Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
26666 | 2nsv RC | 7326 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ASN 1 1H ASN 1 10.694 -3.811 0.950
2 HA ASN 1 HA ASN 1 9.393 -3.045 -1.496
3 HB2 ASN 1 1HB ASN 1 10.786 -5.735 -1.080
4 HB3 ASN 1 2HB ASN 1 9.515 -5.525 -2.268
5 HD21 ASN 1 1HD2 ASN 1 12.443 -6.098 -2.442
6 HD22 ASN 1 2HD2 ASN 1 13.095 -4.939 -3.552
7 HA PRO 2 HA PRO 2 6.174 -4.593 1.080
8 HB2 PRO 2 1HB PRO 2 4.062 -4.264 -0.623
9 HB3 PRO 2 2HB PRO 2 4.710 -2.967 0.361
10 HG2 PRO 2 1HG PRO 2 5.030 -3.429 -2.541
11 HG3 PRO 2 2HG PRO 2 5.294 -1.956 -1.628
12 HD2 PRO 2 1HD PRO 2 7.306 -3.736 -2.635
13 HD3 PRO 2 2HD PRO 2 7.563 -2.328 -1.624
14 H GLU 3 H GLU 3 7.763 -6.585 0.231
15 HA GLU 3 HA GLU 3 6.089 -8.391 -1.231
16 HB2 GLU 3 1HB GLU 3 7.998 -9.784 -1.390
17 HB3 GLU 3 2HB GLU 3 8.654 -8.160 -1.443
18 HG2 GLU 3 1HG GLU 3 9.132 -8.279 1.016
19 HG3 GLU 3 2HG GLU 3 8.490 -9.910 1.057
20 H ASP 4 H ASP 4 7.342 -7.931 2.111
21 HA ASP 4 HA ASP 4 6.159 -10.359 2.994
22 HB2 ASP 4 1HB ASP 4 7.027 -8.070 4.790
23 HB3 ASP 4 2HB ASP 4 7.044 -9.786 5.145
24 H TRP 5 H TRP 5 5.141 -7.113 2.347
25 HA TRP 5 HA TRP 5 2.808 -7.441 4.110
26 HB2 TRP 5 1HB TRP 5 3.299 -4.747 3.107
27 HB3 TRP 5 2HB TRP 5 2.919 -5.305 4.724
28 HD1 TRP 5 HD TRP 5 5.383 -6.786 5.736
29 HE1 TRP 5 1HE TRP 5 7.811 -5.778 5.957
30 HE3 TRP 5 3HE TRP 5 4.707 -3.047 2.357
31 HZ2 TRP 5 2HZ TRP 5 9.147 -3.579 4.723
32 HZ3 TRP 5 3HZ TRP 5 6.623 -1.514 1.923
33 HH2 TRP 5 HH TRP 5 8.785 -1.733 3.042
34 H PHE 6 H PHE 6 1.412 -5.238 2.699
35 HA PHE 6 HA PHE 6 -0.007 -4.976 1.033
36 HB2 PHE 6 1HB PHE 6 1.938 -4.542 -0.361
37 HB3 PHE 6 2HB PHE 6 2.436 -6.222 -0.321
38 HD1 PHE 6 1HD PHE 6 -0.505 -4.206 -1.448
39 HD2 PHE 6 2HD PHE 6 2.113 -7.451 -2.238
40 HE1 PHE 6 1HE PHE 6 -1.655 -4.600 -3.644
41 HE2 PHE 6 2HE PHE 6 0.963 -7.845 -4.434
42 HZ PHE 6 HZ PHE 6 -0.908 -6.415 -5.111
43 H THR 7 H THR 7 -1.899 -6.032 0.643
44 HA THR 7 HA THR 7 -1.729 -8.954 0.293
45 HB THR 7 HB THR 7 -4.004 -8.925 1.441
46 HG1 THR 7 1HG THR 7 -4.104 -6.503 0.809
47 HG21 THR 7 3HG2 THR 7 -2.162 -7.385 3.273
48 HG22 THR 7 1HG2 THR 7 -3.131 -8.839 3.615
49 HG23 THR 7 2HG2 THR 7 -1.613 -8.977 2.696
50 HA PRO 8 HA PRO 8 -3.450 -7.644 -3.543
51 HB2 PRO 8 1HB PRO 8 -2.527 -9.753 -5.016
52 HB3 PRO 8 2HB PRO 8 -1.621 -8.269 -4.796
53 HG2 PRO 8 1HG PRO 8 -1.188 -10.909 -3.538
54 HG3 PRO 8 2HG PRO 8 -0.077 -9.559 -3.669
55 HD2 PRO 8 1HD PRO 8 -1.549 -10.352 -1.338
56 HD3 PRO 8 2HD PRO 8 -0.529 -8.936 -1.502
57 H ASP 9 H ASP 9 -4.223 -9.928 -1.371
58 HA ASP 9 HA ASP 9 -6.088 -11.278 -3.081
59 HB2 ASP 9 1HB ASP 9 -5.501 -11.441 -0.090
60 HB3 ASP 9 2HB ASP 9 -6.727 -12.417 -0.874
61 H THR 10 H THR 10 -5.892 -8.367 -1.303
62 HA THR 10 HA THR 10 -8.799 -8.093 -1.337
63 HB THR 10 HB THR 10 -8.270 -8.835 0.959
64 HG1 THR 10 1HG THR 10 -8.934 -6.707 1.950
65 HG21 THR 10 3HG2 THR 10 -6.182 -6.626 0.754
66 HG22 THR 10 1HG2 THR 10 -6.873 -7.084 2.330
67 HG23 THR 10 2HG2 THR 10 -5.978 -8.284 1.367
68 H CYS 11 H CYS 11 -7.127 -7.141 -3.300
69 HA CYS 11 HA CYS 11 -7.566 -4.336 -2.953
70 HB2 CYS 11 1HB CYS 11 -5.175 -5.038 -2.032
71 HB3 CYS 11 2HB CYS 11 -4.761 -4.995 -3.734
72 H ALA 12 H ALA 12 -7.304 -3.212 -5.096
73 HA ALA 12 HA ALA 12 -8.251 -4.829 -7.190
74 HB1 ALA 12 3HB ALA 12 -7.082 -2.283 -8.022
75 HB2 ALA 12 1HB ALA 12 -8.782 -2.810 -8.037
76 HB3 ALA 12 2HB ALA 12 -8.083 -2.102 -6.561
77 H TYR 13 H TYR 13 -5.020 -3.476 -6.346
78 HA TYR 13 HA TYR 13 -3.856 -4.585 -8.744
79 HB2 TYR 13 1HB TYR 13 -2.484 -3.495 -6.228
80 HB3 TYR 13 2HB TYR 13 -1.897 -3.401 -7.876
81 HD1 TYR 13 2HD TYR 13 -3.840 -2.170 -9.479
82 HD2 TYR 13 1HD TYR 13 -3.060 -1.443 -5.335
83 HE1 TYR 13 2HE TYR 13 -4.834 0.160 -9.693
84 HE2 TYR 13 1HE TYR 13 -4.057 0.885 -5.564
85 HH TYR 13 HH TYR 13 -5.735 1.982 -7.075
86 H GLY 14 H GLY 14 -2.704 -6.476 -8.925
87 HA2 GLY 14 1HA GLY 14 -2.723 -8.228 -6.576
88 HA3 GLY 14 2HA GLY 14 -2.504 -8.697 -8.250
89 H ASP 15 H ASP 15 -0.704 -5.860 -7.650
90 HA ASP 15 HA ASP 15 1.653 -7.495 -7.123
91 HB2 ASP 15 1HB ASP 15 1.815 -4.795 -8.469
92 HB3 ASP 15 2HB ASP 15 2.910 -6.156 -8.608
93 H SER 16 H SER 16 3.113 -6.676 -5.509
94 HA SER 16 HA SER 16 1.958 -4.789 -3.739
95 HB2 SER 16 1HB SER 16 4.764 -5.429 -3.199
96 HB3 SER 16 2HB SER 16 3.345 -5.751 -2.223
97 HG SER 16 HG SER 16 4.753 -7.582 -3.384
98 H ASN 17 H ASN 17 4.413 -4.809 -6.304
99 HA ASN 17 HA ASN 17 5.722 -2.474 -5.523
100 HB2 ASN 17 1HB ASN 17 5.648 -4.281 -7.865
101 HB3 ASN 17 2HB ASN 17 5.909 -2.614 -8.337
102 HD21 ASN 17 1HD2 ASN 17 8.002 -2.763 -8.908
103 HD22 ASN 17 2HD2 ASN 17 9.311 -3.100 -7.825
104 H THR 18 H THR 18 3.476 -3.080 -8.341
105 HA THR 18 HA THR 18 2.995 -0.410 -8.924
106 HB THR 18 HB THR 18 2.460 -2.752 -10.129
107 HG1 THR 18 1HG THR 18 2.170 -0.706 -11.152
108 HG21 THR 18 3HG2 THR 18 -0.328 -1.920 -9.271
109 HG22 THR 18 1HG2 THR 18 0.209 -3.459 -9.985
110 HG23 THR 18 2HG2 THR 18 0.565 -3.098 -8.279
111 H ALA 19 H ALA 19 1.483 -2.565 -6.510
112 HA ALA 19 HA ALA 19 -0.724 -0.944 -5.965
113 HB1 ALA 19 3HB ALA 19 -0.593 -2.199 -3.720
114 HB2 ALA 19 1HB ALA 19 -0.736 -3.189 -5.192
115 HB3 ALA 19 2HB ALA 19 0.843 -3.009 -4.391
116 H TRP 20 H TRP 20 2.389 -1.276 -4.105
117 HA TRP 20 HA TRP 20 1.938 0.847 -2.404
118 HB2 TRP 20 1HB TRP 20 3.653 -0.737 -1.952
119 HB3 TRP 20 2HB TRP 20 4.481 -0.387 -3.456
120 HD1 TRP 20 HD TRP 20 5.175 2.536 -3.495
121 HE1 TRP 20 1HE TRP 20 6.524 3.869 -1.660
122 HE3 TRP 20 3HE TRP 20 4.260 -0.724 0.299
123 HZ2 TRP 20 2HZ TRP 20 7.045 3.420 1.110
124 HZ3 TRP 20 3HZ TRP 20 5.225 -0.203 2.537
125 HH2 TRP 20 HH TRP 20 6.576 1.787 2.974
126 H THR 21 H THR 21 3.648 0.724 -5.608
127 HA THR 21 HA THR 21 4.340 3.405 -5.740
128 HB THR 21 HB THR 21 3.939 1.096 -7.621
129 HG1 THR 21 1HG THR 21 5.955 1.695 -6.494
130 HG21 THR 21 3HG2 THR 21 4.860 2.956 -9.368
131 HG22 THR 21 1HG2 THR 21 3.128 2.562 -9.250
132 HG23 THR 21 2HG2 THR 21 3.773 3.998 -8.418
133 H THR 22 H THR 22 1.408 1.820 -7.183
134 HA THR 22 HA THR 22 0.252 4.234 -7.996
135 HB THR 22 HB THR 22 -0.919 1.488 -7.307
136 HG1 THR 22 1HG THR 22 0.805 1.969 -9.057
137 HG21 THR 22 3HG2 THR 22 -2.805 2.110 -8.736
138 HG22 THR 22 1HG2 THR 22 -2.667 3.352 -7.469
139 HG23 THR 22 2HG2 THR 22 -2.061 3.683 -9.110
140 H CYS 23 H CYS 23 0.696 2.905 -4.831
141 HA CYS 23 HA CYS 23 -1.587 4.253 -3.733
142 HB2 CYS 23 1HB CYS 23 0.310 2.255 -2.867
143 HB3 CYS 23 2HB CYS 23 0.187 3.528 -1.669
144 H THR 24 H THR 24 1.964 4.668 -4.089
145 HA THR 24 HA THR 24 1.948 7.090 -2.501
146 HB THR 24 HB THR 24 4.431 7.005 -3.327
147 HG1 THR 24 1HG THR 24 4.825 5.261 -4.664
148 HG21 THR 24 3HG2 THR 24 4.948 4.932 -1.938
149 HG22 THR 24 1HG2 THR 24 3.928 6.120 -1.091
150 HG23 THR 24 2HG2 THR 24 3.195 4.659 -1.796
151 H THR 25 H THR 25 0.062 7.529 -4.355
152 HA THR 25 HA THR 25 1.401 9.479 -6.083
153 HB THR 25 HB THR 25 -0.209 8.727 -7.926
154 HG1 THR 25 1HG THR 25 -1.696 7.543 -6.616
155 HG21 THR 25 3HG2 THR 25 1.674 7.605 -8.603
156 HG22 THR 25 1HG2 THR 25 2.141 7.248 -6.923
157 HG23 THR 25 2HG2 THR 25 0.993 6.185 -7.773
158 HA PRO 26 HA PRO 26 -1.777 12.071 -4.831
159 HB2 PRO 26 1HB PRO 26 -2.090 13.754 -6.961
160 HB3 PRO 26 2HB PRO 26 -0.787 13.910 -5.799
161 HG2 PRO 26 1HG PRO 26 -0.689 12.873 -8.566
162 HG3 PRO 26 2HG PRO 26 0.629 13.429 -7.555
163 HD2 PRO 26 1HD PRO 26 -0.051 10.705 -8.142
164 HD3 PRO 26 2HD PRO 26 1.194 11.261 -7.041
165 H GLY 27 H GLY 27 -3.836 11.659 -4.367
166 HA2 GLY 27 1HA GLY 27 -5.735 11.532 -6.500
167 HA3 GLY 27 2HA GLY 27 -5.383 9.943 -5.848
168 H GLN 28 H GLN 28 -7.636 9.867 -5.084
169 HA GLN 28 HA GLN 28 -8.215 11.722 -2.942
170 HB2 GLN 28 1HB GLN 28 -9.817 9.950 -4.738
171 HB3 GLN 28 2HB GLN 28 -10.444 10.152 -3.114
172 HG2 GLN 28 1HG GLN 28 -11.423 12.017 -4.060
173 HG3 GLN 28 2HG GLN 28 -9.891 12.748 -3.627
174 HE21 GLN 28 1HE2 GLN 28 -8.827 13.768 -5.139
175 HE22 GLN 28 2HE2 GLN 28 -8.986 13.568 -6.853
176 H THR 29 H THR 29 -7.665 8.240 -3.618
177 HA THR 29 HA THR 29 -7.654 7.785 -0.705
178 HB THR 29 HB THR 29 -8.580 5.614 -1.135
179 HG1 THR 29 1HG THR 29 -7.897 6.304 -3.908
180 HG21 THR 29 3HG2 THR 29 -10.596 5.993 -2.352
181 HG22 THR 29 1HG2 THR 29 -10.158 7.624 -1.790
182 HG23 THR 29 2HG2 THR 29 -9.809 7.137 -3.466
183 H CYS 30 H CYS 30 -5.395 8.917 -1.615
184 HA CYS 30 HA CYS 30 -3.577 7.014 -2.653
185 HB2 CYS 30 1HB CYS 30 -3.064 9.232 -3.138
186 HB3 CYS 30 2HB CYS 30 -3.335 9.771 -1.492
187 H TYR 31 H TYR 31 -4.332 8.408 0.606
188 HA TYR 31 HA TYR 31 -2.456 6.558 1.839
189 HB2 TYR 31 1HB TYR 31 -2.602 8.953 2.552
190 HB3 TYR 31 2HB TYR 31 -4.337 8.818 2.755
191 HD1 TYR 31 1HD TYR 31 -5.242 7.326 4.615
192 HD2 TYR 31 2HD TYR 31 -1.116 8.420 4.325
193 HE1 TYR 31 1HE TYR 31 -4.902 6.719 7.060
194 HE2 TYR 31 2HE TYR 31 -0.790 7.809 6.772
195 HH TYR 31 HH TYR 31 -3.459 6.430 8.656
196 H THR 32 H THR 32 -5.746 6.635 0.871
197 HA THR 32 HA THR 32 -6.676 5.004 3.088
198 HB THR 32 HB THR 32 -7.892 6.318 0.624
199 HG1 THR 32 1HG THR 32 -9.062 7.303 2.444
200 HG21 THR 32 3HG2 THR 32 -9.438 4.599 0.594
201 HG22 THR 32 1HG2 THR 32 -8.913 3.981 2.178
202 HG23 THR 32 2HG2 THR 32 -10.033 5.361 2.089
203 H CYS 33 H CYS 33 -5.463 4.652 -0.220
204 HA CYS 33 HA CYS 33 -6.499 2.092 -0.662
205 HB2 CYS 33 1HB CYS 33 -4.900 1.940 -2.465
206 HB3 CYS 33 2HB CYS 33 -5.677 3.511 -2.458
207 H CYS 34 H CYS 34 -3.490 3.386 0.847
208 HA CYS 34 HA CYS 34 -2.092 1.036 1.086
209 HB2 CYS 34 1HB CYS 34 -2.141 3.295 3.096
210 HB3 CYS 34 2HB CYS 34 -0.871 2.106 2.884
211 H SER 35 H SER 35 -4.856 2.368 2.921
212 HA SER 35 HA SER 35 -4.621 0.442 4.993
213 HB2 SER 35 1HB SER 35 -5.616 2.579 5.529
214 HB3 SER 35 2HB SER 35 -6.774 2.449 4.220
215 HG SER 35 HG SER 35 -7.821 0.714 5.330
216 H SER 36 H SER 36 -5.359 0.105 1.791
217 HA SER 36 HA SER 36 -7.077 -2.156 2.383
218 HB2 SER 36 1HB SER 36 -8.035 0.188 1.166
219 HB3 SER 36 2HB SER 36 -7.739 -0.884 -0.189
220 HG SER 36 HG SER 36 -9.619 -1.764 0.325
221 H CYS 37 H CYS 37 -4.133 -1.443 1.608
222 HA CYS 37 HA CYS 37 -3.984 -3.460 -0.480
223 HB2 CYS 37 1HB CYS 37 -3.554 -0.700 -0.979
224 HB3 CYS 37 2HB CYS 37 -1.981 -1.473 -0.999
225 H PHE 38 H PHE 38 -3.491 -2.934 2.570
226 HA PHE 38 HA PHE 38 -1.000 -4.354 2.638
227 HB2 PHE 38 1HB PHE 38 -1.414 -1.567 3.878
228 HB3 PHE 38 2HB PHE 38 -0.038 -2.589 4.241
229 HD1 PHE 38 2HD PHE 38 1.078 -3.525 1.887
230 HD2 PHE 38 1HD PHE 38 -0.943 0.164 2.448
231 HE1 PHE 38 2HE PHE 38 2.318 -2.549 -0.065
232 HE2 PHE 38 1HE PHE 38 0.297 1.140 0.496
233 HZ PHE 38 HZ PHE 38 1.913 -0.228 -0.737
234 H ASP 39 H ASP 39 -0.377 -4.666 5.130
235 HA ASP 39 HA ASP 39 -2.901 -5.332 6.400
236 HB2 ASP 39 1HB ASP 39 -1.442 -7.247 6.096
237 HB3 ASP 39 2HB ASP 39 -0.056 -6.374 6.718
238 H VAL 40 H VAL 40 0.444 -4.859 7.731
239 HA VAL 40 HA VAL 40 -0.578 -2.618 9.322
240 HB VAL 40 HB VAL 40 -0.560 -4.784 10.586
241 HG11 VAL 40 1HG1 VAL 40 1.495 -5.818 11.234
242 HG12 VAL 40 2HG1 VAL 40 1.526 -5.658 9.461
243 HG13 VAL 40 3HG1 VAL 40 2.459 -4.529 10.473
244 HG21 VAL 40 3HG2 VAL 40 1.110 -2.419 11.451
245 HG22 VAL 40 1HG2 VAL 40 -0.559 -2.841 11.906
246 HG23 VAL 40 2HG2 VAL 40 0.804 -3.796 12.536
247 H VAL 41 H VAL 41 2.290 -4.466 8.111
248 HA VAL 41 HA VAL 41 4.040 -2.257 8.544
249 HB VAL 41 HB VAL 41 4.463 -4.687 6.804
250 HG11 VAL 41 1HG1 VAL 41 6.415 -2.977 8.382
251 HG12 VAL 41 2HG1 VAL 41 6.821 -4.369 7.350
252 HG13 VAL 41 3HG1 VAL 41 6.149 -2.889 6.624
253 HG21 VAL 41 3HG2 VAL 41 4.610 -4.405 9.813
254 HG22 VAL 41 1HG2 VAL 41 3.734 -5.618 8.849
255 HG23 VAL 41 2HG2 VAL 41 5.511 -5.659 8.927
256 H GLY 42 H GLY 42 2.360 -3.737 5.703
257 HA2 GLY 42 1HA GLY 42 3.444 -2.088 3.732
258 HA3 GLY 42 2HA GLY 42 1.902 -2.918 3.662
259 H GLU 43 H GLU 43 0.672 -1.627 5.992
260 HA GLU 43 HA GLU 43 -0.131 0.753 4.661
261 HB2 GLU 43 1HB GLU 43 -1.556 -0.950 6.074
262 HB3 GLU 43 2HB GLU 43 -0.991 -0.037 7.458
263 HG2 GLU 43 1HG GLU 43 -1.820 2.083 6.251
264 HG3 GLU 43 2HG GLU 43 -2.586 1.023 5.084
265 H GLN 44 H GLN 44 1.492 -0.084 7.794
266 HA GLN 44 HA GLN 44 1.776 2.570 8.593
267 HB2 GLN 44 1HB GLN 44 3.051 1.710 10.391
268 HB3 GLN 44 2HB GLN 44 1.957 0.401 9.991
269 HG2 GLN 44 1HG GLN 44 3.877 -0.856 9.952
270 HG3 GLN 44 2HG GLN 44 4.026 -0.229 8.322
271 HE21 GLN 44 1HE2 GLN 44 6.302 -0.667 8.703
272 HE22 GLN 44 2HE2 GLN 44 7.298 0.529 9.463
273 H ALA 45 H ALA 45 3.542 0.523 6.337
274 HA ALA 45 HA ALA 45 5.893 2.198 6.387
275 HB1 ALA 45 3HB ALA 45 5.079 -0.100 4.560
276 HB2 ALA 45 1HB ALA 45 6.698 0.630 4.676
277 HB3 ALA 45 2HB ALA 45 6.022 -0.260 6.062
278 H CYS 46 H CYS 46 2.886 1.749 4.519
279 HA CYS 46 HA CYS 46 3.795 3.462 2.410
280 HB2 CYS 46 1HB CYS 46 2.303 1.648 1.877
281 HB3 CYS 46 2HB CYS 46 1.108 2.222 3.023
282 H GLN 47 H GLN 47 2.291 3.702 5.566
283 HA GLN 47 HA GLN 47 0.777 5.976 5.212
284 HB2 GLN 47 1HB GLN 47 2.053 4.565 7.524
285 HB3 GLN 47 2HB GLN 47 1.568 6.226 7.806
286 HG2 GLN 47 1HG GLN 47 -0.733 5.760 7.224
287 HG3 GLN 47 2HG GLN 47 -0.323 4.198 6.543
288 HE21 GLN 47 1HE2 GLN 47 -0.094 6.071 9.555
289 HE22 GLN 47 2HE2 GLN 47 -0.397 4.767 10.653
290 H MET 48 H MET 48 4.173 5.665 6.490
291 HA MET 48 HA MET 48 4.552 8.443 6.507
292 HB2 MET 48 1HB MET 48 6.323 5.975 6.720
293 HB3 MET 48 2HB MET 48 7.075 7.554 6.605
294 HG2 MET 48 1HG MET 48 5.172 8.042 8.543
295 HG3 MET 48 2HG MET 48 5.521 6.354 8.856
296 HE1 MET 48 3HE MET 48 6.774 7.012 11.380
297 HE2 MET 48 1HE MET 48 7.545 8.616 11.416
298 HE3 MET 48 2HE MET 48 5.868 8.447 10.844
299 H SER 49 H SER 49 5.263 5.823 4.157
300 HA SER 49 HA SER 49 6.896 7.355 2.509
301 HB2 SER 49 1HB SER 49 6.665 4.837 2.492
302 HB3 SER 49 2HB SER 49 5.099 5.017 1.727
303 HG SER 49 HG SER 49 7.702 5.461 0.661
304 H ALA 50 H ALA 50 3.347 6.601 2.430
305 HA ALA 50 HA ALA 50 2.659 7.824 0.098
306 HB1 ALA 50 3HB ALA 50 1.184 7.744 2.760
307 HB2 ALA 50 1HB ALA 50 0.436 8.154 1.198
308 HB3 ALA 50 2HB ALA 50 1.110 6.528 1.462
309 H GLN 51 H GLN 51 3.139 9.815 -0.672
310 HA GLN 51 HA GLN 51 3.472 11.922 1.298
311 HB2 GLN 51 1HB GLN 51 4.897 11.178 -1.078
312 HB3 GLN 51 2HB GLN 51 4.186 12.752 -1.378
313 HG2 GLN 51 1HG GLN 51 5.134 13.070 1.207
314 HG3 GLN 51 2HG GLN 51 6.328 11.977 0.538
315 HE21 GLN 51 1HE2 GLN 51 4.666 15.049 0.086
316 HE22 GLN 51 2HE2 GLN 51 5.883 15.841 -0.858
317 H CYS 52 H CYS 52 0.860 11.414 1.156
318 HA CYS 52 HA CYS 52 -0.154 13.422 -0.722
319 HB2 CYS 52 1HB CYS 52 -2.359 11.960 -0.204
320 HB3 CYS 52 2HB CYS 52 -1.316 11.728 -1.593
Start of MODEL 2
1 H1 ASN 1 1H ASN 1 11.349 -3.517 0.650
2 HA ASN 1 HA ASN 1 9.856 -4.667 -0.995
3 HB2 ASN 1 1HB ASN 1 11.244 -5.860 1.383
4 HB3 ASN 1 2HB ASN 1 10.139 -6.935 0.551
5 HD21 ASN 1 1HD2 ASN 1 10.502 -7.540 -1.567
6 HD22 ASN 1 2HD2 ASN 1 12.026 -7.341 -2.366
7 HA PRO 2 HA PRO 2 5.909 -4.758 1.133
8 HB2 PRO 2 1HB PRO 2 4.336 -4.630 -1.098
9 HB3 PRO 2 2HB PRO 2 4.917 -3.210 -0.252
10 HG2 PRO 2 1HG PRO 2 5.846 -4.348 -2.817
11 HG3 PRO 2 2HG PRO 2 6.101 -2.738 -2.175
12 HD2 PRO 2 1HD PRO 2 8.007 -4.880 -2.243
13 HD3 PRO 2 2HD PRO 2 8.222 -3.309 -1.497
14 H GLU 3 H GLU 3 7.587 -6.973 -0.515
15 HA GLU 3 HA GLU 3 5.673 -8.820 -1.214
16 HB2 GLU 3 1HB GLU 3 7.469 -10.379 -1.375
17 HB3 GLU 3 2HB GLU 3 8.187 -8.820 -1.726
18 HG2 GLU 3 1HG GLU 3 8.907 -8.652 0.695
19 HG3 GLU 3 2HG GLU 3 8.272 -10.263 0.966
20 H ASP 4 H ASP 4 7.133 -8.008 1.943
21 HA ASP 4 HA ASP 4 6.056 -10.318 3.195
22 HB2 ASP 4 1HB ASP 4 6.883 -7.835 4.708
23 HB3 ASP 4 2HB ASP 4 7.099 -9.514 5.160
24 H TRP 5 H TRP 5 4.935 -7.186 2.206
25 HA TRP 5 HA TRP 5 2.637 -7.409 4.029
26 HB2 TRP 5 1HB TRP 5 3.120 -4.746 2.950
27 HB3 TRP 5 2HB TRP 5 2.752 -5.259 4.585
28 HD1 TRP 5 HD TRP 5 5.248 -6.738 5.578
29 HE1 TRP 5 1HE TRP 5 7.666 -5.699 5.773
30 HE3 TRP 5 3HE TRP 5 4.488 -3.010 2.205
31 HZ2 TRP 5 2HZ TRP 5 8.960 -3.484 4.522
32 HZ3 TRP 5 3HZ TRP 5 6.380 -1.453 1.749
33 HH2 TRP 5 HH TRP 5 8.556 -1.644 2.845
34 H PHE 6 H PHE 6 1.271 -5.229 2.528
35 HA PHE 6 HA PHE 6 -0.151 -5.028 0.856
36 HB2 PHE 6 1HB PHE 6 1.784 -4.625 -0.550
37 HB3 PHE 6 2HB PHE 6 2.312 -6.292 -0.437
38 HD1 PHE 6 1HD PHE 6 -0.636 -4.361 -1.685
39 HD2 PHE 6 2HD PHE 6 2.010 -7.622 -2.291
40 HE1 PHE 6 1HE PHE 6 -1.759 -4.865 -3.872
41 HE2 PHE 6 2HE PHE 6 0.888 -8.127 -4.479
42 HZ PHE 6 HZ PHE 6 -0.984 -6.742 -5.243
43 H THR 7 H THR 7 -2.042 -6.136 0.765
44 HA THR 7 HA THR 7 -1.862 -9.050 0.373
45 HB THR 7 HB THR 7 -3.931 -9.153 1.701
46 HG1 THR 7 1HG THR 7 -4.682 -6.944 2.464
47 HG21 THR 7 3HG2 THR 7 -1.571 -8.506 2.864
48 HG22 THR 7 1HG2 THR 7 -2.455 -7.001 3.215
49 HG23 THR 7 2HG2 THR 7 -3.084 -8.560 3.800
50 HA PRO 8 HA PRO 8 -3.706 -7.820 -3.433
51 HB2 PRO 8 1HB PRO 8 -2.805 -9.944 -4.898
52 HB3 PRO 8 2HB PRO 8 -1.909 -8.447 -4.729
53 HG2 PRO 8 1HG PRO 8 -1.410 -11.061 -3.442
54 HG3 PRO 8 2HG PRO 8 -0.318 -9.702 -3.628
55 HD2 PRO 8 1HD PRO 8 -1.711 -10.471 -1.241
56 HD3 PRO 8 2HD PRO 8 -0.712 -9.048 -1.459
57 H ASP 9 H ASP 9 -4.322 -10.178 -1.241
58 HA ASP 9 HA ASP 9 -6.248 -11.532 -2.863
59 HB2 ASP 9 1HB ASP 9 -4.843 -12.032 -0.422
60 HB3 ASP 9 2HB ASP 9 -6.543 -11.988 0.002
61 H THR 10 H THR 10 -6.073 -8.552 -1.308
62 HA THR 10 HA THR 10 -8.973 -8.363 -1.153
63 HB THR 10 HB THR 10 -8.178 -9.037 1.143
64 HG1 THR 10 1HG THR 10 -9.832 -7.631 1.564
65 HG21 THR 10 3HG2 THR 10 -6.332 -8.066 2.070
66 HG22 THR 10 1HG2 THR 10 -6.097 -7.118 0.582
67 HG23 THR 10 2HG2 THR 10 -7.093 -6.466 1.905
68 H CYS 11 H CYS 11 -7.205 -7.457 -3.166
69 HA CYS 11 HA CYS 11 -7.724 -4.628 -2.878
70 HB2 CYS 11 1HB CYS 11 -5.250 -5.382 -2.190
71 HB3 CYS 11 2HB CYS 11 -5.018 -5.297 -3.924
72 H ALA 12 H ALA 12 -6.844 -3.641 -5.223
73 HA ALA 12 HA ALA 12 -8.121 -5.393 -7.183
74 HB1 ALA 12 3HB ALA 12 -8.823 -3.469 -8.244
75 HB2 ALA 12 1HB ALA 12 -8.693 -2.848 -6.581
76 HB3 ALA 12 2HB ALA 12 -7.386 -2.541 -7.751
77 H TYR 13 H TYR 13 -5.052 -3.974 -6.195
78 HA TYR 13 HA TYR 13 -3.822 -4.424 -8.768
79 HB2 TYR 13 1HB TYR 13 -2.716 -3.793 -5.961
80 HB3 TYR 13 2HB TYR 13 -1.837 -3.572 -7.461
81 HD1 TYR 13 2HD TYR 13 -4.340 -2.421 -8.981
82 HD2 TYR 13 1HD TYR 13 -2.461 -1.491 -5.251
83 HE1 TYR 13 2HE TYR 13 -5.205 -0.035 -9.132
84 HE2 TYR 13 1HE TYR 13 -3.333 0.892 -5.415
85 HH TYR 13 HH TYR 13 -5.761 1.796 -7.287
86 H GLY 14 H GLY 14 -2.360 -6.061 -9.303
87 HA2 GLY 14 1HA GLY 14 -2.421 -8.383 -7.502
88 HA3 GLY 14 2HA GLY 14 -2.085 -8.391 -9.221
89 H ASP 15 H ASP 15 -0.374 -5.775 -8.592
90 HA ASP 15 HA ASP 15 1.986 -7.336 -7.941
91 HB2 ASP 15 1HB ASP 15 2.035 -4.488 -8.972
92 HB3 ASP 15 2HB ASP 15 3.248 -5.738 -9.167
93 H SER 16 H SER 16 3.417 -6.590 -6.238
94 HA SER 16 HA SER 16 2.095 -4.944 -4.312
95 HB2 SER 16 1HB SER 16 3.888 -5.616 -2.807
96 HB3 SER 16 2HB SER 16 3.329 -7.029 -3.680
97 HG SER 16 HG SER 16 5.605 -5.457 -4.528
98 H ASN 17 H ASN 17 4.940 -4.829 -6.504
99 HA ASN 17 HA ASN 17 6.069 -2.537 -5.443
100 HB2 ASN 17 1HB ASN 17 6.777 -4.315 -7.397
101 HB3 ASN 17 2HB ASN 17 6.225 -3.000 -8.415
102 HD21 ASN 17 1HD2 ASN 17 7.617 -1.493 -8.918
103 HD22 ASN 17 2HD2 ASN 17 9.082 -1.095 -8.083
104 H THR 18 H THR 18 3.841 -3.095 -8.271
105 HA THR 18 HA THR 18 3.541 -0.339 -8.864
106 HB THR 18 HB THR 18 3.088 -2.696 -10.174
107 HG1 THR 18 1HG THR 18 2.187 -1.202 -11.693
108 HG21 THR 18 3HG2 THR 18 0.286 -1.622 -9.777
109 HG22 THR 18 1HG2 THR 18 0.802 -3.223 -10.360
110 HG23 THR 18 2HG2 THR 18 0.899 -2.834 -8.626
111 H ALA 19 H ALA 19 1.877 -2.610 -6.683
112 HA ALA 19 HA ALA 19 -0.422 -1.083 -6.278
113 HB1 ALA 19 3HB ALA 19 -0.529 -3.281 -5.504
114 HB2 ALA 19 1HB ALA 19 1.083 -3.205 -4.752
115 HB3 ALA 19 2HB ALA 19 -0.295 -2.377 -3.988
116 H TRP 20 H TRP 20 2.604 -1.303 -4.265
117 HA TRP 20 HA TRP 20 1.938 0.708 -2.499
118 HB2 TRP 20 1HB TRP 20 3.734 -0.756 -2.015
119 HB3 TRP 20 2HB TRP 20 4.589 -0.333 -3.485
120 HD1 TRP 20 HD TRP 20 5.180 2.590 -3.469
121 HE1 TRP 20 1HE TRP 20 6.369 3.976 -1.564
122 HE3 TRP 20 3HE TRP 20 4.180 -0.702 0.275
123 HZ2 TRP 20 2HZ TRP 20 6.750 3.549 1.232
124 HZ3 TRP 20 3HZ TRP 20 4.996 -0.142 2.563
125 HH2 TRP 20 HH TRP 20 6.240 1.900 3.070
126 H THR 21 H THR 21 3.857 0.855 -5.586
127 HA THR 21 HA THR 21 4.284 3.601 -5.567
128 HB THR 21 HB THR 21 4.379 1.315 -7.490
129 HG1 THR 21 1HG THR 21 6.478 2.020 -7.258
130 HG21 THR 21 3HG2 THR 21 5.035 3.145 -9.278
131 HG22 THR 21 1HG2 THR 21 3.316 2.725 -9.091
132 HG23 THR 21 2HG2 THR 21 3.957 4.206 -8.341
133 H THR 22 H THR 22 1.453 1.689 -6.637
134 HA THR 22 HA THR 22 0.175 3.976 -7.799
135 HB THR 22 HB THR 22 -0.670 1.122 -7.097
136 HG1 THR 22 1HG THR 22 0.506 1.064 -8.991
137 HG21 THR 22 3HG2 THR 22 -2.179 3.301 -8.635
138 HG22 THR 22 1HG2 THR 22 -2.624 1.578 -8.615
139 HG23 THR 22 2HG2 THR 22 -2.714 2.538 -7.118
140 H CYS 23 H CYS 23 0.627 2.774 -4.579
141 HA CYS 23 HA CYS 23 -1.778 4.072 -3.634
142 HB2 CYS 23 1HB CYS 23 0.071 2.059 -2.627
143 HB3 CYS 23 2HB CYS 23 -0.264 3.293 -1.429
144 H THR 24 H THR 24 1.784 4.439 -3.781
145 HA THR 24 HA THR 24 1.720 6.811 -2.117
146 HB THR 24 HB THR 24 4.251 6.695 -2.873
147 HG1 THR 24 1HG THR 24 3.407 5.133 -4.634
148 HG21 THR 24 3HG2 THR 24 3.196 4.201 -1.463
149 HG22 THR 24 1HG2 THR 24 4.758 5.018 -1.218
150 HG23 THR 24 2HG2 THR 24 3.256 5.781 -0.645
151 H THR 25 H THR 25 -0.044 7.463 -3.940
152 HA THR 25 HA THR 25 1.442 9.341 -5.624
153 HB THR 25 HB THR 25 -0.333 8.731 -7.442
154 HG1 THR 25 1HG THR 25 -1.112 6.496 -7.035
155 HG21 THR 25 3HG2 THR 25 0.975 6.238 -7.508
156 HG22 THR 25 1HG2 THR 25 1.546 7.728 -8.295
157 HG23 THR 25 2HG2 THR 25 2.132 7.299 -6.670
158 HA PRO 26 HA PRO 26 -1.539 12.120 -4.289
159 HB2 PRO 26 1HB PRO 26 -1.626 13.935 -6.330
160 HB3 PRO 26 2HB PRO 26 -0.360 13.916 -5.118
161 HG2 PRO 26 1HG PRO 26 -0.244 13.023 -7.934
162 HG3 PRO 26 2HG PRO 26 1.077 13.408 -6.849
163 HD2 PRO 26 1HD PRO 26 0.192 10.789 -7.612
164 HD3 PRO 26 2HD PRO 26 1.436 11.175 -6.440
165 H GLY 27 H GLY 27 -3.640 11.857 -3.918
166 HA2 GLY 27 1HA GLY 27 -5.458 12.003 -6.124
167 HA3 GLY 27 2HA GLY 27 -5.271 10.363 -5.535
168 H GLN 28 H GLN 28 -7.326 10.127 -4.588
169 HA GLN 28 HA GLN 28 -7.882 12.020 -2.442
170 HB2 GLN 28 1HB GLN 28 -9.582 10.680 -4.469
171 HB3 GLN 28 2HB GLN 28 -10.243 10.620 -2.847
172 HG2 GLN 28 1HG GLN 28 -10.977 12.744 -3.153
173 HG3 GLN 28 2HG GLN 28 -9.305 13.266 -3.084
174 HE21 GLN 28 1HE2 GLN 28 -11.969 12.340 -5.150
175 HE22 GLN 28 2HE2 GLN 28 -11.381 13.019 -6.631
176 H THR 29 H THR 29 -7.823 8.547 -3.408
177 HA THR 29 HA THR 29 -7.953 7.851 -0.549
178 HB THR 29 HB THR 29 -8.728 5.617 -1.451
179 HG1 THR 29 1HG THR 29 -8.300 5.416 -3.611
180 HG21 THR 29 3HG2 THR 29 -10.941 6.288 -2.078
181 HG22 THR 29 1HG2 THR 29 -10.378 7.614 -1.032
182 HG23 THR 29 2HG2 THR 29 -10.362 7.807 -2.801
183 H CYS 30 H CYS 30 -5.547 8.914 -1.542
184 HA CYS 30 HA CYS 30 -3.840 6.887 -2.468
185 HB2 CYS 30 1HB CYS 30 -3.093 9.024 -2.916
186 HB3 CYS 30 2HB CYS 30 -3.475 9.623 -1.314
187 H TYR 31 H TYR 31 -4.102 8.527 0.782
188 HA TYR 31 HA TYR 31 -2.550 6.507 2.050
189 HB2 TYR 31 1HB TYR 31 -2.663 8.866 2.826
190 HB3 TYR 31 2HB TYR 31 -4.413 8.804 2.899
191 HD1 TYR 31 2HD TYR 31 -5.503 7.279 4.650
192 HD2 TYR 31 1HD TYR 31 -1.348 8.298 4.709
193 HE1 TYR 31 2HE TYR 31 -5.371 6.627 7.104
194 HE2 TYR 31 1HE TYR 31 -1.230 7.642 7.163
195 HH TYR 31 HH TYR 31 -2.578 7.351 9.012
196 H THR 32 H THR 32 -5.840 6.695 1.028
197 HA THR 32 HA THR 32 -6.940 5.144 3.176
198 HB THR 32 HB THR 32 -7.890 6.081 0.427
199 HG1 THR 32 1HG THR 32 -7.636 7.538 2.348
200 HG21 THR 32 3HG2 THR 32 -8.963 3.836 1.437
201 HG22 THR 32 1HG2 THR 32 -9.744 4.983 2.552
202 HG23 THR 32 2HG2 THR 32 -10.009 5.127 0.798
203 H CYS 33 H CYS 33 -5.658 4.498 -0.117
204 HA CYS 33 HA CYS 33 -6.427 1.769 -0.019
205 HB2 CYS 33 1HB CYS 33 -5.318 1.531 -2.087
206 HB3 CYS 33 2HB CYS 33 -6.118 3.090 -2.108
207 H CYS 34 H CYS 34 -3.914 3.722 1.367
208 HA CYS 34 HA CYS 34 -1.827 1.858 1.378
209 HB2 CYS 34 1HB CYS 34 -2.470 4.263 3.074
210 HB3 CYS 34 2HB CYS 34 -1.071 3.259 3.402
211 H SER 35 H SER 35 -4.920 1.862 2.839
212 HA SER 35 HA SER 35 -3.956 0.085 4.941
213 HB2 SER 35 1HB SER 35 -5.073 2.057 5.865
214 HB3 SER 35 2HB SER 35 -6.458 1.823 4.818
215 HG SER 35 HG SER 35 -5.861 0.627 7.253
216 H SER 36 H SER 36 -5.172 0.056 1.877
217 HA SER 36 HA SER 36 -6.956 -2.178 2.442
218 HB2 SER 36 1HB SER 36 -7.257 0.106 0.757
219 HB3 SER 36 2HB SER 36 -7.067 -1.266 -0.316
220 HG SER 36 HG SER 36 -9.011 -1.991 0.232
221 H CYS 37 H CYS 37 -4.229 -0.964 0.421
222 HA CYS 37 HA CYS 37 -3.863 -3.625 -0.672
223 HB2 CYS 37 1HB CYS 37 -3.211 -0.922 -1.503
224 HB3 CYS 37 2HB CYS 37 -1.803 -1.961 -1.579
225 H PHE 38 H PHE 38 -3.493 -2.911 2.249
226 HA PHE 38 HA PHE 38 -0.911 -4.125 2.531
227 HB2 PHE 38 1HB PHE 38 -1.611 -1.285 3.474
228 HB3 PHE 38 2HB PHE 38 -0.267 -2.179 4.155
229 HD1 PHE 38 1HD PHE 38 0.976 -3.430 1.847
230 HD2 PHE 38 2HD PHE 38 -0.732 0.438 2.211
231 HE1 PHE 38 1HE PHE 38 2.463 -2.599 0.003
232 HE2 PHE 38 2HE PHE 38 0.754 1.268 0.367
233 HZ PHE 38 HZ PHE 38 2.334 -0.260 -0.715
234 H ASP 39 H ASP 39 -0.414 -4.356 5.024
235 HA ASP 39 HA ASP 39 -2.984 -4.931 6.270
236 HB2 ASP 39 1HB ASP 39 -1.678 -6.954 5.903
237 HB3 ASP 39 2HB ASP 39 -0.234 -6.211 6.561
238 H VAL 40 H VAL 40 -0.022 -5.270 8.126
239 HA VAL 40 HA VAL 40 -0.781 -2.953 9.719
240 HB VAL 40 HB VAL 40 -0.474 -5.214 10.720
241 HG11 VAL 40 1HG1 VAL 40 2.481 -4.767 10.187
242 HG12 VAL 40 2HG1 VAL 40 1.727 -6.158 11.002
243 HG13 VAL 40 3HG1 VAL 40 1.449 -5.886 9.265
244 HG21 VAL 40 3HG2 VAL 40 0.031 -4.208 12.660
245 HG22 VAL 40 1HG2 VAL 40 1.652 -3.740 12.093
246 HG23 VAL 40 2HG2 VAL 40 0.245 -2.722 11.703
247 H VAL 41 H VAL 41 2.164 -4.433 8.188
248 HA VAL 41 HA VAL 41 3.708 -2.091 8.621
249 HB VAL 41 HB VAL 41 4.119 -4.478 6.810
250 HG11 VAL 41 1HG1 VAL 41 6.498 -3.848 6.835
251 HG12 VAL 41 2HG1 VAL 41 5.491 -2.571 6.112
252 HG13 VAL 41 3HG1 VAL 41 6.102 -2.388 7.774
253 HG21 VAL 41 3HG2 VAL 41 4.105 -5.441 8.901
254 HG22 VAL 41 1HG2 VAL 41 5.815 -4.961 8.783
255 HG23 VAL 41 2HG2 VAL 41 4.672 -3.960 9.711
256 H GLY 42 H GLY 42 2.560 -3.652 5.540
257 HA2 GLY 42 1HA GLY 42 3.130 -1.816 3.707
258 HA3 GLY 42 2HA GLY 42 1.599 -2.668 3.725
259 H GLU 43 H GLU 43 0.715 -1.431 6.322
260 HA GLU 43 HA GLU 43 -0.363 0.922 5.139
261 HB2 GLU 43 1HB GLU 43 -1.438 -0.854 6.816
262 HB3 GLU 43 2HB GLU 43 -0.765 0.202 8.043
263 HG2 GLU 43 1HG GLU 43 -2.161 1.688 5.897
264 HG3 GLU 43 2HG GLU 43 -3.212 0.564 6.735
265 H GLN 44 H GLN 44 1.490 0.229 8.199
266 HA GLN 44 HA GLN 44 1.947 2.917 8.732
267 HB2 GLN 44 1HB GLN 44 3.313 2.153 10.518
268 HB3 GLN 44 2HB GLN 44 2.114 0.891 10.315
269 HG2 GLN 44 1HG GLN 44 3.808 -0.594 10.062
270 HG3 GLN 44 2HG GLN 44 4.190 0.173 8.534
271 HE21 GLN 44 1HE2 GLN 44 6.317 0.264 8.473
272 HE22 GLN 44 2HE2 GLN 44 7.358 0.974 9.662
273 H ALA 45 H ALA 45 3.337 0.745 6.412
274 HA ALA 45 HA ALA 45 5.851 2.166 6.261
275 HB1 ALA 45 3HB ALA 45 6.348 0.530 4.499
276 HB2 ALA 45 1HB ALA 45 5.704 -0.293 5.941
277 HB3 ALA 45 2HB ALA 45 4.659 -0.034 4.523
278 H CYS 46 H CYS 46 2.752 1.829 4.452
279 HA CYS 46 HA CYS 46 3.620 3.512 2.342
280 HB2 CYS 46 1HB CYS 46 1.900 1.790 2.047
281 HB3 CYS 46 2HB CYS 46 0.837 2.641 3.150
282 H GLN 47 H GLN 47 2.115 3.878 5.539
283 HA GLN 47 HA GLN 47 0.926 6.321 5.230
284 HB2 GLN 47 1HB GLN 47 2.084 4.780 7.529
285 HB3 GLN 47 2HB GLN 47 1.740 6.475 7.810
286 HG2 GLN 47 1HG GLN 47 -0.585 5.835 6.605
287 HG3 GLN 47 2HG GLN 47 -0.166 4.229 7.170
288 HE21 GLN 47 1HE2 GLN 47 0.233 7.526 8.468
289 HE22 GLN 47 2HE2 GLN 47 -0.521 7.249 10.003
290 H MET 48 H MET 48 4.319 5.554 6.276
291 HA MET 48 HA MET 48 5.060 8.229 6.513
292 HB2 MET 48 1HB MET 48 7.408 7.228 6.452
293 HB3 MET 48 2HB MET 48 6.341 6.435 7.594
294 HG2 MET 48 1HG MET 48 5.981 4.557 6.113
295 HG3 MET 48 2HG MET 48 6.671 5.406 4.744
296 HE1 MET 48 3HE MET 48 8.895 6.692 5.164
297 HE2 MET 48 1HE MET 48 10.350 5.862 5.767
298 HE3 MET 48 2HE MET 48 9.550 5.291 4.282
299 H SER 49 H SER 49 4.935 5.963 3.770
300 HA SER 49 HA SER 49 6.443 7.795 2.139
301 HB2 SER 49 1HB SER 49 5.537 4.963 1.945
302 HB3 SER 49 2HB SER 49 5.560 5.832 0.423
303 HG SER 49 HG SER 49 7.856 6.479 1.640
304 H ALA 50 H ALA 50 3.403 7.832 3.327
305 HA ALA 50 HA ALA 50 1.750 7.989 1.072
306 HB1 ALA 50 3HB ALA 50 1.285 9.575 3.597
307 HB2 ALA 50 1HB ALA 50 0.117 8.684 2.593
308 HB3 ALA 50 2HB ALA 50 1.247 7.796 3.643
309 H GLN 51 H GLN 51 3.027 9.189 -0.503
310 HA GLN 51 HA GLN 51 3.478 11.958 0.173
311 HB2 GLN 51 1HB GLN 51 5.038 10.239 -1.196
312 HB3 GLN 51 2HB GLN 51 4.105 10.847 -2.550
313 HG2 GLN 51 1HG GLN 51 5.575 12.622 -0.543
314 HG3 GLN 51 2HG GLN 51 6.223 12.155 -2.103
315 HE21 GLN 51 1HE2 GLN 51 5.320 12.934 -4.001
316 HE22 GLN 51 2HE2 GLN 51 4.283 14.320 -4.056
317 H CYS 52 H CYS 52 0.982 12.132 0.336
318 HA CYS 52 HA CYS 52 0.029 12.935 -2.303
319 HB2 CYS 52 1HB CYS 52 -2.282 12.103 -1.134
320 HB3 CYS 52 2HB CYS 52 -1.367 11.207 -2.330
Start of MODEL 3
1 H1 ASN 1 1H ASN 1 11.617 -5.355 1.364
2 HA ASN 1 HA ASN 1 9.984 -4.112 -0.444
3 HB2 ASN 1 1HB ASN 1 11.250 -6.691 -0.113
4 HB3 ASN 1 2HB ASN 1 9.592 -6.984 -0.600
5 HD21 ASN 1 1HD2 ASN 1 9.511 -7.347 -2.676
6 HD22 ASN 1 2HD2 ASN 1 10.308 -6.459 -3.931
7 HA PRO 2 HA PRO 2 5.991 -4.859 1.210
8 HB2 PRO 2 1HB PRO 2 4.431 -4.761 -1.031
9 HB3 PRO 2 2HB PRO 2 5.019 -3.329 -0.209
10 HG2 PRO 2 1HG PRO 2 5.952 -4.523 -2.747
11 HG3 PRO 2 2HG PRO 2 6.217 -2.904 -2.133
12 HD2 PRO 2 1HD PRO 2 8.106 -5.063 -2.151
13 HD3 PRO 2 2HD PRO 2 8.330 -3.479 -1.434
14 H GLU 3 H GLU 3 7.647 -7.114 -0.426
15 HA GLU 3 HA GLU 3 5.719 -8.957 -1.080
16 HB2 GLU 3 1HB GLU 3 7.522 -10.586 -1.090
17 HB3 GLU 3 2HB GLU 3 8.151 -9.066 -1.694
18 HG2 GLU 3 1HG GLU 3 9.006 -8.554 0.642
19 HG3 GLU 3 2HG GLU 3 8.485 -10.150 1.142
20 H ASP 4 H ASP 4 7.046 -7.986 2.056
21 HA ASP 4 HA ASP 4 6.009 -10.310 3.356
22 HB2 ASP 4 1HB ASP 4 8.077 -8.713 3.962
23 HB3 ASP 4 2HB ASP 4 6.849 -7.799 4.816
24 H TRP 5 H TRP 5 4.918 -7.190 2.294
25 HA TRP 5 HA TRP 5 2.596 -7.374 4.090
26 HB2 TRP 5 1HB TRP 5 3.159 -4.716 3.018
27 HB3 TRP 5 2HB TRP 5 2.709 -5.217 4.636
28 HD1 TRP 5 HD TRP 5 5.101 -6.696 5.795
29 HE1 TRP 5 1HE TRP 5 7.540 -5.728 6.072
30 HE3 TRP 5 3HE TRP 5 4.632 -3.081 2.251
31 HZ2 TRP 5 2HZ TRP 5 8.967 -3.605 4.805
32 HZ3 TRP 5 3HZ TRP 5 6.595 -1.603 1.833
33 HH2 TRP 5 HH TRP 5 8.708 -1.821 3.042
34 H PHE 6 H PHE 6 1.314 -5.150 2.551
35 HA PHE 6 HA PHE 6 -0.070 -4.922 0.851
36 HB2 PHE 6 1HB PHE 6 1.927 -4.599 -0.504
37 HB3 PHE 6 2HB PHE 6 2.362 -6.293 -0.401
38 HD1 PHE 6 2HD PHE 6 -0.388 -4.135 -1.715
39 HD2 PHE 6 1HD PHE 6 1.947 -7.640 -2.229
40 HE1 PHE 6 2HE PHE 6 -1.504 -4.554 -3.924
41 HE2 PHE 6 1HE PHE 6 0.832 -8.060 -4.438
42 HZ PHE 6 HZ PHE 6 -0.881 -6.512 -5.260
43 H THR 7 H THR 7 -1.989 -5.983 0.789
44 HA THR 7 HA THR 7 -1.888 -8.900 0.391
45 HB THR 7 HB THR 7 -3.986 -8.929 1.694
46 HG1 THR 7 1HG THR 7 -3.533 -6.055 1.952
47 HG21 THR 7 3HG2 THR 7 -1.779 -8.680 3.005
48 HG22 THR 7 1HG2 THR 7 -2.122 -6.935 3.073
49 HG23 THR 7 2HG2 THR 7 -3.232 -8.091 3.848
50 HA PRO 8 HA PRO 8 -3.678 -7.644 -3.428
51 HB2 PRO 8 1HB PRO 8 -2.869 -9.823 -4.864
52 HB3 PRO 8 2HB PRO 8 -1.907 -8.366 -4.710
53 HG2 PRO 8 1HG PRO 8 -1.530 -10.985 -3.390
54 HG3 PRO 8 2HG PRO 8 -0.378 -9.679 -3.587
55 HD2 PRO 8 1HD PRO 8 -1.812 -10.355 -1.197
56 HD3 PRO 8 2HD PRO 8 -0.750 -8.981 -1.428
57 H ASP 9 H ASP 9 -4.277 -10.162 -1.315
58 HA ASP 9 HA ASP 9 -6.265 -11.409 -2.881
59 HB2 ASP 9 1HB ASP 9 -4.952 -11.841 -0.380
60 HB3 ASP 9 2HB ASP 9 -6.660 -11.721 -0.006
61 H THR 10 H THR 10 -6.042 -8.389 -1.353
62 HA THR 10 HA THR 10 -8.939 -8.087 -1.371
63 HB THR 10 HB THR 10 -8.240 -8.763 0.977
64 HG1 THR 10 1HG THR 10 -8.971 -5.953 0.536
65 HG21 THR 10 3HG2 THR 10 -7.109 -6.002 1.350
66 HG22 THR 10 1HG2 THR 10 -6.747 -7.499 2.242
67 HG23 THR 10 2HG2 THR 10 -6.016 -7.216 0.644
68 H CYS 11 H CYS 11 -7.027 -7.278 -3.295
69 HA CYS 11 HA CYS 11 -7.507 -4.446 -3.133
70 HB2 CYS 11 1HB CYS 11 -5.101 -5.245 -2.174
71 HB3 CYS 11 2HB CYS 11 -4.709 -5.067 -3.873
72 H ALA 12 H ALA 12 -6.921 -3.432 -5.347
73 HA ALA 12 HA ALA 12 -7.536 -5.413 -7.403
74 HB1 ALA 12 3HB ALA 12 -8.307 -2.678 -6.822
75 HB2 ALA 12 1HB ALA 12 -7.601 -2.785 -8.452
76 HB3 ALA 12 2HB ALA 12 -8.989 -3.811 -8.014
77 H TYR 13 H TYR 13 -5.002 -5.837 -6.608
78 HA TYR 13 HA TYR 13 -3.489 -4.795 -8.865
79 HB2 TYR 13 1HB TYR 13 -2.547 -4.819 -5.932
80 HB3 TYR 13 2HB TYR 13 -1.641 -4.178 -7.288
81 HD1 TYR 13 1HD TYR 13 -4.772 -3.659 -5.319
82 HD2 TYR 13 2HD TYR 13 -1.844 -1.912 -7.904
83 HE1 TYR 13 1HE TYR 13 -5.771 -1.357 -4.907
84 HE2 TYR 13 2HE TYR 13 -2.853 0.383 -7.483
85 HH TYR 13 HH TYR 13 -5.320 0.851 -5.057
86 H GLY 14 H GLY 14 -1.888 -6.223 -9.611
87 HA2 GLY 14 1HA GLY 14 -2.028 -8.905 -8.416
88 HA3 GLY 14 2HA GLY 14 -1.531 -8.503 -10.048
89 H ASP 15 H ASP 15 0.052 -6.094 -8.797
90 HA ASP 15 HA ASP 15 2.300 -7.749 -7.956
91 HB2 ASP 15 1HB ASP 15 2.434 -4.983 -9.232
92 HB3 ASP 15 2HB ASP 15 3.776 -6.073 -8.949
93 H SER 16 H SER 16 3.618 -6.876 -6.180
94 HA SER 16 HA SER 16 2.088 -5.241 -4.423
95 HB2 SER 16 1HB SER 16 3.916 -5.682 -2.813
96 HB3 SER 16 2HB SER 16 3.360 -7.166 -3.561
97 HG SER 16 HG SER 16 5.435 -5.945 -4.985
98 H ASN 17 H ASN 17 4.903 -4.934 -6.588
99 HA ASN 17 HA ASN 17 5.940 -2.607 -5.506
100 HB2 ASN 17 1HB ASN 17 6.915 -4.216 -7.329
101 HB3 ASN 17 2HB ASN 17 5.962 -3.301 -8.480
102 HD21 ASN 17 1HD2 ASN 17 8.938 -3.648 -7.607
103 HD22 ASN 17 2HD2 ASN 17 9.574 -2.037 -7.646
104 H THR 18 H THR 18 3.601 -3.252 -8.216
105 HA THR 18 HA THR 18 3.174 -0.522 -8.830
106 HB THR 18 HB THR 18 2.786 -2.701 -10.235
107 HG1 THR 18 1HG THR 18 2.121 -0.606 -10.972
108 HG21 THR 18 3HG2 THR 18 1.097 -3.547 -8.353
109 HG22 THR 18 1HG2 THR 18 -0.034 -2.427 -9.150
110 HG23 THR 18 2HG2 THR 18 0.683 -3.771 -10.070
111 H ALA 19 H ALA 19 1.705 -2.800 -6.512
112 HA ALA 19 HA ALA 19 -0.588 -1.312 -5.969
113 HB1 ALA 19 3HB ALA 19 -0.713 -2.683 -3.966
114 HB2 ALA 19 1HB ALA 19 -0.118 -3.688 -5.309
115 HB3 ALA 19 2HB ALA 19 1.018 -3.080 -4.081
116 H TRP 20 H TRP 20 2.541 -1.465 -4.112
117 HA TRP 20 HA TRP 20 1.940 0.594 -2.372
118 HB2 TRP 20 1HB TRP 20 3.753 -0.896 -1.950
119 HB3 TRP 20 2HB TRP 20 4.570 -0.439 -3.431
120 HD1 TRP 20 HD TRP 20 5.085 2.509 -3.376
121 HE1 TRP 20 1HE TRP 20 6.302 3.881 -1.479
122 HE3 TRP 20 3HE TRP 20 4.287 -0.890 0.321
123 HZ2 TRP 20 2HZ TRP 20 6.783 3.402 1.293
124 HZ3 TRP 20 3HZ TRP 20 5.163 -0.361 2.594
125 HH2 TRP 20 HH TRP 20 6.374 1.700 3.108
126 H THR 21 H THR 21 3.551 0.607 -5.619
127 HA THR 21 HA THR 21 4.153 3.313 -5.720
128 HB THR 21 HB THR 21 3.749 1.030 -7.633
129 HG1 THR 21 1HG THR 21 5.942 1.772 -8.046
130 HG21 THR 21 3HG2 THR 21 3.389 3.920 -8.353
131 HG22 THR 21 1HG2 THR 21 4.564 3.016 -9.338
132 HG23 THR 21 2HG2 THR 21 2.875 2.464 -9.237
133 H THR 22 H THR 22 1.240 1.677 -7.147
134 HA THR 22 HA THR 22 -0.031 4.068 -7.825
135 HB THR 22 HB THR 22 -1.057 1.250 -7.205
136 HG1 THR 22 1HG THR 22 0.543 1.880 -9.013
137 HG21 THR 22 3HG2 THR 22 -2.989 2.783 -7.165
138 HG22 THR 22 1HG2 THR 22 -2.388 3.622 -8.615
139 HG23 THR 22 2HG2 THR 22 -2.962 1.941 -8.733
140 H CYS 23 H CYS 23 0.531 2.623 -4.720
141 HA CYS 23 HA CYS 23 -1.755 3.827 -3.498
142 HB2 CYS 23 1HB CYS 23 0.215 1.889 -2.790
143 HB3 CYS 23 2HB CYS 23 0.253 3.159 -1.583
144 H THR 24 H THR 24 1.776 4.455 -3.887
145 HA THR 24 HA THR 24 1.598 6.885 -2.318
146 HB THR 24 HB THR 24 4.104 6.913 -3.183
147 HG1 THR 24 1HG THR 24 3.891 5.328 -4.827
148 HG21 THR 24 3HG2 THR 24 3.802 6.235 -0.893
149 HG22 THR 24 1HG2 THR 24 2.894 4.780 -1.367
150 HG23 THR 24 2HG2 THR 24 4.647 4.869 -1.658
151 H THR 25 H THR 25 -0.232 7.562 -3.907
152 HA THR 25 HA THR 25 1.046 9.377 -5.790
153 HB THR 25 HB THR 25 -0.770 8.616 -7.502
154 HG1 THR 25 1HG THR 25 -2.039 7.114 -6.464
155 HG21 THR 25 3HG2 THR 25 0.550 6.687 -8.300
156 HG22 THR 25 1HG2 THR 25 1.664 7.958 -7.744
157 HG23 THR 25 2HG2 THR 25 1.343 6.543 -6.713
158 HA PRO 26 HA PRO 26 -2.006 12.027 -4.359
159 HB2 PRO 26 1HB PRO 26 -2.237 13.816 -6.413
160 HB3 PRO 26 2HB PRO 26 -0.936 13.866 -5.240
161 HG2 PRO 26 1HG PRO 26 -0.864 12.951 -8.050
162 HG3 PRO 26 2HG PRO 26 0.470 13.407 -7.010
163 HD2 PRO 26 1HD PRO 26 -0.318 10.742 -7.723
164 HD3 PRO 26 2HD PRO 26 0.942 11.196 -6.592
165 H GLY 27 H GLY 27 -4.143 11.990 -3.992
166 HA2 GLY 27 1HA GLY 27 -5.993 11.920 -6.127
167 HA3 GLY 27 2HA GLY 27 -5.750 10.297 -5.511
168 H GLN 28 H GLN 28 -7.776 10.029 -4.511
169 HA GLN 28 HA GLN 28 -8.346 11.961 -2.404
170 HB2 GLN 28 1HB GLN 28 -9.990 10.849 -4.456
171 HB3 GLN 28 2HB GLN 28 -10.557 10.159 -2.949
172 HG2 GLN 28 1HG GLN 28 -10.724 12.450 -1.959
173 HG3 GLN 28 2HG GLN 28 -10.147 13.144 -3.461
174 HE21 GLN 28 1HE2 GLN 28 -11.453 13.284 -5.228
175 HE22 GLN 28 2HE2 GLN 28 -13.154 12.959 -5.214
176 H THR 29 H THR 29 -7.560 8.624 -3.183
177 HA THR 29 HA THR 29 -7.820 7.963 -0.325
178 HB THR 29 HB THR 29 -8.418 5.647 -1.106
179 HG1 THR 29 1HG THR 29 -7.968 5.337 -3.248
180 HG21 THR 29 3HG2 THR 29 -10.530 6.528 -2.608
181 HG22 THR 29 1HG2 THR 29 -10.505 6.633 -0.831
182 HG23 THR 29 2HG2 THR 29 -10.068 8.052 -1.813
183 H CYS 30 H CYS 30 -5.535 9.207 -1.411
184 HA CYS 30 HA CYS 30 -3.630 7.481 -2.384
185 HB2 CYS 30 1HB CYS 30 -3.076 9.721 -2.484
186 HB3 CYS 30 2HB CYS 30 -3.537 10.032 -0.822
187 H TYR 31 H TYR 31 -3.784 8.702 1.045
188 HA TYR 31 HA TYR 31 -2.202 6.601 2.036
189 HB2 TYR 31 1HB TYR 31 -2.359 8.665 3.282
190 HB3 TYR 31 2HB TYR 31 -4.093 8.770 3.052
191 HD1 TYR 31 2HD TYR 31 -1.406 7.185 5.026
192 HD2 TYR 31 1HD TYR 31 -5.632 7.665 4.564
193 HE1 TYR 31 2HE TYR 31 -1.779 6.191 7.336
194 HE2 TYR 31 1HE TYR 31 -5.991 6.670 6.876
195 HH TYR 31 HH TYR 31 -3.213 5.709 8.875
196 H THR 32 H THR 32 -5.672 6.938 1.406
197 HA THR 32 HA THR 32 -6.550 4.927 3.181
198 HB THR 32 HB THR 32 -7.654 6.229 0.647
199 HG1 THR 32 1HG THR 32 -7.455 7.443 2.687
200 HG21 THR 32 3HG2 THR 32 -8.740 3.984 2.345
201 HG22 THR 32 1HG2 THR 32 -9.863 5.290 1.896
202 HG23 THR 32 2HG2 THR 32 -9.044 4.346 0.629
203 H CYS 33 H CYS 33 -5.486 4.864 -0.262
204 HA CYS 33 HA CYS 33 -6.168 2.262 -0.795
205 HB2 CYS 33 1HB CYS 33 -5.499 3.338 -2.673
206 HB3 CYS 33 2HB CYS 33 -4.208 4.208 -1.867
207 H CYS 34 H CYS 34 -3.335 3.686 0.909
208 HA CYS 34 HA CYS 34 -1.817 1.362 1.054
209 HB2 CYS 34 1HB CYS 34 -1.911 3.706 2.964
210 HB3 CYS 34 2HB CYS 34 -0.661 2.479 2.925
211 H SER 35 H SER 35 -4.719 2.483 2.716
212 HA SER 35 HA SER 35 -4.374 0.496 4.785
213 HB2 SER 35 1HB SER 35 -6.169 1.577 5.932
214 HB3 SER 35 2HB SER 35 -5.201 2.870 5.252
215 HG SER 35 HG SER 35 -6.824 2.595 3.331
216 H SER 36 H SER 36 -5.340 0.494 1.628
217 HA SER 36 HA SER 36 -7.364 -1.532 2.178
218 HB2 SER 36 1HB SER 36 -7.573 0.894 0.575
219 HB3 SER 36 2HB SER 36 -7.817 -0.513 -0.440
220 HG SER 36 HG SER 36 -9.597 -1.126 0.733
221 H CYS 37 H CYS 37 -4.312 -1.478 1.665
222 HA CYS 37 HA CYS 37 -4.399 -3.497 -0.427
223 HB2 CYS 37 1HB CYS 37 -3.294 -0.901 -0.804
224 HB3 CYS 37 2HB CYS 37 -1.959 -2.032 -0.711
225 H PHE 38 H PHE 38 -2.473 -1.702 2.073
226 HA PHE 38 HA PHE 38 -0.856 -4.048 2.544
227 HB2 PHE 38 1HB PHE 38 -1.076 -1.266 3.845
228 HB3 PHE 38 2HB PHE 38 0.189 -2.419 4.222
229 HD1 PHE 38 1HD PHE 38 1.527 -3.286 2.083
230 HD2 PHE 38 2HD PHE 38 -0.611 0.373 2.293
231 HE1 PHE 38 1HE PHE 38 2.926 -2.361 0.215
232 HE2 PHE 38 2HE PHE 38 0.788 1.298 0.425
233 HZ PHE 38 HZ PHE 38 2.540 -0.080 -0.591
234 H ASP 39 H ASP 39 -0.402 -4.362 5.110
235 HA ASP 39 HA ASP 39 -3.056 -4.832 6.203
236 HB2 ASP 39 1HB ASP 39 -1.586 -6.383 7.777
237 HB3 ASP 39 2HB ASP 39 -2.032 -6.925 6.172
238 H VAL 40 H VAL 40 -0.227 -5.208 8.255
239 HA VAL 40 HA VAL 40 -1.053 -2.863 9.779
240 HB VAL 40 HB VAL 40 -0.911 -5.113 10.827
241 HG11 VAL 40 1HG1 VAL 40 1.218 -6.149 11.278
242 HG12 VAL 40 2HG1 VAL 40 1.082 -5.886 9.523
243 HG13 VAL 40 3HG1 VAL 40 2.091 -4.802 10.510
244 HG21 VAL 40 3HG2 VAL 40 0.989 -3.013 11.925
245 HG22 VAL 40 1HG2 VAL 40 -0.769 -3.090 12.189
246 HG23 VAL 40 2HG2 VAL 40 0.286 -4.362 12.850
247 H VAL 41 H VAL 41 1.957 -4.456 8.511
248 HA VAL 41 HA VAL 41 3.535 -2.157 9.048
249 HB VAL 41 HB VAL 41 3.978 -4.634 7.374
250 HG11 VAL 41 1HG1 VAL 41 6.287 -4.064 7.199
251 HG12 VAL 41 2HG1 VAL 41 5.366 -2.634 6.674
252 HG13 VAL 41 3HG1 VAL 41 6.099 -2.674 8.295
253 HG21 VAL 41 3HG2 VAL 41 5.612 -5.018 9.402
254 HG22 VAL 41 1HG2 VAL 41 4.515 -3.890 10.233
255 HG23 VAL 41 2HG2 VAL 41 3.881 -5.406 9.549
256 H GLY 42 H GLY 42 2.884 -3.731 5.842
257 HA2 GLY 42 1HA GLY 42 3.580 -1.855 4.118
258 HA3 GLY 42 2HA GLY 42 2.100 -2.774 3.920
259 H GLU 43 H GLU 43 0.753 -1.630 6.320
260 HA GLU 43 HA GLU 43 -0.300 0.642 5.026
261 HB2 GLU 43 1HB GLU 43 -1.506 -1.070 6.557
262 HB3 GLU 43 2HB GLU 43 -0.830 -0.179 7.905
263 HG2 GLU 43 1HG GLU 43 -1.869 1.939 6.918
264 HG3 GLU 43 2HG GLU 43 -2.674 0.925 5.737
265 H GLN 44 H GLN 44 1.424 0.162 8.197
266 HA GLN 44 HA GLN 44 1.679 2.938 8.583
267 HB2 GLN 44 1HB GLN 44 2.717 2.382 10.615
268 HB3 GLN 44 2HB GLN 44 1.685 0.996 10.329
269 HG2 GLN 44 1HG GLN 44 3.652 -0.193 9.263
270 HG3 GLN 44 2HG GLN 44 4.665 1.173 9.683
271 HE21 GLN 44 1HE2 GLN 44 5.970 0.399 11.188
272 HE22 GLN 44 2HE2 GLN 44 5.496 -0.330 12.686
273 H ALA 45 H ALA 45 3.301 0.679 6.571
274 HA ALA 45 HA ALA 45 5.855 2.028 6.673
275 HB1 ALA 45 3HB ALA 45 5.588 0.221 4.455
276 HB2 ALA 45 1HB ALA 45 6.541 0.019 5.945
277 HB3 ALA 45 2HB ALA 45 4.849 -0.532 5.889
278 H CYS 46 H CYS 46 2.984 1.709 4.515
279 HA CYS 46 HA CYS 46 4.130 3.300 2.475
280 HB2 CYS 46 1HB CYS 46 2.449 1.713 1.893
281 HB3 CYS 46 2HB CYS 46 1.309 2.388 3.040
282 H GLN 47 H GLN 47 2.594 3.866 5.567
283 HA GLN 47 HA GLN 47 1.342 6.253 5.143
284 HB2 GLN 47 1HB GLN 47 2.053 4.642 7.352
285 HB3 GLN 47 2HB GLN 47 2.760 6.206 7.706
286 HG2 GLN 47 1HG GLN 47 0.126 6.674 6.636
287 HG3 GLN 47 2HG GLN 47 -0.018 5.417 7.848
288 HE21 GLN 47 1HE2 GLN 47 -0.852 6.421 9.539
289 HE22 GLN 47 2HE2 GLN 47 -0.187 7.800 10.349
290 H MET 48 H MET 48 4.805 5.613 6.004
291 HA MET 48 HA MET 48 5.508 8.302 6.115
292 HB2 MET 48 1HB MET 48 6.930 5.644 5.834
293 HB3 MET 48 2HB MET 48 7.869 7.089 5.518
294 HG2 MET 48 1HG MET 48 6.327 7.513 7.937
295 HG3 MET 48 2HG MET 48 7.151 5.972 8.069
296 HE1 MET 48 3HE MET 48 8.657 9.968 8.812
297 HE2 MET 48 1HE MET 48 7.056 9.191 8.865
298 HE3 MET 48 2HE MET 48 8.316 8.715 10.030
299 H SER 49 H SER 49 5.314 5.936 3.440
300 HA SER 49 HA SER 49 6.654 7.718 1.652
301 HB2 SER 49 1HB SER 49 5.534 4.943 1.542
302 HB3 SER 49 2HB SER 49 5.586 5.813 0.021
303 HG SER 49 HG SER 49 7.961 6.279 1.111
304 H ALA 50 H ALA 50 3.583 7.582 3.028
305 HA ALA 50 HA ALA 50 1.870 7.967 0.871
306 HB1 ALA 50 3HB ALA 50 1.355 7.509 3.344
307 HB2 ALA 50 1HB ALA 50 1.596 9.253 3.607
308 HB3 ALA 50 2HB ALA 50 0.307 8.687 2.518
309 H GLN 51 H GLN 51 2.467 9.384 -0.744
310 HA GLN 51 HA GLN 51 3.479 11.959 0.056
311 HB2 GLN 51 1HB GLN 51 4.556 10.693 -1.806
312 HB3 GLN 51 2HB GLN 51 3.062 10.760 -2.719
313 HG2 GLN 51 1HG GLN 51 3.628 13.446 -1.899
314 HG3 GLN 51 2HG GLN 51 5.140 12.779 -2.482
315 HE21 GLN 51 1HE2 GLN 51 2.452 14.405 -3.355
316 HE22 GLN 51 2HE2 GLN 51 2.354 14.039 -5.045
317 H CYS 52 H CYS 52 1.031 11.951 1.072
318 HA CYS 52 HA CYS 52 -0.480 13.569 -0.830
319 HB2 CYS 52 1HB CYS 52 -2.513 12.453 0.529
320 HB3 CYS 52 2HB CYS 52 -1.935 11.885 -1.025
Start of MODEL 4
1 H1 ASN 1 1H ASN 1 11.747 -4.711 0.857
2 HA ASN 1 HA ASN 1 9.859 -3.776 -0.661
3 HB2 ASN 1 1HB ASN 1 11.023 -6.495 -0.311
4 HB3 ASN 1 2HB ASN 1 9.487 -6.502 -1.155
5 HD21 ASN 1 1HD2 ASN 1 12.488 -4.584 -1.025
6 HD22 ASN 1 2HD2 ASN 1 12.702 -4.394 -2.733
7 HA PRO 2 HA PRO 2 5.978 -4.729 1.149
8 HB2 PRO 2 1HB PRO 2 4.314 -4.590 -1.014
9 HB3 PRO 2 2HB PRO 2 4.890 -3.175 -0.155
10 HG2 PRO 2 1HG PRO 2 5.745 -4.223 -2.783
11 HG3 PRO 2 2HG PRO 2 5.982 -2.623 -2.110
12 HD2 PRO 2 1HD PRO 2 7.941 -4.709 -2.309
13 HD3 PRO 2 2HD PRO 2 8.144 -3.152 -1.532
14 H GLU 3 H GLU 3 7.644 -6.854 -0.628
15 HA GLU 3 HA GLU 3 5.741 -8.736 -1.279
16 HB2 GLU 3 1HB GLU 3 7.595 -10.288 -1.474
17 HB3 GLU 3 2HB GLU 3 8.142 -8.717 -2.025
18 HG2 GLU 3 1HG GLU 3 9.225 -8.284 0.157
19 HG3 GLU 3 2HG GLU 3 8.594 -9.787 0.800
20 H ASP 4 H ASP 4 7.119 -7.790 1.822
21 HA ASP 4 HA ASP 4 6.254 -10.226 3.070
22 HB2 ASP 4 1HB ASP 4 8.332 -8.642 3.632
23 HB3 ASP 4 2HB ASP 4 7.148 -7.755 4.572
24 H TRP 5 H TRP 5 4.914 -7.257 2.061
25 HA TRP 5 HA TRP 5 2.747 -7.515 4.025
26 HB2 TRP 5 1HB TRP 5 3.148 -4.794 3.072
27 HB3 TRP 5 2HB TRP 5 2.856 -5.398 4.691
28 HD1 TRP 5 HD TRP 5 5.402 -6.845 5.547
29 HE1 TRP 5 1HE TRP 5 7.812 -5.779 5.684
30 HE3 TRP 5 3HE TRP 5 4.475 -3.036 2.308
31 HZ2 TRP 5 2HZ TRP 5 9.033 -3.514 4.451
32 HZ3 TRP 5 3HZ TRP 5 6.330 -1.442 1.829
33 HH2 TRP 5 HH TRP 5 8.546 -1.634 2.841
34 H PHE 6 H PHE 6 1.348 -5.246 2.646
35 HA PHE 6 HA PHE 6 -0.106 -4.963 1.015
36 HB2 PHE 6 1HB PHE 6 1.807 -4.588 -0.436
37 HB3 PHE 6 2HB PHE 6 2.273 -6.276 -0.387
38 HD1 PHE 6 2HD PHE 6 -0.523 -4.104 -1.562
39 HD2 PHE 6 1HD PHE 6 1.747 -7.634 -2.185
40 HE1 PHE 6 2HE PHE 6 -1.735 -4.502 -3.724
41 HE2 PHE 6 1HE PHE 6 0.535 -8.032 -4.347
42 HZ PHE 6 HZ PHE 6 -1.191 -6.461 -5.090
43 H THR 7 H THR 7 -2.032 -6.006 0.894
44 HA THR 7 HA THR 7 -1.945 -8.927 0.530
45 HB THR 7 HB THR 7 -4.082 -8.908 1.785
46 HG1 THR 7 1HG THR 7 -4.634 -6.629 2.583
47 HG21 THR 7 3HG2 THR 7 -1.599 -8.094 2.915
48 HG22 THR 7 1HG2 THR 7 -2.807 -6.952 3.552
49 HG23 THR 7 2HG2 THR 7 -3.019 -8.702 3.799
50 HA PRO 8 HA PRO 8 -3.663 -7.752 -3.342
51 HB2 PRO 8 1HB PRO 8 -2.895 -9.996 -4.699
52 HB3 PRO 8 2HB PRO 8 -1.894 -8.563 -4.573
53 HG2 PRO 8 1HG PRO 8 -1.612 -11.149 -3.169
54 HG3 PRO 8 2HG PRO 8 -0.420 -9.882 -3.388
55 HD2 PRO 8 1HD PRO 8 -1.908 -10.445 -1.001
56 HD3 PRO 8 2HD PRO 8 -0.803 -9.109 -1.257
57 H ASP 9 H ASP 9 -4.567 -9.825 -1.026
58 HA ASP 9 HA ASP 9 -6.538 -11.148 -2.644
59 HB2 ASP 9 1HB ASP 9 -5.204 -11.683 -0.186
60 HB3 ASP 9 2HB ASP 9 -6.883 -11.434 0.248
61 H THR 10 H THR 10 -6.145 -8.128 -1.218
62 HA THR 10 HA THR 10 -9.023 -7.700 -1.117
63 HB THR 10 HB THR 10 -8.349 -8.319 1.216
64 HG1 THR 10 1HG THR 10 -9.723 -6.655 1.717
65 HG21 THR 10 3HG2 THR 10 -6.430 -7.515 2.157
66 HG22 THR 10 1HG2 THR 10 -6.036 -6.724 0.612
67 HG23 THR 10 2HG2 THR 10 -6.966 -5.845 1.849
68 H CYS 11 H CYS 11 -7.170 -7.033 -3.145
69 HA CYS 11 HA CYS 11 -7.568 -4.199 -3.107
70 HB2 CYS 11 1HB CYS 11 -5.180 -4.975 -2.069
71 HB3 CYS 11 2HB CYS 11 -4.763 -4.858 -3.767
72 H ALA 12 H ALA 12 -6.970 -3.298 -5.353
73 HA ALA 12 HA ALA 12 -7.498 -5.393 -7.323
74 HB1 ALA 12 3HB ALA 12 -8.417 -2.691 -6.869
75 HB2 ALA 12 1HB ALA 12 -7.644 -2.797 -8.469
76 HB3 ALA 12 2HB ALA 12 -8.991 -3.885 -8.057
77 H TYR 13 H TYR 13 -4.966 -5.689 -6.489
78 HA TYR 13 HA TYR 13 -3.458 -4.639 -8.752
79 HB2 TYR 13 1HB TYR 13 -2.565 -4.621 -5.804
80 HB3 TYR 13 2HB TYR 13 -1.643 -3.978 -7.148
81 HD1 TYR 13 1HD TYR 13 -4.834 -3.498 -5.264
82 HD2 TYR 13 2HD TYR 13 -1.862 -1.720 -7.776
83 HE1 TYR 13 1HE TYR 13 -5.883 -1.211 -4.898
84 HE2 TYR 13 2HE TYR 13 -2.921 0.561 -7.401
85 HH TYR 13 HH TYR 13 -5.670 1.169 -6.658
86 H GLY 14 H GLY 14 -1.891 -6.065 -9.522
87 HA2 GLY 14 1HA GLY 14 -1.996 -8.746 -8.365
88 HA3 GLY 14 2HA GLY 14 -1.376 -8.285 -9.937
89 H ASP 15 H ASP 15 0.317 -6.071 -9.105
90 HA ASP 15 HA ASP 15 2.412 -7.666 -7.903
91 HB2 ASP 15 1HB ASP 15 2.600 -4.911 -9.204
92 HB3 ASP 15 2HB ASP 15 3.943 -5.961 -8.799
93 H SER 16 H SER 16 3.686 -6.751 -6.095
94 HA SER 16 HA SER 16 2.064 -5.110 -4.414
95 HB2 SER 16 1HB SER 16 3.901 -5.523 -2.739
96 HB3 SER 16 2HB SER 16 3.192 -6.988 -3.387
97 HG SER 16 HG SER 16 5.649 -6.799 -3.274
98 H ASN 17 H ASN 17 5.037 -4.873 -6.379
99 HA ASN 17 HA ASN 17 6.008 -2.533 -5.260
100 HB2 ASN 17 1HB ASN 17 6.719 -4.293 -7.365
101 HB3 ASN 17 2HB ASN 17 6.474 -2.754 -8.167
102 HD21 ASN 17 1HD2 ASN 17 7.733 -0.976 -7.648
103 HD22 ASN 17 2HD2 ASN 17 9.239 -1.097 -6.800
104 H THR 18 H THR 18 3.921 -3.209 -8.164
105 HA THR 18 HA THR 18 3.562 -0.480 -8.837
106 HB THR 18 HB THR 18 3.308 -2.706 -10.235
107 HG1 THR 18 1HG THR 18 2.776 -0.380 -10.786
108 HG21 THR 18 3HG2 THR 18 1.198 -3.737 -10.273
109 HG22 THR 18 1HG2 THR 18 1.334 -3.385 -8.533
110 HG23 THR 18 2HG2 THR 18 0.381 -2.311 -9.587
111 H ALA 19 H ALA 19 1.821 -2.773 -6.717
112 HA ALA 19 HA ALA 19 -0.493 -1.259 -6.401
113 HB1 ALA 19 3HB ALA 19 0.941 -3.172 -4.515
114 HB2 ALA 19 1HB ALA 19 -0.728 -2.593 -4.301
115 HB3 ALA 19 2HB ALA 19 -0.308 -3.592 -5.712
116 H TRP 20 H TRP 20 2.450 -1.442 -4.266
117 HA TRP 20 HA TRP 20 1.701 0.560 -2.530
118 HB2 TRP 20 1HB TRP 20 3.500 -0.849 -1.961
119 HB3 TRP 20 2HB TRP 20 4.384 -0.470 -3.426
120 HD1 TRP 20 HD TRP 20 4.896 2.494 -3.472
121 HE1 TRP 20 1HE TRP 20 6.071 3.925 -1.592
122 HE3 TRP 20 3HE TRP 20 4.003 -0.781 0.314
123 HZ2 TRP 20 2HZ TRP 20 6.487 3.536 1.205
124 HZ3 TRP 20 3HZ TRP 20 4.827 -0.179 2.589
125 HH2 TRP 20 HH TRP 20 6.031 1.894 3.064
126 H THR 21 H THR 21 3.677 0.732 -5.577
127 HA THR 21 HA THR 21 4.105 3.472 -5.550
128 HB THR 21 HB THR 21 4.183 1.197 -7.487
129 HG1 THR 21 1HG THR 21 5.933 2.253 -6.135
130 HG21 THR 21 3HG2 THR 21 3.226 2.537 -9.157
131 HG22 THR 21 1HG2 THR 21 3.628 4.050 -8.311
132 HG23 THR 21 2HG2 THR 21 4.892 3.163 -9.196
133 H THR 22 H THR 22 1.413 1.616 -7.111
134 HA THR 22 HA THR 22 0.115 3.909 -8.084
135 HB THR 22 HB THR 22 -0.963 1.136 -7.348
136 HG1 THR 22 1HG THR 22 -0.035 0.618 -9.334
137 HG21 THR 22 3HG2 THR 22 -2.824 2.643 -7.903
138 HG22 THR 22 1HG2 THR 22 -1.917 3.311 -9.281
139 HG23 THR 22 2HG2 THR 22 -2.491 1.627 -9.326
140 H CYS 23 H CYS 23 0.254 2.436 -4.882
141 HA CYS 23 HA CYS 23 -2.099 3.779 -3.981
142 HB2 CYS 23 1HB CYS 23 -0.503 1.666 -3.070
143 HB3 CYS 23 2HB CYS 23 -0.290 2.932 -1.877
144 H THR 24 H THR 24 1.467 4.237 -3.961
145 HA THR 24 HA THR 24 1.251 6.631 -2.343
146 HB THR 24 HB THR 24 3.808 6.583 -2.878
147 HG1 THR 24 1HG THR 24 3.473 5.195 -4.787
148 HG21 THR 24 3HG2 THR 24 3.537 3.929 -1.778
149 HG22 THR 24 1HG2 THR 24 3.926 5.434 -0.909
150 HG23 THR 24 2HG2 THR 24 2.229 4.931 -1.103
151 H THR 25 H THR 25 -0.393 7.436 -4.070
152 HA THR 25 HA THR 25 1.156 9.184 -5.827
153 HB THR 25 HB THR 25 -0.591 8.643 -7.648
154 HG1 THR 25 1HG THR 25 -2.070 7.119 -7.007
155 HG21 THR 25 3HG2 THR 25 0.564 5.976 -7.227
156 HG22 THR 25 1HG2 THR 25 0.902 7.146 -8.525
157 HG23 THR 25 2HG2 THR 25 1.787 7.246 -6.984
158 HA PRO 26 HA PRO 26 -1.686 12.132 -4.551
159 HB2 PRO 26 1HB PRO 26 -1.825 13.840 -6.679
160 HB3 PRO 26 2HB PRO 26 -0.499 13.843 -5.534
161 HG2 PRO 26 1HG PRO 26 -0.556 12.801 -8.299
162 HG3 PRO 26 2HG PRO 26 0.831 13.200 -7.305
163 HD2 PRO 26 1HD PRO 26 -0.171 10.574 -7.881
164 HD3 PRO 26 2HD PRO 26 1.143 10.980 -6.795
165 H GLY 27 H GLY 27 -3.753 11.840 -4.043
166 HA2 GLY 27 1HA GLY 27 -5.683 11.951 -6.178
167 HA3 GLY 27 2HA GLY 27 -5.514 10.353 -5.479
168 H GLN 28 H GLN 28 -7.474 10.201 -4.365
169 HA GLN 28 HA GLN 28 -7.903 12.289 -2.374
170 HB2 GLN 28 1HB GLN 28 -9.654 11.243 -4.337
171 HB3 GLN 28 2HB GLN 28 -10.207 10.545 -2.828
172 HG2 GLN 28 1HG GLN 28 -11.351 12.544 -2.680
173 HG3 GLN 28 2HG GLN 28 -9.846 13.082 -1.960
174 HE21 GLN 28 1HE2 GLN 28 -12.118 14.066 -3.924
175 HE22 GLN 28 2HE2 GLN 28 -11.251 15.002 -5.097
176 H THR 29 H THR 29 -8.079 8.735 -3.032
177 HA THR 29 HA THR 29 -7.905 8.306 -0.122
178 HB THR 29 HB THR 29 -8.972 6.090 -0.676
179 HG1 THR 29 1HG THR 29 -9.274 5.666 -2.867
180 HG21 THR 29 3HG2 THR 29 -11.133 7.128 -1.824
181 HG22 THR 29 1HG2 THR 29 -10.712 7.616 -0.165
182 HG23 THR 29 2HG2 THR 29 -10.308 8.678 -1.535
183 H CYS 30 H CYS 30 -5.570 9.066 -1.432
184 HA CYS 30 HA CYS 30 -4.151 6.855 -2.417
185 HB2 CYS 30 1HB CYS 30 -3.276 8.879 -3.076
186 HB3 CYS 30 2HB CYS 30 -3.448 9.608 -1.491
187 H TYR 31 H TYR 31 -4.027 8.637 0.762
188 HA TYR 31 HA TYR 31 -2.427 6.621 1.975
189 HB2 TYR 31 1HB TYR 31 -2.353 8.955 2.730
190 HB3 TYR 31 2HB TYR 31 -4.101 9.053 2.811
191 HD1 TYR 31 1HD TYR 31 -5.324 7.817 4.653
192 HD2 TYR 31 2HD TYR 31 -1.067 8.239 4.606
193 HE1 TYR 31 1HE TYR 31 -5.234 7.259 7.132
194 HE2 TYR 31 2HE TYR 31 -0.991 7.679 7.084
195 HH TYR 31 HH TYR 31 -3.131 6.160 8.653
196 H THR 32 H THR 32 -5.722 6.729 1.115
197 HA THR 32 HA THR 32 -6.578 5.163 3.427
198 HB THR 32 HB THR 32 -7.934 6.575 1.091
199 HG1 THR 32 1HG THR 32 -7.288 7.604 3.196
200 HG21 THR 32 3HG2 THR 32 -8.911 4.244 2.641
201 HG22 THR 32 1HG2 THR 32 -9.941 5.684 2.830
202 HG23 THR 32 2HG2 THR 32 -9.625 5.022 1.208
203 H CYS 33 H CYS 33 -5.696 4.836 0.007
204 HA CYS 33 HA CYS 33 -6.861 2.292 -0.312
205 HB2 CYS 33 1HB CYS 33 -5.735 2.191 -2.378
206 HB3 CYS 33 2HB CYS 33 -6.229 3.857 -2.153
207 H CYS 34 H CYS 34 -3.794 3.582 0.975
208 HA CYS 34 HA CYS 34 -2.238 1.321 0.856
209 HB2 CYS 34 1HB CYS 34 -2.299 3.476 2.979
210 HB3 CYS 34 2HB CYS 34 -1.025 2.287 2.796
211 H SER 35 H SER 35 -4.831 2.333 3.129
212 HA SER 35 HA SER 35 -4.336 0.222 4.932
213 HB2 SER 35 1HB SER 35 -5.427 2.283 5.676
214 HB3 SER 35 2HB SER 35 -6.735 2.058 4.532
215 HG SER 35 HG SER 35 -6.150 0.538 6.908
216 H SER 36 H SER 36 -5.373 0.163 1.777
217 HA SER 36 HA SER 36 -7.031 -2.175 2.310
218 HB2 SER 36 1HB SER 36 -7.489 0.156 0.479
219 HB3 SER 36 2HB SER 36 -7.934 -1.422 -0.140
220 HG SER 36 HG SER 36 -9.628 -1.481 1.174
221 H CYS 37 H CYS 37 -4.049 -1.232 1.414
222 HA CYS 37 HA CYS 37 -3.836 -3.393 -0.540
223 HB2 CYS 37 1HB CYS 37 -3.331 -0.599 -1.023
224 HB3 CYS 37 2HB CYS 37 -1.835 -1.500 -1.164
225 H PHE 38 H PHE 38 -3.395 -2.806 2.500
226 HA PHE 38 HA PHE 38 -0.873 -4.169 2.627
227 HB2 PHE 38 1HB PHE 38 -1.382 -1.366 3.791
228 HB3 PHE 38 2HB PHE 38 -0.008 -2.353 4.249
229 HD1 PHE 38 1HD PHE 38 1.191 -3.361 1.943
230 HD2 PHE 38 2HD PHE 38 -0.831 0.346 2.367
231 HE1 PHE 38 1HE PHE 38 2.505 -2.424 0.021
232 HE2 PHE 38 2HE PHE 38 0.483 1.283 0.445
233 HZ PHE 38 HZ PHE 38 2.136 -0.113 -0.705
234 H ASP 39 H ASP 39 -0.296 -4.530 5.088
235 HA ASP 39 HA ASP 39 -2.838 -5.110 6.376
236 HB2 ASP 39 1HB ASP 39 -1.191 -6.620 7.811
237 HB3 ASP 39 2HB ASP 39 -1.743 -7.162 6.238
238 H VAL 40 H VAL 40 0.152 -5.400 8.201
239 HA VAL 40 HA VAL 40 -0.647 -3.117 9.826
240 HB VAL 40 HB VAL 40 -0.305 -5.376 10.810
241 HG11 VAL 40 1HG1 VAL 40 2.640 -4.898 10.253
242 HG12 VAL 40 2HG1 VAL 40 1.907 -6.301 11.067
243 HG13 VAL 40 3HG1 VAL 40 1.610 -6.022 9.335
244 HG21 VAL 40 3HG2 VAL 40 0.536 -2.855 11.763
245 HG22 VAL 40 1HG2 VAL 40 0.096 -4.291 12.717
246 HG23 VAL 40 2HG2 VAL 40 1.793 -4.015 12.255
247 H VAL 41 H VAL 41 2.309 -4.533 8.258
248 HA VAL 41 HA VAL 41 3.826 -2.179 8.719
249 HB VAL 41 HB VAL 41 4.258 -4.514 6.844
250 HG11 VAL 41 1HG1 VAL 41 6.558 -3.863 6.724
251 HG12 VAL 41 2HG1 VAL 41 5.580 -2.427 6.336
252 HG13 VAL 41 3HG1 VAL 41 6.326 -2.588 7.944
253 HG21 VAL 41 3HG2 VAL 41 4.221 -5.527 8.921
254 HG22 VAL 41 1HG2 VAL 41 5.938 -5.077 8.790
255 HG23 VAL 41 2HG2 VAL 41 4.829 -4.080 9.761
256 H GLY 42 H GLY 42 2.883 -3.693 5.553
257 HA2 GLY 42 1HA GLY 42 3.351 -1.770 3.808
258 HA3 GLY 42 2HA GLY 42 1.870 -2.705 3.757
259 H GLU 43 H GLU 43 0.778 -1.640 6.311
260 HA GLU 43 HA GLU 43 -0.402 0.674 5.195
261 HB2 GLU 43 1HB GLU 43 -1.366 -1.184 6.838
262 HB3 GLU 43 2HB GLU 43 -0.748 -0.123 8.088
263 HG2 GLU 43 1HG GLU 43 -2.263 1.294 5.960
264 HG3 GLU 43 2HG GLU 43 -3.224 0.134 6.856
265 H GLN 44 H GLN 44 1.486 0.078 8.254
266 HA GLN 44 HA GLN 44 1.776 2.807 8.768
267 HB2 GLN 44 1HB GLN 44 3.191 2.130 10.584
268 HB3 GLN 44 2HB GLN 44 1.955 0.896 10.438
269 HG2 GLN 44 1HG GLN 44 3.606 -0.647 10.257
270 HG3 GLN 44 2HG GLN 44 4.005 0.034 8.692
271 HE21 GLN 44 1HE2 GLN 44 4.653 0.147 12.142
272 HE22 GLN 44 2HE2 GLN 44 6.233 0.852 12.068
273 H ALA 45 H ALA 45 3.274 0.710 6.480
274 HA ALA 45 HA ALA 45 5.771 2.164 6.413
275 HB1 ALA 45 3HB ALA 45 6.267 0.587 4.552
276 HB2 ALA 45 1HB ALA 45 5.746 -0.256 6.030
277 HB3 ALA 45 2HB ALA 45 4.610 -0.052 4.675
278 H CYS 46 H CYS 46 2.827 1.688 4.351
279 HA CYS 46 HA CYS 46 3.688 3.476 2.369
280 HB2 CYS 46 1HB CYS 46 2.024 1.767 1.934
281 HB3 CYS 46 2HB CYS 46 0.923 2.488 3.090
282 H GLN 47 H GLN 47 2.206 3.793 5.557
283 HA GLN 47 HA GLN 47 0.955 6.227 5.232
284 HB2 GLN 47 1HB GLN 47 1.956 4.584 7.504
285 HB3 GLN 47 2HB GLN 47 1.783 6.292 7.857
286 HG2 GLN 47 1HG GLN 47 -0.573 5.806 6.500
287 HG3 GLN 47 2HG GLN 47 -0.316 4.255 7.273
288 HE21 GLN 47 1HE2 GLN 47 -1.611 4.181 8.951
289 HE22 GLN 47 2HE2 GLN 47 -1.763 5.367 10.204
290 H MET 48 H MET 48 4.331 5.433 6.292
291 HA MET 48 HA MET 48 5.071 8.086 6.682
292 HB2 MET 48 1HB MET 48 6.553 5.472 6.150
293 HB3 MET 48 2HB MET 48 7.453 6.969 6.292
294 HG2 MET 48 1HG MET 48 5.618 6.940 8.488
295 HG3 MET 48 2HG MET 48 6.300 5.328 8.406
296 HE1 MET 48 3HE MET 48 8.461 4.743 8.137
297 HE2 MET 48 1HE MET 48 9.935 5.734 8.261
298 HE3 MET 48 2HE MET 48 9.158 5.107 9.734
299 H SER 49 H SER 49 5.414 5.853 3.854
300 HA SER 49 HA SER 49 6.800 7.766 2.326
301 HB2 SER 49 1HB SER 49 7.115 5.443 1.795
302 HB3 SER 49 2HB SER 49 5.391 5.156 1.663
303 HG SER 49 HG SER 49 5.385 6.604 -0.222
304 H ALA 50 H ALA 50 3.490 7.332 3.229
305 HA ALA 50 HA ALA 50 2.016 8.013 1.066
306 HB1 ALA 50 3HB ALA 50 0.371 8.751 2.617
307 HB2 ALA 50 1HB ALA 50 1.324 7.531 3.495
308 HB3 ALA 50 2HB ALA 50 1.600 9.263 3.799
309 H GLN 51 H GLN 51 2.920 9.403 -0.458
310 HA GLN 51 HA GLN 51 3.490 12.082 0.544
311 HB2 GLN 51 1HB GLN 51 5.242 10.508 -0.770
312 HB3 GLN 51 2HB GLN 51 4.438 11.195 -2.168
313 HG2 GLN 51 1HG GLN 51 4.803 13.508 -0.960
314 HG3 GLN 51 2HG GLN 51 5.971 12.642 0.019
315 HE21 GLN 51 1HE2 GLN 51 6.014 14.740 -2.220
316 HE22 GLN 51 2HE2 GLN 51 7.248 14.198 -3.309
317 H CYS 52 H CYS 52 0.862 11.750 0.343
318 HA CYS 52 HA CYS 52 0.197 12.829 -2.300
319 HB2 CYS 52 1HB CYS 52 -2.181 11.877 -1.315
320 HB3 CYS 52 2HB CYS 52 -1.175 11.105 -2.525
Start of MODEL 5
1 H1 ASN 1 1H ASN 1 11.733 -3.866 1.562
2 HA ASN 1 HA ASN 1 10.111 -3.425 0.075
3 HB2 ASN 1 1HB ASN 1 10.948 -6.332 -0.112
4 HB3 ASN 1 2HB ASN 1 9.727 -5.753 -1.228
5 HD21 ASN 1 1HD2 ASN 1 12.981 -6.100 -0.648
6 HD22 ASN 1 2HD2 ASN 1 13.636 -5.013 -1.826
7 HA PRO 2 HA PRO 2 6.061 -4.666 1.210
8 HB2 PRO 2 1HB PRO 2 4.645 -4.452 -1.118
9 HB3 PRO 2 2HB PRO 2 5.073 -3.072 -0.126
10 HG2 PRO 2 1HG PRO 2 6.252 -3.947 -2.692
11 HG3 PRO 2 2HG PRO 2 6.358 -2.381 -1.912
12 HD2 PRO 2 1HD PRO 2 8.396 -4.397 -1.998
13 HD3 PRO 2 2HD PRO 2 8.458 -2.881 -1.121
14 H GLU 3 H GLU 3 7.986 -6.640 -0.481
15 HA GLU 3 HA GLU 3 6.151 -8.544 -1.358
16 HB2 GLU 3 1HB GLU 3 8.071 -9.978 -1.669
17 HB3 GLU 3 2HB GLU 3 8.566 -8.346 -2.069
18 HG2 GLU 3 1HG GLU 3 9.585 -8.073 0.178
19 HG3 GLU 3 2HG GLU 3 9.028 -9.667 0.647
20 H ASP 4 H ASP 4 6.974 -7.530 1.791
21 HA ASP 4 HA ASP 4 6.374 -10.154 2.884
22 HB2 ASP 4 1HB ASP 4 8.392 -8.542 3.586
23 HB3 ASP 4 2HB ASP 4 7.160 -7.759 4.556
24 H TRP 5 H TRP 5 4.978 -7.164 2.018
25 HA TRP 5 HA TRP 5 2.788 -7.578 3.931
26 HB2 TRP 5 1HB TRP 5 3.155 -4.813 3.058
27 HB3 TRP 5 2HB TRP 5 2.783 -5.465 4.641
28 HD1 TRP 5 HD TRP 5 5.279 -6.866 5.643
29 HE1 TRP 5 1HE TRP 5 7.669 -5.785 5.925
30 HE3 TRP 5 3HE TRP 5 4.524 -3.064 2.353
31 HZ2 TRP 5 2HZ TRP 5 8.947 -3.511 4.767
32 HZ3 TRP 5 3HZ TRP 5 6.394 -1.457 1.986
33 HH2 TRP 5 HH TRP 5 8.546 -1.635 3.130
34 H PHE 6 H PHE 6 1.361 -5.281 2.592
35 HA PHE 6 HA PHE 6 -0.085 -4.990 0.955
36 HB2 PHE 6 1HB PHE 6 1.848 -4.544 -0.455
37 HB3 PHE 6 2HB PHE 6 2.329 -6.229 -0.458
38 HD1 PHE 6 2HD PHE 6 -0.443 -4.019 -1.609
39 HD2 PHE 6 1HD PHE 6 1.801 -7.556 -2.285
40 HE1 PHE 6 2HE PHE 6 -1.631 -4.354 -3.794
41 HE2 PHE 6 1HE PHE 6 0.614 -7.892 -4.470
42 HZ PHE 6 HZ PHE 6 -1.088 -6.287 -5.199
43 H THR 7 H THR 7 -1.988 -6.065 0.772
44 HA THR 7 HA THR 7 -1.838 -8.976 0.349
45 HB THR 7 HB THR 7 -4.039 -8.990 1.532
46 HG1 THR 7 1HG THR 7 -4.492 -6.714 2.469
47 HG21 THR 7 3HG2 THR 7 -1.706 -8.722 2.832
48 HG22 THR 7 1HG2 THR 7 -2.359 -7.108 3.205
49 HG23 THR 7 2HG2 THR 7 -3.247 -8.566 3.709
50 HA PRO 8 HA PRO 8 -3.503 -7.766 -3.533
51 HB2 PRO 8 1HB PRO 8 -2.691 -9.985 -4.906
52 HB3 PRO 8 2HB PRO 8 -1.705 -8.546 -4.742
53 HG2 PRO 8 1HG PRO 8 -1.428 -11.149 -3.369
54 HG3 PRO 8 2HG PRO 8 -0.243 -9.870 -3.548
55 HD2 PRO 8 1HD PRO 8 -1.770 -10.478 -1.197
56 HD3 PRO 8 2HD PRO 8 -0.672 -9.130 -1.414
57 H ASP 9 H ASP 9 -4.442 -9.865 -1.261
58 HA ASP 9 HA ASP 9 -6.393 -11.148 -2.948
59 HB2 ASP 9 1HB ASP 9 -5.063 -11.771 -0.488
60 HB3 ASP 9 2HB ASP 9 -6.764 -11.612 -0.097
61 H THR 10 H THR 10 -6.003 -8.202 -1.380
62 HA THR 10 HA THR 10 -8.885 -7.802 -1.220
63 HB THR 10 HB THR 10 -8.108 -8.505 1.077
64 HG1 THR 10 1HG THR 10 -9.779 -7.010 1.208
65 HG21 THR 10 3HG2 THR 10 -6.872 -6.054 1.881
66 HG22 THR 10 1HG2 THR 10 -6.142 -7.677 1.895
67 HG23 THR 10 2HG2 THR 10 -5.958 -6.630 0.467
68 H CYS 11 H CYS 11 -7.069 -7.048 -3.258
69 HA CYS 11 HA CYS 11 -7.415 -4.193 -3.027
70 HB2 CYS 11 1HB CYS 11 -5.023 -4.998 -2.234
71 HB3 CYS 11 2HB CYS 11 -4.719 -5.089 -3.957
72 H ALA 12 H ALA 12 -7.040 -3.171 -5.267
73 HA ALA 12 HA ALA 12 -8.305 -4.792 -7.217
74 HB1 ALA 12 3HB ALA 12 -8.856 -2.528 -7.343
75 HB2 ALA 12 1HB ALA 12 -7.179 -1.998 -7.063
76 HB3 ALA 12 2HB ALA 12 -7.647 -2.677 -8.641
77 H TYR 13 H TYR 13 -4.948 -3.580 -6.675
78 HA TYR 13 HA TYR 13 -4.029 -4.930 -9.059
79 HB2 TYR 13 1HB TYR 13 -2.747 -3.401 -6.711
80 HB3 TYR 13 2HB TYR 13 -1.817 -3.981 -8.078
81 HD1 TYR 13 1HD TYR 13 -3.076 -3.266 -10.458
82 HD2 TYR 13 2HD TYR 13 -3.187 -1.132 -6.751
83 HE1 TYR 13 1HE TYR 13 -3.579 -1.109 -11.706
84 HE2 TYR 13 2HE TYR 13 -3.689 1.017 -8.012
85 HH TYR 13 HH TYR 13 -4.725 1.629 -10.182
86 H GLY 14 H GLY 14 -2.320 -6.566 -9.034
87 HA2 GLY 14 1HA GLY 14 -2.575 -8.325 -6.682
88 HA3 GLY 14 2HA GLY 14 -2.186 -8.823 -8.317
89 H ASP 15 H ASP 15 -0.466 -6.060 -8.190
90 HA ASP 15 HA ASP 15 1.879 -7.496 -7.283
91 HB2 ASP 15 1HB ASP 15 1.996 -4.771 -8.574
92 HB3 ASP 15 2HB ASP 15 3.137 -6.096 -8.698
93 H SER 16 H SER 16 3.197 -6.643 -5.573
94 HA SER 16 HA SER 16 1.861 -4.751 -3.907
95 HB2 SER 16 1HB SER 16 3.173 -5.587 -2.216
96 HB3 SER 16 2HB SER 16 3.356 -6.921 -3.337
97 HG SER 16 HG SER 16 5.346 -5.930 -4.104
98 H ASN 17 H ASN 17 4.723 -4.920 -6.052
99 HA ASN 17 HA ASN 17 5.938 -2.590 -5.185
100 HB2 ASN 17 1HB ASN 17 5.986 -4.246 -7.717
101 HB3 ASN 17 2HB ASN 17 6.729 -2.660 -7.773
102 HD21 ASN 17 1HD2 ASN 17 8.772 -2.549 -7.268
103 HD22 ASN 17 2HD2 ASN 17 9.670 -3.637 -6.263
104 H THR 18 H THR 18 3.736 -3.284 -8.010
105 HA THR 18 HA THR 18 3.512 -0.570 -8.785
106 HB THR 18 HB THR 18 3.054 -2.947 -9.989
107 HG1 THR 18 1HG THR 18 2.971 -0.584 -10.727
108 HG21 THR 18 3HG2 THR 18 0.905 -3.107 -8.388
109 HG22 THR 18 1HG2 THR 18 0.221 -1.964 -9.569
110 HG23 THR 18 2HG2 THR 18 0.785 -3.566 -10.103
111 H ALA 19 H ALA 19 1.705 -2.663 -6.526
112 HA ALA 19 HA ALA 19 -0.522 -1.000 -6.253
113 HB1 ALA 19 3HB ALA 19 -0.614 -2.219 -3.960
114 HB2 ALA 19 1HB ALA 19 -0.706 -3.205 -5.439
115 HB3 ALA 19 2HB ALA 19 0.823 -3.098 -4.534
116 H TRP 20 H TRP 20 2.451 -1.302 -4.176
117 HA TRP 20 HA TRP 20 1.855 0.784 -2.474
118 HB2 TRP 20 1HB TRP 20 3.584 -0.748 -1.938
119 HB3 TRP 20 2HB TRP 20 4.474 -0.385 -3.404
120 HD1 TRP 20 HD TRP 20 5.117 2.548 -3.419
121 HE1 TRP 20 1HE TRP 20 6.353 3.911 -1.527
122 HE3 TRP 20 3HE TRP 20 4.081 -0.717 0.339
123 HZ2 TRP 20 2HZ TRP 20 6.750 3.480 1.266
124 HZ3 TRP 20 3HZ TRP 20 4.930 -0.171 2.619
125 HH2 TRP 20 HH TRP 20 6.222 1.844 3.111
126 H THR 21 H THR 21 3.794 0.763 -5.551
127 HA THR 21 HA THR 21 4.360 3.480 -5.604
128 HB THR 21 HB THR 21 4.320 1.147 -7.471
129 HG1 THR 21 1HG THR 21 6.161 2.066 -6.224
130 HG21 THR 21 3HG2 THR 21 5.083 2.971 -9.274
131 HG22 THR 21 1HG2 THR 21 3.369 2.510 -9.146
132 HG23 THR 21 2HG2 THR 21 3.945 4.012 -8.385
133 H THR 22 H THR 22 1.502 1.694 -6.897
134 HA THR 22 HA THR 22 0.329 4.064 -7.957
135 HB THR 22 HB THR 22 -0.830 1.305 -7.291
136 HG1 THR 22 1HG THR 22 0.960 1.255 -8.794
137 HG21 THR 22 3HG2 THR 22 -1.763 3.635 -9.030
138 HG22 THR 22 1HG2 THR 22 -2.271 1.961 -9.359
139 HG23 THR 22 2HG2 THR 22 -2.700 2.733 -7.814
140 H CYS 23 H CYS 23 0.636 2.750 -4.765
141 HA CYS 23 HA CYS 23 -1.760 4.056 -3.838
142 HB2 CYS 23 1HB CYS 23 -0.040 1.969 -2.897
143 HB3 CYS 23 2HB CYS 23 -0.113 3.224 -1.675
144 H THR 24 H THR 24 1.797 4.459 -3.946
145 HA THR 24 HA THR 24 1.696 6.812 -2.256
146 HB THR 24 HB THR 24 4.234 6.728 -2.990
147 HG1 THR 24 1HG THR 24 4.559 5.070 -4.418
148 HG21 THR 24 3HG2 THR 24 3.278 5.804 -0.774
149 HG22 THR 24 1HG2 THR 24 3.144 4.233 -1.601
150 HG23 THR 24 2HG2 THR 24 4.741 4.987 -1.377
151 H THR 25 H THR 25 -0.052 7.517 -4.041
152 HA THR 25 HA THR 25 1.428 9.411 -5.705
153 HB THR 25 HB THR 25 -0.284 8.817 -7.564
154 HG1 THR 25 1HG THR 25 -1.658 7.557 -6.108
155 HG21 THR 25 3HG2 THR 25 2.199 7.550 -6.881
156 HG22 THR 25 1HG2 THR 25 1.069 6.252 -7.336
157 HG23 THR 25 2HG2 THR 25 1.406 7.579 -8.474
158 HA PRO 26 HA PRO 26 -1.607 12.148 -4.405
159 HB2 PRO 26 1HB PRO 26 -1.794 13.915 -6.482
160 HB3 PRO 26 2HB PRO 26 -0.498 13.955 -5.303
161 HG2 PRO 26 1HG PRO 26 -0.428 13.003 -8.101
162 HG3 PRO 26 2HG PRO 26 0.909 13.447 -7.059
163 HD2 PRO 26 1HD PRO 26 0.075 10.789 -7.743
164 HD3 PRO 26 2HD PRO 26 1.337 11.233 -6.611
165 H GLY 27 H GLY 27 -3.698 11.874 -3.981
166 HA2 GLY 27 1HA GLY 27 -5.568 11.909 -6.144
167 HA3 GLY 27 2HA GLY 27 -5.329 10.290 -5.518
168 H GLN 28 H GLN 28 -7.521 10.231 -4.702
169 HA GLN 28 HA GLN 28 -8.019 12.103 -2.537
170 HB2 GLN 28 1HB GLN 28 -9.797 10.390 -4.287
171 HB3 GLN 28 2HB GLN 28 -10.391 10.947 -2.735
172 HG2 GLN 28 1HG GLN 28 -9.859 13.312 -3.392
173 HG3 GLN 28 2HG GLN 28 -9.296 12.744 -4.952
174 HE21 GLN 28 1HE2 GLN 28 -12.086 12.709 -2.766
175 HE22 GLN 28 2HE2 GLN 28 -13.324 12.707 -3.977
176 H THR 29 H THR 29 -7.897 8.596 -3.368
177 HA THR 29 HA THR 29 -7.915 8.022 -0.477
178 HB THR 29 HB THR 29 -8.977 5.923 -1.048
179 HG1 THR 29 1HG THR 29 -8.544 6.776 -3.818
180 HG21 THR 29 3HG2 THR 29 -10.930 6.551 -2.454
181 HG22 THR 29 1HG2 THR 29 -10.570 7.855 -1.298
182 HG23 THR 29 2HG2 THR 29 -10.076 8.014 -3.001
183 H CYS 30 H CYS 30 -5.552 9.002 -1.506
184 HA CYS 30 HA CYS 30 -3.914 6.954 -2.522
185 HB2 CYS 30 1HB CYS 30 -3.154 9.083 -2.990
186 HB3 CYS 30 2HB CYS 30 -3.462 9.679 -1.372
187 H TYR 31 H TYR 31 -4.027 8.585 0.741
188 HA TYR 31 HA TYR 31 -2.472 6.516 1.936
189 HB2 TYR 31 1HB TYR 31 -2.406 8.824 2.773
190 HB3 TYR 31 2HB TYR 31 -4.154 8.932 2.800
191 HD1 TYR 31 1HD TYR 31 -5.429 7.512 4.521
192 HD2 TYR 31 2HD TYR 31 -1.204 8.159 4.696
193 HE1 TYR 31 1HE TYR 31 -5.425 6.864 6.980
194 HE2 TYR 31 2HE TYR 31 -1.213 7.509 7.154
195 HH TYR 31 HH TYR 31 -2.593 7.303 8.954
196 H THR 32 H THR 32 -5.701 6.635 0.916
197 HA THR 32 HA THR 32 -6.722 5.089 3.164
198 HB THR 32 HB THR 32 -7.900 6.360 0.650
199 HG1 THR 32 1HG THR 32 -9.082 7.382 2.553
200 HG21 THR 32 3HG2 THR 32 -9.779 5.321 2.686
201 HG22 THR 32 1HG2 THR 32 -9.878 5.224 0.912
202 HG23 THR 32 2HG2 THR 32 -8.927 4.022 1.817
203 H CYS 33 H CYS 33 -5.618 4.688 -0.199
204 HA CYS 33 HA CYS 33 -6.673 2.091 -0.477
205 HB2 CYS 33 1HB CYS 33 -5.408 1.952 -2.479
206 HB3 CYS 33 2HB CYS 33 -6.056 3.576 -2.360
207 H CYS 34 H CYS 34 -3.793 3.543 0.998
208 HA CYS 34 HA CYS 34 -2.102 1.363 0.987
209 HB2 CYS 34 1HB CYS 34 -2.398 3.555 3.050
210 HB3 CYS 34 2HB CYS 34 -1.062 2.423 2.983
211 H SER 35 H SER 35 -4.838 2.309 3.128
212 HA SER 35 HA SER 35 -4.351 0.167 4.922
213 HB2 SER 35 1HB SER 35 -5.410 2.238 5.704
214 HB3 SER 35 2HB SER 35 -6.727 2.045 4.564
215 HG SER 35 HG SER 35 -6.592 -0.245 5.996
216 H SER 36 H SER 36 -5.330 0.170 1.766
217 HA SER 36 HA SER 36 -7.032 -2.149 2.231
218 HB2 SER 36 1HB SER 36 -7.381 0.037 0.137
219 HB3 SER 36 2HB SER 36 -8.226 -1.496 0.069
220 HG SER 36 HG SER 36 -9.673 -0.602 1.359
221 H CYS 37 H CYS 37 -4.035 -1.431 1.533
222 HA CYS 37 HA CYS 37 -3.850 -3.462 -0.531
223 HB2 CYS 37 1HB CYS 37 -3.522 -0.733 -1.131
224 HB3 CYS 37 2HB CYS 37 -1.900 -1.391 -1.047
225 H PHE 38 H PHE 38 -3.382 -2.918 2.501
226 HA PHE 38 HA PHE 38 -0.850 -4.261 2.591
227 HB2 PHE 38 1HB PHE 38 -1.358 -1.468 3.781
228 HB3 PHE 38 2HB PHE 38 0.024 -2.453 4.220
229 HD1 PHE 38 1HD PHE 38 1.121 -3.474 1.822
230 HD2 PHE 38 2HD PHE 38 -0.743 0.289 2.437
231 HE1 PHE 38 1HE PHE 38 2.414 -2.519 -0.106
232 HE2 PHE 38 2HE PHE 38 0.550 1.244 0.509
233 HZ PHE 38 HZ PHE 38 2.113 -0.171 -0.739
234 H ASP 39 H ASP 39 -0.236 -4.569 5.076
235 HA ASP 39 HA ASP 39 -2.764 -5.193 6.378
236 HB2 ASP 39 1HB ASP 39 -1.430 -7.180 5.960
237 HB3 ASP 39 2HB ASP 39 0.020 -6.413 6.576
238 H VAL 40 H VAL 40 0.262 -5.474 8.150
239 HA VAL 40 HA VAL 40 -0.527 -3.209 9.805
240 HB VAL 40 HB VAL 40 -0.135 -5.499 10.740
241 HG11 VAL 40 1HG1 VAL 40 2.122 -6.327 11.015
242 HG12 VAL 40 2HG1 VAL 40 1.808 -6.065 9.283
243 HG13 VAL 40 3HG1 VAL 40 2.790 -4.895 10.196
244 HG21 VAL 40 3HG2 VAL 40 -0.020 -4.151 12.533
245 HG22 VAL 40 1HG2 VAL 40 1.742 -4.378 12.424
246 HG23 VAL 40 2HG2 VAL 40 0.980 -2.950 11.682
247 H VAL 41 H VAL 41 2.403 -4.592 8.162
248 HA VAL 41 HA VAL 41 3.913 -2.228 8.616
249 HB VAL 41 HB VAL 41 4.339 -4.546 6.719
250 HG11 VAL 41 1HG1 VAL 41 6.765 -3.856 6.941
251 HG12 VAL 41 2HG1 VAL 41 5.732 -2.743 6.012
252 HG13 VAL 41 3HG1 VAL 41 6.187 -2.346 7.687
253 HG21 VAL 41 3HG2 VAL 41 4.275 -5.536 8.831
254 HG22 VAL 41 1HG2 VAL 41 6.007 -5.190 8.606
255 HG23 VAL 41 2HG2 VAL 41 5.012 -4.125 9.628
256 H GLY 42 H GLY 42 2.956 -3.739 5.454
257 HA2 GLY 42 1HA GLY 42 3.373 -1.803 3.714
258 HA3 GLY 42 2HA GLY 42 1.904 -2.757 3.677
259 H GLU 43 H GLU 43 0.813 -1.725 6.236
260 HA GLU 43 HA GLU 43 -0.398 0.586 5.148
261 HB2 GLU 43 1HB GLU 43 -1.449 -1.229 6.673
262 HB3 GLU 43 2HB GLU 43 -0.671 -0.405 8.010
263 HG2 GLU 43 1HG GLU 43 -1.814 1.762 6.947
264 HG3 GLU 43 2HG GLU 43 -2.879 0.590 6.197
265 H GLN 44 H GLN 44 1.478 -0.001 8.218
266 HA GLN 44 HA GLN 44 1.756 2.730 8.724
267 HB2 GLN 44 1HB GLN 44 3.043 2.073 10.595
268 HB3 GLN 44 2HB GLN 44 1.958 0.720 10.347
269 HG2 GLN 44 1HG GLN 44 3.892 -0.252 8.837
270 HG3 GLN 44 2HG GLN 44 4.907 0.919 9.656
271 HE21 GLN 44 1HE2 GLN 44 5.748 0.426 11.546
272 HE22 GLN 44 2HE2 GLN 44 5.301 -0.900 12.567
273 H ALA 45 H ALA 45 3.266 0.646 6.441
274 HA ALA 45 HA ALA 45 5.766 2.099 6.396
275 HB1 ALA 45 3HB ALA 45 6.319 0.515 4.592
276 HB2 ALA 45 1HB ALA 45 5.683 -0.345 6.015
277 HB3 ALA 45 2HB ALA 45 4.643 -0.085 4.594
278 H CYS 46 H CYS 46 2.774 1.695 4.407
279 HA CYS 46 HA CYS 46 3.668 3.470 2.402
280 HB2 CYS 46 1HB CYS 46 2.024 1.756 1.932
281 HB3 CYS 46 2HB CYS 46 0.908 2.447 3.093
282 H GLN 47 H GLN 47 2.088 3.736 5.561
283 HA GLN 47 HA GLN 47 0.819 6.141 5.277
284 HB2 GLN 47 1HB GLN 47 1.987 4.589 7.557
285 HB3 GLN 47 2HB GLN 47 1.624 6.274 7.872
286 HG2 GLN 47 1HG GLN 47 -0.690 5.651 6.653
287 HG3 GLN 47 2HG GLN 47 -0.259 4.027 7.152
288 HE21 GLN 47 1HE2 GLN 47 0.096 7.275 8.579
289 HE22 GLN 47 2HE2 GLN 47 -0.652 6.928 10.102
290 H MET 48 H MET 48 4.264 5.421 6.097
291 HA MET 48 HA MET 48 4.914 8.129 6.490
292 HB2 MET 48 1HB MET 48 6.285 5.476 6.350
293 HB3 MET 48 2HB MET 48 7.299 6.817 5.853
294 HG2 MET 48 1HG MET 48 6.313 7.950 8.085
295 HG3 MET 48 2HG MET 48 6.049 6.281 8.550
296 HE1 MET 48 3HE MET 48 8.397 5.127 10.042
297 HE2 MET 48 1HE MET 48 8.998 6.702 10.613
298 HE3 MET 48 2HE MET 48 7.251 6.444 10.390
299 H SER 49 H SER 49 5.190 5.828 3.723
300 HA SER 49 HA SER 49 6.491 7.788 2.123
301 HB2 SER 49 1HB SER 49 5.508 4.964 1.732
302 HB3 SER 49 2HB SER 49 5.836 5.931 0.308
303 HG SER 49 HG SER 49 7.707 5.433 2.465
304 H ALA 50 H ALA 50 3.427 7.664 3.289
305 HA ALA 50 HA ALA 50 1.804 7.869 1.013
306 HB1 ALA 50 3HB ALA 50 0.142 8.696 2.571
307 HB2 ALA 50 1HB ALA 50 1.078 7.417 3.381
308 HB3 ALA 50 2HB ALA 50 1.400 9.127 3.755
309 H GLN 51 H GLN 51 3.068 9.200 -0.469
310 HA GLN 51 HA GLN 51 3.413 11.940 0.356
311 HB2 GLN 51 1HB GLN 51 4.811 10.185 -1.372
312 HB3 GLN 51 2HB GLN 51 4.091 11.380 -2.432
313 HG2 GLN 51 1HG GLN 51 6.297 12.170 -1.703
314 HG3 GLN 51 2HG GLN 51 5.059 13.212 -1.030
315 HE21 GLN 51 1HE2 GLN 51 7.043 10.358 -0.345
316 HE22 GLN 51 2HE2 GLN 51 7.207 10.598 1.362
317 H CYS 52 H CYS 52 0.774 11.569 0.436
318 HA CYS 52 HA CYS 52 -0.324 12.162 -2.182
319 HB2 CYS 52 1HB CYS 52 -2.133 12.124 0.140
320 HB3 CYS 52 2HB CYS 52 -2.296 11.382 -1.439
Start of MODEL 6
1 H1 ASN 1 1H ASN 1 11.202 -5.415 1.476
2 HA ASN 1 HA ASN 1 9.894 -3.929 -0.620
3 HB2 ASN 1 1HB ASN 1 10.946 -6.691 -0.244
4 HB3 ASN 1 2HB ASN 1 9.426 -6.640 -1.114
5 HD21 ASN 1 1HD2 ASN 1 12.733 -6.413 -1.341
6 HD22 ASN 1 2HD2 ASN 1 12.900 -5.688 -2.905
7 HA PRO 2 HA PRO 2 5.948 -4.736 1.117
8 HB2 PRO 2 1HB PRO 2 4.330 -4.592 -1.081
9 HB3 PRO 2 2HB PRO 2 4.933 -3.178 -0.241
10 HG2 PRO 2 1HG PRO 2 5.805 -4.307 -2.829
11 HG3 PRO 2 2HG PRO 2 6.079 -2.701 -2.184
12 HD2 PRO 2 1HD PRO 2 7.976 -4.849 -2.302
13 HD3 PRO 2 2HD PRO 2 8.212 -3.283 -1.553
14 H GLU 3 H GLU 3 7.583 -6.949 -0.577
15 HA GLU 3 HA GLU 3 5.655 -8.786 -1.251
16 HB2 GLU 3 1HB GLU 3 7.454 -10.387 -1.360
17 HB3 GLU 3 2HB GLU 3 8.115 -8.840 -1.851
18 HG2 GLU 3 1HG GLU 3 8.962 -8.492 0.503
19 HG3 GLU 3 2HG GLU 3 8.365 -10.084 0.929
20 H ASP 4 H ASP 4 7.164 -7.998 1.890
21 HA ASP 4 HA ASP 4 6.099 -10.306 3.150
22 HB2 ASP 4 1HB ASP 4 8.150 -8.666 3.758
23 HB3 ASP 4 2HB ASP 4 6.914 -7.838 4.683
24 H TRP 5 H TRP 5 4.962 -7.170 2.183
25 HA TRP 5 HA TRP 5 2.674 -7.415 4.017
26 HB2 TRP 5 1HB TRP 5 3.140 -4.737 2.978
27 HB3 TRP 5 2HB TRP 5 2.798 -5.277 4.609
28 HD1 TRP 5 HD TRP 5 5.307 -6.744 5.564
29 HE1 TRP 5 1HE TRP 5 7.726 -5.702 5.732
30 HE3 TRP 5 3HE TRP 5 4.501 -3.006 2.212
31 HZ2 TRP 5 2HZ TRP 5 9.002 -3.482 4.474
32 HZ3 TRP 5 3HZ TRP 5 6.386 -1.444 1.739
33 HH2 TRP 5 HH TRP 5 8.576 -1.637 2.808
34 H PHE 6 H PHE 6 1.325 -5.195 2.535
35 HA PHE 6 HA PHE 6 -0.091 -4.960 0.863
36 HB2 PHE 6 1HB PHE 6 1.870 -4.615 -0.537
37 HB3 PHE 6 2HB PHE 6 2.322 -6.306 -0.451
38 HD1 PHE 6 2HD PHE 6 -0.666 -4.344 -1.561
39 HD2 PHE 6 1HD PHE 6 2.069 -7.476 -2.408
40 HE1 PHE 6 2HE PHE 6 -1.826 -4.766 -3.746
41 HE2 PHE 6 1HE PHE 6 0.908 -7.898 -4.594
42 HZ PHE 6 HZ PHE 6 -1.025 -6.538 -5.236
43 H THR 7 H THR 7 -2.009 -6.015 0.729
44 HA THR 7 HA THR 7 -1.899 -8.938 0.372
45 HB THR 7 HB THR 7 -4.112 -8.871 1.597
46 HG1 THR 7 1HG THR 7 -4.265 -6.483 0.840
47 HG21 THR 7 3HG2 THR 7 -3.186 -8.668 3.737
48 HG22 THR 7 1HG2 THR 7 -1.684 -8.799 2.791
49 HG23 THR 7 2HG2 THR 7 -2.273 -7.201 3.309
50 HA PRO 8 HA PRO 8 -3.697 -7.656 -3.447
51 HB2 PRO 8 1HB PRO 8 -2.780 -9.761 -4.928
52 HB3 PRO 8 2HB PRO 8 -1.889 -8.264 -4.738
53 HG2 PRO 8 1HG PRO 8 -1.391 -10.890 -3.475
54 HG3 PRO 8 2HG PRO 8 -0.302 -9.526 -3.639
55 HD2 PRO 8 1HD PRO 8 -1.709 -10.324 -1.270
56 HD3 PRO 8 2HD PRO 8 -0.712 -8.896 -1.467
57 H ASP 9 H ASP 9 -4.206 -10.207 -1.369
58 HA ASP 9 HA ASP 9 -6.140 -11.502 -2.986
59 HB2 ASP 9 1HB ASP 9 -4.760 -12.007 -0.545
60 HB3 ASP 9 2HB ASP 9 -6.457 -11.947 -0.112
61 H THR 10 H THR 10 -6.022 -8.544 -1.340
62 HA THR 10 HA THR 10 -8.931 -8.380 -1.278
63 HB THR 10 HB THR 10 -8.299 -9.063 1.021
64 HG1 THR 10 1HG THR 10 -9.506 -7.331 1.827
65 HG21 THR 10 3HG2 THR 10 -6.432 -8.266 2.070
66 HG22 THR 10 1HG2 THR 10 -5.993 -7.438 0.557
67 HG23 THR 10 2HG2 THR 10 -6.957 -6.588 1.789
68 H CYS 11 H CYS 11 -7.120 -7.424 -3.231
69 HA CYS 11 HA CYS 11 -7.643 -4.596 -2.879
70 HB2 CYS 11 1HB CYS 11 -5.212 -5.283 -2.179
71 HB3 CYS 11 2HB CYS 11 -4.938 -5.382 -3.907
72 H ALA 12 H ALA 12 -6.774 -3.565 -5.214
73 HA ALA 12 HA ALA 12 -8.154 -5.211 -7.188
74 HB1 ALA 12 3HB ALA 12 -7.259 -2.303 -7.304
75 HB2 ALA 12 1HB ALA 12 -8.356 -3.129 -8.436
76 HB3 ALA 12 2HB ALA 12 -8.861 -2.848 -6.753
77 H TYR 13 H TYR 13 -4.994 -3.762 -6.369
78 HA TYR 13 HA TYR 13 -3.869 -4.505 -8.922
79 HB2 TYR 13 1HB TYR 13 -2.601 -3.593 -6.267
80 HB3 TYR 13 2HB TYR 13 -1.855 -3.474 -7.848
81 HD1 TYR 13 1HD TYR 13 -3.580 -2.172 -9.611
82 HD2 TYR 13 2HD TYR 13 -3.280 -1.567 -5.387
83 HE1 TYR 13 1HE TYR 13 -4.524 0.175 -9.873
84 HE2 TYR 13 2HE TYR 13 -4.225 0.777 -5.662
85 HH TYR 13 HH TYR 13 -4.947 2.274 -7.033
86 H GLY 14 H GLY 14 -2.374 -6.169 -9.310
87 HA2 GLY 14 1HA GLY 14 -2.392 -8.292 -7.277
88 HA3 GLY 14 2HA GLY 14 -2.076 -8.475 -8.991
89 H ASP 15 H ASP 15 -0.406 -5.749 -8.532
90 HA ASP 15 HA ASP 15 2.002 -7.238 -7.911
91 HB2 ASP 15 1HB ASP 15 1.971 -4.383 -8.913
92 HB3 ASP 15 2HB ASP 15 3.187 -5.618 -9.172
93 H SER 16 H SER 16 3.455 -6.463 -6.240
94 HA SER 16 HA SER 16 2.138 -4.852 -4.277
95 HB2 SER 16 1HB SER 16 3.901 -5.542 -2.789
96 HB3 SER 16 2HB SER 16 3.461 -6.946 -3.741
97 HG SER 16 HG SER 16 5.477 -7.048 -4.427
98 H ASN 17 H ASN 17 4.932 -4.682 -6.529
99 HA ASN 17 HA ASN 17 6.046 -2.375 -5.479
100 HB2 ASN 17 1HB ASN 17 6.250 -3.980 -7.973
101 HB3 ASN 17 2HB ASN 17 6.590 -2.280 -8.231
102 HD21 ASN 17 1HD2 ASN 17 8.338 -4.624 -8.307
103 HD22 ASN 17 2HD2 ASN 17 9.632 -4.338 -7.192
104 H THR 18 H THR 18 3.723 -2.979 -8.215
105 HA THR 18 HA THR 18 3.381 -0.219 -8.812
106 HB THR 18 HB THR 18 2.943 -2.580 -10.121
107 HG1 THR 18 1HG THR 18 1.427 -0.071 -10.312
108 HG21 THR 18 3HG2 THR 18 0.134 -1.553 -9.626
109 HG22 THR 18 1HG2 THR 18 0.651 -3.126 -10.278
110 HG23 THR 18 2HG2 THR 18 0.801 -2.792 -8.536
111 H ALA 19 H ALA 19 1.787 -2.538 -6.623
112 HA ALA 19 HA ALA 19 -0.517 -1.032 -6.155
113 HB1 ALA 19 3HB ALA 19 -0.583 -3.254 -5.428
114 HB2 ALA 19 1HB ALA 19 1.027 -3.164 -4.676
115 HB3 ALA 19 2HB ALA 19 -0.363 -2.368 -3.900
116 H TRP 20 H TRP 20 2.562 -1.259 -4.226
117 HA TRP 20 HA TRP 20 1.921 0.699 -2.392
118 HB2 TRP 20 1HB TRP 20 3.753 -0.742 -1.993
119 HB3 TRP 20 2HB TRP 20 4.552 -0.283 -3.484
120 HD1 TRP 20 HD TRP 20 5.172 2.611 -3.453
121 HE1 TRP 20 1HE TRP 20 6.384 3.994 -1.560
122 HE3 TRP 20 3HE TRP 20 4.186 -0.671 0.304
123 HZ2 TRP 20 2HZ TRP 20 6.785 3.569 1.234
124 HZ3 TRP 20 3HZ TRP 20 5.024 -0.112 2.584
125 HH2 TRP 20 HH TRP 20 6.282 1.925 3.078
126 H THR 21 H THR 21 3.733 0.949 -5.536
127 HA THR 21 HA THR 21 4.148 3.688 -5.474
128 HB THR 21 HB THR 21 4.130 1.457 -7.459
129 HG1 THR 21 1HG THR 21 6.222 2.110 -7.160
130 HG21 THR 21 3HG2 THR 21 4.719 3.466 -9.167
131 HG22 THR 21 1HG2 THR 21 3.068 2.812 -9.049
132 HG23 THR 21 2HG2 THR 21 3.493 4.315 -8.195
133 H THR 22 H THR 22 1.445 1.912 -7.127
134 HA THR 22 HA THR 22 0.078 4.213 -7.890
135 HB THR 22 HB THR 22 -0.846 1.360 -7.267
136 HG1 THR 22 1HG THR 22 0.796 1.762 -8.969
137 HG21 THR 22 3HG2 THR 22 -2.194 3.690 -8.716
138 HG22 THR 22 1HG2 THR 22 -2.621 1.992 -9.039
139 HG23 THR 22 2HG2 THR 22 -2.874 2.681 -7.417
140 H CYS 23 H CYS 23 0.593 2.896 -4.735
141 HA CYS 23 HA CYS 23 -1.810 4.116 -3.692
142 HB2 CYS 23 1HB CYS 23 0.097 2.107 -2.800
143 HB3 CYS 23 2HB CYS 23 -0.220 3.296 -1.552
144 H THR 24 H THR 24 1.765 4.516 -3.800
145 HA THR 24 HA THR 24 1.645 6.877 -2.124
146 HB THR 24 HB THR 24 4.205 6.758 -2.912
147 HG1 THR 24 1HG THR 24 3.463 3.988 -3.130
148 HG21 THR 24 3HG2 THR 24 4.655 4.961 -1.231
149 HG22 THR 24 1HG2 THR 24 3.476 6.135 -0.601
150 HG23 THR 24 2HG2 THR 24 2.921 4.557 -1.208
151 H THR 25 H THR 25 -0.068 7.603 -3.918
152 HA THR 25 HA THR 25 1.427 9.512 -5.535
153 HB THR 25 HB THR 25 -0.275 8.848 -7.443
154 HG1 THR 25 1HG THR 25 -1.490 7.363 -6.107
155 HG21 THR 25 3HG2 THR 25 1.412 6.477 -7.285
156 HG22 THR 25 1HG2 THR 25 1.546 7.857 -8.401
157 HG23 THR 25 2HG2 THR 25 2.357 7.911 -6.818
158 HA PRO 26 HA PRO 26 -1.767 12.143 -4.408
159 HB2 PRO 26 1HB PRO 26 -1.962 13.867 -6.520
160 HB3 PRO 26 2HB PRO 26 -0.707 13.981 -5.302
161 HG2 PRO 26 1HG PRO 26 -0.510 12.989 -8.080
162 HG3 PRO 26 2HG PRO 26 0.774 13.506 -7.005
163 HD2 PRO 26 1HD PRO 26 0.074 10.804 -7.669
164 HD3 PRO 26 2HD PRO 26 1.280 11.319 -6.507
165 H GLY 27 H GLY 27 -3.888 11.928 -4.076
166 HA2 GLY 27 1HA GLY 27 -5.667 11.790 -6.294
167 HA3 GLY 27 2HA GLY 27 -5.403 10.200 -5.606
168 H GLN 28 H GLN 28 -7.445 9.902 -4.657
169 HA GLN 28 HA GLN 28 -8.136 11.891 -2.640
170 HB2 GLN 28 1HB GLN 28 -10.465 11.159 -2.887
171 HB3 GLN 28 2HB GLN 28 -9.817 11.621 -4.449
172 HG2 GLN 28 1HG GLN 28 -9.345 9.207 -4.955
173 HG3 GLN 28 2HG GLN 28 -10.024 8.757 -3.403
174 HE21 GLN 28 1HE2 GLN 28 -11.296 7.478 -5.072
175 HE22 GLN 28 2HE2 GLN 28 -12.793 8.157 -5.616
176 H THR 29 H THR 29 -7.877 8.374 -3.392
177 HA THR 29 HA THR 29 -7.949 7.859 -0.491
178 HB THR 29 HB THR 29 -8.635 5.513 -1.302
179 HG1 THR 29 1HG THR 29 -9.446 5.704 -3.608
180 HG21 THR 29 3HG2 THR 29 -10.711 6.358 -0.825
181 HG22 THR 29 1HG2 THR 29 -10.237 7.984 -1.371
182 HG23 THR 29 2HG2 THR 29 -10.828 6.787 -2.548
183 H CYS 30 H CYS 30 -5.597 8.898 -1.598
184 HA CYS 30 HA CYS 30 -3.866 6.911 -2.511
185 HB2 CYS 30 1HB CYS 30 -3.166 9.069 -2.940
186 HB3 CYS 30 2HB CYS 30 -3.530 9.636 -1.322
187 H TYR 31 H TYR 31 -4.168 8.487 0.765
188 HA TYR 31 HA TYR 31 -2.551 6.483 1.990
189 HB2 TYR 31 1HB TYR 31 -2.668 8.811 2.820
190 HB3 TYR 31 2HB TYR 31 -4.419 8.763 2.863
191 HD1 TYR 31 2HD TYR 31 -5.578 7.353 4.613
192 HD2 TYR 31 1HD TYR 31 -1.362 8.080 4.681
193 HE1 TYR 31 2HE TYR 31 -5.492 6.669 7.060
194 HE2 TYR 31 1HE TYR 31 -1.291 7.393 7.127
195 HH TYR 31 HH TYR 31 -3.702 5.711 8.597
196 H THR 32 H THR 32 -5.883 6.689 1.053
197 HA THR 32 HA THR 32 -6.934 5.089 3.176
198 HB THR 32 HB THR 32 -7.890 6.105 0.467
199 HG1 THR 32 1HG THR 32 -9.430 7.020 2.208
200 HG21 THR 32 3HG2 THR 32 -8.890 3.756 1.178
201 HG22 THR 32 1HG2 THR 32 -9.683 4.688 2.471
202 HG23 THR 32 2HG2 THR 32 -10.011 5.076 0.765
203 H CYS 33 H CYS 33 -5.631 4.471 -0.110
204 HA CYS 33 HA CYS 33 -6.385 1.739 -0.046
205 HB2 CYS 33 1HB CYS 33 -5.214 1.522 -2.093
206 HB3 CYS 33 2HB CYS 33 -6.056 3.059 -2.123
207 H CYS 34 H CYS 34 -3.826 3.712 1.295
208 HA CYS 34 HA CYS 34 -1.792 1.793 1.373
209 HB2 CYS 34 1HB CYS 34 -2.353 4.270 2.996
210 HB3 CYS 34 2HB CYS 34 -0.965 3.249 3.314
211 H SER 35 H SER 35 -4.872 1.957 2.859
212 HA SER 35 HA SER 35 -3.945 0.243 5.030
213 HB2 SER 35 1HB SER 35 -5.003 2.244 5.908
214 HB3 SER 35 2HB SER 35 -6.370 2.073 4.825
215 HG SER 35 HG SER 35 -5.925 -0.183 6.434
216 H SER 36 H SER 36 -5.177 0.111 1.972
217 HA SER 36 HA SER 36 -6.958 -2.099 2.646
218 HB2 SER 36 1HB SER 36 -8.200 -1.661 0.649
219 HB3 SER 36 2HB SER 36 -7.948 -0.100 1.403
220 HG SER 36 HG SER 36 -7.510 -0.082 -0.909
221 H CYS 37 H CYS 37 -4.288 -0.899 0.556
222 HA CYS 37 HA CYS 37 -3.978 -3.551 -0.577
223 HB2 CYS 37 1HB CYS 37 -3.489 -0.911 -1.495
224 HB3 CYS 37 2HB CYS 37 -1.934 -1.712 -1.397
225 H PHE 38 H PHE 38 -3.529 -2.838 2.348
226 HA PHE 38 HA PHE 38 -0.965 -4.108 2.564
227 HB2 PHE 38 1HB PHE 38 -1.594 -1.258 3.525
228 HB3 PHE 38 2HB PHE 38 -0.258 -2.178 4.187
229 HD1 PHE 38 1HD PHE 38 0.877 -3.469 1.817
230 HD2 PHE 38 2HD PHE 38 -0.649 0.462 2.295
231 HE1 PHE 38 1HE PHE 38 2.353 -2.669 -0.049
232 HE2 PHE 38 2HE PHE 38 0.828 1.262 0.430
233 HZ PHE 38 HZ PHE 38 2.311 -0.313 -0.720
234 H ASP 39 H ASP 39 -0.419 -4.391 5.030
235 HA ASP 39 HA ASP 39 -2.967 -4.930 6.331
236 HB2 ASP 39 1HB ASP 39 -1.677 -6.958 5.937
237 HB3 ASP 39 2HB ASP 39 -0.218 -6.224 6.574
238 H VAL 40 H VAL 40 0.021 -5.290 8.138
239 HA VAL 40 HA VAL 40 -0.694 -2.969 9.745
240 HB VAL 40 HB VAL 40 -0.390 -5.227 10.745
241 HG11 VAL 40 1HG1 VAL 40 1.804 -6.200 10.981
242 HG12 VAL 40 2HG1 VAL 40 1.489 -5.930 9.250
243 HG13 VAL 40 3HG1 VAL 40 2.557 -4.822 10.143
244 HG21 VAL 40 3HG2 VAL 40 1.233 -4.406 12.569
245 HG22 VAL 40 1HG2 VAL 40 1.338 -2.906 11.616
246 HG23 VAL 40 2HG2 VAL 40 -0.231 -3.441 12.265
247 H VAL 41 H VAL 41 2.208 -4.466 8.152
248 HA VAL 41 HA VAL 41 3.789 -2.150 8.573
249 HB VAL 41 HB VAL 41 4.155 -4.460 6.656
250 HG11 VAL 41 1HG1 VAL 41 6.576 -3.899 6.884
251 HG12 VAL 41 2HG1 VAL 41 5.621 -2.622 6.092
252 HG13 VAL 41 3HG1 VAL 41 6.115 -2.439 7.792
253 HG21 VAL 41 3HG2 VAL 41 4.697 -4.163 9.599
254 HG22 VAL 41 1HG2 VAL 41 4.011 -5.539 8.703
255 HG23 VAL 41 2HG2 VAL 41 5.753 -5.190 8.600
256 H GLY 42 H GLY 42 2.579 -3.648 5.485
257 HA2 GLY 42 1HA GLY 42 3.117 -1.768 3.684
258 HA3 GLY 42 2HA GLY 42 1.592 -2.630 3.704
259 H GLU 43 H GLU 43 0.753 -1.448 6.350
260 HA GLU 43 HA GLU 43 -0.379 0.909 5.234
261 HB2 GLU 43 1HB GLU 43 -1.502 -0.822 6.813
262 HB3 GLU 43 2HB GLU 43 -0.644 -0.022 8.115
263 HG2 GLU 43 1HG GLU 43 -1.671 2.186 7.293
264 HG3 GLU 43 2HG GLU 43 -2.670 1.236 6.212
265 H GLN 44 H GLN 44 1.539 0.220 8.255
266 HA GLN 44 HA GLN 44 2.007 2.917 8.757
267 HB2 GLN 44 1HB GLN 44 3.410 2.163 10.532
268 HB3 GLN 44 2HB GLN 44 2.164 0.940 10.382
269 HG2 GLN 44 1HG GLN 44 3.763 -0.631 10.062
270 HG3 GLN 44 2HG GLN 44 4.234 0.166 8.574
271 HE21 GLN 44 1HE2 GLN 44 5.847 1.787 8.610
272 HE22 GLN 44 2HE2 GLN 44 7.057 1.840 9.849
273 H ALA 45 H ALA 45 3.328 0.747 6.417
274 HA ALA 45 HA ALA 45 5.874 2.108 6.250
275 HB1 ALA 45 3HB ALA 45 4.599 -0.058 4.529
276 HB2 ALA 45 1HB ALA 45 6.292 0.484 4.443
277 HB3 ALA 45 2HB ALA 45 5.693 -0.335 5.905
278 H CYS 46 H CYS 46 2.792 1.784 4.387
279 HA CYS 46 HA CYS 46 3.694 3.574 2.370
280 HB2 CYS 46 1HB CYS 46 2.086 1.803 1.891
281 HB3 CYS 46 2HB CYS 46 0.933 2.512 3.004
282 H GLN 47 H GLN 47 2.191 3.765 5.548
283 HA GLN 47 HA GLN 47 0.861 6.176 5.247
284 HB2 GLN 47 1HB GLN 47 1.857 4.511 7.521
285 HB3 GLN 47 2HB GLN 47 1.541 6.194 7.892
286 HG2 GLN 47 1HG GLN 47 -0.710 5.605 6.439
287 HG3 GLN 47 2HG GLN 47 -0.373 4.027 7.123
288 HE21 GLN 47 1HE2 GLN 47 -1.729 3.754 8.731
289 HE22 GLN 47 2HE2 GLN 47 -2.014 4.840 10.050
290 H MET 48 H MET 48 4.182 5.442 6.530
291 HA MET 48 HA MET 48 4.824 8.134 6.902
292 HB2 MET 48 1HB MET 48 7.171 7.213 7.109
293 HB3 MET 48 2HB MET 48 6.015 6.292 8.051
294 HG2 MET 48 1HG MET 48 5.912 4.535 6.358
295 HG3 MET 48 2HG MET 48 6.829 5.499 5.218
296 HE1 MET 48 3HE MET 48 8.881 6.071 5.173
297 HE2 MET 48 1HE MET 48 10.121 5.973 6.447
298 HE3 MET 48 2HE MET 48 9.933 4.639 5.283
299 H SER 49 H SER 49 5.015 5.922 4.120
300 HA SER 49 HA SER 49 6.575 7.878 2.672
301 HB2 SER 49 1HB SER 49 5.994 4.973 2.406
302 HB3 SER 49 2HB SER 49 6.057 5.837 0.883
303 HG SER 49 HG SER 49 8.150 4.961 1.660
304 H ALA 50 H ALA 50 3.496 7.805 3.549
305 HA ALA 50 HA ALA 50 2.004 7.698 1.185
306 HB1 ALA 50 3HB ALA 50 1.164 7.578 3.564
307 HB2 ALA 50 1HB ALA 50 1.441 9.332 3.689
308 HB3 ALA 50 2HB ALA 50 0.257 8.698 2.520
309 H GLN 51 H GLN 51 3.342 8.821 -0.398
310 HA GLN 51 HA GLN 51 3.606 11.661 0.058
311 HB2 GLN 51 1HB GLN 51 5.378 9.948 -0.995
312 HB3 GLN 51 2HB GLN 51 4.521 10.315 -2.478
313 HG2 GLN 51 1HG GLN 51 4.922 12.737 -2.157
314 HG3 GLN 51 2HG GLN 51 5.681 12.433 -0.607
315 HE21 GLN 51 1HE2 GLN 51 7.213 13.792 -2.109
316 HE22 GLN 51 2HE2 GLN 51 8.468 12.889 -2.891
317 H CYS 52 H CYS 52 1.069 11.612 0.003
318 HA CYS 52 HA CYS 52 -0.007 11.380 -2.654
319 HB2 CYS 52 1HB CYS 52 -1.538 12.479 -0.326
320 HB3 CYS 52 2HB CYS 52 -2.109 11.548 -1.697
Start of MODEL 7
1 H1 ASN 1 1H ASN 1 9.563 -2.612 -0.194
2 HA ASN 1 HA ASN 1 9.360 -4.253 -1.987
3 HB2 ASN 1 1HB ASN 1 11.540 -5.402 -0.453
4 HB3 ASN 1 2HB ASN 1 10.220 -6.555 -0.465
5 HD21 ASN 1 1HD2 ASN 1 12.947 -6.080 -1.890
6 HD22 ASN 1 2HD2 ASN 1 12.633 -6.488 -3.544
7 HA PRO 2 HA PRO 2 6.068 -4.841 0.998
8 HB2 PRO 2 1HB PRO 2 3.990 -4.622 -0.763
9 HB3 PRO 2 2HB PRO 2 4.691 -3.247 0.068
10 HG2 PRO 2 1HG PRO 2 5.015 -4.070 -2.753
11 HG3 PRO 2 2HG PRO 2 5.342 -2.512 -2.019
12 HD2 PRO 2 1HD PRO 2 7.274 -4.492 -2.775
13 HD3 PRO 2 2HD PRO 2 7.590 -2.986 -1.936
14 H GLU 3 H GLU 3 7.564 -6.994 0.429
15 HA GLU 3 HA GLU 3 5.820 -8.883 -0.834
16 HB2 GLU 3 1HB GLU 3 7.662 -10.353 -0.834
17 HB3 GLU 3 2HB GLU 3 8.413 -8.779 -1.003
18 HG2 GLU 3 1HG GLU 3 8.818 -8.714 1.472
19 HG3 GLU 3 2HG GLU 3 8.084 -10.297 1.628
20 H ASP 4 H ASP 4 7.183 -8.206 2.446
21 HA ASP 4 HA ASP 4 5.876 -10.413 3.604
22 HB2 ASP 4 1HB ASP 4 6.758 -7.913 5.093
23 HB3 ASP 4 2HB ASP 4 6.707 -9.559 5.693
24 H TRP 5 H TRP 5 4.942 -7.225 2.576
25 HA TRP 5 HA TRP 5 2.537 -7.350 4.266
26 HB2 TRP 5 1HB TRP 5 3.115 -4.754 3.083
27 HB3 TRP 5 2HB TRP 5 2.689 -5.182 4.728
28 HD1 TRP 5 HD TRP 5 5.124 -6.653 5.869
29 HE1 TRP 5 1HE TRP 5 7.556 -5.653 6.085
30 HE3 TRP 5 3HE TRP 5 4.542 -3.088 2.291
31 HZ2 TRP 5 2HZ TRP 5 8.933 -3.530 4.764
32 HZ3 TRP 5 3HZ TRP 5 6.479 -1.593 1.815
33 HH2 TRP 5 HH TRP 5 8.617 -1.771 2.985
34 H PHE 6 H PHE 6 1.283 -5.218 2.606
35 HA PHE 6 HA PHE 6 -0.060 -5.065 0.866
36 HB2 PHE 6 1HB PHE 6 1.953 -4.798 -0.469
37 HB3 PHE 6 2HB PHE 6 2.403 -6.479 -0.265
38 HD1 PHE 6 2HD PHE 6 -0.521 -4.582 -1.629
39 HD2 PHE 6 1HD PHE 6 2.224 -7.776 -2.150
40 HE1 PHE 6 2HE PHE 6 -1.582 -5.135 -3.835
41 HE2 PHE 6 1HE PHE 6 1.163 -8.328 -4.356
42 HZ PHE 6 HZ PHE 6 -0.728 -7.001 -5.173
43 H THR 7 H THR 7 -1.978 -6.116 0.700
44 HA THR 7 HA THR 7 -1.873 -9.055 0.512
45 HB THR 7 HB THR 7 -4.104 -8.944 1.647
46 HG1 THR 7 1HG THR 7 -4.415 -6.698 0.668
47 HG21 THR 7 3HG2 THR 7 -2.562 -7.018 3.337
48 HG22 THR 7 1HG2 THR 7 -3.250 -8.601 3.771
49 HG23 THR 7 2HG2 THR 7 -1.693 -8.512 2.913
50 HA PRO 8 HA PRO 8 -3.453 -8.003 -3.467
51 HB2 PRO 8 1HB PRO 8 -2.497 -10.214 -4.759
52 HB3 PRO 8 2HB PRO 8 -1.592 -8.720 -4.618
53 HG2 PRO 8 1HG PRO 8 -1.207 -11.265 -3.164
54 HG3 PRO 8 2HG PRO 8 -0.087 -9.930 -3.356
55 HD2 PRO 8 1HD PRO 8 -1.630 -10.552 -1.020
56 HD3 PRO 8 2HD PRO 8 -0.600 -9.154 -1.254
57 H ASP 9 H ASP 9 -4.277 -10.162 -1.172
58 HA ASP 9 HA ASP 9 -6.092 -11.629 -2.826
59 HB2 ASP 9 1HB ASP 9 -5.591 -11.536 0.181
60 HB3 ASP 9 2HB ASP 9 -6.831 -12.547 -0.534
61 H THR 10 H THR 10 -5.958 -8.634 -1.084
62 HA THR 10 HA THR 10 -8.868 -8.351 -1.324
63 HB THR 10 HB THR 10 -8.394 -8.902 1.041
64 HG1 THR 10 1HG THR 10 -9.866 -7.081 0.360
65 HG21 THR 10 3HG2 THR 10 -7.026 -7.207 2.369
66 HG22 THR 10 1HG2 THR 10 -6.047 -8.229 1.290
67 HG23 THR 10 2HG2 THR 10 -6.437 -6.557 0.820
68 H CYS 11 H CYS 11 -6.926 -7.570 -3.231
69 HA CYS 11 HA CYS 11 -7.436 -4.731 -3.141
70 HB2 CYS 11 1HB CYS 11 -5.000 -5.551 -2.224
71 HB3 CYS 11 2HB CYS 11 -4.659 -5.333 -3.930
72 H ALA 12 H ALA 12 -7.218 -3.784 -5.345
73 HA ALA 12 HA ALA 12 -7.664 -5.838 -7.361
74 HB1 ALA 12 3HB ALA 12 -9.378 -4.289 -7.500
75 HB2 ALA 12 1HB ALA 12 -8.340 -2.933 -7.000
76 HB3 ALA 12 2HB ALA 12 -8.224 -3.579 -8.654
77 H TYR 13 H TYR 13 -5.058 -5.969 -6.612
78 HA TYR 13 HA TYR 13 -3.733 -4.814 -8.943
79 HB2 TYR 13 1HB TYR 13 -2.733 -4.784 -6.027
80 HB3 TYR 13 2HB TYR 13 -1.863 -4.117 -7.394
81 HD1 TYR 13 1HD TYR 13 -5.003 -3.721 -5.412
82 HD2 TYR 13 2HD TYR 13 -2.180 -1.873 -8.043
83 HE1 TYR 13 1HE TYR 13 -6.108 -1.464 -5.024
84 HE2 TYR 13 2HE TYR 13 -3.295 0.378 -7.646
85 HH TYR 13 HH TYR 13 -5.990 0.676 -5.358
86 H GLY 14 H GLY 14 -2.415 -6.275 -9.945
87 HA2 GLY 14 1HA GLY 14 -2.067 -8.866 -8.615
88 HA3 GLY 14 2HA GLY 14 -1.919 -8.526 -10.328
89 H ASP 15 H ASP 15 -0.462 -6.279 -8.015
90 HA ASP 15 HA ASP 15 2.065 -7.606 -8.120
91 HB2 ASP 15 1HB ASP 15 1.966 -4.766 -9.181
92 HB3 ASP 15 2HB ASP 15 3.268 -5.930 -9.322
93 H SER 16 H SER 16 3.447 -6.801 -6.406
94 HA SER 16 HA SER 16 2.047 -5.230 -4.482
95 HB2 SER 16 1HB SER 16 3.952 -5.745 -3.012
96 HB3 SER 16 2HB SER 16 3.388 -7.201 -3.808
97 HG SER 16 HG SER 16 5.808 -5.747 -4.183
98 H ASN 17 H ASN 17 4.740 -4.878 -6.802
99 HA ASN 17 HA ASN 17 5.826 -2.568 -5.730
100 HB2 ASN 17 1HB ASN 17 6.211 -4.224 -8.030
101 HB3 ASN 17 2HB ASN 17 5.951 -2.609 -8.659
102 HD21 ASN 17 1HD2 ASN 17 8.245 -3.163 -9.298
103 HD22 ASN 17 2HD2 ASN 17 9.516 -2.643 -8.242
104 H THR 18 H THR 18 3.394 -3.157 -8.376
105 HA THR 18 HA THR 18 2.922 -0.414 -8.885
106 HB THR 18 HB THR 18 2.485 -2.642 -10.281
107 HG1 THR 18 1HG THR 18 0.719 -1.290 -11.300
108 HG21 THR 18 3HG2 THR 18 -0.309 -2.122 -9.195
109 HG22 THR 18 1HG2 THR 18 0.262 -3.494 -10.174
110 HG23 THR 18 2HG2 THR 18 0.719 -3.374 -8.458
111 H ALA 19 H ALA 19 1.611 -2.751 -6.550
112 HA ALA 19 HA ALA 19 -0.706 -1.332 -5.899
113 HB1 ALA 19 3HB ALA 19 -0.292 -3.676 -5.281
114 HB2 ALA 19 1HB ALA 19 1.047 -3.174 -4.221
115 HB3 ALA 19 2HB ALA 19 -0.624 -2.699 -3.831
116 H TRP 20 H TRP 20 2.495 -1.451 -4.165
117 HA TRP 20 HA TRP 20 1.921 0.560 -2.364
118 HB2 TRP 20 1HB TRP 20 3.784 -0.899 -2.052
119 HB3 TRP 20 2HB TRP 20 4.530 -0.381 -3.551
120 HD1 TRP 20 HD TRP 20 5.094 2.514 -3.473
121 HE1 TRP 20 1HE TRP 20 6.304 3.892 -1.575
122 HE3 TRP 20 3HE TRP 20 4.238 -0.850 0.243
123 HZ2 TRP 20 2HZ TRP 20 6.757 3.431 1.204
124 HZ3 TRP 20 3HZ TRP 20 5.098 -0.309 2.520
125 HH2 TRP 20 HH TRP 20 6.319 1.746 3.029
126 H THR 21 H THR 21 3.468 0.690 -5.645
127 HA THR 21 HA THR 21 3.953 3.418 -5.705
128 HB THR 21 HB THR 21 3.625 1.153 -7.649
129 HG1 THR 21 1HG THR 21 5.622 1.988 -6.533
130 HG21 THR 21 3HG2 THR 21 4.307 3.200 -9.339
131 HG22 THR 21 1HG2 THR 21 2.650 2.562 -9.217
132 HG23 THR 21 2HG2 THR 21 3.106 4.030 -8.321
133 H THR 22 H THR 22 1.116 1.721 -7.211
134 HA THR 22 HA THR 22 -0.268 4.048 -7.811
135 HB THR 22 HB THR 22 -1.268 1.231 -7.132
136 HG1 THR 22 1HG THR 22 -0.371 2.712 -9.500
137 HG21 THR 22 3HG2 THR 22 -2.504 3.595 -8.622
138 HG22 THR 22 1HG2 THR 22 -3.017 1.916 -8.918
139 HG23 THR 22 2HG2 THR 22 -3.228 2.641 -7.305
140 H CYS 23 H CYS 23 0.389 2.612 -4.718
141 HA CYS 23 HA CYS 23 -1.914 3.772 -3.470
142 HB2 CYS 23 1HB CYS 23 0.192 1.910 -2.750
143 HB3 CYS 23 2HB CYS 23 -0.043 3.110 -1.495
144 H THR 24 H THR 24 1.649 4.358 -3.734
145 HA THR 24 HA THR 24 1.420 6.812 -2.209
146 HB THR 24 HB THR 24 3.965 6.802 -2.891
147 HG1 THR 24 1HG THR 24 3.682 5.255 -4.628
148 HG21 THR 24 3HG2 THR 24 4.052 4.375 -1.509
149 HG22 THR 24 1HG2 THR 24 3.985 5.980 -0.742
150 HG23 THR 24 2HG2 THR 24 2.487 5.055 -1.002
151 H THR 25 H THR 25 -0.271 7.623 -3.802
152 HA THR 25 HA THR 25 1.138 9.319 -5.693
153 HB THR 25 HB THR 25 -0.707 8.612 -7.426
154 HG1 THR 25 1HG THR 25 -1.606 6.554 -6.898
155 HG21 THR 25 3HG2 THR 25 1.484 6.639 -6.592
156 HG22 THR 25 1HG2 THR 25 0.579 6.555 -8.122
157 HG23 THR 25 2HG2 THR 25 1.649 7.939 -7.797
158 HA PRO 26 HA PRO 26 -1.846 12.140 -4.457
159 HB2 PRO 26 1HB PRO 26 -2.079 13.794 -6.619
160 HB3 PRO 26 2HB PRO 26 -0.752 13.890 -5.478
161 HG2 PRO 26 1HG PRO 26 -0.761 12.790 -8.222
162 HG3 PRO 26 2HG PRO 26 0.606 13.280 -7.240
163 HD2 PRO 26 1HD PRO 26 -0.259 10.595 -7.759
164 HD3 PRO 26 2HD PRO 26 1.034 11.090 -6.685
165 H GLY 27 H GLY 27 -3.912 11.832 -3.950
166 HA2 GLY 27 1HA GLY 27 -5.895 11.906 -5.964
167 HA3 GLY 27 2HA GLY 27 -5.571 10.242 -5.521
168 H GLN 28 H GLN 28 -7.913 10.395 -4.772
169 HA GLN 28 HA GLN 28 -8.301 11.943 -2.397
170 HB2 GLN 28 1HB GLN 28 -9.973 10.530 -4.352
171 HB3 GLN 28 2HB GLN 28 -10.498 10.207 -2.712
172 HG2 GLN 28 1HG GLN 28 -10.524 12.684 -2.255
173 HG3 GLN 28 2HG GLN 28 -10.059 12.980 -3.919
174 HE21 GLN 28 1HE2 GLN 28 -12.464 11.238 -1.964
175 HE22 GLN 28 2HE2 GLN 28 -13.828 11.504 -2.998
176 H THR 29 H THR 29 -7.615 8.580 -3.350
177 HA THR 29 HA THR 29 -7.664 7.842 -0.497
178 HB THR 29 HB THR 29 -8.110 5.525 -1.371
179 HG1 THR 29 1HG THR 29 -8.013 5.284 -3.598
180 HG21 THR 29 3HG2 THR 29 -10.160 6.896 -2.970
181 HG22 THR 29 1HG2 THR 29 -10.358 5.945 -1.478
182 HG23 THR 29 2HG2 THR 29 -9.955 7.676 -1.383
183 H CYS 30 H CYS 30 -5.472 9.262 -1.308
184 HA CYS 30 HA CYS 30 -3.462 7.623 -2.390
185 HB2 CYS 30 1HB CYS 30 -3.149 9.930 -2.608
186 HB3 CYS 30 2HB CYS 30 -3.478 10.241 -0.915
187 H TYR 31 H TYR 31 -4.299 8.712 0.978
188 HA TYR 31 HA TYR 31 -2.385 6.830 2.073
189 HB2 TYR 31 1HB TYR 31 -2.656 9.114 3.026
190 HB3 TYR 31 2HB TYR 31 -4.394 8.911 3.123
191 HD1 TYR 31 2HD TYR 31 -5.362 7.300 4.813
192 HD2 TYR 31 1HD TYR 31 -1.222 8.382 4.789
193 HE1 TYR 31 2HE TYR 31 -5.124 6.474 7.206
194 HE2 TYR 31 1HE TYR 31 -0.999 7.552 7.182
195 HH TYR 31 HH TYR 31 -2.724 5.561 8.565
196 H THR 32 H THR 32 -5.750 6.950 1.195
197 HA THR 32 HA THR 32 -6.678 5.129 3.191
198 HB THR 32 HB THR 32 -7.788 6.126 0.516
199 HG1 THR 32 1HG THR 32 -8.884 7.533 2.017
200 HG21 THR 32 3HG2 THR 32 -9.350 4.886 2.825
201 HG22 THR 32 1HG2 THR 32 -9.929 5.260 1.184
202 HG23 THR 32 2HG2 THR 32 -8.805 3.905 1.443
203 H CYS 33 H CYS 33 -5.429 4.846 -0.162
204 HA CYS 33 HA CYS 33 -6.075 2.116 -0.380
205 HB2 CYS 33 1HB CYS 33 -5.772 3.041 -2.435
206 HB3 CYS 33 2HB CYS 33 -4.465 4.085 -1.912
207 H CYS 34 H CYS 34 -3.600 3.970 1.265
208 HA CYS 34 HA CYS 34 -1.575 2.022 1.260
209 HB2 CYS 34 1HB CYS 34 -2.151 4.427 2.978
210 HB3 CYS 34 2HB CYS 34 -0.812 3.353 3.332
211 H SER 35 H SER 35 -4.704 2.081 2.592
212 HA SER 35 HA SER 35 -3.872 0.257 4.713
213 HB2 SER 35 1HB SER 35 -4.952 2.242 5.640
214 HB3 SER 35 2HB SER 35 -6.299 2.091 4.529
215 HG SER 35 HG SER 35 -6.590 1.250 6.808
216 H SER 36 H SER 36 -4.963 0.302 1.609
217 HA SER 36 HA SER 36 -6.902 -1.822 2.063
218 HB2 SER 36 1HB SER 36 -7.970 -1.210 0.092
219 HB3 SER 36 2HB SER 36 -7.352 0.347 0.607
220 HG SER 36 HG SER 36 -6.880 -0.043 -1.635
221 H CYS 37 H CYS 37 -3.988 -0.847 0.154
222 HA CYS 37 HA CYS 37 -3.697 -3.585 -0.755
223 HB2 CYS 37 1HB CYS 37 -2.782 -0.951 -1.660
224 HB3 CYS 37 2HB CYS 37 -1.530 -2.176 -1.715
225 H PHE 38 H PHE 38 -3.451 -2.794 2.127
226 HA PHE 38 HA PHE 38 -0.918 -4.047 2.596
227 HB2 PHE 38 1HB PHE 38 -1.597 -1.161 3.411
228 HB3 PHE 38 2HB PHE 38 -0.301 -2.062 4.173
229 HD1 PHE 38 1HD PHE 38 1.089 -3.372 2.040
230 HD2 PHE 38 2HD PHE 38 -0.710 0.471 2.052
231 HE1 PHE 38 1HE PHE 38 2.667 -2.628 0.236
232 HE2 PHE 38 2HE PHE 38 0.868 1.215 0.248
233 HZ PHE 38 HZ PHE 38 2.538 -0.343 -0.639
234 H ASP 39 H ASP 39 -0.572 -4.294 5.078
235 HA ASP 39 HA ASP 39 -3.218 -4.708 6.220
236 HB2 ASP 39 1HB ASP 39 -1.981 -6.790 5.963
237 HB3 ASP 39 2HB ASP 39 -0.541 -6.091 6.677
238 H VAL 40 H VAL 40 -0.367 -5.122 8.227
239 HA VAL 40 HA VAL 40 -1.101 -2.736 9.727
240 HB VAL 40 HB VAL 40 -0.946 -4.970 10.804
241 HG11 VAL 40 1HG1 VAL 40 0.996 -5.778 9.438
242 HG12 VAL 40 2HG1 VAL 40 2.048 -4.701 10.388
243 HG13 VAL 40 3HG1 VAL 40 1.179 -6.032 11.190
244 HG21 VAL 40 3HG2 VAL 40 -0.099 -4.138 12.802
245 HG22 VAL 40 1HG2 VAL 40 1.198 -3.223 11.995
246 HG23 VAL 40 2HG2 VAL 40 -0.485 -2.648 11.907
247 H VAL 41 H VAL 41 1.857 -4.378 8.398
248 HA VAL 41 HA VAL 41 3.465 -2.080 8.840
249 HB VAL 41 HB VAL 41 3.913 -4.507 7.090
250 HG11 VAL 41 1HG1 VAL 41 6.273 -3.993 7.251
251 HG12 VAL 41 2HG1 VAL 41 5.410 -2.571 6.620
252 HG13 VAL 41 3HG1 VAL 41 5.939 -2.609 8.319
253 HG21 VAL 41 3HG2 VAL 41 5.392 -5.053 9.235
254 HG22 VAL 41 1HG2 VAL 41 4.157 -4.053 10.036
255 HG23 VAL 41 2HG2 VAL 41 3.675 -5.511 9.136
256 H GLY 42 H GLY 42 2.349 -3.698 5.775
257 HA2 GLY 42 1HA GLY 42 3.110 -1.983 3.891
258 HA3 GLY 42 2HA GLY 42 1.525 -2.731 3.886
259 H GLU 43 H GLU 43 0.605 -1.340 6.374
260 HA GLU 43 HA GLU 43 -0.237 1.042 5.062
261 HB2 GLU 43 1HB GLU 43 -1.522 -0.601 6.731
262 HB3 GLU 43 2HB GLU 43 -0.851 0.456 7.957
263 HG2 GLU 43 1HG GLU 43 -2.004 1.965 5.697
264 HG3 GLU 43 2HG GLU 43 -3.184 0.923 6.466
265 H GLN 44 H GLN 44 1.518 0.258 8.151
266 HA GLN 44 HA GLN 44 2.073 2.921 8.731
267 HB2 GLN 44 1HB GLN 44 3.365 2.081 10.525
268 HB3 GLN 44 2HB GLN 44 2.151 0.843 10.272
269 HG2 GLN 44 1HG GLN 44 3.894 -0.618 10.140
270 HG3 GLN 44 2HG GLN 44 4.153 0.024 8.530
271 HE21 GLN 44 1HE2 GLN 44 6.042 -1.057 10.470
272 HE22 GLN 44 2HE2 GLN 44 7.241 0.158 10.760
273 H ALA 45 H ALA 45 3.416 0.702 6.414
274 HA ALA 45 HA ALA 45 5.968 2.055 6.289
275 HB1 ALA 45 3HB ALA 45 4.722 -0.153 4.601
276 HB2 ALA 45 1HB ALA 45 6.409 0.404 4.495
277 HB3 ALA 45 2HB ALA 45 5.823 -0.382 5.981
278 H CYS 46 H CYS 46 2.914 1.734 4.388
279 HA CYS 46 HA CYS 46 3.859 3.432 2.322
280 HB2 CYS 46 1HB CYS 46 2.173 1.707 1.928
281 HB3 CYS 46 2HB CYS 46 1.059 2.516 3.012
282 H GLN 47 H GLN 47 2.402 3.794 5.505
283 HA GLN 47 HA GLN 47 1.122 6.207 5.173
284 HB2 GLN 47 1HB GLN 47 2.228 4.634 7.453
285 HB3 GLN 47 2HB GLN 47 2.007 6.344 7.769
286 HG2 GLN 47 1HG GLN 47 -0.368 5.799 6.518
287 HG3 GLN 47 2HG GLN 47 -0.044 4.229 7.227
288 HE21 GLN 47 1HE2 GLN 47 -1.146 4.005 9.011
289 HE22 GLN 47 2HE2 GLN 47 -1.334 5.162 10.286
290 H MET 48 H MET 48 4.539 5.481 6.149
291 HA MET 48 HA MET 48 5.250 8.152 6.463
292 HB2 MET 48 1HB MET 48 6.639 5.493 6.136
293 HB3 MET 48 2HB MET 48 7.624 6.915 5.856
294 HG2 MET 48 1HG MET 48 6.026 7.311 8.260
295 HG3 MET 48 2HG MET 48 6.876 5.783 8.374
296 HE1 MET 48 3HE MET 48 7.098 8.150 10.158
297 HE2 MET 48 1HE MET 48 8.481 7.100 10.552
298 HE3 MET 48 2HE MET 48 8.738 8.835 10.249
299 H SER 49 H SER 49 5.349 5.905 3.652
300 HA SER 49 HA SER 49 6.763 7.742 2.040
301 HB2 SER 49 1HB SER 49 6.943 5.379 1.554
302 HB3 SER 49 2HB SER 49 5.203 5.198 1.442
303 HG SER 49 HG SER 49 7.026 6.387 -0.419
304 H ALA 50 H ALA 50 3.429 7.277 2.998
305 HA ALA 50 HA ALA 50 2.008 8.152 0.836
306 HB1 ALA 50 3HB ALA 50 1.522 8.900 3.747
307 HB2 ALA 50 1HB ALA 50 0.307 8.780 2.451
308 HB3 ALA 50 2HB ALA 50 1.130 7.315 3.038
309 H GLN 51 H GLN 51 2.848 9.771 -0.461
310 HA GLN 51 HA GLN 51 3.551 12.241 0.899
311 HB2 GLN 51 1HB GLN 51 4.809 10.810 -1.164
312 HB3 GLN 51 2HB GLN 51 4.050 12.150 -2.000
313 HG2 GLN 51 1HG GLN 51 5.102 13.459 0.184
314 HG3 GLN 51 2HG GLN 51 6.275 12.171 -0.008
315 HE21 GLN 51 1HE2 GLN 51 5.580 15.240 -0.826
316 HE22 GLN 51 2HE2 GLN 51 6.434 15.410 -2.323
317 H CYS 52 H CYS 52 0.916 12.030 1.077
318 HA CYS 52 HA CYS 52 -0.257 13.202 -1.311
319 HB2 CYS 52 1HB CYS 52 -2.015 12.737 0.989
320 HB3 CYS 52 2HB CYS 52 -2.215 12.307 -0.699
Start of MODEL 8
1 H1 ASN 1 1H ASN 1 9.178 -5.867 -1.574
2 HA ASN 1 HA ASN 1 10.613 -5.167 0.549
3 HB2 ASN 1 1HB ASN 1 10.120 -2.782 -0.962
4 HB3 ASN 1 2HB ASN 1 9.058 -2.692 0.430
5 HD21 ASN 1 1HD2 ASN 1 11.942 -1.777 -0.658
6 HD22 ASN 1 2HD2 ASN 1 12.883 -1.709 0.795
7 HA PRO 2 HA PRO 2 5.910 -4.692 1.264
8 HB2 PRO 2 1HB PRO 2 4.228 -4.485 -0.880
9 HB3 PRO 2 2HB PRO 2 4.831 -3.096 0.002
10 HG2 PRO 2 1HG PRO 2 5.648 -4.102 -2.655
11 HG3 PRO 2 2HG PRO 2 5.913 -2.519 -1.951
12 HD2 PRO 2 1HD PRO 2 7.841 -4.627 -2.211
13 HD3 PRO 2 2HD PRO 2 8.073 -3.089 -1.404
14 H GLU 3 H GLU 3 7.572 -6.828 -0.425
15 HA GLU 3 HA GLU 3 5.677 -8.668 -1.205
16 HB2 GLU 3 1HB GLU 3 8.345 -9.544 -0.089
17 HB3 GLU 3 2HB GLU 3 7.481 -10.160 -1.483
18 HG2 GLU 3 1HG GLU 3 7.850 -7.565 -2.281
19 HG3 GLU 3 2HG GLU 3 9.259 -7.762 -1.257
20 H ASP 4 H ASP 4 7.313 -8.133 1.962
21 HA ASP 4 HA ASP 4 6.176 -10.424 3.130
22 HB2 ASP 4 1HB ASP 4 7.033 -7.988 4.714
23 HB3 ASP 4 2HB ASP 4 7.204 -9.680 5.139
24 H TRP 5 H TRP 5 5.017 -7.280 2.261
25 HA TRP 5 HA TRP 5 2.739 -7.586 4.097
26 HB2 TRP 5 1HB TRP 5 3.179 -4.870 3.164
27 HB3 TRP 5 2HB TRP 5 2.875 -5.478 4.779
28 HD1 TRP 5 HD TRP 5 5.427 -6.978 5.594
29 HE1 TRP 5 1HE TRP 5 7.835 -5.912 5.768
30 HE3 TRP 5 3HE TRP 5 4.492 -3.066 2.484
31 HZ2 TRP 5 2HZ TRP 5 9.051 -3.604 4.612
32 HZ3 TRP 5 3HZ TRP 5 6.344 -1.451 2.060
33 HH2 TRP 5 HH TRP 5 8.560 -1.672 3.066
34 H PHE 6 H PHE 6 1.393 -5.310 2.691
35 HA PHE 6 HA PHE 6 -0.021 -5.014 1.027
36 HB2 PHE 6 1HB PHE 6 1.923 -4.629 -0.375
37 HB3 PHE 6 2HB PHE 6 2.396 -6.315 -0.318
38 HD1 PHE 6 2HD PHE 6 -0.462 -4.221 -1.506
39 HD2 PHE 6 1HD PHE 6 2.010 -7.602 -2.190
40 HE1 PHE 6 2HE PHE 6 -1.613 -4.619 -3.701
41 HE2 PHE 6 1HE PHE 6 0.859 -8.000 -4.385
42 HZ PHE 6 HZ PHE 6 -0.938 -6.503 -5.114
43 H THR 7 H THR 7 -1.946 -6.038 0.770
44 HA THR 7 HA THR 7 -1.854 -8.960 0.400
45 HB THR 7 HB THR 7 -4.062 -8.922 1.578
46 HG1 THR 7 1HG THR 7 -4.361 -6.607 0.729
47 HG21 THR 7 3HG2 THR 7 -2.377 -7.092 3.287
48 HG22 THR 7 1HG2 THR 7 -3.237 -8.582 3.743
49 HG23 THR 7 2HG2 THR 7 -1.693 -8.681 2.863
50 HA PRO 8 HA PRO 8 -3.491 -7.687 -3.482
51 HB2 PRO 8 1HB PRO 8 -2.643 -9.871 -4.890
52 HB3 PRO 8 2HB PRO 8 -1.678 -8.420 -4.698
53 HG2 PRO 8 1HG PRO 8 -1.368 -11.042 -3.368
54 HG3 PRO 8 2HG PRO 8 -0.201 -9.744 -3.521
55 HD2 PRO 8 1HD PRO 8 -1.728 -10.414 -1.186
56 HD3 PRO 8 2HD PRO 8 -0.648 -9.047 -1.376
57 H ASP 9 H ASP 9 -4.392 -9.863 -1.256
58 HA ASP 9 HA ASP 9 -6.280 -11.201 -2.946
59 HB2 ASP 9 1HB ASP 9 -5.744 -11.262 0.057
60 HB3 ASP 9 2HB ASP 9 -7.015 -12.204 -0.696
61 H THR 10 H THR 10 -5.993 -8.272 -1.141
62 HA THR 10 HA THR 10 -8.893 -7.875 -1.281
63 HB THR 10 HB THR 10 -8.404 -8.515 1.051
64 HG1 THR 10 1HG THR 10 -8.468 -5.603 0.695
65 HG21 THR 10 3HG2 THR 10 -6.905 -6.969 2.404
66 HG22 THR 10 1HG2 THR 10 -6.009 -7.980 1.245
67 HG23 THR 10 2HG2 THR 10 -6.329 -6.269 0.872
68 H CYS 11 H CYS 11 -7.106 -7.093 -3.259
69 HA CYS 11 HA CYS 11 -7.434 -4.242 -3.023
70 HB2 CYS 11 1HB CYS 11 -5.069 -5.025 -2.157
71 HB3 CYS 11 2HB CYS 11 -4.709 -5.147 -3.868
72 H ALA 12 H ALA 12 -6.946 -3.219 -5.259
73 HA ALA 12 HA ALA 12 -8.077 -4.943 -7.257
74 HB1 ALA 12 3HB ALA 12 -8.881 -2.949 -7.901
75 HB2 ALA 12 1HB ALA 12 -7.848 -2.122 -6.710
76 HB3 ALA 12 2HB ALA 12 -7.232 -2.449 -8.348
77 H TYR 13 H TYR 13 -4.896 -3.599 -6.366
78 HA TYR 13 HA TYR 13 -3.711 -4.447 -8.858
79 HB2 TYR 13 1HB TYR 13 -2.438 -3.572 -6.199
80 HB3 TYR 13 2HB TYR 13 -1.723 -3.420 -7.792
81 HD1 TYR 13 2HD TYR 13 -3.643 -2.115 -9.451
82 HD2 TYR 13 1HD TYR 13 -2.894 -1.496 -5.284
83 HE1 TYR 13 2HE TYR 13 -4.560 0.250 -9.630
84 HE2 TYR 13 1HE TYR 13 -3.813 0.867 -5.477
85 HH TYR 13 HH TYR 13 -4.616 2.238 -8.599
86 H GLY 14 H GLY 14 -2.253 -6.169 -9.145
87 HA2 GLY 14 1HA GLY 14 -2.468 -8.262 -7.099
88 HA3 GLY 14 2HA GLY 14 -2.028 -8.469 -8.782
89 H ASP 15 H ASP 15 -0.179 -6.041 -8.683
90 HA ASP 15 HA ASP 15 2.063 -7.519 -7.683
91 HB2 ASP 15 1HB ASP 15 2.121 -4.721 -8.876
92 HB3 ASP 15 2HB ASP 15 3.412 -5.906 -8.860
93 H SER 16 H SER 16 3.455 -6.745 -5.961
94 HA SER 16 HA SER 16 2.114 -5.019 -4.128
95 HB2 SER 16 1HB SER 16 3.748 -5.722 -2.536
96 HB3 SER 16 2HB SER 16 3.411 -7.137 -3.513
97 HG SER 16 HG SER 16 5.409 -5.834 -4.759
98 H ASN 17 H ASN 17 4.873 -4.933 -6.390
99 HA ASN 17 HA ASN 17 6.035 -2.621 -5.341
100 HB2 ASN 17 1HB ASN 17 6.470 -4.443 -7.544
101 HB3 ASN 17 2HB ASN 17 6.481 -2.819 -8.201
102 HD21 ASN 17 1HD2 ASN 17 8.164 -1.515 -7.880
103 HD22 ASN 17 2HD2 ASN 17 9.564 -1.880 -6.927
104 H THR 18 H THR 18 3.763 -3.316 -8.092
105 HA THR 18 HA THR 18 3.489 -0.571 -8.817
106 HB THR 18 HB THR 18 3.078 -2.979 -10.056
107 HG1 THR 18 1HG THR 18 3.170 -0.837 -11.031
108 HG21 THR 18 3HG2 THR 18 0.759 -3.439 -10.344
109 HG22 THR 18 1HG2 THR 18 0.888 -3.167 -8.590
110 HG23 THR 18 2HG2 THR 18 0.273 -1.875 -9.649
111 H ALA 19 H ALA 19 1.821 -2.790 -6.590
112 HA ALA 19 HA ALA 19 -0.503 -1.274 -6.271
113 HB1 ALA 19 3HB ALA 19 -0.559 -3.478 -5.461
114 HB2 ALA 19 1HB ALA 19 0.997 -3.311 -4.614
115 HB3 ALA 19 2HB ALA 19 -0.457 -2.509 -3.972
116 H TRP 20 H TRP 20 2.529 -1.386 -4.262
117 HA TRP 20 HA TRP 20 1.807 0.660 -2.541
118 HB2 TRP 20 1HB TRP 20 3.611 -0.807 -2.020
119 HB3 TRP 20 2HB TRP 20 4.496 -0.350 -3.462
120 HD1 TRP 20 HD TRP 20 4.961 2.612 -3.395
121 HE1 TRP 20 1HE TRP 20 6.077 4.002 -1.450
122 HE3 TRP 20 3HE TRP 20 4.060 -0.797 0.268
123 HZ2 TRP 20 2HZ TRP 20 6.451 3.531 1.340
124 HZ3 TRP 20 3HZ TRP 20 4.833 -0.255 2.575
125 HH2 TRP 20 HH TRP 20 5.991 1.822 3.138
126 H THR 21 H THR 21 3.699 0.709 -5.642
127 HA THR 21 HA THR 21 4.170 3.446 -5.704
128 HB THR 21 HB THR 21 4.181 1.112 -7.572
129 HG1 THR 21 1HG THR 21 6.295 1.768 -7.367
130 HG21 THR 21 3HG2 THR 21 3.201 2.424 -9.255
131 HG22 THR 21 1HG2 THR 21 3.664 3.952 -8.469
132 HG23 THR 21 2HG2 THR 21 4.881 3.004 -9.357
133 H THR 22 H THR 22 1.417 1.569 -7.122
134 HA THR 22 HA THR 22 0.128 3.860 -8.137
135 HB THR 22 HB THR 22 -0.978 1.115 -7.338
136 HG1 THR 22 1HG THR 22 0.098 2.257 -9.820
137 HG21 THR 22 3HG2 THR 22 -2.590 1.527 -9.172
138 HG22 THR 22 1HG2 THR 22 -2.735 2.823 -7.960
139 HG23 THR 22 2HG2 THR 22 -1.859 3.121 -9.481
140 H CYS 23 H CYS 23 0.506 2.643 -4.906
141 HA CYS 23 HA CYS 23 -1.896 3.936 -3.981
142 HB2 CYS 23 1HB CYS 23 -0.149 1.901 -3.015
143 HB3 CYS 23 2HB CYS 23 -0.158 3.198 -1.838
144 H THR 24 H THR 24 1.649 4.413 -4.164
145 HA THR 24 HA THR 24 1.525 6.816 -2.549
146 HB THR 24 HB THR 24 4.050 6.768 -3.334
147 HG1 THR 24 1HG THR 24 3.530 5.235 -5.088
148 HG21 THR 24 3HG2 THR 24 4.621 5.288 -1.581
149 HG22 THR 24 1HG2 THR 24 2.977 5.773 -1.103
150 HG23 THR 24 2HG2 THR 24 3.243 4.212 -1.915
151 H THR 25 H THR 25 -0.264 7.491 -4.257
152 HA THR 25 HA THR 25 1.147 9.304 -6.068
153 HB THR 25 HB THR 25 -0.500 8.685 -7.874
154 HG1 THR 25 1HG THR 25 -1.850 6.838 -7.363
155 HG21 THR 25 3HG2 THR 25 0.528 5.989 -7.077
156 HG22 THR 25 1HG2 THR 25 0.719 6.860 -8.617
157 HG23 THR 25 2HG2 THR 25 1.768 7.257 -7.235
158 HA PRO 26 HA PRO 26 -1.749 12.143 -4.673
159 HB2 PRO 26 1HB PRO 26 -1.988 13.868 -6.779
160 HB3 PRO 26 2HB PRO 26 -0.638 13.901 -5.662
161 HG2 PRO 26 1HG PRO 26 -0.722 12.887 -8.437
162 HG3 PRO 26 2HG PRO 26 0.672 13.319 -7.468
163 HD2 PRO 26 1HD PRO 26 -0.258 10.669 -8.052
164 HD3 PRO 26 2HD PRO 26 1.066 11.105 -6.990
165 H GLY 27 H GLY 27 -3.818 11.903 -4.142
166 HA2 GLY 27 1HA GLY 27 -5.787 11.944 -6.221
167 HA3 GLY 27 2HA GLY 27 -5.559 10.337 -5.562
168 H GLN 28 H GLN 28 -7.546 10.161 -4.467
169 HA GLN 28 HA GLN 28 -7.959 12.169 -2.395
170 HB2 GLN 28 1HB GLN 28 -9.833 10.529 -4.083
171 HB3 GLN 28 2HB GLN 28 -10.351 10.935 -2.459
172 HG2 GLN 28 1HG GLN 28 -10.035 13.337 -2.900
173 HG3 GLN 28 2HG GLN 28 -9.337 12.997 -4.471
174 HE21 GLN 28 1HE2 GLN 28 -10.699 13.667 -5.946
175 HE22 GLN 28 2HE2 GLN 28 -12.395 13.327 -6.034
176 H THR 29 H THR 29 -8.048 8.633 -3.145
177 HA THR 29 HA THR 29 -7.872 8.125 -0.249
178 HB THR 29 HB THR 29 -8.801 5.862 -0.916
179 HG1 THR 29 1HG THR 29 -8.178 5.771 -3.113
180 HG21 THR 29 3HG2 THR 29 -11.069 6.588 -1.464
181 HG22 THR 29 1HG2 THR 29 -10.386 7.794 -0.347
182 HG23 THR 29 2HG2 THR 29 -10.469 8.143 -2.091
183 H CYS 30 H CYS 30 -5.565 9.036 -1.567
184 HA CYS 30 HA CYS 30 -4.027 6.928 -2.570
185 HB2 CYS 30 1HB CYS 30 -3.253 9.021 -3.151
186 HB3 CYS 30 2HB CYS 30 -3.459 9.677 -1.539
187 H TYR 31 H TYR 31 -4.020 8.614 0.663
188 HA TYR 31 HA TYR 31 -2.373 6.585 1.821
189 HB2 TYR 31 1HB TYR 31 -2.246 8.875 2.647
190 HB3 TYR 31 2HB TYR 31 -3.990 9.042 2.671
191 HD1 TYR 31 2HD TYR 31 -5.312 7.724 4.431
192 HD2 TYR 31 1HD TYR 31 -1.063 8.203 4.583
193 HE1 TYR 31 2HE TYR 31 -5.327 7.137 6.904
194 HE2 TYR 31 1HE TYR 31 -1.093 7.615 7.056
195 HH TYR 31 HH TYR 31 -3.960 7.534 8.854
196 H THR 32 H THR 32 -5.614 6.607 0.908
197 HA THR 32 HA THR 32 -6.518 5.104 3.245
198 HB THR 32 HB THR 32 -7.838 6.395 0.816
199 HG1 THR 32 1HG THR 32 -8.727 7.611 2.596
200 HG21 THR 32 3HG2 THR 32 -9.922 5.451 1.366
201 HG22 THR 32 1HG2 THR 32 -8.856 4.057 1.660
202 HG23 THR 32 2HG2 THR 32 -9.413 5.054 3.025
203 H CYS 33 H CYS 33 -5.622 4.705 -0.179
204 HA CYS 33 HA CYS 33 -6.702 2.130 -0.437
205 HB2 CYS 33 1HB CYS 33 -5.456 1.972 -2.458
206 HB3 CYS 33 2HB CYS 33 -6.097 3.597 -2.327
207 H CYS 34 H CYS 34 -3.746 3.505 0.972
208 HA CYS 34 HA CYS 34 -2.117 1.280 0.922
209 HB2 CYS 34 1HB CYS 34 -2.311 3.479 2.990
210 HB3 CYS 34 2HB CYS 34 -1.011 2.306 2.905
211 H SER 35 H SER 35 -4.791 2.282 3.112
212 HA SER 35 HA SER 35 -4.317 0.152 4.915
213 HB2 SER 35 1HB SER 35 -6.187 0.986 6.118
214 HB3 SER 35 2HB SER 35 -5.452 2.411 5.410
215 HG SER 35 HG SER 35 -7.709 2.501 5.059
216 H SER 36 H SER 36 -5.309 0.121 1.762
217 HA SER 36 HA SER 36 -7.029 -2.178 2.262
218 HB2 SER 36 1HB SER 36 -7.393 0.121 0.334
219 HB3 SER 36 2HB SER 36 -8.020 -1.458 -0.098
220 HG SER 36 HG SER 36 -8.632 -0.615 2.527
221 H CYS 37 H CYS 37 -4.019 -1.401 1.488
222 HA CYS 37 HA CYS 37 -3.840 -3.513 -0.507
223 HB2 CYS 37 1HB CYS 37 -3.474 -0.789 -1.135
224 HB3 CYS 37 2HB CYS 37 -1.866 -1.481 -1.053
225 H PHE 38 H PHE 38 -3.373 -2.891 2.523
226 HA PHE 38 HA PHE 38 -0.870 -4.281 2.655
227 HB2 PHE 38 1HB PHE 38 -1.314 -1.450 3.778
228 HB3 PHE 38 2HB PHE 38 0.059 -2.449 4.211
229 HD1 PHE 38 2HD PHE 38 1.142 -3.517 1.853
230 HD2 PHE 38 1HD PHE 38 -0.743 0.253 2.349
231 HE1 PHE 38 2HE PHE 38 2.414 -2.622 -0.117
232 HE2 PHE 38 1HE PHE 38 0.528 1.148 0.379
233 HZ PHE 38 HZ PHE 38 2.091 -0.300 -0.831
234 H ASP 39 H ASP 39 -0.262 -4.535 5.144
235 HA ASP 39 HA ASP 39 -2.801 -5.056 6.468
236 HB2 ASP 39 1HB ASP 39 -1.511 -7.085 6.100
237 HB3 ASP 39 2HB ASP 39 -0.047 -6.337 6.707
238 H VAL 40 H VAL 40 0.214 -5.366 8.249
239 HA VAL 40 HA VAL 40 -0.510 -3.028 9.831
240 HB VAL 40 HB VAL 40 -0.121 -5.388 10.749
241 HG11 VAL 40 1HG1 VAL 40 1.943 -5.880 9.511
242 HG12 VAL 40 2HG1 VAL 40 2.774 -4.553 10.358
243 HG13 VAL 40 3HG1 VAL 40 2.207 -5.973 11.269
244 HG21 VAL 40 3HG2 VAL 40 1.182 -2.893 11.853
245 HG22 VAL 40 1HG2 VAL 40 -0.371 -3.636 12.303
246 HG23 VAL 40 2HG2 VAL 40 1.158 -4.425 12.759
247 H VAL 41 H VAL 41 2.341 -4.536 8.170
248 HA VAL 41 HA VAL 41 3.959 -2.239 8.590
249 HB VAL 41 HB VAL 41 4.302 -4.492 6.605
250 HG11 VAL 41 1HG1 VAL 41 6.311 -2.652 7.950
251 HG12 VAL 41 2HG1 VAL 41 6.707 -4.008 6.867
252 HG13 VAL 41 3HG1 VAL 41 5.811 -2.602 6.243
253 HG21 VAL 41 3HG2 VAL 41 4.074 -5.693 8.570
254 HG22 VAL 41 1HG2 VAL 41 5.823 -5.362 8.561
255 HG23 VAL 41 2HG2 VAL 41 4.737 -4.384 9.577
256 H GLY 42 H GLY 42 2.958 -3.707 5.427
257 HA2 GLY 42 1HA GLY 42 3.400 -1.742 3.715
258 HA3 GLY 42 2HA GLY 42 1.937 -2.704 3.647
259 H GLU 43 H GLU 43 0.858 -1.692 6.245
260 HA GLU 43 HA GLU 43 -0.365 0.627 5.164
261 HB2 GLU 43 1HB GLU 43 -1.438 -1.218 6.636
262 HB3 GLU 43 2HB GLU 43 -0.679 -0.423 8.001
263 HG2 GLU 43 1HG GLU 43 -1.801 1.767 7.080
264 HG3 GLU 43 2HG GLU 43 -2.797 0.687 6.124
265 H GLN 44 H GLN 44 1.485 -0.024 8.236
266 HA GLN 44 HA GLN 44 1.738 2.688 8.828
267 HB2 GLN 44 1HB GLN 44 3.079 1.984 10.659
268 HB3 GLN 44 2HB GLN 44 1.955 0.665 10.403
269 HG2 GLN 44 1HG GLN 44 3.777 -0.693 10.299
270 HG3 GLN 44 2HG GLN 44 4.062 -0.019 8.706
271 HE21 GLN 44 1HE2 GLN 44 6.239 -0.068 8.737
272 HE22 GLN 44 2HE2 GLN 44 7.242 0.890 9.774
273 H ALA 45 H ALA 45 3.332 0.641 6.534
274 HA ALA 45 HA ALA 45 5.775 2.185 6.509
275 HB1 ALA 45 3HB ALA 45 5.795 -0.255 6.126
276 HB2 ALA 45 1HB ALA 45 4.742 -0.043 4.706
277 HB3 ALA 45 2HB ALA 45 6.392 0.624 4.698
278 H CYS 46 H CYS 46 2.887 1.605 4.395
279 HA CYS 46 HA CYS 46 3.709 3.406 2.418
280 HB2 CYS 46 1HB CYS 46 2.072 1.647 2.017
281 HB3 CYS 46 2HB CYS 46 0.948 2.398 3.132
282 H GLN 47 H GLN 47 2.127 3.703 5.576
283 HA GLN 47 HA GLN 47 0.854 6.107 5.238
284 HB2 GLN 47 1HB GLN 47 1.935 4.544 7.544
285 HB3 GLN 47 2HB GLN 47 1.629 6.241 7.856
286 HG2 GLN 47 1HG GLN 47 -0.687 5.713 6.607
287 HG3 GLN 47 2HG GLN 47 -0.325 4.068 7.091
288 HE21 GLN 47 1HE2 GLN 47 0.105 7.292 8.553
289 HE22 GLN 47 2HE2 GLN 47 -0.667 6.951 10.066
290 H MET 48 H MET 48 4.252 5.408 6.290
291 HA MET 48 HA MET 48 4.925 8.080 6.669
292 HB2 MET 48 1HB MET 48 6.550 5.561 6.037
293 HB3 MET 48 2HB MET 48 7.322 7.094 6.390
294 HG2 MET 48 1HG MET 48 5.616 6.970 8.519
295 HG3 MET 48 2HG MET 48 5.821 5.254 8.228
296 HE1 MET 48 3HE MET 48 8.719 4.060 8.815
297 HE2 MET 48 1HE MET 48 8.337 4.595 10.469
298 HE3 MET 48 2HE MET 48 7.026 4.122 9.361
299 H SER 49 H SER 49 5.384 5.838 3.857
300 HA SER 49 HA SER 49 6.714 7.748 2.312
301 HB2 SER 49 1HB SER 49 7.026 5.473 1.701
302 HB3 SER 49 2HB SER 49 5.307 5.130 1.720
303 HG SER 49 HG SER 49 6.881 6.038 -0.355
304 H ALA 50 H ALA 50 3.367 7.245 3.167
305 HA ALA 50 HA ALA 50 1.951 8.052 1.002
306 HB1 ALA 50 3HB ALA 50 1.425 9.087 3.806
307 HB2 ALA 50 1HB ALA 50 0.244 8.653 2.547
308 HB3 ALA 50 2HB ALA 50 1.185 7.380 3.361
309 H GLN 51 H GLN 51 2.886 9.563 -0.383
310 HA GLN 51 HA GLN 51 3.367 12.171 0.832
311 HB2 GLN 51 1HB GLN 51 5.357 11.059 -0.233
312 HB3 GLN 51 2HB GLN 51 4.511 11.057 -1.768
313 HG2 GLN 51 1HG GLN 51 4.619 13.403 -1.995
314 HG3 GLN 51 2HG GLN 51 4.775 13.670 -0.270
315 HE21 GLN 51 1HE2 GLN 51 6.420 12.180 -3.041
316 HE22 GLN 51 2HE2 GLN 51 8.044 12.543 -2.561
317 H CYS 52 H CYS 52 0.754 11.798 0.494
318 HA CYS 52 HA CYS 52 0.169 13.031 -2.101
319 HB2 CYS 52 1HB CYS 52 -2.232 12.019 -1.233
320 HB3 CYS 52 2HB CYS 52 -1.188 11.318 -2.454
Start of MODEL 9
1 H1 ASN 1 1H ASN 1 10.087 -6.584 -0.889
2 HA ASN 1 HA ASN 1 10.846 -5.589 1.197
3 HB2 ASN 1 1HB ASN 1 10.719 -3.236 -0.464
4 HB3 ASN 1 2HB ASN 1 9.540 -3.016 0.813
5 HD21 ASN 1 1HD2 ASN 1 12.080 -1.672 0.318
6 HD22 ASN 1 2HD2 ASN 1 13.053 -1.861 1.739
7 HA PRO 2 HA PRO 2 6.142 -4.734 1.190
8 HB2 PRO 2 1HB PRO 2 4.811 -4.495 -1.185
9 HB3 PRO 2 2HB PRO 2 5.390 -3.118 -0.269
10 HG2 PRO 2 1HG PRO 2 6.500 -4.297 -2.742
11 HG3 PRO 2 2HG PRO 2 6.787 -2.710 -2.057
12 HD2 PRO 2 1HD PRO 2 8.556 -4.966 -1.962
13 HD3 PRO 2 2HD PRO 2 8.791 -3.415 -1.179
14 H GLU 3 H GLU 3 7.831 -7.032 -0.352
15 HA GLU 3 HA GLU 3 5.854 -8.750 -1.214
16 HB2 GLU 3 1HB GLU 3 7.602 -10.512 -1.011
17 HB3 GLU 3 2HB GLU 3 8.213 -9.064 -1.785
18 HG2 GLU 3 1HG GLU 3 9.169 -8.308 0.413
19 HG3 GLU 3 2HG GLU 3 8.584 -9.780 1.162
20 H ASP 4 H ASP 4 7.155 -8.055 2.033
21 HA ASP 4 HA ASP 4 5.943 -10.335 3.196
22 HB2 ASP 4 1HB ASP 4 7.945 -8.671 3.968
23 HB3 ASP 4 2HB ASP 4 6.627 -7.902 4.830
24 H TRP 5 H TRP 5 5.129 -6.934 2.514
25 HA TRP 5 HA TRP 5 2.674 -7.175 4.096
26 HB2 TRP 5 1HB TRP 5 3.224 -4.590 2.858
27 HB3 TRP 5 2HB TRP 5 2.794 -4.990 4.509
28 HD1 TRP 5 HD TRP 5 5.244 -6.470 5.648
29 HE1 TRP 5 1HE TRP 5 7.668 -5.450 5.867
30 HE3 TRP 5 3HE TRP 5 4.628 -2.891 2.090
31 HZ2 TRP 5 2HZ TRP 5 9.025 -3.309 4.557
32 HZ3 TRP 5 3HZ TRP 5 6.552 -1.376 1.621
33 HH2 TRP 5 HH TRP 5 8.693 -1.543 2.788
34 H PHE 6 H PHE 6 1.272 -5.148 2.504
35 HA PHE 6 HA PHE 6 -0.124 -5.040 0.803
36 HB2 PHE 6 1HB PHE 6 1.808 -4.631 -0.600
37 HB3 PHE 6 2HB PHE 6 2.394 -6.272 -0.410
38 HD1 PHE 6 2HD PHE 6 -0.525 -4.431 -1.835
39 HD2 PHE 6 1HD PHE 6 2.089 -7.759 -2.151
40 HE1 PHE 6 2HE PHE 6 -1.598 -5.066 -4.013
41 HE2 PHE 6 1HE PHE 6 1.016 -8.394 -4.330
42 HZ PHE 6 HZ PHE 6 -0.814 -7.040 -5.235
43 H THR 7 H THR 7 -1.984 -6.194 0.649
44 HA THR 7 HA THR 7 -1.722 -9.121 0.455
45 HB THR 7 HB THR 7 -3.906 -9.159 1.625
46 HG1 THR 7 1HG THR 7 -4.622 -6.881 2.273
47 HG21 THR 7 3HG2 THR 7 -3.192 -8.476 3.751
48 HG22 THR 7 1HG2 THR 7 -1.621 -8.525 2.915
49 HG23 THR 7 2HG2 THR 7 -2.466 -6.973 3.132
50 HA PRO 8 HA PRO 8 -3.339 -8.232 -3.538
51 HB2 PRO 8 1HB PRO 8 -2.364 -10.476 -4.757
52 HB3 PRO 8 2HB PRO 8 -1.469 -8.972 -4.660
53 HG2 PRO 8 1HG PRO 8 -1.072 -11.468 -3.125
54 HG3 PRO 8 2HG PRO 8 0.039 -10.133 -3.357
55 HD2 PRO 8 1HD PRO 8 -1.507 -10.691 -1.006
56 HD3 PRO 8 2HD PRO 8 -0.485 -9.294 -1.281
57 H ASP 9 H ASP 9 -4.197 -10.260 -1.165
58 HA ASP 9 HA ASP 9 -5.997 -11.796 -2.790
59 HB2 ASP 9 1HB ASP 9 -5.531 -11.651 0.224
60 HB3 ASP 9 2HB ASP 9 -6.701 -12.725 -0.517
61 H THR 10 H THR 10 -5.853 -8.744 -1.205
62 HA THR 10 HA THR 10 -8.762 -8.475 -1.394
63 HB THR 10 HB THR 10 -8.319 -8.981 0.975
64 HG1 THR 10 1HG THR 10 -8.438 -6.089 0.498
65 HG21 THR 10 3HG2 THR 10 -6.187 -6.830 0.628
66 HG22 THR 10 1HG2 THR 10 -6.921 -7.144 2.218
67 HG23 THR 10 2HG2 THR 10 -6.021 -8.433 1.384
68 H CYS 11 H CYS 11 -7.009 -7.715 -3.384
69 HA CYS 11 HA CYS 11 -7.462 -4.886 -3.320
70 HB2 CYS 11 1HB CYS 11 -4.988 -5.711 -2.424
71 HB3 CYS 11 2HB CYS 11 -4.690 -5.404 -4.123
72 H ALA 12 H ALA 12 -7.442 -4.020 -5.516
73 HA ALA 12 HA ALA 12 -8.155 -5.911 -7.467
74 HB1 ALA 12 3HB ALA 12 -7.827 -2.965 -7.226
75 HB2 ALA 12 1HB ALA 12 -7.673 -3.624 -8.872
76 HB3 ALA 12 2HB ALA 12 -9.156 -3.916 -7.932
77 H TYR 13 H TYR 13 -5.105 -4.301 -6.563
78 HA TYR 13 HA TYR 13 -3.793 -5.294 -8.954
79 HB2 TYR 13 1HB TYR 13 -2.709 -3.920 -6.422
80 HB3 TYR 13 2HB TYR 13 -1.925 -3.957 -7.989
81 HD1 TYR 13 2HD TYR 13 -3.936 -3.145 -9.889
82 HD2 TYR 13 1HD TYR 13 -3.308 -1.743 -5.896
83 HE1 TYR 13 2HE TYR 13 -5.037 -0.933 -10.485
84 HE2 TYR 13 1HE TYR 13 -4.411 0.465 -6.506
85 HH TYR 13 HH TYR 13 -4.778 1.533 -9.484
86 H GLY 14 H GLY 14 -2.529 -7.105 -9.063
87 HA2 GLY 14 1HA GLY 14 -2.342 -8.723 -6.624
88 HA3 GLY 14 2HA GLY 14 -2.143 -9.269 -8.277
89 H ASP 15 H ASP 15 -0.571 -6.246 -7.772
90 HA ASP 15 HA ASP 15 1.937 -7.674 -7.348
91 HB2 ASP 15 1HB ASP 15 1.736 -4.982 -8.731
92 HB3 ASP 15 2HB ASP 15 3.028 -6.162 -8.836
93 H SER 16 H SER 16 3.404 -6.707 -5.814
94 HA SER 16 HA SER 16 2.152 -4.904 -4.007
95 HB2 SER 16 1HB SER 16 4.717 -5.130 -3.081
96 HB3 SER 16 2HB SER 16 3.440 -6.273 -2.716
97 HG SER 16 HG SER 16 5.193 -6.529 -5.006
98 H ASN 17 H ASN 17 4.601 -4.810 -6.590
99 HA ASN 17 HA ASN 17 5.785 -2.409 -5.882
100 HB2 ASN 17 1HB ASN 17 6.190 -4.292 -7.848
101 HB3 ASN 17 2HB ASN 17 5.452 -3.022 -8.804
102 HD21 ASN 17 1HD2 ASN 17 7.505 -2.920 -9.870
103 HD22 ASN 17 2HD2 ASN 17 8.806 -1.987 -9.209
104 H THR 18 H THR 18 3.313 -3.163 -8.467
105 HA THR 18 HA THR 18 2.713 -0.479 -9.027
106 HB THR 18 HB THR 18 2.271 -2.806 -10.280
107 HG1 THR 18 1HG THR 18 1.042 -1.418 -11.574
108 HG21 THR 18 3HG2 THR 18 0.074 -3.669 -10.058
109 HG22 THR 18 1HG2 THR 18 0.519 -3.372 -8.360
110 HG23 THR 18 2HG2 THR 18 -0.514 -2.209 -9.226
111 H ALA 19 H ALA 19 1.598 -2.697 -6.501
112 HA ALA 19 HA ALA 19 -0.740 -1.276 -5.847
113 HB1 ALA 19 3HB ALA 19 -0.330 -2.519 -3.603
114 HB2 ALA 19 1HB ALA 19 -0.584 -3.496 -5.069
115 HB3 ALA 19 2HB ALA 19 1.062 -3.256 -4.433
116 H TRP 20 H TRP 20 2.494 -1.380 -4.176
117 HA TRP 20 HA TRP 20 1.985 0.696 -2.434
118 HB2 TRP 20 1HB TRP 20 3.838 -0.775 -2.117
119 HB3 TRP 20 2HB TRP 20 4.558 -0.312 -3.646
120 HD1 TRP 20 HD TRP 20 5.175 2.566 -3.674
121 HE1 TRP 20 1HE TRP 20 6.432 3.992 -1.843
122 HE3 TRP 20 3HE TRP 20 4.313 -0.645 0.173
123 HZ2 TRP 20 2HZ TRP 20 6.914 3.624 0.945
124 HZ3 TRP 20 3HZ TRP 20 5.211 -0.037 2.417
125 HH2 TRP 20 HH TRP 20 6.473 2.014 2.836
126 H THR 21 H THR 21 3.397 0.693 -5.773
127 HA THR 21 HA THR 21 3.955 3.405 -5.937
128 HB THR 21 HB THR 21 3.434 1.109 -7.819
129 HG1 THR 21 1HG THR 21 5.631 1.474 -7.935
130 HG21 THR 21 3HG2 THR 21 2.577 2.530 -9.425
131 HG22 THR 21 1HG2 THR 21 3.030 3.984 -8.504
132 HG23 THR 21 2HG2 THR 21 4.243 3.153 -9.507
133 H THR 22 H THR 22 1.016 1.750 -7.287
134 HA THR 22 HA THR 22 -0.331 4.102 -7.876
135 HB THR 22 HB THR 22 -1.224 1.254 -7.211
136 HG1 THR 22 1HG THR 22 -1.126 2.898 -9.637
137 HG21 THR 22 3HG2 THR 22 -2.878 3.285 -8.753
138 HG22 THR 22 1HG2 THR 22 -3.403 1.752 -8.016
139 HG23 THR 22 2HG2 THR 22 -3.054 3.162 -6.986
140 H CYS 23 H CYS 23 0.371 2.660 -4.783
141 HA CYS 23 HA CYS 23 -1.834 3.958 -3.485
142 HB2 CYS 23 1HB CYS 23 0.207 1.993 -2.790
143 HB3 CYS 23 2HB CYS 23 -0.017 3.187 -1.527
144 H THR 24 H THR 24 1.733 4.339 -3.912
145 HA THR 24 HA THR 24 1.734 6.772 -2.337
146 HB THR 24 HB THR 24 4.220 6.651 -3.048
147 HG1 THR 24 1HG THR 24 4.022 5.349 -4.921
148 HG21 THR 24 3HG2 THR 24 3.024 5.356 -0.991
149 HG22 THR 24 1HG2 THR 24 3.462 3.936 -1.971
150 HG23 THR 24 2HG2 THR 24 4.727 5.056 -1.411
151 H THR 25 H THR 25 -0.010 7.676 -3.842
152 HA THR 25 HA THR 25 1.378 9.370 -5.743
153 HB THR 25 HB THR 25 -0.545 8.738 -7.434
154 HG1 THR 25 1HG THR 25 -1.498 6.735 -6.906
155 HG21 THR 25 3HG2 THR 25 1.839 8.073 -7.841
156 HG22 THR 25 1HG2 THR 25 1.620 6.675 -6.762
157 HG23 THR 25 2HG2 THR 25 0.719 6.767 -8.295
158 HA PRO 26 HA PRO 26 -1.504 12.214 -4.330
159 HB2 PRO 26 1HB PRO 26 -1.683 13.980 -6.409
160 HB3 PRO 26 2HB PRO 26 -0.355 13.976 -5.265
161 HG2 PRO 26 1HG PRO 26 -0.396 13.013 -8.060
162 HG3 PRO 26 2HG PRO 26 0.984 13.411 -7.056
163 HD2 PRO 26 1HD PRO 26 0.035 10.784 -7.706
164 HD3 PRO 26 2HD PRO 26 1.343 11.184 -6.611
165 H GLY 27 H GLY 27 -3.591 12.017 -3.848
166 HA2 GLY 27 1HA GLY 27 -5.537 12.167 -5.915
167 HA3 GLY 27 2HA GLY 27 -5.310 10.506 -5.401
168 H GLN 28 H GLN 28 -7.620 10.727 -4.665
169 HA GLN 28 HA GLN 28 -7.931 12.376 -2.322
170 HB2 GLN 28 1HB GLN 28 -9.763 10.932 -4.206
171 HB3 GLN 28 2HB GLN 28 -10.333 11.138 -2.562
172 HG2 GLN 28 1HG GLN 28 -10.904 13.274 -3.053
173 HG3 GLN 28 2HG GLN 28 -9.210 13.651 -3.297
174 HE21 GLN 28 1HE2 GLN 28 -9.709 15.119 -4.914
175 HE22 GLN 28 2HE2 GLN 28 -10.171 14.643 -6.514
176 H THR 29 H THR 29 -7.853 8.924 -3.329
177 HA THR 29 HA THR 29 -7.909 8.188 -0.476
178 HB THR 29 HB THR 29 -8.696 5.960 -1.383
179 HG1 THR 29 1HG THR 29 -9.299 6.166 -3.745
180 HG21 THR 29 3HG2 THR 29 -10.733 7.300 -2.795
181 HG22 THR 29 1HG2 THR 29 -10.757 6.912 -1.058
182 HG23 THR 29 2HG2 THR 29 -10.178 8.503 -1.605
183 H CYS 30 H CYS 30 -5.538 9.270 -1.401
184 HA CYS 30 HA CYS 30 -3.839 7.291 -2.464
185 HB2 CYS 30 1HB CYS 30 -3.107 9.444 -2.848
186 HB3 CYS 30 2HB CYS 30 -3.471 9.987 -1.222
187 H TYR 31 H TYR 31 -4.233 8.738 0.858
188 HA TYR 31 HA TYR 31 -2.538 6.798 2.058
189 HB2 TYR 31 1HB TYR 31 -2.961 9.122 2.917
190 HB3 TYR 31 2HB TYR 31 -4.678 8.790 3.032
191 HD1 TYR 31 1HD TYR 31 -5.567 7.355 4.834
192 HD2 TYR 31 2HD TYR 31 -1.407 8.328 4.610
193 HE1 TYR 31 1HE TYR 31 -5.253 6.597 7.241
194 HE2 TYR 31 2HE TYR 31 -1.107 7.567 7.017
195 HH TYR 31 HH TYR 31 -2.303 7.203 8.950
196 H THR 32 H THR 32 -5.948 6.939 1.187
197 HA THR 32 HA THR 32 -6.836 5.036 3.111
198 HB THR 32 HB THR 32 -7.940 6.201 0.510
199 HG1 THR 32 1HG THR 32 -8.474 6.342 3.395
200 HG21 THR 32 3HG2 THR 32 -9.001 4.023 2.309
201 HG22 THR 32 1HG2 THR 32 -10.142 5.287 1.791
202 HG23 THR 32 2HG2 THR 32 -9.300 4.297 0.576
203 H CYS 33 H CYS 33 -5.425 4.861 -0.158
204 HA CYS 33 HA CYS 33 -6.105 2.125 -0.486
205 HB2 CYS 33 1HB CYS 33 -5.808 3.077 -2.522
206 HB3 CYS 33 2HB CYS 33 -4.550 4.165 -1.970
207 H CYS 34 H CYS 34 -3.644 3.983 1.187
208 HA CYS 34 HA CYS 34 -1.607 2.045 1.149
209 HB2 CYS 34 1HB CYS 34 -2.182 4.427 2.901
210 HB3 CYS 34 2HB CYS 34 -0.829 3.360 3.220
211 H SER 35 H SER 35 -4.728 2.067 2.490
212 HA SER 35 HA SER 35 -3.877 0.236 4.595
213 HB2 SER 35 1HB SER 35 -4.956 2.159 5.590
214 HB3 SER 35 2HB SER 35 -6.272 2.107 4.434
215 HG SER 35 HG SER 35 -6.716 1.185 6.627
216 H SER 36 H SER 36 -4.987 0.302 1.496
217 HA SER 36 HA SER 36 -6.924 -1.823 1.937
218 HB2 SER 36 1HB SER 36 -7.661 0.140 0.573
219 HB3 SER 36 2HB SER 36 -6.370 -0.174 -0.570
220 HG SER 36 HG SER 36 -8.047 -2.381 -0.004
221 H CYS 37 H CYS 37 -4.020 -0.865 -0.008
222 HA CYS 37 HA CYS 37 -3.718 -3.620 -0.858
223 HB2 CYS 37 1HB CYS 37 -2.749 -0.992 -1.787
224 HB3 CYS 37 2HB CYS 37 -1.582 -2.293 -1.910
225 H PHE 38 H PHE 38 -3.464 -2.838 2.001
226 HA PHE 38 HA PHE 38 -0.892 -4.017 2.456
227 HB2 PHE 38 1HB PHE 38 -1.657 -1.150 3.255
228 HB3 PHE 38 2HB PHE 38 -0.362 -2.012 4.062
229 HD1 PHE 38 2HD PHE 38 1.080 -3.329 1.941
230 HD2 PHE 38 1HD PHE 38 -0.735 0.507 1.945
231 HE1 PHE 38 2HE PHE 38 2.690 -2.566 0.174
232 HE2 PHE 38 1HE PHE 38 0.876 1.270 0.177
233 HZ PHE 38 HZ PHE 38 2.569 -0.275 -0.687
234 H ASP 39 H ASP 39 -0.531 -4.244 4.947
235 HA ASP 39 HA ASP 39 -3.163 -4.733 6.096
236 HB2 ASP 39 1HB ASP 39 -1.899 -6.795 5.799
237 HB3 ASP 39 2HB ASP 39 -0.464 -6.087 6.513
238 H VAL 40 H VAL 40 -0.295 -5.141 8.078
239 HA VAL 40 HA VAL 40 -1.040 -2.776 9.606
240 HB VAL 40 HB VAL 40 -0.869 -5.014 10.665
241 HG11 VAL 40 1HG1 VAL 40 2.122 -4.742 10.232
242 HG12 VAL 40 2HG1 VAL 40 1.256 -6.083 11.019
243 HG13 VAL 40 3HG1 VAL 40 1.065 -5.803 9.271
244 HG21 VAL 40 3HG2 VAL 40 0.208 -4.251 12.658
245 HG22 VAL 40 1HG2 VAL 40 1.214 -3.097 11.750
246 HG23 VAL 40 2HG2 VAL 40 -0.540 -2.830 11.891
247 H VAL 41 H VAL 41 1.928 -4.387 8.260
248 HA VAL 41 HA VAL 41 3.515 -2.074 8.709
249 HB VAL 41 HB VAL 41 3.973 -4.518 6.986
250 HG11 VAL 41 1HG1 VAL 41 5.434 -2.587 6.423
251 HG12 VAL 41 2HG1 VAL 41 5.992 -2.549 8.114
252 HG13 VAL 41 3HG1 VAL 41 6.334 -3.969 7.095
253 HG21 VAL 41 3HG2 VAL 41 4.177 -4.018 9.908
254 HG22 VAL 41 1HG2 VAL 41 3.872 -5.528 9.017
255 HG23 VAL 41 2HG2 VAL 41 5.531 -4.900 9.161
256 H GLY 42 H GLY 42 2.232 -3.672 5.703
257 HA2 GLY 42 1HA GLY 42 3.035 -1.973 3.784
258 HA3 GLY 42 2HA GLY 42 1.450 -2.720 3.802
259 H GLU 43 H GLU 43 0.587 -1.318 6.315
260 HA GLU 43 HA GLU 43 -0.269 1.067 5.007
261 HB2 GLU 43 1HB GLU 43 -1.569 -0.569 6.654
262 HB3 GLU 43 2HB GLU 43 -0.868 0.443 7.901
263 HG2 GLU 43 1HG GLU 43 -2.089 1.936 5.623
264 HG3 GLU 43 2HG GLU 43 -3.224 1.005 6.580
265 H GLN 44 H GLN 44 1.503 0.257 8.078
266 HA GLN 44 HA GLN 44 2.063 2.910 8.686
267 HB2 GLN 44 1HB GLN 44 3.364 2.049 10.456
268 HB3 GLN 44 2HB GLN 44 2.178 0.789 10.180
269 HG2 GLN 44 1HG GLN 44 3.953 -0.628 10.009
270 HG3 GLN 44 2HG GLN 44 4.190 0.054 8.412
271 HE21 GLN 44 1HE2 GLN 44 6.248 -1.019 9.900
272 HE22 GLN 44 2HE2 GLN 44 7.373 0.215 10.357
273 H ALA 45 H ALA 45 3.371 0.746 6.304
274 HA ALA 45 HA ALA 45 5.921 2.105 6.168
275 HB1 ALA 45 3HB ALA 45 4.710 -0.005 4.339
276 HB2 ALA 45 1HB ALA 45 6.424 0.464 4.455
277 HB3 ALA 45 2HB ALA 45 5.635 -0.370 5.816
278 H CYS 46 H CYS 46 2.851 1.792 4.286
279 HA CYS 46 HA CYS 46 3.773 3.585 2.278
280 HB2 CYS 46 1HB CYS 46 2.164 1.795 1.807
281 HB3 CYS 46 2HB CYS 46 0.994 2.546 2.874
282 H GLN 47 H GLN 47 2.348 3.787 5.467
283 HA GLN 47 HA GLN 47 0.964 6.179 5.165
284 HB2 GLN 47 1HB GLN 47 1.962 4.501 7.417
285 HB3 GLN 47 2HB GLN 47 1.713 6.190 7.811
286 HG2 GLN 47 1HG GLN 47 -0.594 5.746 6.444
287 HG3 GLN 47 2HG GLN 47 -0.297 4.110 6.997
288 HE21 GLN 47 1HE2 GLN 47 0.265 7.341 8.392
289 HE22 GLN 47 2HE2 GLN 47 -0.588 7.090 9.878
290 H MET 48 H MET 48 4.349 5.433 6.211
291 HA MET 48 HA MET 48 4.978 8.130 6.674
292 HB2 MET 48 1HB MET 48 6.414 5.487 6.481
293 HB3 MET 48 2HB MET 48 7.410 6.912 6.261
294 HG2 MET 48 1HG MET 48 5.652 7.368 8.522
295 HG3 MET 48 2HG MET 48 6.425 5.809 8.728
296 HE1 MET 48 3HE MET 48 8.247 9.044 10.554
297 HE2 MET 48 1HE MET 48 6.541 8.752 10.138
298 HE3 MET 48 2HE MET 48 7.473 7.506 11.003
299 H SER 49 H SER 49 5.361 5.889 3.882
300 HA SER 49 HA SER 49 6.888 7.740 2.401
301 HB2 SER 49 1HB SER 49 7.010 5.296 2.020
302 HB3 SER 49 2HB SER 49 5.329 5.268 1.526
303 HG SER 49 HG SER 49 5.869 6.622 -0.290
304 H ALA 50 H ALA 50 3.437 7.046 2.877
305 HA ALA 50 HA ALA 50 2.274 8.038 0.643
306 HB1 ALA 50 3HB ALA 50 0.864 7.146 2.296
307 HB2 ALA 50 1HB ALA 50 1.565 8.160 3.580
308 HB3 ALA 50 2HB ALA 50 0.495 8.887 2.357
309 H GLN 51 H GLN 51 2.978 9.796 -0.494
310 HA GLN 51 HA GLN 51 3.569 12.178 1.067
311 HB2 GLN 51 1HB GLN 51 4.920 10.926 -1.084
312 HB3 GLN 51 2HB GLN 51 4.212 12.371 -1.779
313 HG2 GLN 51 1HG GLN 51 5.190 13.694 0.176
314 HG3 GLN 51 2HG GLN 51 6.025 12.237 0.674
315 HE21 GLN 51 1HE2 GLN 51 7.032 14.834 -0.245
316 HE22 GLN 51 2HE2 GLN 51 8.079 14.528 -1.591
317 H CYS 52 H CYS 52 0.923 11.834 1.077
318 HA CYS 52 HA CYS 52 -0.011 13.603 -1.064
319 HB2 CYS 52 1HB CYS 52 -2.288 12.359 -0.416
320 HB3 CYS 52 2HB CYS 52 -1.228 11.838 -1.711
Start of MODEL 10
1 H1 ASN 1 1H ASN 1 11.269 -5.468 1.247
2 HA ASN 1 HA ASN 1 9.865 -3.960 -0.757
3 HB2 ASN 1 1HB ASN 1 10.954 -6.718 -0.463
4 HB3 ASN 1 2HB ASN 1 9.416 -6.663 -1.300
5 HD21 ASN 1 1HD2 ASN 1 9.460 -6.350 -3.386
6 HD22 ASN 1 2HD2 ASN 1 10.722 -5.607 -4.312
7 HA PRO 2 HA PRO 2 5.972 -4.845 1.062
8 HB2 PRO 2 1HB PRO 2 4.298 -4.640 -1.088
9 HB3 PRO 2 2HB PRO 2 4.913 -3.250 -0.217
10 HG2 PRO 2 1HG PRO 2 5.727 -4.287 -2.863
11 HG3 PRO 2 2HG PRO 2 6.007 -2.701 -2.172
12 HD2 PRO 2 1HD PRO 2 7.913 -4.831 -2.409
13 HD3 PRO 2 2HD PRO 2 8.158 -3.288 -1.615
14 H GLU 3 H GLU 3 7.561 -6.980 -0.795
15 HA GLU 3 HA GLU 3 5.622 -8.808 -1.449
16 HB2 GLU 3 1HB GLU 3 7.449 -10.425 -1.603
17 HB3 GLU 3 2HB GLU 3 7.994 -8.876 -2.215
18 HG2 GLU 3 1HG GLU 3 8.989 -8.394 0.078
19 HG3 GLU 3 2HG GLU 3 8.561 -10.023 0.558
20 H ASP 4 H ASP 4 7.126 -8.020 1.665
21 HA ASP 4 HA ASP 4 6.179 -10.421 2.881
22 HB2 ASP 4 1HB ASP 4 7.046 -7.979 4.438
23 HB3 ASP 4 2HB ASP 4 7.298 -9.670 4.824
24 H TRP 5 H TRP 5 5.070 -7.168 2.175
25 HA TRP 5 HA TRP 5 2.818 -7.529 4.034
26 HB2 TRP 5 1HB TRP 5 3.256 -4.810 3.085
27 HB3 TRP 5 2HB TRP 5 2.959 -5.413 4.703
28 HD1 TRP 5 HD TRP 5 5.464 -6.875 5.589
29 HE1 TRP 5 1HE TRP 5 7.899 -5.865 5.707
30 HE3 TRP 5 3HE TRP 5 4.634 -3.120 2.263
31 HZ2 TRP 5 2HZ TRP 5 9.176 -3.659 4.424
32 HZ3 TRP 5 3HZ TRP 5 6.528 -1.582 1.751
33 HH2 TRP 5 HH TRP 5 8.738 -1.805 2.771
34 H PHE 6 H PHE 6 1.443 -5.229 2.677
35 HA PHE 6 HA PHE 6 -0.015 -4.907 1.056
36 HB2 PHE 6 1HB PHE 6 1.904 -4.607 -0.413
37 HB3 PHE 6 2HB PHE 6 2.295 -6.314 -0.374
38 HD1 PHE 6 2HD PHE 6 -0.636 -4.199 -1.346
39 HD2 PHE 6 1HD PHE 6 1.899 -7.459 -2.324
40 HE1 PHE 6 2HE PHE 6 -1.897 -4.536 -3.490
41 HE2 PHE 6 1HE PHE 6 0.638 -7.797 -4.467
42 HZ PHE 6 HZ PHE 6 -1.245 -6.331 -5.025
43 H THR 7 H THR 7 -1.976 -5.869 0.806
44 HA THR 7 HA THR 7 -1.982 -8.803 0.533
45 HB THR 7 HB THR 7 -4.205 -8.625 1.715
46 HG1 THR 7 1HG THR 7 -4.223 -6.241 0.864
47 HG21 THR 7 3HG2 THR 7 -1.796 -8.569 2.957
48 HG22 THR 7 1HG2 THR 7 -2.365 -6.946 3.414
49 HG23 THR 7 2HG2 THR 7 -3.316 -8.382 3.864
50 HA PRO 8 HA PRO 8 -3.641 -7.521 -3.353
51 HB2 PRO 8 1HB PRO 8 -2.739 -9.667 -4.784
52 HB3 PRO 8 2HB PRO 8 -1.819 -8.188 -4.593
53 HG2 PRO 8 1HG PRO 8 -1.411 -10.807 -3.284
54 HG3 PRO 8 2HG PRO 8 -0.288 -9.471 -3.440
55 HD2 PRO 8 1HD PRO 8 -1.767 -10.204 -1.094
56 HD3 PRO 8 2HD PRO 8 -0.734 -8.801 -1.286
57 H ASP 9 H ASP 9 -4.441 -9.749 -1.136
58 HA ASP 9 HA ASP 9 -6.330 -11.099 -2.827
59 HB2 ASP 9 1HB ASP 9 -4.949 -11.759 -0.480
60 HB3 ASP 9 2HB ASP 9 -6.576 -11.465 0.101
61 H THR 10 H THR 10 -6.102 -8.141 -1.214
62 HA THR 10 HA THR 10 -8.998 -7.855 -1.157
63 HB THR 10 HB THR 10 -8.403 -8.584 1.145
64 HG1 THR 10 1HG THR 10 -9.746 -6.931 1.769
65 HG21 THR 10 3HG2 THR 10 -7.021 -6.175 1.986
66 HG22 THR 10 1HG2 THR 10 -6.500 -7.866 2.181
67 HG23 THR 10 2HG2 THR 10 -6.066 -6.965 0.708
68 H CYS 11 H CYS 11 -7.311 -6.951 -3.145
69 HA CYS 11 HA CYS 11 -7.768 -4.151 -2.884
70 HB2 CYS 11 1HB CYS 11 -5.349 -4.893 -1.910
71 HB3 CYS 11 2HB CYS 11 -4.941 -4.663 -3.598
72 H ALA 12 H ALA 12 -7.154 -3.067 -5.068
73 HA ALA 12 HA ALA 12 -7.716 -5.007 -7.176
74 HB1 ALA 12 3HB ALA 12 -8.861 -3.321 -8.207
75 HB2 ALA 12 1HB ALA 12 -8.903 -2.639 -6.564
76 HB3 ALA 12 2HB ALA 12 -7.677 -2.081 -7.728
77 H TYR 13 H TYR 13 -5.191 -5.431 -6.339
78 HA TYR 13 HA TYR 13 -3.643 -4.330 -8.547
79 HB2 TYR 13 1HB TYR 13 -2.776 -4.434 -5.592
80 HB3 TYR 13 2HB TYR 13 -1.814 -3.788 -6.907
81 HD1 TYR 13 2HD TYR 13 -4.974 -3.237 -5.000
82 HD2 TYR 13 1HD TYR 13 -1.979 -1.513 -7.523
83 HE1 TYR 13 2HE TYR 13 -5.944 -0.924 -4.584
84 HE2 TYR 13 1HE TYR 13 -2.960 0.794 -7.098
85 HH TYR 13 HH TYR 13 -5.871 1.175 -5.101
86 H GLY 14 H GLY 14 -2.156 -5.784 -9.390
87 HA2 GLY 14 1HA GLY 14 -2.276 -8.483 -8.255
88 HA3 GLY 14 2HA GLY 14 -1.754 -8.029 -9.865
89 H ASP 15 H ASP 15 0.002 -5.807 -9.042
90 HA ASP 15 HA ASP 15 2.172 -7.464 -8.086
91 HB2 ASP 15 1HB ASP 15 2.226 -4.648 -9.267
92 HB3 ASP 15 2HB ASP 15 3.629 -5.647 -8.945
93 H SER 16 H SER 16 3.604 -6.614 -6.346
94 HA SER 16 HA SER 16 2.093 -5.099 -4.446
95 HB2 SER 16 1HB SER 16 3.987 -5.633 -2.911
96 HB3 SER 16 2HB SER 16 3.316 -7.065 -3.667
97 HG SER 16 HG SER 16 5.779 -5.702 -4.302
98 H ASN 17 H ASN 17 5.018 -4.779 -6.505
99 HA ASN 17 HA ASN 17 5.972 -2.455 -5.333
100 HB2 ASN 17 1HB ASN 17 7.178 -3.994 -6.999
101 HB3 ASN 17 2HB ASN 17 6.215 -3.275 -8.274
102 HD21 ASN 17 1HD2 ASN 17 8.817 -2.877 -6.039
103 HD22 ASN 17 2HD2 ASN 17 9.427 -1.359 -6.609
104 H THR 18 H THR 18 3.655 -3.153 -8.015
105 HA THR 18 HA THR 18 3.342 -0.418 -8.769
106 HB THR 18 HB THR 18 2.920 -2.784 -10.009
107 HG1 THR 18 1HG THR 18 2.460 -1.125 -11.397
108 HG21 THR 18 3HG2 THR 18 0.614 -3.397 -10.111
109 HG22 THR 18 1HG2 THR 18 0.901 -3.182 -8.368
110 HG23 THR 18 2HG2 THR 18 0.094 -1.899 -9.301
111 H ALA 19 H ALA 19 1.626 -2.682 -6.576
112 HA ALA 19 HA ALA 19 -0.610 -1.104 -6.127
113 HB1 ALA 19 3HB ALA 19 -0.372 -3.464 -5.448
114 HB2 ALA 19 1HB ALA 19 0.859 -3.000 -4.250
115 HB3 ALA 19 2HB ALA 19 -0.821 -2.443 -4.061
116 H TRP 20 H TRP 20 2.466 -1.327 -4.194
117 HA TRP 20 HA TRP 20 1.839 0.704 -2.422
118 HB2 TRP 20 1HB TRP 20 3.623 -0.810 -1.975
119 HB3 TRP 20 2HB TRP 20 4.478 -0.350 -3.434
120 HD1 TRP 20 HD TRP 20 5.045 2.583 -3.341
121 HE1 TRP 20 1HE TRP 20 6.238 3.920 -1.403
122 HE3 TRP 20 3HE TRP 20 4.094 -0.827 0.309
123 HZ2 TRP 20 2HZ TRP 20 6.641 3.413 1.376
124 HZ3 TRP 20 3HZ TRP 20 4.922 -0.329 2.608
125 HH2 TRP 20 HH TRP 20 6.155 1.705 3.168
126 H THR 21 H THR 21 3.492 0.746 -5.643
127 HA THR 21 HA THR 21 4.122 3.460 -5.671
128 HB THR 21 HB THR 21 3.842 1.186 -7.603
129 HG1 THR 21 1HG THR 21 5.821 1.939 -6.481
130 HG21 THR 21 3HG2 THR 21 2.906 2.605 -9.203
131 HG22 THR 21 1HG2 THR 21 3.437 4.076 -8.353
132 HG23 THR 21 2HG2 THR 21 4.597 3.144 -9.330
133 H THR 22 H THR 22 1.265 1.824 -7.207
134 HA THR 22 HA THR 22 0.011 4.193 -7.953
135 HB THR 22 HB THR 22 -1.067 1.410 -7.260
136 HG1 THR 22 1HG THR 22 -0.963 1.492 -9.736
137 HG21 THR 22 3HG2 THR 22 -2.907 2.046 -8.868
138 HG22 THR 22 1HG2 THR 22 -2.957 3.011 -7.373
139 HG23 THR 22 2HG2 THR 22 -2.291 3.717 -8.865
140 H CYS 23 H CYS 23 0.499 2.831 -4.797
141 HA CYS 23 HA CYS 23 -1.789 4.178 -3.687
142 HB2 CYS 23 1HB CYS 23 0.011 2.091 -2.872
143 HB3 CYS 23 2HB CYS 23 -0.011 3.343 -1.645
144 H THR 24 H THR 24 1.782 4.507 -3.970
145 HA THR 24 HA THR 24 1.781 6.909 -2.346
146 HB THR 24 HB THR 24 4.275 6.769 -2.965
147 HG1 THR 24 1HG THR 24 4.730 5.220 -4.496
148 HG21 THR 24 3HG2 THR 24 2.969 5.351 -1.040
149 HG22 THR 24 1HG2 THR 24 3.501 4.001 -2.072
150 HG23 THR 24 2HG2 THR 24 4.702 5.117 -1.376
151 H THR 25 H THR 25 -0.018 7.310 -4.366
152 HA THR 25 HA THR 25 1.422 9.308 -5.954
153 HB THR 25 HB THR 25 -0.127 8.544 -7.895
154 HG1 THR 25 1HG THR 25 -1.387 6.816 -7.318
155 HG21 THR 25 3HG2 THR 25 1.793 7.537 -8.617
156 HG22 THR 25 1HG2 THR 25 2.367 7.370 -6.940
157 HG23 THR 25 2HG2 THR 25 1.346 6.102 -7.662
158 HA PRO 26 HA PRO 26 -1.875 11.844 -4.909
159 HB2 PRO 26 1HB PRO 26 -2.034 13.563 -7.028
160 HB3 PRO 26 2HB PRO 26 -0.831 13.711 -5.762
161 HG2 PRO 26 1HG PRO 26 -0.498 12.726 -8.529
162 HG3 PRO 26 2HG PRO 26 0.728 13.277 -7.405
163 HD2 PRO 26 1HD PRO 26 0.129 10.558 -8.094
164 HD3 PRO 26 2HD PRO 26 1.274 11.105 -6.886
165 H GLY 27 H GLY 27 -3.931 11.298 -4.604
166 HA2 GLY 27 1HA GLY 27 -5.628 11.159 -6.938
167 HA3 GLY 27 2HA GLY 27 -5.358 9.614 -6.157
168 H GLN 28 H GLN 28 -7.337 9.225 -5.174
169 HA GLN 28 HA GLN 28 -8.314 11.360 -3.450
170 HB2 GLN 28 1HB GLN 28 -10.517 10.220 -3.588
171 HB3 GLN 28 2HB GLN 28 -9.919 10.668 -5.173
172 HG2 GLN 28 1HG GLN 28 -8.878 8.057 -4.632
173 HG3 GLN 28 2HG GLN 28 -10.563 8.023 -4.151
174 HE21 GLN 28 1HE2 GLN 28 -10.817 6.539 -5.911
175 HE22 GLN 28 2HE2 GLN 28 -11.049 7.110 -7.530
176 H THR 29 H THR 29 -7.200 7.993 -3.632
177 HA THR 29 HA THR 29 -7.377 7.872 -0.697
178 HB THR 29 HB THR 29 -7.858 5.395 -1.043
179 HG1 THR 29 1HG THR 29 -8.207 4.782 -3.230
180 HG21 THR 29 3HG2 THR 29 -10.183 5.789 -2.218
181 HG22 THR 29 1HG2 THR 29 -9.891 6.583 -0.652
182 HG23 THR 29 2HG2 THR 29 -9.738 7.512 -2.163
183 H CYS 30 H CYS 30 -5.162 8.992 -1.579
184 HA CYS 30 HA CYS 30 -3.210 7.154 -2.447
185 HB2 CYS 30 1HB CYS 30 -2.956 9.490 -2.918
186 HB3 CYS 30 2HB CYS 30 -3.016 9.905 -1.217
187 H TYR 31 H TYR 31 -4.514 8.260 0.685
188 HA TYR 31 HA TYR 31 -2.514 6.603 2.060
189 HB2 TYR 31 1HB TYR 31 -2.698 9.047 2.665
190 HB3 TYR 31 2HB TYR 31 -4.427 8.872 2.895
191 HD1 TYR 31 2HD TYR 31 -5.312 7.629 4.862
192 HD2 TYR 31 1HD TYR 31 -1.128 8.377 4.374
193 HE1 TYR 31 2HE TYR 31 -4.923 7.095 7.316
194 HE2 TYR 31 1HE TYR 31 -0.753 7.840 6.830
195 HH TYR 31 HH TYR 31 -1.654 6.956 8.635
196 H THR 32 H THR 32 -5.868 6.888 1.139
197 HA THR 32 HA THR 32 -6.830 5.229 3.300
198 HB THR 32 HB THR 32 -8.020 6.524 0.804
199 HG1 THR 32 1HG THR 32 -8.514 7.976 2.410
200 HG21 THR 32 3HG2 THR 32 -9.735 5.005 0.922
201 HG22 THR 32 1HG2 THR 32 -9.076 4.279 2.407
202 HG23 THR 32 2HG2 THR 32 -10.112 5.722 2.507
203 H CYS 33 H CYS 33 -5.477 4.817 0.085
204 HA CYS 33 HA CYS 33 -6.634 2.267 -0.348
205 HB2 CYS 33 1HB CYS 33 -5.174 2.106 -2.233
206 HB3 CYS 33 2HB CYS 33 -5.852 3.721 -2.170
207 H CYS 34 H CYS 34 -3.549 3.577 0.994
208 HA CYS 34 HA CYS 34 -2.206 1.173 1.236
209 HB2 CYS 34 1HB CYS 34 -2.030 3.679 2.920
210 HB3 CYS 34 2HB CYS 34 -0.903 2.341 3.020
211 H SER 35 H SER 35 -5.039 2.408 2.818
212 HA SER 35 HA SER 35 -4.631 0.814 5.174
213 HB2 SER 35 1HB SER 35 -5.706 2.834 5.703
214 HB3 SER 35 2HB SER 35 -6.683 2.822 4.249
215 HG SER 35 HG SER 35 -8.005 2.313 6.053
216 H SER 36 H SER 36 -5.416 0.132 2.040
217 HA SER 36 HA SER 36 -6.957 -2.159 2.882
218 HB2 SER 36 1HB SER 36 -7.857 -0.108 0.836
219 HB3 SER 36 2HB SER 36 -8.395 -1.772 0.719
220 HG SER 36 HG SER 36 -9.752 -1.468 2.351
221 H CYS 37 H CYS 37 -4.161 -1.298 1.811
222 HA CYS 37 HA CYS 37 -4.103 -3.315 -0.297
223 HB2 CYS 37 1HB CYS 37 -3.607 -0.520 -0.657
224 HB3 CYS 37 2HB CYS 37 -2.095 -1.380 -0.861
225 H PHE 38 H PHE 38 -3.472 -2.871 2.757
226 HA PHE 38 HA PHE 38 -0.999 -4.330 2.670
227 HB2 PHE 38 1HB PHE 38 -1.341 -1.575 4.000
228 HB3 PHE 38 2HB PHE 38 0.027 -2.625 4.314
229 HD1 PHE 38 2HD PHE 38 1.284 -3.430 2.093
230 HD2 PHE 38 1HD PHE 38 -1.074 0.082 2.423
231 HE1 PHE 38 2HE PHE 38 2.500 -2.430 0.138
232 HE2 PHE 38 1HE PHE 38 0.142 1.082 0.468
233 HZ PHE 38 HZ PHE 38 1.914 -0.186 -0.651
234 H ASP 39 H ASP 39 -0.275 -4.705 5.137
235 HA ASP 39 HA ASP 39 -2.742 -5.465 6.457
236 HB2 ASP 39 1HB ASP 39 -1.328 -7.356 6.212
237 HB3 ASP 39 2HB ASP 39 0.124 -6.435 6.547
238 H VAL 40 H VAL 40 0.556 -4.992 7.859
239 HA VAL 40 HA VAL 40 -0.481 -2.726 9.406
240 HB VAL 40 HB VAL 40 -0.462 -5.016 10.590
241 HG11 VAL 40 1HG1 VAL 40 2.500 -4.379 10.784
242 HG12 VAL 40 2HG1 VAL 40 1.640 -5.742 11.539
243 HG13 VAL 40 3HG1 VAL 40 1.804 -5.665 9.768
244 HG21 VAL 40 3HG2 VAL 40 -0.883 -3.236 11.996
245 HG22 VAL 40 1HG2 VAL 40 0.649 -3.839 12.673
246 HG23 VAL 40 2HG2 VAL 40 0.648 -2.418 11.602
247 H VAL 41 H VAL 41 2.330 -4.598 8.145
248 HA VAL 41 HA VAL 41 4.176 -2.510 8.738
249 HB VAL 41 HB VAL 41 4.556 -4.740 6.751
250 HG11 VAL 41 1HG1 VAL 41 6.312 -2.966 7.050
251 HG12 VAL 41 2HG1 VAL 41 6.493 -3.509 8.736
252 HG13 VAL 41 3HG1 VAL 41 6.865 -4.622 7.397
253 HG21 VAL 41 3HG2 VAL 41 4.213 -4.916 9.717
254 HG22 VAL 41 1HG2 VAL 41 3.783 -6.080 8.441
255 HG23 VAL 41 2HG2 VAL 41 5.478 -5.914 8.959
256 H GLY 42 H GLY 42 2.565 -3.747 5.730
257 HA2 GLY 42 1HA GLY 42 3.682 -1.847 3.992
258 HA3 GLY 42 2HA GLY 42 2.219 -2.776 3.733
259 H GLU 43 H GLU 43 0.775 -1.811 6.116
260 HA GLU 43 HA GLU 43 -0.235 0.554 4.955
261 HB2 GLU 43 1HB GLU 43 -1.748 -1.010 6.047
262 HB3 GLU 43 2HB GLU 43 -0.863 -0.903 7.555
263 HG2 GLU 43 1HG GLU 43 -1.405 1.644 7.498
264 HG3 GLU 43 2HG GLU 43 -2.554 1.256 6.234
265 H GLN 44 H GLN 44 1.659 -0.250 7.927
266 HA GLN 44 HA GLN 44 1.702 2.448 8.772
267 HB2 GLN 44 1HB GLN 44 2.932 1.666 10.626
268 HB3 GLN 44 2HB GLN 44 1.942 0.285 10.195
269 HG2 GLN 44 1HG GLN 44 3.922 -0.864 10.209
270 HG3 GLN 44 2HG GLN 44 4.136 -0.184 8.608
271 HE21 GLN 44 1HE2 GLN 44 6.405 -0.506 9.135
272 HE22 GLN 44 2HE2 GLN 44 7.278 0.726 9.984
273 H ALA 45 H ALA 45 3.596 0.439 6.591
274 HA ALA 45 HA ALA 45 5.894 2.178 6.679
275 HB1 ALA 45 3HB ALA 45 6.697 0.645 4.873
276 HB2 ALA 45 1HB ALA 45 6.199 -0.218 6.348
277 HB3 ALA 45 2HB ALA 45 5.127 -0.191 4.927
278 H CYS 46 H CYS 46 2.987 1.586 4.665
279 HA CYS 46 HA CYS 46 3.859 3.292 2.576
280 HB2 CYS 46 1HB CYS 46 2.261 1.444 2.249
281 HB3 CYS 46 2HB CYS 46 1.085 2.284 3.240
282 H GLN 47 H GLN 47 2.210 3.614 5.696
283 HA GLN 47 HA GLN 47 0.847 5.947 5.301
284 HB2 GLN 47 1HB GLN 47 2.019 4.509 7.640
285 HB3 GLN 47 2HB GLN 47 1.662 6.204 7.905
286 HG2 GLN 47 1HG GLN 47 -0.672 5.896 7.264
287 HG3 GLN 47 2HG GLN 47 -0.362 4.267 6.695
288 HE21 GLN 47 1HE2 GLN 47 0.176 6.258 9.603
289 HE22 GLN 47 2HE2 GLN 47 -0.310 5.076 10.772
290 H MET 48 H MET 48 4.263 5.487 6.453
291 HA MET 48 HA MET 48 4.771 8.228 6.603
292 HB2 MET 48 1HB MET 48 6.528 5.732 6.369
293 HB3 MET 48 2HB MET 48 7.234 7.328 6.525
294 HG2 MET 48 1HG MET 48 5.163 7.043 8.537
295 HG3 MET 48 2HG MET 48 6.210 5.639 8.615
296 HE1 MET 48 3HE MET 48 9.397 6.705 8.191
297 HE2 MET 48 1HE MET 48 9.359 6.611 9.968
298 HE3 MET 48 2HE MET 48 8.384 5.483 8.996
299 H SER 49 H SER 49 4.855 5.867 3.960
300 HA SER 49 HA SER 49 6.499 7.461 2.300
301 HB2 SER 49 1HB SER 49 5.548 4.820 2.289
302 HB3 SER 49 2HB SER 49 4.737 5.548 0.917
303 HG SER 49 HG SER 49 6.585 5.600 -0.167
304 H ALA 50 H ALA 50 2.991 7.019 2.869
305 HA ALA 50 HA ALA 50 1.883 8.122 0.660
306 HB1 ALA 50 3HB ALA 50 0.465 7.269 2.353
307 HB2 ALA 50 1HB ALA 50 1.189 8.308 3.604
308 HB3 ALA 50 2HB ALA 50 0.145 9.020 2.351
309 H GLN 51 H GLN 51 2.556 9.887 -0.462
310 HA GLN 51 HA GLN 51 3.147 12.249 1.147
311 HB2 GLN 51 1HB GLN 51 4.829 10.889 -0.700
312 HB3 GLN 51 2HB GLN 51 4.327 12.357 -1.515
313 HG2 GLN 51 1HG GLN 51 5.097 12.717 1.346
314 HG3 GLN 51 2HG GLN 51 6.404 12.213 0.293
315 HE21 GLN 51 1HE2 GLN 51 7.561 13.990 0.028
316 HE22 GLN 51 2HE2 GLN 51 6.995 15.504 -0.595
317 H CYS 52 H CYS 52 0.539 11.966 0.667
318 HA CYS 52 HA CYS 52 0.086 13.821 -1.540
319 HB2 CYS 52 1HB CYS 52 -1.850 11.587 -0.980
320 HB3 CYS 52 2HB CYS 52 -1.780 12.659 -2.365
Start of MODEL 11
1 H1 ASN 1 1H ASN 1 10.290 -6.151 -1.233
2 HA ASN 1 HA ASN 1 10.750 -5.145 0.756
3 HB2 ASN 1 1HB ASN 1 10.271 -2.762 -0.797
4 HB3 ASN 1 2HB ASN 1 9.213 -2.679 0.598
5 HD21 ASN 1 1HD2 ASN 1 10.187 -1.224 1.837
6 HD22 ASN 1 2HD2 ASN 1 11.793 -1.335 2.475
7 HA PRO 2 HA PRO 2 6.016 -4.681 1.236
8 HB2 PRO 2 1HB PRO 2 4.441 -4.480 -0.987
9 HB3 PRO 2 2HB PRO 2 4.998 -3.089 -0.078
10 HG2 PRO 2 1HG PRO 2 5.945 -4.095 -2.691
11 HG3 PRO 2 2HG PRO 2 6.173 -2.511 -1.977
12 HD2 PRO 2 1HD PRO 2 8.115 -4.616 -2.140
13 HD3 PRO 2 2HD PRO 2 8.304 -3.076 -1.325
14 H GLU 3 H GLU 3 7.726 -6.788 -0.525
15 HA GLU 3 HA GLU 3 5.832 -8.635 -1.287
16 HB2 GLU 3 1HB GLU 3 7.719 -10.258 -1.269
17 HB3 GLU 3 2HB GLU 3 8.164 -8.744 -2.030
18 HG2 GLU 3 1HG GLU 3 8.936 -8.110 0.467
19 HG3 GLU 3 2HG GLU 3 9.023 -9.852 0.643
20 H ASP 4 H ASP 4 7.239 -7.872 1.885
21 HA ASP 4 HA ASP 4 6.262 -10.286 3.045
22 HB2 ASP 4 1HB ASP 4 7.068 -7.848 4.644
23 HB3 ASP 4 2HB ASP 4 7.301 -9.540 5.039
24 H TRP 5 H TRP 5 5.033 -7.182 2.159
25 HA TRP 5 HA TRP 5 2.766 -7.526 4.001
26 HB2 TRP 5 1HB TRP 5 3.188 -4.796 3.081
27 HB3 TRP 5 2HB TRP 5 2.848 -5.413 4.685
28 HD1 TRP 5 HD TRP 5 5.373 -6.871 5.596
29 HE1 TRP 5 1HE TRP 5 7.774 -5.799 5.820
30 HE3 TRP 5 3HE TRP 5 4.527 -3.018 2.387
31 HZ2 TRP 5 2HZ TRP 5 9.022 -3.512 4.656
32 HZ3 TRP 5 3HZ TRP 5 6.390 -1.410 1.987
33 HH2 TRP 5 HH TRP 5 8.576 -1.610 3.061
34 H PHE 6 H PHE 6 1.387 -5.260 2.610
35 HA PHE 6 HA PHE 6 -0.024 -4.971 0.942
36 HB2 PHE 6 1HB PHE 6 1.906 -4.549 -0.461
37 HB3 PHE 6 2HB PHE 6 2.419 -6.224 -0.397
38 HD1 PHE 6 1HD PHE 6 -0.467 -4.188 -1.615
39 HD2 PHE 6 2HD PHE 6 2.055 -7.540 -2.255
40 HE1 PHE 6 1HE PHE 6 -1.599 -4.619 -3.813
41 HE2 PHE 6 2HE PHE 6 0.923 -7.971 -4.454
42 HZ PHE 6 HZ PHE 6 -0.890 -6.506 -5.207
43 H THR 7 H THR 7 -1.936 -6.019 0.686
44 HA THR 7 HA THR 7 -1.808 -8.938 0.309
45 HB THR 7 HB THR 7 -4.035 -8.916 1.457
46 HG1 THR 7 1HG THR 7 -4.507 -6.671 2.377
47 HG21 THR 7 3HG2 THR 7 -1.663 -8.637 2.759
48 HG22 THR 7 1HG2 THR 7 -2.409 -7.085 3.210
49 HG23 THR 7 2HG2 THR 7 -3.219 -8.616 3.623
50 HA PRO 8 HA PRO 8 -3.416 -7.700 -3.595
51 HB2 PRO 8 1HB PRO 8 -2.543 -9.887 -4.981
52 HB3 PRO 8 2HB PRO 8 -1.587 -8.431 -4.787
53 HG2 PRO 8 1HG PRO 8 -1.278 -11.044 -3.438
54 HG3 PRO 8 2HG PRO 8 -0.116 -9.741 -3.587
55 HD2 PRO 8 1HD PRO 8 -1.663 -10.404 -1.265
56 HD3 PRO 8 2HD PRO 8 -0.588 -9.033 -1.451
57 H ASP 9 H ASP 9 -4.338 -9.853 -1.362
58 HA ASP 9 HA ASP 9 -6.203 -11.210 -3.067
59 HB2 ASP 9 1HB ASP 9 -5.750 -11.260 -0.047
60 HB3 ASP 9 2HB ASP 9 -6.935 -12.259 -0.865
61 H THR 10 H THR 10 -5.938 -8.318 -1.156
62 HA THR 10 HA THR 10 -8.845 -7.928 -1.333
63 HB THR 10 HB THR 10 -8.405 -8.508 0.995
64 HG1 THR 10 1HG THR 10 -9.731 -6.633 0.771
65 HG21 THR 10 3HG2 THR 10 -5.837 -7.804 0.727
66 HG22 THR 10 1HG2 THR 10 -6.442 -6.214 1.250
67 HG23 THR 10 2HG2 THR 10 -6.647 -7.635 2.303
68 H CYS 11 H CYS 11 -6.945 -7.160 -3.289
69 HA CYS 11 HA CYS 11 -7.367 -4.311 -3.119
70 HB2 CYS 11 1HB CYS 11 -5.000 -5.047 -2.199
71 HB3 CYS 11 2HB CYS 11 -4.610 -5.162 -3.903
72 H ALA 12 H ALA 12 -7.375 -3.346 -5.278
73 HA ALA 12 HA ALA 12 -8.242 -5.126 -7.278
74 HB1 ALA 12 3HB ALA 12 -8.951 -3.209 -8.252
75 HB2 ALA 12 1HB ALA 12 -8.440 -2.423 -6.739
76 HB3 ALA 12 2HB ALA 12 -7.345 -2.451 -8.142
77 H TYR 13 H TYR 13 -5.125 -4.371 -6.105
78 HA TYR 13 HA TYR 13 -3.913 -5.017 -8.703
79 HB2 TYR 13 1HB TYR 13 -3.056 -3.622 -6.104
80 HB3 TYR 13 2HB TYR 13 -1.852 -4.144 -7.265
81 HD1 TYR 13 2HD TYR 13 -4.812 -1.925 -6.837
82 HD2 TYR 13 1HD TYR 13 -1.354 -2.839 -9.186
83 HE1 TYR 13 2HE TYR 13 -5.106 0.245 -8.128
84 HE2 TYR 13 1HE TYR 13 -1.660 -0.666 -10.469
85 HH TYR 13 HH TYR 13 -2.699 1.279 -10.487
86 H GLY 14 H GLY 14 -2.139 -6.562 -8.750
87 HA2 GLY 14 1HA GLY 14 -2.405 -8.579 -6.610
88 HA3 GLY 14 2HA GLY 14 -1.967 -8.896 -8.277
89 H ASP 15 H ASP 15 -0.224 -6.343 -8.286
90 HA ASP 15 HA ASP 15 2.089 -7.695 -7.265
91 HB2 ASP 15 1HB ASP 15 2.077 -4.931 -8.515
92 HB3 ASP 15 2HB ASP 15 3.356 -6.128 -8.547
93 H SER 16 H SER 16 3.519 -6.730 -5.642
94 HA SER 16 HA SER 16 2.098 -4.978 -3.866
95 HB2 SER 16 1HB SER 16 4.853 -5.705 -3.108
96 HB3 SER 16 2HB SER 16 3.357 -5.928 -2.222
97 HG SER 16 HG SER 16 4.181 -7.986 -2.735
98 H ASN 17 H ASN 17 4.844 -4.982 -6.130
99 HA ASN 17 HA ASN 17 6.026 -2.640 -5.166
100 HB2 ASN 17 1HB ASN 17 6.988 -4.457 -6.783
101 HB3 ASN 17 2HB ASN 17 6.121 -3.622 -8.057
102 HD21 ASN 17 1HD2 ASN 17 8.924 -3.966 -7.874
103 HD22 ASN 17 2HD2 ASN 17 9.678 -2.411 -7.755
104 H THR 18 H THR 18 3.899 -3.391 -8.033
105 HA THR 18 HA THR 18 3.589 -0.698 -8.818
106 HB THR 18 HB THR 18 3.106 -3.184 -9.904
107 HG1 THR 18 1HG THR 18 3.281 -0.878 -10.785
108 HG21 THR 18 3HG2 THR 18 0.721 -3.417 -10.302
109 HG22 THR 18 1HG2 THR 18 0.921 -3.305 -8.536
110 HG23 THR 18 2HG2 THR 18 0.373 -1.886 -9.462
111 H ALA 19 H ALA 19 1.695 -2.861 -6.660
112 HA ALA 19 HA ALA 19 -0.511 -1.221 -6.357
113 HB1 ALA 19 3HB ALA 19 -0.618 -2.422 -4.072
114 HB2 ALA 19 1HB ALA 19 -0.618 -3.439 -5.533
115 HB3 ALA 19 2HB ALA 19 0.874 -3.249 -4.580
116 H TRP 20 H TRP 20 2.472 -1.425 -4.282
117 HA TRP 20 HA TRP 20 1.821 0.651 -2.589
118 HB2 TRP 20 1HB TRP 20 3.599 -0.823 -2.055
119 HB3 TRP 20 2HB TRP 20 4.469 -0.440 -3.527
120 HD1 TRP 20 HD TRP 20 5.037 2.502 -3.564
121 HE1 TRP 20 1HE TRP 20 6.234 3.916 -1.685
122 HE3 TRP 20 3HE TRP 20 4.084 -0.752 0.225
123 HZ2 TRP 20 2HZ TRP 20 6.639 3.524 1.112
124 HZ3 TRP 20 3HZ TRP 20 4.915 -0.161 2.499
125 HH2 TRP 20 HH TRP 20 6.153 1.893 2.973
126 H THR 21 H THR 21 3.552 0.638 -5.771
127 HA THR 21 HA THR 21 4.195 3.332 -5.863
128 HB THR 21 HB THR 21 3.892 1.023 -7.729
129 HG1 THR 21 1HG THR 21 5.994 1.555 -7.169
130 HG21 THR 21 3HG2 THR 21 2.809 2.404 -9.299
131 HG22 THR 21 1HG2 THR 21 3.467 3.896 -8.585
132 HG23 THR 21 2HG2 THR 21 4.505 2.856 -9.591
133 H THR 22 H THR 22 1.245 1.706 -7.216
134 HA THR 22 HA THR 22 0.042 4.121 -7.997
135 HB THR 22 HB THR 22 -0.911 1.277 -7.444
136 HG1 THR 22 1HG THR 22 -0.757 1.303 -9.726
137 HG21 THR 22 3HG2 THR 22 -2.612 3.149 -9.046
138 HG22 THR 22 1HG2 THR 22 -3.101 1.803 -7.989
139 HG23 THR 22 2HG2 THR 22 -2.677 3.381 -7.282
140 H CYS 23 H CYS 23 0.266 2.463 -4.880
141 HA CYS 23 HA CYS 23 -1.917 3.839 -3.726
142 HB2 CYS 23 1HB CYS 23 -0.179 1.753 -2.995
143 HB3 CYS 23 2HB CYS 23 0.083 3.015 -1.807
144 H THR 24 H THR 24 1.639 4.328 -4.018
145 HA THR 24 HA THR 24 1.531 6.730 -2.399
146 HB THR 24 HB THR 24 4.044 6.688 -3.144
147 HG1 THR 24 1HG THR 24 3.367 5.199 -4.975
148 HG21 THR 24 3HG2 THR 24 4.404 5.517 -1.214
149 HG22 THR 24 1HG2 THR 24 2.656 5.188 -1.150
150 HG23 THR 24 2HG2 THR 24 3.749 4.036 -1.954
151 H THR 25 H THR 25 -0.159 7.722 -3.829
152 HA THR 25 HA THR 25 1.213 9.416 -5.736
153 HB THR 25 HB THR 25 -0.333 8.838 -7.577
154 HG1 THR 25 1HG THR 25 -2.207 8.122 -6.555
155 HG21 THR 25 3HG2 THR 25 0.362 6.573 -8.089
156 HG22 THR 25 1HG2 THR 25 1.715 7.305 -7.194
157 HG23 THR 25 2HG2 THR 25 0.600 6.191 -6.366
158 HA PRO 26 HA PRO 26 -1.609 12.267 -4.220
159 HB2 PRO 26 1HB PRO 26 -1.763 14.091 -6.250
160 HB3 PRO 26 2HB PRO 26 -0.432 14.034 -5.112
161 HG2 PRO 26 1HG PRO 26 -0.499 13.147 -7.931
162 HG3 PRO 26 2HG PRO 26 0.891 13.493 -6.923
163 HD2 PRO 26 1HD PRO 26 -0.106 10.901 -7.639
164 HD3 PRO 26 2HD PRO 26 1.212 11.250 -6.538
165 H GLY 27 H GLY 27 -3.682 11.997 -3.725
166 HA2 GLY 27 1HA GLY 27 -5.624 12.221 -5.824
167 HA3 GLY 27 2HA GLY 27 -5.442 10.574 -5.255
168 H GLN 28 H GLN 28 -7.590 10.566 -4.347
169 HA GLN 28 HA GLN 28 -7.925 12.394 -2.111
170 HB2 GLN 28 1HB GLN 28 -9.670 12.111 -4.040
171 HB3 GLN 28 2HB GLN 28 -10.089 10.601 -3.256
172 HG2 GLN 28 1HG GLN 28 -11.332 11.704 -1.717
173 HG3 GLN 28 2HG GLN 28 -9.933 12.631 -1.212
174 HE21 GLN 28 1HE2 GLN 28 -9.430 14.599 -2.259
175 HE22 GLN 28 2HE2 GLN 28 -10.640 15.538 -3.068
176 H THR 29 H THR 29 -8.068 8.918 -3.077
177 HA THR 29 HA THR 29 -8.016 8.232 -0.212
178 HB THR 29 HB THR 29 -9.015 6.055 -1.025
179 HG1 THR 29 1HG THR 29 -8.009 6.562 -3.244
180 HG21 THR 29 3HG2 THR 29 -10.961 7.194 -0.579
181 HG22 THR 29 1HG2 THR 29 -10.321 8.704 -1.271
182 HG23 THR 29 2HG2 THR 29 -11.042 7.473 -2.335
183 H CYS 30 H CYS 30 -5.646 9.135 -1.442
184 HA CYS 30 HA CYS 30 -4.152 7.049 -2.532
185 HB2 CYS 30 1HB CYS 30 -3.260 9.126 -2.935
186 HB3 CYS 30 2HB CYS 30 -3.536 9.698 -1.302
187 H TYR 31 H TYR 31 -4.190 8.482 0.821
188 HA TYR 31 HA TYR 31 -2.563 6.472 1.926
189 HB2 TYR 31 1HB TYR 31 -2.782 8.566 3.095
190 HB3 TYR 31 2HB TYR 31 -4.508 8.648 2.803
191 HD1 TYR 31 1HD TYR 31 -1.978 6.647 4.713
192 HD2 TYR 31 2HD TYR 31 -5.992 8.115 4.526
193 HE1 TYR 31 1HE TYR 31 -2.423 5.750 7.050
194 HE2 TYR 31 2HE TYR 31 -6.424 7.213 6.863
195 HH TYR 31 HH TYR 31 -4.928 6.716 8.904
196 H THR 32 H THR 32 -6.092 6.799 1.437
197 HA THR 32 HA THR 32 -6.835 4.725 3.202
198 HB THR 32 HB THR 32 -8.135 6.070 0.783
199 HG1 THR 32 1HG THR 32 -8.600 7.459 2.442
200 HG21 THR 32 3HG2 THR 32 -9.689 4.585 2.908
201 HG22 THR 32 1HG2 THR 32 -10.156 4.961 1.232
202 HG23 THR 32 2HG2 THR 32 -9.006 3.643 1.562
203 H CYS 33 H CYS 33 -5.691 4.779 -0.172
204 HA CYS 33 HA CYS 33 -6.513 2.195 -0.817
205 HB2 CYS 33 1HB CYS 33 -5.920 3.246 -2.710
206 HB3 CYS 33 2HB CYS 33 -4.695 4.224 -1.926
207 H CYS 34 H CYS 34 -3.617 3.575 0.814
208 HA CYS 34 HA CYS 34 -2.048 1.299 0.802
209 HB2 CYS 34 1HB CYS 34 -2.189 3.513 2.859
210 HB3 CYS 34 2HB CYS 34 -0.912 2.319 2.754
211 H SER 35 H SER 35 -4.775 2.379 2.864
212 HA SER 35 HA SER 35 -4.375 0.301 4.752
213 HB2 SER 35 1HB SER 35 -5.482 2.575 5.176
214 HB3 SER 35 2HB SER 35 -6.886 1.970 4.320
215 HG SER 35 HG SER 35 -5.849 1.219 6.865
216 H SER 36 H SER 36 -5.256 0.188 1.574
217 HA SER 36 HA SER 36 -7.003 -2.088 2.079
218 HB2 SER 36 1HB SER 36 -7.304 -0.361 -0.395
219 HB3 SER 36 2HB SER 36 -8.445 -1.509 0.276
220 HG SER 36 HG SER 36 -7.654 0.965 1.563
221 H CYS 37 H CYS 37 -3.987 -1.325 1.339
222 HA CYS 37 HA CYS 37 -3.785 -3.448 -0.642
223 HB2 CYS 37 1HB CYS 37 -3.354 -0.707 -1.241
224 HB3 CYS 37 2HB CYS 37 -1.778 -1.473 -1.195
225 H PHE 38 H PHE 38 -3.370 -2.837 2.390
226 HA PHE 38 HA PHE 38 -0.865 -4.221 2.563
227 HB2 PHE 38 1HB PHE 38 -1.345 -1.398 3.693
228 HB3 PHE 38 2HB PHE 38 0.022 -2.394 4.152
229 HD1 PHE 38 1HD PHE 38 1.144 -3.454 1.800
230 HD2 PHE 38 2HD PHE 38 -0.729 0.321 2.302
231 HE1 PHE 38 1HE PHE 38 2.458 -2.544 -0.136
232 HE2 PHE 38 2HE PHE 38 0.585 1.231 0.367
233 HZ PHE 38 HZ PHE 38 2.163 -0.213 -0.829
234 H ASP 39 H ASP 39 -0.310 -4.525 5.046
235 HA ASP 39 HA ASP 39 -2.872 -5.058 6.317
236 HB2 ASP 39 1HB ASP 39 -1.553 -7.072 5.963
237 HB3 ASP 39 2HB ASP 39 -0.112 -6.316 6.611
238 H VAL 40 H VAL 40 0.100 -5.359 8.169
239 HA VAL 40 HA VAL 40 -0.678 -3.038 9.749
240 HB VAL 40 HB VAL 40 -0.370 -5.295 10.765
241 HG11 VAL 40 1HG1 VAL 40 1.849 -6.207 11.085
242 HG12 VAL 40 2HG1 VAL 40 1.556 -5.988 9.343
243 HG13 VAL 40 3HG1 VAL 40 2.581 -4.831 10.226
244 HG21 VAL 40 3HG2 VAL 40 1.538 -3.158 11.775
245 HG22 VAL 40 1HG2 VAL 40 -0.213 -3.216 12.089
246 HG23 VAL 40 2HG2 VAL 40 0.848 -4.496 12.724
247 H VAL 41 H VAL 41 2.240 -4.514 8.172
248 HA VAL 41 HA VAL 41 3.815 -2.197 8.633
249 HB VAL 41 HB VAL 41 4.226 -4.466 6.677
250 HG11 VAL 41 1HG1 VAL 41 6.603 -3.930 6.891
251 HG12 VAL 41 2HG1 VAL 41 5.689 -2.515 6.317
252 HG13 VAL 41 3HG1 VAL 41 6.219 -2.604 8.014
253 HG21 VAL 41 3HG2 VAL 41 4.718 -4.271 9.646
254 HG22 VAL 41 1HG2 VAL 41 3.957 -5.581 8.712
255 HG23 VAL 41 2HG2 VAL 41 5.717 -5.326 8.618
256 H GLY 42 H GLY 42 2.916 -3.675 5.443
257 HA2 GLY 42 1HA GLY 42 3.385 -1.724 3.733
258 HA3 GLY 42 2HA GLY 42 1.916 -2.675 3.645
259 H GLU 43 H GLU 43 0.758 -1.661 6.185
260 HA GLU 43 HA GLU 43 -0.428 0.654 5.083
261 HB2 GLU 43 1HB GLU 43 -1.501 -1.171 6.588
262 HB3 GLU 43 2HB GLU 43 -0.759 -0.334 7.938
263 HG2 GLU 43 1HG GLU 43 -1.889 1.821 6.887
264 HG3 GLU 43 2HG GLU 43 -2.905 0.668 6.045
265 H GLN 44 H GLN 44 1.506 0.024 8.102
266 HA GLN 44 HA GLN 44 1.741 2.776 8.639
267 HB2 GLN 44 1HB GLN 44 2.938 2.121 10.555
268 HB3 GLN 44 2HB GLN 44 1.893 0.745 10.264
269 HG2 GLN 44 1HG GLN 44 3.874 -0.225 8.860
270 HG3 GLN 44 2HG GLN 44 4.856 1.009 9.625
271 HE21 GLN 44 1HE2 GLN 44 6.045 0.073 11.104
272 HE22 GLN 44 2HE2 GLN 44 5.513 -1.024 12.335
273 H ALA 45 H ALA 45 3.293 0.644 6.421
274 HA ALA 45 HA ALA 45 5.803 2.077 6.420
275 HB1 ALA 45 3HB ALA 45 6.132 0.486 4.383
276 HB2 ALA 45 1HB ALA 45 6.045 -0.228 6.011
277 HB3 ALA 45 2HB ALA 45 4.626 -0.283 4.938
278 H CYS 46 H CYS 46 2.859 1.675 4.361
279 HA CYS 46 HA CYS 46 3.822 3.421 2.360
280 HB2 CYS 46 1HB CYS 46 2.184 1.713 1.855
281 HB3 CYS 46 2HB CYS 46 1.040 2.413 2.983
282 H GLN 47 H GLN 47 2.154 3.729 5.470
283 HA GLN 47 HA GLN 47 0.899 6.130 5.131
284 HB2 GLN 47 1HB GLN 47 1.615 4.393 7.302
285 HB3 GLN 47 2HB GLN 47 2.051 6.022 7.778
286 HG2 GLN 47 1HG GLN 47 -0.417 6.481 6.647
287 HG3 GLN 47 2HG GLN 47 -0.649 4.855 7.258
288 HE21 GLN 47 1HE2 GLN 47 -1.698 4.945 9.088
289 HE22 GLN 47 2HE2 GLN 47 -1.380 5.993 10.430
290 H MET 48 H MET 48 4.306 5.454 6.170
291 HA MET 48 HA MET 48 4.965 8.134 6.526
292 HB2 MET 48 1HB MET 48 6.394 5.498 6.223
293 HB3 MET 48 2HB MET 48 7.369 6.926 5.938
294 HG2 MET 48 1HG MET 48 5.618 6.867 8.401
295 HG3 MET 48 2HG MET 48 7.084 5.907 8.405
296 HE1 MET 48 3HE MET 48 7.787 9.045 10.510
297 HE2 MET 48 1HE MET 48 6.176 9.388 9.836
298 HE3 MET 48 2HE MET 48 6.579 7.744 10.387
299 H SER 49 H SER 49 5.482 5.862 3.744
300 HA SER 49 HA SER 49 6.775 7.775 2.178
301 HB2 SER 49 1HB SER 49 5.556 5.068 1.753
302 HB3 SER 49 2HB SER 49 5.798 6.046 0.319
303 HG SER 49 HG SER 49 7.770 5.122 2.209
304 H ALA 50 H ALA 50 3.464 7.328 3.096
305 HA ALA 50 HA ALA 50 2.018 8.047 0.903
306 HB1 ALA 50 3HB ALA 50 1.362 7.470 3.376
307 HB2 ALA 50 1HB ALA 50 1.428 9.232 3.618
308 HB3 ALA 50 2HB ALA 50 0.307 8.539 2.422
309 H GLN 51 H GLN 51 2.981 9.523 -0.515
310 HA GLN 51 HA GLN 51 3.453 12.160 0.637
311 HB2 GLN 51 1HB GLN 51 5.434 11.065 -0.423
312 HB3 GLN 51 2HB GLN 51 4.562 10.958 -1.940
313 HG2 GLN 51 1HG GLN 51 4.740 13.232 -2.375
314 HG3 GLN 51 2HG GLN 51 4.668 13.676 -0.682
315 HE21 GLN 51 1HE2 GLN 51 6.418 14.984 -0.661
316 HE22 GLN 51 2HE2 GLN 51 8.053 14.453 -0.868
317 H CYS 52 H CYS 52 0.839 11.804 0.362
318 HA CYS 52 HA CYS 52 0.195 12.926 -2.269
319 HB2 CYS 52 1HB CYS 52 -2.200 12.055 -1.296
320 HB3 CYS 52 2HB CYS 52 -1.191 11.202 -2.447
Start of MODEL 12
1 H1 ASN 1 1H ASN 1 11.679 -5.006 0.774
2 HA ASN 1 HA ASN 1 9.851 -3.655 -0.704
3 HB2 ASN 1 1HB ASN 1 11.248 -6.128 -0.858
4 HB3 ASN 1 2HB ASN 1 9.561 -6.565 -1.042
5 HD21 ASN 1 1HD2 ASN 1 9.347 -6.951 -3.131
6 HD22 ASN 1 2HD2 ASN 1 9.709 -5.857 -4.424
7 HA PRO 2 HA PRO 2 6.000 -4.701 1.114
8 HB2 PRO 2 1HB PRO 2 4.287 -4.584 -1.012
9 HB3 PRO 2 2HB PRO 2 4.864 -3.161 -0.167
10 HG2 PRO 2 1HG PRO 2 5.674 -4.202 -2.813
11 HG3 PRO 2 2HG PRO 2 5.907 -2.598 -2.146
12 HD2 PRO 2 1HD PRO 2 7.885 -4.661 -2.387
13 HD3 PRO 2 2HD PRO 2 8.087 -3.100 -1.616
14 H GLU 3 H GLU 3 7.634 -6.800 -0.747
15 HA GLU 3 HA GLU 3 5.754 -8.705 -1.348
16 HB2 GLU 3 1HB GLU 3 7.632 -10.254 -1.521
17 HB3 GLU 3 2HB GLU 3 8.122 -8.691 -2.143
18 HG2 GLU 3 1HG GLU 3 9.804 -8.574 -0.630
19 HG3 GLU 3 2HG GLU 3 8.662 -8.713 0.692
20 H ASP 4 H ASP 4 7.150 -7.744 1.739
21 HA ASP 4 HA ASP 4 6.362 -10.190 3.003
22 HB2 ASP 4 1HB ASP 4 8.336 -8.416 3.548
23 HB3 ASP 4 2HB ASP 4 7.089 -7.717 4.561
24 H TRP 5 H TRP 5 5.040 -7.085 2.152
25 HA TRP 5 HA TRP 5 2.821 -7.503 4.037
26 HB2 TRP 5 1HB TRP 5 3.186 -4.763 3.088
27 HB3 TRP 5 2HB TRP 5 2.832 -5.373 4.692
28 HD1 TRP 5 HD TRP 5 5.324 -6.735 5.724
29 HE1 TRP 5 1HE TRP 5 7.724 -5.659 5.942
30 HE3 TRP 5 3HE TRP 5 4.565 -3.063 2.290
31 HZ2 TRP 5 2HZ TRP 5 9.007 -3.443 4.682
32 HZ3 TRP 5 3HZ TRP 5 6.442 -1.485 1.843
33 HH2 TRP 5 HH TRP 5 8.604 -1.631 2.974
34 H PHE 6 H PHE 6 1.364 -5.260 2.669
35 HA PHE 6 HA PHE 6 -0.089 -5.000 1.033
36 HB2 PHE 6 1HB PHE 6 1.816 -4.592 -0.418
37 HB3 PHE 6 2HB PHE 6 2.314 -6.272 -0.365
38 HD1 PHE 6 2HD PHE 6 -0.690 -4.308 -1.421
39 HD2 PHE 6 1HD PHE 6 1.982 -7.489 -2.285
40 HE1 PHE 6 2HE PHE 6 -1.894 -4.732 -3.583
41 HE2 PHE 6 1HE PHE 6 0.778 -7.913 -4.446
42 HZ PHE 6 HZ PHE 6 -1.145 -6.529 -5.070
43 H THR 7 H THR 7 -1.996 -6.044 0.671
44 HA THR 7 HA THR 7 -1.857 -8.974 0.376
45 HB THR 7 HB THR 7 -4.155 -8.859 1.522
46 HG1 THR 7 1HG THR 7 -4.104 -6.417 0.925
47 HG21 THR 7 3HG2 THR 7 -1.775 -9.094 2.748
48 HG22 THR 7 1HG2 THR 7 -2.175 -7.461 3.332
49 HG23 THR 7 2HG2 THR 7 -3.258 -8.826 3.696
50 HA PRO 8 HA PRO 8 -3.607 -7.720 -3.467
51 HB2 PRO 8 1HB PRO 8 -2.713 -9.862 -4.911
52 HB3 PRO 8 2HB PRO 8 -1.796 -8.380 -4.727
53 HG2 PRO 8 1HG PRO 8 -1.365 -10.999 -3.426
54 HG3 PRO 8 2HG PRO 8 -0.248 -9.659 -3.593
55 HD2 PRO 8 1HD PRO 8 -1.700 -10.400 -1.232
56 HD3 PRO 8 2HD PRO 8 -0.673 -8.994 -1.434
57 H ASP 9 H ASP 9 -4.384 -9.941 -1.240
58 HA ASP 9 HA ASP 9 -6.305 -11.270 -2.922
59 HB2 ASP 9 1HB ASP 9 -4.864 -11.967 -0.600
60 HB3 ASP 9 2HB ASP 9 -6.503 -11.750 -0.020
61 H THR 10 H THR 10 -6.038 -8.344 -1.296
62 HA THR 10 HA THR 10 -8.930 -8.088 -1.089
63 HB THR 10 HB THR 10 -8.248 -8.804 1.177
64 HG1 THR 10 1HG THR 10 -9.211 -6.944 2.111
65 HG21 THR 10 3HG2 THR 10 -5.861 -7.367 0.637
66 HG22 THR 10 1HG2 THR 10 -6.724 -6.385 1.846
67 HG23 THR 10 2HG2 THR 10 -6.329 -8.085 2.197
68 H CYS 11 H CYS 11 -7.335 -7.165 -3.155
69 HA CYS 11 HA CYS 11 -7.787 -4.359 -2.836
70 HB2 CYS 11 1HB CYS 11 -5.320 -5.095 -2.052
71 HB3 CYS 11 2HB CYS 11 -5.027 -4.933 -3.773
72 H ALA 12 H ALA 12 -7.241 -3.261 -5.071
73 HA ALA 12 HA ALA 12 -8.323 -4.990 -7.098
74 HB1 ALA 12 3HB ALA 12 -8.871 -2.497 -6.605
75 HB2 ALA 12 1HB ALA 12 -7.358 -2.145 -7.474
76 HB3 ALA 12 2HB ALA 12 -8.683 -2.996 -8.303
77 H TYR 13 H TYR 13 -5.186 -3.663 -6.102
78 HA TYR 13 HA TYR 13 -3.942 -4.349 -8.615
79 HB2 TYR 13 1HB TYR 13 -2.891 -3.523 -5.837
80 HB3 TYR 13 2HB TYR 13 -1.929 -3.517 -7.301
81 HD1 TYR 13 1HD TYR 13 -3.601 -2.234 -9.294
82 HD2 TYR 13 2HD TYR 13 -3.196 -1.332 -5.131
83 HE1 TYR 13 1HE TYR 13 -4.302 0.169 -9.739
84 HE2 TYR 13 2HE TYR 13 -3.898 1.068 -5.591
85 HH TYR 13 HH TYR 13 -5.487 2.034 -8.076
86 H GLY 14 H GLY 14 -2.504 -6.062 -8.991
87 HA2 GLY 14 1HA GLY 14 -2.697 -8.246 -7.032
88 HA3 GLY 14 2HA GLY 14 -2.332 -8.394 -8.740
89 H ASP 15 H ASP 15 -0.498 -5.874 -8.428
90 HA ASP 15 HA ASP 15 1.785 -7.449 -7.629
91 HB2 ASP 15 1HB ASP 15 1.970 -4.622 -8.681
92 HB3 ASP 15 2HB ASP 15 3.089 -5.952 -8.909
93 H SER 16 H SER 16 3.339 -6.596 -6.033
94 HA SER 16 HA SER 16 2.035 -4.937 -4.088
95 HB2 SER 16 1HB SER 16 3.622 -5.746 -2.549
96 HB3 SER 16 2HB SER 16 3.402 -7.105 -3.633
97 HG SER 16 HG SER 16 5.701 -6.193 -3.015
98 H ASN 17 H ASN 17 4.897 -4.922 -6.275
99 HA ASN 17 HA ASN 17 6.026 -2.598 -5.283
100 HB2 ASN 17 1HB ASN 17 6.359 -4.381 -7.589
101 HB3 ASN 17 2HB ASN 17 6.564 -2.713 -8.087
102 HD21 ASN 17 1HD2 ASN 17 8.245 -5.270 -7.272
103 HD22 ASN 17 2HD2 ASN 17 9.595 -4.599 -6.419
104 H THR 18 H THR 18 3.745 -3.275 -8.031
105 HA THR 18 HA THR 18 3.507 -0.545 -8.794
106 HB THR 18 HB THR 18 2.998 -2.978 -9.957
107 HG1 THR 18 1HG THR 18 3.151 -0.898 -11.024
108 HG21 THR 18 3HG2 THR 18 0.817 -3.009 -8.440
109 HG22 THR 18 1HG2 THR 18 0.239 -1.765 -9.574
110 HG23 THR 18 2HG2 THR 18 0.671 -3.384 -10.173
111 H ALA 19 H ALA 19 1.764 -2.696 -6.536
112 HA ALA 19 HA ALA 19 -0.479 -1.082 -6.187
113 HB1 ALA 19 3HB ALA 19 -0.648 -3.251 -5.337
114 HB2 ALA 19 1HB ALA 19 0.958 -3.186 -4.572
115 HB3 ALA 19 2HB ALA 19 -0.406 -2.295 -3.855
116 H TRP 20 H TRP 20 2.560 -1.302 -4.196
117 HA TRP 20 HA TRP 20 1.941 0.791 -2.495
118 HB2 TRP 20 1HB TRP 20 3.690 -0.745 -1.979
119 HB3 TRP 20 2HB TRP 20 4.580 -0.334 -3.432
120 HD1 TRP 20 HD TRP 20 5.155 2.612 -3.391
121 HE1 TRP 20 1HE TRP 20 6.346 3.970 -1.467
122 HE3 TRP 20 3HE TRP 20 4.168 -0.740 0.303
123 HZ2 TRP 20 2HZ TRP 20 6.732 3.501 1.321
124 HZ3 TRP 20 3HZ TRP 20 4.987 -0.213 2.598
125 HH2 TRP 20 HH TRP 20 6.229 1.822 3.135
126 H THR 21 H THR 21 3.758 0.726 -5.637
127 HA THR 21 HA THR 21 4.386 3.426 -5.738
128 HB THR 21 HB THR 21 4.158 1.096 -7.602
129 HG1 THR 21 1HG THR 21 6.322 1.588 -7.475
130 HG21 THR 21 3HG2 THR 21 3.829 3.972 -8.472
131 HG22 THR 21 1HG2 THR 21 4.939 2.939 -9.405
132 HG23 THR 21 2HG2 THR 21 3.225 2.487 -9.247
133 H THR 22 H THR 22 1.527 1.753 -7.224
134 HA THR 22 HA THR 22 0.335 4.137 -8.095
135 HB THR 22 HB THR 22 -0.873 1.410 -7.388
136 HG1 THR 22 1HG THR 22 -0.355 1.099 -9.684
137 HG21 THR 22 3HG2 THR 22 -1.766 3.564 -9.376
138 HG22 THR 22 1HG2 THR 22 -2.543 1.983 -9.124
139 HG23 THR 22 2HG2 THR 22 -2.588 3.211 -7.837
140 H CYS 23 H CYS 23 0.717 2.817 -4.914
141 HA CYS 23 HA CYS 23 -1.627 4.107 -3.883
142 HB2 CYS 23 1HB CYS 23 0.265 2.143 -2.976
143 HB3 CYS 23 2HB CYS 23 0.156 3.428 -1.789
144 H THR 24 H THR 24 1.922 4.622 -4.136
145 HA THR 24 HA THR 24 1.782 7.055 -2.569
146 HB THR 24 HB THR 24 4.306 7.008 -3.398
147 HG1 THR 24 1HG THR 24 4.008 5.412 -5.042
148 HG21 THR 24 3HG2 THR 24 4.874 5.195 -1.760
149 HG22 THR 24 1HG2 THR 24 3.683 6.329 -1.080
150 HG23 THR 24 2HG2 THR 24 3.154 4.741 -1.686
151 H THR 25 H THR 25 0.017 7.833 -4.153
152 HA THR 25 HA THR 25 1.342 9.677 -5.934
153 HB THR 25 HB THR 25 -0.201 8.896 -7.856
154 HG1 THR 25 1HG THR 25 -1.572 7.349 -7.047
155 HG21 THR 25 3HG2 THR 25 1.756 6.754 -6.883
156 HG22 THR 25 1HG2 THR 25 1.248 7.063 -8.560
157 HG23 THR 25 2HG2 THR 25 2.277 8.241 -7.711
158 HA PRO 26 HA PRO 26 -2.000 12.119 -4.810
159 HB2 PRO 26 1HB PRO 26 -2.285 13.818 -6.931
160 HB3 PRO 26 2HB PRO 26 -1.045 14.012 -5.708
161 HG2 PRO 26 1HG PRO 26 -0.776 13.019 -8.480
162 HG3 PRO 26 2HG PRO 26 0.470 13.615 -7.402
163 HD2 PRO 26 1HD PRO 26 -0.067 10.874 -8.055
164 HD3 PRO 26 2HD PRO 26 1.101 11.464 -6.889
165 H GLY 27 H GLY 27 -4.047 11.577 -4.441
166 HA2 GLY 27 1HA GLY 27 -5.826 11.381 -6.689
167 HA3 GLY 27 2HA GLY 27 -5.461 9.824 -5.972
168 H GLN 28 H GLN 28 -7.695 9.614 -5.271
169 HA GLN 28 HA GLN 28 -8.516 11.544 -3.278
170 HB2 GLN 28 1HB GLN 28 -10.139 10.955 -5.040
171 HB3 GLN 28 2HB GLN 28 -10.024 9.258 -4.619
172 HG2 GLN 28 1HG GLN 28 -10.872 9.797 -2.309
173 HG3 GLN 28 2HG GLN 28 -11.038 11.477 -2.779
174 HE21 GLN 28 1HE2 GLN 28 -12.832 9.011 -2.115
175 HE22 GLN 28 2HE2 GLN 28 -14.113 9.103 -3.277
176 H THR 29 H THR 29 -7.584 8.121 -3.708
177 HA THR 29 HA THR 29 -7.656 7.843 -0.777
178 HB THR 29 HB THR 29 -8.331 5.482 -1.157
179 HG1 THR 29 1HG THR 29 -8.464 6.386 -3.942
180 HG21 THR 29 3HG2 THR 29 -10.565 5.794 -2.077
181 HG22 THR 29 1HG2 THR 29 -10.170 7.280 -1.180
182 HG23 THR 29 2HG2 THR 29 -10.056 7.256 -2.956
183 H CYS 30 H CYS 30 -5.428 8.954 -1.644
184 HA CYS 30 HA CYS 30 -3.551 7.113 -2.662
185 HB2 CYS 30 1HB CYS 30 -3.113 9.378 -3.067
186 HB3 CYS 30 2HB CYS 30 -3.361 9.832 -1.393
187 H TYR 31 H TYR 31 -4.174 8.553 0.623
188 HA TYR 31 HA TYR 31 -2.393 6.601 1.817
189 HB2 TYR 31 1HB TYR 31 -2.341 8.913 2.638
190 HB3 TYR 31 2HB TYR 31 -4.090 9.014 2.661
191 HD1 TYR 31 2HD TYR 31 -5.381 7.756 4.432
192 HD2 TYR 31 1HD TYR 31 -1.119 8.121 4.531
193 HE1 TYR 31 2HE TYR 31 -5.377 7.132 6.897
194 HE2 TYR 31 1HE TYR 31 -1.130 7.495 6.995
195 HH TYR 31 HH TYR 31 -2.376 7.192 8.767
196 H THR 32 H THR 32 -5.620 6.668 0.800
197 HA THR 32 HA THR 32 -6.613 5.129 3.069
198 HB THR 32 HB THR 32 -7.835 6.374 0.561
199 HG1 THR 32 1HG THR 32 -8.009 7.904 2.150
200 HG21 THR 32 3HG2 THR 32 -9.312 4.897 2.796
201 HG22 THR 32 1HG2 THR 32 -10.014 5.606 1.322
202 HG23 THR 32 2HG2 THR 32 -8.984 4.158 1.210
203 H CYS 33 H CYS 33 -5.376 4.713 -0.213
204 HA CYS 33 HA CYS 33 -6.496 2.172 -0.631
205 HB2 CYS 33 1HB CYS 33 -4.950 1.977 -2.463
206 HB3 CYS 33 2HB CYS 33 -5.664 3.577 -2.445
207 H CYS 34 H CYS 34 -3.403 3.416 0.763
208 HA CYS 34 HA CYS 34 -2.092 1.016 1.034
209 HB2 CYS 34 1HB CYS 34 -1.982 3.412 2.880
210 HB3 CYS 34 2HB CYS 34 -0.807 2.114 2.821
211 H SER 35 H SER 35 -4.796 2.468 2.827
212 HA SER 35 HA SER 35 -4.537 0.666 5.013
213 HB2 SER 35 1HB SER 35 -6.235 1.897 6.006
214 HB3 SER 35 2HB SER 35 -5.614 3.091 4.884
215 HG SER 35 HG SER 35 -7.389 2.912 3.615
216 H SER 36 H SER 36 -5.354 0.181 1.848
217 HA SER 36 HA SER 36 -7.070 -2.032 2.589
218 HB2 SER 36 1HB SER 36 -7.783 0.249 0.804
219 HB3 SER 36 2HB SER 36 -8.168 -1.338 0.168
220 HG SER 36 HG SER 36 -9.834 -1.421 1.496
221 H CYS 37 H CYS 37 -4.162 -1.378 1.671
222 HA CYS 37 HA CYS 37 -4.123 -3.444 -0.374
223 HB2 CYS 37 1HB CYS 37 -3.629 -0.691 -0.920
224 HB3 CYS 37 2HB CYS 37 -2.097 -1.536 -1.022
225 H PHE 38 H PHE 38 -3.515 -2.872 2.646
226 HA PHE 38 HA PHE 38 -1.044 -4.332 2.651
227 HB2 PHE 38 1HB PHE 38 -1.386 -1.521 3.857
228 HB3 PHE 38 2HB PHE 38 -0.018 -2.558 4.212
229 HD1 PHE 38 1HD PHE 38 1.028 -3.559 1.850
230 HD2 PHE 38 2HD PHE 38 -0.911 0.177 2.389
231 HE1 PHE 38 1HE PHE 38 2.243 -2.640 -0.145
232 HE2 PHE 38 2HE PHE 38 0.304 1.095 0.394
233 HZ PHE 38 HZ PHE 38 1.866 -0.324 -0.849
234 H ASP 39 H ASP 39 -0.372 -4.773 5.053
235 HA ASP 39 HA ASP 39 -2.848 -5.373 6.421
236 HB2 ASP 39 1HB ASP 39 -1.434 -7.291 6.180
237 HB3 ASP 39 2HB ASP 39 0.007 -6.390 6.609
238 H VAL 40 H VAL 40 0.487 -4.888 7.751
239 HA VAL 40 HA VAL 40 -0.523 -2.601 9.284
240 HB VAL 40 HB VAL 40 -0.410 -4.901 10.485
241 HG11 VAL 40 1HG1 VAL 40 2.524 -4.112 10.483
242 HG12 VAL 40 2HG1 VAL 40 1.796 -5.372 11.509
243 HG13 VAL 40 3HG1 VAL 40 1.812 -5.564 9.740
244 HG21 VAL 40 3HG2 VAL 40 -0.910 -3.172 11.905
245 HG22 VAL 40 1HG2 VAL 40 0.701 -3.604 12.527
246 HG23 VAL 40 2HG2 VAL 40 0.514 -2.217 11.428
247 H VAL 41 H VAL 41 2.373 -4.508 8.220
248 HA VAL 41 HA VAL 41 4.114 -2.288 8.581
249 HB VAL 41 HB VAL 41 4.592 -4.747 6.903
250 HG11 VAL 41 1HG1 VAL 41 6.412 -3.294 6.669
251 HG12 VAL 41 2HG1 VAL 41 6.336 -2.766 8.367
252 HG13 VAL 41 3HG1 VAL 41 6.926 -4.397 7.967
253 HG21 VAL 41 3HG2 VAL 41 4.471 -4.471 9.904
254 HG22 VAL 41 1HG2 VAL 41 3.794 -5.742 8.858
255 HG23 VAL 41 2HG2 VAL 41 5.550 -5.661 9.138
256 H GLY 42 H GLY 42 2.258 -3.723 5.865
257 HA2 GLY 42 1HA GLY 42 3.449 -2.205 3.805
258 HA3 GLY 42 2HA GLY 42 1.893 -3.010 3.762
259 H GLU 43 H GLU 43 0.700 -1.623 6.062
260 HA GLU 43 HA GLU 43 0.014 0.777 4.662
261 HB2 GLU 43 1HB GLU 43 -1.617 -0.841 5.852
262 HB3 GLU 43 2HB GLU 43 -1.058 -0.139 7.357
263 HG2 GLU 43 1HG GLU 43 -1.604 2.174 6.207
264 HG3 GLU 43 2HG GLU 43 -2.556 1.215 5.092
265 H GLN 44 H GLN 44 1.528 -0.204 7.789
266 HA GLN 44 HA GLN 44 1.755 2.391 8.772
267 HB2 GLN 44 1HB GLN 44 3.307 -0.158 9.384
268 HB3 GLN 44 2HB GLN 44 3.515 1.327 10.291
269 HG2 GLN 44 1HG GLN 44 0.671 0.571 9.971
270 HG3 GLN 44 2HG GLN 44 1.606 -0.652 10.808
271 HE21 GLN 44 1HE2 GLN 44 2.006 -0.413 12.881
272 HE22 GLN 44 2HE2 GLN 44 1.806 1.029 13.818
273 H ALA 45 H ALA 45 3.652 0.486 6.469
274 HA ALA 45 HA ALA 45 5.915 2.274 6.626
275 HB1 ALA 45 3HB ALA 45 5.274 -0.026 4.735
276 HB2 ALA 45 1HB ALA 45 6.848 0.786 4.908
277 HB3 ALA 45 2HB ALA 45 6.184 -0.165 6.258
278 H CYS 46 H CYS 46 3.040 1.644 4.584
279 HA CYS 46 HA CYS 46 3.890 3.404 2.527
280 HB2 CYS 46 1HB CYS 46 2.359 1.523 2.134
281 HB3 CYS 46 2HB CYS 46 1.147 2.286 3.144
282 H GLN 47 H GLN 47 2.178 3.619 5.626
283 HA GLN 47 HA GLN 47 0.790 5.953 5.218
284 HB2 GLN 47 1HB GLN 47 1.798 4.411 7.557
285 HB3 GLN 47 2HB GLN 47 1.476 6.103 7.880
286 HG2 GLN 47 1HG GLN 47 -0.790 5.587 6.538
287 HG3 GLN 47 2HG GLN 47 -0.442 3.937 7.014
288 HE21 GLN 47 1HE2 GLN 47 -0.029 7.126 8.553
289 HE22 GLN 47 2HE2 GLN 47 -0.873 6.772 10.023
290 H MET 48 H MET 48 4.180 5.412 6.367
291 HA MET 48 HA MET 48 4.675 8.143 6.758
292 HB2 MET 48 1HB MET 48 6.323 5.601 6.520
293 HB3 MET 48 2HB MET 48 7.165 7.138 6.506
294 HG2 MET 48 1HG MET 48 5.460 7.508 8.649
295 HG3 MET 48 2HG MET 48 5.738 5.781 8.749
296 HE1 MET 48 3HE MET 48 8.965 5.411 10.352
297 HE2 MET 48 1HE MET 48 7.294 4.886 10.033
298 HE3 MET 48 2HE MET 48 8.521 4.780 8.747
299 H SER 49 H SER 49 5.450 5.827 4.079
300 HA SER 49 HA SER 49 6.837 7.696 2.561
301 HB2 SER 49 1HB SER 49 7.035 5.274 2.193
302 HB3 SER 49 2HB SER 49 5.343 5.165 1.747
303 HG SER 49 HG SER 49 7.403 5.608 0.115
304 H ALA 50 H ALA 50 3.399 7.032 3.057
305 HA ALA 50 HA ALA 50 2.280 7.986 0.748
306 HB1 ALA 50 3HB ALA 50 0.687 8.924 2.887
307 HB2 ALA 50 1HB ALA 50 0.526 7.380 2.016
308 HB3 ALA 50 2HB ALA 50 1.507 7.468 3.499
309 H GLN 51 H GLN 51 2.931 9.798 -0.326
310 HA GLN 51 HA GLN 51 3.390 12.158 1.316
311 HB2 GLN 51 1HB GLN 51 4.862 10.995 -0.837
312 HB3 GLN 51 2HB GLN 51 4.197 12.494 -1.453
313 HG2 GLN 51 1HG GLN 51 5.314 12.712 1.295
314 HG3 GLN 51 2HG GLN 51 6.501 12.287 0.078
315 HE21 GLN 51 1HE2 GLN 51 6.242 14.724 1.600
316 HE22 GLN 51 2HE2 GLN 51 6.055 16.035 0.483
317 H CYS 52 H CYS 52 0.756 11.707 1.154
318 HA CYS 52 HA CYS 52 -0.120 13.458 -1.028
319 HB2 CYS 52 1HB CYS 52 -2.383 12.102 -0.288
320 HB3 CYS 52 2HB CYS 52 -1.398 11.778 -1.700
Start of MODEL 13
1 H1 ASN 1 1H ASN 1 11.513 -5.791 1.765
2 HA ASN 1 HA ASN 1 10.186 -4.340 -0.215
3 HB2 ASN 1 1HB ASN 1 10.591 -7.317 0.317
4 HB3 ASN 1 2HB ASN 1 9.658 -6.773 -1.063
5 HD21 ASN 1 1HD2 ASN 1 10.648 -6.144 -2.854
6 HD22 ASN 1 2HD2 ASN 1 12.356 -5.942 -3.065
7 HA PRO 2 HA PRO 2 6.068 -4.820 1.220
8 HB2 PRO 2 1HB PRO 2 4.646 -4.536 -1.096
9 HB3 PRO 2 2HB PRO 2 5.292 -3.178 -0.196
10 HG2 PRO 2 1HG PRO 2 6.273 -4.363 -2.720
11 HG3 PRO 2 2HG PRO 2 6.622 -2.787 -2.038
12 HD2 PRO 2 1HD PRO 2 8.344 -5.081 -2.031
13 HD3 PRO 2 2HD PRO 2 8.645 -3.542 -1.249
14 H GLU 3 H GLU 3 7.644 -7.146 -0.389
15 HA GLU 3 HA GLU 3 5.628 -8.818 -1.216
16 HB2 GLU 3 1HB GLU 3 7.371 -10.649 -0.840
17 HB3 GLU 3 2HB GLU 3 7.876 -9.316 -1.860
18 HG2 GLU 3 1HG GLU 3 9.659 -9.042 -0.485
19 HG3 GLU 3 2HG GLU 3 8.548 -8.460 0.740
20 H ASP 4 H ASP 4 7.093 -8.307 2.027
21 HA ASP 4 HA ASP 4 5.763 -10.494 3.186
22 HB2 ASP 4 1HB ASP 4 6.561 -8.085 4.813
23 HB3 ASP 4 2HB ASP 4 6.750 -9.784 5.196
24 H TRP 5 H TRP 5 5.096 -7.022 2.631
25 HA TRP 5 HA TRP 5 2.638 -7.211 4.207
26 HB2 TRP 5 1HB TRP 5 3.277 -4.634 2.985
27 HB3 TRP 5 2HB TRP 5 2.834 -5.032 4.633
28 HD1 TRP 5 HD TRP 5 5.227 -6.624 5.748
29 HE1 TRP 5 1HE TRP 5 7.689 -5.701 5.975
30 HE3 TRP 5 3HE TRP 5 4.742 -2.977 2.238
31 HZ2 TRP 5 2HZ TRP 5 9.125 -3.596 4.689
32 HZ3 TRP 5 3HZ TRP 5 6.722 -1.532 1.784
33 HH2 TRP 5 HH TRP 5 8.857 -1.795 2.944
34 H PHE 6 H PHE 6 1.256 -5.144 2.681
35 HA PHE 6 HA PHE 6 -0.158 -4.967 1.000
36 HB2 PHE 6 1HB PHE 6 1.735 -4.568 -0.443
37 HB3 PHE 6 2HB PHE 6 2.327 -6.207 -0.261
38 HD1 PHE 6 2HD PHE 6 -0.586 -4.349 -1.670
39 HD2 PHE 6 1HD PHE 6 1.978 -7.717 -1.979
40 HE1 PHE 6 2HE PHE 6 -1.683 -4.986 -3.837
41 HE2 PHE 6 1HE PHE 6 0.881 -8.353 -4.145
42 HZ PHE 6 HZ PHE 6 -0.936 -6.980 -5.048
43 H THR 7 H THR 7 -2.043 -6.055 0.675
44 HA THR 7 HA THR 7 -1.867 -8.993 0.580
45 HB THR 7 HB THR 7 -4.213 -8.850 1.512
46 HG1 THR 7 1HG THR 7 -4.762 -6.589 2.186
47 HG21 THR 7 3HG2 THR 7 -3.512 -8.520 3.696
48 HG22 THR 7 1HG2 THR 7 -1.895 -8.496 2.953
49 HG23 THR 7 2HG2 THR 7 -2.733 -6.967 3.308
50 HA PRO 8 HA PRO 8 -3.181 -8.197 -3.539
51 HB2 PRO 8 1HB PRO 8 -2.229 -10.526 -4.607
52 HB3 PRO 8 2HB PRO 8 -1.276 -9.060 -4.503
53 HG2 PRO 8 1HG PRO 8 -1.096 -11.509 -2.856
54 HG3 PRO 8 2HG PRO 8 0.088 -10.232 -3.058
55 HD2 PRO 8 1HD PRO 8 -1.636 -10.632 -0.801
56 HD3 PRO 8 2HD PRO 8 -0.536 -9.292 -1.055
57 H ASP 9 H ASP 9 -4.293 -10.085 -1.159
58 HA ASP 9 HA ASP 9 -6.075 -11.564 -2.871
59 HB2 ASP 9 1HB ASP 9 -4.903 -12.060 -0.383
60 HB3 ASP 9 2HB ASP 9 -6.545 -11.632 0.056
61 H THR 10 H THR 10 -5.843 -8.508 -1.360
62 HA THR 10 HA THR 10 -8.701 -8.067 -1.685
63 HB THR 10 HB THR 10 -8.481 -8.734 0.687
64 HG1 THR 10 1HG THR 10 -9.904 -6.999 0.546
65 HG21 THR 10 3HG2 THR 10 -5.954 -7.426 0.538
66 HG22 THR 10 1HG2 THR 10 -6.965 -6.394 1.578
67 HG23 THR 10 2HG2 THR 10 -6.715 -8.105 1.997
68 H CYS 11 H CYS 11 -6.599 -7.343 -3.404
69 HA CYS 11 HA CYS 11 -6.703 -4.452 -3.007
70 HB2 CYS 11 1HB CYS 11 -4.486 -5.094 -2.321
71 HB3 CYS 11 2HB CYS 11 -4.257 -6.055 -3.769
72 H ALA 12 H ALA 12 -6.403 -3.289 -5.163
73 HA ALA 12 HA ALA 12 -8.017 -4.519 -7.124
74 HB1 ALA 12 3HB ALA 12 -6.552 -1.944 -6.732
75 HB2 ALA 12 1HB ALA 12 -6.959 -2.392 -8.406
76 HB3 ALA 12 2HB ALA 12 -8.248 -2.238 -7.187
77 H TYR 13 H TYR 13 -4.476 -3.812 -6.859
78 HA TYR 13 HA TYR 13 -4.055 -5.366 -9.299
79 HB2 TYR 13 1HB TYR 13 -2.058 -3.867 -7.512
80 HB3 TYR 13 2HB TYR 13 -1.864 -4.244 -9.212
81 HD1 TYR 13 1HD TYR 13 -3.261 -3.011 -10.922
82 HD2 TYR 13 2HD TYR 13 -3.132 -1.857 -6.804
83 HE1 TYR 13 1HE TYR 13 -4.179 -0.718 -11.528
84 HE2 TYR 13 2HE TYR 13 -4.051 0.431 -7.424
85 HH TYR 13 HH TYR 13 -4.155 1.524 -10.623
86 H GLY 14 H GLY 14 -2.165 -6.910 -9.312
87 HA2 GLY 14 1HA GLY 14 -2.182 -8.456 -6.804
88 HA3 GLY 14 2HA GLY 14 -1.880 -9.082 -8.412
89 H ASP 15 H ASP 15 -0.340 -6.098 -8.314
90 HA ASP 15 HA ASP 15 2.163 -7.431 -7.711
91 HB2 ASP 15 1HB ASP 15 2.406 -4.694 -8.712
92 HB3 ASP 15 2HB ASP 15 3.048 -6.176 -9.391
93 H SER 16 H SER 16 3.498 -6.657 -6.000
94 HA SER 16 HA SER 16 2.208 -4.923 -4.153
95 HB2 SER 16 1HB SER 16 4.522 -5.300 -2.934
96 HB3 SER 16 2HB SER 16 3.365 -6.612 -3.043
97 HG SER 16 HG SER 16 4.976 -7.697 -3.945
98 H ASN 17 H ASN 17 4.867 -4.782 -6.535
99 HA ASN 17 HA ASN 17 6.041 -2.452 -5.606
100 HB2 ASN 17 1HB ASN 17 6.802 -4.182 -7.455
101 HB3 ASN 17 2HB ASN 17 5.870 -3.189 -8.558
102 HD21 ASN 17 1HD2 ASN 17 8.808 -3.752 -8.126
103 HD22 ASN 17 2HD2 ASN 17 9.577 -2.201 -8.088
104 H THR 18 H THR 18 3.625 -3.086 -8.264
105 HA THR 18 HA THR 18 3.197 -0.340 -8.823
106 HB THR 18 HB THR 18 2.514 -2.920 -9.879
107 HG1 THR 18 1HG THR 18 2.002 -1.431 -11.658
108 HG21 THR 18 3HG2 THR 18 0.270 -2.721 -8.830
109 HG22 THR 18 1HG2 THR 18 0.125 -1.052 -9.431
110 HG23 THR 18 2HG2 THR 18 0.148 -2.413 -10.579
111 H ALA 19 H ALA 19 1.724 -2.684 -6.573
112 HA ALA 19 HA ALA 19 -0.577 -1.222 -6.002
113 HB1 ALA 19 3HB ALA 19 -0.314 -2.535 -3.756
114 HB2 ALA 19 1HB ALA 19 -0.536 -3.450 -5.266
115 HB3 ALA 19 2HB ALA 19 1.087 -3.288 -4.554
116 H TRP 20 H TRP 20 2.595 -1.354 -4.222
117 HA TRP 20 HA TRP 20 1.976 0.626 -2.390
118 HB2 TRP 20 1HB TRP 20 3.832 -0.832 -2.052
119 HB3 TRP 20 2HB TRP 20 4.605 -0.311 -3.536
120 HD1 TRP 20 HD TRP 20 5.105 2.619 -3.419
121 HE1 TRP 20 1HE TRP 20 6.314 3.972 -1.502
122 HE3 TRP 20 3HE TRP 20 4.345 -0.844 0.226
123 HZ2 TRP 20 2HZ TRP 20 6.805 3.454 1.261
124 HZ3 TRP 20 3HZ TRP 20 5.220 -0.342 2.506
125 HH2 TRP 20 HH TRP 20 6.414 1.720 3.050
126 H THR 21 H THR 21 3.572 0.791 -5.644
127 HA THR 21 HA THR 21 4.071 3.517 -5.666
128 HB THR 21 HB THR 21 3.864 1.248 -7.579
129 HG1 THR 21 1HG THR 21 5.967 1.943 -7.566
130 HG21 THR 21 3HG2 THR 21 3.398 4.146 -8.430
131 HG22 THR 21 1HG2 THR 21 4.134 2.943 -9.516
132 HG23 THR 21 2HG2 THR 21 2.473 2.707 -8.923
133 H THR 22 H THR 22 1.212 1.821 -7.130
134 HA THR 22 HA THR 22 -0.149 4.165 -7.763
135 HB THR 22 HB THR 22 -1.111 1.330 -7.110
136 HG1 THR 22 1HG THR 22 -0.620 2.846 -9.574
137 HG21 THR 22 3HG2 THR 22 -2.462 3.498 -8.796
138 HG22 THR 22 1HG2 THR 22 -3.091 1.871 -8.441
139 HG23 THR 22 2HG2 THR 22 -2.976 3.083 -7.143
140 H CYS 23 H CYS 23 0.375 2.597 -4.668
141 HA CYS 23 HA CYS 23 -1.876 3.839 -3.434
142 HB2 CYS 23 1HB CYS 23 0.167 1.913 -2.715
143 HB3 CYS 23 2HB CYS 23 -0.034 3.108 -1.450
144 H THR 24 H THR 24 1.671 4.396 -3.777
145 HA THR 24 HA THR 24 1.536 6.786 -2.143
146 HB THR 24 HB THR 24 4.048 6.781 -2.971
147 HG1 THR 24 1HG THR 24 4.529 4.535 -3.714
148 HG21 THR 24 3HG2 THR 24 4.679 5.077 -1.346
149 HG22 THR 24 1HG2 THR 24 3.242 5.901 -0.694
150 HG23 THR 24 2HG2 THR 24 3.080 4.303 -1.460
151 H THR 25 H THR 25 -0.298 7.395 -3.862
152 HA THR 25 HA THR 25 1.058 9.258 -5.669
153 HB THR 25 HB THR 25 -0.467 8.601 -7.499
154 HG1 THR 25 1HG THR 25 -2.049 6.978 -7.005
155 HG21 THR 25 3HG2 THR 25 0.180 5.836 -6.670
156 HG22 THR 25 1HG2 THR 25 0.731 6.737 -8.102
157 HG23 THR 25 2HG2 THR 25 1.580 6.928 -6.549
158 HA PRO 26 HA PRO 26 -1.837 12.020 -4.123
159 HB2 PRO 26 1HB PRO 26 -1.906 13.913 -6.092
160 HB3 PRO 26 2HB PRO 26 -0.632 13.826 -4.891
161 HG2 PRO 26 1HG PRO 26 -0.551 13.040 -7.740
162 HG3 PRO 26 2HG PRO 26 0.784 13.360 -6.651
163 HD2 PRO 26 1HD PRO 26 -0.152 10.788 -7.507
164 HD3 PRO 26 2HD PRO 26 1.106 11.107 -6.330
165 H GLY 27 H GLY 27 -3.964 11.956 -3.771
166 HA2 GLY 27 1HA GLY 27 -5.772 12.143 -5.963
167 HA3 GLY 27 2HA GLY 27 -5.638 10.488 -5.402
168 H GLN 28 H GLN 28 -7.673 10.275 -4.428
169 HA GLN 28 HA GLN 28 -8.206 12.185 -2.292
170 HB2 GLN 28 1HB GLN 28 -9.903 10.863 -4.309
171 HB3 GLN 28 2HB GLN 28 -10.551 10.711 -2.688
172 HG2 GLN 28 1HG GLN 28 -9.521 13.428 -3.337
173 HG3 GLN 28 2HG GLN 28 -10.881 12.924 -4.320
174 HE21 GLN 28 1HE2 GLN 28 -12.348 14.293 -3.441
175 HE22 GLN 28 2HE2 GLN 28 -12.964 14.173 -1.827
176 H THR 29 H THR 29 -7.574 8.823 -3.133
177 HA THR 29 HA THR 29 -7.916 8.117 -0.292
178 HB THR 29 HB THR 29 -8.499 5.811 -1.197
179 HG1 THR 29 1HG THR 29 -8.983 5.897 -3.558
180 HG21 THR 29 3HG2 THR 29 -10.455 7.406 -2.718
181 HG22 THR 29 1HG2 THR 29 -10.715 6.388 -1.281
182 HG23 THR 29 2HG2 THR 29 -10.182 8.076 -1.092
183 H CYS 30 H CYS 30 -5.561 9.319 -1.266
184 HA CYS 30 HA CYS 30 -3.678 7.539 -2.206
185 HB2 CYS 30 1HB CYS 30 -3.037 9.748 -2.295
186 HB3 CYS 30 2HB CYS 30 -3.572 10.095 -0.662
187 H TYR 31 H TYR 31 -3.997 8.739 1.223
188 HA TYR 31 HA TYR 31 -2.470 6.608 2.264
189 HB2 TYR 31 1HB TYR 31 -2.638 8.705 3.477
190 HB3 TYR 31 2HB TYR 31 -4.371 8.796 3.238
191 HD1 TYR 31 2HD TYR 31 -1.771 6.768 5.013
192 HD2 TYR 31 1HD TYR 31 -5.821 8.147 4.958
193 HE1 TYR 31 2HE TYR 31 -2.148 5.776 7.323
194 HE2 TYR 31 1HE TYR 31 -6.184 7.150 7.268
195 HH TYR 31 HH TYR 31 -4.707 6.600 9.242
196 H THR 32 H THR 32 -5.898 7.025 1.489
197 HA THR 32 HA THR 32 -6.908 5.053 3.234
198 HB THR 32 HB THR 32 -7.859 6.335 0.627
199 HG1 THR 32 1HG THR 32 -7.830 7.692 2.505
200 HG21 THR 32 3HG2 THR 32 -10.141 5.502 1.364
201 HG22 THR 32 1HG2 THR 32 -9.066 4.193 0.817
202 HG23 THR 32 2HG2 THR 32 -9.326 4.462 2.557
203 H CYS 33 H CYS 33 -5.284 4.911 0.081
204 HA CYS 33 HA CYS 33 -6.076 2.196 -0.342
205 HB2 CYS 33 1HB CYS 33 -5.769 3.231 -2.351
206 HB3 CYS 33 2HB CYS 33 -4.435 4.216 -1.782
207 H CYS 34 H CYS 34 -3.570 4.006 1.334
208 HA CYS 34 HA CYS 34 -1.580 2.020 1.287
209 HB2 CYS 34 1HB CYS 34 -2.089 4.418 3.038
210 HB3 CYS 34 2HB CYS 34 -0.760 3.319 3.352
211 H SER 35 H SER 35 -4.691 2.127 2.654
212 HA SER 35 HA SER 35 -3.871 0.260 4.741
213 HB2 SER 35 1HB SER 35 -5.594 1.039 6.139
214 HB3 SER 35 2HB SER 35 -5.013 2.512 5.387
215 HG SER 35 HG SER 35 -7.463 1.976 5.453
216 H SER 36 H SER 36 -5.025 0.384 1.662
217 HA SER 36 HA SER 36 -7.044 -1.658 2.121
218 HB2 SER 36 1HB SER 36 -7.295 0.553 0.612
219 HB3 SER 36 2HB SER 36 -6.540 -0.465 -0.598
220 HG SER 36 HG SER 36 -8.248 -1.952 -0.459
221 H CYS 37 H CYS 37 -4.148 -0.832 0.096
222 HA CYS 37 HA CYS 37 -3.960 -3.613 -0.702
223 HB2 CYS 37 1HB CYS 37 -2.520 -1.109 -1.575
224 HB3 CYS 37 2HB CYS 37 -2.004 -2.710 -2.068
225 H PHE 38 H PHE 38 -3.604 -2.814 2.129
226 HA PHE 38 HA PHE 38 -1.041 -4.037 2.527
227 HB2 PHE 38 1HB PHE 38 -1.742 -1.148 3.296
228 HB3 PHE 38 2HB PHE 38 -0.472 -2.022 4.128
229 HD1 PHE 38 2HD PHE 38 0.812 -3.467 1.892
230 HD2 PHE 38 1HD PHE 38 -0.635 0.516 2.111
231 HE1 PHE 38 2HE PHE 38 2.449 -2.775 0.119
232 HE2 PHE 38 1HE PHE 38 1.002 1.208 0.338
233 HZ PHE 38 HZ PHE 38 2.524 -0.446 -0.637
234 H ASP 39 H ASP 39 -0.625 -4.282 4.999
235 HA ASP 39 HA ASP 39 -3.236 -4.705 6.222
236 HB2 ASP 39 1HB ASP 39 -2.041 -6.801 5.885
237 HB3 ASP 39 2HB ASP 39 -0.564 -6.135 6.554
238 H VAL 40 H VAL 40 -0.314 -5.192 8.110
239 HA VAL 40 HA VAL 40 -0.943 -2.802 9.656
240 HB VAL 40 HB VAL 40 -0.844 -5.046 10.717
241 HG11 VAL 40 1HG1 VAL 40 1.257 -6.180 11.051
242 HG12 VAL 40 2HG1 VAL 40 1.025 -5.926 9.305
243 HG13 VAL 40 3HG1 VAL 40 2.145 -4.884 10.215
244 HG21 VAL 40 3HG2 VAL 40 -0.444 -3.857 12.559
245 HG22 VAL 40 1HG2 VAL 40 1.305 -3.946 12.235
246 HG23 VAL 40 2HG2 VAL 40 0.347 -2.592 11.588
247 H VAL 41 H VAL 41 1.907 -4.535 8.215
248 HA VAL 41 HA VAL 41 3.620 -2.312 8.647
249 HB VAL 41 HB VAL 41 3.962 -4.667 6.784
250 HG11 VAL 41 1HG1 VAL 41 6.404 -4.284 7.378
251 HG12 VAL 41 2HG1 VAL 41 5.646 -3.046 6.347
252 HG13 VAL 41 3HG1 VAL 41 5.896 -2.730 8.081
253 HG21 VAL 41 3HG2 VAL 41 4.221 -4.446 9.771
254 HG22 VAL 41 1HG2 VAL 41 3.537 -5.758 8.782
255 HG23 VAL 41 2HG2 VAL 41 5.301 -5.534 8.867
256 H GLY 42 H GLY 42 2.032 -3.750 5.712
257 HA2 GLY 42 1HA GLY 42 2.904 -2.035 3.787
258 HA3 GLY 42 2HA GLY 42 1.307 -2.756 3.823
259 H GLU 43 H GLU 43 0.585 -1.391 6.427
260 HA GLU 43 HA GLU 43 -0.300 1.028 5.199
261 HB2 GLU 43 1HB GLU 43 -1.626 -0.564 6.792
262 HB3 GLU 43 2HB GLU 43 -0.764 0.235 8.092
263 HG2 GLU 43 1HG GLU 43 -1.578 2.455 6.821
264 HG3 GLU 43 2HG GLU 43 -2.803 1.379 6.180
265 H GLN 44 H GLN 44 1.483 0.192 8.264
266 HA GLN 44 HA GLN 44 2.163 2.829 8.800
267 HB2 GLN 44 1HB GLN 44 3.403 1.960 10.600
268 HB3 GLN 44 2HB GLN 44 2.194 0.720 10.334
269 HG2 GLN 44 1HG GLN 44 3.959 -0.389 8.751
270 HG3 GLN 44 2HG GLN 44 5.119 0.690 9.500
271 HE21 GLN 44 1HE2 GLN 44 2.414 -1.429 10.451
272 HE22 GLN 44 2HE2 GLN 44 3.189 -2.179 11.807
273 H ALA 45 H ALA 45 3.352 0.574 6.452
274 HA ALA 45 HA ALA 45 5.973 1.785 6.291
275 HB1 ALA 45 3HB ALA 45 4.601 -0.284 4.527
276 HB2 ALA 45 1HB ALA 45 6.333 0.124 4.530
277 HB3 ALA 45 2HB ALA 45 5.600 -0.656 5.952
278 H CYS 46 H CYS 46 2.882 1.643 4.422
279 HA CYS 46 HA CYS 46 3.886 3.350 2.389
280 HB2 CYS 46 1HB CYS 46 2.130 1.686 1.980
281 HB3 CYS 46 2HB CYS 46 1.048 2.543 3.060
282 H GLN 47 H GLN 47 2.320 3.674 5.550
283 HA GLN 47 HA GLN 47 1.167 6.134 5.292
284 HB2 GLN 47 1HB GLN 47 2.101 4.403 7.481
285 HB3 GLN 47 2HB GLN 47 2.210 6.101 7.897
286 HG2 GLN 47 1HG GLN 47 -0.262 6.103 6.749
287 HG3 GLN 47 2HG GLN 47 -0.219 4.441 7.302
288 HE21 GLN 47 1HE2 GLN 47 0.251 7.798 8.302
289 HE22 GLN 47 2HE2 GLN 47 -0.206 7.612 9.962
290 H MET 48 H MET 48 4.585 5.263 6.074
291 HA MET 48 HA MET 48 5.312 7.995 6.358
292 HB2 MET 48 1HB MET 48 6.807 5.333 6.220
293 HB3 MET 48 2HB MET 48 7.690 6.845 6.280
294 HG2 MET 48 1HG MET 48 6.193 7.389 8.374
295 HG3 MET 48 2HG MET 48 5.829 5.675 8.381
296 HE1 MET 48 3HE MET 48 7.359 7.806 10.334
297 HE2 MET 48 1HE MET 48 9.084 7.446 10.583
298 HE3 MET 48 2HE MET 48 8.570 8.406 9.176
299 H SER 49 H SER 49 4.421 6.255 3.681
300 HA SER 49 HA SER 49 6.286 7.762 2.020
301 HB2 SER 49 1HB SER 49 5.452 4.893 1.900
302 HB3 SER 49 2HB SER 49 5.537 5.724 0.359
303 HG SER 49 HG SER 49 7.627 5.195 2.249
304 H ALA 50 H ALA 50 3.273 7.822 3.192
305 HA ALA 50 HA ALA 50 1.592 7.769 0.954
306 HB1 ALA 50 3HB ALA 50 1.302 9.390 3.513
307 HB2 ALA 50 1HB ALA 50 -0.002 8.849 2.428
308 HB3 ALA 50 2HB ALA 50 0.921 7.657 3.375
309 H GLN 51 H GLN 51 2.823 8.853 -0.734
310 HA GLN 51 HA GLN 51 3.383 11.630 -0.310
311 HB2 GLN 51 1HB GLN 51 4.457 9.616 -1.935
312 HB3 GLN 51 2HB GLN 51 3.604 10.636 -3.076
313 HG2 GLN 51 1HG GLN 51 4.799 12.601 -1.674
314 HG3 GLN 51 2HG GLN 51 5.930 11.322 -1.283
315 HE21 GLN 51 1HE2 GLN 51 6.637 9.957 -3.182
316 HE22 GLN 51 2HE2 GLN 51 7.048 10.780 -4.650
317 H CYS 52 H CYS 52 0.954 11.977 0.171
318 HA CYS 52 HA CYS 52 -0.663 12.011 -2.230
319 HB2 CYS 52 1HB CYS 52 -1.714 13.086 0.328
320 HB3 CYS 52 2HB CYS 52 -2.497 12.104 -0.894
Start of MODEL 14
1 H1 ASN 1 1H ASN 1 10.338 -6.265 -1.604
2 HA ASN 1 HA ASN 1 10.737 -5.179 0.292
3 HB2 ASN 1 1HB ASN 1 10.372 -2.929 -1.381
4 HB3 ASN 1 2HB ASN 1 9.174 -2.703 -0.122
5 HD21 ASN 1 1HD2 ASN 1 12.134 -1.852 -0.972
6 HD22 ASN 1 2HD2 ASN 1 12.932 -1.673 0.555
7 HA PRO 2 HA PRO 2 6.049 -4.585 1.016
8 HB2 PRO 2 1HB PRO 2 4.345 -4.521 -1.119
9 HB3 PRO 2 2HB PRO 2 4.977 -3.077 -0.354
10 HG2 PRO 2 1HG PRO 2 5.749 -4.296 -2.934
11 HG3 PRO 2 2HG PRO 2 6.044 -2.668 -2.358
12 HD2 PRO 2 1HD PRO 2 7.940 -4.817 -2.474
13 HD3 PRO 2 2HD PRO 2 8.202 -3.225 -1.791
14 H GLU 3 H GLU 3 7.618 -6.854 -0.670
15 HA GLU 3 HA GLU 3 5.687 -8.717 -1.216
16 HB2 GLU 3 1HB GLU 3 7.513 -10.361 -1.167
17 HB3 GLU 3 2HB GLU 3 8.056 -8.881 -1.933
18 HG2 GLU 3 1HG GLU 3 9.806 -8.952 -0.476
19 HG3 GLU 3 2HG GLU 3 8.668 -8.386 0.731
20 H ASP 4 H ASP 4 7.202 -7.768 1.866
21 HA ASP 4 HA ASP 4 6.258 -10.041 3.253
22 HB2 ASP 4 1HB ASP 4 6.904 -7.412 4.604
23 HB3 ASP 4 2HB ASP 4 7.222 -9.039 5.172
24 H TRP 5 H TRP 5 5.080 -6.810 2.374
25 HA TRP 5 HA TRP 5 2.726 -7.215 4.088
26 HB2 TRP 5 1HB TRP 5 3.135 -4.541 2.965
27 HB3 TRP 5 2HB TRP 5 2.684 -5.038 4.584
28 HD1 TRP 5 HD TRP 5 5.079 -6.279 5.900
29 HE1 TRP 5 1HE TRP 5 7.476 -5.208 6.168
30 HE3 TRP 5 3HE TRP 5 4.603 -2.965 2.072
31 HZ2 TRP 5 2HZ TRP 5 8.872 -3.141 4.781
32 HZ3 TRP 5 3HZ TRP 5 6.530 -1.457 1.596
33 HH2 TRP 5 HH TRP 5 8.610 -1.508 2.878
34 H PHE 6 H PHE 6 1.300 -5.087 2.528
35 HA PHE 6 HA PHE 6 -0.100 -4.955 0.831
36 HB2 PHE 6 1HB PHE 6 1.898 -4.604 -0.536
37 HB3 PHE 6 2HB PHE 6 2.350 -6.294 -0.430
38 HD1 PHE 6 2HD PHE 6 -0.459 -4.183 -1.701
39 HD2 PHE 6 1HD PHE 6 1.935 -7.643 -2.254
40 HE1 PHE 6 2HE PHE 6 -1.606 -4.627 -3.888
41 HE2 PHE 6 1HE PHE 6 0.787 -8.087 -4.442
42 HZ PHE 6 HZ PHE 6 -0.970 -6.574 -5.233
43 H THR 7 H THR 7 -1.980 -6.072 0.644
44 HA THR 7 HA THR 7 -1.767 -9.004 0.432
45 HB THR 7 HB THR 7 -4.032 -8.941 1.581
46 HG1 THR 7 1HG THR 7 -4.167 -6.566 0.755
47 HG21 THR 7 3HG2 THR 7 -3.157 -8.689 3.734
48 HG22 THR 7 1HG2 THR 7 -1.628 -8.798 2.831
49 HG23 THR 7 2HG2 THR 7 -2.269 -7.207 3.305
50 HA PRO 8 HA PRO 8 -3.500 -7.934 -3.484
51 HB2 PRO 8 1HB PRO 8 -2.457 -10.053 -4.859
52 HB3 PRO 8 2HB PRO 8 -1.634 -8.513 -4.702
53 HG2 PRO 8 1HG PRO 8 -1.064 -11.067 -3.327
54 HG3 PRO 8 2HG PRO 8 -0.028 -9.666 -3.515
55 HD2 PRO 8 1HD PRO 8 -1.466 -10.434 -1.155
56 HD3 PRO 8 2HD PRO 8 -0.524 -8.974 -1.379
57 H ASP 9 H ASP 9 -4.182 -10.129 -1.206
58 HA ASP 9 HA ASP 9 -5.997 -11.613 -2.881
59 HB2 ASP 9 1HB ASP 9 -4.569 -12.116 -0.460
60 HB3 ASP 9 2HB ASP 9 -6.264 -12.112 -0.016
61 H THR 10 H THR 10 -5.914 -8.652 -1.287
62 HA THR 10 HA THR 10 -8.818 -8.555 -1.125
63 HB THR 10 HB THR 10 -8.103 -9.223 1.158
64 HG1 THR 10 1HG THR 10 -9.771 -7.710 1.272
65 HG21 THR 10 3HG2 THR 10 -6.328 -8.277 2.270
66 HG22 THR 10 1HG2 THR 10 -5.811 -7.687 0.672
67 HG23 THR 10 2HG2 THR 10 -6.775 -6.638 1.738
68 H CYS 11 H CYS 11 -7.107 -7.565 -3.134
69 HA CYS 11 HA CYS 11 -7.662 -4.746 -2.763
70 HB2 CYS 11 1HB CYS 11 -5.130 -5.558 -2.262
71 HB3 CYS 11 2HB CYS 11 -5.026 -5.307 -3.993
72 H ALA 12 H ALA 12 -6.847 -3.716 -5.137
73 HA ALA 12 HA ALA 12 -8.314 -5.351 -7.051
74 HB1 ALA 12 3HB ALA 12 -7.997 -2.521 -6.473
75 HB2 ALA 12 1HB ALA 12 -7.613 -2.859 -8.178
76 HB3 ALA 12 2HB ALA 12 -9.193 -3.333 -7.511
77 H TYR 13 H TYR 13 -5.101 -3.925 -6.382
78 HA TYR 13 HA TYR 13 -4.091 -4.814 -8.946
79 HB2 TYR 13 1HB TYR 13 -3.125 -3.358 -6.432
80 HB3 TYR 13 2HB TYR 13 -1.938 -3.928 -7.588
81 HD1 TYR 13 2HD TYR 13 -5.245 -2.714 -8.679
82 HD2 TYR 13 1HD TYR 13 -1.129 -1.698 -8.106
83 HE1 TYR 13 2HE TYR 13 -5.567 -0.601 -10.057
84 HE2 TYR 13 1HE TYR 13 -1.465 0.411 -9.486
85 HH TYR 13 HH TYR 13 -4.575 1.541 -10.322
86 H GLY 14 H GLY 14 -2.515 -6.445 -9.256
87 HA2 GLY 14 1HA GLY 14 -2.456 -8.436 -7.092
88 HA3 GLY 14 2HA GLY 14 -2.176 -8.727 -8.797
89 H ASP 15 H ASP 15 -0.604 -5.854 -8.282
90 HA ASP 15 HA ASP 15 1.884 -7.278 -7.842
91 HB2 ASP 15 1HB ASP 15 1.440 -4.428 -8.843
92 HB3 ASP 15 2HB ASP 15 2.960 -5.301 -8.856
93 H SER 16 H SER 16 3.486 -6.315 -6.322
94 HA SER 16 HA SER 16 2.133 -4.860 -4.217
95 HB2 SER 16 1HB SER 16 4.068 -5.540 -2.814
96 HB3 SER 16 2HB SER 16 3.287 -6.921 -3.558
97 HG SER 16 HG SER 16 5.801 -6.589 -3.633
98 H ASN 17 H ASN 17 4.804 -4.669 -6.579
99 HA ASN 17 HA ASN 17 6.000 -2.406 -5.437
100 HB2 ASN 17 1HB ASN 17 6.869 -4.146 -7.260
101 HB3 ASN 17 2HB ASN 17 6.120 -3.052 -8.406
102 HD21 ASN 17 1HD2 ASN 17 6.917 -1.002 -8.724
103 HD22 ASN 17 2HD2 ASN 17 8.469 -0.477 -8.161
104 H THR 18 H THR 18 3.572 -3.033 -8.044
105 HA THR 18 HA THR 18 3.338 -0.263 -8.749
106 HB THR 18 HB THR 18 2.813 -2.702 -9.965
107 HG1 THR 18 1HG THR 18 2.787 -1.042 -11.426
108 HG21 THR 18 3HG2 THR 18 0.473 -2.984 -10.257
109 HG22 THR 18 1HG2 THR 18 0.594 -2.654 -8.512
110 HG23 THR 18 2HG2 THR 18 0.109 -1.358 -9.632
111 H ALA 19 H ALA 19 1.656 -2.547 -6.576
112 HA ALA 19 HA ALA 19 -0.606 -0.981 -6.128
113 HB1 ALA 19 3HB ALA 19 -0.531 -2.315 -3.879
114 HB2 ALA 19 1HB ALA 19 -0.715 -3.210 -5.407
115 HB3 ALA 19 2HB ALA 19 0.873 -3.133 -4.606
116 H TRP 20 H TRP 20 2.493 -1.236 -4.243
117 HA TRP 20 HA TRP 20 1.872 0.723 -2.387
118 HB2 TRP 20 1HB TRP 20 3.676 -0.739 -1.972
119 HB3 TRP 20 2HB TRP 20 4.478 -0.323 -3.474
120 HD1 TRP 20 HD TRP 20 5.094 2.598 -3.474
121 HE1 TRP 20 1HE TRP 20 6.375 3.965 -1.615
122 HE3 TRP 20 3HE TRP 20 4.222 -0.701 0.296
123 HZ2 TRP 20 2HZ TRP 20 6.868 3.524 1.161
124 HZ3 TRP 20 3HZ TRP 20 5.138 -0.157 2.550
125 HH2 TRP 20 HH TRP 20 6.421 1.871 3.012
126 H THR 21 H THR 21 3.637 0.924 -5.557
127 HA THR 21 HA THR 21 4.132 3.653 -5.501
128 HB THR 21 HB THR 21 4.042 1.417 -7.474
129 HG1 THR 21 1HG THR 21 6.083 2.055 -6.799
130 HG21 THR 21 3HG2 THR 21 2.951 2.783 -9.042
131 HG22 THR 21 1HG2 THR 21 3.447 4.285 -8.225
132 HG23 THR 21 2HG2 THR 21 4.617 3.385 -9.221
133 H THR 22 H THR 22 1.366 1.949 -7.124
134 HA THR 22 HA THR 22 0.047 4.288 -7.860
135 HB THR 22 HB THR 22 -0.858 1.423 -7.290
136 HG1 THR 22 1HG THR 22 -0.428 3.115 -9.652
137 HG21 THR 22 3HG2 THR 22 -2.350 3.646 -8.780
138 HG22 THR 22 1HG2 THR 22 -2.877 1.954 -8.608
139 HG23 THR 22 2HG2 THR 22 -2.826 3.019 -7.183
140 H CYS 23 H CYS 23 0.548 2.919 -4.719
141 HA CYS 23 HA CYS 23 -1.805 4.210 -3.646
142 HB2 CYS 23 1HB CYS 23 0.052 2.135 -2.780
143 HB3 CYS 23 2HB CYS 23 -0.254 3.313 -1.519
144 H THR 24 H THR 24 1.775 4.496 -3.800
145 HA THR 24 HA THR 24 1.763 6.825 -2.076
146 HB THR 24 HB THR 24 4.295 6.662 -2.849
147 HG1 THR 24 1HG THR 24 4.678 4.548 -3.780
148 HG21 THR 24 3HG2 THR 24 3.212 4.170 -1.467
149 HG22 THR 24 1HG2 THR 24 4.763 4.998 -1.188
150 HG23 THR 24 2HG2 THR 24 3.245 5.741 -0.630
151 H THR 25 H THR 25 0.023 7.571 -3.884
152 HA THR 25 HA THR 25 1.538 9.507 -5.456
153 HB THR 25 HB THR 25 -0.170 8.910 -7.372
154 HG1 THR 25 1HG THR 25 -1.026 6.790 -7.086
155 HG21 THR 25 3HG2 THR 25 2.429 7.850 -6.730
156 HG22 THR 25 1HG2 THR 25 1.427 6.490 -7.293
157 HG23 THR 25 2HG2 THR 25 1.651 7.920 -8.330
158 HA PRO 26 HA PRO 26 -1.588 12.148 -4.177
159 HB2 PRO 26 1HB PRO 26 -1.610 14.047 -6.142
160 HB3 PRO 26 2HB PRO 26 -0.415 14.008 -4.861
161 HG2 PRO 26 1HG PRO 26 -0.115 13.240 -7.700
162 HG3 PRO 26 2HG PRO 26 1.132 13.612 -6.525
163 HD2 PRO 26 1HD PRO 26 0.364 11.007 -7.447
164 HD3 PRO 26 2HD PRO 26 1.528 11.372 -6.190
165 H GLY 27 H GLY 27 -3.728 11.983 -3.963
166 HA2 GLY 27 1HA GLY 27 -5.386 12.085 -6.286
167 HA3 GLY 27 2HA GLY 27 -5.236 10.449 -5.676
168 H GLN 28 H GLN 28 -7.396 10.270 -4.932
169 HA GLN 28 HA GLN 28 -8.126 12.183 -2.865
170 HB2 GLN 28 1HB GLN 28 -10.459 11.285 -3.214
171 HB3 GLN 28 2HB GLN 28 -9.777 12.068 -4.626
172 HG2 GLN 28 1HG GLN 28 -9.371 9.998 -5.738
173 HG3 GLN 28 2HG GLN 28 -9.465 9.072 -4.253
174 HE21 GLN 28 1HE2 GLN 28 -11.035 7.685 -4.840
175 HE22 GLN 28 2HE2 GLN 28 -12.680 8.120 -5.164
176 H THR 29 H THR 29 -7.586 8.732 -3.607
177 HA THR 29 HA THR 29 -7.881 8.172 -0.728
178 HB THR 29 HB THR 29 -8.600 5.852 -1.545
179 HG1 THR 29 1HG THR 29 -8.417 5.634 -3.738
180 HG21 THR 29 3HG2 THR 29 -10.174 8.372 -2.134
181 HG22 THR 29 1HG2 THR 29 -10.805 6.815 -2.721
182 HG23 THR 29 2HG2 THR 29 -10.539 7.068 -0.979
183 H CYS 30 H CYS 30 -5.493 9.158 -1.436
184 HA CYS 30 HA CYS 30 -3.727 7.250 -2.485
185 HB2 CYS 30 1HB CYS 30 -2.963 9.422 -2.630
186 HB3 CYS 30 2HB CYS 30 -3.443 9.827 -0.994
187 H TYR 31 H TYR 31 -3.832 8.579 0.905
188 HA TYR 31 HA TYR 31 -2.517 6.312 1.964
189 HB2 TYR 31 1HB TYR 31 -2.320 8.380 3.167
190 HB3 TYR 31 2HB TYR 31 -3.992 8.813 2.869
191 HD1 TYR 31 1HD TYR 31 -1.820 6.553 4.885
192 HD2 TYR 31 2HD TYR 31 -5.673 8.368 4.480
193 HE1 TYR 31 1HE TYR 31 -2.448 5.757 7.216
194 HE2 TYR 31 2HE TYR 31 -6.288 7.566 6.813
195 HH TYR 31 HH TYR 31 -4.699 5.206 8.383
196 H THR 32 H THR 32 -5.816 6.940 1.067
197 HA THR 32 HA THR 32 -7.081 5.334 3.029
198 HB THR 32 HB THR 32 -7.813 6.426 0.274
199 HG1 THR 32 1HG THR 32 -9.139 7.722 1.778
200 HG21 THR 32 3HG2 THR 32 -10.158 5.795 0.806
201 HG22 THR 32 1HG2 THR 32 -9.152 4.333 0.673
202 HG23 THR 32 2HG2 THR 32 -9.608 4.957 2.277
203 H CYS 33 H CYS 33 -5.381 4.644 -0.003
204 HA CYS 33 HA CYS 33 -6.399 1.938 0.009
205 HB2 CYS 33 1HB CYS 33 -5.362 1.665 -2.089
206 HB3 CYS 33 2HB CYS 33 -6.125 3.243 -2.100
207 H CYS 34 H CYS 34 -3.849 3.853 1.349
208 HA CYS 34 HA CYS 34 -1.766 1.985 1.298
209 HB2 CYS 34 1HB CYS 34 -2.383 4.409 2.957
210 HB3 CYS 34 2HB CYS 34 -1.040 3.371 3.389
211 H SER 35 H SER 35 -4.833 1.952 2.795
212 HA SER 35 HA SER 35 -3.834 0.140 4.852
213 HB2 SER 35 1HB SER 35 -5.647 0.780 6.270
214 HB3 SER 35 2HB SER 35 -5.012 2.278 5.620
215 HG SER 35 HG SER 35 -6.817 2.603 4.446
216 H SER 36 H SER 36 -5.118 0.180 1.819
217 HA SER 36 HA SER 36 -6.952 -2.012 2.378
218 HB2 SER 36 1HB SER 36 -6.741 -0.024 0.099
219 HB3 SER 36 2HB SER 36 -7.595 -1.537 -0.128
220 HG SER 36 HG SER 36 -9.162 -0.940 1.306
221 H CYS 37 H CYS 37 -4.203 -0.897 0.315
222 HA CYS 37 HA CYS 37 -3.903 -3.588 -0.720
223 HB2 CYS 37 1HB CYS 37 -3.185 -0.916 -1.601
224 HB3 CYS 37 2HB CYS 37 -1.807 -1.997 -1.670
225 H PHE 38 H PHE 38 -3.528 -2.968 2.173
226 HA PHE 38 HA PHE 38 -0.925 -4.141 2.438
227 HB2 PHE 38 1HB PHE 38 -1.691 -1.348 3.466
228 HB3 PHE 38 2HB PHE 38 -0.340 -2.239 4.138
229 HD1 PHE 38 2HD PHE 38 1.270 -3.225 2.156
230 HD2 PHE 38 1HD PHE 38 -1.137 0.262 1.928
231 HE1 PHE 38 2HE PHE 38 2.767 -2.309 0.362
232 HE2 PHE 38 1HE PHE 38 0.360 1.178 0.134
233 HZ PHE 38 HZ PHE 38 2.294 -0.118 -0.628
234 H ASP 39 H ASP 39 -0.447 -4.346 4.976
235 HA ASP 39 HA ASP 39 -3.018 -5.040 6.163
236 HB2 ASP 39 1HB ASP 39 -1.690 -7.036 5.739
237 HB3 ASP 39 2HB ASP 39 -0.256 -6.301 6.427
238 H VAL 40 H VAL 40 -0.057 -5.405 8.019
239 HA VAL 40 HA VAL 40 -0.851 -3.153 9.687
240 HB VAL 40 HB VAL 40 0.461 -5.746 10.044
241 HG11 VAL 40 1HG1 VAL 40 1.666 -3.259 11.247
242 HG12 VAL 40 2HG1 VAL 40 1.701 -4.804 12.130
243 HG13 VAL 40 3HG1 VAL 40 2.474 -4.674 10.532
244 HG21 VAL 40 3HG2 VAL 40 -0.650 -5.707 12.146
245 HG22 VAL 40 1HG2 VAL 40 -0.827 -3.937 12.104
246 HG23 VAL 40 2HG2 VAL 40 -1.763 -4.951 10.981
247 H VAL 41 H VAL 41 2.293 -4.570 8.524
248 HA VAL 41 HA VAL 41 3.631 -2.101 8.839
249 HB VAL 41 HB VAL 41 4.381 -4.582 7.279
250 HG11 VAL 41 1HG1 VAL 41 5.689 -2.536 6.699
251 HG12 VAL 41 2HG1 VAL 41 6.178 -2.409 8.406
252 HG13 VAL 41 3HG1 VAL 41 6.670 -3.822 7.441
253 HG21 VAL 41 3HG2 VAL 41 4.598 -3.847 10.189
254 HG22 VAL 41 1HG2 VAL 41 4.098 -5.382 9.439
255 HG23 VAL 41 2HG2 VAL 41 5.815 -4.911 9.444
256 H GLY 42 H GLY 42 2.181 -3.864 6.042
257 HA2 GLY 42 1HA GLY 42 3.042 -2.342 3.946
258 HA3 GLY 42 2HA GLY 42 1.461 -3.089 4.054
259 H GLU 43 H GLU 43 0.614 -1.521 6.455
260 HA GLU 43 HA GLU 43 -0.191 0.805 4.990
261 HB2 GLU 43 1HB GLU 43 -1.736 -0.631 6.438
262 HB3 GLU 43 2HB GLU 43 -0.923 0.028 7.844
263 HG2 GLU 43 1HG GLU 43 -1.472 2.375 6.801
264 HG3 GLU 43 2HG GLU 43 -2.605 1.503 5.787
265 H GLN 44 H GLN 44 1.534 0.029 8.087
266 HA GLN 44 HA GLN 44 2.027 2.681 8.742
267 HB2 GLN 44 1HB GLN 44 3.302 1.823 10.511
268 HB3 GLN 44 2HB GLN 44 2.223 0.487 10.161
269 HG2 GLN 44 1HG GLN 44 4.206 -0.695 10.137
270 HG3 GLN 44 2HG GLN 44 4.209 -0.188 8.459
271 HE21 GLN 44 1HE2 GLN 44 5.604 0.183 11.597
272 HE22 GLN 44 2HE2 GLN 44 6.931 1.214 11.177
273 H ALA 45 H ALA 45 3.417 0.572 6.342
274 HA ALA 45 HA ALA 45 5.906 2.043 6.211
275 HB1 ALA 45 3HB ALA 45 4.745 -0.191 4.495
276 HB2 ALA 45 1HB ALA 45 6.406 0.442 4.392
277 HB3 ALA 45 2HB ALA 45 5.863 -0.397 5.865
278 H CYS 46 H CYS 46 2.782 1.711 4.466
279 HA CYS 46 HA CYS 46 3.615 3.407 2.343
280 HB2 CYS 46 1HB CYS 46 1.887 1.628 2.135
281 HB3 CYS 46 2HB CYS 46 0.819 2.579 3.148
282 H GLN 47 H GLN 47 2.079 3.715 5.542
283 HA GLN 47 HA GLN 47 0.885 6.155 5.260
284 HB2 GLN 47 1HB GLN 47 1.885 4.480 7.485
285 HB3 GLN 47 2HB GLN 47 1.855 6.190 7.868
286 HG2 GLN 47 1HG GLN 47 -0.592 5.654 6.495
287 HG3 GLN 47 2HG GLN 47 -0.376 4.331 7.624
288 HE21 GLN 47 1HE2 GLN 47 -1.610 4.725 9.301
289 HE22 GLN 47 2HE2 GLN 47 -1.685 6.192 10.220
290 H MET 48 H MET 48 4.300 5.359 6.168
291 HA MET 48 HA MET 48 5.034 8.033 6.530
292 HB2 MET 48 1HB MET 48 6.563 5.443 5.966
293 HB3 MET 48 2HB MET 48 7.407 6.961 6.203
294 HG2 MET 48 1HG MET 48 5.368 5.982 8.239
295 HG3 MET 48 2HG MET 48 7.024 5.411 8.284
296 HE1 MET 48 3HE MET 48 4.911 9.036 8.492
297 HE2 MET 48 1HE MET 48 4.594 7.542 9.406
298 HE3 MET 48 2HE MET 48 5.380 8.925 10.205
299 H SER 49 H SER 49 5.070 5.801 3.717
300 HA SER 49 HA SER 49 6.412 7.787 2.133
301 HB2 SER 49 1HB SER 49 5.573 4.920 1.759
302 HB3 SER 49 2HB SER 49 5.810 5.894 0.321
303 HG SER 49 HG SER 49 7.710 5.082 2.297
304 H ALA 50 H ALA 50 3.452 7.786 3.345
305 HA ALA 50 HA ALA 50 1.741 7.801 1.104
306 HB1 ALA 50 3HB ALA 50 0.145 8.811 2.683
307 HB2 ALA 50 1HB ALA 50 1.007 7.452 3.444
308 HB3 ALA 50 2HB ALA 50 1.467 9.127 3.833
309 H GLN 51 H GLN 51 3.270 9.057 -0.348
310 HA GLN 51 HA GLN 51 3.456 11.846 0.273
311 HB2 GLN 51 1HB GLN 51 4.772 9.962 -1.519
312 HB3 GLN 51 2HB GLN 51 4.277 11.388 -2.410
313 HG2 GLN 51 1HG GLN 51 6.500 11.809 -1.527
314 HG3 GLN 51 2HG GLN 51 5.378 12.825 -0.643
315 HE21 GLN 51 1HE2 GLN 51 6.548 13.020 1.189
316 HE22 GLN 51 2HE2 GLN 51 6.883 11.728 2.294
317 H CYS 52 H CYS 52 0.944 11.880 0.373
318 HA CYS 52 HA CYS 52 -0.211 12.007 -2.294
319 HB2 CYS 52 1HB CYS 52 -1.949 12.530 0.021
320 HB3 CYS 52 2HB CYS 52 -2.204 11.515 -1.384
Start of MODEL 15
1 H1 ASN 1 1H ASN 1 9.974 -3.317 0.775
2 HA ASN 1 HA ASN 1 9.866 -4.880 -1.297
3 HB2 ASN 1 1HB ASN 1 11.322 -6.351 0.879
4 HB3 ASN 1 2HB ASN 1 10.070 -7.267 0.064
5 HD21 ASN 1 1HD2 ASN 1 13.248 -6.562 0.063
6 HD22 ASN 1 2HD2 ASN 1 13.671 -6.838 -1.594
7 HA PRO 2 HA PRO 2 6.101 -4.800 1.125
8 HB2 PRO 2 1HB PRO 2 4.374 -4.489 -0.969
9 HB3 PRO 2 2HB PRO 2 5.120 -3.141 -0.134
10 HG2 PRO 2 1HG PRO 2 5.763 -4.258 -2.795
11 HG3 PRO 2 2HG PRO 2 6.184 -2.691 -2.131
12 HD2 PRO 2 1HD PRO 2 7.917 -4.960 -2.409
13 HD3 PRO 2 2HD PRO 2 8.304 -3.433 -1.640
14 H GLU 3 H GLU 3 7.477 -7.072 -0.718
15 HA GLU 3 HA GLU 3 5.410 -8.757 -1.336
16 HB2 GLU 3 1HB GLU 3 7.069 -10.426 -1.645
17 HB3 GLU 3 2HB GLU 3 7.910 -8.918 -1.944
18 HG2 GLU 3 1HG GLU 3 8.578 -8.974 0.567
19 HG3 GLU 3 2HG GLU 3 8.009 -10.631 0.573
20 H ASP 4 H ASP 4 7.160 -8.239 1.754
21 HA ASP 4 HA ASP 4 6.034 -10.468 3.023
22 HB2 ASP 4 1HB ASP 4 8.069 -8.779 3.613
23 HB3 ASP 4 2HB ASP 4 6.826 -8.020 4.587
24 H TRP 5 H TRP 5 4.982 -7.194 2.258
25 HA TRP 5 HA TRP 5 2.679 -7.510 4.061
26 HB2 TRP 5 1HB TRP 5 3.140 -4.829 3.014
27 HB3 TRP 5 2HB TRP 5 2.804 -5.368 4.647
28 HD1 TRP 5 HD TRP 5 5.300 -6.833 5.606
29 HE1 TRP 5 1HE TRP 5 7.729 -5.813 5.755
30 HE3 TRP 5 3HE TRP 5 4.519 -3.128 2.213
31 HZ2 TRP 5 2HZ TRP 5 9.022 -3.620 4.465
32 HZ3 TRP 5 3HZ TRP 5 6.416 -1.590 1.715
33 HH2 TRP 5 HH TRP 5 8.608 -1.791 2.779
34 H PHE 6 H PHE 6 1.302 -5.282 2.613
35 HA PHE 6 HA PHE 6 -0.143 -5.035 0.967
36 HB2 PHE 6 1HB PHE 6 1.761 -4.702 -0.495
37 HB3 PHE 6 2HB PHE 6 2.247 -6.381 -0.377
38 HD1 PHE 6 2HD PHE 6 -0.602 -4.320 -1.630
39 HD2 PHE 6 1HD PHE 6 1.787 -7.787 -2.151
40 HE1 PHE 6 2HE PHE 6 -1.793 -4.817 -3.783
41 HE2 PHE 6 1HE PHE 6 0.596 -8.284 -4.303
42 HZ PHE 6 HZ PHE 6 -1.179 -6.793 -5.094
43 H THR 7 H THR 7 -2.075 -6.049 0.690
44 HA THR 7 HA THR 7 -2.011 -8.990 0.544
45 HB THR 7 HB THR 7 -4.352 -8.742 1.525
46 HG1 THR 7 1HG THR 7 -4.323 -6.410 0.652
47 HG21 THR 7 3HG2 THR 7 -3.658 -8.141 3.781
48 HG22 THR 7 1HG2 THR 7 -2.282 -8.989 3.035
49 HG23 THR 7 2HG2 THR 7 -2.270 -7.213 3.164
50 HA PRO 8 HA PRO 8 -3.430 -8.070 -3.514
51 HB2 PRO 8 1HB PRO 8 -2.598 -10.410 -4.655
52 HB3 PRO 8 2HB PRO 8 -1.590 -8.980 -4.557
53 HG2 PRO 8 1HG PRO 8 -1.443 -11.464 -2.961
54 HG3 PRO 8 2HG PRO 8 -0.222 -10.227 -3.181
55 HD2 PRO 8 1HD PRO 8 -1.883 -10.609 -0.874
56 HD3 PRO 8 2HD PRO 8 -0.744 -9.304 -1.141
57 H ASP 9 H ASP 9 -4.420 -10.158 -1.170
58 HA ASP 9 HA ASP 9 -6.334 -11.483 -2.831
59 HB2 ASP 9 1HB ASP 9 -5.146 -11.921 -0.281
60 HB3 ASP 9 2HB ASP 9 -6.845 -11.649 0.047
61 H THR 10 H THR 10 -5.989 -8.467 -1.226
62 HA THR 10 HA THR 10 -8.837 -7.936 -1.515
63 HB THR 10 HB THR 10 -8.587 -8.692 0.838
64 HG1 THR 10 1HG THR 10 -9.835 -6.686 0.105
65 HG21 THR 10 3HG2 THR 10 -6.819 -8.090 2.157
66 HG22 THR 10 1HG2 THR 10 -6.058 -7.403 0.702
67 HG23 THR 10 2HG2 THR 10 -7.051 -6.370 1.759
68 H CYS 11 H CYS 11 -6.788 -7.206 -3.258
69 HA CYS 11 HA CYS 11 -6.771 -4.332 -2.747
70 HB2 CYS 11 1HB CYS 11 -4.557 -5.088 -2.158
71 HB3 CYS 11 2HB CYS 11 -4.407 -5.983 -3.657
72 H ALA 12 H ALA 12 -6.476 -3.101 -4.873
73 HA ALA 12 HA ALA 12 -8.187 -4.219 -6.831
74 HB1 ALA 12 3HB ALA 12 -6.683 -1.680 -6.363
75 HB2 ALA 12 1HB ALA 12 -7.136 -2.047 -8.045
76 HB3 ALA 12 2HB ALA 12 -8.393 -1.935 -6.789
77 H TYR 13 H TYR 13 -4.630 -3.591 -6.612
78 HA TYR 13 HA TYR 13 -4.290 -5.010 -9.144
79 HB2 TYR 13 1HB TYR 13 -2.308 -3.578 -7.272
80 HB3 TYR 13 2HB TYR 13 -2.007 -4.005 -8.945
81 HD1 TYR 13 2HD TYR 13 -3.726 -2.939 -10.689
82 HD2 TYR 13 1HD TYR 13 -2.934 -1.394 -6.779
83 HE1 TYR 13 2HE TYR 13 -4.562 -0.650 -11.416
84 HE2 TYR 13 1HE TYR 13 -3.772 0.890 -7.519
85 HH TYR 13 HH TYR 13 -4.700 2.038 -9.098
86 H GLY 14 H GLY 14 -2.539 -6.651 -9.310
87 HA2 GLY 14 1HA GLY 14 -2.513 -8.319 -6.887
88 HA3 GLY 14 2HA GLY 14 -2.263 -8.857 -8.536
89 H ASP 15 H ASP 15 -0.657 -5.881 -8.103
90 HA ASP 15 HA ASP 15 1.823 -7.338 -7.656
91 HB2 ASP 15 1HB ASP 15 1.622 -4.526 -8.782
92 HB3 ASP 15 2HB ASP 15 2.934 -5.672 -8.967
93 H SER 16 H SER 16 3.290 -6.526 -6.032
94 HA SER 16 HA SER 16 2.026 -4.828 -4.106
95 HB2 SER 16 1HB SER 16 4.101 -5.346 -2.751
96 HB3 SER 16 2HB SER 16 3.184 -6.756 -3.240
97 HG SER 16 HG SER 16 5.127 -6.012 -5.114
98 H ASN 17 H ASN 17 4.670 -4.742 -6.508
99 HA ASN 17 HA ASN 17 5.909 -2.450 -5.548
100 HB2 ASN 17 1HB ASN 17 6.210 -4.252 -7.736
101 HB3 ASN 17 2HB ASN 17 6.003 -2.678 -8.477
102 HD21 ASN 17 1HD2 ASN 17 7.585 -1.210 -8.416
103 HD22 ASN 17 2HD2 ASN 17 9.123 -1.412 -7.644
104 H THR 18 H THR 18 3.499 -3.025 -8.224
105 HA THR 18 HA THR 18 3.152 -0.267 -8.790
106 HB THR 18 HB THR 18 2.663 -2.591 -10.111
107 HG1 THR 18 1HG THR 18 1.809 -1.069 -11.544
108 HG21 THR 18 3HG2 THR 18 0.603 -2.850 -8.407
109 HG22 THR 18 1HG2 THR 18 -0.143 -1.646 -9.486
110 HG23 THR 18 2HG2 THR 18 0.394 -3.214 -10.136
111 H ALA 19 H ALA 19 1.639 -2.554 -6.522
112 HA ALA 19 HA ALA 19 -0.647 -1.040 -5.985
113 HB1 ALA 19 3HB ALA 19 -0.411 -2.356 -3.726
114 HB2 ALA 19 1HB ALA 19 -0.691 -3.255 -5.236
115 HB3 ALA 19 2HB ALA 19 0.947 -3.162 -4.547
116 H TRP 20 H TRP 20 2.504 -1.256 -4.175
117 HA TRP 20 HA TRP 20 1.924 0.739 -2.349
118 HB2 TRP 20 1HB TRP 20 3.743 -0.767 -2.006
119 HB3 TRP 20 2HB TRP 20 4.539 -0.255 -3.482
120 HD1 TRP 20 HD TRP 20 5.124 2.652 -3.349
121 HE1 TRP 20 1HE TRP 20 6.340 3.971 -1.414
122 HE3 TRP 20 3HE TRP 20 4.209 -0.788 0.283
123 HZ2 TRP 20 2HZ TRP 20 6.773 3.440 1.356
124 HZ3 TRP 20 3HZ TRP 20 5.063 -0.310 2.576
125 HH2 TRP 20 HH TRP 20 6.306 1.718 3.139
126 H THR 21 H THR 21 3.644 0.888 -5.548
127 HA THR 21 HA THR 21 4.126 3.619 -5.549
128 HB THR 21 HB THR 21 3.988 1.355 -7.500
129 HG1 THR 21 1HG THR 21 6.122 2.143 -7.689
130 HG21 THR 21 3HG2 THR 21 3.476 4.239 -8.253
131 HG22 THR 21 1HG2 THR 21 4.614 3.303 -9.250
132 HG23 THR 21 2HG2 THR 21 2.932 2.752 -9.066
133 H THR 22 H THR 22 1.371 1.895 -7.173
134 HA THR 22 HA THR 22 0.027 4.205 -7.912
135 HB THR 22 HB THR 22 -1.006 1.409 -7.198
136 HG1 THR 22 1HG THR 22 0.579 1.393 -8.882
137 HG21 THR 22 3HG2 THR 22 -2.175 3.707 -8.846
138 HG22 THR 22 1HG2 THR 22 -2.706 2.018 -9.028
139 HG23 THR 22 2HG2 THR 22 -2.942 2.863 -7.479
140 H CYS 23 H CYS 23 0.554 2.891 -4.749
141 HA CYS 23 HA CYS 23 -1.795 4.173 -3.672
142 HB2 CYS 23 1HB CYS 23 0.158 2.195 -2.765
143 HB3 CYS 23 2HB CYS 23 -0.212 3.390 -1.538
144 H THR 24 H THR 24 1.779 4.542 -3.874
145 HA THR 24 HA THR 24 1.722 6.930 -2.236
146 HB THR 24 HB THR 24 4.224 6.830 -2.808
147 HG1 THR 24 1HG THR 24 3.707 5.641 -4.863
148 HG21 THR 24 3HG2 THR 24 4.691 5.007 -1.362
149 HG22 THR 24 1HG2 THR 24 3.040 5.454 -0.872
150 HG23 THR 24 2HG2 THR 24 3.301 4.065 -1.952
151 H THR 25 H THR 25 -0.021 7.721 -3.917
152 HA THR 25 HA THR 25 1.397 9.632 -5.557
153 HB THR 25 HB THR 25 -0.104 8.910 -7.560
154 HG1 THR 25 1HG THR 25 -0.765 6.637 -7.293
155 HG21 THR 25 3HG2 THR 25 2.375 8.358 -7.451
156 HG22 THR 25 1HG2 THR 25 1.953 6.855 -6.596
157 HG23 THR 25 2HG2 THR 25 1.414 7.106 -8.274
158 HA PRO 26 HA PRO 26 -1.965 12.035 -4.410
159 HB2 PRO 26 1HB PRO 26 -1.966 13.976 -6.334
160 HB3 PRO 26 2HB PRO 26 -0.866 13.979 -4.970
161 HG2 PRO 26 1HG PRO 26 -0.315 13.301 -7.794
162 HG3 PRO 26 2HG PRO 26 0.818 13.720 -6.525
163 HD2 PRO 26 1HD PRO 26 0.285 11.095 -7.552
164 HD3 PRO 26 2HD PRO 26 1.331 11.502 -6.205
165 H GLY 27 H GLY 27 -4.013 11.390 -4.324
166 HA2 GLY 27 1HA GLY 27 -5.547 11.560 -6.770
167 HA3 GLY 27 2HA GLY 27 -5.303 9.926 -6.184
168 H GLN 28 H GLN 28 -7.175 9.273 -5.202
169 HA GLN 28 HA GLN 28 -8.402 11.207 -3.397
170 HB2 GLN 28 1HB GLN 28 -9.583 8.975 -5.083
171 HB3 GLN 28 2HB GLN 28 -10.462 9.633 -3.717
172 HG2 GLN 28 1HG GLN 28 -9.527 11.906 -5.132
173 HG3 GLN 28 2HG GLN 28 -10.046 10.788 -6.378
174 HE21 GLN 28 1HE2 GLN 28 -10.985 13.135 -4.217
175 HE22 GLN 28 2HE2 GLN 28 -12.700 12.892 -4.203
176 H THR 29 H THR 29 -7.047 7.956 -3.810
177 HA THR 29 HA THR 29 -7.371 7.550 -0.913
178 HB THR 29 HB THR 29 -7.638 5.077 -1.534
179 HG1 THR 29 1HG THR 29 -7.962 4.714 -3.793
180 HG21 THR 29 3HG2 THR 29 -9.832 6.370 -3.082
181 HG22 THR 29 1HG2 THR 29 -9.931 5.292 -1.668
182 HG23 THR 29 2HG2 THR 29 -9.611 7.028 -1.443
183 H CYS 30 H CYS 30 -5.197 8.868 -1.490
184 HA CYS 30 HA CYS 30 -3.081 7.269 -2.450
185 HB2 CYS 30 1HB CYS 30 -2.928 9.641 -2.642
186 HB3 CYS 30 2HB CYS 30 -3.165 9.870 -0.921
187 H TYR 31 H TYR 31 -4.476 8.097 0.764
188 HA TYR 31 HA TYR 31 -2.543 6.267 2.005
189 HB2 TYR 31 1HB TYR 31 -2.508 8.423 3.080
190 HB3 TYR 31 2HB TYR 31 -4.213 8.696 2.781
191 HD1 TYR 31 1HD TYR 31 -1.895 6.580 4.817
192 HD2 TYR 31 2HD TYR 31 -5.784 8.332 4.486
193 HE1 TYR 31 1HE TYR 31 -2.437 5.843 7.189
194 HE2 TYR 31 2HE TYR 31 -6.312 7.589 6.859
195 HH TYR 31 HH TYR 31 -5.630 6.516 8.600
196 H THR 32 H THR 32 -5.920 6.786 1.170
197 HA THR 32 HA THR 32 -7.054 5.100 3.134
198 HB THR 32 HB THR 32 -7.925 6.145 0.397
199 HG1 THR 32 1HG THR 32 -7.621 7.482 2.447
200 HG21 THR 32 3HG2 THR 32 -10.229 5.540 1.825
201 HG22 THR 32 1HG2 THR 32 -9.585 4.545 0.497
202 HG23 THR 32 2HG2 THR 32 -9.201 4.131 2.185
203 H CYS 33 H CYS 33 -5.386 4.502 0.073
204 HA CYS 33 HA CYS 33 -6.337 1.781 0.011
205 HB2 CYS 33 1HB CYS 33 -5.210 1.571 -2.052
206 HB3 CYS 33 2HB CYS 33 -6.008 3.131 -2.055
207 H CYS 34 H CYS 34 -3.786 3.713 1.392
208 HA CYS 34 HA CYS 34 -1.736 1.811 1.411
209 HB2 CYS 34 1HB CYS 34 -2.324 4.225 3.117
210 HB3 CYS 34 2HB CYS 34 -0.926 3.207 3.404
211 H SER 35 H SER 35 -4.821 1.888 2.888
212 HA SER 35 HA SER 35 -3.883 0.092 4.987
213 HB2 SER 35 1HB SER 35 -5.853 0.735 6.292
214 HB3 SER 35 2HB SER 35 -4.957 2.171 5.837
215 HG SER 35 HG SER 35 -6.913 2.812 5.179
216 H SER 36 H SER 36 -5.117 0.081 1.939
217 HA SER 36 HA SER 36 -6.975 -2.087 2.529
218 HB2 SER 36 1HB SER 36 -7.416 0.176 1.015
219 HB3 SER 36 2HB SER 36 -6.920 -0.959 -0.225
220 HG SER 36 HG SER 36 -9.125 -1.196 1.624
221 H CYS 37 H CYS 37 -4.226 -0.975 0.476
222 HA CYS 37 HA CYS 37 -3.949 -3.665 -0.580
223 HB2 CYS 37 1HB CYS 37 -2.696 -1.017 -1.283
224 HB3 CYS 37 2HB CYS 37 -2.051 -2.529 -1.888
225 H PHE 38 H PHE 38 -3.513 -2.928 2.316
226 HA PHE 38 HA PHE 38 -0.937 -4.165 2.565
227 HB2 PHE 38 1HB PHE 38 -1.605 -1.314 3.499
228 HB3 PHE 38 2HB PHE 38 -0.262 -2.215 4.175
229 HD1 PHE 38 1HD PHE 38 0.866 -3.518 1.787
230 HD2 PHE 38 2HD PHE 38 -0.639 0.417 2.294
231 HE1 PHE 38 1HE PHE 38 2.343 -2.713 -0.076
232 HE2 PHE 38 2HE PHE 38 0.837 1.222 0.431
233 HZ PHE 38 HZ PHE 38 2.311 -0.353 -0.732
234 H ASP 39 H ASP 39 -0.418 -4.506 4.998
235 HA ASP 39 HA ASP 39 -2.970 -5.013 6.303
236 HB2 ASP 39 1HB ASP 39 -1.695 -7.049 5.908
237 HB3 ASP 39 2HB ASP 39 -0.230 -6.326 6.543
238 H VAL 40 H VAL 40 0.021 -5.392 8.107
239 HA VAL 40 HA VAL 40 -0.682 -3.066 9.716
240 HB VAL 40 HB VAL 40 -0.386 -5.372 10.675
241 HG11 VAL 40 1HG1 VAL 40 2.567 -4.847 10.206
242 HG12 VAL 40 2HG1 VAL 40 1.837 -6.259 11.006
243 HG13 VAL 40 3HG1 VAL 40 1.581 -5.991 9.264
244 HG21 VAL 40 3HG2 VAL 40 1.286 -3.053 11.678
245 HG22 VAL 40 1HG2 VAL 40 -0.356 -3.527 12.176
246 HG23 VAL 40 2HG2 VAL 40 1.035 -4.549 12.611
247 H VAL 41 H VAL 41 2.160 -4.584 8.048
248 HA VAL 41 HA VAL 41 3.828 -2.347 8.530
249 HB VAL 41 HB VAL 41 4.109 -4.477 6.407
250 HG11 VAL 41 1HG1 VAL 41 5.743 -2.778 6.103
251 HG12 VAL 41 2HG1 VAL 41 6.063 -2.668 7.851
252 HG13 VAL 41 3HG1 VAL 41 6.568 -4.113 6.943
253 HG21 VAL 41 3HG2 VAL 41 3.867 -5.874 8.203
254 HG22 VAL 41 1HG2 VAL 41 5.594 -5.483 8.383
255 HG23 VAL 41 2HG2 VAL 41 4.382 -4.641 9.378
256 H GLY 42 H GLY 42 2.625 -3.635 5.350
257 HA2 GLY 42 1HA GLY 42 3.139 -1.633 3.690
258 HA3 GLY 42 2HA GLY 42 1.618 -2.503 3.645
259 H GLU 43 H GLU 43 0.728 -1.523 6.339
260 HA GLU 43 HA GLU 43 -0.468 0.853 5.399
261 HB2 GLU 43 1HB GLU 43 -1.149 -1.080 7.238
262 HB3 GLU 43 2HB GLU 43 -0.658 0.221 8.303
263 HG2 GLU 43 1HG GLU 43 -2.391 1.622 7.636
264 HG3 GLU 43 2HG GLU 43 -2.425 0.990 6.002
265 H GLN 44 H GLN 44 1.594 0.171 8.328
266 HA GLN 44 HA GLN 44 2.045 2.898 8.772
267 HB2 GLN 44 1HB GLN 44 3.340 2.203 10.613
268 HB3 GLN 44 2HB GLN 44 2.198 0.887 10.419
269 HG2 GLN 44 1HG GLN 44 3.881 -0.422 9.144
270 HG3 GLN 44 2HG GLN 44 5.019 0.907 9.245
271 HE21 GLN 44 1HE2 GLN 44 6.591 0.131 10.470
272 HE22 GLN 44 2HE2 GLN 44 6.430 -0.487 12.080
273 H ALA 45 H ALA 45 3.338 0.649 6.499
274 HA ALA 45 HA ALA 45 5.911 1.950 6.304
275 HB1 ALA 45 3HB ALA 45 5.667 -0.493 6.000
276 HB2 ALA 45 1HB ALA 45 4.584 -0.211 4.617
277 HB3 ALA 45 2HB ALA 45 6.290 0.286 4.526
278 H CYS 46 H CYS 46 2.794 1.720 4.500
279 HA CYS 46 HA CYS 46 3.725 3.387 2.401
280 HB2 CYS 46 1HB CYS 46 1.978 1.712 2.061
281 HB3 CYS 46 2HB CYS 46 0.922 2.553 3.178
282 H GLN 47 H GLN 47 2.050 3.757 5.537
283 HA GLN 47 HA GLN 47 0.997 6.252 5.209
284 HB2 GLN 47 1HB GLN 47 1.860 4.560 7.497
285 HB3 GLN 47 2HB GLN 47 1.787 6.274 7.854
286 HG2 GLN 47 1HG GLN 47 -0.384 5.020 8.270
287 HG3 GLN 47 2HG GLN 47 -0.542 6.412 7.218
288 HE21 GLN 47 1HE2 GLN 47 -1.318 3.242 7.632
289 HE22 GLN 47 2HE2 GLN 47 -1.692 2.771 6.008
290 H MET 48 H MET 48 4.361 5.244 5.939
291 HA MET 48 HA MET 48 5.206 7.894 6.472
292 HB2 MET 48 1HB MET 48 6.717 5.304 5.819
293 HB3 MET 48 2HB MET 48 7.511 6.779 6.336
294 HG2 MET 48 1HG MET 48 5.262 5.907 8.093
295 HG3 MET 48 2HG MET 48 6.620 4.800 8.049
296 HE1 MET 48 3HE MET 48 9.284 6.577 7.768
297 HE2 MET 48 1HE MET 48 9.536 6.621 9.530
298 HE3 MET 48 2HE MET 48 8.848 5.169 8.766
299 H SER 49 H SER 49 4.713 5.935 3.606
300 HA SER 49 HA SER 49 6.495 7.569 2.049
301 HB2 SER 49 1HB SER 49 5.402 4.931 1.833
302 HB3 SER 49 2HB SER 49 4.818 5.831 0.447
303 HG SER 49 HG SER 49 7.599 5.749 1.252
304 H ALA 50 H ALA 50 3.079 7.253 2.892
305 HA ALA 50 HA ALA 50 1.778 8.349 0.783
306 HB1 ALA 50 3HB ALA 50 0.044 8.667 2.275
307 HB2 ALA 50 1HB ALA 50 1.072 7.584 3.244
308 HB3 ALA 50 2HB ALA 50 1.106 9.339 3.535
309 H GLN 51 H GLN 51 2.640 9.979 -0.456
310 HA GLN 51 HA GLN 51 3.332 12.403 1.016
311 HB2 GLN 51 1HB GLN 51 5.275 11.287 -0.123
312 HB3 GLN 51 2HB GLN 51 4.457 11.468 -1.662
313 HG2 GLN 51 1HG GLN 51 4.312 14.028 -0.989
314 HG3 GLN 51 2HG GLN 51 5.594 13.627 0.136
315 HE21 GLN 51 1HE2 GLN 51 7.295 14.591 -0.753
316 HE22 GLN 51 2HE2 GLN 51 7.944 14.268 -2.327
317 H CYS 52 H CYS 52 0.703 12.196 0.601
318 HA CYS 52 HA CYS 52 0.275 13.982 -1.664
319 HB2 CYS 52 1HB CYS 52 -1.858 11.987 -1.100
320 HB3 CYS 52 2HB CYS 52 -1.440 12.803 -2.594
Start of MODEL 16
1 H1 ASN 1 1H ASN 1 10.103 -5.570 2.643
2 HA ASN 1 HA ASN 1 9.910 -3.942 0.398
3 HB2 ASN 1 1HB ASN 1 10.830 -6.673 -0.104
4 HB3 ASN 1 2HB ASN 1 9.249 -6.449 -0.825
5 HD21 ASN 1 1HD2 ASN 1 10.924 -6.880 -2.647
6 HD22 ASN 1 2HD2 ASN 1 11.520 -5.478 -3.470
7 HA PRO 2 HA PRO 2 5.696 -4.883 1.208
8 HB2 PRO 2 1HB PRO 2 4.424 -4.843 -1.210
9 HB3 PRO 2 2HB PRO 2 4.886 -3.390 -0.347
10 HG2 PRO 2 1HG PRO 2 6.142 -4.610 -2.729
11 HG3 PRO 2 2HG PRO 2 6.308 -2.976 -2.116
12 HD2 PRO 2 1HD PRO 2 8.213 -5.106 -1.862
13 HD3 PRO 2 2HD PRO 2 8.326 -3.509 -1.151
14 H GLU 3 H GLU 3 7.575 -7.139 -0.151
15 HA GLU 3 HA GLU 3 5.749 -9.021 -0.998
16 HB2 GLU 3 1HB GLU 3 7.617 -10.667 -0.506
17 HB3 GLU 3 2HB GLU 3 8.082 -9.307 -1.509
18 HG2 GLU 3 1HG GLU 3 9.170 -8.185 0.338
19 HG3 GLU 3 2HG GLU 3 8.449 -9.266 1.515
20 H ASP 4 H ASP 4 6.980 -8.191 2.268
21 HA ASP 4 HA ASP 4 5.732 -10.440 3.457
22 HB2 ASP 4 1HB ASP 4 6.488 -7.954 5.000
23 HB3 ASP 4 2HB ASP 4 6.627 -9.630 5.490
24 H TRP 5 H TRP 5 4.998 -7.013 2.766
25 HA TRP 5 HA TRP 5 2.505 -7.220 4.291
26 HB2 TRP 5 1HB TRP 5 3.123 -4.634 3.095
27 HB3 TRP 5 2HB TRP 5 2.669 -5.046 4.737
28 HD1 TRP 5 HD TRP 5 5.038 -6.496 5.972
29 HE1 TRP 5 1HE TRP 5 7.492 -5.553 6.196
30 HE3 TRP 5 3HE TRP 5 4.622 -3.068 2.240
31 HZ2 TRP 5 2HZ TRP 5 8.951 -3.524 4.818
32 HZ3 TRP 5 3HZ TRP 5 6.608 -1.646 1.743
33 HH2 TRP 5 HH TRP 5 8.718 -1.832 2.963
34 H PHE 6 H PHE 6 1.288 -5.064 2.618
35 HA PHE 6 HA PHE 6 -0.049 -4.891 0.875
36 HB2 PHE 6 1HB PHE 6 2.002 -4.719 -0.443
37 HB3 PHE 6 2HB PHE 6 2.343 -6.428 -0.262
38 HD1 PHE 6 2HD PHE 6 -0.511 -4.377 -1.550
39 HD2 PHE 6 1HD PHE 6 2.124 -7.639 -2.198
40 HE1 PHE 6 2HE PHE 6 -1.617 -4.832 -3.756
41 HE2 PHE 6 1HE PHE 6 1.018 -8.094 -4.405
42 HZ PHE 6 HZ PHE 6 -0.839 -6.685 -5.158
43 H THR 7 H THR 7 -1.998 -5.884 0.714
44 HA THR 7 HA THR 7 -1.982 -8.826 0.552
45 HB THR 7 HB THR 7 -4.299 -8.528 1.636
46 HG1 THR 7 1HG THR 7 -4.860 -6.391 1.720
47 HG21 THR 7 3HG2 THR 7 -2.454 -7.111 3.509
48 HG22 THR 7 1HG2 THR 7 -3.384 -8.609 3.757
49 HG23 THR 7 2HG2 THR 7 -1.834 -8.658 2.883
50 HA PRO 8 HA PRO 8 -3.607 -7.686 -3.395
51 HB2 PRO 8 1HB PRO 8 -2.652 -9.860 -4.749
52 HB3 PRO 8 2HB PRO 8 -1.759 -8.361 -4.593
53 HG2 PRO 8 1HG PRO 8 -1.324 -10.931 -3.199
54 HG3 PRO 8 2HG PRO 8 -0.221 -9.582 -3.383
55 HD2 PRO 8 1HD PRO 8 -1.716 -10.267 -1.033
56 HD3 PRO 8 2HD PRO 8 -0.703 -8.854 -1.257
57 H ASP 9 H ASP 9 -4.172 -10.194 -1.255
58 HA ASP 9 HA ASP 9 -6.042 -11.559 -2.859
59 HB2 ASP 9 1HB ASP 9 -4.789 -11.922 -0.349
60 HB3 ASP 9 2HB ASP 9 -6.489 -11.754 0.042
61 H THR 10 H THR 10 -6.016 -8.491 -1.413
62 HA THR 10 HA THR 10 -8.917 -8.312 -1.571
63 HB THR 10 HB THR 10 -8.370 -8.905 0.816
64 HG1 THR 10 1HG THR 10 -10.093 -7.346 0.136
65 HG21 THR 10 3HG2 THR 10 -7.350 -6.283 1.557
66 HG22 THR 10 1HG2 THR 10 -6.661 -7.881 1.933
67 HG23 THR 10 2HG2 THR 10 -6.214 -7.052 0.423
68 H CYS 11 H CYS 11 -6.944 -7.464 -3.415
69 HA CYS 11 HA CYS 11 -7.516 -4.638 -3.302
70 HB2 CYS 11 1HB CYS 11 -5.096 -5.402 -2.328
71 HB3 CYS 11 2HB CYS 11 -4.706 -5.198 -4.024
72 H ALA 12 H ALA 12 -6.952 -3.634 -5.519
73 HA ALA 12 HA ALA 12 -7.500 -5.648 -7.561
74 HB1 ALA 12 3HB ALA 12 -7.736 -3.202 -8.778
75 HB2 ALA 12 1HB ALA 12 -9.070 -4.054 -7.964
76 HB3 ALA 12 2HB ALA 12 -8.157 -2.795 -7.097
77 H TYR 13 H TYR 13 -4.961 -6.000 -6.747
78 HA TYR 13 HA TYR 13 -3.463 -4.951 -9.009
79 HB2 TYR 13 1HB TYR 13 -2.529 -4.886 -6.075
80 HB3 TYR 13 2HB TYR 13 -1.650 -4.231 -7.442
81 HD1 TYR 13 1HD TYR 13 -4.833 -3.814 -5.523
82 HD2 TYR 13 2HD TYR 13 -1.906 -1.976 -8.045
83 HE1 TYR 13 1HE TYR 13 -5.921 -1.547 -5.146
84 HE2 TYR 13 2HE TYR 13 -3.004 0.285 -7.659
85 HH TYR 13 HH TYR 13 -5.941 0.547 -5.677
86 H GLY 14 H GLY 14 -1.818 -6.347 -9.717
87 HA2 GLY 14 1HA GLY 14 -1.904 -9.014 -8.494
88 HA3 GLY 14 2HA GLY 14 -1.350 -8.604 -10.106
89 H ASP 15 H ASP 15 0.225 -6.213 -9.110
90 HA ASP 15 HA ASP 15 2.459 -7.782 -8.123
91 HB2 ASP 15 1HB ASP 15 2.402 -4.995 -9.373
92 HB3 ASP 15 2HB ASP 15 3.853 -5.874 -8.934
93 H SER 16 H SER 16 3.811 -6.807 -6.367
94 HA SER 16 HA SER 16 2.154 -5.337 -4.544
95 HB2 SER 16 1HB SER 16 3.999 -5.781 -2.922
96 HB3 SER 16 2HB SER 16 3.405 -7.246 -3.677
97 HG SER 16 HG SER 16 5.268 -7.498 -4.802
98 H ASN 17 H ASN 17 5.115 -4.941 -6.524
99 HA ASN 17 HA ASN 17 5.989 -2.592 -5.349
100 HB2 ASN 17 1HB ASN 17 7.418 -3.901 -6.871
101 HB3 ASN 17 2HB ASN 17 6.293 -3.676 -8.196
102 HD21 ASN 17 1HD2 ASN 17 6.419 -1.936 -9.454
103 HD22 ASN 17 2HD2 ASN 17 7.504 -0.603 -9.242
104 H THR 18 H THR 18 3.709 -3.349 -8.045
105 HA THR 18 HA THR 18 3.335 -0.632 -8.820
106 HB THR 18 HB THR 18 2.980 -2.959 -10.082
107 HG1 THR 18 1HG THR 18 2.584 -0.933 -11.095
108 HG21 THR 18 3HG2 THR 18 0.131 -2.324 -9.203
109 HG22 THR 18 1HG2 THR 18 0.714 -3.741 -10.108
110 HG23 THR 18 2HG2 THR 18 1.088 -3.577 -8.375
111 H ALA 19 H ALA 19 1.631 -2.912 -6.626
112 HA ALA 19 HA ALA 19 -0.615 -1.361 -6.177
113 HB1 ALA 19 3HB ALA 19 0.894 -3.236 -4.310
114 HB2 ALA 19 1HB ALA 19 -0.778 -2.674 -4.074
115 HB3 ALA 19 2HB ALA 19 -0.373 -3.700 -5.472
116 H TRP 20 H TRP 20 2.465 -1.516 -4.245
117 HA TRP 20 HA TRP 20 1.822 0.501 -2.476
118 HB2 TRP 20 1HB TRP 20 3.661 -0.954 -2.066
119 HB3 TRP 20 2HB TRP 20 4.471 -0.470 -3.543
120 HD1 TRP 20 HD TRP 20 4.909 2.499 -3.453
121 HE1 TRP 20 1HE TRP 20 6.115 3.868 -1.547
122 HE3 TRP 20 3HE TRP 20 4.236 -0.980 0.193
123 HZ2 TRP 20 2HZ TRP 20 6.641 3.354 1.211
124 HZ3 TRP 20 3HZ TRP 20 5.126 -0.468 2.465
125 HH2 TRP 20 HH TRP 20 6.294 1.611 3.001
126 H THR 21 H THR 21 3.549 0.626 -5.669
127 HA THR 21 HA THR 21 4.018 3.359 -5.706
128 HB THR 21 HB THR 21 3.901 1.066 -7.615
129 HG1 THR 21 1HG THR 21 6.011 1.697 -7.413
130 HG21 THR 21 3HG2 THR 21 3.309 3.918 -8.428
131 HG22 THR 21 1HG2 THR 21 4.454 2.984 -9.420
132 HG23 THR 21 2HG2 THR 21 2.788 2.399 -9.198
133 H THR 22 H THR 22 1.196 1.550 -7.093
134 HA THR 22 HA THR 22 -0.147 3.886 -7.898
135 HB THR 22 HB THR 22 -1.234 1.110 -7.188
136 HG1 THR 22 1HG THR 22 -0.779 0.927 -9.589
137 HG21 THR 22 3HG2 THR 22 -2.810 1.660 -9.101
138 HG22 THR 22 1HG2 THR 22 -3.060 2.695 -7.674
139 HG23 THR 22 2HG2 THR 22 -2.176 3.323 -9.085
140 H CYS 23 H CYS 23 0.421 2.533 -4.760
141 HA CYS 23 HA CYS 23 -1.956 3.665 -3.624
142 HB2 CYS 23 1HB CYS 23 0.098 1.814 -2.813
143 HB3 CYS 23 2HB CYS 23 -0.088 3.060 -1.595
144 H THR 24 H THR 24 1.562 4.372 -3.936
145 HA THR 24 HA THR 24 1.304 6.788 -2.356
146 HB THR 24 HB THR 24 3.811 6.896 -3.066
147 HG1 THR 24 1HG THR 24 4.485 4.887 -4.072
148 HG21 THR 24 3HG2 THR 24 4.410 4.786 -1.717
149 HG22 THR 24 1HG2 THR 24 3.358 5.947 -0.871
150 HG23 THR 24 2HG2 THR 24 2.662 4.475 -1.591
151 H THR 25 H THR 25 -0.538 7.281 -4.100
152 HA THR 25 HA THR 25 0.767 9.114 -5.984
153 HB THR 25 HB THR 25 -1.031 8.406 -7.655
154 HG1 THR 25 1HG THR 25 -2.303 6.632 -6.992
155 HG21 THR 25 3HG2 THR 25 -0.085 5.877 -7.768
156 HG22 THR 25 1HG2 THR 25 0.922 7.259 -8.261
157 HG23 THR 25 2HG2 THR 25 1.121 6.545 -6.642
158 HA PRO 26 HA PRO 26 -2.097 11.949 -4.517
159 HB2 PRO 26 1HB PRO 26 -2.377 13.659 -6.630
160 HB3 PRO 26 2HB PRO 26 -1.009 13.703 -5.537
161 HG2 PRO 26 1HG PRO 26 -1.138 12.670 -8.304
162 HG3 PRO 26 2HG PRO 26 0.272 13.112 -7.362
163 HD2 PRO 26 1HD PRO 26 -0.661 10.456 -7.912
164 HD3 PRO 26 2HD PRO 26 0.680 10.903 -6.876
165 H GLY 27 H GLY 27 -4.191 11.902 -3.992
166 HA2 GLY 27 1HA GLY 27 -6.190 11.903 -5.989
167 HA3 GLY 27 2HA GLY 27 -5.943 10.268 -5.411
168 H GLN 28 H GLN 28 -8.145 10.354 -4.516
169 HA GLN 28 HA GLN 28 -8.410 12.152 -2.260
170 HB2 GLN 28 1HB GLN 28 -10.800 11.560 -2.317
171 HB3 GLN 28 2HB GLN 28 -10.263 12.087 -3.900
172 HG2 GLN 28 1HG GLN 28 -9.813 9.248 -3.753
173 HG3 GLN 28 2HG GLN 28 -11.431 9.547 -3.148
174 HE21 GLN 28 1HE2 GLN 28 -12.110 8.393 -5.043
175 HE22 GLN 28 2HE2 GLN 28 -12.282 9.207 -6.562
176 H THR 29 H THR 29 -7.493 8.935 -3.033
177 HA THR 29 HA THR 29 -7.809 8.183 -0.212
178 HB THR 29 HB THR 29 -8.416 5.868 -1.049
179 HG1 THR 29 1HG THR 29 -8.673 7.419 -3.527
180 HG21 THR 29 3HG2 THR 29 -10.183 7.842 -0.654
181 HG22 THR 29 1HG2 THR 29 -10.331 7.768 -2.427
182 HG23 THR 29 2HG2 THR 29 -10.694 6.330 -1.442
183 H CYS 30 H CYS 30 -5.530 9.411 -1.160
184 HA CYS 30 HA CYS 30 -3.670 7.622 -2.227
185 HB2 CYS 30 1HB CYS 30 -3.100 9.848 -2.456
186 HB3 CYS 30 2HB CYS 30 -3.517 10.248 -0.802
187 H TYR 31 H TYR 31 -4.016 8.918 1.166
188 HA TYR 31 HA TYR 31 -2.314 6.911 2.234
189 HB2 TYR 31 1HB TYR 31 -2.649 9.186 3.216
190 HB3 TYR 31 2HB TYR 31 -4.377 8.917 3.329
191 HD1 TYR 31 2HD TYR 31 -5.275 7.280 5.014
192 HD2 TYR 31 1HD TYR 31 -1.155 8.430 4.929
193 HE1 TYR 31 2HE TYR 31 -4.976 6.413 7.385
194 HE2 TYR 31 1HE TYR 31 -0.871 7.560 7.301
195 HH TYR 31 HH TYR 31 -3.627 6.138 9.041
196 H THR 32 H THR 32 -5.736 7.104 1.455
197 HA THR 32 HA THR 32 -6.622 5.184 3.353
198 HB THR 32 HB THR 32 -7.714 6.390 0.769
199 HG1 THR 32 1HG THR 32 -8.450 7.771 2.338
200 HG21 THR 32 3HG2 THR 32 -9.398 4.833 2.754
201 HG22 THR 32 1HG2 THR 32 -9.767 5.256 1.065
202 HG23 THR 32 2HG2 THR 32 -8.600 3.961 1.424
203 H CYS 33 H CYS 33 -5.415 5.010 -0.027
204 HA CYS 33 HA CYS 33 -6.043 2.288 -0.325
205 HB2 CYS 33 1HB CYS 33 -5.757 3.381 -2.328
206 HB3 CYS 33 2HB CYS 33 -4.348 4.269 -1.783
207 H CYS 34 H CYS 34 -3.481 4.123 1.263
208 HA CYS 34 HA CYS 34 -1.508 2.131 1.230
209 HB2 CYS 34 1HB CYS 34 -2.000 4.592 2.874
210 HB3 CYS 34 2HB CYS 34 -0.740 3.468 3.343
211 H SER 35 H SER 35 -4.600 2.269 2.651
212 HA SER 35 HA SER 35 -3.755 0.415 4.739
213 HB2 SER 35 1HB SER 35 -4.738 2.381 5.752
214 HB3 SER 35 2HB SER 35 -6.089 2.365 4.636
215 HG SER 35 HG SER 35 -6.765 1.481 6.638
216 H SER 36 H SER 36 -4.950 0.509 1.672
217 HA SER 36 HA SER 36 -6.928 -1.564 2.182
218 HB2 SER 36 1HB SER 36 -7.172 0.689 0.641
219 HB3 SER 36 2HB SER 36 -6.616 -0.448 -0.571
220 HG SER 36 HG SER 36 -8.399 -1.901 0.460
221 H CYS 37 H CYS 37 -4.037 -0.660 0.210
222 HA CYS 37 HA CYS 37 -3.864 -3.389 -0.755
223 HB2 CYS 37 1HB CYS 37 -2.932 -0.780 -1.659
224 HB3 CYS 37 2HB CYS 37 -1.654 -1.978 -1.692
225 H PHE 38 H PHE 38 -3.535 -2.674 2.137
226 HA PHE 38 HA PHE 38 -1.034 -4.019 2.526
227 HB2 PHE 38 1HB PHE 38 -1.614 -1.146 3.460
228 HB3 PHE 38 2HB PHE 38 -0.311 -2.107 4.130
229 HD1 PHE 38 1HD PHE 38 1.210 -3.227 2.155
230 HD2 PHE 38 2HD PHE 38 -0.993 0.389 1.870
231 HE1 PHE 38 1HE PHE 38 2.733 -2.444 0.319
232 HE2 PHE 38 2HE PHE 38 0.530 1.172 0.035
233 HZ PHE 38 HZ PHE 38 2.374 -0.253 -0.719
234 H ASP 39 H ASP 39 -0.639 -4.194 5.062
235 HA ASP 39 HA ASP 39 -3.280 -4.660 6.198
236 HB2 ASP 39 1HB ASP 39 -2.006 -6.726 5.925
237 HB3 ASP 39 2HB ASP 39 -0.588 -6.013 6.668
238 H VAL 40 H VAL 40 -0.455 -5.069 8.227
239 HA VAL 40 HA VAL 40 -1.168 -2.638 9.675
240 HB VAL 40 HB VAL 40 -1.153 -4.848 10.805
241 HG11 VAL 40 1HG1 VAL 40 0.791 -5.778 9.520
242 HG12 VAL 40 2HG1 VAL 40 1.863 -4.735 10.485
243 HG13 VAL 40 3HG1 VAL 40 0.903 -6.004 11.282
244 HG21 VAL 40 3HG2 VAL 40 0.227 -4.097 12.773
245 HG22 VAL 40 1HG2 VAL 40 0.797 -2.737 11.776
246 HG23 VAL 40 2HG2 VAL 40 -0.932 -2.889 12.168
247 H VAL 41 H VAL 41 1.772 -4.437 8.516
248 HA VAL 41 HA VAL 41 3.451 -2.190 8.958
249 HB VAL 41 HB VAL 41 3.858 -4.708 7.331
250 HG11 VAL 41 1HG1 VAL 41 5.827 -2.650 8.377
251 HG12 VAL 41 2HG1 VAL 41 6.287 -4.244 7.732
252 HG13 VAL 41 3HG1 VAL 41 5.484 -3.055 6.678
253 HG21 VAL 41 3HG2 VAL 41 3.672 -5.681 9.361
254 HG22 VAL 41 1HG2 VAL 41 5.312 -5.039 9.615
255 HG23 VAL 41 2HG2 VAL 41 3.901 -4.147 10.234
256 H GLY 42 H GLY 42 2.061 -3.772 5.998
257 HA2 GLY 42 1HA GLY 42 3.080 -2.176 4.046
258 HA3 GLY 42 2HA GLY 42 1.471 -2.870 4.017
259 H GLU 43 H GLU 43 0.583 -1.364 6.476
260 HA GLU 43 HA GLU 43 -0.147 1.011 5.067
261 HB2 GLU 43 1HB GLU 43 -1.660 -0.462 6.580
262 HB3 GLU 43 2HB GLU 43 -0.871 0.318 7.936
263 HG2 GLU 43 1HG GLU 43 -1.507 2.571 6.877
264 HG3 GLU 43 2HG GLU 43 -2.478 1.675 5.726
265 H GLN 44 H GLN 44 1.508 0.197 8.199
266 HA GLN 44 HA GLN 44 2.114 2.839 8.804
267 HB2 GLN 44 1HB GLN 44 3.351 1.960 10.610
268 HB3 GLN 44 2HB GLN 44 2.146 0.723 10.312
269 HG2 GLN 44 1HG GLN 44 3.915 -0.717 10.221
270 HG3 GLN 44 2HG GLN 44 4.161 -0.090 8.604
271 HE21 GLN 44 1HE2 GLN 44 6.042 0.756 8.132
272 HE22 GLN 44 2HE2 GLN 44 7.241 1.327 9.244
273 H ALA 45 H ALA 45 3.486 0.570 6.527
274 HA ALA 45 HA ALA 45 6.033 1.936 6.416
275 HB1 ALA 45 3HB ALA 45 5.097 -0.105 4.411
276 HB2 ALA 45 1HB ALA 45 6.717 0.145 5.105
277 HB3 ALA 45 2HB ALA 45 5.441 -0.624 6.078
278 H CYS 46 H CYS 46 2.964 1.638 4.561
279 HA CYS 46 HA CYS 46 3.924 3.208 2.404
280 HB2 CYS 46 1HB CYS 46 2.124 1.516 2.207
281 HB3 CYS 46 2HB CYS 46 1.079 2.532 3.181
282 H GLN 47 H GLN 47 2.420 3.748 5.571
283 HA GLN 47 HA GLN 47 1.292 6.201 5.177
284 HB2 GLN 47 1HB GLN 47 2.434 4.718 7.515
285 HB3 GLN 47 2HB GLN 47 2.184 6.438 7.739
286 HG2 GLN 47 1HG GLN 47 -0.196 5.840 6.583
287 HG3 GLN 47 2HG GLN 47 0.157 4.266 7.268
288 HE21 GLN 47 1HE2 GLN 47 -1.018 4.057 9.018
289 HE22 GLN 47 2HE2 GLN 47 -1.151 5.183 10.328
290 H MET 48 H MET 48 4.720 5.307 5.808
291 HA MET 48 HA MET 48 5.573 7.959 6.146
292 HB2 MET 48 1HB MET 48 6.885 5.273 5.573
293 HB3 MET 48 2HB MET 48 7.863 6.725 5.499
294 HG2 MET 48 1HG MET 48 6.130 6.518 7.921
295 HG3 MET 48 2HG MET 48 7.376 5.292 7.809
296 HE1 MET 48 3HE MET 48 7.725 6.676 10.145
297 HE2 MET 48 1HE MET 48 9.244 5.957 9.558
298 HE3 MET 48 2HE MET 48 9.230 7.627 10.176
299 H SER 49 H SER 49 5.241 5.761 3.335
300 HA SER 49 HA SER 49 6.664 7.519 1.620
301 HB2 SER 49 1HB SER 49 5.358 4.874 1.451
302 HB3 SER 49 2HB SER 49 5.158 5.821 -0.010
303 HG SER 49 HG SER 49 7.760 5.740 1.155
304 H ALA 50 H ALA 50 3.363 7.138 2.780
305 HA ALA 50 HA ALA 50 1.820 8.097 0.773
306 HB1 ALA 50 3HB ALA 50 1.220 7.366 3.166
307 HB2 ALA 50 1HB ALA 50 1.563 9.046 3.644
308 HB3 ALA 50 2HB ALA 50 0.269 8.701 2.471
309 H GLN 51 H GLN 51 2.518 9.674 -0.631
310 HA GLN 51 HA GLN 51 3.568 12.095 0.581
311 HB2 GLN 51 1HB GLN 51 4.833 10.855 -1.270
312 HB3 GLN 51 2HB GLN 51 3.558 11.339 -2.370
313 HG2 GLN 51 1HG GLN 51 4.007 13.771 -1.556
314 HG3 GLN 51 2HG GLN 51 5.474 13.141 -0.836
315 HE21 GLN 51 1HE2 GLN 51 3.656 13.433 -3.847
316 HE22 GLN 51 2HE2 GLN 51 5.002 13.393 -4.937
317 H CYS 52 H CYS 52 0.969 12.018 1.162
318 HA CYS 52 HA CYS 52 -0.265 13.691 -0.905
319 HB2 CYS 52 1HB CYS 52 -2.392 12.728 0.509
320 HB3 CYS 52 2HB CYS 52 -1.839 12.132 -1.043
Start of MODEL 17
1 H1 ASN 1 1H ASN 1 11.144 -4.957 2.059
2 HA ASN 1 HA ASN 1 9.926 -3.718 -0.246
3 HB2 ASN 1 1HB ASN 1 10.988 -6.459 0.442
4 HB3 ASN 1 2HB ASN 1 9.721 -6.380 -0.766
5 HD21 ASN 1 1HD2 ASN 1 11.554 -7.287 -2.030
6 HD22 ASN 1 2HD2 ASN 1 12.604 -6.192 -2.866
7 HA PRO 2 HA PRO 2 5.949 -4.682 1.352
8 HB2 PRO 2 1HB PRO 2 4.435 -4.416 -0.908
9 HB3 PRO 2 2HB PRO 2 4.951 -3.053 0.065
10 HG2 PRO 2 1HG PRO 2 5.984 -3.957 -2.553
11 HG3 PRO 2 2HG PRO 2 6.175 -2.397 -1.777
12 HD2 PRO 2 1HD PRO 2 8.142 -4.477 -1.959
13 HD3 PRO 2 2HD PRO 2 8.292 -2.966 -1.084
14 H GLU 3 H GLU 3 7.727 -6.706 -0.444
15 HA GLU 3 HA GLU 3 5.856 -8.544 -1.301
16 HB2 GLU 3 1HB GLU 3 7.710 -10.056 -1.561
17 HB3 GLU 3 2HB GLU 3 8.320 -8.448 -1.899
18 HG2 GLU 3 1HG GLU 3 9.214 -8.285 0.425
19 HG3 GLU 3 2HG GLU 3 8.577 -9.876 0.791
20 H ASP 4 H ASP 4 7.165 -7.830 1.906
21 HA ASP 4 HA ASP 4 6.216 -10.320 2.962
22 HB2 ASP 4 1HB ASP 4 7.046 -7.986 4.689
23 HB3 ASP 4 2HB ASP 4 7.305 -9.698 4.959
24 H TRP 5 H TRP 5 4.988 -7.212 2.167
25 HA TRP 5 HA TRP 5 2.745 -7.582 4.031
26 HB2 TRP 5 1HB TRP 5 3.200 -4.826 3.195
27 HB3 TRP 5 2HB TRP 5 2.839 -5.488 4.777
28 HD1 TRP 5 HD TRP 5 5.338 -7.019 5.650
29 HE1 TRP 5 1HE TRP 5 7.752 -5.991 5.928
30 HE3 TRP 5 3HE TRP 5 4.567 -3.040 2.579
31 HZ2 TRP 5 2HZ TRP 5 9.040 -3.681 4.856
32 HZ3 TRP 5 3HZ TRP 5 6.455 -1.446 2.249
33 HH2 TRP 5 HH TRP 5 8.631 -1.716 3.329
34 H PHE 6 H PHE 6 1.429 -5.213 2.696
35 HA PHE 6 HA PHE 6 0.030 -4.833 1.036
36 HB2 PHE 6 1HB PHE 6 1.920 -4.497 -0.417
37 HB3 PHE 6 2HB PHE 6 2.415 -6.174 -0.304
38 HD1 PHE 6 1HD PHE 6 -0.479 -4.166 -1.554
39 HD2 PHE 6 2HD PHE 6 2.057 -7.518 -2.140
40 HE1 PHE 6 1HE PHE 6 -1.623 -4.651 -3.735
41 HE2 PHE 6 2HE PHE 6 0.913 -8.002 -4.321
42 HZ PHE 6 HZ PHE 6 -0.914 -6.563 -5.093
43 H THR 7 H THR 7 -1.924 -5.740 0.542
44 HA THR 7 HA THR 7 -1.986 -8.681 0.381
45 HB THR 7 HB THR 7 -4.395 -8.297 1.190
46 HG1 THR 7 1HG THR 7 -4.565 -6.046 2.125
47 HG21 THR 7 3HG2 THR 7 -3.734 -8.339 3.406
48 HG22 THR 7 1HG2 THR 7 -2.097 -8.450 2.718
49 HG23 THR 7 2HG2 THR 7 -2.742 -6.871 3.229
50 HA PRO 8 HA PRO 8 -3.106 -7.654 -3.746
51 HB2 PRO 8 1HB PRO 8 -2.292 -10.009 -4.868
52 HB3 PRO 8 2HB PRO 8 -1.240 -8.620 -4.686
53 HG2 PRO 8 1HG PRO 8 -1.285 -11.128 -3.122
54 HG3 PRO 8 2HG PRO 8 -0.007 -9.935 -3.247
55 HD2 PRO 8 1HD PRO 8 -1.822 -10.282 -1.053
56 HD3 PRO 8 2HD PRO 8 -0.622 -9.018 -1.230
57 H ASP 9 H ASP 9 -4.422 -9.531 -1.465
58 HA ASP 9 HA ASP 9 -6.252 -10.823 -3.275
59 HB2 ASP 9 1HB ASP 9 -5.962 -10.845 -0.236
60 HB3 ASP 9 2HB ASP 9 -7.224 -11.720 -1.080
61 H THR 10 H THR 10 -5.852 -7.866 -1.561
62 HA THR 10 HA THR 10 -8.649 -7.183 -2.007
63 HB THR 10 HB THR 10 -8.604 -7.987 0.330
64 HG1 THR 10 1HG THR 10 -9.506 -6.022 1.055
65 HG21 THR 10 3HG2 THR 10 -6.866 -7.577 1.759
66 HG22 THR 10 1HG2 THR 10 -5.973 -6.905 0.373
67 HG23 THR 10 2HG2 THR 10 -6.940 -5.832 1.414
68 H CYS 11 H CYS 11 -6.490 -6.516 -3.624
69 HA CYS 11 HA CYS 11 -6.341 -3.661 -3.028
70 HB2 CYS 11 1HB CYS 11 -4.197 -4.752 -2.400
71 HB3 CYS 11 2HB CYS 11 -4.018 -5.306 -4.053
72 H ALA 12 H ALA 12 -5.685 -2.451 -5.163
73 HA ALA 12 HA ALA 12 -7.511 -3.188 -7.156
74 HB1 ALA 12 3HB ALA 12 -5.915 -1.402 -8.404
75 HB2 ALA 12 1HB ALA 12 -7.121 -0.929 -7.183
76 HB3 ALA 12 2HB ALA 12 -5.411 -1.110 -6.722
77 H TYR 13 H TYR 13 -4.029 -3.809 -6.643
78 HA TYR 13 HA TYR 13 -4.076 -5.418 -9.107
79 HB2 TYR 13 1HB TYR 13 -1.784 -3.951 -7.657
80 HB3 TYR 13 2HB TYR 13 -1.610 -4.828 -9.165
81 HD1 TYR 13 1HD TYR 13 -3.315 -3.995 -11.090
82 HD2 TYR 13 2HD TYR 13 -1.973 -1.643 -7.778
83 HE1 TYR 13 1HE TYR 13 -3.836 -1.868 -12.381
84 HE2 TYR 13 2HE TYR 13 -2.498 0.476 -9.080
85 HH TYR 13 HH TYR 13 -2.818 1.237 -11.222
86 H GLY 14 H GLY 14 -2.160 -7.118 -8.999
87 HA2 GLY 14 1HA GLY 14 -2.501 -8.524 -6.438
88 HA3 GLY 14 2HA GLY 14 -2.080 -9.239 -7.981
89 H ASP 15 H ASP 15 -0.308 -6.448 -8.005
90 HA ASP 15 HA ASP 15 1.990 -7.876 -6.974
91 HB2 ASP 15 1HB ASP 15 2.169 -5.211 -8.383
92 HB3 ASP 15 2HB ASP 15 3.308 -6.543 -8.406
93 H SER 16 H SER 16 3.443 -6.805 -5.429
94 HA SER 16 HA SER 16 2.043 -4.990 -3.732
95 HB2 SER 16 1HB SER 16 4.898 -5.521 -3.141
96 HB3 SER 16 2HB SER 16 3.493 -5.695 -2.109
97 HG SER 16 HG SER 16 4.862 -7.645 -3.340
98 H ASN 17 H ASN 17 4.541 -4.909 -6.232
99 HA ASN 17 HA ASN 17 5.678 -2.469 -5.455
100 HB2 ASN 17 1HB ASN 17 6.805 -4.095 -6.986
101 HB3 ASN 17 2HB ASN 17 5.560 -3.841 -8.193
102 HD21 ASN 17 1HD2 ASN 17 8.301 -3.456 -8.608
103 HD22 ASN 17 2HD2 ASN 17 8.610 -1.785 -8.943
104 H THR 18 H THR 18 3.603 -3.349 -8.332
105 HA THR 18 HA THR 18 2.976 -0.749 -9.069
106 HB THR 18 HB THR 18 2.628 -3.191 -10.154
107 HG1 THR 18 1HG THR 18 2.143 -1.512 -11.532
108 HG21 THR 18 3HG2 THR 18 0.761 -3.785 -8.519
109 HG22 THR 18 1HG2 THR 18 -0.165 -2.411 -9.170
110 HG23 THR 18 2HG2 THR 18 0.248 -3.786 -10.223
111 H ALA 19 H ALA 19 1.521 -2.867 -6.591
112 HA ALA 19 HA ALA 19 -0.786 -1.304 -6.213
113 HB1 ALA 19 3HB ALA 19 -0.740 -3.571 -5.439
114 HB2 ALA 19 1HB ALA 19 0.735 -3.286 -4.484
115 HB3 ALA 19 2HB ALA 19 -0.804 -2.545 -3.986
116 H TRP 20 H TRP 20 2.282 -1.532 -4.266
117 HA TRP 20 HA TRP 20 1.716 0.556 -2.559
118 HB2 TRP 20 1HB TRP 20 3.491 -0.941 -2.081
119 HB3 TRP 20 2HB TRP 20 4.318 -0.570 -3.581
120 HD1 TRP 20 HD TRP 20 4.968 2.338 -3.652
121 HE1 TRP 20 1HE TRP 20 6.226 3.748 -1.811
122 HE3 TRP 20 3HE TRP 20 3.987 -0.836 0.197
123 HZ2 TRP 20 2HZ TRP 20 6.660 3.387 0.986
124 HZ3 TRP 20 3HZ TRP 20 4.865 -0.233 2.451
125 HH2 TRP 20 HH TRP 20 6.160 1.795 2.878
126 H THR 21 H THR 21 3.195 0.499 -5.850
127 HA THR 21 HA THR 21 3.920 3.193 -5.956
128 HB THR 21 HB THR 21 3.458 0.901 -7.835
129 HG1 THR 21 1HG THR 21 5.633 1.755 -8.384
130 HG21 THR 21 3HG2 THR 21 4.207 2.782 -9.633
131 HG22 THR 21 1HG2 THR 21 2.495 2.359 -9.393
132 HG23 THR 21 2HG2 THR 21 3.173 3.804 -8.606
133 H THR 22 H THR 22 0.859 1.561 -6.996
134 HA THR 22 HA THR 22 -0.343 4.001 -7.796
135 HB THR 22 HB THR 22 -1.278 1.156 -7.225
136 HG1 THR 22 1HG THR 22 -0.016 1.937 -9.181
137 HG21 THR 22 3HG2 THR 22 -3.006 3.229 -8.606
138 HG22 THR 22 1HG2 THR 22 -3.490 1.687 -7.861
139 HG23 THR 22 2HG2 THR 22 -3.086 3.083 -6.834
140 H CYS 23 H CYS 23 0.276 2.557 -4.698
141 HA CYS 23 HA CYS 23 -1.934 3.871 -3.429
142 HB2 CYS 23 1HB CYS 23 -0.147 1.773 -2.782
143 HB3 CYS 23 2HB CYS 23 0.111 3.032 -1.590
144 H THR 24 H THR 24 1.623 4.270 -3.874
145 HA THR 24 HA THR 24 1.629 6.695 -2.286
146 HB THR 24 HB THR 24 4.116 6.578 -3.112
147 HG1 THR 24 1HG THR 24 4.484 4.291 -3.886
148 HG21 THR 24 3HG2 THR 24 3.169 4.031 -1.728
149 HG22 THR 24 1HG2 THR 24 4.703 4.903 -1.495
150 HG23 THR 24 2HG2 THR 24 3.184 5.592 -0.874
151 H THR 25 H THR 25 -0.233 7.258 -4.052
152 HA THR 25 HA THR 25 1.131 9.145 -5.815
153 HB THR 25 HB THR 25 -0.589 8.397 -7.623
154 HG1 THR 25 1HG THR 25 -1.575 6.401 -7.133
155 HG21 THR 25 3HG2 THR 25 0.733 6.140 -8.027
156 HG22 THR 25 1HG2 THR 25 1.616 7.681 -8.153
157 HG23 THR 25 2HG2 THR 25 1.747 6.698 -6.675
158 HA PRO 26 HA PRO 26 -2.008 11.767 -4.528
159 HB2 PRO 26 1HB PRO 26 -2.207 13.532 -6.605
160 HB3 PRO 26 2HB PRO 26 -0.941 13.613 -5.396
161 HG2 PRO 26 1HG PRO 26 -0.775 12.671 -8.194
162 HG3 PRO 26 2HG PRO 26 0.522 13.157 -7.120
163 HD2 PRO 26 1HD PRO 26 -0.206 10.474 -7.828
164 HD3 PRO 26 2HD PRO 26 1.014 10.957 -6.667
165 H GLY 27 H GLY 27 -4.127 11.558 -4.181
166 HA2 GLY 27 1HA GLY 27 -5.907 11.436 -6.416
167 HA3 GLY 27 2HA GLY 27 -5.680 9.863 -5.677
168 H GLN 28 H GLN 28 -7.756 9.660 -4.758
169 HA GLN 28 HA GLN 28 -8.462 11.751 -2.861
170 HB2 GLN 28 1HB GLN 28 -10.756 10.991 -3.058
171 HB3 GLN 28 2HB GLN 28 -10.112 11.190 -4.675
172 HG2 GLN 28 1HG GLN 28 -9.469 8.621 -4.440
173 HG3 GLN 28 2HG GLN 28 -10.674 8.623 -3.167
174 HE21 GLN 28 1HE2 GLN 28 -12.688 8.267 -3.703
175 HE22 GLN 28 2HE2 GLN 28 -13.399 8.433 -5.273
176 H THR 29 H THR 29 -7.758 8.280 -3.275
177 HA THR 29 HA THR 29 -7.875 8.008 -0.344
178 HB THR 29 HB THR 29 -8.420 5.517 -1.027
179 HG1 THR 29 1HG THR 29 -8.670 5.364 -3.220
180 HG21 THR 29 3HG2 THR 29 -10.883 6.193 -1.583
181 HG22 THR 29 1HG2 THR 29 -10.241 6.704 -0.004
182 HG23 THR 29 2HG2 THR 29 -10.334 7.870 -1.346
183 H CYS 30 H CYS 30 -5.584 9.013 -1.294
184 HA CYS 30 HA CYS 30 -3.787 7.110 -2.274
185 HB2 CYS 30 1HB CYS 30 -3.118 9.286 -2.617
186 HB3 CYS 30 2HB CYS 30 -3.558 9.804 -1.002
187 H TYR 31 H TYR 31 -3.931 8.638 1.035
188 HA TYR 31 HA TYR 31 -2.340 6.646 2.217
189 HB2 TYR 31 1HB TYR 31 -2.667 8.947 3.113
190 HB3 TYR 31 2HB TYR 31 -4.403 8.717 3.180
191 HD1 TYR 31 2HD TYR 31 -5.406 7.241 4.925
192 HD2 TYR 31 1HD TYR 31 -1.228 8.162 4.880
193 HE1 TYR 31 2HE TYR 31 -5.203 6.469 7.339
194 HE2 TYR 31 1HE TYR 31 -1.039 7.388 7.294
195 HH TYR 31 HH TYR 31 -2.535 5.607 8.735
196 H THR 32 H THR 32 -5.796 6.873 1.497
197 HA THR 32 HA THR 32 -6.592 4.915 3.420
198 HB THR 32 HB THR 32 -7.946 6.038 0.909
199 HG1 THR 32 1HG THR 32 -7.619 7.718 2.402
200 HG21 THR 32 3HG2 THR 32 -8.829 3.865 2.327
201 HG22 THR 32 1HG2 THR 32 -9.462 5.176 3.351
202 HG23 THR 32 2HG2 THR 32 -9.932 5.079 1.637
203 H CYS 33 H CYS 33 -5.688 4.880 -0.059
204 HA CYS 33 HA CYS 33 -6.466 2.310 -0.619
205 HB2 CYS 33 1HB CYS 33 -5.819 3.322 -2.519
206 HB3 CYS 33 2HB CYS 33 -4.558 4.255 -1.736
207 H CYS 34 H CYS 34 -3.553 3.616 1.037
208 HA CYS 34 HA CYS 34 -2.029 1.321 1.066
209 HB2 CYS 34 1HB CYS 34 -2.200 3.471 3.187
210 HB3 CYS 34 2HB CYS 34 -0.909 2.297 3.022
211 H SER 35 H SER 35 -4.803 2.410 3.061
212 HA SER 35 HA SER 35 -4.489 0.300 4.929
213 HB2 SER 35 1HB SER 35 -5.540 2.228 5.805
214 HB3 SER 35 2HB SER 35 -6.572 2.428 4.404
215 HG SER 35 HG SER 35 -8.038 1.455 5.635
216 H SER 36 H SER 36 -5.271 0.239 1.724
217 HA SER 36 HA SER 36 -7.018 -2.049 2.140
218 HB2 SER 36 1HB SER 36 -7.949 0.312 1.086
219 HB3 SER 36 2HB SER 36 -7.431 -0.503 -0.376
220 HG SER 36 HG SER 36 -8.760 -2.342 0.245
221 H CYS 37 H CYS 37 -4.013 -1.282 1.475
222 HA CYS 37 HA CYS 37 -3.793 -3.289 -0.618
223 HB2 CYS 37 1HB CYS 37 -2.798 -0.471 -0.784
224 HB3 CYS 37 2HB CYS 37 -1.834 -1.752 -1.491
225 H PHE 38 H PHE 38 -3.376 -2.737 2.457
226 HA PHE 38 HA PHE 38 -0.912 -4.192 2.598
227 HB2 PHE 38 1HB PHE 38 -1.296 -1.373 3.772
228 HB3 PHE 38 2HB PHE 38 0.050 -2.414 4.191
229 HD1 PHE 38 2HD PHE 38 1.185 -3.433 1.871
230 HD2 PHE 38 1HD PHE 38 -0.738 0.322 2.329
231 HE1 PHE 38 2HE PHE 38 2.491 -2.527 -0.072
232 HE2 PHE 38 1HE PHE 38 0.567 1.228 0.386
233 HZ PHE 38 HZ PHE 38 2.166 -0.208 -0.791
234 H ASP 39 H ASP 39 -0.355 -4.573 5.057
235 HA ASP 39 HA ASP 39 -2.919 -5.057 6.336
236 HB2 ASP 39 1HB ASP 39 -1.609 -7.077 5.978
237 HB3 ASP 39 2HB ASP 39 -0.167 -6.332 6.639
238 H VAL 40 H VAL 40 0.043 -5.384 8.199
239 HA VAL 40 HA VAL 40 -0.717 -3.046 9.768
240 HB VAL 40 HB VAL 40 -0.481 -5.297 10.805
241 HG11 VAL 40 1HG1 VAL 40 1.750 -6.228 11.184
242 HG12 VAL 40 2HG1 VAL 40 1.404 -6.114 9.442
243 HG13 VAL 40 3HG1 VAL 40 2.476 -4.922 10.215
244 HG21 VAL 40 3HG2 VAL 40 -0.354 -3.456 12.284
245 HG22 VAL 40 1HG2 VAL 40 1.040 -4.485 12.695
246 HG23 VAL 40 2HG2 VAL 40 1.276 -3.011 11.724
247 H VAL 41 H VAL 41 2.161 -4.584 8.186
248 HA VAL 41 HA VAL 41 3.805 -2.320 8.685
249 HB VAL 41 HB VAL 41 4.160 -4.571 6.699
250 HG11 VAL 41 1HG1 VAL 41 5.707 -2.736 6.325
251 HG12 VAL 41 2HG1 VAL 41 6.148 -2.714 8.049
252 HG13 VAL 41 3HG1 VAL 41 6.577 -4.115 7.038
253 HG21 VAL 41 3HG2 VAL 41 4.549 -4.454 9.677
254 HG22 VAL 41 1HG2 VAL 41 3.890 -5.762 8.665
255 HG23 VAL 41 2HG2 VAL 41 5.642 -5.448 8.685
256 H GLY 42 H GLY 42 2.899 -3.733 5.470
257 HA2 GLY 42 1HA GLY 42 3.421 -1.765 3.795
258 HA3 GLY 42 2HA GLY 42 1.938 -2.690 3.676
259 H GLU 43 H GLU 43 0.766 -1.696 6.217
260 HA GLU 43 HA GLU 43 -0.364 0.659 5.137
261 HB2 GLU 43 1HB GLU 43 -1.446 -1.206 6.635
262 HB3 GLU 43 2HB GLU 43 -0.775 -0.307 7.982
263 HG2 GLU 43 1HG GLU 43 -1.927 1.783 7.012
264 HG3 GLU 43 2HG GLU 43 -2.752 0.714 5.895
265 H GLN 44 H GLN 44 1.442 -0.041 8.223
266 HA GLN 44 HA GLN 44 1.727 2.676 8.822
267 HB2 GLN 44 1HB GLN 44 2.943 1.951 10.710
268 HB3 GLN 44 2HB GLN 44 1.868 0.605 10.385
269 HG2 GLN 44 1HG GLN 44 3.833 -0.341 8.923
270 HG3 GLN 44 2HG GLN 44 4.834 0.830 9.758
271 HE21 GLN 44 1HE2 GLN 44 6.040 -0.746 10.764
272 HE22 GLN 44 2HE2 GLN 44 5.456 -1.704 12.083
273 H ALA 45 H ALA 45 3.326 0.576 6.580
274 HA ALA 45 HA ALA 45 5.807 2.060 6.611
275 HB1 ALA 45 3HB ALA 45 6.608 0.371 5.220
276 HB2 ALA 45 1HB ALA 45 5.370 -0.501 6.155
277 HB3 ALA 45 2HB ALA 45 5.008 0.057 4.504
278 H CYS 46 H CYS 46 2.920 1.575 4.483
279 HA CYS 46 HA CYS 46 3.834 3.290 2.470
280 HB2 CYS 46 1HB CYS 46 2.122 1.641 2.053
281 HB3 CYS 46 2HB CYS 46 1.046 2.390 3.215
282 H GLN 47 H GLN 47 2.408 3.752 5.656
283 HA GLN 47 HA GLN 47 1.167 6.166 5.321
284 HB2 GLN 47 1HB GLN 47 2.430 4.702 7.609
285 HB3 GLN 47 2HB GLN 47 2.113 6.407 7.859
286 HG2 GLN 47 1HG GLN 47 -0.262 5.645 6.709
287 HG3 GLN 47 2HG GLN 47 0.185 4.149 7.506
288 HE21 GLN 47 1HE2 GLN 47 -1.182 4.103 9.164
289 HE22 GLN 47 2HE2 GLN 47 -1.291 5.282 10.428
290 H MET 48 H MET 48 4.627 5.448 6.131
291 HA MET 48 HA MET 48 5.367 8.121 6.344
292 HB2 MET 48 1HB MET 48 6.821 5.494 5.814
293 HB3 MET 48 2HB MET 48 7.719 6.998 5.791
294 HG2 MET 48 1HG MET 48 6.098 7.094 8.144
295 HG3 MET 48 2HG MET 48 6.766 5.475 8.088
296 HE1 MET 48 3HE MET 48 7.356 9.024 7.376
297 HE2 MET 48 1HE MET 48 8.760 9.488 8.366
298 HE3 MET 48 2HE MET 48 9.002 8.859 6.719
299 H SER 49 H SER 49 5.392 5.790 3.588
300 HA SER 49 HA SER 49 6.648 7.654 1.868
301 HB2 SER 49 1HB SER 49 5.543 4.889 1.680
302 HB3 SER 49 2HB SER 49 5.519 5.801 0.184
303 HG SER 49 HG SER 49 7.938 6.073 1.544
304 H ALA 50 H ALA 50 3.531 7.420 3.189
305 HA ALA 50 HA ALA 50 1.875 7.959 1.021
306 HB1 ALA 50 3HB ALA 50 0.257 8.477 2.659
307 HB2 ALA 50 1HB ALA 50 1.348 7.340 3.486
308 HB3 ALA 50 2HB ALA 50 1.477 9.086 3.803
309 H GLN 51 H GLN 51 2.980 9.416 -0.405
310 HA GLN 51 HA GLN 51 3.406 12.066 0.700
311 HB2 GLN 51 1HB GLN 51 5.287 11.006 -0.540
312 HB3 GLN 51 2HB GLN 51 4.281 10.871 -1.968
313 HG2 GLN 51 1HG GLN 51 4.271 13.614 -0.902
314 HG3 GLN 51 2HG GLN 51 5.899 13.070 -1.255
315 HE21 GLN 51 1HE2 GLN 51 4.645 15.118 -2.630
316 HE22 GLN 51 2HE2 GLN 51 4.376 14.659 -4.279
317 H CYS 52 H CYS 52 0.789 11.764 0.683
318 HA CYS 52 HA CYS 52 -0.264 12.451 -1.923
319 HB2 CYS 52 1HB CYS 52 -2.107 12.471 0.360
320 HB3 CYS 52 2HB CYS 52 -2.248 11.697 -1.206
Start of MODEL 18
1 H1 ASN 1 1H ASN 1 11.873 -5.341 1.156
2 HA ASN 1 HA ASN 1 10.190 -3.897 -0.370
3 HB2 ASN 1 1HB ASN 1 10.821 -6.866 -0.234
4 HB3 ASN 1 2HB ASN 1 9.618 -6.308 -1.380
5 HD21 ASN 1 1HD2 ASN 1 10.620 -6.517 -3.263
6 HD22 ASN 1 2HD2 ASN 1 12.103 -5.751 -3.725
7 HA PRO 2 HA PRO 2 6.196 -4.705 1.250
8 HB2 PRO 2 1HB PRO 2 4.601 -4.378 -0.945
9 HB3 PRO 2 2HB PRO 2 5.240 -3.036 -0.017
10 HG2 PRO 2 1HG PRO 2 6.099 -4.034 -2.664
11 HG3 PRO 2 2HG PRO 2 6.417 -2.479 -1.921
12 HD2 PRO 2 1HD PRO 2 8.247 -4.675 -2.156
13 HD3 PRO 2 2HD PRO 2 8.525 -3.164 -1.312
14 H GLU 3 H GLU 3 7.766 -6.854 -0.597
15 HA GLU 3 HA GLU 3 5.773 -8.587 -1.363
16 HB2 GLU 3 1HB GLU 3 7.521 -10.222 -1.621
17 HB3 GLU 3 2HB GLU 3 8.225 -8.664 -2.006
18 HG2 GLU 3 1HG GLU 3 9.164 -8.510 0.306
19 HG3 GLU 3 2HG GLU 3 8.447 -10.058 0.705
20 H ASP 4 H ASP 4 7.207 -7.924 1.808
21 HA ASP 4 HA ASP 4 6.227 -10.331 2.953
22 HB2 ASP 4 1HB ASP 4 6.957 -7.860 4.545
23 HB3 ASP 4 2HB ASP 4 7.188 -9.542 4.978
24 H TRP 5 H TRP 5 5.203 -6.944 2.492
25 HA TRP 5 HA TRP 5 2.838 -7.428 4.160
26 HB2 TRP 5 1HB TRP 5 3.267 -4.712 3.163
27 HB3 TRP 5 2HB TRP 5 2.869 -5.283 4.772
28 HD1 TRP 5 HD TRP 5 5.316 -6.678 5.873
29 HE1 TRP 5 1HE TRP 5 7.731 -5.643 6.121
30 HE3 TRP 5 3HE TRP 5 4.691 -3.047 2.369
31 HZ2 TRP 5 2HZ TRP 5 9.078 -3.471 4.853
32 HZ3 TRP 5 3HZ TRP 5 6.605 -1.511 1.935
33 HH2 TRP 5 HH TRP 5 8.742 -1.679 3.110
34 H PHE 6 H PHE 6 1.453 -5.169 2.721
35 HA PHE 6 HA PHE 6 0.026 -4.914 1.062
36 HB2 PHE 6 1HB PHE 6 1.944 -4.588 -0.385
37 HB3 PHE 6 2HB PHE 6 2.420 -6.270 -0.266
38 HD1 PHE 6 2HD PHE 6 -0.465 -4.236 -1.493
39 HD2 PHE 6 1HD PHE 6 2.021 -7.623 -2.088
40 HE1 PHE 6 2HE PHE 6 -1.644 -4.722 -3.656
41 HE2 PHE 6 1HE PHE 6 0.843 -8.108 -4.250
42 HZ PHE 6 HZ PHE 6 -0.975 -6.652 -5.009
43 H THR 7 H THR 7 -1.907 -5.922 0.771
44 HA THR 7 HA THR 7 -1.842 -8.860 0.543
45 HB THR 7 HB THR 7 -4.138 -8.666 1.651
46 HG1 THR 7 1HG THR 7 -4.105 -6.275 0.914
47 HG21 THR 7 3HG2 THR 7 -3.165 -8.791 3.726
48 HG22 THR 7 1HG2 THR 7 -1.617 -8.534 2.887
49 HG23 THR 7 2HG2 THR 7 -2.493 -7.149 3.582
50 HA PRO 8 HA PRO 8 -3.476 -7.717 -3.382
51 HB2 PRO 8 1HB PRO 8 -2.642 -9.954 -4.712
52 HB3 PRO 8 2HB PRO 8 -1.669 -8.502 -4.573
53 HG2 PRO 8 1HG PRO 8 -1.370 -11.076 -3.151
54 HG3 PRO 8 2HG PRO 8 -0.197 -9.790 -3.352
55 HD2 PRO 8 1HD PRO 8 -1.722 -10.368 -0.993
56 HD3 PRO 8 2HD PRO 8 -0.636 -9.014 -1.233
57 H ASP 9 H ASP 9 -4.386 -9.803 -1.077
58 HA ASP 9 HA ASP 9 -6.291 -11.183 -2.720
59 HB2 ASP 9 1HB ASP 9 -5.764 -11.166 0.287
60 HB3 ASP 9 2HB ASP 9 -7.006 -12.149 -0.462
61 H THR 10 H THR 10 -5.973 -8.189 -1.067
62 HA THR 10 HA THR 10 -8.868 -7.781 -1.177
63 HB THR 10 HB THR 10 -8.396 -8.367 1.168
64 HG1 THR 10 1HG THR 10 -9.709 -6.398 0.497
65 HG21 THR 10 3HG2 THR 10 -6.879 -6.716 2.456
66 HG22 THR 10 1HG2 THR 10 -6.030 -7.915 1.452
67 HG23 THR 10 2HG2 THR 10 -6.218 -6.243 0.873
68 H CYS 11 H CYS 11 -7.210 -7.041 -3.212
69 HA CYS 11 HA CYS 11 -7.509 -4.206 -3.068
70 HB2 CYS 11 1HB CYS 11 -5.133 -4.974 -2.111
71 HB3 CYS 11 2HB CYS 11 -4.738 -4.998 -3.818
72 H ALA 12 H ALA 12 -7.319 -3.266 -5.272
73 HA ALA 12 HA ALA 12 -8.221 -5.068 -7.247
74 HB1 ALA 12 3HB ALA 12 -8.898 -3.135 -8.178
75 HB2 ALA 12 1HB ALA 12 -8.175 -2.289 -6.789
76 HB3 ALA 12 2HB ALA 12 -7.226 -2.531 -8.276
77 H TYR 13 H TYR 13 -5.052 -3.754 -6.301
78 HA TYR 13 HA TYR 13 -3.802 -4.677 -8.733
79 HB2 TYR 13 1HB TYR 13 -2.536 -3.822 -6.072
80 HB3 TYR 13 2HB TYR 13 -1.858 -3.618 -7.675
81 HD1 TYR 13 2HD TYR 13 -4.424 -2.505 -8.987
82 HD2 TYR 13 1HD TYR 13 -2.384 -1.550 -5.350
83 HE1 TYR 13 2HE TYR 13 -5.358 -0.142 -9.076
84 HE2 TYR 13 1HE TYR 13 -3.324 0.810 -5.451
85 HH TYR 13 HH TYR 13 -4.410 2.263 -6.649
86 H GLY 14 H GLY 14 -2.176 -6.336 -8.846
87 HA2 GLY 14 1HA GLY 14 -2.526 -8.392 -6.756
88 HA3 GLY 14 2HA GLY 14 -2.132 -8.688 -8.438
89 H ASP 15 H ASP 15 -0.268 -6.180 -8.321
90 HA ASP 15 HA ASP 15 1.990 -7.709 -7.412
91 HB2 ASP 15 1HB ASP 15 2.013 -4.917 -8.628
92 HB3 ASP 15 2HB ASP 15 3.331 -6.070 -8.592
93 H SER 16 H SER 16 3.725 -6.483 -6.082
94 HA SER 16 HA SER 16 2.346 -4.932 -4.062
95 HB2 SER 16 1HB SER 16 4.577 -5.345 -2.797
96 HB3 SER 16 2HB SER 16 3.509 -6.713 -3.042
97 HG SER 16 HG SER 16 4.830 -7.508 -4.680
98 H ASN 17 H ASN 17 5.132 -4.874 -6.340
99 HA ASN 17 HA ASN 17 6.209 -2.485 -5.447
100 HB2 ASN 17 1HB ASN 17 6.304 -4.052 -8.043
101 HB3 ASN 17 2HB ASN 17 7.001 -2.445 -8.012
102 HD21 ASN 17 1HD2 ASN 17 8.594 -1.959 -6.356
103 HD22 ASN 17 2HD2 ASN 17 9.678 -3.193 -5.808
104 H THR 18 H THR 18 3.882 -3.313 -8.117
105 HA THR 18 HA THR 18 3.508 -0.605 -8.911
106 HB THR 18 HB THR 18 3.096 -3.069 -10.041
107 HG1 THR 18 1HG THR 18 1.808 -1.675 -11.562
108 HG21 THR 18 3HG2 THR 18 0.780 -3.579 -10.222
109 HG22 THR 18 1HG2 THR 18 0.957 -3.216 -8.489
110 HG23 THR 18 2HG2 THR 18 0.290 -1.988 -9.592
111 H ALA 19 H ALA 19 1.885 -2.821 -6.621
112 HA ALA 19 HA ALA 19 -0.409 -1.283 -6.242
113 HB1 ALA 19 3HB ALA 19 -0.291 -2.509 -3.928
114 HB2 ALA 19 1HB ALA 19 -0.484 -3.471 -5.413
115 HB3 ALA 19 2HB ALA 19 1.114 -3.340 -4.639
116 H TRP 20 H TRP 20 2.673 -1.407 -4.311
117 HA TRP 20 HA TRP 20 2.013 0.635 -2.567
118 HB2 TRP 20 1HB TRP 20 3.847 -0.842 -2.142
119 HB3 TRP 20 2HB TRP 20 4.680 -0.334 -3.597
120 HD1 TRP 20 HD TRP 20 5.159 2.605 -3.481
121 HE1 TRP 20 1HE TRP 20 6.293 3.972 -1.530
122 HE3 TRP 20 3HE TRP 20 4.288 -0.846 0.150
123 HZ2 TRP 20 2HZ TRP 20 6.691 3.468 1.251
124 HZ3 TRP 20 3HZ TRP 20 5.082 -0.330 2.456
125 HH2 TRP 20 HH TRP 20 6.246 1.740 3.032
126 H THR 21 H THR 21 3.753 0.699 -5.754
127 HA THR 21 HA THR 21 4.244 3.428 -5.829
128 HB THR 21 HB THR 21 4.108 1.110 -7.712
129 HG1 THR 21 1HG THR 21 6.095 1.851 -6.786
130 HG21 THR 21 3HG2 THR 21 3.576 3.964 -8.552
131 HG22 THR 21 1HG2 THR 21 4.726 3.011 -9.520
132 HG23 THR 21 2HG2 THR 21 3.049 2.449 -9.324
133 H THR 22 H THR 22 1.362 1.586 -7.003
134 HA THR 22 HA THR 22 0.049 3.932 -7.916
135 HB THR 22 HB THR 22 -1.008 1.147 -7.193
136 HG1 THR 22 1HG THR 22 -0.145 0.662 -9.201
137 HG21 THR 22 3HG2 THR 22 -2.697 3.097 -7.677
138 HG22 THR 22 1HG2 THR 22 -2.036 3.061 -9.330
139 HG23 THR 22 2HG2 THR 22 -2.840 1.620 -8.661
140 H CYS 23 H CYS 23 0.548 2.518 -4.768
141 HA CYS 23 HA CYS 23 -1.795 3.723 -3.647
142 HB2 CYS 23 1HB CYS 23 0.035 1.719 -2.882
143 HB3 CYS 23 2HB CYS 23 0.203 2.998 -1.696
144 H THR 24 H THR 24 1.743 4.338 -3.924
145 HA THR 24 HA THR 24 1.535 6.751 -2.330
146 HB THR 24 HB THR 24 4.045 6.801 -2.977
147 HG1 THR 24 1HG THR 24 3.456 5.378 -4.908
148 HG21 THR 24 3HG2 THR 24 3.082 5.598 -0.875
149 HG22 THR 24 1HG2 THR 24 3.185 4.103 -1.836
150 HG23 THR 24 2HG2 THR 24 4.661 5.028 -1.466
151 H THR 25 H THR 25 -0.236 7.499 -3.924
152 HA THR 25 HA THR 25 1.106 9.294 -5.780
153 HB THR 25 HB THR 25 -0.745 8.579 -7.501
154 HG1 THR 25 1HG THR 25 -1.813 7.244 -5.800
155 HG21 THR 25 3HG2 THR 25 0.571 6.494 -8.190
156 HG22 THR 25 1HG2 THR 25 1.570 7.955 -7.995
157 HG23 THR 25 2HG2 THR 25 1.552 6.712 -6.721
158 HA PRO 26 HA PRO 26 -1.904 12.000 -4.362
159 HB2 PRO 26 1HB PRO 26 -2.062 13.815 -6.399
160 HB3 PRO 26 2HB PRO 26 -0.778 13.823 -5.206
161 HG2 PRO 26 1HG PRO 26 -0.685 12.936 -8.025
162 HG3 PRO 26 2HG PRO 26 0.644 13.349 -6.960
163 HD2 PRO 26 1HD PRO 26 -0.195 10.712 -7.713
164 HD3 PRO 26 2HD PRO 26 1.058 11.123 -6.559
165 H GLY 27 H GLY 27 -4.039 11.952 -4.012
166 HA2 GLY 27 1HA GLY 27 -5.887 12.022 -6.131
167 HA3 GLY 27 2HA GLY 27 -5.647 10.354 -5.652
168 H GLN 28 H GLN 28 -7.758 10.112 -4.756
169 HA GLN 28 HA GLN 28 -8.331 11.862 -2.511
170 HB2 GLN 28 1HB GLN 28 -9.965 11.233 -4.543
171 HB3 GLN 28 2HB GLN 28 -10.309 9.837 -3.540
172 HG2 GLN 28 1HG GLN 28 -10.853 11.355 -1.621
173 HG3 GLN 28 2HG GLN 28 -10.519 12.747 -2.632
174 HE21 GLN 28 1HE2 GLN 28 -12.598 13.526 -2.404
175 HE22 GLN 28 2HE2 GLN 28 -13.967 12.842 -3.215
176 H THR 29 H THR 29 -7.496 8.557 -3.432
177 HA THR 29 HA THR 29 -7.685 7.795 -0.592
178 HB THR 29 HB THR 29 -8.334 5.548 -1.359
179 HG1 THR 29 1HG THR 29 -8.193 6.803 -4.005
180 HG21 THR 29 3HG2 THR 29 -10.485 6.290 -1.565
181 HG22 THR 29 1HG2 THR 29 -9.911 7.908 -2.035
182 HG23 THR 29 2HG2 THR 29 -10.148 6.653 -3.275
183 H CYS 30 H CYS 30 -5.442 9.092 -1.230
184 HA CYS 30 HA CYS 30 -3.490 7.383 -2.368
185 HB2 CYS 30 1HB CYS 30 -3.138 9.707 -2.572
186 HB3 CYS 30 2HB CYS 30 -3.370 9.986 -0.857
187 H TYR 31 H TYR 31 -4.366 8.483 0.983
188 HA TYR 31 HA TYR 31 -2.490 6.600 2.127
189 HB2 TYR 31 1HB TYR 31 -2.862 8.892 3.066
190 HB3 TYR 31 2HB TYR 31 -4.589 8.609 3.150
191 HD1 TYR 31 2HD TYR 31 -5.480 6.905 4.808
192 HD2 TYR 31 1HD TYR 31 -1.418 8.248 4.846
193 HE1 TYR 31 2HE TYR 31 -5.219 6.071 7.195
194 HE2 TYR 31 1HE TYR 31 -1.171 7.409 7.234
195 HH TYR 31 HH TYR 31 -3.207 5.275 8.612
196 H THR 32 H THR 32 -5.877 6.761 1.226
197 HA THR 32 HA THR 32 -6.749 4.791 3.120
198 HB THR 32 HB THR 32 -7.957 6.060 0.608
199 HG1 THR 32 1HG THR 32 -7.563 7.359 2.589
200 HG21 THR 32 3HG2 THR 32 -8.836 3.677 1.765
201 HG22 THR 32 1HG2 THR 32 -9.738 4.904 2.686
202 HG23 THR 32 2HG2 THR 32 -9.884 4.837 0.913
203 H CYS 33 H CYS 33 -5.633 4.812 -0.290
204 HA CYS 33 HA CYS 33 -6.377 2.255 -0.951
205 HB2 CYS 33 1HB CYS 33 -5.607 3.360 -2.766
206 HB3 CYS 33 2HB CYS 33 -4.340 4.188 -1.881
207 H CYS 34 H CYS 34 -3.438 3.513 0.748
208 HA CYS 34 HA CYS 34 -2.067 1.123 0.906
209 HB2 CYS 34 1HB CYS 34 -2.071 3.394 2.905
210 HB3 CYS 34 2HB CYS 34 -0.855 2.138 2.776
211 H SER 35 H SER 35 -4.822 2.460 2.733
212 HA SER 35 HA SER 35 -4.619 0.523 4.798
213 HB2 SER 35 1HB SER 35 -6.938 2.360 4.051
214 HB3 SER 35 2HB SER 35 -6.789 1.470 5.553
215 HG SER 35 HG SER 35 -5.422 3.799 4.680
216 H SER 36 H SER 36 -5.318 0.199 1.590
217 HA SER 36 HA SER 36 -7.086 -2.032 2.154
218 HB2 SER 36 1HB SER 36 -8.645 -1.478 0.492
219 HB3 SER 36 2HB SER 36 -8.285 0.087 1.194
220 HG SER 36 HG SER 36 -8.250 0.002 -1.201
221 H CYS 37 H CYS 37 -4.104 -1.325 1.414
222 HA CYS 37 HA CYS 37 -3.931 -3.394 -0.625
223 HB2 CYS 37 1HB CYS 37 -3.429 -0.638 -1.134
224 HB3 CYS 37 2HB CYS 37 -1.883 -1.464 -1.136
225 H PHE 38 H PHE 38 -3.499 -2.807 2.432
226 HA PHE 38 HA PHE 38 -1.037 -4.273 2.583
227 HB2 PHE 38 1HB PHE 38 -1.433 -1.457 3.762
228 HB3 PHE 38 2HB PHE 38 -0.083 -2.494 4.176
229 HD1 PHE 38 2HD PHE 38 1.113 -3.474 1.903
230 HD2 PHE 38 1HD PHE 38 -0.940 0.221 2.276
231 HE1 PHE 38 2HE PHE 38 2.415 -2.554 -0.037
232 HE2 PHE 38 1HE PHE 38 0.361 1.140 0.337
233 HZ PHE 38 HZ PHE 38 2.023 -0.259 -0.797
234 H ASP 39 H ASP 39 -0.525 -4.806 4.965
235 HA ASP 39 HA ASP 39 -3.068 -5.338 6.219
236 HB2 ASP 39 1HB ASP 39 -1.295 -6.620 7.812
237 HB3 ASP 39 2HB ASP 39 -1.912 -7.326 6.332
238 H VAL 40 H VAL 40 0.198 -4.913 7.727
239 HA VAL 40 HA VAL 40 -0.854 -2.614 9.213
240 HB VAL 40 HB VAL 40 -0.931 -4.806 10.479
241 HG11 VAL 40 1HG1 VAL 40 1.162 -5.774 9.656
242 HG12 VAL 40 2HG1 VAL 40 2.087 -4.464 10.429
243 HG13 VAL 40 3HG1 VAL 40 1.186 -5.628 11.430
244 HG21 VAL 40 3HG2 VAL 40 -0.149 -3.803 12.554
245 HG22 VAL 40 1HG2 VAL 40 0.815 -2.613 11.648
246 HG23 VAL 40 2HG2 VAL 40 -0.962 -2.574 11.555
247 H VAL 41 H VAL 41 2.003 -4.534 8.116
248 HA VAL 41 HA VAL 41 3.812 -2.401 8.666
249 HB VAL 41 HB VAL 41 4.211 -4.807 6.886
250 HG11 VAL 41 1HG1 VAL 41 6.033 -3.296 6.673
251 HG12 VAL 41 2HG1 VAL 41 6.080 -2.986 8.425
252 HG13 VAL 41 3HG1 VAL 41 6.577 -4.572 7.788
253 HG21 VAL 41 3HG2 VAL 41 5.189 -5.803 9.071
254 HG22 VAL 41 1HG2 VAL 41 4.181 -4.589 9.895
255 HG23 VAL 41 2HG2 VAL 41 3.423 -5.810 8.845
256 H GLY 42 H GLY 42 2.175 -3.745 5.735
257 HA2 GLY 42 1HA GLY 42 3.396 -2.096 3.843
258 HA3 GLY 42 2HA GLY 42 1.828 -2.864 3.698
259 H GLU 43 H GLU 43 0.500 -1.604 5.949
260 HA GLU 43 HA GLU 43 -0.160 0.830 4.670
261 HB2 GLU 43 1HB GLU 43 -1.701 -0.807 5.983
262 HB3 GLU 43 2HB GLU 43 -1.090 -0.032 7.431
263 HG2 GLU 43 1HG GLU 43 -1.737 2.220 6.222
264 HG3 GLU 43 2HG GLU 43 -2.709 1.202 5.178
265 H GLN 44 H GLN 44 1.353 -0.085 7.838
266 HA GLN 44 HA GLN 44 1.710 2.549 8.665
267 HB2 GLN 44 1HB GLN 44 2.880 1.633 10.493
268 HB3 GLN 44 2HB GLN 44 1.801 0.334 10.025
269 HG2 GLN 44 1HG GLN 44 3.710 -0.936 10.021
270 HG3 GLN 44 2HG GLN 44 3.948 -0.251 8.425
271 HE21 GLN 44 1HE2 GLN 44 6.199 -0.717 8.913
272 HE22 GLN 44 2HE2 GLN 44 7.158 0.445 9.768
273 H ALA 45 H ALA 45 3.488 0.443 6.461
274 HA ALA 45 HA ALA 45 5.872 2.066 6.565
275 HB1 ALA 45 3HB ALA 45 6.681 0.471 4.874
276 HB2 ALA 45 1HB ALA 45 5.969 -0.390 6.260
277 HB3 ALA 45 2HB ALA 45 5.051 -0.233 4.743
278 H CYS 46 H CYS 46 2.921 1.653 4.595
279 HA CYS 46 HA CYS 46 3.890 3.240 2.453
280 HB2 CYS 46 1HB CYS 46 2.165 1.530 2.150
281 HB3 CYS 46 2HB CYS 46 1.072 2.421 3.191
282 H GLN 47 H GLN 47 2.285 3.745 5.579
283 HA GLN 47 HA GLN 47 1.117 6.173 5.151
284 HB2 GLN 47 1HB GLN 47 2.249 4.741 7.534
285 HB3 GLN 47 2HB GLN 47 1.885 6.444 7.732
286 HG2 GLN 47 1HG GLN 47 -0.412 5.713 6.509
287 HG3 GLN 47 2HG GLN 47 0.011 4.151 7.183
288 HE21 GLN 47 1HE2 GLN 47 -1.208 3.847 8.889
289 HE22 GLN 47 2HE2 GLN 47 -1.448 4.941 10.210
290 H MET 48 H MET 48 4.524 5.400 6.097
291 HA MET 48 HA MET 48 5.296 8.061 6.371
292 HB2 MET 48 1HB MET 48 6.634 5.373 6.033
293 HB3 MET 48 2HB MET 48 7.636 6.784 5.756
294 HG2 MET 48 1HG MET 48 6.323 7.480 8.108
295 HG3 MET 48 2HG MET 48 6.499 5.747 8.300
296 HE1 MET 48 3HE MET 48 7.634 6.621 10.342
297 HE2 MET 48 1HE MET 48 8.741 5.274 9.980
298 HE3 MET 48 2HE MET 48 9.395 6.865 10.438
299 H SER 49 H SER 49 5.042 5.870 3.571
300 HA SER 49 HA SER 49 6.579 7.579 1.902
301 HB2 SER 49 1HB SER 49 5.428 4.926 1.770
302 HB3 SER 49 2HB SER 49 4.933 5.820 0.346
303 HG SER 49 HG SER 49 7.651 6.119 1.046
304 H ALA 50 H ALA 50 3.191 7.182 2.857
305 HA ALA 50 HA ALA 50 1.809 8.237 0.779
306 HB1 ALA 50 3HB ALA 50 0.832 7.379 2.878
307 HB2 ALA 50 1HB ALA 50 1.440 8.808 3.748
308 HB3 ALA 50 2HB ALA 50 0.196 8.995 2.489
309 H GLN 51 H GLN 51 2.720 9.853 -0.477
310 HA GLN 51 HA GLN 51 3.452 12.275 0.968
311 HB2 GLN 51 1HB GLN 51 5.234 11.199 -0.437
312 HB3 GLN 51 2HB GLN 51 4.227 11.415 -1.855
313 HG2 GLN 51 1HG GLN 51 4.170 13.957 -1.112
314 HG3 GLN 51 2HG GLN 51 5.579 13.535 -0.159
315 HE21 GLN 51 1HE2 GLN 51 4.404 14.439 -3.172
316 HE22 GLN 51 2HE2 GLN 51 5.817 14.183 -4.142
317 H CYS 52 H CYS 52 0.798 12.104 0.896
318 HA CYS 52 HA CYS 52 0.090 13.932 -1.264
319 HB2 CYS 52 1HB CYS 52 -1.885 11.851 -0.400
320 HB3 CYS 52 2HB CYS 52 -1.852 12.816 -1.862
Start of MODEL 19
1 H1 ASN 1 1H ASN 1 11.695 -4.172 1.539
2 HA ASN 1 HA ASN 1 10.156 -4.541 -0.400
3 HB2 ASN 1 1HB ASN 1 10.602 -6.858 1.557
4 HB3 ASN 1 2HB ASN 1 10.249 -7.040 -0.150
5 HD21 ASN 1 1HD2 ASN 1 11.867 -7.187 -1.509
6 HD22 ASN 1 2HD2 ASN 1 13.516 -6.742 -1.222
7 HA PRO 2 HA PRO 2 6.051 -4.643 1.285
8 HB2 PRO 2 1HB PRO 2 4.697 -4.323 -1.067
9 HB3 PRO 2 2HB PRO 2 5.307 -2.979 -0.123
10 HG2 PRO 2 1HG PRO 2 6.371 -4.111 -2.638
11 HG3 PRO 2 2HG PRO 2 6.691 -2.546 -1.916
12 HD2 PRO 2 1HD PRO 2 8.425 -4.831 -1.899
13 HD3 PRO 2 2HD PRO 2 8.693 -3.305 -1.080
14 H GLU 3 H GLU 3 7.692 -6.934 -0.295
15 HA GLU 3 HA GLU 3 5.714 -8.601 -1.224
16 HB2 GLU 3 1HB GLU 3 7.406 -10.385 -1.055
17 HB3 GLU 3 2HB GLU 3 8.124 -8.914 -1.679
18 HG2 GLU 3 1HG GLU 3 8.808 -8.372 0.755
19 HG3 GLU 3 2HG GLU 3 8.335 -10.011 1.157
20 H ASP 4 H ASP 4 7.146 -8.240 2.069
21 HA ASP 4 HA ASP 4 5.750 -10.415 3.138
22 HB2 ASP 4 1HB ASP 4 7.816 -8.947 4.010
23 HB3 ASP 4 2HB ASP 4 6.556 -8.023 4.804
24 H TRP 5 H TRP 5 5.093 -6.944 2.613
25 HA TRP 5 HA TRP 5 2.609 -7.145 4.146
26 HB2 TRP 5 1HB TRP 5 3.263 -4.557 2.961
27 HB3 TRP 5 2HB TRP 5 2.801 -4.972 4.600
28 HD1 TRP 5 HD TRP 5 5.202 -6.608 5.685
29 HE1 TRP 5 1HE TRP 5 7.652 -5.669 5.966
30 HE3 TRP 5 3HE TRP 5 4.708 -2.839 2.308
31 HZ2 TRP 5 2HZ TRP 5 9.077 -3.504 4.772
32 HZ3 TRP 5 3HZ TRP 5 6.676 -1.358 1.924
33 HH2 TRP 5 HH TRP 5 8.805 -1.642 3.092
34 H PHE 6 H PHE 6 1.200 -5.115 2.651
35 HA PHE 6 HA PHE 6 -0.197 -4.938 0.956
36 HB2 PHE 6 1HB PHE 6 1.709 -4.417 -0.434
37 HB3 PHE 6 2HB PHE 6 2.351 -6.043 -0.308
38 HD1 PHE 6 1HD PHE 6 -0.541 -4.172 -1.730
39 HD2 PHE 6 2HD PHE 6 2.017 -7.543 -2.049
40 HE1 PHE 6 1HE PHE 6 -1.585 -4.755 -3.937
41 HE2 PHE 6 2HE PHE 6 0.973 -8.126 -4.256
42 HZ PHE 6 HZ PHE 6 -0.815 -6.725 -5.174
43 H THR 7 H THR 7 -2.036 -6.123 0.801
44 HA THR 7 HA THR 7 -1.723 -9.022 0.386
45 HB THR 7 HB THR 7 -3.812 -9.228 1.659
46 HG1 THR 7 1HG THR 7 -4.646 -7.017 2.427
47 HG21 THR 7 3HG2 THR 7 -1.477 -8.257 2.832
48 HG22 THR 7 1HG2 THR 7 -2.680 -7.040 3.322
49 HG23 THR 7 2HG2 THR 7 -2.930 -8.753 3.733
50 HA PRO 8 HA PRO 8 -3.506 -7.865 -3.466
51 HB2 PRO 8 1HB PRO 8 -2.525 -9.980 -4.893
52 HB3 PRO 8 2HB PRO 8 -1.663 -8.465 -4.709
53 HG2 PRO 8 1HG PRO 8 -1.149 -11.061 -3.392
54 HG3 PRO 8 2HG PRO 8 -0.079 -9.683 -3.557
55 HD2 PRO 8 1HD PRO 8 -1.522 -10.464 -1.204
56 HD3 PRO 8 2HD PRO 8 -0.544 -9.024 -1.404
57 H ASP 9 H ASP 9 -4.040 -10.360 -1.340
58 HA ASP 9 HA ASP 9 -5.886 -11.755 -2.967
59 HB2 ASP 9 1HB ASP 9 -5.356 -11.725 0.038
60 HB3 ASP 9 2HB ASP 9 -6.542 -12.782 -0.700
61 H THR 10 H THR 10 -5.866 -8.860 -1.006
62 HA THR 10 HA THR 10 -8.796 -8.711 -1.210
63 HB THR 10 HB THR 10 -8.231 -9.242 1.125
64 HG1 THR 10 1HG THR 10 -9.621 -7.583 1.588
65 HG21 THR 10 3HG2 THR 10 -6.008 -8.605 1.587
66 HG22 THR 10 1HG2 THR 10 -6.155 -7.080 0.681
67 HG23 THR 10 2HG2 THR 10 -6.898 -7.234 2.291
68 H CYS 11 H CYS 11 -7.040 -7.804 -3.207
69 HA CYS 11 HA CYS 11 -7.647 -4.985 -3.017
70 HB2 CYS 11 1HB CYS 11 -5.107 -5.759 -2.361
71 HB3 CYS 11 2HB CYS 11 -4.945 -5.472 -4.082
72 H ALA 12 H ALA 12 -6.981 -3.995 -5.346
73 HA ALA 12 HA ALA 12 -8.194 -5.792 -7.262
74 HB1 ALA 12 3HB ALA 12 -7.346 -2.870 -7.388
75 HB2 ALA 12 1HB ALA 12 -8.208 -3.738 -8.681
76 HB3 ALA 12 2HB ALA 12 -8.990 -3.488 -7.101
77 H TYR 13 H TYR 13 -5.047 -4.271 -6.502
78 HA TYR 13 HA TYR 13 -3.885 -5.221 -8.971
79 HB2 TYR 13 1HB TYR 13 -3.022 -3.767 -6.410
80 HB3 TYR 13 2HB TYR 13 -1.814 -4.283 -7.570
81 HD1 TYR 13 1HD TYR 13 -2.503 -3.581 -10.131
82 HD2 TYR 13 2HD TYR 13 -3.686 -1.556 -6.553
83 HE1 TYR 13 1HE TYR 13 -2.870 -1.441 -11.455
84 HE2 TYR 13 2HE TYR 13 -4.049 0.577 -7.889
85 HH TYR 13 HH TYR 13 -2.851 1.000 -10.968
86 H GLY 14 H GLY 14 -2.024 -6.681 -9.040
87 HA2 GLY 14 1HA GLY 14 -2.151 -8.684 -6.869
88 HA3 GLY 14 2HA GLY 14 -1.807 -9.028 -8.553
89 H ASP 15 H ASP 15 -0.252 -6.175 -8.252
90 HA ASP 15 HA ASP 15 2.201 -7.528 -7.488
91 HB2 ASP 15 1HB ASP 15 2.023 -4.808 -8.826
92 HB3 ASP 15 2HB ASP 15 3.364 -5.935 -8.846
93 H SER 16 H SER 16 3.646 -6.469 -5.941
94 HA SER 16 HA SER 16 2.225 -4.755 -4.140
95 HB2 SER 16 1HB SER 16 4.603 -4.980 -2.938
96 HB3 SER 16 2HB SER 16 3.427 -6.279 -2.886
97 HG SER 16 HG SER 16 5.227 -7.335 -3.570
98 H ASN 17 H ASN 17 4.850 -4.618 -6.546
99 HA ASN 17 HA ASN 17 5.969 -2.222 -5.721
100 HB2 ASN 17 1HB ASN 17 5.766 -3.510 -8.493
101 HB3 ASN 17 2HB ASN 17 6.766 -2.110 -8.161
102 HD21 ASN 17 1HD2 ASN 17 7.096 -5.136 -8.794
103 HD22 ASN 17 2HD2 ASN 17 8.366 -5.653 -7.735
104 H THR 18 H THR 18 3.584 -3.001 -8.374
105 HA THR 18 HA THR 18 3.047 -0.298 -8.995
106 HB THR 18 HB THR 18 2.680 -2.642 -10.266
107 HG1 THR 18 1HG THR 18 1.994 -1.008 -11.587
108 HG21 THR 18 3HG2 THR 18 0.414 -3.406 -10.242
109 HG22 THR 18 1HG2 THR 18 0.805 -3.224 -8.515
110 HG23 THR 18 2HG2 THR 18 -0.147 -1.972 -9.349
111 H ALA 19 H ALA 19 1.670 -2.605 -6.649
112 HA ALA 19 HA ALA 19 -0.653 -1.140 -6.098
113 HB1 ALA 19 3HB ALA 19 1.006 -3.176 -4.583
114 HB2 ALA 19 1HB ALA 19 -0.471 -2.465 -3.890
115 HB3 ALA 19 2HB ALA 19 -0.559 -3.404 -5.400
116 H TRP 20 H TRP 20 2.504 -1.317 -4.293
117 HA TRP 20 HA TRP 20 1.922 0.658 -2.461
118 HB2 TRP 20 1HB TRP 20 3.784 -0.772 -2.133
119 HB3 TRP 20 2HB TRP 20 4.522 -0.298 -3.650
120 HD1 TRP 20 HD TRP 20 5.105 2.602 -3.634
121 HE1 TRP 20 1HE TRP 20 6.361 3.999 -1.781
122 HE3 TRP 20 3HE TRP 20 4.290 -0.696 0.149
123 HZ2 TRP 20 2HZ TRP 20 6.861 3.578 0.996
124 HZ3 TRP 20 3HZ TRP 20 5.196 -0.127 2.401
125 HH2 TRP 20 HH TRP 20 6.443 1.925 2.855
126 H THR 21 H THR 21 3.491 0.864 -5.729
127 HA THR 21 HA THR 21 3.971 3.592 -5.730
128 HB THR 21 HB THR 21 3.668 1.362 -7.711
129 HG1 THR 21 1HG THR 21 5.821 1.963 -7.823
130 HG21 THR 21 3HG2 THR 21 4.272 3.388 -9.416
131 HG22 THR 21 1HG2 THR 21 2.605 2.798 -9.216
132 HG23 THR 21 2HG2 THR 21 3.141 4.259 -8.352
133 H THR 22 H THR 22 1.134 1.928 -7.273
134 HA THR 22 HA THR 22 -0.248 4.267 -7.827
135 HB THR 22 HB THR 22 -1.140 1.393 -7.271
136 HG1 THR 22 1HG THR 22 0.354 2.097 -9.105
137 HG21 THR 22 3HG2 THR 22 -3.105 2.096 -8.771
138 HG22 THR 22 1HG2 THR 22 -3.164 2.742 -7.114
139 HG23 THR 22 2HG2 THR 22 -2.635 3.784 -8.457
140 H CYS 23 H CYS 23 0.421 2.785 -4.763
141 HA CYS 23 HA CYS 23 -1.882 3.948 -3.500
142 HB2 CYS 23 1HB CYS 23 0.150 1.997 -2.825
143 HB3 CYS 23 2HB CYS 23 -0.030 3.174 -1.539
144 H THR 24 H THR 24 1.672 4.484 -3.828
145 HA THR 24 HA THR 24 1.529 6.870 -2.181
146 HB THR 24 HB THR 24 4.070 6.812 -3.018
147 HG1 THR 24 1HG THR 24 3.410 4.019 -3.195
148 HG21 THR 24 3HG2 THR 24 4.534 4.868 -1.393
149 HG22 THR 24 1HG2 THR 24 3.611 6.224 -0.702
150 HG23 THR 24 2HG2 THR 24 2.771 4.732 -1.190
151 H THR 25 H THR 25 -0.259 7.433 -4.007
152 HA THR 25 HA THR 25 1.161 9.324 -5.736
153 HB THR 25 HB THR 25 -0.584 8.644 -7.536
154 HG1 THR 25 1HG THR 25 -1.775 7.412 -5.766
155 HG21 THR 25 3HG2 THR 25 0.683 6.151 -7.568
156 HG22 THR 25 1HG2 THR 25 1.326 7.631 -8.319
157 HG23 THR 25 2HG2 THR 25 1.842 7.168 -6.679
158 HA PRO 26 HA PRO 26 -1.850 12.043 -4.345
159 HB2 PRO 26 1HB PRO 26 -1.865 13.925 -6.326
160 HB3 PRO 26 2HB PRO 26 -0.645 13.866 -5.069
161 HG2 PRO 26 1HG PRO 26 -0.424 13.068 -7.907
162 HG3 PRO 26 2HG PRO 26 0.856 13.417 -6.762
163 HD2 PRO 26 1HD PRO 26 0.004 10.824 -7.645
164 HD3 PRO 26 2HD PRO 26 1.203 11.171 -6.415
165 H GLY 27 H GLY 27 -3.982 11.886 -4.077
166 HA2 GLY 27 1HA GLY 27 -5.689 12.028 -6.368
167 HA3 GLY 27 2HA GLY 27 -5.563 10.393 -5.748
168 H GLN 28 H GLN 28 -7.522 10.065 -4.724
169 HA GLN 28 HA GLN 28 -8.251 12.093 -2.759
170 HB2 GLN 28 1HB GLN 28 -9.949 10.184 -4.406
171 HB3 GLN 28 2HB GLN 28 -10.585 10.985 -2.983
172 HG2 GLN 28 1HG GLN 28 -10.723 13.020 -4.029
173 HG3 GLN 28 2HG GLN 28 -9.169 12.832 -4.817
174 HE21 GLN 28 1HE2 GLN 28 -9.030 11.407 -6.674
175 HE22 GLN 28 2HE2 GLN 28 -10.377 11.251 -7.752
176 H THR 29 H THR 29 -7.437 8.720 -3.381
177 HA THR 29 HA THR 29 -7.762 8.188 -0.504
178 HB THR 29 HB THR 29 -8.645 6.007 -1.029
179 HG1 THR 29 1HG THR 29 -7.792 6.814 -3.720
180 HG21 THR 29 3HG2 THR 29 -9.954 8.298 -2.086
181 HG22 THR 29 1HG2 THR 29 -9.981 7.098 -3.400
182 HG23 THR 29 2HG2 THR 29 -10.680 6.696 -1.813
183 H CYS 30 H CYS 30 -5.439 9.305 -1.236
184 HA CYS 30 HA CYS 30 -3.555 7.493 -2.244
185 HB2 CYS 30 1HB CYS 30 -2.916 9.698 -2.427
186 HB3 CYS 30 2HB CYS 30 -3.444 10.112 -0.808
187 H TYR 31 H TYR 31 -3.893 8.830 1.133
188 HA TYR 31 HA TYR 31 -2.348 6.764 2.269
189 HB2 TYR 31 1HB TYR 31 -2.703 9.056 3.227
190 HB3 TYR 31 2HB TYR 31 -4.433 8.785 3.297
191 HD1 TYR 31 1HD TYR 31 -5.374 7.153 4.959
192 HD2 TYR 31 2HD TYR 31 -1.249 8.288 4.972
193 HE1 TYR 31 1HE TYR 31 -5.134 6.282 7.335
194 HE2 TYR 31 2HE TYR 31 -1.023 7.413 7.349
195 HH TYR 31 HH TYR 31 -2.812 5.358 8.688
196 H THR 32 H THR 32 -5.754 7.064 1.400
197 HA THR 32 HA THR 32 -6.732 5.125 3.225
198 HB THR 32 HB THR 32 -7.709 6.471 0.674
199 HG1 THR 32 1HG THR 32 -7.666 7.514 2.842
200 HG21 THR 32 3HG2 THR 32 -8.697 4.124 0.800
201 HG22 THR 32 1HG2 THR 32 -9.287 4.522 2.431
202 HG23 THR 32 2HG2 THR 32 -9.900 5.417 1.021
203 H CYS 33 H CYS 33 -5.484 4.983 -0.146
204 HA CYS 33 HA CYS 33 -6.144 2.270 -0.476
205 HB2 CYS 33 1HB CYS 33 -5.835 3.246 -2.497
206 HB3 CYS 33 2HB CYS 33 -4.558 4.304 -1.932
207 H CYS 34 H CYS 34 -3.608 4.048 1.187
208 HA CYS 34 HA CYS 34 -1.648 2.024 1.118
209 HB2 CYS 34 1HB CYS 34 -2.080 4.485 2.789
210 HB3 CYS 34 2HB CYS 34 -0.811 3.346 3.193
211 H SER 35 H SER 35 -4.737 2.174 2.497
212 HA SER 35 HA SER 35 -3.921 0.366 4.636
213 HB2 SER 35 1HB SER 35 -4.949 2.417 5.515
214 HB3 SER 35 2HB SER 35 -6.335 2.220 4.461
215 HG SER 35 HG SER 35 -7.174 1.189 6.149
216 H SER 36 H SER 36 -5.062 0.400 1.545
217 HA SER 36 HA SER 36 -7.046 -1.667 2.054
218 HB2 SER 36 1HB SER 36 -6.980 0.552 0.258
219 HB3 SER 36 2HB SER 36 -6.854 -0.884 -0.738
220 HG SER 36 HG SER 36 -9.071 -0.357 -0.394
221 H CYS 37 H CYS 37 -4.155 -0.807 0.045
222 HA CYS 37 HA CYS 37 -3.932 -3.582 -0.765
223 HB2 CYS 37 1HB CYS 37 -2.982 -0.997 -1.785
224 HB3 CYS 37 2HB CYS 37 -1.775 -2.265 -1.848
225 H PHE 38 H PHE 38 -3.608 -2.769 2.074
226 HA PHE 38 HA PHE 38 -1.048 -3.987 2.498
227 HB2 PHE 38 1HB PHE 38 -1.751 -1.093 3.249
228 HB3 PHE 38 2HB PHE 38 -0.480 -1.964 4.084
229 HD1 PHE 38 2HD PHE 38 0.907 -3.379 1.963
230 HD2 PHE 38 1HD PHE 38 -0.748 0.528 1.947
231 HE1 PHE 38 2HE PHE 38 2.543 -2.694 0.188
232 HE2 PHE 38 1HE PHE 38 0.889 1.213 0.171
233 HZ PHE 38 HZ PHE 38 2.515 -0.406 -0.687
234 H ASP 39 H ASP 39 -0.651 -4.226 4.970
235 HA ASP 39 HA ASP 39 -3.270 -4.618 6.186
236 HB2 ASP 39 1HB ASP 39 -2.106 -6.731 5.857
237 HB3 ASP 39 2HB ASP 39 -0.619 -6.084 6.523
238 H VAL 40 H VAL 40 -0.358 -5.140 8.079
239 HA VAL 40 HA VAL 40 -0.960 -2.740 9.622
240 HB VAL 40 HB VAL 40 -0.890 -4.977 10.692
241 HG11 VAL 40 1HG1 VAL 40 2.101 -4.876 10.189
242 HG12 VAL 40 2HG1 VAL 40 1.181 -6.160 11.010
243 HG13 VAL 40 3HG1 VAL 40 0.963 -5.885 9.264
244 HG21 VAL 40 3HG2 VAL 40 1.081 -2.855 11.575
245 HG22 VAL 40 1HG2 VAL 40 -0.589 -3.116 12.132
246 HG23 VAL 40 2HG2 VAL 40 0.686 -4.279 12.567
247 H VAL 41 H VAL 41 1.900 -4.518 8.249
248 HA VAL 41 HA VAL 41 3.597 -2.267 8.634
249 HB VAL 41 HB VAL 41 4.054 -4.652 6.845
250 HG11 VAL 41 1HG1 VAL 41 5.682 -2.757 6.766
251 HG12 VAL 41 2HG1 VAL 41 6.001 -3.013 8.499
252 HG13 VAL 41 3HG1 VAL 41 6.392 -4.291 7.324
253 HG21 VAL 41 3HG2 VAL 41 5.172 -5.591 8.999
254 HG22 VAL 41 1HG2 VAL 41 4.093 -4.462 9.853
255 HG23 VAL 41 2HG2 VAL 41 3.408 -5.731 8.808
256 H GLY 42 H GLY 42 1.946 -3.799 5.796
257 HA2 GLY 42 1HA GLY 42 2.886 -2.277 3.749
258 HA3 GLY 42 2HA GLY 42 1.243 -2.876 3.862
259 H GLU 43 H GLU 43 0.419 -1.372 6.224
260 HA GLU 43 HA GLU 43 -0.033 1.122 4.891
261 HB2 GLU 43 1HB GLU 43 -1.785 -0.299 6.170
262 HB3 GLU 43 2HB GLU 43 -1.055 0.318 7.639
263 HG2 GLU 43 1HG GLU 43 -1.363 2.669 6.290
264 HG3 GLU 43 2HG GLU 43 -2.678 1.762 5.570
265 H GLN 44 H GLN 44 1.594 -0.138 7.845
266 HA GLN 44 HA GLN 44 2.180 2.364 8.911
267 HB2 GLN 44 1HB GLN 44 3.432 -0.385 9.264
268 HB3 GLN 44 2HB GLN 44 4.003 1.011 10.156
269 HG2 GLN 44 1HG GLN 44 1.064 0.774 10.240
270 HG3 GLN 44 2HG GLN 44 1.855 -0.654 10.875
271 HE21 GLN 44 1HE2 GLN 44 1.262 2.735 11.246
272 HE22 GLN 44 2HE2 GLN 44 1.930 2.947 12.830
273 H ALA 45 H ALA 45 3.620 0.442 6.324
274 HA ALA 45 HA ALA 45 6.075 1.970 6.355
275 HB1 ALA 45 3HB ALA 45 4.956 -0.285 4.658
276 HB2 ALA 45 1HB ALA 45 6.492 0.529 4.276
277 HB3 ALA 45 2HB ALA 45 6.306 -0.342 5.817
278 H CYS 46 H CYS 46 3.079 1.594 4.371
279 HA CYS 46 HA CYS 46 3.889 3.436 2.413
280 HB2 CYS 46 1HB CYS 46 2.112 1.669 2.192
281 HB3 CYS 46 2HB CYS 46 1.061 2.679 3.166
282 H GLN 47 H GLN 47 2.280 3.628 5.597
283 HA GLN 47 HA GLN 47 1.166 6.111 5.404
284 HB2 GLN 47 1HB GLN 47 2.134 4.349 7.603
285 HB3 GLN 47 2HB GLN 47 1.994 6.044 8.028
286 HG2 GLN 47 1HG GLN 47 -0.371 5.668 6.658
287 HG3 GLN 47 2HG GLN 47 -0.145 4.075 7.354
288 HE21 GLN 47 1HE2 GLN 47 -1.325 3.887 9.092
289 HE22 GLN 47 2HE2 GLN 47 -1.492 5.033 10.380
290 H MET 48 H MET 48 4.565 5.147 6.035
291 HA MET 48 HA MET 48 5.372 7.777 6.678
292 HB2 MET 48 1HB MET 48 6.772 5.156 5.984
293 HB3 MET 48 2HB MET 48 7.711 6.623 6.181
294 HG2 MET 48 1HG MET 48 6.201 6.771 8.451
295 HG3 MET 48 2HG MET 48 6.215 5.031 8.242
296 HE1 MET 48 3HE MET 48 8.629 6.451 10.938
297 HE2 MET 48 1HE MET 48 8.785 7.877 9.885
298 HE3 MET 48 2HE MET 48 7.179 7.181 10.208
299 H SER 49 H SER 49 5.176 5.797 3.712
300 HA SER 49 HA SER 49 6.618 7.821 2.250
301 HB2 SER 49 1HB SER 49 5.669 5.019 1.696
302 HB3 SER 49 2HB SER 49 5.898 6.083 0.322
303 HG SER 49 HG SER 49 7.847 5.221 2.265
304 H ALA 50 H ALA 50 3.638 7.742 3.501
305 HA ALA 50 HA ALA 50 1.893 7.999 1.331
306 HB1 ALA 50 3HB ALA 50 0.345 8.826 2.967
307 HB2 ALA 50 1HB ALA 50 1.354 7.610 3.788
308 HB3 ALA 50 2HB ALA 50 1.662 9.344 4.047
309 H GLN 51 H GLN 51 2.916 9.292 -0.290
310 HA GLN 51 HA GLN 51 3.459 12.025 0.498
311 HB2 GLN 51 1HB GLN 51 4.761 10.242 -1.232
312 HB3 GLN 51 2HB GLN 51 3.939 11.338 -2.325
313 HG2 GLN 51 1HG GLN 51 5.428 12.519 0.022
314 HG3 GLN 51 2HG GLN 51 6.364 11.913 -1.330
315 HE21 GLN 51 1HE2 GLN 51 6.686 14.441 -0.929
316 HE22 GLN 51 2HE2 GLN 51 5.824 15.453 -2.039
317 H CYS 52 H CYS 52 0.939 12.074 0.813
318 HA CYS 52 HA CYS 52 -0.429 12.388 -1.727
319 HB2 CYS 52 1HB CYS 52 -1.838 12.839 0.850
320 HB3 CYS 52 2HB CYS 52 -2.397 12.076 -0.625
Start of MODEL 20
1 H1 ASN 1 1H ASN 1 9.632 -3.265 2.035
2 HA ASN 1 HA ASN 1 10.005 -4.569 -0.339
3 HB2 ASN 1 1HB ASN 1 11.555 -5.810 1.669
4 HB3 ASN 1 2HB ASN 1 10.109 -6.798 1.606
5 HD21 ASN 1 1HD2 ASN 1 12.552 -7.791 0.893
6 HD22 ASN 1 2HD2 ASN 1 12.617 -8.119 -0.807
7 HA PRO 2 HA PRO 2 5.832 -4.797 1.234
8 HB2 PRO 2 1HB PRO 2 4.563 -4.710 -1.185
9 HB3 PRO 2 2HB PRO 2 5.012 -3.274 -0.287
10 HG2 PRO 2 1HG PRO 2 6.282 -4.426 -2.695
11 HG3 PRO 2 2HG PRO 2 6.433 -2.806 -2.043
12 HD2 PRO 2 1HD PRO 2 8.355 -4.926 -1.838
13 HD3 PRO 2 2HD PRO 2 8.454 -3.345 -1.087
14 H GLU 3 H GLU 3 7.728 -7.002 -0.200
15 HA GLU 3 HA GLU 3 5.954 -8.879 -1.114
16 HB2 GLU 3 1HB GLU 3 7.810 -10.528 -0.563
17 HB3 GLU 3 2HB GLU 3 8.300 -9.157 -1.538
18 HG2 GLU 3 1HG GLU 3 9.927 -8.790 0.007
19 HG3 GLU 3 2HG GLU 3 8.660 -8.209 1.069
20 H ASP 4 H ASP 4 7.089 -8.155 2.220
21 HA ASP 4 HA ASP 4 5.797 -10.418 3.311
22 HB2 ASP 4 1HB ASP 4 7.783 -8.886 4.215
23 HB3 ASP 4 2HB ASP 4 6.483 -7.934 4.902
24 H TRP 5 H TRP 5 5.140 -6.887 2.932
25 HA TRP 5 HA TRP 5 2.577 -7.170 4.278
26 HB2 TRP 5 1HB TRP 5 3.152 -4.580 3.091
27 HB3 TRP 5 2HB TRP 5 2.736 -5.004 4.740
28 HD1 TRP 5 HD TRP 5 5.163 -6.425 5.913
29 HE1 TRP 5 1HE TRP 5 7.599 -5.427 6.100
30 HE3 TRP 5 3HE TRP 5 4.593 -2.961 2.234
31 HZ2 TRP 5 2HZ TRP 5 8.983 -3.348 4.719
32 HZ3 TRP 5 3HZ TRP 5 6.536 -1.487 1.716
33 HH2 TRP 5 HH TRP 5 8.674 -1.639 2.891
34 H PHE 6 H PHE 6 1.361 -5.032 2.581
35 HA PHE 6 HA PHE 6 0.045 -4.879 0.820
36 HB2 PHE 6 1HB PHE 6 2.115 -4.696 -0.469
37 HB3 PHE 6 2HB PHE 6 2.461 -6.404 -0.283
38 HD1 PHE 6 1HD PHE 6 -0.288 -4.279 -1.671
39 HD2 PHE 6 2HD PHE 6 2.174 -7.701 -2.157
40 HE1 PHE 6 1HE PHE 6 -1.366 -4.739 -3.891
41 HE2 PHE 6 2HE PHE 6 1.097 -8.161 -4.377
42 HZ PHE 6 HZ PHE 6 -0.660 -6.675 -5.217
43 H THR 7 H THR 7 -1.895 -5.897 0.714
44 HA THR 7 HA THR 7 -1.845 -8.836 0.496
45 HB THR 7 HB THR 7 -4.111 -8.627 1.661
46 HG1 THR 7 1HG THR 7 -4.774 -6.530 1.966
47 HG21 THR 7 3HG2 THR 7 -2.984 -8.878 3.631
48 HG22 THR 7 1HG2 THR 7 -1.501 -8.317 2.823
49 HG23 THR 7 2HG2 THR 7 -2.572 -7.147 3.630
50 HA PRO 8 HA PRO 8 -3.574 -7.627 -3.388
51 HB2 PRO 8 1HB PRO 8 -2.607 -9.746 -4.817
52 HB3 PRO 8 2HB PRO 8 -1.741 -8.233 -4.642
53 HG2 PRO 8 1HG PRO 8 -1.223 -10.828 -3.325
54 HG3 PRO 8 2HG PRO 8 -0.151 -9.452 -3.499
55 HD2 PRO 8 1HD PRO 8 -1.579 -10.226 -1.135
56 HD3 PRO 8 2HD PRO 8 -0.600 -8.788 -1.344
57 H ASP 9 H ASP 9 -4.000 -10.257 -1.337
58 HA ASP 9 HA ASP 9 -5.883 -11.606 -2.919
59 HB2 ASP 9 1HB ASP 9 -4.589 -11.970 -0.421
60 HB3 ASP 9 2HB ASP 9 -6.294 -11.884 -0.026
61 H THR 10 H THR 10 -5.897 -8.591 -1.308
62 HA THR 10 HA THR 10 -8.813 -8.481 -1.437
63 HB THR 10 HB THR 10 -8.163 -9.087 0.926
64 HG1 THR 10 1HG THR 10 -9.951 -7.771 1.046
65 HG21 THR 10 3HG2 THR 10 -7.249 -6.464 1.721
66 HG22 THR 10 1HG2 THR 10 -6.427 -8.024 1.960
67 HG23 THR 10 2HG2 THR 10 -6.132 -7.080 0.480
68 H CYS 11 H CYS 11 -6.962 -7.554 -3.344
69 HA CYS 11 HA CYS 11 -7.516 -4.719 -3.086
70 HB2 CYS 11 1HB CYS 11 -5.023 -5.553 -2.443
71 HB3 CYS 11 2HB CYS 11 -4.833 -5.344 -4.173
72 H ALA 12 H ALA 12 -6.898 -3.677 -5.385
73 HA ALA 12 HA ALA 12 -8.212 -5.348 -7.331
74 HB1 ALA 12 3HB ALA 12 -8.999 -3.262 -7.722
75 HB2 ALA 12 1HB ALA 12 -7.623 -2.490 -6.897
76 HB3 ALA 12 2HB ALA 12 -7.469 -3.003 -8.595
77 H TYR 13 H TYR 13 -4.958 -3.994 -6.647
78 HA TYR 13 HA TYR 13 -3.921 -5.067 -9.126
79 HB2 TYR 13 1HB TYR 13 -2.507 -3.892 -6.661
80 HB3 TYR 13 2HB TYR 13 -1.883 -3.918 -8.298
81 HD1 TYR 13 2HD TYR 13 -3.573 -2.701 -10.065
82 HD2 TYR 13 1HD TYR 13 -3.276 -1.852 -5.882
83 HE1 TYR 13 2HE TYR 13 -4.531 -0.379 -10.461
84 HE2 TYR 13 1HE TYR 13 -4.235 0.466 -6.292
85 HH TYR 13 HH TYR 13 -4.888 1.592 -9.580
86 H GLY 14 H GLY 14 -2.224 -6.665 -9.245
87 HA2 GLY 14 1HA GLY 14 -2.340 -8.569 -6.995
88 HA3 GLY 14 2HA GLY 14 -2.018 -8.964 -8.671
89 H ASP 15 H ASP 15 -0.334 -6.221 -8.575
90 HA ASP 15 HA ASP 15 2.078 -7.630 -7.861
91 HB2 ASP 15 1HB ASP 15 1.945 -4.807 -8.965
92 HB3 ASP 15 2HB ASP 15 3.235 -5.980 -9.143
93 H SER 16 H SER 16 3.551 -6.800 -6.234
94 HA SER 16 HA SER 16 2.253 -5.184 -4.273
95 HB2 SER 16 1HB SER 16 4.351 -5.630 -2.948
96 HB3 SER 16 2HB SER 16 3.533 -7.082 -3.491
97 HG SER 16 HG SER 16 5.348 -7.640 -4.460
98 H ASN 17 H ASN 17 4.955 -4.945 -6.627
99 HA ASN 17 HA ASN 17 6.014 -2.578 -5.653
100 HB2 ASN 17 1HB ASN 17 5.969 -3.762 -8.477
101 HB3 ASN 17 2HB ASN 17 6.940 -2.370 -8.040
102 HD21 ASN 17 1HD2 ASN 17 8.279 -4.387 -9.021
103 HD22 ASN 17 2HD2 ASN 17 9.162 -5.278 -7.826
104 H THR 18 H THR 18 3.671 -3.312 -8.345
105 HA THR 18 HA THR 18 3.191 -0.593 -8.979
106 HB THR 18 HB THR 18 2.780 -3.003 -10.202
107 HG1 THR 18 1HG THR 18 2.664 -0.686 -10.970
108 HG21 THR 18 3HG2 THR 18 -0.036 -2.047 -9.590
109 HG22 THR 18 1HG2 THR 18 0.489 -3.605 -10.272
110 HG23 THR 18 2HG2 THR 18 0.721 -3.269 -8.540
111 H ALA 19 H ALA 19 1.737 -2.903 -6.678
112 HA ALA 19 HA ALA 19 -0.589 -1.460 -6.160
113 HB1 ALA 19 3HB ALA 19 1.095 -3.461 -4.643
114 HB2 ALA 19 1HB ALA 19 -0.331 -2.713 -3.883
115 HB3 ALA 19 2HB ALA 19 -0.515 -3.671 -5.372
116 H TRP 20 H TRP 20 2.549 -1.522 -4.314
117 HA TRP 20 HA TRP 20 1.885 0.512 -2.561
118 HB2 TRP 20 1HB TRP 20 3.737 -0.915 -2.126
119 HB3 TRP 20 2HB TRP 20 4.536 -0.462 -3.619
120 HD1 TRP 20 HD TRP 20 5.027 2.476 -3.620
121 HE1 TRP 20 1HE TRP 20 6.211 3.909 -1.746
122 HE3 TRP 20 3HE TRP 20 4.228 -0.837 0.154
123 HZ2 TRP 20 2HZ TRP 20 6.669 3.505 1.041
124 HZ3 TRP 20 3HZ TRP 20 5.076 -0.240 2.421
125 HH2 TRP 20 HH TRP 20 6.260 1.845 2.895
126 H THR 21 H THR 21 3.555 0.587 -5.782
127 HA THR 21 HA THR 21 4.032 3.319 -5.870
128 HB THR 21 HB THR 21 3.810 1.013 -7.779
129 HG1 THR 21 1HG THR 21 5.810 1.707 -6.768
130 HG21 THR 21 3HG2 THR 21 4.510 2.957 -9.528
131 HG22 THR 21 1HG2 THR 21 2.822 2.418 -9.368
132 HG23 THR 21 2HG2 THR 21 3.366 3.898 -8.541
133 H THR 22 H THR 22 1.203 1.510 -7.250
134 HA THR 22 HA THR 22 -0.156 3.828 -8.039
135 HB THR 22 HB THR 22 -1.186 1.041 -7.285
136 HG1 THR 22 1HG THR 22 0.144 0.695 -9.038
137 HG21 THR 22 3HG2 THR 22 -2.325 3.359 -8.906
138 HG22 THR 22 1HG2 THR 22 -2.798 1.677 -9.244
139 HG23 THR 22 2HG2 THR 22 -3.136 2.393 -7.650
140 H CYS 23 H CYS 23 0.463 2.536 -4.888
141 HA CYS 23 HA CYS 23 -1.888 3.740 -3.748
142 HB2 CYS 23 1HB CYS 23 0.108 1.816 -2.928
143 HB3 CYS 23 2HB CYS 23 -0.075 3.061 -1.708
144 H THR 24 H THR 24 1.642 4.307 -4.121
145 HA THR 24 HA THR 24 1.526 6.711 -2.507
146 HB THR 24 HB THR 24 4.010 6.735 -3.267
147 HG1 THR 24 1HG THR 24 3.865 5.412 -5.125
148 HG21 THR 24 3HG2 THR 24 4.647 5.110 -1.679
149 HG22 THR 24 1HG2 THR 24 2.980 5.451 -1.159
150 HG23 THR 24 2HG2 THR 24 3.328 4.006 -2.138
151 H THR 25 H THR 25 -0.301 7.486 -4.025
152 HA THR 25 HA THR 25 0.983 9.291 -5.911
153 HB THR 25 HB THR 25 -0.864 8.613 -7.610
154 HG1 THR 25 1HG THR 25 -1.417 6.241 -7.063
155 HG21 THR 25 3HG2 THR 25 1.705 7.619 -7.324
156 HG22 THR 25 1HG2 THR 25 0.738 6.129 -7.198
157 HG23 THR 25 2HG2 THR 25 0.603 7.159 -8.644
158 HA PRO 26 HA PRO 26 -1.965 11.992 -4.362
159 HB2 PRO 26 1HB PRO 26 -2.172 13.837 -6.367
160 HB3 PRO 26 2HB PRO 26 -0.853 13.820 -5.214
161 HG2 PRO 26 1HG PRO 26 -0.849 12.972 -8.046
162 HG3 PRO 26 2HG PRO 26 0.513 13.363 -7.014
163 HD2 PRO 26 1HD PRO 26 -0.363 10.742 -7.780
164 HD3 PRO 26 2HD PRO 26 0.926 11.130 -6.657
165 H GLY 27 H GLY 27 -4.046 11.706 -3.905
166 HA2 GLY 27 1HA GLY 27 -5.979 11.893 -5.985
167 HA3 GLY 27 2HA GLY 27 -5.715 10.222 -5.530
168 H GLN 28 H GLN 28 -7.966 10.214 -4.736
169 HA GLN 28 HA GLN 28 -8.475 11.886 -2.458
170 HB2 GLN 28 1HB GLN 28 -10.123 9.908 -4.063
171 HB3 GLN 28 2HB GLN 28 -10.711 10.520 -2.530
172 HG2 GLN 28 1HG GLN 28 -11.474 12.348 -3.633
173 HG3 GLN 28 2HG GLN 28 -9.806 12.828 -3.879
174 HE21 GLN 28 1HE2 GLN 28 -12.693 11.850 -5.311
175 HE22 GLN 28 2HE2 GLN 28 -12.158 11.615 -6.942
176 H THR 29 H THR 29 -7.581 8.540 -3.246
177 HA THR 29 HA THR 29 -7.641 7.929 -0.362
178 HB THR 29 HB THR 29 -8.024 5.555 -1.120
179 HG1 THR 29 1HG THR 29 -8.076 5.227 -3.361
180 HG21 THR 29 3HG2 THR 29 -9.982 7.530 -2.410
181 HG22 THR 29 1HG2 THR 29 -10.319 5.824 -2.027
182 HG23 THR 29 2HG2 THR 29 -10.054 6.996 -0.713
183 H CYS 30 H CYS 30 -5.490 9.344 -1.133
184 HA CYS 30 HA CYS 30 -3.437 7.784 -2.235
185 HB2 CYS 30 1HB CYS 30 -3.138 10.085 -2.389
186 HB3 CYS 30 2HB CYS 30 -3.549 10.364 -0.708
187 H TYR 31 H TYR 31 -4.260 8.788 1.167
188 HA TYR 31 HA TYR 31 -2.323 6.917 2.216
189 HB2 TYR 31 1HB TYR 31 -2.682 9.147 3.250
190 HB3 TYR 31 2HB TYR 31 -4.415 8.893 3.303
191 HD1 TYR 31 1HD TYR 31 -5.390 7.266 4.943
192 HD2 TYR 31 2HD TYR 31 -1.246 8.327 4.991
193 HE1 TYR 31 1HE TYR 31 -5.179 6.363 7.310
194 HE2 TYR 31 2HE TYR 31 -1.049 7.421 7.358
195 HH TYR 31 HH TYR 31 -2.674 5.429 8.663
196 H THR 32 H THR 32 -5.758 7.047 1.461
197 HA THR 32 HA THR 32 -6.576 5.065 3.329
198 HB THR 32 HB THR 32 -7.762 6.212 0.751
199 HG1 THR 32 1HG THR 32 -8.171 6.473 3.648
200 HG21 THR 32 3HG2 THR 32 -9.552 4.807 0.970
201 HG22 THR 32 1HG2 THR 32 -8.591 3.858 2.129
202 HG23 THR 32 2HG2 THR 32 -9.658 5.158 2.712
203 H CYS 33 H CYS 33 -5.489 4.998 -0.102
204 HA CYS 33 HA CYS 33 -6.053 2.287 -0.469
205 HB2 CYS 33 1HB CYS 33 -5.772 3.440 -2.437
206 HB3 CYS 33 2HB CYS 33 -4.375 4.328 -1.861
207 H CYS 34 H CYS 34 -3.492 4.085 1.169
208 HA CYS 34 HA CYS 34 -1.524 2.084 1.078
209 HB2 CYS 34 1HB CYS 34 -1.987 4.533 2.744
210 HB3 CYS 34 2HB CYS 34 -0.744 3.391 3.215
211 H SER 35 H SER 35 -4.607 2.189 2.497
212 HA SER 35 HA SER 35 -3.755 0.332 4.580
213 HB2 SER 35 1HB SER 35 -4.784 2.347 5.527
214 HB3 SER 35 2HB SER 35 -6.175 2.183 4.475
215 HG SER 35 HG SER 35 -7.055 0.906 5.938
216 H SER 36 H SER 36 -4.930 0.429 1.504
217 HA SER 36 HA SER 36 -6.901 -1.656 1.985
218 HB2 SER 36 1HB SER 36 -7.325 0.520 0.540
219 HB3 SER 36 2HB SER 36 -6.433 -0.339 -0.700
220 HG SER 36 HG SER 36 -8.376 -1.161 -1.139
221 H CYS 37 H CYS 37 -3.998 -0.756 0.021
222 HA CYS 37 HA CYS 37 -3.787 -3.505 -0.878
223 HB2 CYS 37 1HB CYS 37 -2.873 -0.903 -1.838
224 HB3 CYS 37 2HB CYS 37 -1.601 -2.108 -1.864
225 H PHE 38 H PHE 38 -3.483 -2.782 1.989
226 HA PHE 38 HA PHE 38 -0.939 -4.034 2.399
227 HB2 PHE 38 1HB PHE 38 -1.624 -1.173 3.295
228 HB3 PHE 38 2HB PHE 38 -0.312 -2.085 4.014
229 HD1 PHE 38 2HD PHE 38 1.271 -3.206 2.071
230 HD2 PHE 38 1HD PHE 38 -0.983 0.373 1.725
231 HE1 PHE 38 2HE PHE 38 2.819 -2.406 0.264
232 HE2 PHE 38 1HE PHE 38 0.565 1.173 -0.082
233 HZ PHE 38 HZ PHE 38 2.447 -0.226 -0.791
234 H ASP 39 H ASP 39 -0.554 -4.169 4.945
235 HA ASP 39 HA ASP 39 -3.188 -4.696 6.076
236 HB2 ASP 39 1HB ASP 39 -1.905 -6.752 5.780
237 HB3 ASP 39 2HB ASP 39 -0.486 -6.037 6.519
238 H VAL 40 H VAL 40 -0.345 -5.102 8.083
239 HA VAL 40 HA VAL 40 -1.062 -2.682 9.550
240 HB VAL 40 HB VAL 40 -1.053 -4.893 10.673
241 HG11 VAL 40 1HG1 VAL 40 0.993 -6.069 11.133
242 HG12 VAL 40 2HG1 VAL 40 0.883 -5.827 9.373
243 HG13 VAL 40 3HG1 VAL 40 1.963 -4.800 10.348
244 HG21 VAL 40 3HG2 VAL 40 -0.869 -3.209 12.229
245 HG22 VAL 40 1HG2 VAL 40 0.646 -4.090 12.539
246 HG23 VAL 40 2HG2 VAL 40 0.666 -2.603 11.560
247 H VAL 41 H VAL 41 1.880 -4.482 8.395
248 HA VAL 41 HA VAL 41 3.555 -2.231 8.837
249 HB VAL 41 HB VAL 41 4.026 -4.703 7.161
250 HG11 VAL 41 1HG1 VAL 41 5.981 -2.845 8.558
251 HG12 VAL 41 2HG1 VAL 41 6.394 -4.293 7.609
252 HG13 VAL 41 3HG1 VAL 41 5.656 -2.885 6.808
253 HG21 VAL 41 3HG2 VAL 41 3.583 -5.725 9.155
254 HG22 VAL 41 1HG2 VAL 41 5.284 -5.289 9.450
255 HG23 VAL 41 2HG2 VAL 41 3.978 -4.278 10.114
256 H GLY 42 H GLY 42 1.973 -3.741 5.956
257 HA2 GLY 42 1HA GLY 42 3.065 -2.179 3.965
258 HA3 GLY 42 2HA GLY 42 1.458 -2.879 3.945
259 H GLU 43 H GLU 43 0.531 -1.395 6.377
260 HA GLU 43 HA GLU 43 -0.157 1.004 4.981
261 HB2 GLU 43 1HB GLU 43 -1.660 -0.558 6.501
262 HB3 GLU 43 2HB GLU 43 -0.996 0.384 7.821
263 HG2 GLU 43 1HG GLU 43 -1.956 2.001 5.507
264 HG3 GLU 43 2HG GLU 43 -3.212 1.109 6.342
265 H GLN 44 H GLN 44 1.464 0.089 8.096
266 HA GLN 44 HA GLN 44 2.012 2.714 8.830
267 HB2 GLN 44 1HB GLN 44 3.219 1.777 10.617
268 HB3 GLN 44 2HB GLN 44 2.072 0.512 10.227
269 HG2 GLN 44 1HG GLN 44 3.947 -0.814 10.184
270 HG3 GLN 44 2HG GLN 44 4.092 -0.211 8.546
271 HE21 GLN 44 1HE2 GLN 44 6.242 -0.180 8.332
272 HE22 GLN 44 2HE2 GLN 44 7.335 0.795 9.258
273 H ALA 45 H ALA 45 3.481 0.533 6.509
274 HA ALA 45 HA ALA 45 5.982 1.985 6.466
275 HB1 ALA 45 3HB ALA 45 6.630 0.326 4.821
276 HB2 ALA 45 1HB ALA 45 5.801 -0.506 6.159
277 HB3 ALA 45 2HB ALA 45 4.943 -0.207 4.628
278 H CYS 46 H CYS 46 2.941 1.649 4.582
279 HA CYS 46 HA CYS 46 3.895 3.303 2.473
280 HB2 CYS 46 1HB CYS 46 2.165 1.514 2.226
281 HB3 CYS 46 2HB CYS 46 1.049 2.518 3.130
282 H GLN 47 H GLN 47 2.342 3.685 5.626
283 HA GLN 47 HA GLN 47 1.070 6.076 5.282
284 HB2 GLN 47 1HB GLN 47 2.237 4.568 7.573
285 HB3 GLN 47 2HB GLN 47 1.995 6.279 7.861
286 HG2 GLN 47 1HG GLN 47 -0.392 5.693 6.670
287 HG3 GLN 47 2HG GLN 47 -0.035 4.127 7.370
288 HE21 GLN 47 1HE2 GLN 47 -1.114 3.890 9.168
289 HE22 GLN 47 2HE2 GLN 47 -1.286 5.041 10.451
290 H MET 48 H MET 48 4.443 5.552 6.557
291 HA MET 48 HA MET 48 5.051 8.266 6.542
292 HB2 MET 48 1HB MET 48 6.729 5.706 6.500
293 HB3 MET 48 2HB MET 48 7.480 7.286 6.604
294 HG2 MET 48 1HG MET 48 5.718 7.620 8.607
295 HG3 MET 48 2HG MET 48 5.753 5.869 8.636
296 HE1 MET 48 3HE MET 48 9.431 4.999 9.333
297 HE2 MET 48 1HE MET 48 7.763 4.456 9.637
298 HE3 MET 48 2HE MET 48 8.295 4.810 7.976
299 H SER 49 H SER 49 4.534 6.146 3.940
300 HA SER 49 HA SER 49 6.471 7.494 2.262
301 HB2 SER 49 1HB SER 49 6.220 5.722 0.730
302 HB3 SER 49 2HB SER 49 6.065 4.924 2.283
303 HG SER 49 HG SER 49 3.869 5.787 0.598
304 H ALA 50 H ALA 50 3.001 7.207 2.963
305 HA ALA 50 HA ALA 50 1.857 8.137 0.669
306 HB1 ALA 50 3HB ALA 50 0.988 7.480 3.140
307 HB2 ALA 50 1HB ALA 50 0.862 9.251 3.257
308 HB3 ALA 50 2HB ALA 50 -0.013 8.379 1.975
309 H GLN 51 H GLN 51 2.644 9.784 -0.571
310 HA GLN 51 HA GLN 51 3.529 12.160 0.844
311 HB2 GLN 51 1HB GLN 51 4.721 10.752 -1.204
312 HB3 GLN 51 2HB GLN 51 3.892 12.005 -2.107
313 HG2 GLN 51 1HG GLN 51 5.431 12.837 0.349
314 HG3 GLN 51 2HG GLN 51 6.352 12.386 -1.073
315 HE21 GLN 51 1HE2 GLN 51 6.726 13.867 -2.538
316 HE22 GLN 51 2HE2 GLN 51 5.882 15.364 -2.752
317 H CYS 52 H CYS 52 0.882 12.077 1.095
318 HA CYS 52 HA CYS 52 -0.310 13.382 -1.206
319 HB2 CYS 52 1HB CYS 52 -2.010 13.057 1.141
320 HB3 CYS 52 2HB CYS 52 -2.268 12.568 -0.522