 -19.556
294 HB2 SER 135 1HB SER 135 -13.182 15.720 -19.117
295 HB3 SER 135 2HB SER 135 -14.665 16.202 -19.941
296 HG SER 135 HG SER 135 -13.504 16.310 -21.676
297 H SER 136 H SER 136 -16.082 17.419 -18.509
298 HA SER 136 HA SER 136 -16.484 18.262 -15.954
299 HB2 SER 136 1HB SER 136 -17.718 16.028 -17.532
300 HB3 SER 136 2HB SER 136 -18.197 16.283 -15.854
301 HG SER 136 HG SER 136 -19.471 17.422 -17.481
302 H GLY 137 H GLY 137 -15.901 17.666 -13.958
303 HA2 GLY 137 1HA GLY 137 -13.818 16.116 -13.280
304 HA3 GLY 137 2HA GLY 137 -15.208 16.293 -12.220
Start of MODEL 19
1 H1 GLY 93 H GLY 93 22.081 -6.344 -19.857
2 HA2 GLY 93 1HA GLY 93 24.165 -5.286 -18.655
3 HA3 GLY 93 2HA GLY 93 22.555 -4.889 -18.073
4 H SER 94 H SER 94 21.851 -5.685 -16.123
5 HA SER 94 HA SER 94 23.945 -6.727 -14.393
6 HB2 SER 94 1HB SER 94 21.144 -5.754 -13.781
7 HB3 SER 94 2HB SER 94 22.310 -6.281 -12.568
8 HG SER 94 HG SER 94 22.799 -4.188 -14.417
9 H SER 95 H SER 95 23.931 -8.692 -13.402
10 HA SER 95 HA SER 95 21.699 -10.415 -13.248
11 HB2 SER 95 1HB SER 95 22.045 -10.591 -15.683
12 HB3 SER 95 2HB SER 95 23.709 -11.106 -15.406
13 HG SER 95 HG SER 95 21.312 -12.472 -14.809
14 H GLY 96 H GLY 96 22.095 -12.152 -11.922
15 HA2 GLY 96 1HA GLY 96 24.053 -13.729 -11.301
16 HA3 GLY 96 2HA GLY 96 24.795 -12.231 -10.758
17 H SER 97 H SER 97 21.534 -13.642 -10.449
18 HA SER 97 HA SER 97 21.785 -13.299 -7.532
19 HB2 SER 97 1HB SER 97 19.297 -12.911 -9.215
20 HB3 SER 97 2HB SER 97 19.377 -12.783 -7.458
21 HG SER 97 HG SER 97 21.180 -11.236 -8.889
22 H SER 98 H SER 98 21.393 -15.046 -6.327
23 HA SER 98 HA SER 98 20.758 -17.537 -7.646
24 HB2 SER 98 1HB SER 98 21.568 -16.792 -4.843
25 HB3 SER 98 2HB SER 98 21.016 -18.421 -5.231
26 HG SER 98 HG SER 98 22.716 -18.066 -7.044
27 H GLY 99 H GLY 99 18.606 -17.374 -8.264
28 HA2 GLY 99 1HA GLY 99 16.342 -17.655 -8.012
29 HA3 GLY 99 2HA GLY 99 16.686 -18.208 -6.380
30 H THR 100 H THR 100 15.144 -15.884 -8.176
31 HA THR 100 HA THR 100 15.479 -13.491 -6.856
32 HB THR 100 HB THR 100 13.100 -12.989 -7.449
33 HG1 THR 100 1HG THR 100 12.961 -15.446 -8.799
34 HG21 THR 100 3HG2 THR 100 14.492 -14.330 -9.753
35 HG22 THR 100 1HG2 THR 100 15.093 -12.832 -9.043
36 HG23 THR 100 2HG2 THR 100 13.487 -12.881 -9.769
37 H GLY 101 H GLY 101 14.702 -12.551 -5.009
38 HA2 GLY 101 1HA GLY 101 13.357 -14.380 -3.119
39 HA3 GLY 101 2HA GLY 101 14.491 -13.126 -2.640
40 H GLN 102 H GLN 102 12.052 -13.278 -1.421
41 HA GLN 102 HA GLN 102 10.161 -11.521 -2.687
42 HB2 GLN 102 1HB GLN 102 8.960 -11.675 -0.506
43 HB3 GLN 102 2HB GLN 102 9.303 -13.236 -1.240
44 HG2 GLN 102 1HG GLN 102 11.160 -13.577 0.266
45 HG3 GLN 102 2HG GLN 102 10.923 -11.973 0.959
46 HE21 GLN 102 1HE2 GLN 102 9.664 -11.803 2.681
47 HE22 GLN 102 2HE2 GLN 102 8.585 -13.019 3.265
48 H LYS 103 H LYS 103 9.421 -9.504 -1.710
49 HA LYS 103 HA LYS 103 11.602 -8.057 -0.352
50 HB2 LYS 103 1HB LYS 103 9.724 -7.088 -2.510
51 HB3 LYS 103 2HB LYS 103 10.737 -6.014 -1.553
52 HG2 LYS 103 1HG LYS 103 12.630 -7.671 -2.394
53 HG3 LYS 103 2HG LYS 103 11.476 -7.904 -3.710
54 HD2 LYS 103 1HD LYS 103 12.634 -6.127 -4.549
55 HD3 LYS 103 2HD LYS 103 11.414 -5.252 -3.620
56 HE2 LYS 103 1HE LYS 103 12.904 -4.707 -1.936
57 HE3 LYS 103 2HE LYS 103 13.991 -6.039 -2.326
58 HZ1 LYS 103 3HZ LYS 103 15.130 -4.238 -3.138
59 HZ2 LYS 103 1HZ LYS 103 13.735 -3.414 -3.624
60 HZ3 LYS 103 2HZ LYS 103 14.297 -4.730 -4.525
61 HA PRO 104 HA PRO 104 8.762 -6.911 2.793
62 HB2 PRO 104 1HB PRO 104 9.672 -4.441 3.458
63 HB3 PRO 104 2HB PRO 104 10.536 -5.927 3.873
64 HG2 PRO 104 1HG PRO 104 11.021 -4.021 1.616
65 HG3 PRO 104 2HG PRO 104 12.195 -4.813 2.684
66 HD2 PRO 104 1HD PRO 104 11.677 -5.699 0.179
67 HD3 PRO 104 2HD PRO 104 12.124 -6.792 1.505
68 H PHE 105 H PHE 105 8.833 -5.353 -0.185
69 HA PHE 105 HA PHE 105 6.178 -4.278 0.233
70 HB2 PHE 105 1HB PHE 105 8.316 -2.428 -0.820
71 HB3 PHE 105 2HB PHE 105 6.656 -2.028 -0.395
72 HD1 PHE 105 2HD PHE 105 5.973 -2.135 2.029
73 HD2 PHE 105 1HD PHE 105 10.033 -2.306 0.761
74 HE1 PHE 105 2HE PHE 105 6.704 -1.513 4.295
75 HE2 PHE 105 1HE PHE 105 10.770 -1.685 3.026
76 HZ PHE 105 HZ PHE 105 9.104 -1.286 4.795
77 H GLU 106 H GLU 106 5.212 -5.384 -1.357
78 HA GLU 106 HA GLU 106 6.333 -5.127 -4.069
79 HB2 GLU 106 1HB GLU 106 6.500 -7.445 -3.011
80 HB3 GLU 106 2HB GLU 106 4.747 -7.509 -3.126
81 HG2 GLU 106 1HG GLU 106 4.775 -7.539 -5.450
82 HG3 GLU 106 2HG GLU 106 6.425 -6.924 -5.532
83 H CYS 107 H CYS 107 4.912 -4.714 -5.727
84 HA CYS 107 HA CYS 107 2.307 -3.708 -4.911
85 HB2 CYS 107 1HB CYS 107 3.893 -2.426 -6.420
86 HB3 CYS 107 2HB CYS 107 3.529 -3.611 -7.670
87 H THR 108 H THR 108 1.616 -5.983 -4.467
88 HA THR 108 HA THR 108 1.325 -8.092 -6.066
89 HB THR 108 HB THR 108 0.241 -7.967 -3.874
90 HG1 THR 108 1HG THR 108 -1.066 -8.877 -6.153
91 HG21 THR 108 3HG2 THR 108 -1.667 -6.723 -3.409
92 HG22 THR 108 1HG2 THR 108 -2.084 -6.537 -5.111
93 HG23 THR 108 2HG2 THR 108 -0.737 -5.626 -4.429
94 H HIS 109 H HIS 109 -0.495 -5.087 -6.432
95 HA HIS 109 HA HIS 109 -2.398 -5.669 -8.255
96 HB2 HIS 109 1HB HIS 109 -0.511 -3.309 -8.274
97 HB3 HIS 109 2HB HIS 109 -1.954 -3.410 -9.279
98 HD2 HIS 109 2HD HIS 109 -0.959 -2.144 -5.877
99 HE1 HIS 109 1HE HIS 109 -5.163 -2.695 -5.723
100 HE2 HIS 109 2HE HIS 109 -3.164 -1.623 -4.628
101 H CYS 110 H CYS 110 0.910 -4.743 -9.229
102 HA CYS 110 HA CYS 110 0.491 -6.248 -11.726
103 HB2 CYS 110 1HB CYS 110 2.257 -4.810 -12.693
104 HB3 CYS 110 2HB CYS 110 0.876 -3.880 -12.122
105 H GLY 111 H GLY 111 2.859 -5.514 -9.190
106 HA2 GLY 111 1HA GLY 111 3.960 -7.634 -8.350
107 HA3 GLY 111 2HA GLY 111 4.378 -7.901 -10.036
108 H LYS 112 H LYS 112 4.429 -4.635 -9.082
109 HA LYS 112 HA LYS 112 7.261 -4.476 -9.494
110 HB2 LYS 112 1HB LYS 112 5.444 -2.729 -10.082
111 HB3 LYS 112 2HB LYS 112 5.567 -2.249 -8.395
112 HG2 LYS 112 1HG LYS 112 7.038 -0.795 -9.362
113 HG3 LYS 112 2HG LYS 112 8.125 -2.119 -8.935
114 HD2 LYS 112 1HD LYS 112 8.160 -2.928 -11.162
115 HD3 LYS 112 2HD LYS 112 6.806 -1.898 -11.632
116 HE2 LYS 112 1HE LYS 112 8.119 0.038 -11.597
117 HE3 LYS 112 2HE LYS 112 9.384 -0.729 -10.637
118 HZ1 LYS 112 3HZ LYS 112 10.171 -0.558 -12.849
119 HZ2 LYS 112 1HZ LYS 112 8.750 -1.212 -13.493
120 HZ3 LYS 112 2HZ LYS 112 9.801 -2.190 -12.598
121 H SER 113 H SER 113 8.718 -4.946 -7.998
122 HA SER 113 HA SER 113 7.994 -4.845 -5.176
123 HB2 SER 113 1HB SER 113 10.026 -6.103 -4.780
124 HB3 SER 113 2HB SER 113 9.156 -6.844 -6.123
125 HG SER 113 HG SER 113 11.560 -5.426 -6.115
126 H PHE 114 H PHE 114 9.393 -3.835 -3.605
127 HA PHE 114 HA PHE 114 11.208 -1.782 -4.600
128 HB2 PHE 114 1HB PHE 114 8.825 -1.163 -2.843
129 HB3 PHE 114 2HB PHE 114 10.119 -0.032 -3.223
130 HD1 PHE 114 2HD PHE 114 7.366 -2.011 -4.697
131 HD2 PHE 114 1HD PHE 114 10.100 1.210 -5.213
132 HE1 PHE 114 2HE PHE 114 6.152 -1.309 -6.718
133 HE2 PHE 114 1HE PHE 114 8.890 1.918 -7.235
134 HZ PHE 114 HZ PHE 114 6.913 0.657 -7.991
135 H ARG 115 H ARG 115 12.221 -0.589 -2.660
136 HA ARG 115 HA ARG 115 13.090 -2.639 -0.780
137 HB2 ARG 115 1HB ARG 115 14.188 -0.056 -1.766
138 HB3 ARG 115 2HB ARG 115 14.643 -0.559 -0.144
139 HG2 ARG 115 1HG ARG 115 14.896 -2.516 -2.370
140 HG3 ARG 115 2HG ARG 115 16.087 -1.221 -2.226
141 HD2 ARG 115 1HD ARG 115 15.363 -2.893 0.149
142 HD3 ARG 115 2HD ARG 115 16.519 -3.488 -1.042
143 HE ARG 115 HE ARG 115 17.031 -1.594 0.979
144 HH11 ARG 115 2HH1 ARG 115 17.711 -2.222 -2.377
145 HH12 ARG 115 1HH1 ARG 115 19.220 -1.370 -2.365
146 HH21 ARG 115 2HH2 ARG 115 19.015 -0.469 1.007
147 HH22 ARG 115 1HH2 ARG 115 19.961 -0.374 -0.440
148 H ALA 116 H ALA 116 11.718 0.630 -0.753
149 HA ALA 116 HA ALA 116 11.057 0.248 2.095
150 HB1 ALA 116 3HB ALA 116 11.918 2.635 0.552
151 HB2 ALA 116 1HB ALA 116 10.780 2.871 1.879
152 HB3 ALA 116 2HB ALA 116 12.349 2.124 2.184
153 H LYS 117 H LYS 117 9.020 1.147 2.828
154 HA LYS 117 HA LYS 117 6.838 0.361 1.270
155 HB2 LYS 117 1HB LYS 117 6.821 0.569 3.745
156 HB3 LYS 117 2HB LYS 117 6.834 2.320 3.574
157 HG2 LYS 117 1HG LYS 117 4.603 1.867 3.928
158 HG3 LYS 117 2HG LYS 117 4.693 1.959 2.168
159 HD2 LYS 117 1HD LYS 117 4.541 -0.358 1.921
160 HD3 LYS 117 2HD LYS 117 5.003 -0.660 3.598
161 HE2 LYS 117 1HE LYS 117 2.864 0.362 4.320
162 HE3 LYS 117 2HE LYS 117 2.405 0.525 2.625
163 HZ1 LYS 117 3HZ LYS 117 2.318 -1.781 4.321
164 HZ2 LYS 117 1HZ LYS 117 3.113 -2.090 2.859
165 HZ3 LYS 117 2HZ LYS 117 1.531 -1.493 2.852
166 H GLY 118 H GLY 118 7.968 3.656 2.042
167 HA2 GLY 118 1HA GLY 118 6.114 5.128 0.640
168 HA3 GLY 118 2HA GLY 118 7.792 5.610 0.843
169 H ASN 119 H ASN 119 9.310 4.241 -0.679
170 HA ASN 119 HA ASN 119 9.097 5.093 -3.223
171 HB2 ASN 119 1HB ASN 119 10.898 3.571 -2.007
172 HB3 ASN 119 2HB ASN 119 10.077 2.292 -2.895
173 HD21 ASN 119 1HD2 ASN 119 10.841 5.649 -3.729
174 HD22 ASN 119 2HD2 ASN 119 11.737 5.270 -5.157
175 H LEU 120 H LEU 120 7.722 2.056 -2.003
176 HA LEU 120 HA LEU 120 6.598 1.271 -4.492
177 HB2 LEU 120 1HB LEU 120 6.936 -0.471 -2.992
178 HB3 LEU 120 2HB LEU 120 6.228 0.421 -1.648
179 HG LEU 120 HG LEU 120 3.998 0.113 -2.641
180 HD11 LEU 120 1HD1 LEU 120 4.970 -0.112 -4.999
181 HD12 LEU 120 2HD1 LEU 120 3.603 -1.139 -4.569
182 HD13 LEU 120 3HD1 LEU 120 5.235 -1.806 -4.584
183 HD21 LEU 120 3HD2 LEU 120 5.603 -2.402 -2.205
184 HD22 LEU 120 1HD2 LEU 120 3.841 -2.326 -2.241
185 HD23 LEU 120 2HD2 LEU 120 4.734 -1.471 -0.984
186 H VAL 121 H VAL 121 5.226 2.793 -1.587
187 HA VAL 121 HA VAL 121 2.578 2.942 -2.279
188 HB VAL 121 HB VAL 121 4.208 5.076 -0.894
189 HG11 VAL 121 1HG1 VAL 121 1.662 5.353 -1.871
190 HG12 VAL 121 2HG1 VAL 121 1.381 4.838 -0.207
191 HG13 VAL 121 3HG1 VAL 121 2.353 6.273 -0.535
192 HG21 VAL 121 3HG2 VAL 121 2.553 3.646 0.889
193 HG22 VAL 121 1HG2 VAL 121 3.393 2.455 -0.105
194 HG23 VAL 121 2HG2 VAL 121 4.315 3.650 0.806
195 H THR 122 H THR 122 5.145 5.226 -3.183
196 HA THR 122 HA THR 122 3.545 7.030 -4.605
197 HB THR 122 HB THR 122 6.467 6.347 -4.752
198 HG1 THR 122 1HG THR 122 5.247 7.778 -3.116
199 HG21 THR 122 3HG2 THR 122 4.955 8.280 -6.506
200 HG22 THR 122 1HG2 THR 122 5.957 6.922 -7.018
201 HG23 THR 122 2HG2 THR 122 6.702 8.335 -6.269
202 H HIS 123 H HIS 123 5.024 3.993 -5.558
203 HA HIS 123 HA HIS 123 4.615 4.264 -8.348
204 HB2 HIS 123 1HB HIS 123 6.163 2.616 -7.830
205 HB3 HIS 123 2HB HIS 123 5.193 1.976 -6.507
206 HD1 HIS 123 1HD HIS 123 5.587 1.805 -10.226
207 HD2 HIS 123 2HD HIS 123 3.326 0.033 -7.225
208 HE1 HIS 123 1HE HIS 123 4.458 -0.163 -11.309
209 H GLN 124 H GLN 124 2.745 2.620 -5.811
210 HA GLN 124 HA GLN 124 0.738 1.513 -7.332
211 HB2 GLN 124 1HB GLN 124 0.078 2.853 -4.732
212 HB3 GLN 124 2HB GLN 124 -0.517 1.328 -5.374
213 HG2 GLN 124 1HG GLN 124 2.024 0.650 -5.145
214 HG3 GLN 124 2HG GLN 124 2.003 1.930 -3.933
215 HE21 GLN 124 1HE2 GLN 124 2.199 0.694 -2.140
216 HE22 GLN 124 2HE2 GLN 124 1.023 -0.463 -1.628
217 H ARG 125 H ARG 125 1.132 4.853 -6.320
218 HA ARG 125 HA ARG 125 -1.357 5.904 -6.822
219 HB2 ARG 125 1HB ARG 125 1.279 7.202 -7.536
220 HB3 ARG 125 2HB ARG 125 -0.248 8.030 -7.257
221 HG2 ARG 125 1HG ARG 125 -0.229 7.308 -4.931
222 HG3 ARG 125 2HG ARG 125 1.289 6.450 -5.206
223 HD2 ARG 125 1HD ARG 125 2.073 8.418 -4.329
224 HD3 ARG 125 2HD ARG 125 2.095 8.801 -6.050
225 HE ARG 125 HE ARG 125 0.392 10.313 -5.713
226 HH11 ARG 125 2HH1 ARG 125 0.829 8.368 -2.859
227 HH12 ARG 125 1HH1 ARG 125 -0.201 9.351 -1.873
228 HH21 ARG 125 2HH2 ARG 125 -0.966 11.615 -4.425
229 HH22 ARG 125 1HH2 ARG 125 -1.222 11.198 -2.765
230 H ILE 126 H ILE 126 0.835 4.524 -9.059
231 HA ILE 126 HA ILE 126 -0.094 5.876 -11.400
232 HB ILE 126 HB ILE 126 1.263 4.434 -12.648
233 HG12 ILE 126 1HG1 ILE 126 1.080 2.502 -10.330
234 HG13 ILE 126 2HG1 ILE 126 0.373 2.303 -11.929
235 HG21 ILE 126 1HG2 ILE 126 2.271 5.367 -10.092
236 HG22 ILE 126 2HG2 ILE 126 3.202 4.010 -10.727
237 HG23 ILE 126 3HG2 ILE 126 2.994 5.468 -11.698
238 HD11 ILE 126 3HD1 ILE 126 2.839 2.477 -12.735
239 HD12 ILE 126 1HD1 ILE 126 3.210 2.042 -11.067
240 HD13 ILE 126 2HD1 ILE 126 2.228 0.965 -12.061
241 H HIS 127 H HIS 127 -0.978 2.937 -9.700
242 HA HIS 127 HA HIS 127 -2.682 1.922 -11.754
243 HB2 HIS 127 1HB HIS 127 -2.422 1.279 -8.815
244 HB3 HIS 127 2HB HIS 127 -3.546 0.445 -9.885
245 HD1 HIS 127 1HD HIS 127 -2.391 -0.884 -11.925
246 HD2 HIS 127 2HD HIS 127 0.119 0.289 -8.828
247 HE1 HIS 127 1HE HIS 127 -0.308 -2.270 -12.186
248 H THR 128 H THR 128 -3.334 3.489 -8.621
249 HA THR 128 HA THR 128 -5.991 3.604 -8.458
250 HB THR 128 HB THR 128 -5.866 5.842 -7.480
251 HG1 THR 128 1HG THR 128 -4.381 7.192 -8.133
252 HG21 THR 128 3HG2 THR 128 -3.323 4.459 -6.691
253 HG22 THR 128 1HG2 THR 128 -4.893 3.735 -6.349
254 HG23 THR 128 2HG2 THR 128 -4.483 5.312 -5.674
255 H GLY 129 H GLY 129 -7.522 3.866 -9.943
256 HA2 GLY 129 1HA GLY 129 -7.085 5.872 -12.064
257 HA3 GLY 129 2HA GLY 129 -8.085 4.438 -12.240
258 H GLU 130 H GLU 130 -7.843 7.563 -10.615
259 HA GLU 130 HA GLU 130 -10.749 7.795 -10.747
260 HB2 GLU 130 1HB GLU 130 -9.178 8.218 -8.199
261 HB3 GLU 130 2HB GLU 130 -10.879 8.602 -8.417
262 HG2 GLU 130 1HG GLU 130 -9.793 5.832 -8.801
263 HG3 GLU 130 2HG GLU 130 -10.334 6.434 -7.235
264 H LYS 131 H LYS 131 -11.513 9.980 -10.554
265 HA LYS 131 HA LYS 131 -9.598 12.138 -10.476
266 HB2 LYS 131 1HB LYS 131 -9.522 11.278 -12.843
267 HB3 LYS 131 2HB LYS 131 -11.212 11.740 -12.998
268 HG2 LYS 131 1HG LYS 131 -10.741 13.990 -12.970
269 HG3 LYS 131 2HG LYS 131 -9.217 13.769 -12.109
270 HD2 LYS 131 1HD LYS 131 -9.574 12.685 -14.878
271 HD3 LYS 131 2HD LYS 131 -9.167 14.384 -14.625
272 HE2 LYS 131 1HE LYS 131 -7.600 12.043 -13.546
273 HE3 LYS 131 2HE LYS 131 -7.183 12.958 -14.994
274 HZ1 LYS 131 3HZ LYS 131 -7.091 13.814 -12.177
275 HZ2 LYS 131 1HZ LYS 131 -7.242 14.965 -13.409
276 HZ3 LYS 131 2HZ LYS 131 -5.898 13.940 -13.369
277 H SER 132 H SER 132 -10.516 13.830 -9.517
278 HA SER 132 HA SER 132 -13.418 13.846 -9.190
279 HB2 SER 132 1HB SER 132 -11.642 14.149 -7.291
280 HB3 SER 132 2HB SER 132 -11.578 15.814 -7.868
281 HG SER 132 HG SER 132 -13.209 15.068 -6.145
282 H GLY 133 H GLY 133 -14.446 16.094 -9.141
283 HA2 GLY 133 1HA GLY 133 -13.304 17.845 -11.210
284 HA3 GLY 133 2HA GLY 133 -14.944 17.244 -11.405
285 HA PRO 134 HA PRO 134 -14.970 21.320 -9.102
286 HB2 PRO 134 1HB PRO 134 -16.629 22.601 -10.828
287 HB3 PRO 134 2HB PRO 134 -14.872 22.581 -11.020
288 HG2 PRO 134 1HG PRO 134 -16.945 20.907 -12.383
289 HG3 PRO 134 2HG PRO 134 -15.514 21.696 -13.072
290 HD2 PRO 134 1HD PRO 134 -15.573 19.057 -12.465
291 HD3 PRO 134 2HD PRO 134 -14.093 20.031 -12.348
292 H SER 135 H SER 135 -17.004 18.810 -9.861
293 HA SER 135 HA SER 135 -19.067 19.840 -8.050
294 HB2 SER 135 1HB SER 135 -19.458 18.849 -10.843
295 HB3 SER 135 2HB SER 135 -20.696 18.491 -9.640
296 HG SER 135 HG SER 135 -20.909 20.708 -9.268
297 H SER 136 H SER 136 -19.824 18.377 -6.612
298 HA SER 136 HA SER 136 -18.869 15.603 -6.897
299 HB2 SER 136 1HB SER 136 -18.453 15.481 -4.576
300 HB3 SER 136 2HB SER 136 -17.824 17.058 -5.053
301 HG SER 136 HG SER 136 -20.388 16.588 -3.926
302 H GLY 137 H GLY 137 -20.386 14.080 -6.956
303 HA2 GLY 137 1HA GLY 137 -23.130 14.664 -6.957
304 HA3 GLY 137 2HA GLY 137 -22.436 13.054 -6.846
Start of MODEL 20
1 H1 GLY 93 H GLY 93 10.533 2.498 -20.030
2 HA2 GLY 93 1HA GLY 93 13.083 3.324 -20.615
3 HA3 GLY 93 2HA GLY 93 12.657 2.462 -19.144
4 H SER 94 H SER 94 13.609 0.567 -18.800
5 HA SER 94 HA SER 94 14.659 -0.918 -21.112
6 HB2 SER 94 1HB SER 94 16.124 -0.542 -18.490
7 HB3 SER 94 2HB SER 94 16.709 -1.417 -19.905
8 HG SER 94 HG SER 94 16.508 0.647 -21.034
9 H SER 95 H SER 95 15.362 -3.197 -20.380
10 HA SER 95 HA SER 95 13.333 -4.244 -18.516
11 HB2 SER 95 1HB SER 95 12.817 -4.873 -20.824
12 HB3 SER 95 2HB SER 95 14.434 -5.549 -21.017
13 HG SER 95 HG SER 95 13.748 -6.884 -19.087
14 H GLY 96 H GLY 96 13.914 -5.965 -17.165
15 HA2 GLY 96 1HA GLY 96 16.829 -6.399 -16.947
16 HA3 GLY 96 2HA GLY 96 15.760 -6.288 -15.557
17 H SER 97 H SER 97 17.317 -8.423 -15.590
18 HA SER 97 HA SER 97 16.040 -10.645 -16.930
19 HB2 SER 97 1HB SER 97 17.785 -12.008 -15.814
20 HB3 SER 97 2HB SER 97 18.469 -10.648 -16.705
21 HG SER 97 HG SER 97 18.113 -10.912 -13.910
22 H SER 98 H SER 98 16.385 -9.433 -13.626
23 HA SER 98 HA SER 98 14.778 -11.581 -12.540
24 HB2 SER 98 1HB SER 98 15.911 -9.090 -11.245
25 HB3 SER 98 2HB SER 98 15.081 -10.386 -10.383
26 HG SER 98 HG SER 98 17.499 -10.594 -11.856
27 H GLY 99 H GLY 99 12.636 -11.575 -12.559
28 HA2 GLY 99 1HA GLY 99 11.205 -9.092 -13.099
29 HA3 GLY 99 2HA GLY 99 10.526 -10.713 -13.124
30 H THR 100 H THR 100 9.740 -11.624 -11.233
31 HA THR 100 HA THR 100 9.341 -9.705 -9.041
32 HB THR 100 HB THR 100 7.437 -11.199 -8.378
33 HG1 THR 100 1HG THR 100 6.765 -12.534 -10.342
34 HG21 THR 100 3HG2 THR 100 5.927 -10.227 -9.874
35 HG22 THR 100 1HG2 THR 100 7.068 -10.295 -11.216
36 HG23 THR 100 2HG2 THR 100 7.307 -9.130 -9.913
37 H GLY 101 H GLY 101 10.716 -10.000 -7.409
38 HA2 GLY 101 1HA GLY 101 11.500 -12.760 -6.721
39 HA3 GLY 101 2HA GLY 101 12.464 -11.332 -6.379
40 H GLN 102 H GLN 102 12.556 -10.989 -4.268
41 HA GLN 102 HA GLN 102 10.061 -11.109 -2.724
42 HB2 GLN 102 1HB GLN 102 11.345 -12.082 -0.819
43 HB3 GLN 102 2HB GLN 102 11.195 -13.161 -2.200
44 HG2 GLN 102 1HG GLN 102 13.616 -11.474 -1.613
45 HG3 GLN 102 2HG GLN 102 13.437 -13.167 -1.154
46 HE21 GLN 102 1HE2 GLN 102 12.513 -14.456 -3.198
47 HE22 GLN 102 2HE2 GLN 102 13.483 -14.262 -4.614
48 H LYS 103 H LYS 103 9.700 -9.330 -1.572
49 HA LYS 103 HA LYS 103 11.894 -7.782 -0.482
50 HB2 LYS 103 1HB LYS 103 10.186 -6.844 -2.744
51 HB3 LYS 103 2HB LYS 103 10.671 -5.677 -1.522
52 HG2 LYS 103 1HG LYS 103 13.055 -6.516 -1.947
53 HG3 LYS 103 2HG LYS 103 12.389 -7.237 -3.414
54 HD2 LYS 103 1HD LYS 103 11.402 -4.841 -3.784
55 HD3 LYS 103 2HD LYS 103 12.687 -4.358 -2.675
56 HE2 LYS 103 1HE LYS 103 14.369 -5.184 -4.121
57 HE3 LYS 103 2HE LYS 103 13.193 -6.043 -5.116
58 HZ1 LYS 103 3HZ LYS 103 13.364 -3.088 -4.866
59 HZ2 LYS 103 1HZ LYS 103 12.323 -3.951 -5.883
60 HZ3 LYS 103 2HZ LYS 103 13.992 -3.987 -6.154
61 HA PRO 104 HA PRO 104 9.032 -6.897 2.724
62 HB2 PRO 104 1HB PRO 104 9.742 -4.382 3.460
63 HB3 PRO 104 2HB PRO 104 10.734 -5.802 3.811
64 HG2 PRO 104 1HG PRO 104 11.020 -3.789 1.614
65 HG3 PRO 104 2HG PRO 104 12.273 -4.513 2.638
66 HD2 PRO 104 1HD PRO 104 11.789 -5.358 0.111
67 HD3 PRO 104 2HD PRO 104 12.349 -6.451 1.393
68 H PHE 105 H PHE 105 8.931 -5.222 -0.196
69 HA PHE 105 HA PHE 105 6.207 -4.363 0.324
70 HB2 PHE 105 1HB PHE 105 8.178 -2.375 -0.802
71 HB3 PHE 105 2HB PHE 105 6.512 -2.085 -0.314
72 HD1 PHE 105 2HD PHE 105 5.918 -2.134 2.104
73 HD2 PHE 105 1HD PHE 105 9.950 -2.251 0.745
74 HE1 PHE 105 2HE PHE 105 6.689 -1.469 4.344
75 HE2 PHE 105 1HE PHE 105 10.727 -1.588 2.983
76 HZ PHE 105 HZ PHE 105 9.096 -1.195 4.786
77 H GLU 106 H GLU 106 5.221 -5.476 -1.241
78 HA GLU 106 HA GLU 106 6.271 -5.215 -3.983
79 HB2 GLU 106 1HB GLU 106 6.430 -7.528 -2.879
80 HB3 GLU 106 2HB GLU 106 4.678 -7.582 -3.019
81 HG2 GLU 106 1HG GLU 106 4.757 -7.558 -5.366
82 HG3 GLU 106 2HG GLU 106 6.451 -7.071 -5.383
83 H CYS 107 H CYS 107 4.818 -4.808 -5.614
84 HA CYS 107 HA CYS 107 2.249 -3.756 -4.763
85 HB2 CYS 107 1HB CYS 107 3.830 -2.579 -6.380
86 HB3 CYS 107 2HB CYS 107 3.352 -3.784 -7.571
87 H THR 108 H THR 108 1.432 -5.923 -4.214
88 HA THR 108 HA THR 108 1.086 -8.117 -5.712
89 HB THR 108 HB THR 108 0.054 -7.970 -3.539
90 HG1 THR 108 1HG THR 108 -2.232 -8.604 -4.324
91 HG21 THR 108 3HG2 THR 108 -0.717 -5.763 -3.352
92 HG22 THR 108 1HG2 THR 108 -2.190 -6.731 -3.389
93 HG23 THR 108 2HG2 THR 108 -1.662 -5.873 -4.837
94 H HIS 109 H HIS 109 -0.491 -5.033 -6.269
95 HA HIS 109 HA HIS 109 -2.504 -5.676 -8.010
96 HB2 HIS 109 1HB HIS 109 -0.618 -3.335 -7.938
97 HB3 HIS 109 2HB HIS 109 -1.874 -3.448 -9.167
98 HD2 HIS 109 2HD HIS 109 -1.561 -1.579 -6.118
99 HE1 HIS 109 1HE HIS 109 -5.538 -3.039 -5.879
100 HE2 HIS 109 2HE HIS 109 -3.899 -1.321 -5.040
101 H CYS 110 H CYS 110 0.841 -4.897 -8.985
102 HA CYS 110 HA CYS 110 0.380 -6.460 -11.441
103 HB2 CYS 110 1HB CYS 110 2.151 -5.067 -12.475
104 HB3 CYS 110 2HB CYS 110 0.766 -4.117 -11.946
105 H GLY 111 H GLY 111 2.771 -5.628 -8.957
106 HA2 GLY 111 1HA GLY 111 3.868 -7.727 -8.047
107 HA3 GLY 111 2HA GLY 111 4.287 -8.043 -9.725
108 H LYS 112 H LYS 112 4.344 -4.748 -8.974
109 HA LYS 112 HA LYS 112 7.166 -4.593 -9.360
110 HB2 LYS 112 1HB LYS 112 5.332 -2.868 -9.975
111 HB3 LYS 112 2HB LYS 112 5.482 -2.339 -8.304
112 HG2 LYS 112 1HG LYS 112 6.934 -0.913 -9.342
113 HG3 LYS 112 2HG LYS 112 8.030 -2.220 -8.885
114 HD2 LYS 112 1HD LYS 112 7.971 -3.131 -11.098
115 HD3 LYS 112 2HD LYS 112 6.687 -2.019 -11.577
116 HE2 LYS 112 1HE LYS 112 8.119 -0.196 -11.645
117 HE3 LYS 112 2HE LYS 112 9.302 -0.960 -10.585
118 HZ1 LYS 112 3HZ LYS 112 8.760 -2.143 -13.219
119 HZ2 LYS 112 1HZ LYS 112 10.174 -2.190 -12.292
120 HZ3 LYS 112 2HZ LYS 112 9.752 -0.777 -13.119
121 H SER 113 H SER 113 8.645 -4.998 -7.866
122 HA SER 113 HA SER 113 7.941 -4.864 -5.043
123 HB2 SER 113 1HB SER 113 10.024 -6.042 -4.645
124 HB3 SER 113 2HB SER 113 9.160 -6.839 -5.960
125 HG SER 113 HG SER 113 10.529 -5.401 -7.347
126 H PHE 114 H PHE 114 9.415 -3.843 -3.500
127 HA PHE 114 HA PHE 114 11.128 -1.735 -4.533
128 HB2 PHE 114 1HB PHE 114 8.700 -1.165 -2.823
129 HB3 PHE 114 2HB PHE 114 9.989 -0.006 -3.132
130 HD1 PHE 114 2HD PHE 114 7.275 -1.950 -4.698
131 HD2 PHE 114 1HD PHE 114 10.084 1.215 -5.151
132 HE1 PHE 114 2HE PHE 114 6.130 -1.233 -6.754
133 HE2 PHE 114 1HE PHE 114 8.943 1.938 -7.208
134 HZ PHE 114 HZ PHE 114 6.964 0.712 -8.012
135 H ARG 115 H ARG 115 12.283 -0.594 -2.742
136 HA ARG 115 HA ARG 115 13.173 -2.551 -0.809
137 HB2 ARG 115 1HB ARG 115 14.139 0.087 -1.791
138 HB3 ARG 115 2HB ARG 115 14.635 -0.407 -0.177
139 HG2 ARG 115 1HG ARG 115 14.982 -2.212 -2.544
140 HG3 ARG 115 2HG ARG 115 16.174 -0.978 -2.129
141 HD2 ARG 115 1HD ARG 115 16.466 -1.965 0.068
142 HD3 ARG 115 2HD ARG 115 15.212 -3.155 -0.277
143 HE ARG 115 HE ARG 115 17.002 -3.556 -2.262
144 HH11 ARG 115 2HH1 ARG 115 17.278 -3.375 1.204
145 HH12 ARG 115 1HH1 ARG 115 18.624 -4.463 1.283
146 HH21 ARG 115 2HH2 ARG 115 18.773 -4.990 -2.170
147 HH22 ARG 115 1HH2 ARG 115 19.474 -5.381 -0.636
148 H ALA 116 H ALA 116 11.762 0.712 -0.718
149 HA ALA 116 HA ALA 116 11.056 0.237 2.104
150 HB1 ALA 116 3HB ALA 116 12.632 2.165 1.499
151 HB2 ALA 116 1HB ALA 116 11.197 2.955 0.845
152 HB3 ALA 116 2HB ALA 116 11.263 2.519 2.553
153 H LYS 117 H LYS 117 9.012 1.114 2.839
154 HA LYS 117 HA LYS 117 6.838 0.357 1.292
155 HB2 LYS 117 1HB LYS 117 6.851 0.694 3.775
156 HB3 LYS 117 2HB LYS 117 6.797 2.429 3.492
157 HG2 LYS 117 1HG LYS 117 4.585 1.845 3.913
158 HG3 LYS 117 2HG LYS 117 4.670 1.962 2.154
159 HD2 LYS 117 1HD LYS 117 4.761 -0.409 1.924
160 HD3 LYS 117 2HD LYS 117 4.981 -0.629 3.661
161 HE2 LYS 117 1HE LYS 117 2.775 -0.217 4.129
162 HE3 LYS 117 2HE LYS 117 2.551 0.801 2.708
163 HZ1 LYS 117 3HZ LYS 117 2.514 -1.126 1.317
164 HZ2 LYS 117 1HZ LYS 117 1.403 -1.364 2.570
165 HZ3 LYS 117 2HZ LYS 117 2.903 -2.144 2.610
166 H GLY 118 H GLY 118 7.598 3.736 2.173
167 HA2 GLY 118 1HA GLY 118 5.912 5.139 0.640
168 HA3 GLY 118 2HA GLY 118 7.591 5.625 0.817
169 H ASN 119 H ASN 119 9.098 4.212 -0.673
170 HA ASN 119 HA ASN 119 8.889 4.986 -3.234
171 HB2 ASN 119 1HB ASN 119 10.035 2.453 -2.089
172 HB3 ASN 119 2HB ASN 119 10.114 2.774 -3.819
173 HD21 ASN 119 1HD2 ASN 119 12.069 2.700 -1.445
174 HD22 ASN 119 2HD2 ASN 119 13.021 4.124 -1.678
175 H LEU 120 H LEU 120 7.582 1.903 -2.022
176 HA LEU 120 HA LEU 120 6.382 1.147 -4.467
177 HB2 LEU 120 1HB LEU 120 6.745 -0.594 -2.969
178 HB3 LEU 120 2HB LEU 120 6.053 0.300 -1.617
179 HG LEU 120 HG LEU 120 3.815 -0.032 -2.528
180 HD11 LEU 120 1HD1 LEU 120 3.350 -1.176 -4.500
181 HD12 LEU 120 2HD1 LEU 120 4.972 -1.861 -4.600
182 HD13 LEU 120 3HD1 LEU 120 4.716 -0.148 -4.932
183 HD21 LEU 120 3HD2 LEU 120 4.365 -1.694 -1.001
184 HD22 LEU 120 1HD2 LEU 120 5.564 -2.420 -2.071
185 HD23 LEU 120 2HD2 LEU 120 3.845 -2.610 -2.416
186 H VAL 121 H VAL 121 5.013 2.594 -1.516
187 HA VAL 121 HA VAL 121 2.372 2.767 -2.174
188 HB VAL 121 HB VAL 121 4.007 4.921 -0.826
189 HG11 VAL 121 1HG1 VAL 121 1.056 4.444 -0.514
190 HG12 VAL 121 2HG1 VAL 121 2.006 5.835 0.011
191 HG13 VAL 121 3HG1 VAL 121 1.709 5.566 -1.707
192 HG21 VAL 121 3HG2 VAL 121 2.699 3.696 1.167
193 HG22 VAL 121 1HG2 VAL 121 2.887 2.335 0.061
194 HG23 VAL 121 2HG2 VAL 121 4.307 3.212 0.630
195 H THR 122 H THR 122 4.919 5.054 -3.127
196 HA THR 122 HA THR 122 3.271 6.840 -4.532
197 HB THR 122 HB THR 122 6.208 6.219 -4.699
198 HG1 THR 122 1HG THR 122 6.367 8.048 -3.545
199 HG21 THR 122 3HG2 THR 122 5.653 6.821 -6.950
200 HG22 THR 122 1HG2 THR 122 6.393 8.228 -6.188
201 HG23 THR 122 2HG2 THR 122 4.643 8.158 -6.401
202 H HIS 123 H HIS 123 4.843 3.849 -5.498
203 HA HIS 123 HA HIS 123 4.429 4.105 -8.282
204 HB2 HIS 123 1HB HIS 123 5.999 2.481 -7.756
205 HB3 HIS 123 2HB HIS 123 5.033 1.828 -6.436
206 HD1 HIS 123 1HD HIS 123 5.456 1.651 -10.151
207 HD2 HIS 123 2HD HIS 123 3.189 -0.137 -7.163
208 HE1 HIS 123 1HE HIS 123 4.359 -0.335 -11.236
209 H GLN 124 H GLN 124 2.559 2.467 -5.743
210 HA GLN 124 HA GLN 124 0.581 1.315 -7.276
211 HB2 GLN 124 1HB GLN 124 -0.117 2.657 -4.688
212 HB3 GLN 124 2HB GLN 124 -0.682 1.119 -5.325
213 HG2 GLN 124 1HG GLN 124 1.880 0.500 -5.076
214 HG3 GLN 124 2HG GLN 124 1.805 1.770 -3.855
215 HE21 GLN 124 1HE2 GLN 124 2.040 0.485 -2.090
216 HE22 GLN 124 2HE2 GLN 124 0.874 -0.690 -1.595
217 H ARG 125 H ARG 125 0.972 4.668 -6.349
218 HA ARG 125 HA ARG 125 -1.544 5.687 -6.846
219 HB2 ARG 125 1HB ARG 125 1.104 6.983 -7.520
220 HB3 ARG 125 2HB ARG 125 -0.432 7.820 -7.339
221 HG2 ARG 125 1HG ARG 125 -0.519 7.143 -4.988
222 HG3 ARG 125 2HG ARG 125 1.034 6.325 -5.175
223 HD2 ARG 125 1HD ARG 125 2.204 8.306 -5.375
224 HD3 ARG 125 2HD ARG 125 0.786 9.207 -5.910
225 HE ARG 125 HE ARG 125 0.106 8.601 -3.403
226 HH11 ARG 125 2HH1 ARG 125 3.065 9.871 -4.728
227 HH12 ARG 125 1HH1 ARG 125 3.479 10.755 -3.297
228 HH21 ARG 125 2HH2 ARG 125 0.641 9.761 -1.513
229 HH22 ARG 125 1HH2 ARG 125 2.100 10.691 -1.468
230 H ILE 126 H ILE 126 0.728 4.377 -9.071
231 HA ILE 126 HA ILE 126 -0.225 5.676 -11.421
232 HB ILE 126 HB ILE 126 1.168 4.256 -12.650
233 HG12 ILE 126 1HG1 ILE 126 0.953 2.321 -10.339
234 HG13 ILE 126 2HG1 ILE 126 0.323 2.108 -11.968
235 HG21 ILE 126 1HG2 ILE 126 2.127 5.292 -10.150
236 HG22 ILE 126 2HG2 ILE 126 3.045 3.859 -10.611
237 HG23 ILE 126 3HG2 ILE 126 2.933 5.227 -11.717
238 HD11 ILE 126 3HD1 ILE 126 2.825 2.333 -12.655
239 HD12 ILE 126 1HD1 ILE 126 3.120 1.894 -10.973
240 HD13 ILE 126 2HD1 ILE 126 2.207 0.808 -12.022
241 H HIS 127 H HIS 127 -1.112 2.774 -9.677
242 HA HIS 127 HA HIS 127 -2.774 1.706 -11.750
243 HB2 HIS 127 1HB HIS 127 -2.501 1.081 -8.810
244 HB3 HIS 127 2HB HIS 127 -3.633 0.236 -9.863
245 HD1 HIS 127 1HD HIS 127 -2.523 -1.155 -11.859
246 HD2 HIS 127 2HD HIS 127 0.073 0.154 -8.891
247 HE1 HIS 127 1HE HIS 127 -0.431 -2.521 -12.145
248 H THR 128 H THR 128 -3.440 3.330 -8.651
249 HA THR 128 HA THR 128 -6.113 3.391 -8.502
250 HB THR 128 HB THR 128 -6.019 5.627 -7.517
251 HG1 THR 128 1HG THR 128 -3.530 5.692 -8.853
252 HG21 THR 128 3HG2 THR 128 -3.443 4.453 -6.618
253 HG22 THR 128 1HG2 THR 128 -4.884 3.445 -6.497
254 HG23 THR 128 2HG2 THR 128 -4.826 5.003 -5.673
255 H GLY 129 H GLY 129 -4.208 5.479 -10.659
256 HA2 GLY 129 1HA GLY 129 -4.824 6.754 -12.468
257 HA3 GLY 129 2HA GLY 129 -5.986 5.473 -12.775
258 H GLU 130 H GLU 130 -5.542 8.320 -10.680
259 HA GLU 130 HA GLU 130 -8.445 8.735 -10.731
260 HB2 GLU 130 1HB GLU 130 -6.251 9.689 -8.916
261 HB3 GLU 130 2HB GLU 130 -7.800 10.519 -8.959
262 HG2 GLU 130 1HG GLU 130 -7.417 7.598 -8.345
263 HG3 GLU 130 2HG GLU 130 -7.654 8.871 -7.149
264 H LYS 131 H LYS 131 -8.494 9.546 -12.885
265 HA LYS 131 HA LYS 131 -7.428 12.283 -13.136
266 HB2 LYS 131 1HB LYS 131 -7.870 10.226 -15.308
267 HB3 LYS 131 2HB LYS 131 -7.391 11.894 -15.591
268 HG2 LYS 131 1HG LYS 131 -5.374 10.809 -15.690
269 HG3 LYS 131 2HG LYS 131 -5.417 11.312 -13.999
270 HD2 LYS 131 1HD LYS 131 -4.812 9.116 -13.751
271 HD3 LYS 131 2HD LYS 131 -6.569 8.961 -13.683
272 HE2 LYS 131 1HE LYS 131 -5.736 7.270 -15.152
273 HE3 LYS 131 2HE LYS 131 -6.548 8.489 -16.133
274 HZ1 LYS 131 3HZ LYS 131 -4.600 8.120 -17.280
275 HZ2 LYS 131 1HZ LYS 131 -3.667 7.934 -15.881
276 HZ3 LYS 131 2HZ LYS 131 -4.190 9.472 -16.349
277 H SER 132 H SER 132 -9.360 13.118 -12.209
278 HA SER 132 HA SER 132 -11.584 13.205 -14.125
279 HB2 SER 132 1HB SER 132 -13.191 13.157 -12.225
280 HB3 SER 132 2HB SER 132 -12.280 11.656 -12.385
281 HG SER 132 HG SER 132 -12.506 12.730 -10.204
282 H GLY 133 H GLY 133 -11.466 15.250 -14.829
283 HA2 GLY 133 1HA GLY 133 -10.939 17.392 -12.889
284 HA3 GLY 133 2HA GLY 133 -10.812 17.535 -14.636
285 HA PRO 134 HA PRO 134 -15.013 19.003 -12.895
286 HB2 PRO 134 1HB PRO 134 -14.560 21.680 -12.880
287 HB3 PRO 134 2HB PRO 134 -14.254 20.646 -11.479
288 HG2 PRO 134 1HG PRO 134 -12.328 21.694 -13.517
289 HG3 PRO 134 2HG PRO 134 -12.146 21.589 -11.756
290 HD2 PRO 134 1HD PRO 134 -11.029 19.792 -13.446
291 HD3 PRO 134 2HD PRO 134 -11.593 19.352 -11.821
292 H SER 135 H SER 135 -16.577 19.433 -14.345
293 HA SER 135 HA SER 135 -16.226 21.159 -16.585
294 HB2 SER 135 1HB SER 135 -15.925 18.213 -16.958
295 HB3 SER 135 2HB SER 135 -16.799 19.120 -18.191
296 HG SER 135 HG SER 135 -14.756 20.569 -17.862
297 H SER 136 H SER 136 -18.169 21.535 -17.725
298 HA SER 136 HA SER 136 -20.495 21.512 -16.254
299 HB2 SER 136 1HB SER 136 -19.951 21.754 -19.194
300 HB3 SER 136 2HB SER 136 -21.616 21.698 -18.614
301 HG SER 136 HG SER 136 -20.035 23.418 -17.193
302 H GLY 137 H GLY 137 -19.734 19.321 -18.970
303 HA2 GLY 137 1HA GLY 137 -21.932 17.577 -18.187
304 HA3 GLY 137 2HA GLY 137 -20.930 17.412 -19.621
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