NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
19174 |
2ee3   |
10271 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 14.862 -22.244 12.837
2 HA2 GLY 1 1HA GLY 1 16.203 -23.483 11.023
3 HA3 GLY 1 2HA GLY 1 14.657 -24.253 10.693
4 H SER 2 H SER 2 13.619 -23.416 9.024
5 HA SER 2 HA SER 2 13.774 -20.512 8.579
6 HB2 SER 2 1HB SER 2 13.914 -20.888 6.158
7 HB3 SER 2 2HB SER 2 15.278 -21.641 6.984
8 HG SER 2 HG SER 2 13.677 -23.557 6.955
9 H SER 3 H SER 3 11.978 -19.607 7.419
10 HA SER 3 HA SER 3 9.511 -21.116 7.893
11 HB2 SER 3 1HB SER 3 8.371 -19.036 7.983
12 HB3 SER 3 2HB SER 3 9.882 -18.776 8.854
13 HG SER 3 HG SER 3 8.962 -17.582 6.598
14 H GLY 4 H GLY 4 8.353 -21.919 6.268
15 HA2 GLY 4 1HA GLY 4 8.748 -20.785 3.573
16 HA3 GLY 4 2HA GLY 4 8.794 -22.522 3.834
17 H SER 5 H SER 5 6.962 -20.531 2.355
18 HA SER 5 HA SER 5 4.588 -22.022 2.612
19 HB2 SER 5 1HB SER 5 4.375 -20.822 4.749
20 HB3 SER 5 2HB SER 5 4.505 -19.282 3.901
21 HG SER 5 HG SER 5 2.590 -19.956 2.722
22 H SER 6 H SER 6 3.845 -21.967 0.608
23 HA SER 6 HA SER 6 4.611 -20.012 -1.287
24 HB2 SER 6 1HB SER 6 2.515 -22.186 -1.349
25 HB3 SER 6 2HB SER 6 2.854 -21.144 -2.731
26 HG SER 6 HG SER 6 4.022 -23.279 -2.468
27 H GLY 7 H GLY 7 3.469 -18.339 -2.234
28 HA2 GLY 7 1HA GLY 7 1.261 -17.305 -0.602
29 HA3 GLY 7 2HA GLY 7 2.242 -16.370 -1.722
30 H LEU 8 H LEU 8 -0.774 -17.335 -1.273
31 HA LEU 8 HA LEU 8 -1.531 -18.504 -3.732
32 HB2 LEU 8 1HB LEU 8 -2.970 -17.081 -1.539
33 HB3 LEU 8 2HB LEU 8 -3.812 -17.420 -3.049
34 HG LEU 8 HG LEU 8 -4.283 -19.100 -1.329
35 HD11 LEU 8 1HD1 LEU 8 -4.226 -20.888 -2.759
36 HD12 LEU 8 2HD1 LEU 8 -2.599 -20.522 -3.331
37 HD13 LEU 8 3HD1 LEU 8 -3.967 -19.561 -3.891
38 HD21 LEU 8 3HD2 LEU 8 -1.334 -19.714 -1.489
39 HD22 LEU 8 1HD2 LEU 8 -2.540 -20.627 -0.582
40 HD23 LEU 8 2HD2 LEU 8 -2.159 -18.968 -0.120
41 H ALA 9 H ALA 9 -2.396 -17.609 -5.593
42 HA ALA 9 HA ALA 9 -1.323 -15.165 -6.463
43 HB1 ALA 9 3HB ALA 9 -2.142 -17.179 -7.839
44 HB2 ALA 9 1HB ALA 9 -3.729 -16.417 -7.737
45 HB3 ALA 9 2HB ALA 9 -2.387 -15.561 -8.496
46 HA PRO 10 HA PRO 10 -4.150 -12.174 -4.902
47 HB2 PRO 10 1HB PRO 10 -3.736 -10.199 -6.718
48 HB3 PRO 10 2HB PRO 10 -2.565 -10.606 -5.458
49 HG2 PRO 10 1HG PRO 10 -2.599 -11.405 -8.343
50 HG3 PRO 10 2HG PRO 10 -1.234 -10.865 -7.347
51 HD2 PRO 10 1HD PRO 10 -1.686 -13.475 -7.907
52 HD3 PRO 10 2HD PRO 10 -0.956 -12.938 -6.380
53 HA PRO 11 HA PRO 11 -7.899 -12.726 -7.176
54 HB2 PRO 11 1HB PRO 11 -9.383 -10.797 -5.971
55 HB3 PRO 11 2HB PRO 11 -8.980 -12.330 -5.188
56 HG2 PRO 11 1HG PRO 11 -7.693 -9.646 -4.872
57 HG3 PRO 11 2HG PRO 11 -8.115 -10.838 -3.628
58 HD2 PRO 11 1HD PRO 11 -5.595 -10.551 -4.577
59 HD3 PRO 11 2HD PRO 11 -6.240 -12.115 -4.038
60 H ARG 12 H ARG 12 -6.957 -9.325 -6.627
61 HA ARG 12 HA ARG 12 -7.618 -8.785 -9.445
62 HB2 ARG 12 1HB ARG 12 -8.028 -6.874 -7.139
63 HB3 ARG 12 2HB ARG 12 -8.440 -6.588 -8.825
64 HG2 ARG 12 1HG ARG 12 -9.651 -8.877 -7.328
65 HG3 ARG 12 2HG ARG 12 -10.303 -7.244 -7.174
66 HD2 ARG 12 1HD ARG 12 -11.568 -7.999 -8.917
67 HD3 ARG 12 2HD ARG 12 -10.201 -7.333 -9.809
68 HE ARG 12 HE ARG 12 -9.711 -10.041 -9.211
69 HH11 ARG 12 1HH1 ARG 12 -11.707 -8.036 -11.240
70 HH12 ARG 12 2HH1 ARG 12 -11.867 -9.231 -12.485
71 HH21 ARG 12 1HH2 ARG 12 -9.915 -11.622 -10.843
72 HH22 ARG 12 2HH2 ARG 12 -10.848 -11.270 -12.258
73 H HIS 13 H HIS 13 -6.695 -6.349 -9.851
74 HA HIS 13 HA HIS 13 -3.829 -6.580 -9.247
75 HB2 HIS 13 1HB HIS 13 -3.367 -5.485 -11.271
76 HB3 HIS 13 2HB HIS 13 -4.721 -6.540 -11.663
77 HD1 HIS 13 1HD HIS 13 -3.807 -3.671 -12.963
78 HD2 HIS 13 2HD HIS 13 -7.113 -4.497 -10.586
79 HE1 HIS 13 1HE HIS 13 -5.477 -1.864 -13.482
80 HE2 HIS 13 2HE HIS 13 -7.435 -2.336 -11.970
81 H LEU 14 H LEU 14 -2.617 -4.669 -8.757
82 HA LEU 14 HA LEU 14 -4.204 -2.718 -7.254
83 HB2 LEU 14 1HB LEU 14 -1.435 -3.768 -7.067
84 HB3 LEU 14 2HB LEU 14 -1.714 -2.107 -6.545
85 HG LEU 14 HG LEU 14 -3.363 -4.364 -5.457
86 HD11 LEU 14 1HD1 LEU 14 -0.771 -3.390 -4.274
87 HD12 LEU 14 2HD1 LEU 14 -0.944 -4.896 -5.175
88 HD13 LEU 14 3HD1 LEU 14 -1.819 -4.669 -3.661
89 HD21 LEU 14 3HD2 LEU 14 -4.348 -2.575 -4.545
90 HD22 LEU 14 1HD2 LEU 14 -3.003 -1.510 -4.954
91 HD23 LEU 14 2HD2 LEU 14 -2.931 -2.502 -3.497
92 H GLY 15 H GLY 15 -3.583 -0.445 -7.324
93 HA2 GLY 15 1HA GLY 15 -2.198 0.361 -9.788
94 HA3 GLY 15 2HA GLY 15 -3.827 0.952 -9.495
95 H PHE 16 H PHE 16 -0.803 1.956 -9.453
96 HA PHE 16 HA PHE 16 -1.107 3.569 -7.009
97 HB2 PHE 16 1HB PHE 16 1.412 2.914 -8.553
98 HB3 PHE 16 2HB PHE 16 1.332 3.897 -7.094
99 HD1 PHE 16 1HD PHE 16 0.587 2.824 -4.950
100 HD2 PHE 16 2HD PHE 16 1.532 0.577 -8.439
101 HE1 PHE 16 1HE PHE 16 0.849 0.802 -3.572
102 HE2 PHE 16 2HE PHE 16 1.795 -1.448 -7.067
103 HZ PHE 16 HZ PHE 16 1.453 -1.338 -4.631
104 H SER 17 H SER 17 -1.613 5.631 -7.281
105 HA SER 17 HA SER 17 -0.675 7.034 -9.681
106 HB2 SER 17 1HB SER 17 -3.154 6.202 -9.767
107 HB3 SER 17 2HB SER 17 -3.453 7.547 -8.667
108 HG SER 17 HG SER 17 -3.525 7.822 -11.132
109 H ASP 18 H ASP 18 -0.989 9.443 -9.457
110 HA ASP 18 HA ASP 18 -0.310 11.331 -8.366
111 HB2 ASP 18 1HB ASP 18 -2.743 10.733 -7.502
112 HB3 ASP 18 2HB ASP 18 -1.897 10.513 -5.973
113 H VAL 19 H VAL 19 1.316 8.932 -7.953
114 HA VAL 19 HA VAL 19 2.162 8.683 -5.284
115 HB VAL 19 HB VAL 19 3.772 8.220 -7.800
116 HG11 VAL 19 1HG1 VAL 19 4.684 6.455 -5.934
117 HG12 VAL 19 2HG1 VAL 19 5.452 7.993 -6.330
118 HG13 VAL 19 3HG1 VAL 19 4.358 7.882 -4.950
119 HG21 VAL 19 3HG2 VAL 19 1.882 6.480 -6.243
120 HG22 VAL 19 1HG2 VAL 19 1.884 6.839 -7.970
121 HG23 VAL 19 2HG2 VAL 19 3.133 5.799 -7.284
122 H SER 20 H SER 20 3.880 9.582 -4.155
123 HA SER 20 HA SER 20 5.136 11.956 -5.359
124 HB2 SER 20 1HB SER 20 3.221 12.439 -3.702
125 HB3 SER 20 2HB SER 20 4.330 11.865 -2.456
126 HG SER 20 HG SER 20 5.229 13.792 -4.278
127 H HIS 21 H HIS 21 6.887 12.739 -3.576
128 HA HIS 21 HA HIS 21 8.748 10.519 -3.430
129 HB2 HIS 21 1HB HIS 21 10.367 12.286 -2.701
130 HB3 HIS 21 2HB HIS 21 9.627 12.594 -4.269
131 HD1 HIS 21 1HD HIS 21 8.201 14.685 -4.505
132 HD2 HIS 21 2HD HIS 21 9.499 14.016 -0.616
133 HE1 HIS 21 1HE HIS 21 7.651 16.788 -3.242
134 HE2 HIS 21 2HE HIS 21 8.523 16.392 -0.912
135 H ASP 22 H ASP 22 6.463 11.913 -1.410
136 HA ASP 22 HA ASP 22 7.723 10.668 0.937
137 HB2 ASP 22 1HB ASP 22 6.832 12.483 2.354
138 HB3 ASP 22 2HB ASP 22 7.993 13.080 1.171
139 H ALA 23 H ALA 23 5.413 10.224 -1.135
140 HA ALA 23 HA ALA 23 3.743 8.764 0.645
141 HB1 ALA 23 3HB ALA 23 2.854 10.986 1.119
142 HB2 ALA 23 1HB ALA 23 2.532 11.231 -0.598
143 HB3 ALA 23 2HB ALA 23 1.657 9.987 0.295
144 H ALA 24 H ALA 24 1.807 7.837 -0.559
145 HA ALA 24 HA ALA 24 1.890 7.846 -3.425
146 HB1 ALA 24 3HB ALA 24 2.272 5.094 -2.768
147 HB2 ALA 24 1HB ALA 24 3.230 6.128 -3.829
148 HB3 ALA 24 2HB ALA 24 3.607 6.039 -2.108
149 H ARG 25 H ARG 25 -0.101 7.459 -4.150
150 HA ARG 25 HA ARG 25 -2.115 6.508 -2.290
151 HB2 ARG 25 1HB ARG 25 -2.354 8.499 -3.911
152 HB3 ARG 25 2HB ARG 25 -2.604 7.282 -5.155
153 HG2 ARG 25 1HG ARG 25 -4.630 6.619 -4.293
154 HG3 ARG 25 2HG ARG 25 -4.244 7.190 -2.668
155 HD2 ARG 25 1HD ARG 25 -5.934 8.593 -3.771
156 HD3 ARG 25 2HD ARG 25 -4.465 9.491 -3.392
157 HE ARG 25 HE ARG 25 -4.058 9.742 -5.647
158 HH11 ARG 25 1HH1 ARG 25 -6.667 7.492 -5.145
159 HH12 ARG 25 2HH1 ARG 25 -7.134 7.460 -6.813
160 HH21 ARG 25 1HH2 ARG 25 -4.663 9.707 -7.846
161 HH22 ARG 25 2HH2 ARG 25 -5.993 8.719 -8.349
162 H VAL 26 H VAL 26 -2.812 4.481 -2.200
163 HA VAL 26 HA VAL 26 -2.303 2.719 -4.509
164 HB VAL 26 HB VAL 26 -0.957 1.930 -2.725
165 HG11 VAL 26 1HG1 VAL 26 -2.005 1.367 -0.491
166 HG12 VAL 26 2HG1 VAL 26 -1.811 3.084 -0.847
167 HG13 VAL 26 3HG1 VAL 26 -3.394 2.323 -1.006
168 HG21 VAL 26 3HG2 VAL 26 -1.554 -0.212 -2.948
169 HG22 VAL 26 1HG2 VAL 26 -3.093 0.045 -2.126
170 HG23 VAL 26 2HG2 VAL 26 -2.945 0.390 -3.849
171 H PHE 27 H PHE 27 -4.070 2.084 -5.535
172 HA PHE 27 HA PHE 27 -6.543 1.694 -3.989
173 HB2 PHE 27 1HB PHE 27 -7.856 2.633 -5.796
174 HB3 PHE 27 2HB PHE 27 -6.641 3.806 -5.298
175 HD1 PHE 27 1HD PHE 27 -4.762 4.342 -6.740
176 HD2 PHE 27 2HD PHE 27 -7.767 1.585 -7.957
177 HE1 PHE 27 1HE PHE 27 -3.972 4.512 -9.064
178 HE2 PHE 27 2HE PHE 27 -6.982 1.750 -10.283
179 HZ PHE 27 HZ PHE 27 -5.082 3.214 -10.839
180 H TRP 28 H TRP 28 -8.020 0.138 -4.861
181 HA TRP 28 HA TRP 28 -6.810 -1.724 -6.793
182 HB2 TRP 28 1HB TRP 28 -8.014 -3.540 -5.397
183 HB3 TRP 28 2HB TRP 28 -6.501 -2.879 -4.783
184 HD1 TRP 28 HD TRP 28 -10.052 -3.430 -3.821
185 HE1 TRP 28 1HE TRP 28 -10.534 -2.336 -1.542
186 HE3 TRP 28 3HE TRP 28 -5.803 -0.625 -3.352
187 HZ2 TRP 28 2HZ TRP 28 -9.279 -0.523 0.221
188 HZ3 TRP 28 3HZ TRP 28 -5.522 0.762 -1.340
189 HH2 TRP 28 HH TRP 28 -7.225 0.811 0.409
190 H GLU 29 H GLU 29 -8.577 -3.405 -7.478
191 HA GLU 29 HA GLU 29 -10.841 -1.824 -8.423
192 HB2 GLU 29 1HB GLU 29 -9.806 -4.546 -9.229
193 HB3 GLU 29 2HB GLU 29 -11.236 -3.794 -9.922
194 HG2 GLU 29 1HG GLU 29 -8.388 -2.862 -10.120
195 HG3 GLU 29 2HG GLU 29 -9.438 -3.425 -11.419
196 H GLY 30 H GLY 30 -10.459 -3.139 -5.661
197 HA2 GLY 30 1HA GLY 30 -11.988 -3.857 -4.083
198 HA3 GLY 30 2HA GLY 30 -13.214 -3.879 -5.342
199 H ALA 31 H ALA 31 -12.236 -5.809 -3.149
200 HA ALA 31 HA ALA 31 -11.274 -8.116 -4.514
201 HB1 ALA 31 3HB ALA 31 -12.127 -9.244 -2.329
202 HB2 ALA 31 1HB ALA 31 -10.750 -8.143 -2.268
203 HB3 ALA 31 2HB ALA 31 -12.349 -7.583 -1.779
204 HA PRO 32 HA PRO 32 -14.943 -9.896 -6.137
205 HB2 PRO 32 1HB PRO 32 -14.465 -12.544 -5.779
206 HB3 PRO 32 2HB PRO 32 -13.619 -11.570 -6.988
207 HG2 PRO 32 1HG PRO 32 -12.711 -12.415 -4.263
208 HG3 PRO 32 2HG PRO 32 -11.805 -12.391 -5.787
209 HD2 PRO 32 1HD PRO 32 -11.549 -10.457 -3.909
210 HD3 PRO 32 2HD PRO 32 -11.383 -10.129 -5.646
211 H ARG 33 H ARG 33 -14.215 -10.041 -2.860
212 HA ARG 33 HA ARG 33 -16.929 -10.984 -2.255
213 HB2 ARG 33 1HB ARG 33 -16.237 -12.412 -0.542
214 HB3 ARG 33 2HB ARG 33 -15.072 -12.719 -1.823
215 HG2 ARG 33 1HG ARG 33 -13.399 -11.445 -0.725
216 HG3 ARG 33 2HG ARG 33 -14.562 -10.810 0.441
217 HD2 ARG 33 1HD ARG 33 -13.590 -12.457 1.697
218 HD3 ARG 33 2HD ARG 33 -14.918 -13.362 0.972
219 HE ARG 33 HE ARG 33 -12.718 -13.587 -0.721
220 HH11 ARG 33 1HH1 ARG 33 -13.653 -14.527 2.498
221 HH12 ARG 33 2HH1 ARG 33 -12.653 -15.941 2.516
222 HH21 ARG 33 1HH2 ARG 33 -11.398 -15.447 -0.710
223 HH22 ARG 33 2HH2 ARG 33 -11.370 -16.463 0.691
224 HA PRO 34 HA PRO 34 -17.251 -7.401 0.262
225 HB2 PRO 34 1HB PRO 34 -18.973 -8.268 2.174
226 HB3 PRO 34 2HB PRO 34 -19.473 -7.929 0.513
227 HG2 PRO 34 1HG PRO 34 -18.839 -10.555 1.802
228 HG3 PRO 34 2HG PRO 34 -20.167 -10.141 0.702
229 HD2 PRO 34 1HD PRO 34 -17.932 -11.423 -0.131
230 HD3 PRO 34 2HD PRO 34 -18.833 -10.302 -1.171
231 H VAL 35 H VAL 35 -16.290 -6.462 2.004
232 HA VAL 35 HA VAL 35 -15.111 -8.237 4.038
233 HB VAL 35 HB VAL 35 -13.249 -7.648 2.723
234 HG11 VAL 35 1HG1 VAL 35 -14.681 -5.090 2.407
235 HG12 VAL 35 2HG1 VAL 35 -12.920 -4.990 2.466
236 HG13 VAL 35 3HG1 VAL 35 -13.708 -5.998 1.251
237 HG21 VAL 35 3HG2 VAL 35 -11.894 -6.287 4.192
238 HG22 VAL 35 1HG2 VAL 35 -13.338 -5.612 4.947
239 HG23 VAL 35 2HG2 VAL 35 -12.950 -7.320 5.156
240 H ARG 36 H ARG 36 -14.602 -7.158 6.080
241 HA ARG 36 HA ARG 36 -16.620 -5.127 6.697
242 HB2 ARG 36 1HB ARG 36 -16.520 -5.840 8.943
243 HB3 ARG 36 2HB ARG 36 -16.443 -7.316 7.990
244 HG2 ARG 36 1HG ARG 36 -14.095 -7.518 8.357
245 HG3 ARG 36 2HG ARG 36 -14.024 -5.923 9.108
246 HD2 ARG 36 1HD ARG 36 -15.451 -6.721 10.929
247 HD3 ARG 36 2HD ARG 36 -15.520 -8.314 10.177
248 HE ARG 36 HE ARG 36 -12.844 -7.423 10.699
249 HH11 ARG 36 1HH1 ARG 36 -15.646 -8.976 12.062
250 HH12 ARG 36 2HH1 ARG 36 -14.746 -9.830 13.271
251 HH21 ARG 36 1HH2 ARG 36 -11.648 -8.542 12.286
252 HH22 ARG 36 2HH2 ARG 36 -12.472 -9.582 13.398
253 H LEU 37 H LEU 37 -13.160 -5.771 6.970
254 HA LEU 37 HA LEU 37 -12.691 -2.900 7.223
255 HB2 LEU 37 1HB LEU 37 -12.747 -3.879 9.513
256 HB3 LEU 37 2HB LEU 37 -11.393 -4.910 9.056
257 HG LEU 37 HG LEU 37 -10.040 -2.851 8.675
258 HD11 LEU 37 1HD1 LEU 37 -10.804 -0.730 9.443
259 HD12 LEU 37 2HD1 LEU 37 -12.297 -1.428 10.069
260 HD13 LEU 37 3HD1 LEU 37 -12.018 -1.360 8.329
261 HD21 LEU 37 3HD2 LEU 37 -10.417 -2.256 11.342
262 HD22 LEU 37 1HD2 LEU 37 -9.355 -3.505 10.693
263 HD23 LEU 37 2HD2 LEU 37 -10.991 -3.919 11.205
264 H VAL 38 H VAL 38 -10.417 -2.318 6.828
265 HA VAL 38 HA VAL 38 -8.900 -4.353 5.356
266 HB VAL 38 HB VAL 38 -9.347 -1.566 4.285
267 HG11 VAL 38 1HG1 VAL 38 -8.291 -2.446 2.263
268 HG12 VAL 38 2HG1 VAL 38 -7.214 -2.569 3.655
269 HG13 VAL 38 3HG1 VAL 38 -8.055 -4.001 3.060
270 HG21 VAL 38 3HG2 VAL 38 -11.317 -2.282 3.533
271 HG22 VAL 38 1HG2 VAL 38 -10.436 -3.418 2.510
272 HG23 VAL 38 2HG2 VAL 38 -11.005 -3.922 4.101
273 H ARG 39 H ARG 39 -6.910 -4.446 6.140
274 HA ARG 39 HA ARG 39 -5.742 -2.007 7.310
275 HB2 ARG 39 1HB ARG 39 -6.241 -4.162 8.735
276 HB3 ARG 39 2HB ARG 39 -4.749 -4.740 8.005
277 HG2 ARG 39 1HG ARG 39 -3.501 -2.946 8.959
278 HG3 ARG 39 2HG ARG 39 -4.974 -2.149 9.515
279 HD2 ARG 39 1HD ARG 39 -5.321 -4.463 10.751
280 HD3 ARG 39 2HD ARG 39 -3.565 -4.529 10.605
281 HE ARG 39 HE ARG 39 -3.922 -2.093 11.638
282 HH11 ARG 39 1HH1 ARG 39 -5.272 -5.179 12.517
283 HH12 ARG 39 2HH1 ARG 39 -5.429 -4.780 14.195
284 HH21 ARG 39 1HH2 ARG 39 -4.123 -1.555 13.846
285 HH22 ARG 39 2HH2 ARG 39 -4.776 -2.718 14.950
286 H VAL 40 H VAL 40 -4.527 -1.169 5.704
287 HA VAL 40 HA VAL 40 -2.941 -2.872 3.979
288 HB VAL 40 HB VAL 40 -2.956 0.144 4.091
289 HG11 VAL 40 1HG1 VAL 40 -1.886 -1.891 2.181
290 HG12 VAL 40 2HG1 VAL 40 -2.365 -0.295 1.599
291 HG13 VAL 40 3HG1 VAL 40 -1.110 -0.446 2.830
292 HG21 VAL 40 3HG2 VAL 40 -4.649 -1.686 2.391
293 HG22 VAL 40 1HG2 VAL 40 -5.225 -0.707 3.740
294 HG23 VAL 40 2HG2 VAL 40 -4.598 0.074 2.288
295 H THR 41 H THR 41 -0.768 -3.143 4.032
296 HA THR 41 HA THR 41 0.740 -1.705 6.113
297 HB THR 41 HB THR 41 2.081 -3.838 6.407
298 HG1 THR 41 1HG THR 41 1.496 -5.540 5.298
299 HG21 THR 41 3HG2 THR 41 -0.781 -4.244 7.214
300 HG22 THR 41 1HG2 THR 41 0.185 -2.944 7.912
301 HG23 THR 41 2HG2 THR 41 0.689 -4.622 8.112
302 H TYR 42 H TYR 42 2.404 -0.631 5.296
303 HA TYR 42 HA TYR 42 3.604 -1.598 2.784
304 HB2 TYR 42 1HB TYR 42 4.294 0.850 2.504
305 HB3 TYR 42 2HB TYR 42 2.590 0.472 2.278
306 HD1 TYR 42 2HD TYR 42 0.975 0.979 4.144
307 HD2 TYR 42 1HD TYR 42 4.993 2.379 4.162
308 HE1 TYR 42 2HE TYR 42 0.373 2.668 5.827
309 HE2 TYR 42 1HE TYR 42 4.402 4.071 5.846
310 HH TYR 42 HH TYR 42 1.449 5.080 6.481
311 H VAL 43 H VAL 43 5.808 -1.720 2.622
312 HA VAL 43 HA VAL 43 7.444 -0.808 4.866
313 HB VAL 43 HB VAL 43 6.800 -3.177 5.328
314 HG11 VAL 43 1HG1 VAL 43 7.873 -4.939 3.961
315 HG12 VAL 43 2HG1 VAL 43 6.656 -4.021 3.072
316 HG13 VAL 43 3HG1 VAL 43 8.370 -3.701 2.807
317 HG21 VAL 43 3HG2 VAL 43 9.612 -3.607 4.949
318 HG22 VAL 43 1HG2 VAL 43 9.317 -1.947 5.469
319 HG23 VAL 43 2HG2 VAL 43 8.722 -3.294 6.439
320 H SER 44 H SER 44 9.552 -0.328 4.335
321 HA SER 44 HA SER 44 10.076 0.068 1.531
322 HB2 SER 44 1HB SER 44 10.703 1.749 3.257
323 HB3 SER 44 2HB SER 44 11.882 0.606 3.901
324 HG SER 44 HG SER 44 13.027 0.737 2.001
325 H SER 45 H SER 45 11.417 -1.054 0.235
326 HA SER 45 HA SER 45 12.042 -3.681 0.648
327 HB2 SER 45 1HB SER 45 13.414 -1.626 -1.088
328 HB3 SER 45 2HB SER 45 13.835 -3.338 -1.132
329 HG SER 45 HG SER 45 11.569 -2.036 -2.061
330 H GLU 46 H GLU 46 14.377 -4.592 0.602
331 HA GLU 46 HA GLU 46 16.121 -5.154 1.974
332 HB2 GLU 46 1HB GLU 46 16.528 -2.317 1.169
333 HB3 GLU 46 2HB GLU 46 17.603 -2.980 2.391
334 HG2 GLU 46 1HG GLU 46 17.137 -4.315 -0.256
335 HG3 GLU 46 2HG GLU 46 18.396 -3.108 0.001
336 H GLY 47 H GLY 47 13.698 -4.563 3.387
337 HA2 GLY 47 1HA GLY 47 12.941 -4.168 5.519
338 HA3 GLY 47 2HA GLY 47 14.581 -4.563 6.015
339 H GLY 48 H GLY 48 12.297 -2.029 5.395
340 HA2 GLY 48 1HA GLY 48 14.110 -0.151 6.744
341 HA3 GLY 48 2HA GLY 48 13.410 0.315 5.201
342 H HIS 49 H HIS 49 12.153 1.992 5.873
343 HA HIS 49 HA HIS 49 10.606 2.057 8.208
344 HB2 HIS 49 1HB HIS 49 10.891 4.159 7.302
345 HB3 HIS 49 2HB HIS 49 10.633 3.600 5.652
346 HD1 HIS 49 1HD HIS 49 8.698 4.924 4.844
347 HD2 HIS 49 2HD HIS 49 8.069 3.422 8.667
348 HE1 HIS 49 1HE HIS 49 6.325 5.526 5.421
349 HE2 HIS 49 2HE HIS 49 5.995 4.682 7.771
350 H SER 50 H SER 50 8.585 1.395 8.706
351 HA SER 50 HA SER 50 6.890 0.299 6.581
352 HB2 SER 50 1HB SER 50 6.418 -1.715 7.899
353 HB3 SER 50 2HB SER 50 8.140 -1.600 7.538
354 HG SER 50 HG SER 50 6.902 -1.669 9.932
355 H GLY 51 H GLY 51 4.654 0.198 7.102
356 HA2 GLY 51 1HA GLY 51 3.816 1.421 9.623
357 HA3 GLY 51 2HA GLY 51 3.389 2.263 8.141
358 H GLN 52 H GLN 52 1.202 1.873 9.149
359 HA GLN 52 HA GLN 52 -0.079 -0.251 7.741
360 HB2 GLN 52 1HB GLN 52 0.671 -1.613 9.570
361 HB3 GLN 52 2HB GLN 52 0.124 -0.427 10.748
362 HG2 GLN 52 1HG GLN 52 -2.214 -0.841 9.849
363 HG3 GLN 52 2HG GLN 52 -1.530 -2.244 9.029
364 HE21 GLN 52 1HE2 GLN 52 -1.185 -4.070 10.151
365 HE22 GLN 52 2HE2 GLN 52 -1.489 -4.256 11.841
366 H THR 53 H THR 53 -1.883 0.656 7.038
367 HA THR 53 HA THR 53 -3.220 2.651 8.747
368 HB THR 53 HB THR 53 -2.268 3.368 6.463
369 HG1 THR 53 1HG THR 53 -3.695 4.717 7.525
370 HG21 THR 53 3HG2 THR 53 -3.840 1.229 5.594
371 HG22 THR 53 1HG2 THR 53 -3.040 2.437 4.588
372 HG23 THR 53 2HG2 THR 53 -4.713 2.676 5.091
373 H GLU 54 H GLU 54 -5.545 2.730 8.681
374 HA GLU 54 HA GLU 54 -6.748 0.116 8.045
375 HB2 GLU 54 1HB GLU 54 -7.121 1.982 10.347
376 HB3 GLU 54 2HB GLU 54 -8.486 1.005 9.826
377 HG2 GLU 54 1HG GLU 54 -6.900 -0.988 10.015
378 HG3 GLU 54 2HG GLU 54 -5.847 0.101 10.916
379 H ALA 55 H ALA 55 -8.687 0.048 6.971
380 HA ALA 55 HA ALA 55 -10.090 2.518 6.354
381 HB1 ALA 55 3HB ALA 55 -8.162 1.625 4.589
382 HB2 ALA 55 1HB ALA 55 -9.670 1.018 3.905
383 HB3 ALA 55 2HB ALA 55 -9.477 2.742 4.224
384 HA PRO 56 HA PRO 56 -13.619 -0.093 6.476
385 HB2 PRO 56 1HB PRO 56 -15.306 1.243 4.821
386 HB3 PRO 56 2HB PRO 56 -14.885 1.824 6.436
387 HG2 PRO 56 1HG PRO 56 -13.784 2.651 3.778
388 HG3 PRO 56 2HG PRO 56 -14.240 3.660 5.163
389 HD2 PRO 56 1HD PRO 56 -11.669 3.001 4.626
390 HD3 PRO 56 2HD PRO 56 -12.268 3.240 6.280
391 H GLY 57 H GLY 57 -14.494 -1.826 5.428
392 HA2 GLY 57 1HA GLY 57 -13.248 -2.979 3.257
393 HA3 GLY 57 2HA GLY 57 -14.882 -3.371 3.771
394 H ASN 58 H ASN 58 -15.514 -0.404 3.231
395 HA ASN 58 HA ASN 58 -16.355 -0.842 0.497
396 HB2 ASN 58 1HB ASN 58 -16.801 1.640 2.158
397 HB3 ASN 58 2HB ASN 58 -17.735 1.086 0.772
398 HD21 ASN 58 1HD2 ASN 58 -18.445 1.697 3.606
399 HD22 ASN 58 2HD2 ASN 58 -19.284 0.292 4.161
400 H ALA 59 H ALA 59 -13.943 0.973 2.212
401 HA ALA 59 HA ALA 59 -13.350 2.896 0.232
402 HB1 ALA 59 3HB ALA 59 -12.240 3.601 2.035
403 HB2 ALA 59 1HB ALA 59 -12.181 1.983 2.735
404 HB3 ALA 59 2HB ALA 59 -10.970 2.477 1.551
405 H THR 60 H THR 60 -12.556 2.586 -1.731
406 HA THR 60 HA THR 60 -11.023 0.138 -2.277
407 HB THR 60 HB THR 60 -11.516 0.582 -4.669
408 HG1 THR 60 1HG THR 60 -12.981 2.228 -5.182
409 HG21 THR 60 3HG2 THR 60 -13.736 0.254 -2.682
410 HG22 THR 60 1HG2 THR 60 -13.002 -0.949 -3.741
411 HG23 THR 60 2HG2 THR 60 -14.079 0.276 -4.412
412 H SER 61 H SER 61 -10.205 2.960 -1.235
413 HA SER 61 HA SER 61 -7.690 3.006 -2.639
414 HB2 SER 61 1HB SER 61 -7.945 5.507 -3.143
415 HB3 SER 61 2HB SER 61 -8.806 4.391 -4.202
416 HG SER 61 HG SER 61 -10.477 5.557 -3.687
417 H ALA 62 H ALA 62 -6.076 3.790 -1.385
418 HA ALA 62 HA ALA 62 -6.666 5.492 0.892
419 HB1 ALA 62 3HB ALA 62 -6.358 4.018 2.555
420 HB2 ALA 62 1HB ALA 62 -6.754 2.809 1.333
421 HB3 ALA 62 2HB ALA 62 -5.067 3.172 1.701
422 H MET 63 H MET 63 -4.957 6.745 1.490
423 HA MET 63 HA MET 63 -2.617 6.643 -0.227
424 HB2 MET 63 1HB MET 63 -3.653 8.644 1.770
425 HB3 MET 63 2HB MET 63 -2.047 8.786 1.069
426 HG2 MET 63 1HG MET 63 -3.341 8.569 -1.191
427 HG3 MET 63 2HG MET 63 -4.712 9.094 -0.217
428 HE1 MET 63 3HE MET 63 -1.498 9.775 -1.888
429 HE2 MET 63 1HE MET 63 -1.163 11.494 -1.680
430 HE3 MET 63 2HE MET 63 -0.751 10.355 -0.398
431 H LEU 64 H LEU 64 -0.442 6.968 0.733
432 HA LEU 64 HA LEU 64 -0.162 5.705 3.372
433 HB2 LEU 64 1HB LEU 64 1.650 5.079 1.057
434 HB3 LEU 64 2HB LEU 64 1.573 4.276 2.624
435 HG LEU 64 HG LEU 64 -0.754 4.186 0.735
436 HD11 LEU 64 1HD1 LEU 64 0.093 2.164 -0.241
437 HD12 LEU 64 2HD1 LEU 64 1.539 2.232 0.766
438 HD13 LEU 64 3HD1 LEU 64 1.277 3.449 -0.483
439 HD21 LEU 64 3HD2 LEU 64 -1.620 2.975 2.378
440 HD22 LEU 64 1HD2 LEU 64 -0.133 3.134 3.312
441 HD23 LEU 64 2HD2 LEU 64 -0.322 1.797 2.178
442 H GLY 65 H GLY 65 1.961 6.079 4.375
443 HA2 GLY 65 1HA GLY 65 4.097 7.441 3.891
444 HA3 GLY 65 2HA GLY 65 2.953 8.754 3.652
445 HA PRO 66 HA PRO 66 4.679 10.032 4.390
446 HB2 PRO 66 1HB PRO 66 6.920 10.536 5.838
447 HB3 PRO 66 2HB PRO 66 5.438 11.487 5.998
448 HG2 PRO 66 1HG PRO 66 6.456 9.259 7.720
449 HG3 PRO 66 2HG PRO 66 5.720 10.798 8.202
450 HD2 PRO 66 1HD PRO 66 4.336 8.471 8.164
451 HD3 PRO 66 2HD PRO 66 3.578 10.038 7.819
452 H LEU 67 H LEU 67 5.757 9.060 2.800
453 HA LEU 67 HA LEU 67 7.335 6.668 3.406
454 HB2 LEU 67 1HB LEU 67 6.538 7.682 0.690
455 HB3 LEU 67 2HB LEU 67 7.105 6.069 1.119
456 HG LEU 67 HG LEU 67 4.455 7.264 1.930
457 HD11 LEU 67 1HD1 LEU 67 5.015 5.079 -0.066
458 HD12 LEU 67 2HD1 LEU 67 4.696 6.758 -0.500
459 HD13 LEU 67 3HD1 LEU 67 3.457 5.810 0.320
460 HD21 LEU 67 3HD2 LEU 67 5.641 5.512 3.422
461 HD22 LEU 67 1HD2 LEU 67 5.224 4.380 2.136
462 HD23 LEU 67 2HD2 LEU 67 3.952 5.261 2.981
463 H SER 68 H SER 68 9.125 6.449 1.492
464 HA SER 68 HA SER 68 10.879 8.761 1.918
465 HB2 SER 68 1HB SER 68 11.565 6.376 2.577
466 HB3 SER 68 2HB SER 68 11.735 6.075 0.847
467 HG SER 68 HG SER 68 13.698 6.756 1.871
468 H SER 69 H SER 69 12.615 8.817 -0.003
469 HA SER 69 HA SER 69 11.027 9.139 -2.460
470 HB2 SER 69 1HB SER 69 12.933 10.728 -3.101
471 HB3 SER 69 2HB SER 69 11.850 11.264 -1.817
472 HG SER 69 HG SER 69 13.402 10.666 -0.306
473 H SER 70 H SER 70 11.986 8.608 -4.482
474 HA SER 70 HA SER 70 12.904 6.981 -5.819
475 HB2 SER 70 1HB SER 70 14.662 8.777 -5.605
476 HB3 SER 70 2HB SER 70 15.433 7.784 -4.367
477 HG SER 70 HG SER 70 15.175 6.112 -6.233
478 H THR 71 H THR 71 11.888 5.972 -3.305
479 HA THR 71 HA THR 71 13.616 3.602 -3.037
480 HB THR 71 HB THR 71 12.124 5.025 -0.827
481 HG1 THR 71 1HG THR 71 14.415 5.572 -1.648
482 HG21 THR 71 3HG2 THR 71 12.657 2.258 -1.096
483 HG22 THR 71 1HG2 THR 71 12.033 3.114 0.313
484 HG23 THR 71 2HG2 THR 71 13.772 2.891 0.114
485 H THR 72 H THR 72 12.627 1.671 -3.206
486 HA THR 72 HA THR 72 9.893 1.598 -4.068
487 HB THR 72 HB THR 72 11.840 -0.650 -3.522
488 HG1 THR 72 1HG THR 72 11.735 -0.665 -5.926
489 HG21 THR 72 3HG2 THR 72 9.658 -1.222 -5.346
490 HG22 THR 72 1HG2 THR 72 9.078 -0.829 -3.729
491 HG23 THR 72 2HG2 THR 72 10.233 -2.142 -3.956
492 H TYR 73 H TYR 73 8.112 0.932 -2.985
493 HA TYR 73 HA TYR 73 8.470 0.029 -0.205
494 HB2 TYR 73 1HB TYR 73 6.796 2.229 -1.302
495 HB3 TYR 73 2HB TYR 73 6.106 1.264 -0.002
496 HD1 TYR 73 1HD TYR 73 8.974 3.425 -0.912
497 HD2 TYR 73 2HD TYR 73 6.801 1.565 2.238
498 HE1 TYR 73 1HE TYR 73 10.232 4.753 0.732
499 HE2 TYR 73 2HE TYR 73 8.052 2.889 3.890
500 HH TYR 73 HH TYR 73 10.860 4.575 3.149
501 H THR 74 H THR 74 7.650 -1.919 0.118
502 HA THR 74 HA THR 74 5.898 -3.136 -1.818
503 HB THR 74 HB THR 74 6.784 -4.277 0.835
504 HG1 THR 74 1HG THR 74 8.621 -4.875 -0.125
505 HG21 THR 74 3HG2 THR 74 5.201 -5.263 -1.404
506 HG22 THR 74 1HG2 THR 74 5.378 -5.912 0.226
507 HG23 THR 74 2HG2 THR 74 6.565 -6.310 -1.016
508 H VAL 75 H VAL 75 3.842 -2.425 -1.791
509 HA VAL 75 HA VAL 75 2.482 -1.993 0.755
510 HB VAL 75 HB VAL 75 1.453 -1.541 -2.049
511 HG11 VAL 75 1HG1 VAL 75 -0.077 0.048 -0.659
512 HG12 VAL 75 2HG1 VAL 75 -0.452 -1.673 -0.755
513 HG13 VAL 75 3HG1 VAL 75 0.348 -1.022 0.676
514 HG21 VAL 75 3HG2 VAL 75 2.994 0.109 -2.014
515 HG22 VAL 75 1HG2 VAL 75 1.789 0.928 -1.021
516 HG23 VAL 75 2HG2 VAL 75 3.136 0.085 -0.257
517 H ARG 76 H ARG 76 1.009 -3.340 1.595
518 HA ARG 76 HA ARG 76 -0.067 -5.487 -0.098
519 HB2 ARG 76 1HB ARG 76 1.468 -5.722 2.439
520 HB3 ARG 76 2HB ARG 76 0.105 -6.811 2.216
521 HG2 ARG 76 1HG ARG 76 1.088 -7.894 0.436
522 HG3 ARG 76 2HG ARG 76 2.141 -6.531 0.054
523 HD2 ARG 76 1HD ARG 76 3.612 -8.043 1.002
524 HD3 ARG 76 2HD ARG 76 3.193 -7.014 2.371
525 HE ARG 76 HE ARG 76 1.432 -9.209 2.265
526 HH11 ARG 76 1HH1 ARG 76 4.747 -8.434 2.993
527 HH12 ARG 76 2HH1 ARG 76 4.945 -9.745 4.108
528 HH21 ARG 76 1HH2 ARG 76 1.680 -10.939 3.731
529 HH22 ARG 76 2HH2 ARG 76 3.200 -11.170 4.526
530 H VAL 77 H VAL 77 -2.109 -4.671 -0.242
531 HA VAL 77 HA VAL 77 -3.509 -3.585 2.009
532 HB VAL 77 HB VAL 77 -4.511 -4.412 -0.718
533 HG11 VAL 77 1HG1 VAL 77 -6.428 -4.466 0.598
534 HG12 VAL 77 2HG1 VAL 77 -5.885 -3.131 1.616
535 HG13 VAL 77 3HG1 VAL 77 -6.422 -2.821 -0.036
536 HG21 VAL 77 3HG2 VAL 77 -3.521 -2.536 -1.393
537 HG22 VAL 77 1HG2 VAL 77 -4.669 -1.646 -0.392
538 HG23 VAL 77 2HG2 VAL 77 -3.094 -2.098 0.261
539 H THR 78 H THR 78 -3.886 -4.978 3.643
540 HA THR 78 HA THR 78 -4.830 -7.676 3.087
541 HB THR 78 HB THR 78 -4.472 -6.458 5.821
542 HG1 THR 78 1HG THR 78 -2.331 -7.671 5.525
543 HG21 THR 78 3HG2 THR 78 -3.928 -9.300 5.088
544 HG22 THR 78 1HG2 THR 78 -5.599 -8.768 5.273
545 HG23 THR 78 2HG2 THR 78 -4.472 -8.618 6.621
546 H CYS 79 H CYS 79 -6.925 -8.013 2.781
547 HA CYS 79 HA CYS 79 -8.870 -6.203 4.014
548 HB2 CYS 79 1HB CYS 79 -9.376 -8.328 1.926
549 HB3 CYS 79 2HB CYS 79 -10.460 -7.027 2.405
550 HG CYS 79 HG CYS 79 -9.081 -5.005 1.217
551 H LEU 80 H LEU 80 -9.156 -6.908 6.076
552 HA LEU 80 HA LEU 80 -9.341 -9.671 6.771
553 HB2 LEU 80 1HB LEU 80 -9.632 -7.076 8.177
554 HB3 LEU 80 2HB LEU 80 -10.385 -8.487 8.917
555 HG LEU 80 HG LEU 80 -8.271 -8.247 9.937
556 HD11 LEU 80 1HD1 LEU 80 -7.705 -10.300 7.828
557 HD12 LEU 80 2HD1 LEU 80 -8.966 -10.544 9.036
558 HD13 LEU 80 3HD1 LEU 80 -7.291 -10.324 9.542
559 HD21 LEU 80 3HD2 LEU 80 -6.350 -8.492 7.929
560 HD22 LEU 80 1HD2 LEU 80 -6.703 -7.063 8.901
561 HD23 LEU 80 2HD2 LEU 80 -7.489 -7.282 7.337
562 H TYR 81 H TYR 81 -10.991 -10.780 5.883
563 HA TYR 81 HA TYR 81 -13.593 -9.677 5.487
564 HB2 TYR 81 1HB TYR 81 -12.810 -12.595 5.465
565 HB3 TYR 81 2HB TYR 81 -14.215 -11.866 4.696
566 HD1 TYR 81 2HD TYR 81 -13.147 -9.568 3.306
567 HD2 TYR 81 1HD TYR 81 -11.443 -13.436 3.799
568 HE1 TYR 81 2HE TYR 81 -11.857 -9.258 1.235
569 HE2 TYR 81 1HE TYR 81 -10.147 -13.135 1.730
570 HH TYR 81 HH TYR 81 -10.474 -11.659 -0.449
571 HA PRO 82 HA PRO 82 -15.446 -10.418 9.403
572 HB2 PRO 82 1HB PRO 82 -18.031 -10.756 8.644
573 HB3 PRO 82 2HB PRO 82 -17.226 -9.182 8.637
574 HG2 PRO 82 1HG PRO 82 -17.724 -11.065 6.364
575 HG3 PRO 82 2HG PRO 82 -17.902 -9.302 6.416
576 HD2 PRO 82 1HD PRO 82 -15.746 -10.517 5.316
577 HD3 PRO 82 2HD PRO 82 -15.644 -8.940 6.125
578 H GLY 83 H GLY 83 -14.394 -12.459 9.807
579 HA2 GLY 83 1HA GLY 83 -14.439 -14.678 10.395
580 HA3 GLY 83 2HA GLY 83 -16.189 -14.583 10.259
581 H GLY 84 H GLY 84 -13.354 -14.593 8.086
582 HA2 GLY 84 1HA GLY 84 -14.056 -16.985 6.785
583 HA3 GLY 84 2HA GLY 84 -14.706 -15.639 5.861
584 H GLY 85 H GLY 85 -11.644 -16.255 7.593
585 HA2 GLY 85 1HA GLY 85 -9.465 -16.127 6.878
586 HA3 GLY 85 2HA GLY 85 -10.071 -16.405 5.252
587 H SER 86 H SER 86 -8.263 -14.917 4.733
588 HA SER 86 HA SER 86 -9.289 -12.273 4.309
589 HB2 SER 86 1HB SER 86 -7.337 -11.133 5.426
590 HB3 SER 86 2HB SER 86 -8.489 -11.872 6.538
591 HG SER 86 HG SER 86 -6.288 -13.372 5.667
592 H SER 87 H SER 87 -7.977 -11.026 2.862
593 HA SER 87 HA SER 87 -6.015 -12.665 1.395
594 HB2 SER 87 1HB SER 87 -7.957 -10.593 0.350
595 HB3 SER 87 2HB SER 87 -6.680 -11.328 -0.619
596 HG SER 87 HG SER 87 -8.188 -12.755 -1.004
597 H THR 88 H THR 88 -4.435 -11.331 0.111
598 HA THR 88 HA THR 88 -3.819 -8.734 1.293
599 HB THR 88 HB THR 88 -1.711 -10.894 1.179
600 HG1 THR 88 1HG THR 88 -1.985 -10.683 3.580
601 HG21 THR 88 3HG2 THR 88 -1.661 -8.051 1.576
602 HG22 THR 88 1HG2 THR 88 -0.314 -9.184 1.483
603 HG23 THR 88 2HG2 THR 88 -1.095 -8.869 3.032
604 H LEU 89 H LEU 89 -3.862 -7.542 -0.518
605 HA LEU 89 HA LEU 89 -2.799 -8.560 -3.011
606 HB2 LEU 89 1HB LEU 89 -4.348 -6.182 -2.151
607 HB3 LEU 89 2HB LEU 89 -3.370 -6.030 -3.610
608 HG LEU 89 HG LEU 89 -5.393 -8.227 -3.260
609 HD11 LEU 89 1HD1 LEU 89 -5.810 -5.373 -3.852
610 HD12 LEU 89 2HD1 LEU 89 -6.924 -6.577 -3.204
611 HD13 LEU 89 3HD1 LEU 89 -6.609 -6.510 -4.938
612 HD21 LEU 89 3HD2 LEU 89 -4.085 -6.973 -5.671
613 HD22 LEU 89 1HD2 LEU 89 -5.314 -8.237 -5.715
614 HD23 LEU 89 2HD2 LEU 89 -3.736 -8.566 -4.999
615 H THR 90 H THR 90 -0.653 -8.594 -3.214
616 HA THR 90 HA THR 90 1.020 -6.614 -1.934
617 HB THR 90 HB THR 90 2.818 -7.967 -2.392
618 HG1 THR 90 1HG THR 90 3.152 -8.443 -4.419
619 HG21 THR 90 3HG2 THR 90 0.917 -9.246 -1.245
620 HG22 THR 90 1HG2 THR 90 2.236 -10.195 -1.927
621 HG23 THR 90 2HG2 THR 90 0.704 -10.067 -2.791
622 H GLY 91 H GLY 91 2.124 -4.970 -2.895
623 HA2 GLY 91 1HA GLY 91 2.241 -4.742 -5.781
624 HA3 GLY 91 2HA GLY 91 1.194 -3.567 -4.999
625 H ARG 92 H ARG 92 4.146 -3.899 -6.269
626 HA ARG 92 HA ARG 92 5.590 -2.374 -4.244
627 HB2 ARG 92 1HB ARG 92 6.468 -3.548 -6.887
628 HB3 ARG 92 2HB ARG 92 7.521 -2.636 -5.814
629 HG2 ARG 92 1HG ARG 92 6.794 -4.405 -4.047
630 HG3 ARG 92 2HG ARG 92 6.365 -5.361 -5.467
631 HD2 ARG 92 1HD ARG 92 9.057 -4.063 -5.203
632 HD3 ARG 92 2HD ARG 92 8.721 -5.636 -4.481
633 HE ARG 92 HE ARG 92 7.915 -5.831 -7.104
634 HH11 ARG 92 1HH1 ARG 92 10.877 -5.124 -5.417
635 HH12 ARG 92 2HH1 ARG 92 11.893 -5.776 -6.660
636 HH21 ARG 92 1HH2 ARG 92 9.241 -6.692 -8.748
637 HH22 ARG 92 2HH2 ARG 92 10.962 -6.667 -8.555
638 H VAL 93 H VAL 93 6.230 -0.276 -4.473
639 HA VAL 93 HA VAL 93 5.677 1.123 -6.976
640 HB VAL 93 HB VAL 93 3.621 1.352 -5.616
641 HG11 VAL 93 1HG1 VAL 93 3.590 1.982 -3.461
642 HG12 VAL 93 2HG1 VAL 93 5.287 1.496 -3.471
643 HG13 VAL 93 3HG1 VAL 93 4.852 3.192 -3.693
644 HG21 VAL 93 3HG2 VAL 93 5.292 3.580 -6.542
645 HG22 VAL 93 1HG2 VAL 93 3.620 3.174 -6.930
646 HG23 VAL 93 2HG2 VAL 93 3.995 4.039 -5.439
647 H THR 94 H THR 94 7.213 2.566 -7.445
648 HA THR 94 HA THR 94 9.285 3.070 -5.453
649 HB THR 94 HB THR 94 9.278 3.810 -8.385
650 HG1 THR 94 1HG THR 94 10.817 1.909 -8.344
651 HG21 THR 94 3HG2 THR 94 11.657 3.467 -6.578
652 HG22 THR 94 1HG2 THR 94 10.836 5.017 -6.755
653 HG23 THR 94 2HG2 THR 94 11.579 4.248 -8.157
654 H THR 95 H THR 95 9.057 4.803 -4.208
655 HA THR 95 HA THR 95 7.322 6.949 -4.708
656 HB THR 95 HB THR 95 8.788 8.129 -2.922
657 HG1 THR 95 1HG THR 95 10.505 7.064 -2.316
658 HG21 THR 95 3HG2 THR 95 7.315 7.332 -1.427
659 HG22 THR 95 1HG2 THR 95 7.826 5.664 -1.676
660 HG23 THR 95 2HG2 THR 95 6.660 6.403 -2.775
661 H LYS 96 H LYS 96 7.863 9.208 -5.040
662 HA LYS 96 HA LYS 96 9.702 9.539 -7.218
663 HB2 LYS 96 1HB LYS 96 8.167 11.676 -5.732
664 HB3 LYS 96 2HB LYS 96 8.877 11.806 -7.336
665 HG2 LYS 96 1HG LYS 96 7.277 9.748 -7.805
666 HG3 LYS 96 2HG LYS 96 6.382 10.465 -6.463
667 HD2 LYS 96 1HD LYS 96 5.887 12.373 -7.635
668 HD3 LYS 96 2HD LYS 96 7.320 12.246 -8.658
669 HE2 LYS 96 1HE LYS 96 6.316 10.446 -9.911
670 HE3 LYS 96 2HE LYS 96 4.928 10.416 -8.825
671 HZ1 LYS 96 3HZ LYS 96 4.206 11.618 -10.664
672 HZ2 LYS 96 1HZ LYS 96 5.659 12.472 -10.816
673 HZ3 LYS 96 2HZ LYS 96 4.601 12.823 -9.544
674 H LYS 97 H LYS 97 11.240 11.429 -7.231
675 HA LYS 97 HA LYS 97 13.079 11.131 -5.053
676 HB2 LYS 97 1HB LYS 97 13.057 12.599 -7.652
677 HB3 LYS 97 2HB LYS 97 14.215 13.095 -6.424
678 HG2 LYS 97 1HG LYS 97 15.276 10.993 -6.430
679 HG3 LYS 97 2HG LYS 97 13.959 10.246 -7.338
680 HD2 LYS 97 1HD LYS 97 14.621 12.107 -9.106
681 HD3 LYS 97 2HD LYS 97 16.176 11.988 -8.281
682 HE2 LYS 97 1HE LYS 97 16.467 10.381 -9.875
683 HE3 LYS 97 2HE LYS 97 15.745 9.401 -8.600
684 HZ1 LYS 97 3HZ LYS 97 13.579 10.291 -9.910
685 HZ2 LYS 97 1HZ LYS 97 14.328 8.803 -10.206
686 HZ3 LYS 97 2HZ LYS 97 14.683 10.137 -11.183
687 H ALA 98 H ALA 98 13.671 12.613 -3.505
688 HA ALA 98 HA ALA 98 11.725 14.741 -3.007
689 HB1 ALA 98 3HB ALA 98 13.405 13.026 -1.329
690 HB2 ALA 98 1HB ALA 98 13.325 14.708 -0.805
691 HB3 ALA 98 2HB ALA 98 11.843 13.770 -0.989
692 HA PRO 99 HA PRO 99 14.497 17.965 -4.132
693 HB2 PRO 99 1HB PRO 99 13.526 19.966 -2.575
694 HB3 PRO 99 2HB PRO 99 12.683 19.371 -4.011
695 HG2 PRO 99 1HG PRO 99 12.206 18.719 -1.128
696 HG3 PRO 99 2HG PRO 99 11.027 19.056 -2.409
697 HD2 PRO 99 1HD PRO 99 11.613 16.542 -1.592
698 HD3 PRO 99 2HD PRO 99 11.161 16.921 -3.266
699 H SER 100 H SER 100 16.480 18.602 -3.521
700 HA SER 100 HA SER 100 17.848 17.657 -1.380
701 HB2 SER 100 1HB SER 100 19.489 19.427 -1.735
702 HB3 SER 100 2HB SER 100 18.879 18.860 -3.289
703 HG SER 100 HG SER 100 17.296 20.719 -2.919
704 HA PRO 101 HA PRO 101 16.349 19.652 2.244
705 HB2 PRO 101 1HB PRO 101 18.532 19.370 3.832
706 HB3 PRO 101 2HB PRO 101 17.465 18.023 3.420
707 HG2 PRO 101 1HG PRO 101 20.102 18.784 2.226
708 HG3 PRO 101 2HG PRO 101 19.495 17.177 2.665
709 HD2 PRO 101 1HD PRO 101 19.486 18.091 0.117
710 HD3 PRO 101 2HD PRO 101 18.245 16.985 0.739
711 H SER 102 H SER 102 18.956 20.830 0.400
712 HA SER 102 HA SER 102 19.776 23.002 2.022
713 HB2 SER 102 1HB SER 102 21.238 22.323 0.261
714 HB3 SER 102 2HB SER 102 19.968 22.496 -0.950
715 HG SER 102 HG SER 102 20.039 24.725 -0.649
716 H SER 103 H SER 103 18.696 24.774 2.539
717 HA SER 103 HA SER 103 16.468 25.621 0.809
718 HB2 SER 103 1HB SER 103 15.600 26.763 2.882
719 HB3 SER 103 2HB SER 103 15.643 25.002 2.979
720 HG SER 103 HG SER 103 16.534 26.328 4.809
721 H GLY 104 H GLY 104 16.526 27.580 -0.108
722 HA2 GLY 104 1HA GLY 104 18.569 29.485 0.856
723 HA3 GLY 104 2HA GLY 104 18.303 29.192 -0.856
724 HA PRO 105 HA PRO 105 15.832 32.916 0.250
725 HB2 PRO 105 1HB PRO 105 16.392 34.238 -2.054
726 HB3 PRO 105 2HB PRO 105 17.451 34.283 -0.640
727 HG2 PRO 105 1HG PRO 105 17.674 32.623 -3.120
728 HG3 PRO 105 2HG PRO 105 18.943 33.492 -2.238
729 HD2 PRO 105 1HD PRO 105 18.558 30.824 -1.983
730 HD3 PRO 105 2HD PRO 105 19.148 31.835 -0.649
731 H SER 106 H SER 106 14.204 34.083 -1.279
732 HA SER 106 HA SER 106 13.092 32.472 -3.389
733 HB2 SER 106 1HB SER 106 12.275 31.475 -1.150
734 HB3 SER 106 2HB SER 106 11.291 32.933 -1.019
735 HG SER 106 HG SER 106 9.949 31.752 -2.153
736 H SER 107 H SER 107 10.800 33.468 -3.957
737 HA SER 107 HA SER 107 10.871 36.377 -3.584
738 HB2 SER 107 1HB SER 107 11.994 35.920 -5.719
739 HB3 SER 107 2HB SER 107 10.599 34.988 -6.262
740 HG SER 107 HG SER 107 9.465 36.795 -6.522
741 H GLY 108 H GLY 108 8.870 37.422 -3.767
742 HA2 GLY 108 1HA GLY 108 6.644 36.085 -2.809
743 HA3 GLY 108 2HA GLY 108 6.585 37.628 -3.648
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -0.985 -20.802 14.270
2 HA2 GLY 1 1HA GLY 1 -1.416 -23.504 13.464
3 HA3 GLY 1 2HA GLY 1 -2.406 -22.398 12.523
4 H SER 2 H SER 2 -1.365 -20.810 11.213
5 HA SER 2 HA SER 2 1.420 -21.514 10.550
6 HB2 SER 2 1HB SER 2 -0.931 -20.866 8.803
7 HB3 SER 2 2HB SER 2 0.701 -20.518 8.234
8 HG SER 2 HG SER 2 -0.161 -23.050 9.182
9 H SER 3 H SER 3 2.875 -19.876 10.157
10 HA SER 3 HA SER 3 1.922 -17.137 10.682
11 HB2 SER 3 1HB SER 3 4.009 -16.687 11.878
12 HB3 SER 3 2HB SER 3 3.162 -18.045 12.619
13 HG SER 3 HG SER 3 4.940 -19.106 12.317
14 H GLY 4 H GLY 4 1.941 -16.248 8.693
15 HA2 GLY 4 1HA GLY 4 2.871 -15.229 6.847
16 HA3 GLY 4 2HA GLY 4 4.455 -15.678 7.465
17 H SER 5 H SER 5 1.588 -17.358 6.162
18 HA SER 5 HA SER 5 3.330 -18.669 4.205
19 HB2 SER 5 1HB SER 5 2.965 -20.135 6.268
20 HB3 SER 5 2HB SER 5 1.280 -20.245 5.762
21 HG SER 5 HG SER 5 1.883 -21.712 4.402
22 H SER 6 H SER 6 2.512 -18.207 2.282
23 HA SER 6 HA SER 6 -0.391 -18.404 1.893
24 HB2 SER 6 1HB SER 6 0.238 -16.005 2.132
25 HB3 SER 6 2HB SER 6 1.322 -16.182 0.753
26 HG SER 6 HG SER 6 -1.262 -15.647 0.721
27 H GLY 7 H GLY 7 -1.014 -19.373 0.028
28 HA2 GLY 7 1HA GLY 7 0.949 -19.759 -2.107
29 HA3 GLY 7 2HA GLY 7 0.304 -21.200 -1.334
30 H LEU 8 H LEU 8 -1.396 -18.194 -2.108
31 HA LEU 8 HA LEU 8 -3.019 -19.696 -4.051
32 HB2 LEU 8 1HB LEU 8 -4.983 -18.415 -3.287
33 HB3 LEU 8 2HB LEU 8 -4.322 -19.483 -2.050
34 HG LEU 8 HG LEU 8 -3.090 -17.292 -1.275
35 HD11 LEU 8 1HD1 LEU 8 -4.002 -15.285 -1.857
36 HD12 LEU 8 2HD1 LEU 8 -5.576 -15.982 -2.240
37 HD13 LEU 8 3HD1 LEU 8 -4.234 -16.163 -3.368
38 HD21 LEU 8 3HD2 LEU 8 -5.431 -18.668 -0.526
39 HD22 LEU 8 1HD2 LEU 8 -5.791 -16.946 -0.406
40 HD23 LEU 8 2HD2 LEU 8 -4.418 -17.621 0.470
41 H ALA 9 H ALA 9 -4.264 -18.228 -5.529
42 HA ALA 9 HA ALA 9 -2.465 -16.179 -6.528
43 HB1 ALA 9 3HB ALA 9 -3.474 -16.433 -8.556
44 HB2 ALA 9 1HB ALA 9 -3.837 -18.011 -7.856
45 HB3 ALA 9 2HB ALA 9 -5.062 -16.742 -7.854
46 HA PRO 10 HA PRO 10 -4.642 -12.714 -4.919
47 HB2 PRO 10 1HB PRO 10 -4.057 -10.865 -6.819
48 HB3 PRO 10 2HB PRO 10 -2.870 -11.442 -5.642
49 HG2 PRO 10 1HG PRO 10 -3.270 -12.269 -8.492
50 HG3 PRO 10 2HG PRO 10 -1.759 -11.948 -7.621
51 HD2 PRO 10 1HD PRO 10 -2.678 -14.455 -8.068
52 HD3 PRO 10 2HD PRO 10 -1.748 -14.023 -6.618
53 HA PRO 11 HA PRO 11 -8.604 -12.597 -6.858
54 HB2 PRO 11 1HB PRO 11 -9.571 -10.330 -5.719
55 HB3 PRO 11 2HB PRO 11 -9.405 -11.852 -4.837
56 HG2 PRO 11 1HG PRO 11 -7.598 -9.465 -4.853
57 HG3 PRO 11 2HG PRO 11 -8.129 -10.457 -3.482
58 HD2 PRO 11 1HD PRO 11 -5.697 -10.750 -4.637
59 HD3 PRO 11 2HD PRO 11 -6.583 -12.110 -3.917
60 H ARG 12 H ARG 12 -6.867 -9.486 -6.728
61 HA ARG 12 HA ARG 12 -7.369 -9.097 -9.565
62 HB2 ARG 12 1HB ARG 12 -8.600 -7.457 -7.406
63 HB3 ARG 12 2HB ARG 12 -8.012 -6.615 -8.833
64 HG2 ARG 12 1HG ARG 12 -9.536 -7.653 -10.234
65 HG3 ARG 12 2HG ARG 12 -9.812 -8.985 -9.109
66 HD2 ARG 12 1HD ARG 12 -10.806 -7.245 -7.542
67 HD3 ARG 12 2HD ARG 12 -10.795 -6.151 -8.925
68 HE ARG 12 HE ARG 12 -12.616 -8.303 -8.446
69 HH11 ARG 12 1HH1 ARG 12 -11.061 -6.416 -10.923
70 HH12 ARG 12 2HH1 ARG 12 -12.303 -6.696 -12.098
71 HH21 ARG 12 1HH2 ARG 12 -14.258 -8.678 -9.984
72 HH22 ARG 12 2HH2 ARG 12 -14.121 -7.982 -11.563
73 H HIS 13 H HIS 13 -6.404 -6.745 -10.109
74 HA HIS 13 HA HIS 13 -3.664 -6.845 -9.097
75 HB2 HIS 13 1HB HIS 13 -4.797 -5.293 -11.434
76 HB3 HIS 13 2HB HIS 13 -3.091 -5.467 -11.031
77 HD1 HIS 13 1HD HIS 13 -6.031 -7.588 -12.139
78 HD2 HIS 13 2HD HIS 13 -1.877 -7.638 -12.147
79 HE1 HIS 13 1HE HIS 13 -5.386 -9.592 -13.513
80 HE2 HIS 13 2HE HIS 13 -2.869 -9.651 -13.433
81 H LEU 14 H LEU 14 -2.532 -4.851 -8.588
82 HA LEU 14 HA LEU 14 -4.267 -3.014 -7.123
83 HB2 LEU 14 1HB LEU 14 -1.350 -3.675 -7.024
84 HB3 LEU 14 2HB LEU 14 -1.950 -2.180 -6.309
85 HG LEU 14 HG LEU 14 -3.022 -4.882 -5.533
86 HD11 LEU 14 1HD1 LEU 14 -0.643 -4.923 -5.101
87 HD12 LEU 14 2HD1 LEU 14 -1.525 -4.757 -3.583
88 HD13 LEU 14 3HD1 LEU 14 -0.733 -3.354 -4.301
89 HD21 LEU 14 3HD2 LEU 14 -4.512 -3.354 -4.713
90 HD22 LEU 14 1HD2 LEU 14 -3.299 -2.082 -4.565
91 HD23 LEU 14 2HD2 LEU 14 -3.352 -3.392 -3.384
92 H GLY 15 H GLY 15 -3.335 -0.672 -7.037
93 HA2 GLY 15 1HA GLY 15 -2.273 0.219 -9.602
94 HA3 GLY 15 2HA GLY 15 -3.900 0.754 -9.208
95 H PHE 16 H PHE 16 -0.953 1.897 -9.350
96 HA PHE 16 HA PHE 16 -1.134 3.422 -6.838
97 HB2 PHE 16 1HB PHE 16 1.273 2.877 -8.587
98 HB3 PHE 16 2HB PHE 16 1.284 3.890 -7.147
99 HD1 PHE 16 1HD PHE 16 0.545 2.777 -4.943
100 HD2 PHE 16 2HD PHE 16 1.719 0.614 -8.416
101 HE1 PHE 16 1HE PHE 16 1.004 0.799 -3.553
102 HE2 PHE 16 2HE PHE 16 2.179 -1.367 -7.032
103 HZ PHE 16 HZ PHE 16 1.821 -1.277 -4.597
104 H SER 17 H SER 17 -1.825 5.437 -7.035
105 HA SER 17 HA SER 17 -1.188 6.918 -9.498
106 HB2 SER 17 1HB SER 17 -3.578 6.154 -9.456
107 HB3 SER 17 2HB SER 17 -3.809 7.123 -8.000
108 HG SER 17 HG SER 17 -4.421 8.336 -9.779
109 H ASP 18 H ASP 18 -1.563 9.336 -9.166
110 HA ASP 18 HA ASP 18 -0.612 11.180 -8.178
111 HB2 ASP 18 1HB ASP 18 -2.639 10.082 -6.276
112 HB3 ASP 18 2HB ASP 18 -1.664 11.459 -5.769
113 H VAL 19 H VAL 19 1.194 9.109 -8.071
114 HA VAL 19 HA VAL 19 2.178 8.664 -5.425
115 HB VAL 19 HB VAL 19 3.612 8.294 -8.059
116 HG11 VAL 19 1HG1 VAL 19 5.290 8.207 -6.474
117 HG12 VAL 19 2HG1 VAL 19 4.233 7.520 -5.239
118 HG13 VAL 19 3HG1 VAL 19 4.798 6.517 -6.576
119 HG21 VAL 19 3HG2 VAL 19 2.977 5.830 -7.495
120 HG22 VAL 19 1HG2 VAL 19 1.702 6.577 -6.532
121 HG23 VAL 19 2HG2 VAL 19 1.792 6.885 -8.266
122 H SER 20 H SER 20 3.879 9.613 -4.364
123 HA SER 20 HA SER 20 5.130 11.948 -5.641
124 HB2 SER 20 1HB SER 20 3.904 11.822 -2.880
125 HB3 SER 20 2HB SER 20 4.989 13.110 -3.404
126 HG SER 20 HG SER 20 2.428 12.453 -4.413
127 H HIS 21 H HIS 21 6.965 12.764 -4.061
128 HA HIS 21 HA HIS 21 8.775 10.536 -3.788
129 HB2 HIS 21 1HB HIS 21 10.438 12.278 -3.192
130 HB3 HIS 21 2HB HIS 21 9.621 12.611 -4.716
131 HD1 HIS 21 1HD HIS 21 8.277 14.752 -4.879
132 HD2 HIS 21 2HD HIS 21 9.679 13.998 -1.041
133 HE1 HIS 21 1HE HIS 21 7.832 16.856 -3.576
134 HE2 HIS 21 2HE HIS 21 8.766 16.406 -1.280
135 H ASP 22 H ASP 22 6.549 12.068 -1.786
136 HA ASP 22 HA ASP 22 7.798 10.853 0.582
137 HB2 ASP 22 1HB ASP 22 7.450 12.719 1.926
138 HB3 ASP 22 2HB ASP 22 7.951 13.448 0.402
139 H ALA 23 H ALA 23 5.524 10.261 -1.391
140 HA ALA 23 HA ALA 23 3.792 9.026 0.474
141 HB1 ALA 23 3HB ALA 23 1.750 10.424 -0.487
142 HB2 ALA 23 1HB ALA 23 2.627 10.916 0.963
143 HB3 ALA 23 2HB ALA 23 2.989 11.676 -0.587
144 H ALA 24 H ALA 24 1.891 7.996 -0.631
145 HA ALA 24 HA ALA 24 1.909 7.836 -3.496
146 HB1 ALA 24 3HB ALA 24 2.345 5.136 -2.577
147 HB2 ALA 24 1HB ALA 24 3.168 6.039 -3.849
148 HB3 ALA 24 2HB ALA 24 3.713 6.175 -2.176
149 H ARG 25 H ARG 25 -0.085 7.368 -4.170
150 HA ARG 25 HA ARG 25 -2.026 6.426 -2.201
151 HB2 ARG 25 1HB ARG 25 -2.431 8.487 -3.603
152 HB3 ARG 25 2HB ARG 25 -2.561 7.425 -4.999
153 HG2 ARG 25 1HG ARG 25 -4.447 6.273 -3.931
154 HG3 ARG 25 2HG ARG 25 -4.329 7.381 -2.562
155 HD2 ARG 25 1HD ARG 25 -4.619 8.461 -5.333
156 HD3 ARG 25 2HD ARG 25 -6.034 7.845 -4.481
157 HE ARG 25 HE ARG 25 -4.451 9.763 -3.006
158 HH11 ARG 25 1HH1 ARG 25 -7.131 9.250 -5.168
159 HH12 ARG 25 2HH1 ARG 25 -7.914 10.741 -4.761
160 HH21 ARG 25 1HH2 ARG 25 -5.472 11.729 -2.461
161 HH22 ARG 25 2HH2 ARG 25 -6.969 12.151 -3.222
162 H VAL 26 H VAL 26 -2.678 4.386 -2.154
163 HA VAL 26 HA VAL 26 -2.279 2.726 -4.557
164 HB VAL 26 HB VAL 26 -0.902 1.889 -2.797
165 HG11 VAL 26 1HG1 VAL 26 -3.349 1.817 -1.036
166 HG12 VAL 26 2HG1 VAL 26 -1.711 1.341 -0.587
167 HG13 VAL 26 3HG1 VAL 26 -2.073 3.030 -0.943
168 HG21 VAL 26 3HG2 VAL 26 -3.217 0.038 -2.538
169 HG22 VAL 26 1HG2 VAL 26 -2.553 0.338 -4.144
170 HG23 VAL 26 2HG2 VAL 26 -1.522 -0.314 -2.871
171 H PHE 27 H PHE 27 -3.988 1.750 -5.455
172 HA PHE 27 HA PHE 27 -6.474 1.527 -3.914
173 HB2 PHE 27 1HB PHE 27 -7.802 2.415 -5.718
174 HB3 PHE 27 2HB PHE 27 -6.551 3.589 -5.324
175 HD1 PHE 27 2HD PHE 27 -7.636 1.068 -7.771
176 HD2 PHE 27 1HD PHE 27 -4.875 4.187 -6.899
177 HE1 PHE 27 2HE PHE 27 -6.921 1.088 -10.125
178 HE2 PHE 27 1HE PHE 27 -4.156 4.214 -9.252
179 HZ PHE 27 HZ PHE 27 -5.179 2.662 -10.868
180 H TRP 28 H TRP 28 -7.965 -0.053 -4.732
181 HA TRP 28 HA TRP 28 -6.742 -2.010 -6.562
182 HB2 TRP 28 1HB TRP 28 -8.039 -3.732 -5.113
183 HB3 TRP 28 2HB TRP 28 -6.511 -3.095 -4.511
184 HD1 TRP 28 HD TRP 28 -10.143 -3.374 -3.636
185 HE1 TRP 28 1HE TRP 28 -10.590 -2.202 -1.389
186 HE3 TRP 28 3HE TRP 28 -5.676 -0.950 -3.082
187 HZ2 TRP 28 2HZ TRP 28 -9.230 -0.478 0.384
188 HZ3 TRP 28 3HZ TRP 28 -5.330 0.442 -1.083
189 HH2 TRP 28 HH TRP 28 -7.071 0.672 0.613
190 H GLU 29 H GLU 29 -8.354 -3.524 -7.522
191 HA GLU 29 HA GLU 29 -10.601 -2.006 -8.511
192 HB2 GLU 29 1HB GLU 29 -9.371 -4.655 -9.183
193 HB3 GLU 29 2HB GLU 29 -10.980 -4.263 -9.773
194 HG2 GLU 29 1HG GLU 29 -10.038 -2.210 -10.803
195 HG3 GLU 29 2HG GLU 29 -8.434 -2.760 -10.322
196 H GLY 30 H GLY 30 -10.346 -3.265 -5.680
197 HA2 GLY 30 1HA GLY 30 -12.049 -3.757 -4.165
198 HA3 GLY 30 2HA GLY 30 -13.150 -3.986 -5.515
199 H ALA 31 H ALA 31 -13.691 -5.807 -3.908
200 HA ALA 31 HA ALA 31 -12.153 -8.187 -4.714
201 HB1 ALA 31 3HB ALA 31 -11.737 -8.734 -2.604
202 HB2 ALA 31 1HB ALA 31 -12.408 -7.181 -2.108
203 HB3 ALA 31 2HB ALA 31 -13.446 -8.605 -2.189
204 HA PRO 32 HA PRO 32 -15.946 -9.950 -6.049
205 HB2 PRO 32 1HB PRO 32 -15.522 -12.580 -5.527
206 HB3 PRO 32 2HB PRO 32 -14.710 -11.718 -6.838
207 HG2 PRO 32 1HG PRO 32 -13.695 -12.400 -4.106
208 HG3 PRO 32 2HG PRO 32 -12.863 -12.509 -5.668
209 HD2 PRO 32 1HD PRO 32 -12.465 -10.458 -3.945
210 HD3 PRO 32 2HD PRO 32 -12.374 -10.257 -5.706
211 H ARG 33 H ARG 33 -15.151 -9.721 -2.840
212 HA ARG 33 HA ARG 33 -17.842 -10.517 -2.037
213 HB2 ARG 33 1HB ARG 33 -16.866 -11.620 0.024
214 HB3 ARG 33 2HB ARG 33 -16.665 -12.499 -1.486
215 HG2 ARG 33 1HG ARG 33 -14.370 -11.770 -1.653
216 HG3 ARG 33 2HG ARG 33 -14.557 -10.769 -0.211
217 HD2 ARG 33 1HD ARG 33 -13.580 -12.633 0.697
218 HD3 ARG 33 2HD ARG 33 -15.286 -13.040 0.882
219 HE ARG 33 HE ARG 33 -13.373 -14.295 -0.890
220 HH11 ARG 33 1HH1 ARG 33 -16.726 -13.812 -0.087
221 HH12 ARG 33 2HH1 ARG 33 -17.262 -15.244 -0.901
222 HH21 ARG 33 1HH2 ARG 33 -14.066 -16.183 -1.965
223 HH22 ARG 33 2HH2 ARG 33 -15.748 -16.593 -1.968
224 HA PRO 34 HA PRO 34 -17.710 -6.859 0.386
225 HB2 PRO 34 1HB PRO 34 -19.330 -7.535 2.457
226 HB3 PRO 34 2HB PRO 34 -19.937 -7.213 0.829
227 HG2 PRO 34 1HG PRO 34 -19.390 -9.837 2.163
228 HG3 PRO 34 2HG PRO 34 -20.769 -9.360 1.155
229 HD2 PRO 34 1HD PRO 34 -18.705 -10.831 0.200
230 HD3 PRO 34 2HD PRO 34 -19.605 -9.680 -0.809
231 H VAL 35 H VAL 35 -16.635 -5.926 2.088
232 HA VAL 35 HA VAL 35 -15.354 -7.737 4.026
233 HB VAL 35 HB VAL 35 -13.987 -5.288 2.931
234 HG11 VAL 35 1HG1 VAL 35 -12.087 -6.043 4.021
235 HG12 VAL 35 2HG1 VAL 35 -13.371 -6.468 5.156
236 HG13 VAL 35 3HG1 VAL 35 -12.672 -7.704 4.108
237 HG21 VAL 35 3HG2 VAL 35 -12.686 -6.777 1.479
238 HG22 VAL 35 1HG2 VAL 35 -13.701 -8.134 1.968
239 HG23 VAL 35 2HG2 VAL 35 -14.399 -6.793 1.058
240 H ARG 36 H ARG 36 -15.015 -6.920 6.100
241 HA ARG 36 HA ARG 36 -16.798 -4.744 6.826
242 HB2 ARG 36 1HB ARG 36 -16.592 -5.498 9.064
243 HB3 ARG 36 2HB ARG 36 -16.684 -6.946 8.071
244 HG2 ARG 36 1HG ARG 36 -14.367 -7.365 8.303
245 HG3 ARG 36 2HG ARG 36 -14.083 -5.772 9.007
246 HD2 ARG 36 1HD ARG 36 -15.643 -6.497 10.881
247 HD3 ARG 36 2HD ARG 36 -15.496 -8.128 10.227
248 HE ARG 36 HE ARG 36 -12.933 -7.020 10.635
249 HH11 ARG 36 1HH1 ARG 36 -15.658 -8.291 12.391
250 HH12 ARG 36 2HH1 ARG 36 -14.708 -8.821 13.739
251 HH21 ARG 36 1HH2 ARG 36 -11.672 -7.714 12.405
252 HH22 ARG 36 2HH2 ARG 36 -12.441 -8.492 13.747
253 H LEU 37 H LEU 37 -13.359 -5.506 6.872
254 HA LEU 37 HA LEU 37 -12.749 -2.677 7.110
255 HB2 LEU 37 1HB LEU 37 -12.844 -3.938 9.422
256 HB3 LEU 37 2HB LEU 37 -11.245 -4.492 8.930
257 HG LEU 37 HG LEU 37 -11.828 -1.569 8.878
258 HD11 LEU 37 1HD1 LEU 37 -10.998 -1.508 11.268
259 HD12 LEU 37 2HD1 LEU 37 -11.385 -3.227 11.345
260 HD13 LEU 37 3HD1 LEU 37 -12.659 -2.049 11.029
261 HD21 LEU 37 3HD2 LEU 37 -9.569 -3.291 8.600
262 HD22 LEU 37 1HD2 LEU 37 -9.328 -2.242 9.997
263 HD23 LEU 37 2HD2 LEU 37 -9.660 -1.539 8.414
264 H VAL 38 H VAL 38 -10.399 -2.257 6.780
265 HA VAL 38 HA VAL 38 -9.012 -4.404 5.345
266 HB VAL 38 HB VAL 38 -9.342 -1.619 4.222
267 HG11 VAL 38 1HG1 VAL 38 -8.242 -2.582 2.230
268 HG12 VAL 38 2HG1 VAL 38 -7.198 -2.576 3.653
269 HG13 VAL 38 3HG1 VAL 38 -7.971 -4.073 3.131
270 HG21 VAL 38 3HG2 VAL 38 -11.386 -2.499 3.717
271 HG22 VAL 38 1HG2 VAL 38 -10.459 -3.142 2.361
272 HG23 VAL 38 2HG2 VAL 38 -10.803 -4.163 3.757
273 H ARG 39 H ARG 39 -6.966 -4.563 5.977
274 HA ARG 39 HA ARG 39 -5.719 -2.226 7.268
275 HB2 ARG 39 1HB ARG 39 -6.206 -4.502 8.528
276 HB3 ARG 39 2HB ARG 39 -4.715 -4.998 7.738
277 HG2 ARG 39 1HG ARG 39 -3.441 -3.411 8.879
278 HG3 ARG 39 2HG ARG 39 -4.861 -2.470 9.337
279 HD2 ARG 39 1HD ARG 39 -4.322 -5.268 10.312
280 HD3 ARG 39 2HD ARG 39 -3.828 -3.819 11.185
281 HE ARG 39 HE ARG 39 -6.496 -3.466 10.754
282 HH11 ARG 39 1HH1 ARG 39 -4.559 -5.962 12.217
283 HH12 ARG 39 2HH1 ARG 39 -5.791 -6.444 13.335
284 HH21 ARG 39 1HH2 ARG 39 -8.126 -4.091 12.221
285 HH22 ARG 39 2HH2 ARG 39 -7.820 -5.380 13.336
286 H VAL 40 H VAL 40 -4.302 -1.285 5.960
287 HA VAL 40 HA VAL 40 -2.819 -2.915 4.026
288 HB VAL 40 HB VAL 40 -3.080 0.090 4.204
289 HG11 VAL 40 1HG1 VAL 40 -2.221 -0.189 1.766
290 HG12 VAL 40 2HG1 VAL 40 -1.071 -0.223 3.104
291 HG13 VAL 40 3HG1 VAL 40 -1.598 -1.730 2.354
292 HG21 VAL 40 3HG2 VAL 40 -5.094 -1.468 3.540
293 HG22 VAL 40 1HG2 VAL 40 -4.758 0.014 2.644
294 HG23 VAL 40 2HG2 VAL 40 -4.240 -1.544 1.999
295 H THR 41 H THR 41 -0.553 -2.708 3.795
296 HA THR 41 HA THR 41 0.904 -1.346 5.928
297 HB THR 41 HB THR 41 2.344 -3.466 6.173
298 HG1 THR 41 1HG THR 41 0.028 -4.467 4.887
299 HG21 THR 41 3HG2 THR 41 1.349 -3.609 8.163
300 HG22 THR 41 1HG2 THR 41 -0.121 -4.261 7.439
301 HG23 THR 41 2HG2 THR 41 0.104 -2.516 7.559
302 H TYR 42 H TYR 42 2.784 -0.493 5.248
303 HA TYR 42 HA TYR 42 3.850 -1.394 2.654
304 HB2 TYR 42 1HB TYR 42 4.526 1.037 2.313
305 HB3 TYR 42 2HB TYR 42 2.809 0.677 2.166
306 HD1 TYR 42 2HD TYR 42 1.251 1.333 3.979
307 HD2 TYR 42 1HD TYR 42 5.348 2.479 4.031
308 HE1 TYR 42 2HE TYR 42 0.742 3.054 5.661
309 HE2 TYR 42 1HE TYR 42 4.851 4.202 5.714
310 HH TYR 42 HH TYR 42 2.743 4.378 7.599
311 H VAL 43 H VAL 43 6.070 -1.426 2.425
312 HA VAL 43 HA VAL 43 7.725 -0.544 4.665
313 HB VAL 43 HB VAL 43 7.132 -2.921 5.112
314 HG11 VAL 43 1HG1 VAL 43 8.498 -4.543 3.581
315 HG12 VAL 43 2HG1 VAL 43 6.890 -4.003 3.095
316 HG13 VAL 43 3HG1 VAL 43 8.325 -3.249 2.397
317 HG21 VAL 43 3HG2 VAL 43 9.216 -3.429 5.924
318 HG22 VAL 43 1HG2 VAL 43 10.037 -2.899 4.456
319 HG23 VAL 43 2HG2 VAL 43 9.416 -1.708 5.598
320 H SER 44 H SER 44 9.885 -0.160 4.133
321 HA SER 44 HA SER 44 10.401 0.741 1.544
322 HB2 SER 44 1HB SER 44 11.679 1.621 3.377
323 HB3 SER 44 2HB SER 44 12.292 0.021 3.792
324 HG SER 44 HG SER 44 13.497 0.018 1.915
325 H SER 45 H SER 45 12.134 -0.014 0.079
326 HA SER 45 HA SER 45 11.651 -2.613 -0.827
327 HB2 SER 45 1HB SER 45 12.739 -0.512 -2.000
328 HB3 SER 45 2HB SER 45 14.244 -1.266 -1.475
329 HG SER 45 HG SER 45 13.211 -3.240 -2.499
330 H GLU 46 H GLU 46 14.479 -1.319 0.907
331 HA GLU 46 HA GLU 46 15.634 -3.943 1.206
332 HB2 GLU 46 1HB GLU 46 17.370 -2.773 2.517
333 HB3 GLU 46 2HB GLU 46 17.109 -2.038 0.942
334 HG2 GLU 46 1HG GLU 46 17.170 -0.162 2.205
335 HG3 GLU 46 2HG GLU 46 15.449 -0.519 2.330
336 H GLY 47 H GLY 47 13.073 -3.905 2.276
337 HA2 GLY 47 1HA GLY 47 11.856 -4.158 4.238
338 HA3 GLY 47 2HA GLY 47 13.195 -5.238 4.600
339 H GLY 48 H GLY 48 11.944 -1.975 5.020
340 HA2 GLY 48 1HA GLY 48 13.419 -1.812 7.544
341 HA3 GLY 48 2HA GLY 48 13.686 -0.537 6.365
342 H HIS 49 H HIS 49 12.641 1.235 6.961
343 HA HIS 49 HA HIS 49 10.626 1.476 8.806
344 HB2 HIS 49 1HB HIS 49 11.550 3.513 8.251
345 HB3 HIS 49 2HB HIS 49 11.533 3.172 6.524
346 HD1 HIS 49 1HD HIS 49 10.031 4.766 5.399
347 HD2 HIS 49 2HD HIS 49 8.539 3.604 9.098
348 HE1 HIS 49 1HE HIS 49 7.817 5.936 5.629
349 HE2 HIS 49 2HE HIS 49 6.973 5.286 7.911
350 H SER 50 H SER 50 8.621 0.735 8.874
351 HA SER 50 HA SER 50 7.065 0.615 6.382
352 HB2 SER 50 1HB SER 50 7.549 -1.650 6.618
353 HB3 SER 50 2HB SER 50 7.538 -1.573 8.380
354 HG SER 50 HG SER 50 5.598 -2.388 6.884
355 H GLY 51 H GLY 51 4.740 0.633 6.699
356 HA2 GLY 51 1HA GLY 51 3.949 1.783 9.303
357 HA3 GLY 51 2HA GLY 51 3.413 2.482 7.782
358 H GLN 52 H GLN 52 1.254 2.162 8.668
359 HA GLN 52 HA GLN 52 0.019 -0.145 7.608
360 HB2 GLN 52 1HB GLN 52 0.943 -1.229 9.592
361 HB3 GLN 52 2HB GLN 52 0.199 -0.014 10.623
362 HG2 GLN 52 1HG GLN 52 -1.960 -0.819 10.208
363 HG3 GLN 52 2HG GLN 52 -1.431 -1.762 8.816
364 HE21 GLN 52 1HE2 GLN 52 -0.506 -1.460 12.233
365 HE22 GLN 52 2HE2 GLN 52 -0.494 -3.158 12.555
366 H THR 53 H THR 53 -1.684 0.853 6.762
367 HA THR 53 HA THR 53 -3.148 2.795 8.426
368 HB THR 53 HB THR 53 -2.165 3.702 6.316
369 HG1 THR 53 1HG THR 53 -4.249 4.408 7.345
370 HG21 THR 53 3HG2 THR 53 -2.324 1.863 4.818
371 HG22 THR 53 1HG2 THR 53 -3.418 3.101 4.203
372 HG23 THR 53 2HG2 THR 53 -4.061 1.712 5.079
373 H GLU 54 H GLU 54 -5.335 2.596 8.694
374 HA GLU 54 HA GLU 54 -6.509 0.071 7.755
375 HB2 GLU 54 1HB GLU 54 -6.941 1.764 10.184
376 HB3 GLU 54 2HB GLU 54 -8.245 0.732 9.613
377 HG2 GLU 54 1HG GLU 54 -7.226 -0.653 11.112
378 HG3 GLU 54 2HG GLU 54 -6.396 -1.112 9.627
379 H ALA 55 H ALA 55 -8.555 0.022 6.822
380 HA ALA 55 HA ALA 55 -9.987 2.499 6.355
381 HB1 ALA 55 3HB ALA 55 -9.226 2.908 4.313
382 HB2 ALA 55 1HB ALA 55 -8.149 1.516 4.424
383 HB3 ALA 55 2HB ALA 55 -9.782 1.319 3.788
384 HA PRO 56 HA PRO 56 -13.481 -0.158 6.406
385 HB2 PRO 56 1HB PRO 56 -15.210 1.210 4.822
386 HB3 PRO 56 2HB PRO 56 -14.775 1.740 6.451
387 HG2 PRO 56 1HG PRO 56 -13.723 2.678 3.810
388 HG3 PRO 56 2HG PRO 56 -14.175 3.630 5.237
389 HD2 PRO 56 1HD PRO 56 -11.603 3.029 4.642
390 HD3 PRO 56 2HD PRO 56 -12.182 3.200 6.311
391 H GLY 57 H GLY 57 -14.531 -1.767 5.248
392 HA2 GLY 57 1HA GLY 57 -13.244 -2.894 3.062
393 HA3 GLY 57 2HA GLY 57 -14.891 -3.268 3.549
394 H ASN 58 H ASN 58 -15.310 -0.197 3.093
395 HA ASN 58 HA ASN 58 -16.210 -0.535 0.354
396 HB2 ASN 58 1HB ASN 58 -17.372 1.597 0.691
397 HB3 ASN 58 2HB ASN 58 -17.721 0.481 2.008
398 HD21 ASN 58 1HD2 ASN 58 -17.940 1.603 3.799
399 HD22 ASN 58 2HD2 ASN 58 -16.894 2.866 4.342
400 H ALA 59 H ALA 59 -13.794 1.245 2.150
401 HA ALA 59 HA ALA 59 -13.087 3.131 0.192
402 HB1 ALA 59 3HB ALA 59 -11.939 2.113 2.682
403 HB2 ALA 59 1HB ALA 59 -10.743 2.679 1.515
404 HB3 ALA 59 2HB ALA 59 -12.025 3.761 2.060
405 H THR 60 H THR 60 -12.463 2.684 -1.812
406 HA THR 60 HA THR 60 -10.927 0.244 -2.338
407 HB THR 60 HB THR 60 -11.387 0.788 -4.756
408 HG1 THR 60 1HG THR 60 -13.280 2.628 -3.697
409 HG21 THR 60 3HG2 THR 60 -13.953 0.365 -4.450
410 HG22 THR 60 1HG2 THR 60 -13.520 0.190 -2.750
411 HG23 THR 60 2HG2 THR 60 -12.789 -0.865 -3.960
412 H SER 61 H SER 61 -9.875 2.824 -1.177
413 HA SER 61 HA SER 61 -7.412 2.862 -2.592
414 HB2 SER 61 1HB SER 61 -7.537 5.314 -3.226
415 HB3 SER 61 2HB SER 61 -8.518 4.229 -4.211
416 HG SER 61 HG SER 61 -9.696 5.383 -1.957
417 H ALA 62 H ALA 62 -5.807 3.594 -1.306
418 HA ALA 62 HA ALA 62 -6.460 5.307 0.973
419 HB1 ALA 62 3HB ALA 62 -6.647 2.933 1.715
420 HB2 ALA 62 1HB ALA 62 -4.938 2.731 1.327
421 HB3 ALA 62 2HB ALA 62 -5.429 3.869 2.583
422 H MET 63 H MET 63 -4.799 6.617 1.640
423 HA MET 63 HA MET 63 -2.517 6.768 -0.157
424 HB2 MET 63 1HB MET 63 -3.602 8.604 1.972
425 HB3 MET 63 2HB MET 63 -2.058 8.895 1.182
426 HG2 MET 63 1HG MET 63 -3.530 8.623 -0.994
427 HG3 MET 63 2HG MET 63 -4.814 9.111 0.111
428 HE1 MET 63 3HE MET 63 -1.986 9.834 -1.988
429 HE2 MET 63 1HE MET 63 -1.760 11.583 -1.970
430 HE3 MET 63 2HE MET 63 -0.945 10.577 -0.773
431 H LEU 64 H LEU 64 -0.359 7.338 0.853
432 HA LEU 64 HA LEU 64 0.107 6.089 3.445
433 HB2 LEU 64 1HB LEU 64 1.732 5.271 1.052
434 HB3 LEU 64 2HB LEU 64 1.768 4.583 2.674
435 HG LEU 64 HG LEU 64 -0.669 4.391 0.927
436 HD11 LEU 64 1HD1 LEU 64 1.877 2.913 0.742
437 HD12 LEU 64 2HD1 LEU 64 0.644 3.213 -0.481
438 HD13 LEU 64 3HD1 LEU 64 0.405 1.943 0.718
439 HD21 LEU 64 3HD2 LEU 64 -1.518 3.364 2.699
440 HD22 LEU 64 1HD2 LEU 64 -0.017 3.633 3.584
441 HD23 LEU 64 2HD2 LEU 64 -0.225 2.165 2.629
442 H GLY 65 H GLY 65 2.010 6.761 4.468
443 HA2 GLY 65 1HA GLY 65 4.242 7.946 3.737
444 HA3 GLY 65 2HA GLY 65 3.112 9.240 3.367
445 HA PRO 66 HA PRO 66 4.859 10.574 3.920
446 HB2 PRO 66 1HB PRO 66 7.132 11.216 5.259
447 HB3 PRO 66 2HB PRO 66 5.663 12.196 5.335
448 HG2 PRO 66 1HG PRO 66 6.692 10.171 7.285
449 HG3 PRO 66 2HG PRO 66 5.980 11.765 7.598
450 HD2 PRO 66 1HD PRO 66 4.575 9.465 7.856
451 HD3 PRO 66 2HD PRO 66 3.824 10.990 7.345
452 H LEU 67 H LEU 67 6.110 9.588 2.447
453 HA LEU 67 HA LEU 67 7.628 7.217 3.299
454 HB2 LEU 67 1HB LEU 67 6.811 7.844 0.481
455 HB3 LEU 67 2HB LEU 67 7.300 6.294 1.162
456 HG LEU 67 HG LEU 67 4.712 7.727 1.760
457 HD11 LEU 67 1HD1 LEU 67 3.896 5.546 0.544
458 HD12 LEU 67 2HD1 LEU 67 5.483 5.642 -0.218
459 HD13 LEU 67 3HD1 LEU 67 4.349 6.984 -0.372
460 HD21 LEU 67 3HD2 LEU 67 5.555 6.337 3.611
461 HD22 LEU 67 1HD2 LEU 67 5.636 4.957 2.516
462 HD23 LEU 67 2HD2 LEU 67 4.077 5.688 2.899
463 H SER 68 H SER 68 9.420 6.750 1.499
464 HA SER 68 HA SER 68 11.170 9.085 1.593
465 HB2 SER 68 1HB SER 68 11.771 6.626 2.306
466 HB3 SER 68 2HB SER 68 12.055 6.407 0.579
467 HG SER 68 HG SER 68 13.751 7.696 0.677
468 H SER 69 H SER 69 12.820 8.989 -0.402
469 HA SER 69 HA SER 69 11.131 9.136 -2.810
470 HB2 SER 69 1HB SER 69 12.897 10.745 -3.643
471 HB3 SER 69 2HB SER 69 11.959 11.316 -2.264
472 HG SER 69 HG SER 69 13.844 11.608 -1.387
473 H SER 70 H SER 70 11.917 8.352 -4.776
474 HA SER 70 HA SER 70 12.901 6.767 -6.086
475 HB2 SER 70 1HB SER 70 14.710 8.409 -6.081
476 HB3 SER 70 2HB SER 70 15.353 7.725 -4.588
477 HG SER 70 HG SER 70 16.522 6.750 -6.130
478 H THR 71 H THR 71 11.890 5.948 -3.433
479 HA THR 71 HA THR 71 13.513 3.509 -3.096
480 HB THR 71 HB THR 71 11.942 4.977 -0.968
481 HG1 THR 71 1HG THR 71 14.236 5.596 -1.781
482 HG21 THR 71 3HG2 THR 71 12.541 2.246 -1.139
483 HG22 THR 71 1HG2 THR 71 11.993 3.131 0.284
484 HG23 THR 71 2HG2 THR 71 13.718 2.919 -0.012
485 H THR 72 H THR 72 12.497 1.644 -3.447
486 HA THR 72 HA THR 72 9.716 1.644 -4.186
487 HB THR 72 HB THR 72 11.518 -0.760 -3.875
488 HG1 THR 72 1HG THR 72 11.794 -0.412 -6.214
489 HG21 THR 72 3HG2 THR 72 9.607 -0.845 -6.026
490 HG22 THR 72 1HG2 THR 72 8.794 -0.509 -4.498
491 HG23 THR 72 2HG2 THR 72 9.802 -1.947 -4.663
492 H TYR 73 H TYR 73 8.104 1.464 -2.789
493 HA TYR 73 HA TYR 73 8.599 0.140 -0.211
494 HB2 TYR 73 1HB TYR 73 6.781 2.345 -1.080
495 HB3 TYR 73 2HB TYR 73 6.289 1.333 0.273
496 HD1 TYR 73 1HD TYR 73 8.890 3.666 -0.928
497 HD2 TYR 73 2HD TYR 73 7.302 1.564 2.412
498 HE1 TYR 73 1HE TYR 73 10.295 5.010 0.578
499 HE2 TYR 73 2HE TYR 73 8.702 2.903 3.928
500 HH TYR 73 HH TYR 73 11.102 4.253 3.502
501 H THR 74 H THR 74 7.856 -1.853 -0.003
502 HA THR 74 HA THR 74 5.986 -2.975 -1.871
503 HB THR 74 HB THR 74 7.068 -4.218 0.663
504 HG1 THR 74 1HG THR 74 8.163 -3.839 -1.879
505 HG21 THR 74 3HG2 THR 74 6.044 -6.127 0.072
506 HG22 THR 74 1HG2 THR 74 6.443 -5.920 -1.633
507 HG23 THR 74 2HG2 THR 74 5.036 -5.104 -0.951
508 H VAL 75 H VAL 75 3.942 -2.232 -1.688
509 HA VAL 75 HA VAL 75 2.713 -1.825 0.898
510 HB VAL 75 HB VAL 75 1.609 -1.566 -1.900
511 HG11 VAL 75 1HG1 VAL 75 -0.218 -0.269 -0.599
512 HG12 VAL 75 2HG1 VAL 75 -0.298 -2.031 -0.664
513 HG13 VAL 75 3HG1 VAL 75 0.320 -1.227 0.780
514 HG21 VAL 75 3HG2 VAL 75 2.182 0.613 -1.840
515 HG22 VAL 75 1HG2 VAL 75 1.820 0.767 -0.121
516 HG23 VAL 75 2HG2 VAL 75 3.356 0.073 -0.640
517 H ARG 76 H ARG 76 0.855 -2.914 1.656
518 HA ARG 76 HA ARG 76 0.111 -5.400 0.315
519 HB2 ARG 76 1HB ARG 76 1.991 -5.638 2.158
520 HB3 ARG 76 2HB ARG 76 0.619 -5.536 3.255
521 HG2 ARG 76 1HG ARG 76 -0.316 -7.516 2.468
522 HG3 ARG 76 2HG ARG 76 0.634 -7.482 0.981
523 HD2 ARG 76 1HD ARG 76 2.628 -8.048 2.146
524 HD3 ARG 76 2HD ARG 76 1.857 -7.799 3.712
525 HE ARG 76 HE ARG 76 0.541 -9.821 2.202
526 HH11 ARG 76 1HH1 ARG 76 3.331 -9.192 4.187
527 HH12 ARG 76 2HH1 ARG 76 3.499 -10.838 4.700
528 HH21 ARG 76 1HH2 ARG 76 0.752 -11.992 2.870
529 HH22 ARG 76 2HH2 ARG 76 2.032 -12.430 3.950
530 H VAL 77 H VAL 77 -1.991 -4.987 -0.006
531 HA VAL 77 HA VAL 77 -3.567 -3.703 2.087
532 HB VAL 77 HB VAL 77 -4.386 -4.531 -0.701
533 HG11 VAL 77 1HG1 VAL 77 -5.797 -3.100 1.517
534 HG12 VAL 77 2HG1 VAL 77 -6.216 -2.780 -0.168
535 HG13 VAL 77 3HG1 VAL 77 -6.374 -4.411 0.488
536 HG21 VAL 77 3HG2 VAL 77 -3.304 -2.726 -1.413
537 HG22 VAL 77 1HG2 VAL 77 -4.362 -1.732 -0.412
538 HG23 VAL 77 2HG2 VAL 77 -2.830 -2.318 0.235
539 H THR 78 H THR 78 -3.904 -5.230 3.653
540 HA THR 78 HA THR 78 -4.928 -7.854 2.902
541 HB THR 78 HB THR 78 -4.339 -6.768 5.663
542 HG1 THR 78 1HG THR 78 -2.332 -7.079 5.085
543 HG21 THR 78 3HG2 THR 78 -5.928 -8.794 5.283
544 HG22 THR 78 1HG2 THR 78 -4.646 -8.916 6.487
545 HG23 THR 78 2HG2 THR 78 -4.442 -9.663 4.902
546 H CYS 79 H CYS 79 -7.038 -8.061 2.569
547 HA CYS 79 HA CYS 79 -8.909 -6.264 3.903
548 HB2 CYS 79 1HB CYS 79 -9.108 -8.151 1.575
549 HB3 CYS 79 2HB CYS 79 -10.564 -7.567 2.372
550 HG CYS 79 HG CYS 79 -10.712 -5.433 0.970
551 H LEU 80 H LEU 80 -9.600 -6.861 5.846
552 HA LEU 80 HA LEU 80 -9.695 -9.655 6.606
553 HB2 LEU 80 1HB LEU 80 -9.975 -7.045 8.001
554 HB3 LEU 80 2HB LEU 80 -10.707 -8.466 8.744
555 HG LEU 80 HG LEU 80 -8.587 -8.195 9.750
556 HD11 LEU 80 1HD1 LEU 80 -7.756 -10.297 9.486
557 HD12 LEU 80 2HD1 LEU 80 -7.828 -10.229 7.726
558 HD13 LEU 80 3HD1 LEU 80 -9.300 -10.498 8.658
559 HD21 LEU 80 3HD2 LEU 80 -7.023 -7.018 8.700
560 HD22 LEU 80 1HD2 LEU 80 -7.837 -7.223 7.149
561 HD23 LEU 80 2HD2 LEU 80 -6.689 -8.439 7.709
562 H TYR 81 H TYR 81 -11.378 -10.808 5.916
563 HA TYR 81 HA TYR 81 -13.941 -9.634 5.385
564 HB2 TYR 81 1HB TYR 81 -13.161 -12.555 5.478
565 HB3 TYR 81 2HB TYR 81 -14.625 -11.890 4.761
566 HD1 TYR 81 2HD TYR 81 -13.975 -9.830 3.043
567 HD2 TYR 81 1HD TYR 81 -11.587 -13.234 3.949
568 HE1 TYR 81 2HE TYR 81 -12.811 -9.580 0.890
569 HE2 TYR 81 1HE TYR 81 -10.416 -12.992 1.800
570 HH TYR 81 HH TYR 81 -10.795 -11.994 -0.402
571 HA PRO 82 HA PRO 82 -15.837 -10.131 9.320
572 HB2 PRO 82 1HB PRO 82 -18.428 -10.399 8.556
573 HB3 PRO 82 2HB PRO 82 -17.562 -8.860 8.490
574 HG2 PRO 82 1HG PRO 82 -18.120 -10.814 6.293
575 HG3 PRO 82 2HG PRO 82 -18.229 -9.045 6.270
576 HD2 PRO 82 1HD PRO 82 -16.116 -10.387 5.239
577 HD3 PRO 82 2HD PRO 82 -15.957 -8.783 5.982
578 H GLY 83 H GLY 83 -16.048 -12.563 6.875
579 HA2 GLY 83 1HA GLY 83 -17.514 -14.482 8.420
580 HA3 GLY 83 2HA GLY 83 -16.627 -14.797 6.936
581 H GLY 84 H GLY 84 -14.358 -15.224 7.061
582 HA2 GLY 84 1HA GLY 84 -13.186 -15.621 9.689
583 HA3 GLY 84 2HA GLY 84 -13.498 -17.091 8.778
584 H GLY 85 H GLY 85 -12.761 -16.656 6.297
585 HA2 GLY 85 1HA GLY 85 -9.929 -16.605 6.421
586 HA3 GLY 85 2HA GLY 85 -10.895 -16.654 4.954
587 H SER 86 H SER 86 -8.809 -15.265 4.522
588 HA SER 86 HA SER 86 -9.733 -12.549 4.301
589 HB2 SER 86 1HB SER 86 -7.720 -11.562 5.397
590 HB3 SER 86 2HB SER 86 -8.777 -12.411 6.525
591 HG SER 86 HG SER 86 -6.825 -13.982 5.392
592 H SER 87 H SER 87 -8.407 -11.261 2.888
593 HA SER 87 HA SER 87 -6.651 -12.901 1.180
594 HB2 SER 87 1HB SER 87 -8.813 -12.171 0.131
595 HB3 SER 87 2HB SER 87 -8.278 -10.501 0.316
596 HG SER 87 HG SER 87 -7.831 -11.843 -1.743
597 H THR 88 H THR 88 -5.231 -11.340 -0.243
598 HA THR 88 HA THR 88 -4.321 -8.966 1.114
599 HB THR 88 HB THR 88 -2.478 -11.358 0.944
600 HG1 THR 88 1HG THR 88 -3.958 -10.175 3.005
601 HG21 THR 88 3HG2 THR 88 -1.305 -9.366 2.494
602 HG22 THR 88 1HG2 THR 88 -1.965 -8.511 1.101
603 HG23 THR 88 2HG2 THR 88 -0.836 -9.845 0.863
604 H LEU 89 H LEU 89 -3.406 -7.570 -0.285
605 HA LEU 89 HA LEU 89 -2.676 -8.599 -2.949
606 HB2 LEU 89 1HB LEU 89 -4.268 -6.230 -2.111
607 HB3 LEU 89 2HB LEU 89 -3.267 -6.094 -3.555
608 HG LEU 89 HG LEU 89 -5.379 -8.210 -3.169
609 HD11 LEU 89 1HD1 LEU 89 -6.912 -6.906 -4.321
610 HD12 LEU 89 2HD1 LEU 89 -5.673 -5.810 -4.932
611 HD13 LEU 89 3HD1 LEU 89 -6.145 -5.747 -3.234
612 HD21 LEU 89 3HD2 LEU 89 -3.934 -7.259 -5.639
613 HD22 LEU 89 1HD2 LEU 89 -5.135 -8.548 -5.551
614 HD23 LEU 89 2HD2 LEU 89 -3.572 -8.743 -4.757
615 H THR 90 H THR 90 -0.549 -8.515 -3.201
616 HA THR 90 HA THR 90 1.020 -6.504 -1.789
617 HB THR 90 HB THR 90 2.985 -7.760 -2.534
618 HG1 THR 90 1HG THR 90 2.044 -8.481 -4.554
619 HG21 THR 90 3HG2 THR 90 1.397 -10.043 -1.664
620 HG22 THR 90 1HG2 THR 90 1.101 -8.597 -0.700
621 HG23 THR 90 2HG2 THR 90 2.739 -9.230 -0.861
622 H GLY 91 H GLY 91 2.189 -4.900 -2.757
623 HA2 GLY 91 1HA GLY 91 2.533 -4.794 -5.618
624 HA3 GLY 91 2HA GLY 91 1.351 -3.642 -5.013
625 H ARG 92 H ARG 92 4.281 -3.635 -6.129
626 HA ARG 92 HA ARG 92 5.533 -2.058 -4.005
627 HB2 ARG 92 1HB ARG 92 6.517 -3.525 -6.397
628 HB3 ARG 92 2HB ARG 92 7.420 -2.101 -5.898
629 HG2 ARG 92 1HG ARG 92 8.047 -3.041 -3.881
630 HG3 ARG 92 2HG ARG 92 6.726 -4.212 -3.903
631 HD2 ARG 92 1HD ARG 92 9.046 -5.118 -4.367
632 HD3 ARG 92 2HD ARG 92 7.791 -5.537 -5.533
633 HE ARG 92 HE ARG 92 9.277 -3.185 -6.243
634 HH11 ARG 92 1HH1 ARG 92 9.190 -6.662 -6.388
635 HH12 ARG 92 2HH1 ARG 92 10.200 -6.759 -7.793
636 HH21 ARG 92 1HH2 ARG 92 10.608 -3.299 -8.093
637 HH22 ARG 92 2HH2 ARG 92 11.007 -4.846 -8.761
638 H VAL 93 H VAL 93 5.969 0.087 -4.182
639 HA VAL 93 HA VAL 93 5.267 1.435 -6.699
640 HB VAL 93 HB VAL 93 3.339 1.789 -5.350
641 HG11 VAL 93 1HG1 VAL 93 5.106 1.521 -3.200
642 HG12 VAL 93 2HG1 VAL 93 4.455 3.157 -3.076
643 HG13 VAL 93 3HG1 VAL 93 3.362 1.773 -3.127
644 HG21 VAL 93 3HG2 VAL 93 4.603 4.350 -4.675
645 HG22 VAL 93 1HG2 VAL 93 4.828 3.833 -6.346
646 HG23 VAL 93 2HG2 VAL 93 3.201 4.007 -5.688
647 H THR 94 H THR 94 7.050 2.401 -7.391
648 HA THR 94 HA THR 94 9.176 3.145 -5.598
649 HB THR 94 HB THR 94 8.900 3.644 -8.569
650 HG1 THR 94 1HG THR 94 8.993 1.387 -7.767
651 HG21 THR 94 3HG2 THR 94 10.599 4.942 -6.943
652 HG22 THR 94 1HG2 THR 94 11.006 4.492 -8.598
653 HG23 THR 94 2HG2 THR 94 11.545 3.487 -7.253
654 H THR 95 H THR 95 8.941 4.911 -4.384
655 HA THR 95 HA THR 95 7.261 7.084 -4.952
656 HB THR 95 HB THR 95 8.815 8.284 -3.231
657 HG1 THR 95 1HG THR 95 10.493 7.141 -2.663
658 HG21 THR 95 3HG2 THR 95 6.761 6.251 -2.957
659 HG22 THR 95 1HG2 THR 95 6.978 7.758 -2.069
660 HG23 THR 95 2HG2 THR 95 7.831 6.302 -1.557
661 H LYS 96 H LYS 96 7.698 9.194 -5.640
662 HA LYS 96 HA LYS 96 9.555 9.427 -7.761
663 HB2 LYS 96 1HB LYS 96 8.161 11.687 -6.322
664 HB3 LYS 96 2HB LYS 96 8.799 11.705 -7.961
665 HG2 LYS 96 1HG LYS 96 7.116 9.746 -8.331
666 HG3 LYS 96 2HG LYS 96 6.328 10.418 -6.901
667 HD2 LYS 96 1HD LYS 96 5.806 12.403 -7.962
668 HD3 LYS 96 2HD LYS 96 7.100 12.229 -9.149
669 HE2 LYS 96 1HE LYS 96 5.885 10.744 -10.446
670 HE3 LYS 96 2HE LYS 96 4.834 10.279 -9.108
671 HZ1 LYS 96 3HZ LYS 96 4.431 12.983 -9.495
672 HZ2 LYS 96 1HZ LYS 96 3.370 11.725 -9.887
673 HZ3 LYS 96 2HZ LYS 96 4.456 12.307 -11.046
674 H LYS 97 H LYS 97 11.156 11.259 -7.899
675 HA LYS 97 HA LYS 97 13.066 10.972 -5.790
676 HB2 LYS 97 1HB LYS 97 12.973 12.376 -8.420
677 HB3 LYS 97 2HB LYS 97 14.185 12.887 -7.252
678 HG2 LYS 97 1HG LYS 97 15.170 11.273 -8.705
679 HG3 LYS 97 2HG LYS 97 14.964 10.532 -7.117
680 HD2 LYS 97 1HD LYS 97 14.144 8.849 -8.424
681 HD3 LYS 97 2HD LYS 97 12.659 9.772 -8.180
682 HE2 LYS 97 1HE LYS 97 14.404 10.463 -10.490
683 HE3 LYS 97 2HE LYS 97 13.425 9.000 -10.584
684 HZ1 LYS 97 3HZ LYS 97 11.614 10.202 -10.955
685 HZ2 LYS 97 1HZ LYS 97 12.603 11.565 -11.120
686 HZ3 LYS 97 2HZ LYS 97 11.904 11.203 -9.623
687 H ALA 98 H ALA 98 13.867 12.557 -4.394
688 HA ALA 98 HA ALA 98 11.929 14.637 -3.726
689 HB1 ALA 98 3HB ALA 98 12.564 13.273 -1.880
690 HB2 ALA 98 1HB ALA 98 14.279 13.506 -2.221
691 HB3 ALA 98 2HB ALA 98 13.303 14.856 -1.643
692 HA PRO 99 HA PRO 99 14.343 17.909 -5.413
693 HB2 PRO 99 1HB PRO 99 13.444 19.956 -3.873
694 HB3 PRO 99 2HB PRO 99 12.474 19.221 -5.154
695 HG2 PRO 99 1HG PRO 99 12.386 18.743 -2.200
696 HG3 PRO 99 2HG PRO 99 11.044 18.928 -3.344
697 HD2 PRO 99 1HD PRO 99 11.876 16.510 -2.454
698 HD3 PRO 99 2HD PRO 99 11.204 16.749 -4.080
699 H SER 100 H SER 100 15.614 19.920 -4.492
700 HA SER 100 HA SER 100 17.210 19.003 -2.189
701 HB2 SER 100 1HB SER 100 18.260 18.900 -4.575
702 HB3 SER 100 2HB SER 100 18.402 20.649 -4.401
703 HG SER 100 HG SER 100 20.235 19.290 -3.667
704 HA PRO 101 HA PRO 101 16.294 22.894 -0.346
705 HB2 PRO 101 1HB PRO 101 18.356 23.022 1.416
706 HB3 PRO 101 2HB PRO 101 16.973 21.943 1.633
707 HG2 PRO 101 1HG PRO 101 19.700 21.335 0.557
708 HG3 PRO 101 2HG PRO 101 18.707 20.395 1.687
709 HD2 PRO 101 1HD PRO 101 18.895 19.783 -0.945
710 HD3 PRO 101 2HD PRO 101 17.421 19.491 0.001
711 H SER 102 H SER 102 17.440 24.989 0.244
712 HA SER 102 HA SER 102 19.884 25.676 -1.022
713 HB2 SER 102 1HB SER 102 17.328 26.208 -2.490
714 HB3 SER 102 2HB SER 102 18.640 27.381 -2.600
715 HG SER 102 HG SER 102 18.591 25.632 -4.221
716 H SER 103 H SER 103 20.697 27.358 0.042
717 HA SER 103 HA SER 103 19.353 28.611 2.145
718 HB2 SER 103 1HB SER 103 21.883 28.423 1.732
719 HB3 SER 103 2HB SER 103 21.700 29.852 0.715
720 HG SER 103 HG SER 103 22.189 30.571 2.747
721 H GLY 104 H GLY 104 20.195 29.911 -1.067
722 HA2 GLY 104 1HA GLY 104 18.951 32.409 -0.732
723 HA3 GLY 104 2HA GLY 104 19.309 31.648 -2.276
724 HA PRO 105 HA PRO 105 14.653 31.524 -1.007
725 HB2 PRO 105 1HB PRO 105 13.776 33.942 -1.875
726 HB3 PRO 105 2HB PRO 105 14.317 33.654 -0.217
727 HG2 PRO 105 1HG PRO 105 15.803 34.880 -2.509
728 HG3 PRO 105 2HG PRO 105 15.741 35.394 -0.812
729 HD2 PRO 105 1HD PRO 105 17.819 33.991 -1.836
730 HD3 PRO 105 2HD PRO 105 17.291 33.821 -0.149
731 H SER 106 H SER 106 14.366 30.049 -2.645
732 HA SER 106 HA SER 106 14.686 30.734 -5.408
733 HB2 SER 106 1HB SER 106 13.338 28.323 -4.168
734 HB3 SER 106 2HB SER 106 13.832 28.482 -5.853
735 HG SER 106 HG SER 106 15.997 28.982 -4.655
736 H SER 107 H SER 107 13.317 32.494 -5.768
737 HA SER 107 HA SER 107 11.384 33.590 -6.270
738 HB2 SER 107 1HB SER 107 11.344 31.713 -7.942
739 HB3 SER 107 2HB SER 107 10.301 30.821 -6.835
740 HG SER 107 HG SER 107 8.788 32.520 -7.009
741 H GLY 108 H GLY 108 11.712 33.089 -3.548
742 HA2 GLY 108 1HA GLY 108 10.567 32.799 -1.553
743 HA3 GLY 108 2HA GLY 108 9.392 33.809 -2.383
Start of MODEL 3
1 H1 GLY 1 H GLY 1 12.507 -25.372 1.657
2 HA2 GLY 1 1HA GLY 1 11.353 -27.972 2.416
3 HA3 GLY 1 2HA GLY 1 11.830 -26.704 3.536
4 H SER 2 H SER 2 9.960 -26.328 4.596
5 HA SER 2 HA SER 2 7.716 -25.327 2.980
6 HB2 SER 2 1HB SER 2 7.358 -27.688 3.904
7 HB3 SER 2 2HB SER 2 7.305 -26.937 5.499
8 HG SER 2 HG SER 2 5.614 -25.553 4.551
9 H SER 3 H SER 3 8.163 -23.192 3.399
10 HA SER 3 HA SER 3 8.722 -22.215 6.027
11 HB2 SER 3 1HB SER 3 8.185 -20.949 3.362
12 HB3 SER 3 2HB SER 3 8.163 -19.955 4.819
13 HG SER 3 HG SER 3 10.278 -20.445 5.187
14 H GLY 4 H GLY 4 5.893 -21.965 3.873
15 HA2 GLY 4 1HA GLY 4 4.010 -22.299 5.936
16 HA3 GLY 4 2HA GLY 4 4.234 -20.578 5.659
17 H SER 5 H SER 5 2.319 -20.054 4.742
18 HA SER 5 HA SER 5 1.444 -21.602 2.403
19 HB2 SER 5 1HB SER 5 -0.746 -20.560 2.724
20 HB3 SER 5 2HB SER 5 -0.210 -21.326 4.220
21 HG SER 5 HG SER 5 -1.065 -19.198 4.526
22 H SER 6 H SER 6 2.708 -20.749 0.787
23 HA SER 6 HA SER 6 2.203 -17.920 0.146
24 HB2 SER 6 1HB SER 6 4.788 -19.427 0.199
25 HB3 SER 6 2HB SER 6 4.573 -18.144 -0.992
26 HG SER 6 HG SER 6 4.746 -17.992 1.788
27 H GLY 7 H GLY 7 0.617 -19.988 -0.806
28 HA2 GLY 7 1HA GLY 7 1.273 -19.869 -3.669
29 HA3 GLY 7 2HA GLY 7 0.884 -21.422 -2.947
30 H LEU 8 H LEU 8 -0.350 -18.458 -4.181
31 HA LEU 8 HA LEU 8 -2.947 -19.514 -4.530
32 HB2 LEU 8 1HB LEU 8 -4.233 -18.326 -2.986
33 HB3 LEU 8 2HB LEU 8 -2.887 -18.970 -2.048
34 HG LEU 8 HG LEU 8 -1.861 -16.583 -2.550
35 HD11 LEU 8 1HD1 LEU 8 -3.544 -15.677 -3.930
36 HD12 LEU 8 2HD1 LEU 8 -3.745 -14.906 -2.357
37 HD13 LEU 8 3HD1 LEU 8 -4.829 -16.209 -2.845
38 HD21 LEU 8 3HD2 LEU 8 -3.759 -16.147 -0.466
39 HD22 LEU 8 1HD2 LEU 8 -2.035 -16.500 -0.342
40 HD23 LEU 8 2HD2 LEU 8 -3.204 -17.820 -0.397
41 H ALA 9 H ALA 9 -4.152 -18.299 -5.953
42 HA ALA 9 HA ALA 9 -2.733 -16.283 -7.412
43 HB1 ALA 9 3HB ALA 9 -4.146 -16.784 -9.065
44 HB2 ALA 9 1HB ALA 9 -4.725 -18.082 -8.020
45 HB3 ALA 9 2HB ALA 9 -5.562 -16.530 -8.046
46 HA PRO 10 HA PRO 10 -4.189 -12.682 -5.345
47 HB2 PRO 10 1HB PRO 10 -3.971 -10.889 -7.372
48 HB3 PRO 10 2HB PRO 10 -2.571 -11.539 -6.510
49 HG2 PRO 10 1HG PRO 10 -3.715 -12.354 -9.154
50 HG3 PRO 10 2HG PRO 10 -2.018 -12.133 -8.689
51 HD2 PRO 10 1HD PRO 10 -3.181 -14.573 -8.838
52 HD3 PRO 10 2HD PRO 10 -1.896 -14.198 -7.672
53 HA PRO 11 HA PRO 11 -8.491 -12.307 -6.253
54 HB2 PRO 11 1HB PRO 11 -8.999 -9.976 -4.957
55 HB3 PRO 11 2HB PRO 11 -8.719 -11.503 -4.112
56 HG2 PRO 11 1HG PRO 11 -6.822 -9.244 -4.618
57 HG3 PRO 11 2HG PRO 11 -7.062 -10.193 -3.140
58 HD2 PRO 11 1HD PRO 11 -5.013 -10.653 -4.850
59 HD3 PRO 11 2HD PRO 11 -5.780 -11.948 -3.909
60 H ARG 12 H ARG 12 -6.577 -9.321 -6.616
61 HA ARG 12 HA ARG 12 -7.648 -8.924 -9.273
62 HB2 ARG 12 1HB ARG 12 -8.365 -7.158 -6.959
63 HB3 ARG 12 2HB ARG 12 -8.215 -6.471 -8.571
64 HG2 ARG 12 1HG ARG 12 -10.058 -8.719 -7.785
65 HG3 ARG 12 2HG ARG 12 -10.525 -7.036 -8.043
66 HD2 ARG 12 1HD ARG 12 -9.582 -7.277 -10.381
67 HD3 ARG 12 2HD ARG 12 -9.496 -9.010 -10.066
68 HE ARG 12 HE ARG 12 -12.089 -8.099 -9.489
69 HH11 ARG 12 1HH1 ARG 12 -9.971 -8.624 -12.202
70 HH12 ARG 12 2HH1 ARG 12 -11.261 -8.922 -13.318
71 HH21 ARG 12 1HH2 ARG 12 -13.796 -8.490 -10.949
72 HH22 ARG 12 2HH2 ARG 12 -13.437 -8.845 -12.605
73 H HIS 13 H HIS 13 -6.812 -6.547 -9.981
74 HA HIS 13 HA HIS 13 -3.926 -6.661 -9.520
75 HB2 HIS 13 1HB HIS 13 -5.653 -5.471 -11.671
76 HB3 HIS 13 2HB HIS 13 -3.983 -4.946 -11.476
77 HD1 HIS 13 1HD HIS 13 -3.417 -5.964 -13.808
78 HD2 HIS 13 2HD HIS 13 -4.692 -8.726 -10.979
79 HE1 HIS 13 1HE HIS 13 -2.829 -8.218 -14.757
80 HE2 HIS 13 2HE HIS 13 -3.687 -9.876 -13.067
81 H LEU 14 H LEU 14 -2.712 -4.888 -8.870
82 HA LEU 14 HA LEU 14 -4.211 -2.890 -7.361
83 HB2 LEU 14 1HB LEU 14 -1.419 -3.925 -7.311
84 HB3 LEU 14 2HB LEU 14 -1.735 -2.310 -6.681
85 HG LEU 14 HG LEU 14 -3.147 -4.783 -5.696
86 HD11 LEU 14 1HD1 LEU 14 -0.552 -4.602 -5.403
87 HD12 LEU 14 2HD1 LEU 14 -1.577 -5.087 -4.052
88 HD13 LEU 14 3HD1 LEU 14 -0.984 -3.430 -4.157
89 HD21 LEU 14 3HD2 LEU 14 -4.052 -3.459 -4.046
90 HD22 LEU 14 1HD2 LEU 14 -4.041 -2.345 -5.413
91 HD23 LEU 14 2HD2 LEU 14 -2.785 -2.238 -4.180
92 H GLY 15 H GLY 15 -3.469 -0.624 -7.396
93 HA2 GLY 15 1HA GLY 15 -2.130 0.207 -9.859
94 HA3 GLY 15 2HA GLY 15 -3.782 0.756 -9.619
95 H PHE 16 H PHE 16 -0.801 1.854 -9.502
96 HA PHE 16 HA PHE 16 -1.191 3.436 -7.050
97 HB2 PHE 16 1HB PHE 16 1.337 2.832 -8.597
98 HB3 PHE 16 2HB PHE 16 1.252 3.911 -7.208
99 HD1 PHE 16 1HD PHE 16 0.331 2.897 -5.018
100 HD2 PHE 16 2HD PHE 16 1.772 0.585 -8.288
101 HE1 PHE 16 1HE PHE 16 0.675 0.984 -3.509
102 HE2 PHE 16 2HE PHE 16 2.117 -1.332 -6.785
103 HZ PHE 16 HZ PHE 16 1.568 -1.134 -4.392
104 H SER 17 H SER 17 -1.963 5.403 -7.384
105 HA SER 17 HA SER 17 -1.120 6.854 -9.806
106 HB2 SER 17 1HB SER 17 -3.458 6.201 -10.042
107 HB3 SER 17 2HB SER 17 -3.839 6.909 -8.472
108 HG SER 17 HG SER 17 -3.068 8.938 -9.421
109 H ASP 18 H ASP 18 -1.045 9.173 -9.611
110 HA ASP 18 HA ASP 18 -0.299 11.068 -8.593
111 HB2 ASP 18 1HB ASP 18 -2.439 10.043 -6.791
112 HB3 ASP 18 2HB ASP 18 -1.428 11.356 -6.194
113 H VAL 19 H VAL 19 1.390 8.842 -8.339
114 HA VAL 19 HA VAL 19 2.303 8.528 -5.654
115 HB VAL 19 HB VAL 19 3.703 7.890 -8.255
116 HG11 VAL 19 1HG1 VAL 19 4.611 7.822 -5.521
117 HG12 VAL 19 2HG1 VAL 19 4.620 6.206 -6.228
118 HG13 VAL 19 3HG1 VAL 19 5.506 7.517 -7.009
119 HG21 VAL 19 3HG2 VAL 19 1.972 6.424 -8.339
120 HG22 VAL 19 1HG2 VAL 19 3.022 5.507 -7.259
121 HG23 VAL 19 2HG2 VAL 19 1.702 6.471 -6.597
122 H SER 20 H SER 20 3.523 9.864 -4.506
123 HA SER 20 HA SER 20 5.021 11.965 -5.921
124 HB2 SER 20 1HB SER 20 3.148 12.411 -4.097
125 HB3 SER 20 2HB SER 20 4.486 12.121 -2.985
126 HG SER 20 HG SER 20 5.041 14.097 -3.386
127 H HIS 21 H HIS 21 6.832 12.798 -4.197
128 HA HIS 21 HA HIS 21 8.672 10.560 -4.036
129 HB2 HIS 21 1HB HIS 21 10.327 12.347 -3.403
130 HB3 HIS 21 2HB HIS 21 9.573 12.568 -4.979
131 HD1 HIS 21 1HD HIS 21 8.280 14.698 -5.355
132 HD2 HIS 21 2HD HIS 21 9.374 14.157 -1.384
133 HE1 HIS 21 1HE HIS 21 7.728 16.865 -4.204
134 HE2 HIS 21 2HE HIS 21 8.477 16.543 -1.821
135 H ASP 22 H ASP 22 6.467 12.050 -2.002
136 HA ASP 22 HA ASP 22 7.764 10.851 0.344
137 HB2 ASP 22 1HB ASP 22 7.517 12.722 1.678
138 HB3 ASP 22 2HB ASP 22 7.894 13.468 0.127
139 H ALA 23 H ALA 23 5.461 10.251 -1.575
140 HA ALA 23 HA ALA 23 3.760 9.016 0.299
141 HB1 ALA 23 3HB ALA 23 1.682 10.389 -0.373
142 HB2 ALA 23 1HB ALA 23 2.767 11.041 0.856
143 HB3 ALA 23 2HB ALA 23 2.842 11.646 -0.799
144 H ALA 24 H ALA 24 1.945 7.894 -0.727
145 HA ALA 24 HA ALA 24 1.833 7.862 -3.616
146 HB1 ALA 24 3HB ALA 24 3.660 6.172 -2.407
147 HB2 ALA 24 1HB ALA 24 2.261 5.141 -2.709
148 HB3 ALA 24 2HB ALA 24 3.013 6.021 -4.041
149 H ARG 25 H ARG 25 -0.186 7.452 -4.249
150 HA ARG 25 HA ARG 25 -2.101 6.510 -2.258
151 HB2 ARG 25 1HB ARG 25 -2.536 8.585 -3.590
152 HB3 ARG 25 2HB ARG 25 -2.632 7.583 -5.032
153 HG2 ARG 25 1HG ARG 25 -4.577 6.474 -4.231
154 HG3 ARG 25 2HG ARG 25 -4.408 7.210 -2.636
155 HD2 ARG 25 1HD ARG 25 -6.033 8.539 -3.579
156 HD3 ARG 25 2HD ARG 25 -4.573 9.448 -3.966
157 HE ARG 25 HE ARG 25 -4.999 7.761 -6.102
158 HH11 ARG 25 1HH1 ARG 25 -6.740 10.318 -4.504
159 HH12 ARG 25 2HH1 ARG 25 -7.572 10.824 -5.937
160 HH21 ARG 25 1HH2 ARG 25 -6.088 8.418 -7.995
161 HH22 ARG 25 2HH2 ARG 25 -7.201 9.742 -7.922
162 H VAL 26 H VAL 26 -2.576 4.425 -2.170
163 HA VAL 26 HA VAL 26 -2.292 2.793 -4.599
164 HB VAL 26 HB VAL 26 -0.943 1.948 -2.809
165 HG11 VAL 26 1HG1 VAL 26 -2.000 1.227 -0.656
166 HG12 VAL 26 2HG1 VAL 26 -1.950 2.973 -0.903
167 HG13 VAL 26 3HG1 VAL 26 -3.456 2.088 -1.153
168 HG21 VAL 26 3HG2 VAL 26 -2.353 0.366 -4.233
169 HG22 VAL 26 1HG2 VAL 26 -1.668 -0.283 -2.743
170 HG23 VAL 26 2HG2 VAL 26 -3.369 0.176 -2.804
171 H PHE 27 H PHE 27 -4.038 2.000 -5.570
172 HA PHE 27 HA PHE 27 -6.530 1.753 -4.032
173 HB2 PHE 27 1HB PHE 27 -7.807 2.627 -5.933
174 HB3 PHE 27 2HB PHE 27 -6.648 3.820 -5.355
175 HD1 PHE 27 1HD PHE 27 -4.615 4.304 -6.656
176 HD2 PHE 27 2HD PHE 27 -7.656 1.709 -8.120
177 HE1 PHE 27 1HE PHE 27 -3.696 4.514 -8.929
178 HE2 PHE 27 2HE PHE 27 -6.741 1.914 -10.394
179 HZ PHE 27 HZ PHE 27 -4.758 3.317 -10.801
180 H TRP 28 H TRP 28 -8.064 0.234 -4.915
181 HA TRP 28 HA TRP 28 -6.887 -1.711 -6.782
182 HB2 TRP 28 1HB TRP 28 -8.117 -3.471 -5.341
183 HB3 TRP 28 2HB TRP 28 -6.594 -2.820 -4.742
184 HD1 TRP 28 HD TRP 28 -10.203 -3.200 -3.826
185 HE1 TRP 28 1HE TRP 28 -10.650 -2.081 -1.552
186 HE3 TRP 28 3HE TRP 28 -5.792 -0.673 -3.285
187 HZ2 TRP 28 2HZ TRP 28 -9.309 -0.356 0.235
188 HZ3 TRP 28 3HZ TRP 28 -5.454 0.689 -1.264
189 HH2 TRP 28 HH TRP 28 -7.177 0.844 0.458
190 H GLU 29 H GLU 29 -8.612 -3.290 -7.577
191 HA GLU 29 HA GLU 29 -10.891 -1.709 -8.459
192 HB2 GLU 29 1HB GLU 29 -9.984 -4.467 -9.304
193 HB3 GLU 29 2HB GLU 29 -11.271 -3.536 -10.057
194 HG2 GLU 29 1HG GLU 29 -9.586 -3.046 -11.486
195 HG3 GLU 29 2HG GLU 29 -9.340 -1.752 -10.315
196 H GLY 30 H GLY 30 -10.478 -3.134 -5.730
197 HA2 GLY 30 1HA GLY 30 -12.119 -3.749 -4.185
198 HA3 GLY 30 2HA GLY 30 -13.250 -3.975 -5.510
199 H ALA 31 H ALA 31 -13.648 -5.885 -3.961
200 HA ALA 31 HA ALA 31 -12.049 -8.155 -4.940
201 HB1 ALA 31 3HB ALA 31 -12.812 -9.119 -2.569
202 HB2 ALA 31 1HB ALA 31 -11.301 -8.239 -2.803
203 HB3 ALA 31 2HB ALA 31 -12.715 -7.407 -2.157
204 HA PRO 32 HA PRO 32 -15.825 -10.069 -6.097
205 HB2 PRO 32 1HB PRO 32 -15.284 -12.687 -5.623
206 HB3 PRO 32 2HB PRO 32 -14.564 -11.784 -6.961
207 HG2 PRO 32 1HG PRO 32 -13.402 -12.453 -4.285
208 HG3 PRO 32 2HG PRO 32 -12.638 -12.517 -5.884
209 HD2 PRO 32 1HD PRO 32 -12.236 -10.470 -4.159
210 HD3 PRO 32 2HD PRO 32 -12.232 -10.249 -5.920
211 H ARG 33 H ARG 33 -14.921 -9.796 -2.935
212 HA ARG 33 HA ARG 33 -17.525 -10.749 -2.019
213 HB2 ARG 33 1HB ARG 33 -16.501 -11.844 -0.047
214 HB3 ARG 33 2HB ARG 33 -16.070 -12.626 -1.562
215 HG2 ARG 33 1HG ARG 33 -13.902 -11.501 -1.530
216 HG3 ARG 33 2HG ARG 33 -14.335 -10.718 -0.009
217 HD2 ARG 33 1HD ARG 33 -13.174 -12.499 0.811
218 HD3 ARG 33 2HD ARG 33 -14.781 -13.220 0.728
219 HE ARG 33 HE ARG 33 -13.393 -13.636 -1.699
220 HH11 ARG 33 1HH1 ARG 33 -13.488 -14.701 1.614
221 HH12 ARG 33 2HH1 ARG 33 -12.857 -16.276 1.263
222 HH21 ARG 33 1HH2 ARG 33 -12.563 -15.707 -2.175
223 HH22 ARG 33 2HH2 ARG 33 -12.331 -16.847 -0.893
224 HA PRO 34 HA PRO 34 -17.536 -7.044 0.336
225 HB2 PRO 34 1HB PRO 34 -19.076 -7.775 2.448
226 HB3 PRO 34 2HB PRO 34 -19.731 -7.508 0.828
227 HG2 PRO 34 1HG PRO 34 -19.020 -10.081 2.183
228 HG3 PRO 34 2HG PRO 34 -20.442 -9.691 1.198
229 HD2 PRO 34 1HD PRO 34 -18.323 -11.064 0.219
230 HD3 PRO 34 2HD PRO 34 -19.302 -9.975 -0.785
231 H VAL 35 H VAL 35 -16.393 -6.042 1.926
232 HA VAL 35 HA VAL 35 -14.940 -7.768 3.826
233 HB VAL 35 HB VAL 35 -13.974 -5.223 2.515
234 HG11 VAL 35 1HG1 VAL 35 -13.007 -6.768 4.853
235 HG12 VAL 35 2HG1 VAL 35 -11.795 -6.149 3.729
236 HG13 VAL 35 3HG1 VAL 35 -12.915 -5.039 4.519
237 HG21 VAL 35 3HG2 VAL 35 -13.999 -7.546 1.298
238 HG22 VAL 35 1HG2 VAL 35 -12.584 -6.497 1.200
239 HG23 VAL 35 2HG2 VAL 35 -12.596 -7.861 2.318
240 H ARG 36 H ARG 36 -14.615 -6.993 5.924
241 HA ARG 36 HA ARG 36 -16.566 -4.982 6.757
242 HB2 ARG 36 1HB ARG 36 -16.033 -5.832 9.062
243 HB3 ARG 36 2HB ARG 36 -16.727 -7.027 7.975
244 HG2 ARG 36 1HG ARG 36 -14.576 -8.030 7.612
245 HG3 ARG 36 2HG ARG 36 -13.784 -6.755 8.540
246 HD2 ARG 36 1HD ARG 36 -15.939 -8.363 9.827
247 HD3 ARG 36 2HD ARG 36 -14.340 -9.079 9.632
248 HE ARG 36 HE ARG 36 -15.089 -7.176 11.567
249 HH11 ARG 36 1HH1 ARG 36 -12.480 -7.936 9.392
250 HH12 ARG 36 2HH1 ARG 36 -11.265 -7.199 10.383
251 HH21 ARG 36 1HH2 ARG 36 -13.499 -6.202 12.881
252 HH22 ARG 36 2HH2 ARG 36 -11.846 -6.214 12.368
253 H LEU 37 H LEU 37 -13.134 -5.545 6.589
254 HA LEU 37 HA LEU 37 -12.547 -2.792 6.992
255 HB2 LEU 37 1HB LEU 37 -12.937 -3.888 9.341
256 HB3 LEU 37 2HB LEU 37 -11.310 -4.517 9.087
257 HG LEU 37 HG LEU 37 -11.829 -1.583 8.826
258 HD11 LEU 37 1HD1 LEU 37 -10.925 -1.794 11.365
259 HD12 LEU 37 2HD1 LEU 37 -11.998 -3.190 11.279
260 HD13 LEU 37 3HD1 LEU 37 -12.620 -1.578 10.928
261 HD21 LEU 37 3HD2 LEU 37 -9.476 -3.319 9.535
262 HD22 LEU 37 1HD2 LEU 37 -9.478 -1.568 9.745
263 HD23 LEU 37 2HD2 LEU 37 -9.671 -2.262 8.135
264 H VAL 38 H VAL 38 -10.501 -2.262 6.295
265 HA VAL 38 HA VAL 38 -8.844 -4.514 5.355
266 HB VAL 38 HB VAL 38 -9.016 -1.773 4.100
267 HG11 VAL 38 1HG1 VAL 38 -7.720 -4.323 3.143
268 HG12 VAL 38 2HG1 VAL 38 -7.775 -2.794 2.264
269 HG13 VAL 38 3HG1 VAL 38 -6.875 -2.911 3.777
270 HG21 VAL 38 3HG2 VAL 38 -10.163 -4.330 3.002
271 HG22 VAL 38 1HG2 VAL 38 -11.112 -3.169 3.930
272 HG23 VAL 38 2HG2 VAL 38 -10.386 -2.689 2.396
273 H ARG 39 H ARG 39 -6.748 -4.559 5.927
274 HA ARG 39 HA ARG 39 -5.683 -2.223 7.375
275 HB2 ARG 39 1HB ARG 39 -6.175 -4.529 8.579
276 HB3 ARG 39 2HB ARG 39 -4.621 -4.966 7.880
277 HG2 ARG 39 1HG ARG 39 -3.485 -3.315 9.098
278 HG3 ARG 39 2HG ARG 39 -4.982 -2.481 9.520
279 HD2 ARG 39 1HD ARG 39 -4.390 -5.289 10.415
280 HD3 ARG 39 2HD ARG 39 -3.883 -3.877 11.341
281 HE ARG 39 HE ARG 39 -6.677 -3.866 10.686
282 HH11 ARG 39 1HH1 ARG 39 -4.279 -5.009 12.936
283 HH12 ARG 39 2HH1 ARG 39 -5.401 -5.182 14.245
284 HH21 ARG 39 1HH2 ARG 39 -8.164 -4.090 12.401
285 HH22 ARG 39 2HH2 ARG 39 -7.611 -4.660 13.939
286 H VAL 40 H VAL 40 -4.466 -1.238 5.850
287 HA VAL 40 HA VAL 40 -2.791 -2.763 4.049
288 HB VAL 40 HB VAL 40 -2.801 0.232 4.387
289 HG11 VAL 40 1HG1 VAL 40 -0.975 -0.854 3.071
290 HG12 VAL 40 2HG1 VAL 40 -2.208 -1.452 1.960
291 HG13 VAL 40 3HG1 VAL 40 -1.960 0.284 2.152
292 HG21 VAL 40 3HG2 VAL 40 -4.400 0.061 2.350
293 HG22 VAL 40 1HG2 VAL 40 -4.734 -1.556 2.968
294 HG23 VAL 40 2HG2 VAL 40 -5.051 -0.144 3.976
295 H THR 41 H THR 41 -0.564 -2.822 4.031
296 HA THR 41 HA THR 41 0.887 -1.492 6.194
297 HB THR 41 HB THR 41 2.161 -3.669 6.588
298 HG1 THR 41 1HG THR 41 1.352 -5.489 5.780
299 HG21 THR 41 3HG2 THR 41 -0.740 -3.537 7.420
300 HG22 THR 41 1HG2 THR 41 0.601 -2.723 8.224
301 HG23 THR 41 2HG2 THR 41 0.519 -4.484 8.212
302 H TYR 42 H TYR 42 2.496 -0.427 5.264
303 HA TYR 42 HA TYR 42 3.712 -1.538 2.826
304 HB2 TYR 42 1HB TYR 42 4.602 0.882 2.623
305 HB3 TYR 42 2HB TYR 42 2.903 0.586 2.276
306 HD1 TYR 42 2HD TYR 42 1.218 1.041 4.154
307 HD2 TYR 42 1HD TYR 42 5.227 2.463 4.230
308 HE1 TYR 42 2HE TYR 42 0.579 2.736 5.817
309 HE2 TYR 42 1HE TYR 42 4.599 4.162 5.894
310 HH TYR 42 HH TYR 42 1.379 4.237 7.317
311 H VAL 43 H VAL 43 6.054 -1.071 2.539
312 HA VAL 43 HA VAL 43 7.663 -0.558 4.854
313 HB VAL 43 HB VAL 43 6.994 -2.905 5.279
314 HG11 VAL 43 1HG1 VAL 43 6.678 -3.758 3.083
315 HG12 VAL 43 2HG1 VAL 43 8.338 -3.374 2.625
316 HG13 VAL 43 3HG1 VAL 43 8.018 -4.656 3.794
317 HG21 VAL 43 3HG2 VAL 43 9.189 -3.715 5.790
318 HG22 VAL 43 1HG2 VAL 43 9.912 -2.678 4.561
319 HG23 VAL 43 2HG2 VAL 43 9.191 -1.965 6.004
320 H SER 44 H SER 44 9.787 -0.123 4.338
321 HA SER 44 HA SER 44 10.315 0.386 1.557
322 HB2 SER 44 1HB SER 44 11.053 2.002 3.221
323 HB3 SER 44 2HB SER 44 12.035 0.774 4.020
324 HG SER 44 HG SER 44 13.184 2.204 2.545
325 H SER 45 H SER 45 11.871 -0.548 0.259
326 HA SER 45 HA SER 45 12.275 -3.257 0.368
327 HB2 SER 45 1HB SER 45 12.774 -1.542 -1.531
328 HB3 SER 45 2HB SER 45 14.391 -1.492 -0.830
329 HG SER 45 HG SER 45 13.081 -3.569 -2.156
330 H GLU 46 H GLU 46 14.529 -0.732 1.464
331 HA GLU 46 HA GLU 46 16.682 -2.199 2.243
332 HB2 GLU 46 1HB GLU 46 15.401 0.109 3.714
333 HB3 GLU 46 2HB GLU 46 17.001 -0.521 4.077
334 HG2 GLU 46 1HG GLU 46 17.805 0.103 1.907
335 HG3 GLU 46 2HG GLU 46 16.185 0.574 1.397
336 H GLY 47 H GLY 47 13.709 -1.710 4.129
337 HA2 GLY 47 1HA GLY 47 12.732 -3.367 5.503
338 HA3 GLY 47 2HA GLY 47 14.275 -4.206 5.547
339 H GLY 48 H GLY 48 12.540 -1.372 6.757
340 HA2 GLY 48 1HA GLY 48 13.652 -1.706 9.369
341 HA3 GLY 48 2HA GLY 48 14.379 -0.344 8.529
342 H HIS 49 H HIS 49 12.325 0.787 7.197
343 HA HIS 49 HA HIS 49 10.602 1.694 9.394
344 HB2 HIS 49 1HB HIS 49 11.709 3.562 8.533
345 HB3 HIS 49 2HB HIS 49 11.589 2.988 6.872
346 HD1 HIS 49 1HD HIS 49 9.997 4.320 5.552
347 HD2 HIS 49 2HD HIS 49 8.861 4.090 9.541
348 HE1 HIS 49 1HE HIS 49 7.880 5.666 5.726
349 HE2 HIS 49 2HE HIS 49 7.258 5.583 8.166
350 H SER 50 H SER 50 8.681 0.738 9.451
351 HA SER 50 HA SER 50 7.257 0.320 6.905
352 HB2 SER 50 1HB SER 50 6.233 -1.699 7.876
353 HB3 SER 50 2HB SER 50 7.990 -1.840 7.817
354 HG SER 50 HG SER 50 6.327 -1.370 10.048
355 H GLY 51 H GLY 51 4.866 0.201 7.171
356 HA2 GLY 51 1HA GLY 51 3.907 1.760 9.478
357 HA3 GLY 51 2HA GLY 51 3.520 2.287 7.847
358 H GLN 52 H GLN 52 1.329 2.032 9.009
359 HA GLN 52 HA GLN 52 0.010 -0.189 7.864
360 HB2 GLN 52 1HB GLN 52 0.977 -1.431 9.710
361 HB3 GLN 52 2HB GLN 52 0.373 -0.250 10.864
362 HG2 GLN 52 1HG GLN 52 -1.911 -0.869 10.342
363 HG3 GLN 52 2HG GLN 52 -1.340 -2.009 9.125
364 HE21 GLN 52 1HE2 GLN 52 0.628 -3.348 10.270
365 HE22 GLN 52 2HE2 GLN 52 0.099 -4.174 11.692
366 H THR 53 H THR 53 -1.939 0.538 7.353
367 HA THR 53 HA THR 53 -3.225 2.502 9.135
368 HB THR 53 HB THR 53 -2.429 3.657 7.140
369 HG1 THR 53 1HG THR 53 -5.203 3.386 6.719
370 HG21 THR 53 3HG2 THR 53 -3.317 3.086 4.921
371 HG22 THR 53 1HG2 THR 53 -4.123 1.678 5.610
372 HG23 THR 53 2HG2 THR 53 -2.362 1.767 5.596
373 H GLU 54 H GLU 54 -5.551 2.528 9.089
374 HA GLU 54 HA GLU 54 -6.702 -0.046 8.232
375 HB2 GLU 54 1HB GLU 54 -7.007 1.537 10.732
376 HB3 GLU 54 2HB GLU 54 -8.429 0.696 10.130
377 HG2 GLU 54 1HG GLU 54 -7.447 -1.400 10.380
378 HG3 GLU 54 2HG GLU 54 -5.821 -0.728 10.476
379 H ALA 55 H ALA 55 -8.415 -0.005 6.912
380 HA ALA 55 HA ALA 55 -9.865 2.532 6.569
381 HB1 ALA 55 3HB ALA 55 -9.134 2.753 4.489
382 HB2 ALA 55 1HB ALA 55 -8.170 1.285 4.659
383 HB3 ALA 55 2HB ALA 55 -9.832 1.186 4.078
384 HA PRO 56 HA PRO 56 -13.572 0.196 6.821
385 HB2 PRO 56 1HB PRO 56 -15.185 1.515 5.081
386 HB3 PRO 56 2HB PRO 56 -14.711 2.183 6.648
387 HG2 PRO 56 1HG PRO 56 -13.586 2.743 3.931
388 HG3 PRO 56 2HG PRO 56 -13.962 3.877 5.242
389 HD2 PRO 56 1HD PRO 56 -11.445 3.014 4.740
390 HD3 PRO 56 2HD PRO 56 -12.011 3.411 6.375
391 H GLY 57 H GLY 57 -14.941 -1.296 5.726
392 HA2 GLY 57 1HA GLY 57 -13.670 -2.774 3.682
393 HA3 GLY 57 2HA GLY 57 -15.315 -3.015 4.251
394 H ASN 58 H ASN 58 -15.386 0.088 3.455
395 HA ASN 58 HA ASN 58 -16.338 -0.494 0.741
396 HB2 ASN 58 1HB ASN 58 -17.494 1.747 0.982
397 HB3 ASN 58 2HB ASN 58 -18.054 0.485 2.076
398 HD21 ASN 58 1HD2 ASN 58 -18.548 1.345 3.951
399 HD22 ASN 58 2HD2 ASN 58 -17.628 2.535 4.802
400 H ALA 59 H ALA 59 -13.610 0.567 2.161
401 HA ALA 59 HA ALA 59 -13.033 2.830 0.463
402 HB1 ALA 59 3HB ALA 59 -11.440 1.303 2.498
403 HB2 ALA 59 1HB ALA 59 -10.714 2.553 1.487
404 HB3 ALA 59 2HB ALA 59 -12.036 2.961 2.581
405 H THR 60 H THR 60 -12.283 2.713 -1.541
406 HA THR 60 HA THR 60 -11.054 0.191 -2.438
407 HB THR 60 HB THR 60 -11.651 1.025 -4.762
408 HG1 THR 60 1HG THR 60 -13.549 2.544 -4.579
409 HG21 THR 60 3HG2 THR 60 -14.276 0.708 -4.031
410 HG22 THR 60 1HG2 THR 60 -13.416 -0.049 -2.691
411 HG23 THR 60 2HG2 THR 60 -13.139 -0.604 -4.342
412 H SER 61 H SER 61 -9.991 2.897 -1.254
413 HA SER 61 HA SER 61 -7.515 2.838 -2.655
414 HB2 SER 61 1HB SER 61 -7.728 5.371 -3.269
415 HB3 SER 61 2HB SER 61 -8.405 4.158 -4.357
416 HG SER 61 HG SER 61 -10.378 4.773 -3.843
417 H ALA 62 H ALA 62 -5.898 3.687 -1.436
418 HA ALA 62 HA ALA 62 -6.562 5.471 0.781
419 HB1 ALA 62 3HB ALA 62 -5.048 3.969 2.244
420 HB2 ALA 62 1HB ALA 62 -6.727 3.495 1.980
421 HB3 ALA 62 2HB ALA 62 -5.435 2.714 1.067
422 H MET 63 H MET 63 -4.796 6.665 1.584
423 HA MET 63 HA MET 63 -2.544 6.800 -0.287
424 HB2 MET 63 1HB MET 63 -3.643 8.775 1.712
425 HB3 MET 63 2HB MET 63 -2.128 9.025 0.855
426 HG2 MET 63 1HG MET 63 -3.627 8.590 -1.256
427 HG3 MET 63 2HG MET 63 -4.918 9.084 -0.163
428 HE1 MET 63 3HE MET 63 -1.071 10.658 -0.594
429 HE2 MET 63 1HE MET 63 -1.773 9.825 -1.981
430 HE3 MET 63 2HE MET 63 -1.605 11.580 -2.000
431 H LEU 64 H LEU 64 -0.383 7.063 0.511
432 HA LEU 64 HA LEU 64 0.032 6.090 3.255
433 HB2 LEU 64 1HB LEU 64 1.692 5.238 0.894
434 HB3 LEU 64 2HB LEU 64 1.778 4.626 2.545
435 HG LEU 64 HG LEU 64 -0.636 4.252 0.785
436 HD11 LEU 64 1HD1 LEU 64 0.594 2.857 -0.440
437 HD12 LEU 64 2HD1 LEU 64 0.628 1.812 0.980
438 HD13 LEU 64 3HD1 LEU 64 1.953 2.937 0.682
439 HD21 LEU 64 3HD2 LEU 64 -0.992 2.349 2.388
440 HD22 LEU 64 1HD2 LEU 64 -1.155 3.962 3.084
441 HD23 LEU 64 2HD2 LEU 64 0.312 3.024 3.366
442 H GLY 65 H GLY 65 1.892 6.832 4.305
443 HA2 GLY 65 1HA GLY 65 4.114 8.054 3.565
444 HA3 GLY 65 2HA GLY 65 2.951 9.317 3.188
445 HA PRO 66 HA PRO 66 4.641 10.712 3.736
446 HB2 PRO 66 1HB PRO 66 6.891 11.439 5.070
447 HB3 PRO 66 2HB PRO 66 5.388 12.367 5.144
448 HG2 PRO 66 1HG PRO 66 6.491 10.386 7.099
449 HG3 PRO 66 2HG PRO 66 5.723 11.954 7.408
450 HD2 PRO 66 1HD PRO 66 4.400 9.607 7.675
451 HD3 PRO 66 2HD PRO 66 3.595 11.103 7.160
452 H LEU 67 H LEU 67 5.685 9.553 2.254
453 HA LEU 67 HA LEU 67 7.314 7.277 3.099
454 HB2 LEU 67 1HB LEU 67 6.422 8.054 0.327
455 HB3 LEU 67 2HB LEU 67 7.167 6.530 0.806
456 HG LEU 67 HG LEU 67 4.436 7.496 1.655
457 HD11 LEU 67 1HD1 LEU 67 5.298 5.422 -0.352
458 HD12 LEU 67 2HD1 LEU 67 4.416 6.915 -0.672
459 HD13 LEU 67 3HD1 LEU 67 3.648 5.616 0.241
460 HD21 LEU 67 3HD2 LEU 67 5.969 4.969 2.230
461 HD22 LEU 67 1HD2 LEU 67 4.227 5.125 2.457
462 HD23 LEU 67 2HD2 LEU 67 5.332 6.138 3.387
463 H SER 68 H SER 68 9.108 6.896 1.199
464 HA SER 68 HA SER 68 10.855 9.240 1.435
465 HB2 SER 68 1HB SER 68 11.611 6.997 2.319
466 HB3 SER 68 2HB SER 68 11.647 6.430 0.649
467 HG SER 68 HG SER 68 13.635 7.438 1.755
468 H SER 69 H SER 69 12.589 9.147 -0.486
469 HA SER 69 HA SER 69 11.000 9.255 -2.961
470 HB2 SER 69 1HB SER 69 12.761 10.862 -3.752
471 HB3 SER 69 2HB SER 69 11.835 11.437 -2.365
472 HG SER 69 HG SER 69 14.114 10.010 -1.744
473 H SER 70 H SER 70 11.966 8.568 -4.930
474 HA SER 70 HA SER 70 12.932 6.883 -6.146
475 HB2 SER 70 1HB SER 70 14.690 8.594 -6.163
476 HB3 SER 70 2HB SER 70 15.358 7.935 -4.670
477 HG SER 70 HG SER 70 16.510 7.099 -6.392
478 H THR 71 H THR 71 11.874 6.067 -3.556
479 HA THR 71 HA THR 71 13.564 3.693 -3.124
480 HB THR 71 HB THR 71 12.025 5.209 -1.006
481 HG1 THR 71 1HG THR 71 14.176 5.993 -1.789
482 HG21 THR 71 3HG2 THR 71 12.231 2.593 -0.933
483 HG22 THR 71 1HG2 THR 71 12.523 3.551 0.518
484 HG23 THR 71 2HG2 THR 71 13.883 2.944 -0.426
485 H THR 72 H THR 72 12.555 1.829 -3.469
486 HA THR 72 HA THR 72 9.784 1.762 -4.167
487 HB THR 72 HB THR 72 11.664 -0.562 -3.711
488 HG1 THR 72 1HG THR 72 11.225 1.163 -5.888
489 HG21 THR 72 3HG2 THR 72 9.903 -1.375 -5.593
490 HG22 THR 72 1HG2 THR 72 8.869 -0.325 -4.625
491 HG23 THR 72 2HG2 THR 72 9.705 -1.682 -3.868
492 H TYR 73 H TYR 73 8.060 1.187 -2.978
493 HA TYR 73 HA TYR 73 8.550 0.191 -0.248
494 HB2 TYR 73 1HB TYR 73 6.805 2.386 -1.243
495 HB3 TYR 73 2HB TYR 73 6.185 1.398 0.075
496 HD1 TYR 73 1HD TYR 73 8.948 3.638 -0.936
497 HD2 TYR 73 2HD TYR 73 7.014 1.643 2.286
498 HE1 TYR 73 1HE TYR 73 10.264 4.962 0.665
499 HE2 TYR 73 2HE TYR 73 8.324 2.962 3.896
500 HH TYR 73 HH TYR 73 10.918 5.080 2.858
501 H THR 74 H THR 74 7.726 -1.745 0.133
502 HA THR 74 HA THR 74 5.908 -2.964 -1.751
503 HB THR 74 HB THR 74 7.018 -4.097 0.824
504 HG1 THR 74 1HG THR 74 8.784 -3.928 -0.400
505 HG21 THR 74 3HG2 THR 74 5.776 -5.902 0.425
506 HG22 THR 74 1HG2 THR 74 6.440 -6.034 -1.203
507 HG23 THR 74 2HG2 THR 74 5.005 -5.050 -0.912
508 H VAL 75 H VAL 75 3.863 -2.211 -1.598
509 HA VAL 75 HA VAL 75 2.629 -1.761 0.987
510 HB VAL 75 HB VAL 75 1.460 -1.520 -1.789
511 HG11 VAL 75 1HG1 VAL 75 -0.510 -1.363 -0.773
512 HG12 VAL 75 2HG1 VAL 75 0.247 -1.469 0.818
513 HG13 VAL 75 3HG1 VAL 75 0.071 0.097 0.026
514 HG21 VAL 75 3HG2 VAL 75 3.008 0.317 -0.061
515 HG22 VAL 75 1HG2 VAL 75 2.916 0.217 -1.820
516 HG23 VAL 75 2HG2 VAL 75 1.623 1.002 -0.912
517 H ARG 76 H ARG 76 1.085 -2.999 1.936
518 HA ARG 76 HA ARG 76 0.206 -5.419 0.511
519 HB2 ARG 76 1HB ARG 76 2.063 -5.628 2.389
520 HB3 ARG 76 2HB ARG 76 0.668 -5.537 3.457
521 HG2 ARG 76 1HG ARG 76 -0.328 -7.449 2.225
522 HG3 ARG 76 2HG ARG 76 1.173 -7.579 1.306
523 HD2 ARG 76 1HD ARG 76 1.186 -9.163 3.136
524 HD3 ARG 76 2HD ARG 76 2.405 -7.918 3.409
525 HE ARG 76 HE ARG 76 0.254 -6.978 4.750
526 HH11 ARG 76 1HH1 ARG 76 1.929 -10.030 4.759
527 HH12 ARG 76 2HH1 ARG 76 1.564 -10.373 6.418
528 HH21 ARG 76 1HH2 ARG 76 -0.234 -7.419 6.934
529 HH22 ARG 76 2HH2 ARG 76 0.333 -8.888 7.653
530 H VAL 77 H VAL 77 -1.894 -5.034 0.167
531 HA VAL 77 HA VAL 77 -3.498 -3.758 2.253
532 HB VAL 77 HB VAL 77 -4.286 -4.507 -0.566
533 HG11 VAL 77 1HG1 VAL 77 -6.093 -2.753 -0.044
534 HG12 VAL 77 2HG1 VAL 77 -6.275 -4.369 0.643
535 HG13 VAL 77 3HG1 VAL 77 -5.683 -3.044 1.646
536 HG21 VAL 77 3HG2 VAL 77 -3.417 -2.588 -1.304
537 HG22 VAL 77 1HG2 VAL 77 -4.084 -1.677 0.050
538 HG23 VAL 77 2HG2 VAL 77 -2.541 -2.513 0.224
539 H THR 78 H THR 78 -3.947 -5.286 3.769
540 HA THR 78 HA THR 78 -4.929 -7.902 2.933
541 HB THR 78 HB THR 78 -4.633 -6.975 5.783
542 HG1 THR 78 1HG THR 78 -2.503 -7.489 5.706
543 HG21 THR 78 3HG2 THR 78 -5.702 -9.029 5.796
544 HG22 THR 78 1HG2 THR 78 -4.009 -9.505 5.919
545 HG23 THR 78 2HG2 THR 78 -4.843 -9.603 4.367
546 H CYS 79 H CYS 79 -7.022 -8.052 2.467
547 HA CYS 79 HA CYS 79 -8.944 -6.296 3.775
548 HB2 CYS 79 1HB CYS 79 -9.363 -8.316 1.562
549 HB3 CYS 79 2HB CYS 79 -10.540 -7.133 2.121
550 HG CYS 79 HG CYS 79 -7.546 -6.061 0.920
551 H LEU 80 H LEU 80 -9.594 -6.969 5.720
552 HA LEU 80 HA LEU 80 -9.784 -9.774 6.369
553 HB2 LEU 80 1HB LEU 80 -10.092 -7.208 7.838
554 HB3 LEU 80 2HB LEU 80 -10.851 -8.649 8.512
555 HG LEU 80 HG LEU 80 -8.791 -8.497 9.603
556 HD11 LEU 80 1HD1 LEU 80 -7.714 -10.488 9.054
557 HD12 LEU 80 2HD1 LEU 80 -8.053 -10.309 7.333
558 HD13 LEU 80 3HD1 LEU 80 -9.355 -10.717 8.450
559 HD21 LEU 80 3HD2 LEU 80 -7.970 -7.161 7.230
560 HD22 LEU 80 1HD2 LEU 80 -6.837 -8.473 7.553
561 HD23 LEU 80 2HD2 LEU 80 -7.147 -7.253 8.788
562 H TYR 81 H TYR 81 -11.442 -10.843 5.474
563 HA TYR 81 HA TYR 81 -13.990 -9.623 4.986
564 HB2 TYR 81 1HB TYR 81 -13.301 -12.563 4.882
565 HB3 TYR 81 2HB TYR 81 -14.648 -11.756 4.086
566 HD1 TYR 81 2HD TYR 81 -13.705 -9.607 2.621
567 HD2 TYR 81 1HD TYR 81 -11.638 -13.233 3.445
568 HE1 TYR 81 2HE TYR 81 -12.322 -9.268 0.614
569 HE2 TYR 81 1HE TYR 81 -10.249 -12.905 1.442
570 HH TYR 81 HH TYR 81 -10.882 -11.236 -0.981
571 HA PRO 82 HA PRO 82 -15.934 -10.422 8.852
572 HB2 PRO 82 1HB PRO 82 -18.523 -10.465 8.036
573 HB3 PRO 82 2HB PRO 82 -17.577 -8.976 8.154
574 HG2 PRO 82 1HG PRO 82 -18.200 -10.640 5.744
575 HG3 PRO 82 2HG PRO 82 -18.216 -8.875 5.920
576 HD2 PRO 82 1HD PRO 82 -16.159 -10.205 4.765
577 HD3 PRO 82 2HD PRO 82 -15.929 -8.704 5.687
578 H GLY 83 H GLY 83 -16.190 -12.245 9.981
579 HA2 GLY 83 1HA GLY 83 -17.416 -14.289 10.382
580 HA3 GLY 83 2HA GLY 83 -17.428 -14.565 8.647
581 H GLY 84 H GLY 84 -15.185 -14.801 7.652
582 HA2 GLY 84 1HA GLY 84 -12.996 -15.614 9.247
583 HA3 GLY 84 2HA GLY 84 -13.916 -17.027 8.754
584 H GLY 85 H GLY 85 -11.316 -15.208 7.981
585 HA2 GLY 85 1HA GLY 85 -10.101 -16.137 6.002
586 HA3 GLY 85 2HA GLY 85 -11.576 -15.819 5.101
587 H SER 86 H SER 86 -9.101 -14.812 4.321
588 HA SER 86 HA SER 86 -9.704 -12.079 3.979
589 HB2 SER 86 1HB SER 86 -7.843 -11.072 5.238
590 HB3 SER 86 2HB SER 86 -8.969 -11.897 6.316
591 HG SER 86 HG SER 86 -7.288 -12.951 6.984
592 H SER 87 H SER 87 -8.334 -11.065 2.486
593 HA SER 87 HA SER 87 -6.418 -12.887 1.187
594 HB2 SER 87 1HB SER 87 -8.529 -12.098 -0.069
595 HB3 SER 87 2HB SER 87 -7.723 -10.533 -0.167
596 HG SER 87 HG SER 87 -6.657 -12.994 -1.100
597 H THR 88 H THR 88 -4.750 -11.608 -0.164
598 HA THR 88 HA THR 88 -3.881 -9.161 1.181
599 HB THR 88 HB THR 88 -2.006 -11.499 0.786
600 HG1 THR 88 1HG THR 88 -2.352 -12.011 2.850
601 HG21 THR 88 3HG2 THR 88 -1.318 -8.919 0.856
602 HG22 THR 88 1HG2 THR 88 -0.326 -10.182 1.582
603 HG23 THR 88 2HG2 THR 88 -1.409 -9.222 2.590
604 H LEU 89 H LEU 89 -3.450 -7.700 -0.325
605 HA LEU 89 HA LEU 89 -2.626 -8.618 -2.994
606 HB2 LEU 89 1HB LEU 89 -4.229 -6.330 -1.997
607 HB3 LEU 89 2HB LEU 89 -3.241 -6.064 -3.432
608 HG LEU 89 HG LEU 89 -5.210 -8.328 -3.258
609 HD11 LEU 89 1HD1 LEU 89 -5.945 -5.683 -3.067
610 HD12 LEU 89 2HD1 LEU 89 -6.961 -7.004 -3.642
611 HD13 LEU 89 3HD1 LEU 89 -6.068 -6.014 -4.795
612 HD21 LEU 89 3HD2 LEU 89 -4.995 -7.345 -5.847
613 HD22 LEU 89 1HD2 LEU 89 -4.261 -8.816 -5.209
614 HD23 LEU 89 2HD2 LEU 89 -3.347 -7.309 -5.219
615 H THR 90 H THR 90 -0.468 -8.628 -3.120
616 HA THR 90 HA THR 90 1.123 -6.624 -1.756
617 HB THR 90 HB THR 90 3.056 -7.866 -2.471
618 HG1 THR 90 1HG THR 90 1.212 -9.098 -4.230
619 HG21 THR 90 3HG2 THR 90 2.738 -9.734 -1.185
620 HG22 THR 90 1HG2 THR 90 1.174 -10.102 -1.909
621 HG23 THR 90 2HG2 THR 90 1.311 -8.810 -0.716
622 H GLY 91 H GLY 91 1.782 -4.779 -2.641
623 HA2 GLY 91 1HA GLY 91 2.123 -4.640 -5.557
624 HA3 GLY 91 2HA GLY 91 1.087 -3.461 -4.767
625 H ARG 92 H ARG 92 4.077 -3.890 -5.994
626 HA ARG 92 HA ARG 92 5.450 -2.243 -4.002
627 HB2 ARG 92 1HB ARG 92 6.456 -3.750 -6.418
628 HB3 ARG 92 2HB ARG 92 7.471 -2.710 -5.428
629 HG2 ARG 92 1HG ARG 92 6.938 -4.132 -3.471
630 HG3 ARG 92 2HG ARG 92 6.050 -5.213 -4.548
631 HD2 ARG 92 1HD ARG 92 8.903 -4.489 -5.105
632 HD3 ARG 92 2HD ARG 92 8.505 -5.767 -3.957
633 HE ARG 92 HE ARG 92 7.819 -7.102 -5.709
634 HH11 ARG 92 1HH1 ARG 92 8.422 -3.862 -6.832
635 HH12 ARG 92 2HH1 ARG 92 8.346 -4.289 -8.509
636 HH21 ARG 92 1HH2 ARG 92 7.717 -7.677 -7.914
637 HH22 ARG 92 2HH2 ARG 92 7.944 -6.460 -9.124
638 H VAL 93 H VAL 93 5.999 -0.164 -4.343
639 HA VAL 93 HA VAL 93 5.688 0.962 -7.035
640 HB VAL 93 HB VAL 93 3.623 1.590 -6.124
641 HG11 VAL 93 1HG1 VAL 93 3.211 1.530 -3.944
642 HG12 VAL 93 2HG1 VAL 93 4.930 1.266 -3.644
643 HG13 VAL 93 3HG1 VAL 93 4.281 2.906 -3.678
644 HG21 VAL 93 3HG2 VAL 93 5.335 3.942 -5.364
645 HG22 VAL 93 1HG2 VAL 93 5.079 3.460 -7.042
646 HG23 VAL 93 2HG2 VAL 93 3.707 3.944 -6.044
647 H THR 94 H THR 94 7.116 2.556 -7.548
648 HA THR 94 HA THR 94 9.199 3.113 -5.555
649 HB THR 94 HB THR 94 9.294 3.506 -8.553
650 HG1 THR 94 1HG THR 94 10.021 1.511 -8.652
651 HG21 THR 94 3HG2 THR 94 11.472 4.199 -8.343
652 HG22 THR 94 1HG2 THR 94 11.707 3.360 -6.810
653 HG23 THR 94 2HG2 THR 94 10.793 4.867 -6.859
654 H THR 95 H THR 95 8.826 4.934 -4.463
655 HA THR 95 HA THR 95 7.196 7.048 -5.223
656 HB THR 95 HB THR 95 8.549 8.404 -3.538
657 HG1 THR 95 1HG THR 95 10.509 7.393 -3.525
658 HG21 THR 95 3HG2 THR 95 6.536 6.694 -3.172
659 HG22 THR 95 1HG2 THR 95 7.325 7.519 -1.828
660 HG23 THR 95 2HG2 THR 95 7.767 5.859 -2.225
661 H LYS 96 H LYS 96 7.744 9.246 -5.805
662 HA LYS 96 HA LYS 96 9.598 9.338 -7.989
663 HB2 LYS 96 1HB LYS 96 8.128 11.662 -6.743
664 HB3 LYS 96 2HB LYS 96 8.782 11.561 -8.372
665 HG2 LYS 96 1HG LYS 96 7.121 9.506 -8.517
666 HG3 LYS 96 2HG LYS 96 6.292 10.408 -7.247
667 HD2 LYS 96 1HD LYS 96 5.765 12.145 -8.637
668 HD3 LYS 96 2HD LYS 96 7.182 11.899 -9.660
669 HE2 LYS 96 1HE LYS 96 6.108 9.827 -10.531
670 HE3 LYS 96 2HE LYS 96 4.663 10.242 -9.608
671 HZ1 LYS 96 3HZ LYS 96 4.904 10.938 -12.097
672 HZ2 LYS 96 1HZ LYS 96 5.775 12.236 -11.449
673 HZ3 LYS 96 2HZ LYS 96 4.170 11.978 -10.983
674 H LYS 97 H LYS 97 11.181 11.161 -8.196
675 HA LYS 97 HA LYS 97 12.992 11.086 -5.977
676 HB2 LYS 97 1HB LYS 97 13.031 12.253 -8.728
677 HB3 LYS 97 2HB LYS 97 14.204 12.827 -7.551
678 HG2 LYS 97 1HG LYS 97 15.295 11.118 -8.710
679 HG3 LYS 97 2HG LYS 97 14.798 10.381 -7.185
680 HD2 LYS 97 1HD LYS 97 12.855 9.394 -8.293
681 HD3 LYS 97 2HD LYS 97 13.338 10.142 -9.817
682 HE2 LYS 97 1HE LYS 97 15.366 8.838 -9.863
683 HE3 LYS 97 2HE LYS 97 15.019 8.176 -8.266
684 HZ1 LYS 97 3HZ LYS 97 14.159 6.499 -9.460
685 HZ2 LYS 97 1HZ LYS 97 13.935 7.438 -10.850
686 HZ3 LYS 97 2HZ LYS 97 12.806 7.505 -9.593
687 H ALA 98 H ALA 98 13.372 12.588 -4.452
688 HA ALA 98 HA ALA 98 11.505 14.761 -4.172
689 HB1 ALA 98 3HB ALA 98 12.727 15.195 -2.052
690 HB2 ALA 98 1HB ALA 98 12.124 13.544 -2.200
691 HB3 ALA 98 2HB ALA 98 13.833 13.887 -2.469
692 HA PRO 99 HA PRO 99 13.905 17.940 -6.048
693 HB2 PRO 99 1HB PRO 99 12.861 20.089 -4.759
694 HB3 PRO 99 2HB PRO 99 11.985 19.202 -6.012
695 HG2 PRO 99 1HG PRO 99 11.752 19.000 -3.034
696 HG3 PRO 99 2HG PRO 99 10.469 19.029 -4.258
697 HD2 PRO 99 1HD PRO 99 11.325 16.736 -3.099
698 HD3 PRO 99 2HD PRO 99 10.736 16.799 -4.773
699 H SER 100 H SER 100 15.999 17.565 -5.321
700 HA SER 100 HA SER 100 17.120 17.709 -2.877
701 HB2 SER 100 1HB SER 100 18.095 18.404 -5.589
702 HB3 SER 100 2HB SER 100 19.067 18.990 -4.240
703 HG SER 100 HG SER 100 18.801 16.673 -3.486
704 HA PRO 101 HA PRO 101 17.609 22.510 -3.019
705 HB2 PRO 101 1HB PRO 101 16.334 23.840 -5.013
706 HB3 PRO 101 2HB PRO 101 17.983 23.225 -5.170
707 HG2 PRO 101 1HG PRO 101 15.417 22.037 -6.152
708 HG3 PRO 101 2HG PRO 101 16.980 22.162 -6.979
709 HD2 PRO 101 1HD PRO 101 16.138 19.877 -5.795
710 HD3 PRO 101 2HD PRO 101 17.852 20.334 -5.879
711 H SER 102 H SER 102 16.119 24.400 -2.584
712 HA SER 102 HA SER 102 13.780 23.434 -1.237
713 HB2 SER 102 1HB SER 102 15.428 25.422 -0.637
714 HB3 SER 102 2HB SER 102 14.283 26.358 -1.597
715 HG SER 102 HG SER 102 12.666 25.197 -0.158
716 H SER 103 H SER 103 11.647 23.787 -1.712
717 HA SER 103 HA SER 103 11.066 25.024 -4.324
718 HB2 SER 103 1HB SER 103 10.895 22.446 -4.152
719 HB3 SER 103 2HB SER 103 9.439 22.751 -3.204
720 HG SER 103 HG SER 103 9.284 22.496 -5.621
721 H GLY 104 H GLY 104 8.604 25.479 -4.500
722 HA2 GLY 104 1HA GLY 104 7.327 26.169 -1.990
723 HA3 GLY 104 2HA GLY 104 7.850 27.545 -2.950
724 HA PRO 105 HA PRO 105 3.701 25.575 -4.394
725 HB2 PRO 105 1HB PRO 105 1.917 26.957 -2.884
726 HB3 PRO 105 2HB PRO 105 2.578 25.392 -2.397
727 HG2 PRO 105 1HG PRO 105 3.391 28.142 -1.538
728 HG3 PRO 105 2HG PRO 105 3.184 26.679 -0.558
729 HD2 PRO 105 1HD PRO 105 5.614 27.563 -1.363
730 HD3 PRO 105 2HD PRO 105 5.247 25.839 -1.152
731 H SER 106 H SER 106 5.247 28.529 -4.091
732 HA SER 106 HA SER 106 3.632 30.524 -4.908
733 HB2 SER 106 1HB SER 106 6.184 30.539 -4.649
734 HB3 SER 106 2HB SER 106 6.244 30.044 -6.340
735 HG SER 106 HG SER 106 4.662 32.010 -6.454
736 H SER 107 H SER 107 4.914 27.968 -6.998
737 HA SER 107 HA SER 107 3.659 28.986 -9.362
738 HB2 SER 107 1HB SER 107 5.688 27.635 -9.525
739 HB3 SER 107 2HB SER 107 4.860 26.267 -8.780
740 HG SER 107 HG SER 107 3.323 26.713 -10.696
741 H GLY 108 H GLY 108 1.471 29.226 -8.695
742 HA2 GLY 108 1HA GLY 108 -0.687 28.525 -8.227
743 HA3 GLY 108 2HA GLY 108 -0.342 27.418 -9.548
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -18.887 -28.712 6.123
2 HA2 GLY 1 1HA GLY 1 -19.191 -28.943 3.378
3 HA3 GLY 1 2HA GLY 1 -19.361 -27.232 3.742
4 H SER 2 H SER 2 -17.325 -28.193 2.123
5 HA SER 2 HA SER 2 -15.055 -27.040 3.343
6 HB2 SER 2 1HB SER 2 -15.062 -29.250 4.520
7 HB3 SER 2 2HB SER 2 -14.863 -30.035 2.954
8 HG SER 2 HG SER 2 -12.967 -28.442 2.843
9 H SER 3 H SER 3 -13.963 -26.141 1.734
10 HA SER 3 HA SER 3 -13.342 -27.555 -0.683
11 HB2 SER 3 1HB SER 3 -14.492 -26.062 -2.233
12 HB3 SER 3 2HB SER 3 -15.663 -26.822 -1.156
13 HG SER 3 HG SER 3 -14.573 -24.349 -0.425
14 H GLY 4 H GLY 4 -11.837 -26.421 -2.025
15 HA2 GLY 4 1HA GLY 4 -10.855 -23.844 -1.098
16 HA3 GLY 4 2HA GLY 4 -9.750 -25.196 -0.897
17 H SER 5 H SER 5 -10.451 -22.684 -2.847
18 HA SER 5 HA SER 5 -10.432 -23.626 -5.449
19 HB2 SER 5 1HB SER 5 -9.274 -21.116 -4.239
20 HB3 SER 5 2HB SER 5 -9.248 -21.420 -5.976
21 HG SER 5 HG SER 5 -11.631 -21.557 -4.462
22 H SER 6 H SER 6 -7.938 -23.723 -3.099
23 HA SER 6 HA SER 6 -5.710 -24.251 -3.177
24 HB2 SER 6 1HB SER 6 -7.041 -26.157 -5.081
25 HB3 SER 6 2HB SER 6 -5.301 -26.239 -4.809
26 HG SER 6 HG SER 6 -5.730 -26.532 -2.592
27 H GLY 7 H GLY 7 -6.017 -21.932 -4.502
28 HA2 GLY 7 1HA GLY 7 -4.314 -22.275 -6.894
29 HA3 GLY 7 2HA GLY 7 -5.561 -21.042 -6.784
30 H LEU 8 H LEU 8 -3.009 -20.322 -7.428
31 HA LEU 8 HA LEU 8 -2.171 -18.869 -5.012
32 HB2 LEU 8 1HB LEU 8 -0.475 -20.327 -7.009
33 HB3 LEU 8 2HB LEU 8 0.178 -19.005 -6.044
34 HG LEU 8 HG LEU 8 -0.596 -20.364 -4.010
35 HD11 LEU 8 1HD1 LEU 8 -1.637 -22.003 -6.008
36 HD12 LEU 8 2HD1 LEU 8 -1.515 -22.365 -4.287
37 HD13 LEU 8 3HD1 LEU 8 -0.232 -22.869 -5.387
38 HD21 LEU 8 3HD2 LEU 8 1.457 -21.741 -4.078
39 HD22 LEU 8 1HD2 LEU 8 1.734 -20.064 -4.551
40 HD23 LEU 8 2HD2 LEU 8 1.647 -21.325 -5.782
41 H ALA 9 H ALA 9 -3.544 -17.184 -5.906
42 HA ALA 9 HA ALA 9 -2.050 -15.274 -7.378
43 HB1 ALA 9 3HB ALA 9 -2.607 -16.545 -9.314
44 HB2 ALA 9 1HB ALA 9 -4.299 -16.657 -8.827
45 HB3 ALA 9 2HB ALA 9 -3.623 -15.104 -9.319
46 HA PRO 10 HA PRO 10 -4.825 -12.648 -5.198
47 HB2 PRO 10 1HB PRO 10 -4.502 -10.359 -6.622
48 HB3 PRO 10 2HB PRO 10 -3.272 -10.984 -5.516
49 HG2 PRO 10 1HG PRO 10 -3.436 -11.220 -8.496
50 HG3 PRO 10 2HG PRO 10 -2.029 -10.862 -7.477
51 HD2 PRO 10 1HD PRO 10 -2.497 -13.325 -8.503
52 HD3 PRO 10 2HD PRO 10 -1.699 -13.078 -6.936
53 HA PRO 11 HA PRO 11 -8.705 -12.636 -7.285
54 HB2 PRO 11 1HB PRO 11 -9.976 -10.665 -5.916
55 HB3 PRO 11 2HB PRO 11 -9.656 -12.261 -5.227
56 HG2 PRO 11 1HG PRO 11 -8.152 -9.700 -4.852
57 HG3 PRO 11 2HG PRO 11 -8.605 -10.918 -3.646
58 HD2 PRO 11 1HD PRO 11 -6.118 -10.773 -4.708
59 HD3 PRO 11 2HD PRO 11 -6.856 -12.309 -4.211
60 H ARG 12 H ARG 12 -7.309 -9.410 -6.704
61 HA ARG 12 HA ARG 12 -8.093 -8.667 -9.437
62 HB2 ARG 12 1HB ARG 12 -8.483 -7.038 -6.926
63 HB3 ARG 12 2HB ARG 12 -8.539 -6.342 -8.539
64 HG2 ARG 12 1HG ARG 12 -10.314 -8.606 -7.675
65 HG3 ARG 12 2HG ARG 12 -10.757 -6.907 -7.499
66 HD2 ARG 12 1HD ARG 12 -10.592 -6.576 -9.885
67 HD3 ARG 12 2HD ARG 12 -10.000 -8.222 -10.105
68 HE ARG 12 HE ARG 12 -12.579 -8.075 -8.843
69 HH11 ARG 12 1HH1 ARG 12 -10.871 -8.168 -11.875
70 HH12 ARG 12 2HH1 ARG 12 -12.218 -8.798 -12.764
71 HH21 ARG 12 1HH2 ARG 12 -14.360 -8.904 -10.002
72 HH22 ARG 12 2HH2 ARG 12 -14.202 -9.215 -11.698
73 H HIS 13 H HIS 13 -7.010 -6.309 -9.801
74 HA HIS 13 HA HIS 13 -4.160 -6.708 -9.184
75 HB2 HIS 13 1HB HIS 13 -5.292 -5.047 -11.437
76 HB3 HIS 13 2HB HIS 13 -3.629 -5.589 -11.229
77 HD1 HIS 13 1HD HIS 13 -6.620 -6.398 -13.018
78 HD2 HIS 13 2HD HIS 13 -3.498 -8.585 -11.366
79 HE1 HIS 13 1HE HIS 13 -6.700 -8.643 -14.148
80 HE2 HIS 13 2HE HIS 13 -4.855 -9.977 -13.071
81 H LEU 14 H LEU 14 -2.914 -5.016 -8.434
82 HA LEU 14 HA LEU 14 -4.377 -2.908 -7.092
83 HB2 LEU 14 1HB LEU 14 -1.630 -4.017 -6.985
84 HB3 LEU 14 2HB LEU 14 -1.843 -2.338 -6.496
85 HG LEU 14 HG LEU 14 -3.348 -4.653 -5.283
86 HD11 LEU 14 1HD1 LEU 14 -1.228 -5.115 -4.548
87 HD12 LEU 14 2HD1 LEU 14 -1.759 -3.975 -3.313
88 HD13 LEU 14 3HD1 LEU 14 -0.713 -3.430 -4.624
89 HD21 LEU 14 3HD2 LEU 14 -4.471 -2.494 -5.099
90 HD22 LEU 14 1HD2 LEU 14 -3.008 -1.783 -4.416
91 HD23 LEU 14 2HD2 LEU 14 -3.877 -3.036 -3.529
92 H GLY 15 H GLY 15 -3.386 -0.656 -7.121
93 HA2 GLY 15 1HA GLY 15 -2.127 0.101 -9.628
94 HA3 GLY 15 2HA GLY 15 -3.775 0.672 -9.414
95 H PHE 16 H PHE 16 -0.757 1.711 -9.274
96 HA PHE 16 HA PHE 16 -1.165 3.377 -6.883
97 HB2 PHE 16 1HB PHE 16 1.391 2.761 -8.380
98 HB3 PHE 16 2HB PHE 16 1.268 3.784 -6.954
99 HD1 PHE 16 1HD PHE 16 0.360 2.710 -4.814
100 HD2 PHE 16 2HD PHE 16 1.742 0.479 -8.165
101 HE1 PHE 16 1HE PHE 16 0.662 0.739 -3.372
102 HE2 PHE 16 2HE PHE 16 2.045 -1.496 -6.729
103 HZ PHE 16 HZ PHE 16 1.503 -1.368 -4.330
104 H SER 17 H SER 17 -1.750 5.410 -7.206
105 HA SER 17 HA SER 17 -0.873 6.769 -9.662
106 HB2 SER 17 1HB SER 17 -3.106 7.901 -9.741
107 HB3 SER 17 2HB SER 17 -3.184 6.164 -10.038
108 HG SER 17 HG SER 17 -4.542 6.108 -8.448
109 H ASP 18 H ASP 18 -1.256 9.204 -9.466
110 HA ASP 18 HA ASP 18 -0.437 11.098 -8.468
111 HB2 ASP 18 1HB ASP 18 -2.855 10.584 -7.519
112 HB3 ASP 18 2HB ASP 18 -1.973 10.390 -6.007
113 H VAL 19 H VAL 19 1.281 8.863 -8.129
114 HA VAL 19 HA VAL 19 2.166 8.648 -5.431
115 HB VAL 19 HB VAL 19 3.649 7.992 -7.981
116 HG11 VAL 19 1HG1 VAL 19 4.887 6.421 -6.409
117 HG12 VAL 19 2HG1 VAL 19 5.264 8.140 -6.276
118 HG13 VAL 19 3HG1 VAL 19 4.203 7.374 -5.093
119 HG21 VAL 19 3HG2 VAL 19 2.872 5.640 -6.738
120 HG22 VAL 19 1HG2 VAL 19 1.464 6.692 -6.590
121 HG23 VAL 19 2HG2 VAL 19 2.149 6.353 -8.179
122 H SER 20 H SER 20 3.823 9.658 -4.373
123 HA SER 20 HA SER 20 5.135 11.889 -5.782
124 HB2 SER 20 1HB SER 20 3.864 11.830 -3.053
125 HB3 SER 20 2HB SER 20 5.119 13.005 -3.450
126 HG SER 20 HG SER 20 3.101 13.892 -3.887
127 H HIS 21 H HIS 21 6.937 12.736 -4.037
128 HA HIS 21 HA HIS 21 8.804 10.528 -3.910
129 HB2 HIS 21 1HB HIS 21 10.300 12.461 -2.970
130 HB3 HIS 21 2HB HIS 21 9.878 12.431 -4.679
131 HD1 HIS 21 1HD HIS 21 8.480 14.347 -5.575
132 HD2 HIS 21 2HD HIS 21 8.933 14.448 -1.446
133 HE1 HIS 21 1HE HIS 21 7.598 16.590 -4.856
134 HE2 HIS 21 2HE HIS 21 7.961 16.661 -2.365
135 H ASP 22 H ASP 22 6.608 12.040 -1.813
136 HA ASP 22 HA ASP 22 7.824 10.650 0.474
137 HB2 ASP 22 1HB ASP 22 7.009 13.511 0.268
138 HB3 ASP 22 2HB ASP 22 6.714 12.678 1.792
139 H ALA 23 H ALA 23 5.577 10.100 -1.438
140 HA ALA 23 HA ALA 23 3.766 8.988 0.422
141 HB1 ALA 23 3HB ALA 23 2.843 11.483 -0.990
142 HB2 ALA 23 1HB ALA 23 1.754 10.322 -0.230
143 HB3 ALA 23 2HB ALA 23 2.931 11.199 0.748
144 H ALA 24 H ALA 24 1.899 7.937 -0.664
145 HA ALA 24 HA ALA 24 1.958 7.721 -3.538
146 HB1 ALA 24 3HB ALA 24 2.245 5.039 -2.484
147 HB2 ALA 24 1HB ALA 24 3.106 5.833 -3.804
148 HB3 ALA 24 2HB ALA 24 3.658 6.037 -2.141
149 H ARG 25 H ARG 25 0.002 7.166 -4.311
150 HA ARG 25 HA ARG 25 -2.062 6.468 -2.356
151 HB2 ARG 25 1HB ARG 25 -2.232 8.443 -4.014
152 HB3 ARG 25 2HB ARG 25 -2.563 7.212 -5.226
153 HG2 ARG 25 1HG ARG 25 -4.589 6.630 -4.270
154 HG3 ARG 25 2HG ARG 25 -4.153 7.303 -2.698
155 HD2 ARG 25 1HD ARG 25 -5.567 8.937 -3.430
156 HD3 ARG 25 2HD ARG 25 -4.049 9.548 -4.087
157 HE ARG 25 HE ARG 25 -4.861 9.183 -6.193
158 HH11 ARG 25 1HH1 ARG 25 -6.791 7.399 -3.910
159 HH12 ARG 25 2HH1 ARG 25 -7.972 6.920 -5.084
160 HH21 ARG 25 1HH2 ARG 25 -6.408 8.559 -7.748
161 HH22 ARG 25 2HH2 ARG 25 -7.753 7.580 -7.267
162 H VAL 26 H VAL 26 -2.783 4.456 -2.207
163 HA VAL 26 HA VAL 26 -2.358 2.636 -4.485
164 HB VAL 26 HB VAL 26 -1.094 1.905 -2.571
165 HG11 VAL 26 1HG1 VAL 26 -1.770 2.376 -0.510
166 HG12 VAL 26 2HG1 VAL 26 -3.351 2.875 -1.115
167 HG13 VAL 26 3HG1 VAL 26 -3.063 1.190 -0.681
168 HG21 VAL 26 3HG2 VAL 26 -3.093 0.371 -3.835
169 HG22 VAL 26 1HG2 VAL 26 -1.599 -0.195 -3.087
170 HG23 VAL 26 2HG2 VAL 26 -3.083 -0.105 -2.137
171 H PHE 27 H PHE 27 -4.091 1.830 -5.468
172 HA PHE 27 HA PHE 27 -6.631 1.696 -4.001
173 HB2 PHE 27 1HB PHE 27 -7.858 2.609 -5.870
174 HB3 PHE 27 2HB PHE 27 -6.587 3.744 -5.425
175 HD1 PHE 27 2HD PHE 27 -7.586 1.186 -7.887
176 HD2 PHE 27 1HD PHE 27 -4.884 4.338 -6.949
177 HE1 PHE 27 2HE PHE 27 -6.768 1.170 -10.207
178 HE2 PHE 27 1HE PHE 27 -4.063 4.328 -9.268
179 HZ PHE 27 HZ PHE 27 -5.004 2.743 -10.901
180 H TRP 28 H TRP 28 -7.822 -0.099 -4.369
181 HA TRP 28 HA TRP 28 -6.830 -1.963 -6.426
182 HB2 TRP 28 1HB TRP 28 -7.748 -3.766 -4.870
183 HB3 TRP 28 2HB TRP 28 -6.286 -2.939 -4.340
184 HD1 TRP 28 HD TRP 28 -9.625 -3.907 -3.133
185 HE1 TRP 28 1HE TRP 28 -10.175 -2.717 -0.918
186 HE3 TRP 28 3HE TRP 28 -5.910 -0.395 -3.154
187 HZ2 TRP 28 2HZ TRP 28 -9.168 -0.573 0.617
188 HZ3 TRP 28 3HZ TRP 28 -5.773 1.188 -1.276
189 HH2 TRP 28 HH TRP 28 -7.369 1.100 0.570
190 H GLU 29 H GLU 29 -8.477 -3.544 -7.183
191 HA GLU 29 HA GLU 29 -10.947 -2.136 -7.770
192 HB2 GLU 29 1HB GLU 29 -9.698 -4.668 -8.819
193 HB3 GLU 29 2HB GLU 29 -11.337 -4.193 -9.244
194 HG2 GLU 29 1HG GLU 29 -9.021 -2.341 -9.659
195 HG3 GLU 29 2HG GLU 29 -9.440 -3.577 -10.844
196 H GLY 30 H GLY 30 -10.219 -3.519 -5.115
197 HA2 GLY 30 1HA GLY 30 -11.537 -4.406 -3.437
198 HA3 GLY 30 2HA GLY 30 -12.874 -4.464 -4.576
199 H ALA 31 H ALA 31 -13.185 -6.529 -3.310
200 HA ALA 31 HA ALA 31 -11.838 -8.702 -4.755
201 HB1 ALA 31 3HB ALA 31 -11.987 -8.302 -1.816
202 HB2 ALA 31 1HB ALA 31 -12.130 -9.946 -2.439
203 HB3 ALA 31 2HB ALA 31 -10.695 -8.986 -2.802
204 HA PRO 32 HA PRO 32 -15.877 -10.304 -5.397
205 HB2 PRO 32 1HB PRO 32 -15.346 -12.961 -5.557
206 HB3 PRO 32 2HB PRO 32 -14.911 -11.816 -6.831
207 HG2 PRO 32 1HG PRO 32 -13.203 -12.978 -4.664
208 HG3 PRO 32 2HG PRO 32 -12.822 -12.733 -6.378
209 HD2 PRO 32 1HD PRO 32 -11.963 -11.050 -4.439
210 HD3 PRO 32 2HD PRO 32 -12.347 -10.497 -6.081
211 H ARG 33 H ARG 33 -14.292 -10.610 -2.529
212 HA ARG 33 HA ARG 33 -16.480 -12.172 -1.320
213 HB2 ARG 33 1HB ARG 33 -13.889 -11.820 0.111
214 HB3 ARG 33 2HB ARG 33 -15.027 -13.159 0.166
215 HG2 ARG 33 1HG ARG 33 -13.458 -12.616 -2.319
216 HG3 ARG 33 2HG ARG 33 -12.731 -13.488 -0.968
217 HD2 ARG 33 1HD ARG 33 -14.985 -14.866 -1.122
218 HD3 ARG 33 2HD ARG 33 -14.940 -14.290 -2.788
219 HE ARG 33 HE ARG 33 -12.464 -15.281 -2.456
220 HH11 ARG 33 1HH1 ARG 33 -15.622 -16.583 -1.782
221 HH12 ARG 33 2HH1 ARG 33 -15.145 -18.227 -2.050
222 HH21 ARG 33 1HH2 ARG 33 -11.824 -17.441 -2.811
223 HH22 ARG 33 2HH2 ARG 33 -12.984 -18.714 -2.634
224 HA PRO 34 HA PRO 34 -17.609 -8.692 1.104
225 HB2 PRO 34 1HB PRO 34 -18.413 -9.881 3.408
226 HB3 PRO 34 2HB PRO 34 -19.346 -9.963 1.909
227 HG2 PRO 34 1HG PRO 34 -17.487 -11.987 3.097
228 HG3 PRO 34 2HG PRO 34 -19.073 -12.231 2.341
229 HD2 PRO 34 1HD PRO 34 -16.749 -12.699 1.033
230 HD3 PRO 34 2HD PRO 34 -18.212 -12.128 0.206
231 H VAL 35 H VAL 35 -16.675 -7.240 2.443
232 HA VAL 35 HA VAL 35 -14.598 -8.185 4.301
233 HB VAL 35 HB VAL 35 -14.351 -5.783 2.484
234 HG11 VAL 35 1HG1 VAL 35 -13.283 -6.067 4.982
235 HG12 VAL 35 2HG1 VAL 35 -11.995 -6.699 3.955
236 HG13 VAL 35 3HG1 VAL 35 -12.610 -5.065 3.696
237 HG21 VAL 35 3HG2 VAL 35 -12.385 -7.080 1.591
238 HG22 VAL 35 1HG2 VAL 35 -13.004 -8.475 2.475
239 HG23 VAL 35 2HG2 VAL 35 -13.970 -7.742 1.194
240 H ARG 36 H ARG 36 -14.619 -7.260 6.273
241 HA ARG 36 HA ARG 36 -16.685 -5.245 6.778
242 HB2 ARG 36 1HB ARG 36 -16.562 -5.915 9.103
243 HB3 ARG 36 2HB ARG 36 -16.759 -7.339 8.090
244 HG2 ARG 36 1HG ARG 36 -14.422 -7.880 8.315
245 HG3 ARG 36 2HG ARG 36 -14.133 -6.389 9.214
246 HD2 ARG 36 1HD ARG 36 -16.029 -8.547 10.118
247 HD3 ARG 36 2HD ARG 36 -14.340 -8.462 10.615
248 HE ARG 36 HE ARG 36 -15.779 -6.032 11.104
249 HH11 ARG 36 1HH1 ARG 36 -15.048 -9.201 12.347
250 HH12 ARG 36 2HH1 ARG 36 -15.334 -8.762 13.998
251 HH21 ARG 36 1HH2 ARG 36 -16.159 -5.443 13.275
252 HH22 ARG 36 2HH2 ARG 36 -15.967 -6.624 14.525
253 H LEU 37 H LEU 37 -13.252 -5.768 6.891
254 HA LEU 37 HA LEU 37 -12.803 -2.947 7.301
255 HB2 LEU 37 1HB LEU 37 -12.980 -3.740 9.597
256 HB3 LEU 37 2HB LEU 37 -11.759 -4.970 9.278
257 HG LEU 37 HG LEU 37 -10.154 -3.066 8.817
258 HD11 LEU 37 1HD1 LEU 37 -10.922 -0.990 8.769
259 HD12 LEU 37 2HD1 LEU 37 -11.411 -1.135 10.457
260 HD13 LEU 37 3HD1 LEU 37 -12.541 -1.561 9.172
261 HD21 LEU 37 3HD2 LEU 37 -10.617 -4.430 11.043
262 HD22 LEU 37 1HD2 LEU 37 -11.078 -2.831 11.628
263 HD23 LEU 37 2HD2 LEU 37 -9.458 -3.102 10.985
264 H VAL 38 H VAL 38 -10.583 -2.324 6.918
265 HA VAL 38 HA VAL 38 -8.989 -4.390 5.552
266 HB VAL 38 HB VAL 38 -9.447 -1.560 4.599
267 HG11 VAL 38 1HG1 VAL 38 -7.377 -1.760 3.765
268 HG12 VAL 38 2HG1 VAL 38 -7.332 -3.502 4.040
269 HG13 VAL 38 3HG1 VAL 38 -8.117 -2.856 2.599
270 HG21 VAL 38 3HG2 VAL 38 -9.985 -3.561 2.642
271 HG22 VAL 38 1HG2 VAL 38 -10.865 -3.959 4.118
272 HG23 VAL 38 2HG2 VAL 38 -11.091 -2.386 3.354
273 H ARG 39 H ARG 39 -6.776 -4.251 5.768
274 HA ARG 39 HA ARG 39 -5.714 -2.059 7.409
275 HB2 ARG 39 1HB ARG 39 -6.225 -4.350 8.617
276 HB3 ARG 39 2HB ARG 39 -4.709 -4.834 7.869
277 HG2 ARG 39 1HG ARG 39 -3.475 -3.262 9.075
278 HG3 ARG 39 2HG ARG 39 -4.912 -2.331 9.502
279 HD2 ARG 39 1HD ARG 39 -4.625 -5.165 10.415
280 HD3 ARG 39 2HD ARG 39 -3.795 -3.870 11.276
281 HE ARG 39 HE ARG 39 -6.336 -2.968 11.126
282 HH11 ARG 39 1HH1 ARG 39 -4.932 -5.969 12.197
283 HH12 ARG 39 2HH1 ARG 39 -6.172 -6.283 13.366
284 HH21 ARG 39 1HH2 ARG 39 -7.974 -3.370 12.662
285 HH22 ARG 39 2HH2 ARG 39 -7.902 -4.804 13.629
286 H VAL 40 H VAL 40 -4.554 -1.093 5.812
287 HA VAL 40 HA VAL 40 -2.922 -2.634 3.993
288 HB VAL 40 HB VAL 40 -3.127 0.357 4.373
289 HG11 VAL 40 1HG1 VAL 40 -2.202 0.154 1.909
290 HG12 VAL 40 2HG1 VAL 40 -1.115 0.183 3.299
291 HG13 VAL 40 3HG1 VAL 40 -1.531 -1.352 2.535
292 HG21 VAL 40 3HG2 VAL 40 -5.199 -0.853 3.612
293 HG22 VAL 40 1HG2 VAL 40 -4.592 0.376 2.502
294 HG23 VAL 40 2HG2 VAL 40 -4.300 -1.332 2.173
295 H THR 41 H THR 41 -0.710 -2.770 3.956
296 HA THR 41 HA THR 41 0.796 -1.469 6.109
297 HB THR 41 HB THR 41 2.072 -3.638 6.434
298 HG1 THR 41 1HG THR 41 -0.246 -4.909 5.431
299 HG21 THR 41 3HG2 THR 41 -0.834 -3.492 7.238
300 HG22 THR 41 1HG2 THR 41 0.549 -2.866 8.135
301 HG23 THR 41 2HG2 THR 41 0.339 -4.607 7.939
302 H TYR 42 H TYR 42 2.464 -0.431 5.257
303 HA TYR 42 HA TYR 42 3.676 -1.499 2.792
304 HB2 TYR 42 1HB TYR 42 4.386 0.948 2.444
305 HB3 TYR 42 2HB TYR 42 2.697 0.542 2.163
306 HD1 TYR 42 2HD TYR 42 1.022 1.045 4.011
307 HD2 TYR 42 1HD TYR 42 4.982 2.601 4.002
308 HE1 TYR 42 2HE TYR 42 0.334 2.788 5.603
309 HE2 TYR 42 1HE TYR 42 4.305 4.348 5.595
310 HH TYR 42 HH TYR 42 1.008 4.465 6.901
311 H VAL 43 H VAL 43 5.968 -1.092 2.511
312 HA VAL 43 HA VAL 43 7.521 -0.312 4.823
313 HB VAL 43 HB VAL 43 7.073 -2.655 5.348
314 HG11 VAL 43 1HG1 VAL 43 6.630 -3.572 3.190
315 HG12 VAL 43 2HG1 VAL 43 8.256 -3.179 2.627
316 HG13 VAL 43 3HG1 VAL 43 8.023 -4.423 3.856
317 HG21 VAL 43 3HG2 VAL 43 9.231 -1.705 5.978
318 HG22 VAL 43 1HG2 VAL 43 9.387 -3.417 5.583
319 HG23 VAL 43 2HG2 VAL 43 9.910 -2.193 4.425
320 H SER 44 H SER 44 9.768 -0.051 4.359
321 HA SER 44 HA SER 44 10.269 0.868 1.720
322 HB2 SER 44 1HB SER 44 12.510 1.386 2.524
323 HB3 SER 44 2HB SER 44 11.323 1.854 3.741
324 HG SER 44 HG SER 44 13.253 -0.134 3.808
325 H SER 45 H SER 45 12.635 0.172 0.848
326 HA SER 45 HA SER 45 12.294 -2.621 0.111
327 HB2 SER 45 1HB SER 45 14.075 -2.133 -1.562
328 HB3 SER 45 2HB SER 45 12.693 -1.045 -1.693
329 HG SER 45 HG SER 45 13.945 0.571 -1.216
330 H GLU 46 H GLU 46 14.701 -0.534 1.647
331 HA GLU 46 HA GLU 46 16.497 -2.759 2.114
332 HB2 GLU 46 1HB GLU 46 16.638 0.123 3.019
333 HB3 GLU 46 2HB GLU 46 17.909 -1.071 3.246
334 HG2 GLU 46 1HG GLU 46 18.066 -1.311 0.791
335 HG3 GLU 46 2HG GLU 46 16.878 -0.020 0.622
336 H GLY 47 H GLY 47 13.910 -3.035 3.277
337 HA2 GLY 47 1HA GLY 47 12.829 -3.313 5.315
338 HA3 GLY 47 2HA GLY 47 14.324 -4.163 5.673
339 H GLY 48 H GLY 48 12.515 -1.214 6.103
340 HA2 GLY 48 1HA GLY 48 13.987 -0.650 8.524
341 HA3 GLY 48 2HA GLY 48 14.232 0.536 7.250
342 H HIS 49 H HIS 49 12.524 1.879 6.624
343 HA HIS 49 HA HIS 49 10.643 2.441 8.712
344 HB2 HIS 49 1HB HIS 49 11.542 4.323 7.566
345 HB3 HIS 49 2HB HIS 49 11.131 3.650 5.991
346 HD1 HIS 49 1HD HIS 49 9.041 4.516 4.989
347 HD2 HIS 49 2HD HIS 49 9.088 4.982 9.117
348 HE1 HIS 49 1HE HIS 49 6.944 5.787 5.546
349 HE2 HIS 49 2HE HIS 49 7.037 6.131 8.039
350 H SER 50 H SER 50 8.617 1.746 8.909
351 HA SER 50 HA SER 50 7.231 0.707 6.537
352 HB2 SER 50 1HB SER 50 6.831 -0.699 9.141
353 HB3 SER 50 2HB SER 50 6.705 -1.324 7.497
354 HG SER 50 HG SER 50 8.631 -2.073 7.856
355 H GLY 51 H GLY 51 4.839 0.344 7.041
356 HA2 GLY 51 1HA GLY 51 3.770 2.064 9.128
357 HA3 GLY 51 2HA GLY 51 3.473 2.596 7.480
358 H GLN 52 H GLN 52 1.332 2.120 9.043
359 HA GLN 52 HA GLN 52 0.019 -0.002 7.616
360 HB2 GLN 52 1HB GLN 52 1.005 -1.316 9.399
361 HB3 GLN 52 2HB GLN 52 0.382 -0.202 10.609
362 HG2 GLN 52 1HG GLN 52 -1.920 -0.814 9.896
363 HG3 GLN 52 2HG GLN 52 -1.214 -2.035 8.839
364 HE21 GLN 52 1HE2 GLN 52 0.480 -3.426 10.078
365 HE22 GLN 52 2HE2 GLN 52 -0.071 -4.056 11.589
366 H THR 53 H THR 53 -1.964 0.675 7.159
367 HA THR 53 HA THR 53 -3.275 2.553 9.013
368 HB THR 53 HB THR 53 -2.539 3.793 7.052
369 HG1 THR 53 1HG THR 53 -4.452 4.594 7.726
370 HG21 THR 53 3HG2 THR 53 -2.433 1.914 5.470
371 HG22 THR 53 1HG2 THR 53 -3.365 3.262 4.818
372 HG23 THR 53 2HG2 THR 53 -4.195 1.839 5.450
373 H GLU 54 H GLU 54 -5.664 2.633 8.744
374 HA GLU 54 HA GLU 54 -6.725 -0.010 7.985
375 HB2 GLU 54 1HB GLU 54 -7.449 1.768 10.310
376 HB3 GLU 54 2HB GLU 54 -8.482 0.453 9.769
377 HG2 GLU 54 1HG GLU 54 -7.240 -0.423 11.545
378 HG3 GLU 54 2HG GLU 54 -6.483 -1.065 10.088
379 H ALA 55 H ALA 55 -8.690 -0.095 6.927
380 HA ALA 55 HA ALA 55 -10.112 2.383 6.366
381 HB1 ALA 55 3HB ALA 55 -8.210 1.783 4.615
382 HB2 ALA 55 1HB ALA 55 -9.485 0.748 3.972
383 HB3 ALA 55 2HB ALA 55 -9.750 2.486 4.122
384 HA PRO 56 HA PRO 56 -13.642 -0.225 6.519
385 HB2 PRO 56 1HB PRO 56 -15.354 1.143 4.916
386 HB3 PRO 56 2HB PRO 56 -14.903 1.696 6.532
387 HG2 PRO 56 1HG PRO 56 -13.847 2.565 3.870
388 HG3 PRO 56 2HG PRO 56 -14.276 3.552 5.279
389 HD2 PRO 56 1HD PRO 56 -11.717 2.895 4.685
390 HD3 PRO 56 2HD PRO 56 -12.286 3.108 6.354
391 H GLY 57 H GLY 57 -14.946 -1.683 5.295
392 HA2 GLY 57 1HA GLY 57 -13.630 -2.978 3.193
393 HA3 GLY 57 2HA GLY 57 -15.312 -3.225 3.637
394 H ASN 58 H ASN 58 -15.642 -0.201 3.134
395 HA ASN 58 HA ASN 58 -16.357 -0.515 0.337
396 HB2 ASN 58 1HB ASN 58 -17.190 1.962 0.855
397 HB3 ASN 58 2HB ASN 58 -18.112 0.548 1.358
398 HD21 ASN 58 1HD2 ASN 58 -15.595 2.767 2.476
399 HD22 ASN 58 2HD2 ASN 58 -16.081 2.759 4.134
400 H ALA 59 H ALA 59 -13.806 0.783 2.165
401 HA ALA 59 HA ALA 59 -13.041 2.854 0.328
402 HB1 ALA 59 3HB ALA 59 -12.061 3.465 2.240
403 HB2 ALA 59 1HB ALA 59 -12.107 1.826 2.892
404 HB3 ALA 59 2HB ALA 59 -10.799 2.310 1.811
405 H THR 60 H THR 60 -12.242 2.439 -1.617
406 HA THR 60 HA THR 60 -10.617 0.013 -1.996
407 HB THR 60 HB THR 60 -11.153 0.193 -4.396
408 HG1 THR 60 1HG THR 60 -12.770 2.377 -3.531
409 HG21 THR 60 3HG2 THR 60 -13.763 -0.058 -4.026
410 HG22 THR 60 1HG2 THR 60 -13.278 -0.085 -2.331
411 HG23 THR 60 2HG2 THR 60 -12.630 -1.281 -3.453
412 H SER 61 H SER 61 -9.772 2.725 -1.024
413 HA SER 61 HA SER 61 -7.343 2.889 -2.489
414 HB2 SER 61 1HB SER 61 -7.680 5.280 -3.252
415 HB3 SER 61 2HB SER 61 -8.594 4.069 -4.152
416 HG SER 61 HG SER 61 -10.145 5.464 -3.696
417 H ALA 62 H ALA 62 -5.779 3.928 -1.336
418 HA ALA 62 HA ALA 62 -6.479 5.747 0.807
419 HB1 ALA 62 3HB ALA 62 -6.501 3.172 1.526
420 HB2 ALA 62 1HB ALA 62 -4.782 3.509 1.728
421 HB3 ALA 62 2HB ALA 62 -5.977 4.465 2.605
422 H MET 63 H MET 63 -4.692 6.919 1.624
423 HA MET 63 HA MET 63 -2.438 6.989 -0.227
424 HB2 MET 63 1HB MET 63 -3.453 8.893 1.874
425 HB3 MET 63 2HB MET 63 -1.890 9.111 1.099
426 HG2 MET 63 1HG MET 63 -3.360 8.865 -1.089
427 HG3 MET 63 2HG MET 63 -4.619 9.443 0.000
428 HE1 MET 63 3HE MET 63 -0.884 11.745 -1.362
429 HE2 MET 63 1HE MET 63 -0.838 10.092 -0.751
430 HE3 MET 63 2HE MET 63 -1.657 10.446 -2.271
431 H LEU 64 H LEU 64 -0.241 7.270 0.619
432 HA LEU 64 HA LEU 64 0.182 6.052 3.256
433 HB2 LEU 64 1HB LEU 64 1.750 5.292 0.800
434 HB3 LEU 64 2HB LEU 64 1.887 4.594 2.413
435 HG LEU 64 HG LEU 64 -0.566 4.352 0.677
436 HD11 LEU 64 1HD1 LEU 64 1.840 3.197 0.124
437 HD12 LEU 64 2HD1 LEU 64 0.269 2.539 -0.334
438 HD13 LEU 64 3HD1 LEU 64 1.069 1.971 1.131
439 HD21 LEU 64 3HD2 LEU 64 0.120 3.600 3.412
440 HD22 LEU 64 1HD2 LEU 64 -0.505 2.262 2.447
441 HD23 LEU 64 2HD2 LEU 64 -1.457 3.736 2.632
442 H GLY 65 H GLY 65 2.064 6.682 4.326
443 HA2 GLY 65 1HA GLY 65 4.325 7.855 3.654
444 HA3 GLY 65 2HA GLY 65 3.215 9.175 3.316
445 HA PRO 66 HA PRO 66 4.961 10.477 3.928
446 HB2 PRO 66 1HB PRO 66 7.226 11.059 5.306
447 HB3 PRO 66 2HB PRO 66 5.763 12.046 5.402
448 HG2 PRO 66 1HG PRO 66 6.762 9.951 7.293
449 HG3 PRO 66 2HG PRO 66 6.058 11.538 7.652
450 HD2 PRO 66 1HD PRO 66 4.634 9.240 7.822
451 HD3 PRO 66 2HD PRO 66 3.899 10.787 7.355
452 H LEU 67 H LEU 67 6.037 9.386 2.414
453 HA LEU 67 HA LEU 67 7.581 7.021 3.205
454 HB2 LEU 67 1HB LEU 67 6.763 7.785 0.416
455 HB3 LEU 67 2HB LEU 67 7.288 6.208 1.002
456 HG LEU 67 HG LEU 67 4.684 7.555 1.719
457 HD11 LEU 67 1HD1 LEU 67 4.294 6.943 -0.448
458 HD12 LEU 67 2HD1 LEU 67 3.892 5.436 0.375
459 HD13 LEU 67 3HD1 LEU 67 5.463 5.622 -0.404
460 HD21 LEU 67 3HD2 LEU 67 5.834 4.851 2.384
461 HD22 LEU 67 1HD2 LEU 67 4.134 5.275 2.588
462 HD23 LEU 67 2HD2 LEU 67 5.372 6.132 3.505
463 H SER 68 H SER 68 9.328 6.613 1.279
464 HA SER 68 HA SER 68 11.145 8.896 1.516
465 HB2 SER 68 1HB SER 68 11.493 5.957 1.187
466 HB3 SER 68 2HB SER 68 12.729 7.002 0.488
467 HG SER 68 HG SER 68 13.009 6.307 2.760
468 H SER 69 H SER 69 12.752 8.995 -0.442
469 HA SER 69 HA SER 69 11.087 9.226 -2.854
470 HB2 SER 69 1HB SER 69 12.883 10.827 -3.618
471 HB3 SER 69 2HB SER 69 11.979 11.355 -2.199
472 HG SER 69 HG SER 69 13.839 11.490 -1.252
473 H SER 70 H SER 70 11.958 8.635 -4.896
474 HA SER 70 HA SER 70 12.830 6.992 -6.239
475 HB2 SER 70 1HB SER 70 14.610 8.690 -6.245
476 HB3 SER 70 2HB SER 70 15.347 7.927 -4.837
477 HG SER 70 HG SER 70 16.282 6.585 -6.139
478 H THR 71 H THR 71 11.879 6.049 -3.660
479 HA THR 71 HA THR 71 13.571 3.650 -3.411
480 HB THR 71 HB THR 71 12.092 5.032 -1.163
481 HG1 THR 71 1HG THR 71 14.726 5.081 -2.071
482 HG21 THR 71 3HG2 THR 71 12.191 3.097 -0.067
483 HG22 THR 71 1HG2 THR 71 13.945 3.094 -0.241
484 HG23 THR 71 2HG2 THR 71 12.936 2.325 -1.466
485 H THR 72 H THR 72 12.549 1.722 -3.477
486 HA THR 72 HA THR 72 9.772 1.696 -4.250
487 HB THR 72 HB THR 72 11.625 -0.649 -3.790
488 HG1 THR 72 1HG THR 72 12.546 0.254 -5.499
489 HG21 THR 72 3HG2 THR 72 10.069 -1.971 -4.949
490 HG22 THR 72 1HG2 THR 72 9.194 -0.567 -5.556
491 HG23 THR 72 2HG2 THR 72 9.085 -1.004 -3.851
492 H TYR 73 H TYR 73 8.048 1.033 -3.080
493 HA TYR 73 HA TYR 73 8.557 0.147 -0.315
494 HB2 TYR 73 1HB TYR 73 6.660 2.180 -1.405
495 HB3 TYR 73 2HB TYR 73 6.168 1.244 0.002
496 HD1 TYR 73 1HD TYR 73 8.720 3.595 -1.279
497 HD2 TYR 73 2HD TYR 73 7.058 1.706 2.152
498 HE1 TYR 73 1HE TYR 73 9.997 5.117 0.170
499 HE2 TYR 73 2HE TYR 73 8.330 3.224 3.611
500 HH TYR 73 HH TYR 73 9.348 5.696 3.254
501 H THR 74 H THR 74 7.709 -1.748 0.235
502 HA THR 74 HA THR 74 6.060 -3.179 -1.664
503 HB THR 74 HB THR 74 6.957 -4.133 1.057
504 HG1 THR 74 1HG THR 74 8.349 -3.826 -1.338
505 HG21 THR 74 3HG2 THR 74 5.535 -5.319 -1.209
506 HG22 THR 74 1HG2 THR 74 5.624 -5.845 0.472
507 HG23 THR 74 2HG2 THR 74 6.911 -6.273 -0.655
508 H VAL 75 H VAL 75 4.010 -2.372 -1.663
509 HA VAL 75 HA VAL 75 2.612 -1.866 0.824
510 HB VAL 75 HB VAL 75 1.636 -1.728 -2.033
511 HG11 VAL 75 1HG1 VAL 75 -0.221 -0.379 -1.020
512 HG12 VAL 75 2HG1 VAL 75 -0.249 -2.098 -0.621
513 HG13 VAL 75 3HG1 VAL 75 0.333 -0.926 0.562
514 HG21 VAL 75 3HG2 VAL 75 3.424 -0.073 -0.808
515 HG22 VAL 75 1HG2 VAL 75 2.358 0.394 -2.133
516 HG23 VAL 75 2HG2 VAL 75 1.894 0.734 -0.466
517 H ARG 76 H ARG 76 0.683 -2.918 1.467
518 HA ARG 76 HA ARG 76 -0.080 -5.378 0.131
519 HB2 ARG 76 1HB ARG 76 1.403 -5.293 2.705
520 HB3 ARG 76 2HB ARG 76 0.064 -6.427 2.591
521 HG2 ARG 76 1HG ARG 76 1.120 -7.740 1.062
522 HG3 ARG 76 2HG ARG 76 2.040 -6.397 0.380
523 HD2 ARG 76 1HD ARG 76 3.544 -7.866 1.549
524 HD3 ARG 76 2HD ARG 76 3.413 -6.349 2.438
525 HE ARG 76 HE ARG 76 2.520 -7.505 4.195
526 HH11 ARG 76 1HH1 ARG 76 2.320 -9.473 1.330
527 HH12 ARG 76 2HH1 ARG 76 1.769 -10.880 2.178
528 HH21 ARG 76 1HH2 ARG 76 1.795 -9.351 5.322
529 HH22 ARG 76 2HH2 ARG 76 1.470 -10.810 4.448
530 H VAL 77 H VAL 77 -2.192 -4.991 -0.077
531 HA VAL 77 HA VAL 77 -3.671 -3.633 2.024
532 HB VAL 77 HB VAL 77 -4.589 -4.659 -0.666
533 HG11 VAL 77 1HG1 VAL 77 -6.140 -2.611 0.786
534 HG12 VAL 77 2HG1 VAL 77 -6.688 -3.946 -0.230
535 HG13 VAL 77 3HG1 VAL 77 -6.207 -4.246 1.441
536 HG21 VAL 77 3HG2 VAL 77 -3.005 -2.855 -0.909
537 HG22 VAL 77 1HG2 VAL 77 -4.625 -2.255 -1.264
538 HG23 VAL 77 2HG2 VAL 77 -3.869 -1.888 0.286
539 H THR 78 H THR 78 -3.645 -5.188 3.680
540 HA THR 78 HA THR 78 -4.653 -7.843 3.239
541 HB THR 78 HB THR 78 -4.291 -6.482 5.909
542 HG1 THR 78 1HG THR 78 -2.211 -6.583 5.578
543 HG21 THR 78 3HG2 THR 78 -3.558 -9.214 5.913
544 HG22 THR 78 1HG2 THR 78 -5.112 -9.094 5.090
545 HG23 THR 78 2HG2 THR 78 -4.928 -8.455 6.723
546 H CYS 79 H CYS 79 -6.747 -7.909 2.610
547 HA CYS 79 HA CYS 79 -8.731 -6.281 3.988
548 HB2 CYS 79 1HB CYS 79 -8.917 -8.137 1.611
549 HB3 CYS 79 2HB CYS 79 -10.303 -7.305 2.305
550 HG CYS 79 HG CYS 79 -9.483 -6.003 -0.053
551 H LEU 80 H LEU 80 -9.496 -7.028 5.849
552 HA LEU 80 HA LEU 80 -9.542 -9.869 6.414
553 HB2 LEU 80 1HB LEU 80 -10.004 -7.374 7.973
554 HB3 LEU 80 2HB LEU 80 -10.665 -8.889 8.583
555 HG LEU 80 HG LEU 80 -8.567 -8.470 9.662
556 HD11 LEU 80 1HD1 LEU 80 -7.568 -10.531 9.349
557 HD12 LEU 80 2HD1 LEU 80 -7.864 -10.528 7.611
558 HD13 LEU 80 3HD1 LEU 80 -9.198 -10.804 8.732
559 HD21 LEU 80 3HD2 LEU 80 -6.527 -8.608 7.925
560 HD22 LEU 80 1HD2 LEU 80 -7.230 -7.088 8.477
561 HD23 LEU 80 2HD2 LEU 80 -7.713 -7.770 6.923
562 H TYR 81 H TYR 81 -11.243 -11.162 6.181
563 HA TYR 81 HA TYR 81 -13.767 -10.028 5.296
564 HB2 TYR 81 1HB TYR 81 -12.817 -12.889 5.525
565 HB3 TYR 81 2HB TYR 81 -14.393 -12.414 4.903
566 HD1 TYR 81 2HD TYR 81 -12.410 -9.861 3.832
567 HD2 TYR 81 1HD TYR 81 -12.993 -14.015 3.117
568 HE1 TYR 81 2HE TYR 81 -11.447 -9.604 1.584
569 HE2 TYR 81 1HE TYR 81 -12.031 -13.769 0.867
570 HH TYR 81 HH TYR 81 -10.639 -12.317 -0.391
571 HA PRO 82 HA PRO 82 -15.858 -10.337 9.149
572 HB2 PRO 82 1HB PRO 82 -18.400 -10.712 8.275
573 HB3 PRO 82 2HB PRO 82 -17.564 -9.160 8.158
574 HG2 PRO 82 1HG PRO 82 -17.968 -11.257 6.060
575 HG3 PRO 82 2HG PRO 82 -18.111 -9.495 5.923
576 HD2 PRO 82 1HD PRO 82 -15.921 -10.848 5.083
577 HD3 PRO 82 2HD PRO 82 -15.834 -9.198 5.733
578 H GLY 83 H GLY 83 -15.518 -12.936 7.034
579 HA2 GLY 83 1HA GLY 83 -15.514 -14.947 8.872
580 HA3 GLY 83 2HA GLY 83 -17.206 -14.814 8.413
581 H GLY 84 H GLY 84 -14.078 -15.920 7.504
582 HA2 GLY 84 1HA GLY 84 -14.742 -17.898 5.819
583 HA3 GLY 84 2HA GLY 84 -14.841 -16.497 4.762
584 H GLY 85 H GLY 85 -12.743 -14.964 5.470
585 HA2 GLY 85 1HA GLY 85 -10.307 -16.230 5.979
586 HA3 GLY 85 2HA GLY 85 -10.566 -16.281 4.242
587 H SER 86 H SER 86 -9.172 -14.829 3.445
588 HA SER 86 HA SER 86 -9.663 -12.062 3.763
589 HB2 SER 86 1HB SER 86 -7.662 -11.349 4.903
590 HB3 SER 86 2HB SER 86 -8.473 -12.538 5.922
591 HG SER 86 HG SER 86 -6.731 -13.687 5.820
592 H SER 87 H SER 87 -7.842 -10.748 2.683
593 HA SER 87 HA SER 87 -6.410 -12.296 0.657
594 HB2 SER 87 1HB SER 87 -7.277 -11.034 -1.185
595 HB3 SER 87 2HB SER 87 -8.664 -11.608 -0.259
596 HG SER 87 HG SER 87 -8.468 -9.248 -0.956
597 H THR 88 H THR 88 -4.413 -11.551 0.350
598 HA THR 88 HA THR 88 -3.783 -8.840 1.319
599 HB THR 88 HB THR 88 -1.829 -11.133 1.129
600 HG1 THR 88 1HG THR 88 -2.147 -11.087 3.515
601 HG21 THR 88 3HG2 THR 88 -1.749 -8.337 2.163
602 HG22 THR 88 1HG2 THR 88 -0.536 -9.234 1.251
603 HG23 THR 88 2HG2 THR 88 -0.776 -9.568 2.966
604 H LEU 89 H LEU 89 -3.813 -7.614 -0.491
605 HA LEU 89 HA LEU 89 -2.620 -8.584 -2.953
606 HB2 LEU 89 1HB LEU 89 -4.193 -6.170 -2.167
607 HB3 LEU 89 2HB LEU 89 -3.265 -6.160 -3.664
608 HG LEU 89 HG LEU 89 -5.240 -8.345 -3.123
609 HD11 LEU 89 1HD1 LEU 89 -6.822 -6.755 -2.933
610 HD12 LEU 89 2HD1 LEU 89 -6.654 -6.669 -4.686
611 HD13 LEU 89 3HD1 LEU 89 -5.811 -5.507 -3.662
612 HD21 LEU 89 3HD2 LEU 89 -4.640 -8.967 -5.165
613 HD22 LEU 89 1HD2 LEU 89 -3.490 -7.632 -5.234
614 HD23 LEU 89 2HD2 LEU 89 -5.143 -7.401 -5.804
615 H THR 90 H THR 90 -0.458 -8.572 -2.978
616 HA THR 90 HA THR 90 1.035 -6.448 -1.675
617 HB THR 90 HB THR 90 2.959 -7.739 -1.956
618 HG1 THR 90 1HG THR 90 1.575 -9.063 -4.068
619 HG21 THR 90 3HG2 THR 90 0.538 -9.462 -1.585
620 HG22 THR 90 1HG2 THR 90 1.740 -8.956 -0.399
621 HG23 THR 90 2HG2 THR 90 2.147 -10.184 -1.597
622 H GLY 91 H GLY 91 1.910 -4.734 -2.664
623 HA2 GLY 91 1HA GLY 91 2.300 -4.806 -5.571
624 HA3 GLY 91 2HA GLY 91 1.281 -3.541 -4.899
625 H ARG 92 H ARG 92 4.183 -3.951 -6.145
626 HA ARG 92 HA ARG 92 5.659 -2.383 -4.163
627 HB2 ARG 92 1HB ARG 92 6.546 -3.798 -6.680
628 HB3 ARG 92 2HB ARG 92 7.611 -2.814 -5.685
629 HG2 ARG 92 1HG ARG 92 6.893 -4.369 -3.763
630 HG3 ARG 92 2HG ARG 92 6.336 -5.442 -5.048
631 HD2 ARG 92 1HD ARG 92 9.096 -4.304 -5.150
632 HD3 ARG 92 2HD ARG 92 8.755 -5.678 -4.099
633 HE ARG 92 HE ARG 92 7.866 -5.999 -6.825
634 HH11 ARG 92 1HH1 ARG 92 10.471 -6.443 -4.559
635 HH12 ARG 92 2HH1 ARG 92 11.231 -7.699 -5.479
636 HH21 ARG 92 1HH2 ARG 92 8.857 -7.651 -8.046
637 HH22 ARG 92 2HH2 ARG 92 10.313 -8.384 -7.463
638 H VAL 93 H VAL 93 5.814 -0.253 -4.349
639 HA VAL 93 HA VAL 93 5.512 0.959 -7.018
640 HB VAL 93 HB VAL 93 3.490 1.316 -5.623
641 HG11 VAL 93 1HG1 VAL 93 3.585 1.956 -3.494
642 HG12 VAL 93 2HG1 VAL 93 5.333 1.730 -3.580
643 HG13 VAL 93 3HG1 VAL 93 4.633 3.320 -3.885
644 HG21 VAL 93 3HG2 VAL 93 4.025 4.025 -5.661
645 HG22 VAL 93 1HG2 VAL 93 5.133 3.365 -6.864
646 HG23 VAL 93 2HG2 VAL 93 3.401 3.068 -7.005
647 H THR 94 H THR 94 6.923 2.550 -7.556
648 HA THR 94 HA THR 94 9.112 3.042 -5.671
649 HB THR 94 HB THR 94 8.965 3.567 -8.647
650 HG1 THR 94 1HG THR 94 10.426 1.779 -8.714
651 HG21 THR 94 3HG2 THR 94 11.230 4.209 -8.574
652 HG22 THR 94 1HG2 THR 94 11.431 3.623 -6.924
653 HG23 THR 94 2HG2 THR 94 10.473 5.072 -7.236
654 H THR 95 H THR 95 9.018 4.842 -4.514
655 HA THR 95 HA THR 95 7.252 6.977 -5.017
656 HB THR 95 HB THR 95 8.725 8.214 -3.320
657 HG1 THR 95 1HG THR 95 10.594 7.278 -3.001
658 HG21 THR 95 3HG2 THR 95 8.064 5.900 -1.790
659 HG22 THR 95 1HG2 THR 95 6.830 6.126 -3.029
660 HG23 THR 95 2HG2 THR 95 7.197 7.432 -1.902
661 H LYS 96 H LYS 96 7.659 9.120 -5.667
662 HA LYS 96 HA LYS 96 9.454 9.373 -7.855
663 HB2 LYS 96 1HB LYS 96 7.993 11.584 -6.402
664 HB3 LYS 96 2HB LYS 96 8.640 11.644 -8.036
665 HG2 LYS 96 1HG LYS 96 7.030 9.621 -8.429
666 HG3 LYS 96 2HG LYS 96 6.206 10.269 -7.008
667 HD2 LYS 96 1HD LYS 96 5.636 12.238 -8.075
668 HD3 LYS 96 2HD LYS 96 6.944 12.100 -9.252
669 HE2 LYS 96 1HE LYS 96 5.794 10.419 -10.464
670 HE3 LYS 96 2HE LYS 96 4.609 10.204 -9.177
671 HZ1 LYS 96 3HZ LYS 96 4.752 12.886 -10.236
672 HZ2 LYS 96 1HZ LYS 96 3.401 11.925 -9.898
673 HZ3 LYS 96 2HZ LYS 96 4.236 11.727 -11.356
674 H LYS 97 H LYS 97 10.880 11.436 -7.972
675 HA LYS 97 HA LYS 97 12.853 11.181 -5.876
676 HB2 LYS 97 1HB LYS 97 12.739 12.459 -8.566
677 HB3 LYS 97 2HB LYS 97 13.925 13.065 -7.417
678 HG2 LYS 97 1HG LYS 97 15.058 11.026 -7.329
679 HG3 LYS 97 2HG LYS 97 13.703 10.141 -8.032
680 HD2 LYS 97 1HD LYS 97 15.097 12.296 -9.580
681 HD3 LYS 97 2HD LYS 97 15.758 10.660 -9.512
682 HE2 LYS 97 1HE LYS 97 12.903 11.185 -10.281
683 HE3 LYS 97 2HE LYS 97 14.207 11.247 -11.465
684 HZ1 LYS 97 3HZ LYS 97 12.956 8.971 -10.243
685 HZ2 LYS 97 1HZ LYS 97 14.646 8.904 -10.177
686 HZ3 LYS 97 2HZ LYS 97 13.864 9.069 -11.667
687 H ALA 98 H ALA 98 13.244 12.577 -4.263
688 HA ALA 98 HA ALA 98 11.380 14.738 -3.829
689 HB1 ALA 98 3HB ALA 98 13.059 13.101 -2.206
690 HB2 ALA 98 1HB ALA 98 13.414 14.797 -1.873
691 HB3 ALA 98 2HB ALA 98 11.764 14.192 -1.714
692 HA PRO 99 HA PRO 99 13.817 18.056 -5.366
693 HB2 PRO 99 1HB PRO 99 12.967 20.067 -3.752
694 HB3 PRO 99 2HB PRO 99 11.970 19.384 -5.042
695 HG2 PRO 99 1HG PRO 99 11.916 18.817 -2.103
696 HG3 PRO 99 2HG PRO 99 10.561 19.054 -3.222
697 HD2 PRO 99 1HD PRO 99 11.372 16.600 -2.417
698 HD3 PRO 99 2HD PRO 99 10.682 16.897 -4.025
699 H SER 100 H SER 100 15.638 19.319 -4.920
700 HA SER 100 HA SER 100 17.246 18.399 -2.732
701 HB2 SER 100 1HB SER 100 19.027 19.599 -3.729
702 HB3 SER 100 2HB SER 100 18.056 19.022 -5.084
703 HG SER 100 HG SER 100 16.996 21.168 -4.919
704 HA PRO 101 HA PRO 101 16.232 21.474 0.249
705 HB2 PRO 101 1HB PRO 101 18.492 21.374 1.750
706 HB3 PRO 101 2HB PRO 101 17.260 20.107 1.784
707 HG2 PRO 101 1HG PRO 101 19.861 20.182 0.303
708 HG3 PRO 101 2HG PRO 101 19.125 18.844 1.205
709 HD2 PRO 101 1HD PRO 101 19.011 19.017 -1.495
710 HD3 PRO 101 2HD PRO 101 17.714 18.285 -0.529
711 H SER 102 H SER 102 16.290 23.235 -1.308
712 HA SER 102 HA SER 102 18.114 25.267 -0.585
713 HB2 SER 102 1HB SER 102 19.388 23.653 -2.260
714 HB3 SER 102 2HB SER 102 18.489 24.572 -3.467
715 HG SER 102 HG SER 102 19.464 26.341 -1.807
716 H SER 103 H SER 103 17.602 27.298 -1.528
717 HA SER 103 HA SER 103 15.134 27.323 -3.133
718 HB2 SER 103 1HB SER 103 15.771 28.874 -0.633
719 HB3 SER 103 2HB SER 103 14.586 29.466 -1.796
720 HG SER 103 HG SER 103 13.225 27.998 -1.144
721 H GLY 104 H GLY 104 15.477 28.292 -5.013
722 HA2 GLY 104 1HA GLY 104 17.803 29.918 -5.465
723 HA3 GLY 104 2HA GLY 104 16.555 29.531 -6.640
724 HA PRO 105 HA PRO 105 16.102 34.012 -5.817
725 HB2 PRO 105 1HB PRO 105 15.323 34.609 -8.349
726 HB3 PRO 105 2HB PRO 105 17.020 34.468 -7.874
727 HG2 PRO 105 1HG PRO 105 15.264 32.469 -9.246
728 HG3 PRO 105 2HG PRO 105 16.948 32.903 -9.593
729 HD2 PRO 105 1HD PRO 105 16.273 30.682 -8.199
730 HD3 PRO 105 2HD PRO 105 17.770 31.585 -7.890
731 H SER 106 H SER 106 14.244 35.213 -5.507
732 HA SER 106 HA SER 106 11.695 34.275 -6.504
733 HB2 SER 106 1HB SER 106 11.787 32.861 -4.588
734 HB3 SER 106 2HB SER 106 12.401 34.163 -3.569
735 HG SER 106 HG SER 106 10.431 34.831 -3.260
736 H SER 107 H SER 107 9.973 35.781 -6.143
737 HA SER 107 HA SER 107 10.960 38.513 -5.877
738 HB2 SER 107 1HB SER 107 8.319 37.407 -6.855
739 HB3 SER 107 2HB SER 107 8.694 39.128 -6.759
740 HG SER 107 HG SER 107 10.112 38.931 -8.375
741 H GLY 108 H GLY 108 8.108 36.689 -4.732
742 HA2 GLY 108 1HA GLY 108 7.283 38.540 -2.813
743 HA3 GLY 108 2HA GLY 108 6.919 36.821 -2.774
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -21.092 -31.453 -7.730
2 HA2 GLY 1 1HA GLY 1 -19.389 -33.470 -6.433
3 HA3 GLY 1 2HA GLY 1 -18.866 -32.331 -7.665
4 H SER 2 H SER 2 -17.153 -32.297 -5.811
5 HA SER 2 HA SER 2 -17.786 -29.951 -4.160
6 HB2 SER 2 1HB SER 2 -17.858 -32.111 -2.824
7 HB3 SER 2 2HB SER 2 -16.129 -32.262 -3.138
8 HG SER 2 HG SER 2 -17.220 -29.912 -2.018
9 H SER 3 H SER 3 -16.446 -28.360 -4.654
10 HA SER 3 HA SER 3 -13.751 -29.036 -5.633
11 HB2 SER 3 1HB SER 3 -13.801 -26.789 -6.726
12 HB3 SER 3 2HB SER 3 -15.045 -27.885 -7.326
13 HG SER 3 HG SER 3 -15.358 -25.753 -5.484
14 H GLY 4 H GLY 4 -12.898 -29.168 -3.500
15 HA2 GLY 4 1HA GLY 4 -12.586 -26.526 -2.212
16 HA3 GLY 4 2HA GLY 4 -12.752 -28.013 -1.291
17 H SER 5 H SER 5 -10.597 -25.860 -2.760
18 HA SER 5 HA SER 5 -8.367 -27.707 -2.225
19 HB2 SER 5 1HB SER 5 -8.809 -25.901 -4.586
20 HB3 SER 5 2HB SER 5 -7.175 -26.343 -4.092
21 HG SER 5 HG SER 5 -9.238 -28.213 -4.639
22 H SER 6 H SER 6 -6.463 -26.781 -1.407
23 HA SER 6 HA SER 6 -6.852 -24.112 -0.228
24 HB2 SER 6 1HB SER 6 -5.389 -24.787 1.567
25 HB3 SER 6 2HB SER 6 -6.608 -26.044 1.355
26 HG SER 6 HG SER 6 -4.625 -26.693 -0.223
27 H GLY 7 H GLY 7 -5.774 -22.564 -1.249
28 HA2 GLY 7 1HA GLY 7 -2.982 -22.579 -1.572
29 HA3 GLY 7 2HA GLY 7 -3.719 -22.986 -3.114
30 H LEU 8 H LEU 8 -3.086 -20.494 -0.811
31 HA LEU 8 HA LEU 8 -4.732 -18.442 -1.369
32 HB2 LEU 8 1HB LEU 8 -1.783 -18.538 -0.941
33 HB3 LEU 8 2HB LEU 8 -2.537 -17.001 -1.359
34 HG LEU 8 HG LEU 8 -3.260 -18.689 1.036
35 HD11 LEU 8 1HD1 LEU 8 -1.461 -16.305 0.715
36 HD12 LEU 8 2HD1 LEU 8 -1.102 -17.863 1.459
37 HD13 LEU 8 3HD1 LEU 8 -2.196 -16.735 2.260
38 HD21 LEU 8 3HD2 LEU 8 -5.061 -17.406 1.199
39 HD22 LEU 8 1HD2 LEU 8 -4.615 -16.566 -0.287
40 HD23 LEU 8 2HD2 LEU 8 -4.033 -15.973 1.269
41 H ALA 9 H ALA 9 -4.923 -16.796 -2.907
42 HA ALA 9 HA ALA 9 -3.330 -16.843 -5.311
43 HB1 ALA 9 3HB ALA 9 -4.856 -17.617 -6.831
44 HB2 ALA 9 1HB ALA 9 -5.268 -18.619 -5.439
45 HB3 ALA 9 2HB ALA 9 -6.240 -17.198 -5.822
46 HA PRO 10 HA PRO 10 -4.365 -12.567 -5.176
47 HB2 PRO 10 1HB PRO 10 -3.762 -11.890 -7.735
48 HB3 PRO 10 2HB PRO 10 -2.529 -12.234 -6.517
49 HG2 PRO 10 1HG PRO 10 -3.613 -14.011 -8.668
50 HG3 PRO 10 2HG PRO 10 -1.934 -13.785 -8.144
51 HD2 PRO 10 1HD PRO 10 -3.430 -15.903 -7.366
52 HD3 PRO 10 2HD PRO 10 -2.179 -15.186 -6.331
53 HA PRO 11 HA PRO 11 -8.586 -12.720 -6.674
54 HB2 PRO 11 1HB PRO 11 -9.351 -10.387 -5.514
55 HB3 PRO 11 2HB PRO 11 -9.195 -11.901 -4.615
56 HG2 PRO 11 1HG PRO 11 -7.279 -9.610 -4.813
57 HG3 PRO 11 2HG PRO 11 -7.755 -10.550 -3.387
58 HD2 PRO 11 1HD PRO 11 -5.433 -10.986 -4.712
59 HD3 PRO 11 2HD PRO 11 -6.329 -12.287 -3.901
60 H ARG 12 H ARG 12 -6.789 -9.634 -6.683
61 HA ARG 12 HA ARG 12 -7.355 -9.301 -9.509
62 HB2 ARG 12 1HB ARG 12 -8.604 -7.656 -7.369
63 HB3 ARG 12 2HB ARG 12 -8.036 -6.815 -8.806
64 HG2 ARG 12 1HG ARG 12 -9.607 -7.763 -10.155
65 HG3 ARG 12 2HG ARG 12 -9.712 -9.234 -9.185
66 HD2 ARG 12 1HD ARG 12 -10.781 -7.774 -7.391
67 HD3 ARG 12 2HD ARG 12 -10.941 -6.545 -8.645
68 HE ARG 12 HE ARG 12 -12.448 -9.004 -8.407
69 HH11 ARG 12 1HH1 ARG 12 -11.493 -6.354 -10.453
70 HH12 ARG 12 2HH1 ARG 12 -12.830 -6.541 -11.539
71 HH21 ARG 12 1HH2 ARG 12 -14.212 -9.260 -9.830
72 HH22 ARG 12 2HH2 ARG 12 -14.376 -8.193 -11.183
73 H HIS 13 H HIS 13 -6.491 -6.862 -10.037
74 HA HIS 13 HA HIS 13 -3.727 -6.895 -9.059
75 HB2 HIS 13 1HB HIS 13 -5.016 -5.785 -11.544
76 HB3 HIS 13 2HB HIS 13 -3.392 -5.310 -11.058
77 HD1 HIS 13 1HD HIS 13 -2.542 -6.432 -13.284
78 HD2 HIS 13 2HD HIS 13 -4.231 -9.039 -10.525
79 HE1 HIS 13 1HE HIS 13 -1.854 -8.735 -14.026
80 HE2 HIS 13 2HE HIS 13 -2.958 -10.300 -12.390
81 H LEU 14 H LEU 14 -2.661 -4.914 -8.518
82 HA LEU 14 HA LEU 14 -4.456 -3.038 -7.191
83 HB2 LEU 14 1HB LEU 14 -1.564 -3.722 -6.972
84 HB3 LEU 14 2HB LEU 14 -2.109 -2.138 -6.423
85 HG LEU 14 HG LEU 14 -3.298 -4.710 -5.406
86 HD11 LEU 14 1HD1 LEU 14 -0.685 -4.055 -5.038
87 HD12 LEU 14 2HD1 LEU 14 -1.658 -4.993 -3.906
88 HD13 LEU 14 3HD1 LEU 14 -1.445 -3.260 -3.660
89 HD21 LEU 14 3HD2 LEU 14 -4.730 -2.904 -4.951
90 HD22 LEU 14 1HD2 LEU 14 -3.389 -1.829 -4.558
91 HD23 LEU 14 2HD2 LEU 14 -3.813 -3.146 -3.464
92 H GLY 15 H GLY 15 -3.383 -0.686 -7.138
93 HA2 GLY 15 1HA GLY 15 -2.373 0.118 -9.743
94 HA3 GLY 15 2HA GLY 15 -3.991 0.684 -9.353
95 H PHE 16 H PHE 16 -0.956 1.702 -9.482
96 HA PHE 16 HA PHE 16 -1.183 3.388 -7.078
97 HB2 PHE 16 1HB PHE 16 1.301 2.641 -8.636
98 HB3 PHE 16 2HB PHE 16 1.259 3.680 -7.216
99 HD1 PHE 16 1HD PHE 16 0.453 2.683 -5.030
100 HD2 PHE 16 2HD PHE 16 1.473 0.326 -8.424
101 HE1 PHE 16 1HE PHE 16 0.711 0.712 -3.580
102 HE2 PHE 16 2HE PHE 16 1.731 -1.649 -6.980
103 HZ PHE 16 HZ PHE 16 1.349 -1.458 -4.554
104 H SER 17 H SER 17 -1.728 5.424 -7.443
105 HA SER 17 HA SER 17 -0.766 6.749 -9.878
106 HB2 SER 17 1HB SER 17 -3.064 6.057 -10.350
107 HB3 SER 17 2HB SER 17 -3.621 6.837 -8.870
108 HG SER 17 HG SER 17 -2.618 8.803 -9.879
109 H ASP 18 H ASP 18 -0.725 9.072 -9.741
110 HA ASP 18 HA ASP 18 -0.206 11.032 -8.710
111 HB2 ASP 18 1HB ASP 18 -2.632 10.478 -7.819
112 HB3 ASP 18 2HB ASP 18 -1.784 10.276 -6.288
113 H VAL 19 H VAL 19 1.410 8.631 -8.230
114 HA VAL 19 HA VAL 19 2.278 8.463 -5.565
115 HB VAL 19 HB VAL 19 3.839 7.912 -8.093
116 HG11 VAL 19 1HG1 VAL 19 4.396 7.326 -5.204
117 HG12 VAL 19 2HG1 VAL 19 5.096 6.351 -6.497
118 HG13 VAL 19 3HG1 VAL 19 5.447 8.077 -6.403
119 HG21 VAL 19 3HG2 VAL 19 1.623 6.580 -6.922
120 HG22 VAL 19 1HG2 VAL 19 2.578 6.101 -8.325
121 HG23 VAL 19 2HG2 VAL 19 3.046 5.560 -6.713
122 H SER 20 H SER 20 3.567 9.701 -4.353
123 HA SER 20 HA SER 20 4.905 11.976 -5.658
124 HB2 SER 20 1HB SER 20 3.035 12.231 -3.804
125 HB3 SER 20 2HB SER 20 4.387 11.927 -2.713
126 HG SER 20 HG SER 20 4.239 13.968 -4.682
127 H HIS 21 H HIS 21 6.727 12.811 -4.001
128 HA HIS 21 HA HIS 21 8.673 10.672 -3.962
129 HB2 HIS 21 1HB HIS 21 10.229 12.517 -3.216
130 HB3 HIS 21 2HB HIS 21 9.466 12.768 -4.783
131 HD1 HIS 21 1HD HIS 21 8.173 14.887 -5.085
132 HD2 HIS 21 2HD HIS 21 9.035 14.110 -1.096
133 HE1 HIS 21 1HE HIS 21 7.455 16.944 -3.829
134 HE2 HIS 21 2HE HIS 21 8.065 16.484 -1.429
135 H ASP 22 H ASP 22 6.479 12.044 -1.780
136 HA ASP 22 HA ASP 22 7.831 10.690 0.452
137 HB2 ASP 22 1HB ASP 22 7.406 12.465 1.957
138 HB3 ASP 22 2HB ASP 22 8.071 13.228 0.516
139 H ALA 23 H ALA 23 5.490 10.184 -1.447
140 HA ALA 23 HA ALA 23 3.826 8.869 0.430
141 HB1 ALA 23 3HB ALA 23 3.139 11.594 -0.169
142 HB2 ALA 23 1HB ALA 23 1.870 10.503 -0.726
143 HB3 ALA 23 2HB ALA 23 2.383 10.471 0.961
144 H ALA 24 H ALA 24 1.958 7.798 -0.631
145 HA ALA 24 HA ALA 24 1.939 7.730 -3.522
146 HB1 ALA 24 3HB ALA 24 3.196 5.932 -3.848
147 HB2 ALA 24 1HB ALA 24 3.602 5.933 -2.132
148 HB3 ALA 24 2HB ALA 24 2.219 5.004 -2.710
149 H ARG 25 H ARG 25 -0.059 7.322 -4.236
150 HA ARG 25 HA ARG 25 -2.064 6.464 -2.290
151 HB2 ARG 25 1HB ARG 25 -2.343 8.553 -3.705
152 HB3 ARG 25 2HB ARG 25 -2.549 7.486 -5.087
153 HG2 ARG 25 1HG ARG 25 -4.498 6.476 -4.031
154 HG3 ARG 25 2HG ARG 25 -4.283 7.520 -2.625
155 HD2 ARG 25 1HD ARG 25 -5.861 8.704 -3.795
156 HD3 ARG 25 2HD ARG 25 -4.380 9.428 -4.420
157 HE ARG 25 HE ARG 25 -4.832 8.513 -6.475
158 HH11 ARG 25 1HH1 ARG 25 -6.883 7.045 -4.075
159 HH12 ARG 25 2HH1 ARG 25 -7.864 6.211 -5.234
160 HH21 ARG 25 1HH2 ARG 25 -6.116 7.421 -8.011
161 HH22 ARG 25 2HH2 ARG 25 -7.426 6.425 -7.473
162 H VAL 26 H VAL 26 -2.491 4.365 -2.195
163 HA VAL 26 HA VAL 26 -2.258 2.749 -4.640
164 HB VAL 26 HB VAL 26 -0.884 1.929 -2.826
165 HG11 VAL 26 1HG1 VAL 26 -1.984 2.854 -0.918
166 HG12 VAL 26 2HG1 VAL 26 -3.445 1.916 -1.237
167 HG13 VAL 26 3HG1 VAL 26 -1.965 1.101 -0.729
168 HG21 VAL 26 3HG2 VAL 26 -1.708 -0.355 -2.681
169 HG22 VAL 26 1HG2 VAL 26 -3.314 0.176 -3.178
170 HG23 VAL 26 2HG2 VAL 26 -1.962 0.287 -4.304
171 H PHE 27 H PHE 27 -3.999 1.841 -5.542
172 HA PHE 27 HA PHE 27 -6.477 1.657 -3.980
173 HB2 PHE 27 1HB PHE 27 -7.789 2.541 -5.822
174 HB3 PHE 27 2HB PHE 27 -6.558 3.713 -5.365
175 HD1 PHE 27 1HD PHE 27 -4.515 3.953 -6.780
176 HD2 PHE 27 2HD PHE 27 -7.876 1.639 -7.992
177 HE1 PHE 27 1HE PHE 27 -3.726 4.033 -9.109
178 HE2 PHE 27 2HE PHE 27 -7.091 1.715 -10.323
179 HZ PHE 27 HZ PHE 27 -5.013 2.912 -10.884
180 H TRP 28 H TRP 28 -8.037 0.141 -4.845
181 HA TRP 28 HA TRP 28 -6.833 -1.878 -6.621
182 HB2 TRP 28 1HB TRP 28 -8.279 -3.520 -5.203
183 HB3 TRP 28 2HB TRP 28 -6.728 -2.972 -4.572
184 HD1 TRP 28 HD TRP 28 -10.378 -3.052 -3.757
185 HE1 TRP 28 1HE TRP 28 -10.805 -1.826 -1.535
186 HE3 TRP 28 3HE TRP 28 -5.812 -0.830 -3.164
187 HZ2 TRP 28 2HZ TRP 28 -9.395 -0.139 0.234
188 HZ3 TRP 28 3HZ TRP 28 -5.433 0.575 -1.180
189 HH2 TRP 28 HH TRP 28 -7.188 0.912 0.483
190 H GLU 29 H GLU 29 -8.561 -3.418 -7.486
191 HA GLU 29 HA GLU 29 -10.719 -1.780 -8.559
192 HB2 GLU 29 1HB GLU 29 -9.633 -4.493 -9.309
193 HB3 GLU 29 2HB GLU 29 -11.073 -3.807 -10.047
194 HG2 GLU 29 1HG GLU 29 -8.589 -2.180 -10.032
195 HG3 GLU 29 2HG GLU 29 -8.696 -3.546 -11.142
196 H GLY 30 H GLY 30 -10.564 -3.120 -5.783
197 HA2 GLY 30 1HA GLY 30 -12.212 -3.805 -4.317
198 HA3 GLY 30 2HA GLY 30 -13.355 -3.768 -5.651
199 H ALA 31 H ALA 31 -12.981 -5.760 -3.513
200 HA ALA 31 HA ALA 31 -11.989 -8.101 -4.936
201 HB1 ALA 31 3HB ALA 31 -13.099 -8.896 -2.487
202 HB2 ALA 31 1HB ALA 31 -11.392 -8.697 -2.884
203 HB3 ALA 31 2HB ALA 31 -12.297 -7.355 -2.182
204 HA PRO 32 HA PRO 32 -15.885 -9.639 -6.246
205 HB2 PRO 32 1HB PRO 32 -15.552 -12.315 -5.930
206 HB3 PRO 32 2HB PRO 32 -14.747 -11.390 -7.203
207 HG2 PRO 32 1HG PRO 32 -13.675 -12.309 -4.563
208 HG3 PRO 32 2HG PRO 32 -12.897 -12.334 -6.157
209 HD2 PRO 32 1HD PRO 32 -12.364 -10.432 -4.305
210 HD3 PRO 32 2HD PRO 32 -12.319 -10.105 -6.049
211 H ARG 33 H ARG 33 -15.000 -9.640 -3.064
212 HA ARG 33 HA ARG 33 -17.668 -10.529 -2.238
213 HB2 ARG 33 1HB ARG 33 -16.733 -11.695 -0.291
214 HB3 ARG 33 2HB ARG 33 -16.172 -12.408 -1.798
215 HG2 ARG 33 1HG ARG 33 -14.105 -10.912 -1.494
216 HG3 ARG 33 2HG ARG 33 -14.657 -10.745 0.174
217 HD2 ARG 33 1HD ARG 33 -13.835 -13.243 -1.281
218 HD3 ARG 33 2HD ARG 33 -13.124 -12.541 0.171
219 HE ARG 33 HE ARG 33 -15.884 -13.343 0.442
220 HH11 ARG 33 1HH1 ARG 33 -12.547 -14.289 0.743
221 HH12 ARG 33 2HH1 ARG 33 -12.874 -15.564 1.870
222 HH21 ARG 33 1HH2 ARG 33 -16.328 -15.019 1.925
223 HH22 ARG 33 2HH2 ARG 33 -15.025 -15.979 2.541
224 HA PRO 34 HA PRO 34 -17.718 -6.849 0.156
225 HB2 PRO 34 1HB PRO 34 -19.347 -7.590 2.197
226 HB3 PRO 34 2HB PRO 34 -19.937 -7.291 0.558
227 HG2 PRO 34 1HG PRO 34 -19.311 -9.892 1.900
228 HG3 PRO 34 2HG PRO 34 -20.689 -9.469 0.868
229 HD2 PRO 34 1HD PRO 34 -18.552 -10.856 -0.051
230 HD3 PRO 34 2HD PRO 34 -19.478 -9.740 -1.075
231 H VAL 35 H VAL 35 -16.698 -5.877 1.866
232 HA VAL 35 HA VAL 35 -15.373 -7.641 3.818
233 HB VAL 35 HB VAL 35 -14.178 -5.197 2.503
234 HG11 VAL 35 1HG1 VAL 35 -12.125 -6.304 3.810
235 HG12 VAL 35 2HG1 VAL 35 -13.158 -5.064 4.524
236 HG13 VAL 35 3HG1 VAL 35 -13.433 -6.766 4.898
237 HG21 VAL 35 3HG2 VAL 35 -12.933 -6.561 1.178
238 HG22 VAL 35 1HG2 VAL 35 -12.896 -7.864 2.367
239 HG23 VAL 35 2HG2 VAL 35 -14.335 -7.612 1.379
240 H ARG 36 H ARG 36 -15.048 -6.790 5.900
241 HA ARG 36 HA ARG 36 -16.909 -4.637 6.580
242 HB2 ARG 36 1HB ARG 36 -16.621 -5.443 8.911
243 HB3 ARG 36 2HB ARG 36 -17.221 -6.684 7.820
244 HG2 ARG 36 1HG ARG 36 -15.151 -7.799 7.781
245 HG3 ARG 36 2HG ARG 36 -14.311 -6.426 8.506
246 HD2 ARG 36 1HD ARG 36 -16.510 -7.868 9.953
247 HD3 ARG 36 2HD ARG 36 -14.845 -8.448 9.996
248 HE ARG 36 HE ARG 36 -14.697 -5.799 10.685
249 HH11 ARG 36 1HH1 ARG 36 -16.364 -8.605 11.899
250 HH12 ARG 36 2HH1 ARG 36 -16.371 -8.052 13.541
251 HH21 ARG 36 1HH2 ARG 36 -14.700 -5.060 12.843
252 HH22 ARG 36 2HH2 ARG 36 -15.425 -6.035 14.076
253 H LEU 37 H LEU 37 -13.517 -5.491 6.713
254 HA LEU 37 HA LEU 37 -12.840 -2.718 7.225
255 HB2 LEU 37 1HB LEU 37 -13.041 -3.665 9.468
256 HB3 LEU 37 2HB LEU 37 -11.900 -4.937 9.038
257 HG LEU 37 HG LEU 37 -10.190 -3.111 8.681
258 HD11 LEU 37 1HD1 LEU 37 -10.567 -0.942 9.332
259 HD12 LEU 37 2HD1 LEU 37 -11.911 -1.376 10.388
260 HD13 LEU 37 3HD1 LEU 37 -12.133 -1.364 8.639
261 HD21 LEU 37 3HD2 LEU 37 -9.967 -2.726 11.214
262 HD22 LEU 37 1HD2 LEU 37 -9.911 -4.383 10.611
263 HD23 LEU 37 2HD2 LEU 37 -11.387 -3.764 11.350
264 H VAL 38 H VAL 38 -10.577 -2.252 6.840
265 HA VAL 38 HA VAL 38 -9.162 -4.347 5.334
266 HB VAL 38 HB VAL 38 -9.445 -1.461 4.485
267 HG11 VAL 38 1HG1 VAL 38 -7.305 -2.002 3.802
268 HG12 VAL 38 2HG1 VAL 38 -7.708 -3.699 3.530
269 HG13 VAL 38 3HG1 VAL 38 -8.264 -2.466 2.398
270 HG21 VAL 38 3HG2 VAL 38 -11.132 -2.084 3.171
271 HG22 VAL 38 1HG2 VAL 38 -10.227 -3.469 2.560
272 HG23 VAL 38 2HG2 VAL 38 -11.157 -3.612 4.051
273 H ARG 39 H ARG 39 -6.959 -4.388 5.554
274 HA ARG 39 HA ARG 39 -5.732 -2.312 7.238
275 HB2 ARG 39 1HB ARG 39 -6.322 -4.656 8.320
276 HB3 ARG 39 2HB ARG 39 -4.834 -5.144 7.520
277 HG2 ARG 39 1HG ARG 39 -3.670 -3.281 8.690
278 HG3 ARG 39 2HG ARG 39 -5.161 -2.981 9.585
279 HD2 ARG 39 1HD ARG 39 -3.770 -4.335 10.961
280 HD3 ARG 39 2HD ARG 39 -5.069 -5.362 10.356
281 HE ARG 39 HE ARG 39 -3.077 -5.750 8.563
282 HH11 ARG 39 1HH1 ARG 39 -3.258 -5.941 12.035
283 HH12 ARG 39 2HH1 ARG 39 -2.042 -7.168 12.161
284 HH21 ARG 39 1HH2 ARG 39 -1.474 -7.366 8.717
285 HH22 ARG 39 2HH2 ARG 39 -1.027 -7.977 10.273
286 H VAL 40 H VAL 40 -4.145 -1.369 6.154
287 HA VAL 40 HA VAL 40 -2.707 -2.914 4.105
288 HB VAL 40 HB VAL 40 -2.765 0.089 4.399
289 HG11 VAL 40 1HG1 VAL 40 -1.930 0.088 2.117
290 HG12 VAL 40 2HG1 VAL 40 -0.856 -0.843 3.163
291 HG13 VAL 40 3HG1 VAL 40 -1.974 -1.674 2.082
292 HG21 VAL 40 3HG2 VAL 40 -4.422 0.138 2.635
293 HG22 VAL 40 1HG2 VAL 40 -4.422 -1.624 2.550
294 HG23 VAL 40 2HG2 VAL 40 -5.028 -0.810 3.993
295 H THR 41 H THR 41 -0.513 -3.096 4.140
296 HA THR 41 HA THR 41 0.943 -1.746 6.309
297 HB THR 41 HB THR 41 2.290 -3.892 6.561
298 HG1 THR 41 1HG THR 41 0.214 -4.740 4.874
299 HG21 THR 41 3HG2 THR 41 -0.522 -4.420 7.399
300 HG22 THR 41 1HG2 THR 41 0.285 -2.979 8.013
301 HG23 THR 41 2HG2 THR 41 0.975 -4.573 8.318
302 H TYR 42 H TYR 42 2.437 -0.518 5.381
303 HA TYR 42 HA TYR 42 3.714 -1.461 2.905
304 HB2 TYR 42 1HB TYR 42 4.409 0.970 2.682
305 HB3 TYR 42 2HB TYR 42 2.686 0.646 2.528
306 HD1 TYR 42 2HD TYR 42 1.245 0.981 4.645
307 HD2 TYR 42 1HD TYR 42 5.166 2.571 4.197
308 HE1 TYR 42 2HE TYR 42 0.774 2.625 6.413
309 HE2 TYR 42 1HE TYR 42 4.706 4.218 5.964
310 HH TYR 42 HH TYR 42 2.945 4.209 8.075
311 H VAL 43 H VAL 43 5.947 -1.450 2.689
312 HA VAL 43 HA VAL 43 7.576 -0.716 4.994
313 HB VAL 43 HB VAL 43 6.944 -3.118 5.294
314 HG11 VAL 43 1HG1 VAL 43 7.907 -4.794 3.832
315 HG12 VAL 43 2HG1 VAL 43 6.872 -3.707 2.903
316 HG13 VAL 43 3HG1 VAL 43 8.626 -3.538 2.825
317 HG21 VAL 43 3HG2 VAL 43 9.745 -3.535 4.935
318 HG22 VAL 43 1HG2 VAL 43 9.475 -1.882 5.488
319 HG23 VAL 43 2HG2 VAL 43 8.851 -3.239 6.426
320 H SER 44 H SER 44 9.697 -0.223 4.495
321 HA SER 44 HA SER 44 10.241 0.702 1.913
322 HB2 SER 44 1HB SER 44 12.606 0.916 2.733
323 HB3 SER 44 2HB SER 44 11.406 1.648 3.798
324 HG SER 44 HG SER 44 13.112 0.219 4.748
325 H SER 45 H SER 45 12.426 0.010 0.807
326 HA SER 45 HA SER 45 11.996 -2.652 -0.156
327 HB2 SER 45 1HB SER 45 12.909 -0.513 -1.398
328 HB3 SER 45 2HB SER 45 14.468 -1.100 -0.819
329 HG SER 45 HG SER 45 12.683 -2.268 -2.639
330 H GLU 46 H GLU 46 14.989 -1.156 1.079
331 HA GLU 46 HA GLU 46 16.372 -3.507 1.555
332 HB2 GLU 46 1HB GLU 46 16.608 -0.984 3.200
333 HB3 GLU 46 2HB GLU 46 17.840 -2.217 2.974
334 HG2 GLU 46 1HG GLU 46 18.584 -0.673 1.493
335 HG3 GLU 46 2HG GLU 46 17.509 -1.586 0.435
336 H GLY 47 H GLY 47 14.351 -1.644 3.814
337 HA2 GLY 47 1HA GLY 47 12.867 -2.984 5.265
338 HA3 GLY 47 2HA GLY 47 14.234 -4.059 5.515
339 H GLY 48 H GLY 48 12.732 -1.065 6.409
340 HA2 GLY 48 1HA GLY 48 14.148 -1.014 8.895
341 HA3 GLY 48 2HA GLY 48 14.692 0.256 7.809
342 H HIS 49 H HIS 49 12.301 0.944 6.582
343 HA HIS 49 HA HIS 49 10.795 2.056 8.856
344 HB2 HIS 49 1HB HIS 49 11.840 3.846 7.688
345 HB3 HIS 49 2HB HIS 49 11.382 3.185 6.121
346 HD1 HIS 49 1HD HIS 49 9.560 4.476 5.088
347 HD2 HIS 49 2HD HIS 49 9.250 4.438 9.231
348 HE1 HIS 49 1HE HIS 49 7.519 5.845 5.622
349 HE2 HIS 49 2HE HIS 49 7.401 5.879 8.138
350 H SER 50 H SER 50 8.908 1.079 9.136
351 HA SER 50 HA SER 50 7.271 0.480 6.771
352 HB2 SER 50 1HB SER 50 6.540 -1.636 7.805
353 HB3 SER 50 2HB SER 50 8.278 -1.630 7.509
354 HG SER 50 HG SER 50 8.099 -2.335 9.557
355 H GLY 51 H GLY 51 4.947 0.108 7.361
356 HA2 GLY 51 1HA GLY 51 4.076 1.271 9.876
357 HA3 GLY 51 2HA GLY 51 3.710 2.223 8.445
358 H GLN 52 H GLN 52 1.472 1.899 9.166
359 HA GLN 52 HA GLN 52 0.196 -0.117 7.647
360 HB2 GLN 52 1HB GLN 52 0.832 -1.631 9.392
361 HB3 GLN 52 2HB GLN 52 0.294 -0.512 10.638
362 HG2 GLN 52 1HG GLN 52 -1.701 -1.463 8.657
363 HG3 GLN 52 2HG GLN 52 -1.156 -2.585 9.903
364 HE21 GLN 52 1HE2 GLN 52 -1.348 -1.866 12.139
365 HE22 GLN 52 2HE2 GLN 52 -2.668 -0.839 12.574
366 H THR 53 H THR 53 -2.029 0.207 7.477
367 HA THR 53 HA THR 53 -3.225 2.324 9.104
368 HB THR 53 HB THR 53 -2.402 3.532 7.178
369 HG1 THR 53 1HG THR 53 -4.616 3.907 7.996
370 HG21 THR 53 3HG2 THR 53 -2.247 1.569 5.658
371 HG22 THR 53 1HG2 THR 53 -3.005 2.974 4.910
372 HG23 THR 53 2HG2 THR 53 -3.999 1.626 5.465
373 H GLU 54 H GLU 54 -5.540 2.367 9.038
374 HA GLU 54 HA GLU 54 -6.714 -0.164 8.087
375 HB2 GLU 54 1HB GLU 54 -7.067 1.359 10.628
376 HB3 GLU 54 2HB GLU 54 -8.446 0.476 9.988
377 HG2 GLU 54 1HG GLU 54 -7.159 -1.586 10.015
378 HG3 GLU 54 2HG GLU 54 -5.753 -0.711 10.616
379 H ALA 55 H ALA 55 -8.581 -0.097 6.933
380 HA ALA 55 HA ALA 55 -9.962 2.470 6.633
381 HB1 ALA 55 3HB ALA 55 -9.338 2.800 4.528
382 HB2 ALA 55 1HB ALA 55 -8.198 1.466 4.704
383 HB3 ALA 55 2HB ALA 55 -9.819 1.164 4.079
384 HA PRO 56 HA PRO 56 -13.666 0.120 6.675
385 HB2 PRO 56 1HB PRO 56 -15.233 1.466 4.914
386 HB3 PRO 56 2HB PRO 56 -14.814 2.103 6.508
387 HG2 PRO 56 1HG PRO 56 -13.607 2.729 3.841
388 HG3 PRO 56 2HG PRO 56 -14.033 3.832 5.163
389 HD2 PRO 56 1HD PRO 56 -11.495 2.997 4.724
390 HD3 PRO 56 2HD PRO 56 -12.115 3.354 6.349
391 H GLY 57 H GLY 57 -14.761 -1.527 5.632
392 HA2 GLY 57 1HA GLY 57 -13.480 -2.854 3.530
393 HA3 GLY 57 2HA GLY 57 -15.114 -3.185 4.086
394 H ASN 58 H ASN 58 -15.457 -0.120 3.383
395 HA ASN 58 HA ASN 58 -16.328 -0.681 0.645
396 HB2 ASN 58 1HB ASN 58 -17.035 1.556 2.554
397 HB3 ASN 58 2HB ASN 58 -17.638 1.438 0.904
398 HD21 ASN 58 1HD2 ASN 58 -18.171 -1.215 0.667
399 HD22 ASN 58 2HD2 ASN 58 -19.426 -1.667 1.765
400 H ALA 59 H ALA 59 -13.592 0.322 1.936
401 HA ALA 59 HA ALA 59 -13.149 2.692 0.310
402 HB1 ALA 59 3HB ALA 59 -11.465 1.233 2.326
403 HB2 ALA 59 1HB ALA 59 -10.832 2.550 1.338
404 HB3 ALA 59 2HB ALA 59 -12.173 2.843 2.446
405 H THR 60 H THR 60 -12.300 2.658 -1.663
406 HA THR 60 HA THR 60 -11.046 0.163 -2.599
407 HB THR 60 HB THR 60 -11.620 0.891 -4.882
408 HG1 THR 60 1HG THR 60 -12.431 3.173 -3.491
409 HG21 THR 60 3HG2 THR 60 -13.196 -0.557 -3.811
410 HG22 THR 60 1HG2 THR 60 -14.111 0.691 -4.656
411 HG23 THR 60 2HG2 THR 60 -13.899 0.785 -2.908
412 H SER 61 H SER 61 -9.993 2.800 -1.281
413 HA SER 61 HA SER 61 -7.487 2.784 -2.642
414 HB2 SER 61 1HB SER 61 -7.546 5.240 -3.241
415 HB3 SER 61 2HB SER 61 -8.555 4.203 -4.249
416 HG SER 61 HG SER 61 -10.353 4.935 -3.205
417 H ALA 62 H ALA 62 -5.862 3.923 -1.515
418 HA ALA 62 HA ALA 62 -6.532 5.451 0.839
419 HB1 ALA 62 3HB ALA 62 -4.897 2.998 1.349
420 HB2 ALA 62 1HB ALA 62 -5.770 4.018 2.493
421 HB3 ALA 62 2HB ALA 62 -6.658 2.934 1.422
422 H MET 63 H MET 63 -4.783 6.618 1.671
423 HA MET 63 HA MET 63 -2.505 6.789 -0.151
424 HB2 MET 63 1HB MET 63 -3.579 8.636 1.976
425 HB3 MET 63 2HB MET 63 -2.029 8.904 1.190
426 HG2 MET 63 1HG MET 63 -3.514 8.651 -0.988
427 HG3 MET 63 2HG MET 63 -4.776 9.183 0.121
428 HE1 MET 63 3HE MET 63 -1.542 10.893 -2.008
429 HE2 MET 63 1HE MET 63 -0.822 11.278 -0.444
430 HE3 MET 63 2HE MET 63 -1.240 9.610 -0.834
431 H LEU 64 H LEU 64 -0.335 7.139 0.773
432 HA LEU 64 HA LEU 64 0.066 5.924 3.407
433 HB2 LEU 64 1HB LEU 64 1.726 5.106 1.041
434 HB3 LEU 64 2HB LEU 64 1.678 4.377 2.645
435 HG LEU 64 HG LEU 64 -0.738 4.316 0.875
436 HD11 LEU 64 1HD1 LEU 64 -0.038 2.394 -0.237
437 HD12 LEU 64 2HD1 LEU 64 1.309 2.128 0.869
438 HD13 LEU 64 3HD1 LEU 64 1.375 3.449 -0.298
439 HD21 LEU 64 3HD2 LEU 64 -1.445 3.430 2.820
440 HD22 LEU 64 1HD2 LEU 64 0.189 3.052 3.365
441 HD23 LEU 64 2HD2 LEU 64 -0.631 1.981 2.229
442 H GLY 65 H GLY 65 2.094 6.423 4.386
443 HA2 GLY 65 1HA GLY 65 4.315 7.594 3.746
444 HA3 GLY 65 2HA GLY 65 3.237 8.921 3.338
445 HA PRO 66 HA PRO 66 4.753 10.376 3.877
446 HB2 PRO 66 1HB PRO 66 6.979 11.210 5.188
447 HB3 PRO 66 2HB PRO 66 5.435 12.065 5.277
448 HG2 PRO 66 1HG PRO 66 6.649 10.140 7.222
449 HG3 PRO 66 2HG PRO 66 5.811 11.671 7.538
450 HD2 PRO 66 1HD PRO 66 4.603 9.264 7.819
451 HD3 PRO 66 2HD PRO 66 3.723 10.720 7.311
452 H LEU 67 H LEU 67 5.859 9.290 2.384
453 HA LEU 67 HA LEU 67 7.609 7.098 3.219
454 HB2 LEU 67 1HB LEU 67 6.706 7.763 0.428
455 HB3 LEU 67 2HB LEU 67 7.408 6.252 1.002
456 HG LEU 67 HG LEU 67 4.681 7.313 1.742
457 HD11 LEU 67 1HD1 LEU 67 4.684 6.625 -0.552
458 HD12 LEU 67 2HD1 LEU 67 3.889 5.374 0.403
459 HD13 LEU 67 3HD1 LEU 67 5.545 5.137 -0.155
460 HD21 LEU 67 3HD2 LEU 67 5.956 5.882 3.431
461 HD22 LEU 67 1HD2 LEU 67 5.769 4.565 2.272
462 HD23 LEU 67 2HD2 LEU 67 4.343 5.341 2.961
463 H SER 68 H SER 68 9.381 6.791 1.289
464 HA SER 68 HA SER 68 11.010 9.221 1.475
465 HB2 SER 68 1HB SER 68 11.838 6.923 2.276
466 HB3 SER 68 2HB SER 68 11.982 6.515 0.567
467 HG SER 68 HG SER 68 13.655 7.937 2.097
468 H SER 69 H SER 69 12.688 9.228 -0.497
469 HA SER 69 HA SER 69 11.016 9.312 -2.916
470 HB2 SER 69 1HB SER 69 12.862 10.904 -3.728
471 HB3 SER 69 2HB SER 69 11.784 11.501 -2.467
472 HG SER 69 HG SER 69 13.435 11.667 -1.189
473 H SER 70 H SER 70 11.906 8.648 -4.923
474 HA SER 70 HA SER 70 12.868 7.018 -6.208
475 HB2 SER 70 1HB SER 70 14.627 8.739 -6.197
476 HB3 SER 70 2HB SER 70 15.330 8.014 -4.752
477 HG SER 70 HG SER 70 15.640 7.313 -7.343
478 H THR 71 H THR 71 11.860 6.137 -3.619
479 HA THR 71 HA THR 71 13.596 3.785 -3.232
480 HB THR 71 HB THR 71 11.968 5.257 -1.154
481 HG1 THR 71 1HG THR 71 14.209 5.929 -1.803
482 HG21 THR 71 3HG2 THR 71 12.472 2.501 -1.284
483 HG22 THR 71 1HG2 THR 71 11.894 3.419 0.106
484 HG23 THR 71 2HG2 THR 71 13.623 3.144 -0.113
485 H THR 72 H THR 72 12.664 1.834 -3.424
486 HA THR 72 HA THR 72 9.921 1.701 -4.310
487 HB THR 72 HB THR 72 11.899 -0.544 -3.865
488 HG1 THR 72 1HG THR 72 12.739 0.129 -5.677
489 HG21 THR 72 3HG2 THR 72 9.126 -0.415 -4.934
490 HG22 THR 72 1HG2 THR 72 9.916 -1.681 -3.995
491 HG23 THR 72 2HG2 THR 72 10.264 -1.511 -5.716
492 H TYR 73 H TYR 73 8.228 1.391 -3.034
493 HA TYR 73 HA TYR 73 8.672 0.241 -0.361
494 HB2 TYR 73 1HB TYR 73 6.731 2.279 -1.399
495 HB3 TYR 73 2HB TYR 73 6.344 1.350 0.045
496 HD1 TYR 73 1HD TYR 73 8.898 3.626 -1.408
497 HD2 TYR 73 2HD TYR 73 7.213 1.973 2.132
498 HE1 TYR 73 1HE TYR 73 10.224 5.193 -0.053
499 HE2 TYR 73 2HE TYR 73 8.534 3.536 3.497
500 HH TYR 73 HH TYR 73 10.770 4.838 3.157
501 H THR 74 H THR 74 7.636 -1.570 0.234
502 HA THR 74 HA THR 74 6.017 -2.924 -1.780
503 HB THR 74 HB THR 74 7.051 -3.990 0.855
504 HG1 THR 74 1HG THR 74 8.880 -3.949 -0.224
505 HG21 THR 74 3HG2 THR 74 5.468 -5.143 -1.375
506 HG22 THR 74 1HG2 THR 74 5.427 -5.509 0.349
507 HG23 THR 74 2HG2 THR 74 6.719 -6.159 -0.660
508 H VAL 75 H VAL 75 3.989 -2.051 -1.683
509 HA VAL 75 HA VAL 75 2.648 -1.689 0.858
510 HB VAL 75 HB VAL 75 1.624 -1.336 -1.963
511 HG11 VAL 75 1HG1 VAL 75 0.166 0.158 -0.026
512 HG12 VAL 75 2HG1 VAL 75 -0.415 -1.101 -1.117
513 HG13 VAL 75 3HG1 VAL 75 0.205 -1.531 0.477
514 HG21 VAL 75 3HG2 VAL 75 3.329 0.269 -1.547
515 HG22 VAL 75 1HG2 VAL 75 1.786 1.100 -1.351
516 HG23 VAL 75 2HG2 VAL 75 2.708 0.606 0.069
517 H ARG 76 H ARG 76 1.021 -2.920 1.686
518 HA ARG 76 HA ARG 76 0.148 -5.265 0.147
519 HB2 ARG 76 1HB ARG 76 2.002 -5.662 1.960
520 HB3 ARG 76 2HB ARG 76 0.659 -5.520 3.086
521 HG2 ARG 76 1HG ARG 76 -0.423 -7.411 2.197
522 HG3 ARG 76 2HG ARG 76 0.613 -7.426 0.769
523 HD2 ARG 76 1HD ARG 76 1.614 -9.082 1.976
524 HD3 ARG 76 2HD ARG 76 2.509 -7.693 2.591
525 HE ARG 76 HE ARG 76 0.165 -8.280 4.128
526 HH11 ARG 76 1HH1 ARG 76 3.510 -9.106 3.628
527 HH12 ARG 76 2HH1 ARG 76 3.738 -9.704 5.238
528 HH21 ARG 76 1HH2 ARG 76 0.453 -9.064 6.250
529 HH22 ARG 76 2HH2 ARG 76 1.999 -9.680 6.728
530 H VAL 77 H VAL 77 -1.983 -5.209 -0.035
531 HA VAL 77 HA VAL 77 -3.560 -3.827 2.020
532 HB VAL 77 HB VAL 77 -4.339 -4.646 -0.783
533 HG11 VAL 77 1HG1 VAL 77 -6.081 -4.426 1.211
534 HG12 VAL 77 2HG1 VAL 77 -5.933 -2.715 0.807
535 HG13 VAL 77 3HG1 VAL 77 -6.447 -3.871 -0.422
536 HG21 VAL 77 3HG2 VAL 77 -3.243 -2.155 0.402
537 HG22 VAL 77 1HG2 VAL 77 -2.991 -2.857 -1.197
538 HG23 VAL 77 2HG2 VAL 77 -4.487 -1.994 -0.838
539 H THR 78 H THR 78 -4.185 -5.192 3.574
540 HA THR 78 HA THR 78 -5.111 -7.877 2.815
541 HB THR 78 HB THR 78 -4.409 -6.855 5.574
542 HG1 THR 78 1HG THR 78 -2.474 -7.989 5.273
543 HG21 THR 78 3HG2 THR 78 -4.281 -9.712 5.162
544 HG22 THR 78 1HG2 THR 78 -5.889 -9.091 4.794
545 HG23 THR 78 2HG2 THR 78 -5.169 -8.794 6.377
546 H CYS 79 H CYS 79 -7.233 -7.784 2.360
547 HA CYS 79 HA CYS 79 -9.015 -6.069 3.862
548 HB2 CYS 79 1HB CYS 79 -9.406 -7.953 1.542
549 HB3 CYS 79 2HB CYS 79 -10.761 -7.170 2.346
550 HG CYS 79 HG CYS 79 -8.288 -5.711 0.506
551 H LEU 80 H LEU 80 -9.748 -6.682 5.780
552 HA LEU 80 HA LEU 80 -9.854 -9.481 6.514
553 HB2 LEU 80 1HB LEU 80 -10.240 -6.890 7.949
554 HB3 LEU 80 2HB LEU 80 -10.827 -8.385 8.674
555 HG LEU 80 HG LEU 80 -8.692 -7.899 9.613
556 HD11 LEU 80 1HD1 LEU 80 -7.619 -9.891 7.811
557 HD12 LEU 80 2HD1 LEU 80 -9.276 -10.261 8.287
558 HD13 LEU 80 3HD1 LEU 80 -8.037 -10.021 9.519
559 HD21 LEU 80 3HD2 LEU 80 -7.159 -8.072 7.114
560 HD22 LEU 80 1HD2 LEU 80 -6.931 -7.032 8.520
561 HD23 LEU 80 2HD2 LEU 80 -8.129 -6.610 7.296
562 H TYR 81 H TYR 81 -11.528 -10.621 5.773
563 HA TYR 81 HA TYR 81 -14.091 -9.443 5.252
564 HB2 TYR 81 1HB TYR 81 -13.358 -12.376 5.315
565 HB3 TYR 81 2HB TYR 81 -14.759 -11.654 4.533
566 HD1 TYR 81 2HD TYR 81 -14.246 -9.906 2.666
567 HD2 TYR 81 1HD TYR 81 -11.434 -12.770 4.078
568 HE1 TYR 81 2HE TYR 81 -12.962 -9.664 0.582
569 HE2 TYR 81 1HE TYR 81 -10.142 -12.536 1.998
570 HH TYR 81 HH TYR 81 -9.818 -10.900 0.207
571 HA PRO 82 HA PRO 82 -16.016 -10.024 9.160
572 HB2 PRO 82 1HB PRO 82 -18.599 -10.300 8.373
573 HB3 PRO 82 2HB PRO 82 -17.744 -8.753 8.339
574 HG2 PRO 82 1HG PRO 82 -18.270 -10.676 6.105
575 HG3 PRO 82 2HG PRO 82 -18.393 -8.907 6.111
576 HD2 PRO 82 1HD PRO 82 -16.262 -10.216 5.074
577 HD3 PRO 82 2HD PRO 82 -16.121 -8.623 5.844
578 H GLY 83 H GLY 83 -16.523 -12.373 6.602
579 HA2 GLY 83 1HA GLY 83 -17.805 -14.332 8.239
580 HA3 GLY 83 2HA GLY 83 -17.103 -14.602 6.650
581 H GLY 84 H GLY 84 -14.953 -15.270 6.471
582 HA2 GLY 84 1HA GLY 84 -13.344 -15.609 8.851
583 HA3 GLY 84 2HA GLY 84 -13.962 -17.110 8.178
584 H GLY 85 H GLY 85 -11.450 -14.897 8.108
585 HA2 GLY 85 1HA GLY 85 -9.454 -15.757 6.906
586 HA3 GLY 85 2HA GLY 85 -10.512 -15.974 5.520
587 H SER 86 H SER 86 -8.552 -14.640 4.712
588 HA SER 86 HA SER 86 -9.484 -12.050 4.099
589 HB2 SER 86 1HB SER 86 -7.720 -10.717 5.219
590 HB3 SER 86 2HB SER 86 -8.794 -11.504 6.376
591 HG SER 86 HG SER 86 -7.213 -13.054 6.739
592 H SER 87 H SER 87 -8.303 -11.085 2.449
593 HA SER 87 HA SER 87 -6.337 -12.847 1.195
594 HB2 SER 87 1HB SER 87 -8.239 -12.118 -0.178
595 HB3 SER 87 2HB SER 87 -7.793 -10.433 0.088
596 HG SER 87 HG SER 87 -6.798 -12.220 -1.693
597 H THR 88 H THR 88 -4.759 -11.364 -0.267
598 HA THR 88 HA THR 88 -3.702 -9.116 1.232
599 HB THR 88 HB THR 88 -1.916 -11.495 0.707
600 HG1 THR 88 1HG THR 88 -2.155 -12.008 2.841
601 HG21 THR 88 3HG2 THR 88 -1.263 -9.350 2.651
602 HG22 THR 88 1HG2 THR 88 -1.148 -8.950 0.938
603 HG23 THR 88 2HG2 THR 88 -0.201 -10.284 1.597
604 H LEU 89 H LEU 89 -3.678 -7.691 -0.400
605 HA LEU 89 HA LEU 89 -2.725 -8.520 -3.034
606 HB2 LEU 89 1HB LEU 89 -4.339 -6.266 -1.977
607 HB3 LEU 89 2HB LEU 89 -3.376 -5.969 -3.423
608 HG LEU 89 HG LEU 89 -5.393 -8.196 -3.199
609 HD11 LEU 89 1HD1 LEU 89 -5.708 -5.330 -3.952
610 HD12 LEU 89 2HD1 LEU 89 -6.795 -6.386 -3.050
611 HD13 LEU 89 3HD1 LEU 89 -6.651 -6.556 -4.800
612 HD21 LEU 89 3HD2 LEU 89 -4.922 -7.220 -5.835
613 HD22 LEU 89 1HD2 LEU 89 -4.621 -8.829 -5.179
614 HD23 LEU 89 2HD2 LEU 89 -3.372 -7.588 -5.078
615 H THR 90 H THR 90 -0.593 -8.437 -3.301
616 HA THR 90 HA THR 90 1.005 -6.469 -1.876
617 HB THR 90 HB THR 90 2.949 -7.647 -2.833
618 HG1 THR 90 1HG THR 90 2.356 -9.708 -3.940
619 HG21 THR 90 3HG2 THR 90 2.735 -8.870 -0.981
620 HG22 THR 90 1HG2 THR 90 1.836 -10.053 -1.931
621 HG23 THR 90 2HG2 THR 90 0.976 -8.780 -1.064
622 H GLY 91 H GLY 91 2.274 -4.891 -2.844
623 HA2 GLY 91 1HA GLY 91 2.380 -4.577 -5.698
624 HA3 GLY 91 2HA GLY 91 1.279 -3.440 -4.935
625 H ARG 92 H ARG 92 4.324 -3.763 -6.063
626 HA ARG 92 HA ARG 92 5.584 -2.098 -4.017
627 HB2 ARG 92 1HB ARG 92 6.566 -3.816 -6.238
628 HB3 ARG 92 2HB ARG 92 7.551 -2.428 -5.793
629 HG2 ARG 92 1HG ARG 92 7.675 -3.234 -3.499
630 HG3 ARG 92 2HG ARG 92 6.659 -4.614 -3.923
631 HD2 ARG 92 1HD ARG 92 8.531 -4.956 -5.764
632 HD3 ARG 92 2HD ARG 92 9.501 -4.059 -4.597
633 HE ARG 92 HE ARG 92 8.062 -6.227 -3.406
634 HH11 ARG 92 1HH1 ARG 92 10.930 -5.371 -5.184
635 HH12 ARG 92 2HH1 ARG 92 11.848 -6.724 -4.608
636 HH21 ARG 92 1HH2 ARG 92 9.259 -8.011 -2.642
637 HH22 ARG 92 2HH2 ARG 92 10.896 -8.225 -3.163
638 H VAL 93 H VAL 93 5.810 0.030 -4.238
639 HA VAL 93 HA VAL 93 5.503 1.203 -6.924
640 HB VAL 93 HB VAL 93 3.476 1.660 -5.693
641 HG11 VAL 93 1HG1 VAL 93 4.134 3.347 -3.615
642 HG12 VAL 93 2HG1 VAL 93 3.618 1.666 -3.464
643 HG13 VAL 93 3HG1 VAL 93 5.336 2.063 -3.493
644 HG21 VAL 93 3HG2 VAL 93 5.375 3.866 -6.264
645 HG22 VAL 93 1HG2 VAL 93 3.812 3.497 -6.993
646 HG23 VAL 93 2HG2 VAL 93 3.886 4.272 -5.411
647 H THR 94 H THR 94 7.023 2.623 -7.531
648 HA THR 94 HA THR 94 9.158 3.224 -5.625
649 HB THR 94 HB THR 94 9.089 3.629 -8.622
650 HG1 THR 94 1HG THR 94 10.694 1.807 -8.374
651 HG21 THR 94 3HG2 THR 94 10.653 5.038 -7.056
652 HG22 THR 94 1HG2 THR 94 11.288 4.319 -8.535
653 HG23 THR 94 2HG2 THR 94 11.582 3.541 -6.980
654 H THR 95 H THR 95 8.779 5.016 -4.476
655 HA THR 95 HA THR 95 7.145 7.149 -5.138
656 HB THR 95 HB THR 95 8.559 8.479 -3.493
657 HG1 THR 95 1HG THR 95 10.531 7.495 -3.600
658 HG21 THR 95 3HG2 THR 95 7.753 5.815 -2.366
659 HG22 THR 95 1HG2 THR 95 6.551 6.951 -2.978
660 HG23 THR 95 2HG2 THR 95 7.603 7.415 -1.641
661 H LYS 96 H LYS 96 7.728 9.389 -5.636
662 HA LYS 96 HA LYS 96 9.467 9.500 -7.925
663 HB2 LYS 96 1HB LYS 96 8.054 11.807 -6.588
664 HB3 LYS 96 2HB LYS 96 8.635 11.723 -8.246
665 HG2 LYS 96 1HG LYS 96 6.972 9.698 -8.389
666 HG3 LYS 96 2HG LYS 96 6.213 10.510 -7.019
667 HD2 LYS 96 1HD LYS 96 5.594 12.330 -8.266
668 HD3 LYS 96 2HD LYS 96 6.929 12.139 -9.405
669 HE2 LYS 96 1HE LYS 96 5.827 10.489 -10.612
670 HE3 LYS 96 2HE LYS 96 4.743 10.099 -9.277
671 HZ1 LYS 96 3HZ LYS 96 3.922 12.514 -9.657
672 HZ2 LYS 96 1HZ LYS 96 3.376 11.275 -10.671
673 HZ3 LYS 96 2HZ LYS 96 4.598 12.320 -11.196
674 H LYS 97 H LYS 97 11.027 11.350 -8.162
675 HA LYS 97 HA LYS 97 12.938 11.228 -6.030
676 HB2 LYS 97 1HB LYS 97 12.845 12.403 -8.765
677 HB3 LYS 97 2HB LYS 97 14.025 13.057 -7.637
678 HG2 LYS 97 1HG LYS 97 15.139 11.379 -8.848
679 HG3 LYS 97 2HG LYS 97 14.799 10.685 -7.261
680 HD2 LYS 97 1HD LYS 97 14.158 8.965 -8.654
681 HD3 LYS 97 2HD LYS 97 12.628 9.816 -8.432
682 HE2 LYS 97 1HE LYS 97 13.199 11.093 -10.548
683 HE3 LYS 97 2HE LYS 97 14.492 9.919 -10.792
684 HZ1 LYS 97 3HZ LYS 97 11.587 9.332 -10.617
685 HZ2 LYS 97 1HZ LYS 97 12.799 8.157 -10.732
686 HZ3 LYS 97 2HZ LYS 97 12.552 9.244 -12.004
687 H ALA 98 H ALA 98 13.348 12.676 -4.467
688 HA ALA 98 HA ALA 98 11.496 14.839 -4.061
689 HB1 ALA 98 3HB ALA 98 13.211 15.212 -2.071
690 HB2 ALA 98 1HB ALA 98 11.995 13.935 -2.035
691 HB3 ALA 98 2HB ALA 98 13.658 13.558 -2.486
692 HA PRO 99 HA PRO 99 13.821 18.078 -5.927
693 HB2 PRO 99 1HB PRO 99 12.830 20.185 -4.532
694 HB3 PRO 99 2HB PRO 99 11.905 19.337 -5.777
695 HG2 PRO 99 1HG PRO 99 11.788 19.043 -2.800
696 HG3 PRO 99 2HG PRO 99 10.458 19.109 -3.970
697 HD2 PRO 99 1HD PRO 99 11.358 16.782 -2.918
698 HD3 PRO 99 2HD PRO 99 10.704 16.895 -4.564
699 H SER 100 H SER 100 15.942 18.225 -5.527
700 HA SER 100 HA SER 100 16.861 18.752 -2.795
701 HB2 SER 100 1HB SER 100 18.473 17.975 -5.238
702 HB3 SER 100 2HB SER 100 19.065 18.061 -3.579
703 HG SER 100 HG SER 100 18.399 15.920 -4.441
704 HA PRO 101 HA PRO 101 17.871 22.948 -3.612
705 HB2 PRO 101 1HB PRO 101 19.966 23.280 -1.917
706 HB3 PRO 101 2HB PRO 101 18.293 23.142 -1.362
707 HG2 PRO 101 1HG PRO 101 20.437 21.055 -1.451
708 HG3 PRO 101 2HG PRO 101 19.261 21.397 -0.169
709 HD2 PRO 101 1HD PRO 101 18.944 19.367 -1.932
710 HD3 PRO 101 2HD PRO 101 17.571 20.255 -1.240
711 H SER 102 H SER 102 20.324 20.476 -3.920
712 HA SER 102 HA SER 102 22.563 21.656 -4.772
713 HB2 SER 102 1HB SER 102 21.121 19.337 -6.061
714 HB3 SER 102 2HB SER 102 22.747 19.828 -6.535
715 HG SER 102 HG SER 102 22.148 19.354 -3.829
716 H SER 103 H SER 103 23.389 22.673 -6.577
717 HA SER 103 HA SER 103 21.373 23.816 -8.382
718 HB2 SER 103 1HB SER 103 22.941 25.279 -6.936
719 HB3 SER 103 2HB SER 103 24.194 24.828 -8.092
720 HG SER 103 HG SER 103 23.101 25.854 -9.691
721 H GLY 104 H GLY 104 21.351 23.304 -10.477
722 HA2 GLY 104 1HA GLY 104 23.621 22.767 -12.050
723 HA3 GLY 104 2HA GLY 104 22.929 21.238 -11.530
724 HA PRO 105 HA PRO 105 20.854 22.560 -15.474
725 HB2 PRO 105 1HB PRO 105 21.147 20.164 -16.717
726 HB3 PRO 105 2HB PRO 105 22.381 21.429 -16.766
727 HG2 PRO 105 1HG PRO 105 22.237 18.991 -15.036
728 HG3 PRO 105 2HG PRO 105 23.632 19.677 -15.888
729 HD2 PRO 105 1HD PRO 105 23.210 20.058 -13.240
730 HD3 PRO 105 2HD PRO 105 23.995 21.275 -14.267
731 H SER 106 H SER 106 18.874 22.647 -14.346
732 HA SER 106 HA SER 106 17.482 20.585 -13.170
733 HB2 SER 106 1HB SER 106 16.930 23.153 -13.461
734 HB3 SER 106 2HB SER 106 15.953 22.567 -14.808
735 HG SER 106 HG SER 106 14.642 21.556 -13.445
736 H SER 107 H SER 107 15.697 19.287 -13.896
737 HA SER 107 HA SER 107 16.249 17.868 -16.268
738 HB2 SER 107 1HB SER 107 13.779 17.877 -14.519
739 HB3 SER 107 2HB SER 107 14.079 16.716 -15.812
740 HG SER 107 HG SER 107 14.936 16.636 -13.301
741 H GLY 108 H GLY 108 14.744 17.531 -18.080
742 HA2 GLY 108 1HA GLY 108 14.193 19.878 -19.463
743 HA3 GLY 108 2HA GLY 108 13.507 18.308 -19.851
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -11.201 -30.752 4.831
2 HA2 GLY 1 1HA GLY 1 -9.358 -31.474 3.419
3 HA3 GLY 1 2HA GLY 1 -10.548 -32.047 2.260
4 H SER 2 H SER 2 -8.447 -29.571 3.014
5 HA SER 2 HA SER 2 -9.796 -27.775 1.108
6 HB2 SER 2 1HB SER 2 -8.352 -27.080 3.665
7 HB3 SER 2 2HB SER 2 -8.641 -25.891 2.394
8 HG SER 2 HG SER 2 -10.797 -27.423 3.307
9 H SER 3 H SER 3 -7.992 -29.721 0.309
10 HA SER 3 HA SER 3 -5.758 -28.050 -0.606
11 HB2 SER 3 1HB SER 3 -5.096 -29.643 1.285
12 HB3 SER 3 2HB SER 3 -5.370 -30.950 0.133
13 HG SER 3 HG SER 3 -3.774 -28.842 -0.722
14 H GLY 4 H GLY 4 -5.341 -28.198 -2.735
15 HA2 GLY 4 1HA GLY 4 -5.443 -30.309 -4.435
16 HA3 GLY 4 2HA GLY 4 -7.119 -29.785 -4.362
17 H SER 5 H SER 5 -6.910 -27.071 -4.279
18 HA SER 5 HA SER 5 -6.100 -26.500 -6.999
19 HB2 SER 5 1HB SER 5 -7.531 -24.874 -4.893
20 HB3 SER 5 2HB SER 5 -7.098 -24.225 -6.474
21 HG SER 5 HG SER 5 -8.346 -25.930 -7.399
22 H SER 6 H SER 6 -3.856 -27.085 -5.647
23 HA SER 6 HA SER 6 -2.475 -25.223 -4.218
24 HB2 SER 6 1HB SER 6 -1.493 -27.040 -6.422
25 HB3 SER 6 2HB SER 6 -0.405 -26.083 -5.417
26 HG SER 6 HG SER 6 -2.155 -27.400 -3.867
27 H GLY 7 H GLY 7 -1.621 -23.254 -4.533
28 HA2 GLY 7 1HA GLY 7 -0.579 -21.559 -5.838
29 HA3 GLY 7 2HA GLY 7 -1.301 -22.263 -7.277
30 H LEU 8 H LEU 8 -2.670 -21.175 -4.173
31 HA LEU 8 HA LEU 8 -5.089 -20.306 -4.917
32 HB2 LEU 8 1HB LEU 8 -5.097 -18.797 -3.112
33 HB3 LEU 8 2HB LEU 8 -4.017 -20.110 -2.648
34 HG LEU 8 HG LEU 8 -2.838 -17.653 -3.854
35 HD11 LEU 8 1HD1 LEU 8 -3.041 -17.573 -0.944
36 HD12 LEU 8 2HD1 LEU 8 -4.586 -17.373 -1.770
37 HD13 LEU 8 3HD1 LEU 8 -3.245 -16.288 -2.135
38 HD21 LEU 8 3HD2 LEU 8 -1.808 -19.985 -2.885
39 HD22 LEU 8 1HD2 LEU 8 -1.664 -18.916 -1.489
40 HD23 LEU 8 2HD2 LEU 8 -0.922 -18.465 -3.025
41 H ALA 9 H ALA 9 -6.048 -18.402 -5.714
42 HA ALA 9 HA ALA 9 -4.244 -16.744 -7.353
43 HB1 ALA 9 3HB ALA 9 -5.735 -16.750 -9.082
44 HB2 ALA 9 1HB ALA 9 -6.079 -18.335 -8.388
45 HB3 ALA 9 2HB ALA 9 -7.131 -16.966 -8.026
46 HA PRO 10 HA PRO 10 -5.558 -13.220 -5.066
47 HB2 PRO 10 1HB PRO 10 -5.063 -11.291 -6.911
48 HB3 PRO 10 2HB PRO 10 -3.781 -12.122 -6.023
49 HG2 PRO 10 1HG PRO 10 -4.796 -12.621 -8.794
50 HG3 PRO 10 2HG PRO 10 -3.124 -12.578 -8.206
51 HD2 PRO 10 1HD PRO 10 -4.457 -14.895 -8.641
52 HD3 PRO 10 2HD PRO 10 -3.231 -14.723 -7.368
53 HA PRO 11 HA PRO 11 -9.742 -12.403 -6.202
54 HB2 PRO 11 1HB PRO 11 -10.144 -10.130 -4.773
55 HB3 PRO 11 2HB PRO 11 -10.045 -11.729 -4.026
56 HG2 PRO 11 1HG PRO 11 -7.942 -9.611 -4.253
57 HG3 PRO 11 2HG PRO 11 -8.355 -10.633 -2.864
58 HD2 PRO 11 1HD PRO 11 -6.242 -11.150 -4.477
59 HD3 PRO 11 2HD PRO 11 -7.172 -12.436 -3.679
60 H ARG 12 H ARG 12 -7.582 -9.567 -6.224
61 HA ARG 12 HA ARG 12 -8.494 -8.890 -8.896
62 HB2 ARG 12 1HB ARG 12 -9.006 -7.175 -6.483
63 HB3 ARG 12 2HB ARG 12 -8.805 -6.451 -8.073
64 HG2 ARG 12 1HG ARG 12 -10.828 -8.594 -7.477
65 HG3 ARG 12 2HG ARG 12 -11.171 -6.866 -7.367
66 HD2 ARG 12 1HD ARG 12 -10.362 -6.702 -9.765
67 HD3 ARG 12 2HD ARG 12 -10.414 -8.463 -9.801
68 HE ARG 12 HE ARG 12 -12.629 -6.687 -9.990
69 HH11 ARG 12 1HH1 ARG 12 -11.654 -9.805 -8.787
70 HH12 ARG 12 2HH1 ARG 12 -13.245 -10.483 -8.879
71 HH21 ARG 12 1HH2 ARG 12 -14.729 -7.569 -10.116
72 HH22 ARG 12 2HH2 ARG 12 -14.994 -9.211 -9.636
73 H HIS 13 H HIS 13 -7.364 -6.553 -9.371
74 HA HIS 13 HA HIS 13 -4.523 -7.038 -8.812
75 HB2 HIS 13 1HB HIS 13 -5.873 -5.443 -10.998
76 HB3 HIS 13 2HB HIS 13 -4.128 -5.543 -10.777
77 HD1 HIS 13 1HD HIS 13 -6.923 -7.214 -12.399
78 HD2 HIS 13 2HD HIS 13 -3.109 -8.266 -11.129
79 HE1 HIS 13 1HE HIS 13 -6.385 -9.361 -13.592
80 HE2 HIS 13 2HE HIS 13 -4.108 -10.023 -12.743
81 H LEU 14 H LEU 14 -3.194 -4.903 -8.899
82 HA LEU 14 HA LEU 14 -4.479 -3.013 -7.045
83 HB2 LEU 14 1HB LEU 14 -1.686 -4.025 -7.317
84 HB3 LEU 14 2HB LEU 14 -1.960 -2.425 -6.632
85 HG LEU 14 HG LEU 14 -3.118 -4.990 -5.542
86 HD11 LEU 14 1HD1 LEU 14 -0.871 -3.332 -4.417
87 HD12 LEU 14 2HD1 LEU 14 -0.631 -4.799 -5.366
88 HD13 LEU 14 3HD1 LEU 14 -1.476 -4.877 -3.820
89 HD21 LEU 14 3HD2 LEU 14 -3.148 -2.141 -4.563
90 HD22 LEU 14 1HD2 LEU 14 -3.567 -3.529 -3.559
91 HD23 LEU 14 2HD2 LEU 14 -4.530 -3.152 -4.988
92 H GLY 15 H GLY 15 -3.122 -0.810 -7.126
93 HA2 GLY 15 1HA GLY 15 -2.183 0.040 -9.668
94 HA3 GLY 15 2HA GLY 15 -3.863 0.508 -9.453
95 H PHE 16 H PHE 16 -0.856 1.665 -9.256
96 HA PHE 16 HA PHE 16 -1.379 3.336 -6.895
97 HB2 PHE 16 1HB PHE 16 1.206 2.870 -8.398
98 HB3 PHE 16 2HB PHE 16 1.026 3.883 -6.969
99 HD1 PHE 16 1HD PHE 16 0.285 2.790 -4.811
100 HD2 PHE 16 2HD PHE 16 1.592 0.578 -8.204
101 HE1 PHE 16 1HE PHE 16 0.704 0.838 -3.373
102 HE2 PHE 16 2HE PHE 16 2.012 -1.378 -6.771
103 HZ PHE 16 HZ PHE 16 1.567 -1.250 -4.353
104 H SER 17 H SER 17 -2.005 5.365 -7.183
105 HA SER 17 HA SER 17 -1.255 6.748 -9.666
106 HB2 SER 17 1HB SER 17 -3.585 5.961 -9.880
107 HB3 SER 17 2HB SER 17 -4.003 6.813 -8.394
108 HG SER 17 HG SER 17 -2.857 8.605 -9.873
109 H ASP 18 H ASP 18 -1.018 8.993 -9.507
110 HA ASP 18 HA ASP 18 -0.450 10.961 -8.516
111 HB2 ASP 18 1HB ASP 18 -2.556 9.905 -6.677
112 HB3 ASP 18 2HB ASP 18 -1.621 11.309 -6.172
113 H VAL 19 H VAL 19 1.314 8.817 -8.212
114 HA VAL 19 HA VAL 19 2.189 8.558 -5.505
115 HB VAL 19 HB VAL 19 3.720 7.965 -8.042
116 HG11 VAL 19 1HG1 VAL 19 4.592 6.212 -6.150
117 HG12 VAL 19 2HG1 VAL 19 5.402 7.721 -6.575
118 HG13 VAL 19 3HG1 VAL 19 4.314 7.664 -5.187
119 HG21 VAL 19 3HG2 VAL 19 1.544 6.554 -6.658
120 HG22 VAL 19 1HG2 VAL 19 2.087 6.445 -8.333
121 HG23 VAL 19 2HG2 VAL 19 2.939 5.557 -7.070
122 H SER 20 H SER 20 3.569 9.775 -4.370
123 HA SER 20 HA SER 20 4.941 11.969 -5.780
124 HB2 SER 20 1HB SER 20 3.052 12.408 -3.991
125 HB3 SER 20 2HB SER 20 4.359 12.106 -2.847
126 HG SER 20 HG SER 20 4.036 14.354 -3.564
127 H HIS 21 H HIS 21 6.757 12.848 -4.131
128 HA HIS 21 HA HIS 21 8.653 10.679 -3.962
129 HB2 HIS 21 1HB HIS 21 10.199 12.544 -3.173
130 HB3 HIS 21 2HB HIS 21 9.547 12.705 -4.801
131 HD1 HIS 21 1HD HIS 21 8.172 14.756 -5.300
132 HD2 HIS 21 2HD HIS 21 9.002 14.318 -1.252
133 HE1 HIS 21 1HE HIS 21 7.419 16.901 -4.223
134 HE2 HIS 21 2HE HIS 21 8.010 16.646 -1.788
135 H ASP 22 H ASP 22 6.422 12.132 -1.874
136 HA ASP 22 HA ASP 22 7.674 10.791 0.420
137 HB2 ASP 22 1HB ASP 22 7.915 13.394 0.335
138 HB3 ASP 22 2HB ASP 22 6.221 13.384 0.816
139 H ALA 23 H ALA 23 5.395 10.267 -1.500
140 HA ALA 23 HA ALA 23 3.605 9.147 0.399
141 HB1 ALA 23 3HB ALA 23 2.153 11.131 -1.259
142 HB2 ALA 23 1HB ALA 23 1.789 10.514 0.353
143 HB3 ALA 23 2HB ALA 23 3.048 11.730 0.137
144 H ALA 24 H ALA 24 1.748 8.051 -0.672
145 HA ALA 24 HA ALA 24 1.757 7.762 -3.521
146 HB1 ALA 24 3HB ALA 24 3.564 6.351 -3.415
147 HB2 ALA 24 1HB ALA 24 3.133 5.740 -1.818
148 HB3 ALA 24 2HB ALA 24 2.239 5.201 -3.240
149 H ARG 25 H ARG 25 -0.267 7.338 -4.102
150 HA ARG 25 HA ARG 25 -2.142 6.368 -2.093
151 HB2 ARG 25 1HB ARG 25 -2.545 8.402 -3.605
152 HB3 ARG 25 2HB ARG 25 -2.829 7.237 -4.892
153 HG2 ARG 25 1HG ARG 25 -4.718 6.337 -3.786
154 HG3 ARG 25 2HG ARG 25 -4.339 7.203 -2.295
155 HD2 ARG 25 1HD ARG 25 -6.126 8.363 -3.359
156 HD3 ARG 25 2HD ARG 25 -4.672 9.339 -3.556
157 HE ARG 25 HE ARG 25 -4.832 9.051 -5.819
158 HH11 ARG 25 1HH1 ARG 25 -6.826 6.681 -4.228
159 HH12 ARG 25 2HH1 ARG 25 -7.545 6.109 -5.697
160 HH21 ARG 25 1HH2 ARG 25 -5.772 8.307 -7.759
161 HH22 ARG 25 2HH2 ARG 25 -6.945 7.034 -7.705
162 H VAL 26 H VAL 26 -2.530 4.267 -1.948
163 HA VAL 26 HA VAL 26 -2.162 2.574 -4.318
164 HB VAL 26 HB VAL 26 -0.879 1.881 -2.373
165 HG11 VAL 26 1HG1 VAL 26 -2.373 2.870 -0.668
166 HG12 VAL 26 2HG1 VAL 26 -3.517 1.556 -0.949
167 HG13 VAL 26 3HG1 VAL 26 -1.914 1.208 -0.301
168 HG21 VAL 26 3HG2 VAL 26 -3.071 -0.138 -2.493
169 HG22 VAL 26 1HG2 VAL 26 -2.172 0.245 -3.961
170 HG23 VAL 26 2HG2 VAL 26 -1.323 -0.368 -2.543
171 H PHE 27 H PHE 27 -3.887 1.884 -5.382
172 HA PHE 27 HA PHE 27 -6.422 1.572 -3.919
173 HB2 PHE 27 1HB PHE 27 -7.662 2.518 -5.712
174 HB3 PHE 27 2HB PHE 27 -6.329 3.626 -5.408
175 HD1 PHE 27 2HD PHE 27 -7.378 0.823 -7.604
176 HD2 PHE 27 1HD PHE 27 -4.906 4.256 -7.131
177 HE1 PHE 27 2HE PHE 27 -6.717 0.669 -9.969
178 HE2 PHE 27 1HE PHE 27 -4.242 4.107 -9.496
179 HZ PHE 27 HZ PHE 27 -5.146 2.312 -10.918
180 H TRP 28 H TRP 28 -7.942 0.067 -4.934
181 HA TRP 28 HA TRP 28 -6.636 -1.932 -6.650
182 HB2 TRP 28 1HB TRP 28 -8.018 -3.637 -5.244
183 HB3 TRP 28 2HB TRP 28 -6.490 -3.035 -4.607
184 HD1 TRP 28 HD TRP 28 -10.152 -3.221 -3.824
185 HE1 TRP 28 1HE TRP 28 -10.622 -2.045 -1.583
186 HE3 TRP 28 3HE TRP 28 -5.633 -0.927 -3.147
187 HZ2 TRP 28 2HZ TRP 28 -9.259 -0.367 0.231
188 HZ3 TRP 28 3HZ TRP 28 -5.298 0.446 -1.133
189 HH2 TRP 28 HH TRP 28 -7.075 0.720 0.520
190 H GLU 29 H GLU 29 -8.325 -3.542 -7.497
191 HA GLU 29 HA GLU 29 -10.438 -1.990 -8.712
192 HB2 GLU 29 1HB GLU 29 -9.438 -4.805 -9.080
193 HB3 GLU 29 2HB GLU 29 -10.907 -4.240 -9.863
194 HG2 GLU 29 1HG GLU 29 -8.181 -3.009 -10.191
195 HG3 GLU 29 2HG GLU 29 -8.947 -4.117 -11.328
196 H GLY 30 H GLY 30 -10.389 -2.936 -5.777
197 HA2 GLY 30 1HA GLY 30 -12.104 -3.292 -4.266
198 HA3 GLY 30 2HA GLY 30 -13.217 -3.423 -5.620
199 H ALA 31 H ALA 31 -14.170 -5.168 -4.354
200 HA ALA 31 HA ALA 31 -12.892 -7.715 -5.011
201 HB1 ALA 31 3HB ALA 31 -13.532 -6.756 -2.269
202 HB2 ALA 31 1HB ALA 31 -13.769 -8.464 -2.643
203 HB3 ALA 31 2HB ALA 31 -12.177 -7.730 -2.840
204 HA PRO 32 HA PRO 32 -16.948 -8.910 -6.201
205 HB2 PRO 32 1HB PRO 32 -16.820 -11.593 -5.806
206 HB3 PRO 32 2HB PRO 32 -15.986 -10.776 -7.134
207 HG2 PRO 32 1HG PRO 32 -14.905 -11.697 -4.498
208 HG3 PRO 32 2HG PRO 32 -14.184 -11.834 -6.113
209 HD2 PRO 32 1HD PRO 32 -13.439 -9.926 -4.343
210 HD3 PRO 32 2HD PRO 32 -13.426 -9.658 -6.098
211 H ARG 33 H ARG 33 -15.868 -9.132 -3.019
212 HA ARG 33 HA ARG 33 -18.612 -9.568 -2.081
213 HB2 ARG 33 1HB ARG 33 -17.863 -11.011 -0.279
214 HB3 ARG 33 2HB ARG 33 -17.387 -11.696 -1.827
215 HG2 ARG 33 1HG ARG 33 -15.119 -10.721 -1.480
216 HG3 ARG 33 2HG ARG 33 -15.632 -10.249 0.141
217 HD2 ARG 33 1HD ARG 33 -14.561 -12.284 0.489
218 HD3 ARG 33 2HD ARG 33 -16.266 -12.728 0.427
219 HE ARG 33 HE ARG 33 -14.900 -12.902 -2.104
220 HH11 ARG 33 1HH1 ARG 33 -15.751 -14.562 0.835
221 HH12 ARG 33 2HH1 ARG 33 -15.592 -16.142 0.142
222 HH21 ARG 33 1HH2 ARG 33 -14.688 -14.977 -3.028
223 HH22 ARG 33 2HH2 ARG 33 -14.987 -16.377 -2.055
224 HA PRO 34 HA PRO 34 -17.886 -6.060 0.459
225 HB2 PRO 34 1HB PRO 34 -19.515 -6.605 2.561
226 HB3 PRO 34 2HB PRO 34 -20.125 -6.126 0.973
227 HG2 PRO 34 1HG PRO 34 -19.903 -8.860 2.171
228 HG3 PRO 34 2HG PRO 34 -21.235 -8.152 1.239
229 HD2 PRO 34 1HD PRO 34 -19.428 -9.844 0.143
230 HD3 PRO 34 2HD PRO 34 -20.192 -8.534 -0.780
231 H VAL 35 H VAL 35 -16.659 -5.361 2.177
232 HA VAL 35 HA VAL 35 -15.487 -7.452 3.894
233 HB VAL 35 HB VAL 35 -14.043 -4.956 3.009
234 HG11 VAL 35 1HG1 VAL 35 -12.070 -6.094 3.826
235 HG12 VAL 35 2HG1 VAL 35 -13.288 -6.024 5.102
236 HG13 VAL 35 3HG1 VAL 35 -13.022 -7.526 4.215
237 HG21 VAL 35 3HG2 VAL 35 -14.278 -7.625 1.704
238 HG22 VAL 35 1HG2 VAL 35 -14.185 -6.019 0.981
239 HG23 VAL 35 2HG2 VAL 35 -12.734 -6.776 1.637
240 H ARG 36 H ARG 36 -14.862 -6.806 6.020
241 HA ARG 36 HA ARG 36 -16.601 -4.730 7.096
242 HB2 ARG 36 1HB ARG 36 -16.041 -5.681 9.285
243 HB3 ARG 36 2HB ARG 36 -16.615 -6.922 8.179
244 HG2 ARG 36 1HG ARG 36 -14.410 -7.754 7.844
245 HG3 ARG 36 2HG ARG 36 -13.703 -6.385 8.704
246 HD2 ARG 36 1HD ARG 36 -14.682 -7.120 10.777
247 HD3 ARG 36 2HD ARG 36 -15.561 -8.405 9.950
248 HE ARG 36 HE ARG 36 -12.708 -8.554 9.627
249 HH11 ARG 36 1HH1 ARG 36 -15.417 -9.426 11.631
250 HH12 ARG 36 2HH1 ARG 36 -14.615 -10.780 12.354
251 HH21 ARG 36 1HH2 ARG 36 -11.640 -10.335 10.571
252 HH22 ARG 36 2HH2 ARG 36 -12.465 -11.296 11.750
253 H LEU 37 H LEU 37 -13.169 -5.571 6.956
254 HA LEU 37 HA LEU 37 -12.509 -2.772 7.459
255 HB2 LEU 37 1HB LEU 37 -12.393 -3.817 9.645
256 HB3 LEU 37 2HB LEU 37 -11.344 -5.081 9.008
257 HG LEU 37 HG LEU 37 -9.664 -3.250 8.512
258 HD11 LEU 37 1HD1 LEU 37 -11.730 -1.565 9.084
259 HD12 LEU 37 2HD1 LEU 37 -10.025 -1.116 9.074
260 HD13 LEU 37 3HD1 LEU 37 -10.814 -1.546 10.591
261 HD21 LEU 37 3HD2 LEU 37 -8.972 -4.498 10.280
262 HD22 LEU 37 1HD2 LEU 37 -10.472 -4.264 11.177
263 HD23 LEU 37 2HD2 LEU 37 -9.265 -2.979 11.128
264 H VAL 38 H VAL 38 -10.406 -2.165 6.733
265 HA VAL 38 HA VAL 38 -9.042 -4.145 5.041
266 HB VAL 38 HB VAL 38 -9.674 -1.311 4.204
267 HG11 VAL 38 1HG1 VAL 38 -8.173 -3.521 2.805
268 HG12 VAL 38 2HG1 VAL 38 -8.693 -2.020 2.035
269 HG13 VAL 38 3HG1 VAL 38 -7.525 -1.976 3.356
270 HG21 VAL 38 3HG2 VAL 38 -11.456 -2.064 3.074
271 HG22 VAL 38 1HG2 VAL 38 -10.614 -3.516 2.533
272 HG23 VAL 38 2HG2 VAL 38 -11.357 -3.472 4.132
273 H ARG 39 H ARG 39 -7.090 -4.363 5.918
274 HA ARG 39 HA ARG 39 -5.763 -2.016 7.071
275 HB2 ARG 39 1HB ARG 39 -5.612 -4.943 7.533
276 HB3 ARG 39 2HB ARG 39 -4.114 -4.039 7.716
277 HG2 ARG 39 1HG ARG 39 -5.314 -2.525 9.299
278 HG3 ARG 39 2HG ARG 39 -6.690 -3.627 9.211
279 HD2 ARG 39 1HD ARG 39 -3.929 -4.181 10.267
280 HD3 ARG 39 2HD ARG 39 -5.457 -4.231 11.144
281 HE ARG 39 HE ARG 39 -5.846 -6.118 9.298
282 HH11 ARG 39 1HH1 ARG 39 -3.141 -5.491 11.398
283 HH12 ARG 39 2HH1 ARG 39 -2.666 -7.154 11.499
284 HH21 ARG 39 1HH2 ARG 39 -5.231 -8.311 9.422
285 HH22 ARG 39 2HH2 ARG 39 -3.855 -8.757 10.374
286 H VAL 40 H VAL 40 -3.817 -1.267 6.347
287 HA VAL 40 HA VAL 40 -2.635 -2.619 4.013
288 HB VAL 40 HB VAL 40 -3.020 0.362 4.321
289 HG11 VAL 40 1HG1 VAL 40 -1.143 0.395 3.072
290 HG12 VAL 40 2HG1 VAL 40 -1.331 -1.281 2.552
291 HG13 VAL 40 3HG1 VAL 40 -2.253 -0.002 1.761
292 HG21 VAL 40 3HG2 VAL 40 -4.978 0.080 3.312
293 HG22 VAL 40 1HG2 VAL 40 -4.153 -0.650 1.935
294 HG23 VAL 40 2HG2 VAL 40 -4.721 -1.664 3.261
295 H THR 41 H THR 41 -0.541 -3.034 4.240
296 HA THR 41 HA THR 41 1.007 -1.432 6.172
297 HB THR 41 HB THR 41 2.384 -3.475 6.579
298 HG1 THR 41 1HG THR 41 0.530 -4.511 4.756
299 HG21 THR 41 3HG2 THR 41 1.071 -4.070 8.319
300 HG22 THR 41 1HG2 THR 41 -0.330 -4.376 7.293
301 HG23 THR 41 2HG2 THR 41 0.070 -2.726 7.770
302 H TYR 42 H TYR 42 2.638 -0.354 5.294
303 HA TYR 42 HA TYR 42 3.773 -1.341 2.760
304 HB2 TYR 42 1HB TYR 42 4.425 1.089 2.402
305 HB3 TYR 42 2HB TYR 42 2.704 0.730 2.306
306 HD1 TYR 42 2HD TYR 42 1.230 1.298 4.260
307 HD2 TYR 42 1HD TYR 42 5.267 2.617 4.000
308 HE1 TYR 42 2HE TYR 42 0.771 3.018 5.958
309 HE2 TYR 42 1HE TYR 42 4.820 4.340 5.698
310 HH TYR 42 HH TYR 42 2.042 4.350 7.617
311 H VAL 43 H VAL 43 5.979 -1.409 2.511
312 HA VAL 43 HA VAL 43 7.659 -0.535 4.745
313 HB VAL 43 HB VAL 43 7.107 -2.938 5.108
314 HG11 VAL 43 1HG1 VAL 43 6.866 -3.733 2.874
315 HG12 VAL 43 2HG1 VAL 43 8.513 -3.253 2.462
316 HG13 VAL 43 3HG1 VAL 43 8.236 -4.581 3.590
317 HG21 VAL 43 3HG2 VAL 43 9.928 -3.223 4.554
318 HG22 VAL 43 1HG2 VAL 43 9.568 -1.648 5.261
319 HG23 VAL 43 2HG2 VAL 43 9.091 -3.122 6.103
320 H SER 44 H SER 44 9.769 -0.025 4.192
321 HA SER 44 HA SER 44 10.218 0.864 1.566
322 HB2 SER 44 1HB SER 44 12.265 0.352 3.737
323 HB3 SER 44 2HB SER 44 12.498 1.360 2.310
324 HG SER 44 HG SER 44 11.545 2.924 3.323
325 H SER 45 H SER 45 12.431 0.229 0.467
326 HA SER 45 HA SER 45 12.087 -2.402 -0.523
327 HB2 SER 45 1HB SER 45 13.109 -0.353 -1.710
328 HB3 SER 45 2HB SER 45 14.604 -0.785 -0.880
329 HG SER 45 HG SER 45 14.205 -2.955 -1.839
330 H GLU 46 H GLU 46 14.681 -0.944 1.439
331 HA GLU 46 HA GLU 46 15.846 -3.542 1.955
332 HB2 GLU 46 1HB GLU 46 17.492 -2.266 3.298
333 HB3 GLU 46 2HB GLU 46 17.349 -1.674 1.649
334 HG2 GLU 46 1HG GLU 46 15.890 0.137 2.450
335 HG3 GLU 46 2HG GLU 46 16.114 -0.439 4.101
336 H GLY 47 H GLY 47 13.246 -3.493 2.860
337 HA2 GLY 47 1HA GLY 47 11.905 -3.644 4.747
338 HA3 GLY 47 2HA GLY 47 13.260 -4.615 5.304
339 H GLY 48 H GLY 48 13.147 -1.119 4.726
340 HA2 GLY 48 1HA GLY 48 14.147 -0.706 7.441
341 HA3 GLY 48 2HA GLY 48 14.120 0.487 6.151
342 H HIS 49 H HIS 49 12.538 1.965 6.137
343 HA HIS 49 HA HIS 49 10.802 2.219 8.342
344 HB2 HIS 49 1HB HIS 49 11.440 4.223 7.262
345 HB3 HIS 49 2HB HIS 49 10.959 3.620 5.679
346 HD1 HIS 49 1HD HIS 49 9.109 5.112 4.974
347 HD2 HIS 49 2HD HIS 49 8.708 3.901 8.928
348 HE1 HIS 49 1HE HIS 49 6.891 6.020 5.733
349 HE2 HIS 49 2HE HIS 49 6.709 5.348 8.153
350 H SER 50 H SER 50 8.650 1.802 8.611
351 HA SER 50 HA SER 50 7.071 0.775 6.402
352 HB2 SER 50 1HB SER 50 6.444 -1.286 7.677
353 HB3 SER 50 2HB SER 50 8.129 -1.265 7.156
354 HG SER 50 HG SER 50 7.313 -1.686 9.556
355 H GLY 51 H GLY 51 4.788 0.395 7.053
356 HA2 GLY 51 1HA GLY 51 3.943 1.626 9.546
357 HA3 GLY 51 2HA GLY 51 3.511 2.507 8.087
358 H GLN 52 H GLN 52 1.425 1.856 9.490
359 HA GLN 52 HA GLN 52 0.099 -0.143 7.875
360 HB2 GLN 52 1HB GLN 52 0.924 -1.588 9.596
361 HB3 GLN 52 2HB GLN 52 0.428 -0.468 10.857
362 HG2 GLN 52 1HG GLN 52 -1.944 -0.854 10.104
363 HG3 GLN 52 2HG GLN 52 -1.321 -2.168 9.106
364 HE21 GLN 52 1HE2 GLN 52 -1.181 -4.104 9.996
365 HE22 GLN 52 2HE2 GLN 52 -1.252 -4.448 11.688
366 H THR 53 H THR 53 -1.782 0.702 7.307
367 HA THR 53 HA THR 53 -3.108 2.566 9.168
368 HB THR 53 HB THR 53 -2.229 3.590 7.035
369 HG1 THR 53 1HG THR 53 -5.036 3.795 7.029
370 HG21 THR 53 3HG2 THR 53 -4.321 2.955 5.287
371 HG22 THR 53 1HG2 THR 53 -3.746 1.410 5.911
372 HG23 THR 53 2HG2 THR 53 -2.622 2.515 5.120
373 H GLU 54 H GLU 54 -5.476 2.669 8.969
374 HA GLU 54 HA GLU 54 -6.615 0.067 8.179
375 HB2 GLU 54 1HB GLU 54 -7.067 1.750 10.614
376 HB3 GLU 54 2HB GLU 54 -8.362 0.719 10.021
377 HG2 GLU 54 1HG GLU 54 -6.757 -1.201 10.133
378 HG3 GLU 54 2HG GLU 54 -5.634 -0.121 10.957
379 H ALA 55 H ALA 55 -8.431 0.068 6.960
380 HA ALA 55 HA ALA 55 -9.850 2.597 6.537
381 HB1 ALA 55 3HB ALA 55 -9.313 2.813 4.383
382 HB2 ALA 55 1HB ALA 55 -8.009 1.672 4.713
383 HB3 ALA 55 2HB ALA 55 -9.545 1.094 4.065
384 HA PRO 56 HA PRO 56 -13.495 0.156 6.696
385 HB2 PRO 56 1HB PRO 56 -15.134 1.528 5.022
386 HB3 PRO 56 2HB PRO 56 -14.678 2.124 6.623
387 HG2 PRO 56 1HG PRO 56 -13.559 2.848 3.942
388 HG3 PRO 56 2HG PRO 56 -13.963 3.904 5.308
389 HD2 PRO 56 1HD PRO 56 -11.427 3.124 4.770
390 HD3 PRO 56 2HD PRO 56 -12.004 3.422 6.422
391 H GLY 57 H GLY 57 -14.455 -1.557 5.688
392 HA2 GLY 57 1HA GLY 57 -13.268 -2.795 3.522
393 HA3 GLY 57 2HA GLY 57 -14.903 -3.129 4.074
394 H ASN 58 H ASN 58 -15.394 -0.122 3.476
395 HA ASN 58 HA ASN 58 -16.344 -0.594 0.781
396 HB2 ASN 58 1HB ASN 58 -16.723 1.628 2.778
397 HB3 ASN 58 2HB ASN 58 -17.263 1.793 1.110
398 HD21 ASN 58 1HD2 ASN 58 -17.521 -0.305 3.940
399 HD22 ASN 58 2HD2 ASN 58 -19.143 -0.816 3.632
400 H ALA 59 H ALA 59 -13.894 1.308 2.407
401 HA ALA 59 HA ALA 59 -13.236 3.063 0.320
402 HB1 ALA 59 3HB ALA 59 -10.861 2.726 1.595
403 HB2 ALA 59 1HB ALA 59 -12.151 3.798 2.141
404 HB3 ALA 59 2HB ALA 59 -11.998 2.180 2.827
405 H THR 60 H THR 60 -12.567 2.568 -1.653
406 HA THR 60 HA THR 60 -11.128 0.056 -2.100
407 HB THR 60 HB THR 60 -11.551 0.527 -4.528
408 HG1 THR 60 1HG THR 60 -11.998 2.910 -3.828
409 HG21 THR 60 3HG2 THR 60 -14.163 0.328 -4.204
410 HG22 THR 60 1HG2 THR 60 -13.709 0.125 -2.512
411 HG23 THR 60 2HG2 THR 60 -13.085 -0.985 -3.732
412 H SER 61 H SER 61 -10.012 2.673 -1.022
413 HA SER 61 HA SER 61 -7.511 2.543 -2.357
414 HB2 SER 61 1HB SER 61 -7.474 4.847 -3.262
415 HB3 SER 61 2HB SER 61 -8.674 3.840 -4.071
416 HG SER 61 HG SER 61 -9.016 6.108 -2.615
417 H ALA 62 H ALA 62 -5.888 3.539 -1.197
418 HA ALA 62 HA ALA 62 -6.594 5.309 1.007
419 HB1 ALA 62 3HB ALA 62 -5.462 2.560 1.358
420 HB2 ALA 62 1HB ALA 62 -5.113 3.837 2.524
421 HB3 ALA 62 2HB ALA 62 -6.781 3.345 2.228
422 H MET 63 H MET 63 -4.955 6.675 1.618
423 HA MET 63 HA MET 63 -2.697 6.820 -0.191
424 HB2 MET 63 1HB MET 63 -3.741 8.632 1.978
425 HB3 MET 63 2HB MET 63 -2.213 8.935 1.162
426 HG2 MET 63 1HG MET 63 -3.729 8.677 -0.988
427 HG3 MET 63 2HG MET 63 -4.988 9.158 0.148
428 HE1 MET 63 3HE MET 63 -1.561 9.706 -1.081
429 HE2 MET 63 1HE MET 63 -2.054 10.993 -2.181
430 HE3 MET 63 2HE MET 63 -1.146 11.383 -0.720
431 H LEU 64 H LEU 64 -0.506 7.306 0.706
432 HA LEU 64 HA LEU 64 0.024 6.013 3.278
433 HB2 LEU 64 1HB LEU 64 1.557 5.355 0.770
434 HB3 LEU 64 2HB LEU 64 1.795 4.661 2.373
435 HG LEU 64 HG LEU 64 -0.763 4.304 0.832
436 HD11 LEU 64 1HD1 LEU 64 1.628 3.411 -0.107
437 HD12 LEU 64 2HD1 LEU 64 0.074 2.633 -0.403
438 HD13 LEU 64 3HD1 LEU 64 1.114 2.057 0.899
439 HD21 LEU 64 3HD2 LEU 64 -1.328 3.521 2.857
440 HD22 LEU 64 1HD2 LEU 64 0.350 3.374 3.381
441 HD23 LEU 64 2HD2 LEU 64 -0.377 2.110 2.389
442 H GLY 65 H GLY 65 1.822 6.775 4.362
443 HA2 GLY 65 1HA GLY 65 4.045 8.030 3.681
444 HA3 GLY 65 2HA GLY 65 2.879 9.299 3.337
445 HA PRO 66 HA PRO 66 4.573 10.673 3.949
446 HB2 PRO 66 1HB PRO 66 6.810 11.349 5.330
447 HB3 PRO 66 2HB PRO 66 5.309 12.277 5.420
448 HG2 PRO 66 1HG PRO 66 6.386 10.230 7.319
449 HG3 PRO 66 2HG PRO 66 5.618 11.789 7.672
450 HD2 PRO 66 1HD PRO 66 4.288 9.437 7.846
451 HD3 PRO 66 2HD PRO 66 3.492 10.951 7.373
452 H LEU 67 H LEU 67 5.621 9.551 2.441
453 HA LEU 67 HA LEU 67 7.269 7.269 3.239
454 HB2 LEU 67 1HB LEU 67 6.446 8.022 0.448
455 HB3 LEU 67 2HB LEU 67 7.028 6.461 1.023
456 HG LEU 67 HG LEU 67 4.355 7.714 1.650
457 HD11 LEU 67 1HD1 LEU 67 5.277 5.616 -0.262
458 HD12 LEU 67 2HD1 LEU 67 4.131 6.934 -0.505
459 HD13 LEU 67 3HD1 LEU 67 3.660 5.519 0.438
460 HD21 LEU 67 3HD2 LEU 67 5.247 6.406 3.530
461 HD22 LEU 67 1HD2 LEU 67 5.464 5.026 2.453
462 HD23 LEU 67 2HD2 LEU 67 3.843 5.635 2.791
463 H SER 68 H SER 68 9.104 6.891 1.465
464 HA SER 68 HA SER 68 10.810 9.256 1.661
465 HB2 SER 68 1HB SER 68 11.612 7.025 2.490
466 HB3 SER 68 2HB SER 68 11.582 6.452 0.822
467 HG SER 68 HG SER 68 13.214 8.450 1.974
468 H SER 69 H SER 69 12.488 9.317 -0.263
469 HA SER 69 HA SER 69 10.882 9.424 -2.726
470 HB2 SER 69 1HB SER 69 12.646 11.081 -3.479
471 HB3 SER 69 2HB SER 69 11.639 11.613 -2.132
472 HG SER 69 HG SER 69 13.980 11.935 -1.912
473 H SER 70 H SER 70 11.801 8.762 -4.705
474 HA SER 70 HA SER 70 12.800 7.129 -5.964
475 HB2 SER 70 1HB SER 70 14.485 8.985 -5.895
476 HB3 SER 70 2HB SER 70 15.287 8.143 -4.569
477 HG SER 70 HG SER 70 15.336 7.627 -7.256
478 H THR 71 H THR 71 11.861 6.253 -3.348
479 HA THR 71 HA THR 71 13.699 3.985 -2.941
480 HB THR 71 HB THR 71 12.005 5.360 -0.847
481 HG1 THR 71 1HG THR 71 14.482 5.821 -1.720
482 HG21 THR 71 3HG2 THR 71 12.668 3.748 0.701
483 HG22 THR 71 1HG2 THR 71 13.983 3.167 -0.320
484 HG23 THR 71 2HG2 THR 71 12.310 2.794 -0.738
485 H THR 72 H THR 72 12.848 2.052 -3.332
486 HA THR 72 HA THR 72 10.146 1.751 -4.154
487 HB THR 72 HB THR 72 12.145 -0.410 -3.461
488 HG1 THR 72 1HG THR 72 12.369 1.338 -5.325
489 HG21 THR 72 3HG2 THR 72 9.479 -0.729 -3.859
490 HG22 THR 72 1HG2 THR 72 10.692 -1.947 -4.251
491 HG23 THR 72 2HG2 THR 72 10.083 -0.871 -5.510
492 H TYR 73 H TYR 73 8.397 0.906 -3.118
493 HA TYR 73 HA TYR 73 8.738 0.027 -0.335
494 HB2 TYR 73 1HB TYR 73 7.073 2.266 -1.368
495 HB3 TYR 73 2HB TYR 73 6.381 1.265 -0.096
496 HD1 TYR 73 1HD TYR 73 9.263 3.435 -0.945
497 HD2 TYR 73 2HD TYR 73 7.070 1.507 2.151
498 HE1 TYR 73 1HE TYR 73 10.526 4.710 0.736
499 HE2 TYR 73 2HE TYR 73 8.327 2.779 3.840
500 HH TYR 73 HH TYR 73 10.642 5.279 2.912
501 H THR 74 H THR 74 7.731 -1.822 0.099
502 HA THR 74 HA THR 74 6.014 -2.999 -1.931
503 HB THR 74 HB THR 74 7.033 -4.202 0.651
504 HG1 THR 74 1HG THR 74 7.987 -4.383 -2.030
505 HG21 THR 74 3HG2 THR 74 5.123 -5.428 -0.018
506 HG22 THR 74 1HG2 THR 74 6.507 -6.353 -0.596
507 HG23 THR 74 2HG2 THR 74 5.579 -5.359 -1.719
508 H VAL 75 H VAL 75 3.961 -2.296 -1.843
509 HA VAL 75 HA VAL 75 2.657 -1.791 0.696
510 HB VAL 75 HB VAL 75 1.536 -1.640 -2.107
511 HG11 VAL 75 1HG1 VAL 75 -0.029 -0.006 -0.724
512 HG12 VAL 75 2HG1 VAL 75 -0.372 -1.731 -0.864
513 HG13 VAL 75 3HG1 VAL 75 0.410 -1.101 0.586
514 HG21 VAL 75 3HG2 VAL 75 1.744 0.861 -1.634
515 HG22 VAL 75 1HG2 VAL 75 2.840 0.401 -0.331
516 HG23 VAL 75 2HG2 VAL 75 3.229 -0.017 -2.000
517 H ARG 76 H ARG 76 0.703 -2.812 1.360
518 HA ARG 76 HA ARG 76 -0.059 -5.292 0.047
519 HB2 ARG 76 1HB ARG 76 1.358 -5.144 2.656
520 HB3 ARG 76 2HB ARG 76 0.025 -6.285 2.529
521 HG2 ARG 76 1HG ARG 76 1.125 -7.623 1.051
522 HG3 ARG 76 2HG ARG 76 2.069 -6.292 0.379
523 HD2 ARG 76 1HD ARG 76 3.638 -7.539 1.569
524 HD3 ARG 76 2HD ARG 76 3.227 -6.222 2.668
525 HE ARG 76 HE ARG 76 1.608 -8.533 3.099
526 HH11 ARG 76 1HH1 ARG 76 4.723 -7.121 3.752
527 HH12 ARG 76 2HH1 ARG 76 4.972 -8.025 5.209
528 HH21 ARG 76 1HH2 ARG 76 1.926 -9.730 5.015
529 HH22 ARG 76 2HH2 ARG 76 3.381 -9.510 5.926
530 H VAL 77 H VAL 77 -2.181 -5.053 -0.166
531 HA VAL 77 HA VAL 77 -3.700 -3.627 1.885
532 HB VAL 77 HB VAL 77 -4.546 -4.584 -0.853
533 HG11 VAL 77 1HG1 VAL 77 -6.586 -3.381 -0.527
534 HG12 VAL 77 2HG1 VAL 77 -6.376 -4.471 0.845
535 HG13 VAL 77 3HG1 VAL 77 -6.029 -2.751 1.022
536 HG21 VAL 77 3HG2 VAL 77 -4.358 -1.711 -0.132
537 HG22 VAL 77 1HG2 VAL 77 -2.854 -2.585 -0.424
538 HG23 VAL 77 2HG2 VAL 77 -4.089 -2.510 -1.681
539 H THR 78 H THR 78 -3.978 -5.072 3.538
540 HA THR 78 HA THR 78 -4.807 -7.785 3.066
541 HB THR 78 HB THR 78 -4.795 -6.271 5.683
542 HG1 THR 78 1HG THR 78 -2.704 -6.947 5.911
543 HG21 THR 78 3HG2 THR 78 -5.236 -9.098 4.899
544 HG22 THR 78 1HG2 THR 78 -5.924 -8.174 6.233
545 HG23 THR 78 2HG2 THR 78 -4.281 -8.805 6.352
546 H CYS 79 H CYS 79 -6.807 -8.219 2.406
547 HA CYS 79 HA CYS 79 -9.022 -6.524 3.295
548 HB2 CYS 79 1HB CYS 79 -8.883 -8.645 1.143
549 HB3 CYS 79 2HB CYS 79 -10.323 -7.715 1.539
550 HG CYS 79 HG CYS 79 -8.255 -7.006 -0.725
551 H LEU 80 H LEU 80 -9.651 -7.180 5.280
552 HA LEU 80 HA LEU 80 -9.997 -10.038 5.798
553 HB2 LEU 80 1HB LEU 80 -9.966 -7.607 7.561
554 HB3 LEU 80 2HB LEU 80 -10.511 -9.178 8.146
555 HG LEU 80 HG LEU 80 -7.813 -8.975 6.896
556 HD11 LEU 80 1HD1 LEU 80 -7.215 -8.622 9.503
557 HD12 LEU 80 2HD1 LEU 80 -8.662 -7.623 9.366
558 HD13 LEU 80 3HD1 LEU 80 -7.277 -7.317 8.317
559 HD21 LEU 80 3HD2 LEU 80 -7.740 -11.068 7.623
560 HD22 LEU 80 1HD2 LEU 80 -9.340 -10.895 8.346
561 HD23 LEU 80 2HD2 LEU 80 -7.901 -10.488 9.282
562 H TYR 81 H TYR 81 -11.898 -10.849 5.212
563 HA TYR 81 HA TYR 81 -14.268 -9.204 5.084
564 HB2 TYR 81 1HB TYR 81 -14.039 -12.186 4.645
565 HB3 TYR 81 2HB TYR 81 -15.344 -11.131 4.114
566 HD1 TYR 81 2HD TYR 81 -14.935 -9.491 2.286
567 HD2 TYR 81 1HD TYR 81 -12.041 -12.416 3.371
568 HE1 TYR 81 2HE TYR 81 -13.783 -9.138 0.142
569 HE2 TYR 81 1HE TYR 81 -10.881 -12.070 1.230
570 HH TYR 81 HH TYR 81 -11.928 -9.572 -1.044
571 HA PRO 82 HA PRO 82 -15.969 -10.139 9.023
572 HB2 PRO 82 1HB PRO 82 -18.622 -10.072 8.453
573 HB3 PRO 82 2HB PRO 82 -17.619 -8.619 8.527
574 HG2 PRO 82 1HG PRO 82 -18.519 -10.180 6.136
575 HG3 PRO 82 2HG PRO 82 -18.459 -8.422 6.367
576 HD2 PRO 82 1HD PRO 82 -16.565 -9.776 4.984
577 HD3 PRO 82 2HD PRO 82 -16.199 -8.316 5.925
578 H GLY 83 H GLY 83 -16.320 -11.951 10.164
579 HA2 GLY 83 1HA GLY 83 -17.420 -13.994 10.644
580 HA3 GLY 83 2HA GLY 83 -17.796 -14.163 8.936
581 H GLY 84 H GLY 84 -16.020 -14.714 7.476
582 HA2 GLY 84 1HA GLY 84 -13.596 -15.767 8.673
583 HA3 GLY 84 2HA GLY 84 -14.688 -16.981 8.024
584 H GLY 85 H GLY 85 -11.975 -15.388 7.321
585 HA2 GLY 85 1HA GLY 85 -11.223 -16.061 4.982
586 HA3 GLY 85 2HA GLY 85 -12.607 -15.115 4.452
587 H SER 86 H SER 86 -9.935 -14.637 3.662
588 HA SER 86 HA SER 86 -9.762 -11.858 4.096
589 HB2 SER 86 1HB SER 86 -7.650 -11.764 5.370
590 HB3 SER 86 2HB SER 86 -8.943 -12.502 6.314
591 HG SER 86 HG SER 86 -7.323 -14.188 4.795
592 H SER 87 H SER 87 -7.503 -11.035 3.312
593 HA SER 87 HA SER 87 -6.089 -12.759 1.507
594 HB2 SER 87 1HB SER 87 -8.274 -12.083 0.309
595 HB3 SER 87 2HB SER 87 -7.555 -10.477 0.196
596 HG SER 87 HG SER 87 -5.983 -12.631 -0.600
597 H THR 88 H THR 88 -4.420 -11.516 0.256
598 HA THR 88 HA THR 88 -3.710 -8.957 1.492
599 HB THR 88 HB THR 88 -1.673 -11.165 1.199
600 HG1 THR 88 1HG THR 88 -1.908 -11.040 3.643
601 HG21 THR 88 3HG2 THR 88 -0.156 -9.717 2.064
602 HG22 THR 88 1HG2 THR 88 -1.342 -8.923 3.098
603 HG23 THR 88 2HG2 THR 88 -1.251 -8.514 1.385
604 H LEU 89 H LEU 89 -3.766 -7.681 -0.261
605 HA LEU 89 HA LEU 89 -2.685 -8.628 -2.797
606 HB2 LEU 89 1HB LEU 89 -4.324 -6.274 -1.951
607 HB3 LEU 89 2HB LEU 89 -3.476 -6.253 -3.496
608 HG LEU 89 HG LEU 89 -5.336 -8.501 -2.818
609 HD11 LEU 89 1HD1 LEU 89 -7.062 -7.106 -2.717
610 HD12 LEU 89 2HD1 LEU 89 -6.766 -6.743 -4.417
611 HD13 LEU 89 3HD1 LEU 89 -6.061 -5.723 -3.162
612 HD21 LEU 89 3HD2 LEU 89 -3.664 -8.012 -4.934
613 HD22 LEU 89 1HD2 LEU 89 -5.217 -7.423 -5.526
614 HD23 LEU 89 2HD2 LEU 89 -5.064 -9.086 -4.958
615 H THR 90 H THR 90 -0.518 -8.538 -2.847
616 HA THR 90 HA THR 90 0.919 -6.335 -1.629
617 HB THR 90 HB THR 90 2.901 -7.529 -2.022
618 HG1 THR 90 1HG THR 90 1.449 -8.649 -4.147
619 HG21 THR 90 3HG2 THR 90 0.689 -8.854 -0.887
620 HG22 THR 90 1HG2 THR 90 2.400 -9.153 -0.581
621 HG23 THR 90 2HG2 THR 90 1.558 -10.057 -1.840
622 H GLY 91 H GLY 91 2.129 -4.792 -2.705
623 HA2 GLY 91 1HA GLY 91 2.258 -4.792 -5.600
624 HA3 GLY 91 2HA GLY 91 1.218 -3.553 -4.914
625 H ARG 92 H ARG 92 4.140 -3.956 -6.184
626 HA ARG 92 HA ARG 92 5.700 -2.449 -4.264
627 HB2 ARG 92 1HB ARG 92 6.234 -3.813 -6.855
628 HB3 ARG 92 2HB ARG 92 7.303 -2.495 -6.394
629 HG2 ARG 92 1HG ARG 92 6.743 -4.584 -4.366
630 HG3 ARG 92 2HG ARG 92 7.787 -5.007 -5.725
631 HD2 ARG 92 1HD ARG 92 9.027 -2.816 -5.159
632 HD3 ARG 92 2HD ARG 92 8.190 -2.923 -3.611
633 HE ARG 92 HE ARG 92 9.595 -4.627 -3.011
634 HH11 ARG 92 1HH1 ARG 92 9.792 -4.144 -6.453
635 HH12 ARG 92 2HH1 ARG 92 11.125 -5.232 -6.661
636 HH21 ARG 92 1HH2 ARG 92 11.349 -6.061 -3.271
637 HH22 ARG 92 2HH2 ARG 92 12.009 -6.323 -4.850
638 H VAL 93 H VAL 93 6.418 -0.349 -4.502
639 HA VAL 93 HA VAL 93 5.614 1.196 -6.828
640 HB VAL 93 HB VAL 93 3.639 1.341 -5.383
641 HG11 VAL 93 1HG1 VAL 93 5.401 1.262 -3.298
642 HG12 VAL 93 2HG1 VAL 93 4.920 2.959 -3.311
643 HG13 VAL 93 3HG1 VAL 93 3.697 1.696 -3.172
644 HG21 VAL 93 3HG2 VAL 93 4.251 4.024 -4.901
645 HG22 VAL 93 1HG2 VAL 93 5.223 3.564 -6.299
646 HG23 VAL 93 2HG2 VAL 93 3.474 3.347 -6.331
647 H THR 94 H THR 94 7.212 2.529 -7.347
648 HA THR 94 HA THR 94 9.276 3.105 -5.355
649 HB THR 94 HB THR 94 9.305 3.525 -8.350
650 HG1 THR 94 1HG THR 94 10.525 1.549 -6.693
651 HG21 THR 94 3HG2 THR 94 11.246 4.614 -8.141
652 HG22 THR 94 1HG2 THR 94 11.870 3.428 -6.997
653 HG23 THR 94 2HG2 THR 94 10.873 4.765 -6.425
654 H THR 95 H THR 95 8.947 4.902 -4.216
655 HA THR 95 HA THR 95 7.282 7.025 -4.879
656 HB THR 95 HB THR 95 8.752 8.345 -3.216
657 HG1 THR 95 1HG THR 95 10.432 7.334 -2.383
658 HG21 THR 95 3HG2 THR 95 7.365 7.606 -1.605
659 HG22 THR 95 1HG2 THR 95 7.888 5.933 -1.789
660 HG23 THR 95 2HG2 THR 95 6.674 6.602 -2.879
661 H LYS 96 H LYS 96 7.814 9.246 -5.408
662 HA LYS 96 HA LYS 96 9.615 9.396 -7.639
663 HB2 LYS 96 1HB LYS 96 8.069 11.621 -6.297
664 HB3 LYS 96 2HB LYS 96 8.802 11.672 -7.895
665 HG2 LYS 96 1HG LYS 96 7.234 9.576 -8.281
666 HG3 LYS 96 2HG LYS 96 6.310 10.346 -6.988
667 HD2 LYS 96 1HD LYS 96 5.794 12.177 -8.262
668 HD3 LYS 96 2HD LYS 96 7.254 12.041 -9.244
669 HE2 LYS 96 1HE LYS 96 6.288 10.045 -10.335
670 HE3 LYS 96 2HE LYS 96 4.811 10.278 -9.401
671 HZ1 LYS 96 3HZ LYS 96 4.176 12.017 -10.669
672 HZ2 LYS 96 1HZ LYS 96 5.150 11.264 -11.830
673 HZ3 LYS 96 2HZ LYS 96 5.754 12.566 -10.935
674 H LYS 97 H LYS 97 11.070 11.404 -7.803
675 HA LYS 97 HA LYS 97 12.897 11.312 -5.547
676 HB2 LYS 97 1HB LYS 97 13.055 12.219 -8.384
677 HB3 LYS 97 2HB LYS 97 14.179 12.919 -7.227
678 HG2 LYS 97 1HG LYS 97 15.103 10.791 -6.712
679 HG3 LYS 97 2HG LYS 97 13.835 9.957 -7.614
680 HD2 LYS 97 1HD LYS 97 14.661 11.074 -9.681
681 HD3 LYS 97 2HD LYS 97 16.000 11.733 -8.738
682 HE2 LYS 97 1HE LYS 97 16.476 9.293 -8.093
683 HE3 LYS 97 2HE LYS 97 15.416 8.873 -9.437
684 HZ1 LYS 97 3HZ LYS 97 17.738 8.920 -10.109
685 HZ2 LYS 97 1HZ LYS 97 17.867 10.539 -9.634
686 HZ3 LYS 97 2HZ LYS 97 16.856 10.113 -10.921
687 H ALA 98 H ALA 98 13.284 12.935 -4.146
688 HA ALA 98 HA ALA 98 11.464 15.179 -4.137
689 HB1 ALA 98 3HB ALA 98 13.582 15.199 -2.129
690 HB2 ALA 98 1HB ALA 98 11.830 15.246 -1.933
691 HB3 ALA 98 2HB ALA 98 12.651 13.702 -2.161
692 HA PRO 99 HA PRO 99 14.132 18.112 -6.050
693 HB2 PRO 99 1HB PRO 99 13.112 20.390 -4.983
694 HB3 PRO 99 2HB PRO 99 12.278 19.456 -6.231
695 HG2 PRO 99 1HG PRO 99 11.841 19.476 -3.269
696 HG3 PRO 99 2HG PRO 99 10.643 19.475 -4.577
697 HD2 PRO 99 1HD PRO 99 11.310 17.234 -3.210
698 HD3 PRO 99 2HD PRO 99 10.835 17.203 -4.921
699 H SER 100 H SER 100 13.628 18.342 -2.551
700 HA SER 100 HA SER 100 14.962 19.078 -0.852
701 HB2 SER 100 1HB SER 100 16.989 17.803 -2.694
702 HB3 SER 100 2HB SER 100 17.381 18.358 -1.067
703 HG SER 100 HG SER 100 16.295 16.732 -0.235
704 HA PRO 101 HA PRO 101 16.280 22.831 -3.400
705 HB2 PRO 101 1HB PRO 101 14.352 24.518 -2.501
706 HB3 PRO 101 2HB PRO 101 14.146 23.496 -3.928
707 HG2 PRO 101 1HG PRO 101 13.176 23.059 -1.130
708 HG3 PRO 101 2HG PRO 101 12.324 22.798 -2.663
709 HD2 PRO 101 1HD PRO 101 13.453 20.775 -1.261
710 HD3 PRO 101 2HD PRO 101 13.351 20.768 -3.033
711 H SER 102 H SER 102 14.799 22.922 -0.151
712 HA SER 102 HA SER 102 15.385 24.205 1.681
713 HB2 SER 102 1HB SER 102 17.901 22.651 1.040
714 HB3 SER 102 2HB SER 102 17.604 23.464 2.577
715 HG SER 102 HG SER 102 15.697 22.133 2.750
716 H SER 103 H SER 103 15.631 25.732 -0.698
717 HA SER 103 HA SER 103 18.145 27.178 -0.486
718 HB2 SER 103 1HB SER 103 17.310 28.467 -2.416
719 HB3 SER 103 2HB SER 103 17.233 26.732 -2.719
720 HG SER 103 HG SER 103 15.303 28.245 -3.144
721 H GLY 104 H GLY 104 14.669 27.859 -0.134
722 HA2 GLY 104 1HA GLY 104 14.488 30.449 0.442
723 HA3 GLY 104 2HA GLY 104 13.669 29.258 1.442
724 HA PRO 105 HA PRO 105 17.797 30.804 3.543
725 HB2 PRO 105 1HB PRO 105 18.225 33.445 3.084
726 HB3 PRO 105 2HB PRO 105 18.935 32.169 2.087
727 HG2 PRO 105 1HG PRO 105 16.515 33.853 1.567
728 HG3 PRO 105 2HG PRO 105 17.812 33.382 0.453
729 HD2 PRO 105 1HD PRO 105 15.405 32.142 0.495
730 HD3 PRO 105 2HD PRO 105 16.910 31.293 0.086
731 H SER 106 H SER 106 14.928 32.773 3.022
732 HA SER 106 HA SER 106 14.909 33.426 5.896
733 HB2 SER 106 1HB SER 106 13.443 35.357 5.253
734 HB3 SER 106 2HB SER 106 15.078 35.453 4.597
735 HG SER 106 HG SER 106 14.146 34.484 2.649
736 H SER 107 H SER 107 12.515 33.971 6.576
737 HA SER 107 HA SER 107 11.094 31.564 6.574
738 HB2 SER 107 1HB SER 107 10.956 33.673 8.146
739 HB3 SER 107 2HB SER 107 9.668 34.156 7.042
740 HG SER 107 HG SER 107 8.565 32.279 7.547
741 H GLY 108 H GLY 108 10.373 34.599 4.845
742 HA2 GLY 108 1HA GLY 108 8.260 33.321 3.332
743 HA3 GLY 108 2HA GLY 108 8.787 34.991 3.188
Start of MODEL 7
1 H1 GLY 1 H GLY 1 5.981 -30.947 1.830
2 HA2 GLY 1 1HA GLY 1 5.854 -33.282 0.249
3 HA3 GLY 1 2HA GLY 1 5.881 -33.737 1.947
4 H SER 2 H SER 2 4.304 -31.110 0.125
5 HA SER 2 HA SER 2 1.787 -31.835 1.464
6 HB2 SER 2 1HB SER 2 2.782 -29.493 1.745
7 HB3 SER 2 2HB SER 2 2.345 -29.224 0.058
8 HG SER 2 HG SER 2 0.379 -30.246 1.748
9 H SER 3 H SER 3 -0.034 -32.273 0.309
10 HA SER 3 HA SER 3 0.325 -32.596 -2.586
11 HB2 SER 3 1HB SER 3 -1.765 -33.826 -0.773
12 HB3 SER 3 2HB SER 3 -1.515 -34.200 -2.478
13 HG SER 3 HG SER 3 -0.268 -35.698 -1.663
14 H GLY 4 H GLY 4 -1.394 -32.024 -4.030
15 HA2 GLY 4 1HA GLY 4 -3.520 -30.966 -4.441
16 HA3 GLY 4 2HA GLY 4 -3.320 -30.079 -2.937
17 H SER 5 H SER 5 -2.959 -29.993 -6.289
18 HA SER 5 HA SER 5 -0.857 -28.422 -6.911
19 HB2 SER 5 1HB SER 5 -2.314 -29.004 -8.678
20 HB3 SER 5 2HB SER 5 -3.705 -28.266 -7.886
21 HG SER 5 HG SER 5 -3.180 -26.710 -9.245
22 H SER 6 H SER 6 -0.025 -26.685 -5.982
23 HA SER 6 HA SER 6 -1.739 -24.865 -4.485
24 HB2 SER 6 1HB SER 6 0.514 -25.796 -3.647
25 HB3 SER 6 2HB SER 6 1.254 -24.635 -4.749
26 HG SER 6 HG SER 6 -0.408 -24.127 -2.518
27 H GLY 7 H GLY 7 -2.813 -23.711 -6.081
28 HA2 GLY 7 1HA GLY 7 -1.189 -21.654 -7.372
29 HA3 GLY 7 2HA GLY 7 -2.156 -22.677 -8.425
30 H LEU 8 H LEU 8 -2.311 -20.359 -5.771
31 HA LEU 8 HA LEU 8 -5.176 -20.034 -6.093
32 HB2 LEU 8 1HB LEU 8 -3.165 -18.693 -4.298
33 HB3 LEU 8 2HB LEU 8 -4.882 -18.299 -4.311
34 HG LEU 8 HG LEU 8 -5.100 -20.904 -3.847
35 HD11 LEU 8 1HD1 LEU 8 -3.235 -21.956 -3.282
36 HD12 LEU 8 2HD1 LEU 8 -2.892 -20.750 -2.042
37 HD13 LEU 8 3HD1 LEU 8 -2.316 -20.507 -3.691
38 HD21 LEU 8 3HD2 LEU 8 -4.380 -18.860 -1.747
39 HD22 LEU 8 1HD2 LEU 8 -5.235 -20.378 -1.467
40 HD23 LEU 8 2HD2 LEU 8 -5.982 -19.112 -2.442
41 H ALA 9 H ALA 9 -5.959 -18.796 -7.655
42 HA ALA 9 HA ALA 9 -4.362 -16.874 -9.046
43 HB1 ALA 9 3HB ALA 9 -6.316 -16.487 -10.400
44 HB2 ALA 9 1HB ALA 9 -6.129 -18.220 -10.135
45 HB3 ALA 9 2HB ALA 9 -7.339 -17.314 -9.226
46 HA PRO 10 HA PRO 10 -5.153 -13.285 -6.627
47 HB2 PRO 10 1HB PRO 10 -4.814 -11.380 -8.530
48 HB3 PRO 10 2HB PRO 10 -3.468 -12.285 -7.826
49 HG2 PRO 10 1HG PRO 10 -4.886 -12.717 -10.427
50 HG3 PRO 10 2HG PRO 10 -3.148 -12.769 -10.078
51 HD2 PRO 10 1HD PRO 10 -4.656 -15.006 -10.313
52 HD3 PRO 10 2HD PRO 10 -3.257 -14.907 -9.224
53 HA PRO 11 HA PRO 11 -9.471 -12.483 -7.279
54 HB2 PRO 11 1HB PRO 11 -9.750 -10.593 -5.350
55 HB3 PRO 11 2HB PRO 11 -9.621 -12.319 -4.992
56 HG2 PRO 11 1HG PRO 11 -7.512 -10.198 -4.875
57 HG3 PRO 11 2HG PRO 11 -7.844 -11.509 -3.729
58 HD2 PRO 11 1HD PRO 11 -5.849 -11.641 -5.555
59 HD3 PRO 11 2HD PRO 11 -6.740 -13.076 -5.008
60 H ARG 12 H ARG 12 -7.253 -9.728 -6.842
61 HA ARG 12 HA ARG 12 -8.389 -8.452 -9.194
62 HB2 ARG 12 1HB ARG 12 -8.380 -7.119 -6.481
63 HB3 ARG 12 2HB ARG 12 -8.716 -6.299 -8.000
64 HG2 ARG 12 1HG ARG 12 -10.328 -8.638 -7.025
65 HG3 ARG 12 2HG ARG 12 -10.715 -6.965 -6.618
66 HD2 ARG 12 1HD ARG 12 -11.066 -6.407 -8.906
67 HD3 ARG 12 2HD ARG 12 -10.405 -7.950 -9.445
68 HE ARG 12 HE ARG 12 -12.671 -8.310 -7.762
69 HH11 ARG 12 1HH1 ARG 12 -11.708 -7.480 -11.003
70 HH12 ARG 12 2HH1 ARG 12 -13.185 -8.030 -11.722
71 HH21 ARG 12 1HH2 ARG 12 -14.620 -9.038 -8.697
72 HH22 ARG 12 2HH2 ARG 12 -14.841 -8.915 -10.410
73 H HIS 13 H HIS 13 -7.196 -6.172 -9.403
74 HA HIS 13 HA HIS 13 -4.336 -6.704 -8.930
75 HB2 HIS 13 1HB HIS 13 -5.028 -6.788 -11.320
76 HB3 HIS 13 2HB HIS 13 -5.560 -5.114 -11.194
77 HD1 HIS 13 1HD HIS 13 -3.866 -4.210 -12.871
78 HD2 HIS 13 2HD HIS 13 -2.122 -6.234 -9.689
79 HE1 HIS 13 1HE HIS 13 -1.405 -3.715 -13.026
80 HE2 HIS 13 2HE HIS 13 -0.361 -5.019 -11.142
81 H LEU 14 H LEU 14 -3.020 -5.031 -8.243
82 HA LEU 14 HA LEU 14 -4.405 -2.861 -6.902
83 HB2 LEU 14 1HB LEU 14 -1.670 -4.033 -6.801
84 HB3 LEU 14 2HB LEU 14 -1.897 -2.375 -6.248
85 HG LEU 14 HG LEU 14 -3.429 -4.727 -5.148
86 HD11 LEU 14 1HD1 LEU 14 -0.720 -3.752 -4.578
87 HD12 LEU 14 2HD1 LEU 14 -1.457 -5.321 -4.257
88 HD13 LEU 14 3HD1 LEU 14 -1.750 -3.969 -3.164
89 HD21 LEU 14 3HD2 LEU 14 -4.265 -3.281 -3.556
90 HD22 LEU 14 1HD2 LEU 14 -4.240 -2.259 -4.993
91 HD23 LEU 14 2HD2 LEU 14 -2.965 -2.109 -3.783
92 H GLY 15 H GLY 15 -3.572 -0.636 -7.032
93 HA2 GLY 15 1HA GLY 15 -2.176 0.035 -9.512
94 HA3 GLY 15 2HA GLY 15 -3.809 0.655 -9.322
95 H PHE 16 H PHE 16 -0.980 1.855 -9.390
96 HA PHE 16 HA PHE 16 -1.256 3.465 -6.937
97 HB2 PHE 16 1HB PHE 16 1.253 2.833 -8.506
98 HB3 PHE 16 2HB PHE 16 1.176 3.898 -7.107
99 HD1 PHE 16 1HD PHE 16 0.346 2.886 -4.906
100 HD2 PHE 16 2HD PHE 16 1.623 0.560 -8.235
101 HE1 PHE 16 1HE PHE 16 0.705 0.959 -3.418
102 HE2 PHE 16 2HE PHE 16 1.984 -1.370 -6.752
103 HZ PHE 16 HZ PHE 16 1.524 -1.172 -4.341
104 H SER 17 H SER 17 -1.799 5.516 -7.233
105 HA SER 17 HA SER 17 -1.049 6.840 -9.749
106 HB2 SER 17 1HB SER 17 -3.418 6.168 -9.893
107 HB3 SER 17 2HB SER 17 -3.754 7.048 -8.401
108 HG SER 17 HG SER 17 -2.954 8.094 -10.908
109 H ASP 18 H ASP 18 -1.518 9.297 -9.531
110 HA ASP 18 HA ASP 18 -0.567 11.179 -8.601
111 HB2 ASP 18 1HB ASP 18 -2.505 10.196 -6.504
112 HB3 ASP 18 2HB ASP 18 -1.730 11.776 -6.428
113 H VAL 19 H VAL 19 1.119 8.929 -8.251
114 HA VAL 19 HA VAL 19 2.032 8.689 -5.576
115 HB VAL 19 HB VAL 19 3.475 8.095 -8.163
116 HG11 VAL 19 1HG1 VAL 19 5.262 8.015 -6.793
117 HG12 VAL 19 2HG1 VAL 19 4.274 7.875 -5.338
118 HG13 VAL 19 3HG1 VAL 19 4.589 6.452 -6.333
119 HG21 VAL 19 3HG2 VAL 19 1.410 6.707 -6.648
120 HG22 VAL 19 1HG2 VAL 19 1.974 6.445 -8.298
121 HG23 VAL 19 2HG2 VAL 19 2.835 5.711 -6.945
122 H SER 20 H SER 20 3.518 9.812 -4.446
123 HA SER 20 HA SER 20 4.887 12.027 -5.827
124 HB2 SER 20 1HB SER 20 3.798 11.998 -3.002
125 HB3 SER 20 2HB SER 20 4.703 13.324 -3.733
126 HG SER 20 HG SER 20 2.310 12.312 -4.856
127 H HIS 21 H HIS 21 6.668 12.897 -4.133
128 HA HIS 21 HA HIS 21 8.539 10.715 -3.911
129 HB2 HIS 21 1HB HIS 21 10.123 12.493 -3.173
130 HB3 HIS 21 2HB HIS 21 9.364 12.833 -4.725
131 HD1 HIS 21 1HD HIS 21 7.694 14.807 -4.822
132 HD2 HIS 21 2HD HIS 21 9.462 14.253 -1.104
133 HE1 HIS 21 1HE HIS 21 7.178 16.893 -3.515
134 HE2 HIS 21 2HE HIS 21 8.330 16.570 -1.298
135 H ASP 22 H ASP 22 6.369 12.377 -1.833
136 HA ASP 22 HA ASP 22 7.520 10.962 0.479
137 HB2 ASP 22 1HB ASP 22 6.641 12.853 1.890
138 HB3 ASP 22 2HB ASP 22 7.982 13.284 0.833
139 H ALA 23 H ALA 23 5.291 10.420 -1.511
140 HA ALA 23 HA ALA 23 3.470 9.269 0.345
141 HB1 ALA 23 3HB ALA 23 2.599 11.737 -1.131
142 HB2 ALA 23 1HB ALA 23 1.452 10.540 -0.526
143 HB3 ALA 23 2HB ALA 23 2.505 11.400 0.598
144 H ALA 24 H ALA 24 1.635 8.171 -0.787
145 HA ALA 24 HA ALA 24 1.725 7.867 -3.626
146 HB1 ALA 24 3HB ALA 24 2.344 5.265 -2.415
147 HB2 ALA 24 1HB ALA 24 2.916 5.986 -3.920
148 HB3 ALA 24 2HB ALA 24 3.665 6.434 -2.386
149 H ARG 25 H ARG 25 -0.272 7.385 -4.256
150 HA ARG 25 HA ARG 25 -2.188 6.428 -2.287
151 HB2 ARG 25 1HB ARG 25 -2.734 8.359 -3.745
152 HB3 ARG 25 2HB ARG 25 -2.631 7.302 -5.147
153 HG2 ARG 25 1HG ARG 25 -4.570 6.152 -4.579
154 HG3 ARG 25 2HG ARG 25 -4.510 6.692 -2.900
155 HD2 ARG 25 1HD ARG 25 -6.246 7.922 -3.932
156 HD3 ARG 25 2HD ARG 25 -4.886 9.031 -3.764
157 HE ARG 25 HE ARG 25 -4.622 7.950 -6.269
158 HH11 ARG 25 1HH1 ARG 25 -7.085 9.724 -4.563
159 HH12 ARG 25 2HH1 ARG 25 -7.715 10.477 -5.991
160 HH21 ARG 25 1HH2 ARG 25 -5.443 8.935 -8.155
161 HH22 ARG 25 2HH2 ARG 25 -6.781 10.027 -8.033
162 H VAL 26 H VAL 26 -2.660 4.351 -2.083
163 HA VAL 26 HA VAL 26 -2.226 2.571 -4.392
164 HB VAL 26 HB VAL 26 -0.756 2.049 -2.507
165 HG11 VAL 26 1HG1 VAL 26 -3.049 1.181 -0.826
166 HG12 VAL 26 2HG1 VAL 26 -1.435 1.714 -0.351
167 HG13 VAL 26 3HG1 VAL 26 -2.642 2.896 -0.861
168 HG21 VAL 26 3HG2 VAL 26 -1.646 -0.350 -2.113
169 HG22 VAL 26 1HG2 VAL 26 -2.917 0.113 -3.244
170 HG23 VAL 26 2HG2 VAL 26 -1.229 0.147 -3.753
171 H PHE 27 H PHE 27 -4.060 1.990 -5.336
172 HA PHE 27 HA PHE 27 -6.395 1.420 -3.635
173 HB2 PHE 27 1HB PHE 27 -7.850 2.266 -5.424
174 HB3 PHE 27 2HB PHE 27 -6.753 3.518 -4.851
175 HD1 PHE 27 1HD PHE 27 -4.640 3.953 -6.212
176 HD2 PHE 27 2HD PHE 27 -7.957 1.726 -7.682
177 HE1 PHE 27 1HE PHE 27 -3.871 4.336 -8.517
178 HE2 PHE 27 2HE PHE 27 -7.192 2.105 -9.989
179 HZ PHE 27 HZ PHE 27 -5.147 3.410 -10.410
180 H TRP 28 H TRP 28 -8.048 0.050 -4.867
181 HA TRP 28 HA TRP 28 -6.729 -1.868 -6.656
182 HB2 TRP 28 1HB TRP 28 -8.151 -3.633 -5.323
183 HB3 TRP 28 2HB TRP 28 -6.574 -3.126 -4.724
184 HD1 TRP 28 HD TRP 28 -10.170 -3.301 -3.744
185 HE1 TRP 28 1HE TRP 28 -10.507 -2.214 -1.435
186 HE3 TRP 28 3HE TRP 28 -5.616 -1.034 -3.241
187 HZ2 TRP 28 2HZ TRP 28 -9.037 -0.608 0.361
188 HZ3 TRP 28 3HZ TRP 28 -5.161 0.259 -1.198
189 HH2 TRP 28 HH TRP 28 -6.838 0.467 0.564
190 H GLU 29 H GLU 29 -8.630 -3.594 -7.238
191 HA GLU 29 HA GLU 29 -10.694 -1.930 -8.469
192 HB2 GLU 29 1HB GLU 29 -9.526 -4.616 -9.059
193 HB3 GLU 29 2HB GLU 29 -11.152 -4.259 -9.624
194 HG2 GLU 29 1HG GLU 29 -8.935 -2.348 -10.194
195 HG3 GLU 29 2HG GLU 29 -9.106 -3.813 -11.159
196 H GLY 30 H GLY 30 -10.562 -3.049 -5.594
197 HA2 GLY 30 1HA GLY 30 -12.134 -3.671 -4.038
198 HA3 GLY 30 2HA GLY 30 -13.352 -3.418 -5.279
199 H ALA 31 H ALA 31 -12.729 -5.580 -3.174
200 HA ALA 31 HA ALA 31 -12.296 -7.958 -4.728
201 HB1 ALA 31 3HB ALA 31 -13.484 -8.360 -2.101
202 HB2 ALA 31 1HB ALA 31 -11.954 -8.944 -2.756
203 HB3 ALA 31 2HB ALA 31 -12.057 -7.325 -2.064
204 HA PRO 32 HA PRO 32 -16.421 -8.845 -5.955
205 HB2 PRO 32 1HB PRO 32 -16.354 -11.559 -5.983
206 HB3 PRO 32 2HB PRO 32 -15.541 -10.566 -7.198
207 HG2 PRO 32 1HG PRO 32 -14.401 -11.906 -4.775
208 HG3 PRO 32 2HG PRO 32 -13.737 -11.808 -6.417
209 HD2 PRO 32 1HD PRO 32 -12.883 -10.213 -4.402
210 HD3 PRO 32 2HD PRO 32 -12.920 -9.677 -6.094
211 H ARG 33 H ARG 33 -15.279 -9.477 -2.878
212 HA ARG 33 HA ARG 33 -17.960 -10.300 -1.975
213 HB2 ARG 33 1HB ARG 33 -16.701 -11.368 -0.013
214 HB3 ARG 33 2HB ARG 33 -16.647 -12.201 -1.561
215 HG2 ARG 33 1HG ARG 33 -14.437 -10.875 -1.897
216 HG3 ARG 33 2HG ARG 33 -14.493 -10.703 -0.142
217 HD2 ARG 33 1HD ARG 33 -13.298 -12.646 -0.319
218 HD3 ARG 33 2HD ARG 33 -14.935 -13.295 -0.236
219 HE ARG 33 HE ARG 33 -14.103 -12.805 -2.922
220 HH11 ARG 33 1HH1 ARG 33 -13.868 -15.051 -0.273
221 HH12 ARG 33 2HH1 ARG 33 -13.563 -16.421 -1.289
222 HH21 ARG 33 1HH2 ARG 33 -13.703 -14.600 -4.272
223 HH22 ARG 33 2HH2 ARG 33 -13.469 -16.163 -3.564
224 HA PRO 34 HA PRO 34 -18.000 -6.790 0.659
225 HB2 PRO 34 1HB PRO 34 -19.364 -7.736 2.807
226 HB3 PRO 34 2HB PRO 34 -20.134 -7.400 1.252
227 HG2 PRO 34 1HG PRO 34 -19.213 -10.014 2.384
228 HG3 PRO 34 2HG PRO 34 -20.713 -9.637 1.516
229 HD2 PRO 34 1HD PRO 34 -18.598 -10.831 0.320
230 HD3 PRO 34 2HD PRO 34 -19.691 -9.733 -0.547
231 H VAL 35 H VAL 35 -16.911 -5.836 2.347
232 HA VAL 35 HA VAL 35 -15.315 -7.589 4.091
233 HB VAL 35 HB VAL 35 -14.316 -5.111 2.679
234 HG11 VAL 35 1HG1 VAL 35 -13.165 -4.936 4.637
235 HG12 VAL 35 2HG1 VAL 35 -13.282 -6.661 4.991
236 HG13 VAL 35 3HG1 VAL 35 -12.116 -6.081 3.801
237 HG21 VAL 35 3HG2 VAL 35 -13.508 -8.009 2.440
238 HG22 VAL 35 1HG2 VAL 35 -14.375 -7.060 1.232
239 HG23 VAL 35 2HG2 VAL 35 -12.707 -6.656 1.641
240 H ARG 36 H ARG 36 -14.806 -6.748 6.142
241 HA ARG 36 HA ARG 36 -16.629 -4.626 7.014
242 HB2 ARG 36 1HB ARG 36 -16.284 -5.488 9.270
243 HB3 ARG 36 2HB ARG 36 -16.779 -6.780 8.184
244 HG2 ARG 36 1HG ARG 36 -14.671 -7.758 8.182
245 HG3 ARG 36 2HG ARG 36 -13.886 -6.288 8.763
246 HD2 ARG 36 1HD ARG 36 -15.770 -8.032 10.346
247 HD3 ARG 36 2HD ARG 36 -14.015 -7.993 10.513
248 HE ARG 36 HE ARG 36 -15.151 -5.411 10.871
249 HH11 ARG 36 1HH1 ARG 36 -14.646 -8.471 12.454
250 HH12 ARG 36 2HH1 ARG 36 -14.673 -7.797 14.050
251 HH21 ARG 36 1HH2 ARG 36 -15.189 -4.513 12.967
252 HH22 ARG 36 2HH2 ARG 36 -14.983 -5.546 14.341
253 H LEU 37 H LEU 37 -13.239 -5.497 6.884
254 HA LEU 37 HA LEU 37 -12.521 -2.734 7.427
255 HB2 LEU 37 1HB LEU 37 -12.485 -3.699 9.638
256 HB3 LEU 37 2HB LEU 37 -11.499 -5.045 9.070
257 HG LEU 37 HG LEU 37 -9.697 -3.341 8.562
258 HD11 LEU 37 1HD1 LEU 37 -11.356 -1.415 8.668
259 HD12 LEU 37 2HD1 LEU 37 -9.807 -1.184 9.478
260 HD13 LEU 37 3HD1 LEU 37 -11.247 -1.565 10.422
261 HD21 LEU 37 3HD2 LEU 37 -9.121 -3.088 11.026
262 HD22 LEU 37 1HD2 LEU 37 -9.374 -4.729 10.432
263 HD23 LEU 37 2HD2 LEU 37 -10.640 -3.921 11.356
264 H VAL 38 H VAL 38 -10.428 -2.170 6.698
265 HA VAL 38 HA VAL 38 -9.043 -4.225 5.112
266 HB VAL 38 HB VAL 38 -9.588 -1.400 4.190
267 HG11 VAL 38 1HG1 VAL 38 -8.610 -2.271 2.040
268 HG12 VAL 38 2HG1 VAL 38 -7.463 -2.068 3.366
269 HG13 VAL 38 3HG1 VAL 38 -8.057 -3.676 2.950
270 HG21 VAL 38 3HG2 VAL 38 -10.916 -4.001 3.666
271 HG22 VAL 38 1HG2 VAL 38 -11.597 -2.377 3.747
272 HG23 VAL 38 2HG2 VAL 38 -10.722 -2.895 2.307
273 H ARG 39 H ARG 39 -7.080 -4.447 5.948
274 HA ARG 39 HA ARG 39 -5.750 -2.103 7.113
275 HB2 ARG 39 1HB ARG 39 -5.666 -5.020 7.651
276 HB3 ARG 39 2HB ARG 39 -4.156 -4.140 7.846
277 HG2 ARG 39 1HG ARG 39 -5.356 -2.567 9.366
278 HG3 ARG 39 2HG ARG 39 -6.756 -3.636 9.270
279 HD2 ARG 39 1HD ARG 39 -4.129 -4.825 9.987
280 HD3 ARG 39 2HD ARG 39 -4.957 -3.852 11.201
281 HE ARG 39 HE ARG 39 -6.636 -5.838 9.985
282 HH11 ARG 39 1HH1 ARG 39 -4.305 -5.217 12.495
283 HH12 ARG 39 2HH1 ARG 39 -4.848 -6.518 13.502
284 HH21 ARG 39 1HH2 ARG 39 -7.361 -7.554 11.302
285 HH22 ARG 39 2HH2 ARG 39 -6.586 -7.847 12.822
286 H VAL 40 H VAL 40 -3.814 -1.375 6.374
287 HA VAL 40 HA VAL 40 -2.565 -2.837 4.145
288 HB VAL 40 HB VAL 40 -2.922 0.161 4.264
289 HG11 VAL 40 1HG1 VAL 40 -2.027 0.116 1.979
290 HG12 VAL 40 2HG1 VAL 40 -0.863 -0.503 3.152
291 HG13 VAL 40 3HG1 VAL 40 -1.762 -1.621 2.124
292 HG21 VAL 40 3HG2 VAL 40 -4.972 -1.337 3.782
293 HG22 VAL 40 1HG2 VAL 40 -4.622 0.000 2.687
294 HG23 VAL 40 2HG2 VAL 40 -4.184 -1.647 2.235
295 H THR 41 H THR 41 -0.425 -3.090 4.306
296 HA THR 41 HA THR 41 1.037 -1.412 6.238
297 HB THR 41 HB THR 41 2.472 -3.431 6.703
298 HG1 THR 41 1HG THR 41 1.914 -4.765 4.990
299 HG21 THR 41 3HG2 THR 41 -0.284 -4.171 7.524
300 HG22 THR 41 1HG2 THR 41 0.301 -2.575 7.989
301 HG23 THR 41 2HG2 THR 41 1.181 -4.017 8.492
302 H TYR 42 H TYR 42 2.739 -0.398 5.408
303 HA TYR 42 HA TYR 42 3.876 -1.414 2.886
304 HB2 TYR 42 1HB TYR 42 4.568 1.002 2.518
305 HB3 TYR 42 2HB TYR 42 2.843 0.670 2.412
306 HD1 TYR 42 2HD TYR 42 1.331 1.381 4.234
307 HD2 TYR 42 1HD TYR 42 5.457 2.420 4.229
308 HE1 TYR 42 2HE TYR 42 0.889 3.119 5.916
309 HE2 TYR 42 1HE TYR 42 5.026 4.161 5.913
310 HH TYR 42 HH TYR 42 3.416 5.342 6.970
311 H VAL 43 H VAL 43 6.146 -1.156 2.561
312 HA VAL 43 HA VAL 43 7.790 -0.413 4.837
313 HB VAL 43 HB VAL 43 7.278 -2.790 5.259
314 HG11 VAL 43 1HG1 VAL 43 6.915 -3.871 3.275
315 HG12 VAL 43 2HG1 VAL 43 8.248 -3.053 2.457
316 HG13 VAL 43 3HG1 VAL 43 8.579 -4.362 3.592
317 HG21 VAL 43 3HG2 VAL 43 9.760 -3.562 5.175
318 HG22 VAL 43 1HG2 VAL 43 10.063 -1.918 4.613
319 HG23 VAL 43 2HG2 VAL 43 9.310 -2.188 6.185
320 H SER 44 H SER 44 9.903 0.095 4.289
321 HA SER 44 HA SER 44 10.333 0.774 1.542
322 HB2 SER 44 1HB SER 44 11.137 2.208 3.386
323 HB3 SER 44 2HB SER 44 12.242 0.929 3.888
324 HG SER 44 HG SER 44 12.907 2.766 2.322
325 H SER 45 H SER 45 12.218 0.141 0.294
326 HA SER 45 HA SER 45 12.466 -2.590 -0.054
327 HB2 SER 45 1HB SER 45 14.288 -2.121 -1.550
328 HB3 SER 45 2HB SER 45 13.131 -0.797 -1.695
329 HG SER 45 HG SER 45 14.981 0.263 -1.436
330 H GLU 46 H GLU 46 13.778 -4.168 0.711
331 HA GLU 46 HA GLU 46 15.091 -5.263 2.218
332 HB2 GLU 46 1HB GLU 46 16.786 -2.818 1.702
333 HB3 GLU 46 2HB GLU 46 17.348 -4.218 2.605
334 HG2 GLU 46 1HG GLU 46 16.270 -4.509 -0.170
335 HG3 GLU 46 2HG GLU 46 17.941 -4.027 0.114
336 H GLY 47 H GLY 47 13.013 -3.751 3.369
337 HA2 GLY 47 1HA GLY 47 12.333 -3.298 5.531
338 HA3 GLY 47 2HA GLY 47 13.982 -3.586 6.067
339 H GLY 48 H GLY 48 12.537 -1.571 7.208
340 HA2 GLY 48 1HA GLY 48 14.028 0.569 7.468
341 HA3 GLY 48 2HA GLY 48 13.357 0.908 5.880
342 H HIS 49 H HIS 49 11.891 2.462 6.095
343 HA HIS 49 HA HIS 49 10.368 2.819 8.497
344 HB2 HIS 49 1HB HIS 49 10.790 4.852 7.480
345 HB3 HIS 49 2HB HIS 49 10.551 4.210 5.857
346 HD1 HIS 49 1HD HIS 49 8.818 5.874 5.080
347 HD2 HIS 49 2HD HIS 49 7.784 4.004 8.643
348 HE1 HIS 49 1HE HIS 49 6.429 6.529 5.514
349 HE2 HIS 49 2HE HIS 49 5.852 5.455 7.718
350 H SER 50 H SER 50 8.933 1.228 8.917
351 HA SER 50 HA SER 50 7.076 0.436 6.778
352 HB2 SER 50 1HB SER 50 6.595 -1.546 8.168
353 HB3 SER 50 2HB SER 50 8.314 -1.420 7.792
354 HG SER 50 HG SER 50 7.181 -0.428 10.190
355 H GLY 51 H GLY 51 4.852 0.468 7.110
356 HA2 GLY 51 1HA GLY 51 3.855 1.591 9.623
357 HA3 GLY 51 2HA GLY 51 3.546 2.497 8.150
358 H GLN 52 H GLN 52 1.480 1.592 9.750
359 HA GLN 52 HA GLN 52 0.173 -0.272 7.911
360 HB2 GLN 52 1HB GLN 52 0.913 -1.696 9.710
361 HB3 GLN 52 2HB GLN 52 0.274 -0.584 10.913
362 HG2 GLN 52 1HG GLN 52 -1.978 -1.080 10.262
363 HG3 GLN 52 2HG GLN 52 -1.415 -2.057 8.907
364 HE21 GLN 52 1HE2 GLN 52 -1.148 -4.159 9.220
365 HE22 GLN 52 2HE2 GLN 52 -1.140 -4.955 10.753
366 H THR 53 H THR 53 -1.588 0.698 7.184
367 HA THR 53 HA THR 53 -2.988 2.598 8.945
368 HB THR 53 HB THR 53 -2.138 3.628 6.897
369 HG1 THR 53 1HG THR 53 -4.129 4.524 6.241
370 HG21 THR 53 3HG2 THR 53 -2.201 1.545 5.517
371 HG22 THR 53 1HG2 THR 53 -2.873 2.960 4.710
372 HG23 THR 53 2HG2 THR 53 -3.949 1.740 5.392
373 H GLU 54 H GLU 54 -5.325 2.678 8.807
374 HA GLU 54 HA GLU 54 -6.502 0.077 8.073
375 HB2 GLU 54 1HB GLU 54 -6.957 1.840 10.458
376 HB3 GLU 54 2HB GLU 54 -8.226 0.755 9.907
377 HG2 GLU 54 1HG GLU 54 -6.855 -1.157 10.270
378 HG3 GLU 54 2HG GLU 54 -5.440 -0.153 10.579
379 H ALA 55 H ALA 55 -8.394 0.061 6.945
380 HA ALA 55 HA ALA 55 -9.694 2.632 6.382
381 HB1 ALA 55 3HB ALA 55 -8.133 1.110 4.524
382 HB2 ALA 55 1HB ALA 55 -9.814 1.162 3.991
383 HB3 ALA 55 2HB ALA 55 -8.938 2.663 4.296
384 HA PRO 56 HA PRO 56 -13.499 0.499 6.855
385 HB2 PRO 56 1HB PRO 56 -15.069 1.695 4.991
386 HB3 PRO 56 2HB PRO 56 -14.558 2.503 6.477
387 HG2 PRO 56 1HG PRO 56 -13.429 2.728 3.713
388 HG3 PRO 56 2HG PRO 56 -13.750 4.008 4.899
389 HD2 PRO 56 1HD PRO 56 -11.274 2.994 4.483
390 HD3 PRO 56 2HD PRO 56 -11.811 3.582 6.070
391 H GLY 57 H GLY 57 -14.739 -1.187 6.050
392 HA2 GLY 57 1HA GLY 57 -13.618 -2.890 4.165
393 HA3 GLY 57 2HA GLY 57 -15.288 -2.964 4.705
394 H ASN 58 H ASN 58 -15.359 -0.029 3.605
395 HA ASN 58 HA ASN 58 -16.020 -0.860 0.863
396 HB2 ASN 58 1HB ASN 58 -17.284 1.455 0.988
397 HB3 ASN 58 2HB ASN 58 -17.994 0.002 1.685
398 HD21 ASN 58 1HD2 ASN 58 -18.022 -0.252 3.925
399 HD22 ASN 58 2HD2 ASN 58 -17.795 1.085 4.995
400 H ALA 59 H ALA 59 -13.375 0.055 2.046
401 HA ALA 59 HA ALA 59 -12.901 2.531 0.583
402 HB1 ALA 59 3HB ALA 59 -11.917 1.612 2.949
403 HB2 ALA 59 1HB ALA 59 -10.602 1.221 1.841
404 HB3 ALA 59 2HB ALA 59 -11.179 2.883 1.975
405 H THR 60 H THR 60 -12.446 2.405 -1.508
406 HA THR 60 HA THR 60 -11.023 0.039 -2.520
407 HB THR 60 HB THR 60 -11.839 0.676 -4.747
408 HG1 THR 60 1HG THR 60 -13.575 2.388 -4.641
409 HG21 THR 60 3HG2 THR 60 -13.690 -0.507 -4.356
410 HG22 THR 60 1HG2 THR 60 -14.411 0.818 -3.443
411 HG23 THR 60 2HG2 THR 60 -13.358 -0.342 -2.632
412 H SER 61 H SER 61 -9.974 2.631 -1.244
413 HA SER 61 HA SER 61 -7.613 2.827 -2.772
414 HB2 SER 61 1HB SER 61 -7.909 5.258 -3.451
415 HB3 SER 61 2HB SER 61 -8.835 4.086 -4.387
416 HG SER 61 HG SER 61 -10.062 5.171 -2.137
417 H ALA 62 H ALA 62 -6.019 3.600 -1.517
418 HA ALA 62 HA ALA 62 -6.688 5.361 0.727
419 HB1 ALA 62 3HB ALA 62 -4.796 3.154 1.314
420 HB2 ALA 62 1HB ALA 62 -5.933 3.988 2.374
421 HB3 ALA 62 2HB ALA 62 -6.514 2.761 1.247
422 H MET 63 H MET 63 -4.831 6.452 1.646
423 HA MET 63 HA MET 63 -2.666 6.752 -0.323
424 HB2 MET 63 1HB MET 63 -3.763 8.686 1.722
425 HB3 MET 63 2HB MET 63 -2.316 8.990 0.769
426 HG2 MET 63 1HG MET 63 -3.940 8.478 -1.237
427 HG3 MET 63 2HG MET 63 -5.165 8.950 -0.062
428 HE1 MET 63 3HE MET 63 -1.809 11.497 -1.807
429 HE2 MET 63 1HE MET 63 -1.438 10.808 -0.226
430 HE3 MET 63 2HE MET 63 -1.835 9.748 -1.579
431 H LEU 64 H LEU 64 -0.518 7.307 0.557
432 HA LEU 64 HA LEU 64 -0.036 6.259 3.253
433 HB2 LEU 64 1HB LEU 64 1.636 5.496 0.869
434 HB3 LEU 64 2HB LEU 64 1.792 4.899 2.519
435 HG LEU 64 HG LEU 64 -0.637 4.381 0.818
436 HD11 LEU 64 1HD1 LEU 64 1.977 2.945 0.952
437 HD12 LEU 64 2HD1 LEU 64 0.963 3.304 -0.445
438 HD13 LEU 64 3HD1 LEU 64 0.485 2.041 0.689
439 HD21 LEU 64 3HD2 LEU 64 -0.083 2.356 2.712
440 HD22 LEU 64 1HD2 LEU 64 -1.439 3.483 2.680
441 HD23 LEU 64 2HD2 LEU 64 0.039 3.907 3.544
442 H GLY 65 H GLY 65 1.961 6.950 4.207
443 HA2 GLY 65 1HA GLY 65 4.055 8.316 3.513
444 HA3 GLY 65 2HA GLY 65 2.849 9.528 3.108
445 HA PRO 66 HA PRO 66 4.637 10.892 3.684
446 HB2 PRO 66 1HB PRO 66 6.866 11.570 5.077
447 HB3 PRO 66 2HB PRO 66 5.391 12.545 5.091
448 HG2 PRO 66 1HG PRO 66 6.370 10.562 7.108
449 HG3 PRO 66 2HG PRO 66 5.642 12.157 7.370
450 HD2 PRO 66 1HD PRO 66 4.239 9.856 7.629
451 HD3 PRO 66 2HD PRO 66 3.498 11.368 7.067
452 H LEU 67 H LEU 67 5.678 9.668 2.253
453 HA LEU 67 HA LEU 67 7.252 7.387 3.198
454 HB2 LEU 67 1HB LEU 67 6.467 8.008 0.362
455 HB3 LEU 67 2HB LEU 67 7.022 6.470 1.020
456 HG LEU 67 HG LEU 67 4.370 7.792 1.595
457 HD11 LEU 67 1HD1 LEU 67 5.286 5.957 -0.467
458 HD12 LEU 67 2HD1 LEU 67 3.793 6.888 -0.359
459 HD13 LEU 67 3HD1 LEU 67 3.920 5.330 0.456
460 HD21 LEU 67 3HD2 LEU 67 5.534 5.169 2.521
461 HD22 LEU 67 1HD2 LEU 67 3.845 5.643 2.708
462 HD23 LEU 67 2HD2 LEU 67 5.114 6.558 3.524
463 H SER 68 H SER 68 9.048 6.886 1.350
464 HA SER 68 HA SER 68 10.858 9.173 1.523
465 HB2 SER 68 1HB SER 68 11.494 6.815 2.291
466 HB3 SER 68 2HB SER 68 11.573 6.397 0.579
467 HG SER 68 HG SER 68 13.349 7.772 2.107
468 H SER 69 H SER 69 12.493 9.206 -0.421
469 HA SER 69 HA SER 69 10.862 9.343 -2.867
470 HB2 SER 69 1HB SER 69 12.631 10.990 -3.631
471 HB3 SER 69 2HB SER 69 11.638 11.526 -2.276
472 HG SER 69 HG SER 69 14.334 10.845 -2.355
473 H SER 70 H SER 70 11.753 8.671 -4.852
474 HA SER 70 HA SER 70 12.748 7.061 -6.138
475 HB2 SER 70 1HB SER 70 14.473 8.837 -6.092
476 HB3 SER 70 2HB SER 70 15.208 8.068 -4.686
477 HG SER 70 HG SER 70 16.090 6.627 -5.944
478 H THR 71 H THR 71 11.772 6.176 -3.526
479 HA THR 71 HA THR 71 13.509 3.818 -3.198
480 HB THR 71 HB THR 71 11.983 5.238 -1.005
481 HG1 THR 71 1HG THR 71 14.018 6.197 -1.736
482 HG21 THR 71 3HG2 THR 71 12.267 2.637 -0.995
483 HG22 THR 71 1HG2 THR 71 12.601 3.566 0.466
484 HG23 THR 71 2HG2 THR 71 13.932 3.016 -0.552
485 H THR 72 H THR 72 12.526 1.943 -3.561
486 HA THR 72 HA THR 72 9.725 1.854 -4.165
487 HB THR 72 HB THR 72 11.749 -0.385 -3.970
488 HG1 THR 72 1HG THR 72 10.639 0.642 -6.355
489 HG21 THR 72 3HG2 THR 72 9.213 -0.599 -5.521
490 HG22 THR 72 1HG2 THR 72 9.153 -0.831 -3.774
491 HG23 THR 72 2HG2 THR 72 10.183 -1.863 -4.766
492 H TYR 73 H TYR 73 8.077 1.234 -2.906
493 HA TYR 73 HA TYR 73 8.718 0.084 -0.268
494 HB2 TYR 73 1HB TYR 73 6.822 2.252 -1.062
495 HB3 TYR 73 2HB TYR 73 6.396 1.217 0.296
496 HD1 TYR 73 1HD TYR 73 9.349 3.148 -0.951
497 HD2 TYR 73 2HD TYR 73 7.020 1.931 2.395
498 HE1 TYR 73 1HE TYR 73 10.767 4.512 0.524
499 HE2 TYR 73 2HE TYR 73 8.431 3.293 3.880
500 HH TYR 73 HH TYR 73 9.976 5.506 3.431
501 H THR 74 H THR 74 7.725 -1.756 0.287
502 HA THR 74 HA THR 74 5.962 -3.003 -1.658
503 HB THR 74 HB THR 74 7.025 -4.164 0.923
504 HG1 THR 74 1HG THR 74 8.734 -3.619 -0.492
505 HG21 THR 74 3HG2 THR 74 5.250 -5.138 -1.167
506 HG22 THR 74 1HG2 THR 74 5.582 -5.804 0.432
507 HG23 THR 74 2HG2 THR 74 6.646 -6.188 -0.922
508 H VAL 75 H VAL 75 3.911 -2.280 -1.509
509 HA VAL 75 HA VAL 75 2.681 -1.894 1.105
510 HB VAL 75 HB VAL 75 1.552 -1.424 -1.659
511 HG11 VAL 75 1HG1 VAL 75 0.019 0.085 -0.103
512 HG12 VAL 75 2HG1 VAL 75 -0.364 -1.605 -0.440
513 HG13 VAL 75 3HG1 VAL 75 0.426 -1.163 1.075
514 HG21 VAL 75 3HG2 VAL 75 2.932 0.342 -1.618
515 HG22 VAL 75 1HG2 VAL 75 1.803 1.014 -0.441
516 HG23 VAL 75 2HG2 VAL 75 3.251 0.170 0.108
517 H ARG 76 H ARG 76 1.263 -3.253 2.019
518 HA ARG 76 HA ARG 76 0.299 -5.525 0.407
519 HB2 ARG 76 1HB ARG 76 2.077 -5.860 2.340
520 HB3 ARG 76 2HB ARG 76 0.647 -5.786 3.361
521 HG2 ARG 76 1HG ARG 76 -0.316 -7.678 2.282
522 HG3 ARG 76 2HG ARG 76 0.936 -7.673 1.038
523 HD2 ARG 76 1HD ARG 76 1.379 -8.175 3.980
524 HD3 ARG 76 2HD ARG 76 1.319 -9.414 2.726
525 HE ARG 76 HE ARG 76 3.430 -8.778 2.019
526 HH11 ARG 76 1HH1 ARG 76 2.236 -6.583 4.443
527 HH12 ARG 76 2HH1 ARG 76 3.772 -5.822 4.696
528 HH21 ARG 76 1HH2 ARG 76 5.457 -7.784 2.344
529 HH22 ARG 76 2HH2 ARG 76 5.603 -6.506 3.501
530 H VAL 77 H VAL 77 -1.797 -5.208 0.036
531 HA VAL 77 HA VAL 77 -3.455 -3.916 2.071
532 HB VAL 77 HB VAL 77 -4.091 -4.645 -0.792
533 HG11 VAL 77 1HG1 VAL 77 -5.970 -2.854 -0.130
534 HG12 VAL 77 2HG1 VAL 77 -6.199 -4.596 0.034
535 HG13 VAL 77 3HG1 VAL 77 -5.744 -3.628 1.437
536 HG21 VAL 77 3HG2 VAL 77 -2.416 -2.742 -0.184
537 HG22 VAL 77 1HG2 VAL 77 -3.677 -2.451 -1.383
538 HG23 VAL 77 2HG2 VAL 77 -3.874 -1.858 0.267
539 H THR 78 H THR 78 -4.295 -5.246 3.537
540 HA THR 78 HA THR 78 -5.237 -7.896 2.663
541 HB THR 78 HB THR 78 -4.560 -7.006 5.473
542 HG1 THR 78 1HG THR 78 -2.822 -7.363 3.741
543 HG21 THR 78 3HG2 THR 78 -4.710 -9.862 4.715
544 HG22 THR 78 1HG2 THR 78 -6.242 -8.994 4.813
545 HG23 THR 78 2HG2 THR 78 -5.176 -9.062 6.216
546 H CYS 79 H CYS 79 -7.354 -8.257 2.631
547 HA CYS 79 HA CYS 79 -9.119 -6.337 3.982
548 HB2 CYS 79 1HB CYS 79 -9.806 -8.299 1.786
549 HB3 CYS 79 2HB CYS 79 -10.845 -7.029 2.420
550 HG CYS 79 HG CYS 79 -8.213 -5.459 1.505
551 H LEU 80 H LEU 80 -9.576 -7.056 5.974
552 HA LEU 80 HA LEU 80 -9.826 -9.852 6.582
553 HB2 LEU 80 1HB LEU 80 -10.044 -7.303 8.107
554 HB3 LEU 80 2HB LEU 80 -10.736 -8.768 8.802
555 HG LEU 80 HG LEU 80 -8.540 -8.423 9.709
556 HD11 LEU 80 1HD1 LEU 80 -9.399 -10.749 8.777
557 HD12 LEU 80 2HD1 LEU 80 -7.804 -10.565 9.504
558 HD13 LEU 80 3HD1 LEU 80 -7.976 -10.577 7.749
559 HD21 LEU 80 3HD2 LEU 80 -7.253 -8.704 7.034
560 HD22 LEU 80 1HD2 LEU 80 -6.635 -7.965 8.512
561 HD23 LEU 80 2HD2 LEU 80 -7.846 -7.123 7.544
562 H TYR 81 H TYR 81 -11.556 -10.947 5.924
563 HA TYR 81 HA TYR 81 -14.103 -9.679 5.506
564 HB2 TYR 81 1HB TYR 81 -13.375 -12.614 5.410
565 HB3 TYR 81 2HB TYR 81 -14.857 -11.893 4.793
566 HD1 TYR 81 2HD TYR 81 -14.221 -9.725 3.184
567 HD2 TYR 81 1HD TYR 81 -11.902 -13.245 3.764
568 HE1 TYR 81 2HE TYR 81 -13.141 -9.367 1.003
569 HE2 TYR 81 1HE TYR 81 -10.815 -12.896 1.586
570 HH TYR 81 HH TYR 81 -11.740 -11.452 -0.721
571 HA PRO 82 HA PRO 82 -15.877 -10.342 9.475
572 HB2 PRO 82 1HB PRO 82 -18.501 -10.445 8.786
573 HB3 PRO 82 2HB PRO 82 -17.568 -8.944 8.792
574 HG2 PRO 82 1HG PRO 82 -18.283 -10.721 6.491
575 HG3 PRO 82 2HG PRO 82 -18.312 -8.950 6.589
576 HD2 PRO 82 1HD PRO 82 -16.296 -10.312 5.399
577 HD3 PRO 82 2HD PRO 82 -16.041 -8.769 6.240
578 H GLY 83 H GLY 83 -15.778 -12.674 7.090
579 HA2 GLY 83 1HA GLY 83 -15.927 -14.865 8.755
580 HA3 GLY 83 2HA GLY 83 -17.569 -14.611 8.181
581 H GLY 84 H GLY 84 -14.233 -14.897 6.963
582 HA2 GLY 84 1HA GLY 84 -14.658 -17.032 5.270
583 HA3 GLY 84 2HA GLY 84 -15.057 -15.606 4.324
584 H GLY 85 H GLY 85 -12.532 -16.039 6.782
585 HA2 GLY 85 1HA GLY 85 -10.241 -15.915 6.631
586 HA3 GLY 85 2HA GLY 85 -10.402 -16.311 4.927
587 H SER 86 H SER 86 -9.016 -14.863 4.044
588 HA SER 86 HA SER 86 -9.882 -12.197 3.688
589 HB2 SER 86 1HB SER 86 -9.082 -11.737 5.890
590 HB3 SER 86 2HB SER 86 -7.594 -12.642 5.611
591 HG SER 86 HG SER 86 -7.808 -10.126 5.359
592 H SER 87 H SER 87 -8.420 -10.953 2.312
593 HA SER 87 HA SER 87 -6.623 -12.715 0.780
594 HB2 SER 87 1HB SER 87 -8.587 -12.039 -0.514
595 HB3 SER 87 2HB SER 87 -8.239 -10.342 -0.185
596 HG SER 87 HG SER 87 -6.815 -10.359 -1.726
597 H THR 88 H THR 88 -4.852 -11.564 -0.372
598 HA THR 88 HA THR 88 -3.963 -9.105 0.939
599 HB THR 88 HB THR 88 -2.129 -11.492 0.692
600 HG1 THR 88 1HG THR 88 -2.407 -11.208 3.160
601 HG21 THR 88 3HG2 THR 88 -1.426 -8.911 0.827
602 HG22 THR 88 1HG2 THR 88 -0.488 -10.196 1.586
603 HG23 THR 88 2HG2 THR 88 -1.617 -9.242 2.549
604 H LEU 89 H LEU 89 -3.523 -7.722 -0.638
605 HA LEU 89 HA LEU 89 -2.498 -8.757 -3.192
606 HB2 LEU 89 1HB LEU 89 -4.093 -6.336 -2.449
607 HB3 LEU 89 2HB LEU 89 -3.160 -6.365 -3.944
608 HG LEU 89 HG LEU 89 -5.079 -8.583 -3.412
609 HD11 LEU 89 1HD1 LEU 89 -5.787 -5.743 -3.890
610 HD12 LEU 89 2HD1 LEU 89 -6.663 -7.001 -3.019
611 HD13 LEU 89 3HD1 LEU 89 -6.681 -6.975 -4.782
612 HD21 LEU 89 3HD2 LEU 89 -4.624 -9.064 -5.530
613 HD22 LEU 89 1HD2 LEU 89 -3.423 -7.771 -5.524
614 HD23 LEU 89 2HD2 LEU 89 -5.075 -7.438 -6.044
615 H THR 90 H THR 90 -0.343 -8.696 -3.217
616 HA THR 90 HA THR 90 1.127 -6.637 -1.812
617 HB THR 90 HB THR 90 3.142 -7.811 -2.606
618 HG1 THR 90 1HG THR 90 2.748 -8.757 -4.495
619 HG21 THR 90 3HG2 THR 90 1.059 -9.697 -1.498
620 HG22 THR 90 1HG2 THR 90 2.012 -8.558 -0.547
621 HG23 THR 90 2HG2 THR 90 2.808 -9.891 -1.385
622 H GLY 91 H GLY 91 1.955 -4.831 -2.668
623 HA2 GLY 91 1HA GLY 91 2.304 -4.654 -5.576
624 HA3 GLY 91 2HA GLY 91 1.269 -3.471 -4.790
625 H ARG 92 H ARG 92 4.214 -3.811 -6.047
626 HA ARG 92 HA ARG 92 5.606 -2.252 -3.990
627 HB2 ARG 92 1HB ARG 92 6.502 -3.933 -6.295
628 HB3 ARG 92 2HB ARG 92 7.558 -2.654 -5.710
629 HG2 ARG 92 1HG ARG 92 7.539 -3.647 -3.482
630 HG3 ARG 92 2HG ARG 92 6.468 -4.925 -4.060
631 HD2 ARG 92 1HD ARG 92 9.227 -4.367 -5.142
632 HD3 ARG 92 2HD ARG 92 8.848 -5.608 -3.948
633 HE ARG 92 HE ARG 92 7.198 -6.258 -5.951
634 HH11 ARG 92 1HH1 ARG 92 10.589 -5.473 -5.915
635 HH12 ARG 92 2HH1 ARG 92 10.969 -6.473 -7.277
636 HH21 ARG 92 1HH2 ARG 92 7.685 -7.579 -7.745
637 HH22 ARG 92 2HH2 ARG 92 9.316 -7.671 -8.318
638 H VAL 93 H VAL 93 5.649 -0.120 -4.177
639 HA VAL 93 HA VAL 93 5.450 1.064 -6.870
640 HB VAL 93 HB VAL 93 3.434 1.520 -5.571
641 HG11 VAL 93 1HG1 VAL 93 4.253 3.326 -3.612
642 HG12 VAL 93 2HG1 VAL 93 3.603 1.704 -3.360
643 HG13 VAL 93 3HG1 VAL 93 5.347 1.952 -3.455
644 HG21 VAL 93 3HG2 VAL 93 5.125 4.010 -5.749
645 HG22 VAL 93 1HG2 VAL 93 4.369 3.222 -7.135
646 HG23 VAL 93 2HG2 VAL 93 3.367 3.900 -5.851
647 H THR 94 H THR 94 6.849 2.677 -7.417
648 HA THR 94 HA THR 94 9.060 3.150 -5.544
649 HB THR 94 HB THR 94 8.960 3.635 -8.528
650 HG1 THR 94 1HG THR 94 10.522 1.789 -8.386
651 HG21 THR 94 3HG2 THR 94 10.850 4.784 -8.273
652 HG22 THR 94 1HG2 THR 94 11.599 3.388 -7.500
653 HG23 THR 94 2HG2 THR 94 10.743 4.583 -6.525
654 H THR 95 H THR 95 8.739 4.924 -4.357
655 HA THR 95 HA THR 95 7.092 7.077 -4.948
656 HB THR 95 HB THR 95 8.581 8.360 -3.299
657 HG1 THR 95 1HG THR 95 10.297 7.357 -2.505
658 HG21 THR 95 3HG2 THR 95 7.942 6.136 -1.662
659 HG22 THR 95 1HG2 THR 95 6.717 6.232 -2.926
660 HG23 THR 95 2HG2 THR 95 7.023 7.624 -1.888
661 H LYS 96 H LYS 96 7.717 9.340 -5.357
662 HA LYS 96 HA LYS 96 9.467 9.482 -7.654
663 HB2 LYS 96 1HB LYS 96 7.910 11.702 -6.318
664 HB3 LYS 96 2HB LYS 96 8.624 11.739 -7.925
665 HG2 LYS 96 1HG LYS 96 7.080 9.685 -8.355
666 HG3 LYS 96 2HG LYS 96 6.188 10.311 -6.967
667 HD2 LYS 96 1HD LYS 96 5.591 12.256 -8.061
668 HD3 LYS 96 2HD LYS 96 6.946 12.160 -9.188
669 HE2 LYS 96 1HE LYS 96 5.897 10.441 -10.438
670 HE3 LYS 96 2HE LYS 96 4.673 10.188 -9.194
671 HZ1 LYS 96 3HZ LYS 96 4.759 12.134 -11.319
672 HZ2 LYS 96 1HZ LYS 96 4.339 12.787 -9.815
673 HZ3 LYS 96 2HZ LYS 96 3.433 11.517 -10.468
674 H LYS 97 H LYS 97 10.967 11.405 -7.840
675 HA LYS 97 HA LYS 97 12.874 11.280 -5.715
676 HB2 LYS 97 1HB LYS 97 12.713 12.627 -8.372
677 HB3 LYS 97 2HB LYS 97 13.889 13.226 -7.210
678 HG2 LYS 97 1HG LYS 97 15.140 11.305 -7.274
679 HG3 LYS 97 2HG LYS 97 13.775 10.304 -7.775
680 HD2 LYS 97 1HD LYS 97 15.222 10.492 -9.652
681 HD3 LYS 97 2HD LYS 97 13.826 11.523 -9.976
682 HE2 LYS 97 1HE LYS 97 15.514 12.949 -10.560
683 HE3 LYS 97 2HE LYS 97 15.353 13.355 -8.852
684 HZ1 LYS 97 3HZ LYS 97 17.178 11.185 -9.419
685 HZ2 LYS 97 1HZ LYS 97 17.357 12.508 -8.381
686 HZ3 LYS 97 2HZ LYS 97 17.659 12.685 -10.035
687 H ALA 98 H ALA 98 13.375 12.763 -4.172
688 HA ALA 98 HA ALA 98 11.373 14.756 -3.572
689 HB1 ALA 98 3HB ALA 98 13.922 14.108 -2.096
690 HB2 ALA 98 1HB ALA 98 12.571 15.070 -1.494
691 HB3 ALA 98 2HB ALA 98 12.357 13.347 -1.807
692 HA PRO 99 HA PRO 99 13.396 18.223 -5.376
693 HB2 PRO 99 1HB PRO 99 12.368 20.196 -3.820
694 HB3 PRO 99 2HB PRO 99 11.423 19.355 -5.054
695 HG2 PRO 99 1HG PRO 99 11.497 18.909 -2.095
696 HG3 PRO 99 2HG PRO 99 10.099 18.951 -3.185
697 HD2 PRO 99 1HD PRO 99 11.192 16.635 -2.306
698 HD3 PRO 99 2HD PRO 99 10.437 16.788 -3.906
699 H SER 100 H SER 100 14.887 19.972 -4.890
700 HA SER 100 HA SER 100 16.055 20.159 -2.269
701 HB2 SER 100 1HB SER 100 18.317 19.430 -2.955
702 HB3 SER 100 2HB SER 100 17.147 18.113 -3.048
703 HG SER 100 HG SER 100 18.396 18.144 -4.919
704 HA PRO 101 HA PRO 101 16.600 24.177 -4.105
705 HB2 PRO 101 1HB PRO 101 17.635 25.358 -1.890
706 HB3 PRO 101 2HB PRO 101 15.911 25.020 -2.081
707 HG2 PRO 101 1HG PRO 101 17.989 23.474 -0.581
708 HG3 PRO 101 2HG PRO 101 16.331 23.877 -0.100
709 HD2 PRO 101 1HD PRO 101 17.014 21.446 -1.077
710 HD3 PRO 101 2HD PRO 101 15.418 22.173 -1.355
711 H SER 102 H SER 102 18.217 24.256 -5.558
712 HA SER 102 HA SER 102 20.938 23.597 -4.799
713 HB2 SER 102 1HB SER 102 19.839 22.957 -7.020
714 HB3 SER 102 2HB SER 102 20.037 24.647 -7.480
715 HG SER 102 HG SER 102 22.242 23.234 -6.480
716 H SER 103 H SER 103 22.382 25.028 -4.125
717 HA SER 103 HA SER 103 21.842 27.885 -4.580
718 HB2 SER 103 1HB SER 103 23.305 26.440 -2.372
719 HB3 SER 103 2HB SER 103 23.464 28.178 -2.620
720 HG SER 103 HG SER 103 20.958 27.915 -2.630
721 H GLY 104 H GLY 104 24.034 29.184 -4.393
722 HA2 GLY 104 1HA GLY 104 26.419 29.085 -4.952
723 HA3 GLY 104 2HA GLY 104 26.016 27.837 -6.122
724 HA PRO 105 HA PRO 105 25.975 32.243 -7.954
725 HB2 PRO 105 1HB PRO 105 28.379 32.191 -9.213
726 HB3 PRO 105 2HB PRO 105 28.171 32.792 -7.564
727 HG2 PRO 105 1HG PRO 105 29.142 30.119 -8.498
728 HG3 PRO 105 2HG PRO 105 29.772 31.146 -7.197
729 HD2 PRO 105 1HD PRO 105 28.175 29.011 -6.724
730 HD3 PRO 105 2HD PRO 105 28.153 30.465 -5.704
731 H SER 106 H SER 106 24.320 31.088 -9.170
732 HA SER 106 HA SER 106 24.840 29.280 -11.239
733 HB2 SER 106 1HB SER 106 22.587 29.695 -10.309
734 HB3 SER 106 2HB SER 106 22.582 31.290 -11.059
735 HG SER 106 HG SER 106 21.951 28.920 -12.142
736 H SER 107 H SER 107 24.640 29.646 -13.568
737 HA SER 107 HA SER 107 26.538 31.195 -14.681
738 HB2 SER 107 1HB SER 107 25.488 30.909 -16.787
739 HB3 SER 107 2HB SER 107 24.987 29.515 -15.831
740 HG SER 107 HG SER 107 23.503 31.714 -16.699
741 H GLY 108 H GLY 108 26.967 33.293 -14.763
742 HA2 GLY 108 1HA GLY 108 24.919 35.217 -14.037
743 HA3 GLY 108 2HA GLY 108 26.627 35.551 -14.283
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -13.193 -35.298 5.165
2 HA2 GLY 1 1HA GLY 1 -13.595 -33.140 3.975
3 HA3 GLY 1 2HA GLY 1 -13.513 -32.933 5.718
4 H SER 2 H SER 2 -12.166 -32.087 2.718
5 HA SER 2 HA SER 2 -10.178 -30.423 4.082
6 HB2 SER 2 1HB SER 2 -9.644 -32.380 1.860
7 HB3 SER 2 2HB SER 2 -8.627 -30.954 2.072
8 HG SER 2 HG SER 2 -8.449 -31.731 4.340
9 H SER 3 H SER 3 -9.416 -28.622 2.763
10 HA SER 3 HA SER 3 -11.205 -27.928 0.539
11 HB2 SER 3 1HB SER 3 -12.052 -26.824 2.579
12 HB3 SER 3 2HB SER 3 -10.476 -26.070 2.818
13 HG SER 3 HG SER 3 -12.452 -25.519 0.922
14 H GLY 4 H GLY 4 -10.375 -26.129 -0.793
15 HA2 GLY 4 1HA GLY 4 -8.243 -24.712 -1.004
16 HA3 GLY 4 2HA GLY 4 -7.435 -26.271 -0.928
17 H SER 5 H SER 5 -8.948 -23.983 -2.928
18 HA SER 5 HA SER 5 -9.451 -25.806 -5.119
19 HB2 SER 5 1HB SER 5 -10.107 -23.768 -6.357
20 HB3 SER 5 2HB SER 5 -10.936 -23.888 -4.805
21 HG SER 5 HG SER 5 -10.088 -21.784 -5.214
22 H SER 6 H SER 6 -7.385 -26.671 -5.509
23 HA SER 6 HA SER 6 -5.173 -26.682 -6.178
24 HB2 SER 6 1HB SER 6 -6.402 -24.955 -8.340
25 HB3 SER 6 2HB SER 6 -4.961 -25.960 -8.493
26 HG SER 6 HG SER 6 -7.524 -26.651 -8.815
27 H GLY 7 H GLY 7 -5.133 -24.970 -4.172
28 HA2 GLY 7 1HA GLY 7 -3.731 -23.344 -3.321
29 HA3 GLY 7 2HA GLY 7 -3.101 -23.097 -4.943
30 H LEU 8 H LEU 8 -3.698 -21.057 -3.026
31 HA LEU 8 HA LEU 8 -6.187 -19.820 -3.632
32 HB2 LEU 8 1HB LEU 8 -5.497 -18.067 -2.269
33 HB3 LEU 8 2HB LEU 8 -4.698 -19.481 -1.584
34 HG LEU 8 HG LEU 8 -3.218 -17.761 -3.526
35 HD11 LEU 8 1HD1 LEU 8 -3.343 -17.157 -0.583
36 HD12 LEU 8 2HD1 LEU 8 -4.298 -16.291 -1.786
37 HD13 LEU 8 3HD1 LEU 8 -2.537 -16.236 -1.852
38 HD21 LEU 8 3HD2 LEU 8 -1.332 -18.463 -2.045
39 HD22 LEU 8 1HD2 LEU 8 -2.147 -19.792 -2.871
40 HD23 LEU 8 2HD2 LEU 8 -2.475 -19.480 -1.166
41 H ALA 9 H ALA 9 -6.149 -17.454 -4.456
42 HA ALA 9 HA ALA 9 -4.201 -16.855 -6.486
43 HB1 ALA 9 3HB ALA 9 -5.738 -16.884 -8.378
44 HB2 ALA 9 1HB ALA 9 -5.577 -18.492 -7.670
45 HB3 ALA 9 2HB ALA 9 -7.015 -17.523 -7.343
46 HA PRO 10 HA PRO 10 -5.512 -12.788 -5.428
47 HB2 PRO 10 1HB PRO 10 -4.510 -11.441 -7.562
48 HB3 PRO 10 2HB PRO 10 -3.492 -12.081 -6.266
49 HG2 PRO 10 1HG PRO 10 -4.063 -13.233 -8.970
50 HG3 PRO 10 2HG PRO 10 -2.521 -13.131 -8.099
51 HD2 PRO 10 1HD PRO 10 -3.994 -15.402 -8.195
52 HD3 PRO 10 2HD PRO 10 -2.994 -14.971 -6.793
53 HA PRO 11 HA PRO 11 -9.384 -12.535 -7.648
54 HB2 PRO 11 1HB PRO 11 -10.412 -10.507 -6.166
55 HB3 PRO 11 2HB PRO 11 -10.363 -12.181 -5.600
56 HG2 PRO 11 1HG PRO 11 -8.517 -9.912 -4.964
57 HG3 PRO 11 2HG PRO 11 -9.199 -11.137 -3.879
58 HD2 PRO 11 1HD PRO 11 -6.672 -11.287 -4.841
59 HD3 PRO 11 2HD PRO 11 -7.650 -12.728 -4.498
60 H ARG 12 H ARG 12 -7.404 -9.704 -6.847
61 HA ARG 12 HA ARG 12 -7.847 -8.663 -9.530
62 HB2 ARG 12 1HB ARG 12 -8.603 -7.201 -7.007
63 HB3 ARG 12 2HB ARG 12 -8.249 -6.351 -8.505
64 HG2 ARG 12 1HG ARG 12 -10.402 -8.424 -8.138
65 HG3 ARG 12 2HG ARG 12 -10.647 -6.677 -8.178
66 HD2 ARG 12 1HD ARG 12 -9.391 -6.883 -10.477
67 HD3 ARG 12 2HD ARG 12 -9.946 -8.554 -10.385
68 HE ARG 12 HE ARG 12 -12.101 -6.817 -9.871
69 HH11 ARG 12 1HH1 ARG 12 -10.044 -7.877 -12.472
70 HH12 ARG 12 2HH1 ARG 12 -11.236 -7.604 -13.700
71 HH21 ARG 12 1HH2 ARG 12 -13.678 -6.453 -11.478
72 HH22 ARG 12 2HH2 ARG 12 -13.302 -6.793 -13.133
73 H HIS 13 H HIS 13 -6.567 -6.389 -9.580
74 HA HIS 13 HA HIS 13 -3.905 -6.993 -8.476
75 HB2 HIS 13 1HB HIS 13 -4.411 -6.866 -11.061
76 HB3 HIS 13 2HB HIS 13 -4.287 -5.131 -10.786
77 HD1 HIS 13 1HD HIS 13 -2.125 -7.816 -9.213
78 HD2 HIS 13 2HD HIS 13 -1.834 -4.640 -11.876
79 HE1 HIS 13 1HE HIS 13 0.331 -7.566 -9.697
80 HE2 HIS 13 2HE HIS 13 0.489 -5.584 -11.243
81 H LEU 14 H LEU 14 -2.519 -4.872 -8.410
82 HA LEU 14 HA LEU 14 -4.084 -2.924 -6.864
83 HB2 LEU 14 1HB LEU 14 -1.302 -3.941 -6.714
84 HB3 LEU 14 2HB LEU 14 -1.577 -2.263 -6.253
85 HG LEU 14 HG LEU 14 -2.916 -4.664 -5.007
86 HD11 LEU 14 1HD1 LEU 14 -0.591 -4.617 -4.408
87 HD12 LEU 14 2HD1 LEU 14 -1.543 -4.054 -3.035
88 HD13 LEU 14 3HD1 LEU 14 -0.676 -2.894 -4.041
89 HD21 LEU 14 3HD2 LEU 14 -3.094 -1.710 -4.469
90 HD22 LEU 14 1HD2 LEU 14 -3.567 -2.930 -3.287
91 HD23 LEU 14 2HD2 LEU 14 -4.402 -2.835 -4.837
92 H GLY 15 H GLY 15 -3.573 -0.657 -7.067
93 HA2 GLY 15 1HA GLY 15 -2.209 0.090 -9.562
94 HA3 GLY 15 2HA GLY 15 -3.860 0.633 -9.298
95 H PHE 16 H PHE 16 -0.904 1.780 -9.329
96 HA PHE 16 HA PHE 16 -1.212 3.433 -6.914
97 HB2 PHE 16 1HB PHE 16 1.249 2.894 -8.588
98 HB3 PHE 16 2HB PHE 16 1.196 3.953 -7.183
99 HD1 PHE 16 1HD PHE 16 0.627 2.954 -4.940
100 HD2 PHE 16 2HD PHE 16 1.568 0.590 -8.352
101 HE1 PHE 16 1HE PHE 16 1.111 1.038 -3.474
102 HE2 PHE 16 2HE PHE 16 2.053 -1.330 -6.892
103 HZ PHE 16 HZ PHE 16 1.824 -1.108 -4.450
104 H SER 17 H SER 17 -1.706 5.515 -7.124
105 HA SER 17 HA SER 17 -1.152 6.867 -9.670
106 HB2 SER 17 1HB SER 17 -3.387 7.924 -9.608
107 HB3 SER 17 2HB SER 17 -3.495 6.171 -9.761
108 HG SER 17 HG SER 17 -3.515 7.250 -7.190
109 H ASP 18 H ASP 18 -1.745 9.317 -9.372
110 HA ASP 18 HA ASP 18 -0.817 11.224 -8.471
111 HB2 ASP 18 1HB ASP 18 -3.118 10.663 -7.313
112 HB3 ASP 18 2HB ASP 18 -2.107 10.439 -5.889
113 H VAL 19 H VAL 19 0.888 8.869 -8.205
114 HA VAL 19 HA VAL 19 2.056 8.676 -5.660
115 HB VAL 19 HB VAL 19 3.365 8.231 -8.347
116 HG11 VAL 19 1HG1 VAL 19 4.675 6.558 -6.793
117 HG12 VAL 19 2HG1 VAL 19 5.168 8.247 -6.933
118 HG13 VAL 19 3HG1 VAL 19 4.221 7.716 -5.542
119 HG21 VAL 19 3HG2 VAL 19 2.869 5.770 -7.506
120 HG22 VAL 19 1HG2 VAL 19 1.558 6.587 -6.655
121 HG23 VAL 19 2HG2 VAL 19 1.673 6.698 -8.411
122 H SER 20 H SER 20 3.737 9.719 -4.676
123 HA SER 20 HA SER 20 4.937 12.002 -6.086
124 HB2 SER 20 1HB SER 20 3.563 11.999 -3.411
125 HB3 SER 20 2HB SER 20 4.822 13.179 -3.775
126 HG SER 20 HG SER 20 2.310 12.829 -5.006
127 H HIS 21 H HIS 21 6.823 12.904 -4.717
128 HA HIS 21 HA HIS 21 8.595 10.685 -4.188
129 HB2 HIS 21 1HB HIS 21 10.309 12.483 -3.882
130 HB3 HIS 21 2HB HIS 21 9.495 12.530 -5.444
131 HD1 HIS 21 1HD HIS 21 8.109 14.595 -5.987
132 HD2 HIS 21 2HD HIS 21 9.640 14.609 -2.125
133 HE1 HIS 21 1HE HIS 21 7.708 16.919 -5.113
134 HE2 HIS 21 2HE HIS 21 8.719 16.928 -2.806
135 H ASP 22 H ASP 22 6.341 12.160 -2.366
136 HA ASP 22 HA ASP 22 7.836 11.639 0.115
137 HB2 ASP 22 1HB ASP 22 6.668 13.514 1.194
138 HB3 ASP 22 2HB ASP 22 7.637 14.064 -0.171
139 H ALA 23 H ALA 23 5.447 10.592 -1.777
140 HA ALA 23 HA ALA 23 4.247 8.982 0.197
141 HB1 ALA 23 3HB ALA 23 3.003 11.578 -0.255
142 HB2 ALA 23 1HB ALA 23 1.894 10.224 -0.474
143 HB3 ALA 23 2HB ALA 23 2.762 10.416 1.049
144 H ALA 24 H ALA 24 2.196 7.885 -0.726
145 HA ALA 24 HA ALA 24 1.975 7.867 -3.600
146 HB1 ALA 24 3HB ALA 24 3.674 5.941 -2.229
147 HB2 ALA 24 1HB ALA 24 2.428 5.181 -3.220
148 HB3 ALA 24 2HB ALA 24 3.555 6.329 -3.945
149 H ARG 25 H ARG 25 -0.055 7.385 -4.147
150 HA ARG 25 HA ARG 25 -1.837 6.347 -2.082
151 HB2 ARG 25 1HB ARG 25 -2.344 8.435 -3.447
152 HB3 ARG 25 2HB ARG 25 -2.617 7.360 -4.812
153 HG2 ARG 25 1HG ARG 25 -4.541 6.480 -3.913
154 HG3 ARG 25 2HG ARG 25 -4.073 6.875 -2.258
155 HD2 ARG 25 1HD ARG 25 -5.806 8.376 -2.808
156 HD3 ARG 25 2HD ARG 25 -4.313 9.308 -2.917
157 HE ARG 25 HE ARG 25 -4.768 8.364 -5.454
158 HH11 ARG 25 1HH1 ARG 25 -6.501 10.325 -3.159
159 HH12 ARG 25 2HH1 ARG 25 -7.327 11.246 -4.372
160 HH21 ARG 25 1HH2 ARG 25 -5.849 9.570 -7.061
161 HH22 ARG 25 2HH2 ARG 25 -6.956 10.815 -6.591
162 H VAL 26 H VAL 26 -2.824 4.408 -2.167
163 HA VAL 26 HA VAL 26 -2.305 2.731 -4.536
164 HB VAL 26 HB VAL 26 -1.079 1.771 -2.759
165 HG11 VAL 26 1HG1 VAL 26 -1.590 2.416 -0.688
166 HG12 VAL 26 2HG1 VAL 26 -3.254 2.796 -1.136
167 HG13 VAL 26 3HG1 VAL 26 -2.813 1.145 -0.697
168 HG21 VAL 26 3HG2 VAL 26 -2.112 -0.383 -2.461
169 HG22 VAL 26 1HG2 VAL 26 -3.703 0.287 -2.823
170 HG23 VAL 26 2HG2 VAL 26 -2.473 0.202 -4.084
171 H PHE 27 H PHE 27 -3.993 1.800 -5.529
172 HA PHE 27 HA PHE 27 -6.577 1.695 -4.148
173 HB2 PHE 27 1HB PHE 27 -7.759 2.691 -5.966
174 HB3 PHE 27 2HB PHE 27 -6.416 3.765 -5.591
175 HD1 PHE 27 2HD PHE 27 -7.699 1.284 -7.981
176 HD2 PHE 27 1HD PHE 27 -4.674 4.164 -7.161
177 HE1 PHE 27 2HE PHE 27 -6.966 1.177 -10.327
178 HE2 PHE 27 1HE PHE 27 -3.937 4.062 -9.507
179 HZ PHE 27 HZ PHE 27 -5.082 2.566 -11.093
180 H TRP 28 H TRP 28 -7.994 0.087 -4.885
181 HA TRP 28 HA TRP 28 -6.795 -1.869 -6.735
182 HB2 TRP 28 1HB TRP 28 -8.224 -3.537 -5.304
183 HB3 TRP 28 2HB TRP 28 -6.648 -3.006 -4.723
184 HD1 TRP 28 HD TRP 28 -10.282 -3.035 -3.803
185 HE1 TRP 28 1HE TRP 28 -10.617 -1.846 -1.545
186 HE3 TRP 28 3HE TRP 28 -5.647 -0.939 -3.294
187 HZ2 TRP 28 2HZ TRP 28 -9.115 -0.232 0.218
188 HZ3 TRP 28 3HZ TRP 28 -5.177 0.413 -1.293
189 HH2 TRP 28 HH TRP 28 -6.876 0.758 0.426
190 H GLU 29 H GLU 29 -8.398 -3.322 -7.771
191 HA GLU 29 HA GLU 29 -10.581 -1.757 -8.815
192 HB2 GLU 29 1HB GLU 29 -9.300 -4.359 -9.476
193 HB3 GLU 29 2HB GLU 29 -10.963 -4.122 -9.993
194 HG2 GLU 29 1HG GLU 29 -10.299 -2.089 -11.181
195 HG3 GLU 29 2HG GLU 29 -8.630 -2.348 -10.677
196 H GLY 30 H GLY 30 -10.428 -3.049 -5.976
197 HA2 GLY 30 1HA GLY 30 -12.067 -3.643 -4.465
198 HA3 GLY 30 2HA GLY 30 -13.246 -3.496 -5.760
199 H ALA 31 H ALA 31 -13.192 -5.520 -3.738
200 HA ALA 31 HA ALA 31 -12.363 -7.927 -5.185
201 HB1 ALA 31 3HB ALA 31 -11.649 -8.342 -3.088
202 HB2 ALA 31 1HB ALA 31 -12.824 -7.249 -2.356
203 HB3 ALA 31 2HB ALA 31 -13.314 -8.872 -2.847
204 HA PRO 32 HA PRO 32 -16.415 -9.083 -6.413
205 HB2 PRO 32 1HB PRO 32 -16.322 -11.782 -6.141
206 HB3 PRO 32 2HB PRO 32 -15.466 -10.916 -7.422
207 HG2 PRO 32 1HG PRO 32 -14.420 -11.969 -4.823
208 HG3 PRO 32 2HG PRO 32 -13.686 -12.041 -6.436
209 HD2 PRO 32 1HD PRO 32 -12.935 -10.224 -4.574
210 HD3 PRO 32 2HD PRO 32 -12.904 -9.876 -6.315
211 H ARG 33 H ARG 33 -15.345 -9.545 -3.234
212 HA ARG 33 HA ARG 33 -18.102 -10.077 -2.353
213 HB2 ARG 33 1HB ARG 33 -17.074 -11.294 -0.386
214 HB3 ARG 33 2HB ARG 33 -16.961 -12.116 -1.936
215 HG2 ARG 33 1HG ARG 33 -14.651 -11.399 -2.171
216 HG3 ARG 33 2HG ARG 33 -14.758 -10.522 -0.644
217 HD2 ARG 33 1HD ARG 33 -14.724 -13.471 -1.139
218 HD3 ARG 33 2HD ARG 33 -13.745 -12.515 -0.028
219 HE ARG 33 HE ARG 33 -15.446 -12.617 1.532
220 HH11 ARG 33 1HH1 ARG 33 -16.520 -13.910 -1.516
221 HH12 ARG 33 2HH1 ARG 33 -17.969 -14.598 -0.862
222 HH21 ARG 33 1HH2 ARG 33 -17.351 -13.518 2.405
223 HH22 ARG 33 2HH2 ARG 33 -18.441 -14.373 1.368
224 HA PRO 34 HA PRO 34 -17.741 -6.527 0.201
225 HB2 PRO 34 1HB PRO 34 -19.275 -7.238 2.325
226 HB3 PRO 34 2HB PRO 34 -19.952 -6.835 0.742
227 HG2 PRO 34 1HG PRO 34 -19.419 -9.523 1.946
228 HG3 PRO 34 2HG PRO 34 -20.831 -8.969 1.028
229 HD2 PRO 34 1HD PRO 34 -18.863 -10.458 -0.085
230 HD3 PRO 34 2HD PRO 34 -19.776 -9.243 -1.003
231 H VAL 35 H VAL 35 -16.490 -5.701 1.818
232 HA VAL 35 HA VAL 35 -15.093 -7.642 3.544
233 HB VAL 35 HB VAL 35 -13.994 -4.997 2.590
234 HG11 VAL 35 1HG1 VAL 35 -12.828 -5.462 4.516
235 HG12 VAL 35 2HG1 VAL 35 -12.966 -7.209 4.307
236 HG13 VAL 35 3HG1 VAL 35 -11.835 -6.288 3.316
237 HG21 VAL 35 3HG2 VAL 35 -12.571 -7.244 1.555
238 HG22 VAL 35 1HG2 VAL 35 -14.278 -7.404 1.140
239 HG23 VAL 35 2HG2 VAL 35 -13.391 -5.952 0.677
240 H ARG 36 H ARG 36 -14.602 -7.009 5.678
241 HA ARG 36 HA ARG 36 -16.479 -5.049 6.756
242 HB2 ARG 36 1HB ARG 36 -15.808 -6.046 8.964
243 HB3 ARG 36 2HB ARG 36 -16.572 -7.169 7.848
244 HG2 ARG 36 1HG ARG 36 -14.595 -8.305 7.433
245 HG3 ARG 36 2HG ARG 36 -13.594 -6.962 7.988
246 HD2 ARG 36 1HD ARG 36 -15.397 -8.588 9.774
247 HD3 ARG 36 2HD ARG 36 -13.675 -8.901 9.555
248 HE ARG 36 HE ARG 36 -14.213 -6.205 10.342
249 HH11 ARG 36 1HH1 ARG 36 -13.825 -9.463 11.504
250 HH12 ARG 36 2HH1 ARG 36 -13.338 -8.977 13.094
251 HH21 ARG 36 1HH2 ARG 36 -13.572 -5.552 12.432
252 HH22 ARG 36 2HH2 ARG 36 -13.195 -6.753 13.621
253 H LEU 37 H LEU 37 -13.026 -5.740 6.620
254 HA LEU 37 HA LEU 37 -12.449 -2.957 7.185
255 HB2 LEU 37 1HB LEU 37 -12.554 -4.154 9.396
256 HB3 LEU 37 2HB LEU 37 -11.171 -5.107 8.861
257 HG LEU 37 HG LEU 37 -9.879 -2.976 8.662
258 HD11 LEU 37 1HD1 LEU 37 -10.826 -1.056 10.007
259 HD12 LEU 37 2HD1 LEU 37 -12.388 -1.866 9.891
260 HD13 LEU 37 3HD1 LEU 37 -11.559 -1.337 8.427
261 HD21 LEU 37 3HD2 LEU 37 -9.569 -2.707 11.097
262 HD22 LEU 37 1HD2 LEU 37 -9.597 -4.398 10.594
263 HD23 LEU 37 2HD2 LEU 37 -11.014 -3.684 11.366
264 H VAL 38 H VAL 38 -10.334 -2.324 6.574
265 HA VAL 38 HA VAL 38 -8.827 -4.342 5.047
266 HB VAL 38 HB VAL 38 -9.195 -1.473 4.184
267 HG11 VAL 38 1HG1 VAL 38 -8.421 -3.274 2.108
268 HG12 VAL 38 2HG1 VAL 38 -7.560 -1.867 2.735
269 HG13 VAL 38 3HG1 VAL 38 -7.316 -3.452 3.470
270 HG21 VAL 38 3HG2 VAL 38 -10.426 -2.893 2.262
271 HG22 VAL 38 1HG2 VAL 38 -10.801 -3.894 3.665
272 HG23 VAL 38 2HG2 VAL 38 -11.270 -2.194 3.643
273 H ARG 39 H ARG 39 -6.995 -4.626 6.147
274 HA ARG 39 HA ARG 39 -5.701 -2.311 7.398
275 HB2 ARG 39 1HB ARG 39 -6.212 -4.635 8.546
276 HB3 ARG 39 2HB ARG 39 -4.710 -5.105 7.761
277 HG2 ARG 39 1HG ARG 39 -3.438 -3.642 9.021
278 HG3 ARG 39 2HG ARG 39 -4.824 -2.625 9.421
279 HD2 ARG 39 1HD ARG 39 -4.763 -5.459 10.353
280 HD3 ARG 39 2HD ARG 39 -3.803 -4.249 11.203
281 HE ARG 39 HE ARG 39 -6.322 -3.172 10.988
282 HH11 ARG 39 1HH1 ARG 39 -4.924 -6.045 12.370
283 HH12 ARG 39 2HH1 ARG 39 -6.110 -6.175 13.626
284 HH21 ARG 39 1HH2 ARG 39 -7.889 -3.332 12.637
285 HH22 ARG 39 2HH2 ARG 39 -7.797 -4.632 13.776
286 H VAL 40 H VAL 40 -4.335 -1.299 6.074
287 HA VAL 40 HA VAL 40 -2.742 -2.867 4.176
288 HB VAL 40 HB VAL 40 -3.130 0.126 4.342
289 HG11 VAL 40 1HG1 VAL 40 -1.029 -0.274 3.331
290 HG12 VAL 40 2HG1 VAL 40 -1.659 -1.623 2.384
291 HG13 VAL 40 3HG1 VAL 40 -2.158 0.027 2.010
292 HG21 VAL 40 3HG2 VAL 40 -4.868 -1.864 3.390
293 HG22 VAL 40 1HG2 VAL 40 -4.996 -0.119 3.163
294 HG23 VAL 40 2HG2 VAL 40 -4.160 -1.106 1.964
295 H THR 41 H THR 41 -0.492 -2.650 4.041
296 HA THR 41 HA THR 41 0.887 -1.144 6.119
297 HB THR 41 HB THR 41 2.233 -3.066 6.838
298 HG1 THR 41 1HG THR 41 1.979 -5.014 5.962
299 HG21 THR 41 3HG2 THR 41 -0.753 -3.390 7.119
300 HG22 THR 41 1HG2 THR 41 0.343 -2.551 8.215
301 HG23 THR 41 2HG2 THR 41 0.425 -4.305 8.059
302 H TYR 42 H TYR 42 2.624 -0.186 5.291
303 HA TYR 42 HA TYR 42 3.750 -1.264 2.792
304 HB2 TYR 42 1HB TYR 42 4.612 1.133 2.515
305 HB3 TYR 42 2HB TYR 42 2.884 0.872 2.304
306 HD1 TYR 42 2HD TYR 42 1.316 1.514 4.149
307 HD2 TYR 42 1HD TYR 42 5.438 2.567 4.212
308 HE1 TYR 42 2HE TYR 42 0.846 3.232 5.846
309 HE2 TYR 42 1HE TYR 42 4.979 4.286 5.910
310 HH TYR 42 HH TYR 42 3.082 5.635 6.698
311 H VAL 43 H VAL 43 6.027 -1.169 2.488
312 HA VAL 43 HA VAL 43 7.710 -0.539 4.767
313 HB VAL 43 HB VAL 43 7.002 -2.890 5.159
314 HG11 VAL 43 1HG1 VAL 43 7.854 -4.652 3.691
315 HG12 VAL 43 2HG1 VAL 43 6.744 -3.581 2.833
316 HG13 VAL 43 3HG1 VAL 43 8.484 -3.429 2.587
317 HG21 VAL 43 3HG2 VAL 43 9.746 -3.487 4.677
318 HG22 VAL 43 1HG2 VAL 43 9.612 -1.799 5.169
319 HG23 VAL 43 2HG2 VAL 43 8.956 -3.073 6.198
320 H SER 44 H SER 44 9.817 -0.097 4.212
321 HA SER 44 HA SER 44 10.351 0.701 1.584
322 HB2 SER 44 1HB SER 44 12.422 1.403 2.362
323 HB3 SER 44 2HB SER 44 11.492 1.351 3.859
324 HG SER 44 HG SER 44 12.384 -0.997 3.781
325 H SER 45 H SER 45 12.604 -0.094 0.587
326 HA SER 45 HA SER 45 12.120 -2.857 -0.152
327 HB2 SER 45 1HB SER 45 12.606 -1.079 -1.855
328 HB3 SER 45 2HB SER 45 14.242 -0.975 -1.206
329 HG SER 45 HG SER 45 13.011 -3.090 -2.597
330 H GLU 46 H GLU 46 14.401 -0.987 1.692
331 HA GLU 46 HA GLU 46 16.185 -3.291 1.974
332 HB2 GLU 46 1HB GLU 46 16.484 -0.424 2.887
333 HB3 GLU 46 2HB GLU 46 17.678 -1.687 3.153
334 HG2 GLU 46 1HG GLU 46 17.739 -1.973 0.642
335 HG3 GLU 46 2HG GLU 46 16.811 -0.477 0.548
336 H GLY 47 H GLY 47 13.482 -3.127 3.186
337 HA2 GLY 47 1HA GLY 47 12.435 -3.357 5.240
338 HA3 GLY 47 2HA GLY 47 13.773 -4.464 5.508
339 H GLY 48 H GLY 48 12.788 -1.077 5.835
340 HA2 GLY 48 1HA GLY 48 14.364 -0.950 8.306
341 HA3 GLY 48 2HA GLY 48 14.662 0.261 7.068
342 H HIS 49 H HIS 49 12.061 0.719 6.186
343 HA HIS 49 HA HIS 49 10.758 1.780 8.606
344 HB2 HIS 49 1HB HIS 49 11.586 3.719 7.625
345 HB3 HIS 49 2HB HIS 49 11.362 3.108 5.988
346 HD1 HIS 49 1HD HIS 49 9.610 4.391 4.830
347 HD2 HIS 49 2HD HIS 49 8.749 3.927 8.868
348 HE1 HIS 49 1HE HIS 49 7.400 5.537 5.182
349 HE2 HIS 49 2HE HIS 49 6.941 5.317 7.649
350 H SER 50 H SER 50 8.741 1.112 8.894
351 HA SER 50 HA SER 50 7.060 0.516 6.581
352 HB2 SER 50 1HB SER 50 6.428 -1.662 7.356
353 HB3 SER 50 2HB SER 50 8.191 -1.614 7.337
354 HG SER 50 HG SER 50 6.545 -2.076 9.401
355 H GLY 51 H GLY 51 4.777 0.369 7.110
356 HA2 GLY 51 1HA GLY 51 4.061 1.473 9.740
357 HA3 GLY 51 2HA GLY 51 3.524 2.305 8.288
358 H GLN 52 H GLN 52 1.363 1.956 9.134
359 HA GLN 52 HA GLN 52 0.098 -0.264 7.922
360 HB2 GLN 52 1HB GLN 52 0.945 -1.511 9.814
361 HB3 GLN 52 2HB GLN 52 0.315 -0.312 10.935
362 HG2 GLN 52 1HG GLN 52 -1.954 -0.896 10.334
363 HG3 GLN 52 2HG GLN 52 -1.362 -2.041 9.131
364 HE21 GLN 52 1HE2 GLN 52 -0.903 -4.061 9.740
365 HE22 GLN 52 2HE2 GLN 52 -0.939 -4.637 11.369
366 H THR 53 H THR 53 -1.806 0.486 7.289
367 HA THR 53 HA THR 53 -3.176 2.468 8.987
368 HB THR 53 HB THR 53 -2.243 3.545 6.977
369 HG1 THR 53 1HG THR 53 -4.458 4.215 6.148
370 HG21 THR 53 3HG2 THR 53 -3.175 2.988 4.764
371 HG22 THR 53 1HG2 THR 53 -4.026 1.620 5.480
372 HG23 THR 53 2HG2 THR 53 -2.263 1.646 5.455
373 H GLU 54 H GLU 54 -5.481 2.475 8.893
374 HA GLU 54 HA GLU 54 -6.618 -0.077 7.952
375 HB2 GLU 54 1HB GLU 54 -7.208 1.543 10.420
376 HB3 GLU 54 2HB GLU 54 -8.347 0.355 9.802
377 HG2 GLU 54 1HG GLU 54 -7.230 -0.936 11.293
378 HG3 GLU 54 2HG GLU 54 -6.225 -1.206 9.870
379 H ALA 55 H ALA 55 -8.470 -0.037 6.773
380 HA ALA 55 HA ALA 55 -9.898 2.497 6.455
381 HB1 ALA 55 3HB ALA 55 -8.261 1.186 4.399
382 HB2 ALA 55 1HB ALA 55 -9.878 1.661 3.877
383 HB3 ALA 55 2HB ALA 55 -8.775 2.866 4.544
384 HA PRO 56 HA PRO 56 -13.502 -0.010 6.430
385 HB2 PRO 56 1HB PRO 56 -15.149 1.436 4.828
386 HB3 PRO 56 2HB PRO 56 -14.717 1.940 6.466
387 HG2 PRO 56 1HG PRO 56 -13.588 2.846 3.846
388 HG3 PRO 56 2HG PRO 56 -14.021 3.809 5.270
389 HD2 PRO 56 1HD PRO 56 -11.468 3.105 4.710
390 HD3 PRO 56 2HD PRO 56 -12.064 3.292 6.371
391 H GLY 57 H GLY 57 -14.489 -1.637 5.288
392 HA2 GLY 57 1HA GLY 57 -13.241 -2.734 3.068
393 HA3 GLY 57 2HA GLY 57 -14.875 -3.125 3.584
394 H ASN 58 H ASN 58 -15.309 -0.045 3.156
395 HA ASN 58 HA ASN 58 -16.271 -0.373 0.436
396 HB2 ASN 58 1HB ASN 58 -17.803 0.620 2.019
397 HB3 ASN 58 2HB ASN 58 -16.621 1.852 2.454
398 HD21 ASN 58 1HD2 ASN 58 -15.993 3.372 0.780
399 HD22 ASN 58 2HD2 ASN 58 -17.150 3.822 -0.422
400 H ALA 59 H ALA 59 -13.704 1.207 2.132
401 HA ALA 59 HA ALA 59 -13.078 3.163 0.165
402 HB1 ALA 59 3HB ALA 59 -11.927 3.851 1.942
403 HB2 ALA 59 1HB ALA 59 -11.978 2.253 2.687
404 HB3 ALA 59 2HB ALA 59 -10.720 2.639 1.513
405 H THR 60 H THR 60 -12.456 2.699 -1.835
406 HA THR 60 HA THR 60 -10.929 0.248 -2.339
407 HB THR 60 HB THR 60 -11.398 0.822 -4.777
408 HG1 THR 60 1HG THR 60 -13.473 2.211 -4.742
409 HG21 THR 60 3HG2 THR 60 -13.065 -0.345 -2.770
410 HG22 THR 60 1HG2 THR 60 -12.937 -0.760 -4.479
411 HG23 THR 60 2HG2 THR 60 -14.082 0.475 -3.954
412 H SER 61 H SER 61 -9.880 2.860 -1.234
413 HA SER 61 HA SER 61 -7.419 2.870 -2.645
414 HB2 SER 61 1HB SER 61 -7.571 5.317 -3.344
415 HB3 SER 61 2HB SER 61 -8.490 4.173 -4.323
416 HG SER 61 HG SER 61 -9.770 5.358 -2.142
417 H ALA 62 H ALA 62 -5.829 3.624 -1.361
418 HA ALA 62 HA ALA 62 -6.522 5.393 0.872
419 HB1 ALA 62 3HB ALA 62 -6.206 3.856 2.439
420 HB2 ALA 62 1HB ALA 62 -6.061 2.637 1.172
421 HB3 ALA 62 2HB ALA 62 -4.620 3.455 1.780
422 H MET 63 H MET 63 -4.693 6.486 1.814
423 HA MET 63 HA MET 63 -2.504 6.806 -0.117
424 HB2 MET 63 1HB MET 63 -3.605 8.643 2.007
425 HB3 MET 63 2HB MET 63 -2.106 8.968 1.148
426 HG2 MET 63 1HG MET 63 -3.671 8.594 -0.956
427 HG3 MET 63 2HG MET 63 -4.908 9.088 0.197
428 HE1 MET 63 3HE MET 63 -1.681 11.505 -1.810
429 HE2 MET 63 1HE MET 63 -1.031 10.675 -0.396
430 HE3 MET 63 2HE MET 63 -1.816 9.751 -1.677
431 H LEU 64 H LEU 64 -0.339 7.246 0.758
432 HA LEU 64 HA LEU 64 0.151 6.122 3.416
433 HB2 LEU 64 1HB LEU 64 1.826 5.295 1.069
434 HB3 LEU 64 2HB LEU 64 1.769 4.588 2.683
435 HG LEU 64 HG LEU 64 -0.522 4.433 0.733
436 HD11 LEU 64 1HD1 LEU 64 1.934 3.234 0.374
437 HD12 LEU 64 2HD1 LEU 64 0.404 2.707 -0.327
438 HD13 LEU 64 3HD1 LEU 64 0.979 1.986 1.176
439 HD21 LEU 64 3HD2 LEU 64 -0.101 3.654 3.485
440 HD22 LEU 64 1HD2 LEU 64 -0.516 2.268 2.476
441 HD23 LEU 64 2HD2 LEU 64 -1.585 3.670 2.531
442 H GLY 65 H GLY 65 2.076 6.813 4.402
443 HA2 GLY 65 1HA GLY 65 4.269 8.044 3.573
444 HA3 GLY 65 2HA GLY 65 3.092 9.324 3.313
445 HA PRO 66 HA PRO 66 4.796 10.707 3.810
446 HB2 PRO 66 1HB PRO 66 7.120 11.398 5.031
447 HB3 PRO 66 2HB PRO 66 5.621 12.312 5.233
448 HG2 PRO 66 1HG PRO 66 6.850 10.266 7.040
449 HG3 PRO 66 2HG PRO 66 6.095 11.816 7.455
450 HD2 PRO 66 1HD PRO 66 4.802 9.451 7.712
451 HD3 PRO 66 2HD PRO 66 3.960 10.960 7.304
452 H LEU 67 H LEU 67 5.818 9.673 2.221
453 HA LEU 67 HA LEU 67 7.508 7.373 2.885
454 HB2 LEU 67 1HB LEU 67 6.288 8.209 0.258
455 HB3 LEU 67 2HB LEU 67 7.236 6.747 0.527
456 HG LEU 67 HG LEU 67 4.529 7.373 1.705
457 HD11 LEU 67 1HD1 LEU 67 5.078 6.511 -0.805
458 HD12 LEU 67 2HD1 LEU 67 3.607 6.123 0.086
459 HD13 LEU 67 3HD1 LEU 67 4.949 4.980 0.060
460 HD21 LEU 67 3HD2 LEU 67 5.993 6.112 3.248
461 HD22 LEU 67 1HD2 LEU 67 6.205 4.883 2.000
462 HD23 LEU 67 2HD2 LEU 67 4.608 5.173 2.690
463 H SER 68 H SER 68 9.239 7.031 1.014
464 HA SER 68 HA SER 68 10.888 9.453 1.062
465 HB2 SER 68 1HB SER 68 11.636 7.076 1.892
466 HB3 SER 68 2HB SER 68 11.915 6.779 0.177
467 HG SER 68 HG SER 68 13.725 7.789 0.463
468 H SER 69 H SER 69 12.534 9.357 -0.937
469 HA SER 69 HA SER 69 10.819 9.376 -3.325
470 HB2 SER 69 1HB SER 69 12.439 10.972 -4.269
471 HB3 SER 69 2HB SER 69 11.796 11.550 -2.732
472 HG SER 69 HG SER 69 13.848 10.271 -1.979
473 H SER 70 H SER 70 11.715 8.674 -5.349
474 HA SER 70 HA SER 70 12.545 6.895 -6.548
475 HB2 SER 70 1HB SER 70 14.305 8.598 -6.751
476 HB3 SER 70 2HB SER 70 15.079 7.978 -5.292
477 HG SER 70 HG SER 70 14.965 5.883 -6.648
478 H THR 71 H THR 71 11.707 6.225 -3.814
479 HA THR 71 HA THR 71 13.452 3.889 -3.371
480 HB THR 71 HB THR 71 11.843 5.389 -1.295
481 HG1 THR 71 1HG THR 71 14.046 6.146 -2.229
482 HG21 THR 71 3HG2 THR 71 13.859 3.471 -0.401
483 HG22 THR 71 1HG2 THR 71 12.520 2.726 -1.273
484 HG23 THR 71 2HG2 THR 71 12.203 3.713 0.154
485 H THR 72 H THR 72 12.519 1.984 -3.694
486 HA THR 72 HA THR 72 9.779 1.749 -4.402
487 HB THR 72 HB THR 72 11.652 -0.508 -3.674
488 HG1 THR 72 1HG THR 72 11.506 1.148 -5.923
489 HG21 THR 72 3HG2 THR 72 9.781 -0.956 -5.836
490 HG22 THR 72 1HG2 THR 72 8.948 -0.506 -4.349
491 HG23 THR 72 2HG2 THR 72 10.040 -1.891 -4.364
492 H TYR 73 H TYR 73 8.037 1.148 -3.240
493 HA TYR 73 HA TYR 73 8.467 0.390 -0.426
494 HB2 TYR 73 1HB TYR 73 6.590 2.393 -1.625
495 HB3 TYR 73 2HB TYR 73 6.131 1.554 -0.148
496 HD1 TYR 73 2HD TYR 73 7.347 1.940 1.932
497 HD2 TYR 73 1HD TYR 73 8.387 4.015 -1.633
498 HE1 TYR 73 2HE TYR 73 8.661 3.543 3.256
499 HE2 TYR 73 1HE TYR 73 9.706 5.623 -0.320
500 HH TYR 73 HH TYR 73 9.953 5.343 3.215
501 H THR 74 H THR 74 7.798 -1.607 -0.061
502 HA THR 74 HA THR 74 5.996 -2.947 -1.865
503 HB THR 74 HB THR 74 7.194 -3.929 0.734
504 HG1 THR 74 1HG THR 74 8.039 -4.731 -1.832
505 HG21 THR 74 3HG2 THR 74 5.333 -5.106 -1.201
506 HG22 THR 74 1HG2 THR 74 5.673 -5.565 0.467
507 HG23 THR 74 2HG2 THR 74 6.728 -6.119 -0.832
508 H VAL 75 H VAL 75 3.961 -2.098 -1.699
509 HA VAL 75 HA VAL 75 2.713 -1.623 0.851
510 HB VAL 75 HB VAL 75 1.398 -1.693 -1.866
511 HG11 VAL 75 1HG1 VAL 75 0.415 0.138 0.194
512 HG12 VAL 75 2HG1 VAL 75 -0.472 -0.940 -0.886
513 HG13 VAL 75 3HG1 VAL 75 0.239 -1.569 0.601
514 HG21 VAL 75 3HG2 VAL 75 3.344 0.131 -0.824
515 HG22 VAL 75 1HG2 VAL 75 2.537 0.140 -2.393
516 HG23 VAL 75 2HG2 VAL 75 1.799 0.960 -1.017
517 H ARG 76 H ARG 76 1.185 -2.836 1.879
518 HA ARG 76 HA ARG 76 0.414 -5.392 0.649
519 HB2 ARG 76 1HB ARG 76 2.310 -5.392 2.504
520 HB3 ARG 76 2HB ARG 76 0.926 -5.304 3.586
521 HG2 ARG 76 1HG ARG 76 0.081 -7.311 2.089
522 HG3 ARG 76 2HG ARG 76 1.813 -7.506 1.809
523 HD2 ARG 76 1HD ARG 76 2.017 -7.340 4.375
524 HD3 ARG 76 2HD ARG 76 0.285 -7.673 4.382
525 HE ARG 76 HE ARG 76 0.796 -9.855 4.008
526 HH11 ARG 76 1HH1 ARG 76 3.410 -7.901 2.795
527 HH12 ARG 76 2HH1 ARG 76 4.381 -9.258 2.328
528 HH21 ARG 76 1HH2 ARG 76 2.065 -11.650 3.397
529 HH22 ARG 76 2HH2 ARG 76 3.614 -11.390 2.669
530 H VAL 77 H VAL 77 -1.696 -4.991 0.280
531 HA VAL 77 HA VAL 77 -3.314 -3.697 2.334
532 HB VAL 77 HB VAL 77 -4.150 -4.640 -0.411
533 HG11 VAL 77 1HG1 VAL 77 -6.148 -3.482 -0.103
534 HG12 VAL 77 2HG1 VAL 77 -5.883 -4.264 1.457
535 HG13 VAL 77 3HG1 VAL 77 -5.511 -2.551 1.253
536 HG21 VAL 77 3HG2 VAL 77 -2.441 -2.520 0.259
537 HG22 VAL 77 1HG2 VAL 77 -3.212 -2.831 -1.297
538 HG23 VAL 77 2HG2 VAL 77 -4.001 -1.787 -0.114
539 H THR 78 H THR 78 -4.199 -4.912 3.861
540 HA THR 78 HA THR 78 -4.741 -7.736 3.343
541 HB THR 78 HB THR 78 -4.968 -6.256 5.968
542 HG1 THR 78 1HG THR 78 -2.871 -7.533 6.242
543 HG21 THR 78 3HG2 THR 78 -4.337 -9.125 5.900
544 HG22 THR 78 1HG2 THR 78 -5.946 -8.711 5.312
545 HG23 THR 78 2HG2 THR 78 -5.451 -8.234 6.936
546 H CYS 79 H CYS 79 -6.704 -8.366 2.760
547 HA CYS 79 HA CYS 79 -8.997 -6.654 3.438
548 HB2 CYS 79 1HB CYS 79 -10.025 -8.289 1.577
549 HB3 CYS 79 2HB CYS 79 -9.187 -6.796 1.171
550 HG CYS 79 HG CYS 79 -7.094 -7.845 0.015
551 H LEU 80 H LEU 80 -9.709 -7.393 5.371
552 HA LEU 80 HA LEU 80 -10.079 -10.275 5.733
553 HB2 LEU 80 1HB LEU 80 -10.004 -7.937 7.604
554 HB3 LEU 80 2HB LEU 80 -10.700 -9.476 8.108
555 HG LEU 80 HG LEU 80 -7.944 -9.477 6.983
556 HD11 LEU 80 1HD1 LEU 80 -7.213 -7.987 8.469
557 HD12 LEU 80 2HD1 LEU 80 -7.553 -9.205 9.697
558 HD13 LEU 80 3HD1 LEU 80 -8.753 -7.966 9.330
559 HD21 LEU 80 3HD2 LEU 80 -8.533 -10.958 9.417
560 HD22 LEU 80 1HD2 LEU 80 -7.872 -11.518 7.880
561 HD23 LEU 80 2HD2 LEU 80 -9.617 -11.364 8.086
562 H TYR 81 H TYR 81 -11.952 -10.936 4.872
563 HA TYR 81 HA TYR 81 -14.298 -9.283 4.820
564 HB2 TYR 81 1HB TYR 81 -14.163 -12.241 4.237
565 HB3 TYR 81 2HB TYR 81 -15.347 -11.079 3.649
566 HD1 TYR 81 2HD TYR 81 -14.279 -9.068 2.263
567 HD2 TYR 81 1HD TYR 81 -12.482 -12.888 2.798
568 HE1 TYR 81 2HE TYR 81 -12.927 -8.709 0.240
569 HE2 TYR 81 1HE TYR 81 -11.124 -12.538 0.777
570 HH TYR 81 HH TYR 81 -10.292 -10.720 -0.590
571 HA PRO 82 HA PRO 82 -16.179 -10.422 8.621
572 HB2 PRO 82 1HB PRO 82 -18.805 -10.303 7.943
573 HB3 PRO 82 2HB PRO 82 -17.798 -8.864 8.139
574 HG2 PRO 82 1HG PRO 82 -18.604 -10.284 5.630
575 HG3 PRO 82 2HG PRO 82 -18.543 -8.543 5.960
576 HD2 PRO 82 1HD PRO 82 -16.600 -9.834 4.586
577 HD3 PRO 82 2HD PRO 82 -16.266 -8.431 5.621
578 H GLY 83 H GLY 83 -16.668 -12.269 9.666
579 HA2 GLY 83 1HA GLY 83 -17.985 -14.289 9.861
580 HA3 GLY 83 2HA GLY 83 -17.877 -14.466 8.115
581 H GLY 84 H GLY 84 -15.954 -15.253 7.182
582 HA2 GLY 84 1HA GLY 84 -13.754 -16.035 8.890
583 HA3 GLY 84 2HA GLY 84 -14.723 -17.378 8.303
584 H GLY 85 H GLY 85 -13.328 -14.387 6.934
585 HA2 GLY 85 1HA GLY 85 -11.753 -15.928 5.063
586 HA3 GLY 85 2HA GLY 85 -13.091 -15.059 4.324
587 H SER 86 H SER 86 -10.256 -14.686 3.871
588 HA SER 86 HA SER 86 -10.156 -11.872 3.893
589 HB2 SER 86 1HB SER 86 -8.418 -11.442 5.512
590 HB3 SER 86 2HB SER 86 -9.727 -12.298 6.327
591 HG SER 86 HG SER 86 -7.318 -12.989 6.487
592 H SER 87 H SER 87 -8.053 -11.042 3.087
593 HA SER 87 HA SER 87 -6.199 -12.965 1.988
594 HB2 SER 87 1HB SER 87 -8.304 -12.621 0.408
595 HB3 SER 87 2HB SER 87 -7.422 -11.167 -0.060
596 HG SER 87 HG SER 87 -6.837 -12.910 -1.382
597 H THR 88 H THR 88 -4.754 -11.565 0.285
598 HA THR 88 HA THR 88 -4.293 -8.883 1.326
599 HB THR 88 HB THR 88 -2.015 -10.860 1.260
600 HG1 THR 88 1HG THR 88 -2.243 -10.759 3.604
601 HG21 THR 88 3HG2 THR 88 -1.845 -8.525 2.999
602 HG22 THR 88 1HG2 THR 88 -2.028 -8.104 1.297
603 HG23 THR 88 2HG2 THR 88 -0.693 -9.136 1.811
604 H LEU 89 H LEU 89 -3.523 -7.510 -0.187
605 HA LEU 89 HA LEU 89 -2.773 -8.672 -2.788
606 HB2 LEU 89 1HB LEU 89 -4.320 -6.234 -2.033
607 HB3 LEU 89 2HB LEU 89 -3.432 -6.259 -3.555
608 HG LEU 89 HG LEU 89 -5.449 -8.374 -2.854
609 HD11 LEU 89 1HD1 LEU 89 -7.035 -6.812 -2.955
610 HD12 LEU 89 2HD1 LEU 89 -6.663 -6.708 -4.675
611 HD13 LEU 89 3HD1 LEU 89 -5.910 -5.586 -3.541
612 HD21 LEU 89 3HD2 LEU 89 -4.164 -9.095 -4.651
613 HD22 LEU 89 1HD2 LEU 89 -4.023 -7.473 -5.329
614 HD23 LEU 89 2HD2 LEU 89 -5.555 -8.341 -5.431
615 H THR 90 H THR 90 -0.619 -8.661 -2.931
616 HA THR 90 HA THR 90 0.989 -6.621 -1.685
617 HB THR 90 HB THR 90 2.889 -7.844 -2.390
618 HG1 THR 90 1HG THR 90 1.155 -8.776 -4.390
619 HG21 THR 90 3HG2 THR 90 2.536 -9.700 -1.162
620 HG22 THR 90 1HG2 THR 90 1.190 -10.231 -2.170
621 HG23 THR 90 2HG2 THR 90 0.927 -9.023 -0.912
622 H GLY 91 H GLY 91 2.113 -4.978 -2.656
623 HA2 GLY 91 1HA GLY 91 2.136 -4.715 -5.544
624 HA3 GLY 91 2HA GLY 91 1.139 -3.536 -4.705
625 H ARG 92 H ARG 92 3.926 -3.711 -6.188
626 HA ARG 92 HA ARG 92 5.454 -2.208 -4.176
627 HB2 ARG 92 1HB ARG 92 6.219 -3.904 -6.507
628 HB3 ARG 92 2HB ARG 92 7.283 -2.576 -6.064
629 HG2 ARG 92 1HG ARG 92 7.476 -3.485 -3.802
630 HG3 ARG 92 2HG ARG 92 6.416 -4.822 -4.255
631 HD2 ARG 92 1HD ARG 92 8.189 -5.129 -6.179
632 HD3 ARG 92 2HD ARG 92 9.234 -4.270 -5.047
633 HE ARG 92 HE ARG 92 8.222 -6.186 -3.487
634 HH11 ARG 92 1HH1 ARG 92 9.590 -6.316 -6.686
635 HH12 ARG 92 2HH1 ARG 92 10.193 -7.930 -6.504
636 HH21 ARG 92 1HH2 ARG 92 9.012 -8.311 -3.235
637 HH22 ARG 92 2HH2 ARG 92 9.863 -9.064 -4.541
638 H VAL 93 H VAL 93 5.851 -0.099 -4.438
639 HA VAL 93 HA VAL 93 5.432 1.107 -7.085
640 HB VAL 93 HB VAL 93 3.385 1.583 -5.967
641 HG11 VAL 93 1HG1 VAL 93 3.458 1.305 -3.737
642 HG12 VAL 93 2HG1 VAL 93 5.126 1.868 -3.618
643 HG13 VAL 93 3HG1 VAL 93 3.805 3.033 -3.716
644 HG21 VAL 93 3HG2 VAL 93 4.387 3.457 -7.186
645 HG22 VAL 93 1HG2 VAL 93 3.428 4.017 -5.815
646 HG23 VAL 93 2HG2 VAL 93 5.188 3.989 -5.707
647 H THR 94 H THR 94 6.945 2.550 -7.654
648 HA THR 94 HA THR 94 9.047 3.152 -5.715
649 HB THR 94 HB THR 94 9.000 3.593 -8.707
650 HG1 THR 94 1HG THR 94 9.825 1.475 -7.062
651 HG21 THR 94 3HG2 THR 94 11.269 4.195 -8.575
652 HG22 THR 94 1HG2 THR 94 11.415 3.621 -6.915
653 HG23 THR 94 2HG2 THR 94 10.497 5.086 -7.264
654 H THR 95 H THR 95 8.743 4.947 -4.568
655 HA THR 95 HA THR 95 7.045 7.055 -5.149
656 HB THR 95 HB THR 95 8.674 8.393 -3.605
657 HG1 THR 95 1HG THR 95 10.336 7.308 -2.847
658 HG21 THR 95 3HG2 THR 95 7.889 6.590 -1.717
659 HG22 THR 95 1HG2 THR 95 6.790 6.211 -3.042
660 HG23 THR 95 2HG2 THR 95 6.855 7.850 -2.392
661 H LYS 96 H LYS 96 7.342 9.137 -5.975
662 HA LYS 96 HA LYS 96 8.977 9.347 -8.252
663 HB2 LYS 96 1HB LYS 96 7.597 11.521 -6.666
664 HB3 LYS 96 2HB LYS 96 8.287 11.729 -8.271
665 HG2 LYS 96 1HG LYS 96 6.675 9.665 -8.778
666 HG3 LYS 96 2HG LYS 96 5.789 10.391 -7.435
667 HD2 LYS 96 1HD LYS 96 5.261 12.259 -8.616
668 HD3 LYS 96 2HD LYS 96 6.761 12.227 -9.546
669 HE2 LYS 96 1HE LYS 96 4.812 10.042 -10.016
670 HE3 LYS 96 2HE LYS 96 4.391 11.645 -10.618
671 HZ1 LYS 96 3HZ LYS 96 5.548 10.433 -12.314
672 HZ2 LYS 96 1HZ LYS 96 6.839 10.098 -11.273
673 HZ3 LYS 96 2HZ LYS 96 6.548 11.686 -11.775
674 H LYS 97 H LYS 97 10.424 11.398 -8.526
675 HA LYS 97 HA LYS 97 12.564 11.128 -6.582
676 HB2 LYS 97 1HB LYS 97 12.313 12.288 -9.326
677 HB3 LYS 97 2HB LYS 97 13.634 12.826 -8.298
678 HG2 LYS 97 1HG LYS 97 14.645 11.103 -9.394
679 HG3 LYS 97 2HG LYS 97 14.014 10.246 -7.985
680 HD2 LYS 97 1HD LYS 97 12.286 10.467 -10.399
681 HD3 LYS 97 2HD LYS 97 13.642 9.338 -10.440
682 HE2 LYS 97 1HE LYS 97 12.648 8.655 -8.077
683 HE3 LYS 97 2HE LYS 97 11.169 9.292 -8.794
684 HZ1 LYS 97 3HZ LYS 97 12.697 6.911 -9.494
685 HZ2 LYS 97 1HZ LYS 97 11.998 7.766 -10.776
686 HZ3 LYS 97 2HZ LYS 97 11.026 7.173 -9.525
687 H ALA 98 H ALA 98 13.129 12.603 -5.097
688 HA ALA 98 HA ALA 98 11.386 14.844 -4.633
689 HB1 ALA 98 3HB ALA 98 11.976 14.183 -2.577
690 HB2 ALA 98 1HB ALA 98 13.451 13.402 -3.148
691 HB3 ALA 98 2HB ALA 98 13.432 15.140 -2.846
692 HA PRO 99 HA PRO 99 13.682 17.942 -6.755
693 HB2 PRO 99 1HB PRO 99 12.874 20.122 -5.355
694 HB3 PRO 99 2HB PRO 99 11.829 19.277 -6.503
695 HG2 PRO 99 1HG PRO 99 11.923 19.067 -3.518
696 HG3 PRO 99 2HG PRO 99 10.513 19.152 -4.590
697 HD2 PRO 99 1HD PRO 99 11.405 16.822 -3.537
698 HD3 PRO 99 2HD PRO 99 10.634 16.916 -5.134
699 H SER 100 H SER 100 15.492 19.287 -6.549
700 HA SER 100 HA SER 100 17.108 18.755 -4.191
701 HB2 SER 100 1HB SER 100 17.751 20.066 -6.841
702 HB3 SER 100 2HB SER 100 18.920 19.867 -5.535
703 HG SER 100 HG SER 100 18.699 18.178 -7.309
704 HA PRO 101 HA PRO 101 16.580 22.660 -2.258
705 HB2 PRO 101 1HB PRO 101 19.022 23.006 -1.125
706 HB3 PRO 101 2HB PRO 101 17.843 21.833 -0.526
707 HG2 PRO 101 1HG PRO 101 20.219 21.397 -2.295
708 HG3 PRO 101 2HG PRO 101 19.649 20.424 -0.926
709 HD2 PRO 101 1HD PRO 101 19.170 19.737 -3.501
710 HD3 PRO 101 2HD PRO 101 18.035 19.367 -2.187
711 H SER 102 H SER 102 19.002 22.194 -4.668
712 HA SER 102 HA SER 102 19.842 24.953 -4.758
713 HB2 SER 102 1HB SER 102 21.267 24.297 -6.562
714 HB3 SER 102 2HB SER 102 21.304 22.980 -5.389
715 HG SER 102 HG SER 102 20.029 23.096 -7.896
716 H SER 103 H SER 103 17.144 24.963 -4.922
717 HA SER 103 HA SER 103 16.517 25.343 -7.769
718 HB2 SER 103 1HB SER 103 14.225 25.051 -7.232
719 HB3 SER 103 2HB SER 103 15.079 23.819 -6.304
720 HG SER 103 HG SER 103 15.039 25.441 -4.550
721 H GLY 104 H GLY 104 15.063 27.191 -8.283
722 HA2 GLY 104 1HA GLY 104 15.569 29.501 -6.516
723 HA3 GLY 104 2HA GLY 104 15.856 29.604 -8.247
724 HA PRO 105 HA PRO 105 11.063 29.305 -7.449
725 HB2 PRO 105 1HB PRO 105 10.295 30.120 -4.976
726 HB3 PRO 105 2HB PRO 105 10.644 28.432 -5.366
727 HG2 PRO 105 1HG PRO 105 12.382 30.464 -4.021
728 HG3 PRO 105 2HG PRO 105 12.131 28.758 -3.608
729 HD2 PRO 105 1HD PRO 105 14.308 29.623 -4.966
730 HD3 PRO 105 2HD PRO 105 13.592 28.020 -5.230
731 H SER 106 H SER 106 12.833 31.771 -5.595
732 HA SER 106 HA SER 106 12.431 34.038 -5.387
733 HB2 SER 106 1HB SER 106 12.896 33.385 -8.266
734 HB3 SER 106 2HB SER 106 12.495 35.047 -7.835
735 HG SER 106 HG SER 106 14.842 33.906 -7.692
736 H SER 107 H SER 107 10.039 32.880 -4.964
737 HA SER 107 HA SER 107 8.001 33.747 -6.759
738 HB2 SER 107 1HB SER 107 7.717 31.833 -5.203
739 HB3 SER 107 2HB SER 107 7.751 32.958 -3.845
740 HG SER 107 HG SER 107 5.748 33.452 -4.236
741 H GLY 108 H GLY 108 6.335 35.323 -6.284
742 HA2 GLY 108 1HA GLY 108 5.675 37.152 -4.712
743 HA3 GLY 108 2HA GLY 108 7.380 37.578 -4.683
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -15.258 -30.226 -1.003
2 HA2 GLY 1 1HA GLY 1 -12.964 -31.063 -0.690
3 HA3 GLY 1 2HA GLY 1 -13.013 -29.324 -0.442
4 H SER 2 H SER 2 -10.955 -30.504 0.687
5 HA SER 2 HA SER 2 -11.688 -30.748 3.532
6 HB2 SER 2 1HB SER 2 -9.781 -32.316 1.859
7 HB3 SER 2 2HB SER 2 -9.341 -32.008 3.538
8 HG SER 2 HG SER 2 -11.937 -32.842 3.169
9 H SER 3 H SER 3 -11.036 -29.068 4.684
10 HA SER 3 HA SER 3 -9.921 -27.189 5.334
11 HB2 SER 3 1HB SER 3 -7.677 -29.016 4.491
12 HB3 SER 3 2HB SER 3 -7.364 -27.422 5.177
13 HG SER 3 HG SER 3 -7.669 -28.298 7.049
14 H GLY 4 H GLY 4 -11.042 -26.965 2.797
15 HA2 GLY 4 1HA GLY 4 -9.155 -25.957 0.897
16 HA3 GLY 4 2HA GLY 4 -10.904 -25.803 0.810
17 H SER 5 H SER 5 -8.217 -24.565 2.804
18 HA SER 5 HA SER 5 -9.314 -21.864 2.437
19 HB2 SER 5 1HB SER 5 -8.645 -23.244 5.019
20 HB3 SER 5 2HB SER 5 -8.503 -21.491 4.890
21 HG SER 5 HG SER 5 -10.578 -22.200 5.630
22 H SER 6 H SER 6 -7.620 -20.233 3.429
23 HA SER 6 HA SER 6 -5.631 -19.202 2.992
24 HB2 SER 6 1HB SER 6 -5.102 -20.836 4.887
25 HB3 SER 6 2HB SER 6 -4.362 -21.858 3.655
26 HG SER 6 HG SER 6 -3.372 -19.663 4.863
27 H GLY 7 H GLY 7 -6.872 -20.238 0.693
28 HA2 GLY 7 1HA GLY 7 -5.050 -21.721 -0.919
29 HA3 GLY 7 2HA GLY 7 -6.459 -20.840 -1.490
30 H LEU 8 H LEU 8 -3.938 -20.987 -2.811
31 HA LEU 8 HA LEU 8 -2.894 -18.260 -2.487
32 HB2 LEU 8 1HB LEU 8 -1.444 -20.440 -2.466
33 HB3 LEU 8 2HB LEU 8 -1.601 -20.319 -4.217
34 HG LEU 8 HG LEU 8 -0.717 -17.886 -3.833
35 HD11 LEU 8 1HD1 LEU 8 0.683 -17.576 -1.956
36 HD12 LEU 8 2HD1 LEU 8 0.530 -19.263 -1.469
37 HD13 LEU 8 3HD1 LEU 8 -0.852 -18.177 -1.328
38 HD21 LEU 8 3HD2 LEU 8 0.521 -20.430 -4.341
39 HD22 LEU 8 1HD2 LEU 8 1.642 -19.356 -3.502
40 HD23 LEU 8 2HD2 LEU 8 0.898 -18.844 -5.018
41 H ALA 9 H ALA 9 -4.295 -17.033 -3.674
42 HA ALA 9 HA ALA 9 -3.980 -17.063 -6.507
43 HB1 ALA 9 3HB ALA 9 -5.973 -18.745 -5.598
44 HB2 ALA 9 1HB ALA 9 -6.838 -17.278 -6.057
45 HB3 ALA 9 2HB ALA 9 -5.812 -18.102 -7.232
46 HA PRO 10 HA PRO 10 -4.740 -12.824 -5.363
47 HB2 PRO 10 1HB PRO 10 -4.251 -11.782 -7.822
48 HB3 PRO 10 2HB PRO 10 -2.965 -12.301 -6.726
49 HG2 PRO 10 1HG PRO 10 -4.163 -13.744 -9.059
50 HG3 PRO 10 2HG PRO 10 -2.460 -13.599 -8.588
51 HD2 PRO 10 1HD PRO 10 -3.936 -15.806 -8.057
52 HD3 PRO 10 2HD PRO 10 -2.632 -15.250 -6.988
53 HA PRO 11 HA PRO 11 -9.020 -12.671 -6.639
54 HB2 PRO 11 1HB PRO 11 -9.637 -10.419 -5.255
55 HB3 PRO 11 2HB PRO 11 -9.479 -12.004 -4.489
56 HG2 PRO 11 1HG PRO 11 -7.502 -9.760 -4.624
57 HG3 PRO 11 2HG PRO 11 -7.925 -10.798 -3.250
58 HD2 PRO 11 1HD PRO 11 -5.701 -11.192 -4.743
59 HD3 PRO 11 2HD PRO 11 -6.590 -12.528 -3.984
60 H ARG 12 H ARG 12 -6.986 -9.747 -6.616
61 HA ARG 12 HA ARG 12 -7.821 -9.132 -9.322
62 HB2 ARG 12 1HB ARG 12 -8.355 -7.226 -7.036
63 HB3 ARG 12 2HB ARG 12 -8.483 -6.811 -8.740
64 HG2 ARG 12 1HG ARG 12 -10.087 -9.004 -7.456
65 HG3 ARG 12 2HG ARG 12 -10.644 -7.334 -7.580
66 HD2 ARG 12 1HD ARG 12 -9.668 -8.676 -10.046
67 HD3 ARG 12 2HD ARG 12 -11.242 -9.153 -9.410
68 HE ARG 12 HE ARG 12 -10.853 -6.304 -9.693
69 HH11 ARG 12 1HH1 ARG 12 -11.973 -9.246 -11.180
70 HH12 ARG 12 2HH1 ARG 12 -13.009 -8.435 -12.308
71 HH21 ARG 12 1HH2 ARG 12 -12.213 -5.225 -11.173
72 HH22 ARG 12 2HH2 ARG 12 -13.144 -6.148 -12.303
73 H HIS 13 H HIS 13 -6.804 -6.720 -9.745
74 HA HIS 13 HA HIS 13 -3.968 -7.056 -9.067
75 HB2 HIS 13 1HB HIS 13 -5.238 -5.414 -11.268
76 HB3 HIS 13 2HB HIS 13 -3.510 -5.644 -11.019
77 HD1 HIS 13 1HD HIS 13 -5.039 -6.474 -13.635
78 HD2 HIS 13 2HD HIS 13 -4.030 -9.025 -10.514
79 HE1 HIS 13 1HE HIS 13 -4.973 -8.777 -14.643
80 HE2 HIS 13 2HE HIS 13 -4.445 -10.313 -12.718
81 H LEU 14 H LEU 14 -2.686 -5.173 -8.575
82 HA LEU 14 HA LEU 14 -4.188 -3.249 -6.970
83 HB2 LEU 14 1HB LEU 14 -1.402 -4.268 -6.999
84 HB3 LEU 14 2HB LEU 14 -1.661 -2.623 -6.421
85 HG LEU 14 HG LEU 14 -3.026 -5.060 -5.281
86 HD11 LEU 14 1HD1 LEU 14 -1.441 -5.145 -3.588
87 HD12 LEU 14 2HD1 LEU 14 -0.828 -3.530 -3.942
88 HD13 LEU 14 3HD1 LEU 14 -0.467 -4.868 -5.032
89 HD21 LEU 14 3HD2 LEU 14 -4.384 -3.303 -4.692
90 HD22 LEU 14 1HD2 LEU 14 -3.056 -2.141 -4.669
91 HD23 LEU 14 2HD2 LEU 14 -3.236 -3.302 -3.352
92 H GLY 15 H GLY 15 -3.431 -0.962 -6.972
93 HA2 GLY 15 1HA GLY 15 -2.272 -0.077 -9.510
94 HA3 GLY 15 2HA GLY 15 -3.893 0.479 -9.121
95 H PHE 16 H PHE 16 -1.260 1.891 -9.439
96 HA PHE 16 HA PHE 16 -1.340 3.324 -6.869
97 HB2 PHE 16 1HB PHE 16 1.106 2.711 -8.539
98 HB3 PHE 16 2HB PHE 16 1.092 3.770 -7.133
99 HD1 PHE 16 1HD PHE 16 0.595 2.819 -4.887
100 HD2 PHE 16 2HD PHE 16 1.216 0.367 -8.311
101 HE1 PHE 16 1HE PHE 16 0.998 0.883 -3.423
102 HE2 PHE 16 2HE PHE 16 1.620 -1.573 -6.853
103 HZ PHE 16 HZ PHE 16 1.511 -1.317 -4.406
104 H SER 17 H SER 17 -1.896 5.382 -7.081
105 HA SER 17 HA SER 17 -1.212 6.795 -9.566
106 HB2 SER 17 1HB SER 17 -3.903 6.458 -8.310
107 HB3 SER 17 2HB SER 17 -3.531 7.988 -9.104
108 HG SER 17 HG SER 17 -4.448 6.551 -10.583
109 H ASP 18 H ASP 18 -1.825 9.253 -9.205
110 HA ASP 18 HA ASP 18 -0.871 11.121 -8.242
111 HB2 ASP 18 1HB ASP 18 -3.208 10.536 -7.140
112 HB3 ASP 18 2HB ASP 18 -2.217 10.316 -5.700
113 H VAL 19 H VAL 19 0.907 8.918 -8.097
114 HA VAL 19 HA VAL 19 1.982 8.622 -5.479
115 HB VAL 19 HB VAL 19 3.275 8.101 -8.159
116 HG11 VAL 19 1HG1 VAL 19 4.815 6.657 -6.887
117 HG12 VAL 19 2HG1 VAL 19 4.954 8.356 -6.431
118 HG13 VAL 19 3HG1 VAL 19 4.086 7.230 -5.388
119 HG21 VAL 19 3HG2 VAL 19 1.270 6.686 -6.625
120 HG22 VAL 19 1HG2 VAL 19 1.839 6.402 -8.270
121 HG23 VAL 19 2HG2 VAL 19 2.699 5.691 -6.904
122 H SER 20 H SER 20 3.753 9.582 -4.527
123 HA SER 20 HA SER 20 4.954 11.868 -5.931
124 HB2 SER 20 1HB SER 20 4.025 11.888 -3.049
125 HB3 SER 20 2HB SER 20 4.833 13.213 -3.887
126 HG SER 20 HG SER 20 2.851 13.784 -4.325
127 H HIS 21 H HIS 21 6.773 12.747 -4.236
128 HA HIS 21 HA HIS 21 8.643 10.544 -4.072
129 HB2 HIS 21 1HB HIS 21 10.107 12.559 -3.158
130 HB3 HIS 21 2HB HIS 21 9.772 12.373 -4.877
131 HD1 HIS 21 1HD HIS 21 7.886 13.957 -5.870
132 HD2 HIS 21 2HD HIS 21 9.147 14.866 -2.017
133 HE1 HIS 21 1HE HIS 21 7.066 16.293 -5.427
134 HE2 HIS 21 2HE HIS 21 7.914 16.853 -3.123
135 H ASP 22 H ASP 22 6.497 12.159 -1.986
136 HA ASP 22 HA ASP 22 7.752 10.846 0.329
137 HB2 ASP 22 1HB ASP 22 7.545 12.703 1.688
138 HB3 ASP 22 2HB ASP 22 7.930 13.463 0.146
139 H ALA 23 H ALA 23 5.482 10.208 -1.552
140 HA ALA 23 HA ALA 23 3.736 9.071 0.347
141 HB1 ALA 23 3HB ALA 23 2.805 11.606 -0.965
142 HB2 ALA 23 1HB ALA 23 1.677 10.389 -0.366
143 HB3 ALA 23 2HB ALA 23 2.793 11.183 0.746
144 H ALA 24 H ALA 24 1.891 7.953 -0.680
145 HA ALA 24 HA ALA 24 1.822 7.767 -3.551
146 HB1 ALA 24 3HB ALA 24 2.434 5.143 -2.335
147 HB2 ALA 24 1HB ALA 24 2.859 5.790 -3.920
148 HB3 ALA 24 2HB ALA 24 3.776 6.277 -2.495
149 H ARG 25 H ARG 25 -0.215 7.384 -4.114
150 HA ARG 25 HA ARG 25 -2.083 6.414 -2.100
151 HB2 ARG 25 1HB ARG 25 -2.573 8.453 -3.466
152 HB3 ARG 25 2HB ARG 25 -2.661 7.422 -4.889
153 HG2 ARG 25 1HG ARG 25 -4.573 6.284 -4.042
154 HG3 ARG 25 2HG ARG 25 -4.409 7.066 -2.468
155 HD2 ARG 25 1HD ARG 25 -5.005 9.183 -3.365
156 HD3 ARG 25 2HD ARG 25 -4.872 8.592 -5.020
157 HE ARG 25 HE ARG 25 -6.838 7.187 -3.481
158 HH11 ARG 25 1HH1 ARG 25 -6.230 10.026 -5.401
159 HH12 ARG 25 2HH1 ARG 25 -7.892 10.246 -5.839
160 HH21 ARG 25 1HH2 ARG 25 -9.029 7.465 -4.050
161 HH22 ARG 25 2HH2 ARG 25 -9.483 8.789 -5.069
162 H VAL 26 H VAL 26 -2.619 4.345 -1.986
163 HA VAL 26 HA VAL 26 -2.281 2.660 -4.375
164 HB VAL 26 HB VAL 26 -0.928 1.794 -2.644
165 HG11 VAL 26 1HG1 VAL 26 -3.308 2.027 -0.805
166 HG12 VAL 26 2HG1 VAL 26 -1.735 1.352 -0.376
167 HG13 VAL 26 3HG1 VAL 26 -1.880 3.060 -0.790
168 HG21 VAL 26 3HG2 VAL 26 -1.596 -0.296 -3.004
169 HG22 VAL 26 1HG2 VAL 26 -2.988 -0.083 -1.942
170 HG23 VAL 26 2HG2 VAL 26 -3.107 0.345 -3.649
171 H PHE 27 H PHE 27 -4.003 1.758 -5.306
172 HA PHE 27 HA PHE 27 -6.497 1.535 -3.773
173 HB2 PHE 27 1HB PHE 27 -7.796 2.384 -5.646
174 HB3 PHE 27 2HB PHE 27 -6.602 3.583 -5.160
175 HD1 PHE 27 2HD PHE 27 -7.373 0.996 -7.682
176 HD2 PHE 27 1HD PHE 27 -4.977 4.363 -6.667
177 HE1 PHE 27 2HE PHE 27 -6.539 1.095 -9.994
178 HE2 PHE 27 1HE PHE 27 -4.139 4.468 -8.978
179 HZ PHE 27 HZ PHE 27 -4.919 2.832 -10.645
180 H TRP 28 H TRP 28 -8.055 0.033 -4.736
181 HA TRP 28 HA TRP 28 -6.847 -1.936 -6.547
182 HB2 TRP 28 1HB TRP 28 -8.030 -3.702 -5.064
183 HB3 TRP 28 2HB TRP 28 -6.496 -3.032 -4.514
184 HD1 TRP 28 HD TRP 28 -10.101 -3.384 -3.523
185 HE1 TRP 28 1HE TRP 28 -10.483 -2.268 -1.235
186 HE3 TRP 28 3HE TRP 28 -5.637 -0.936 -3.059
187 HZ2 TRP 28 2HZ TRP 28 -9.077 -0.574 0.532
188 HZ3 TRP 28 3HZ TRP 28 -5.235 0.412 -1.040
189 HH2 TRP 28 HH TRP 28 -6.921 0.588 0.717
190 H GLU 29 H GLU 29 -8.550 -3.552 -7.306
191 HA GLU 29 HA GLU 29 -10.819 -2.034 -8.260
192 HB2 GLU 29 1HB GLU 29 -9.947 -4.875 -8.813
193 HB3 GLU 29 2HB GLU 29 -11.291 -4.067 -9.607
194 HG2 GLU 29 1HG GLU 29 -9.689 -3.708 -11.163
195 HG3 GLU 29 2HG GLU 29 -9.420 -2.284 -10.160
196 H GLY 30 H GLY 30 -10.447 -3.149 -5.394
197 HA2 GLY 30 1HA GLY 30 -12.085 -3.548 -3.782
198 HA3 GLY 30 2HA GLY 30 -13.241 -3.856 -5.068
199 H ALA 31 H ALA 31 -13.943 -5.670 -3.778
200 HA ALA 31 HA ALA 31 -12.338 -8.052 -4.348
201 HB1 ALA 31 3HB ALA 31 -13.675 -7.968 -1.699
202 HB2 ALA 31 1HB ALA 31 -12.209 -8.809 -2.204
203 HB3 ALA 31 2HB ALA 31 -12.167 -7.073 -1.891
204 HA PRO 32 HA PRO 32 -16.183 -9.753 -5.631
205 HB2 PRO 32 1HB PRO 32 -15.678 -12.397 -5.275
206 HB3 PRO 32 2HB PRO 32 -14.958 -11.449 -6.582
207 HG2 PRO 32 1HG PRO 32 -13.777 -12.249 -3.949
208 HG3 PRO 32 2HG PRO 32 -13.032 -12.257 -5.558
209 HD2 PRO 32 1HD PRO 32 -12.579 -10.290 -3.753
210 HD3 PRO 32 2HD PRO 32 -12.591 -9.995 -5.504
211 H ARG 33 H ARG 33 -15.167 -9.755 -2.453
212 HA ARG 33 HA ARG 33 -17.795 -10.692 -1.553
213 HB2 ARG 33 1HB ARG 33 -16.666 -11.779 0.417
214 HB3 ARG 33 2HB ARG 33 -16.408 -12.583 -1.126
215 HG2 ARG 33 1HG ARG 33 -14.214 -11.379 -1.279
216 HG3 ARG 33 2HG ARG 33 -14.476 -10.844 0.382
217 HD2 ARG 33 1HD ARG 33 -13.265 -12.734 0.784
218 HD3 ARG 33 2HD ARG 33 -14.886 -13.427 0.768
219 HE ARG 33 HE ARG 33 -13.706 -13.448 -1.823
220 HH11 ARG 33 1HH1 ARG 33 -13.729 -15.089 1.247
221 HH12 ARG 33 2HH1 ARG 33 -13.236 -16.612 0.584
222 HH21 ARG 33 1HH2 ARG 33 -13.057 -15.447 -2.708
223 HH22 ARG 33 2HH2 ARG 33 -12.853 -16.814 -1.666
224 HA PRO 34 HA PRO 34 -17.824 -7.081 0.941
225 HB2 PRO 34 1HB PRO 34 -19.291 -7.917 3.066
226 HB3 PRO 34 2HB PRO 34 -19.995 -7.611 1.474
227 HG2 PRO 34 1HG PRO 34 -19.192 -10.210 2.722
228 HG3 PRO 34 2HG PRO 34 -20.648 -9.820 1.788
229 HD2 PRO 34 1HD PRO 34 -18.527 -11.112 0.709
230 HD3 PRO 34 2HD PRO 34 -19.556 -10.013 -0.232
231 H VAL 35 H VAL 35 -16.640 -6.109 2.514
232 HA VAL 35 HA VAL 35 -15.244 -7.830 4.452
233 HB VAL 35 HB VAL 35 -13.578 -7.327 2.832
234 HG11 VAL 35 1HG1 VAL 35 -14.947 -4.734 2.724
235 HG12 VAL 35 2HG1 VAL 35 -13.187 -4.647 2.628
236 HG13 VAL 35 3HG1 VAL 35 -14.088 -5.620 1.464
237 HG21 VAL 35 3HG2 VAL 35 -13.311 -6.666 5.450
238 HG22 VAL 35 1HG2 VAL 35 -11.991 -6.659 4.280
239 HG23 VAL 35 2HG2 VAL 35 -12.832 -5.158 4.670
240 H ARG 36 H ARG 36 -14.882 -6.959 6.480
241 HA ARG 36 HA ARG 36 -16.597 -4.725 7.176
242 HB2 ARG 36 1HB ARG 36 -16.148 -5.345 9.485
243 HB3 ARG 36 2HB ARG 36 -16.602 -6.766 8.554
244 HG2 ARG 36 1HG ARG 36 -14.264 -7.425 8.392
245 HG3 ARG 36 2HG ARG 36 -13.791 -5.985 9.297
246 HD2 ARG 36 1HD ARG 36 -15.157 -6.783 11.199
247 HD3 ARG 36 2HD ARG 36 -15.510 -8.254 10.293
248 HE ARG 36 HE ARG 36 -13.441 -9.044 10.855
249 HH11 ARG 36 1HH1 ARG 36 -13.506 -5.599 11.354
250 HH12 ARG 36 2HH1 ARG 36 -11.945 -5.547 12.104
251 HH21 ARG 36 1HH2 ARG 36 -11.385 -8.988 11.841
252 HH22 ARG 36 2HH2 ARG 36 -10.740 -7.475 12.380
253 H LEU 37 H LEU 37 -13.166 -5.530 7.154
254 HA LEU 37 HA LEU 37 -12.525 -2.694 7.272
255 HB2 LEU 37 1HB LEU 37 -12.516 -3.911 9.613
256 HB3 LEU 37 2HB LEU 37 -10.943 -4.478 9.055
257 HG LEU 37 HG LEU 37 -11.509 -1.556 8.954
258 HD11 LEU 37 1HD1 LEU 37 -10.875 -1.257 11.260
259 HD12 LEU 37 2HD1 LEU 37 -10.727 -3.001 11.481
260 HD13 LEU 37 3HD1 LEU 37 -12.308 -2.283 11.173
261 HD21 LEU 37 3HD2 LEU 37 -9.179 -3.381 9.083
262 HD22 LEU 37 1HD2 LEU 37 -9.023 -1.815 9.879
263 HD23 LEU 37 2HD2 LEU 37 -9.410 -1.895 8.160
264 H VAL 38 H VAL 38 -10.378 -2.206 6.556
265 HA VAL 38 HA VAL 38 -9.003 -4.428 5.201
266 HB VAL 38 HB VAL 38 -9.432 -1.682 4.015
267 HG11 VAL 38 1HG1 VAL 38 -8.133 -4.156 2.878
268 HG12 VAL 38 2HG1 VAL 38 -8.426 -2.654 2.000
269 HG13 VAL 38 3HG1 VAL 38 -7.308 -2.675 3.365
270 HG21 VAL 38 3HG2 VAL 38 -10.635 -3.311 2.279
271 HG22 VAL 38 1HG2 VAL 38 -10.907 -4.238 3.754
272 HG23 VAL 38 2HG2 VAL 38 -11.487 -2.577 3.637
273 H ARG 39 H ARG 39 -7.082 -4.618 6.141
274 HA ARG 39 HA ARG 39 -5.741 -2.245 7.199
275 HB2 ARG 39 1HB ARG 39 -5.601 -5.161 7.725
276 HB3 ARG 39 2HB ARG 39 -4.103 -4.257 7.906
277 HG2 ARG 39 1HG ARG 39 -5.209 -2.754 9.492
278 HG3 ARG 39 2HG ARG 39 -6.698 -3.686 9.322
279 HD2 ARG 39 1HD ARG 39 -5.156 -5.697 9.975
280 HD3 ARG 39 2HD ARG 39 -4.127 -4.430 10.643
281 HE ARG 39 HE ARG 39 -6.493 -3.822 11.724
282 HH11 ARG 39 1HH1 ARG 39 -4.800 -6.852 11.453
283 HH12 ARG 39 2HH1 ARG 39 -5.468 -7.505 12.911
284 HH21 ARG 39 1HH2 ARG 39 -7.380 -4.671 13.646
285 HH22 ARG 39 2HH2 ARG 39 -6.937 -6.264 14.157
286 H VAL 40 H VAL 40 -3.910 -1.413 6.365
287 HA VAL 40 HA VAL 40 -2.639 -2.858 4.132
288 HB VAL 40 HB VAL 40 -3.081 0.126 4.317
289 HG11 VAL 40 1HG1 VAL 40 -1.616 -1.597 2.341
290 HG12 VAL 40 2HG1 VAL 40 -2.231 0.001 1.913
291 HG13 VAL 40 3HG1 VAL 40 -1.038 -0.170 3.201
292 HG21 VAL 40 3HG2 VAL 40 -4.285 -1.890 2.423
293 HG22 VAL 40 1HG2 VAL 40 -5.120 -1.151 3.789
294 HG23 VAL 40 2HG2 VAL 40 -4.586 -0.152 2.437
295 H THR 41 H THR 41 -0.527 -3.185 4.358
296 HA THR 41 HA THR 41 0.947 -1.525 6.298
297 HB THR 41 HB THR 41 2.446 -3.540 6.593
298 HG1 THR 41 1HG THR 41 0.974 -5.524 6.073
299 HG21 THR 41 3HG2 THR 41 0.580 -4.811 7.925
300 HG22 THR 41 1HG2 THR 41 -0.401 -3.411 7.493
301 HG23 THR 41 2HG2 THR 41 1.082 -3.196 8.423
302 H TYR 42 H TYR 42 2.559 -0.375 5.473
303 HA TYR 42 HA TYR 42 3.740 -1.249 2.918
304 HB2 TYR 42 1HB TYR 42 4.243 1.201 2.564
305 HB3 TYR 42 2HB TYR 42 2.538 0.770 2.511
306 HD1 TYR 42 1HD TYR 42 5.145 2.502 4.421
307 HD2 TYR 42 2HD TYR 42 1.010 1.520 4.235
308 HE1 TYR 42 1HE TYR 42 4.672 4.195 6.140
309 HE2 TYR 42 2HE TYR 42 0.525 3.211 5.953
310 HH TYR 42 HH TYR 42 2.056 4.314 7.932
311 H VAL 43 H VAL 43 5.982 -0.861 2.600
312 HA VAL 43 HA VAL 43 7.581 -0.021 4.874
313 HB VAL 43 HB VAL 43 7.222 -2.431 5.281
314 HG11 VAL 43 1HG1 VAL 43 8.885 -3.609 3.350
315 HG12 VAL 43 2HG1 VAL 43 7.147 -3.833 3.559
316 HG13 VAL 43 3HG1 VAL 43 7.752 -2.587 2.466
317 HG21 VAL 43 3HG2 VAL 43 10.044 -2.490 4.542
318 HG22 VAL 43 1HG2 VAL 43 9.572 -1.019 5.394
319 HG23 VAL 43 2HG2 VAL 43 9.286 -2.596 6.131
320 H SER 44 H SER 44 9.690 0.566 4.332
321 HA SER 44 HA SER 44 10.058 1.360 1.611
322 HB2 SER 44 1HB SER 44 12.105 2.392 2.372
323 HB3 SER 44 2HB SER 44 10.858 2.680 3.585
324 HG SER 44 HG SER 44 11.755 0.770 4.669
325 H SER 45 H SER 45 12.112 0.904 0.424
326 HA SER 45 HA SER 45 12.359 -1.794 -0.169
327 HB2 SER 45 1HB SER 45 13.084 -0.104 -1.743
328 HB3 SER 45 2HB SER 45 14.329 0.457 -0.628
329 HG SER 45 HG SER 45 15.584 -1.077 -1.311
330 H GLU 46 H GLU 46 14.322 -3.158 0.022
331 HA GLU 46 HA GLU 46 15.496 -4.465 1.514
332 HB2 GLU 46 1HB GLU 46 17.581 -3.402 2.196
333 HB3 GLU 46 2HB GLU 46 17.174 -2.955 0.545
334 HG2 GLU 46 1HG GLU 46 16.244 -0.822 1.416
335 HG3 GLU 46 2HG GLU 46 16.842 -1.269 3.013
336 H GLY 47 H GLY 47 13.129 -3.398 2.710
337 HA2 GLY 47 1HA GLY 47 12.169 -3.344 4.798
338 HA3 GLY 47 2HA GLY 47 13.705 -3.907 5.438
339 H GLY 48 H GLY 48 12.568 -2.306 7.103
340 HA2 GLY 48 1HA GLY 48 13.827 -0.454 8.180
341 HA3 GLY 48 2HA GLY 48 13.765 0.354 6.620
342 H HIS 49 H HIS 49 12.533 2.100 6.930
343 HA HIS 49 HA HIS 49 10.507 2.442 8.780
344 HB2 HIS 49 1HB HIS 49 11.320 4.393 7.750
345 HB3 HIS 49 2HB HIS 49 11.056 3.755 6.130
346 HD1 HIS 49 1HD HIS 49 9.043 4.626 4.995
347 HD2 HIS 49 2HD HIS 49 8.703 4.852 9.129
348 HE1 HIS 49 1HE HIS 49 6.852 5.783 5.427
349 HE2 HIS 49 2HE HIS 49 6.708 5.984 7.933
350 H SER 50 H SER 50 8.505 1.690 8.978
351 HA SER 50 HA SER 50 6.915 1.036 6.646
352 HB2 SER 50 1HB SER 50 6.464 -1.265 7.314
353 HB3 SER 50 2HB SER 50 8.197 -1.045 7.078
354 HG SER 50 HG SER 50 8.127 -0.588 9.482
355 H GLY 51 H GLY 51 4.693 0.920 7.072
356 HA2 GLY 51 1HA GLY 51 3.854 1.399 9.848
357 HA3 GLY 51 2HA GLY 51 3.387 2.556 8.610
358 H GLN 52 H GLN 52 1.289 1.695 9.760
359 HA GLN 52 HA GLN 52 0.092 -0.168 7.867
360 HB2 GLN 52 1HB GLN 52 0.760 -1.641 9.663
361 HB3 GLN 52 2HB GLN 52 0.040 -0.573 10.860
362 HG2 GLN 52 1HG GLN 52 -2.177 -1.008 9.776
363 HG3 GLN 52 2HG GLN 52 -1.378 -2.244 8.805
364 HE21 GLN 52 1HE2 GLN 52 -1.248 -4.223 9.610
365 HE22 GLN 52 2HE2 GLN 52 -1.554 -4.666 11.251
366 H THR 53 H THR 53 -1.758 0.650 7.164
367 HA THR 53 HA THR 53 -3.189 2.567 8.887
368 HB THR 53 HB THR 53 -2.296 3.657 6.898
369 HG1 THR 53 1HG THR 53 -5.090 3.277 7.100
370 HG21 THR 53 3HG2 THR 53 -2.233 1.608 5.476
371 HG22 THR 53 1HG2 THR 53 -2.925 3.013 4.667
372 HG23 THR 53 2HG2 THR 53 -3.980 1.742 5.284
373 H GLU 54 H GLU 54 -5.461 2.512 8.921
374 HA GLU 54 HA GLU 54 -6.610 -0.041 8.005
375 HB2 GLU 54 1HB GLU 54 -7.193 1.665 10.413
376 HB3 GLU 54 2HB GLU 54 -8.349 0.476 9.832
377 HG2 GLU 54 1HG GLU 54 -7.072 -0.502 11.592
378 HG3 GLU 54 2HG GLU 54 -6.608 -1.267 10.074
379 H ALA 55 H ALA 55 -8.356 -0.029 6.709
380 HA ALA 55 HA ALA 55 -9.755 2.520 6.271
381 HB1 ALA 55 3HB ALA 55 -8.623 0.690 4.171
382 HB2 ALA 55 1HB ALA 55 -9.866 1.893 3.826
383 HB3 ALA 55 2HB ALA 55 -8.287 2.402 4.424
384 HA PRO 56 HA PRO 56 -13.477 0.216 6.605
385 HB2 PRO 56 1HB PRO 56 -15.106 1.597 4.930
386 HB3 PRO 56 2HB PRO 56 -14.589 2.223 6.500
387 HG2 PRO 56 1HG PRO 56 -13.513 2.826 3.772
388 HG3 PRO 56 2HG PRO 56 -13.844 3.936 5.115
389 HD2 PRO 56 1HD PRO 56 -11.352 3.048 4.541
390 HD3 PRO 56 2HD PRO 56 -11.876 3.416 6.196
391 H GLY 57 H GLY 57 -14.572 -1.461 5.655
392 HA2 GLY 57 1HA GLY 57 -13.471 -2.823 3.512
393 HA3 GLY 57 2HA GLY 57 -15.107 -3.067 4.104
394 H ASN 58 H ASN 58 -15.409 -0.031 3.408
395 HA ASN 58 HA ASN 58 -16.219 -0.549 0.636
396 HB2 ASN 58 1HB ASN 58 -17.093 1.570 2.610
397 HB3 ASN 58 2HB ASN 58 -17.631 1.503 0.934
398 HD21 ASN 58 1HD2 ASN 58 -17.811 0.027 4.068
399 HD22 ASN 58 2HD2 ASN 58 -19.168 -0.990 3.736
400 H ALA 59 H ALA 59 -13.489 0.264 1.738
401 HA ALA 59 HA ALA 59 -13.140 2.749 0.200
402 HB1 ALA 59 3HB ALA 59 -11.742 1.612 2.569
403 HB2 ALA 59 1HB ALA 59 -10.834 2.642 1.463
404 HB3 ALA 59 2HB ALA 59 -12.281 3.262 2.259
405 H THR 60 H THR 60 -12.475 2.400 -1.810
406 HA THR 60 HA THR 60 -10.752 0.092 -2.373
407 HB THR 60 HB THR 60 -11.303 0.551 -4.772
408 HG1 THR 60 1HG THR 60 -12.772 2.103 -5.270
409 HG21 THR 60 3HG2 THR 60 -12.545 -1.130 -3.509
410 HG22 THR 60 1HG2 THR 60 -13.605 -0.299 -4.647
411 HG23 THR 60 2HG2 THR 60 -13.658 0.109 -2.932
412 H SER 61 H SER 61 -9.883 2.696 -1.191
413 HA SER 61 HA SER 61 -7.490 3.001 -2.692
414 HB2 SER 61 1HB SER 61 -7.878 5.482 -3.175
415 HB3 SER 61 2HB SER 61 -8.715 4.336 -4.222
416 HG SER 61 HG SER 61 -9.990 5.301 -1.913
417 H ALA 62 H ALA 62 -5.907 3.768 -1.411
418 HA ALA 62 HA ALA 62 -6.559 5.431 0.890
419 HB1 ALA 62 3HB ALA 62 -5.761 4.000 2.538
420 HB2 ALA 62 1HB ALA 62 -6.691 2.928 1.491
421 HB3 ALA 62 2HB ALA 62 -4.931 2.964 1.377
422 H MET 63 H MET 63 -4.864 6.692 1.602
423 HA MET 63 HA MET 63 -2.569 6.804 -0.195
424 HB2 MET 63 1HB MET 63 -3.511 8.713 1.952
425 HB3 MET 63 2HB MET 63 -2.119 8.982 0.911
426 HG2 MET 63 1HG MET 63 -3.921 8.588 -0.983
427 HG3 MET 63 2HG MET 63 -5.012 9.125 0.291
428 HE1 MET 63 3HE MET 63 -1.576 11.379 -1.635
429 HE2 MET 63 1HE MET 63 -1.215 10.918 0.029
430 HE3 MET 63 2HE MET 63 -1.630 9.681 -1.158
431 H LEU 64 H LEU 64 -0.404 7.188 0.713
432 HA LEU 64 HA LEU 64 0.002 6.055 3.385
433 HB2 LEU 64 1HB LEU 64 1.667 5.197 1.035
434 HB3 LEU 64 2HB LEU 64 1.650 4.519 2.662
435 HG LEU 64 HG LEU 64 -0.719 4.342 0.816
436 HD11 LEU 64 1HD1 LEU 64 0.024 2.102 0.228
437 HD12 LEU 64 2HD1 LEU 64 1.507 2.336 1.153
438 HD13 LEU 64 3HD1 LEU 64 1.204 3.308 -0.287
439 HD21 LEU 64 3HD2 LEU 64 -1.532 3.764 2.859
440 HD22 LEU 64 1HD2 LEU 64 0.043 3.254 3.467
441 HD23 LEU 64 2HD2 LEU 64 -0.866 2.200 2.385
442 H GLY 65 H GLY 65 1.928 6.690 4.412
443 HA2 GLY 65 1HA GLY 65 4.167 7.864 3.684
444 HA3 GLY 65 2HA GLY 65 3.044 9.168 3.325
445 HA PRO 66 HA PRO 66 4.677 10.572 3.861
446 HB2 PRO 66 1HB PRO 66 6.941 11.314 5.161
447 HB3 PRO 66 2HB PRO 66 5.428 12.220 5.275
448 HG2 PRO 66 1HG PRO 66 6.593 10.233 7.186
449 HG3 PRO 66 2HG PRO 66 5.810 11.787 7.527
450 HD2 PRO 66 1HD PRO 66 4.524 9.419 7.791
451 HD3 PRO 66 2HD PRO 66 3.690 10.909 7.309
452 H LEU 67 H LEU 67 5.692 9.427 2.348
453 HA LEU 67 HA LEU 67 7.395 7.187 3.145
454 HB2 LEU 67 1HB LEU 67 6.543 7.863 0.347
455 HB3 LEU 67 2HB LEU 67 7.083 6.310 0.983
456 HG LEU 67 HG LEU 67 4.465 7.645 1.670
457 HD11 LEU 67 1HD1 LEU 67 4.263 7.012 -0.574
458 HD12 LEU 67 2HD1 LEU 67 3.566 5.669 0.331
459 HD13 LEU 67 3HD1 LEU 67 5.193 5.533 -0.334
460 HD21 LEU 67 3HD2 LEU 67 5.326 6.197 3.440
461 HD22 LEU 67 1HD2 LEU 67 5.513 4.883 2.279
462 HD23 LEU 67 2HD2 LEU 67 3.905 5.491 2.670
463 H SER 68 H SER 68 9.130 6.829 1.197
464 HA SER 68 HA SER 68 10.845 9.195 1.373
465 HB2 SER 68 1HB SER 68 11.375 6.272 0.914
466 HB3 SER 68 2HB SER 68 12.587 7.480 0.490
467 HG SER 68 HG SER 68 11.794 6.574 2.955
468 H SER 69 H SER 69 12.356 9.477 -0.572
469 HA SER 69 HA SER 69 10.691 9.462 -2.993
470 HB2 SER 69 1HB SER 69 13.191 11.088 -2.792
471 HB3 SER 69 2HB SER 69 11.690 11.440 -3.649
472 HG SER 69 HG SER 69 10.797 11.549 -1.380
473 H SER 70 H SER 70 11.450 8.667 -4.924
474 HA SER 70 HA SER 70 12.567 7.203 -6.266
475 HB2 SER 70 1HB SER 70 14.171 9.121 -6.214
476 HB3 SER 70 2HB SER 70 15.024 8.319 -4.895
477 HG SER 70 HG SER 70 16.090 7.547 -6.578
478 H THR 71 H THR 71 11.629 6.133 -3.811
479 HA THR 71 HA THR 71 13.574 3.956 -3.449
480 HB THR 71 HB THR 71 11.939 5.202 -1.230
481 HG1 THR 71 1HG THR 71 14.096 6.135 -2.192
482 HG21 THR 71 3HG2 THR 71 12.394 2.689 -1.160
483 HG22 THR 71 1HG2 THR 71 12.902 3.633 0.240
484 HG23 THR 71 2HG2 THR 71 14.092 3.119 -0.956
485 H THR 72 H THR 72 12.746 1.966 -3.639
486 HA THR 72 HA THR 72 10.000 1.648 -4.391
487 HB THR 72 HB THR 72 12.026 -0.525 -3.832
488 HG1 THR 72 1HG THR 72 12.587 1.127 -5.488
489 HG21 THR 72 3HG2 THR 72 10.533 -1.620 -5.672
490 HG22 THR 72 1HG2 THR 72 9.336 -0.440 -5.139
491 HG23 THR 72 2HG2 THR 72 9.989 -1.612 -3.995
492 H TYR 73 H TYR 73 8.328 1.239 -3.109
493 HA TYR 73 HA TYR 73 8.860 0.204 -0.401
494 HB2 TYR 73 1HB TYR 73 7.015 2.323 -1.398
495 HB3 TYR 73 2HB TYR 73 6.487 1.346 -0.032
496 HD1 TYR 73 1HD TYR 73 9.723 2.932 -1.049
497 HD2 TYR 73 2HD TYR 73 6.779 2.421 1.979
498 HE1 TYR 73 1HE TYR 73 11.045 4.348 0.467
499 HE2 TYR 73 2HE TYR 73 8.092 3.836 3.503
500 HH TYR 73 HH TYR 73 9.808 5.611 3.348
501 H THR 74 H THR 74 7.824 -1.590 0.244
502 HA THR 74 HA THR 74 6.136 -2.951 -1.703
503 HB THR 74 HB THR 74 7.252 -3.963 0.920
504 HG1 THR 74 1HG THR 74 8.376 -3.622 -1.516
505 HG21 THR 74 3HG2 THR 74 5.758 -5.606 0.642
506 HG22 THR 74 1HG2 THR 74 6.735 -6.117 -0.734
507 HG23 THR 74 2HG2 THR 74 5.344 -5.061 -0.983
508 H VAL 75 H VAL 75 4.072 -2.269 -1.615
509 HA VAL 75 HA VAL 75 2.800 -1.779 0.962
510 HB VAL 75 HB VAL 75 1.736 -1.433 -1.845
511 HG11 VAL 75 1HG1 VAL 75 0.483 -1.195 0.823
512 HG12 VAL 75 2HG1 VAL 75 0.115 0.076 -0.345
513 HG13 VAL 75 3HG1 VAL 75 -0.232 -1.609 -0.734
514 HG21 VAL 75 3HG2 VAL 75 3.630 0.077 -0.725
515 HG22 VAL 75 1HG2 VAL 75 2.384 0.742 -1.780
516 HG23 VAL 75 2HG2 VAL 75 2.211 0.859 -0.029
517 H ARG 76 H ARG 76 1.157 -2.980 1.814
518 HA ARG 76 HA ARG 76 0.297 -5.363 0.321
519 HB2 ARG 76 1HB ARG 76 2.088 -5.646 2.253
520 HB3 ARG 76 2HB ARG 76 0.661 -5.551 3.276
521 HG2 ARG 76 1HG ARG 76 -0.159 -7.553 2.564
522 HG3 ARG 76 2HG ARG 76 0.596 -7.421 0.974
523 HD2 ARG 76 1HD ARG 76 2.819 -7.683 2.219
524 HD3 ARG 76 2HD ARG 76 1.843 -8.221 3.585
525 HE ARG 76 HE ARG 76 0.975 -9.776 1.546
526 HH11 ARG 76 1HH1 ARG 76 4.123 -9.057 2.846
527 HH12 ARG 76 2HH1 ARG 76 4.793 -10.598 2.423
528 HH21 ARG 76 1HH2 ARG 76 1.845 -11.808 0.985
529 HH22 ARG 76 2HH2 ARG 76 3.497 -12.162 1.364
530 H VAL 77 H VAL 77 -1.807 -5.109 -0.023
531 HA VAL 77 HA VAL 77 -3.449 -3.793 2.024
532 HB VAL 77 HB VAL 77 -4.095 -4.420 -0.860
533 HG11 VAL 77 1HG1 VAL 77 -6.125 -4.460 0.383
534 HG12 VAL 77 2HG1 VAL 77 -5.675 -3.010 1.282
535 HG13 VAL 77 3HG1 VAL 77 -6.047 -2.902 -0.439
536 HG21 VAL 77 3HG2 VAL 77 -4.034 -1.914 -1.069
537 HG22 VAL 77 1HG2 VAL 77 -3.303 -1.873 0.536
538 HG23 VAL 77 2HG2 VAL 77 -2.471 -2.683 -0.792
539 H THR 78 H THR 78 -4.264 -5.188 3.449
540 HA THR 78 HA THR 78 -5.291 -7.767 2.462
541 HB THR 78 HB THR 78 -4.478 -7.049 5.285
542 HG1 THR 78 1HG THR 78 -3.170 -8.534 3.237
543 HG21 THR 78 3HG2 THR 78 -6.148 -8.732 5.390
544 HG22 THR 78 1HG2 THR 78 -4.602 -9.563 5.563
545 HG23 THR 78 2HG2 THR 78 -5.457 -9.602 4.021
546 H CYS 79 H CYS 79 -7.416 -8.083 2.494
547 HA CYS 79 HA CYS 79 -9.091 -6.172 3.959
548 HB2 CYS 79 1HB CYS 79 -9.818 -8.087 1.733
549 HB3 CYS 79 2HB CYS 79 -10.913 -6.934 2.484
550 HG CYS 79 HG CYS 79 -10.455 -5.140 0.717
551 H LEU 80 H LEU 80 -9.471 -6.894 5.966
552 HA LEU 80 HA LEU 80 -9.716 -9.683 6.587
553 HB2 LEU 80 1HB LEU 80 -9.830 -7.128 8.092
554 HB3 LEU 80 2HB LEU 80 -10.596 -8.539 8.818
555 HG LEU 80 HG LEU 80 -8.355 -8.260 9.685
556 HD11 LEU 80 1HD1 LEU 80 -8.363 -10.584 7.771
557 HD12 LEU 80 2HD1 LEU 80 -9.289 -10.543 9.271
558 HD13 LEU 80 3HD1 LEU 80 -7.528 -10.462 9.320
559 HD21 LEU 80 3HD2 LEU 80 -6.628 -8.900 7.637
560 HD22 LEU 80 1HD2 LEU 80 -6.858 -7.299 8.340
561 HD23 LEU 80 2HD2 LEU 80 -7.744 -7.758 6.885
562 H TYR 81 H TYR 81 -11.460 -10.747 5.888
563 HA TYR 81 HA TYR 81 -14.033 -9.469 5.654
564 HB2 TYR 81 1HB TYR 81 -13.373 -12.401 5.334
565 HB3 TYR 81 2HB TYR 81 -14.794 -11.558 4.725
566 HD1 TYR 81 2HD TYR 81 -14.003 -9.335 3.279
567 HD2 TYR 81 1HD TYR 81 -11.869 -12.992 3.701
568 HE1 TYR 81 2HE TYR 81 -12.836 -8.892 1.160
569 HE2 TYR 81 1HE TYR 81 -10.695 -12.558 1.583
570 HH TYR 81 HH TYR 81 -11.372 -9.639 -0.327
571 HA PRO 82 HA PRO 82 -15.597 -10.456 9.647
572 HB2 PRO 82 1HB PRO 82 -18.254 -10.452 9.087
573 HB3 PRO 82 2HB PRO 82 -17.290 -8.973 9.184
574 HG2 PRO 82 1HG PRO 82 -18.156 -10.513 6.768
575 HG3 PRO 82 2HG PRO 82 -18.143 -8.760 7.032
576 HD2 PRO 82 1HD PRO 82 -16.218 -10.035 5.617
577 HD3 PRO 82 2HD PRO 82 -15.889 -8.583 6.585
578 H GLY 83 H GLY 83 -15.826 -12.521 6.980
579 HA2 GLY 83 1HA GLY 83 -17.446 -14.555 8.243
580 HA3 GLY 83 2HA GLY 83 -16.605 -14.692 6.707
581 H GLY 84 H GLY 84 -14.016 -14.315 7.290
582 HA2 GLY 84 1HA GLY 84 -12.880 -15.350 9.556
583 HA3 GLY 84 2HA GLY 84 -13.339 -16.765 8.621
584 H GLY 85 H GLY 85 -12.811 -15.968 6.051
585 HA2 GLY 85 1HA GLY 85 -9.938 -16.159 6.018
586 HA3 GLY 85 2HA GLY 85 -11.002 -16.164 4.619
587 H SER 86 H SER 86 -8.961 -14.826 4.000
588 HA SER 86 HA SER 86 -9.798 -12.133 3.728
589 HB2 SER 86 1HB SER 86 -8.091 -10.993 5.004
590 HB3 SER 86 2HB SER 86 -8.956 -12.083 6.087
591 HG SER 86 HG SER 86 -7.153 -13.607 5.482
592 H SER 87 H SER 87 -8.716 -11.100 2.093
593 HA SER 87 HA SER 87 -6.661 -12.701 0.732
594 HB2 SER 87 1HB SER 87 -8.715 -10.737 -0.252
595 HB3 SER 87 2HB SER 87 -7.298 -11.121 -1.229
596 HG SER 87 HG SER 87 -9.157 -13.012 -0.214
597 H THR 88 H THR 88 -4.730 -11.808 0.089
598 HA THR 88 HA THR 88 -4.159 -9.093 1.086
599 HB THR 88 HB THR 88 -2.240 -11.430 1.031
600 HG1 THR 88 1HG THR 88 -2.456 -10.832 3.448
601 HG21 THR 88 3HG2 THR 88 -1.030 -9.679 2.604
602 HG22 THR 88 1HG2 THR 88 -1.952 -8.528 1.638
603 HG23 THR 88 2HG2 THR 88 -0.825 -9.635 0.854
604 H LEU 89 H LEU 89 -3.731 -7.730 -0.511
605 HA LEU 89 HA LEU 89 -2.675 -8.781 -3.040
606 HB2 LEU 89 1HB LEU 89 -4.202 -6.307 -2.310
607 HB3 LEU 89 2HB LEU 89 -3.315 -6.413 -3.829
608 HG LEU 89 HG LEU 89 -5.385 -8.456 -3.086
609 HD11 LEU 89 1HD1 LEU 89 -5.785 -5.657 -3.884
610 HD12 LEU 89 2HD1 LEU 89 -6.880 -6.780 -3.078
611 HD13 LEU 89 3HD1 LEU 89 -6.681 -6.847 -4.829
612 HD21 LEU 89 3HD2 LEU 89 -3.626 -8.597 -5.025
613 HD22 LEU 89 1HD2 LEU 89 -4.746 -7.503 -5.837
614 HD23 LEU 89 2HD2 LEU 89 -5.300 -9.086 -5.292
615 H THR 90 H THR 90 -0.558 -8.625 -3.310
616 HA THR 90 HA THR 90 0.964 -6.621 -1.841
617 HB THR 90 HB THR 90 2.957 -7.814 -2.629
618 HG1 THR 90 1HG THR 90 1.070 -9.463 -3.991
619 HG21 THR 90 3HG2 THR 90 2.487 -10.020 -1.541
620 HG22 THR 90 1HG2 THR 90 0.788 -9.556 -1.461
621 HG23 THR 90 2HG2 THR 90 1.999 -8.620 -0.585
622 H GLY 91 H GLY 91 1.961 -4.895 -2.734
623 HA2 GLY 91 1HA GLY 91 2.287 -4.718 -5.621
624 HA3 GLY 91 2HA GLY 91 1.170 -3.565 -4.907
625 H ARG 92 H ARG 92 4.192 -3.830 -6.017
626 HA ARG 92 HA ARG 92 5.443 -2.184 -3.945
627 HB2 ARG 92 1HB ARG 92 6.545 -3.623 -6.356
628 HB3 ARG 92 2HB ARG 92 7.504 -2.502 -5.400
629 HG2 ARG 92 1HG ARG 92 6.863 -3.968 -3.396
630 HG3 ARG 92 2HG ARG 92 6.380 -5.160 -4.605
631 HD2 ARG 92 1HD ARG 92 8.555 -5.394 -5.417
632 HD3 ARG 92 2HD ARG 92 9.084 -3.872 -4.701
633 HE ARG 92 HE ARG 92 8.335 -5.561 -2.621
634 HH11 ARG 92 1HH1 ARG 92 10.747 -5.413 -5.126
635 HH12 ARG 92 2HH1 ARG 92 11.930 -6.297 -4.220
636 HH21 ARG 92 1HH2 ARG 92 9.883 -6.726 -1.418
637 HH22 ARG 92 2HH2 ARG 92 11.437 -7.045 -2.111
638 H VAL 93 H VAL 93 6.030 -0.090 -4.249
639 HA VAL 93 HA VAL 93 5.565 1.108 -6.892
640 HB VAL 93 HB VAL 93 3.578 1.620 -5.623
641 HG11 VAL 93 1HG1 VAL 93 3.845 3.035 -3.518
642 HG12 VAL 93 2HG1 VAL 93 4.202 1.313 -3.380
643 HG13 VAL 93 3HG1 VAL 93 5.518 2.481 -3.498
644 HG21 VAL 93 3HG2 VAL 93 5.406 3.597 -6.589
645 HG22 VAL 93 1HG2 VAL 93 3.643 3.596 -6.633
646 HG23 VAL 93 2HG2 VAL 93 4.490 4.258 -5.235
647 H THR 94 H THR 94 7.030 2.609 -7.504
648 HA THR 94 HA THR 94 9.237 3.133 -5.643
649 HB THR 94 HB THR 94 9.131 3.443 -8.650
650 HG1 THR 94 1HG THR 94 10.605 1.626 -8.519
651 HG21 THR 94 3HG2 THR 94 11.632 3.491 -7.004
652 HG22 THR 94 1HG2 THR 94 10.690 4.965 -7.223
653 HG23 THR 94 2HG2 THR 94 11.350 4.124 -8.626
654 H THR 95 H THR 95 8.643 4.900 -4.478
655 HA THR 95 HA THR 95 7.129 7.055 -5.159
656 HB THR 95 HB THR 95 8.665 8.408 -3.600
657 HG1 THR 95 1HG THR 95 10.486 7.476 -3.092
658 HG21 THR 95 3HG2 THR 95 7.778 5.903 -2.250
659 HG22 THR 95 1HG2 THR 95 6.571 6.895 -3.067
660 HG23 THR 95 2HG2 THR 95 7.547 7.584 -1.770
661 H LYS 96 H LYS 96 7.734 9.295 -5.686
662 HA LYS 96 HA LYS 96 9.384 9.353 -8.043
663 HB2 LYS 96 1HB LYS 96 7.988 11.644 -6.651
664 HB3 LYS 96 2HB LYS 96 8.617 11.642 -8.294
665 HG2 LYS 96 1HG LYS 96 6.981 9.650 -8.633
666 HG3 LYS 96 2HG LYS 96 6.191 10.299 -7.194
667 HD2 LYS 96 1HD LYS 96 5.562 12.242 -8.252
668 HD3 LYS 96 2HD LYS 96 6.880 12.156 -9.424
669 HE2 LYS 96 1HE LYS 96 5.766 10.331 -10.575
670 HE3 LYS 96 2HE LYS 96 4.477 10.332 -9.372
671 HZ1 LYS 96 3HZ LYS 96 5.064 12.358 -11.438
672 HZ2 LYS 96 1HZ LYS 96 4.139 12.744 -10.075
673 HZ3 LYS 96 2HZ LYS 96 3.614 11.540 -11.140
674 H LYS 97 H LYS 97 10.861 11.350 -8.312
675 HA LYS 97 HA LYS 97 12.913 11.144 -6.307
676 HB2 LYS 97 1HB LYS 97 12.656 12.456 -8.978
677 HB3 LYS 97 2HB LYS 97 13.929 13.000 -7.894
678 HG2 LYS 97 1HG LYS 97 14.836 11.350 -9.359
679 HG3 LYS 97 2HG LYS 97 14.727 10.654 -7.741
680 HD2 LYS 97 1HD LYS 97 12.923 9.294 -8.317
681 HD3 LYS 97 2HD LYS 97 12.518 10.269 -9.732
682 HE2 LYS 97 1HE LYS 97 15.101 8.747 -9.519
683 HE3 LYS 97 2HE LYS 97 13.627 8.008 -10.143
684 HZ1 LYS 97 3HZ LYS 97 13.567 9.513 -11.932
685 HZ2 LYS 97 1HZ LYS 97 15.174 8.992 -11.840
686 HZ3 LYS 97 2HZ LYS 97 14.745 10.518 -11.249
687 H ALA 98 H ALA 98 13.558 12.653 -4.841
688 HA ALA 98 HA ALA 98 11.655 14.621 -4.037
689 HB1 ALA 98 3HB ALA 98 13.164 13.314 -2.504
690 HB2 ALA 98 1HB ALA 98 14.481 14.359 -3.038
691 HB3 ALA 98 2HB ALA 98 13.091 15.049 -2.200
692 HA PRO 99 HA PRO 99 13.048 18.064 -6.406
693 HB2 PRO 99 1HB PRO 99 12.061 20.062 -4.855
694 HB3 PRO 99 2HB PRO 99 11.039 19.045 -5.877
695 HG2 PRO 99 1HG PRO 99 11.569 18.850 -2.937
696 HG3 PRO 99 2HG PRO 99 10.035 18.683 -3.810
697 HD2 PRO 99 1HD PRO 99 11.460 16.548 -2.946
698 HD3 PRO 99 2HD PRO 99 10.477 16.505 -4.424
699 H SER 100 H SER 100 13.608 18.121 -2.901
700 HA SER 100 HA SER 100 15.290 18.985 -1.629
701 HB2 SER 100 1HB SER 100 16.712 18.061 -4.110
702 HB3 SER 100 2HB SER 100 17.608 18.848 -2.810
703 HG SER 100 HG SER 100 17.419 17.109 -1.641
704 HA PRO 101 HA PRO 101 15.065 23.036 -4.050
705 HB2 PRO 101 1HB PRO 101 13.262 24.269 -2.439
706 HB3 PRO 101 2HB PRO 101 12.792 23.293 -3.836
707 HG2 PRO 101 1HG PRO 101 12.849 22.547 -0.937
708 HG3 PRO 101 2HG PRO 101 11.614 22.194 -2.159
709 HD2 PRO 101 1HD PRO 101 13.459 20.370 -1.384
710 HD3 PRO 101 2HD PRO 101 12.804 20.424 -3.033
711 H SER 102 H SER 102 17.157 23.501 -3.353
712 HA SER 102 HA SER 102 18.297 23.736 -0.957
713 HB2 SER 102 1HB SER 102 19.319 24.406 -3.161
714 HB3 SER 102 2HB SER 102 18.523 25.970 -2.984
715 HG SER 102 HG SER 102 20.814 25.111 -1.884
716 H SER 103 H SER 103 18.305 25.040 0.821
717 HA SER 103 HA SER 103 15.984 26.767 1.147
718 HB2 SER 103 1HB SER 103 17.999 25.603 3.063
719 HB3 SER 103 2HB SER 103 16.852 26.845 3.565
720 HG SER 103 HG SER 103 16.197 24.322 2.437
721 H GLY 104 H GLY 104 16.041 28.939 1.398
722 HA2 GLY 104 1HA GLY 104 18.575 30.299 1.847
723 HA3 GLY 104 2HA GLY 104 17.818 30.592 0.288
724 HA PRO 105 HA PRO 105 16.245 33.655 3.462
725 HB2 PRO 105 1HB PRO 105 16.956 35.879 2.076
726 HB3 PRO 105 2HB PRO 105 18.039 35.070 3.215
727 HG2 PRO 105 1HG PRO 105 17.945 34.879 0.229
728 HG3 PRO 105 2HG PRO 105 19.353 35.016 1.297
729 HD2 PRO 105 1HD PRO 105 18.559 32.658 0.229
730 HD3 PRO 105 2HD PRO 105 19.329 32.772 1.825
731 H SER 106 H SER 106 15.631 32.671 0.327
732 HA SER 106 HA SER 106 13.711 34.624 -0.461
733 HB2 SER 106 1HB SER 106 13.060 32.937 -2.174
734 HB3 SER 106 2HB SER 106 14.796 33.243 -2.139
735 HG SER 106 HG SER 106 13.364 30.988 -1.272
736 H SER 107 H SER 107 12.311 34.882 1.299
737 HA SER 107 HA SER 107 10.138 32.978 1.362
738 HB2 SER 107 1HB SER 107 11.936 33.433 3.731
739 HB3 SER 107 2HB SER 107 10.246 32.982 3.953
740 HG SER 107 HG SER 107 11.615 31.451 2.119
741 H GLY 108 H GLY 108 8.255 33.798 2.506
742 HA2 GLY 108 1HA GLY 108 7.455 36.297 1.882
743 HA3 GLY 108 2HA GLY 108 6.862 35.463 3.311
Start of MODEL 10
1 H1 GLY 1 H GLY 1 12.646 -32.055 0.651
2 HA2 GLY 1 1HA GLY 1 11.745 -31.332 3.052
3 HA3 GLY 1 2HA GLY 1 11.932 -30.141 1.773
4 H SER 2 H SER 2 10.111 -29.682 3.734
5 HA SER 2 HA SER 2 7.504 -30.637 3.105
6 HB2 SER 2 1HB SER 2 8.625 -28.524 4.899
7 HB3 SER 2 2HB SER 2 6.900 -28.491 4.532
8 HG SER 2 HG SER 2 6.630 -30.133 5.807
9 H SER 3 H SER 3 7.242 -30.270 0.878
10 HA SER 3 HA SER 3 6.627 -27.473 0.209
11 HB2 SER 3 1HB SER 3 7.497 -27.859 -2.076
12 HB3 SER 3 2HB SER 3 8.757 -28.026 -0.853
13 HG SER 3 HG SER 3 9.076 -29.902 -1.737
14 H GLY 4 H GLY 4 4.437 -28.083 0.732
15 HA2 GLY 4 1HA GLY 4 3.174 -29.640 -1.440
16 HA3 GLY 4 2HA GLY 4 2.638 -29.758 0.230
17 H SER 5 H SER 5 3.483 -26.947 -1.781
18 HA SER 5 HA SER 5 1.277 -25.439 -0.798
19 HB2 SER 5 1HB SER 5 3.457 -24.467 -1.600
20 HB3 SER 5 2HB SER 5 2.951 -24.845 -3.247
21 HG SER 5 HG SER 5 1.682 -23.094 -1.411
22 H SER 6 H SER 6 -0.668 -24.967 -1.721
23 HA SER 6 HA SER 6 -1.561 -26.769 -3.817
24 HB2 SER 6 1HB SER 6 -2.999 -24.845 -1.990
25 HB3 SER 6 2HB SER 6 -3.818 -25.693 -3.301
26 HG SER 6 HG SER 6 -3.398 -26.592 -0.899
27 H GLY 7 H GLY 7 -1.777 -23.255 -3.210
28 HA2 GLY 7 1HA GLY 7 -0.823 -22.364 -5.631
29 HA3 GLY 7 2HA GLY 7 -2.530 -22.680 -5.909
30 H LEU 8 H LEU 8 -0.446 -20.290 -5.270
31 HA LEU 8 HA LEU 8 -2.418 -18.762 -3.702
32 HB2 LEU 8 1HB LEU 8 0.582 -18.518 -3.787
33 HB3 LEU 8 2HB LEU 8 -0.476 -17.332 -3.024
34 HG LEU 8 HG LEU 8 -1.303 -19.414 -1.654
35 HD11 LEU 8 1HD1 LEU 8 0.103 -20.968 -3.047
36 HD12 LEU 8 2HD1 LEU 8 0.317 -21.106 -1.303
37 HD13 LEU 8 3HD1 LEU 8 1.519 -20.255 -2.274
38 HD21 LEU 8 3HD2 LEU 8 1.362 -18.660 -0.713
39 HD22 LEU 8 1HD2 LEU 8 -0.215 -18.453 0.049
40 HD23 LEU 8 2HD2 LEU 8 0.341 -17.292 -1.157
41 H ALA 9 H ALA 9 -3.307 -17.059 -4.669
42 HA ALA 9 HA ALA 9 -1.869 -15.494 -6.619
43 HB1 ALA 9 3HB ALA 9 -4.361 -16.199 -7.869
44 HB2 ALA 9 1HB ALA 9 -2.717 -16.311 -8.500
45 HB3 ALA 9 2HB ALA 9 -3.394 -17.641 -7.559
46 HA PRO 10 HA PRO 10 -4.428 -12.394 -4.812
47 HB2 PRO 10 1HB PRO 10 -4.059 -10.435 -6.655
48 HB3 PRO 10 2HB PRO 10 -2.820 -10.897 -5.483
49 HG2 PRO 10 1HG PRO 10 -3.096 -11.687 -8.357
50 HG3 PRO 10 2HG PRO 10 -1.641 -11.209 -7.463
51 HD2 PRO 10 1HD PRO 10 -2.246 -13.796 -7.985
52 HD3 PRO 10 2HD PRO 10 -1.386 -13.295 -6.516
53 HA PRO 11 HA PRO 11 -8.368 -12.659 -6.774
54 HB2 PRO 11 1HB PRO 11 -9.568 -10.493 -5.663
55 HB3 PRO 11 2HB PRO 11 -9.253 -11.982 -4.765
56 HG2 PRO 11 1HG PRO 11 -7.700 -9.423 -4.795
57 HG3 PRO 11 2HG PRO 11 -8.135 -10.451 -3.418
58 HD2 PRO 11 1HD PRO 11 -5.679 -10.504 -4.556
59 HD3 PRO 11 2HD PRO 11 -6.425 -11.941 -3.828
60 H ARG 12 H ARG 12 -7.066 -9.338 -6.620
61 HA ARG 12 HA ARG 12 -7.735 -9.022 -9.461
62 HB2 ARG 12 1HB ARG 12 -8.607 -7.308 -7.174
63 HB3 ARG 12 2HB ARG 12 -8.261 -6.545 -8.720
64 HG2 ARG 12 1HG ARG 12 -10.128 -8.879 -8.511
65 HG3 ARG 12 2HG ARG 12 -10.672 -7.224 -8.229
66 HD2 ARG 12 1HD ARG 12 -10.210 -6.576 -10.428
67 HD3 ARG 12 2HD ARG 12 -9.168 -7.969 -10.714
68 HE ARG 12 HE ARG 12 -11.699 -8.963 -10.195
69 HH11 ARG 12 1HH1 ARG 12 -10.173 -6.922 -12.567
70 HH12 ARG 12 2HH1 ARG 12 -11.257 -7.371 -13.841
71 HH21 ARG 12 1HH2 ARG 12 -13.132 -9.563 -11.865
72 HH22 ARG 12 2HH2 ARG 12 -12.940 -8.873 -13.441
73 H HIS 13 H HIS 13 -6.793 -6.685 -10.116
74 HA HIS 13 HA HIS 13 -3.956 -6.830 -9.404
75 HB2 HIS 13 1HB HIS 13 -4.461 -6.963 -11.783
76 HB3 HIS 13 2HB HIS 13 -5.353 -5.447 -11.703
77 HD1 HIS 13 1HD HIS 13 -4.036 -3.625 -12.704
78 HD2 HIS 13 2HD HIS 13 -1.613 -6.350 -10.712
79 HE1 HIS 13 1HE HIS 13 -1.692 -2.748 -12.952
80 HE2 HIS 13 2HE HIS 13 -0.235 -4.458 -11.812
81 H LEU 14 H LEU 14 -2.812 -5.098 -8.615
82 HA LEU 14 HA LEU 14 -4.391 -3.041 -7.318
83 HB2 LEU 14 1HB LEU 14 -1.616 -4.064 -7.109
84 HB3 LEU 14 2HB LEU 14 -1.901 -2.392 -6.631
85 HG LEU 14 HG LEU 14 -3.313 -4.789 -5.463
86 HD11 LEU 14 1HD1 LEU 14 -1.100 -4.958 -4.719
87 HD12 LEU 14 2HD1 LEU 14 -1.939 -4.103 -3.426
88 HD13 LEU 14 3HD1 LEU 14 -0.925 -3.211 -4.560
89 HD21 LEU 14 3HD2 LEU 14 -3.339 -1.859 -4.755
90 HD22 LEU 14 1HD2 LEU 14 -4.001 -3.137 -3.735
91 HD23 LEU 14 2HD2 LEU 14 -4.693 -2.834 -5.328
92 H GLY 15 H GLY 15 -3.341 -0.768 -7.288
93 HA2 GLY 15 1HA GLY 15 -2.040 0.028 -9.741
94 HA3 GLY 15 2HA GLY 15 -3.720 0.531 -9.632
95 H PHE 16 H PHE 16 -0.787 1.726 -9.352
96 HA PHE 16 HA PHE 16 -1.340 3.330 -6.952
97 HB2 PHE 16 1HB PHE 16 1.243 2.931 -8.476
98 HB3 PHE 16 2HB PHE 16 1.057 3.953 -7.055
99 HD1 PHE 16 1HD PHE 16 0.365 2.869 -4.879
100 HD2 PHE 16 2HD PHE 16 1.663 0.644 -8.267
101 HE1 PHE 16 1HE PHE 16 0.833 0.938 -3.428
102 HE2 PHE 16 2HE PHE 16 2.132 -1.291 -6.822
103 HZ PHE 16 HZ PHE 16 1.716 -1.146 -4.399
104 H SER 17 H SER 17 -1.553 5.513 -7.053
105 HA SER 17 HA SER 17 -1.013 6.905 -9.556
106 HB2 SER 17 1HB SER 17 -3.485 5.979 -9.345
107 HB3 SER 17 2HB SER 17 -3.691 7.401 -8.323
108 HG SER 17 HG SER 17 -3.893 7.393 -10.865
109 H ASP 18 H ASP 18 -1.278 9.284 -9.315
110 HA ASP 18 HA ASP 18 -0.559 11.186 -8.277
111 HB2 ASP 18 1HB ASP 18 -2.149 10.202 -5.909
112 HB3 ASP 18 2HB ASP 18 -1.854 11.868 -6.400
113 H VAL 19 H VAL 19 1.051 8.730 -7.892
114 HA VAL 19 HA VAL 19 2.075 8.655 -5.255
115 HB VAL 19 HB VAL 19 2.611 6.737 -6.400
116 HG11 VAL 19 1HG1 VAL 19 2.745 8.530 -8.715
117 HG12 VAL 19 2HG1 VAL 19 3.887 7.186 -8.760
118 HG13 VAL 19 3HG1 VAL 19 2.160 6.871 -8.595
119 HG21 VAL 19 3HG2 VAL 19 5.035 6.704 -6.806
120 HG22 VAL 19 1HG2 VAL 19 5.053 8.467 -6.779
121 HG23 VAL 19 2HG2 VAL 19 4.627 7.567 -5.323
122 H SER 20 H SER 20 3.720 9.726 -4.287
123 HA SER 20 HA SER 20 5.157 11.743 -5.883
124 HB2 SER 20 1HB SER 20 3.892 12.045 -3.159
125 HB3 SER 20 2HB SER 20 5.127 13.153 -3.756
126 HG SER 20 HG SER 20 2.628 12.602 -4.987
127 H HIS 21 H HIS 21 6.989 12.678 -4.264
128 HA HIS 21 HA HIS 21 8.729 10.419 -3.823
129 HB2 HIS 21 1HB HIS 21 10.416 12.177 -3.255
130 HB3 HIS 21 2HB HIS 21 9.694 12.371 -4.849
131 HD1 HIS 21 1HD HIS 21 8.376 14.495 -5.290
132 HD2 HIS 21 2HD HIS 21 9.599 14.119 -1.337
133 HE1 HIS 21 1HE HIS 21 7.907 16.725 -4.226
134 HE2 HIS 21 2HE HIS 21 8.734 16.501 -1.858
135 H ASP 22 H ASP 22 6.465 12.035 -1.979
136 HA ASP 22 HA ASP 22 7.692 11.030 0.499
137 HB2 ASP 22 1HB ASP 22 6.480 13.726 -0.027
138 HB3 ASP 22 2HB ASP 22 6.435 13.035 1.593
139 H ALA 23 H ALA 23 5.499 10.210 -1.498
140 HA ALA 23 HA ALA 23 3.786 8.990 0.390
141 HB1 ALA 23 3HB ALA 23 1.680 10.199 -0.549
142 HB2 ALA 23 1HB ALA 23 2.611 10.938 0.754
143 HB3 ALA 23 2HB ALA 23 2.817 11.499 -0.906
144 H ALA 24 H ALA 24 1.891 7.894 -0.734
145 HA ALA 24 HA ALA 24 1.965 7.592 -3.569
146 HB1 ALA 24 3HB ALA 24 2.790 5.342 -3.724
147 HB2 ALA 24 1HB ALA 24 4.005 6.335 -2.918
148 HB3 ALA 24 2HB ALA 24 2.986 5.247 -1.974
149 H ARG 25 H ARG 25 -0.059 7.165 -4.133
150 HA ARG 25 HA ARG 25 -1.911 6.106 -2.160
151 HB2 ARG 25 1HB ARG 25 -2.483 8.085 -3.570
152 HB3 ARG 25 2HB ARG 25 -2.461 7.037 -4.982
153 HG2 ARG 25 1HG ARG 25 -4.428 6.025 -4.439
154 HG3 ARG 25 2HG ARG 25 -4.201 6.266 -2.706
155 HD2 ARG 25 1HD ARG 25 -5.059 8.382 -2.748
156 HD3 ARG 25 2HD ARG 25 -4.552 8.671 -4.411
157 HE ARG 25 HE ARG 25 -6.522 6.713 -4.475
158 HH11 ARG 25 1HH1 ARG 25 -6.209 10.064 -3.585
159 HH12 ARG 25 2HH1 ARG 25 -7.854 10.454 -3.967
160 HH21 ARG 25 1HH2 ARG 25 -8.689 7.214 -4.982
161 HH22 ARG 25 2HH2 ARG 25 -9.264 8.832 -4.761
162 H VAL 26 H VAL 26 -2.990 4.185 -2.298
163 HA VAL 26 HA VAL 26 -2.302 2.414 -4.550
164 HB VAL 26 HB VAL 26 -0.958 1.654 -2.724
165 HG11 VAL 26 1HG1 VAL 26 -3.010 0.942 -0.818
166 HG12 VAL 26 2HG1 VAL 26 -1.520 1.857 -0.579
167 HG13 VAL 26 3HG1 VAL 26 -2.985 2.680 -1.118
168 HG21 VAL 26 3HG2 VAL 26 -3.185 -0.279 -2.448
169 HG22 VAL 26 1HG2 VAL 26 -2.605 0.051 -4.081
170 HG23 VAL 26 2HG2 VAL 26 -1.491 -0.551 -2.853
171 H PHE 27 H PHE 27 -4.095 1.943 -5.622
172 HA PHE 27 HA PHE 27 -6.583 1.543 -4.092
173 HB2 PHE 27 1HB PHE 27 -7.838 2.390 -5.973
174 HB3 PHE 27 2HB PHE 27 -6.600 3.568 -5.550
175 HD1 PHE 27 1HD PHE 27 -4.665 3.912 -6.994
176 HD2 PHE 27 2HD PHE 27 -7.783 1.217 -8.059
177 HE1 PHE 27 1HE PHE 27 -3.847 3.888 -9.315
178 HE2 PHE 27 2HE PHE 27 -6.970 1.189 -10.381
179 HZ PHE 27 HZ PHE 27 -4.999 2.525 -11.012
180 H TRP 28 H TRP 28 -8.101 0.000 -5.007
181 HA TRP 28 HA TRP 28 -6.847 -2.013 -6.745
182 HB2 TRP 28 1HB TRP 28 -8.133 -3.718 -5.273
183 HB3 TRP 28 2HB TRP 28 -6.613 -3.062 -4.674
184 HD1 TRP 28 HD TRP 28 -10.277 -3.286 -3.854
185 HE1 TRP 28 1HE TRP 28 -10.732 -2.111 -1.610
186 HE3 TRP 28 3HE TRP 28 -5.758 -0.984 -3.214
187 HZ2 TRP 28 2HZ TRP 28 -9.356 -0.430 0.193
188 HZ3 TRP 28 3HZ TRP 28 -5.408 0.390 -1.203
189 HH2 TRP 28 HH TRP 28 -7.172 0.660 0.464
190 H GLU 29 H GLU 29 -8.568 -3.663 -7.477
191 HA GLU 29 HA GLU 29 -10.812 -2.122 -8.517
192 HB2 GLU 29 1HB GLU 29 -9.709 -4.843 -9.218
193 HB3 GLU 29 2HB GLU 29 -11.163 -4.174 -9.945
194 HG2 GLU 29 1HG GLU 29 -8.417 -2.950 -10.085
195 HG3 GLU 29 2HG GLU 29 -9.199 -3.877 -11.365
196 H GLY 30 H GLY 30 -10.418 -3.539 -5.733
197 HA2 GLY 30 1HA GLY 30 -12.166 -4.009 -4.218
198 HA3 GLY 30 2HA GLY 30 -13.212 -4.388 -5.578
199 H ALA 31 H ALA 31 -13.599 -6.178 -3.871
200 HA ALA 31 HA ALA 31 -11.862 -8.447 -4.586
201 HB1 ALA 31 3HB ALA 31 -11.266 -8.124 -2.372
202 HB2 ALA 31 1HB ALA 31 -12.894 -7.640 -1.896
203 HB3 ALA 31 2HB ALA 31 -12.544 -9.332 -2.250
204 HA PRO 32 HA PRO 32 -15.488 -10.592 -5.820
205 HB2 PRO 32 1HB PRO 32 -14.842 -13.149 -5.177
206 HB3 PRO 32 2HB PRO 32 -14.105 -12.284 -6.530
207 HG2 PRO 32 1HG PRO 32 -13.039 -12.747 -3.771
208 HG3 PRO 32 2HG PRO 32 -12.198 -12.858 -5.329
209 HD2 PRO 32 1HD PRO 32 -11.979 -10.702 -3.706
210 HD3 PRO 32 2HD PRO 32 -11.903 -10.577 -5.475
211 H ARG 33 H ARG 33 -14.731 -10.128 -2.634
212 HA ARG 33 HA ARG 33 -17.346 -11.095 -1.785
213 HB2 ARG 33 1HB ARG 33 -16.321 -12.079 0.295
214 HB3 ARG 33 2HB ARG 33 -16.005 -12.972 -1.187
215 HG2 ARG 33 1HG ARG 33 -13.782 -11.953 -1.319
216 HG3 ARG 33 2HG ARG 33 -14.101 -11.083 0.182
217 HD2 ARG 33 1HD ARG 33 -12.798 -13.031 0.692
218 HD3 ARG 33 2HD ARG 33 -14.431 -13.271 1.312
219 HE ARG 33 HE ARG 33 -13.144 -14.728 -0.833
220 HH11 ARG 33 1HH1 ARG 33 -16.125 -13.929 0.777
221 HH12 ARG 33 2HH1 ARG 33 -16.970 -15.321 0.185
222 HH21 ARG 33 1HH2 ARG 33 -14.245 -16.564 -1.619
223 HH22 ARG 33 2HH2 ARG 33 -15.900 -16.820 -1.177
224 HA PRO 34 HA PRO 34 -17.453 -7.351 0.504
225 HB2 PRO 34 1HB PRO 34 -19.027 -8.056 2.600
226 HB3 PRO 34 2HB PRO 34 -19.652 -7.832 0.962
227 HG2 PRO 34 1HG PRO 34 -18.937 -10.366 2.387
228 HG3 PRO 34 2HG PRO 34 -20.343 -10.016 1.365
229 HD2 PRO 34 1HD PRO 34 -18.188 -11.383 0.460
230 HD3 PRO 34 2HD PRO 34 -19.159 -10.329 -0.588
231 H VAL 35 H VAL 35 -16.369 -6.299 2.108
232 HA VAL 35 HA VAL 35 -14.962 -7.960 4.096
233 HB VAL 35 HB VAL 35 -13.219 -7.273 2.721
234 HG11 VAL 35 1HG1 VAL 35 -14.931 -4.924 2.239
235 HG12 VAL 35 2HG1 VAL 35 -13.191 -4.627 2.205
236 HG13 VAL 35 3HG1 VAL 35 -13.903 -5.829 1.128
237 HG21 VAL 35 3HG2 VAL 35 -13.352 -4.980 4.668
238 HG22 VAL 35 1HG2 VAL 35 -12.944 -6.630 5.139
239 HG23 VAL 35 2HG2 VAL 35 -11.914 -5.756 4.004
240 H ARG 36 H ARG 36 -14.609 -7.041 6.152
241 HA ARG 36 HA ARG 36 -16.543 -4.946 6.829
242 HB2 ARG 36 1HB ARG 36 -16.308 -5.733 9.141
243 HB3 ARG 36 2HB ARG 36 -16.755 -7.045 8.059
244 HG2 ARG 36 1HG ARG 36 -14.646 -8.025 8.176
245 HG3 ARG 36 2HG ARG 36 -13.894 -6.550 8.787
246 HD2 ARG 36 1HD ARG 36 -15.954 -8.133 10.312
247 HD3 ARG 36 2HD ARG 36 -14.216 -8.373 10.484
248 HE ARG 36 HE ARG 36 -15.063 -5.651 10.874
249 HH11 ARG 36 1HH1 ARG 36 -14.563 -8.748 12.385
250 HH12 ARG 36 2HH1 ARG 36 -14.375 -8.088 13.975
251 HH21 ARG 36 1HH2 ARG 36 -14.817 -4.770 12.964
252 HH22 ARG 36 2HH2 ARG 36 -14.520 -5.825 14.304
253 H LEU 37 H LEU 37 -13.145 -5.658 6.785
254 HA LEU 37 HA LEU 37 -12.521 -2.895 7.324
255 HB2 LEU 37 1HB LEU 37 -12.699 -3.886 9.581
256 HB3 LEU 37 2HB LEU 37 -11.445 -5.045 9.143
257 HG LEU 37 HG LEU 37 -9.962 -2.986 8.740
258 HD11 LEU 37 1HD1 LEU 37 -12.207 -1.759 10.328
259 HD12 LEU 37 2HD1 LEU 37 -11.614 -1.262 8.744
260 HD13 LEU 37 3HD1 LEU 37 -10.601 -1.047 10.171
261 HD21 LEU 37 3HD2 LEU 37 -10.387 -4.615 10.920
262 HD22 LEU 37 1HD2 LEU 37 -10.460 -2.991 11.605
263 HD23 LEU 37 2HD2 LEU 37 -9.035 -3.503 10.702
264 H VAL 38 H VAL 38 -10.435 -2.307 6.665
265 HA VAL 38 HA VAL 38 -8.892 -4.422 5.313
266 HB VAL 38 HB VAL 38 -9.301 -1.613 4.278
267 HG11 VAL 38 1HG1 VAL 38 -8.232 -2.627 2.216
268 HG12 VAL 38 2HG1 VAL 38 -7.165 -2.351 3.594
269 HG13 VAL 38 3HG1 VAL 38 -7.755 -3.977 3.245
270 HG21 VAL 38 3HG2 VAL 38 -10.924 -3.961 4.020
271 HG22 VAL 38 1HG2 VAL 38 -11.190 -2.345 3.367
272 HG23 VAL 38 2HG2 VAL 38 -10.255 -3.525 2.447
273 H ARG 39 H ARG 39 -6.940 -4.607 6.172
274 HA ARG 39 HA ARG 39 -5.722 -2.251 7.445
275 HB2 ARG 39 1HB ARG 39 -6.189 -4.562 8.651
276 HB3 ARG 39 2HB ARG 39 -4.673 -5.011 7.882
277 HG2 ARG 39 1HG ARG 39 -3.461 -3.394 9.065
278 HG3 ARG 39 2HG ARG 39 -4.923 -2.531 9.547
279 HD2 ARG 39 1HD ARG 39 -4.315 -5.346 10.418
280 HD3 ARG 39 2HD ARG 39 -3.810 -3.928 11.337
281 HE ARG 39 HE ARG 39 -6.588 -3.834 10.777
282 HH11 ARG 39 1HH1 ARG 39 -4.236 -5.396 12.814
283 HH12 ARG 39 2HH1 ARG 39 -5.356 -5.691 14.102
284 HH21 ARG 39 1HH2 ARG 39 -8.072 -4.218 12.466
285 HH22 ARG 39 2HH2 ARG 39 -7.538 -5.022 13.903
286 H VAL 40 H VAL 40 -4.400 -1.254 6.062
287 HA VAL 40 HA VAL 40 -2.858 -2.801 4.129
288 HB VAL 40 HB VAL 40 -2.999 0.197 4.468
289 HG11 VAL 40 1HG1 VAL 40 -2.066 0.286 2.228
290 HG12 VAL 40 2HG1 VAL 40 -0.995 -0.620 3.300
291 HG13 VAL 40 3HG1 VAL 40 -2.027 -1.475 2.153
292 HG21 VAL 40 3HG2 VAL 40 -5.165 -1.073 3.896
293 HG22 VAL 40 1HG2 VAL 40 -4.694 0.282 2.870
294 HG23 VAL 40 2HG2 VAL 40 -4.404 -1.373 2.334
295 H THR 41 H THR 41 -0.633 -2.859 4.045
296 HA THR 41 HA THR 41 0.864 -1.532 6.187
297 HB THR 41 HB THR 41 2.174 -3.639 6.565
298 HG1 THR 41 1HG THR 41 1.046 -4.537 4.499
299 HG21 THR 41 3HG2 THR 41 0.711 -4.467 8.192
300 HG22 THR 41 1HG2 THR 41 -0.718 -4.107 7.224
301 HG23 THR 41 2HG2 THR 41 0.191 -2.796 7.975
302 H TYR 42 H TYR 42 2.571 -0.520 5.373
303 HA TYR 42 HA TYR 42 3.689 -1.485 2.823
304 HB2 TYR 42 1HB TYR 42 4.481 0.913 2.560
305 HB3 TYR 42 2HB TYR 42 2.743 0.661 2.441
306 HD1 TYR 42 2HD TYR 42 1.281 1.277 4.373
307 HD2 TYR 42 1HD TYR 42 5.410 2.296 4.250
308 HE1 TYR 42 2HE TYR 42 0.913 2.959 6.130
309 HE2 TYR 42 1HE TYR 42 5.054 3.979 6.007
310 HH TYR 42 HH TYR 42 2.023 5.076 6.913
311 H VAL 43 H VAL 43 5.961 -1.348 2.521
312 HA VAL 43 HA VAL 43 7.607 -0.815 4.869
313 HB VAL 43 HB VAL 43 7.117 -3.176 5.118
314 HG11 VAL 43 1HG1 VAL 43 8.331 -4.510 3.056
315 HG12 VAL 43 2HG1 VAL 43 6.592 -4.278 3.242
316 HG13 VAL 43 3HG1 VAL 43 7.526 -3.179 2.227
317 HG21 VAL 43 3HG2 VAL 43 9.892 -3.098 3.993
318 HG22 VAL 43 1HG2 VAL 43 9.478 -2.178 5.440
319 HG23 VAL 43 2HG2 VAL 43 9.294 -3.932 5.427
320 H SER 44 H SER 44 9.861 -0.591 4.387
321 HA SER 44 HA SER 44 10.301 0.356 1.668
322 HB2 SER 44 1HB SER 44 12.336 1.382 2.564
323 HB3 SER 44 2HB SER 44 10.946 1.799 3.567
324 HG SER 44 HG SER 44 12.613 -0.400 4.171
325 H SER 45 H SER 45 10.453 -1.626 0.564
326 HA SER 45 HA SER 45 11.542 -3.384 -0.381
327 HB2 SER 45 1HB SER 45 13.395 -1.860 -0.698
328 HB3 SER 45 2HB SER 45 13.923 -2.091 0.968
329 HG SER 45 HG SER 45 13.686 -4.367 -0.615
330 H GLU 46 H GLU 46 10.141 -4.090 1.779
331 HA GLU 46 HA GLU 46 9.995 -5.473 3.616
332 HB2 GLU 46 1HB GLU 46 10.969 -7.736 3.116
333 HB3 GLU 46 2HB GLU 46 9.936 -7.080 1.854
334 HG2 GLU 46 1HG GLU 46 11.950 -6.357 0.627
335 HG3 GLU 46 2HG GLU 46 12.945 -7.121 1.866
336 H GLY 47 H GLY 47 11.883 -3.536 4.160
337 HA2 GLY 47 1HA GLY 47 13.290 -4.612 6.303
338 HA3 GLY 47 2HA GLY 47 14.402 -4.574 4.943
339 H GLY 48 H GLY 48 12.430 -2.619 7.096
340 HA2 GLY 48 1HA GLY 48 14.054 -0.616 7.704
341 HA3 GLY 48 2HA GLY 48 13.615 -0.159 6.065
342 H HIS 49 H HIS 49 12.428 1.641 6.458
343 HA HIS 49 HA HIS 49 10.627 2.004 8.569
344 HB2 HIS 49 1HB HIS 49 11.266 3.981 7.519
345 HB3 HIS 49 2HB HIS 49 11.008 3.326 5.905
346 HD1 HIS 49 1HD HIS 49 9.538 5.385 5.301
347 HD2 HIS 49 2HD HIS 49 8.056 3.067 8.414
348 HE1 HIS 49 1HE HIS 49 7.160 6.134 5.624
349 HE2 HIS 49 2HE HIS 49 6.310 4.778 7.569
350 H SER 50 H SER 50 8.728 1.100 8.967
351 HA SER 50 HA SER 50 7.052 0.253 6.706
352 HB2 SER 50 1HB SER 50 6.531 -1.841 7.739
353 HB3 SER 50 2HB SER 50 8.289 -1.693 7.751
354 HG SER 50 HG SER 50 6.466 -1.465 9.881
355 H GLY 51 H GLY 51 4.798 0.240 7.107
356 HA2 GLY 51 1HA GLY 51 3.938 1.472 9.636
357 HA3 GLY 51 2HA GLY 51 3.483 2.226 8.115
358 H GLN 52 H GLN 52 1.345 1.785 9.328
359 HA GLN 52 HA GLN 52 0.048 -0.361 7.961
360 HB2 GLN 52 1HB GLN 52 0.873 -1.749 9.703
361 HB3 GLN 52 2HB GLN 52 0.482 -0.558 10.936
362 HG2 GLN 52 1HG GLN 52 -1.950 -0.908 10.263
363 HG3 GLN 52 2HG GLN 52 -1.378 -2.337 9.403
364 HE21 GLN 52 1HE2 GLN 52 0.535 -3.282 11.105
365 HE22 GLN 52 2HE2 GLN 52 -0.195 -3.779 12.590
366 H THR 53 H THR 53 -1.788 0.538 7.335
367 HA THR 53 HA THR 53 -3.157 2.384 9.183
368 HB THR 53 HB THR 53 -2.310 3.586 7.236
369 HG1 THR 53 1HG THR 53 -4.142 4.582 7.677
370 HG21 THR 53 3HG2 THR 53 -3.275 3.068 4.986
371 HG22 THR 53 1HG2 THR 53 -3.914 1.571 5.663
372 HG23 THR 53 2HG2 THR 53 -2.172 1.837 5.599
373 H GLU 54 H GLU 54 -5.521 2.505 8.897
374 HA GLU 54 HA GLU 54 -6.640 -0.087 8.048
375 HB2 GLU 54 1HB GLU 54 -7.098 1.541 10.504
376 HB3 GLU 54 2HB GLU 54 -8.456 0.642 9.841
377 HG2 GLU 54 1HG GLU 54 -7.174 -1.426 9.996
378 HG3 GLU 54 2HG GLU 54 -5.804 -0.529 10.649
379 H ALA 55 H ALA 55 -8.571 -0.088 6.938
380 HA ALA 55 HA ALA 55 -9.901 2.460 6.425
381 HB1 ALA 55 3HB ALA 55 -9.557 0.945 3.962
382 HB2 ALA 55 1HB ALA 55 -9.334 2.666 4.276
383 HB3 ALA 55 2HB ALA 55 -8.035 1.528 4.635
384 HA PRO 56 HA PRO 56 -13.560 0.035 6.551
385 HB2 PRO 56 1HB PRO 56 -15.187 1.465 4.915
386 HB3 PRO 56 2HB PRO 56 -14.726 2.015 6.530
387 HG2 PRO 56 1HG PRO 56 -13.602 2.800 3.869
388 HG3 PRO 56 2HG PRO 56 -13.996 3.823 5.263
389 HD2 PRO 56 1HD PRO 56 -11.467 3.035 4.704
390 HD3 PRO 56 2HD PRO 56 -12.041 3.295 6.363
391 H GLY 57 H GLY 57 -14.635 -1.584 5.464
392 HA2 GLY 57 1HA GLY 57 -13.424 -2.788 3.267
393 HA3 GLY 57 2HA GLY 57 -15.055 -3.134 3.824
394 H ASN 58 H ASN 58 -15.424 -0.053 3.298
395 HA ASN 58 HA ASN 58 -16.457 -0.454 0.615
396 HB2 ASN 58 1HB ASN 58 -16.664 1.969 2.416
397 HB3 ASN 58 2HB ASN 58 -17.576 1.691 0.935
398 HD21 ASN 58 1HD2 ASN 58 -18.004 1.820 4.057
399 HD22 ASN 58 2HD2 ASN 58 -19.175 0.574 4.304
400 H ALA 59 H ALA 59 -13.930 1.330 2.247
401 HA ALA 59 HA ALA 59 -13.266 3.149 0.223
402 HB1 ALA 59 3HB ALA 59 -12.106 3.754 2.048
403 HB2 ALA 59 1HB ALA 59 -11.981 2.098 2.643
404 HB3 ALA 59 2HB ALA 59 -10.867 2.677 1.403
405 H THR 60 H THR 60 -12.598 2.773 -1.776
406 HA THR 60 HA THR 60 -11.270 0.227 -2.385
407 HB THR 60 HB THR 60 -11.717 1.058 -4.819
408 HG1 THR 60 1HG THR 60 -13.804 2.455 -3.496
409 HG21 THR 60 3HG2 THR 60 -13.583 -0.146 -2.846
410 HG22 THR 60 1HG2 THR 60 -12.910 -0.826 -4.327
411 HG23 THR 60 2HG2 THR 60 -14.244 0.324 -4.412
412 H SER 61 H SER 61 -10.078 2.798 -1.253
413 HA SER 61 HA SER 61 -7.605 2.658 -2.608
414 HB2 SER 61 1HB SER 61 -7.599 5.034 -3.471
415 HB3 SER 61 2HB SER 61 -8.622 3.918 -4.375
416 HG SER 61 HG SER 61 -9.676 5.907 -3.914
417 H ALA 62 H ALA 62 -5.993 3.511 -1.383
418 HA ALA 62 HA ALA 62 -6.710 5.333 0.801
419 HB1 ALA 62 3HB ALA 62 -6.428 3.791 2.369
420 HB2 ALA 62 1HB ALA 62 -6.092 2.579 1.133
421 HB3 ALA 62 2HB ALA 62 -4.774 3.531 1.815
422 H MET 63 H MET 63 -4.852 6.422 1.758
423 HA MET 63 HA MET 63 -2.717 6.795 -0.225
424 HB2 MET 63 1HB MET 63 -3.783 8.602 1.944
425 HB3 MET 63 2HB MET 63 -2.322 8.956 1.033
426 HG2 MET 63 1HG MET 63 -3.955 8.567 -1.015
427 HG3 MET 63 2HG MET 63 -5.158 9.034 0.185
428 HE1 MET 63 3HE MET 63 -1.929 11.613 -1.740
429 HE2 MET 63 1HE MET 63 -1.355 10.467 -0.528
430 HE3 MET 63 2HE MET 63 -2.219 9.885 -1.952
431 H LEU 64 H LEU 64 -0.535 7.183 0.559
432 HA LEU 64 HA LEU 64 0.019 5.997 3.190
433 HB2 LEU 64 1HB LEU 64 1.545 5.385 0.665
434 HB3 LEU 64 2HB LEU 64 1.878 4.743 2.272
435 HG LEU 64 HG LEU 64 -0.595 4.171 0.640
436 HD11 LEU 64 1HD1 LEU 64 1.880 3.201 0.141
437 HD12 LEU 64 2HD1 LEU 64 0.384 2.322 -0.176
438 HD13 LEU 64 3HD1 LEU 64 1.287 2.017 1.307
439 HD21 LEU 64 3HD2 LEU 64 -0.216 4.015 3.389
440 HD22 LEU 64 1HD2 LEU 64 0.015 2.364 2.812
441 HD23 LEU 64 2HD2 LEU 64 -1.481 3.224 2.448
442 H GLY 65 H GLY 65 2.056 6.608 4.123
443 HA2 GLY 65 1HA GLY 65 4.136 7.999 3.518
444 HA3 GLY 65 2HA GLY 65 2.948 9.240 3.149
445 HA PRO 66 HA PRO 66 4.761 10.550 3.789
446 HB2 PRO 66 1HB PRO 66 6.989 11.136 5.226
447 HB3 PRO 66 2HB PRO 66 5.533 12.136 5.262
448 HG2 PRO 66 1HG PRO 66 6.455 10.064 7.215
449 HG3 PRO 66 2HG PRO 66 5.755 11.663 7.527
450 HD2 PRO 66 1HD PRO 66 4.307 9.380 7.691
451 HD3 PRO 66 2HD PRO 66 3.599 10.925 7.177
452 H LEU 67 H LEU 67 6.044 9.563 2.347
453 HA LEU 67 HA LEU 67 7.544 7.190 3.236
454 HB2 LEU 67 1HB LEU 67 6.637 7.791 0.431
455 HB3 LEU 67 2HB LEU 67 7.267 6.269 1.058
456 HG LEU 67 HG LEU 67 4.579 7.508 1.631
457 HD11 LEU 67 1HD1 LEU 67 5.572 5.276 -0.058
458 HD12 LEU 67 2HD1 LEU 67 4.281 6.438 -0.359
459 HD13 LEU 67 3HD1 LEU 67 4.011 5.088 0.743
460 HD21 LEU 67 3HD2 LEU 67 5.716 6.391 3.612
461 HD22 LEU 67 1HD2 LEU 67 5.585 4.886 2.701
462 HD23 LEU 67 2HD2 LEU 67 4.128 5.773 3.153
463 H SER 68 H SER 68 9.404 6.686 1.612
464 HA SER 68 HA SER 68 11.141 9.003 1.646
465 HB2 SER 68 1HB SER 68 11.745 6.549 2.292
466 HB3 SER 68 2HB SER 68 11.936 6.320 0.553
467 HG SER 68 HG SER 68 13.187 8.490 1.828
468 H SER 69 H SER 69 12.773 8.918 -0.382
469 HA SER 69 HA SER 69 11.058 9.153 -2.766
470 HB2 SER 69 1HB SER 69 12.786 10.821 -3.556
471 HB3 SER 69 2HB SER 69 11.847 11.330 -2.152
472 HG SER 69 HG SER 69 13.572 11.068 -0.877
473 H SER 70 H SER 70 11.842 8.437 -4.756
474 HA SER 70 HA SER 70 12.836 6.889 -6.105
475 HB2 SER 70 1HB SER 70 14.580 8.603 -6.120
476 HB3 SER 70 2HB SER 70 15.292 7.915 -4.661
477 HG SER 70 HG SER 70 16.393 7.176 -6.491
478 H THR 71 H THR 71 11.937 6.006 -3.427
479 HA THR 71 HA THR 71 13.695 3.659 -3.119
480 HB THR 71 HB THR 71 11.908 4.879 -1.007
481 HG1 THR 71 1HG THR 71 13.733 6.184 -1.408
482 HG21 THR 71 3HG2 THR 71 12.127 2.903 0.006
483 HG22 THR 71 1HG2 THR 71 13.851 3.240 0.151
484 HG23 THR 71 2HG2 THR 71 13.244 2.329 -1.232
485 H THR 72 H THR 72 12.806 1.656 -3.199
486 HA THR 72 HA THR 72 10.091 1.460 -4.191
487 HB THR 72 HB THR 72 12.301 -0.562 -3.849
488 HG1 THR 72 1HG THR 72 11.665 -0.626 -6.254
489 HG21 THR 72 3HG2 THR 72 9.398 -0.982 -4.419
490 HG22 THR 72 1HG2 THR 72 10.498 -1.947 -3.436
491 HG23 THR 72 2HG2 THR 72 10.595 -2.018 -5.196
492 H TYR 73 H TYR 73 8.437 1.322 -2.834
493 HA TYR 73 HA TYR 73 8.841 -0.005 -0.238
494 HB2 TYR 73 1HB TYR 73 7.133 2.277 -1.122
495 HB3 TYR 73 2HB TYR 73 6.545 1.257 0.186
496 HD1 TYR 73 1HD TYR 73 9.576 3.177 -0.846
497 HD2 TYR 73 2HD TYR 73 7.185 1.733 2.364
498 HE1 TYR 73 1HE TYR 73 10.969 4.430 0.748
499 HE2 TYR 73 2HE TYR 73 8.570 2.982 3.966
500 HH TYR 73 HH TYR 73 10.407 5.414 3.305
501 H THR 74 H THR 74 7.862 -1.880 0.121
502 HA THR 74 HA THR 74 6.017 -2.926 -1.863
503 HB THR 74 HB THR 74 7.108 -4.291 0.604
504 HG1 THR 74 1HG THR 74 8.382 -5.329 -1.256
505 HG21 THR 74 3HG2 THR 74 5.879 -5.452 -1.898
506 HG22 THR 74 1HG2 THR 74 5.051 -5.288 -0.350
507 HG23 THR 74 2HG2 THR 74 6.452 -6.350 -0.492
508 H VAL 75 H VAL 75 3.963 -2.284 -1.645
509 HA VAL 75 HA VAL 75 2.805 -1.959 1.015
510 HB VAL 75 HB VAL 75 1.607 -1.377 -1.698
511 HG11 VAL 75 1HG1 VAL 75 0.586 -1.124 1.089
512 HG12 VAL 75 2HG1 VAL 75 0.112 0.083 -0.108
513 HG13 VAL 75 3HG1 VAL 75 -0.254 -1.621 -0.379
514 HG21 VAL 75 3HG2 VAL 75 3.645 -0.021 -0.747
515 HG22 VAL 75 1HG2 VAL 75 2.283 0.809 -1.500
516 HG23 VAL 75 2HG2 VAL 75 2.404 0.728 0.258
517 H ARG 76 H ARG 76 0.916 -3.028 1.687
518 HA ARG 76 HA ARG 76 -0.024 -5.273 0.074
519 HB2 ARG 76 1HB ARG 76 1.442 -5.483 2.652
520 HB3 ARG 76 2HB ARG 76 0.064 -6.550 2.422
521 HG2 ARG 76 1HG ARG 76 1.063 -7.689 0.684
522 HG3 ARG 76 2HG ARG 76 2.157 -6.358 0.306
523 HD2 ARG 76 1HD ARG 76 3.151 -6.816 2.645
524 HD3 ARG 76 2HD ARG 76 2.320 -8.366 2.523
525 HE ARG 76 HE ARG 76 3.700 -8.221 0.202
526 HH11 ARG 76 1HH1 ARG 76 4.595 -7.845 3.545
527 HH12 ARG 76 2HH1 ARG 76 6.210 -8.427 3.314
528 HH21 ARG 76 1HH2 ARG 76 5.825 -8.988 -0.116
529 HH22 ARG 76 2HH2 ARG 76 6.909 -9.076 1.231
530 H VAL 77 H VAL 77 -2.132 -4.883 -0.076
531 HA VAL 77 HA VAL 77 -3.556 -3.659 2.161
532 HB VAL 77 HB VAL 77 -4.539 -4.289 -0.625
533 HG11 VAL 77 1HG1 VAL 77 -6.573 -3.823 0.130
534 HG12 VAL 77 2HG1 VAL 77 -5.929 -3.575 1.755
535 HG13 VAL 77 3HG1 VAL 77 -6.017 -2.224 0.623
536 HG21 VAL 77 3HG2 VAL 77 -4.457 -1.612 -0.533
537 HG22 VAL 77 1HG2 VAL 77 -3.105 -1.982 0.538
538 HG23 VAL 77 2HG2 VAL 77 -3.114 -2.597 -1.115
539 H THR 78 H THR 78 -4.098 -5.130 3.665
540 HA THR 78 HA THR 78 -5.145 -7.730 2.825
541 HB THR 78 HB THR 78 -4.560 -6.810 5.642
542 HG1 THR 78 1HG THR 78 -2.603 -8.112 5.284
543 HG21 THR 78 3HG2 THR 78 -4.721 -9.604 4.520
544 HG22 THR 78 1HG2 THR 78 -6.077 -8.786 5.295
545 HG23 THR 78 2HG2 THR 78 -4.612 -9.128 6.215
546 H CYS 79 H CYS 79 -7.264 -7.879 2.529
547 HA CYS 79 HA CYS 79 -9.058 -6.092 3.991
548 HB2 CYS 79 1HB CYS 79 -9.588 -7.945 1.658
549 HB3 CYS 79 2HB CYS 79 -10.777 -6.872 2.387
550 HG CYS 79 HG CYS 79 -8.187 -5.055 1.609
551 H LEU 80 H LEU 80 -9.498 -6.892 5.963
552 HA LEU 80 HA LEU 80 -9.740 -9.693 6.492
553 HB2 LEU 80 1HB LEU 80 -10.030 -7.181 8.050
554 HB3 LEU 80 2HB LEU 80 -10.784 -8.639 8.690
555 HG LEU 80 HG LEU 80 -8.666 -8.425 9.736
556 HD11 LEU 80 1HD1 LEU 80 -7.680 -10.492 9.240
557 HD12 LEU 80 2HD1 LEU 80 -8.167 -10.418 7.547
558 HD13 LEU 80 3HD1 LEU 80 -9.378 -10.685 8.802
559 HD21 LEU 80 3HD2 LEU 80 -7.901 -7.140 7.399
560 HD22 LEU 80 1HD2 LEU 80 -6.925 -8.608 7.432
561 HD23 LEU 80 2HD2 LEU 80 -6.880 -7.490 8.795
562 H TYR 81 H TYR 81 -11.406 -10.765 5.624
563 HA TYR 81 HA TYR 81 -13.993 -9.543 5.280
564 HB2 TYR 81 1HB TYR 81 -13.239 -12.443 4.885
565 HB3 TYR 81 2HB TYR 81 -14.636 -11.607 4.217
566 HD1 TYR 81 2HD TYR 81 -14.037 -9.509 2.714
567 HD2 TYR 81 1HD TYR 81 -11.387 -12.734 3.537
568 HE1 TYR 81 2HE TYR 81 -12.745 -8.954 0.696
569 HE2 TYR 81 1HE TYR 81 -10.086 -12.187 1.522
570 HH TYR 81 HH TYR 81 -10.162 -9.390 -0.011
571 HA PRO 82 HA PRO 82 -15.759 -10.729 9.133
572 HB2 PRO 82 1HB PRO 82 -18.379 -10.721 8.422
573 HB3 PRO 82 2HB PRO 82 -17.440 -9.240 8.647
574 HG2 PRO 82 1HG PRO 82 -18.149 -10.667 6.113
575 HG3 PRO 82 2HG PRO 82 -18.171 -8.928 6.462
576 HD2 PRO 82 1HD PRO 82 -16.154 -10.115 5.100
577 HD3 PRO 82 2HD PRO 82 -15.897 -8.710 6.154
578 H GLY 83 H GLY 83 -14.860 -12.893 9.117
579 HA2 GLY 83 1HA GLY 83 -16.652 -14.927 9.523
580 HA3 GLY 83 2HA GLY 83 -16.244 -15.039 7.817
581 H GLY 84 H GLY 84 -14.452 -16.116 7.247
582 HA2 GLY 84 1HA GLY 84 -12.335 -16.508 9.236
583 HA3 GLY 84 2HA GLY 84 -13.113 -17.936 8.570
584 H GLY 85 H GLY 85 -11.599 -14.908 7.438
585 HA2 GLY 85 1HA GLY 85 -9.569 -16.131 5.969
586 HA3 GLY 85 2HA GLY 85 -10.933 -15.917 4.882
587 H SER 86 H SER 86 -8.601 -14.677 4.285
588 HA SER 86 HA SER 86 -9.386 -11.955 4.128
589 HB2 SER 86 1HB SER 86 -7.834 -10.880 5.533
590 HB3 SER 86 2HB SER 86 -8.446 -12.207 6.520
591 HG SER 86 HG SER 86 -6.574 -13.398 5.898
592 H SER 87 H SER 87 -8.371 -10.944 2.468
593 HA SER 87 HA SER 87 -6.386 -12.523 1.008
594 HB2 SER 87 1HB SER 87 -8.562 -11.557 -0.029
595 HB3 SER 87 2HB SER 87 -7.692 -10.023 -0.037
596 HG SER 87 HG SER 87 -6.772 -12.428 -1.234
597 H THR 88 H THR 88 -4.737 -11.158 -0.238
598 HA THR 88 HA THR 88 -3.820 -8.815 1.235
599 HB THR 88 HB THR 88 -1.957 -11.145 0.761
600 HG1 THR 88 1HG THR 88 -2.899 -10.308 3.297
601 HG21 THR 88 3HG2 THR 88 -0.328 -9.721 1.289
602 HG22 THR 88 1HG2 THR 88 -1.140 -9.311 2.799
603 HG23 THR 88 2HG2 THR 88 -1.511 -8.413 1.327
604 H LEU 89 H LEU 89 -3.818 -7.403 -0.412
605 HA LEU 89 HA LEU 89 -2.812 -8.209 -3.027
606 HB2 LEU 89 1HB LEU 89 -4.395 -5.927 -1.970
607 HB3 LEU 89 2HB LEU 89 -3.448 -5.672 -3.434
608 HG LEU 89 HG LEU 89 -5.483 -7.875 -3.154
609 HD11 LEU 89 1HD1 LEU 89 -5.835 -5.003 -3.682
610 HD12 LEU 89 2HD1 LEU 89 -6.984 -6.201 -3.088
611 HD13 LEU 89 3HD1 LEU 89 -6.640 -6.090 -4.814
612 HD21 LEU 89 3HD2 LEU 89 -5.326 -8.042 -5.520
613 HD22 LEU 89 1HD2 LEU 89 -3.678 -8.045 -4.892
614 HD23 LEU 89 2HD2 LEU 89 -4.340 -6.583 -5.623
615 H THR 90 H THR 90 -0.666 -8.172 -3.221
616 HA THR 90 HA THR 90 0.907 -6.159 -1.821
617 HB THR 90 HB THR 90 2.819 -7.433 -2.301
618 HG1 THR 90 1HG THR 90 1.264 -8.642 -4.358
619 HG21 THR 90 3HG2 THR 90 2.203 -9.063 -0.915
620 HG22 THR 90 1HG2 THR 90 1.411 -9.907 -2.245
621 HG23 THR 90 2HG2 THR 90 0.510 -8.736 -1.282
622 H GLY 91 H GLY 91 1.921 -4.469 -2.764
623 HA2 GLY 91 1HA GLY 91 2.146 -4.354 -5.673
624 HA3 GLY 91 2HA GLY 91 1.144 -3.129 -4.911
625 H ARG 92 H ARG 92 4.025 -3.489 -6.240
626 HA ARG 92 HA ARG 92 5.549 -2.016 -4.224
627 HB2 ARG 92 1HB ARG 92 6.315 -3.393 -6.792
628 HB3 ARG 92 2HB ARG 92 7.423 -2.325 -5.942
629 HG2 ARG 92 1HG ARG 92 7.150 -3.774 -3.926
630 HG3 ARG 92 2HG ARG 92 6.231 -4.894 -4.934
631 HD2 ARG 92 1HD ARG 92 8.975 -3.987 -5.729
632 HD3 ARG 92 2HD ARG 92 8.751 -5.317 -4.593
633 HE ARG 92 HE ARG 92 8.356 -5.387 -7.422
634 HH11 ARG 92 1HH1 ARG 92 7.307 -6.751 -4.395
635 HH12 ARG 92 2HH1 ARG 92 6.782 -8.244 -5.100
636 HH21 ARG 92 1HH2 ARG 92 7.668 -7.348 -8.362
637 HH22 ARG 92 2HH2 ARG 92 6.989 -8.583 -7.357
638 H VAL 93 H VAL 93 5.764 0.117 -4.311
639 HA VAL 93 HA VAL 93 5.386 1.476 -6.896
640 HB VAL 93 HB VAL 93 3.360 1.886 -5.713
641 HG11 VAL 93 1HG1 VAL 93 5.090 1.845 -3.399
642 HG12 VAL 93 2HG1 VAL 93 4.014 3.243 -3.376
643 HG13 VAL 93 3HG1 VAL 93 3.345 1.616 -3.504
644 HG21 VAL 93 3HG2 VAL 93 3.354 4.060 -6.209
645 HG22 VAL 93 1HG2 VAL 93 4.488 4.430 -4.910
646 HG23 VAL 93 2HG2 VAL 93 5.089 3.913 -6.486
647 H THR 94 H THR 94 7.407 2.113 -7.365
648 HA THR 94 HA THR 94 9.342 2.862 -5.428
649 HB THR 94 HB THR 94 9.276 3.323 -8.414
650 HG1 THR 94 1HG THR 94 10.750 1.549 -8.376
651 HG21 THR 94 3HG2 THR 94 11.434 3.833 -6.378
652 HG22 THR 94 1HG2 THR 94 10.767 4.953 -7.564
653 HG23 THR 94 2HG2 THR 94 11.780 3.610 -8.092
654 H THR 95 H THR 95 8.976 4.591 -4.172
655 HA THR 95 HA THR 95 7.439 6.805 -4.652
656 HB THR 95 HB THR 95 8.999 8.027 -3.049
657 HG1 THR 95 1HG THR 95 10.745 6.987 -2.314
658 HG21 THR 95 3HG2 THR 95 7.427 7.215 -1.684
659 HG22 THR 95 1HG2 THR 95 8.530 5.880 -1.352
660 HG23 THR 95 2HG2 THR 95 7.301 5.717 -2.606
661 H LYS 96 H LYS 96 7.767 8.871 -5.460
662 HA LYS 96 HA LYS 96 9.571 9.067 -7.664
663 HB2 LYS 96 1HB LYS 96 8.125 11.423 -6.496
664 HB3 LYS 96 2HB LYS 96 8.505 11.081 -8.179
665 HG2 LYS 96 1HG LYS 96 6.890 9.017 -7.699
666 HG3 LYS 96 2HG LYS 96 6.244 10.156 -6.515
667 HD2 LYS 96 1HD LYS 96 5.455 11.574 -8.109
668 HD3 LYS 96 2HD LYS 96 6.752 11.192 -9.244
669 HE2 LYS 96 1HE LYS 96 5.694 9.228 -9.961
670 HE3 LYS 96 2HE LYS 96 4.618 9.194 -8.565
671 HZ1 LYS 96 3HZ LYS 96 3.145 10.123 -9.935
672 HZ2 LYS 96 1HZ LYS 96 4.316 10.559 -11.076
673 HZ3 LYS 96 2HZ LYS 96 4.023 11.557 -9.742
674 H LYS 97 H LYS 97 10.993 11.026 -7.943
675 HA LYS 97 HA LYS 97 12.925 11.074 -5.848
676 HB2 LYS 97 1HB LYS 97 12.650 12.369 -8.526
677 HB3 LYS 97 2HB LYS 97 13.838 13.010 -7.398
678 HG2 LYS 97 1HG LYS 97 14.753 10.672 -7.211
679 HG3 LYS 97 2HG LYS 97 13.705 10.244 -8.566
680 HD2 LYS 97 1HD LYS 97 14.797 12.142 -9.836
681 HD3 LYS 97 2HD LYS 97 15.977 12.221 -8.526
682 HE2 LYS 97 1HE LYS 97 15.445 9.578 -9.777
683 HE3 LYS 97 2HE LYS 97 16.381 10.755 -10.698
684 HZ1 LYS 97 3HZ LYS 97 18.127 10.060 -9.542
685 HZ2 LYS 97 1HZ LYS 97 17.172 9.168 -8.467
686 HZ3 LYS 97 2HZ LYS 97 17.459 10.810 -8.180
687 H ALA 98 H ALA 98 13.429 12.665 -4.397
688 HA ALA 98 HA ALA 98 11.370 14.711 -3.993
689 HB1 ALA 98 3HB ALA 98 11.646 13.490 -2.026
690 HB2 ALA 98 1HB ALA 98 13.402 13.449 -2.185
691 HB3 ALA 98 2HB ALA 98 12.590 14.952 -1.745
692 HA PRO 99 HA PRO 99 14.021 17.947 -5.376
693 HB2 PRO 99 1HB PRO 99 12.836 20.029 -4.099
694 HB3 PRO 99 2HB PRO 99 12.123 19.235 -5.508
695 HG2 PRO 99 1HG PRO 99 11.504 18.855 -2.604
696 HG3 PRO 99 2HG PRO 99 10.390 18.979 -3.979
697 HD2 PRO 99 1HD PRO 99 11.071 16.606 -2.866
698 HD3 PRO 99 2HD PRO 99 10.704 16.780 -4.594
699 H SER 100 H SER 100 16.026 17.644 -4.480
700 HA SER 100 HA SER 100 16.922 17.487 -1.971
701 HB2 SER 100 1HB SER 100 18.054 18.740 -4.408
702 HB3 SER 100 2HB SER 100 18.847 19.145 -2.886
703 HG SER 100 HG SER 100 18.861 16.780 -2.533
704 HA PRO 101 HA PRO 101 16.961 22.257 -1.224
705 HB2 PRO 101 1HB PRO 101 15.744 23.825 -3.075
706 HB3 PRO 101 2HB PRO 101 17.452 23.379 -3.167
707 HG2 PRO 101 1HG PRO 101 15.105 22.194 -4.599
708 HG3 PRO 101 2HG PRO 101 16.715 22.590 -5.227
709 HD2 PRO 101 1HD PRO 101 15.995 20.069 -4.552
710 HD3 PRO 101 2HD PRO 101 17.658 20.665 -4.378
711 H SER 102 H SER 102 15.373 23.697 -0.307
712 HA SER 102 HA SER 102 12.910 22.355 0.301
713 HB2 SER 102 1HB SER 102 13.935 25.088 1.107
714 HB3 SER 102 2HB SER 102 12.482 24.327 1.754
715 HG SER 102 HG SER 102 14.010 22.532 2.304
716 H SER 103 H SER 103 13.571 25.628 -0.962
717 HA SER 103 HA SER 103 12.184 27.066 -2.102
718 HB2 SER 103 1HB SER 103 12.371 24.543 -3.704
719 HB3 SER 103 2HB SER 103 11.341 25.852 -4.282
720 HG SER 103 HG SER 103 13.058 26.927 -4.831
721 H GLY 104 H GLY 104 10.766 26.265 0.023
722 HA2 GLY 104 1HA GLY 104 8.276 25.027 -0.702
723 HA3 GLY 104 2HA GLY 104 8.660 25.772 0.842
724 HA PRO 105 HA PRO 105 5.556 28.435 -1.354
725 HB2 PRO 105 1HB PRO 105 3.917 28.712 0.793
726 HB3 PRO 105 2HB PRO 105 3.793 27.363 -0.343
727 HG2 PRO 105 1HG PRO 105 5.106 27.461 2.346
728 HG3 PRO 105 2HG PRO 105 4.083 26.193 1.646
729 HD2 PRO 105 1HD PRO 105 6.784 26.012 1.715
730 HD3 PRO 105 2HD PRO 105 5.812 25.305 0.408
731 H SER 106 H SER 106 4.757 30.620 -0.630
732 HA SER 106 HA SER 106 6.444 31.887 1.394
733 HB2 SER 106 1HB SER 106 6.381 32.598 -1.528
734 HB3 SER 106 2HB SER 106 6.767 33.814 -0.311
735 HG SER 106 HG SER 106 8.209 31.557 -1.104
736 H SER 107 H SER 107 4.963 32.671 2.745
737 HA SER 107 HA SER 107 2.744 34.239 1.604
738 HB2 SER 107 1HB SER 107 1.411 33.525 3.621
739 HB3 SER 107 2HB SER 107 1.778 32.225 2.488
740 HG SER 107 HG SER 107 3.686 31.891 3.953
741 H GLY 108 H GLY 108 1.783 35.761 3.299
742 HA2 GLY 108 1HA GLY 108 3.790 36.743 5.195
743 HA3 GLY 108 2HA GLY 108 3.240 37.842 3.939
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -4.675 -30.915 2.643
2 HA2 GLY 1 1HA GLY 1 -3.937 -30.604 5.416
3 HA3 GLY 1 2HA GLY 1 -3.968 -32.277 4.879
4 H SER 2 H SER 2 -1.845 -32.780 4.870
5 HA SER 2 HA SER 2 0.290 -31.138 4.243
6 HB2 SER 2 1HB SER 2 0.480 -33.389 5.287
7 HB3 SER 2 2HB SER 2 0.124 -34.116 3.721
8 HG SER 2 HG SER 2 2.050 -33.490 2.969
9 H SER 3 H SER 3 -1.275 -33.500 2.075
10 HA SER 3 HA SER 3 0.108 -32.446 -0.222
11 HB2 SER 3 1HB SER 3 -2.061 -34.535 0.060
12 HB3 SER 3 2HB SER 3 -1.311 -34.101 -1.476
13 HG SER 3 HG SER 3 -0.235 -35.868 -0.623
14 H GLY 4 H GLY 4 -0.617 -30.255 -0.179
15 HA2 GLY 4 1HA GLY 4 -3.343 -29.950 -1.272
16 HA3 GLY 4 2HA GLY 4 -2.715 -28.844 -0.059
17 H SER 5 H SER 5 -3.454 -27.408 -1.957
18 HA SER 5 HA SER 5 -1.560 -27.246 -4.143
19 HB2 SER 5 1HB SER 5 -4.054 -25.728 -3.408
20 HB3 SER 5 2HB SER 5 -2.986 -25.158 -4.690
21 HG SER 5 HG SER 5 -3.316 -27.116 -5.769
22 H SER 6 H SER 6 0.403 -26.551 -3.495
23 HA SER 6 HA SER 6 0.724 -24.468 -1.539
24 HB2 SER 6 1HB SER 6 2.678 -25.955 -3.300
25 HB3 SER 6 2HB SER 6 3.172 -24.686 -2.179
26 HG SER 6 HG SER 6 2.765 -27.234 -1.648
27 H GLY 7 H GLY 7 -0.561 -22.846 -2.686
28 HA2 GLY 7 1HA GLY 7 1.114 -21.018 -4.093
29 HA3 GLY 7 2HA GLY 7 -0.035 -21.784 -5.179
30 H LEU 8 H LEU 8 -0.561 -19.372 -5.333
31 HA LEU 8 HA LEU 8 -3.055 -18.926 -4.111
32 HB2 LEU 8 1HB LEU 8 -1.506 -18.485 -2.180
33 HB3 LEU 8 2HB LEU 8 -0.878 -17.113 -3.091
34 HG LEU 8 HG LEU 8 -3.807 -17.269 -2.533
35 HD11 LEU 8 1HD1 LEU 8 -2.026 -17.524 -0.463
36 HD12 LEU 8 2HD1 LEU 8 -3.661 -16.874 -0.342
37 HD13 LEU 8 3HD1 LEU 8 -2.291 -15.782 -0.539
38 HD21 LEU 8 3HD2 LEU 8 -2.001 -14.875 -2.484
39 HD22 LEU 8 1HD2 LEU 8 -3.738 -14.951 -2.781
40 HD23 LEU 8 2HD2 LEU 8 -2.609 -15.538 -4.002
41 H ALA 9 H ALA 9 -4.191 -17.450 -5.252
42 HA ALA 9 HA ALA 9 -2.687 -15.773 -7.155
43 HB1 ALA 9 3HB ALA 9 -3.916 -17.647 -8.221
44 HB2 ALA 9 1HB ALA 9 -5.420 -16.964 -7.601
45 HB3 ALA 9 2HB ALA 9 -4.451 -16.056 -8.762
46 HA PRO 10 HA PRO 10 -4.641 -12.333 -5.193
47 HB2 PRO 10 1HB PRO 10 -4.156 -10.481 -7.118
48 HB3 PRO 10 2HB PRO 10 -2.904 -11.080 -6.024
49 HG2 PRO 10 1HG PRO 10 -3.498 -11.886 -8.845
50 HG3 PRO 10 2HG PRO 10 -1.929 -11.589 -8.073
51 HD2 PRO 10 1HD PRO 10 -2.909 -14.082 -8.470
52 HD3 PRO 10 2HD PRO 10 -1.881 -13.670 -7.083
53 HA PRO 11 HA PRO 11 -8.720 -12.229 -6.891
54 HB2 PRO 11 1HB PRO 11 -9.651 -10.057 -5.554
55 HB3 PRO 11 2HB PRO 11 -9.413 -11.630 -4.784
56 HG2 PRO 11 1HG PRO 11 -7.644 -9.216 -4.745
57 HG3 PRO 11 2HG PRO 11 -8.081 -10.303 -3.415
58 HD2 PRO 11 1HD PRO 11 -5.716 -10.478 -4.721
59 HD3 PRO 11 2HD PRO 11 -6.540 -11.897 -4.044
60 H ARG 12 H ARG 12 -6.641 -9.395 -6.956
61 HA ARG 12 HA ARG 12 -7.495 -8.740 -9.613
62 HB2 ARG 12 1HB ARG 12 -8.489 -7.195 -7.280
63 HB3 ARG 12 2HB ARG 12 -7.943 -6.269 -8.673
64 HG2 ARG 12 1HG ARG 12 -10.149 -8.305 -8.556
65 HG3 ARG 12 2HG ARG 12 -10.270 -6.583 -8.925
66 HD2 ARG 12 1HD ARG 12 -10.326 -7.374 -11.049
67 HD3 ARG 12 2HD ARG 12 -8.576 -7.300 -10.855
68 HE ARG 12 HE ARG 12 -9.807 -9.812 -10.111
69 HH11 ARG 12 1HH1 ARG 12 -8.243 -7.949 -12.601
70 HH12 ARG 12 2HH1 ARG 12 -7.758 -9.337 -13.517
71 HH21 ARG 12 1HH2 ARG 12 -9.175 -11.648 -11.309
72 HH22 ARG 12 2HH2 ARG 12 -8.289 -11.441 -12.782
73 H HIS 13 H HIS 13 -6.486 -6.389 -10.114
74 HA HIS 13 HA HIS 13 -3.673 -6.650 -9.356
75 HB2 HIS 13 1HB HIS 13 -3.121 -5.660 -11.359
76 HB3 HIS 13 2HB HIS 13 -4.652 -6.409 -11.800
77 HD1 HIS 13 1HD HIS 13 -6.789 -4.704 -11.619
78 HD2 HIS 13 2HD HIS 13 -3.008 -3.000 -11.869
79 HE1 HIS 13 1HE HIS 13 -7.171 -2.322 -12.328
80 HE2 HIS 13 2HE HIS 13 -4.865 -1.335 -12.555
81 H LEU 14 H LEU 14 -2.431 -4.837 -8.693
82 HA LEU 14 HA LEU 14 -4.006 -2.885 -7.186
83 HB2 LEU 14 1HB LEU 14 -1.275 -4.025 -6.950
84 HB3 LEU 14 2HB LEU 14 -1.533 -2.386 -6.356
85 HG LEU 14 HG LEU 14 -3.146 -4.761 -5.440
86 HD11 LEU 14 1HD1 LEU 14 -0.586 -4.754 -4.975
87 HD12 LEU 14 2HD1 LEU 14 -1.716 -5.097 -3.666
88 HD13 LEU 14 3HD1 LEU 14 -0.991 -3.496 -3.807
89 HD21 LEU 14 3HD2 LEU 14 -3.611 -3.217 -3.524
90 HD22 LEU 14 1HD2 LEU 14 -4.299 -2.710 -5.067
91 HD23 LEU 14 2HD2 LEU 14 -2.839 -1.931 -4.454
92 H GLY 15 H GLY 15 -3.544 -0.645 -7.262
93 HA2 GLY 15 1HA GLY 15 -1.956 0.225 -9.589
94 HA3 GLY 15 2HA GLY 15 -3.586 0.835 -9.344
95 H PHE 16 H PHE 16 -1.155 2.371 -9.506
96 HA PHE 16 HA PHE 16 -1.329 3.703 -6.899
97 HB2 PHE 16 1HB PHE 16 1.249 3.084 -8.357
98 HB3 PHE 16 2HB PHE 16 1.116 4.102 -6.926
99 HD1 PHE 16 1HD PHE 16 0.658 3.136 -4.748
100 HD2 PHE 16 2HD PHE 16 1.062 0.690 -8.208
101 HE1 PHE 16 1HE PHE 16 0.906 1.153 -3.313
102 HE2 PHE 16 2HE PHE 16 1.310 -1.297 -6.779
103 HZ PHE 16 HZ PHE 16 1.232 -1.067 -4.328
104 H SER 17 H SER 17 -1.930 5.735 -7.191
105 HA SER 17 HA SER 17 -0.987 7.161 -9.587
106 HB2 SER 17 1HB SER 17 -3.388 6.466 -9.797
107 HB3 SER 17 2HB SER 17 -3.748 7.459 -8.385
108 HG SER 17 HG SER 17 -4.102 8.809 -10.038
109 H ASP 18 H ASP 18 -0.856 9.471 -9.368
110 HA ASP 18 HA ASP 18 -0.174 11.361 -8.300
111 HB2 ASP 18 1HB ASP 18 -2.153 10.296 -6.285
112 HB3 ASP 18 2HB ASP 18 -1.341 11.846 -6.090
113 H VAL 19 H VAL 19 1.270 8.801 -7.887
114 HA VAL 19 HA VAL 19 2.215 8.484 -5.292
115 HB VAL 19 HB VAL 19 3.691 8.057 -7.893
116 HG11 VAL 19 1HG1 VAL 19 4.402 7.436 -5.058
117 HG12 VAL 19 2HG1 VAL 19 4.949 6.374 -6.357
118 HG13 VAL 19 3HG1 VAL 19 5.412 8.076 -6.353
119 HG21 VAL 19 3HG2 VAL 19 1.628 6.754 -7.677
120 HG22 VAL 19 1HG2 VAL 19 3.056 5.720 -7.608
121 HG23 VAL 19 2HG2 VAL 19 2.187 6.125 -6.127
122 H SER 20 H SER 20 3.531 9.616 -4.011
123 HA SER 20 HA SER 20 5.008 11.873 -5.200
124 HB2 SER 20 1HB SER 20 3.023 12.203 -3.468
125 HB3 SER 20 2HB SER 20 4.297 11.860 -2.298
126 HG SER 20 HG SER 20 5.260 13.586 -4.063
127 H HIS 21 H HIS 21 6.685 12.605 -3.281
128 HA HIS 21 HA HIS 21 8.514 10.346 -3.124
129 HB2 HIS 21 1HB HIS 21 10.190 12.028 -2.471
130 HB3 HIS 21 2HB HIS 21 9.380 12.469 -3.972
131 HD1 HIS 21 1HD HIS 21 7.834 14.541 -3.921
132 HD2 HIS 21 2HD HIS 21 9.720 13.738 -0.308
133 HE1 HIS 21 1HE HIS 21 7.500 16.600 -2.516
134 HE2 HIS 21 2HE HIS 21 8.723 16.123 -0.367
135 H ASP 22 H ASP 22 6.199 11.770 -1.182
136 HA ASP 22 HA ASP 22 7.396 10.556 1.214
137 HB2 ASP 22 1HB ASP 22 7.463 13.148 1.108
138 HB3 ASP 22 2HB ASP 22 5.729 13.050 1.403
139 H ALA 23 H ALA 23 5.109 10.148 -0.924
140 HA ALA 23 HA ALA 23 3.411 8.667 0.812
141 HB1 ALA 23 3HB ALA 23 2.369 11.269 -0.279
142 HB2 ALA 23 1HB ALA 23 1.315 9.956 0.249
143 HB3 ALA 23 2HB ALA 23 2.408 10.727 1.399
144 H ALA 24 H ALA 24 1.615 7.620 -0.384
145 HA ALA 24 HA ALA 24 1.676 7.727 -3.266
146 HB1 ALA 24 3HB ALA 24 3.486 6.021 -2.076
147 HB2 ALA 24 1HB ALA 24 2.125 4.969 -2.468
148 HB3 ALA 24 2HB ALA 24 2.898 5.922 -3.736
149 H ARG 25 H ARG 25 -0.321 7.387 -3.986
150 HA ARG 25 HA ARG 25 -2.305 6.272 -2.167
151 HB2 ARG 25 1HB ARG 25 -2.627 8.429 -3.494
152 HB3 ARG 25 2HB ARG 25 -2.809 7.407 -4.914
153 HG2 ARG 25 1HG ARG 25 -4.769 6.398 -4.046
154 HG3 ARG 25 2HG ARG 25 -4.508 7.112 -2.453
155 HD2 ARG 25 1HD ARG 25 -6.268 8.241 -3.817
156 HD3 ARG 25 2HD ARG 25 -4.966 9.303 -3.281
157 HE ARG 25 HE ARG 25 -4.416 8.265 -5.859
158 HH11 ARG 25 1HH1 ARG 25 -6.397 10.596 -4.196
159 HH12 ARG 25 2HH1 ARG 25 -6.544 11.644 -5.568
160 HH21 ARG 25 1HH2 ARG 25 -4.602 9.636 -7.672
161 HH22 ARG 25 2HH2 ARG 25 -5.523 11.096 -7.545
162 H VAL 26 H VAL 26 -2.792 4.189 -2.232
163 HA VAL 26 HA VAL 26 -2.391 2.717 -4.751
164 HB VAL 26 HB VAL 26 -1.010 1.773 -3.062
165 HG11 VAL 26 1HG1 VAL 26 -3.345 2.285 -1.335
166 HG12 VAL 26 2HG1 VAL 26 -2.431 0.817 -0.987
167 HG13 VAL 26 3HG1 VAL 26 -1.622 2.385 -0.976
168 HG21 VAL 26 3HG2 VAL 26 -2.418 0.230 -4.501
169 HG22 VAL 26 1HG2 VAL 26 -1.744 -0.471 -3.030
170 HG23 VAL 26 2HG2 VAL 26 -3.442 0.002 -3.084
171 H PHE 27 H PHE 27 -4.146 2.084 -5.803
172 HA PHE 27 HA PHE 27 -6.623 1.630 -4.276
173 HB2 PHE 27 1HB PHE 27 -7.924 2.608 -6.053
174 HB3 PHE 27 2HB PHE 27 -6.681 3.761 -5.581
175 HD1 PHE 27 2HD PHE 27 -7.394 1.100 -8.079
176 HD2 PHE 27 1HD PHE 27 -5.313 4.705 -7.188
177 HE1 PHE 27 2HE PHE 27 -6.643 1.240 -10.417
178 HE2 PHE 27 1HE PHE 27 -4.560 4.851 -9.526
179 HZ PHE 27 HZ PHE 27 -5.224 3.117 -11.144
180 H TRP 28 H TRP 28 -7.663 -0.235 -4.664
181 HA TRP 28 HA TRP 28 -6.554 -1.982 -6.752
182 HB2 TRP 28 1HB TRP 28 -7.796 -3.780 -5.360
183 HB3 TRP 28 2HB TRP 28 -6.304 -3.099 -4.717
184 HD1 TRP 28 HD TRP 28 -9.914 -3.585 -3.886
185 HE1 TRP 28 1HE TRP 28 -10.453 -2.471 -1.629
186 HE3 TRP 28 3HE TRP 28 -5.609 -0.901 -3.257
187 HZ2 TRP 28 2HZ TRP 28 -9.216 -0.691 0.179
188 HZ3 TRP 28 3HZ TRP 28 -5.366 0.482 -1.237
189 HH2 TRP 28 HH TRP 28 -7.134 0.585 0.444
190 H GLU 29 H GLU 29 -8.176 -3.595 -7.648
191 HA GLU 29 HA GLU 29 -10.418 -2.099 -8.694
192 HB2 GLU 29 1HB GLU 29 -9.080 -4.681 -9.343
193 HB3 GLU 29 2HB GLU 29 -10.752 -4.473 -9.845
194 HG2 GLU 29 1HG GLU 29 -9.845 -2.202 -10.798
195 HG3 GLU 29 2HG GLU 29 -8.305 -3.058 -10.762
196 H GLY 30 H GLY 30 -10.188 -3.269 -5.837
197 HA2 GLY 30 1HA GLY 30 -11.900 -3.743 -4.328
198 HA3 GLY 30 2HA GLY 30 -12.982 -4.028 -5.683
199 H ALA 31 H ALA 31 -13.643 -5.851 -4.264
200 HA ALA 31 HA ALA 31 -12.038 -8.218 -4.923
201 HB1 ALA 31 3HB ALA 31 -11.638 -8.775 -2.809
202 HB2 ALA 31 1HB ALA 31 -12.208 -7.170 -2.351
203 HB3 ALA 31 2HB ALA 31 -13.326 -8.534 -2.360
204 HA PRO 32 HA PRO 32 -15.847 -9.982 -6.215
205 HB2 PRO 32 1HB PRO 32 -15.365 -12.615 -5.762
206 HB3 PRO 32 2HB PRO 32 -14.606 -11.712 -7.078
207 HG2 PRO 32 1HG PRO 32 -13.500 -12.433 -4.392
208 HG3 PRO 32 2HG PRO 32 -12.713 -12.496 -5.979
209 HD2 PRO 32 1HD PRO 32 -12.298 -10.475 -4.226
210 HD3 PRO 32 2HD PRO 32 -12.262 -10.235 -5.984
211 H ARG 33 H ARG 33 -14.838 -10.047 -2.991
212 HA ARG 33 HA ARG 33 -17.506 -10.949 -2.139
213 HB2 ARG 33 1HB ARG 33 -16.232 -11.739 -0.011
214 HB3 ARG 33 2HB ARG 33 -16.235 -12.759 -1.443
215 HG2 ARG 33 1HG ARG 33 -14.021 -11.456 -1.984
216 HG3 ARG 33 2HG ARG 33 -14.022 -11.180 -0.240
217 HD2 ARG 33 1HD ARG 33 -13.975 -13.500 0.220
218 HD3 ARG 33 2HD ARG 33 -14.355 -13.912 -1.452
219 HE ARG 33 HE ARG 33 -11.878 -12.473 -1.087
220 HH11 ARG 33 1HH1 ARG 33 -13.426 -15.584 -1.282
221 HH12 ARG 33 2HH1 ARG 33 -11.975 -16.425 -1.717
222 HH21 ARG 33 1HH2 ARG 33 -9.960 -13.568 -1.659
223 HH22 ARG 33 2HH2 ARG 33 -10.004 -15.277 -1.930
224 HA PRO 34 HA PRO 34 -17.794 -7.242 0.190
225 HB2 PRO 34 1HB PRO 34 -19.195 -8.063 2.367
226 HB3 PRO 34 2HB PRO 34 -19.921 -7.896 0.764
227 HG2 PRO 34 1HG PRO 34 -18.931 -10.359 2.148
228 HG3 PRO 34 2HG PRO 34 -20.413 -10.126 1.202
229 HD2 PRO 34 1HD PRO 34 -18.206 -11.320 0.184
230 HD3 PRO 34 2HD PRO 34 -19.312 -10.351 -0.811
231 H VAL 35 H VAL 35 -16.741 -6.099 1.759
232 HA VAL 35 HA VAL 35 -15.100 -7.633 3.668
233 HB VAL 35 HB VAL 35 -14.307 -5.085 2.250
234 HG11 VAL 35 1HG1 VAL 35 -13.394 -5.081 4.461
235 HG12 VAL 35 2HG1 VAL 35 -12.877 -6.762 4.306
236 HG13 VAL 35 3HG1 VAL 35 -12.101 -5.507 3.340
237 HG21 VAL 35 3HG2 VAL 35 -13.778 -6.522 0.606
238 HG22 VAL 35 1HG2 VAL 35 -12.415 -6.946 1.643
239 HG23 VAL 35 2HG2 VAL 35 -13.880 -7.927 1.666
240 H ARG 36 H ARG 36 -14.762 -6.715 5.709
241 HA ARG 36 HA ARG 36 -16.739 -4.666 6.431
242 HB2 ARG 36 1HB ARG 36 -16.597 -5.522 8.699
243 HB3 ARG 36 2HB ARG 36 -16.925 -6.841 7.583
244 HG2 ARG 36 1HG ARG 36 -14.838 -7.772 7.854
245 HG3 ARG 36 2HG ARG 36 -14.111 -6.249 8.370
246 HD2 ARG 36 1HD ARG 36 -15.122 -6.391 10.511
247 HD3 ARG 36 2HD ARG 36 -16.171 -7.714 10.002
248 HE ARG 36 HE ARG 36 -13.604 -8.638 9.667
249 HH11 ARG 36 1HH1 ARG 36 -15.514 -7.416 12.309
250 HH12 ARG 36 2HH1 ARG 36 -14.692 -8.357 13.510
251 HH21 ARG 36 1HH2 ARG 36 -12.514 -9.881 11.238
252 HH22 ARG 36 2HH2 ARG 36 -12.984 -9.757 12.900
253 H LEU 37 H LEU 37 -13.343 -5.408 6.423
254 HA LEU 37 HA LEU 37 -12.682 -2.666 6.963
255 HB2 LEU 37 1HB LEU 37 -12.981 -3.498 9.235
256 HB3 LEU 37 2HB LEU 37 -11.843 -4.804 8.916
257 HG LEU 37 HG LEU 37 -10.090 -3.021 8.548
258 HD11 LEU 37 1HD1 LEU 37 -10.482 -0.820 9.398
259 HD12 LEU 37 2HD1 LEU 37 -12.109 -1.256 9.919
260 HD13 LEU 37 3HD1 LEU 37 -11.726 -1.178 8.200
261 HD21 LEU 37 3HD2 LEU 37 -10.923 -4.301 10.816
262 HD22 LEU 37 1HD2 LEU 37 -10.918 -2.611 11.320
263 HD23 LEU 37 2HD2 LEU 37 -9.450 -3.341 10.668
264 H VAL 38 H VAL 38 -10.411 -2.212 6.645
265 HA VAL 38 HA VAL 38 -8.893 -4.379 5.366
266 HB VAL 38 HB VAL 38 -9.166 -1.599 4.215
267 HG11 VAL 38 1HG1 VAL 38 -6.994 -2.437 3.740
268 HG12 VAL 38 2HG1 VAL 38 -7.629 -4.031 3.327
269 HG13 VAL 38 3HG1 VAL 38 -7.958 -2.651 2.279
270 HG21 VAL 38 3HG2 VAL 38 -10.056 -3.396 2.328
271 HG22 VAL 38 1HG2 VAL 38 -10.719 -4.031 3.834
272 HG23 VAL 38 2HG2 VAL 38 -11.073 -2.374 3.343
273 H ARG 39 H ARG 39 -6.679 -4.272 5.596
274 HA ARG 39 HA ARG 39 -5.610 -2.017 7.153
275 HB2 ARG 39 1HB ARG 39 -6.090 -4.316 8.381
276 HB3 ARG 39 2HB ARG 39 -4.556 -4.764 7.648
277 HG2 ARG 39 1HG ARG 39 -3.524 -2.778 8.716
278 HG3 ARG 39 2HG ARG 39 -5.056 -2.477 9.538
279 HD2 ARG 39 1HD ARG 39 -3.529 -3.668 11.002
280 HD3 ARG 39 2HD ARG 39 -4.911 -4.684 10.596
281 HE ARG 39 HE ARG 39 -2.151 -5.096 9.820
282 HH11 ARG 39 1HH1 ARG 39 -5.490 -5.937 9.307
283 HH12 ARG 39 2HH1 ARG 39 -5.128 -7.456 8.557
284 HH21 ARG 39 1HH2 ARG 39 -1.661 -7.094 8.835
285 HH22 ARG 39 2HH2 ARG 39 -2.950 -8.114 8.290
286 H VAL 40 H VAL 40 -4.341 -1.039 5.692
287 HA VAL 40 HA VAL 40 -2.693 -2.635 3.887
288 HB VAL 40 HB VAL 40 -2.956 0.371 4.013
289 HG11 VAL 40 1HG1 VAL 40 -2.272 -0.068 1.510
290 HG12 VAL 40 2HG1 VAL 40 -1.053 0.035 2.782
291 HG13 VAL 40 3HG1 VAL 40 -1.582 -1.541 2.191
292 HG21 VAL 40 3HG2 VAL 40 -5.086 -0.121 3.394
293 HG22 VAL 40 1HG2 VAL 40 -4.321 -0.271 1.812
294 HG23 VAL 40 2HG2 VAL 40 -4.655 -1.713 2.770
295 H THR 41 H THR 41 -0.541 -2.861 4.061
296 HA THR 41 HA THR 41 0.896 -1.195 6.012
297 HB THR 41 HB THR 41 2.230 -3.279 6.612
298 HG1 THR 41 1HG THR 41 -0.077 -4.600 5.587
299 HG21 THR 41 3HG2 THR 41 0.971 -3.493 8.474
300 HG22 THR 41 1HG2 THR 41 -0.503 -3.819 7.564
301 HG23 THR 41 2HG2 THR 41 0.052 -2.159 7.777
302 H TYR 42 H TYR 42 2.530 -0.205 5.044
303 HA TYR 42 HA TYR 42 3.775 -1.492 2.706
304 HB2 TYR 42 1HB TYR 42 4.557 0.905 2.217
305 HB3 TYR 42 2HB TYR 42 2.854 0.541 1.966
306 HD1 TYR 42 2HD TYR 42 1.187 1.262 3.708
307 HD2 TYR 42 1HD TYR 42 5.237 2.567 3.753
308 HE1 TYR 42 2HE TYR 42 0.567 3.117 5.200
309 HE2 TYR 42 1HE TYR 42 4.628 4.424 5.246
310 HH TYR 42 HH TYR 42 2.691 4.833 6.979
311 H VAL 43 H VAL 43 6.010 -1.561 2.526
312 HA VAL 43 HA VAL 43 7.592 -0.620 4.806
313 HB VAL 43 HB VAL 43 6.995 -3.017 5.194
314 HG11 VAL 43 1HG1 VAL 43 7.169 -3.481 2.642
315 HG12 VAL 43 2HG1 VAL 43 8.879 -3.745 2.990
316 HG13 VAL 43 3HG1 VAL 43 7.653 -4.730 3.789
317 HG21 VAL 43 3HG2 VAL 43 9.599 -1.788 5.231
318 HG22 VAL 43 1HG2 VAL 43 8.861 -2.886 6.397
319 HG23 VAL 43 2HG2 VAL 43 9.738 -3.532 5.010
320 H SER 44 H SER 44 9.678 -0.043 4.319
321 HA SER 44 HA SER 44 10.263 0.705 1.681
322 HB2 SER 44 1HB SER 44 12.328 1.501 2.503
323 HB3 SER 44 2HB SER 44 11.226 1.643 3.873
324 HG SER 44 HG SER 44 13.351 -0.127 3.463
325 H SER 45 H SER 45 11.870 -0.053 0.232
326 HA SER 45 HA SER 45 11.834 -2.596 -0.570
327 HB2 SER 45 1HB SER 45 13.159 -0.593 -1.540
328 HB3 SER 45 2HB SER 45 14.498 -1.195 -0.563
329 HG SER 45 HG SER 45 14.717 -2.206 -2.484
330 H GLU 46 H GLU 46 14.106 -1.364 1.867
331 HA GLU 46 HA GLU 46 14.932 -4.105 2.471
332 HB2 GLU 46 1HB GLU 46 16.028 -1.484 3.505
333 HB3 GLU 46 2HB GLU 46 16.707 -3.076 3.810
334 HG2 GLU 46 1HG GLU 46 17.224 -3.347 1.466
335 HG3 GLU 46 2HG GLU 46 16.454 -1.805 1.094
336 H GLY 47 H GLY 47 15.380 -4.438 4.931
337 HA2 GLY 47 1HA GLY 47 12.819 -4.073 6.251
338 HA3 GLY 47 2HA GLY 47 14.155 -5.065 6.817
339 H GLY 48 H GLY 48 12.582 -2.025 7.020
340 HA2 GLY 48 1HA GLY 48 14.095 -1.332 9.362
341 HA3 GLY 48 2HA GLY 48 14.450 -0.286 7.995
342 H HIS 49 H HIS 49 12.527 0.735 6.938
343 HA HIS 49 HA HIS 49 10.741 1.726 9.027
344 HB2 HIS 49 1HB HIS 49 11.858 3.450 7.786
345 HB3 HIS 49 2HB HIS 49 11.380 2.732 6.251
346 HD1 HIS 49 1HD HIS 49 9.422 3.800 5.193
347 HD2 HIS 49 2HD HIS 49 9.426 4.328 9.314
348 HE1 HIS 49 1HE HIS 49 7.435 5.260 5.686
349 HE2 HIS 49 2HE HIS 49 7.507 5.636 8.175
350 H SER 50 H SER 50 8.484 1.809 8.779
351 HA SER 50 HA SER 50 7.124 0.723 6.536
352 HB2 SER 50 1HB SER 50 6.292 -1.343 7.503
353 HB3 SER 50 2HB SER 50 8.056 -1.375 7.504
354 HG SER 50 HG SER 50 6.775 -0.369 9.768
355 H GLY 51 H GLY 51 4.779 0.604 6.880
356 HA2 GLY 51 1HA GLY 51 3.876 2.080 9.265
357 HA3 GLY 51 2HA GLY 51 3.413 2.633 7.663
358 H GLN 52 H GLN 52 1.245 2.340 8.734
359 HA GLN 52 HA GLN 52 -0.003 0.031 7.683
360 HB2 GLN 52 1HB GLN 52 0.867 -1.168 9.545
361 HB3 GLN 52 2HB GLN 52 0.439 0.120 10.663
362 HG2 GLN 52 1HG GLN 52 -1.980 -0.358 10.022
363 HG3 GLN 52 2HG GLN 52 -1.366 -1.843 9.296
364 HE21 GLN 52 1HE2 GLN 52 -3.007 -0.985 11.794
365 HE22 GLN 52 2HE2 GLN 52 -2.344 -1.981 13.040
366 H THR 53 H THR 53 -1.790 0.941 6.932
367 HA THR 53 HA THR 53 -3.244 2.828 8.670
368 HB THR 53 HB THR 53 -2.237 3.871 6.622
369 HG1 THR 53 1HG THR 53 -5.054 3.944 6.407
370 HG21 THR 53 3HG2 THR 53 -4.171 2.003 5.258
371 HG22 THR 53 1HG2 THR 53 -2.430 2.126 5.009
372 HG23 THR 53 2HG2 THR 53 -3.491 3.432 4.479
373 H GLU 54 H GLU 54 -5.470 2.656 8.797
374 HA GLU 54 HA GLU 54 -6.573 0.134 7.766
375 HB2 GLU 54 1HB GLU 54 -7.351 1.858 10.116
376 HB3 GLU 54 2HB GLU 54 -8.352 0.537 9.532
377 HG2 GLU 54 1HG GLU 54 -7.114 -0.323 11.334
378 HG3 GLU 54 2HG GLU 54 -6.368 -0.971 9.874
379 H ALA 55 H ALA 55 -8.567 0.080 6.728
380 HA ALA 55 HA ALA 55 -9.889 2.616 6.134
381 HB1 ALA 55 3HB ALA 55 -8.810 0.765 4.013
382 HB2 ALA 55 1HB ALA 55 -9.937 2.087 3.709
383 HB3 ALA 55 2HB ALA 55 -8.320 2.430 4.324
384 HA PRO 56 HA PRO 56 -13.562 0.232 6.475
385 HB2 PRO 56 1HB PRO 56 -15.228 1.625 4.845
386 HB3 PRO 56 2HB PRO 56 -14.708 2.223 6.425
387 HG2 PRO 56 1HG PRO 56 -13.664 2.907 3.704
388 HG3 PRO 56 2HG PRO 56 -14.002 3.980 5.075
389 HD2 PRO 56 1HD PRO 56 -11.500 3.146 4.461
390 HD3 PRO 56 2HD PRO 56 -12.017 3.467 6.128
391 H GLY 57 H GLY 57 -14.899 -1.263 5.388
392 HA2 GLY 57 1HA GLY 57 -13.720 -2.664 3.272
393 HA3 GLY 57 2HA GLY 57 -15.377 -2.867 3.819
394 H ASN 58 H ASN 58 -15.631 0.165 3.199
395 HA ASN 58 HA ASN 58 -16.532 -0.259 0.466
396 HB2 ASN 58 1HB ASN 58 -16.852 2.198 2.201
397 HB3 ASN 58 2HB ASN 58 -17.722 1.834 0.714
398 HD21 ASN 58 1HD2 ASN 58 -18.604 2.319 3.517
399 HD22 ASN 58 2HD2 ASN 58 -19.603 0.964 3.908
400 H ALA 59 H ALA 59 -13.740 0.747 1.925
401 HA ALA 59 HA ALA 59 -13.069 2.842 0.030
402 HB1 ALA 59 3HB ALA 59 -11.973 1.837 2.546
403 HB2 ALA 59 1HB ALA 59 -10.748 2.275 1.355
404 HB3 ALA 59 2HB ALA 59 -11.947 3.463 1.864
405 H THR 60 H THR 60 -12.101 2.516 -1.858
406 HA THR 60 HA THR 60 -11.029 -0.152 -2.443
407 HB THR 60 HB THR 60 -11.045 0.796 -4.856
408 HG1 THR 60 1HG THR 60 -12.400 2.531 -5.180
409 HG21 THR 60 3HG2 THR 60 -13.751 0.450 -3.587
410 HG22 THR 60 1HG2 THR 60 -12.632 -0.897 -3.794
411 HG23 THR 60 2HG2 THR 60 -13.230 -0.022 -5.204
412 H SER 61 H SER 61 -9.844 2.599 -1.275
413 HA SER 61 HA SER 61 -7.181 2.052 -2.230
414 HB2 SER 61 1HB SER 61 -7.933 3.514 -4.021
415 HB3 SER 61 2HB SER 61 -8.500 4.706 -2.851
416 HG SER 61 HG SER 61 -6.311 4.936 -2.175
417 H ALA 62 H ALA 62 -5.550 3.393 -1.112
418 HA ALA 62 HA ALA 62 -6.450 4.814 1.256
419 HB1 ALA 62 3HB ALA 62 -5.308 3.447 2.842
420 HB2 ALA 62 1HB ALA 62 -6.359 2.397 1.890
421 HB3 ALA 62 2HB ALA 62 -4.625 2.439 1.566
422 H MET 63 H MET 63 -4.938 6.243 2.069
423 HA MET 63 HA MET 63 -2.772 6.902 0.282
424 HB2 MET 63 1HB MET 63 -4.022 8.178 2.680
425 HB3 MET 63 2HB MET 63 -2.419 8.698 2.177
426 HG2 MET 63 1HG MET 63 -4.550 8.565 0.118
427 HG3 MET 63 2HG MET 63 -4.615 9.868 1.302
428 HE1 MET 63 3HE MET 63 -1.455 9.177 -1.933
429 HE2 MET 63 1HE MET 63 -1.274 8.230 -0.456
430 HE3 MET 63 2HE MET 63 -2.739 8.079 -1.427
431 H LEU 64 H LEU 64 -0.569 7.043 0.847
432 HA LEU 64 HA LEU 64 0.209 5.486 3.223
433 HB2 LEU 64 1HB LEU 64 1.631 5.440 0.570
434 HB3 LEU 64 2HB LEU 64 1.989 4.458 1.989
435 HG LEU 64 HG LEU 64 -0.435 4.244 0.206
436 HD11 LEU 64 1HD1 LEU 64 2.123 2.767 0.460
437 HD12 LEU 64 2HD1 LEU 64 1.145 3.109 -0.967
438 HD13 LEU 64 3HD1 LEU 64 0.662 1.830 0.146
439 HD21 LEU 64 3HD2 LEU 64 -0.102 3.519 2.949
440 HD22 LEU 64 1HD2 LEU 64 -0.231 2.057 1.972
441 HD23 LEU 64 2HD2 LEU 64 -1.498 3.281 1.898
442 H GLY 65 H GLY 65 2.324 5.976 4.087
443 HA2 GLY 65 1HA GLY 65 4.315 7.498 3.732
444 HA3 GLY 65 2HA GLY 65 3.114 8.761 3.505
445 HA PRO 66 HA PRO 66 4.921 9.997 4.307
446 HB2 PRO 66 1HB PRO 66 7.136 10.421 5.819
447 HB3 PRO 66 2HB PRO 66 5.673 11.403 5.962
448 HG2 PRO 66 1HG PRO 66 6.596 9.120 7.664
449 HG3 PRO 66 2HG PRO 66 5.883 10.667 8.157
450 HD2 PRO 66 1HD PRO 66 4.449 8.374 8.041
451 HD3 PRO 66 2HD PRO 66 3.735 9.965 7.708
452 H LEU 67 H LEU 67 6.183 9.166 2.758
453 HA LEU 67 HA LEU 67 7.711 6.728 3.378
454 HB2 LEU 67 1HB LEU 67 6.819 7.621 0.650
455 HB3 LEU 67 2HB LEU 67 7.423 6.036 1.129
456 HG LEU 67 HG LEU 67 4.744 7.248 1.793
457 HD11 LEU 67 1HD1 LEU 67 4.216 6.307 -0.157
458 HD12 LEU 67 2HD1 LEU 67 4.390 4.761 0.674
459 HD13 LEU 67 3HD1 LEU 67 5.741 5.426 -0.244
460 HD21 LEU 67 3HD2 LEU 67 4.254 5.365 3.124
461 HD22 LEU 67 1HD2 LEU 67 5.831 5.935 3.671
462 HD23 LEU 67 2HD2 LEU 67 5.721 4.526 2.617
463 H SER 68 H SER 68 9.461 6.479 1.444
464 HA SER 68 HA SER 68 11.208 8.794 1.798
465 HB2 SER 68 1HB SER 68 12.007 6.469 2.337
466 HB3 SER 68 2HB SER 68 11.902 6.097 0.617
467 HG SER 68 HG SER 68 13.762 7.021 0.387
468 H SER 69 H SER 69 12.834 8.897 -0.241
469 HA SER 69 HA SER 69 11.090 9.377 -2.563
470 HB2 SER 69 1HB SER 69 12.944 10.986 -3.253
471 HB3 SER 69 2HB SER 69 11.998 11.452 -1.839
472 HG SER 69 HG SER 69 14.431 10.027 -1.624
473 H SER 70 H SER 70 11.792 8.809 -4.633
474 HA SER 70 HA SER 70 12.610 7.247 -6.097
475 HB2 SER 70 1HB SER 70 14.400 9.091 -5.871
476 HB3 SER 70 2HB SER 70 15.308 7.908 -4.930
477 HG SER 70 HG SER 70 14.278 7.123 -7.407
478 H THR 71 H THR 71 11.874 6.196 -3.484
479 HA THR 71 HA THR 71 13.670 3.860 -3.401
480 HB THR 71 HB THR 71 12.163 5.097 -1.089
481 HG1 THR 71 1HG THR 71 14.353 5.908 -2.004
482 HG21 THR 71 3HG2 THR 71 12.186 3.010 -0.265
483 HG22 THR 71 1HG2 THR 71 13.918 3.260 -0.049
484 HG23 THR 71 2HG2 THR 71 13.318 2.441 -1.491
485 H THR 72 H THR 72 12.757 1.925 -3.708
486 HA THR 72 HA THR 72 9.967 1.771 -4.367
487 HB THR 72 HB THR 72 12.051 -0.412 -4.173
488 HG1 THR 72 1HG THR 72 12.203 -0.148 -6.386
489 HG21 THR 72 3HG2 THR 72 9.815 -0.951 -5.916
490 HG22 THR 72 1HG2 THR 72 9.269 -0.669 -4.264
491 HG23 THR 72 2HG2 THR 72 10.465 -1.923 -4.596
492 H TYR 73 H TYR 73 8.318 0.982 -3.183
493 HA TYR 73 HA TYR 73 8.954 -0.166 -0.545
494 HB2 TYR 73 1HB TYR 73 7.055 2.008 -1.300
495 HB3 TYR 73 2HB TYR 73 6.594 0.919 0.004
496 HD1 TYR 73 1HD TYR 73 9.480 3.023 -1.094
497 HD2 TYR 73 2HD TYR 73 7.247 1.436 2.162
498 HE1 TYR 73 1HE TYR 73 10.847 4.333 0.475
499 HE2 TYR 73 2HE TYR 73 8.607 2.742 3.740
500 HH TYR 73 HH TYR 73 10.793 3.805 3.844
501 H THR 74 H THR 74 7.494 -1.719 0.276
502 HA THR 74 HA THR 74 5.922 -3.056 -1.821
503 HB THR 74 HB THR 74 6.951 -4.265 0.751
504 HG1 THR 74 1HG THR 74 8.545 -3.562 -0.952
505 HG21 THR 74 3HG2 THR 74 5.433 -5.829 0.198
506 HG22 THR 74 1HG2 THR 74 6.589 -6.287 -1.053
507 HG23 THR 74 2HG2 THR 74 5.250 -5.208 -1.442
508 H VAL 75 H VAL 75 3.878 -2.318 -1.670
509 HA VAL 75 HA VAL 75 2.645 -1.842 0.911
510 HB VAL 75 HB VAL 75 1.406 -1.664 -1.839
511 HG11 VAL 75 1HG1 VAL 75 -0.117 -0.048 -0.540
512 HG12 VAL 75 2HG1 VAL 75 -0.359 -1.782 -0.319
513 HG13 VAL 75 3HG1 VAL 75 0.506 -0.849 0.902
514 HG21 VAL 75 3HG2 VAL 75 3.198 -0.117 -1.812
515 HG22 VAL 75 1HG2 VAL 75 1.739 0.816 -1.478
516 HG23 VAL 75 2HG2 VAL 75 2.834 0.389 -0.163
517 H ARG 76 H ARG 76 1.026 -3.029 1.835
518 HA ARG 76 HA ARG 76 0.172 -5.476 0.449
519 HB2 ARG 76 1HB ARG 76 2.016 -5.669 2.342
520 HB3 ARG 76 2HB ARG 76 0.614 -5.561 3.399
521 HG2 ARG 76 1HG ARG 76 -0.377 -7.497 2.274
522 HG3 ARG 76 2HG ARG 76 1.045 -7.610 1.235
523 HD2 ARG 76 1HD ARG 76 1.468 -9.171 2.910
524 HD3 ARG 76 2HD ARG 76 2.378 -7.753 3.428
525 HE ARG 76 HE ARG 76 -0.007 -7.457 4.676
526 HH11 ARG 76 1HH1 ARG 76 2.303 -10.056 4.493
527 HH12 ARG 76 2HH1 ARG 76 1.928 -10.674 6.067
528 HH21 ARG 76 1HH2 ARG 76 -0.509 -8.261 6.750
529 HH22 ARG 76 2HH2 ARG 76 0.328 -9.653 7.350
530 H VAL 77 H VAL 77 -1.944 -5.256 0.150
531 HA VAL 77 HA VAL 77 -3.552 -3.836 2.140
532 HB VAL 77 HB VAL 77 -4.289 -4.798 -0.628
533 HG11 VAL 77 1HG1 VAL 77 -6.035 -4.408 1.389
534 HG12 VAL 77 2HG1 VAL 77 -5.932 -2.770 0.739
535 HG13 VAL 77 3HG1 VAL 77 -6.412 -4.107 -0.307
536 HG21 VAL 77 3HG2 VAL 77 -3.406 -2.147 0.462
537 HG22 VAL 77 1HG2 VAL 77 -2.802 -3.028 -0.941
538 HG23 VAL 77 2HG2 VAL 77 -4.385 -2.254 -1.000
539 H THR 78 H THR 78 -3.944 -5.250 3.779
540 HA THR 78 HA THR 78 -4.875 -7.946 3.172
541 HB THR 78 HB THR 78 -4.468 -6.692 5.891
542 HG1 THR 78 1HG THR 78 -2.446 -6.732 5.127
543 HG21 THR 78 3HG2 THR 78 -5.771 -8.606 6.196
544 HG22 THR 78 1HG2 THR 78 -4.125 -9.191 6.440
545 HG23 THR 78 2HG2 THR 78 -4.948 -9.486 4.908
546 H CYS 79 H CYS 79 -6.958 -7.963 2.543
547 HA CYS 79 HA CYS 79 -8.911 -6.239 3.816
548 HB2 CYS 79 1HB CYS 79 -9.283 -8.344 1.675
549 HB3 CYS 79 2HB CYS 79 -10.485 -7.163 2.182
550 HG CYS 79 HG CYS 79 -7.667 -5.682 1.260
551 H LEU 80 H LEU 80 -9.460 -6.868 5.820
552 HA LEU 80 HA LEU 80 -9.703 -9.653 6.526
553 HB2 LEU 80 1HB LEU 80 -9.871 -7.053 7.943
554 HB3 LEU 80 2HB LEU 80 -10.716 -8.422 8.661
555 HG LEU 80 HG LEU 80 -8.600 -8.289 9.713
556 HD11 LEU 80 1HD1 LEU 80 -8.011 -10.394 7.692
557 HD12 LEU 80 2HD1 LEU 80 -9.459 -10.544 8.687
558 HD13 LEU 80 3HD1 LEU 80 -7.872 -10.444 9.450
559 HD21 LEU 80 3HD2 LEU 80 -7.160 -7.010 8.508
560 HD22 LEU 80 1HD2 LEU 80 -7.640 -7.722 6.967
561 HD23 LEU 80 2HD2 LEU 80 -6.551 -8.599 8.043
562 H TYR 81 H TYR 81 -11.415 -10.743 5.804
563 HA TYR 81 HA TYR 81 -13.936 -9.486 5.268
564 HB2 TYR 81 1HB TYR 81 -13.241 -12.429 5.336
565 HB3 TYR 81 2HB TYR 81 -14.685 -11.719 4.623
566 HD1 TYR 81 2HD TYR 81 -14.067 -9.740 2.868
567 HD2 TYR 81 1HD TYR 81 -11.591 -13.054 3.862
568 HE1 TYR 81 2HE TYR 81 -12.892 -9.500 0.720
569 HE2 TYR 81 1HE TYR 81 -10.408 -12.822 1.718
570 HH TYR 81 HH TYR 81 -10.316 -10.268 -0.063
571 HA PRO 82 HA PRO 82 -15.915 -9.978 9.159
572 HB2 PRO 82 1HB PRO 82 -18.493 -10.261 8.359
573 HB3 PRO 82 2HB PRO 82 -17.631 -8.719 8.292
574 HG2 PRO 82 1HG PRO 82 -18.150 -10.695 6.104
575 HG3 PRO 82 2HG PRO 82 -18.263 -8.926 6.064
576 HD2 PRO 82 1HD PRO 82 -16.131 -10.272 5.077
577 HD3 PRO 82 2HD PRO 82 -15.988 -8.661 5.808
578 H GLY 83 H GLY 83 -16.302 -12.405 6.676
579 HA2 GLY 83 1HA GLY 83 -17.576 -14.314 8.435
580 HA3 GLY 83 2HA GLY 83 -17.041 -14.605 6.787
581 H GLY 84 H GLY 84 -15.523 -16.108 6.662
582 HA2 GLY 84 1HA GLY 84 -13.509 -16.222 8.823
583 HA3 GLY 84 2HA GLY 84 -14.211 -17.672 8.122
584 H GLY 85 H GLY 85 -11.852 -15.180 7.780
585 HA2 GLY 85 1HA GLY 85 -9.903 -16.260 6.448
586 HA3 GLY 85 2HA GLY 85 -11.067 -16.188 5.133
587 H SER 86 H SER 86 -8.998 -14.931 4.408
588 HA SER 86 HA SER 86 -9.734 -12.193 4.254
589 HB2 SER 86 1HB SER 86 -7.763 -11.214 5.353
590 HB3 SER 86 2HB SER 86 -8.735 -12.134 6.500
591 HG SER 86 HG SER 86 -7.198 -13.618 6.646
592 H SER 87 H SER 87 -8.226 -10.937 2.910
593 HA SER 87 HA SER 87 -6.602 -12.688 1.181
594 HB2 SER 87 1HB SER 87 -8.686 -11.904 0.081
595 HB3 SER 87 2HB SER 87 -8.166 -10.238 0.333
596 HG SER 87 HG SER 87 -6.335 -10.706 -0.965
597 H THR 88 H THR 88 -4.883 -11.525 -0.027
598 HA THR 88 HA THR 88 -3.902 -9.109 1.298
599 HB THR 88 HB THR 88 -2.185 -11.571 0.934
600 HG1 THR 88 1HG THR 88 -2.620 -12.012 2.967
601 HG21 THR 88 3HG2 THR 88 -1.224 -9.416 2.654
602 HG22 THR 88 1HG2 THR 88 -1.405 -8.933 0.968
603 HG23 THR 88 2HG2 THR 88 -0.385 -10.310 1.386
604 H LEU 89 H LEU 89 -3.702 -7.712 -0.325
605 HA LEU 89 HA LEU 89 -2.774 -8.672 -2.937
606 HB2 LEU 89 1HB LEU 89 -4.420 -6.377 -2.016
607 HB3 LEU 89 2HB LEU 89 -3.450 -6.163 -3.472
608 HG LEU 89 HG LEU 89 -5.464 -8.377 -3.119
609 HD11 LEU 89 1HD1 LEU 89 -5.813 -5.551 -3.825
610 HD12 LEU 89 2HD1 LEU 89 -6.985 -6.732 -3.241
611 HD13 LEU 89 3HD1 LEU 89 -6.546 -6.696 -4.949
612 HD21 LEU 89 3HD2 LEU 89 -3.701 -7.430 -5.327
613 HD22 LEU 89 1HD2 LEU 89 -5.275 -8.121 -5.722
614 HD23 LEU 89 2HD2 LEU 89 -4.094 -9.074 -4.822
615 H THR 90 H THR 90 -0.644 -8.562 -3.189
616 HA THR 90 HA THR 90 0.923 -6.553 -1.797
617 HB THR 90 HB THR 90 2.881 -7.709 -2.679
618 HG1 THR 90 1HG THR 90 2.332 -8.436 -4.665
619 HG21 THR 90 3HG2 THR 90 2.715 -9.619 -1.376
620 HG22 THR 90 1HG2 THR 90 1.039 -9.914 -1.837
621 HG23 THR 90 2HG2 THR 90 1.429 -8.612 -0.713
622 H GLY 91 H GLY 91 1.705 -4.731 -2.666
623 HA2 GLY 91 1HA GLY 91 1.858 -4.488 -5.585
624 HA3 GLY 91 2HA GLY 91 0.875 -3.324 -4.708
625 H ARG 92 H ARG 92 3.760 -3.677 -6.135
626 HA ARG 92 HA ARG 92 5.326 -2.234 -4.140
627 HB2 ARG 92 1HB ARG 92 5.944 -3.678 -6.678
628 HB3 ARG 92 2HB ARG 92 7.045 -2.415 -6.147
629 HG2 ARG 92 1HG ARG 92 6.215 -4.571 -4.255
630 HG3 ARG 92 2HG ARG 92 7.477 -4.868 -5.452
631 HD2 ARG 92 1HD ARG 92 8.389 -2.565 -4.500
632 HD3 ARG 92 2HD ARG 92 7.479 -3.080 -3.080
633 HE ARG 92 HE ARG 92 9.046 -4.711 -2.704
634 HH11 ARG 92 1HH1 ARG 92 9.455 -3.436 -5.917
635 HH12 ARG 92 2HH1 ARG 92 10.949 -4.266 -6.198
636 HH21 ARG 92 1HH2 ARG 92 11.013 -5.810 -3.061
637 HH22 ARG 92 2HH2 ARG 92 11.834 -5.617 -4.573
638 H VAL 93 H VAL 93 6.097 -0.163 -4.407
639 HA VAL 93 HA VAL 93 5.386 1.312 -6.822
640 HB VAL 93 HB VAL 93 3.445 1.711 -5.472
641 HG11 VAL 93 1HG1 VAL 93 5.376 1.703 -3.308
642 HG12 VAL 93 2HG1 VAL 93 4.265 3.071 -3.206
643 HG13 VAL 93 3HG1 VAL 93 3.635 1.424 -3.270
644 HG21 VAL 93 3HG2 VAL 93 4.759 4.238 -4.814
645 HG22 VAL 93 1HG2 VAL 93 5.048 3.693 -6.466
646 HG23 VAL 93 2HG2 VAL 93 3.397 3.913 -5.886
647 H THR 94 H THR 94 6.777 2.946 -7.303
648 HA THR 94 HA THR 94 9.068 3.270 -5.492
649 HB THR 94 HB THR 94 8.893 3.981 -8.426
650 HG1 THR 94 1HG THR 94 9.818 1.666 -7.070
651 HG21 THR 94 3HG2 THR 94 11.442 3.541 -6.942
652 HG22 THR 94 1HG2 THR 94 10.603 5.079 -6.746
653 HG23 THR 94 2HG2 THR 94 11.118 4.554 -8.349
654 H THR 95 H THR 95 8.862 4.988 -4.209
655 HA THR 95 HA THR 95 7.208 7.199 -4.667
656 HB THR 95 HB THR 95 8.652 8.328 -2.891
657 HG1 THR 95 1HG THR 95 10.494 7.384 -2.489
658 HG21 THR 95 3HG2 THR 95 8.018 6.218 -1.274
659 HG22 THR 95 1HG2 THR 95 6.968 5.939 -2.662
660 HG23 THR 95 2HG2 THR 95 6.889 7.470 -1.789
661 H LYS 96 H LYS 96 7.574 9.255 -5.430
662 HA LYS 96 HA LYS 96 9.532 9.551 -7.460
663 HB2 LYS 96 1HB LYS 96 7.992 11.811 -6.196
664 HB3 LYS 96 2HB LYS 96 8.603 11.699 -7.842
665 HG2 LYS 96 1HG LYS 96 6.977 9.608 -7.904
666 HG3 LYS 96 2HG LYS 96 6.164 10.526 -6.634
667 HD2 LYS 96 1HD LYS 96 5.568 12.216 -8.050
668 HD3 LYS 96 2HD LYS 96 6.972 11.983 -9.094
669 HE2 LYS 96 1HE LYS 96 5.984 10.170 -10.203
670 HE3 LYS 96 2HE LYS 96 4.770 9.950 -8.944
671 HZ1 LYS 96 3HZ LYS 96 4.921 12.200 -10.875
672 HZ2 LYS 96 1HZ LYS 96 3.807 12.097 -9.606
673 HZ3 LYS 96 2HZ LYS 96 3.769 10.961 -10.858
674 H LYS 97 H LYS 97 11.118 11.322 -7.569
675 HA LYS 97 HA LYS 97 12.960 11.212 -5.468
676 HB2 LYS 97 1HB LYS 97 12.675 12.765 -7.972
677 HB3 LYS 97 2HB LYS 97 13.728 13.464 -6.749
678 HG2 LYS 97 1HG LYS 97 14.092 10.596 -7.414
679 HG3 LYS 97 2HG LYS 97 14.630 11.800 -8.587
680 HD2 LYS 97 1HD LYS 97 16.199 12.702 -7.128
681 HD3 LYS 97 2HD LYS 97 15.394 12.044 -5.701
682 HE2 LYS 97 1HE LYS 97 17.135 10.583 -5.840
683 HE3 LYS 97 2HE LYS 97 15.989 9.749 -6.889
684 HZ1 LYS 97 3HZ LYS 97 17.200 10.200 -8.720
685 HZ2 LYS 97 1HZ LYS 97 18.474 10.306 -7.612
686 HZ3 LYS 97 2HZ LYS 97 17.716 11.713 -8.165
687 H ALA 98 H ALA 98 13.742 12.950 -4.104
688 HA ALA 98 HA ALA 98 11.524 14.523 -3.029
689 HB1 ALA 98 3HB ALA 98 13.918 13.284 -1.919
690 HB2 ALA 98 1HB ALA 98 13.649 14.928 -1.339
691 HB3 ALA 98 2HB ALA 98 12.393 13.705 -1.140
692 HA PRO 99 HA PRO 99 13.008 18.311 -4.713
693 HB2 PRO 99 1HB PRO 99 11.877 20.036 -2.947
694 HB3 PRO 99 2HB PRO 99 10.947 19.178 -4.181
695 HG2 PRO 99 1HG PRO 99 11.282 18.538 -1.276
696 HG3 PRO 99 2HG PRO 99 9.814 18.492 -2.270
697 HD2 PRO 99 1HD PRO 99 11.220 16.264 -1.645
698 HD3 PRO 99 2HD PRO 99 10.341 16.440 -3.177
699 H SER 100 H SER 100 13.177 18.117 -1.153
700 HA SER 100 HA SER 100 15.947 19.065 -1.291
701 HB2 SER 100 1HB SER 100 15.620 20.699 0.446
702 HB3 SER 100 2HB SER 100 14.422 21.007 -0.811
703 HG SER 100 HG SER 100 14.038 19.747 1.696
704 HA PRO 101 HA PRO 101 16.660 15.818 1.590
705 HB2 PRO 101 1HB PRO 101 18.975 16.708 2.696
706 HB3 PRO 101 2HB PRO 101 18.885 16.039 1.062
707 HG2 PRO 101 1HG PRO 101 18.944 18.901 1.937
708 HG3 PRO 101 2HG PRO 101 19.807 18.123 0.597
709 HD2 PRO 101 1HD PRO 101 17.554 19.580 0.229
710 HD3 PRO 101 2HD PRO 101 17.967 18.185 -0.790
711 H SER 102 H SER 102 17.271 19.079 2.909
712 HA SER 102 HA SER 102 16.507 18.201 5.566
713 HB2 SER 102 1HB SER 102 17.606 20.755 4.424
714 HB3 SER 102 2HB SER 102 16.922 20.723 6.049
715 HG SER 102 HG SER 102 19.223 19.476 5.054
716 H SER 103 H SER 103 14.980 19.617 6.833
717 HA SER 103 HA SER 103 12.521 19.886 5.306
718 HB2 SER 103 1HB SER 103 13.050 20.095 8.280
719 HB3 SER 103 2HB SER 103 11.455 20.165 7.531
720 HG SER 103 HG SER 103 12.434 18.039 8.368
721 H GLY 104 H GLY 104 11.086 21.773 5.744
722 HA2 GLY 104 1HA GLY 104 12.093 24.215 6.740
723 HA3 GLY 104 2HA GLY 104 12.316 24.168 4.997
724 HA PRO 105 HA PRO 105 7.551 24.094 5.991
725 HB2 PRO 105 1HB PRO 105 6.906 25.145 8.410
726 HB3 PRO 105 2HB PRO 105 7.189 23.419 8.157
727 HG2 PRO 105 1HG PRO 105 9.039 25.501 9.254
728 HG3 PRO 105 2HG PRO 105 8.753 23.847 9.824
729 HD2 PRO 105 1HD PRO 105 10.900 24.518 8.316
730 HD3 PRO 105 2HD PRO 105 10.126 22.923 8.220
731 H SER 106 H SER 106 5.979 25.900 6.073
732 HA SER 106 HA SER 106 7.291 28.532 5.906
733 HB2 SER 106 1HB SER 106 6.877 27.808 3.638
734 HB3 SER 106 2HB SER 106 5.214 27.377 4.033
735 HG SER 106 HG SER 106 4.651 29.397 3.839
736 H SER 107 H SER 107 6.404 30.033 7.157
737 HA SER 107 HA SER 107 3.866 29.450 8.472
738 HB2 SER 107 1HB SER 107 5.880 31.652 8.990
739 HB3 SER 107 2HB SER 107 4.458 31.310 9.975
740 HG SER 107 HG SER 107 6.889 30.131 10.011
741 H GLY 108 H GLY 108 2.201 31.075 8.659
742 HA2 GLY 108 1HA GLY 108 0.672 32.476 7.666
743 HA3 GLY 108 2HA GLY 108 2.066 33.500 7.356
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -10.514 -33.355 9.170
2 HA2 GLY 1 1HA GLY 1 -8.304 -34.262 8.421
3 HA3 GLY 1 2HA GLY 1 -9.232 -35.522 7.622
4 H SER 2 H SER 2 -7.553 -32.799 7.055
5 HA SER 2 HA SER 2 -8.765 -32.445 4.454
6 HB2 SER 2 1HB SER 2 -9.201 -30.084 4.654
7 HB3 SER 2 2HB SER 2 -10.044 -30.901 5.970
8 HG SER 2 HG SER 2 -8.166 -28.993 6.104
9 H SER 3 H SER 3 -7.467 -31.038 3.051
10 HA SER 3 HA SER 3 -4.880 -30.163 3.885
11 HB2 SER 3 1HB SER 3 -3.611 -31.747 2.395
12 HB3 SER 3 2HB SER 3 -4.312 -32.499 3.828
13 HG SER 3 HG SER 3 -4.631 -33.297 1.399
14 H GLY 4 H GLY 4 -3.507 -29.638 1.835
15 HA2 GLY 4 1HA GLY 4 -4.828 -29.236 -0.639
16 HA3 GLY 4 2HA GLY 4 -4.895 -27.762 0.316
17 H SER 5 H SER 5 -3.532 -28.256 -2.217
18 HA SER 5 HA SER 5 -0.712 -28.048 -1.438
19 HB2 SER 5 1HB SER 5 -0.188 -28.449 -3.776
20 HB3 SER 5 2HB SER 5 -1.330 -29.674 -3.222
21 HG SER 5 HG SER 5 -2.535 -29.044 -4.811
22 H SER 6 H SER 6 0.617 -26.397 -2.483
23 HA SER 6 HA SER 6 -0.351 -23.820 -2.087
24 HB2 SER 6 1HB SER 6 2.092 -24.684 -2.278
25 HB3 SER 6 2HB SER 6 1.901 -24.372 -4.003
26 HG SER 6 HG SER 6 1.302 -22.415 -2.053
27 H GLY 7 H GLY 7 -0.879 -22.126 -3.525
28 HA2 GLY 7 1HA GLY 7 -1.015 -21.749 -6.096
29 HA3 GLY 7 2HA GLY 7 -2.147 -23.089 -5.993
30 H LEU 8 H LEU 8 -1.542 -19.975 -4.362
31 HA LEU 8 HA LEU 8 -4.433 -19.613 -4.091
32 HB2 LEU 8 1HB LEU 8 -2.670 -19.277 -2.214
33 HB3 LEU 8 2HB LEU 8 -2.374 -17.731 -3.008
34 HG LEU 8 HG LEU 8 -3.875 -17.439 -1.134
35 HD11 LEU 8 1HD1 LEU 8 -5.453 -16.111 -2.188
36 HD12 LEU 8 2HD1 LEU 8 -5.626 -17.218 -3.549
37 HD13 LEU 8 3HD1 LEU 8 -4.174 -16.230 -3.397
38 HD21 LEU 8 3HD2 LEU 8 -4.946 -19.908 -2.011
39 HD22 LEU 8 1HD2 LEU 8 -6.235 -18.707 -2.089
40 HD23 LEU 8 2HD2 LEU 8 -5.372 -18.976 -0.575
41 H ALA 9 H ALA 9 -5.553 -18.225 -5.303
42 HA ALA 9 HA ALA 9 -4.048 -16.444 -7.101
43 HB1 ALA 9 3HB ALA 9 -6.870 -16.903 -7.726
44 HB2 ALA 9 1HB ALA 9 -5.449 -16.966 -8.769
45 HB3 ALA 9 2HB ALA 9 -5.871 -18.356 -7.767
46 HA PRO 10 HA PRO 10 -5.708 -13.018 -4.845
47 HB2 PRO 10 1HB PRO 10 -5.068 -11.081 -6.636
48 HB3 PRO 10 2HB PRO 10 -3.873 -11.851 -5.587
49 HG2 PRO 10 1HG PRO 10 -4.514 -12.410 -8.457
50 HG3 PRO 10 2HG PRO 10 -2.931 -12.292 -7.667
51 HD2 PRO 10 1HD PRO 10 -4.102 -14.667 -8.237
52 HD3 PRO 10 2HD PRO 10 -3.053 -14.434 -6.824
53 HA PRO 11 HA PRO 11 -9.750 -12.394 -6.501
54 HB2 PRO 11 1HB PRO 11 -10.426 -10.139 -5.149
55 HB3 PRO 11 2HB PRO 11 -10.352 -11.731 -4.385
56 HG2 PRO 11 1HG PRO 11 -8.331 -9.523 -4.360
57 HG3 PRO 11 2HG PRO 11 -8.870 -10.561 -3.028
58 HD2 PRO 11 1HD PRO 11 -6.551 -10.986 -4.360
59 HD3 PRO 11 2HD PRO 11 -7.517 -12.310 -3.677
60 H ARG 12 H ARG 12 -7.520 -9.640 -6.432
61 HA ARG 12 HA ARG 12 -8.247 -8.943 -9.137
62 HB2 ARG 12 1HB ARG 12 -9.115 -7.331 -6.794
63 HB3 ARG 12 2HB ARG 12 -8.515 -6.457 -8.196
64 HG2 ARG 12 1HG ARG 12 -10.769 -8.454 -8.217
65 HG3 ARG 12 2HG ARG 12 -10.947 -6.698 -8.229
66 HD2 ARG 12 1HD ARG 12 -9.440 -6.808 -10.333
67 HD3 ARG 12 2HD ARG 12 -9.898 -8.510 -10.369
68 HE ARG 12 HE ARG 12 -12.162 -6.786 -10.141
69 HH11 ARG 12 1HH1 ARG 12 -9.862 -8.124 -12.386
70 HH12 ARG 12 2HH1 ARG 12 -10.921 -7.992 -13.751
71 HH21 ARG 12 1HH2 ARG 12 -13.565 -6.606 -11.930
72 HH22 ARG 12 2HH2 ARG 12 -13.026 -7.127 -13.491
73 H HIS 13 H HIS 13 -7.064 -6.627 -9.551
74 HA HIS 13 HA HIS 13 -4.290 -7.101 -8.712
75 HB2 HIS 13 1HB HIS 13 -5.355 -5.504 -11.051
76 HB3 HIS 13 2HB HIS 13 -3.654 -5.777 -10.687
77 HD1 HIS 13 1HD HIS 13 -6.745 -7.650 -11.784
78 HD2 HIS 13 2HD HIS 13 -2.621 -8.134 -11.642
79 HE1 HIS 13 1HE HIS 13 -6.269 -9.750 -13.084
80 HE2 HIS 13 2HE HIS 13 -3.777 -10.069 -12.911
81 H LEU 14 H LEU 14 -2.925 -5.065 -8.585
82 HA LEU 14 HA LEU 14 -4.405 -3.052 -7.032
83 HB2 LEU 14 1HB LEU 14 -1.669 -4.199 -6.841
84 HB3 LEU 14 2HB LEU 14 -1.905 -2.527 -6.337
85 HG LEU 14 HG LEU 14 -3.418 -4.880 -5.207
86 HD11 LEU 14 1HD1 LEU 14 -1.225 -5.221 -4.487
87 HD12 LEU 14 2HD1 LEU 14 -1.972 -4.318 -3.171
88 HD13 LEU 14 3HD1 LEU 14 -0.913 -3.494 -4.314
89 HD21 LEU 14 3HD2 LEU 14 -4.660 -2.832 -5.009
90 HD22 LEU 14 1HD2 LEU 14 -3.240 -1.978 -4.407
91 HD23 LEU 14 2HD2 LEU 14 -3.988 -3.242 -3.430
92 H GLY 15 H GLY 15 -3.381 -0.825 -7.080
93 HA2 GLY 15 1HA GLY 15 -2.062 -0.165 -9.597
94 HA3 GLY 15 2HA GLY 15 -3.669 0.505 -9.358
95 H PHE 16 H PHE 16 -0.951 1.753 -9.577
96 HA PHE 16 HA PHE 16 -1.047 3.277 -7.057
97 HB2 PHE 16 1HB PHE 16 1.371 2.594 -8.741
98 HB3 PHE 16 2HB PHE 16 1.391 3.699 -7.370
99 HD1 PHE 16 1HD PHE 16 0.648 2.761 -5.102
100 HD2 PHE 16 2HD PHE 16 1.718 0.325 -8.424
101 HE1 PHE 16 1HE PHE 16 1.046 0.868 -3.581
102 HE2 PHE 16 2HE PHE 16 2.118 -1.572 -6.909
103 HZ PHE 16 HZ PHE 16 1.781 -1.302 -4.485
104 H SER 17 H SER 17 -1.762 5.269 -7.368
105 HA SER 17 HA SER 17 -0.952 6.703 -9.803
106 HB2 SER 17 1HB SER 17 -3.212 7.698 -9.954
107 HB3 SER 17 2HB SER 17 -3.250 5.946 -10.153
108 HG SER 17 HG SER 17 -4.660 7.325 -8.477
109 H ASP 18 H ASP 18 -1.056 9.043 -9.607
110 HA ASP 18 HA ASP 18 -0.508 10.986 -8.559
111 HB2 ASP 18 1HB ASP 18 -2.858 10.329 -7.545
112 HB3 ASP 18 2HB ASP 18 -1.917 10.116 -6.071
113 H VAL 19 H VAL 19 1.192 8.602 -8.212
114 HA VAL 19 HA VAL 19 2.227 8.449 -5.602
115 HB VAL 19 HB VAL 19 3.662 7.921 -8.209
116 HG11 VAL 19 1HG1 VAL 19 5.390 7.940 -6.707
117 HG12 VAL 19 2HG1 VAL 19 4.364 7.462 -5.353
118 HG13 VAL 19 3HG1 VAL 19 4.862 6.265 -6.549
119 HG21 VAL 19 3HG2 VAL 19 1.427 6.659 -7.332
120 HG22 VAL 19 1HG2 VAL 19 2.669 5.906 -8.332
121 HG23 VAL 19 2HG2 VAL 19 2.685 5.676 -6.583
122 H SER 20 H SER 20 3.794 9.554 -4.537
123 HA SER 20 HA SER 20 5.051 11.815 -5.947
124 HB2 SER 20 1HB SER 20 4.064 11.818 -3.084
125 HB3 SER 20 2HB SER 20 4.836 13.165 -3.920
126 HG SER 20 HG SER 20 3.049 13.106 -5.401
127 H HIS 21 H HIS 21 6.860 12.735 -4.347
128 HA HIS 21 HA HIS 21 8.728 10.546 -4.037
129 HB2 HIS 21 1HB HIS 21 10.212 12.586 -3.270
130 HB3 HIS 21 2HB HIS 21 9.828 12.343 -4.971
131 HD1 HIS 21 1HD HIS 21 7.879 13.889 -5.943
132 HD2 HIS 21 2HD HIS 21 9.357 14.963 -2.212
133 HE1 HIS 21 1HE HIS 21 7.106 16.253 -5.569
134 HE2 HIS 21 2HE HIS 21 8.084 16.910 -3.343
135 H ASP 22 H ASP 22 6.466 12.043 -2.088
136 HA ASP 22 HA ASP 22 7.799 11.020 0.323
137 HB2 ASP 22 1HB ASP 22 7.845 13.597 0.039
138 HB3 ASP 22 2HB ASP 22 6.128 13.517 0.423
139 H ALA 23 H ALA 23 5.476 10.337 -1.632
140 HA ALA 23 HA ALA 23 3.848 9.048 0.303
141 HB1 ALA 23 3HB ALA 23 3.096 11.542 0.277
142 HB2 ALA 23 1HB ALA 23 2.287 11.087 -1.223
143 HB3 ALA 23 2HB ALA 23 1.886 10.259 0.283
144 H ALA 24 H ALA 24 1.850 8.056 -0.799
145 HA ALA 24 HA ALA 24 1.851 7.798 -3.636
146 HB1 ALA 24 3HB ALA 24 2.478 5.384 -3.695
147 HB2 ALA 24 1HB ALA 24 3.813 6.471 -3.313
148 HB3 ALA 24 2HB ALA 24 3.037 5.542 -2.030
149 H ARG 25 H ARG 25 -0.179 7.372 -4.191
150 HA ARG 25 HA ARG 25 -2.020 6.358 -2.179
151 HB2 ARG 25 1HB ARG 25 -2.523 8.369 -3.625
152 HB3 ARG 25 2HB ARG 25 -2.661 7.263 -4.986
153 HG2 ARG 25 1HG ARG 25 -4.568 6.227 -4.091
154 HG3 ARG 25 2HG ARG 25 -4.303 6.936 -2.497
155 HD2 ARG 25 1HD ARG 25 -4.528 9.191 -3.852
156 HD3 ARG 25 2HD ARG 25 -5.427 8.160 -4.965
157 HE ARG 25 HE ARG 25 -6.550 7.589 -2.581
158 HH11 ARG 25 1HH1 ARG 25 -5.873 10.580 -4.229
159 HH12 ARG 25 2HH1 ARG 25 -7.215 11.421 -3.528
160 HH21 ARG 25 1HH2 ARG 25 -8.320 8.686 -1.650
161 HH22 ARG 25 2HH2 ARG 25 -8.606 10.344 -2.060
162 H VAL 26 H VAL 26 -2.825 4.356 -2.141
163 HA VAL 26 HA VAL 26 -2.314 2.617 -4.467
164 HB VAL 26 HB VAL 26 -0.974 1.770 -2.724
165 HG11 VAL 26 1HG1 VAL 26 -1.745 1.396 -0.450
166 HG12 VAL 26 2HG1 VAL 26 -1.967 3.087 -0.904
167 HG13 VAL 26 3HG1 VAL 26 -3.349 1.991 -0.877
168 HG21 VAL 26 3HG2 VAL 26 -3.302 0.031 -2.171
169 HG22 VAL 26 1HG2 VAL 26 -2.849 0.240 -3.863
170 HG23 VAL 26 2HG2 VAL 26 -1.675 -0.387 -2.705
171 H PHE 27 H PHE 27 -4.086 2.015 -5.504
172 HA PHE 27 HA PHE 27 -6.577 1.686 -3.968
173 HB2 PHE 27 1HB PHE 27 -7.852 2.597 -5.769
174 HB3 PHE 27 2HB PHE 27 -6.533 3.722 -5.462
175 HD1 PHE 27 2HD PHE 27 -7.770 1.104 -7.739
176 HD2 PHE 27 1HD PHE 27 -4.899 4.183 -7.112
177 HE1 PHE 27 2HE PHE 27 -7.109 0.966 -10.105
178 HE2 PHE 27 1HE PHE 27 -4.235 4.051 -9.477
179 HZ PHE 27 HZ PHE 27 -5.339 2.439 -10.977
180 H TRP 28 H TRP 28 -7.988 0.033 -4.640
181 HA TRP 28 HA TRP 28 -6.762 -1.962 -6.430
182 HB2 TRP 28 1HB TRP 28 -8.213 -3.587 -4.966
183 HB3 TRP 28 2HB TRP 28 -6.644 -3.036 -4.384
184 HD1 TRP 28 HD TRP 28 -10.300 -3.005 -3.525
185 HE1 TRP 28 1HE TRP 28 -10.656 -1.752 -1.305
186 HE3 TRP 28 3HE TRP 28 -5.644 -0.963 -2.988
187 HZ2 TRP 28 2HZ TRP 28 -9.162 -0.115 0.442
188 HZ3 TRP 28 3HZ TRP 28 -5.189 0.434 -1.014
189 HH2 TRP 28 HH TRP 28 -6.913 0.849 0.664
190 H GLU 29 H GLU 29 -8.546 -3.640 -7.102
191 HA GLU 29 HA GLU 29 -10.661 -2.068 -8.352
192 HB2 GLU 29 1HB GLU 29 -9.344 -4.676 -8.911
193 HB3 GLU 29 2HB GLU 29 -11.014 -4.488 -9.429
194 HG2 GLU 29 1HG GLU 29 -9.023 -2.384 -10.122
195 HG3 GLU 29 2HG GLU 29 -9.050 -3.893 -11.033
196 H GLY 30 H GLY 30 -10.418 -3.414 -5.481
197 HA2 GLY 30 1HA GLY 30 -11.998 -4.036 -3.926
198 HA3 GLY 30 2HA GLY 30 -13.230 -3.722 -5.139
199 H ALA 31 H ALA 31 -13.053 -5.905 -3.205
200 HA ALA 31 HA ALA 31 -12.552 -8.243 -4.884
201 HB1 ALA 31 3HB ALA 31 -11.712 -8.882 -2.901
202 HB2 ALA 31 1HB ALA 31 -12.693 -7.728 -1.997
203 HB3 ALA 31 2HB ALA 31 -13.390 -9.263 -2.516
204 HA PRO 32 HA PRO 32 -16.769 -8.989 -5.859
205 HB2 PRO 32 1HB PRO 32 -16.796 -11.702 -5.960
206 HB3 PRO 32 2HB PRO 32 -16.025 -10.702 -7.197
207 HG2 PRO 32 1HG PRO 32 -14.786 -12.145 -4.885
208 HG3 PRO 32 2HG PRO 32 -14.220 -12.023 -6.561
209 HD2 PRO 32 1HD PRO 32 -13.192 -10.512 -4.563
210 HD3 PRO 32 2HD PRO 32 -13.313 -9.930 -6.236
211 H ARG 33 H ARG 33 -15.442 -9.823 -2.885
212 HA ARG 33 HA ARG 33 -18.079 -10.632 -1.846
213 HB2 ARG 33 1HB ARG 33 -16.700 -11.647 0.060
214 HB3 ARG 33 2HB ARG 33 -16.683 -12.485 -1.486
215 HG2 ARG 33 1HG ARG 33 -14.551 -10.489 -0.921
216 HG3 ARG 33 2HG ARG 33 -14.473 -12.070 -0.140
217 HD2 ARG 33 1HD ARG 33 -14.415 -11.413 -3.067
218 HD3 ARG 33 2HD ARG 33 -13.239 -12.319 -2.116
219 HE ARG 33 HE ARG 33 -15.531 -13.363 -3.422
220 HH11 ARG 33 1HH1 ARG 33 -13.581 -13.716 -0.559
221 HH12 ARG 33 2HH1 ARG 33 -13.971 -15.390 -0.342
222 HH21 ARG 33 1HH2 ARG 33 -16.052 -15.567 -3.146
223 HH22 ARG 33 2HH2 ARG 33 -15.375 -16.442 -1.815
224 HA PRO 34 HA PRO 34 -18.114 -7.107 0.768
225 HB2 PRO 34 1HB PRO 34 -19.346 -8.082 2.982
226 HB3 PRO 34 2HB PRO 34 -20.197 -7.782 1.462
227 HG2 PRO 34 1HG PRO 34 -19.140 -10.357 2.565
228 HG3 PRO 34 2HG PRO 34 -20.689 -10.035 1.765
229 HD2 PRO 34 1HD PRO 34 -18.593 -11.167 0.478
230 HD3 PRO 34 2HD PRO 34 -19.760 -10.111 -0.343
231 H VAL 35 H VAL 35 -16.844 -6.103 2.247
232 HA VAL 35 HA VAL 35 -15.125 -7.797 3.940
233 HB VAL 35 HB VAL 35 -14.335 -5.182 2.650
234 HG11 VAL 35 1HG1 VAL 35 -13.353 -5.956 4.932
235 HG12 VAL 35 2HG1 VAL 35 -12.451 -7.108 3.944
236 HG13 VAL 35 3HG1 VAL 35 -12.271 -5.375 3.667
237 HG21 VAL 35 3HG2 VAL 35 -13.156 -6.343 1.037
238 HG22 VAL 35 1HG2 VAL 35 -13.111 -7.827 1.989
239 HG23 VAL 35 2HG2 VAL 35 -14.608 -7.329 1.201
240 H ARG 36 H ARG 36 -14.737 -7.124 6.023
241 HA ARG 36 HA ARG 36 -16.567 -5.090 7.036
242 HB2 ARG 36 1HB ARG 36 -15.980 -5.995 9.260
243 HB3 ARG 36 2HB ARG 36 -16.595 -7.231 8.171
244 HG2 ARG 36 1HG ARG 36 -14.379 -8.071 7.783
245 HG3 ARG 36 2HG ARG 36 -13.674 -6.748 8.714
246 HD2 ARG 36 1HD ARG 36 -14.750 -7.557 10.731
247 HD3 ARG 36 2HD ARG 36 -15.552 -8.834 9.817
248 HE ARG 36 HE ARG 36 -12.885 -9.216 9.353
249 HH11 ARG 36 1HH1 ARG 36 -14.906 -9.023 12.181
250 HH12 ARG 36 2HH1 ARG 36 -13.917 -10.091 13.121
251 HH21 ARG 36 1HH2 ARG 36 -11.575 -10.624 10.580
252 HH22 ARG 36 2HH2 ARG 36 -12.022 -11.001 12.209
253 H LEU 37 H LEU 37 -13.124 -5.803 6.851
254 HA LEU 37 HA LEU 37 -12.548 -3.001 7.410
255 HB2 LEU 37 1HB LEU 37 -12.414 -4.141 9.581
256 HB3 LEU 37 2HB LEU 37 -11.235 -5.266 8.909
257 HG LEU 37 HG LEU 37 -9.723 -3.294 8.524
258 HD11 LEU 37 1HD1 LEU 37 -10.247 -1.313 10.005
259 HD12 LEU 37 2HD1 LEU 37 -11.896 -1.930 10.090
260 HD13 LEU 37 3HD1 LEU 37 -11.209 -1.463 8.535
261 HD21 LEU 37 3HD2 LEU 37 -9.643 -4.891 10.490
262 HD22 LEU 37 1HD2 LEU 37 -10.469 -3.638 11.417
263 HD23 LEU 37 2HD2 LEU 37 -8.877 -3.319 10.725
264 H VAL 38 H VAL 38 -10.276 -2.442 6.907
265 HA VAL 38 HA VAL 38 -8.936 -4.323 5.107
266 HB VAL 38 HB VAL 38 -9.721 -1.509 4.344
267 HG11 VAL 38 1HG1 VAL 38 -7.878 -3.439 2.937
268 HG12 VAL 38 2HG1 VAL 38 -8.491 -1.936 2.245
269 HG13 VAL 38 3HG1 VAL 38 -7.434 -1.892 3.658
270 HG21 VAL 38 3HG2 VAL 38 -10.608 -2.874 2.319
271 HG22 VAL 38 1HG2 VAL 38 -10.525 -4.241 3.431
272 HG23 VAL 38 2HG2 VAL 38 -11.536 -2.849 3.819
273 H ARG 39 H ARG 39 -6.987 -4.538 5.987
274 HA ARG 39 HA ARG 39 -5.703 -2.207 7.220
275 HB2 ARG 39 1HB ARG 39 -5.534 -5.139 7.616
276 HB3 ARG 39 2HB ARG 39 -4.037 -4.239 7.818
277 HG2 ARG 39 1HG ARG 39 -5.201 -2.774 9.449
278 HG3 ARG 39 2HG ARG 39 -6.616 -3.820 9.310
279 HD2 ARG 39 1HD ARG 39 -3.996 -5.080 9.924
280 HD3 ARG 39 2HD ARG 39 -4.795 -4.165 11.203
281 HE ARG 39 HE ARG 39 -6.541 -6.036 9.921
282 HH11 ARG 39 1HH1 ARG 39 -4.081 -5.669 12.358
283 HH12 ARG 39 2HH1 ARG 39 -4.608 -7.037 13.281
284 HH21 ARG 39 1HH2 ARG 39 -7.244 -7.839 11.129
285 HH22 ARG 39 2HH2 ARG 39 -6.407 -8.271 12.581
286 H VAL 40 H VAL 40 -3.925 -1.284 6.387
287 HA VAL 40 HA VAL 40 -2.655 -2.596 4.071
288 HB VAL 40 HB VAL 40 -3.068 0.367 4.493
289 HG11 VAL 40 1HG1 VAL 40 -2.088 0.639 2.285
290 HG12 VAL 40 2HG1 VAL 40 -0.948 -0.156 3.373
291 HG13 VAL 40 3HG1 VAL 40 -1.826 -1.101 2.169
292 HG21 VAL 40 3HG2 VAL 40 -4.681 0.303 2.783
293 HG22 VAL 40 1HG2 VAL 40 -4.223 -1.329 2.299
294 HG23 VAL 40 2HG2 VAL 40 -5.068 -1.066 3.824
295 H THR 41 H THR 41 -0.566 -3.022 4.305
296 HA THR 41 HA THR 41 0.973 -1.471 6.284
297 HB THR 41 HB THR 41 2.378 -3.537 6.577
298 HG1 THR 41 1HG THR 41 0.955 -5.489 5.972
299 HG21 THR 41 3HG2 THR 41 -0.473 -4.122 7.311
300 HG22 THR 41 1HG2 THR 41 0.405 -2.789 8.059
301 HG23 THR 41 2HG2 THR 41 0.996 -4.442 8.232
302 H TYR 42 H TYR 42 2.503 -0.281 5.375
303 HA TYR 42 HA TYR 42 3.678 -1.193 2.833
304 HB2 TYR 42 1HB TYR 42 4.285 1.248 2.537
305 HB3 TYR 42 2HB TYR 42 2.566 0.878 2.468
306 HD1 TYR 42 2HD TYR 42 1.110 1.431 4.413
307 HD2 TYR 42 1HD TYR 42 5.172 2.681 4.217
308 HE1 TYR 42 2HE TYR 42 0.677 3.097 6.171
309 HE2 TYR 42 1HE TYR 42 4.751 4.349 5.974
310 HH TYR 42 HH TYR 42 1.849 4.385 7.815
311 H VAL 43 H VAL 43 5.921 -0.977 2.513
312 HA VAL 43 HA VAL 43 7.593 -0.194 4.756
313 HB VAL 43 HB VAL 43 7.085 -2.584 5.184
314 HG11 VAL 43 1HG1 VAL 43 6.754 -3.558 3.094
315 HG12 VAL 43 2HG1 VAL 43 8.246 -2.884 2.436
316 HG13 VAL 43 3HG1 VAL 43 8.313 -4.204 3.606
317 HG21 VAL 43 3HG2 VAL 43 9.951 -2.542 4.398
318 HG22 VAL 43 1HG2 VAL 43 9.385 -1.331 5.549
319 HG23 VAL 43 2HG2 VAL 43 9.201 -3.047 5.912
320 H SER 44 H SER 44 9.660 0.386 4.165
321 HA SER 44 HA SER 44 10.073 1.179 1.498
322 HB2 SER 44 1HB SER 44 12.178 0.842 3.646
323 HB3 SER 44 2HB SER 44 12.287 1.864 2.213
324 HG SER 44 HG SER 44 10.724 2.204 4.527
325 H SER 45 H SER 45 11.960 0.547 0.150
326 HA SER 45 HA SER 45 11.840 -2.011 -0.761
327 HB2 SER 45 1HB SER 45 13.033 -0.159 -1.905
328 HB3 SER 45 2HB SER 45 14.348 -0.314 -0.740
329 HG SER 45 HG SER 45 13.460 -2.440 -2.392
330 H GLU 46 H GLU 46 14.095 -0.782 1.690
331 HA GLU 46 HA GLU 46 14.983 -3.520 2.230
332 HB2 GLU 46 1HB GLU 46 16.044 -0.892 3.284
333 HB3 GLU 46 2HB GLU 46 16.747 -2.475 3.583
334 HG2 GLU 46 1HG GLU 46 16.407 -1.388 0.810
335 HG3 GLU 46 2HG GLU 46 17.824 -1.027 1.794
336 H GLY 47 H GLY 47 14.491 -4.597 4.059
337 HA2 GLY 47 1HA GLY 47 12.279 -4.021 5.581
338 HA3 GLY 47 2HA GLY 47 13.590 -5.057 6.126
339 H GLY 48 H GLY 48 11.943 -2.139 6.611
340 HA2 GLY 48 1HA GLY 48 13.370 -1.573 9.001
341 HA3 GLY 48 2HA GLY 48 13.850 -0.460 7.728
342 H HIS 49 H HIS 49 12.521 1.201 7.173
343 HA HIS 49 HA HIS 49 10.504 1.960 9.015
344 HB2 HIS 49 1HB HIS 49 11.727 3.705 7.958
345 HB3 HIS 49 2HB HIS 49 11.368 3.079 6.351
346 HD1 HIS 49 1HD HIS 49 9.475 4.168 5.181
347 HD2 HIS 49 2HD HIS 49 9.278 4.711 9.296
348 HE1 HIS 49 1HE HIS 49 7.524 5.708 5.564
349 HE2 HIS 49 2HE HIS 49 7.477 6.090 8.053
350 H SER 50 H SER 50 8.458 1.335 9.092
351 HA SER 50 HA SER 50 6.956 0.890 6.648
352 HB2 SER 50 1HB SER 50 6.145 -1.340 7.415
353 HB3 SER 50 2HB SER 50 7.865 -1.327 7.029
354 HG SER 50 HG SER 50 7.324 -0.712 9.642
355 H GLY 51 H GLY 51 4.635 0.663 7.045
356 HA2 GLY 51 1HA GLY 51 3.779 1.557 9.713
357 HA3 GLY 51 2HA GLY 51 3.309 2.499 8.305
358 H GLN 52 H GLN 52 1.287 1.669 9.774
359 HA GLN 52 HA GLN 52 0.005 -0.304 8.065
360 HB2 GLN 52 1HB GLN 52 0.902 -1.681 9.853
361 HB3 GLN 52 2HB GLN 52 0.195 -0.620 11.064
362 HG2 GLN 52 1HG GLN 52 -2.055 -1.213 10.101
363 HG3 GLN 52 2HG GLN 52 -1.228 -2.455 9.162
364 HE21 GLN 52 1HE2 GLN 52 -1.208 -4.388 10.037
365 HE22 GLN 52 2HE2 GLN 52 -1.315 -4.749 11.723
366 H THR 53 H THR 53 -1.768 0.690 7.391
367 HA THR 53 HA THR 53 -3.226 2.414 9.285
368 HB THR 53 HB THR 53 -2.295 3.594 7.299
369 HG1 THR 53 1HG THR 53 -4.429 4.498 6.694
370 HG21 THR 53 3HG2 THR 53 -3.497 3.214 5.123
371 HG22 THR 53 1HG2 THR 53 -4.154 1.734 5.821
372 HG23 THR 53 2HG2 THR 53 -2.412 1.911 5.607
373 H GLU 54 H GLU 54 -5.526 2.381 9.230
374 HA GLU 54 HA GLU 54 -6.625 -0.140 8.172
375 HB2 GLU 54 1HB GLU 54 -7.127 1.366 10.706
376 HB3 GLU 54 2HB GLU 54 -8.425 0.400 10.019
377 HG2 GLU 54 1HG GLU 54 -7.217 -1.595 10.259
378 HG3 GLU 54 2HG GLU 54 -5.700 -0.740 10.532
379 H ALA 55 H ALA 55 -8.501 -0.111 7.009
380 HA ALA 55 HA ALA 55 -9.873 2.455 6.646
381 HB1 ALA 55 3HB ALA 55 -9.977 1.905 4.157
382 HB2 ALA 55 1HB ALA 55 -8.442 2.500 4.790
383 HB3 ALA 55 2HB ALA 55 -8.658 0.778 4.472
384 HA PRO 56 HA PRO 56 -13.564 0.085 6.839
385 HB2 PRO 56 1HB PRO 56 -15.209 1.537 5.240
386 HB3 PRO 56 2HB PRO 56 -14.703 2.080 6.844
387 HG2 PRO 56 1HG PRO 56 -13.629 2.851 4.159
388 HG3 PRO 56 2HG PRO 56 -13.979 3.879 5.561
389 HD2 PRO 56 1HD PRO 56 -11.473 3.057 4.945
390 HD3 PRO 56 2HD PRO 56 -12.006 3.324 6.617
391 H GLY 57 H GLY 57 -14.716 -1.499 5.764
392 HA2 GLY 57 1HA GLY 57 -13.568 -2.752 3.566
393 HA3 GLY 57 2HA GLY 57 -15.211 -3.029 4.127
394 H ASN 58 H ASN 58 -15.444 0.066 3.588
395 HA ASN 58 HA ASN 58 -16.461 -0.308 0.886
396 HB2 ASN 58 1HB ASN 58 -16.683 2.120 2.677
397 HB3 ASN 58 2HB ASN 58 -17.603 1.806 1.209
398 HD21 ASN 58 1HD2 ASN 58 -19.479 0.779 1.374
399 HD22 ASN 58 2HD2 ASN 58 -20.070 -0.001 2.798
400 H ALA 59 H ALA 59 -13.825 1.195 2.534
401 HA ALA 59 HA ALA 59 -13.139 3.115 0.559
402 HB1 ALA 59 3HB ALA 59 -11.995 2.100 3.037
403 HB2 ALA 59 1HB ALA 59 -10.778 2.516 1.829
404 HB3 ALA 59 2HB ALA 59 -11.954 3.723 2.350
405 H THR 60 H THR 60 -12.390 2.756 -1.414
406 HA THR 60 HA THR 60 -11.062 0.194 -1.983
407 HB THR 60 HB THR 60 -11.521 0.868 -4.417
408 HG1 THR 60 1HG THR 60 -13.331 2.628 -3.087
409 HG21 THR 60 3HG2 THR 60 -14.068 0.314 -4.048
410 HG22 THR 60 1HG2 THR 60 -13.540 0.016 -2.393
411 HG23 THR 60 2HG2 THR 60 -12.826 -0.895 -3.723
412 H SER 61 H SER 61 -10.024 2.957 -0.976
413 HA SER 61 HA SER 61 -7.517 2.800 -2.348
414 HB2 SER 61 1HB SER 61 -7.661 5.311 -3.002
415 HB3 SER 61 2HB SER 61 -8.423 4.120 -4.056
416 HG SER 61 HG SER 61 -10.255 5.056 -3.682
417 H ALA 62 H ALA 62 -5.870 3.767 -1.210
418 HA ALA 62 HA ALA 62 -6.524 5.508 1.036
419 HB1 ALA 62 3HB ALA 62 -5.062 4.065 2.535
420 HB2 ALA 62 1HB ALA 62 -6.674 3.453 2.164
421 HB3 ALA 62 2HB ALA 62 -5.267 2.795 1.328
422 H MET 63 H MET 63 -4.822 6.807 1.715
423 HA MET 63 HA MET 63 -2.587 6.945 -0.160
424 HB2 MET 63 1HB MET 63 -3.680 8.878 1.879
425 HB3 MET 63 2HB MET 63 -2.165 9.156 1.031
426 HG2 MET 63 1HG MET 63 -3.691 8.717 -1.083
427 HG3 MET 63 2HG MET 63 -4.951 9.250 0.028
428 HE1 MET 63 3HE MET 63 -2.082 10.997 -2.453
429 HE2 MET 63 1HE MET 63 -1.163 11.477 -1.026
430 HE3 MET 63 2HE MET 63 -1.559 9.779 -1.289
431 H LEU 64 H LEU 64 -0.431 6.945 0.477
432 HA LEU 64 HA LEU 64 0.077 6.034 3.233
433 HB2 LEU 64 1HB LEU 64 1.659 5.220 0.806
434 HB3 LEU 64 2HB LEU 64 1.795 4.578 2.442
435 HG LEU 64 HG LEU 64 -0.673 4.242 0.750
436 HD11 LEU 64 1HD1 LEU 64 1.613 3.240 -0.095
437 HD12 LEU 64 2HD1 LEU 64 0.119 2.305 -0.161
438 HD13 LEU 64 3HD1 LEU 64 1.274 2.031 1.143
439 HD21 LEU 64 3HD2 LEU 64 -1.382 3.704 2.835
440 HD22 LEU 64 1HD2 LEU 64 0.243 3.332 3.413
441 HD23 LEU 64 2HD2 LEU 64 -0.631 2.161 2.425
442 H GLY 65 H GLY 65 1.858 6.856 4.289
443 HA2 GLY 65 1HA GLY 65 4.106 8.043 3.519
444 HA3 GLY 65 2HA GLY 65 2.944 9.306 3.140
445 HA PRO 66 HA PRO 66 4.726 10.642 3.688
446 HB2 PRO 66 1HB PRO 66 6.993 11.287 5.034
447 HB3 PRO 66 2HB PRO 66 5.529 12.275 5.091
448 HG2 PRO 66 1HG PRO 66 6.536 10.265 7.068
449 HG3 PRO 66 2HG PRO 66 5.830 11.865 7.360
450 HD2 PRO 66 1HD PRO 66 4.411 9.575 7.633
451 HD3 PRO 66 2HD PRO 66 3.671 11.099 7.102
452 H LEU 67 H LEU 67 5.926 9.592 2.227
453 HA LEU 67 HA LEU 67 7.472 7.255 3.125
454 HB2 LEU 67 1HB LEU 67 6.531 7.820 0.325
455 HB3 LEU 67 2HB LEU 67 7.151 6.302 0.972
456 HG LEU 67 HG LEU 67 4.495 7.581 1.616
457 HD11 LEU 67 1HD1 LEU 67 5.398 5.543 -0.296
458 HD12 LEU 67 2HD1 LEU 67 3.970 6.576 -0.323
459 HD13 LEU 67 3HD1 LEU 67 3.977 5.107 0.652
460 HD21 LEU 67 3HD2 LEU 67 5.534 6.424 3.551
461 HD22 LEU 67 1HD2 LEU 67 5.609 4.952 2.583
462 HD23 LEU 67 2HD2 LEU 67 4.046 5.661 2.989
463 H SER 68 H SER 68 9.237 6.738 1.317
464 HA SER 68 HA SER 68 11.042 9.003 1.399
465 HB2 SER 68 1HB SER 68 11.600 6.495 1.871
466 HB3 SER 68 2HB SER 68 11.712 6.372 0.116
467 HG SER 68 HG SER 68 13.065 8.451 1.416
468 H SER 69 H SER 69 12.551 9.079 -0.682
469 HA SER 69 HA SER 69 10.742 9.428 -2.981
470 HB2 SER 69 1HB SER 69 13.336 10.894 -2.841
471 HB3 SER 69 2HB SER 69 11.797 11.396 -3.540
472 HG SER 69 HG SER 69 11.490 12.433 -1.751
473 H SER 70 H SER 70 11.301 8.606 -4.942
474 HA SER 70 HA SER 70 12.267 7.154 -6.408
475 HB2 SER 70 1HB SER 70 13.915 9.010 -6.487
476 HB3 SER 70 2HB SER 70 14.838 8.216 -5.212
477 HG SER 70 HG SER 70 14.193 6.850 -7.591
478 H THR 71 H THR 71 11.507 6.046 -3.909
479 HA THR 71 HA THR 71 13.458 3.849 -3.712
480 HB THR 71 HB THR 71 11.888 5.059 -1.428
481 HG1 THR 71 1HG THR 71 13.714 6.281 -1.884
482 HG21 THR 71 3HG2 THR 71 13.913 3.213 -0.611
483 HG22 THR 71 1HG2 THR 71 12.839 2.418 -1.761
484 HG23 THR 71 2HG2 THR 71 12.177 3.159 -0.304
485 H THR 72 H THR 72 12.643 1.799 -3.653
486 HA THR 72 HA THR 72 9.902 1.473 -4.491
487 HB THR 72 HB THR 72 11.947 -0.676 -3.907
488 HG1 THR 72 1HG THR 72 12.192 -0.595 -6.253
489 HG21 THR 72 3HG2 THR 72 9.197 -0.654 -4.989
490 HG22 THR 72 1HG2 THR 72 10.062 -1.919 -4.118
491 HG23 THR 72 2HG2 THR 72 10.359 -1.672 -5.839
492 H TYR 73 H TYR 73 8.258 1.257 -3.136
493 HA TYR 73 HA TYR 73 8.779 0.174 -0.447
494 HB2 TYR 73 1HB TYR 73 6.987 2.332 -1.447
495 HB3 TYR 73 2HB TYR 73 6.419 1.366 -0.091
496 HD1 TYR 73 1HD TYR 73 9.481 3.214 -1.182
497 HD2 TYR 73 2HD TYR 73 6.944 2.079 2.040
498 HE1 TYR 73 1HE TYR 73 10.824 4.590 0.352
499 HE2 TYR 73 2HE TYR 73 8.280 3.453 3.583
500 HH TYR 73 HH TYR 73 11.247 4.472 3.038
501 H THR 74 H THR 74 7.819 -1.665 0.131
502 HA THR 74 HA THR 74 6.081 -2.999 -1.767
503 HB THR 74 HB THR 74 7.099 -3.992 0.902
504 HG1 THR 74 1HG THR 74 8.729 -3.504 -0.750
505 HG21 THR 74 3HG2 THR 74 5.505 -5.544 0.509
506 HG22 THR 74 1HG2 THR 74 6.686 -6.188 -0.630
507 HG23 THR 74 2HG2 THR 74 5.388 -5.141 -1.203
508 H VAL 75 H VAL 75 4.000 -2.417 -1.731
509 HA VAL 75 HA VAL 75 2.701 -1.801 0.813
510 HB VAL 75 HB VAL 75 1.625 -1.562 -2.000
511 HG11 VAL 75 1HG1 VAL 75 -0.084 -0.108 -0.890
512 HG12 VAL 75 2HG1 VAL 75 -0.193 -1.819 -0.474
513 HG13 VAL 75 3HG1 VAL 75 0.527 -0.678 0.662
514 HG21 VAL 75 3HG2 VAL 75 2.046 0.795 -1.824
515 HG22 VAL 75 1HG2 VAL 75 2.601 0.616 -0.159
516 HG23 VAL 75 2HG2 VAL 75 3.547 -0.066 -1.482
517 H ARG 76 H ARG 76 0.707 -2.781 1.424
518 HA ARG 76 HA ARG 76 -0.110 -5.205 0.048
519 HB2 ARG 76 1HB ARG 76 1.306 -5.175 2.662
520 HB3 ARG 76 2HB ARG 76 -0.056 -6.275 2.499
521 HG2 ARG 76 1HG ARG 76 1.010 -7.595 0.979
522 HG3 ARG 76 2HG ARG 76 1.994 -6.271 0.353
523 HD2 ARG 76 1HD ARG 76 3.402 -7.814 1.557
524 HD3 ARG 76 2HD ARG 76 3.298 -6.298 2.451
525 HE ARG 76 HE ARG 76 1.326 -8.063 3.395
526 HH11 ARG 76 1HH1 ARG 76 4.783 -7.649 3.392
527 HH12 ARG 76 2HH1 ARG 76 5.014 -8.479 4.895
528 HH21 ARG 76 1HH2 ARG 76 1.618 -9.158 5.374
529 HH22 ARG 76 2HH2 ARG 76 3.214 -9.338 6.021
530 H VAL 77 H VAL 77 -2.230 -4.946 -0.142
531 HA VAL 77 HA VAL 77 -3.710 -3.525 1.945
532 HB VAL 77 HB VAL 77 -4.583 -4.379 -0.819
533 HG11 VAL 77 1HG1 VAL 77 -6.488 -4.314 0.647
534 HG12 VAL 77 2HG1 VAL 77 -5.995 -2.744 1.285
535 HG13 VAL 77 3HG1 VAL 77 -6.522 -2.890 -0.392
536 HG21 VAL 77 3HG2 VAL 77 -3.781 -2.451 -1.598
537 HG22 VAL 77 1HG2 VAL 77 -4.507 -1.537 -0.276
538 HG23 VAL 77 2HG2 VAL 77 -2.923 -2.283 -0.066
539 H THR 78 H THR 78 -3.895 -5.094 3.538
540 HA THR 78 HA THR 78 -4.813 -7.743 3.001
541 HB THR 78 HB THR 78 -4.741 -6.242 5.626
542 HG1 THR 78 1HG THR 78 -2.674 -6.514 4.637
543 HG21 THR 78 3HG2 THR 78 -5.801 -8.814 4.918
544 HG22 THR 78 1HG2 THR 78 -5.789 -8.010 6.487
545 HG23 THR 78 2HG2 THR 78 -4.422 -9.012 5.999
546 H CYS 79 H CYS 79 -6.806 -8.155 2.311
547 HA CYS 79 HA CYS 79 -9.022 -6.478 3.247
548 HB2 CYS 79 1HB CYS 79 -8.839 -8.425 0.940
549 HB3 CYS 79 2HB CYS 79 -10.300 -7.552 1.387
550 HG CYS 79 HG CYS 79 -8.550 -5.074 1.122
551 H LEU 80 H LEU 80 -9.491 -7.326 5.244
552 HA LEU 80 HA LEU 80 -9.878 -10.184 5.558
553 HB2 LEU 80 1HB LEU 80 -10.080 -7.852 7.445
554 HB3 LEU 80 2HB LEU 80 -10.508 -9.497 7.912
555 HG LEU 80 HG LEU 80 -7.798 -9.030 6.780
556 HD11 LEU 80 1HD1 LEU 80 -7.309 -8.691 9.413
557 HD12 LEU 80 2HD1 LEU 80 -8.821 -7.799 9.247
558 HD13 LEU 80 3HD1 LEU 80 -7.431 -7.370 8.251
559 HD21 LEU 80 3HD2 LEU 80 -7.444 -11.068 7.595
560 HD22 LEU 80 1HD2 LEU 80 -9.168 -11.149 7.956
561 HD23 LEU 80 2HD2 LEU 80 -8.034 -10.601 9.191
562 H TYR 81 H TYR 81 -11.749 -11.176 5.236
563 HA TYR 81 HA TYR 81 -14.174 -9.578 4.933
564 HB2 TYR 81 1HB TYR 81 -13.837 -12.529 4.392
565 HB3 TYR 81 2HB TYR 81 -15.122 -11.473 3.817
566 HD1 TYR 81 2HD TYR 81 -14.359 -9.487 2.297
567 HD2 TYR 81 1HD TYR 81 -12.028 -12.974 3.010
568 HE1 TYR 81 2HE TYR 81 -13.083 -9.047 0.241
569 HE2 TYR 81 1HE TYR 81 -10.744 -12.543 0.957
570 HH TYR 81 HH TYR 81 -10.191 -10.417 -0.456
571 HA PRO 82 HA PRO 82 -15.938 -10.757 8.778
572 HB2 PRO 82 1HB PRO 82 -18.575 -10.756 8.135
573 HB3 PRO 82 2HB PRO 82 -17.628 -9.274 8.308
574 HG2 PRO 82 1HG PRO 82 -18.405 -10.747 5.820
575 HG3 PRO 82 2HG PRO 82 -18.415 -9.002 6.137
576 HD2 PRO 82 1HD PRO 82 -16.436 -10.219 4.746
577 HD3 PRO 82 2HD PRO 82 -16.150 -8.795 5.766
578 H GLY 83 H GLY 83 -14.974 -12.941 8.617
579 HA2 GLY 83 1HA GLY 83 -15.456 -15.158 9.213
580 HA3 GLY 83 2HA GLY 83 -17.089 -14.944 8.601
581 H GLY 84 H GLY 84 -16.339 -13.925 6.026
582 HA2 GLY 84 1HA GLY 84 -16.161 -16.303 4.573
583 HA3 GLY 84 2HA GLY 84 -15.858 -14.699 3.920
584 H GLY 85 H GLY 85 -13.643 -14.300 5.900
585 HA2 GLY 85 1HA GLY 85 -11.558 -15.793 6.143
586 HA3 GLY 85 2HA GLY 85 -11.622 -15.815 4.387
587 H SER 86 H SER 86 -9.893 -14.672 3.765
588 HA SER 86 HA SER 86 -9.867 -11.857 4.069
589 HB2 SER 86 1HB SER 86 -7.741 -11.649 5.330
590 HB3 SER 86 2HB SER 86 -9.030 -12.353 6.305
591 HG SER 86 HG SER 86 -7.702 -14.299 5.026
592 H SER 87 H SER 87 -7.723 -10.933 3.196
593 HA SER 87 HA SER 87 -6.239 -12.688 1.448
594 HB2 SER 87 1HB SER 87 -8.384 -12.108 0.209
595 HB3 SER 87 2HB SER 87 -7.808 -10.442 0.174
596 HG SER 87 HG SER 87 -6.514 -12.712 -0.935
597 H THR 88 H THR 88 -4.501 -11.541 0.306
598 HA THR 88 HA THR 88 -3.829 -8.935 1.484
599 HB THR 88 HB THR 88 -1.811 -11.166 1.217
600 HG1 THR 88 1HG THR 88 -3.139 -11.790 2.875
601 HG21 THR 88 3HG2 THR 88 -1.449 -8.446 1.429
602 HG22 THR 88 1HG2 THR 88 -0.263 -9.677 1.865
603 HG23 THR 88 2HG2 THR 88 -1.317 -8.991 3.101
604 H LEU 89 H LEU 89 -3.756 -7.611 -0.214
605 HA LEU 89 HA LEU 89 -2.703 -8.581 -2.764
606 HB2 LEU 89 1HB LEU 89 -4.353 -6.226 -1.940
607 HB3 LEU 89 2HB LEU 89 -3.498 -6.216 -3.480
608 HG LEU 89 HG LEU 89 -5.389 -8.435 -2.770
609 HD11 LEU 89 1HD1 LEU 89 -6.024 -5.673 -3.717
610 HD12 LEU 89 2HD1 LEU 89 -6.862 -6.674 -2.532
611 HD13 LEU 89 3HD1 LEU 89 -7.001 -7.041 -4.251
612 HD21 LEU 89 3HD2 LEU 89 -4.340 -7.279 -5.349
613 HD22 LEU 89 1HD2 LEU 89 -5.595 -8.514 -5.249
614 HD23 LEU 89 2HD2 LEU 89 -3.970 -8.858 -4.655
615 H THR 90 H THR 90 -0.539 -8.475 -2.814
616 HA THR 90 HA THR 90 0.884 -6.278 -1.569
617 HB THR 90 HB THR 90 2.899 -7.443 -2.083
618 HG1 THR 90 1HG THR 90 1.434 -8.405 -4.157
619 HG21 THR 90 3HG2 THR 90 1.948 -9.947 -1.525
620 HG22 THR 90 1HG2 THR 90 0.633 -8.920 -0.957
621 HG23 THR 90 2HG2 THR 90 2.264 -8.694 -0.326
622 H GLY 91 H GLY 91 2.173 -4.768 -2.643
623 HA2 GLY 91 1HA GLY 91 2.273 -4.720 -5.531
624 HA3 GLY 91 2HA GLY 91 1.239 -3.483 -4.831
625 H ARG 92 H ARG 92 4.188 -3.933 -6.072
626 HA ARG 92 HA ARG 92 5.680 -2.343 -4.146
627 HB2 ARG 92 1HB ARG 92 6.406 -3.735 -6.714
628 HB3 ARG 92 2HB ARG 92 7.508 -2.604 -5.939
629 HG2 ARG 92 1HG ARG 92 7.405 -3.998 -3.886
630 HG3 ARG 92 2HG ARG 92 6.436 -5.167 -4.784
631 HD2 ARG 92 1HD ARG 92 9.095 -4.261 -5.822
632 HD3 ARG 92 2HD ARG 92 8.992 -5.525 -4.598
633 HE ARG 92 HE ARG 92 8.381 -5.771 -7.377
634 HH11 ARG 92 1HH1 ARG 92 7.597 -6.970 -4.204
635 HH12 ARG 92 2HH1 ARG 92 7.052 -8.511 -4.779
636 HH21 ARG 92 1HH2 ARG 92 7.667 -7.797 -8.146
637 HH22 ARG 92 2HH2 ARG 92 7.093 -8.981 -7.021
638 H VAL 93 H VAL 93 6.083 -0.221 -4.322
639 HA VAL 93 HA VAL 93 5.553 1.125 -6.875
640 HB VAL 93 HB VAL 93 3.536 1.337 -5.425
641 HG11 VAL 93 1HG1 VAL 93 3.600 2.049 -3.302
642 HG12 VAL 93 2HG1 VAL 93 5.319 1.656 -3.380
643 HG13 VAL 93 3HG1 VAL 93 4.777 3.312 -3.661
644 HG21 VAL 93 3HG2 VAL 93 3.606 3.037 -6.963
645 HG22 VAL 93 1HG2 VAL 93 3.644 3.966 -5.464
646 HG23 VAL 93 2HG2 VAL 93 5.136 3.671 -6.357
647 H THR 94 H THR 94 7.154 2.447 -7.423
648 HA THR 94 HA THR 94 9.187 3.101 -5.429
649 HB THR 94 HB THR 94 9.221 3.431 -8.435
650 HG1 THR 94 1HG THR 94 10.192 1.521 -8.463
651 HG21 THR 94 3HG2 THR 94 11.820 3.491 -7.589
652 HG22 THR 94 1HG2 THR 94 11.002 4.393 -6.314
653 HG23 THR 94 2HG2 THR 94 10.856 4.911 -7.994
654 H THR 95 H THR 95 8.842 4.920 -4.331
655 HA THR 95 HA THR 95 7.170 7.017 -5.017
656 HB THR 95 HB THR 95 8.690 8.393 -3.433
657 HG1 THR 95 1HG THR 95 10.462 7.428 -2.821
658 HG21 THR 95 3HG2 THR 95 7.340 7.716 -1.762
659 HG22 THR 95 1HG2 THR 95 7.820 6.028 -1.925
660 HG23 THR 95 2HG2 THR 95 6.595 6.704 -2.999
661 H LYS 96 H LYS 96 7.659 9.219 -5.636
662 HA LYS 96 HA LYS 96 9.349 9.336 -7.934
663 HB2 LYS 96 1HB LYS 96 7.974 11.617 -6.505
664 HB3 LYS 96 2HB LYS 96 8.581 11.625 -8.155
665 HG2 LYS 96 1HG LYS 96 6.920 9.584 -8.395
666 HG3 LYS 96 2HG LYS 96 6.128 10.388 -7.038
667 HD2 LYS 96 1HD LYS 96 5.595 12.249 -8.277
668 HD3 LYS 96 2HD LYS 96 6.938 12.018 -9.399
669 HE2 LYS 96 1HE LYS 96 5.804 10.354 -10.590
670 HE3 LYS 96 2HE LYS 96 4.646 10.086 -9.289
671 HZ1 LYS 96 3HZ LYS 96 3.461 11.966 -9.838
672 HZ2 LYS 96 1HZ LYS 96 3.934 11.413 -11.365
673 HZ3 LYS 96 2HZ LYS 96 4.758 12.699 -10.639
674 H LYS 97 H LYS 97 10.911 11.193 -8.228
675 HA LYS 97 HA LYS 97 12.905 11.033 -6.161
676 HB2 LYS 97 1HB LYS 97 12.758 12.170 -8.914
677 HB3 LYS 97 2HB LYS 97 14.006 12.777 -7.834
678 HG2 LYS 97 1HG LYS 97 15.039 10.686 -7.664
679 HG3 LYS 97 2HG LYS 97 13.628 9.840 -8.305
680 HD2 LYS 97 1HD LYS 97 14.958 11.874 -10.023
681 HD3 LYS 97 2HD LYS 97 15.755 10.315 -9.801
682 HE2 LYS 97 1HE LYS 97 14.438 10.021 -11.710
683 HE3 LYS 97 2HE LYS 97 13.494 9.284 -10.416
684 HZ1 LYS 97 3HZ LYS 97 13.017 12.106 -11.026
685 HZ2 LYS 97 1HZ LYS 97 11.936 10.919 -10.493
686 HZ3 LYS 97 2HZ LYS 97 12.422 10.954 -12.113
687 H ALA 98 H ALA 98 13.414 12.512 -4.656
688 HA ALA 98 HA ALA 98 11.626 14.541 -3.944
689 HB1 ALA 98 3HB ALA 98 14.530 14.370 -3.157
690 HB2 ALA 98 1HB ALA 98 13.235 15.194 -2.288
691 HB3 ALA 98 2HB ALA 98 13.236 13.434 -2.409
692 HA PRO 99 HA PRO 99 12.685 17.887 -6.605
693 HB2 PRO 99 1HB PRO 99 11.774 19.943 -5.084
694 HB3 PRO 99 2HB PRO 99 10.699 18.838 -5.948
695 HG2 PRO 99 1HG PRO 99 11.500 18.833 -3.063
696 HG3 PRO 99 2HG PRO 99 9.900 18.570 -3.780
697 HD2 PRO 99 1HD PRO 99 11.470 16.533 -2.932
698 HD3 PRO 99 2HD PRO 99 10.359 16.373 -4.309
699 H SER 100 H SER 100 14.990 17.633 -6.415
700 HA SER 100 HA SER 100 16.628 18.453 -4.371
701 HB2 SER 100 1HB SER 100 16.936 18.211 -7.311
702 HB3 SER 100 2HB SER 100 18.153 19.175 -6.474
703 HG SER 100 HG SER 100 18.782 17.005 -6.541
704 HA PRO 101 HA PRO 101 16.770 22.932 -6.179
705 HB2 PRO 101 1HB PRO 101 14.965 23.553 -8.109
706 HB3 PRO 101 2HB PRO 101 16.565 22.892 -8.467
707 HG2 PRO 101 1HG PRO 101 13.922 21.492 -8.336
708 HG3 PRO 101 2HG PRO 101 15.226 21.311 -9.523
709 HD2 PRO 101 1HD PRO 101 14.850 19.558 -7.494
710 HD3 PRO 101 2HD PRO 101 16.458 19.932 -8.147
711 H SER 102 H SER 102 14.291 21.199 -4.936
712 HA SER 102 HA SER 102 12.003 22.521 -4.717
713 HB2 SER 102 1HB SER 102 12.076 22.035 -2.184
714 HB3 SER 102 2HB SER 102 12.254 20.669 -3.285
715 HG SER 102 HG SER 102 14.649 21.300 -3.001
716 H SER 103 H SER 103 11.172 24.404 -3.977
717 HA SER 103 HA SER 103 12.963 26.258 -2.566
718 HB2 SER 103 1HB SER 103 12.975 26.860 -4.958
719 HB3 SER 103 2HB SER 103 11.217 26.996 -4.929
720 HG SER 103 HG SER 103 12.719 28.474 -3.085
721 H GLY 104 H GLY 104 11.828 28.008 -1.458
722 HA2 GLY 104 1HA GLY 104 9.225 27.066 -0.470
723 HA3 GLY 104 2HA GLY 104 10.307 28.162 0.376
724 HA PRO 105 HA PRO 105 7.656 30.485 -3.003
725 HB2 PRO 105 1HB PRO 105 5.105 29.556 -3.048
726 HB3 PRO 105 2HB PRO 105 6.364 28.957 -4.134
727 HG2 PRO 105 1HG PRO 105 5.327 27.759 -1.594
728 HG3 PRO 105 2HG PRO 105 5.712 26.963 -3.131
729 HD2 PRO 105 1HD PRO 105 7.389 26.916 -1.006
730 HD3 PRO 105 2HD PRO 105 7.972 26.912 -2.683
731 H SER 106 H SER 106 7.498 32.301 -1.828
732 HA SER 106 HA SER 106 5.870 32.315 0.603
733 HB2 SER 106 1HB SER 106 6.908 34.549 0.992
734 HB3 SER 106 2HB SER 106 8.095 33.254 0.840
735 HG SER 106 HG SER 106 7.596 35.413 -0.819
736 H SER 107 H SER 107 4.177 33.760 0.933
737 HA SER 107 HA SER 107 3.327 35.482 -1.246
738 HB2 SER 107 1HB SER 107 1.168 34.481 -1.541
739 HB3 SER 107 2HB SER 107 2.362 33.195 -1.709
740 HG SER 107 HG SER 107 0.957 33.778 0.687
741 H GLY 108 H GLY 108 1.113 36.525 -0.580
742 HA2 GLY 108 1HA GLY 108 -0.267 37.204 1.305
743 HA3 GLY 108 2HA GLY 108 1.152 37.032 2.328
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -3.894 -17.434 13.470
2 HA2 GLY 1 1HA GLY 1 -4.763 -19.027 15.803
3 HA3 GLY 1 2HA GLY 1 -5.418 -19.283 14.193
4 H SER 2 H SER 2 -4.409 -21.429 15.426
5 HA SER 2 HA SER 2 -1.622 -21.802 14.780
6 HB2 SER 2 1HB SER 2 -2.463 -22.918 16.746
7 HB3 SER 2 2HB SER 2 -3.737 -23.703 15.813
8 HG SER 2 HG SER 2 -0.960 -24.099 15.384
9 H SER 3 H SER 3 -1.600 -21.457 12.525
10 HA SER 3 HA SER 3 -2.161 -23.836 10.994
11 HB2 SER 3 1HB SER 3 -3.702 -21.288 10.572
12 HB3 SER 3 2HB SER 3 -3.398 -22.389 9.228
13 HG SER 3 HG SER 3 -4.879 -23.663 9.986
14 H GLY 4 H GLY 4 -1.557 -23.385 8.587
15 HA2 GLY 4 1HA GLY 4 0.879 -21.713 8.613
16 HA3 GLY 4 2HA GLY 4 0.737 -23.222 7.725
17 H SER 5 H SER 5 0.955 -22.630 5.651
18 HA SER 5 HA SER 5 -1.068 -20.822 4.557
19 HB2 SER 5 1HB SER 5 0.571 -19.605 3.225
20 HB3 SER 5 2HB SER 5 0.978 -19.468 4.936
21 HG SER 5 HG SER 5 2.754 -20.564 4.606
22 H SER 6 H SER 6 -1.653 -21.244 2.433
23 HA SER 6 HA SER 6 -0.493 -23.692 1.269
24 HB2 SER 6 1HB SER 6 -3.345 -22.805 1.539
25 HB3 SER 6 2HB SER 6 -2.881 -23.850 0.197
26 HG SER 6 HG SER 6 -2.232 -24.454 2.883
27 H GLY 7 H GLY 7 -2.182 -20.654 0.522
28 HA2 GLY 7 1HA GLY 7 -0.946 -19.265 -1.167
29 HA3 GLY 7 2HA GLY 7 -0.911 -20.725 -2.145
30 H LEU 8 H LEU 8 -2.682 -17.944 -1.278
31 HA LEU 8 HA LEU 8 -5.162 -18.921 -2.461
32 HB2 LEU 8 1HB LEU 8 -4.359 -16.538 -0.873
33 HB3 LEU 8 2HB LEU 8 -5.758 -16.398 -1.936
34 HG LEU 8 HG LEU 8 -6.493 -16.902 0.299
35 HD11 LEU 8 1HD1 LEU 8 -7.313 -18.201 -1.916
36 HD12 LEU 8 2HD1 LEU 8 -8.059 -18.391 -0.329
37 HD13 LEU 8 3HD1 LEU 8 -6.871 -19.567 -0.891
38 HD21 LEU 8 3HD2 LEU 8 -4.184 -18.584 0.323
39 HD22 LEU 8 1HD2 LEU 8 -5.611 -19.548 0.708
40 HD23 LEU 8 2HD2 LEU 8 -5.232 -18.114 1.662
41 H ALA 9 H ALA 9 -5.944 -18.310 -4.412
42 HA ALA 9 HA ALA 9 -4.138 -17.263 -6.339
43 HB1 ALA 9 3HB ALA 9 -7.091 -17.844 -6.473
44 HB2 ALA 9 1HB ALA 9 -6.122 -17.333 -7.856
45 HB3 ALA 9 2HB ALA 9 -5.766 -18.858 -7.045
46 HA PRO 10 HA PRO 10 -4.835 -12.935 -5.966
47 HB2 PRO 10 1HB PRO 10 -4.221 -12.161 -8.495
48 HB3 PRO 10 2HB PRO 10 -3.000 -12.670 -7.323
49 HG2 PRO 10 1HG PRO 10 -4.257 -14.230 -9.548
50 HG3 PRO 10 2HG PRO 10 -2.557 -14.167 -9.047
51 HD2 PRO 10 1HD PRO 10 -4.205 -16.203 -8.358
52 HD3 PRO 10 2HD PRO 10 -2.884 -15.647 -7.310
53 HA PRO 11 HA PRO 11 -9.097 -12.822 -7.442
54 HB2 PRO 11 1HB PRO 11 -9.822 -10.728 -5.874
55 HB3 PRO 11 2HB PRO 11 -9.713 -12.386 -5.272
56 HG2 PRO 11 1HG PRO 11 -7.742 -10.147 -5.024
57 HG3 PRO 11 2HG PRO 11 -8.257 -11.324 -3.802
58 HD2 PRO 11 1HD PRO 11 -5.930 -11.563 -5.165
59 HD3 PRO 11 2HD PRO 11 -6.865 -12.970 -4.619
60 H ARG 12 H ARG 12 -7.203 -9.849 -6.878
61 HA ARG 12 HA ARG 12 -7.809 -8.966 -9.584
62 HB2 ARG 12 1HB ARG 12 -8.677 -7.516 -7.097
63 HB3 ARG 12 2HB ARG 12 -8.373 -6.648 -8.596
64 HG2 ARG 12 1HG ARG 12 -10.287 -8.956 -8.405
65 HG3 ARG 12 2HG ARG 12 -10.766 -7.278 -8.145
66 HD2 ARG 12 1HD ARG 12 -10.397 -6.694 -10.351
67 HD3 ARG 12 2HD ARG 12 -9.280 -8.031 -10.624
68 HE ARG 12 HE ARG 12 -11.973 -8.872 -10.081
69 HH11 ARG 12 1HH1 ARG 12 -9.744 -7.826 -12.543
70 HH12 ARG 12 2HH1 ARG 12 -10.607 -8.594 -13.834
71 HH21 ARG 12 1HH2 ARG 12 -13.117 -9.888 -11.773
72 HH22 ARG 12 2HH2 ARG 12 -12.526 -9.766 -13.395
73 H HIS 13 H HIS 13 -6.706 -6.676 -9.872
74 HA HIS 13 HA HIS 13 -3.983 -6.965 -8.802
75 HB2 HIS 13 1HB HIS 13 -5.004 -5.641 -11.319
76 HB3 HIS 13 2HB HIS 13 -3.337 -5.522 -10.763
77 HD1 HIS 13 1HD HIS 13 -5.656 -7.711 -12.590
78 HD2 HIS 13 2HD HIS 13 -1.907 -8.020 -10.827
79 HE1 HIS 13 1HE HIS 13 -4.654 -9.827 -13.509
80 HE2 HIS 13 2HE HIS 13 -2.421 -10.037 -12.362
81 H LEU 14 H LEU 14 -2.782 -5.004 -8.316
82 HA LEU 14 HA LEU 14 -4.467 -3.076 -6.940
83 HB2 LEU 14 1HB LEU 14 -1.611 -3.870 -6.846
84 HB3 LEU 14 2HB LEU 14 -2.010 -2.220 -6.374
85 HG LEU 14 HG LEU 14 -3.399 -4.568 -5.125
86 HD11 LEU 14 1HD1 LEU 14 -1.280 -3.482 -3.502
87 HD12 LEU 14 2HD1 LEU 14 -0.646 -4.168 -4.998
88 HD13 LEU 14 3HD1 LEU 14 -1.631 -5.159 -3.921
89 HD21 LEU 14 3HD2 LEU 14 -2.727 -1.979 -3.803
90 HD22 LEU 14 1HD2 LEU 14 -4.077 -3.076 -3.512
91 HD23 LEU 14 2HD2 LEU 14 -4.071 -2.048 -4.944
92 H GLY 15 H GLY 15 -3.736 -0.729 -7.016
93 HA2 GLY 15 1HA GLY 15 -2.712 0.066 -9.643
94 HA3 GLY 15 2HA GLY 15 -4.322 0.608 -9.195
95 H PHE 16 H PHE 16 -1.313 1.677 -9.453
96 HA PHE 16 HA PHE 16 -1.479 3.385 -7.059
97 HB2 PHE 16 1HB PHE 16 0.948 2.602 -8.686
98 HB3 PHE 16 2HB PHE 16 0.965 3.727 -7.333
99 HD1 PHE 16 1HD PHE 16 0.382 2.893 -5.048
100 HD2 PHE 16 2HD PHE 16 1.028 0.279 -8.344
101 HE1 PHE 16 1HE PHE 16 0.717 1.017 -3.491
102 HE2 PHE 16 2HE PHE 16 1.363 -1.600 -6.793
103 HZ PHE 16 HZ PHE 16 1.207 -1.233 -4.362
104 H SER 17 H SER 17 -1.964 5.445 -7.392
105 HA SER 17 HA SER 17 -1.180 6.713 -9.919
106 HB2 SER 17 1HB SER 17 -3.599 5.962 -9.988
107 HB3 SER 17 2HB SER 17 -3.912 7.111 -8.687
108 HG SER 17 HG SER 17 -4.303 8.262 -10.481
109 H ASP 18 H ASP 18 -1.265 9.091 -9.818
110 HA ASP 18 HA ASP 18 -0.568 11.039 -8.869
111 HB2 ASP 18 1HB ASP 18 -2.494 9.955 -6.840
112 HB3 ASP 18 2HB ASP 18 -1.611 11.443 -6.509
113 H VAL 19 H VAL 19 1.048 8.614 -8.474
114 HA VAL 19 HA VAL 19 2.140 8.531 -5.877
115 HB VAL 19 HB VAL 19 3.446 7.787 -8.499
116 HG11 VAL 19 1HG1 VAL 19 5.182 7.983 -6.925
117 HG12 VAL 19 2HG1 VAL 19 4.209 7.267 -5.639
118 HG13 VAL 19 3HG1 VAL 19 4.791 6.264 -6.968
119 HG21 VAL 19 3HG2 VAL 19 1.311 6.590 -7.011
120 HG22 VAL 19 1HG2 VAL 19 2.031 6.075 -8.537
121 HG23 VAL 19 2HG2 VAL 19 2.710 5.515 -7.009
122 H SER 20 H SER 20 3.524 9.824 -4.855
123 HA SER 20 HA SER 20 4.878 11.918 -6.423
124 HB2 SER 20 1HB SER 20 4.062 11.953 -3.507
125 HB3 SER 20 2HB SER 20 4.881 13.263 -4.358
126 HG SER 20 HG SER 20 3.067 13.495 -5.667
127 H HIS 21 H HIS 21 6.784 12.818 -4.844
128 HA HIS 21 HA HIS 21 8.659 10.613 -4.744
129 HB2 HIS 21 1HB HIS 21 10.275 12.498 -4.108
130 HB3 HIS 21 2HB HIS 21 9.566 12.559 -5.719
131 HD1 HIS 21 1HD HIS 21 7.690 14.368 -6.106
132 HD2 HIS 21 2HD HIS 21 9.679 14.636 -2.469
133 HE1 HIS 21 1HE HIS 21 7.130 16.646 -5.201
134 HE2 HIS 21 2HE HIS 21 8.413 16.818 -3.040
135 H ASP 22 H ASP 22 6.557 12.119 -2.596
136 HA ASP 22 HA ASP 22 7.982 10.927 -0.319
137 HB2 ASP 22 1HB ASP 22 7.281 12.830 1.098
138 HB3 ASP 22 2HB ASP 22 8.370 13.326 -0.195
139 H ALA 23 H ALA 23 5.633 10.210 -2.083
140 HA ALA 23 HA ALA 23 4.024 9.032 -0.095
141 HB1 ALA 23 3HB ALA 23 3.247 11.709 -0.932
142 HB2 ALA 23 1HB ALA 23 1.965 10.517 -1.153
143 HB3 ALA 23 2HB ALA 23 2.695 10.744 0.437
144 H ALA 24 H ALA 24 2.161 7.862 -1.016
145 HA ALA 24 HA ALA 24 1.929 7.688 -3.880
146 HB1 ALA 24 3HB ALA 24 3.406 5.611 -2.326
147 HB2 ALA 24 1HB ALA 24 2.451 5.140 -3.732
148 HB3 ALA 24 2HB ALA 24 3.768 6.300 -3.908
149 H ARG 25 H ARG 25 -0.119 7.227 -4.347
150 HA ARG 25 HA ARG 25 -1.867 6.264 -2.231
151 HB2 ARG 25 1HB ARG 25 -2.512 8.225 -3.608
152 HB3 ARG 25 2HB ARG 25 -2.551 7.187 -5.027
153 HG2 ARG 25 1HG ARG 25 -4.360 5.892 -4.065
154 HG3 ARG 25 2HG ARG 25 -4.292 6.862 -2.592
155 HD2 ARG 25 1HD ARG 25 -6.035 7.847 -3.747
156 HD3 ARG 25 2HD ARG 25 -4.667 8.865 -4.195
157 HE ARG 25 HE ARG 25 -4.773 6.938 -6.135
158 HH11 ARG 25 1HH1 ARG 25 -6.985 9.308 -4.867
159 HH12 ARG 25 2HH1 ARG 25 -7.832 9.510 -6.365
160 HH21 ARG 25 1HH2 ARG 25 -5.880 7.195 -8.113
161 HH22 ARG 25 2HH2 ARG 25 -7.203 8.307 -8.210
162 H VAL 26 H VAL 26 -2.486 4.219 -2.049
163 HA VAL 26 HA VAL 26 -2.128 2.435 -4.366
164 HB VAL 26 HB VAL 26 -0.732 1.871 -2.410
165 HG11 VAL 26 1HG1 VAL 26 -2.837 2.638 -0.894
166 HG12 VAL 26 2HG1 VAL 26 -3.008 0.883 -0.831
167 HG13 VAL 26 3HG1 VAL 26 -1.504 1.643 -0.308
168 HG21 VAL 26 3HG2 VAL 26 -2.327 0.172 -3.930
169 HG22 VAL 26 1HG2 VAL 26 -0.895 -0.270 -3.001
170 HG23 VAL 26 2HG2 VAL 26 -2.496 -0.416 -2.276
171 H PHE 27 H PHE 27 -3.946 1.850 -5.333
172 HA PHE 27 HA PHE 27 -6.359 1.473 -3.688
173 HB2 PHE 27 1HB PHE 27 -7.731 2.458 -5.347
174 HB3 PHE 27 2HB PHE 27 -6.362 3.550 -5.168
175 HD1 PHE 27 2HD PHE 27 -7.740 0.841 -7.281
176 HD2 PHE 27 1HD PHE 27 -5.006 4.090 -6.995
177 HE1 PHE 27 2HE PHE 27 -7.306 0.684 -9.697
178 HE2 PHE 27 1HE PHE 27 -4.568 3.939 -9.412
179 HZ PHE 27 HZ PHE 27 -5.718 2.233 -10.766
180 H TRP 28 H TRP 28 -7.856 -0.116 -4.447
181 HA TRP 28 HA TRP 28 -6.659 -2.082 -6.288
182 HB2 TRP 28 1HB TRP 28 -8.043 -3.761 -4.860
183 HB3 TRP 28 2HB TRP 28 -6.505 -3.171 -4.237
184 HD1 TRP 28 HD TRP 28 -10.154 -3.339 -3.414
185 HE1 TRP 28 1HE TRP 28 -10.601 -2.138 -1.182
186 HE3 TRP 28 3HE TRP 28 -5.631 -1.033 -2.812
187 HZ2 TRP 28 2HZ TRP 28 -9.219 -0.438 0.598
188 HZ3 TRP 28 3HZ TRP 28 -5.275 0.363 -0.818
189 HH2 TRP 28 HH TRP 28 -7.033 0.654 0.851
190 H GLU 29 H GLU 29 -8.187 -3.440 -7.440
191 HA GLU 29 HA GLU 29 -10.431 -1.911 -8.390
192 HB2 GLU 29 1HB GLU 29 -9.291 -4.600 -9.127
193 HB3 GLU 29 2HB GLU 29 -10.774 -3.987 -9.844
194 HG2 GLU 29 1HG GLU 29 -8.319 -2.301 -9.902
195 HG3 GLU 29 2HG GLU 29 -8.481 -3.644 -11.033
196 H GLY 30 H GLY 30 -10.170 -3.474 -5.645
197 HA2 GLY 30 1HA GLY 30 -11.832 -4.121 -4.161
198 HA3 GLY 30 2HA GLY 30 -12.999 -4.014 -5.471
199 H ALA 31 H ALA 31 -13.245 -6.063 -3.738
200 HA ALA 31 HA ALA 31 -12.199 -8.381 -5.230
201 HB1 ALA 31 3HB ALA 31 -11.267 -8.806 -3.211
202 HB2 ALA 31 1HB ALA 31 -12.474 -7.867 -2.332
203 HB3 ALA 31 2HB ALA 31 -12.858 -9.496 -2.889
204 HA PRO 32 HA PRO 32 -16.309 -9.608 -6.170
205 HB2 PRO 32 1HB PRO 32 -16.052 -12.310 -6.182
206 HB3 PRO 32 2HB PRO 32 -15.386 -11.277 -7.452
207 HG2 PRO 32 1HG PRO 32 -14.011 -12.506 -5.094
208 HG3 PRO 32 2HG PRO 32 -13.456 -12.381 -6.774
209 HD2 PRO 32 1HD PRO 32 -12.597 -10.707 -4.826
210 HD3 PRO 32 2HD PRO 32 -12.773 -10.195 -6.517
211 H ARG 33 H ARG 33 -15.030 -9.932 -3.158
212 HA ARG 33 HA ARG 33 -17.522 -11.092 -2.098
213 HB2 ARG 33 1HB ARG 33 -16.073 -11.836 -0.132
214 HB3 ARG 33 2HB ARG 33 -15.898 -12.732 -1.634
215 HG2 ARG 33 1HG ARG 33 -14.065 -10.448 -1.172
216 HG3 ARG 33 2HG ARG 33 -13.814 -11.918 -0.230
217 HD2 ARG 33 1HD ARG 33 -14.010 -11.802 -3.237
218 HD3 ARG 33 2HD ARG 33 -12.501 -11.864 -2.327
219 HE ARG 33 HE ARG 33 -14.273 -14.015 -1.679
220 HH11 ARG 33 1HH1 ARG 33 -11.879 -12.907 -3.950
221 HH12 ARG 33 2HH1 ARG 33 -11.417 -14.503 -4.441
222 HH21 ARG 33 1HH2 ARG 33 -13.674 -16.121 -2.317
223 HH22 ARG 33 2HH2 ARG 33 -12.439 -16.330 -3.512
224 HA PRO 34 HA PRO 34 -18.028 -7.455 0.305
225 HB2 PRO 34 1HB PRO 34 -19.173 -8.447 2.558
226 HB3 PRO 34 2HB PRO 34 -20.027 -8.338 1.014
227 HG2 PRO 34 1HG PRO 34 -18.687 -10.700 2.274
228 HG3 PRO 34 2HG PRO 34 -20.249 -10.613 1.440
229 HD2 PRO 34 1HD PRO 34 -18.009 -11.553 0.244
230 HD3 PRO 34 2HD PRO 34 -19.280 -10.694 -0.649
231 H VAL 35 H VAL 35 -16.873 -6.224 1.691
232 HA VAL 35 HA VAL 35 -15.006 -7.600 3.513
233 HB VAL 35 HB VAL 35 -14.546 -5.056 1.950
234 HG11 VAL 35 1HG1 VAL 35 -13.433 -5.920 4.441
235 HG12 VAL 35 2HG1 VAL 35 -12.177 -5.916 3.201
236 HG13 VAL 35 3HG1 VAL 35 -13.104 -4.450 3.525
237 HG21 VAL 35 3HG2 VAL 35 -12.468 -6.730 1.410
238 HG22 VAL 35 1HG2 VAL 35 -13.807 -7.867 1.570
239 HG23 VAL 35 2HG2 VAL 35 -13.903 -6.551 0.401
240 H ARG 36 H ARG 36 -14.859 -6.874 5.579
241 HA ARG 36 HA ARG 36 -16.794 -4.821 6.376
242 HB2 ARG 36 1HB ARG 36 -16.710 -5.767 8.578
243 HB3 ARG 36 2HB ARG 36 -16.894 -7.087 7.430
244 HG2 ARG 36 1HG ARG 36 -14.562 -7.649 7.629
245 HG3 ARG 36 2HG ARG 36 -14.280 -6.248 8.664
246 HD2 ARG 36 1HD ARG 36 -16.280 -8.357 9.404
247 HD3 ARG 36 2HD ARG 36 -14.567 -8.556 9.768
248 HE ARG 36 HE ARG 36 -15.671 -6.057 10.669
249 HH11 ARG 36 1HH1 ARG 36 -15.127 -9.405 11.451
250 HH12 ARG 36 2HH1 ARG 36 -15.201 -9.152 13.163
251 HH21 ARG 36 1HH2 ARG 36 -15.772 -5.711 12.921
252 HH22 ARG 36 2HH2 ARG 36 -15.569 -7.051 13.999
253 H LEU 37 H LEU 37 -13.390 -5.569 6.363
254 HA LEU 37 HA LEU 37 -12.742 -2.834 6.983
255 HB2 LEU 37 1HB LEU 37 -12.964 -3.625 9.225
256 HB3 LEU 37 2HB LEU 37 -12.010 -5.063 8.869
257 HG LEU 37 HG LEU 37 -10.088 -3.399 8.411
258 HD11 LEU 37 1HD1 LEU 37 -10.198 -1.278 9.411
259 HD12 LEU 37 2HD1 LEU 37 -11.706 -1.655 10.243
260 HD13 LEU 37 3HD1 LEU 37 -11.697 -1.434 8.494
261 HD21 LEU 37 3HD2 LEU 37 -11.189 -4.418 10.944
262 HD22 LEU 37 1HD2 LEU 37 -9.985 -3.137 11.095
263 HD23 LEU 37 2HD2 LEU 37 -9.587 -4.623 10.233
264 H VAL 38 H VAL 38 -10.560 -2.303 6.521
265 HA VAL 38 HA VAL 38 -9.019 -4.422 5.177
266 HB VAL 38 HB VAL 38 -9.349 -1.591 4.173
267 HG11 VAL 38 1HG1 VAL 38 -8.134 -2.560 2.167
268 HG12 VAL 38 2HG1 VAL 38 -7.166 -2.289 3.617
269 HG13 VAL 38 3HG1 VAL 38 -7.707 -3.917 3.208
270 HG21 VAL 38 3HG2 VAL 38 -10.141 -3.658 2.336
271 HG22 VAL 38 1HG2 VAL 38 -11.039 -3.798 3.848
272 HG23 VAL 38 2HG2 VAL 38 -11.067 -2.285 2.942
273 H ARG 39 H ARG 39 -6.908 -4.504 5.677
274 HA ARG 39 HA ARG 39 -5.790 -2.275 7.249
275 HB2 ARG 39 1HB ARG 39 -6.251 -4.656 8.313
276 HB3 ARG 39 2HB ARG 39 -4.723 -5.048 7.534
277 HG2 ARG 39 1HG ARG 39 -3.683 -3.140 8.732
278 HG3 ARG 39 2HG ARG 39 -5.207 -2.905 9.590
279 HD2 ARG 39 1HD ARG 39 -3.655 -4.196 10.943
280 HD3 ARG 39 2HD ARG 39 -5.045 -5.180 10.486
281 HE ARG 39 HE ARG 39 -3.143 -5.675 8.570
282 HH11 ARG 39 1HH1 ARG 39 -3.342 -5.957 12.035
283 HH12 ARG 39 2HH1 ARG 39 -2.245 -7.294 12.120
284 HH21 ARG 39 1HH2 ARG 39 -1.697 -7.436 8.669
285 HH22 ARG 39 2HH2 ARG 39 -1.308 -8.135 10.205
286 H VAL 40 H VAL 40 -4.412 -1.192 6.003
287 HA VAL 40 HA VAL 40 -2.800 -2.644 4.032
288 HB VAL 40 HB VAL 40 -2.982 0.349 4.340
289 HG11 VAL 40 1HG1 VAL 40 -2.113 -1.476 2.107
290 HG12 VAL 40 2HG1 VAL 40 -2.367 0.260 1.915
291 HG13 VAL 40 3HG1 VAL 40 -1.120 -0.334 3.013
292 HG21 VAL 40 3HG2 VAL 40 -4.600 0.102 2.350
293 HG22 VAL 40 1HG2 VAL 40 -4.811 -1.553 2.920
294 HG23 VAL 40 2HG2 VAL 40 -5.217 -0.199 3.974
295 H THR 41 H THR 41 -0.578 -2.594 4.014
296 HA THR 41 HA THR 41 0.824 -1.116 6.104
297 HB THR 41 HB THR 41 2.128 -3.134 6.760
298 HG1 THR 41 1HG THR 41 0.086 -4.524 5.331
299 HG21 THR 41 3HG2 THR 41 -0.816 -2.933 7.264
300 HG22 THR 41 1HG2 THR 41 0.530 -2.591 8.350
301 HG23 THR 41 2HG2 THR 41 0.110 -4.260 7.965
302 H TYR 42 H TYR 42 2.583 -0.197 5.284
303 HA TYR 42 HA TYR 42 3.753 -1.355 2.840
304 HB2 TYR 42 1HB TYR 42 4.603 1.024 2.465
305 HB3 TYR 42 2HB TYR 42 2.875 0.760 2.257
306 HD1 TYR 42 2HD TYR 42 1.355 1.328 4.257
307 HD2 TYR 42 1HD TYR 42 5.372 2.688 3.908
308 HE1 TYR 42 2HE TYR 42 0.883 3.120 5.874
309 HE2 TYR 42 1HE TYR 42 4.911 4.483 5.525
310 HH TYR 42 HH TYR 42 3.164 5.671 6.510
311 H VAL 43 H VAL 43 6.051 -1.184 2.573
312 HA VAL 43 HA VAL 43 7.662 -0.485 4.879
313 HB VAL 43 HB VAL 43 6.959 -2.848 5.292
314 HG11 VAL 43 1HG1 VAL 43 6.803 -3.715 3.080
315 HG12 VAL 43 2HG1 VAL 43 8.487 -3.313 2.739
316 HG13 VAL 43 3HG1 VAL 43 8.100 -4.590 3.893
317 HG21 VAL 43 3HG2 VAL 43 8.969 -2.062 6.320
318 HG22 VAL 43 1HG2 VAL 43 9.281 -3.684 5.703
319 HG23 VAL 43 2HG2 VAL 43 9.882 -2.277 4.826
320 H SER 44 H SER 44 9.834 -0.155 4.390
321 HA SER 44 HA SER 44 10.405 0.600 1.730
322 HB2 SER 44 1HB SER 44 12.763 0.874 2.602
323 HB3 SER 44 2HB SER 44 11.527 1.750 3.506
324 HG SER 44 HG SER 44 12.159 -0.837 4.338
325 H SER 45 H SER 45 12.268 -0.197 0.454
326 HA SER 45 HA SER 45 11.985 -2.931 -0.139
327 HB2 SER 45 1HB SER 45 12.853 -0.968 -1.618
328 HB3 SER 45 2HB SER 45 14.427 -1.371 -0.932
329 HG SER 45 HG SER 45 12.723 -3.229 -2.235
330 H GLU 46 H GLU 46 14.475 -1.157 1.644
331 HA GLU 46 HA GLU 46 15.800 -3.680 2.316
332 HB2 GLU 46 1HB GLU 46 17.597 -2.245 3.224
333 HB3 GLU 46 2HB GLU 46 17.266 -1.921 1.529
334 HG2 GLU 46 1HG GLU 46 15.872 0.013 2.239
335 HG3 GLU 46 2HG GLU 46 16.411 -0.273 3.893
336 H GLY 47 H GLY 47 13.270 -3.271 3.457
337 HA2 GLY 47 1HA GLY 47 12.175 -3.280 5.477
338 HA3 GLY 47 2HA GLY 47 13.689 -3.905 6.115
339 H GLY 48 H GLY 48 12.324 -2.489 7.853
340 HA2 GLY 48 1HA GLY 48 13.243 -0.837 9.356
341 HA3 GLY 48 2HA GLY 48 13.785 0.069 7.951
342 H HIS 49 H HIS 49 12.501 1.622 7.130
343 HA HIS 49 HA HIS 49 10.387 2.665 8.600
344 HB2 HIS 49 1HB HIS 49 11.699 3.934 6.922
345 HB3 HIS 49 2HB HIS 49 10.894 3.034 5.639
346 HD1 HIS 49 1HD HIS 49 9.523 4.821 4.560
347 HD2 HIS 49 2HD HIS 49 9.074 4.761 8.690
348 HE1 HIS 49 1HE HIS 49 7.677 6.454 5.059
349 HE2 HIS 49 2HE HIS 49 7.481 6.464 7.570
350 H SER 50 H SER 50 8.582 1.573 9.055
351 HA SER 50 HA SER 50 7.003 0.539 6.809
352 HB2 SER 50 1HB SER 50 6.541 -1.529 7.864
353 HB3 SER 50 2HB SER 50 8.282 -1.309 8.045
354 HG SER 50 HG SER 50 8.036 -0.932 10.152
355 H GLY 51 H GLY 51 4.783 0.700 7.048
356 HA2 GLY 51 1HA GLY 51 3.810 1.923 9.545
357 HA3 GLY 51 2HA GLY 51 3.436 2.665 7.997
358 H GLN 52 H GLN 52 1.305 2.126 9.404
359 HA GLN 52 HA GLN 52 0.028 0.000 7.914
360 HB2 GLN 52 1HB GLN 52 0.867 -1.241 9.825
361 HB3 GLN 52 2HB GLN 52 0.167 -0.068 10.932
362 HG2 GLN 52 1HG GLN 52 -2.072 -0.718 9.787
363 HG3 GLN 52 2HG GLN 52 -1.184 -2.156 9.287
364 HE21 GLN 52 1HE2 GLN 52 0.046 -3.225 11.126
365 HE22 GLN 52 2HE2 GLN 52 -0.806 -3.389 12.620
366 H THR 53 H THR 53 -1.911 0.679 7.298
367 HA THR 53 HA THR 53 -3.339 2.615 8.995
368 HB THR 53 HB THR 53 -2.281 3.753 7.039
369 HG1 THR 53 1HG THR 53 -4.106 4.949 6.645
370 HG21 THR 53 3HG2 THR 53 -2.424 1.949 5.412
371 HG22 THR 53 1HG2 THR 53 -3.267 3.376 4.811
372 HG23 THR 53 2HG2 THR 53 -4.185 2.018 5.461
373 H GLU 54 H GLU 54 -5.519 2.339 9.177
374 HA GLU 54 HA GLU 54 -6.628 -0.052 7.873
375 HB2 GLU 54 1HB GLU 54 -7.229 1.305 10.487
376 HB3 GLU 54 2HB GLU 54 -8.387 0.206 9.751
377 HG2 GLU 54 1HG GLU 54 -6.732 -1.581 9.793
378 HG3 GLU 54 2HG GLU 54 -5.557 -0.481 10.513
379 H ALA 55 H ALA 55 -8.624 0.012 6.862
380 HA ALA 55 HA ALA 55 -10.012 2.576 6.677
381 HB1 ALA 55 3HB ALA 55 -8.580 1.239 4.446
382 HB2 ALA 55 1HB ALA 55 -10.130 2.004 4.094
383 HB3 ALA 55 2HB ALA 55 -8.811 2.955 4.778
384 HA PRO 56 HA PRO 56 -13.649 0.118 6.667
385 HB2 PRO 56 1HB PRO 56 -15.322 1.626 5.151
386 HB3 PRO 56 2HB PRO 56 -14.839 2.080 6.789
387 HG2 PRO 56 1HG PRO 56 -13.771 3.045 4.164
388 HG3 PRO 56 2HG PRO 56 -14.154 3.973 5.626
389 HD2 PRO 56 1HD PRO 56 -11.625 3.256 4.977
390 HD3 PRO 56 2HD PRO 56 -12.174 3.404 6.659
391 H GLY 57 H GLY 57 -14.903 -1.319 5.433
392 HA2 GLY 57 1HA GLY 57 -13.679 -2.500 3.229
393 HA3 GLY 57 2HA GLY 57 -15.356 -2.747 3.694
394 H ASN 58 H ASN 58 -15.506 0.363 3.332
395 HA ASN 58 HA ASN 58 -16.424 0.187 0.586
396 HB2 ASN 58 1HB ASN 58 -17.871 1.300 2.182
397 HB3 ASN 58 2HB ASN 58 -16.583 2.417 2.625
398 HD21 ASN 58 1HD2 ASN 58 -15.806 3.871 0.952
399 HD22 ASN 58 2HD2 ASN 58 -16.911 4.430 -0.252
400 H ALA 59 H ALA 59 -13.746 1.469 2.361
401 HA ALA 59 HA ALA 59 -12.888 3.381 0.435
402 HB1 ALA 59 3HB ALA 59 -11.655 3.950 2.191
403 HB2 ALA 59 1HB ALA 59 -12.001 2.417 2.993
404 HB3 ALA 59 2HB ALA 59 -10.642 2.541 1.875
405 H THR 60 H THR 60 -12.214 2.906 -1.543
406 HA THR 60 HA THR 60 -10.864 0.335 -2.010
407 HB THR 60 HB THR 60 -11.313 0.982 -4.483
408 HG1 THR 60 1HG THR 60 -13.463 2.441 -3.381
409 HG21 THR 60 3HG2 THR 60 -12.432 -0.858 -3.308
410 HG22 THR 60 1HG2 THR 60 -13.544 -0.018 -4.388
411 HG23 THR 60 2HG2 THR 60 -13.610 0.277 -2.651
412 H SER 61 H SER 61 -9.783 3.053 -1.049
413 HA SER 61 HA SER 61 -7.301 2.889 -2.446
414 HB2 SER 61 1HB SER 61 -7.348 5.262 -3.291
415 HB3 SER 61 2HB SER 61 -8.418 4.158 -4.155
416 HG SER 61 HG SER 61 -10.044 5.332 -3.553
417 H ALA 62 H ALA 62 -5.672 3.688 -1.227
418 HA ALA 62 HA ALA 62 -6.282 5.572 0.925
419 HB1 ALA 62 3HB ALA 62 -4.511 3.603 1.985
420 HB2 ALA 62 1HB ALA 62 -6.103 4.093 2.566
421 HB3 ALA 62 2HB ALA 62 -5.958 2.804 1.371
422 H MET 63 H MET 63 -4.551 6.837 1.574
423 HA MET 63 HA MET 63 -2.303 6.863 -0.278
424 HB2 MET 63 1HB MET 63 -3.155 8.827 1.856
425 HB3 MET 63 2HB MET 63 -1.783 9.054 0.780
426 HG2 MET 63 1HG MET 63 -3.642 8.650 -1.063
427 HG3 MET 63 2HG MET 63 -4.685 9.245 0.227
428 HE1 MET 63 3HE MET 63 -1.562 9.592 -1.641
429 HE2 MET 63 1HE MET 63 -1.792 11.134 -2.466
430 HE3 MET 63 2HE MET 63 -0.863 11.066 -0.968
431 H LEU 64 H LEU 64 -0.107 7.070 0.471
432 HA LEU 64 HA LEU 64 0.362 6.002 3.170
433 HB2 LEU 64 1HB LEU 64 1.957 5.158 0.767
434 HB3 LEU 64 2HB LEU 64 1.993 4.472 2.390
435 HG LEU 64 HG LEU 64 -0.489 4.318 0.715
436 HD11 LEU 64 1HD1 LEU 64 1.253 1.963 0.700
437 HD12 LEU 64 2HD1 LEU 64 1.863 3.332 -0.228
438 HD13 LEU 64 3HD1 LEU 64 0.272 2.662 -0.588
439 HD21 LEU 64 3HD2 LEU 64 -1.239 3.226 2.493
440 HD22 LEU 64 1HD2 LEU 64 0.314 3.445 3.301
441 HD23 LEU 64 2HD2 LEU 64 0.037 2.024 2.292
442 H GLY 65 H GLY 65 2.181 6.753 4.222
443 HA2 GLY 65 1HA GLY 65 4.461 7.871 3.472
444 HA3 GLY 65 2HA GLY 65 3.346 9.170 3.071
445 HA PRO 66 HA PRO 66 4.838 10.665 3.565
446 HB2 PRO 66 1HB PRO 66 7.069 11.563 4.823
447 HB3 PRO 66 2HB PRO 66 5.508 12.384 4.933
448 HG2 PRO 66 1HG PRO 66 6.803 10.509 6.874
449 HG3 PRO 66 2HG PRO 66 5.937 12.024 7.190
450 HD2 PRO 66 1HD PRO 66 4.790 9.593 7.520
451 HD3 PRO 66 2HD PRO 66 3.868 11.023 7.014
452 H LEU 67 H LEU 67 5.944 9.592 2.061
453 HA LEU 67 HA LEU 67 7.805 7.486 2.901
454 HB2 LEU 67 1HB LEU 67 6.753 7.952 0.125
455 HB3 LEU 67 2HB LEU 67 7.496 6.492 0.777
456 HG LEU 67 HG LEU 67 4.778 7.574 1.521
457 HD11 LEU 67 1HD1 LEU 67 4.911 6.646 -0.760
458 HD12 LEU 67 2HD1 LEU 67 3.895 5.682 0.311
459 HD13 LEU 67 3HD1 LEU 67 5.524 5.135 -0.086
460 HD21 LEU 67 3HD2 LEU 67 6.257 6.218 3.214
461 HD22 LEU 67 1HD2 LEU 67 5.755 4.848 2.223
462 HD23 LEU 67 2HD2 LEU 67 4.542 5.853 3.018
463 H SER 68 H SER 68 9.529 7.146 0.989
464 HA SER 68 HA SER 68 10.963 9.704 0.829
465 HB2 SER 68 1HB SER 68 12.983 8.292 0.451
466 HB3 SER 68 2HB SER 68 12.191 7.965 1.993
467 HG SER 68 HG SER 68 12.517 5.991 1.147
468 H SER 69 H SER 69 12.658 9.499 -1.145
469 HA SER 69 HA SER 69 10.965 9.157 -3.523
470 HB2 SER 69 1HB SER 69 12.608 10.683 -4.630
471 HB3 SER 69 2HB SER 69 11.777 11.421 -3.261
472 HG SER 69 HG SER 69 14.180 10.118 -2.738
473 H SER 70 H SER 70 12.004 8.385 -5.499
474 HA SER 70 HA SER 70 12.933 6.551 -6.529
475 HB2 SER 70 1HB SER 70 14.676 8.287 -6.720
476 HB3 SER 70 2HB SER 70 15.384 7.736 -5.202
477 HG SER 70 HG SER 70 14.993 5.836 -7.202
478 H THR 71 H THR 71 11.876 5.950 -3.916
479 HA THR 71 HA THR 71 13.653 3.715 -3.183
480 HB THR 71 HB THR 71 11.869 5.258 -1.290
481 HG1 THR 71 1HG THR 71 13.606 6.542 -1.561
482 HG21 THR 71 3HG2 THR 71 13.269 3.926 0.402
483 HG22 THR 71 1HG2 THR 71 13.667 2.874 -0.956
484 HG23 THR 71 2HG2 THR 71 11.987 3.071 -0.456
485 H THR 72 H THR 72 12.770 1.806 -3.587
486 HA THR 72 HA THR 72 9.995 1.543 -4.253
487 HB THR 72 HB THR 72 12.049 -0.641 -3.859
488 HG1 THR 72 1HG THR 72 12.653 0.856 -5.498
489 HG21 THR 72 3HG2 THR 72 9.315 -0.573 -5.115
490 HG22 THR 72 1HG2 THR 72 9.911 -1.643 -3.846
491 HG23 THR 72 2HG2 THR 72 10.496 -1.824 -5.500
492 H TYR 73 H TYR 73 8.375 1.168 -2.900
493 HA TYR 73 HA TYR 73 8.984 -0.039 -0.281
494 HB2 TYR 73 1HB TYR 73 7.249 2.259 -1.046
495 HB3 TYR 73 2HB TYR 73 6.705 1.228 0.272
496 HD1 TYR 73 1HD TYR 73 9.613 3.250 -0.869
497 HD2 TYR 73 2HD TYR 73 7.545 1.536 2.431
498 HE1 TYR 73 1HE TYR 73 11.091 4.462 0.679
499 HE2 TYR 73 2HE TYR 73 9.016 2.745 3.988
500 HH TYR 73 HH TYR 73 11.499 3.723 3.788
501 H THR 74 H THR 74 7.962 -1.867 0.222
502 HA THR 74 HA THR 74 6.066 -2.978 -1.673
503 HB THR 74 HB THR 74 7.095 -4.262 0.860
504 HG1 THR 74 1HG THR 74 8.475 -5.329 -0.906
505 HG21 THR 74 3HG2 THR 74 5.411 -5.656 0.205
506 HG22 THR 74 1HG2 THR 74 6.697 -6.288 -0.822
507 HG23 THR 74 2HG2 THR 74 5.511 -5.163 -1.485
508 H VAL 75 H VAL 75 3.962 -2.631 -1.472
509 HA VAL 75 HA VAL 75 2.855 -1.990 1.167
510 HB VAL 75 HB VAL 75 1.626 -1.677 -1.576
511 HG11 VAL 75 1HG1 VAL 75 0.097 -0.136 -0.054
512 HG12 VAL 75 2HG1 VAL 75 -0.250 -1.850 -0.291
513 HG13 VAL 75 3HG1 VAL 75 0.569 -1.309 1.175
514 HG21 VAL 75 3HG2 VAL 75 3.286 -0.047 -1.445
515 HG22 VAL 75 1HG2 VAL 75 1.841 0.797 -0.887
516 HG23 VAL 75 2HG2 VAL 75 3.028 0.215 0.280
517 H ARG 76 H ARG 76 0.979 -3.022 1.951
518 HA ARG 76 HA ARG 76 0.212 -5.517 0.610
519 HB2 ARG 76 1HB ARG 76 1.510 -5.219 3.231
520 HB3 ARG 76 2HB ARG 76 0.067 -6.224 3.248
521 HG2 ARG 76 1HG ARG 76 1.732 -7.761 2.849
522 HG3 ARG 76 2HG ARG 76 1.164 -7.400 1.218
523 HD2 ARG 76 1HD ARG 76 3.003 -5.860 0.885
524 HD3 ARG 76 2HD ARG 76 3.540 -6.103 2.547
525 HE ARG 76 HE ARG 76 4.124 -7.757 0.316
526 HH11 ARG 76 1HH1 ARG 76 3.457 -7.855 3.731
527 HH12 ARG 76 2HH1 ARG 76 4.340 -9.322 3.994
528 HH21 ARG 76 1HH2 ARG 76 5.291 -9.689 0.649
529 HH22 ARG 76 2HH2 ARG 76 5.384 -10.364 2.241
530 H VAL 77 H VAL 77 -1.892 -5.391 0.227
531 HA VAL 77 HA VAL 77 -3.597 -3.865 2.066
532 HB VAL 77 HB VAL 77 -4.310 -4.887 -0.684
533 HG11 VAL 77 1HG1 VAL 77 -6.338 -4.430 0.251
534 HG12 VAL 77 2HG1 VAL 77 -5.678 -3.237 1.372
535 HG13 VAL 77 3HG1 VAL 77 -5.923 -2.816 -0.324
536 HG21 VAL 77 3HG2 VAL 77 -4.074 -2.177 -0.921
537 HG22 VAL 77 1HG2 VAL 77 -2.734 -2.569 0.158
538 HG23 VAL 77 2HG2 VAL 77 -2.853 -3.348 -1.420
539 H THR 78 H THR 78 -4.100 -5.274 3.684
540 HA THR 78 HA THR 78 -5.003 -7.964 3.050
541 HB THR 78 HB THR 78 -4.946 -6.696 5.786
542 HG1 THR 78 1HG THR 78 -2.828 -7.730 5.906
543 HG21 THR 78 3HG2 THR 78 -5.266 -8.782 6.615
544 HG22 THR 78 1HG2 THR 78 -4.339 -9.553 5.329
545 HG23 THR 78 2HG2 THR 78 -6.005 -9.055 5.038
546 H CYS 79 H CYS 79 -7.043 -8.244 2.441
547 HA CYS 79 HA CYS 79 -9.110 -6.419 3.413
548 HB2 CYS 79 1HB CYS 79 -9.126 -8.500 1.220
549 HB3 CYS 79 2HB CYS 79 -10.536 -7.555 1.686
550 HG CYS 79 HG CYS 79 -9.234 -5.085 1.064
551 H LEU 80 H LEU 80 -9.548 -7.105 5.476
552 HA LEU 80 HA LEU 80 -9.901 -9.849 6.167
553 HB2 LEU 80 1HB LEU 80 -10.335 -7.234 7.529
554 HB3 LEU 80 2HB LEU 80 -11.058 -8.685 8.220
555 HG LEU 80 HG LEU 80 -8.970 -8.206 9.325
556 HD11 LEU 80 1HD1 LEU 80 -7.923 -10.324 9.126
557 HD12 LEU 80 2HD1 LEU 80 -8.507 -10.534 7.476
558 HD13 LEU 80 3HD1 LEU 80 -9.643 -10.575 8.824
559 HD21 LEU 80 3HD2 LEU 80 -7.567 -8.531 6.684
560 HD22 LEU 80 1HD2 LEU 80 -6.888 -8.005 8.225
561 HD23 LEU 80 2HD2 LEU 80 -8.005 -6.957 7.350
562 H TYR 81 H TYR 81 -11.526 -11.000 5.352
563 HA TYR 81 HA TYR 81 -14.054 -9.781 4.674
564 HB2 TYR 81 1HB TYR 81 -13.256 -12.697 4.588
565 HB3 TYR 81 2HB TYR 81 -14.663 -11.974 3.815
566 HD1 TYR 81 2HD TYR 81 -13.535 -9.555 2.603
567 HD2 TYR 81 1HD TYR 81 -11.921 -13.484 2.856
568 HE1 TYR 81 2HE TYR 81 -12.208 -9.135 0.575
569 HE2 TYR 81 1HE TYR 81 -10.588 -13.074 0.830
570 HH TYR 81 HH TYR 81 -10.932 -10.088 -1.021
571 HA PRO 82 HA PRO 82 -16.165 -10.599 8.445
572 HB2 PRO 82 1HB PRO 82 -18.710 -10.743 7.512
573 HB3 PRO 82 2HB PRO 82 -17.821 -9.221 7.647
574 HG2 PRO 82 1HG PRO 82 -18.274 -10.944 5.241
575 HG3 PRO 82 2HG PRO 82 -18.358 -9.178 5.384
576 HD2 PRO 82 1HD PRO 82 -16.206 -10.456 4.350
577 HD3 PRO 82 2HD PRO 82 -16.070 -8.934 5.254
578 H GLY 83 H GLY 83 -16.324 -12.769 5.748
579 HA2 GLY 83 1HA GLY 83 -16.405 -15.060 7.427
580 HA3 GLY 83 2HA GLY 83 -17.976 -14.788 6.688
581 H GLY 84 H GLY 84 -14.588 -15.489 6.060
582 HA2 GLY 84 1HA GLY 84 -14.770 -17.402 4.212
583 HA3 GLY 84 2HA GLY 84 -15.114 -15.979 3.238
584 H GLY 85 H GLY 85 -12.775 -16.697 5.838
585 HA2 GLY 85 1HA GLY 85 -10.500 -16.409 5.932
586 HA3 GLY 85 2HA GLY 85 -10.500 -16.790 4.217
587 H SER 86 H SER 86 -8.826 -15.297 3.839
588 HA SER 86 HA SER 86 -9.735 -12.663 3.219
589 HB2 SER 86 1HB SER 86 -7.582 -12.844 5.335
590 HB3 SER 86 2HB SER 86 -8.332 -11.382 4.694
591 HG SER 86 HG SER 86 -9.081 -12.484 6.816
592 H SER 87 H SER 87 -7.902 -11.307 2.334
593 HA SER 87 HA SER 87 -5.695 -12.941 1.304
594 HB2 SER 87 1HB SER 87 -7.795 -11.534 -0.291
595 HB3 SER 87 2HB SER 87 -6.147 -11.569 -0.918
596 HG SER 87 HG SER 87 -7.937 -13.454 -1.122
597 H THR 88 H THR 88 -3.940 -11.641 0.378
598 HA THR 88 HA THR 88 -3.845 -8.922 1.511
599 HB THR 88 HB THR 88 -1.482 -10.796 1.346
600 HG1 THR 88 1HG THR 88 -2.705 -10.063 3.774
601 HG21 THR 88 3HG2 THR 88 -1.846 -7.984 2.019
602 HG22 THR 88 1HG2 THR 88 -0.370 -8.873 1.643
603 HG23 THR 88 2HG2 THR 88 -1.016 -8.890 3.284
604 H LEU 89 H LEU 89 -4.181 -7.780 -0.346
605 HA LEU 89 HA LEU 89 -2.709 -8.429 -2.759
606 HB2 LEU 89 1HB LEU 89 -4.815 -6.422 -2.048
607 HB3 LEU 89 2HB LEU 89 -3.905 -6.278 -3.551
608 HG LEU 89 HG LEU 89 -5.348 -8.819 -2.898
609 HD11 LEU 89 1HD1 LEU 89 -7.078 -7.533 -4.540
610 HD12 LEU 89 2HD1 LEU 89 -6.540 -6.209 -3.508
611 HD13 LEU 89 3HD1 LEU 89 -7.259 -7.650 -2.790
612 HD21 LEU 89 3HD2 LEU 89 -4.756 -7.446 -5.515
613 HD22 LEU 89 1HD2 LEU 89 -5.384 -9.077 -5.283
614 HD23 LEU 89 2HD2 LEU 89 -3.737 -8.688 -4.786
615 H THR 90 H THR 90 -0.593 -7.936 -2.592
616 HA THR 90 HA THR 90 0.191 -5.346 -1.478
617 HB THR 90 HB THR 90 1.710 -6.757 -0.561
618 HG1 THR 90 1HG THR 90 2.952 -5.434 -1.978
619 HG21 THR 90 3HG2 THR 90 0.789 -8.815 -1.326
620 HG22 THR 90 1HG2 THR 90 2.508 -8.855 -1.712
621 HG23 THR 90 2HG2 THR 90 1.328 -8.517 -2.979
622 H GLY 91 H GLY 91 1.764 -4.019 -2.618
623 HA2 GLY 91 1HA GLY 91 2.096 -4.464 -5.466
624 HA3 GLY 91 2HA GLY 91 1.067 -3.103 -5.044
625 H ARG 92 H ARG 92 4.044 -3.781 -6.035
626 HA ARG 92 HA ARG 92 5.565 -2.101 -4.243
627 HB2 ARG 92 1HB ARG 92 6.249 -3.468 -6.847
628 HB3 ARG 92 2HB ARG 92 7.386 -2.464 -5.958
629 HG2 ARG 92 1HG ARG 92 7.029 -3.995 -3.992
630 HG3 ARG 92 2HG ARG 92 6.147 -5.059 -5.089
631 HD2 ARG 92 1HD ARG 92 8.119 -5.257 -6.504
632 HD3 ARG 92 2HD ARG 92 9.001 -4.151 -5.451
633 HE ARG 92 HE ARG 92 8.086 -6.267 -3.886
634 HH11 ARG 92 1HH1 ARG 92 10.297 -5.715 -6.518
635 HH12 ARG 92 2HH1 ARG 92 11.349 -7.019 -6.079
636 HH21 ARG 92 1HH2 ARG 92 9.464 -7.987 -3.298
637 HH22 ARG 92 2HH2 ARG 92 10.874 -8.312 -4.248
638 H VAL 93 H VAL 93 5.761 0.030 -4.390
639 HA VAL 93 HA VAL 93 5.263 1.323 -6.989
640 HB VAL 93 HB VAL 93 3.291 1.682 -5.622
641 HG11 VAL 93 1HG1 VAL 93 4.487 3.345 -3.571
642 HG12 VAL 93 2HG1 VAL 93 3.331 2.019 -3.419
643 HG13 VAL 93 3HG1 VAL 93 5.061 1.679 -3.490
644 HG21 VAL 93 3HG2 VAL 93 3.946 4.343 -5.230
645 HG22 VAL 93 1HG2 VAL 93 5.039 3.818 -6.511
646 HG23 VAL 93 2HG2 VAL 93 3.296 3.631 -6.707
647 H THR 94 H THR 94 7.101 2.224 -7.625
648 HA THR 94 HA THR 94 9.140 3.000 -5.734
649 HB THR 94 HB THR 94 9.053 3.246 -8.747
650 HG1 THR 94 1HG THR 94 10.329 1.406 -8.693
651 HG21 THR 94 3HG2 THR 94 10.549 4.913 -7.748
652 HG22 THR 94 1HG2 THR 94 11.457 3.670 -8.607
653 HG23 THR 94 2HG2 THR 94 11.367 3.638 -6.846
654 H THR 95 H THR 95 8.895 4.851 -4.659
655 HA THR 95 HA THR 95 7.289 7.004 -5.367
656 HB THR 95 HB THR 95 8.918 8.324 -3.811
657 HG1 THR 95 1HG THR 95 10.605 7.213 -3.209
658 HG21 THR 95 3HG2 THR 95 7.583 7.744 -2.056
659 HG22 THR 95 1HG2 THR 95 7.734 6.016 -2.369
660 HG23 THR 95 2HG2 THR 95 6.649 6.999 -3.352
661 H LYS 96 H LYS 96 7.762 9.089 -6.171
662 HA LYS 96 HA LYS 96 9.547 9.109 -8.387
663 HB2 LYS 96 1HB LYS 96 8.200 11.508 -7.147
664 HB3 LYS 96 2HB LYS 96 8.751 11.326 -8.808
665 HG2 LYS 96 1HG LYS 96 7.046 9.353 -8.858
666 HG3 LYS 96 2HG LYS 96 6.337 10.192 -7.476
667 HD2 LYS 96 1HD LYS 96 5.678 11.985 -8.730
668 HD3 LYS 96 2HD LYS 96 6.999 11.800 -9.886
669 HE2 LYS 96 1HE LYS 96 5.900 10.058 -11.021
670 HE3 LYS 96 2HE LYS 96 4.754 9.812 -9.704
671 HZ1 LYS 96 3HZ LYS 96 4.324 11.303 -11.942
672 HZ2 LYS 96 1HZ LYS 96 4.654 12.469 -10.762
673 HZ3 LYS 96 2HZ LYS 96 3.403 11.356 -10.525
674 H LYS 97 H LYS 97 11.176 10.850 -8.733
675 HA LYS 97 HA LYS 97 13.079 10.819 -6.594
676 HB2 LYS 97 1HB LYS 97 13.023 11.861 -9.392
677 HB3 LYS 97 2HB LYS 97 14.256 12.469 -8.295
678 HG2 LYS 97 1HG LYS 97 14.882 10.075 -7.845
679 HG3 LYS 97 2HG LYS 97 13.813 9.631 -9.177
680 HD2 LYS 97 1HD LYS 97 15.143 11.239 -10.608
681 HD3 LYS 97 2HD LYS 97 16.303 11.322 -9.279
682 HE2 LYS 97 1HE LYS 97 15.482 8.639 -10.261
683 HE3 LYS 97 2HE LYS 97 16.568 9.593 -11.270
684 HZ1 LYS 97 3HZ LYS 97 17.715 9.848 -8.868
685 HZ2 LYS 97 1HZ LYS 97 18.138 8.659 -9.995
686 HZ3 LYS 97 2HZ LYS 97 17.071 8.289 -8.736
687 H ALA 98 H ALA 98 13.562 12.367 -5.147
688 HA ALA 98 HA ALA 98 11.749 14.503 -4.708
689 HB1 ALA 98 3HB ALA 98 13.690 13.184 -3.217
690 HB2 ALA 98 1HB ALA 98 14.264 14.848 -3.331
691 HB3 ALA 98 2HB ALA 98 12.660 14.511 -2.679
692 HA PRO 99 HA PRO 99 13.481 17.653 -7.256
693 HB2 PRO 99 1HB PRO 99 12.481 19.824 -5.970
694 HB3 PRO 99 2HB PRO 99 11.488 18.761 -6.974
695 HG2 PRO 99 1HG PRO 99 11.790 18.816 -3.996
696 HG3 PRO 99 2HG PRO 99 10.319 18.634 -4.968
697 HD2 PRO 99 1HD PRO 99 11.569 16.530 -3.809
698 HD3 PRO 99 2HD PRO 99 10.697 16.392 -5.349
699 H SER 100 H SER 100 15.138 19.177 -7.293
700 HA SER 100 HA SER 100 17.072 18.952 -5.205
701 HB2 SER 100 1HB SER 100 18.389 20.550 -6.596
702 HB3 SER 100 2HB SER 100 17.813 19.153 -7.506
703 HG SER 100 HG SER 100 17.102 21.827 -7.706
704 HA PRO 101 HA PRO 101 16.010 22.367 -2.655
705 HB2 PRO 101 1HB PRO 101 18.464 23.062 -1.724
706 HB3 PRO 101 2HB PRO 101 17.614 21.604 -1.197
707 HG2 PRO 101 1HG PRO 101 19.790 21.897 -3.231
708 HG3 PRO 101 2HG PRO 101 19.592 20.661 -1.976
709 HD2 PRO 101 1HD PRO 101 18.935 20.225 -4.566
710 HD3 PRO 101 2HD PRO 101 18.065 19.463 -3.219
711 H SER 102 H SER 102 18.836 22.907 -4.754
712 HA SER 102 HA SER 102 18.981 25.651 -4.682
713 HB2 SER 102 1HB SER 102 19.401 23.886 -7.107
714 HB3 SER 102 2HB SER 102 20.011 25.529 -6.913
715 HG SER 102 HG SER 102 21.594 24.776 -5.762
716 H SER 103 H SER 103 17.377 27.060 -4.899
717 HA SER 103 HA SER 103 15.032 26.508 -6.448
718 HB2 SER 103 1HB SER 103 14.906 27.840 -4.390
719 HB3 SER 103 2HB SER 103 15.935 29.074 -5.116
720 HG SER 103 HG SER 103 13.294 28.348 -5.806
721 H GLY 104 H GLY 104 14.510 27.156 -8.461
722 HA2 GLY 104 1HA GLY 104 16.057 29.234 -9.787
723 HA3 GLY 104 2HA GLY 104 16.211 27.619 -10.465
724 HA PRO 105 HA PRO 105 11.585 28.936 -11.057
725 HB2 PRO 105 1HB PRO 105 11.016 31.548 -10.585
726 HB3 PRO 105 2HB PRO 105 10.893 30.299 -9.341
727 HG2 PRO 105 1HG PRO 105 13.095 32.265 -9.841
728 HG3 PRO 105 2HG PRO 105 12.371 31.763 -8.302
729 HD2 PRO 105 1HD PRO 105 14.733 30.781 -9.191
730 HD3 PRO 105 2HD PRO 105 13.608 29.820 -8.211
731 H SER 106 H SER 106 10.518 30.107 -12.814
732 HA SER 106 HA SER 106 12.464 31.342 -14.651
733 HB2 SER 106 1HB SER 106 11.672 29.118 -15.402
734 HB3 SER 106 2HB SER 106 10.013 29.715 -15.373
735 HG SER 106 HG SER 106 10.426 30.287 -17.352
736 H SER 107 H SER 107 11.615 32.939 -16.139
737 HA SER 107 HA SER 107 9.730 34.693 -14.822
738 HB2 SER 107 1HB SER 107 11.359 35.006 -17.352
739 HB3 SER 107 2HB SER 107 10.303 36.257 -16.697
740 HG SER 107 HG SER 107 12.700 36.154 -16.112
741 H GLY 108 H GLY 108 9.982 33.137 -18.020
742 HA2 GLY 108 1HA GLY 108 7.270 32.429 -18.159
743 HA3 GLY 108 2HA GLY 108 7.473 33.973 -18.974
Start of MODEL 14
1 H1 GLY 1 H GLY 1 1.402 -21.211 11.088
2 HA2 GLY 1 1HA GLY 1 3.514 -20.654 9.143
3 HA3 GLY 1 2HA GLY 1 2.912 -22.242 9.594
4 H SER 2 H SER 2 3.069 -22.359 7.141
5 HA SER 2 HA SER 2 0.414 -22.210 6.086
6 HB2 SER 2 1HB SER 2 0.861 -20.710 4.220
7 HB3 SER 2 2HB SER 2 1.171 -19.870 5.739
8 HG SER 2 HG SER 2 2.877 -19.466 4.366
9 H SER 3 H SER 3 0.114 -23.695 4.510
10 HA SER 3 HA SER 3 2.122 -24.605 2.739
11 HB2 SER 3 1HB SER 3 2.980 -25.644 4.829
12 HB3 SER 3 2HB SER 3 1.453 -26.511 4.995
13 HG SER 3 HG SER 3 1.942 -27.387 2.850
14 H GLY 4 H GLY 4 1.342 -26.138 1.229
15 HA2 GLY 4 1HA GLY 4 -0.254 -27.394 0.112
16 HA3 GLY 4 2HA GLY 4 -1.296 -27.260 1.520
17 H SER 5 H SER 5 -0.844 -26.312 -1.650
18 HA SER 5 HA SER 5 -2.467 -23.887 -1.355
19 HB2 SER 5 1HB SER 5 -0.775 -24.960 -3.609
20 HB3 SER 5 2HB SER 5 -1.916 -23.637 -3.848
21 HG SER 5 HG SER 5 -0.677 -22.336 -2.698
22 H SER 6 H SER 6 -4.511 -24.707 -1.037
23 HA SER 6 HA SER 6 -5.584 -26.681 -2.876
24 HB2 SER 6 1HB SER 6 -6.907 -25.221 -0.576
25 HB3 SER 6 2HB SER 6 -7.606 -26.567 -1.477
26 HG SER 6 HG SER 6 -6.363 -27.923 -0.429
27 H GLY 7 H GLY 7 -6.126 -23.278 -2.032
28 HA2 GLY 7 1HA GLY 7 -6.978 -22.684 -4.709
29 HA3 GLY 7 2HA GLY 7 -8.307 -22.655 -3.559
30 H LEU 8 H LEU 8 -4.987 -21.403 -3.898
31 HA LEU 8 HA LEU 8 -5.949 -18.866 -2.748
32 HB2 LEU 8 1HB LEU 8 -3.477 -20.440 -2.255
33 HB3 LEU 8 2HB LEU 8 -3.357 -18.681 -2.222
34 HG LEU 8 HG LEU 8 -5.141 -18.669 -0.473
35 HD11 LEU 8 1HD1 LEU 8 -6.191 -20.788 -0.918
36 HD12 LEU 8 2HD1 LEU 8 -5.547 -20.795 0.723
37 HD13 LEU 8 3HD1 LEU 8 -4.693 -21.648 -0.562
38 HD21 LEU 8 3HD2 LEU 8 -2.391 -19.549 -0.236
39 HD22 LEU 8 1HD2 LEU 8 -3.390 -20.133 1.095
40 HD23 LEU 8 2HD2 LEU 8 -3.301 -18.405 0.752
41 H ALA 9 H ALA 9 -5.688 -17.095 -3.952
42 HA ALA 9 HA ALA 9 -3.531 -16.661 -5.730
43 HB1 ALA 9 3HB ALA 9 -5.568 -18.256 -6.809
44 HB2 ALA 9 1HB ALA 9 -5.773 -16.655 -7.522
45 HB3 ALA 9 2HB ALA 9 -4.228 -17.494 -7.666
46 HA PRO 10 HA PRO 10 -4.895 -12.504 -5.413
47 HB2 PRO 10 1HB PRO 10 -4.211 -11.456 -7.822
48 HB3 PRO 10 2HB PRO 10 -3.020 -11.888 -6.589
49 HG2 PRO 10 1HG PRO 10 -3.879 -13.421 -9.014
50 HG3 PRO 10 2HG PRO 10 -2.246 -13.170 -8.368
51 HD2 PRO 10 1HD PRO 10 -3.638 -15.457 -7.962
52 HD3 PRO 10 2HD PRO 10 -2.489 -14.814 -6.771
53 HA PRO 11 HA PRO 11 -9.018 -12.680 -7.153
54 HB2 PRO 11 1HB PRO 11 -9.971 -10.544 -5.774
55 HB3 PRO 11 2HB PRO 11 -9.772 -12.144 -5.050
56 HG2 PRO 11 1HG PRO 11 -7.983 -9.749 -4.877
57 HG3 PRO 11 2HG PRO 11 -8.472 -10.875 -3.597
58 HD2 PRO 11 1HD PRO 11 -6.069 -11.030 -4.834
59 HD3 PRO 11 2HD PRO 11 -6.926 -12.463 -4.230
60 H ARG 12 H ARG 12 -7.209 -9.634 -6.819
61 HA ARG 12 HA ARG 12 -7.914 -8.942 -9.559
62 HB2 ARG 12 1HB ARG 12 -8.674 -7.316 -7.146
63 HB3 ARG 12 2HB ARG 12 -8.428 -6.557 -8.713
64 HG2 ARG 12 1HG ARG 12 -10.340 -8.836 -8.290
65 HG3 ARG 12 2HG ARG 12 -10.804 -7.142 -8.116
66 HD2 ARG 12 1HD ARG 12 -10.243 -6.694 -10.406
67 HD3 ARG 12 2HD ARG 12 -9.563 -8.309 -10.602
68 HE ARG 12 HE ARG 12 -11.669 -9.075 -11.013
69 HH11 ARG 12 1HH1 ARG 12 -11.907 -6.063 -9.284
70 HH12 ARG 12 2HH1 ARG 12 -13.634 -5.986 -9.394
71 HH21 ARG 12 1HH2 ARG 12 -13.943 -8.985 -11.165
72 HH22 ARG 12 2HH2 ARG 12 -14.791 -7.649 -10.463
73 H HIS 13 H HIS 13 -6.861 -6.573 -9.924
74 HA HIS 13 HA HIS 13 -4.059 -6.905 -9.108
75 HB2 HIS 13 1HB HIS 13 -4.878 -6.777 -11.592
76 HB3 HIS 13 2HB HIS 13 -4.942 -5.044 -11.287
77 HD1 HIS 13 1HD HIS 13 -2.351 -7.761 -10.608
78 HD2 HIS 13 2HD HIS 13 -2.652 -3.903 -12.121
79 HE1 HIS 13 1HE HIS 13 -0.010 -7.107 -11.250
80 HE2 HIS 13 2HE HIS 13 -0.204 -4.738 -12.083
81 H LEU 14 H LEU 14 -2.799 -4.969 -8.652
82 HA LEU 14 HA LEU 14 -4.373 -3.053 -7.105
83 HB2 LEU 14 1HB LEU 14 -1.564 -4.014 -7.055
84 HB3 LEU 14 2HB LEU 14 -1.879 -2.374 -6.492
85 HG LEU 14 HG LEU 14 -3.236 -4.825 -5.378
86 HD11 LEU 14 1HD1 LEU 14 -1.309 -3.457 -3.678
87 HD12 LEU 14 2HD1 LEU 14 -0.574 -4.212 -5.092
88 HD13 LEU 14 3HD1 LEU 14 -1.538 -5.180 -3.976
89 HD21 LEU 14 3HD2 LEU 14 -3.060 -1.973 -4.410
90 HD22 LEU 14 1HD2 LEU 14 -3.810 -3.308 -3.535
91 HD23 LEU 14 2HD2 LEU 14 -4.490 -2.769 -5.071
92 H GLY 15 H GLY 15 -3.162 -0.785 -7.024
93 HA2 GLY 15 1HA GLY 15 -2.112 0.086 -9.567
94 HA3 GLY 15 2HA GLY 15 -3.752 0.638 -9.257
95 H PHE 16 H PHE 16 -0.936 1.905 -9.380
96 HA PHE 16 HA PHE 16 -1.142 3.375 -6.835
97 HB2 PHE 16 1HB PHE 16 1.283 2.842 -8.560
98 HB3 PHE 16 2HB PHE 16 1.277 3.927 -7.173
99 HD1 PHE 16 1HD PHE 16 0.459 2.875 -4.929
100 HD2 PHE 16 2HD PHE 16 1.870 0.637 -8.263
101 HE1 PHE 16 1HE PHE 16 0.953 0.978 -3.442
102 HE2 PHE 16 2HE PHE 16 2.365 -1.264 -6.782
103 HZ PHE 16 HZ PHE 16 1.907 -1.095 -4.368
104 H SER 17 H SER 17 -1.746 5.426 -6.974
105 HA SER 17 HA SER 17 -1.182 6.912 -9.447
106 HB2 SER 17 1HB SER 17 -3.812 6.433 -8.135
107 HB3 SER 17 2HB SER 17 -3.522 8.037 -8.807
108 HG SER 17 HG SER 17 -3.867 7.215 -10.696
109 H ASP 18 H ASP 18 -1.191 9.243 -9.186
110 HA ASP 18 HA ASP 18 -0.362 11.107 -8.167
111 HB2 ASP 18 1HB ASP 18 -2.742 10.648 -7.100
112 HB3 ASP 18 2HB ASP 18 -1.786 10.385 -5.644
113 H VAL 19 H VAL 19 1.337 8.877 -8.011
114 HA VAL 19 HA VAL 19 2.345 8.513 -5.368
115 HB VAL 19 HB VAL 19 3.731 7.969 -7.997
116 HG11 VAL 19 1HG1 VAL 19 4.762 6.156 -6.363
117 HG12 VAL 19 2HG1 VAL 19 5.446 7.776 -6.505
118 HG13 VAL 19 3HG1 VAL 19 4.377 7.385 -5.158
119 HG21 VAL 19 3HG2 VAL 19 1.564 6.596 -6.587
120 HG22 VAL 19 1HG2 VAL 19 2.084 6.473 -8.268
121 HG23 VAL 19 2HG2 VAL 19 2.919 5.553 -7.017
122 H SER 20 H SER 20 3.674 9.765 -4.237
123 HA SER 20 HA SER 20 5.170 11.864 -5.669
124 HB2 SER 20 1HB SER 20 3.234 12.439 -3.969
125 HB3 SER 20 2HB SER 20 4.488 12.134 -2.767
126 HG SER 20 HG SER 20 4.132 14.290 -4.336
127 H HIS 21 H HIS 21 6.972 12.727 -4.019
128 HA HIS 21 HA HIS 21 8.728 10.457 -3.629
129 HB2 HIS 21 1HB HIS 21 10.322 12.393 -2.902
130 HB3 HIS 21 2HB HIS 21 9.890 12.217 -4.600
131 HD1 HIS 21 1HD HIS 21 8.427 14.050 -5.646
132 HD2 HIS 21 2HD HIS 21 9.242 14.651 -1.617
133 HE1 HIS 21 1HE HIS 21 7.714 16.413 -5.161
134 HE2 HIS 21 2HE HIS 21 8.296 16.781 -2.738
135 H ASP 22 H ASP 22 6.451 11.990 -1.780
136 HA ASP 22 HA ASP 22 7.716 11.033 0.692
137 HB2 ASP 22 1HB ASP 22 6.707 12.994 1.888
138 HB3 ASP 22 2HB ASP 22 8.000 13.417 0.769
139 H ALA 23 H ALA 23 5.430 10.341 -1.326
140 HA ALA 23 HA ALA 23 3.779 9.016 0.541
141 HB1 ALA 23 3HB ALA 23 1.656 10.258 0.015
142 HB2 ALA 23 1HB ALA 23 2.801 11.118 1.045
143 HB3 ALA 23 2HB ALA 23 2.662 11.538 -0.663
144 H ALA 24 H ALA 24 1.830 8.019 -0.562
145 HA ALA 24 HA ALA 24 1.763 7.942 -3.417
146 HB1 ALA 24 3HB ALA 24 3.107 6.240 -3.891
147 HB2 ALA 24 1HB ALA 24 3.679 6.294 -2.223
148 HB3 ALA 24 2HB ALA 24 2.345 5.227 -2.665
149 H ARG 25 H ARG 25 -0.257 7.473 -3.993
150 HA ARG 25 HA ARG 25 -2.065 6.364 -1.997
151 HB2 ARG 25 1HB ARG 25 -2.610 8.437 -3.333
152 HB3 ARG 25 2HB ARG 25 -2.753 7.401 -4.747
153 HG2 ARG 25 1HG ARG 25 -4.569 6.181 -3.706
154 HG3 ARG 25 2HG ARG 25 -4.399 7.148 -2.239
155 HD2 ARG 25 1HD ARG 25 -5.162 8.165 -4.974
156 HD3 ARG 25 2HD ARG 25 -6.246 7.959 -3.599
157 HE ARG 25 HE ARG 25 -4.171 9.637 -2.799
158 HH11 ARG 25 1HH1 ARG 25 -6.825 9.639 -5.052
159 HH12 ARG 25 2HH1 ARG 25 -7.037 11.358 -5.001
160 HH21 ARG 25 1HH2 ARG 25 -4.440 11.901 -2.724
161 HH22 ARG 25 2HH2 ARG 25 -5.680 12.644 -3.677
162 H VAL 26 H VAL 26 -2.974 4.392 -2.098
163 HA VAL 26 HA VAL 26 -2.412 2.753 -4.485
164 HB VAL 26 HB VAL 26 -1.098 1.924 -2.643
165 HG11 VAL 26 1HG1 VAL 26 -3.118 1.009 -0.843
166 HG12 VAL 26 2HG1 VAL 26 -1.757 2.089 -0.530
167 HG13 VAL 26 3HG1 VAL 26 -3.298 2.747 -1.082
168 HG21 VAL 26 3HG2 VAL 26 -2.786 0.408 -4.141
169 HG22 VAL 26 1HG2 VAL 26 -1.552 -0.237 -3.060
170 HG23 VAL 26 2HG2 VAL 26 -3.222 -0.098 -2.509
171 H PHE 27 H PHE 27 -4.139 2.038 -5.536
172 HA PHE 27 HA PHE 27 -6.676 1.771 -4.066
173 HB2 PHE 27 1HB PHE 27 -7.888 2.604 -5.984
174 HB3 PHE 27 2HB PHE 27 -6.653 3.778 -5.543
175 HD1 PHE 27 2HD PHE 27 -7.304 0.950 -7.864
176 HD2 PHE 27 1HD PHE 27 -5.172 4.562 -7.140
177 HE1 PHE 27 2HE PHE 27 -6.438 0.895 -10.166
178 HE2 PHE 27 1HE PHE 27 -4.303 4.514 -9.442
179 HZ PHE 27 HZ PHE 27 -4.935 2.679 -10.958
180 H TRP 28 H TRP 28 -7.863 -0.036 -4.442
181 HA TRP 28 HA TRP 28 -6.715 -1.989 -6.327
182 HB2 TRP 28 1HB TRP 28 -7.976 -3.658 -4.791
183 HB3 TRP 28 2HB TRP 28 -6.463 -2.960 -4.220
184 HD1 TRP 28 HD TRP 28 -10.035 -3.372 -3.266
185 HE1 TRP 28 1HE TRP 28 -10.536 -2.057 -1.110
186 HE3 TRP 28 3HE TRP 28 -5.756 -0.588 -3.001
187 HZ2 TRP 28 2HZ TRP 28 -9.282 -0.099 0.490
188 HZ3 TRP 28 3HZ TRP 28 -5.485 0.983 -1.127
189 HH2 TRP 28 HH TRP 28 -7.212 1.221 0.581
190 H GLU 29 H GLU 29 -8.358 -3.640 -7.097
191 HA GLU 29 HA GLU 29 -10.663 -2.184 -8.120
192 HB2 GLU 29 1HB GLU 29 -9.582 -4.921 -8.813
193 HB3 GLU 29 2HB GLU 29 -10.936 -4.139 -9.616
194 HG2 GLU 29 1HG GLU 29 -8.057 -3.279 -9.618
195 HG3 GLU 29 2HG GLU 29 -9.014 -3.857 -10.981
196 H GLY 30 H GLY 30 -10.290 -3.457 -5.317
197 HA2 GLY 30 1HA GLY 30 -11.767 -4.271 -3.750
198 HA3 GLY 30 2HA GLY 30 -13.026 -4.172 -4.973
199 H ALA 31 H ALA 31 -13.264 -6.230 -3.352
200 HA ALA 31 HA ALA 31 -12.140 -8.528 -4.816
201 HB1 ALA 31 3HB ALA 31 -12.441 -7.983 -1.963
202 HB2 ALA 31 1HB ALA 31 -13.039 -9.569 -2.450
203 HB3 ALA 31 2HB ALA 31 -11.372 -9.111 -2.797
204 HA PRO 32 HA PRO 32 -16.146 -9.919 -5.939
205 HB2 PRO 32 1HB PRO 32 -15.964 -12.605 -5.592
206 HB3 PRO 32 2HB PRO 32 -15.143 -11.748 -6.902
207 HG2 PRO 32 1HG PRO 32 -14.050 -12.693 -4.281
208 HG3 PRO 32 2HG PRO 32 -13.323 -12.787 -5.896
209 HD2 PRO 32 1HD PRO 32 -12.622 -10.895 -4.089
210 HD3 PRO 32 2HD PRO 32 -12.610 -10.595 -5.839
211 H ARG 33 H ARG 33 -15.035 -10.292 -2.753
212 HA ARG 33 HA ARG 33 -17.752 -10.984 -1.845
213 HB2 ARG 33 1HB ARG 33 -16.554 -11.858 0.241
214 HB3 ARG 33 2HB ARG 33 -16.441 -12.831 -1.220
215 HG2 ARG 33 1HG ARG 33 -14.216 -11.965 -1.654
216 HG3 ARG 33 2HG ARG 33 -14.329 -10.926 -0.231
217 HD2 ARG 33 1HD ARG 33 -13.182 -12.689 0.662
218 HD3 ARG 33 2HD ARG 33 -14.836 -13.216 0.973
219 HE ARG 33 HE ARG 33 -14.039 -14.182 -1.535
220 HH11 ARG 33 1HH1 ARG 33 -13.336 -14.632 1.845
221 HH12 ARG 33 2HH1 ARG 33 -12.861 -16.287 1.660
222 HH21 ARG 33 1HH2 ARG 33 -13.415 -16.360 -1.792
223 HH22 ARG 33 2HH2 ARG 33 -12.905 -17.269 -0.410
224 HA PRO 34 HA PRO 34 -17.861 -7.231 0.427
225 HB2 PRO 34 1HB PRO 34 -19.288 -7.962 2.617
226 HB3 PRO 34 2HB PRO 34 -20.012 -7.781 1.015
227 HG2 PRO 34 1HG PRO 34 -19.130 -10.270 2.424
228 HG3 PRO 34 2HG PRO 34 -20.603 -9.981 1.480
229 HD2 PRO 34 1HD PRO 34 -18.457 -11.285 0.468
230 HD3 PRO 34 2HD PRO 34 -19.522 -10.278 -0.533
231 H VAL 35 H VAL 35 -16.705 -6.124 1.935
232 HA VAL 35 HA VAL 35 -15.115 -7.713 3.844
233 HB VAL 35 HB VAL 35 -14.297 -5.186 2.404
234 HG11 VAL 35 1HG1 VAL 35 -13.168 -4.890 4.354
235 HG12 VAL 35 2HG1 VAL 35 -13.186 -6.609 4.755
236 HG13 VAL 35 3HG1 VAL 35 -12.041 -5.992 3.563
237 HG21 VAL 35 3HG2 VAL 35 -12.581 -7.519 2.157
238 HG22 VAL 35 1HG2 VAL 35 -14.203 -7.801 1.526
239 HG23 VAL 35 2HG2 VAL 35 -13.238 -6.461 0.908
240 H ARG 36 H ARG 36 -14.904 -6.959 5.921
241 HA ARG 36 HA ARG 36 -16.787 -4.855 6.688
242 HB2 ARG 36 1HB ARG 36 -16.523 -5.733 8.971
243 HB3 ARG 36 2HB ARG 36 -17.016 -6.987 7.842
244 HG2 ARG 36 1HG ARG 36 -15.008 -8.083 7.963
245 HG3 ARG 36 2HG ARG 36 -14.118 -6.626 8.410
246 HD2 ARG 36 1HD ARG 36 -16.051 -8.123 10.176
247 HD3 ARG 36 2HD ARG 36 -14.293 -8.202 10.280
248 HE ARG 36 HE ARG 36 -15.068 -5.523 10.487
249 HH11 ARG 36 1HH1 ARG 36 -15.310 -8.500 12.277
250 HH12 ARG 36 2HH1 ARG 36 -15.367 -7.718 13.822
251 HH21 ARG 36 1HH2 ARG 36 -15.143 -4.482 12.515
252 HH22 ARG 36 2HH2 ARG 36 -15.273 -5.433 13.956
253 H LEU 37 H LEU 37 -13.398 -5.558 6.547
254 HA LEU 37 HA LEU 37 -12.769 -2.829 7.248
255 HB2 LEU 37 1HB LEU 37 -12.856 -3.941 9.437
256 HB3 LEU 37 2HB LEU 37 -11.660 -5.109 8.881
257 HG LEU 37 HG LEU 37 -10.000 -3.318 8.695
258 HD11 LEU 37 1HD1 LEU 37 -10.487 -1.095 9.590
259 HD12 LEU 37 2HD1 LEU 37 -12.174 -1.556 9.818
260 HD13 LEU 37 3HD1 LEU 37 -11.497 -1.467 8.192
261 HD21 LEU 37 3HD2 LEU 37 -9.871 -4.415 10.740
262 HD22 LEU 37 1HD2 LEU 37 -11.408 -3.758 11.303
263 HD23 LEU 37 2HD2 LEU 37 -9.987 -2.717 11.203
264 H VAL 38 H VAL 38 -10.647 -2.210 6.645
265 HA VAL 38 HA VAL 38 -9.200 -4.197 5.018
266 HB VAL 38 HB VAL 38 -9.605 -1.280 4.338
267 HG11 VAL 38 1HG1 VAL 38 -7.582 -1.621 3.377
268 HG12 VAL 38 2HG1 VAL 38 -7.786 -3.372 3.306
269 HG13 VAL 38 3HG1 VAL 38 -8.575 -2.341 2.111
270 HG21 VAL 38 3HG2 VAL 38 -10.607 -2.592 2.239
271 HG22 VAL 38 1HG2 VAL 38 -10.949 -3.780 3.497
272 HG23 VAL 38 2HG2 VAL 38 -11.586 -2.141 3.635
273 H ARG 39 H ARG 39 -7.233 -4.538 5.791
274 HA ARG 39 HA ARG 39 -5.879 -2.348 7.221
275 HB2 ARG 39 1HB ARG 39 -6.511 -4.585 8.407
276 HB3 ARG 39 2HB ARG 39 -5.126 -5.232 7.539
277 HG2 ARG 39 1HG ARG 39 -4.796 -2.739 9.133
278 HG3 ARG 39 2HG ARG 39 -4.870 -4.294 9.963
279 HD2 ARG 39 1HD ARG 39 -3.070 -4.046 7.611
280 HD3 ARG 39 2HD ARG 39 -2.582 -3.260 9.112
281 HE ARG 39 HE ARG 39 -2.391 -5.360 10.129
282 HH11 ARG 39 1HH1 ARG 39 -3.439 -5.598 6.818
283 HH12 ARG 39 2HH1 ARG 39 -3.085 -7.289 6.690
284 HH21 ARG 39 1HH2 ARG 39 -1.921 -7.587 9.974
285 HH22 ARG 39 2HH2 ARG 39 -2.222 -8.420 8.487
286 H VAL 40 H VAL 40 -4.333 -1.435 6.051
287 HA VAL 40 HA VAL 40 -2.892 -3.062 4.072
288 HB VAL 40 HB VAL 40 -2.910 -0.051 4.256
289 HG11 VAL 40 1HG1 VAL 40 -2.462 -0.642 1.672
290 HG12 VAL 40 2HG1 VAL 40 -1.174 -0.436 2.861
291 HG13 VAL 40 3HG1 VAL 40 -1.733 -2.054 2.437
292 HG21 VAL 40 3HG2 VAL 40 -5.052 -1.750 3.518
293 HG22 VAL 40 1HG2 VAL 40 -4.954 0.007 3.394
294 HG23 VAL 40 2HG2 VAL 40 -4.431 -1.003 2.046
295 H THR 41 H THR 41 -0.626 -2.958 3.927
296 HA THR 41 HA THR 41 0.827 -1.609 6.068
297 HB THR 41 HB THR 41 2.163 -3.780 6.422
298 HG1 THR 41 1HG THR 41 0.527 -5.611 6.152
299 HG21 THR 41 3HG2 THR 41 0.279 -4.662 7.984
300 HG22 THR 41 1HG2 THR 41 -0.593 -3.224 7.456
301 HG23 THR 41 2HG2 THR 41 0.961 -3.062 8.274
302 H TYR 42 H TYR 42 2.329 -0.480 5.033
303 HA TYR 42 HA TYR 42 3.561 -1.627 2.623
304 HB2 TYR 42 1HB TYR 42 4.286 0.750 2.186
305 HB3 TYR 42 2HB TYR 42 2.548 0.480 2.138
306 HD1 TYR 42 2HD TYR 42 1.178 1.116 4.182
307 HD2 TYR 42 1HD TYR 42 5.217 2.342 3.642
308 HE1 TYR 42 2HE TYR 42 0.850 2.906 5.837
309 HE2 TYR 42 1HE TYR 42 4.900 4.135 5.296
310 HH TYR 42 HH TYR 42 3.464 5.176 6.631
311 H VAL 43 H VAL 43 5.843 -1.388 2.309
312 HA VAL 43 HA VAL 43 7.459 -0.700 4.632
313 HB VAL 43 HB VAL 43 6.946 -3.102 4.925
314 HG11 VAL 43 1HG1 VAL 43 8.293 -3.352 2.241
315 HG12 VAL 43 2HG1 VAL 43 8.010 -4.710 3.333
316 HG13 VAL 43 3HG1 VAL 43 6.645 -3.814 2.664
317 HG21 VAL 43 3HG2 VAL 43 9.266 -1.878 5.354
318 HG22 VAL 43 1HG2 VAL 43 9.040 -3.598 5.670
319 HG23 VAL 43 2HG2 VAL 43 9.818 -3.071 4.178
320 H SER 44 H SER 44 9.561 -0.128 4.134
321 HA SER 44 HA SER 44 10.034 0.767 1.486
322 HB2 SER 44 1HB SER 44 10.993 1.991 3.328
323 HB3 SER 44 2HB SER 44 11.862 0.563 3.888
324 HG SER 44 HG SER 44 12.641 2.390 2.108
325 H SER 45 H SER 45 12.207 -1.341 3.350
326 HA SER 45 HA SER 45 12.183 -3.478 1.499
327 HB2 SER 45 1HB SER 45 13.329 -1.914 0.025
328 HB3 SER 45 2HB SER 45 14.514 -1.557 1.282
329 HG SER 45 HG SER 45 15.270 -3.096 -0.257
330 H GLU 46 H GLU 46 14.008 -5.034 1.927
331 HA GLU 46 HA GLU 46 14.943 -6.424 3.484
332 HB2 GLU 46 1HB GLU 46 16.823 -5.481 4.665
333 HB3 GLU 46 2HB GLU 46 16.744 -4.768 3.060
334 HG2 GLU 46 1HG GLU 46 15.929 -2.724 3.895
335 HG3 GLU 46 2HG GLU 46 15.574 -3.423 5.473
336 H GLY 47 H GLY 47 12.347 -5.335 4.205
337 HA2 GLY 47 1HA GLY 47 10.938 -5.175 6.014
338 HA3 GLY 47 2HA GLY 47 12.040 -6.321 6.763
339 H GLY 48 H GLY 48 12.742 -2.993 5.788
340 HA2 GLY 48 1HA GLY 48 13.699 -2.452 8.484
341 HA3 GLY 48 2HA GLY 48 13.911 -1.423 7.075
342 H HIS 49 H HIS 49 12.633 0.309 6.857
343 HA HIS 49 HA HIS 49 10.757 0.909 8.955
344 HB2 HIS 49 1HB HIS 49 11.928 2.807 8.322
345 HB3 HIS 49 2HB HIS 49 11.882 2.392 6.611
346 HD1 HIS 49 1HD HIS 49 10.231 3.647 5.258
347 HD2 HIS 49 2HD HIS 49 9.252 3.652 9.296
348 HE1 HIS 49 1HE HIS 49 8.220 5.143 5.460
349 HE2 HIS 49 2HE HIS 49 7.698 5.199 7.924
350 H SER 50 H SER 50 8.722 0.250 8.943
351 HA SER 50 HA SER 50 7.256 0.220 6.398
352 HB2 SER 50 1HB SER 50 6.211 -1.900 6.939
353 HB3 SER 50 2HB SER 50 7.963 -2.101 6.983
354 HG SER 50 HG SER 50 6.189 -2.549 8.924
355 H GLY 51 H GLY 51 4.990 0.531 6.575
356 HA2 GLY 51 1HA GLY 51 4.204 1.778 9.134
357 HA3 GLY 51 2HA GLY 51 3.600 2.277 7.561
358 H GLN 52 H GLN 52 1.500 2.027 8.668
359 HA GLN 52 HA GLN 52 0.217 -0.348 7.868
360 HB2 GLN 52 1HB GLN 52 1.245 -1.404 9.757
361 HB3 GLN 52 2HB GLN 52 0.793 -0.076 10.818
362 HG2 GLN 52 1HG GLN 52 -1.614 -0.685 10.319
363 HG3 GLN 52 2HG GLN 52 -0.982 -2.162 9.594
364 HE21 GLN 52 1HE2 GLN 52 -2.718 -2.197 11.743
365 HE22 GLN 52 2HE2 GLN 52 -1.887 -2.797 13.133
366 H THR 53 H THR 53 -1.653 0.458 7.211
367 HA THR 53 HA THR 53 -3.023 2.420 8.933
368 HB THR 53 HB THR 53 -2.106 3.422 6.822
369 HG1 THR 53 1HG THR 53 -3.959 4.612 6.509
370 HG21 THR 53 3HG2 THR 53 -4.075 1.504 5.587
371 HG22 THR 53 1HG2 THR 53 -2.350 1.652 5.251
372 HG23 THR 53 2HG2 THR 53 -3.459 2.927 4.747
373 H GLU 54 H GLU 54 -5.434 2.582 8.237
374 HA GLU 54 HA GLU 54 -6.505 -0.055 7.537
375 HB2 GLU 54 1HB GLU 54 -6.852 1.399 10.103
376 HB3 GLU 54 2HB GLU 54 -8.276 0.614 9.436
377 HG2 GLU 54 1HG GLU 54 -5.770 -0.963 9.587
378 HG3 GLU 54 2HG GLU 54 -6.629 -0.624 11.089
379 H ALA 55 H ALA 55 -8.782 -0.005 6.931
380 HA ALA 55 HA ALA 55 -10.015 2.556 6.425
381 HB1 ALA 55 3HB ALA 55 -10.193 1.529 3.890
382 HB2 ALA 55 1HB ALA 55 -9.109 2.823 4.401
383 HB3 ALA 55 2HB ALA 55 -8.529 1.158 4.342
384 HA PRO 56 HA PRO 56 -13.704 0.202 6.767
385 HB2 PRO 56 1HB PRO 56 -15.403 1.625 5.200
386 HB3 PRO 56 2HB PRO 56 -14.842 2.198 6.776
387 HG2 PRO 56 1HG PRO 56 -13.863 2.918 4.040
388 HG3 PRO 56 2HG PRO 56 -14.163 3.972 5.434
389 HD2 PRO 56 1HD PRO 56 -11.680 3.138 4.746
390 HD3 PRO 56 2HD PRO 56 -12.154 3.436 6.430
391 H GLY 57 H GLY 57 -15.050 -1.291 5.703
392 HA2 GLY 57 1HA GLY 57 -13.944 -2.681 3.557
393 HA3 GLY 57 2HA GLY 57 -15.606 -2.843 4.107
394 H ASN 58 H ASN 58 -15.651 0.244 3.488
395 HA ASN 58 HA ASN 58 -16.674 -0.137 0.791
396 HB2 ASN 58 1HB ASN 58 -18.123 1.093 2.242
397 HB3 ASN 58 2HB ASN 58 -16.818 2.167 2.739
398 HD21 ASN 58 1HD2 ASN 58 -18.519 1.103 -0.184
399 HD22 ASN 58 2HD2 ASN 58 -18.542 2.655 -0.942
400 H ALA 59 H ALA 59 -13.999 1.357 2.436
401 HA ALA 59 HA ALA 59 -13.171 3.075 0.332
402 HB1 ALA 59 3HB ALA 59 -12.238 3.716 2.320
403 HB2 ALA 59 1HB ALA 59 -11.946 2.057 2.845
404 HB3 ALA 59 2HB ALA 59 -10.899 2.796 1.633
405 H THR 60 H THR 60 -12.458 2.459 -1.591
406 HA THR 60 HA THR 60 -11.251 -0.189 -1.905
407 HB THR 60 HB THR 60 -11.432 0.415 -4.399
408 HG1 THR 60 1HG THR 60 -11.958 2.733 -3.626
409 HG21 THR 60 3HG2 THR 60 -13.710 -0.130 -2.540
410 HG22 THR 60 1HG2 THR 60 -12.938 -1.200 -3.710
411 HG23 THR 60 2HG2 THR 60 -14.021 0.077 -4.263
412 H SER 61 H SER 61 -10.178 2.793 -1.202
413 HA SER 61 HA SER 61 -7.516 2.217 -2.147
414 HB2 SER 61 1HB SER 61 -8.544 4.911 -2.956
415 HB3 SER 61 2HB SER 61 -7.205 3.978 -3.624
416 HG SER 61 HG SER 61 -9.967 3.711 -4.082
417 H ALA 62 H ALA 62 -5.908 3.635 -1.221
418 HA ALA 62 HA ALA 62 -6.753 5.533 0.798
419 HB1 ALA 62 3HB ALA 62 -4.907 3.726 2.070
420 HB2 ALA 62 1HB ALA 62 -6.492 4.279 2.612
421 HB3 ALA 62 2HB ALA 62 -6.362 2.874 1.554
422 H MET 63 H MET 63 -4.939 6.704 1.747
423 HA MET 63 HA MET 63 -2.712 6.876 -0.150
424 HB2 MET 63 1HB MET 63 -3.806 8.804 1.894
425 HB3 MET 63 2HB MET 63 -2.282 9.074 1.061
426 HG2 MET 63 1HG MET 63 -3.788 8.669 -1.070
427 HG3 MET 63 2HG MET 63 -5.059 9.196 0.032
428 HE1 MET 63 3HE MET 63 -1.583 11.704 -1.602
429 HE2 MET 63 1HE MET 63 -1.241 10.306 -0.582
430 HE3 MET 63 2HE MET 63 -2.068 10.090 -2.125
431 H LEU 64 H LEU 64 -0.569 6.810 0.496
432 HA LEU 64 HA LEU 64 -0.104 5.846 3.242
433 HB2 LEU 64 1HB LEU 64 1.643 5.164 0.902
434 HB3 LEU 64 2HB LEU 64 1.550 4.372 2.474
435 HG LEU 64 HG LEU 64 -0.665 4.283 0.433
436 HD11 LEU 64 1HD1 LEU 64 0.330 2.615 -0.651
437 HD12 LEU 64 2HD1 LEU 64 0.818 1.826 0.848
438 HD13 LEU 64 3HD1 LEU 64 1.818 3.105 0.159
439 HD21 LEU 64 3HD2 LEU 64 -0.812 2.064 2.036
440 HD22 LEU 64 1HD2 LEU 64 -1.778 3.528 2.217
441 HD23 LEU 64 2HD2 LEU 64 -0.305 3.322 3.164
442 H GLY 65 H GLY 65 1.826 6.489 4.280
443 HA2 GLY 65 1HA GLY 65 4.009 7.768 3.665
444 HA3 GLY 65 2HA GLY 65 2.866 9.039 3.261
445 HA PRO 66 HA PRO 66 4.564 10.405 3.887
446 HB2 PRO 66 1HB PRO 66 6.772 11.086 5.314
447 HB3 PRO 66 2HB PRO 66 5.281 12.035 5.340
448 HG2 PRO 66 1HG PRO 66 6.278 10.019 7.315
449 HG3 PRO 66 2HG PRO 66 5.522 11.595 7.611
450 HD2 PRO 66 1HD PRO 66 4.155 9.265 7.802
451 HD3 PRO 66 2HD PRO 66 3.393 10.778 7.272
452 H LEU 67 H LEU 67 5.832 9.407 2.447
453 HA LEU 67 HA LEU 67 7.405 7.093 3.353
454 HB2 LEU 67 1HB LEU 67 6.592 7.681 0.522
455 HB3 LEU 67 2HB LEU 67 7.161 6.157 1.199
456 HG LEU 67 HG LEU 67 4.490 7.454 1.739
457 HD11 LEU 67 1HD1 LEU 67 5.446 5.488 -0.222
458 HD12 LEU 67 2HD1 LEU 67 4.037 6.547 -0.264
459 HD13 LEU 67 3HD1 LEU 67 3.978 5.036 0.643
460 HD21 LEU 67 3HD2 LEU 67 3.967 5.664 3.136
461 HD22 LEU 67 1HD2 LEU 67 5.614 6.087 3.602
462 HD23 LEU 67 2HD2 LEU 67 5.323 4.693 2.561
463 H SER 68 H SER 68 9.203 6.670 1.498
464 HA SER 68 HA SER 68 10.921 9.026 1.656
465 HB2 SER 68 1HB SER 68 11.423 6.101 1.175
466 HB3 SER 68 2HB SER 68 12.653 7.301 0.779
467 HG SER 68 HG SER 68 11.751 7.859 3.200
468 H SER 69 H SER 69 12.504 9.192 -0.299
469 HA SER 69 HA SER 69 10.849 9.233 -2.733
470 HB2 SER 69 1HB SER 69 13.337 10.875 -2.472
471 HB3 SER 69 2HB SER 69 11.862 11.212 -3.378
472 HG SER 69 HG SER 69 11.065 11.146 -0.935
473 H SER 70 H SER 70 11.624 8.410 -4.636
474 HA SER 70 HA SER 70 12.795 7.001 -5.986
475 HB2 SER 70 1HB SER 70 14.434 8.893 -5.797
476 HB3 SER 70 2HB SER 70 15.223 8.012 -4.489
477 HG SER 70 HG SER 70 16.243 6.951 -5.971
478 H THR 71 H THR 71 11.762 5.935 -3.532
479 HA THR 71 HA THR 71 13.623 3.682 -3.185
480 HB THR 71 HB THR 71 12.018 5.004 -0.989
481 HG1 THR 71 1HG THR 71 13.840 6.159 -1.107
482 HG21 THR 71 3HG2 THR 71 13.248 2.346 -1.224
483 HG22 THR 71 1HG2 THR 71 11.988 2.919 -0.132
484 HG23 THR 71 2HG2 THR 71 13.684 3.234 0.236
485 H THR 72 H THR 72 12.726 1.684 -3.226
486 HA THR 72 HA THR 72 10.047 1.433 -4.198
487 HB THR 72 HB THR 72 12.190 -0.561 -3.505
488 HG1 THR 72 1HG THR 72 12.559 0.029 -5.524
489 HG21 THR 72 3HG2 THR 72 10.502 -1.982 -2.988
490 HG22 THR 72 1HG2 THR 72 10.352 -2.095 -4.741
491 HG23 THR 72 2HG2 THR 72 9.289 -1.020 -3.832
492 H TYR 73 H TYR 73 8.230 0.801 -3.159
493 HA TYR 73 HA TYR 73 8.457 0.089 -0.311
494 HB2 TYR 73 1HB TYR 73 6.769 2.182 -1.615
495 HB3 TYR 73 2HB TYR 73 6.126 1.331 -0.215
496 HD1 TYR 73 1HD TYR 73 8.731 3.633 -1.402
497 HD2 TYR 73 2HD TYR 73 7.047 1.688 1.987
498 HE1 TYR 73 1HE TYR 73 9.985 5.143 0.080
499 HE2 TYR 73 2HE TYR 73 8.295 3.193 3.478
500 HH TYR 73 HH TYR 73 9.564 5.036 3.592
501 H THR 74 H THR 74 7.743 -1.910 -0.044
502 HA THR 74 HA THR 74 5.960 -3.148 -1.941
503 HB THR 74 HB THR 74 6.993 -4.269 0.670
504 HG1 THR 74 1HG THR 74 8.572 -3.594 -1.056
505 HG21 THR 74 3HG2 THR 74 6.433 -6.064 -1.576
506 HG22 THR 74 1HG2 THR 74 5.007 -5.249 -0.936
507 HG23 THR 74 2HG2 THR 74 6.019 -6.222 0.131
508 H VAL 75 H VAL 75 3.993 -2.079 -1.756
509 HA VAL 75 HA VAL 75 2.678 -1.871 0.813
510 HB VAL 75 HB VAL 75 1.649 -1.235 -1.956
511 HG11 VAL 75 1HG1 VAL 75 0.426 -1.119 0.737
512 HG12 VAL 75 2HG1 VAL 75 0.120 0.242 -0.343
513 HG13 VAL 75 3HG1 VAL 75 -0.319 -1.393 -0.838
514 HG21 VAL 75 3HG2 VAL 75 2.419 0.775 0.126
515 HG22 VAL 75 1HG2 VAL 75 3.633 0.082 -0.949
516 HG23 VAL 75 2HG2 VAL 75 2.270 0.978 -1.620
517 H ARG 76 H ARG 76 1.153 -3.193 1.615
518 HA ARG 76 HA ARG 76 0.055 -5.284 -0.137
519 HB2 ARG 76 1HB ARG 76 1.538 -5.581 2.422
520 HB3 ARG 76 2HB ARG 76 0.154 -6.636 2.170
521 HG2 ARG 76 1HG ARG 76 1.137 -7.729 0.397
522 HG3 ARG 76 2HG ARG 76 2.224 -6.386 0.038
523 HD2 ARG 76 1HD ARG 76 3.504 -8.179 0.992
524 HD3 ARG 76 2HD ARG 76 3.422 -6.859 2.159
525 HE ARG 76 HE ARG 76 1.366 -8.421 2.909
526 HH11 ARG 76 1HH1 ARG 76 4.707 -9.110 2.211
527 HH12 ARG 76 2HH1 ARG 76 4.798 -10.442 3.316
528 HH21 ARG 76 1HH2 ARG 76 1.474 -10.172 4.366
529 HH22 ARG 76 2HH2 ARG 76 2.959 -11.046 4.541
530 H VAL 77 H VAL 77 -2.055 -4.908 -0.257
531 HA VAL 77 HA VAL 77 -3.466 -3.708 1.995
532 HB VAL 77 HB VAL 77 -4.539 -4.410 -0.740
533 HG11 VAL 77 1HG1 VAL 77 -5.735 -2.255 0.874
534 HG12 VAL 77 2HG1 VAL 77 -6.504 -3.477 -0.141
535 HG13 VAL 77 3HG1 VAL 77 -5.969 -3.892 1.488
536 HG21 VAL 77 3HG2 VAL 77 -3.471 -2.642 -1.556
537 HG22 VAL 77 1HG2 VAL 77 -4.257 -1.610 -0.361
538 HG23 VAL 77 2HG2 VAL 77 -2.711 -2.372 0.012
539 H THR 78 H THR 78 -4.016 -5.139 3.524
540 HA THR 78 HA THR 78 -4.985 -7.788 2.746
541 HB THR 78 HB THR 78 -4.684 -6.928 5.599
542 HG1 THR 78 1HG THR 78 -2.646 -7.289 3.711
543 HG21 THR 78 3HG2 THR 78 -4.389 -9.201 6.029
544 HG22 THR 78 1HG2 THR 78 -3.917 -9.554 4.368
545 HG23 THR 78 2HG2 THR 78 -5.600 -9.191 4.748
546 H CYS 79 H CYS 79 -7.090 -7.765 2.231
547 HA CYS 79 HA CYS 79 -8.964 -6.010 3.533
548 HB2 CYS 79 1HB CYS 79 -9.438 -8.262 1.568
549 HB3 CYS 79 2HB CYS 79 -10.635 -7.075 2.071
550 HG CYS 79 HG CYS 79 -9.709 -5.005 0.684
551 H LEU 80 H LEU 80 -9.354 -6.489 5.621
552 HA LEU 80 HA LEU 80 -9.495 -9.156 6.623
553 HB2 LEU 80 1HB LEU 80 -10.135 -6.456 7.758
554 HB3 LEU 80 2HB LEU 80 -10.501 -7.931 8.651
555 HG LEU 80 HG LEU 80 -8.439 -7.080 9.474
556 HD11 LEU 80 1HD1 LEU 80 -8.644 -9.549 9.034
557 HD12 LEU 80 2HD1 LEU 80 -6.997 -8.931 9.161
558 HD13 LEU 80 3HD1 LEU 80 -7.684 -9.288 7.577
559 HD21 LEU 80 3HD2 LEU 80 -6.542 -6.559 8.095
560 HD22 LEU 80 1HD2 LEU 80 -7.936 -5.654 7.505
561 HD23 LEU 80 2HD2 LEU 80 -7.393 -7.096 6.646
562 H TYR 81 H TYR 81 -11.096 -10.479 6.061
563 HA TYR 81 HA TYR 81 -13.727 -9.479 5.414
564 HB2 TYR 81 1HB TYR 81 -12.766 -12.340 5.609
565 HB3 TYR 81 2HB TYR 81 -14.255 -11.786 4.851
566 HD1 TYR 81 2HD TYR 81 -13.463 -9.550 3.224
567 HD2 TYR 81 1HD TYR 81 -11.368 -13.177 3.973
568 HE1 TYR 81 2HE TYR 81 -12.283 -9.304 1.080
569 HE2 TYR 81 1HE TYR 81 -10.180 -12.940 1.832
570 HH TYR 81 HH TYR 81 -11.016 -11.374 -0.572
571 HA PRO 82 HA PRO 82 -15.585 -9.971 9.368
572 HB2 PRO 82 1HB PRO 82 -18.154 -10.427 8.617
573 HB3 PRO 82 2HB PRO 82 -17.387 -8.838 8.503
574 HG2 PRO 82 1HG PRO 82 -17.819 -10.891 6.367
575 HG3 PRO 82 2HG PRO 82 -18.040 -9.133 6.291
576 HD2 PRO 82 1HD PRO 82 -15.846 -10.370 5.297
577 HD3 PRO 82 2HD PRO 82 -15.790 -8.737 5.991
578 H GLY 83 H GLY 83 -15.678 -12.484 6.988
579 HA2 GLY 83 1HA GLY 83 -15.503 -14.531 8.952
580 HA3 GLY 83 2HA GLY 83 -17.118 -14.482 8.260
581 H GLY 84 H GLY 84 -13.752 -15.171 7.668
582 HA2 GLY 84 1HA GLY 84 -13.822 -17.256 6.070
583 HA3 GLY 84 2HA GLY 84 -14.332 -16.022 4.927
584 H GLY 85 H GLY 85 -11.885 -15.909 7.505
585 HA2 GLY 85 1HA GLY 85 -9.625 -15.503 7.422
586 HA3 GLY 85 2HA GLY 85 -9.654 -16.136 5.783
587 H SER 86 H SER 86 -8.148 -14.566 5.109
588 HA SER 86 HA SER 86 -9.367 -12.099 4.262
589 HB2 SER 86 1HB SER 86 -7.023 -12.026 6.177
590 HB3 SER 86 2HB SER 86 -7.655 -10.635 5.297
591 HG SER 86 HG SER 86 -9.717 -11.710 6.480
592 H SER 87 H SER 87 -8.119 -10.977 2.681
593 HA SER 87 HA SER 87 -6.131 -12.712 1.392
594 HB2 SER 87 1HB SER 87 -8.021 -10.616 0.357
595 HB3 SER 87 2HB SER 87 -6.605 -11.085 -0.584
596 HG SER 87 HG SER 87 -8.894 -12.295 -0.559
597 H THR 88 H THR 88 -4.590 -11.270 -0.068
598 HA THR 88 HA THR 88 -3.690 -8.869 1.295
599 HB THR 88 HB THR 88 -1.773 -11.179 0.960
600 HG1 THR 88 1HG THR 88 -1.951 -11.408 3.216
601 HG21 THR 88 3HG2 THR 88 -1.407 -8.398 1.383
602 HG22 THR 88 1HG2 THR 88 -0.186 -9.669 1.359
603 HG23 THR 88 2HG2 THR 88 -0.970 -9.229 2.876
604 H LEU 89 H LEU 89 -3.714 -7.557 -0.431
605 HA LEU 89 HA LEU 89 -2.691 -8.499 -2.995
606 HB2 LEU 89 1HB LEU 89 -4.351 -6.213 -2.079
607 HB3 LEU 89 2HB LEU 89 -3.396 -5.999 -3.544
608 HG LEU 89 HG LEU 89 -5.304 -8.298 -3.211
609 HD11 LEU 89 1HD1 LEU 89 -6.841 -6.618 -2.999
610 HD12 LEU 89 2HD1 LEU 89 -6.732 -6.723 -4.756
611 HD13 LEU 89 3HD1 LEU 89 -5.862 -5.455 -3.893
612 HD21 LEU 89 3HD2 LEU 89 -3.875 -8.696 -5.011
613 HD22 LEU 89 1HD2 LEU 89 -3.855 -7.000 -5.494
614 HD23 LEU 89 2HD2 LEU 89 -5.301 -7.974 -5.759
615 H THR 90 H THR 90 -0.531 -8.451 -3.110
616 HA THR 90 HA THR 90 1.029 -6.418 -1.793
617 HB THR 90 HB THR 90 2.900 -7.653 -2.306
618 HG1 THR 90 1HG THR 90 2.742 -9.177 -4.230
619 HG21 THR 90 3HG2 THR 90 0.922 -9.058 -1.277
620 HG22 THR 90 1HG2 THR 90 2.440 -9.832 -1.729
621 HG23 THR 90 2HG2 THR 90 1.044 -9.935 -2.802
622 H GLY 91 H GLY 91 2.334 -4.852 -2.787
623 HA2 GLY 91 1HA GLY 91 2.256 -4.462 -5.641
624 HA3 GLY 91 2HA GLY 91 1.283 -3.299 -4.754
625 H ARG 92 H ARG 92 4.260 -3.840 -6.071
626 HA ARG 92 HA ARG 92 5.757 -2.298 -4.103
627 HB2 ARG 92 1HB ARG 92 6.516 -3.757 -6.624
628 HB3 ARG 92 2HB ARG 92 7.635 -2.661 -5.823
629 HG2 ARG 92 1HG ARG 92 7.012 -4.134 -3.720
630 HG3 ARG 92 2HG ARG 92 6.646 -5.323 -4.972
631 HD2 ARG 92 1HD ARG 92 8.920 -4.920 -5.915
632 HD3 ARG 92 2HD ARG 92 9.261 -3.894 -4.522
633 HE ARG 92 HE ARG 92 9.446 -5.778 -3.204
634 HH11 ARG 92 1HH1 ARG 92 8.195 -6.627 -6.340
635 HH12 ARG 92 2HH1 ARG 92 8.390 -8.332 -6.101
636 HH21 ARG 92 1HH2 ARG 92 9.707 -8.020 -2.877
637 HH22 ARG 92 2HH2 ARG 92 9.250 -9.123 -4.130
638 H VAL 93 H VAL 93 6.136 -0.182 -4.260
639 HA VAL 93 HA VAL 93 5.748 1.139 -6.860
640 HB VAL 93 HB VAL 93 3.737 1.634 -5.691
641 HG11 VAL 93 1HG1 VAL 93 3.786 2.682 -3.420
642 HG12 VAL 93 2HG1 VAL 93 4.306 0.997 -3.460
643 HG13 VAL 93 3HG1 VAL 93 5.502 2.287 -3.338
644 HG21 VAL 93 3HG2 VAL 93 3.741 3.906 -5.906
645 HG22 VAL 93 1HG2 VAL 93 5.252 4.099 -5.017
646 HG23 VAL 93 2HG2 VAL 93 5.278 3.545 -6.691
647 H THR 94 H THR 94 7.343 2.481 -7.414
648 HA THR 94 HA THR 94 9.465 2.984 -5.471
649 HB THR 94 HB THR 94 9.440 3.502 -8.451
650 HG1 THR 94 1HG THR 94 10.662 1.586 -8.550
651 HG21 THR 94 3HG2 THR 94 11.285 4.216 -6.333
652 HG22 THR 94 1HG2 THR 94 11.273 4.708 -8.026
653 HG23 THR 94 2HG2 THR 94 12.055 3.200 -7.551
654 H THR 95 H THR 95 8.870 4.697 -4.231
655 HA THR 95 HA THR 95 7.379 6.896 -4.852
656 HB THR 95 HB THR 95 8.820 8.150 -3.155
657 HG1 THR 95 1HG THR 95 10.656 7.245 -2.655
658 HG21 THR 95 3HG2 THR 95 8.087 5.639 -1.820
659 HG22 THR 95 1HG2 THR 95 6.820 6.327 -2.835
660 HG23 THR 95 2HG2 THR 95 7.521 7.284 -1.530
661 H LYS 96 H LYS 96 7.763 8.972 -5.631
662 HA LYS 96 HA LYS 96 9.599 9.179 -7.770
663 HB2 LYS 96 1HB LYS 96 8.146 11.433 -6.377
664 HB3 LYS 96 2HB LYS 96 8.811 11.456 -8.005
665 HG2 LYS 96 1HG LYS 96 7.174 9.394 -8.302
666 HG3 LYS 96 2HG LYS 96 6.326 10.207 -6.984
667 HD2 LYS 96 1HD LYS 96 5.821 12.043 -8.261
668 HD3 LYS 96 2HD LYS 96 7.226 11.836 -9.308
669 HE2 LYS 96 1HE LYS 96 6.081 9.761 -10.200
670 HE3 LYS 96 2HE LYS 96 4.638 10.300 -9.343
671 HZ1 LYS 96 3HZ LYS 96 5.951 11.471 -11.690
672 HZ2 LYS 96 1HZ LYS 96 5.117 12.497 -10.635
673 HZ3 LYS 96 2HZ LYS 96 4.305 11.221 -11.390
674 H LYS 97 H LYS 97 11.105 11.134 -7.952
675 HA LYS 97 HA LYS 97 13.032 10.939 -5.816
676 HB2 LYS 97 1HB LYS 97 12.972 12.096 -8.557
677 HB3 LYS 97 2HB LYS 97 14.134 12.769 -7.422
678 HG2 LYS 97 1HG LYS 97 15.367 10.850 -7.327
679 HG3 LYS 97 2HG LYS 97 13.988 9.814 -7.703
680 HD2 LYS 97 1HD LYS 97 15.234 9.713 -9.654
681 HD3 LYS 97 2HD LYS 97 14.066 10.986 -10.019
682 HE2 LYS 97 1HE LYS 97 15.691 12.688 -9.546
683 HE3 LYS 97 2HE LYS 97 16.843 11.490 -8.959
684 HZ1 LYS 97 3HZ LYS 97 16.320 12.340 -11.635
685 HZ2 LYS 97 1HZ LYS 97 16.227 10.657 -11.484
686 HZ3 LYS 97 2HZ LYS 97 17.635 11.471 -11.020
687 H ALA 98 H ALA 98 13.622 12.497 -4.373
688 HA ALA 98 HA ALA 98 11.702 14.497 -3.724
689 HB1 ALA 98 3HB ALA 98 12.758 13.671 -1.851
690 HB2 ALA 98 1HB ALA 98 14.348 13.675 -2.615
691 HB3 ALA 98 2HB ALA 98 13.615 15.193 -2.095
692 HA PRO 99 HA PRO 99 13.155 17.924 -6.063
693 HB2 PRO 99 1HB PRO 99 12.360 19.963 -4.456
694 HB3 PRO 99 2HB PRO 99 11.231 19.002 -5.418
695 HG2 PRO 99 1HG PRO 99 11.919 18.770 -2.514
696 HG3 PRO 99 2HG PRO 99 10.331 18.683 -3.298
697 HD2 PRO 99 1HD PRO 99 11.694 16.476 -2.518
698 HD3 PRO 99 2HD PRO 99 10.627 16.488 -3.938
699 H SER 100 H SER 100 15.273 18.314 -6.238
700 HA SER 100 HA SER 100 17.156 18.338 -4.213
701 HB2 SER 100 1HB SER 100 17.074 19.298 -7.017
702 HB3 SER 100 2HB SER 100 18.351 19.970 -6.003
703 HG SER 100 HG SER 100 18.593 17.564 -5.427
704 HA PRO 101 HA PRO 101 16.926 23.158 -4.051
705 HB2 PRO 101 1HB PRO 101 14.898 24.361 -5.397
706 HB3 PRO 101 2HB PRO 101 16.469 24.019 -6.132
707 HG2 PRO 101 1HG PRO 101 13.905 22.490 -6.346
708 HG3 PRO 101 2HG PRO 101 15.075 22.896 -7.615
709 HD2 PRO 101 1HD PRO 101 14.984 20.456 -6.444
710 HD3 PRO 101 2HD PRO 101 16.496 21.179 -7.029
711 H SER 102 H SER 102 16.302 23.188 -1.962
712 HA SER 102 HA SER 102 13.802 22.318 -0.996
713 HB2 SER 102 1HB SER 102 14.474 23.423 1.121
714 HB3 SER 102 2HB SER 102 15.759 22.416 0.454
715 HG SER 102 HG SER 102 16.254 24.679 1.209
716 H SER 103 H SER 103 15.088 25.617 -1.408
717 HA SER 103 HA SER 103 12.958 27.109 -0.590
718 HB2 SER 103 1HB SER 103 15.110 28.046 -1.394
719 HB3 SER 103 2HB SER 103 14.628 27.683 -3.051
720 HG SER 103 HG SER 103 13.118 29.330 -1.306
721 H GLY 104 H GLY 104 11.060 27.902 -1.481
722 HA2 GLY 104 1HA GLY 104 10.071 26.370 -3.802
723 HA3 GLY 104 2HA GLY 104 9.057 26.983 -2.504
724 HA PRO 105 HA PRO 105 10.354 30.709 -5.350
725 HB2 PRO 105 1HB PRO 105 11.129 30.000 -7.854
726 HB3 PRO 105 2HB PRO 105 12.268 30.209 -6.519
727 HG2 PRO 105 1HG PRO 105 11.090 27.690 -7.627
728 HG3 PRO 105 2HG PRO 105 12.761 28.021 -7.134
729 HD2 PRO 105 1HD PRO 105 11.018 26.670 -5.562
730 HD3 PRO 105 2HD PRO 105 12.296 27.709 -4.898
731 H SER 106 H SER 106 8.005 30.629 -5.094
732 HA SER 106 HA SER 106 6.372 29.403 -7.095
733 HB2 SER 106 1HB SER 106 4.514 30.555 -6.002
734 HB3 SER 106 2HB SER 106 5.565 29.819 -4.792
735 HG SER 106 HG SER 106 5.324 32.541 -5.504
736 H SER 107 H SER 107 4.843 30.647 -8.454
737 HA SER 107 HA SER 107 5.943 32.090 -10.414
738 HB2 SER 107 1HB SER 107 3.560 31.404 -10.358
739 HB3 SER 107 2HB SER 107 3.223 32.730 -9.246
740 HG SER 107 HG SER 107 4.336 33.983 -11.102
741 H GLY 108 H GLY 108 4.730 33.495 -7.387
742 HA2 GLY 108 1HA GLY 108 6.631 35.666 -7.624
743 HA3 GLY 108 2HA GLY 108 4.949 36.156 -7.762
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -2.343 -25.303 7.468
2 HA2 GLY 1 1HA GLY 1 -3.568 -27.744 6.792
3 HA3 GLY 1 2HA GLY 1 -4.122 -26.636 8.039
4 H SER 2 H SER 2 -4.748 -27.955 4.983
5 HA SER 2 HA SER 2 -7.256 -26.543 4.820
6 HB2 SER 2 1HB SER 2 -5.159 -26.194 2.667
7 HB3 SER 2 2HB SER 2 -6.859 -25.769 2.471
8 HG SER 2 HG SER 2 -4.947 -24.628 4.214
9 H SER 3 H SER 3 -8.628 -27.382 3.054
10 HA SER 3 HA SER 3 -7.826 -30.078 2.187
11 HB2 SER 3 1HB SER 3 -10.205 -30.791 2.578
12 HB3 SER 3 2HB SER 3 -9.313 -30.413 4.051
13 HG SER 3 HG SER 3 -11.585 -29.350 3.198
14 H GLY 4 H GLY 4 -7.729 -30.061 0.043
15 HA2 GLY 4 1HA GLY 4 -9.491 -30.033 -1.848
16 HA3 GLY 4 2HA GLY 4 -9.579 -28.324 -1.447
17 H SER 5 H SER 5 -8.705 -27.318 -3.151
18 HA SER 5 HA SER 5 -6.257 -28.374 -4.347
19 HB2 SER 5 1HB SER 5 -8.259 -27.615 -5.734
20 HB3 SER 5 2HB SER 5 -7.826 -25.968 -5.277
21 HG SER 5 HG SER 5 -6.875 -27.267 -7.284
22 H SER 6 H SER 6 -4.527 -26.811 -4.918
23 HA SER 6 HA SER 6 -4.184 -24.809 -2.781
24 HB2 SER 6 1HB SER 6 -2.039 -26.449 -4.150
25 HB3 SER 6 2HB SER 6 -1.771 -25.252 -2.883
26 HG SER 6 HG SER 6 -1.944 -27.588 -2.279
27 H GLY 7 H GLY 7 -5.174 -23.246 -4.203
28 HA2 GLY 7 1HA GLY 7 -3.208 -22.133 -6.082
29 HA3 GLY 7 2HA GLY 7 -4.850 -22.408 -6.644
30 H LEU 8 H LEU 8 -2.746 -20.304 -4.980
31 HA LEU 8 HA LEU 8 -4.876 -18.728 -3.792
32 HB2 LEU 8 1HB LEU 8 -1.904 -18.692 -3.739
33 HB3 LEU 8 2HB LEU 8 -2.757 -17.187 -3.402
34 HG LEU 8 HG LEU 8 -3.203 -19.753 -1.883
35 HD11 LEU 8 1HD1 LEU 8 -1.979 -18.089 -0.140
36 HD12 LEU 8 2HD1 LEU 8 -1.141 -17.674 -1.634
37 HD13 LEU 8 3HD1 LEU 8 -1.151 -19.343 -1.064
38 HD21 LEU 8 3HD2 LEU 8 -5.047 -18.605 -1.304
39 HD22 LEU 8 1HD2 LEU 8 -4.384 -17.062 -1.844
40 HD23 LEU 8 2HD2 LEU 8 -3.937 -17.709 -0.265
41 H ALA 9 H ALA 9 -5.069 -18.973 -6.587
42 HA ALA 9 HA ALA 9 -4.000 -17.144 -8.254
43 HB1 ALA 9 3HB ALA 9 -5.571 -18.153 -9.473
44 HB2 ALA 9 1HB ALA 9 -6.581 -18.467 -8.061
45 HB3 ALA 9 2HB ALA 9 -6.674 -16.909 -8.883
46 HA PRO 10 HA PRO 10 -4.708 -13.148 -6.516
47 HB2 PRO 10 1HB PRO 10 -4.219 -11.674 -8.743
48 HB3 PRO 10 2HB PRO 10 -2.938 -12.451 -7.804
49 HG2 PRO 10 1HG PRO 10 -4.251 -13.364 -10.335
50 HG3 PRO 10 2HG PRO 10 -2.533 -13.387 -9.894
51 HD2 PRO 10 1HD PRO 10 -4.104 -15.588 -9.753
52 HD3 PRO 10 2HD PRO 10 -2.754 -15.306 -8.636
53 HA PRO 11 HA PRO 11 -8.975 -12.439 -7.555
54 HB2 PRO 11 1HB PRO 11 -9.325 -10.266 -5.967
55 HB3 PRO 11 2HB PRO 11 -9.262 -11.916 -5.337
56 HG2 PRO 11 1HG PRO 11 -7.112 -9.834 -5.415
57 HG3 PRO 11 2HG PRO 11 -7.547 -10.944 -4.102
58 HD2 PRO 11 1HD PRO 11 -5.447 -11.390 -5.752
59 HD3 PRO 11 2HD PRO 11 -6.405 -12.709 -5.047
60 H ARG 12 H ARG 12 -6.830 -9.594 -7.308
61 HA ARG 12 HA ARG 12 -7.656 -8.738 -9.958
62 HB2 ARG 12 1HB ARG 12 -8.336 -7.270 -7.440
63 HB3 ARG 12 2HB ARG 12 -7.979 -6.357 -8.900
64 HG2 ARG 12 1HG ARG 12 -10.062 -8.521 -8.769
65 HG3 ARG 12 2HG ARG 12 -10.403 -6.814 -8.483
66 HD2 ARG 12 1HD ARG 12 -10.075 -6.239 -10.676
67 HD3 ARG 12 2HD ARG 12 -8.951 -7.566 -10.966
68 HE ARG 12 HE ARG 12 -11.315 -8.823 -10.554
69 HH11 ARG 12 1HH1 ARG 12 -10.296 -6.246 -12.662
70 HH12 ARG 12 2HH1 ARG 12 -11.435 -6.639 -13.907
71 HH21 ARG 12 1HH2 ARG 12 -12.819 -9.350 -12.186
72 HH22 ARG 12 2HH2 ARG 12 -12.870 -8.404 -13.635
73 H HIS 13 H HIS 13 -6.519 -6.433 -10.320
74 HA HIS 13 HA HIS 13 -3.709 -6.864 -9.575
75 HB2 HIS 13 1HB HIS 13 -4.894 -5.279 -11.864
76 HB3 HIS 13 2HB HIS 13 -3.172 -5.460 -11.539
77 HD1 HIS 13 1HD HIS 13 -6.037 -7.126 -13.142
78 HD2 HIS 13 2HD HIS 13 -2.170 -8.114 -11.989
79 HE1 HIS 13 1HE HIS 13 -5.509 -9.276 -14.334
80 HE2 HIS 13 2HE HIS 13 -3.197 -9.899 -13.554
81 H LEU 14 H LEU 14 -2.467 -5.227 -8.713
82 HA LEU 14 HA LEU 14 -3.961 -3.090 -7.424
83 HB2 LEU 14 1HB LEU 14 -1.302 -4.358 -7.059
84 HB3 LEU 14 2HB LEU 14 -1.490 -2.687 -6.532
85 HG LEU 14 HG LEU 14 -3.110 -5.039 -5.559
86 HD11 LEU 14 1HD1 LEU 14 -1.914 -4.793 -3.491
87 HD12 LEU 14 2HD1 LEU 14 -1.033 -3.401 -4.117
88 HD13 LEU 14 3HD1 LEU 14 -0.751 -5.002 -4.800
89 HD21 LEU 14 3HD2 LEU 14 -3.725 -3.235 -3.797
90 HD22 LEU 14 1HD2 LEU 14 -4.560 -3.250 -5.351
91 HD23 LEU 14 2HD2 LEU 14 -3.260 -2.094 -5.060
92 H GLY 15 H GLY 15 -3.014 -0.883 -7.358
93 HA2 GLY 15 1HA GLY 15 -1.213 -0.065 -9.427
94 HA3 GLY 15 2HA GLY 15 -2.883 0.304 -9.830
95 H PHE 16 H PHE 16 -0.375 1.904 -9.025
96 HA PHE 16 HA PHE 16 -1.593 3.435 -6.829
97 HB2 PHE 16 1HB PHE 16 1.271 3.528 -7.797
98 HB3 PHE 16 2HB PHE 16 0.618 4.317 -6.364
99 HD1 PHE 16 2HD PHE 16 1.352 1.025 -7.879
100 HD2 PHE 16 1HD PHE 16 0.463 3.179 -4.317
101 HE1 PHE 16 2HE PHE 16 1.895 -0.968 -6.542
102 HE2 PHE 16 1HE PHE 16 1.004 1.190 -2.974
103 HZ PHE 16 HZ PHE 16 1.720 -0.888 -4.087
104 H SER 17 H SER 17 -1.881 5.645 -7.003
105 HA SER 17 HA SER 17 -1.254 6.906 -9.572
106 HB2 SER 17 1HB SER 17 -3.537 6.165 -9.851
107 HB3 SER 17 2HB SER 17 -3.993 6.839 -8.287
108 HG SER 17 HG SER 17 -4.379 8.080 -10.385
109 H ASP 18 H ASP 18 -1.693 9.313 -9.475
110 HA ASP 18 HA ASP 18 -0.855 11.254 -8.562
111 HB2 ASP 18 1HB ASP 18 -2.722 10.525 -6.304
112 HB3 ASP 18 2HB ASP 18 -2.290 12.137 -6.868
113 H VAL 19 H VAL 19 0.593 8.778 -7.779
114 HA VAL 19 HA VAL 19 1.353 8.902 -5.066
115 HB VAL 19 HB VAL 19 1.766 7.002 -6.732
116 HG11 VAL 19 1HG1 VAL 19 4.114 7.120 -7.708
117 HG12 VAL 19 2HG1 VAL 19 2.867 8.073 -8.513
118 HG13 VAL 19 3HG1 VAL 19 4.021 8.859 -7.434
119 HG21 VAL 19 3HG2 VAL 19 4.268 6.899 -5.541
120 HG22 VAL 19 1HG2 VAL 19 3.313 7.914 -4.460
121 HG23 VAL 19 2HG2 VAL 19 2.757 6.290 -4.866
122 H SER 20 H SER 20 3.190 9.769 -4.076
123 HA SER 20 HA SER 20 4.643 11.809 -5.621
124 HB2 SER 20 1HB SER 20 3.351 12.094 -2.910
125 HB3 SER 20 2HB SER 20 4.637 13.172 -3.452
126 HG SER 20 HG SER 20 2.338 13.788 -3.870
127 H HIS 21 H HIS 21 6.579 12.625 -4.211
128 HA HIS 21 HA HIS 21 8.216 10.327 -3.704
129 HB2 HIS 21 1HB HIS 21 9.992 11.981 -3.240
130 HB3 HIS 21 2HB HIS 21 9.176 12.295 -4.769
131 HD1 HIS 21 1HD HIS 21 7.434 14.319 -4.747
132 HD2 HIS 21 2HD HIS 21 9.942 14.050 -1.446
133 HE1 HIS 21 1HE HIS 21 7.299 16.561 -3.615
134 HE2 HIS 21 2HE HIS 21 8.890 16.402 -1.670
135 H ASP 22 H ASP 22 6.109 12.175 -1.825
136 HA ASP 22 HA ASP 22 7.355 11.162 0.646
137 HB2 ASP 22 1HB ASP 22 6.831 13.109 1.804
138 HB3 ASP 22 2HB ASP 22 7.291 13.733 0.223
139 H ALA 23 H ALA 23 4.939 10.591 -1.397
140 HA ALA 23 HA ALA 23 3.363 9.220 0.573
141 HB1 ALA 23 3HB ALA 23 1.776 10.732 0.910
142 HB2 ALA 23 1HB ALA 23 2.572 11.849 -0.198
143 HB3 ALA 23 2HB ALA 23 1.391 10.691 -0.810
144 H ALA 24 H ALA 24 1.366 8.204 -0.559
145 HA ALA 24 HA ALA 24 1.569 7.809 -3.395
146 HB1 ALA 24 3HB ALA 24 2.513 5.670 -1.511
147 HB2 ALA 24 1HB ALA 24 1.914 5.296 -3.127
148 HB3 ALA 24 2HB ALA 24 3.328 6.331 -2.928
149 H ARG 25 H ARG 25 -0.390 7.353 -4.179
150 HA ARG 25 HA ARG 25 -2.486 6.588 -2.276
151 HB2 ARG 25 1HB ARG 25 -2.672 8.667 -3.747
152 HB3 ARG 25 2HB ARG 25 -2.892 7.564 -5.099
153 HG2 ARG 25 1HG ARG 25 -4.884 6.651 -4.070
154 HG3 ARG 25 2HG ARG 25 -4.644 7.675 -2.652
155 HD2 ARG 25 1HD ARG 25 -4.791 8.970 -5.326
156 HD3 ARG 25 2HD ARG 25 -6.284 8.367 -4.608
157 HE ARG 25 HE ARG 25 -5.027 9.850 -2.647
158 HH11 ARG 25 1HH1 ARG 25 -6.304 10.400 -5.839
159 HH12 ARG 25 2HH1 ARG 25 -6.711 12.056 -5.532
160 HH21 ARG 25 1HH2 ARG 25 -5.557 12.029 -2.232
161 HH22 ARG 25 2HH2 ARG 25 -6.285 12.982 -3.481
162 H VAL 26 H VAL 26 -2.666 4.434 -2.147
163 HA VAL 26 HA VAL 26 -2.368 2.791 -4.538
164 HB VAL 26 HB VAL 26 -1.236 1.956 -2.591
165 HG11 VAL 26 1HG1 VAL 26 -2.118 2.675 -0.646
166 HG12 VAL 26 2HG1 VAL 26 -3.772 2.639 -1.261
167 HG13 VAL 26 3HG1 VAL 26 -3.001 1.150 -0.715
168 HG21 VAL 26 3HG2 VAL 26 -3.689 0.241 -2.879
169 HG22 VAL 26 1HG2 VAL 26 -2.467 0.371 -4.144
170 HG23 VAL 26 2HG2 VAL 26 -2.030 -0.265 -2.558
171 H PHE 27 H PHE 27 -4.003 1.820 -5.583
172 HA PHE 27 HA PHE 27 -6.655 1.762 -4.335
173 HB2 PHE 27 1HB PHE 27 -7.718 2.605 -6.355
174 HB3 PHE 27 2HB PHE 27 -6.538 3.775 -5.771
175 HD1 PHE 27 1HD PHE 27 -4.377 4.036 -6.941
176 HD2 PHE 27 2HD PHE 27 -7.492 1.574 -8.475
177 HE1 PHE 27 1HE PHE 27 -3.296 4.051 -9.151
178 HE2 PHE 27 2HE PHE 27 -6.415 1.584 -10.687
179 HZ PHE 27 HZ PHE 27 -4.314 2.823 -11.028
180 H TRP 28 H TRP 28 -8.014 0.108 -5.046
181 HA TRP 28 HA TRP 28 -6.767 -1.877 -6.831
182 HB2 TRP 28 1HB TRP 28 -8.101 -3.561 -5.353
183 HB3 TRP 28 2HB TRP 28 -6.562 -2.932 -4.769
184 HD1 TRP 28 HD TRP 28 -10.230 -3.058 -3.932
185 HE1 TRP 28 1HE TRP 28 -10.642 -1.859 -1.691
186 HE3 TRP 28 3HE TRP 28 -5.646 -0.879 -3.322
187 HZ2 TRP 28 2HZ TRP 28 -9.213 -0.208 0.097
188 HZ3 TRP 28 3HZ TRP 28 -5.250 0.495 -1.319
189 HH2 TRP 28 HH TRP 28 -6.998 0.822 0.354
190 H GLU 29 H GLU 29 -8.475 -3.539 -7.571
191 HA GLU 29 HA GLU 29 -10.682 -2.015 -8.697
192 HB2 GLU 29 1HB GLU 29 -9.467 -4.699 -9.281
193 HB3 GLU 29 2HB GLU 29 -11.046 -4.272 -9.927
194 HG2 GLU 29 1HG GLU 29 -8.730 -2.436 -10.331
195 HG3 GLU 29 2HG GLU 29 -8.910 -3.870 -11.341
196 H GLY 30 H GLY 30 -10.458 -3.134 -5.829
197 HA2 GLY 30 1HA GLY 30 -12.133 -3.637 -4.301
198 HA3 GLY 30 2HA GLY 30 -13.246 -3.867 -5.641
199 H ALA 31 H ALA 31 -13.604 -5.624 -3.763
200 HA ALA 31 HA ALA 31 -12.151 -8.042 -4.623
201 HB1 ALA 31 3HB ALA 31 -11.554 -7.895 -2.412
202 HB2 ALA 31 1HB ALA 31 -13.083 -7.155 -1.935
203 HB3 ALA 31 2HB ALA 31 -13.012 -8.880 -2.294
204 HA PRO 32 HA PRO 32 -15.938 -9.813 -5.965
205 HB2 PRO 32 1HB PRO 32 -15.505 -12.439 -5.430
206 HB3 PRO 32 2HB PRO 32 -14.694 -11.580 -6.745
207 HG2 PRO 32 1HG PRO 32 -13.680 -12.244 -4.008
208 HG3 PRO 32 2HG PRO 32 -12.845 -12.357 -5.569
209 HD2 PRO 32 1HD PRO 32 -12.458 -10.296 -3.856
210 HD3 PRO 32 2HD PRO 32 -12.365 -10.103 -5.619
211 H ARG 33 H ARG 33 -15.086 -9.680 -2.732
212 HA ARG 33 HA ARG 33 -17.796 -10.441 -1.933
213 HB2 ARG 33 1HB ARG 33 -17.044 -11.750 -0.066
214 HB3 ARG 33 2HB ARG 33 -16.275 -12.378 -1.518
215 HG2 ARG 33 1HG ARG 33 -14.201 -11.337 -0.956
216 HG3 ARG 33 2HG ARG 33 -14.946 -10.467 0.387
217 HD2 ARG 33 1HD ARG 33 -13.700 -12.362 1.226
218 HD3 ARG 33 2HD ARG 33 -15.425 -12.617 1.485
219 HE ARG 33 HE ARG 33 -14.509 -13.777 -0.960
220 HH11 ARG 33 1HH1 ARG 33 -14.702 -14.251 2.484
221 HH12 ARG 33 2HH1 ARG 33 -14.646 -15.980 2.380
222 HH21 ARG 33 1HH2 ARG 33 -14.435 -16.052 -1.109
223 HH22 ARG 33 2HH2 ARG 33 -14.494 -17.003 0.336
224 HA PRO 34 HA PRO 34 -17.653 -6.763 0.461
225 HB2 PRO 34 1HB PRO 34 -19.352 -7.403 2.480
226 HB3 PRO 34 2HB PRO 34 -19.900 -7.069 0.833
227 HG2 PRO 34 1HG PRO 34 -19.452 -9.703 2.182
228 HG3 PRO 34 2HG PRO 34 -20.788 -9.197 1.131
229 HD2 PRO 34 1HD PRO 34 -18.727 -10.712 0.241
230 HD3 PRO 34 2HD PRO 34 -19.570 -9.542 -0.795
231 H VAL 35 H VAL 35 -16.589 -5.856 2.177
232 HA VAL 35 HA VAL 35 -15.464 -7.675 4.199
233 HB VAL 35 HB VAL 35 -13.622 -7.309 2.772
234 HG11 VAL 35 1HG1 VAL 35 -14.016 -5.645 1.286
235 HG12 VAL 35 2HG1 VAL 35 -14.782 -4.604 2.488
236 HG13 VAL 35 3HG1 VAL 35 -13.023 -4.725 2.415
237 HG21 VAL 35 3HG2 VAL 35 -12.061 -6.124 4.153
238 HG22 VAL 35 1HG2 VAL 35 -13.360 -5.207 4.916
239 HG23 VAL 35 2HG2 VAL 35 -13.216 -6.941 5.205
240 H ARG 36 H ARG 36 -14.849 -6.643 6.200
241 HA ARG 36 HA ARG 36 -16.613 -4.401 6.825
242 HB2 ARG 36 1HB ARG 36 -16.373 -5.016 9.118
243 HB3 ARG 36 2HB ARG 36 -16.614 -6.501 8.208
244 HG2 ARG 36 1HG ARG 36 -14.137 -6.825 8.236
245 HG3 ARG 36 2HG ARG 36 -14.033 -5.446 9.332
246 HD2 ARG 36 1HD ARG 36 -15.416 -6.592 10.955
247 HD3 ARG 36 2HD ARG 36 -15.644 -7.943 9.845
248 HE ARG 36 HE ARG 36 -13.588 -8.743 10.454
249 HH11 ARG 36 1HH1 ARG 36 -13.874 -5.430 11.484
250 HH12 ARG 36 2HH1 ARG 36 -12.401 -5.449 12.396
251 HH21 ARG 36 1HH2 ARG 36 -11.647 -8.781 11.652
252 HH22 ARG 36 2HH2 ARG 36 -11.135 -7.356 12.490
253 H LEU 37 H LEU 37 -13.206 -5.324 6.989
254 HA LEU 37 HA LEU 37 -12.484 -2.499 7.051
255 HB2 LEU 37 1HB LEU 37 -12.568 -3.687 9.404
256 HB3 LEU 37 2HB LEU 37 -11.000 -4.308 8.891
257 HG LEU 37 HG LEU 37 -11.497 -1.370 8.768
258 HD11 LEU 37 1HD1 LEU 37 -12.197 -1.566 10.944
259 HD12 LEU 37 2HD1 LEU 37 -10.453 -1.432 11.166
260 HD13 LEU 37 3HD1 LEU 37 -11.233 -3.013 11.241
261 HD21 LEU 37 3HD2 LEU 37 -9.326 -1.359 8.319
262 HD22 LEU 37 1HD2 LEU 37 -9.320 -3.122 8.378
263 HD23 LEU 37 2HD2 LEU 37 -8.981 -2.191 9.837
264 H VAL 38 H VAL 38 -10.193 -2.139 6.550
265 HA VAL 38 HA VAL 38 -8.884 -4.399 5.212
266 HB VAL 38 HB VAL 38 -9.225 -1.676 3.947
267 HG11 VAL 38 1HG1 VAL 38 -8.234 -2.855 1.957
268 HG12 VAL 38 2HG1 VAL 38 -7.123 -2.573 3.300
269 HG13 VAL 38 3HG1 VAL 38 -7.813 -4.177 3.045
270 HG21 VAL 38 3HG2 VAL 38 -10.468 -4.329 3.226
271 HG22 VAL 38 1HG2 VAL 38 -11.306 -2.933 3.903
272 HG23 VAL 38 2HG2 VAL 38 -10.607 -2.844 2.286
273 H ARG 39 H ARG 39 -6.890 -4.594 5.966
274 HA ARG 39 HA ARG 39 -5.571 -2.249 7.133
275 HB2 ARG 39 1HB ARG 39 -5.448 -5.173 7.617
276 HB3 ARG 39 2HB ARG 39 -3.947 -4.280 7.818
277 HG2 ARG 39 1HG ARG 39 -5.219 -2.726 9.346
278 HG3 ARG 39 2HG ARG 39 -6.535 -3.900 9.291
279 HD2 ARG 39 1HD ARG 39 -3.722 -4.368 10.270
280 HD3 ARG 39 2HD ARG 39 -5.186 -4.297 11.250
281 HE ARG 39 HE ARG 39 -5.417 -6.312 9.279
282 HH11 ARG 39 1HH1 ARG 39 -3.827 -5.599 12.293
283 HH12 ARG 39 2HH1 ARG 39 -3.698 -7.260 12.769
284 HH21 ARG 39 1HH2 ARG 39 -5.253 -8.503 9.894
285 HH22 ARG 39 2HH2 ARG 39 -4.509 -8.911 11.403
286 H VAL 40 H VAL 40 -3.637 -1.491 6.410
287 HA VAL 40 HA VAL 40 -2.389 -2.888 4.139
288 HB VAL 40 HB VAL 40 -2.853 0.091 4.345
289 HG11 VAL 40 1HG1 VAL 40 -1.141 -1.577 2.580
290 HG12 VAL 40 2HG1 VAL 40 -1.973 -0.194 1.867
291 HG13 VAL 40 3HG1 VAL 40 -0.867 0.043 3.220
292 HG21 VAL 40 3HG2 VAL 40 -4.186 -0.286 2.263
293 HG22 VAL 40 1HG2 VAL 40 -4.032 -2.020 2.547
294 HG23 VAL 40 2HG2 VAL 40 -4.882 -1.007 3.714
295 H THR 41 H THR 41 -0.319 -3.312 4.491
296 HA THR 41 HA THR 41 1.159 -1.623 6.403
297 HB THR 41 HB THR 41 2.605 -3.653 6.785
298 HG1 THR 41 1HG THR 41 2.041 -4.901 4.999
299 HG21 THR 41 3HG2 THR 41 1.057 -3.112 8.492
300 HG22 THR 41 1HG2 THR 41 0.847 -4.835 8.187
301 HG23 THR 41 2HG2 THR 41 -0.312 -3.677 7.535
302 H TYR 42 H TYR 42 2.585 -0.375 5.400
303 HA TYR 42 HA TYR 42 3.861 -1.369 2.944
304 HB2 TYR 42 1HB TYR 42 4.440 1.097 2.622
305 HB3 TYR 42 2HB TYR 42 2.744 0.656 2.456
306 HD1 TYR 42 1HD TYR 42 5.217 2.317 4.621
307 HD2 TYR 42 2HD TYR 42 1.095 1.472 3.993
308 HE1 TYR 42 1HE TYR 42 4.621 4.002 6.310
309 HE2 TYR 42 2HE TYR 42 0.487 3.156 5.680
310 HH TYR 42 HH TYR 42 2.226 4.228 7.916
311 H VAL 43 H VAL 43 6.068 -1.378 2.725
312 HA VAL 43 HA VAL 43 7.705 -0.409 4.947
313 HB VAL 43 HB VAL 43 7.171 -2.832 5.351
314 HG11 VAL 43 1HG1 VAL 43 7.958 -3.023 2.615
315 HG12 VAL 43 2HG1 VAL 43 9.044 -4.008 3.597
316 HG13 VAL 43 3HG1 VAL 43 7.301 -4.274 3.670
317 HG21 VAL 43 3HG2 VAL 43 9.134 -3.020 6.416
318 HG22 VAL 43 1HG2 VAL 43 10.060 -2.903 4.919
319 HG23 VAL 43 2HG2 VAL 43 9.499 -1.439 5.727
320 H SER 44 H SER 44 9.906 -0.070 4.416
321 HA SER 44 HA SER 44 10.380 0.939 1.860
322 HB2 SER 44 1HB SER 44 12.747 1.081 2.545
323 HB3 SER 44 2HB SER 44 11.668 1.649 3.820
324 HG SER 44 HG SER 44 12.365 -1.046 3.848
325 H SER 45 H SER 45 12.626 0.132 0.763
326 HA SER 45 HA SER 45 11.925 -2.315 -0.514
327 HB2 SER 45 1HB SER 45 13.827 -1.951 -1.910
328 HB3 SER 45 2HB SER 45 13.145 -0.359 -1.578
329 HG SER 45 HG SER 45 15.445 -0.455 -1.329
330 H GLU 46 H GLU 46 14.962 -1.471 1.159
331 HA GLU 46 HA GLU 46 15.572 -4.246 1.603
332 HB2 GLU 46 1HB GLU 46 17.579 -3.388 2.747
333 HB3 GLU 46 2HB GLU 46 17.373 -2.677 1.152
334 HG2 GLU 46 1HG GLU 46 16.346 -0.689 2.253
335 HG3 GLU 46 2HG GLU 46 16.789 -1.394 3.807
336 H GLY 47 H GLY 47 14.161 -1.632 3.427
337 HA2 GLY 47 1HA GLY 47 12.639 -2.473 5.229
338 HA3 GLY 47 2HA GLY 47 14.017 -3.412 5.782
339 H GLY 48 H GLY 48 12.801 -1.809 7.576
340 HA2 GLY 48 1HA GLY 48 14.253 -0.524 9.157
341 HA3 GLY 48 2HA GLY 48 14.622 0.510 7.785
342 H HIS 49 H HIS 49 12.344 1.144 6.646
343 HA HIS 49 HA HIS 49 10.737 2.329 8.813
344 HB2 HIS 49 1HB HIS 49 11.872 4.075 7.636
345 HB3 HIS 49 2HB HIS 49 11.429 3.394 6.073
346 HD1 HIS 49 1HD HIS 49 9.477 4.459 4.994
347 HD2 HIS 49 2HD HIS 49 9.436 4.976 9.116
348 HE1 HIS 49 1HE HIS 49 7.494 5.930 5.467
349 HE2 HIS 49 2HE HIS 49 7.539 6.299 7.958
350 H SER 50 H SER 50 8.656 1.795 8.920
351 HA SER 50 HA SER 50 7.181 1.057 6.533
352 HB2 SER 50 1HB SER 50 6.371 -1.076 7.594
353 HB3 SER 50 2HB SER 50 8.069 -1.101 7.119
354 HG SER 50 HG SER 50 7.084 -0.595 9.735
355 H GLY 51 H GLY 51 4.835 0.438 7.223
356 HA2 GLY 51 1HA GLY 51 3.960 1.732 9.673
357 HA3 GLY 51 2HA GLY 51 3.479 2.537 8.186
358 H GLN 52 H GLN 52 1.385 1.937 9.482
359 HA GLN 52 HA GLN 52 0.191 -0.261 8.036
360 HB2 GLN 52 1HB GLN 52 1.088 -1.405 10.008
361 HB3 GLN 52 2HB GLN 52 0.253 -0.269 11.059
362 HG2 GLN 52 1HG GLN 52 -1.842 -1.147 10.548
363 HG3 GLN 52 2HG GLN 52 -1.252 -1.951 9.094
364 HE21 GLN 52 1HE2 GLN 52 -1.346 -4.057 9.343
365 HE22 GLN 52 2HE2 GLN 52 -0.912 -4.939 10.763
366 H THR 53 H THR 53 -1.447 0.829 7.154
367 HA THR 53 HA THR 53 -3.000 2.664 8.849
368 HB THR 53 HB THR 53 -2.050 3.653 6.793
369 HG1 THR 53 1HG THR 53 -4.301 4.103 7.730
370 HG21 THR 53 3HG2 THR 53 -3.161 2.985 4.618
371 HG22 THR 53 1HG2 THR 53 -3.730 1.541 5.454
372 HG23 THR 53 2HG2 THR 53 -2.000 1.831 5.272
373 H GLU 54 H GLU 54 -5.282 2.593 8.814
374 HA GLU 54 HA GLU 54 -6.392 0.022 7.892
375 HB2 GLU 54 1HB GLU 54 -6.747 1.536 10.435
376 HB3 GLU 54 2HB GLU 54 -8.128 0.647 9.807
377 HG2 GLU 54 1HG GLU 54 -6.920 -1.414 9.882
378 HG3 GLU 54 2HG GLU 54 -5.426 -0.577 10.301
379 H ALA 55 H ALA 55 -8.216 0.047 6.692
380 HA ALA 55 HA ALA 55 -9.643 2.596 6.374
381 HB1 ALA 55 3HB ALA 55 -9.500 1.083 3.898
382 HB2 ALA 55 1HB ALA 55 -9.192 2.793 4.200
383 HB3 ALA 55 2HB ALA 55 -7.915 1.605 4.467
384 HA PRO 56 HA PRO 56 -13.356 0.274 6.646
385 HB2 PRO 56 1HB PRO 56 -14.976 1.564 4.890
386 HB3 PRO 56 2HB PRO 56 -14.497 2.258 6.443
387 HG2 PRO 56 1HG PRO 56 -13.380 2.773 3.714
388 HG3 PRO 56 2HG PRO 56 -13.753 3.928 5.007
389 HD2 PRO 56 1HD PRO 56 -11.237 3.058 4.511
390 HD3 PRO 56 2HD PRO 56 -11.797 3.481 6.142
391 H GLY 57 H GLY 57 -14.593 -1.340 5.659
392 HA2 GLY 57 1HA GLY 57 -13.359 -2.761 3.558
393 HA3 GLY 57 2HA GLY 57 -14.956 -3.088 4.216
394 H ASN 58 H ASN 58 -15.225 0.003 3.388
395 HA ASN 58 HA ASN 58 -16.265 -0.666 0.723
396 HB2 ASN 58 1HB ASN 58 -16.931 1.804 2.319
397 HB3 ASN 58 2HB ASN 58 -17.823 1.109 0.969
398 HD21 ASN 58 1HD2 ASN 58 -17.291 1.079 4.349
399 HD22 ASN 58 2HD2 ASN 58 -18.478 -0.110 4.753
400 H ALA 59 H ALA 59 -13.518 0.453 1.906
401 HA ALA 59 HA ALA 59 -13.212 2.757 0.141
402 HB1 ALA 59 3HB ALA 59 -11.919 3.456 1.805
403 HB2 ALA 59 1HB ALA 59 -11.979 1.875 2.585
404 HB3 ALA 59 2HB ALA 59 -10.756 2.208 1.358
405 H THR 60 H THR 60 -12.405 2.580 -1.838
406 HA THR 60 HA THR 60 -10.996 0.105 -2.567
407 HB THR 60 HB THR 60 -11.553 0.641 -4.897
408 HG1 THR 60 1HG THR 60 -12.468 3.004 -3.699
409 HG21 THR 60 3HG2 THR 60 -13.122 -0.716 -3.613
410 HG22 THR 60 1HG2 THR 60 -13.985 0.311 -4.756
411 HG23 THR 60 2HG2 THR 60 -13.939 0.740 -3.046
412 H SER 61 H SER 61 -10.027 2.811 -1.376
413 HA SER 61 HA SER 61 -7.514 2.813 -2.722
414 HB2 SER 61 1HB SER 61 -7.660 5.268 -3.384
415 HB3 SER 61 2HB SER 61 -8.562 4.140 -4.395
416 HG SER 61 HG SER 61 -10.345 4.718 -2.784
417 H ALA 62 H ALA 62 -5.924 3.745 -1.496
418 HA ALA 62 HA ALA 62 -6.675 5.407 0.784
419 HB1 ALA 62 3HB ALA 62 -5.896 4.023 2.439
420 HB2 ALA 62 1HB ALA 62 -6.583 2.843 1.323
421 HB3 ALA 62 2HB ALA 62 -4.842 3.126 1.347
422 H MET 63 H MET 63 -4.867 6.505 1.763
423 HA MET 63 HA MET 63 -2.669 6.885 -0.144
424 HB2 MET 63 1HB MET 63 -3.781 8.650 2.036
425 HB3 MET 63 2HB MET 63 -2.288 9.013 1.180
426 HG2 MET 63 1HG MET 63 -3.847 8.697 -0.930
427 HG3 MET 63 2HG MET 63 -5.096 9.124 0.238
428 HE1 MET 63 3HE MET 63 -2.661 10.916 -2.362
429 HE2 MET 63 1HE MET 63 -1.578 11.651 -1.179
430 HE3 MET 63 2HE MET 63 -1.762 9.898 -1.236
431 H LEU 64 H LEU 64 -0.502 7.108 0.628
432 HA LEU 64 HA LEU 64 -0.007 5.971 3.292
433 HB2 LEU 64 1HB LEU 64 1.611 5.230 0.870
434 HB3 LEU 64 2HB LEU 64 1.663 4.503 2.475
435 HG LEU 64 HG LEU 64 -0.719 4.309 0.639
436 HD11 LEU 64 1HD1 LEU 64 1.149 2.038 1.095
437 HD12 LEU 64 2HD1 LEU 64 1.569 3.259 -0.105
438 HD13 LEU 64 3HD1 LEU 64 0.063 2.355 -0.258
439 HD21 LEU 64 3HD2 LEU 64 -1.669 3.586 2.524
440 HD22 LEU 64 1HD2 LEU 64 -0.121 3.481 3.364
441 HD23 LEU 64 2HD2 LEU 64 -0.663 2.148 2.344
442 H GLY 65 H GLY 65 1.830 6.705 4.347
443 HA2 GLY 65 1HA GLY 65 4.062 7.923 3.604
444 HA3 GLY 65 2HA GLY 65 2.902 9.206 3.291
445 HA PRO 66 HA PRO 66 4.689 10.516 3.869
446 HB2 PRO 66 1HB PRO 66 6.976 11.103 5.210
447 HB3 PRO 66 2HB PRO 66 5.514 12.090 5.326
448 HG2 PRO 66 1HG PRO 66 6.544 10.000 7.206
449 HG3 PRO 66 2HG PRO 66 5.845 11.588 7.573
450 HD2 PRO 66 1HD PRO 66 4.426 9.290 7.771
451 HD3 PRO 66 2HD PRO 66 3.682 10.835 7.312
452 H LEU 67 H LEU 67 5.875 9.530 2.351
453 HA LEU 67 HA LEU 67 7.431 7.159 3.134
454 HB2 LEU 67 1HB LEU 67 6.505 7.796 0.351
455 HB3 LEU 67 2HB LEU 67 7.033 6.246 1.003
456 HG LEU 67 HG LEU 67 4.446 7.657 1.656
457 HD11 LEU 67 1HD1 LEU 67 5.193 5.464 -0.221
458 HD12 LEU 67 2HD1 LEU 67 4.083 6.815 -0.451
459 HD13 LEU 67 3HD1 LEU 67 3.609 5.445 0.554
460 HD21 LEU 67 3HD2 LEU 67 5.275 4.878 2.451
461 HD22 LEU 67 1HD2 LEU 67 3.884 5.809 3.009
462 HD23 LEU 67 2HD2 LEU 67 5.513 6.280 3.496
463 H SER 68 H SER 68 9.224 6.697 1.412
464 HA SER 68 HA SER 68 10.963 9.018 1.445
465 HB2 SER 68 1HB SER 68 11.887 6.874 2.149
466 HB3 SER 68 2HB SER 68 11.471 6.156 0.593
467 HG SER 68 HG SER 68 13.607 6.740 0.497
468 H SER 69 H SER 69 12.526 8.976 -0.635
469 HA SER 69 HA SER 69 10.726 9.307 -2.942
470 HB2 SER 69 1HB SER 69 12.439 10.921 -3.786
471 HB3 SER 69 2HB SER 69 11.702 11.414 -2.262
472 HG SER 69 HG SER 69 14.294 10.476 -2.771
473 H SER 70 H SER 70 11.437 8.666 -5.010
474 HA SER 70 HA SER 70 12.204 6.979 -6.370
475 HB2 SER 70 1HB SER 70 13.902 8.693 -6.682
476 HB3 SER 70 2HB SER 70 14.783 8.119 -5.267
477 HG SER 70 HG SER 70 14.379 6.767 -7.725
478 H THR 71 H THR 71 11.556 6.096 -3.681
479 HA THR 71 HA THR 71 13.426 3.828 -3.452
480 HB THR 71 HB THR 71 11.819 5.105 -1.230
481 HG1 THR 71 1HG THR 71 13.951 6.032 -2.195
482 HG21 THR 71 3HG2 THR 71 13.437 3.570 0.122
483 HG22 THR 71 1HG2 THR 71 13.529 2.654 -1.381
484 HG23 THR 71 2HG2 THR 71 11.974 2.886 -0.583
485 H THR 72 H THR 72 12.581 1.898 -3.856
486 HA THR 72 HA THR 72 9.798 1.588 -4.423
487 HB THR 72 HB THR 72 11.941 -0.533 -4.179
488 HG1 THR 72 1HG THR 72 12.470 -0.013 -6.171
489 HG21 THR 72 3HG2 THR 72 10.235 -1.621 -5.869
490 HG22 THR 72 1HG2 THR 72 9.084 -0.580 -5.032
491 HG23 THR 72 2HG2 THR 72 10.010 -1.778 -4.127
492 H TYR 73 H TYR 73 8.298 1.422 -2.898
493 HA TYR 73 HA TYR 73 8.983 0.077 -0.374
494 HB2 TYR 73 1HB TYR 73 7.179 2.331 -1.074
495 HB3 TYR 73 2HB TYR 73 6.647 1.256 0.214
496 HD1 TYR 73 1HD TYR 73 9.811 2.971 -0.821
497 HD2 TYR 73 2HD TYR 73 7.177 1.919 2.351
498 HE1 TYR 73 1HE TYR 73 11.255 4.171 0.768
499 HE2 TYR 73 2HE TYR 73 8.613 3.117 3.948
500 HH TYR 73 HH TYR 73 11.187 5.171 2.925
501 H THR 74 H THR 74 7.907 -1.702 0.277
502 HA THR 74 HA THR 74 6.133 -2.970 -1.638
503 HB THR 74 HB THR 74 7.053 -4.070 1.021
504 HG1 THR 74 1HG THR 74 8.680 -5.116 -0.294
505 HG21 THR 74 3HG2 THR 74 6.784 -6.183 -0.636
506 HG22 THR 74 1HG2 THR 74 5.540 -5.118 -1.288
507 HG23 THR 74 2HG2 THR 74 5.493 -5.594 0.410
508 H VAL 75 H VAL 75 4.034 -2.521 -1.575
509 HA VAL 75 HA VAL 75 2.777 -1.888 1.001
510 HB VAL 75 HB VAL 75 1.702 -1.472 -1.792
511 HG11 VAL 75 1HG1 VAL 75 -0.254 -1.385 -0.701
512 HG12 VAL 75 2HG1 VAL 75 0.522 -1.244 0.878
513 HG13 VAL 75 3HG1 VAL 75 0.310 0.186 -0.133
514 HG21 VAL 75 3HG2 VAL 75 3.051 0.394 0.146
515 HG22 VAL 75 1HG2 VAL 75 3.523 0.013 -1.511
516 HG23 VAL 75 2HG2 VAL 75 2.067 0.960 -1.204
517 H ARG 76 H ARG 76 1.449 -3.287 1.953
518 HA ARG 76 HA ARG 76 0.411 -5.532 0.350
519 HB2 ARG 76 1HB ARG 76 2.172 -5.856 2.313
520 HB3 ARG 76 2HB ARG 76 0.722 -5.781 3.304
521 HG2 ARG 76 1HG ARG 76 0.802 -8.018 2.955
522 HG3 ARG 76 2HG ARG 76 -0.130 -7.555 1.529
523 HD2 ARG 76 1HD ARG 76 1.638 -9.097 0.914
524 HD3 ARG 76 2HD ARG 76 1.940 -7.508 0.210
525 HE ARG 76 HE ARG 76 3.302 -7.565 2.613
526 HH11 ARG 76 1HH1 ARG 76 3.334 -9.334 -0.385
527 HH12 ARG 76 2HH1 ARG 76 5.020 -9.718 -0.291
528 HH21 ARG 76 1HH2 ARG 76 5.524 -8.063 2.748
529 HH22 ARG 76 2HH2 ARG 76 6.265 -8.995 1.491
530 H VAL 77 H VAL 77 -1.677 -5.178 -0.036
531 HA VAL 77 HA VAL 77 -3.322 -3.833 1.972
532 HB VAL 77 HB VAL 77 -3.961 -4.604 -0.879
533 HG11 VAL 77 1HG1 VAL 77 -5.968 -3.232 -0.603
534 HG12 VAL 77 2HG1 VAL 77 -5.961 -4.593 0.519
535 HG13 VAL 77 3HG1 VAL 77 -5.561 -2.974 1.093
536 HG21 VAL 77 3HG2 VAL 77 -2.294 -2.830 -0.717
537 HG22 VAL 77 1HG2 VAL 77 -3.826 -2.199 -1.319
538 HG23 VAL 77 2HG2 VAL 77 -3.354 -1.917 0.356
539 H THR 78 H THR 78 -3.890 -5.287 3.506
540 HA THR 78 HA THR 78 -5.005 -7.864 2.645
541 HB THR 78 HB THR 78 -4.320 -7.068 5.474
542 HG1 THR 78 1HG THR 78 -2.439 -6.985 4.145
543 HG21 THR 78 3HG2 THR 78 -4.014 -9.844 4.857
544 HG22 THR 78 1HG2 THR 78 -5.611 -9.310 4.337
545 HG23 THR 78 2HG2 THR 78 -5.106 -9.081 6.011
546 H CYS 79 H CYS 79 -7.137 -8.056 2.558
547 HA CYS 79 HA CYS 79 -8.801 -6.166 4.056
548 HB2 CYS 79 1HB CYS 79 -9.555 -8.040 1.803
549 HB3 CYS 79 2HB CYS 79 -10.610 -6.842 2.542
550 HG CYS 79 HG CYS 79 -9.961 -4.908 0.993
551 H LEU 80 H LEU 80 -9.486 -6.845 5.971
552 HA LEU 80 HA LEU 80 -9.713 -9.676 6.552
553 HB2 LEU 80 1HB LEU 80 -9.760 -7.157 8.129
554 HB3 LEU 80 2HB LEU 80 -10.553 -8.576 8.810
555 HG LEU 80 HG LEU 80 -8.371 -8.495 9.727
556 HD11 LEU 80 1HD1 LEU 80 -9.297 -10.657 8.344
557 HD12 LEU 80 2HD1 LEU 80 -7.901 -10.659 9.420
558 HD13 LEU 80 3HD1 LEU 80 -7.674 -10.463 7.682
559 HD21 LEU 80 3HD2 LEU 80 -6.484 -8.727 7.800
560 HD22 LEU 80 1HD2 LEU 80 -6.936 -7.206 8.571
561 HD23 LEU 80 2HD2 LEU 80 -7.633 -7.645 7.011
562 H TYR 81 H TYR 81 -11.488 -10.616 5.735
563 HA TYR 81 HA TYR 81 -13.993 -9.262 5.475
564 HB2 TYR 81 1HB TYR 81 -13.480 -12.235 5.294
565 HB3 TYR 81 2HB TYR 81 -14.834 -11.344 4.607
566 HD1 TYR 81 2HD TYR 81 -14.006 -9.318 3.008
567 HD2 TYR 81 1HD TYR 81 -11.841 -12.890 3.820
568 HE1 TYR 81 2HE TYR 81 -12.757 -9.031 0.909
569 HE2 TYR 81 1HE TYR 81 -10.585 -12.612 1.723
570 HH TYR 81 HH TYR 81 -11.484 -10.779 -0.729
571 HA PRO 82 HA PRO 82 -15.708 -10.007 9.457
572 HB2 PRO 82 1HB PRO 82 -18.346 -9.929 8.823
573 HB3 PRO 82 2HB PRO 82 -17.329 -8.485 8.879
574 HG2 PRO 82 1HG PRO 82 -18.191 -10.104 6.513
575 HG3 PRO 82 2HG PRO 82 -18.116 -8.341 6.696
576 HD2 PRO 82 1HD PRO 82 -16.206 -9.754 5.397
577 HD3 PRO 82 2HD PRO 82 -15.846 -8.271 6.304
578 H GLY 83 H GLY 83 -14.918 -12.205 9.626
579 HA2 GLY 83 1HA GLY 83 -15.417 -14.372 10.281
580 HA3 GLY 83 2HA GLY 83 -17.083 -14.102 9.793
581 H GLY 84 H GLY 84 -14.184 -15.641 9.035
582 HA2 GLY 84 1HA GLY 84 -14.770 -17.430 7.268
583 HA3 GLY 84 2HA GLY 84 -14.968 -16.028 6.226
584 H GLY 85 H GLY 85 -13.281 -15.630 4.970
585 HA2 GLY 85 1HA GLY 85 -10.624 -16.521 5.894
586 HA3 GLY 85 2HA GLY 85 -11.104 -16.383 4.209
587 H SER 86 H SER 86 -9.275 -15.083 3.784
588 HA SER 86 HA SER 86 -9.759 -12.291 4.049
589 HB2 SER 86 1HB SER 86 -7.925 -11.640 5.439
590 HB3 SER 86 2HB SER 86 -8.806 -12.890 6.319
591 HG SER 86 HG SER 86 -7.211 -14.379 5.355
592 H SER 87 H SER 87 -8.723 -11.171 2.480
593 HA SER 87 HA SER 87 -6.828 -12.688 0.818
594 HB2 SER 87 1HB SER 87 -8.991 -11.946 -0.232
595 HB3 SER 87 2HB SER 87 -8.463 -10.279 -0.003
596 HG SER 87 HG SER 87 -7.685 -10.665 -1.953
597 H THR 88 H THR 88 -4.982 -11.649 -0.024
598 HA THR 88 HA THR 88 -4.261 -9.084 1.211
599 HB THR 88 HB THR 88 -2.353 -11.423 1.081
600 HG1 THR 88 1HG THR 88 -4.336 -11.149 2.744
601 HG21 THR 88 3HG2 THR 88 -0.943 -9.645 1.216
602 HG22 THR 88 1HG2 THR 88 -1.340 -9.770 2.929
603 HG23 THR 88 2HG2 THR 88 -2.167 -8.587 1.916
604 H LEU 89 H LEU 89 -4.134 -7.813 -0.542
605 HA LEU 89 HA LEU 89 -2.955 -8.817 -3.007
606 HB2 LEU 89 1HB LEU 89 -4.523 -6.408 -2.226
607 HB3 LEU 89 2HB LEU 89 -3.507 -6.327 -3.664
608 HG LEU 89 HG LEU 89 -5.545 -8.503 -3.324
609 HD11 LEU 89 1HD1 LEU 89 -6.897 -6.897 -4.891
610 HD12 LEU 89 2HD1 LEU 89 -5.974 -5.648 -4.057
611 HD13 LEU 89 3HD1 LEU 89 -7.003 -6.745 -3.137
612 HD21 LEU 89 3HD2 LEU 89 -3.755 -7.514 -5.427
613 HD22 LEU 89 1HD2 LEU 89 -5.406 -7.841 -5.955
614 HD23 LEU 89 2HD2 LEU 89 -4.457 -9.115 -5.189
615 H THR 90 H THR 90 -0.812 -8.793 -3.140
616 HA THR 90 HA THR 90 0.748 -6.808 -1.704
617 HB THR 90 HB THR 90 2.582 -8.157 -1.983
618 HG1 THR 90 1HG THR 90 3.121 -8.859 -3.905
619 HG21 THR 90 3HG2 THR 90 0.343 -10.134 -2.433
620 HG22 THR 90 1HG2 THR 90 0.818 -9.472 -0.870
621 HG23 THR 90 2HG2 THR 90 1.938 -10.494 -1.771
622 H GLY 91 H GLY 91 1.815 -5.119 -2.590
623 HA2 GLY 91 1HA GLY 91 2.275 -4.956 -5.440
624 HA3 GLY 91 2HA GLY 91 1.058 -3.838 -4.845
625 H ARG 92 H ARG 92 3.881 -3.562 -5.969
626 HA ARG 92 HA ARG 92 5.075 -2.057 -3.742
627 HB2 ARG 92 1HB ARG 92 6.251 -3.283 -6.227
628 HB3 ARG 92 2HB ARG 92 7.122 -2.072 -5.297
629 HG2 ARG 92 1HG ARG 92 7.046 -3.504 -3.331
630 HG3 ARG 92 2HG ARG 92 6.136 -4.713 -4.240
631 HD2 ARG 92 1HD ARG 92 8.048 -4.867 -5.825
632 HD3 ARG 92 2HD ARG 92 8.952 -3.780 -4.773
633 HE ARG 92 HE ARG 92 9.295 -5.518 -3.314
634 HH11 ARG 92 1HH1 ARG 92 6.846 -6.404 -5.625
635 HH12 ARG 92 2HH1 ARG 92 6.802 -8.066 -5.137
636 HH21 ARG 92 1HH2 ARG 92 9.246 -7.704 -2.663
637 HH22 ARG 92 2HH2 ARG 92 8.167 -8.804 -3.452
638 H VAL 93 H VAL 93 5.781 0.071 -4.046
639 HA VAL 93 HA VAL 93 5.012 1.403 -6.539
640 HB VAL 93 HB VAL 93 3.082 1.785 -5.191
641 HG11 VAL 93 1HG1 VAL 93 3.090 1.878 -2.967
642 HG12 VAL 93 2HG1 VAL 93 4.817 1.521 -3.040
643 HG13 VAL 93 3HG1 VAL 93 4.264 3.194 -2.958
644 HG21 VAL 93 3HG2 VAL 93 2.946 4.021 -5.506
645 HG22 VAL 93 1HG2 VAL 93 4.434 4.345 -4.616
646 HG23 VAL 93 2HG2 VAL 93 4.509 3.783 -6.286
647 H THR 94 H THR 94 6.821 2.322 -7.232
648 HA THR 94 HA THR 94 8.933 3.084 -5.430
649 HB THR 94 HB THR 94 8.679 3.449 -8.421
650 HG1 THR 94 1HG THR 94 10.271 1.600 -6.952
651 HG21 THR 94 3HG2 THR 94 10.218 5.090 -7.553
652 HG22 THR 94 1HG2 THR 94 11.142 3.805 -8.331
653 HG23 THR 94 2HG2 THR 94 11.028 3.869 -6.572
654 H THR 95 H THR 95 8.574 4.855 -4.228
655 HA THR 95 HA THR 95 6.948 7.002 -4.725
656 HB THR 95 HB THR 95 8.660 8.330 -3.295
657 HG1 THR 95 1HG THR 95 10.423 7.295 -2.743
658 HG21 THR 95 3HG2 THR 95 7.168 7.760 -1.743
659 HG22 THR 95 1HG2 THR 95 8.034 6.246 -1.492
660 HG23 THR 95 2HG2 THR 95 6.720 6.325 -2.665
661 H LYS 96 H LYS 96 7.028 8.845 -5.890
662 HA LYS 96 HA LYS 96 8.670 9.057 -8.131
663 HB2 LYS 96 1HB LYS 96 7.374 11.425 -6.794
664 HB3 LYS 96 2HB LYS 96 7.682 11.178 -8.508
665 HG2 LYS 96 1HG LYS 96 6.074 9.092 -8.065
666 HG3 LYS 96 2HG LYS 96 5.480 10.183 -6.810
667 HD2 LYS 96 1HD LYS 96 4.665 11.690 -8.314
668 HD3 LYS 96 2HD LYS 96 5.897 11.315 -9.521
669 HE2 LYS 96 1HE LYS 96 4.648 9.007 -9.611
670 HE3 LYS 96 2HE LYS 96 3.309 9.945 -8.950
671 HZ1 LYS 96 3HZ LYS 96 3.277 11.330 -10.826
672 HZ2 LYS 96 1HZ LYS 96 3.432 9.764 -11.447
673 HZ3 LYS 96 2HZ LYS 96 4.780 10.784 -11.378
674 H LYS 97 H LYS 97 10.108 10.965 -8.621
675 HA LYS 97 HA LYS 97 12.261 10.997 -6.735
676 HB2 LYS 97 1HB LYS 97 11.776 12.156 -9.446
677 HB3 LYS 97 2HB LYS 97 13.095 12.802 -8.478
678 HG2 LYS 97 1HG LYS 97 13.914 10.425 -8.237
679 HG3 LYS 97 2HG LYS 97 12.735 9.993 -9.478
680 HD2 LYS 97 1HD LYS 97 13.803 11.774 -10.924
681 HD3 LYS 97 2HD LYS 97 15.093 11.850 -9.722
682 HE2 LYS 97 1HE LYS 97 14.331 9.185 -10.796
683 HE3 LYS 97 2HE LYS 97 15.240 10.271 -11.846
684 HZ1 LYS 97 3HZ LYS 97 16.796 10.500 -9.846
685 HZ2 LYS 97 1HZ LYS 97 16.868 9.070 -10.747
686 HZ3 LYS 97 2HZ LYS 97 16.053 9.096 -9.265
687 H ALA 98 H ALA 98 12.919 12.594 -5.378
688 HA ALA 98 HA ALA 98 10.990 14.679 -4.783
689 HB1 ALA 98 3HB ALA 98 12.087 14.951 -2.736
690 HB2 ALA 98 1HB ALA 98 12.187 13.219 -3.057
691 HB3 ALA 98 2HB ALA 98 13.588 14.252 -3.344
692 HA PRO 99 HA PRO 99 13.080 17.908 -6.924
693 HB2 PRO 99 1HB PRO 99 12.170 20.032 -5.499
694 HB3 PRO 99 2HB PRO 99 11.159 19.136 -6.639
695 HG2 PRO 99 1HG PRO 99 11.304 18.916 -3.657
696 HG3 PRO 99 2HG PRO 99 9.877 18.928 -4.710
697 HD2 PRO 99 1HD PRO 99 10.911 16.645 -3.684
698 HD3 PRO 99 2HD PRO 99 10.116 16.705 -5.270
699 H SER 100 H SER 100 14.796 19.384 -6.722
700 HA SER 100 HA SER 100 16.855 18.772 -5.034
701 HB2 SER 100 1HB SER 100 16.216 21.446 -6.297
702 HB3 SER 100 2HB SER 100 17.763 21.053 -5.548
703 HG SER 100 HG SER 100 16.745 19.332 -7.505
704 HA PRO 101 HA PRO 101 15.922 20.326 -1.034
705 HB2 PRO 101 1HB PRO 101 18.420 20.884 -0.128
706 HB3 PRO 101 2HB PRO 101 17.812 19.235 -0.315
707 HG2 PRO 101 1HG PRO 101 19.580 20.820 -2.138
708 HG3 PRO 101 2HG PRO 101 19.712 19.120 -1.651
709 HD2 PRO 101 1HD PRO 101 18.677 19.876 -4.036
710 HD3 PRO 101 2HD PRO 101 18.120 18.431 -3.167
711 H SER 102 H SER 102 14.806 22.245 -1.560
712 HA SER 102 HA SER 102 16.449 24.681 -1.710
713 HB2 SER 102 1HB SER 102 14.462 25.781 -2.643
714 HB3 SER 102 2HB SER 102 14.887 24.355 -3.589
715 HG SER 102 HG SER 102 12.654 24.861 -2.055
716 H SER 103 H SER 103 15.105 26.644 -0.778
717 HA SER 103 HA SER 103 15.232 26.712 1.893
718 HB2 SER 103 1HB SER 103 14.637 28.662 0.496
719 HB3 SER 103 2HB SER 103 13.007 28.018 0.307
720 HG SER 103 HG SER 103 14.149 28.541 2.842
721 H GLY 104 H GLY 104 12.222 25.869 0.168
722 HA2 GLY 104 1HA GLY 104 10.873 24.000 0.833
723 HA3 GLY 104 2HA GLY 104 11.492 24.184 2.468
724 HA PRO 105 HA PRO 105 8.123 27.603 1.654
725 HB2 PRO 105 1HB PRO 105 6.354 26.975 -0.307
726 HB3 PRO 105 2HB PRO 105 7.820 27.917 -0.602
727 HG2 PRO 105 1HG PRO 105 7.313 25.004 -1.072
728 HG3 PRO 105 2HG PRO 105 8.146 26.176 -2.109
729 HD2 PRO 105 1HD PRO 105 9.476 24.416 -0.539
730 HD3 PRO 105 2HD PRO 105 10.108 26.034 -0.909
731 H SER 106 H SER 106 7.144 27.057 3.534
732 HA SER 106 HA SER 106 5.052 24.989 3.403
733 HB2 SER 106 1HB SER 106 7.123 25.462 5.532
734 HB3 SER 106 2HB SER 106 5.585 24.693 5.927
735 HG SER 106 HG SER 106 6.968 23.711 3.721
736 H SER 107 H SER 107 3.316 25.278 4.995
737 HA SER 107 HA SER 107 2.648 28.107 5.241
738 HB2 SER 107 1HB SER 107 1.041 25.565 5.434
739 HB3 SER 107 2HB SER 107 0.378 27.117 5.948
740 HG SER 107 HG SER 107 0.817 26.144 3.423
741 H GLY 108 H GLY 108 1.897 29.038 7.195
742 HA2 GLY 108 1HA GLY 108 3.319 28.087 9.515
743 HA3 GLY 108 2HA GLY 108 2.346 29.547 9.411
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -5.088 -31.887 8.495
2 HA2 GLY 1 1HA GLY 1 -5.133 -28.964 8.876
3 HA3 GLY 1 2HA GLY 1 -3.943 -29.945 9.718
4 H SER 2 H SER 2 -2.381 -28.569 8.616
5 HA SER 2 HA SER 2 -0.943 -28.020 6.924
6 HB2 SER 2 1HB SER 2 -0.383 -30.432 7.520
7 HB3 SER 2 2HB SER 2 -1.288 -30.899 6.080
8 HG SER 2 HG SER 2 1.196 -30.298 6.122
9 H SER 3 H SER 3 -3.553 -27.330 6.284
10 HA SER 3 HA SER 3 -3.377 -27.158 3.437
11 HB2 SER 3 1HB SER 3 -4.386 -29.434 3.749
12 HB3 SER 3 2HB SER 3 -5.757 -28.663 4.546
13 HG SER 3 HG SER 3 -6.478 -28.000 2.673
14 H GLY 4 H GLY 4 -4.634 -25.508 2.602
15 HA2 GLY 4 1HA GLY 4 -5.709 -23.477 2.699
16 HA3 GLY 4 2HA GLY 4 -6.892 -24.345 3.668
17 H SER 5 H SER 5 -3.919 -22.456 3.804
18 HA SER 5 HA SER 5 -4.590 -21.763 6.590
19 HB2 SER 5 1HB SER 5 -1.949 -22.395 5.323
20 HB3 SER 5 2HB SER 5 -2.009 -21.273 6.682
21 HG SER 5 HG SER 5 -3.441 -23.189 7.526
22 H SER 6 H SER 6 -2.688 -20.596 3.806
23 HA SER 6 HA SER 6 -3.859 -17.938 4.205
24 HB2 SER 6 1HB SER 6 -0.901 -18.506 3.900
25 HB3 SER 6 2HB SER 6 -1.625 -16.900 3.823
26 HG SER 6 HG SER 6 -0.816 -17.417 5.915
27 H GLY 7 H GLY 7 -4.859 -17.445 2.374
28 HA2 GLY 7 1HA GLY 7 -4.872 -18.646 -0.021
29 HA3 GLY 7 2HA GLY 7 -5.038 -16.903 0.121
30 H LEU 8 H LEU 8 -3.756 -18.677 -1.935
31 HA LEU 8 HA LEU 8 -1.162 -17.291 -1.986
32 HB2 LEU 8 1HB LEU 8 -0.433 -19.420 -3.312
33 HB3 LEU 8 2HB LEU 8 -0.397 -19.400 -1.551
34 HG LEU 8 HG LEU 8 -2.832 -20.425 -1.881
35 HD11 LEU 8 1HD1 LEU 8 -1.667 -21.980 -4.043
36 HD12 LEU 8 2HD1 LEU 8 -1.994 -20.309 -4.500
37 HD13 LEU 8 3HD1 LEU 8 -3.293 -21.320 -3.868
38 HD21 LEU 8 3HD2 LEU 8 -1.689 -21.907 -0.676
39 HD22 LEU 8 1HD2 LEU 8 -0.168 -21.480 -1.459
40 HD23 LEU 8 2HD2 LEU 8 -1.237 -22.669 -2.201
41 H ALA 9 H ALA 9 -3.898 -16.915 -3.250
42 HA ALA 9 HA ALA 9 -2.908 -16.624 -6.002
43 HB1 ALA 9 3HB ALA 9 -5.780 -17.175 -5.793
44 HB2 ALA 9 1HB ALA 9 -4.586 -17.774 -6.946
45 HB3 ALA 9 2HB ALA 9 -4.736 -18.528 -5.358
46 HA PRO 10 HA PRO 10 -4.231 -12.455 -5.220
47 HB2 PRO 10 1HB PRO 10 -3.703 -11.501 -7.706
48 HB3 PRO 10 2HB PRO 10 -2.441 -11.816 -6.509
49 HG2 PRO 10 1HG PRO 10 -3.329 -13.507 -8.814
50 HG3 PRO 10 2HG PRO 10 -1.684 -13.150 -8.257
51 HD2 PRO 10 1HD PRO 10 -2.947 -15.474 -7.676
52 HD3 PRO 10 2HD PRO 10 -1.779 -14.720 -6.572
53 HA PRO 11 HA PRO 11 -8.406 -13.024 -6.803
54 HB2 PRO 11 1HB PRO 11 -9.500 -11.053 -5.290
55 HB3 PRO 11 2HB PRO 11 -9.133 -12.660 -4.654
56 HG2 PRO 11 1HG PRO 11 -7.562 -10.123 -4.412
57 HG3 PRO 11 2HG PRO 11 -7.904 -11.349 -3.177
58 HD2 PRO 11 1HD PRO 11 -5.540 -11.224 -4.491
59 HD3 PRO 11 2HD PRO 11 -6.243 -12.756 -3.935
60 H ARG 12 H ARG 12 -7.116 -9.744 -6.218
61 HA ARG 12 HA ARG 12 -8.077 -8.989 -8.897
62 HB2 ARG 12 1HB ARG 12 -8.119 -7.225 -6.442
63 HB3 ARG 12 2HB ARG 12 -8.665 -6.781 -8.054
64 HG2 ARG 12 1HG ARG 12 -9.887 -9.088 -6.588
65 HG3 ARG 12 2HG ARG 12 -10.418 -7.430 -6.302
66 HD2 ARG 12 1HD ARG 12 -11.867 -7.988 -7.966
67 HD3 ARG 12 2HD ARG 12 -10.525 -7.407 -8.951
68 HE ARG 12 HE ARG 12 -10.250 -10.176 -8.461
69 HH11 ARG 12 1HH1 ARG 12 -12.130 -7.903 -10.310
70 HH12 ARG 12 2HH1 ARG 12 -12.473 -9.025 -11.585
71 HH21 ARG 12 1HH2 ARG 12 -10.694 -11.662 -10.134
72 HH22 ARG 12 2HH2 ARG 12 -11.656 -11.163 -11.484
73 H HIS 13 H HIS 13 -7.062 -6.562 -9.235
74 HA HIS 13 HA HIS 13 -4.162 -6.966 -8.931
75 HB2 HIS 13 1HB HIS 13 -5.296 -6.854 -11.265
76 HB3 HIS 13 2HB HIS 13 -5.399 -5.123 -10.957
77 HD1 HIS 13 1HD HIS 13 -3.741 -4.571 -12.847
78 HD2 HIS 13 2HD HIS 13 -2.171 -7.038 -9.896
79 HE1 HIS 13 1HE HIS 13 -1.260 -4.612 -13.255
80 HE2 HIS 13 2HE HIS 13 -0.341 -6.178 -11.509
81 H LEU 14 H LEU 14 -2.829 -5.119 -8.532
82 HA LEU 14 HA LEU 14 -4.215 -3.077 -6.946
83 HB2 LEU 14 1HB LEU 14 -1.512 -4.303 -6.873
84 HB3 LEU 14 2HB LEU 14 -1.671 -2.633 -6.332
85 HG LEU 14 HG LEU 14 -3.246 -4.939 -5.191
86 HD11 LEU 14 1HD1 LEU 14 -0.712 -3.633 -4.214
87 HD12 LEU 14 2HD1 LEU 14 -0.928 -5.314 -4.699
88 HD13 LEU 14 3HD1 LEU 14 -1.722 -4.707 -3.246
89 HD21 LEU 14 3HD2 LEU 14 -4.263 -2.695 -4.984
90 HD22 LEU 14 1HD2 LEU 14 -2.805 -2.138 -4.163
91 HD23 LEU 14 2HD2 LEU 14 -3.806 -3.390 -3.428
92 H GLY 15 H GLY 15 -3.432 -0.853 -7.051
93 HA2 GLY 15 1HA GLY 15 -2.059 -0.140 -9.543
94 HA3 GLY 15 2HA GLY 15 -3.664 0.519 -9.263
95 H PHE 16 H PHE 16 -1.326 2.069 -9.627
96 HA PHE 16 HA PHE 16 -1.290 3.466 -7.050
97 HB2 PHE 16 1HB PHE 16 1.173 2.875 -8.706
98 HB3 PHE 16 2HB PHE 16 1.130 3.875 -7.258
99 HD1 PHE 16 1HD PHE 16 0.754 2.860 -5.059
100 HD2 PHE 16 2HD PHE 16 1.149 0.494 -8.575
101 HE1 PHE 16 1HE PHE 16 1.151 0.868 -3.670
102 HE2 PHE 16 2HE PHE 16 1.545 -1.502 -7.192
103 HZ PHE 16 HZ PHE 16 1.546 -1.317 -4.736
104 H SER 17 H SER 17 -1.909 5.494 -7.332
105 HA SER 17 HA SER 17 -1.172 6.874 -9.821
106 HB2 SER 17 1HB SER 17 -3.493 6.234 -10.086
107 HB3 SER 17 2HB SER 17 -3.893 6.883 -8.496
108 HG SER 17 HG SER 17 -3.186 8.958 -9.359
109 H ASP 18 H ASP 18 -1.299 9.248 -9.643
110 HA ASP 18 HA ASP 18 -0.525 11.153 -8.656
111 HB2 ASP 18 1HB ASP 18 -2.918 10.664 -7.628
112 HB3 ASP 18 2HB ASP 18 -1.988 10.466 -6.145
113 H VAL 19 H VAL 19 1.211 8.953 -8.397
114 HA VAL 19 HA VAL 19 2.169 8.686 -5.726
115 HB VAL 19 HB VAL 19 3.589 8.090 -8.326
116 HG11 VAL 19 1HG1 VAL 19 4.283 7.661 -5.470
117 HG12 VAL 19 2HG1 VAL 19 4.713 6.400 -6.628
118 HG13 VAL 19 3HG1 VAL 19 5.322 8.042 -6.842
119 HG21 VAL 19 3HG2 VAL 19 2.890 5.690 -7.247
120 HG22 VAL 19 1HG2 VAL 19 1.504 6.691 -6.813
121 HG23 VAL 19 2HG2 VAL 19 1.981 6.530 -8.503
122 H SER 20 H SER 20 3.702 9.796 -4.645
123 HA SER 20 HA SER 20 5.032 12.008 -6.069
124 HB2 SER 20 1HB SER 20 3.906 11.945 -3.264
125 HB3 SER 20 2HB SER 20 4.982 13.214 -3.848
126 HG SER 20 HG SER 20 2.974 12.818 -5.595
127 H HIS 21 H HIS 21 6.849 12.869 -4.367
128 HA HIS 21 HA HIS 21 8.746 10.700 -4.266
129 HB2 HIS 21 1HB HIS 21 10.304 12.502 -3.438
130 HB3 HIS 21 2HB HIS 21 9.589 12.805 -5.018
131 HD1 HIS 21 1HD HIS 21 7.534 14.545 -5.018
132 HD2 HIS 21 2HD HIS 21 9.886 14.469 -1.593
133 HE1 HIS 21 1HE HIS 21 7.019 16.685 -3.801
134 HE2 HIS 21 2HE HIS 21 8.516 16.656 -1.776
135 H ASP 22 H ASP 22 6.688 12.380 -2.051
136 HA ASP 22 HA ASP 22 7.827 10.797 0.156
137 HB2 ASP 22 1HB ASP 22 6.907 13.667 0.169
138 HB3 ASP 22 2HB ASP 22 7.035 12.721 1.649
139 H ALA 23 H ALA 23 5.538 10.382 -1.729
140 HA ALA 23 HA ALA 23 3.684 9.376 0.180
141 HB1 ALA 23 3HB ALA 23 1.730 10.729 -0.571
142 HB2 ALA 23 1HB ALA 23 2.930 11.641 0.345
143 HB3 ALA 23 2HB ALA 23 2.854 11.797 -1.410
144 H ALA 24 H ALA 24 1.857 8.258 -0.851
145 HA ALA 24 HA ALA 24 1.828 7.925 -3.698
146 HB1 ALA 24 3HB ALA 24 3.228 6.222 -3.934
147 HB2 ALA 24 1HB ALA 24 3.604 6.286 -2.212
148 HB3 ALA 24 2HB ALA 24 2.280 5.274 -2.789
149 H ARG 25 H ARG 25 -0.195 7.474 -4.267
150 HA ARG 25 HA ARG 25 -2.056 6.547 -2.215
151 HB2 ARG 25 1HB ARG 25 -2.509 8.590 -3.647
152 HB3 ARG 25 2HB ARG 25 -2.721 7.490 -5.003
153 HG2 ARG 25 1HG ARG 25 -4.561 6.393 -3.828
154 HG3 ARG 25 2HG ARG 25 -4.347 7.497 -2.468
155 HD2 ARG 25 1HD ARG 25 -6.152 8.314 -3.802
156 HD3 ARG 25 2HD ARG 25 -4.775 9.391 -4.034
157 HE ARG 25 HE ARG 25 -4.484 7.724 -6.092
158 HH11 ARG 25 1HH1 ARG 25 -7.298 9.373 -4.875
159 HH12 ARG 25 2HH1 ARG 25 -8.062 9.488 -6.426
160 HH21 ARG 25 1HH2 ARG 25 -5.479 7.869 -8.140
161 HH22 ARG 25 2HH2 ARG 25 -7.027 8.632 -8.282
162 H VAL 26 H VAL 26 -2.483 4.454 -2.076
163 HA VAL 26 HA VAL 26 -2.252 2.792 -4.494
164 HB VAL 26 HB VAL 26 -0.761 2.091 -2.705
165 HG11 VAL 26 1HG1 VAL 26 -1.317 2.148 -0.554
166 HG12 VAL 26 2HG1 VAL 26 -2.874 2.830 -1.028
167 HG13 VAL 26 3HG1 VAL 26 -2.697 1.086 -0.830
168 HG21 VAL 26 3HG2 VAL 26 -3.042 0.357 -3.506
169 HG22 VAL 26 1HG2 VAL 26 -1.326 0.220 -3.893
170 HG23 VAL 26 2HG2 VAL 26 -1.911 -0.250 -2.297
171 H PHE 27 H PHE 27 -4.042 1.990 -5.361
172 HA PHE 27 HA PHE 27 -6.409 1.629 -3.654
173 HB2 PHE 27 1HB PHE 27 -7.856 2.533 -5.354
174 HB3 PHE 27 2HB PHE 27 -6.595 3.716 -5.021
175 HD1 PHE 27 2HD PHE 27 -7.631 1.071 -7.397
176 HD2 PHE 27 1HD PHE 27 -5.207 4.505 -6.728
177 HE1 PHE 27 2HE PHE 27 -7.069 1.137 -9.791
178 HE2 PHE 27 1HE PHE 27 -4.641 4.577 -9.122
179 HZ PHE 27 HZ PHE 27 -5.572 2.890 -10.657
180 H TRP 28 H TRP 28 -8.110 0.277 -4.849
181 HA TRP 28 HA TRP 28 -6.874 -1.727 -6.595
182 HB2 TRP 28 1HB TRP 28 -8.249 -3.446 -5.182
183 HB3 TRP 28 2HB TRP 28 -6.673 -2.909 -4.609
184 HD1 TRP 28 HD TRP 28 -10.307 -2.974 -3.660
185 HE1 TRP 28 1HE TRP 28 -10.620 -1.869 -1.357
186 HE3 TRP 28 3HE TRP 28 -5.657 -0.924 -3.107
187 HZ2 TRP 28 2HZ TRP 28 -9.096 -0.330 0.454
188 HZ3 TRP 28 3HZ TRP 28 -5.166 0.350 -1.060
189 HH2 TRP 28 HH TRP 28 -6.851 0.640 0.682
190 H GLU 29 H GLU 29 -8.481 -3.129 -7.663
191 HA GLU 29 HA GLU 29 -10.698 -1.549 -8.594
192 HB2 GLU 29 1HB GLU 29 -11.025 -3.252 -10.232
193 HB3 GLU 29 2HB GLU 29 -9.290 -3.023 -10.065
194 HG2 GLU 29 1HG GLU 29 -9.508 -4.991 -8.352
195 HG3 GLU 29 2HG GLU 29 -10.988 -5.325 -9.249
196 H GLY 30 H GLY 30 -10.375 -3.179 -5.851
197 HA2 GLY 30 1HA GLY 30 -12.067 -3.662 -4.311
198 HA3 GLY 30 2HA GLY 30 -13.237 -3.630 -5.622
199 H ALA 31 H ALA 31 -12.432 -5.592 -3.377
200 HA ALA 31 HA ALA 31 -11.556 -7.954 -4.712
201 HB1 ALA 31 3HB ALA 31 -12.807 -8.816 -2.417
202 HB2 ALA 31 1HB ALA 31 -11.108 -8.365 -2.565
203 HB3 ALA 31 2HB ALA 31 -12.289 -7.181 -2.004
204 HA PRO 32 HA PRO 32 -15.280 -9.605 -6.343
205 HB2 PRO 32 1HB PRO 32 -15.001 -12.257 -5.832
206 HB3 PRO 32 2HB PRO 32 -14.049 -11.410 -7.056
207 HG2 PRO 32 1HG PRO 32 -13.296 -12.168 -4.260
208 HG3 PRO 32 2HG PRO 32 -12.339 -12.288 -5.748
209 HD2 PRO 32 1HD PRO 32 -12.011 -10.278 -3.963
210 HD3 PRO 32 2HD PRO 32 -11.764 -10.056 -5.707
211 H ARG 33 H ARG 33 -14.791 -9.373 -3.098
212 HA ARG 33 HA ARG 33 -17.561 -10.024 -2.526
213 HB2 ARG 33 1HB ARG 33 -17.016 -11.424 -0.588
214 HB3 ARG 33 2HB ARG 33 -16.428 -12.142 -2.081
215 HG2 ARG 33 1HG ARG 33 -14.177 -11.202 -1.559
216 HG3 ARG 33 2HG ARG 33 -14.814 -10.703 0.009
217 HD2 ARG 33 1HD ARG 33 -14.753 -13.532 -1.037
218 HD3 ARG 33 2HD ARG 33 -13.613 -12.848 0.121
219 HE ARG 33 HE ARG 33 -15.255 -12.930 1.763
220 HH11 ARG 33 1HH1 ARG 33 -16.537 -13.867 -1.335
221 HH12 ARG 33 2HH1 ARG 33 -17.997 -14.528 -0.677
222 HH21 ARG 33 1HH2 ARG 33 -17.173 -13.797 2.641
223 HH22 ARG 33 2HH2 ARG 33 -18.358 -14.487 1.585
224 HA PRO 34 HA PRO 34 -17.258 -6.515 0.095
225 HB2 PRO 34 1HB PRO 34 -19.148 -7.096 1.956
226 HB3 PRO 34 2HB PRO 34 -19.544 -6.625 0.299
227 HG2 PRO 34 1HG PRO 34 -19.435 -9.358 1.518
228 HG3 PRO 34 2HG PRO 34 -20.641 -8.673 0.413
229 HD2 PRO 34 1HD PRO 34 -18.670 -10.328 -0.427
230 HD3 PRO 34 2HD PRO 34 -19.326 -9.030 -1.446
231 H VAL 35 H VAL 35 -16.117 -5.835 1.836
232 HA VAL 35 HA VAL 35 -15.292 -7.870 3.805
233 HB VAL 35 HB VAL 35 -13.336 -7.453 2.577
234 HG11 VAL 35 1HG1 VAL 35 -12.779 -4.751 2.571
235 HG12 VAL 35 2HG1 VAL 35 -13.365 -5.697 1.201
236 HG13 VAL 35 3HG1 VAL 35 -14.505 -4.817 2.220
237 HG21 VAL 35 3HG2 VAL 35 -13.092 -7.252 5.047
238 HG22 VAL 35 1HG2 VAL 35 -11.854 -6.387 4.136
239 HG23 VAL 35 2HG2 VAL 35 -13.190 -5.500 4.871
240 H ARG 36 H ARG 36 -14.756 -7.054 5.933
241 HA ARG 36 HA ARG 36 -16.519 -4.858 6.691
242 HB2 ARG 36 1HB ARG 36 -16.214 -5.650 8.978
243 HB3 ARG 36 2HB ARG 36 -16.682 -6.977 7.923
244 HG2 ARG 36 1HG ARG 36 -14.402 -7.771 7.847
245 HG3 ARG 36 2HG ARG 36 -13.865 -6.392 8.808
246 HD2 ARG 36 1HD ARG 36 -15.347 -7.164 10.643
247 HD3 ARG 36 2HD ARG 36 -15.730 -8.593 9.684
248 HE ARG 36 HE ARG 36 -13.660 -9.463 10.191
249 HH11 ARG 36 1HH1 ARG 36 -13.817 -6.127 11.174
250 HH12 ARG 36 2HH1 ARG 36 -12.336 -6.187 12.073
251 HH21 ARG 36 1HH2 ARG 36 -11.710 -9.554 11.371
252 HH22 ARG 36 2HH2 ARG 36 -11.138 -8.136 12.183
253 H LEU 37 H LEU 37 -13.128 -5.839 7.054
254 HA LEU 37 HA LEU 37 -12.432 -3.013 7.430
255 HB2 LEU 37 1HB LEU 37 -12.422 -3.986 9.635
256 HB3 LEU 37 2HB LEU 37 -11.429 -5.330 9.075
257 HG LEU 37 HG LEU 37 -9.649 -3.558 8.566
258 HD11 LEU 37 1HD1 LEU 37 -10.458 -1.802 10.654
259 HD12 LEU 37 2HD1 LEU 37 -11.739 -1.872 9.444
260 HD13 LEU 37 3HD1 LEU 37 -10.100 -1.428 8.968
261 HD21 LEU 37 3HD2 LEU 37 -8.672 -4.230 10.460
262 HD22 LEU 37 1HD2 LEU 37 -10.161 -5.127 10.759
263 HD23 LEU 37 2HD2 LEU 37 -9.938 -3.527 11.468
264 H VAL 38 H VAL 38 -10.337 -2.430 6.730
265 HA VAL 38 HA VAL 38 -8.923 -4.467 5.144
266 HB VAL 38 HB VAL 38 -9.481 -1.631 4.264
267 HG11 VAL 38 1HG1 VAL 38 -7.533 -3.642 3.401
268 HG12 VAL 38 2HG1 VAL 38 -8.488 -2.941 2.094
269 HG13 VAL 38 3HG1 VAL 38 -7.547 -1.896 3.157
270 HG21 VAL 38 3HG2 VAL 38 -11.008 -4.003 3.990
271 HG22 VAL 38 1HG2 VAL 38 -11.314 -2.414 3.290
272 HG23 VAL 38 2HG2 VAL 38 -10.353 -3.598 2.404
273 H ARG 39 H ARG 39 -7.080 -4.732 6.248
274 HA ARG 39 HA ARG 39 -5.744 -2.422 7.429
275 HB2 ARG 39 1HB ARG 39 -6.106 -4.797 8.512
276 HB3 ARG 39 2HB ARG 39 -4.660 -5.203 7.598
277 HG2 ARG 39 1HG ARG 39 -3.322 -3.770 8.821
278 HG3 ARG 39 2HG ARG 39 -4.689 -2.793 9.361
279 HD2 ARG 39 1HD ARG 39 -4.200 -5.646 10.202
280 HD3 ARG 39 2HD ARG 39 -3.695 -4.237 11.134
281 HE ARG 39 HE ARG 39 -6.498 -4.267 10.484
282 HH11 ARG 39 1HH1 ARG 39 -4.062 -5.295 12.749
283 HH12 ARG 39 2HH1 ARG 39 -5.171 -5.452 14.070
284 HH21 ARG 39 1HH2 ARG 39 -7.968 -4.471 12.216
285 HH22 ARG 39 2HH2 ARG 39 -7.393 -4.985 13.766
286 H VAL 40 H VAL 40 -4.318 -1.337 6.258
287 HA VAL 40 HA VAL 40 -2.855 -2.749 4.131
288 HB VAL 40 HB VAL 40 -3.271 0.225 4.459
289 HG11 VAL 40 1HG1 VAL 40 -2.618 -0.175 1.862
290 HG12 VAL 40 2HG1 VAL 40 -1.461 0.263 3.121
291 HG13 VAL 40 3HG1 VAL 40 -1.650 -1.425 2.644
292 HG21 VAL 40 3HG2 VAL 40 -5.124 0.118 3.182
293 HG22 VAL 40 1HG2 VAL 40 -4.489 -1.192 2.187
294 HG23 VAL 40 2HG2 VAL 40 -5.196 -1.545 3.764
295 H THR 41 H THR 41 -0.646 -2.679 4.018
296 HA THR 41 HA THR 41 0.807 -1.169 6.067
297 HB THR 41 HB THR 41 2.270 -3.158 6.492
298 HG1 THR 41 1HG THR 41 1.789 -4.473 4.753
299 HG21 THR 41 3HG2 THR 41 0.089 -2.414 7.803
300 HG22 THR 41 1HG2 THR 41 0.979 -3.872 8.243
301 HG23 THR 41 2HG2 THR 41 -0.481 -3.992 7.260
302 H TYR 42 H TYR 42 2.670 -0.295 5.358
303 HA TYR 42 HA TYR 42 3.683 -1.176 2.735
304 HB2 TYR 42 1HB TYR 42 4.381 1.241 2.417
305 HB3 TYR 42 2HB TYR 42 2.650 0.930 2.348
306 HD1 TYR 42 2HD TYR 42 1.278 1.388 4.458
307 HD2 TYR 42 1HD TYR 42 5.247 2.820 3.913
308 HE1 TYR 42 2HE TYR 42 0.900 3.082 6.200
309 HE2 TYR 42 1HE TYR 42 4.880 4.518 5.654
310 HH TYR 42 HH TYR 42 1.778 4.743 7.375
311 H VAL 43 H VAL 43 5.905 -1.191 2.435
312 HA VAL 43 HA VAL 43 7.632 -0.396 4.646
313 HB VAL 43 HB VAL 43 6.964 -2.791 5.040
314 HG11 VAL 43 1HG1 VAL 43 6.952 -3.360 2.584
315 HG12 VAL 43 2HG1 VAL 43 8.715 -3.392 2.666
316 HG13 VAL 43 3HG1 VAL 43 7.765 -4.522 3.632
317 HG21 VAL 43 3HG2 VAL 43 9.827 -3.053 4.581
318 HG22 VAL 43 1HG2 VAL 43 9.391 -1.529 5.354
319 HG23 VAL 43 2HG2 VAL 43 8.918 -3.059 6.092
320 H SER 44 H SER 44 9.744 0.032 4.045
321 HA SER 44 HA SER 44 10.167 0.746 1.340
322 HB2 SER 44 1HB SER 44 11.229 1.853 3.339
323 HB3 SER 44 2HB SER 44 12.285 0.448 3.479
324 HG SER 44 HG SER 44 12.147 1.618 0.972
325 H SER 45 H SER 45 11.807 -0.042 -0.102
326 HA SER 45 HA SER 45 11.709 -2.607 -0.848
327 HB2 SER 45 1HB SER 45 13.767 -2.329 -2.040
328 HB3 SER 45 2HB SER 45 12.991 -0.746 -1.988
329 HG SER 45 HG SER 45 14.988 -1.609 -0.166
330 H GLU 46 H GLU 46 13.757 -1.352 1.725
331 HA GLU 46 HA GLU 46 14.478 -4.124 2.419
332 HB2 GLU 46 1HB GLU 46 16.502 -3.199 3.490
333 HB3 GLU 46 2HB GLU 46 16.448 -2.873 1.763
334 HG2 GLU 46 1HG GLU 46 15.538 -0.601 2.328
335 HG3 GLU 46 2HG GLU 46 15.909 -0.959 4.014
336 H GLY 47 H GLY 47 14.760 -4.556 4.727
337 HA2 GLY 47 1HA GLY 47 12.545 -3.724 6.240
338 HA3 GLY 47 2HA GLY 47 13.943 -4.582 6.871
339 H GLY 48 H GLY 48 12.210 -1.718 6.955
340 HA2 GLY 48 1HA GLY 48 14.020 -0.545 8.832
341 HA3 GLY 48 2HA GLY 48 14.047 0.303 7.293
342 H HIS 49 H HIS 49 12.260 1.502 6.644
343 HA HIS 49 HA HIS 49 10.500 2.282 8.829
344 HB2 HIS 49 1HB HIS 49 11.450 4.149 7.742
345 HB3 HIS 49 2HB HIS 49 11.145 3.479 6.142
346 HD1 HIS 49 1HD HIS 49 9.386 4.772 5.006
347 HD2 HIS 49 2HD HIS 49 8.664 4.461 9.086
348 HE1 HIS 49 1HE HIS 49 7.217 5.982 5.399
349 HE2 HIS 49 2HE HIS 49 6.844 5.855 7.887
350 H SER 50 H SER 50 8.598 1.328 9.059
351 HA SER 50 HA SER 50 7.045 0.662 6.659
352 HB2 SER 50 1HB SER 50 6.510 -1.510 7.408
353 HB3 SER 50 2HB SER 50 8.242 -1.363 7.703
354 HG SER 50 HG SER 50 6.886 -2.224 9.471
355 H GLY 51 H GLY 51 4.772 0.648 6.948
356 HA2 GLY 51 1HA GLY 51 3.827 1.767 9.506
357 HA3 GLY 51 2HA GLY 51 3.390 2.538 7.989
358 H GLN 52 H GLN 52 1.267 1.977 9.284
359 HA GLN 52 HA GLN 52 0.032 -0.164 7.816
360 HB2 GLN 52 1HB GLN 52 0.870 -1.518 9.595
361 HB3 GLN 52 2HB GLN 52 0.364 -0.349 10.808
362 HG2 GLN 52 1HG GLN 52 -1.993 -0.808 10.191
363 HG3 GLN 52 2HG GLN 52 -1.419 -2.072 9.105
364 HE21 GLN 52 1HE2 GLN 52 -2.567 -1.442 12.134
365 HE22 GLN 52 2HE2 GLN 52 -2.021 -2.866 12.945
366 H THR 53 H THR 53 -1.723 0.828 7.091
367 HA THR 53 HA THR 53 -3.218 2.573 8.938
368 HB THR 53 HB THR 53 -2.231 3.755 6.980
369 HG1 THR 53 1HG THR 53 -4.007 4.777 7.716
370 HG21 THR 53 3HG2 THR 53 -3.022 3.360 4.764
371 HG22 THR 53 1HG2 THR 53 -4.216 2.193 5.332
372 HG23 THR 53 2HG2 THR 53 -2.497 1.806 5.410
373 H GLU 54 H GLU 54 -5.382 2.264 9.194
374 HA GLU 54 HA GLU 54 -6.499 -0.144 7.940
375 HB2 GLU 54 1HB GLU 54 -7.101 1.314 10.498
376 HB3 GLU 54 2HB GLU 54 -8.267 0.198 9.802
377 HG2 GLU 54 1HG GLU 54 -6.596 -1.591 9.892
378 HG3 GLU 54 2HG GLU 54 -5.449 -0.469 10.622
379 H ALA 55 H ALA 55 -8.458 -0.123 6.881
380 HA ALA 55 HA ALA 55 -9.872 2.420 6.604
381 HB1 ALA 55 3HB ALA 55 -9.148 2.834 4.550
382 HB2 ALA 55 1HB ALA 55 -8.114 1.406 4.620
383 HB3 ALA 55 2HB ALA 55 -9.764 1.272 4.011
384 HA PRO 56 HA PRO 56 -13.496 -0.056 6.634
385 HB2 PRO 56 1HB PRO 56 -15.151 1.365 5.017
386 HB3 PRO 56 2HB PRO 56 -14.701 1.901 6.640
387 HG2 PRO 56 1HG PRO 56 -13.592 2.746 3.991
388 HG3 PRO 56 2HG PRO 56 -14.007 3.741 5.399
389 HD2 PRO 56 1HD PRO 56 -11.462 3.012 4.830
390 HD3 PRO 56 2HD PRO 56 -12.042 3.236 6.493
391 H GLY 57 H GLY 57 -14.444 -1.733 5.554
392 HA2 GLY 57 1HA GLY 57 -13.250 -2.904 3.371
393 HA3 GLY 57 2HA GLY 57 -14.908 -3.219 3.861
394 H ASN 58 H ASN 58 -15.337 -0.193 3.362
395 HA ASN 58 HA ASN 58 -16.191 -0.544 0.617
396 HB2 ASN 58 1HB ASN 58 -17.812 0.512 1.967
397 HB3 ASN 58 2HB ASN 58 -16.628 1.598 2.688
398 HD21 ASN 58 1HD2 ASN 58 -17.363 3.547 2.149
399 HD22 ASN 58 2HD2 ASN 58 -17.664 4.084 0.535
400 H ALA 59 H ALA 59 -13.797 1.277 2.415
401 HA ALA 59 HA ALA 59 -13.045 3.107 0.427
402 HB1 ALA 59 3HB ALA 59 -10.721 2.625 1.811
403 HB2 ALA 59 1HB ALA 59 -11.971 3.784 2.263
404 HB3 ALA 59 2HB ALA 59 -11.972 2.166 2.967
405 H THR 60 H THR 60 -12.381 2.627 -1.556
406 HA THR 60 HA THR 60 -10.796 0.191 -1.985
407 HB THR 60 HB THR 60 -11.353 0.447 -4.374
408 HG1 THR 60 1HG THR 60 -12.361 2.858 -3.440
409 HG21 THR 60 3HG2 THR 60 -14.038 0.663 -3.220
410 HG22 THR 60 1HG2 THR 60 -12.981 -0.468 -2.377
411 HG23 THR 60 2HG2 THR 60 -13.288 -0.667 -4.102
412 H SER 61 H SER 61 -9.795 2.814 -0.957
413 HA SER 61 HA SER 61 -7.397 2.911 -2.482
414 HB2 SER 61 1HB SER 61 -7.600 5.300 -3.195
415 HB3 SER 61 2HB SER 61 -8.709 4.219 -4.038
416 HG SER 61 HG SER 61 -9.936 5.917 -3.411
417 H ALA 62 H ALA 62 -5.754 3.764 -1.306
418 HA ALA 62 HA ALA 62 -6.347 5.478 0.978
419 HB1 ALA 62 3HB ALA 62 -6.511 3.228 1.893
420 HB2 ALA 62 1HB ALA 62 -4.904 2.846 1.273
421 HB3 ALA 62 2HB ALA 62 -5.096 4.063 2.535
422 H MET 63 H MET 63 -4.605 6.727 1.668
423 HA MET 63 HA MET 63 -2.407 6.880 -0.249
424 HB2 MET 63 1HB MET 63 -3.402 8.775 1.877
425 HB3 MET 63 2HB MET 63 -1.925 9.054 0.965
426 HG2 MET 63 1HG MET 63 -3.483 8.745 -1.102
427 HG3 MET 63 2HG MET 63 -4.759 9.126 0.052
428 HE1 MET 63 3HE MET 63 -1.074 11.212 -1.031
429 HE2 MET 63 1HE MET 63 -1.910 9.948 -1.935
430 HE3 MET 63 2HE MET 63 -2.188 11.644 -2.330
431 H LEU 64 H LEU 64 -0.215 7.395 0.620
432 HA LEU 64 HA LEU 64 0.320 6.214 3.244
433 HB2 LEU 64 1HB LEU 64 1.877 5.445 0.786
434 HB3 LEU 64 2HB LEU 64 2.051 4.791 2.413
435 HG LEU 64 HG LEU 64 -0.452 4.440 0.779
436 HD11 LEU 64 1HD1 LEU 64 0.479 2.105 0.413
437 HD12 LEU 64 2HD1 LEU 64 2.048 2.778 0.853
438 HD13 LEU 64 3HD1 LEU 64 1.183 3.404 -0.551
439 HD21 LEU 64 3HD2 LEU 64 -0.388 4.141 3.323
440 HD22 LEU 64 1HD2 LEU 64 0.588 2.709 2.997
441 HD23 LEU 64 2HD2 LEU 64 -1.051 2.823 2.356
442 H GLY 65 H GLY 65 2.021 7.113 4.326
443 HA2 GLY 65 1HA GLY 65 4.284 8.302 3.558
444 HA3 GLY 65 2HA GLY 65 3.111 9.554 3.178
445 HA PRO 66 HA PRO 66 4.853 10.923 3.731
446 HB2 PRO 66 1HB PRO 66 7.106 11.612 5.080
447 HB3 PRO 66 2HB PRO 66 5.621 12.569 5.138
448 HG2 PRO 66 1HG PRO 66 6.669 10.576 7.111
449 HG3 PRO 66 2HG PRO 66 5.930 12.160 7.406
450 HD2 PRO 66 1HD PRO 66 4.558 9.840 7.673
451 HD3 PRO 66 2HD PRO 66 3.788 11.350 7.145
452 H LEU 67 H LEU 67 5.867 9.719 2.264
453 HA LEU 67 HA LEU 67 7.489 7.449 3.147
454 HB2 LEU 67 1HB LEU 67 6.686 8.067 0.322
455 HB3 LEU 67 2HB LEU 67 7.185 6.521 1.004
456 HG LEU 67 HG LEU 67 4.575 7.941 1.532
457 HD11 LEU 67 1HD1 LEU 67 5.443 6.086 -0.505
458 HD12 LEU 67 2HD1 LEU 67 3.927 6.974 -0.360
459 HD13 LEU 67 3HD1 LEU 67 4.120 5.422 0.454
460 HD21 LEU 67 3HD2 LEU 67 5.453 5.207 2.444
461 HD22 LEU 67 1HD2 LEU 67 3.948 6.039 2.836
462 HD23 LEU 67 2HD2 LEU 67 5.480 6.646 3.464
463 H SER 68 H SER 68 9.262 6.980 1.286
464 HA SER 68 HA SER 68 11.007 9.332 1.366
465 HB2 SER 68 1HB SER 68 11.490 6.379 1.190
466 HB3 SER 68 2HB SER 68 12.726 7.496 0.610
467 HG SER 68 HG SER 68 12.932 8.326 2.633
468 H SER 69 H SER 69 12.600 9.419 -0.552
469 HA SER 69 HA SER 69 10.989 9.336 -3.005
470 HB2 SER 69 1HB SER 69 12.720 10.943 -3.880
471 HB3 SER 69 2HB SER 69 11.793 11.546 -2.506
472 HG SER 69 HG SER 69 13.652 11.838 -1.592
473 H SER 70 H SER 70 11.956 8.649 -4.990
474 HA SER 70 HA SER 70 12.929 6.961 -6.196
475 HB2 SER 70 1HB SER 70 14.687 8.726 -6.135
476 HB3 SER 70 2HB SER 70 15.393 7.931 -4.728
477 HG SER 70 HG SER 70 16.337 6.599 -6.036
478 H THR 71 H THR 71 11.863 6.156 -3.612
479 HA THR 71 HA THR 71 13.562 3.794 -3.149
480 HB THR 71 HB THR 71 11.954 5.251 -1.042
481 HG1 THR 71 1HG THR 71 14.155 6.054 -1.928
482 HG21 THR 71 3HG2 THR 71 12.503 2.615 -1.057
483 HG22 THR 71 1HG2 THR 71 12.423 3.579 0.417
484 HG23 THR 71 2HG2 THR 71 13.985 3.227 -0.323
485 H THR 72 H THR 72 12.569 1.942 -3.573
486 HA THR 72 HA THR 72 9.802 1.852 -4.263
487 HB THR 72 HB THR 72 11.666 -0.483 -3.803
488 HG1 THR 72 1HG THR 72 12.609 0.681 -5.407
489 HG21 THR 72 3HG2 THR 72 9.017 -0.174 -5.194
490 HG22 THR 72 1HG2 THR 72 9.459 -1.306 -3.917
491 HG23 THR 72 2HG2 THR 72 10.110 -1.513 -5.543
492 H TYR 73 H TYR 73 8.076 1.150 -3.122
493 HA TYR 73 HA TYR 73 8.561 0.144 -0.396
494 HB2 TYR 73 1HB TYR 73 6.837 2.380 -1.333
495 HB3 TYR 73 2HB TYR 73 6.208 1.364 -0.041
496 HD1 TYR 73 1HD TYR 73 9.129 3.457 -0.993
497 HD2 TYR 73 2HD TYR 73 6.903 1.689 2.173
498 HE1 TYR 73 1HE TYR 73 10.459 4.725 0.642
499 HE2 TYR 73 2HE TYR 73 8.226 2.953 3.817
500 HH TYR 73 HH TYR 73 10.564 5.384 2.816
501 H THR 74 H THR 74 7.666 -1.763 -0.006
502 HA THR 74 HA THR 74 5.846 -2.925 -1.937
503 HB THR 74 HB THR 74 7.022 -4.110 0.586
504 HG1 THR 74 1HG THR 74 8.195 -3.559 -1.673
505 HG21 THR 74 3HG2 THR 74 4.910 -5.018 -1.111
506 HG22 THR 74 1HG2 THR 74 5.614 -5.811 0.297
507 HG23 THR 74 2HG2 THR 74 6.299 -6.086 -1.304
508 H VAL 75 H VAL 75 3.821 -2.117 -1.744
509 HA VAL 75 HA VAL 75 2.604 -1.678 0.837
510 HB VAL 75 HB VAL 75 1.469 -1.471 -1.955
511 HG11 VAL 75 1HG1 VAL 75 0.236 -1.058 0.737
512 HG12 VAL 75 2HG1 VAL 75 -0.300 -0.091 -0.639
513 HG13 VAL 75 3HG1 VAL 75 -0.429 -1.850 -0.691
514 HG21 VAL 75 3HG2 VAL 75 2.225 0.696 0.002
515 HG22 VAL 75 1HG2 VAL 75 3.227 0.170 -1.351
516 HG23 VAL 75 2HG2 VAL 75 1.656 0.912 -1.653
517 H ARG 76 H ARG 76 0.942 -2.835 1.760
518 HA ARG 76 HA ARG 76 0.158 -5.343 0.442
519 HB2 ARG 76 1HB ARG 76 1.961 -5.452 2.372
520 HB3 ARG 76 2HB ARG 76 0.544 -5.309 3.403
521 HG2 ARG 76 1HG ARG 76 -0.386 -7.320 2.543
522 HG3 ARG 76 2HG ARG 76 0.829 -7.405 1.267
523 HD2 ARG 76 1HD ARG 76 1.746 -8.876 2.745
524 HD3 ARG 76 2HD ARG 76 2.475 -7.385 3.340
525 HE ARG 76 HE ARG 76 -0.037 -8.075 4.581
526 HH11 ARG 76 1HH1 ARG 76 3.428 -8.400 4.683
527 HH12 ARG 76 2HH1 ARG 76 3.474 -8.765 6.376
528 HH21 ARG 76 1HH2 ARG 76 0.011 -8.554 6.811
529 HH22 ARG 76 2HH2 ARG 76 1.530 -8.853 7.585
530 H VAL 77 H VAL 77 -1.949 -5.118 0.067
531 HA VAL 77 HA VAL 77 -3.624 -3.681 1.986
532 HB VAL 77 HB VAL 77 -4.277 -4.712 -0.779
533 HG11 VAL 77 1HG1 VAL 77 -6.408 -4.476 -0.185
534 HG12 VAL 77 2HG1 VAL 77 -5.959 -3.787 1.376
535 HG13 VAL 77 3HG1 VAL 77 -6.106 -2.745 -0.039
536 HG21 VAL 77 3HG2 VAL 77 -3.025 -2.929 -1.354
537 HG22 VAL 77 1HG2 VAL 77 -4.469 -2.017 -0.913
538 HG23 VAL 77 2HG2 VAL 77 -3.150 -2.194 0.244
539 H THR 78 H THR 78 -4.362 -4.905 3.599
540 HA THR 78 HA THR 78 -5.065 -7.700 3.098
541 HB THR 78 HB THR 78 -5.025 -6.259 5.753
542 HG1 THR 78 1HG THR 78 -2.927 -6.273 5.388
543 HG21 THR 78 3HG2 THR 78 -4.441 -9.080 5.794
544 HG22 THR 78 1HG2 THR 78 -5.990 -8.781 5.006
545 HG23 THR 78 2HG2 THR 78 -5.704 -8.188 6.642
546 H CYS 79 H CYS 79 -7.099 -8.266 2.729
547 HA CYS 79 HA CYS 79 -9.245 -6.470 3.649
548 HB2 CYS 79 1HB CYS 79 -9.234 -8.361 1.287
549 HB3 CYS 79 2HB CYS 79 -10.595 -7.364 1.784
550 HG CYS 79 HG CYS 79 -9.478 -4.960 1.127
551 H LEU 80 H LEU 80 -9.497 -7.456 5.667
552 HA LEU 80 HA LEU 80 -9.994 -10.293 5.853
553 HB2 LEU 80 1HB LEU 80 -9.909 -8.021 7.794
554 HB3 LEU 80 2HB LEU 80 -10.619 -9.562 8.270
555 HG LEU 80 HG LEU 80 -7.853 -9.492 7.136
556 HD11 LEU 80 1HD1 LEU 80 -7.316 -8.013 8.757
557 HD12 LEU 80 2HD1 LEU 80 -7.329 -9.462 9.761
558 HD13 LEU 80 3HD1 LEU 80 -8.733 -8.397 9.734
559 HD21 LEU 80 3HD2 LEU 80 -7.594 -11.527 8.225
560 HD22 LEU 80 1HD2 LEU 80 -9.266 -11.585 7.668
561 HD23 LEU 80 2HD2 LEU 80 -8.912 -11.205 9.353
562 H TYR 81 H TYR 81 -11.848 -10.807 4.771
563 HA TYR 81 HA TYR 81 -14.231 -9.305 4.822
564 HB2 TYR 81 1HB TYR 81 -14.046 -12.282 4.361
565 HB3 TYR 81 2HB TYR 81 -15.260 -11.169 3.739
566 HD1 TYR 81 2HD TYR 81 -14.257 -9.201 2.255
567 HD2 TYR 81 1HD TYR 81 -12.355 -12.945 2.939
568 HE1 TYR 81 2HE TYR 81 -12.932 -8.896 0.205
569 HE2 TYR 81 1HE TYR 81 -11.024 -12.650 0.892
570 HH TYR 81 HH TYR 81 -10.232 -10.457 -0.487
571 HA PRO 82 HA PRO 82 -16.043 -10.301 8.698
572 HB2 PRO 82 1HB PRO 82 -18.677 -10.162 8.057
573 HB3 PRO 82 2HB PRO 82 -17.647 -8.733 8.199
574 HG2 PRO 82 1HG PRO 82 -18.511 -10.207 5.742
575 HG3 PRO 82 2HG PRO 82 -18.421 -8.459 6.024
576 HD2 PRO 82 1HD PRO 82 -16.517 -9.814 4.656
577 HD3 PRO 82 2HD PRO 82 -16.148 -8.389 5.648
578 H GLY 83 H GLY 83 -17.029 -12.123 5.852
579 HA2 GLY 83 1HA GLY 83 -17.124 -14.548 7.451
580 HA3 GLY 83 2HA GLY 83 -18.644 -14.082 6.701
581 H GLY 84 H GLY 84 -15.215 -14.604 5.879
582 HA2 GLY 84 1HA GLY 84 -15.645 -16.548 3.949
583 HA3 GLY 84 2HA GLY 84 -15.713 -15.005 3.110
584 H GLY 85 H GLY 85 -13.667 -15.986 5.841
585 HA2 GLY 85 1HA GLY 85 -11.382 -16.230 5.998
586 HA3 GLY 85 2HA GLY 85 -11.328 -16.342 4.245
587 H SER 86 H SER 86 -9.620 -15.010 3.859
588 HA SER 86 HA SER 86 -10.123 -12.171 4.128
589 HB2 SER 86 1HB SER 86 -8.204 -11.615 5.394
590 HB3 SER 86 2HB SER 86 -8.930 -12.973 6.254
591 HG SER 86 HG SER 86 -6.537 -12.817 4.876
592 H SER 87 H SER 87 -7.968 -11.002 3.277
593 HA SER 87 HA SER 87 -6.771 -12.505 1.085
594 HB2 SER 87 1HB SER 87 -8.684 -10.234 0.754
595 HB3 SER 87 2HB SER 87 -7.327 -10.359 -0.366
596 HG SER 87 HG SER 87 -8.981 -12.578 0.178
597 H THR 88 H THR 88 -5.177 -11.015 -0.130
598 HA THR 88 HA THR 88 -4.096 -8.788 1.299
599 HB THR 88 HB THR 88 -2.489 -11.350 1.337
600 HG1 THR 88 1HG THR 88 -3.561 -11.600 3.148
601 HG21 THR 88 3HG2 THR 88 -1.725 -8.574 1.498
602 HG22 THR 88 1HG2 THR 88 -0.707 -10.013 1.460
603 HG23 THR 88 2HG2 THR 88 -1.333 -9.415 2.997
604 H LEU 89 H LEU 89 -3.553 -7.513 -0.338
605 HA LEU 89 HA LEU 89 -2.476 -8.705 -2.791
606 HB2 LEU 89 1HB LEU 89 -3.760 -6.061 -2.182
607 HB3 LEU 89 2HB LEU 89 -2.880 -6.343 -3.683
608 HG LEU 89 HG LEU 89 -5.085 -8.208 -2.942
609 HD11 LEU 89 1HD1 LEU 89 -6.571 -6.599 -4.304
610 HD12 LEU 89 2HD1 LEU 89 -5.403 -5.367 -3.828
611 HD13 LEU 89 3HD1 LEU 89 -6.294 -6.260 -2.596
612 HD21 LEU 89 3HD2 LEU 89 -4.323 -8.963 -4.913
613 HD22 LEU 89 1HD2 LEU 89 -3.534 -7.435 -5.308
614 HD23 LEU 89 2HD2 LEU 89 -5.263 -7.634 -5.594
615 H THR 90 H THR 90 -0.346 -8.733 -2.995
616 HA THR 90 HA THR 90 1.255 -6.710 -1.596
617 HB THR 90 HB THR 90 3.185 -8.235 -2.084
618 HG1 THR 90 1HG THR 90 1.685 -9.320 -3.805
619 HG21 THR 90 3HG2 THR 90 1.851 -10.181 -0.634
620 HG22 THR 90 1HG2 THR 90 0.959 -8.704 -0.273
621 HG23 THR 90 2HG2 THR 90 2.695 -8.783 0.030
622 H GLY 91 H GLY 91 2.208 -5.124 -2.695
623 HA2 GLY 91 1HA GLY 91 2.831 -5.548 -5.540
624 HA3 GLY 91 2HA GLY 91 1.900 -4.137 -5.060
625 H ARG 92 H ARG 92 3.639 -2.921 -6.073
626 HA ARG 92 HA ARG 92 5.595 -2.115 -4.121
627 HB2 ARG 92 1HB ARG 92 6.490 -3.332 -6.740
628 HB3 ARG 92 2HB ARG 92 7.536 -2.437 -5.645
629 HG2 ARG 92 1HG ARG 92 7.131 -4.112 -3.902
630 HG3 ARG 92 2HG ARG 92 6.113 -5.017 -5.025
631 HD2 ARG 92 1HD ARG 92 8.046 -5.251 -6.539
632 HD3 ARG 92 2HD ARG 92 9.049 -4.412 -5.357
633 HE ARG 92 HE ARG 92 8.135 -7.145 -5.240
634 HH11 ARG 92 1HH1 ARG 92 9.367 -4.429 -3.445
635 HH12 ARG 92 2HH1 ARG 92 9.985 -5.399 -2.149
636 HH21 ARG 92 1HH2 ARG 92 8.943 -8.433 -3.540
637 HH22 ARG 92 2HH2 ARG 92 9.744 -7.677 -2.205
638 H VAL 93 H VAL 93 5.918 0.014 -4.273
639 HA VAL 93 HA VAL 93 5.382 1.337 -6.848
640 HB VAL 93 HB VAL 93 3.444 1.743 -5.479
641 HG11 VAL 93 1HG1 VAL 93 4.629 3.280 -3.349
642 HG12 VAL 93 2HG1 VAL 93 3.505 1.923 -3.263
643 HG13 VAL 93 3HG1 VAL 93 5.242 1.627 -3.348
644 HG21 VAL 93 3HG2 VAL 93 4.128 4.355 -4.973
645 HG22 VAL 93 1HG2 VAL 93 5.289 3.877 -6.212
646 HG23 VAL 93 2HG2 VAL 93 3.559 3.721 -6.518
647 H THR 94 H THR 94 7.022 2.543 -7.521
648 HA THR 94 HA THR 94 9.210 3.132 -5.695
649 HB THR 94 HB THR 94 8.991 3.567 -8.681
650 HG1 THR 94 1HG THR 94 9.062 1.353 -8.034
651 HG21 THR 94 3HG2 THR 94 10.645 4.950 -7.115
652 HG22 THR 94 1HG2 THR 94 11.126 4.374 -8.710
653 HG23 THR 94 2HG2 THR 94 11.601 3.476 -7.268
654 H THR 95 H THR 95 8.947 4.911 -4.497
655 HA THR 95 HA THR 95 7.329 7.101 -5.080
656 HB THR 95 HB THR 95 8.904 8.329 -3.426
657 HG1 THR 95 1HG THR 95 10.571 7.230 -2.724
658 HG21 THR 95 3HG2 THR 95 7.959 6.037 -1.925
659 HG22 THR 95 1HG2 THR 95 6.762 6.586 -3.097
660 HG23 THR 95 2HG2 THR 95 7.399 7.709 -1.895
661 H LYS 96 H LYS 96 7.908 9.298 -5.608
662 HA LYS 96 HA LYS 96 9.726 9.421 -7.834
663 HB2 LYS 96 1HB LYS 96 8.193 11.677 -6.534
664 HB3 LYS 96 2HB LYS 96 8.913 11.679 -8.138
665 HG2 LYS 96 1HG LYS 96 7.335 9.644 -8.542
666 HG3 LYS 96 2HG LYS 96 6.448 10.312 -7.170
667 HD2 LYS 96 1HD LYS 96 5.925 12.270 -8.299
668 HD3 LYS 96 2HD LYS 96 7.252 12.079 -9.448
669 HE2 LYS 96 1HE LYS 96 6.105 10.321 -10.586
670 HE3 LYS 96 2HE LYS 96 4.865 10.244 -9.335
671 HZ1 LYS 96 3HZ LYS 96 4.476 12.700 -10.004
672 HZ2 LYS 96 1HZ LYS 96 3.833 11.463 -10.964
673 HZ3 LYS 96 2HZ LYS 96 5.247 12.257 -11.443
674 H LYS 97 H LYS 97 11.242 11.343 -8.008
675 HA LYS 97 HA LYS 97 13.116 11.204 -5.847
676 HB2 LYS 97 1HB LYS 97 13.034 12.539 -8.520
677 HB3 LYS 97 2HB LYS 97 14.225 13.075 -7.342
678 HG2 LYS 97 1HG LYS 97 15.330 11.478 -8.641
679 HG3 LYS 97 2HG LYS 97 14.905 10.634 -7.150
680 HD2 LYS 97 1HD LYS 97 14.318 9.117 -8.819
681 HD3 LYS 97 2HD LYS 97 12.787 9.902 -8.422
682 HE2 LYS 97 1HE LYS 97 14.453 11.085 -10.581
683 HE3 LYS 97 2HE LYS 97 13.595 9.584 -10.925
684 HZ1 LYS 97 3HZ LYS 97 11.960 11.017 -11.464
685 HZ2 LYS 97 1HZ LYS 97 12.549 12.259 -10.477
686 HZ3 LYS 97 2HZ LYS 97 11.654 10.994 -9.800
687 H ALA 98 H ALA 98 13.513 12.639 -4.258
688 HA ALA 98 HA ALA 98 11.570 14.698 -3.759
689 HB1 ALA 98 3HB ALA 98 12.857 15.077 -1.685
690 HB2 ALA 98 1HB ALA 98 12.397 13.389 -1.908
691 HB3 ALA 98 2HB ALA 98 14.051 13.905 -2.240
692 HA PRO 99 HA PRO 99 13.696 18.070 -5.638
693 HB2 PRO 99 1HB PRO 99 12.539 20.104 -4.261
694 HB3 PRO 99 2HB PRO 99 11.695 19.194 -5.520
695 HG2 PRO 99 1HG PRO 99 11.550 18.892 -2.545
696 HG3 PRO 99 2HG PRO 99 10.238 18.866 -3.738
697 HD2 PRO 99 1HD PRO 99 11.279 16.607 -2.668
698 HD3 PRO 99 2HD PRO 99 10.646 16.675 -4.325
699 H SER 100 H SER 100 13.761 17.507 -2.205
700 HA SER 100 HA SER 100 15.087 18.383 -0.524
701 HB2 SER 100 1HB SER 100 16.975 17.446 -2.684
702 HB3 SER 100 2HB SER 100 17.545 17.960 -1.096
703 HG SER 100 HG SER 100 16.190 15.668 -1.841
704 HA PRO 101 HA PRO 101 15.803 22.478 -2.767
705 HB2 PRO 101 1HB PRO 101 13.839 23.872 -1.514
706 HB3 PRO 101 2HB PRO 101 13.575 22.981 -3.017
707 HG2 PRO 101 1HG PRO 101 12.943 22.179 -0.203
708 HG3 PRO 101 2HG PRO 101 11.962 21.988 -1.668
709 HD2 PRO 101 1HD PRO 101 13.402 19.956 -0.604
710 HD3 PRO 101 2HD PRO 101 13.118 20.114 -2.350
711 H SER 102 H SER 102 15.719 24.732 -1.396
712 HA SER 102 HA SER 102 17.469 24.207 0.889
713 HB2 SER 102 1HB SER 102 18.241 25.718 -0.952
714 HB3 SER 102 2HB SER 102 16.947 26.835 -0.519
715 HG SER 102 HG SER 102 18.626 25.991 1.531
716 H SER 103 H SER 103 15.701 23.610 2.289
717 HA SER 103 HA SER 103 14.422 25.971 3.474
718 HB2 SER 103 1HB SER 103 13.008 23.349 2.930
719 HB3 SER 103 2HB SER 103 12.319 24.738 3.769
720 HG SER 103 HG SER 103 12.877 25.896 1.720
721 H GLY 104 H GLY 104 14.961 26.112 5.543
722 HA2 GLY 104 1HA GLY 104 14.737 23.951 7.366
723 HA3 GLY 104 2HA GLY 104 16.425 24.217 6.955
724 HA PRO 105 HA PRO 105 16.618 27.227 10.145
725 HB2 PRO 105 1HB PRO 105 18.724 28.695 9.261
726 HB3 PRO 105 2HB PRO 105 18.902 27.077 9.952
727 HG2 PRO 105 1HG PRO 105 18.846 27.914 7.078
728 HG3 PRO 105 2HG PRO 105 19.913 26.749 7.884
729 HD2 PRO 105 1HD PRO 105 17.771 25.988 6.412
730 HD3 PRO 105 2HD PRO 105 18.333 25.071 7.825
731 H SER 106 H SER 106 15.725 27.939 6.980
732 HA SER 106 HA SER 106 15.729 30.743 6.940
733 HB2 SER 106 1HB SER 106 13.773 28.865 5.592
734 HB3 SER 106 2HB SER 106 14.063 30.549 5.154
735 HG SER 106 HG SER 106 15.385 28.376 4.357
736 H SER 107 H SER 107 13.653 32.066 6.869
737 HA SER 107 HA SER 107 12.004 31.353 9.205
738 HB2 SER 107 1HB SER 107 13.318 33.319 9.678
739 HB3 SER 107 2HB SER 107 12.832 34.068 8.157
740 HG SER 107 HG SER 107 10.790 33.298 9.876
741 H GLY 108 H GLY 108 9.839 31.270 8.995
742 HA2 GLY 108 1HA GLY 108 7.941 32.486 7.757
743 HA3 GLY 108 2HA GLY 108 8.746 31.861 6.325
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -7.282 -32.630 -12.261
2 HA2 GLY 1 1HA GLY 1 -7.262 -32.624 -9.644
3 HA3 GLY 1 2HA GLY 1 -6.132 -31.580 -10.493
4 H SER 2 H SER 2 -8.249 -31.621 -8.035
5 HA SER 2 HA SER 2 -8.593 -28.720 -8.147
6 HB2 SER 2 1HB SER 2 -10.716 -29.474 -8.967
7 HB3 SER 2 2HB SER 2 -10.832 -30.704 -7.709
8 HG SER 2 HG SER 2 -11.834 -28.337 -7.591
9 H SER 3 H SER 3 -8.685 -27.712 -6.138
10 HA SER 3 HA SER 3 -7.840 -27.462 -4.013
11 HB2 SER 3 1HB SER 3 -10.278 -28.043 -3.745
12 HB3 SER 3 2HB SER 3 -9.784 -29.709 -3.441
13 HG SER 3 HG SER 3 -9.121 -27.409 -1.919
14 H GLY 4 H GLY 4 -6.115 -29.056 -5.481
15 HA2 GLY 4 1HA GLY 4 -5.426 -31.287 -3.697
16 HA3 GLY 4 2HA GLY 4 -4.813 -31.052 -5.327
17 H SER 5 H SER 5 -4.927 -28.931 -2.469
18 HA SER 5 HA SER 5 -3.305 -27.761 -1.383
19 HB2 SER 5 1HB SER 5 -1.728 -30.144 -2.338
20 HB3 SER 5 2HB SER 5 -0.966 -28.846 -1.419
21 HG SER 5 HG SER 5 -2.887 -30.716 -0.616
22 H SER 6 H SER 6 -3.990 -26.826 -3.889
23 HA SER 6 HA SER 6 -1.614 -25.334 -4.567
24 HB2 SER 6 1HB SER 6 -2.906 -27.201 -6.564
25 HB3 SER 6 2HB SER 6 -1.836 -25.877 -7.027
26 HG SER 6 HG SER 6 -0.325 -26.930 -5.453
27 H GLY 7 H GLY 7 -2.159 -23.763 -6.443
28 HA2 GLY 7 1HA GLY 7 -3.823 -22.472 -7.573
29 HA3 GLY 7 2HA GLY 7 -5.000 -23.010 -6.383
30 H LEU 8 H LEU 8 -2.127 -20.984 -6.805
31 HA LEU 8 HA LEU 8 -3.149 -19.256 -4.648
32 HB2 LEU 8 1HB LEU 8 -0.292 -19.868 -5.383
33 HB3 LEU 8 2HB LEU 8 -0.776 -18.606 -4.252
34 HG LEU 8 HG LEU 8 -1.970 -20.671 -3.070
35 HD11 LEU 8 1HD1 LEU 8 0.358 -21.883 -4.550
36 HD12 LEU 8 2HD1 LEU 8 -1.342 -22.330 -4.693
37 HD13 LEU 8 3HD1 LEU 8 -0.473 -22.638 -3.189
38 HD21 LEU 8 3HD2 LEU 8 -0.418 -20.389 -1.454
39 HD22 LEU 8 1HD2 LEU 8 0.084 -19.045 -2.479
40 HD23 LEU 8 2HD2 LEU 8 0.937 -20.586 -2.567
41 H ALA 9 H ALA 9 -4.146 -17.678 -5.779
42 HA ALA 9 HA ALA 9 -2.468 -15.940 -7.392
43 HB1 ALA 9 3HB ALA 9 -3.232 -16.607 -9.365
44 HB2 ALA 9 1HB ALA 9 -4.303 -17.775 -8.590
45 HB3 ALA 9 2HB ALA 9 -4.855 -16.123 -8.875
46 HA PRO 10 HA PRO 10 -4.836 -12.862 -5.320
47 HB2 PRO 10 1HB PRO 10 -4.373 -10.762 -6.977
48 HB3 PRO 10 2HB PRO 10 -3.149 -11.404 -5.874
49 HG2 PRO 10 1HG PRO 10 -3.505 -11.900 -8.804
50 HG3 PRO 10 2HG PRO 10 -2.014 -11.595 -7.894
51 HD2 PRO 10 1HD PRO 10 -2.777 -14.081 -8.647
52 HD3 PRO 10 2HD PRO 10 -1.872 -13.772 -7.152
53 HA PRO 11 HA PRO 11 -8.803 -12.771 -7.254
54 HB2 PRO 11 1HB PRO 11 -9.920 -10.750 -5.828
55 HB3 PRO 11 2HB PRO 11 -9.648 -12.362 -5.157
56 HG2 PRO 11 1HG PRO 11 -8.010 -9.877 -4.839
57 HG3 PRO 11 2HG PRO 11 -8.469 -11.078 -3.618
58 HD2 PRO 11 1HD PRO 11 -6.025 -11.045 -4.784
59 HD3 PRO 11 2HD PRO 11 -6.813 -12.548 -4.261
60 H ARG 12 H ARG 12 -7.136 -9.668 -6.782
61 HA ARG 12 HA ARG 12 -7.909 -8.889 -9.489
62 HB2 ARG 12 1HB ARG 12 -8.567 -7.356 -6.986
63 HB3 ARG 12 2HB ARG 12 -8.387 -6.541 -8.534
64 HG2 ARG 12 1HG ARG 12 -10.252 -8.861 -8.207
65 HG3 ARG 12 2HG ARG 12 -10.737 -7.218 -7.784
66 HD2 ARG 12 1HD ARG 12 -10.330 -6.463 -10.029
67 HD3 ARG 12 2HD ARG 12 -9.646 -8.026 -10.474
68 HE ARG 12 HE ARG 12 -12.313 -8.299 -9.534
69 HH11 ARG 12 1HH1 ARG 12 -10.431 -7.312 -12.292
70 HH12 ARG 12 2HH1 ARG 12 -11.678 -7.679 -13.438
71 HH21 ARG 12 1HH2 ARG 12 -13.962 -8.786 -11.033
72 HH22 ARG 12 2HH2 ARG 12 -13.686 -8.516 -12.721
73 H HIS 13 H HIS 13 -6.866 -6.506 -9.797
74 HA HIS 13 HA HIS 13 -4.046 -6.836 -9.025
75 HB2 HIS 13 1HB HIS 13 -5.379 -5.728 -11.467
76 HB3 HIS 13 2HB HIS 13 -3.771 -5.160 -11.028
77 HD1 HIS 13 1HD HIS 13 -5.315 -8.645 -11.165
78 HD2 HIS 13 2HD HIS 13 -1.993 -6.541 -12.506
79 HE1 HIS 13 1HE HIS 13 -3.916 -10.322 -12.412
80 HE2 HIS 13 2HE HIS 13 -1.870 -9.045 -13.140
81 H LEU 14 H LEU 14 -2.818 -4.979 -8.454
82 HA LEU 14 HA LEU 14 -4.419 -2.959 -7.090
83 HB2 LEU 14 1HB LEU 14 -1.633 -3.967 -6.867
84 HB3 LEU 14 2HB LEU 14 -1.956 -2.312 -6.355
85 HG LEU 14 HG LEU 14 -3.511 -4.647 -5.274
86 HD11 LEU 14 1HD1 LEU 14 -1.467 -5.323 -4.526
87 HD12 LEU 14 2HD1 LEU 14 -1.872 -4.163 -3.262
88 HD13 LEU 14 3HD1 LEU 14 -0.786 -3.696 -4.570
89 HD21 LEU 14 3HD2 LEU 14 -4.109 -3.157 -3.530
90 HD22 LEU 14 1HD2 LEU 14 -4.344 -2.279 -5.042
91 HD23 LEU 14 2HD2 LEU 14 -2.921 -1.961 -4.049
92 H GLY 15 H GLY 15 -3.382 -0.689 -7.062
93 HA2 GLY 15 1HA GLY 15 -2.120 0.063 -9.574
94 HA3 GLY 15 2HA GLY 15 -3.752 0.668 -9.331
95 H PHE 16 H PHE 16 -0.946 1.899 -9.436
96 HA PHE 16 HA PHE 16 -1.181 3.444 -6.937
97 HB2 PHE 16 1HB PHE 16 1.306 2.815 -8.541
98 HB3 PHE 16 2HB PHE 16 1.256 3.889 -7.147
99 HD1 PHE 16 1HD PHE 16 0.237 2.818 -4.971
100 HD2 PHE 16 2HD PHE 16 1.881 0.616 -8.221
101 HE1 PHE 16 1HE PHE 16 0.606 0.897 -3.478
102 HE2 PHE 16 2HE PHE 16 2.253 -1.308 -6.734
103 HZ PHE 16 HZ PHE 16 1.614 -1.170 -4.360
104 H SER 17 H SER 17 -1.790 5.477 -7.211
105 HA SER 17 HA SER 17 -0.974 6.899 -9.646
106 HB2 SER 17 1HB SER 17 -3.751 6.458 -8.633
107 HB3 SER 17 2HB SER 17 -3.370 8.005 -9.390
108 HG SER 17 HG SER 17 -4.060 5.913 -10.658
109 H ASP 18 H ASP 18 -1.094 9.247 -9.445
110 HA ASP 18 HA ASP 18 -0.510 11.175 -8.386
111 HB2 ASP 18 1HB ASP 18 -2.897 10.568 -7.438
112 HB3 ASP 18 2HB ASP 18 -2.004 10.329 -5.938
113 H VAL 19 H VAL 19 1.101 8.713 -7.956
114 HA VAL 19 HA VAL 19 2.074 8.573 -5.329
115 HB VAL 19 HB VAL 19 3.517 7.967 -7.913
116 HG11 VAL 19 1HG1 VAL 19 4.735 6.368 -6.209
117 HG12 VAL 19 2HG1 VAL 19 5.266 8.036 -6.438
118 HG13 VAL 19 3HG1 VAL 19 4.259 7.611 -5.053
119 HG21 VAL 19 3HG2 VAL 19 1.866 6.267 -6.054
120 HG22 VAL 19 1HG2 VAL 19 1.567 6.613 -7.757
121 HG23 VAL 19 2HG2 VAL 19 2.935 5.603 -7.289
122 H SER 20 H SER 20 3.798 9.532 -4.291
123 HA SER 20 HA SER 20 5.048 11.822 -5.655
124 HB2 SER 20 1HB SER 20 3.601 11.727 -3.054
125 HB3 SER 20 2HB SER 20 5.039 12.743 -3.145
126 HG SER 20 HG SER 20 2.582 13.212 -4.111
127 H HIS 21 H HIS 21 6.851 12.661 -3.909
128 HA HIS 21 HA HIS 21 8.699 10.422 -3.755
129 HB2 HIS 21 1HB HIS 21 10.338 12.254 -3.106
130 HB3 HIS 21 2HB HIS 21 9.648 12.370 -4.722
131 HD1 HIS 21 1HD HIS 21 8.191 14.395 -5.239
132 HD2 HIS 21 2HD HIS 21 9.432 14.225 -1.277
133 HE1 HIS 21 1HE HIS 21 7.603 16.633 -4.253
134 HE2 HIS 21 2HE HIS 21 8.440 16.537 -1.879
135 H ASP 22 H ASP 22 6.486 11.886 -1.735
136 HA ASP 22 HA ASP 22 7.853 10.802 0.633
137 HB2 ASP 22 1HB ASP 22 6.821 12.689 1.952
138 HB3 ASP 22 2HB ASP 22 8.108 13.169 0.848
139 H ALA 23 H ALA 23 5.491 10.185 -1.332
140 HA ALA 23 HA ALA 23 3.931 8.756 0.554
141 HB1 ALA 23 3HB ALA 23 2.851 11.359 -0.449
142 HB2 ALA 23 1HB ALA 23 1.762 10.023 -0.078
143 HB3 ALA 23 2HB ALA 23 2.810 10.683 1.179
144 H ALA 24 H ALA 24 1.976 7.742 -0.523
145 HA ALA 24 HA ALA 24 1.940 7.693 -3.401
146 HB1 ALA 24 3HB ALA 24 2.880 5.239 -1.920
147 HB2 ALA 24 1HB ALA 24 2.517 5.332 -3.643
148 HB3 ALA 24 2HB ALA 24 3.863 6.254 -2.975
149 H ARG 25 H ARG 25 -0.090 7.359 -4.021
150 HA ARG 25 HA ARG 25 -2.015 6.365 -2.075
151 HB2 ARG 25 1HB ARG 25 -2.431 8.454 -3.397
152 HB3 ARG 25 2HB ARG 25 -2.527 7.459 -4.844
153 HG2 ARG 25 1HG ARG 25 -4.436 6.263 -3.897
154 HG3 ARG 25 2HG ARG 25 -4.341 7.265 -2.448
155 HD2 ARG 25 1HD ARG 25 -6.005 8.285 -3.725
156 HD3 ARG 25 2HD ARG 25 -4.569 9.255 -4.049
157 HE ARG 25 HE ARG 25 -4.496 7.495 -6.060
158 HH11 ARG 25 1HH1 ARG 25 -7.090 9.442 -4.794
159 HH12 ARG 25 2HH1 ARG 25 -7.902 9.583 -6.318
160 HH21 ARG 25 1HH2 ARG 25 -5.556 7.674 -8.072
161 HH22 ARG 25 2HH2 ARG 25 -7.030 8.576 -8.181
162 H VAL 26 H VAL 26 -2.734 4.345 -2.071
163 HA VAL 26 HA VAL 26 -2.307 2.699 -4.475
164 HB VAL 26 HB VAL 26 -1.076 1.759 -2.680
165 HG11 VAL 26 1HG1 VAL 26 -2.863 1.092 -0.662
166 HG12 VAL 26 2HG1 VAL 26 -1.624 2.348 -0.604
167 HG13 VAL 26 3HG1 VAL 26 -3.273 2.755 -1.083
168 HG21 VAL 26 3HG2 VAL 26 -1.768 -0.342 -3.014
169 HG22 VAL 26 1HG2 VAL 26 -3.340 -0.034 -2.277
170 HG23 VAL 26 2HG2 VAL 26 -3.065 0.373 -3.970
171 H PHE 27 H PHE 27 -3.997 1.786 -5.475
172 HA PHE 27 HA PHE 27 -6.587 1.711 -4.094
173 HB2 PHE 27 1HB PHE 27 -7.746 2.618 -5.985
174 HB3 PHE 27 2HB PHE 27 -6.429 3.721 -5.597
175 HD1 PHE 27 2HD PHE 27 -7.438 0.994 -7.890
176 HD2 PHE 27 1HD PHE 27 -4.811 4.270 -7.192
177 HE1 PHE 27 2HE PHE 27 -6.629 0.836 -10.209
178 HE2 PHE 27 1HE PHE 27 -3.999 4.117 -9.510
179 HZ PHE 27 HZ PHE 27 -4.907 2.397 -11.021
180 H TRP 28 H TRP 28 -7.992 0.067 -4.748
181 HA TRP 28 HA TRP 28 -6.854 -1.920 -6.599
182 HB2 TRP 28 1HB TRP 28 -8.011 -3.636 -5.052
183 HB3 TRP 28 2HB TRP 28 -6.486 -2.933 -4.521
184 HD1 TRP 28 HD TRP 28 -10.058 -3.346 -3.490
185 HE1 TRP 28 1HE TRP 28 -10.468 -2.136 -1.255
186 HE3 TRP 28 3HE TRP 28 -5.694 -0.700 -3.186
187 HZ2 TRP 28 2HZ TRP 28 -9.121 -0.302 0.415
188 HZ3 TRP 28 3HZ TRP 28 -5.333 0.759 -1.238
189 HH2 TRP 28 HH TRP 28 -7.012 0.953 0.524
190 H GLU 29 H GLU 29 -8.528 -3.501 -7.378
191 HA GLU 29 HA GLU 29 -10.884 -2.011 -8.199
192 HB2 GLU 29 1HB GLU 29 -9.940 -4.761 -9.028
193 HB3 GLU 29 2HB GLU 29 -11.249 -3.854 -9.771
194 HG2 GLU 29 1HG GLU 29 -8.416 -2.861 -9.669
195 HG3 GLU 29 2HG GLU 29 -9.057 -3.829 -10.995
196 H GLY 30 H GLY 30 -10.365 -3.374 -5.461
197 HA2 GLY 30 1HA GLY 30 -11.887 -4.072 -3.851
198 HA3 GLY 30 2HA GLY 30 -13.103 -4.227 -5.110
199 H ALA 31 H ALA 31 -13.188 -6.149 -3.330
200 HA ALA 31 HA ALA 31 -11.798 -8.429 -4.582
201 HB1 ALA 31 3HB ALA 31 -12.030 -9.557 -2.357
202 HB2 ALA 31 1HB ALA 31 -10.942 -8.169 -2.375
203 HB3 ALA 31 2HB ALA 31 -12.564 -8.010 -1.699
204 HA PRO 32 HA PRO 32 -15.710 -10.180 -5.546
205 HB2 PRO 32 1HB PRO 32 -15.112 -12.826 -5.430
206 HB3 PRO 32 2HB PRO 32 -14.558 -11.772 -6.736
207 HG2 PRO 32 1HG PRO 32 -13.084 -12.712 -4.306
208 HG3 PRO 32 2HG PRO 32 -12.516 -12.590 -5.981
209 HD2 PRO 32 1HD PRO 32 -11.915 -10.736 -4.101
210 HD3 PRO 32 2HD PRO 32 -12.122 -10.325 -5.815
211 H ARG 33 H ARG 33 -14.307 -10.461 -2.503
212 HA ARG 33 HA ARG 33 -16.728 -11.751 -1.425
213 HB2 ARG 33 1HB ARG 33 -15.228 -12.360 0.542
214 HB3 ARG 33 2HB ARG 33 -14.958 -13.238 -0.957
215 HG2 ARG 33 1HG ARG 33 -13.349 -10.792 -0.478
216 HG3 ARG 33 2HG ARG 33 -12.969 -12.237 0.461
217 HD2 ARG 33 1HD ARG 33 -12.896 -11.855 -2.514
218 HD3 ARG 33 2HD ARG 33 -11.600 -12.376 -1.438
219 HE ARG 33 HE ARG 33 -13.556 -14.029 -2.683
220 HH11 ARG 33 1HH1 ARG 33 -11.618 -13.676 0.187
221 HH12 ARG 33 2HH1 ARG 33 -11.605 -15.371 0.545
222 HH21 ARG 33 1HH2 ARG 33 -13.547 -16.263 -2.223
223 HH22 ARG 33 2HH2 ARG 33 -12.702 -16.842 -0.827
224 HA PRO 34 HA PRO 34 -17.535 -8.100 0.878
225 HB2 PRO 34 1HB PRO 34 -18.756 -9.142 3.068
226 HB3 PRO 34 2HB PRO 34 -19.528 -9.073 1.479
227 HG2 PRO 34 1HG PRO 34 -18.153 -11.370 2.818
228 HG3 PRO 34 2HG PRO 34 -19.670 -11.356 1.899
229 HD2 PRO 34 1HD PRO 34 -17.327 -12.193 0.830
230 HD3 PRO 34 2HD PRO 34 -18.585 -11.393 -0.134
231 H VAL 35 H VAL 35 -16.592 -6.820 2.396
232 HA VAL 35 HA VAL 35 -14.862 -8.091 4.406
233 HB VAL 35 HB VAL 35 -13.237 -7.442 2.873
234 HG11 VAL 35 1HG1 VAL 35 -15.196 -5.401 2.138
235 HG12 VAL 35 2HG1 VAL 35 -13.525 -4.834 2.103
236 HG13 VAL 35 3HG1 VAL 35 -14.002 -6.238 1.146
237 HG21 VAL 35 3HG2 VAL 35 -12.045 -5.626 3.884
238 HG22 VAL 35 1HG2 VAL 35 -13.529 -4.973 4.577
239 HG23 VAL 35 2HG2 VAL 35 -12.884 -6.507 5.160
240 H ARG 36 H ARG 36 -14.777 -7.092 6.376
241 HA ARG 36 HA ARG 36 -16.719 -4.942 6.793
242 HB2 ARG 36 1HB ARG 36 -16.745 -5.576 9.097
243 HB3 ARG 36 2HB ARG 36 -16.836 -7.053 8.147
244 HG2 ARG 36 1HG ARG 36 -14.424 -7.398 8.498
245 HG3 ARG 36 2HG ARG 36 -14.389 -5.954 9.512
246 HD2 ARG 36 1HD ARG 36 -16.258 -7.132 10.850
247 HD3 ARG 36 2HD ARG 36 -15.716 -8.591 10.023
248 HE ARG 36 HE ARG 36 -13.468 -7.374 11.113
249 HH11 ARG 36 1HH1 ARG 36 -16.421 -8.853 12.214
250 HH12 ARG 36 2HH1 ARG 36 -15.744 -9.394 13.715
251 HH21 ARG 36 1HH2 ARG 36 -12.565 -8.081 13.085
252 HH22 ARG 36 2HH2 ARG 36 -13.551 -8.953 14.209
253 H LEU 37 H LEU 37 -13.322 -5.615 6.908
254 HA LEU 37 HA LEU 37 -12.781 -2.804 7.409
255 HB2 LEU 37 1HB LEU 37 -12.809 -3.933 9.632
256 HB3 LEU 37 2HB LEU 37 -11.480 -4.949 9.078
257 HG LEU 37 HG LEU 37 -10.110 -2.881 8.799
258 HD11 LEU 37 1HD1 LEU 37 -10.893 -0.818 9.185
259 HD12 LEU 37 2HD1 LEU 37 -11.846 -1.330 10.577
260 HD13 LEU 37 3HD1 LEU 37 -12.479 -1.553 8.946
261 HD21 LEU 37 3HD2 LEU 37 -9.513 -3.944 10.724
262 HD22 LEU 37 1HD2 LEU 37 -11.143 -3.889 11.395
263 HD23 LEU 37 2HD2 LEU 37 -10.133 -2.442 11.411
264 H VAL 38 H VAL 38 -10.541 -2.219 6.947
265 HA VAL 38 HA VAL 38 -9.131 -4.186 5.274
266 HB VAL 38 HB VAL 38 -9.538 -1.277 4.564
267 HG11 VAL 38 1HG1 VAL 38 -8.495 -2.113 2.372
268 HG12 VAL 38 2HG1 VAL 38 -7.423 -1.839 3.747
269 HG13 VAL 38 3HG1 VAL 38 -7.920 -3.479 3.327
270 HG21 VAL 38 3HG2 VAL 38 -11.252 -1.857 3.241
271 HG22 VAL 38 1HG2 VAL 38 -10.456 -3.336 2.701
272 HG23 VAL 38 2HG2 VAL 38 -11.331 -3.313 4.232
273 H ARG 39 H ARG 39 -7.051 -4.400 5.779
274 HA ARG 39 HA ARG 39 -5.735 -2.213 7.250
275 HB2 ARG 39 1HB ARG 39 -5.970 -5.085 7.877
276 HB3 ARG 39 2HB ARG 39 -4.355 -4.414 8.057
277 HG2 ARG 39 1HG ARG 39 -5.587 -2.547 9.398
278 HG3 ARG 39 2HG ARG 39 -6.851 -3.770 9.550
279 HD2 ARG 39 1HD ARG 39 -5.061 -5.340 10.386
280 HD3 ARG 39 2HD ARG 39 -3.989 -3.943 10.465
281 HE ARG 39 HE ARG 39 -6.195 -4.553 12.233
282 HH11 ARG 39 1HH1 ARG 39 -3.966 -2.142 11.078
283 HH12 ARG 39 2HH1 ARG 39 -4.126 -1.135 12.478
284 HH21 ARG 39 1HH2 ARG 39 -6.414 -3.236 14.083
285 HH22 ARG 39 2HH2 ARG 39 -5.518 -1.758 14.188
286 H VAL 40 H VAL 40 -4.155 -1.349 6.093
287 HA VAL 40 HA VAL 40 -2.757 -3.025 4.120
288 HB VAL 40 HB VAL 40 -2.633 -0.023 4.198
289 HG11 VAL 40 1HG1 VAL 40 -2.466 -0.634 1.631
290 HG12 VAL 40 2HG1 VAL 40 -1.056 -0.699 2.691
291 HG13 VAL 40 3HG1 VAL 40 -1.922 -2.180 2.282
292 HG21 VAL 40 3HG2 VAL 40 -4.879 -0.079 3.914
293 HG22 VAL 40 1HG2 VAL 40 -4.427 -0.449 2.250
294 HG23 VAL 40 2HG2 VAL 40 -4.876 -1.751 3.352
295 H THR 41 H THR 41 -0.495 -2.951 3.959
296 HA THR 41 HA THR 41 0.963 -1.600 6.109
297 HB THR 41 HB THR 41 2.360 -3.770 6.315
298 HG1 THR 41 1HG THR 41 0.998 -5.653 5.970
299 HG21 THR 41 3HG2 THR 41 -0.161 -4.434 7.586
300 HG22 THR 41 1HG2 THR 41 0.233 -2.725 7.764
301 HG23 THR 41 2HG2 THR 41 1.373 -3.955 8.312
302 H TYR 42 H TYR 42 2.498 -0.436 5.173
303 HA TYR 42 HA TYR 42 3.714 -1.437 2.685
304 HB2 TYR 42 1HB TYR 42 4.391 1.013 2.399
305 HB3 TYR 42 2HB TYR 42 2.684 0.632 2.205
306 HD1 TYR 42 2HD TYR 42 1.117 1.099 4.138
307 HD2 TYR 42 1HD TYR 42 5.108 2.570 4.013
308 HE1 TYR 42 2HE TYR 42 0.544 2.782 5.838
309 HE2 TYR 42 1HE TYR 42 4.546 4.256 5.714
310 HH TYR 42 HH TYR 42 1.545 4.197 7.437
311 H VAL 43 H VAL 43 5.932 -1.462 2.450
312 HA VAL 43 HA VAL 43 7.574 -0.648 4.733
313 HB VAL 43 HB VAL 43 7.135 -3.004 5.133
314 HG11 VAL 43 1HG1 VAL 43 8.017 -4.682 3.466
315 HG12 VAL 43 2HG1 VAL 43 6.551 -3.823 2.988
316 HG13 VAL 43 3HG1 VAL 43 8.111 -3.355 2.308
317 HG21 VAL 43 3HG2 VAL 43 9.928 -2.855 4.041
318 HG22 VAL 43 1HG2 VAL 43 9.440 -1.944 5.470
319 HG23 VAL 43 2HG2 VAL 43 9.345 -3.705 5.472
320 H SER 44 H SER 44 9.808 -0.363 4.237
321 HA SER 44 HA SER 44 10.248 0.667 1.612
322 HB2 SER 44 1HB SER 44 12.505 1.198 2.426
323 HB3 SER 44 2HB SER 44 11.283 1.686 3.600
324 HG SER 44 HG SER 44 13.345 0.116 4.009
325 H SER 45 H SER 45 12.270 0.070 0.372
326 HA SER 45 HA SER 45 12.105 -2.397 -0.751
327 HB2 SER 45 1HB SER 45 14.396 -2.082 -1.578
328 HB3 SER 45 2HB SER 45 13.488 -0.573 -1.662
329 HG SER 45 HG SER 45 15.198 0.147 -0.643
330 H GLU 46 H GLU 46 14.273 -1.506 1.926
331 HA GLU 46 HA GLU 46 14.669 -4.376 2.452
332 HB2 GLU 46 1HB GLU 46 16.725 -3.686 3.665
333 HB3 GLU 46 2HB GLU 46 16.759 -3.281 1.954
334 HG2 GLU 46 1HG GLU 46 15.990 -0.967 2.624
335 HG3 GLU 46 2HG GLU 46 16.343 -1.439 4.286
336 H GLY 47 H GLY 47 14.224 -5.207 4.442
337 HA2 GLY 47 1HA GLY 47 12.274 -4.168 6.045
338 HA3 GLY 47 2HA GLY 47 13.483 -5.305 6.622
339 H GLY 48 H GLY 48 12.275 -2.141 6.837
340 HA2 GLY 48 1HA GLY 48 14.100 -1.528 8.979
341 HA3 GLY 48 2HA GLY 48 14.342 -0.525 7.556
342 H HIS 49 H HIS 49 12.032 0.223 6.656
343 HA HIS 49 HA HIS 49 10.586 1.345 8.966
344 HB2 HIS 49 1HB HIS 49 11.573 3.232 8.067
345 HB3 HIS 49 2HB HIS 49 11.524 2.604 6.422
346 HD1 HIS 49 1HD HIS 49 9.930 3.836 5.010
347 HD2 HIS 49 2HD HIS 49 8.685 3.713 8.972
348 HE1 HIS 49 1HE HIS 49 7.770 5.123 5.077
349 HE2 HIS 49 2HE HIS 49 7.080 5.107 7.499
350 H SER 50 H SER 50 8.673 0.387 9.135
351 HA SER 50 HA SER 50 7.074 0.029 6.691
352 HB2 SER 50 1HB SER 50 6.176 -2.081 7.650
353 HB3 SER 50 2HB SER 50 7.906 -2.169 7.321
354 HG SER 50 HG SER 50 7.091 -1.341 9.861
355 H GLY 51 H GLY 51 4.853 0.335 6.902
356 HA2 GLY 51 1HA GLY 51 3.974 1.408 9.512
357 HA3 GLY 51 2HA GLY 51 3.560 2.193 7.995
358 H GLN 52 H GLN 52 1.396 1.824 9.182
359 HA GLN 52 HA GLN 52 0.034 -0.269 7.792
360 HB2 GLN 52 1HB GLN 52 0.755 -1.702 9.529
361 HB3 GLN 52 2HB GLN 52 0.453 -0.488 10.765
362 HG2 GLN 52 1HG GLN 52 -1.916 -0.731 10.511
363 HG3 GLN 52 2HG GLN 52 -1.700 -1.802 9.128
364 HE21 GLN 52 1HE2 GLN 52 -2.065 -1.602 12.464
365 HE22 GLN 52 2HE2 GLN 52 -1.722 -3.249 12.857
366 H THR 53 H THR 53 -1.921 0.464 7.287
367 HA THR 53 HA THR 53 -3.169 2.468 9.051
368 HB THR 53 HB THR 53 -2.246 3.471 6.944
369 HG1 THR 53 1HG THR 53 -5.040 3.685 6.786
370 HG21 THR 53 3HG2 THR 53 -2.967 1.345 5.615
371 HG22 THR 53 1HG2 THR 53 -3.046 2.926 4.840
372 HG23 THR 53 2HG2 THR 53 -4.512 2.182 5.477
373 H GLU 54 H GLU 54 -5.542 2.652 8.746
374 HA GLU 54 HA GLU 54 -6.721 0.043 8.046
375 HB2 GLU 54 1HB GLU 54 -7.119 1.818 10.398
376 HB3 GLU 54 2HB GLU 54 -8.533 0.983 9.772
377 HG2 GLU 54 1HG GLU 54 -7.327 -1.158 9.999
378 HG3 GLU 54 2HG GLU 54 -5.975 -0.286 10.720
379 H ALA 55 H ALA 55 -8.702 0.021 6.990
380 HA ALA 55 HA ALA 55 -9.986 2.535 6.306
381 HB1 ALA 55 3HB ALA 55 -8.074 1.496 4.580
382 HB2 ALA 55 1HB ALA 55 -9.618 1.012 3.877
383 HB3 ALA 55 2HB ALA 55 -9.291 2.715 4.201
384 HA PRO 56 HA PRO 56 -13.640 0.104 6.335
385 HB2 PRO 56 1HB PRO 56 -15.170 1.384 4.493
386 HB3 PRO 56 2HB PRO 56 -14.815 2.063 6.085
387 HG2 PRO 56 1HG PRO 56 -13.531 2.650 3.446
388 HG3 PRO 56 2HG PRO 56 -14.019 3.775 4.727
389 HD2 PRO 56 1HD PRO 56 -11.454 2.974 4.390
390 HD3 PRO 56 2HD PRO 56 -12.133 3.357 5.985
391 H GLY 57 H GLY 57 -14.539 -1.659 5.357
392 HA2 GLY 57 1HA GLY 57 -13.212 -2.983 3.315
393 HA3 GLY 57 2HA GLY 57 -14.860 -3.331 3.817
394 H ASN 58 H ASN 58 -15.337 -0.340 3.041
395 HA ASN 58 HA ASN 58 -16.137 -0.977 0.317
396 HB2 ASN 58 1HB ASN 58 -17.907 0.069 1.374
397 HB3 ASN 58 2HB ASN 58 -16.860 1.137 2.303
398 HD21 ASN 58 1HD2 ASN 58 -16.923 3.170 1.715
399 HD22 ASN 58 2HD2 ASN 58 -17.283 3.768 0.135
400 H ALA 59 H ALA 59 -13.886 1.066 2.035
401 HA ALA 59 HA ALA 59 -13.215 2.846 -0.027
402 HB1 ALA 59 3HB ALA 59 -12.406 3.523 2.013
403 HB2 ALA 59 1HB ALA 59 -11.850 1.907 2.451
404 HB3 ALA 59 2HB ALA 59 -10.945 2.864 1.277
405 H THR 60 H THR 60 -12.386 2.411 -1.953
406 HA THR 60 HA THR 60 -10.783 -0.025 -2.303
407 HB THR 60 HB THR 60 -11.223 0.190 -4.696
408 HG1 THR 60 1HG THR 60 -12.549 2.576 -3.894
409 HG21 THR 60 3HG2 THR 60 -13.903 0.304 -4.374
410 HG22 THR 60 1HG2 THR 60 -13.397 0.039 -2.707
411 HG23 THR 60 2HG2 THR 60 -12.927 -1.106 -3.964
412 H SER 61 H SER 61 -10.059 2.884 -1.402
413 HA SER 61 HA SER 61 -7.479 2.880 -2.684
414 HB2 SER 61 1HB SER 61 -7.775 5.360 -3.343
415 HB3 SER 61 2HB SER 61 -8.488 4.139 -4.397
416 HG SER 61 HG SER 61 -9.949 5.380 -2.318
417 H ALA 62 H ALA 62 -5.942 3.776 -1.408
418 HA ALA 62 HA ALA 62 -6.733 5.546 0.775
419 HB1 ALA 62 3HB ALA 62 -6.880 3.270 1.692
420 HB2 ALA 62 1HB ALA 62 -5.191 3.000 1.259
421 HB3 ALA 62 2HB ALA 62 -5.609 4.219 2.464
422 H MET 63 H MET 63 -4.881 6.567 1.837
423 HA MET 63 HA MET 63 -2.623 6.841 -0.029
424 HB2 MET 63 1HB MET 63 -3.777 8.764 1.992
425 HB3 MET 63 2HB MET 63 -2.262 9.045 1.146
426 HG2 MET 63 1HG MET 63 -3.794 8.598 -0.968
427 HG3 MET 63 2HG MET 63 -5.046 9.147 0.144
428 HE1 MET 63 3HE MET 63 -1.222 11.425 -0.722
429 HE2 MET 63 1HE MET 63 -1.514 9.689 -0.845
430 HE3 MET 63 2HE MET 63 -1.953 10.754 -2.181
431 H LEU 64 H LEU 64 -0.503 6.865 0.744
432 HA LEU 64 HA LEU 64 -0.166 5.870 3.498
433 HB2 LEU 64 1HB LEU 64 1.691 5.219 1.231
434 HB3 LEU 64 2HB LEU 64 1.562 4.434 2.804
435 HG LEU 64 HG LEU 64 -0.586 4.288 0.696
436 HD11 LEU 64 1HD1 LEU 64 0.875 1.845 1.109
437 HD12 LEU 64 2HD1 LEU 64 1.952 3.131 0.567
438 HD13 LEU 64 3HD1 LEU 64 0.532 2.710 -0.390
439 HD21 LEU 64 3HD2 LEU 64 -0.985 2.138 2.144
440 HD22 LEU 64 1HD2 LEU 64 -1.613 3.702 2.662
441 HD23 LEU 64 2HD2 LEU 64 -0.131 3.067 3.377
442 H GLY 65 H GLY 65 2.113 6.225 4.329
443 HA2 GLY 65 1HA GLY 65 4.146 7.659 3.837
444 HA3 GLY 65 2HA GLY 65 2.976 8.936 3.541
445 HA PRO 66 HA PRO 66 4.744 10.236 4.219
446 HB2 PRO 66 1HB PRO 66 6.987 10.786 5.647
447 HB3 PRO 66 2HB PRO 66 5.515 11.758 5.757
448 HG2 PRO 66 1HG PRO 66 6.504 9.606 7.588
449 HG3 PRO 66 2HG PRO 66 5.783 11.175 7.992
450 HD2 PRO 66 1HD PRO 66 4.376 8.863 8.063
451 HD3 PRO 66 2HD PRO 66 3.634 10.419 7.640
452 H LEU 67 H LEU 67 6.075 9.388 2.721
453 HA LEU 67 HA LEU 67 7.592 6.973 3.452
454 HB2 LEU 67 1HB LEU 67 6.726 7.725 0.676
455 HB3 LEU 67 2HB LEU 67 7.294 6.160 1.255
456 HG LEU 67 HG LEU 67 4.643 7.451 1.896
457 HD11 LEU 67 1HD1 LEU 67 5.560 5.499 -0.112
458 HD12 LEU 67 2HD1 LEU 67 4.200 6.619 -0.151
459 HD13 LEU 67 3HD1 LEU 67 4.065 5.100 0.734
460 HD21 LEU 67 3HD2 LEU 67 4.124 5.607 3.234
461 HD22 LEU 67 1HD2 LEU 67 5.768 6.033 3.710
462 HD23 LEU 67 2HD2 LEU 67 5.489 4.667 2.629
463 H SER 68 H SER 68 9.336 6.645 1.514
464 HA SER 68 HA SER 68 11.053 9.008 1.730
465 HB2 SER 68 1HB SER 68 11.537 6.084 1.428
466 HB3 SER 68 2HB SER 68 12.726 7.184 0.729
467 HG SER 68 HG SER 68 11.840 7.150 3.427
468 H SER 69 H SER 69 12.702 9.008 -0.267
469 HA SER 69 HA SER 69 11.007 9.168 -2.670
470 HB2 SER 69 1HB SER 69 12.688 10.857 -3.468
471 HB3 SER 69 2HB SER 69 11.795 11.353 -2.031
472 HG SER 69 HG SER 69 14.406 10.237 -2.075
473 H SER 70 H SER 70 11.929 8.599 -4.703
474 HA SER 70 HA SER 70 12.913 7.018 -6.034
475 HB2 SER 70 1HB SER 70 14.655 8.777 -5.910
476 HB3 SER 70 2HB SER 70 15.373 7.945 -4.531
477 HG SER 70 HG SER 70 16.419 7.378 -6.471
478 H THR 71 H THR 71 11.900 6.046 -3.475
479 HA THR 71 HA THR 71 13.626 3.674 -3.194
480 HB THR 71 HB THR 71 11.982 4.887 -0.966
481 HG1 THR 71 1HG THR 71 13.628 6.262 -1.012
482 HG21 THR 71 3HG2 THR 71 13.113 2.330 -1.299
483 HG22 THR 71 1HG2 THR 71 12.411 3.016 0.165
484 HG23 THR 71 2HG2 THR 71 14.139 3.182 -0.146
485 H THR 72 H THR 72 12.647 1.726 -3.312
486 HA THR 72 HA THR 72 9.898 1.652 -4.179
487 HB THR 72 HB THR 72 11.824 -0.634 -3.714
488 HG1 THR 72 1HG THR 72 11.693 -0.450 -6.181
489 HG21 THR 72 3HG2 THR 72 9.457 -0.731 -5.537
490 HG22 THR 72 1HG2 THR 72 9.236 -1.003 -3.809
491 HG23 THR 72 2HG2 THR 72 10.310 -2.050 -4.736
492 H TYR 73 H TYR 73 8.156 1.076 -3.024
493 HA TYR 73 HA TYR 73 8.594 0.028 -0.304
494 HB2 TYR 73 1HB TYR 73 6.792 2.200 -1.295
495 HB3 TYR 73 2HB TYR 73 6.283 1.233 0.085
496 HD1 TYR 73 1HD TYR 73 8.883 3.548 -1.151
497 HD2 TYR 73 2HD TYR 73 7.258 1.545 2.233
498 HE1 TYR 73 1HE TYR 73 10.249 4.957 0.331
499 HE2 TYR 73 2HE TYR 73 8.619 2.950 3.725
500 HH TYR 73 HH TYR 73 9.749 5.555 3.276
501 H THR 74 H THR 74 7.618 -1.831 0.159
502 HA THR 74 HA THR 74 5.903 -3.061 -1.828
503 HB THR 74 HB THR 74 6.814 -4.206 0.817
504 HG1 THR 74 1HG THR 74 7.983 -4.877 -1.654
505 HG21 THR 74 3HG2 THR 74 4.911 -5.375 -0.160
506 HG22 THR 74 1HG2 THR 74 6.364 -6.366 -0.274
507 HG23 THR 74 2HG2 THR 74 5.765 -5.513 -1.696
508 H VAL 75 H VAL 75 3.865 -2.285 -1.784
509 HA VAL 75 HA VAL 75 2.515 -1.882 0.771
510 HB VAL 75 HB VAL 75 1.515 -1.349 -2.030
511 HG11 VAL 75 1HG1 VAL 75 -0.423 -1.485 -0.810
512 HG12 VAL 75 2HG1 VAL 75 0.351 -0.955 0.685
513 HG13 VAL 75 3HG1 VAL 75 -0.016 0.216 -0.582
514 HG21 VAL 75 3HG2 VAL 75 2.222 0.834 -0.145
515 HG22 VAL 75 1HG2 VAL 75 3.541 -0.027 -0.939
516 HG23 VAL 75 2HG2 VAL 75 2.310 0.785 -1.906
517 H ARG 76 H ARG 76 1.166 -3.316 1.633
518 HA ARG 76 HA ARG 76 0.048 -5.414 -0.107
519 HB2 ARG 76 1HB ARG 76 1.486 -5.623 2.486
520 HB3 ARG 76 2HB ARG 76 0.117 -6.700 2.239
521 HG2 ARG 76 1HG ARG 76 1.133 -7.783 0.449
522 HG3 ARG 76 2HG ARG 76 2.285 -6.472 0.189
523 HD2 ARG 76 1HD ARG 76 3.443 -8.318 1.191
524 HD3 ARG 76 2HD ARG 76 3.319 -7.021 2.379
525 HE ARG 76 HE ARG 76 1.141 -8.707 2.760
526 HH11 ARG 76 1HH1 ARG 76 4.612 -8.844 2.984
527 HH12 ARG 76 2HH1 ARG 76 4.615 -10.049 4.229
528 HH21 ARG 76 1HH2 ARG 76 1.131 -10.293 4.400
529 HH22 ARG 76 2HH2 ARG 76 2.634 -10.873 5.033
530 H VAL 77 H VAL 77 -2.064 -5.062 -0.278
531 HA VAL 77 HA VAL 77 -3.534 -3.795 1.891
532 HB VAL 77 HB VAL 77 -4.558 -4.680 -0.809
533 HG11 VAL 77 1HG1 VAL 77 -5.997 -4.009 1.401
534 HG12 VAL 77 2HG1 VAL 77 -5.838 -2.448 0.595
535 HG13 VAL 77 3HG1 VAL 77 -6.554 -3.815 -0.260
536 HG21 VAL 77 3HG2 VAL 77 -3.313 -2.103 0.103
537 HG22 VAL 77 1HG2 VAL 77 -2.908 -3.090 -1.302
538 HG23 VAL 77 2HG2 VAL 77 -4.411 -2.169 -1.276
539 H THR 78 H THR 78 -4.112 -5.127 3.491
540 HA THR 78 HA THR 78 -5.072 -7.821 2.829
541 HB THR 78 HB THR 78 -4.617 -6.895 5.642
542 HG1 THR 78 1HG THR 78 -2.637 -7.597 3.728
543 HG21 THR 78 3HG2 THR 78 -3.714 -9.540 4.785
544 HG22 THR 78 1HG2 THR 78 -5.438 -9.268 4.531
545 HG23 THR 78 2HG2 THR 78 -4.743 -9.080 6.141
546 H CYS 79 H CYS 79 -7.200 -7.907 2.512
547 HA CYS 79 HA CYS 79 -8.978 -6.091 3.926
548 HB2 CYS 79 1HB CYS 79 -9.450 -8.119 1.737
549 HB3 CYS 79 2HB CYS 79 -10.739 -7.180 2.481
550 HG CYS 79 HG CYS 79 -10.556 -5.466 0.565
551 H LEU 80 H LEU 80 -9.346 -6.699 5.978
552 HA LEU 80 HA LEU 80 -9.496 -9.433 6.796
553 HB2 LEU 80 1HB LEU 80 -9.938 -6.792 8.118
554 HB3 LEU 80 2HB LEU 80 -10.464 -8.269 8.924
555 HG LEU 80 HG LEU 80 -8.319 -7.644 9.784
556 HD11 LEU 80 1HD1 LEU 80 -7.164 -9.661 9.514
557 HD12 LEU 80 2HD1 LEU 80 -7.745 -9.878 7.864
558 HD13 LEU 80 3HD1 LEU 80 -8.853 -10.076 9.222
559 HD21 LEU 80 3HD2 LEU 80 -6.354 -7.401 8.375
560 HD22 LEU 80 1HD2 LEU 80 -7.598 -6.244 7.904
561 HD23 LEU 80 2HD2 LEU 80 -7.329 -7.693 6.935
562 H TYR 81 H TYR 81 -11.146 -10.672 6.184
563 HA TYR 81 HA TYR 81 -13.788 -9.553 5.777
564 HB2 TYR 81 1HB TYR 81 -12.898 -12.434 5.552
565 HB3 TYR 81 2HB TYR 81 -14.386 -11.738 4.920
566 HD1 TYR 81 2HD TYR 81 -13.433 -9.270 3.656
567 HD2 TYR 81 1HD TYR 81 -11.702 -13.157 3.695
568 HE1 TYR 81 2HE TYR 81 -12.303 -8.782 1.527
569 HE2 TYR 81 1HE TYR 81 -10.566 -12.679 1.566
570 HH TYR 81 HH TYR 81 -11.239 -9.780 -0.265
571 HA PRO 82 HA PRO 82 -15.486 -10.569 9.698
572 HB2 PRO 82 1HB PRO 82 -18.072 -11.023 9.008
573 HB3 PRO 82 2HB PRO 82 -17.355 -9.407 9.039
574 HG2 PRO 82 1HG PRO 82 -17.825 -11.226 6.708
575 HG3 PRO 82 2HG PRO 82 -18.097 -9.478 6.837
576 HD2 PRO 82 1HD PRO 82 -15.916 -10.527 5.623
577 HD3 PRO 82 2HD PRO 82 -15.874 -8.979 6.490
578 H GLY 83 H GLY 83 -16.319 -12.757 7.024
579 HA2 GLY 83 1HA GLY 83 -16.887 -14.936 8.854
580 HA3 GLY 83 2HA GLY 83 -16.966 -14.997 7.099
581 H GLY 84 H GLY 84 -14.643 -14.604 6.094
582 HA2 GLY 84 1HA GLY 84 -12.284 -15.262 7.284
583 HA3 GLY 84 2HA GLY 84 -13.060 -16.819 7.031
584 H GLY 85 H GLY 85 -10.633 -15.434 5.836
585 HA2 GLY 85 1HA GLY 85 -10.079 -16.493 3.576
586 HA3 GLY 85 2HA GLY 85 -11.441 -15.542 3.003
587 H SER 86 H SER 86 -9.937 -13.817 5.396
588 HA SER 86 HA SER 86 -9.246 -11.607 4.105
589 HB2 SER 86 1HB SER 86 -7.391 -11.251 5.727
590 HB3 SER 86 2HB SER 86 -8.869 -11.831 6.495
591 HG SER 86 HG SER 86 -6.415 -12.975 6.403
592 H SER 87 H SER 87 -8.193 -11.187 2.292
593 HA SER 87 HA SER 87 -6.045 -12.981 1.429
594 HB2 SER 87 1HB SER 87 -7.872 -11.073 0.017
595 HB3 SER 87 2HB SER 87 -6.329 -11.495 -0.725
596 HG SER 87 HG SER 87 -7.449 -13.141 -1.430
597 H THR 88 H THR 88 -4.492 -11.513 -0.144
598 HA THR 88 HA THR 88 -3.667 -9.083 1.219
599 HB THR 88 HB THR 88 -1.697 -11.353 0.913
600 HG1 THR 88 1HG THR 88 -3.401 -10.630 3.011
601 HG21 THR 88 3HG2 THR 88 -1.427 -8.829 2.532
602 HG22 THR 88 1HG2 THR 88 -0.895 -8.941 0.855
603 HG23 THR 88 2HG2 THR 88 -0.167 -9.978 2.083
604 H LEU 89 H LEU 89 -3.683 -7.768 -0.502
605 HA LEU 89 HA LEU 89 -2.581 -8.696 -3.045
606 HB2 LEU 89 1HB LEU 89 -4.282 -6.379 -2.216
607 HB3 LEU 89 2HB LEU 89 -3.419 -6.342 -3.752
608 HG LEU 89 HG LEU 89 -5.252 -8.617 -3.079
609 HD11 LEU 89 1HD1 LEU 89 -6.753 -7.016 -4.685
610 HD12 LEU 89 2HD1 LEU 89 -5.983 -5.835 -3.627
611 HD13 LEU 89 3HD1 LEU 89 -6.936 -7.147 -2.936
612 HD21 LEU 89 3HD2 LEU 89 -3.644 -8.674 -5.020
613 HD22 LEU 89 1HD2 LEU 89 -4.581 -7.359 -5.729
614 HD23 LEU 89 2HD2 LEU 89 -5.343 -8.920 -5.426
615 H THR 90 H THR 90 -0.432 -8.518 -3.152
616 HA THR 90 HA THR 90 0.989 -6.395 -1.810
617 HB THR 90 HB THR 90 2.985 -7.472 -2.437
618 HG1 THR 90 1HG THR 90 1.454 -8.805 -4.439
619 HG21 THR 90 3HG2 THR 90 2.448 -9.080 -0.982
620 HG22 THR 90 1HG2 THR 90 1.986 -10.064 -2.370
621 HG23 THR 90 2HG2 THR 90 0.771 -9.105 -1.525
622 H GLY 91 H GLY 91 2.238 -4.779 -2.799
623 HA2 GLY 91 1HA GLY 91 2.146 -4.430 -5.669
624 HA3 GLY 91 2HA GLY 91 1.176 -3.272 -4.772
625 H ARG 92 H ARG 92 4.174 -3.862 -6.081
626 HA ARG 92 HA ARG 92 5.667 -2.260 -4.167
627 HB2 ARG 92 1HB ARG 92 6.422 -3.729 -6.686
628 HB3 ARG 92 2HB ARG 92 7.539 -2.641 -5.874
629 HG2 ARG 92 1HG ARG 92 7.024 -4.077 -3.779
630 HG3 ARG 92 2HG ARG 92 6.453 -5.264 -4.954
631 HD2 ARG 92 1HD ARG 92 8.667 -5.038 -6.112
632 HD3 ARG 92 2HD ARG 92 9.205 -4.058 -4.748
633 HE ARG 92 HE ARG 92 9.354 -5.964 -3.465
634 HH11 ARG 92 1HH1 ARG 92 7.707 -6.671 -6.450
635 HH12 ARG 92 2HH1 ARG 92 7.754 -8.387 -6.221
636 HH21 ARG 92 1HH2 ARG 92 9.421 -8.223 -3.152
637 HH22 ARG 92 2HH2 ARG 92 8.728 -9.269 -4.344
638 H VAL 93 H VAL 93 6.090 -0.152 -4.374
639 HA VAL 93 HA VAL 93 5.724 1.132 -6.987
640 HB VAL 93 HB VAL 93 3.629 1.506 -5.829
641 HG11 VAL 93 1HG1 VAL 93 4.697 3.148 -3.664
642 HG12 VAL 93 2HG1 VAL 93 3.423 1.927 -3.641
643 HG13 VAL 93 3HG1 VAL 93 5.115 1.440 -3.528
644 HG21 VAL 93 3HG2 VAL 93 3.865 3.412 -7.003
645 HG22 VAL 93 1HG2 VAL 93 4.105 4.145 -5.416
646 HG23 VAL 93 2HG2 VAL 93 5.498 3.700 -6.402
647 H THR 94 H THR 94 7.297 2.528 -7.471
648 HA THR 94 HA THR 94 9.327 3.079 -5.454
649 HB THR 94 HB THR 94 9.339 3.676 -8.420
650 HG1 THR 94 1HG THR 94 9.403 1.381 -7.556
651 HG21 THR 94 3HG2 THR 94 11.579 3.762 -6.395
652 HG22 THR 94 1HG2 THR 94 10.810 5.165 -7.136
653 HG23 THR 94 2HG2 THR 94 11.738 4.041 -8.129
654 H THR 95 H THR 95 9.087 4.838 -4.248
655 HA THR 95 HA THR 95 7.373 6.978 -4.787
656 HB THR 95 HB THR 95 8.917 8.203 -3.072
657 HG1 THR 95 1HG THR 95 10.562 7.077 -2.369
658 HG21 THR 95 3HG2 THR 95 6.749 6.476 -2.848
659 HG22 THR 95 1HG2 THR 95 7.356 7.568 -1.604
660 HG23 THR 95 2HG2 THR 95 7.902 5.891 -1.649
661 H LYS 96 H LYS 96 7.778 9.137 -5.396
662 HA LYS 96 HA LYS 96 9.631 9.425 -7.538
663 HB2 LYS 96 1HB LYS 96 8.115 11.632 -6.143
664 HB3 LYS 96 2HB LYS 96 8.757 11.648 -7.781
665 HG2 LYS 96 1HG LYS 96 7.157 9.570 -8.057
666 HG3 LYS 96 2HG LYS 96 6.319 10.338 -6.707
667 HD2 LYS 96 1HD LYS 96 5.739 12.185 -7.940
668 HD3 LYS 96 2HD LYS 96 7.114 12.018 -9.035
669 HE2 LYS 96 1HE LYS 96 6.071 10.227 -10.200
670 HE3 LYS 96 2HE LYS 96 4.806 10.085 -8.980
671 HZ1 LYS 96 3HZ LYS 96 3.746 11.255 -10.623
672 HZ2 LYS 96 1HZ LYS 96 5.132 12.105 -11.089
673 HZ3 LYS 96 2HZ LYS 96 4.320 12.526 -9.666
674 H LYS 97 H LYS 97 11.168 11.290 -7.668
675 HA LYS 97 HA LYS 97 13.007 11.147 -5.473
676 HB2 LYS 97 1HB LYS 97 12.994 12.462 -8.161
677 HB3 LYS 97 2HB LYS 97 14.181 12.969 -6.966
678 HG2 LYS 97 1HG LYS 97 15.263 10.933 -6.978
679 HG3 LYS 97 2HG LYS 97 13.850 10.069 -7.587
680 HD2 LYS 97 1HD LYS 97 15.422 10.182 -9.370
681 HD3 LYS 97 2HD LYS 97 14.134 11.330 -9.743
682 HE2 LYS 97 1HE LYS 97 16.027 12.566 -10.210
683 HE3 LYS 97 2HE LYS 97 15.680 13.045 -8.549
684 HZ1 LYS 97 3HZ LYS 97 18.054 12.097 -9.458
685 HZ2 LYS 97 1HZ LYS 97 17.372 10.734 -8.723
686 HZ3 LYS 97 2HZ LYS 97 17.579 12.159 -7.835
687 H ALA 98 H ALA 98 13.527 12.687 -3.983
688 HA ALA 98 HA ALA 98 11.560 14.757 -3.525
689 HB1 ALA 98 3HB ALA 98 13.077 13.187 -1.865
690 HB2 ALA 98 1HB ALA 98 13.884 14.753 -1.762
691 HB3 ALA 98 2HB ALA 98 12.167 14.618 -1.379
692 HA PRO 99 HA PRO 99 13.790 18.059 -5.401
693 HB2 PRO 99 1HB PRO 99 12.691 20.137 -4.042
694 HB3 PRO 99 2HB PRO 99 11.824 19.244 -5.296
695 HG2 PRO 99 1HG PRO 99 11.664 18.968 -2.320
696 HG3 PRO 99 2HG PRO 99 10.354 18.973 -3.514
697 HD2 PRO 99 1HD PRO 99 11.325 16.691 -2.426
698 HD3 PRO 99 2HD PRO 99 10.697 16.766 -4.085
699 H SER 100 H SER 100 14.562 20.415 -4.279
700 HA SER 100 HA SER 100 16.671 19.538 -2.446
701 HB2 SER 100 1HB SER 100 17.947 21.390 -3.181
702 HB3 SER 100 2HB SER 100 17.159 20.781 -4.636
703 HG SER 100 HG SER 100 16.054 22.571 -4.783
704 HA PRO 101 HA PRO 101 14.867 21.582 1.007
705 HB2 PRO 101 1HB PRO 101 17.105 22.002 2.486
706 HB3 PRO 101 2HB PRO 101 16.364 20.408 2.294
707 HG2 PRO 101 1HG PRO 101 18.717 21.588 0.867
708 HG3 PRO 101 2HG PRO 101 18.511 19.954 1.523
709 HD2 PRO 101 1HD PRO 101 18.211 20.515 -1.108
710 HD3 PRO 101 2HD PRO 101 17.279 19.244 -0.291
711 H SER 102 H SER 102 14.095 23.588 0.741
712 HA SER 102 HA SER 102 15.857 25.844 1.081
713 HB2 SER 102 1HB SER 102 15.287 26.978 -0.989
714 HB3 SER 102 2HB SER 102 15.992 25.407 -1.369
715 HG SER 102 HG SER 102 14.021 25.987 -2.541
716 H SER 103 H SER 103 14.809 26.899 2.626
717 HA SER 103 HA SER 103 11.877 27.019 2.544
718 HB2 SER 103 1HB SER 103 13.241 26.222 4.614
719 HB3 SER 103 2HB SER 103 13.540 27.941 4.871
720 HG SER 103 HG SER 103 11.308 28.264 4.985
721 H GLY 104 H GLY 104 11.726 28.651 0.952
722 HA2 GLY 104 1HA GLY 104 12.131 31.334 2.046
723 HA3 GLY 104 2HA GLY 104 12.890 30.969 0.504
724 HA PRO 105 HA PRO 105 8.086 30.802 -0.170
725 HB2 PRO 105 1HB PRO 105 6.588 31.921 1.797
726 HB3 PRO 105 2HB PRO 105 7.008 30.205 1.768
727 HG2 PRO 105 1HG PRO 105 8.269 32.438 3.313
728 HG3 PRO 105 2HG PRO 105 7.863 30.797 3.848
729 HD2 PRO 105 1HD PRO 105 10.377 31.522 3.151
730 HD3 PRO 105 2HD PRO 105 9.749 29.882 2.889
731 H SER 106 H SER 106 6.278 32.698 -0.137
732 HA SER 106 HA SER 106 7.207 35.363 0.085
733 HB2 SER 106 1HB SER 106 8.419 34.342 -2.011
734 HB3 SER 106 2HB SER 106 6.859 34.599 -2.792
735 HG SER 106 HG SER 106 8.704 36.458 -1.829
736 H SER 107 H SER 107 5.659 36.919 -1.000
737 HA SER 107 HA SER 107 3.008 36.204 -0.304
738 HB2 SER 107 1HB SER 107 4.343 38.603 -1.456
739 HB3 SER 107 2HB SER 107 2.598 38.467 -1.670
740 HG SER 107 HG SER 107 3.856 38.152 0.846
741 H GLY 108 H GLY 108 4.321 37.178 -3.482
742 HA2 GLY 108 1HA GLY 108 2.907 35.059 -4.819
743 HA3 GLY 108 2HA GLY 108 2.180 36.638 -5.080
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -3.484 -24.944 4.790
2 HA2 GLY 1 1HA GLY 1 -5.108 -26.898 6.260
3 HA3 GLY 1 2HA GLY 1 -5.338 -26.421 4.584
4 H SER 2 H SER 2 -5.479 -28.769 4.254
5 HA SER 2 HA SER 2 -3.095 -30.345 4.579
6 HB2 SER 2 1HB SER 2 -4.399 -32.095 3.370
7 HB3 SER 2 2HB SER 2 -5.249 -31.442 4.770
8 HG SER 2 HG SER 2 -5.648 -30.616 2.083
9 H SER 3 H SER 3 -2.010 -31.430 2.791
10 HA SER 3 HA SER 3 -1.049 -29.653 0.868
11 HB2 SER 3 1HB SER 3 0.169 -31.493 -0.040
12 HB3 SER 3 2HB SER 3 0.058 -31.785 1.696
13 HG SER 3 HG SER 3 -2.004 -32.974 0.886
14 H GLY 4 H GLY 4 -1.808 -28.979 -1.029
15 HA2 GLY 4 1HA GLY 4 -3.328 -30.642 -2.785
16 HA3 GLY 4 2HA GLY 4 -4.350 -29.465 -1.973
17 H SER 5 H SER 5 -4.657 -27.633 -3.034
18 HA SER 5 HA SER 5 -3.376 -27.024 -5.455
19 HB2 SER 5 1HB SER 5 -5.657 -26.194 -4.421
20 HB3 SER 5 2HB SER 5 -4.664 -24.859 -3.837
21 HG SER 5 HG SER 5 -3.935 -24.920 -6.220
22 H SER 6 H SER 6 -1.245 -26.661 -5.540
23 HA SER 6 HA SER 6 0.224 -25.382 -3.461
24 HB2 SER 6 1HB SER 6 0.859 -26.358 -6.221
25 HB3 SER 6 2HB SER 6 2.008 -25.304 -5.395
26 HG SER 6 HG SER 6 1.033 -27.822 -4.528
27 H GLY 7 H GLY 7 -0.464 -23.325 -3.054
28 HA2 GLY 7 1HA GLY 7 -0.123 -21.024 -3.363
29 HA3 GLY 7 2HA GLY 7 0.256 -21.329 -5.051
30 H LEU 8 H LEU 8 -1.593 -19.394 -3.722
31 HA LEU 8 HA LEU 8 -4.073 -20.200 -5.096
32 HB2 LEU 8 1HB LEU 8 -3.798 -18.302 -2.771
33 HB3 LEU 8 2HB LEU 8 -5.301 -18.812 -3.537
34 HG LEU 8 HG LEU 8 -3.465 -20.758 -2.165
35 HD11 LEU 8 1HD1 LEU 8 -4.857 -18.655 -0.917
36 HD12 LEU 8 2HD1 LEU 8 -4.071 -20.039 -0.159
37 HD13 LEU 8 3HD1 LEU 8 -5.775 -20.128 -0.604
38 HD21 LEU 8 3HD2 LEU 8 -6.431 -20.979 -2.449
39 HD22 LEU 8 1HD2 LEU 8 -5.219 -22.251 -2.291
40 HD23 LEU 8 2HD2 LEU 8 -5.384 -21.375 -3.813
41 H ALA 9 H ALA 9 -5.421 -18.225 -5.738
42 HA ALA 9 HA ALA 9 -3.624 -16.231 -6.956
43 HB1 ALA 9 3HB ALA 9 -4.549 -16.741 -8.905
44 HB2 ALA 9 1HB ALA 9 -5.601 -17.916 -8.116
45 HB3 ALA 9 2HB ALA 9 -6.122 -16.240 -8.285
46 HA PRO 10 HA PRO 10 -5.668 -13.110 -4.612
47 HB2 PRO 10 1HB PRO 10 -5.052 -10.963 -6.155
48 HB3 PRO 10 2HB PRO 10 -3.870 -11.771 -5.118
49 HG2 PRO 10 1HG PRO 10 -4.317 -12.060 -8.064
50 HG3 PRO 10 2HG PRO 10 -2.790 -11.938 -7.170
51 HD2 PRO 10 1HD PRO 10 -3.779 -14.301 -8.049
52 HD3 PRO 10 2HD PRO 10 -2.825 -14.160 -6.558
53 HA PRO 11 HA PRO 11 -9.631 -12.369 -6.376
54 HB2 PRO 11 1HB PRO 11 -10.323 -10.058 -5.130
55 HB3 PRO 11 2HB PRO 11 -10.277 -11.619 -4.302
56 HG2 PRO 11 1HG PRO 11 -8.243 -9.422 -4.319
57 HG3 PRO 11 2HG PRO 11 -8.819 -10.404 -2.959
58 HD2 PRO 11 1HD PRO 11 -6.473 -10.895 -4.219
59 HD3 PRO 11 2HD PRO 11 -7.463 -12.185 -3.506
60 H ARG 12 H ARG 12 -7.584 -9.454 -6.225
61 HA ARG 12 HA ARG 12 -8.178 -8.912 -9.022
62 HB2 ARG 12 1HB ARG 12 -9.014 -7.166 -6.741
63 HB3 ARG 12 2HB ARG 12 -8.518 -6.418 -8.252
64 HG2 ARG 12 1HG ARG 12 -10.629 -8.548 -8.131
65 HG3 ARG 12 2HG ARG 12 -10.993 -6.832 -7.940
66 HD2 ARG 12 1HD ARG 12 -10.090 -6.358 -10.131
67 HD3 ARG 12 2HD ARG 12 -9.578 -8.035 -10.315
68 HE ARG 12 HE ARG 12 -12.353 -7.939 -9.843
69 HH11 ARG 12 1HH1 ARG 12 -9.997 -7.206 -12.299
70 HH12 ARG 12 2HH1 ARG 12 -11.097 -7.458 -13.613
71 HH21 ARG 12 1HH2 ARG 12 -13.811 -8.273 -11.565
72 HH22 ARG 12 2HH2 ARG 12 -13.266 -8.064 -13.195
73 H HIS 13 H HIS 13 -6.997 -6.596 -9.472
74 HA HIS 13 HA HIS 13 -4.230 -7.066 -8.626
75 HB2 HIS 13 1HB HIS 13 -5.213 -5.306 -10.878
76 HB3 HIS 13 2HB HIS 13 -3.556 -5.826 -10.581
77 HD1 HIS 13 1HD HIS 13 -6.306 -6.575 -12.681
78 HD2 HIS 13 2HD HIS 13 -3.466 -8.868 -10.698
79 HE1 HIS 13 1HE HIS 13 -6.298 -8.798 -13.855
80 HE2 HIS 13 2HE HIS 13 -4.634 -10.197 -12.585
81 H LEU 14 H LEU 14 -2.862 -5.030 -8.463
82 HA LEU 14 HA LEU 14 -4.341 -3.037 -6.880
83 HB2 LEU 14 1HB LEU 14 -1.653 -4.268 -6.622
84 HB3 LEU 14 2HB LEU 14 -1.830 -2.586 -6.127
85 HG LEU 14 HG LEU 14 -3.449 -4.882 -5.027
86 HD11 LEU 14 1HD1 LEU 14 -0.881 -3.636 -4.180
87 HD12 LEU 14 2HD1 LEU 14 -1.389 -5.324 -4.130
88 HD13 LEU 14 3HD1 LEU 14 -2.018 -4.178 -2.946
89 HD21 LEU 14 3HD2 LEU 14 -4.037 -3.213 -3.285
90 HD22 LEU 14 1HD2 LEU 14 -4.653 -2.808 -4.887
91 HD23 LEU 14 2HD2 LEU 14 -3.233 -1.976 -4.252
92 H GLY 15 H GLY 15 -3.649 -0.814 -7.007
93 HA2 GLY 15 1HA GLY 15 -2.087 -0.123 -9.397
94 HA3 GLY 15 2HA GLY 15 -3.715 0.521 -9.237
95 H PHE 16 H PHE 16 -1.228 1.991 -9.418
96 HA PHE 16 HA PHE 16 -1.406 3.440 -6.865
97 HB2 PHE 16 1HB PHE 16 1.124 2.871 -8.422
98 HB3 PHE 16 2HB PHE 16 1.019 3.911 -7.006
99 HD1 PHE 16 1HD PHE 16 0.422 2.917 -4.800
100 HD2 PHE 16 2HD PHE 16 1.291 0.531 -8.216
101 HE1 PHE 16 1HE PHE 16 0.799 0.971 -3.341
102 HE2 PHE 16 2HE PHE 16 1.668 -1.418 -6.763
103 HZ PHE 16 HZ PHE 16 1.421 -1.200 -4.323
104 H SER 17 H SER 17 -1.850 5.533 -7.087
105 HA SER 17 HA SER 17 -1.136 6.892 -9.587
106 HB2 SER 17 1HB SER 17 -3.618 6.060 -9.414
107 HB3 SER 17 2HB SER 17 -3.806 7.445 -8.338
108 HG SER 17 HG SER 17 -2.923 7.476 -11.034
109 H ASP 18 H ASP 18 -1.831 9.356 -9.268
110 HA ASP 18 HA ASP 18 -0.939 11.255 -8.308
111 HB2 ASP 18 1HB ASP 18 -3.267 10.617 -7.219
112 HB3 ASP 18 2HB ASP 18 -2.282 10.429 -5.771
113 H VAL 19 H VAL 19 0.794 8.928 -8.039
114 HA VAL 19 HA VAL 19 1.883 8.728 -5.449
115 HB VAL 19 HB VAL 19 3.279 8.264 -8.089
116 HG11 VAL 19 1HG1 VAL 19 5.065 8.083 -6.739
117 HG12 VAL 19 2HG1 VAL 19 4.078 7.923 -5.285
118 HG13 VAL 19 3HG1 VAL 19 4.368 6.520 -6.315
119 HG21 VAL 19 3HG2 VAL 19 2.379 5.937 -6.581
120 HG22 VAL 19 1HG2 VAL 19 1.055 6.963 -7.135
121 HG23 VAL 19 2HG2 VAL 19 2.211 6.309 -8.296
122 H SER 20 H SER 20 3.744 9.638 -4.541
123 HA SER 20 HA SER 20 4.925 11.941 -5.909
124 HB2 SER 20 1HB SER 20 3.692 12.027 -3.147
125 HB3 SER 20 2HB SER 20 4.731 13.290 -3.807
126 HG SER 20 HG SER 20 2.361 12.407 -5.083
127 H HIS 21 H HIS 21 6.650 12.892 -4.173
128 HA HIS 21 HA HIS 21 8.462 10.661 -3.731
129 HB2 HIS 21 1HB HIS 21 10.065 12.580 -3.130
130 HB3 HIS 21 2HB HIS 21 9.533 12.457 -4.804
131 HD1 HIS 21 1HD HIS 21 7.938 14.298 -5.681
132 HD2 HIS 21 2HD HIS 21 9.180 14.845 -1.754
133 HE1 HIS 21 1HE HIS 21 7.305 16.661 -5.099
134 HE2 HIS 21 2HE HIS 21 8.142 16.997 -2.747
135 H ASP 22 H ASP 22 6.104 12.089 -1.972
136 HA ASP 22 HA ASP 22 7.444 11.417 0.560
137 HB2 ASP 22 1HB ASP 22 5.971 13.905 -0.176
138 HB3 ASP 22 2HB ASP 22 5.793 13.292 1.466
139 H ALA 23 H ALA 23 5.181 10.472 -1.495
140 HA ALA 23 HA ALA 23 3.804 8.852 0.349
141 HB1 ALA 23 3HB ALA 23 1.580 10.294 -0.584
142 HB2 ALA 23 1HB ALA 23 2.170 10.165 1.073
143 HB3 ALA 23 2HB ALA 23 2.721 11.485 0.041
144 H ALA 24 H ALA 24 2.122 7.538 -0.678
145 HA ALA 24 HA ALA 24 2.034 7.661 -3.596
146 HB1 ALA 24 3HB ALA 24 3.195 5.796 -4.002
147 HB2 ALA 24 1HB ALA 24 3.833 5.991 -2.369
148 HB3 ALA 24 2HB ALA 24 2.451 4.933 -2.657
149 H ARG 25 H ARG 25 0.005 7.423 -4.245
150 HA ARG 25 HA ARG 25 -2.025 6.521 -2.410
151 HB2 ARG 25 1HB ARG 25 -2.142 8.398 -4.241
152 HB3 ARG 25 2HB ARG 25 -2.553 7.061 -5.307
153 HG2 ARG 25 1HG ARG 25 -4.582 6.720 -4.330
154 HG3 ARG 25 2HG ARG 25 -4.048 7.315 -2.757
155 HD2 ARG 25 1HD ARG 25 -5.416 9.032 -3.427
156 HD3 ARG 25 2HD ARG 25 -3.857 9.596 -4.026
157 HE ARG 25 HE ARG 25 -4.849 8.235 -6.132
158 HH11 ARG 25 1HH1 ARG 25 -6.161 10.731 -4.090
159 HH12 ARG 25 2HH1 ARG 25 -7.165 11.401 -5.333
160 HH21 ARG 25 1HH2 ARG 25 -6.167 9.108 -7.776
161 HH22 ARG 25 2HH2 ARG 25 -7.168 10.476 -7.429
162 H VAL 26 H VAL 26 -2.551 4.465 -2.137
163 HA VAL 26 HA VAL 26 -2.156 2.593 -4.379
164 HB VAL 26 HB VAL 26 -0.733 2.078 -2.455
165 HG11 VAL 26 1HG1 VAL 26 -2.856 2.932 -0.935
166 HG12 VAL 26 2HG1 VAL 26 -2.872 1.185 -0.690
167 HG13 VAL 26 3HG1 VAL 26 -1.417 2.114 -0.329
168 HG21 VAL 26 3HG2 VAL 26 -2.990 0.130 -2.911
169 HG22 VAL 26 1HG2 VAL 26 -1.470 0.226 -3.801
170 HG23 VAL 26 2HG2 VAL 26 -1.471 -0.269 -2.108
171 H PHE 27 H PHE 27 -3.990 2.016 -5.323
172 HA PHE 27 HA PHE 27 -6.378 1.638 -3.642
173 HB2 PHE 27 1HB PHE 27 -7.776 2.495 -5.416
174 HB3 PHE 27 2HB PHE 27 -6.529 3.686 -5.058
175 HD1 PHE 27 1HD PHE 27 -4.691 4.068 -6.624
176 HD2 PHE 27 2HD PHE 27 -7.862 1.376 -7.525
177 HE1 PHE 27 1HE PHE 27 -4.036 4.097 -8.996
178 HE2 PHE 27 2HE PHE 27 -7.212 1.400 -9.898
179 HZ PHE 27 HZ PHE 27 -5.297 2.761 -10.636
180 H TRP 28 H TRP 28 -8.076 0.297 -4.900
181 HA TRP 28 HA TRP 28 -6.820 -1.768 -6.549
182 HB2 TRP 28 1HB TRP 28 -8.198 -3.459 -5.125
183 HB3 TRP 28 2HB TRP 28 -6.646 -2.888 -4.518
184 HD1 TRP 28 HD TRP 28 -10.270 -3.071 -3.624
185 HE1 TRP 28 1HE TRP 28 -10.680 -1.884 -1.377
186 HE3 TRP 28 3HE TRP 28 -5.753 -0.733 -3.104
187 HZ2 TRP 28 2HZ TRP 28 -9.275 -0.181 0.382
188 HZ3 TRP 28 3HZ TRP 28 -5.367 0.657 -1.111
189 HH2 TRP 28 HH TRP 28 -7.093 0.926 0.595
190 H GLU 29 H GLU 29 -8.639 -3.404 -7.232
191 HA GLU 29 HA GLU 29 -10.764 -1.770 -8.373
192 HB2 GLU 29 1HB GLU 29 -9.909 -4.616 -8.926
193 HB3 GLU 29 2HB GLU 29 -11.218 -3.791 -9.761
194 HG2 GLU 29 1HG GLU 29 -8.336 -2.926 -9.760
195 HG3 GLU 29 2HG GLU 29 -9.141 -3.808 -11.056
196 H GLY 30 H GLY 30 -10.514 -3.064 -5.520
197 HA2 GLY 30 1HA GLY 30 -12.203 -3.476 -3.972
198 HA3 GLY 30 2HA GLY 30 -13.354 -3.583 -5.296
199 H ALA 31 H ALA 31 -13.930 -5.393 -3.632
200 HA ALA 31 HA ALA 31 -12.626 -7.865 -4.569
201 HB1 ALA 31 3HB ALA 31 -13.669 -7.260 -1.807
202 HB2 ALA 31 1HB ALA 31 -13.148 -8.854 -2.353
203 HB3 ALA 31 2HB ALA 31 -11.990 -7.525 -2.278
204 HA PRO 32 HA PRO 32 -16.591 -9.240 -5.871
205 HB2 PRO 32 1HB PRO 32 -16.299 -11.925 -5.591
206 HB3 PRO 32 2HB PRO 32 -15.505 -11.001 -6.871
207 HG2 PRO 32 1HG PRO 32 -14.393 -11.967 -4.265
208 HG3 PRO 32 2HG PRO 32 -13.651 -11.989 -5.876
209 HD2 PRO 32 1HD PRO 32 -13.042 -10.117 -4.016
210 HD3 PRO 32 2HD PRO 32 -13.030 -9.772 -5.758
211 H ARG 33 H ARG 33 -15.495 -9.629 -2.686
212 HA ARG 33 HA ARG 33 -18.212 -10.347 -1.812
213 HB2 ARG 33 1HB ARG 33 -16.827 -11.333 0.236
214 HB3 ARG 33 2HB ARG 33 -17.203 -12.296 -1.187
215 HG2 ARG 33 1HG ARG 33 -15.001 -11.859 -2.100
216 HG3 ARG 33 2HG ARG 33 -14.621 -10.817 -0.727
217 HD2 ARG 33 1HD ARG 33 -14.672 -12.649 0.784
218 HD3 ARG 33 2HD ARG 33 -15.379 -13.714 -0.431
219 HE ARG 33 HE ARG 33 -12.614 -13.146 -0.059
220 HH11 ARG 33 1HH1 ARG 33 -15.011 -13.890 -2.471
221 HH12 ARG 33 2HH1 ARG 33 -13.874 -14.601 -3.569
222 HH21 ARG 33 1HH2 ARG 33 -11.108 -14.078 -1.496
223 HH22 ARG 33 2HH2 ARG 33 -11.654 -14.708 -3.013
224 HA PRO 34 HA PRO 34 -18.115 -6.857 0.844
225 HB2 PRO 34 1HB PRO 34 -19.378 -7.771 3.066
226 HB3 PRO 34 2HB PRO 34 -20.221 -7.448 1.546
227 HG2 PRO 34 1HG PRO 34 -19.259 -10.054 2.663
228 HG3 PRO 34 2HG PRO 34 -20.797 -9.679 1.864
229 HD2 PRO 34 1HD PRO 34 -18.748 -10.898 0.581
230 HD3 PRO 34 2HD PRO 34 -19.876 -9.804 -0.245
231 H VAL 35 H VAL 35 -17.033 -5.899 2.570
232 HA VAL 35 HA VAL 35 -15.360 -7.631 4.247
233 HB VAL 35 HB VAL 35 -14.317 -5.193 2.799
234 HG11 VAL 35 1HG1 VAL 35 -12.155 -6.554 3.745
235 HG12 VAL 35 2HG1 VAL 35 -12.900 -5.165 4.539
236 HG13 VAL 35 3HG1 VAL 35 -13.328 -6.802 5.039
237 HG21 VAL 35 3HG2 VAL 35 -13.060 -7.793 2.301
238 HG22 VAL 35 1HG2 VAL 35 -14.715 -7.658 1.706
239 HG23 VAL 35 2HG2 VAL 35 -13.490 -6.505 1.175
240 H ARG 36 H ARG 36 -14.899 -6.833 6.282
241 HA ARG 36 HA ARG 36 -16.622 -4.667 7.170
242 HB2 ARG 36 1HB ARG 36 -16.047 -5.393 9.426
243 HB3 ARG 36 2HB ARG 36 -16.564 -6.762 8.450
244 HG2 ARG 36 1HG ARG 36 -14.267 -7.457 8.146
245 HG3 ARG 36 2HG ARG 36 -13.700 -6.040 9.033
246 HD2 ARG 36 1HD ARG 36 -15.226 -6.946 10.931
247 HD3 ARG 36 2HD ARG 36 -15.123 -8.468 10.046
248 HE ARG 36 HE ARG 36 -12.534 -7.459 10.394
249 HH11 ARG 36 1HH1 ARG 36 -15.151 -8.781 12.271
250 HH12 ARG 36 2HH1 ARG 36 -14.115 -9.435 13.496
251 HH21 ARG 36 1HH2 ARG 36 -11.159 -8.315 12.000
252 HH22 ARG 36 2HH2 ARG 36 -11.845 -9.168 13.342
253 H LEU 37 H LEU 37 -13.172 -5.497 7.190
254 HA LEU 37 HA LEU 37 -12.535 -2.650 7.293
255 HB2 LEU 37 1HB LEU 37 -12.517 -3.904 9.614
256 HB3 LEU 37 2HB LEU 37 -10.946 -4.460 9.042
257 HG LEU 37 HG LEU 37 -11.522 -1.537 8.997
258 HD11 LEU 37 1HD1 LEU 37 -10.510 -1.548 11.372
259 HD12 LEU 37 2HD1 LEU 37 -11.111 -3.204 11.448
260 HD13 LEU 37 3HD1 LEU 37 -12.233 -1.871 11.177
261 HD21 LEU 37 3HD2 LEU 37 -9.295 -3.253 8.603
262 HD22 LEU 37 1HD2 LEU 37 -8.980 -2.262 10.028
263 HD23 LEU 37 2HD2 LEU 37 -9.365 -1.494 8.488
264 H VAL 38 H VAL 38 -10.393 -2.150 6.575
265 HA VAL 38 HA VAL 38 -9.049 -4.347 5.146
266 HB VAL 38 HB VAL 38 -9.362 -1.535 4.090
267 HG11 VAL 38 1HG1 VAL 38 -8.425 -2.457 2.030
268 HG12 VAL 38 2HG1 VAL 38 -7.305 -2.647 3.381
269 HG13 VAL 38 3HG1 VAL 38 -8.243 -4.028 2.810
270 HG21 VAL 38 3HG2 VAL 38 -10.692 -4.027 3.047
271 HG22 VAL 38 1HG2 VAL 38 -11.478 -2.894 4.147
272 HG23 VAL 38 2HG2 VAL 38 -10.970 -2.360 2.545
273 H ARG 39 H ARG 39 -7.089 -4.625 5.963
274 HA ARG 39 HA ARG 39 -5.709 -2.358 7.200
275 HB2 ARG 39 1HB ARG 39 -5.622 -5.304 7.528
276 HB3 ARG 39 2HB ARG 39 -4.105 -4.444 7.754
277 HG2 ARG 39 1HG ARG 39 -5.402 -2.936 9.354
278 HG3 ARG 39 2HG ARG 39 -6.656 -4.177 9.303
279 HD2 ARG 39 1HD ARG 39 -4.642 -5.779 9.820
280 HD3 ARG 39 2HD ARG 39 -3.898 -4.301 10.429
281 HE ARG 39 HE ARG 39 -6.320 -4.311 11.630
282 HH11 ARG 39 1HH1 ARG 39 -3.770 -6.666 11.370
283 HH12 ARG 39 2HH1 ARG 39 -4.116 -7.403 12.899
284 HH21 ARG 39 1HH2 ARG 39 -6.786 -5.272 13.646
285 HH22 ARG 39 2HH2 ARG 39 -5.833 -6.609 14.193
286 H VAL 40 H VAL 40 -3.776 -1.585 6.490
287 HA VAL 40 HA VAL 40 -2.539 -2.898 4.167
288 HB VAL 40 HB VAL 40 -3.059 0.068 4.420
289 HG11 VAL 40 1HG1 VAL 40 -2.131 0.090 2.071
290 HG12 VAL 40 2HG1 VAL 40 -0.958 -0.194 3.358
291 HG13 VAL 40 3HG1 VAL 40 -1.540 -1.542 2.381
292 HG21 VAL 40 3HG2 VAL 40 -5.036 -1.294 3.806
293 HG22 VAL 40 1HG2 VAL 40 -4.527 -0.193 2.525
294 HG23 VAL 40 2HG2 VAL 40 -4.142 -1.911 2.417
295 H THR 41 H THR 41 -0.439 -3.235 4.443
296 HA THR 41 HA THR 41 1.016 -1.539 6.367
297 HB THR 41 HB THR 41 2.502 -3.577 6.712
298 HG1 THR 41 1HG THR 41 1.278 -4.611 4.790
299 HG21 THR 41 3HG2 THR 41 0.842 -4.666 8.267
300 HG22 THR 41 1HG2 THR 41 -0.373 -3.565 7.619
301 HG23 THR 41 2HG2 THR 41 1.033 -2.925 8.470
302 H TYR 42 H TYR 42 2.534 -0.352 5.432
303 HA TYR 42 HA TYR 42 3.773 -1.344 2.951
304 HB2 TYR 42 1HB TYR 42 4.292 1.079 2.512
305 HB3 TYR 42 2HB TYR 42 2.577 0.681 2.505
306 HD1 TYR 42 2HD TYR 42 1.261 1.138 4.671
307 HD2 TYR 42 1HD TYR 42 5.094 2.801 3.867
308 HE1 TYR 42 2HE TYR 42 0.843 2.893 6.342
309 HE2 TYR 42 1HE TYR 42 4.687 4.560 5.537
310 HH TYR 42 HH TYR 42 2.260 5.629 6.530
311 H VAL 43 H VAL 43 6.002 -1.179 2.682
312 HA VAL 43 HA VAL 43 7.598 -0.266 4.956
313 HB VAL 43 HB VAL 43 7.250 -2.664 5.348
314 HG11 VAL 43 1HG1 VAL 43 8.328 -4.276 3.751
315 HG12 VAL 43 2HG1 VAL 43 6.862 -3.496 3.153
316 HG13 VAL 43 3HG1 VAL 43 8.445 -2.947 2.599
317 HG21 VAL 43 3HG2 VAL 43 10.083 -2.295 4.425
318 HG22 VAL 43 1HG2 VAL 43 9.441 -1.434 5.824
319 HG23 VAL 43 2HG2 VAL 43 9.484 -3.197 5.817
320 H SER 44 H SER 44 9.782 0.195 4.447
321 HA SER 44 HA SER 44 10.155 1.067 1.733
322 HB2 SER 44 1HB SER 44 11.011 2.549 3.364
323 HB3 SER 44 2HB SER 44 11.828 1.251 4.234
324 HG SER 44 HG SER 44 12.918 2.804 2.502
325 H SER 45 H SER 45 11.830 0.437 0.322
326 HA SER 45 HA SER 45 12.186 -2.146 -0.264
327 HB2 SER 45 1HB SER 45 13.132 -0.084 -1.475
328 HB3 SER 45 2HB SER 45 14.557 -0.294 -0.458
329 HG SER 45 HG SER 45 13.750 -1.714 -2.644
330 H GLU 46 H GLU 46 14.551 -0.366 1.730
331 HA GLU 46 HA GLU 46 15.644 -2.901 2.672
332 HB2 GLU 46 1HB GLU 46 17.333 -1.404 3.802
333 HB3 GLU 46 2HB GLU 46 17.313 -1.329 2.046
334 HG2 GLU 46 1HG GLU 46 16.118 0.748 2.089
335 HG3 GLU 46 2HG GLU 46 15.925 0.648 3.838
336 H GLY 47 H GLY 47 14.990 -3.805 4.503
337 HA2 GLY 47 1HA GLY 47 12.987 -3.037 6.143
338 HA3 GLY 47 2HA GLY 47 14.349 -3.985 6.720
339 H GLY 48 H GLY 48 12.842 -0.870 6.658
340 HA2 GLY 48 1HA GLY 48 14.563 -0.031 8.860
341 HA3 GLY 48 2HA GLY 48 14.565 0.989 7.430
342 H HIS 49 H HIS 49 12.272 1.581 6.658
343 HA HIS 49 HA HIS 49 10.705 2.351 9.031
344 HB2 HIS 49 1HB HIS 49 11.327 4.390 8.165
345 HB3 HIS 49 2HB HIS 49 11.398 3.788 6.512
346 HD1 HIS 49 1HD HIS 49 9.773 5.131 5.221
347 HD2 HIS 49 2HD HIS 49 8.253 4.001 8.919
348 HE1 HIS 49 1HE HIS 49 7.395 5.949 5.249
349 HE2 HIS 49 2HE HIS 49 6.522 5.329 7.529
350 H SER 50 H SER 50 8.576 1.876 9.125
351 HA SER 50 HA SER 50 7.179 0.963 6.738
352 HB2 SER 50 1HB SER 50 6.369 -1.088 7.942
353 HB3 SER 50 2HB SER 50 8.088 -1.116 7.548
354 HG SER 50 HG SER 50 8.043 -0.042 9.873
355 H GLY 51 H GLY 51 4.822 0.498 7.266
356 HA2 GLY 51 1HA GLY 51 3.794 1.826 9.633
357 HA3 GLY 51 2HA GLY 51 3.467 2.655 8.117
358 H GLN 52 H GLN 52 1.372 1.857 9.646
359 HA GLN 52 HA GLN 52 0.154 -0.170 7.933
360 HB2 GLN 52 1HB GLN 52 0.975 -1.366 9.933
361 HB3 GLN 52 2HB GLN 52 0.033 -0.286 10.952
362 HG2 GLN 52 1HG GLN 52 -2.022 -1.120 10.022
363 HG3 GLN 52 2HG GLN 52 -1.135 -2.110 8.864
364 HE21 GLN 52 1HE2 GLN 52 -2.716 -2.123 11.757
365 HE22 GLN 52 2HE2 GLN 52 -2.051 -3.565 12.439
366 H THR 53 H THR 53 -1.511 0.862 7.059
367 HA THR 53 HA THR 53 -3.063 2.719 8.736
368 HB THR 53 HB THR 53 -1.979 3.638 6.646
369 HG1 THR 53 1HG THR 53 -4.092 4.336 7.733
370 HG21 THR 53 3HG2 THR 53 -3.168 3.170 4.516
371 HG22 THR 53 1HG2 THR 53 -4.052 1.880 5.331
372 HG23 THR 53 2HG2 THR 53 -2.301 1.770 5.148
373 H GLU 54 H GLU 54 -5.260 2.511 8.911
374 HA GLU 54 HA GLU 54 -6.394 0.020 7.836
375 HB2 GLU 54 1HB GLU 54 -6.818 1.549 10.358
376 HB3 GLU 54 2HB GLU 54 -8.184 0.663 9.695
377 HG2 GLU 54 1HG GLU 54 -7.234 -0.844 11.166
378 HG3 GLU 54 2HG GLU 54 -6.581 -1.339 9.606
379 H ALA 55 H ALA 55 -8.328 0.019 6.745
380 HA ALA 55 HA ALA 55 -9.668 2.589 6.307
381 HB1 ALA 55 3HB ALA 55 -9.649 1.175 3.834
382 HB2 ALA 55 1HB ALA 55 -9.007 2.776 4.199
383 HB3 ALA 55 2HB ALA 55 -7.989 1.350 4.402
384 HA PRO 56 HA PRO 56 -13.389 0.286 6.666
385 HB2 PRO 56 1HB PRO 56 -15.043 1.688 5.032
386 HB3 PRO 56 2HB PRO 56 -14.501 2.296 6.601
387 HG2 PRO 56 1HG PRO 56 -13.466 2.928 3.863
388 HG3 PRO 56 2HG PRO 56 -13.776 4.023 5.223
389 HD2 PRO 56 1HD PRO 56 -11.293 3.139 4.600
390 HD3 PRO 56 2HD PRO 56 -11.792 3.490 6.268
391 H GLY 57 H GLY 57 -14.458 -1.403 5.729
392 HA2 GLY 57 1HA GLY 57 -13.406 -2.737 3.555
393 HA3 GLY 57 2HA GLY 57 -15.038 -2.980 4.161
394 H ASN 58 H ASN 58 -15.393 0.039 3.510
395 HA ASN 58 HA ASN 58 -16.386 -0.449 0.821
396 HB2 ASN 58 1HB ASN 58 -16.709 1.948 2.642
397 HB3 ASN 58 2HB ASN 58 -17.512 1.735 1.089
398 HD21 ASN 58 1HD2 ASN 58 -18.645 2.064 3.752
399 HD22 ASN 58 2HD2 ASN 58 -19.639 0.678 4.024
400 H ALA 59 H ALA 59 -13.916 1.396 2.460
401 HA ALA 59 HA ALA 59 -13.272 3.194 0.392
402 HB1 ALA 59 3HB ALA 59 -10.961 3.132 1.585
403 HB2 ALA 59 1HB ALA 59 -12.365 3.787 2.428
404 HB3 ALA 59 2HB ALA 59 -11.810 2.150 2.778
405 H THR 60 H THR 60 -12.638 2.682 -1.591
406 HA THR 60 HA THR 60 -11.094 0.221 -2.013
407 HB THR 60 HB THR 60 -11.623 0.744 -4.485
408 HG1 THR 60 1HG THR 60 -12.393 2.884 -4.114
409 HG21 THR 60 3HG2 THR 60 -13.856 -0.293 -4.295
410 HG22 THR 60 1HG2 THR 60 -13.828 0.003 -2.557
411 HG23 THR 60 2HG2 THR 60 -12.657 -1.098 -3.284
412 H SER 61 H SER 61 -10.362 3.238 -1.311
413 HA SER 61 HA SER 61 -7.881 3.162 -2.831
414 HB2 SER 61 1HB SER 61 -8.321 5.780 -3.137
415 HB3 SER 61 2HB SER 61 -8.839 4.600 -4.340
416 HG SER 61 HG SER 61 -10.531 5.346 -2.212
417 H ALA 62 H ALA 62 -6.168 3.977 -1.729
418 HA ALA 62 HA ALA 62 -6.548 5.721 0.549
419 HB1 ALA 62 3HB ALA 62 -6.289 4.262 2.213
420 HB2 ALA 62 1HB ALA 62 -6.624 3.004 1.023
421 HB3 ALA 62 2HB ALA 62 -4.957 3.444 1.396
422 H MET 63 H MET 63 -4.577 6.618 1.344
423 HA MET 63 HA MET 63 -2.299 6.252 -0.491
424 HB2 MET 63 1HB MET 63 -1.873 8.534 -0.496
425 HB3 MET 63 2HB MET 63 -3.631 8.484 -0.501
426 HG2 MET 63 1HG MET 63 -3.730 9.000 1.818
427 HG3 MET 63 2HG MET 63 -1.989 8.797 1.996
428 HE1 MET 63 3HE MET 63 -1.107 11.778 -0.701
429 HE2 MET 63 1HE MET 63 -0.639 10.137 -0.255
430 HE3 MET 63 2HE MET 63 -2.034 10.402 -1.300
431 H LEU 64 H LEU 64 -0.176 6.593 0.418
432 HA LEU 64 HA LEU 64 -0.074 6.145 3.328
433 HB2 LEU 64 1HB LEU 64 1.978 5.044 1.448
434 HB3 LEU 64 2HB LEU 64 1.606 4.548 3.098
435 HG LEU 64 HG LEU 64 -0.438 4.138 0.961
436 HD11 LEU 64 1HD1 LEU 64 2.064 3.248 0.479
437 HD12 LEU 64 2HD1 LEU 64 0.600 2.419 -0.051
438 HD13 LEU 64 3HD1 LEU 64 1.420 1.905 1.424
439 HD21 LEU 64 3HD2 LEU 64 -1.454 3.045 2.602
440 HD22 LEU 64 1HD2 LEU 64 -0.140 3.488 3.692
441 HD23 LEU 64 2HD2 LEU 64 -0.061 1.977 2.786
442 H GLY 65 H GLY 65 1.902 6.851 4.382
443 HA2 GLY 65 1HA GLY 65 4.074 8.124 3.554
444 HA3 GLY 65 2HA GLY 65 2.859 9.344 3.204
445 HA PRO 66 HA PRO 66 4.668 10.702 3.712
446 HB2 PRO 66 1HB PRO 66 6.954 11.370 5.014
447 HB3 PRO 66 2HB PRO 66 5.483 12.346 5.094
448 HG2 PRO 66 1HG PRO 66 6.541 10.352 7.060
449 HG3 PRO 66 2HG PRO 66 5.828 11.948 7.359
450 HD2 PRO 66 1HD PRO 66 4.433 9.647 7.666
451 HD3 PRO 66 2HD PRO 66 3.671 11.163 7.142
452 H LEU 67 H LEU 67 6.035 9.802 2.261
453 HA LEU 67 HA LEU 67 7.550 7.428 3.127
454 HB2 LEU 67 1HB LEU 67 6.493 8.016 0.368
455 HB3 LEU 67 2HB LEU 67 7.271 6.530 0.911
456 HG LEU 67 HG LEU 67 4.543 7.552 1.686
457 HD11 LEU 67 1HD1 LEU 67 5.575 5.366 -0.064
458 HD12 LEU 67 2HD1 LEU 67 4.277 6.523 -0.356
459 HD13 LEU 67 3HD1 LEU 67 4.025 5.178 0.756
460 HD21 LEU 67 3HD2 LEU 67 4.324 5.640 3.113
461 HD22 LEU 67 1HD2 LEU 67 5.766 6.531 3.599
462 HD23 LEU 67 2HD2 LEU 67 5.921 5.051 2.652
463 H SER 68 H SER 68 9.386 6.933 1.487
464 HA SER 68 HA SER 68 11.065 9.299 1.415
465 HB2 SER 68 1HB SER 68 12.706 7.430 0.469
466 HB3 SER 68 2HB SER 68 12.351 7.557 2.192
467 HG SER 68 HG SER 68 12.084 5.432 0.858
468 H SER 69 H SER 69 12.663 9.229 -0.607
469 HA SER 69 HA SER 69 10.919 9.354 -2.972
470 HB2 SER 69 1HB SER 69 12.893 10.819 -3.839
471 HB3 SER 69 2HB SER 69 11.770 11.507 -2.666
472 HG SER 69 HG SER 69 13.874 11.921 -2.005
473 H SER 70 H SER 70 11.726 8.645 -5.005
474 HA SER 70 HA SER 70 12.537 6.908 -6.269
475 HB2 SER 70 1HB SER 70 14.354 8.739 -6.172
476 HB3 SER 70 2HB SER 70 15.214 7.637 -5.096
477 HG SER 70 HG SER 70 15.932 7.038 -7.037
478 H THR 71 H THR 71 11.669 6.100 -3.640
479 HA THR 71 HA THR 71 13.453 3.790 -3.223
480 HB THR 71 HB THR 71 11.901 5.375 -1.178
481 HG1 THR 71 1HG THR 71 14.287 5.671 -1.958
482 HG21 THR 71 3HG2 THR 71 13.189 3.447 0.253
483 HG22 THR 71 1HG2 THR 71 12.671 2.541 -1.168
484 HG23 THR 71 2HG2 THR 71 11.482 3.397 -0.186
485 H THR 72 H THR 72 12.557 1.867 -3.564
486 HA THR 72 HA THR 72 9.833 1.620 -4.352
487 HB THR 72 HB THR 72 11.797 -0.581 -3.686
488 HG1 THR 72 1HG THR 72 11.147 0.414 -6.265
489 HG21 THR 72 3HG2 THR 72 9.029 -0.557 -4.618
490 HG22 THR 72 1HG2 THR 72 9.982 -1.876 -3.941
491 HG23 THR 72 2HG2 THR 72 10.109 -1.487 -5.656
492 H TYR 73 H TYR 73 8.104 1.369 -3.110
493 HA TYR 73 HA TYR 73 8.486 0.474 -0.333
494 HB2 TYR 73 1HB TYR 73 6.613 2.394 -1.631
495 HB3 TYR 73 2HB TYR 73 6.028 1.495 -0.236
496 HD1 TYR 73 1HD TYR 73 8.385 4.043 -1.401
497 HD2 TYR 73 2HD TYR 73 6.966 1.874 1.974
498 HE1 TYR 73 1HE TYR 73 9.503 5.647 0.092
499 HE2 TYR 73 2HE TYR 73 8.079 3.472 3.476
500 HH TYR 73 HH TYR 73 10.350 5.215 2.950
501 H THR 74 H THR 74 7.567 -1.354 0.360
502 HA THR 74 HA THR 74 6.009 -2.915 -1.555
503 HB THR 74 HB THR 74 7.019 -3.844 1.134
504 HG1 THR 74 1HG THR 74 8.372 -4.430 -1.259
505 HG21 THR 74 3HG2 THR 74 5.861 -5.668 0.568
506 HG22 THR 74 1HG2 THR 74 7.045 -5.922 -0.713
507 HG23 THR 74 2HG2 THR 74 5.550 -5.051 -1.054
508 H VAL 75 H VAL 75 3.909 -2.331 -1.490
509 HA VAL 75 HA VAL 75 2.601 -1.906 1.087
510 HB VAL 75 HB VAL 75 1.360 -1.653 -1.650
511 HG11 VAL 75 1HG1 VAL 75 0.056 0.106 -0.129
512 HG12 VAL 75 2HG1 VAL 75 -0.430 -1.586 -0.253
513 HG13 VAL 75 3HG1 VAL 75 0.526 -1.040 1.126
514 HG21 VAL 75 3HG2 VAL 75 2.081 0.514 -1.857
515 HG22 VAL 75 1HG2 VAL 75 2.307 0.720 -0.120
516 HG23 VAL 75 2HG2 VAL 75 3.478 -0.207 -1.058
517 H ARG 76 H ARG 76 0.998 -3.188 1.900
518 HA ARG 76 HA ARG 76 0.239 -5.569 0.352
519 HB2 ARG 76 1HB ARG 76 2.045 -5.834 2.270
520 HB3 ARG 76 2HB ARG 76 0.621 -5.815 3.302
521 HG2 ARG 76 1HG ARG 76 -0.190 -7.799 2.448
522 HG3 ARG 76 2HG ARG 76 0.729 -7.648 0.949
523 HD2 ARG 76 1HD ARG 76 1.918 -9.283 2.053
524 HD3 ARG 76 2HD ARG 76 2.795 -7.829 2.528
525 HE ARG 76 HE ARG 76 0.790 -8.331 4.421
526 HH11 ARG 76 1HH1 ARG 76 3.789 -9.687 3.288
527 HH12 ARG 76 2HH1 ARG 76 4.189 -10.408 4.812
528 HH21 ARG 76 1HH2 ARG 76 1.305 -9.276 6.432
529 HH22 ARG 76 2HH2 ARG 76 2.775 -10.175 6.599
530 H VAL 77 H VAL 77 -1.833 -5.007 -0.077
531 HA VAL 77 HA VAL 77 -3.525 -3.877 1.991
532 HB VAL 77 HB VAL 77 -4.189 -4.660 -0.851
533 HG11 VAL 77 1HG1 VAL 77 -5.777 -3.363 1.330
534 HG12 VAL 77 2HG1 VAL 77 -6.123 -3.014 -0.365
535 HG13 VAL 77 3HG1 VAL 77 -6.239 -4.668 0.237
536 HG21 VAL 77 3HG2 VAL 77 -2.794 -2.408 0.244
537 HG22 VAL 77 1HG2 VAL 77 -3.143 -2.792 -1.441
538 HG23 VAL 77 2HG2 VAL 77 -4.309 -1.876 -0.486
539 H THR 78 H THR 78 -4.093 -5.328 3.512
540 HA THR 78 HA THR 78 -5.049 -7.970 2.656
541 HB THR 78 HB THR 78 -4.498 -7.101 5.493
542 HG1 THR 78 1HG THR 78 -2.436 -7.404 5.128
543 HG21 THR 78 3HG2 THR 78 -4.102 -9.645 5.649
544 HG22 THR 78 1HG2 THR 78 -4.968 -9.726 4.115
545 HG23 THR 78 2HG2 THR 78 -5.764 -9.065 5.543
546 H CYS 79 H CYS 79 -7.168 -8.162 2.398
547 HA CYS 79 HA CYS 79 -8.972 -6.382 3.852
548 HB2 CYS 79 1HB CYS 79 -9.251 -8.113 1.417
549 HB3 CYS 79 2HB CYS 79 -10.684 -7.569 2.281
550 HG CYS 79 HG CYS 79 -10.709 -5.678 0.457
551 H LEU 80 H LEU 80 -9.641 -7.078 5.769
552 HA LEU 80 HA LEU 80 -9.825 -9.923 6.330
553 HB2 LEU 80 1HB LEU 80 -9.914 -7.424 7.952
554 HB3 LEU 80 2HB LEU 80 -10.614 -8.899 8.616
555 HG LEU 80 HG LEU 80 -8.396 -8.678 9.466
556 HD11 LEU 80 1HD1 LEU 80 -7.561 -10.780 8.965
557 HD12 LEU 80 2HD1 LEU 80 -8.061 -10.690 7.277
558 HD13 LEU 80 3HD1 LEU 80 -9.266 -10.929 8.542
559 HD21 LEU 80 3HD2 LEU 80 -7.750 -8.008 6.644
560 HD22 LEU 80 1HD2 LEU 80 -6.522 -8.832 7.605
561 HD23 LEU 80 2HD2 LEU 80 -7.169 -7.282 8.143
562 H TYR 81 H TYR 81 -11.620 -10.975 5.816
563 HA TYR 81 HA TYR 81 -14.135 -9.586 5.499
564 HB2 TYR 81 1HB TYR 81 -13.564 -12.547 5.267
565 HB3 TYR 81 2HB TYR 81 -14.988 -11.699 4.673
566 HD1 TYR 81 2HD TYR 81 -14.315 -9.609 3.071
567 HD2 TYR 81 1HD TYR 81 -12.007 -13.132 3.680
568 HE1 TYR 81 2HE TYR 81 -13.202 -9.247 0.908
569 HE2 TYR 81 1HE TYR 81 -10.887 -12.779 1.519
570 HH TYR 81 HH TYR 81 -11.611 -11.484 -0.739
571 HA PRO 82 HA PRO 82 -15.816 -10.392 9.478
572 HB2 PRO 82 1HB PRO 82 -18.458 -10.504 8.865
573 HB3 PRO 82 2HB PRO 82 -17.539 -8.995 8.881
574 HG2 PRO 82 1HG PRO 82 -18.308 -10.721 6.558
575 HG3 PRO 82 2HG PRO 82 -18.349 -8.953 6.701
576 HD2 PRO 82 1HD PRO 82 -16.358 -10.265 5.418
577 HD3 PRO 82 2HD PRO 82 -16.091 -8.741 6.289
578 H GLY 83 H GLY 83 -16.084 -12.615 6.897
579 HA2 GLY 83 1HA GLY 83 -16.281 -14.831 8.710
580 HA3 GLY 83 2HA GLY 83 -17.746 -14.607 7.765
581 H GLY 84 H GLY 84 -14.888 -16.235 7.884
582 HA2 GLY 84 1HA GLY 84 -14.809 -17.885 5.952
583 HA3 GLY 84 2HA GLY 84 -14.708 -16.448 4.945
584 H GLY 85 H GLY 85 -12.793 -15.245 4.892
585 HA2 GLY 85 1HA GLY 85 -10.526 -16.159 6.474
586 HA3 GLY 85 2HA GLY 85 -10.412 -16.438 4.743
587 H SER 86 H SER 86 -8.946 -15.026 4.026
588 HA SER 86 HA SER 86 -9.556 -12.227 4.064
589 HB2 SER 86 1HB SER 86 -7.517 -11.473 5.194
590 HB3 SER 86 2HB SER 86 -8.490 -12.464 6.280
591 HG SER 86 HG SER 86 -6.330 -13.471 4.744
592 H SER 87 H SER 87 -8.374 -11.051 2.540
593 HA SER 87 HA SER 87 -6.669 -12.692 0.782
594 HB2 SER 87 1HB SER 87 -8.761 -10.633 0.172
595 HB3 SER 87 2HB SER 87 -7.434 -10.887 -0.961
596 HG SER 87 HG SER 87 -9.245 -12.210 -1.435
597 H THR 88 H THR 88 -4.763 -11.845 0.031
598 HA THR 88 HA THR 88 -3.967 -9.237 1.154
599 HB THR 88 HB THR 88 -2.028 -11.471 0.585
600 HG1 THR 88 1HG THR 88 -3.695 -12.036 2.199
601 HG21 THR 88 3HG2 THR 88 -1.383 -8.982 0.927
602 HG22 THR 88 1HG2 THR 88 -0.490 -10.223 1.804
603 HG23 THR 88 2HG2 THR 88 -1.744 -9.294 2.625
604 H LEU 89 H LEU 89 -3.381 -7.744 -0.277
605 HA LEU 89 HA LEU 89 -2.710 -8.618 -3.009
606 HB2 LEU 89 1HB LEU 89 -4.279 -6.338 -1.937
607 HB3 LEU 89 2HB LEU 89 -3.333 -6.064 -3.399
608 HG LEU 89 HG LEU 89 -5.199 -8.393 -3.282
609 HD11 LEU 89 1HD1 LEU 89 -6.831 -6.928 -2.702
610 HD12 LEU 89 2HD1 LEU 89 -6.789 -6.601 -4.434
611 HD13 LEU 89 3HD1 LEU 89 -5.951 -5.528 -3.314
612 HD21 LEU 89 3HD2 LEU 89 -4.591 -8.547 -5.408
613 HD22 LEU 89 1HD2 LEU 89 -3.538 -7.145 -5.212
614 HD23 LEU 89 2HD2 LEU 89 -5.215 -6.925 -5.715
615 H THR 90 H THR 90 -0.568 -8.595 -3.244
616 HA THR 90 HA THR 90 1.077 -6.667 -1.839
617 HB THR 90 HB THR 90 2.950 -7.901 -2.528
618 HG1 THR 90 1HG THR 90 3.076 -8.754 -4.463
619 HG21 THR 90 3HG2 THR 90 0.925 -10.110 -2.521
620 HG22 THR 90 1HG2 THR 90 1.179 -9.127 -1.080
621 HG23 THR 90 2HG2 THR 90 2.516 -10.054 -1.762
622 H GLY 91 H GLY 91 1.996 -4.882 -2.680
623 HA2 GLY 91 1HA GLY 91 2.137 -4.533 -5.571
624 HA3 GLY 91 2HA GLY 91 1.102 -3.409 -4.702
625 H ARG 92 H ARG 92 4.039 -3.675 -6.040
626 HA ARG 92 HA ARG 92 5.448 -2.147 -3.974
627 HB2 ARG 92 1HB ARG 92 6.294 -3.788 -6.312
628 HB3 ARG 92 2HB ARG 92 7.332 -2.452 -5.831
629 HG2 ARG 92 1HG ARG 92 7.503 -3.383 -3.583
630 HG3 ARG 92 2HG ARG 92 6.450 -4.718 -4.056
631 HD2 ARG 92 1HD ARG 92 8.065 -5.521 -5.627
632 HD3 ARG 92 2HD ARG 92 9.069 -4.089 -5.405
633 HE ARG 92 HE ARG 92 8.792 -5.326 -2.923
634 HH11 ARG 92 1HH1 ARG 92 10.202 -5.981 -6.038
635 HH12 ARG 92 2HH1 ARG 92 11.455 -6.996 -5.403
636 HH21 ARG 92 1HH2 ARG 92 10.437 -6.660 -2.075
637 HH22 ARG 92 2HH2 ARG 92 11.587 -7.382 -3.149
638 H VAL 93 H VAL 93 5.574 -0.012 -4.103
639 HA VAL 93 HA VAL 93 5.253 1.263 -6.742
640 HB VAL 93 HB VAL 93 3.243 1.693 -5.503
641 HG11 VAL 93 1HG1 VAL 93 5.014 1.733 -3.262
642 HG12 VAL 93 2HG1 VAL 93 4.089 3.236 -3.298
643 HG13 VAL 93 3HG1 VAL 93 3.251 1.683 -3.283
644 HG21 VAL 93 3HG2 VAL 93 4.367 3.562 -6.785
645 HG22 VAL 93 1HG2 VAL 93 3.191 4.058 -5.568
646 HG23 VAL 93 2HG2 VAL 93 4.917 4.180 -5.227
647 H THR 94 H THR 94 6.894 2.506 -7.345
648 HA THR 94 HA THR 94 9.004 3.107 -5.433
649 HB THR 94 HB THR 94 8.909 3.592 -8.417
650 HG1 THR 94 1HG THR 94 9.958 1.675 -8.597
651 HG21 THR 94 3HG2 THR 94 10.471 5.043 -7.061
652 HG22 THR 94 1HG2 THR 94 11.239 4.054 -8.302
653 HG23 THR 94 2HG2 THR 94 11.321 3.566 -6.609
654 H THR 95 H THR 95 8.806 4.905 -4.272
655 HA THR 95 HA THR 95 7.145 7.074 -4.868
656 HB THR 95 HB THR 95 8.671 8.316 -3.188
657 HG1 THR 95 1HG THR 95 10.412 7.271 -2.622
658 HG21 THR 95 3HG2 THR 95 7.349 7.541 -1.508
659 HG22 THR 95 1HG2 THR 95 7.648 5.849 -1.906
660 HG23 THR 95 2HG2 THR 95 6.494 6.788 -2.854
661 H LYS 96 H LYS 96 7.484 9.063 -5.786
662 HA LYS 96 HA LYS 96 9.372 9.262 -7.860
663 HB2 LYS 96 1HB LYS 96 7.977 11.607 -6.580
664 HB3 LYS 96 2HB LYS 96 8.515 11.446 -8.247
665 HG2 LYS 96 1HG LYS 96 6.828 9.461 -8.305
666 HG3 LYS 96 2HG LYS 96 6.126 10.272 -6.904
667 HD2 LYS 96 1HD LYS 96 5.456 12.092 -8.124
668 HD3 LYS 96 2HD LYS 96 6.743 11.902 -9.317
669 HE2 LYS 96 1HE LYS 96 5.601 10.187 -10.436
670 HE3 LYS 96 2HE LYS 96 4.507 9.913 -9.081
671 HZ1 LYS 96 3HZ LYS 96 4.373 12.582 -10.135
672 HZ2 LYS 96 1HZ LYS 96 3.126 11.491 -9.794
673 HZ3 LYS 96 2HZ LYS 96 3.948 11.401 -11.269
674 H LYS 97 H LYS 97 10.897 11.172 -8.074
675 HA LYS 97 HA LYS 97 12.788 11.050 -5.916
676 HB2 LYS 97 1HB LYS 97 12.732 12.256 -8.647
677 HB3 LYS 97 2HB LYS 97 13.923 12.846 -7.494
678 HG2 LYS 97 1HG LYS 97 15.018 10.805 -7.386
679 HG3 LYS 97 2HG LYS 97 13.628 9.915 -8.011
680 HD2 LYS 97 1HD LYS 97 14.984 11.970 -9.711
681 HD3 LYS 97 2HD LYS 97 15.676 10.354 -9.554
682 HE2 LYS 97 1HE LYS 97 13.941 9.355 -10.662
683 HE3 LYS 97 2HE LYS 97 12.778 10.588 -10.177
684 HZ1 LYS 97 3HZ LYS 97 14.964 11.207 -12.064
685 HZ2 LYS 97 1HZ LYS 97 13.506 12.032 -11.826
686 HZ3 LYS 97 2HZ LYS 97 13.510 10.530 -12.602
687 H ALA 98 H ALA 98 13.509 12.741 -4.615
688 HA ALA 98 HA ALA 98 11.524 14.828 -4.157
689 HB1 ALA 98 3HB ALA 98 12.217 13.582 -2.218
690 HB2 ALA 98 1HB ALA 98 13.911 13.957 -2.535
691 HB3 ALA 98 2HB ALA 98 12.795 15.242 -2.071
692 HA PRO 99 HA PRO 99 13.875 18.003 -6.101
693 HB2 PRO 99 1HB PRO 99 12.868 20.152 -4.782
694 HB3 PRO 99 2HB PRO 99 11.958 19.267 -6.013
695 HG2 PRO 99 1HG PRO 99 11.803 19.062 -3.030
696 HG3 PRO 99 2HG PRO 99 10.488 19.094 -4.219
697 HD2 PRO 99 1HD PRO 99 11.373 16.799 -3.086
698 HD3 PRO 99 2HD PRO 99 10.740 16.863 -4.743
699 H SER 100 H SER 100 15.475 19.641 -5.671
700 HA SER 100 HA SER 100 16.894 19.154 -3.149
701 HB2 SER 100 1HB SER 100 18.873 20.065 -4.315
702 HB3 SER 100 2HB SER 100 18.176 18.699 -5.185
703 HG SER 100 HG SER 100 17.452 21.355 -5.803
704 HA PRO 101 HA PRO 101 15.903 23.182 -1.668
705 HB2 PRO 101 1HB PRO 101 17.905 23.453 0.146
706 HB3 PRO 101 2HB PRO 101 16.510 22.399 0.405
707 HG2 PRO 101 1HG PRO 101 19.269 21.698 -0.523
708 HG3 PRO 101 2HG PRO 101 18.234 20.857 0.647
709 HD2 PRO 101 1HD PRO 101 18.508 20.028 -1.916
710 HD3 PRO 101 2HD PRO 101 17.001 19.818 -1.000
711 H SER 102 H SER 102 19.063 22.416 -2.953
712 HA SER 102 HA SER 102 20.496 24.687 -2.887
713 HB2 SER 102 1HB SER 102 20.032 23.064 -5.401
714 HB3 SER 102 2HB SER 102 21.404 24.129 -5.096
715 HG SER 102 HG SER 102 22.303 22.606 -3.966
716 H SER 103 H SER 103 20.459 26.718 -3.689
717 HA SER 103 HA SER 103 17.997 27.556 -5.030
718 HB2 SER 103 1HB SER 103 18.663 29.839 -4.387
719 HB3 SER 103 2HB SER 103 18.624 28.766 -2.988
720 HG SER 103 HG SER 103 20.592 29.421 -2.685
721 H GLY 104 H GLY 104 17.939 28.193 -7.094
722 HA2 GLY 104 1HA GLY 104 20.363 29.130 -8.413
723 HA3 GLY 104 2HA GLY 104 19.666 27.644 -9.041
724 HA PRO 105 HA PRO 105 17.759 31.387 -11.132
725 HB2 PRO 105 1HB PRO 105 18.475 30.701 -13.659
726 HB3 PRO 105 2HB PRO 105 19.503 31.674 -12.600
727 HG2 PRO 105 1HG PRO 105 19.643 28.746 -13.209
728 HG3 PRO 105 2HG PRO 105 20.960 29.928 -13.087
729 HD2 PRO 105 1HD PRO 105 20.351 28.213 -11.082
730 HD3 PRO 105 2HD PRO 105 20.993 29.841 -10.784
731 H SER 106 H SER 106 15.633 31.047 -11.244
732 HA SER 106 HA SER 106 14.657 28.802 -12.872
733 HB2 SER 106 1HB SER 106 14.382 28.092 -10.578
734 HB3 SER 106 2HB SER 106 13.634 29.629 -10.146
735 HG SER 106 HG SER 106 12.045 28.060 -10.478
736 H SER 107 H SER 107 12.865 29.210 -14.107
737 HA SER 107 HA SER 107 11.346 31.647 -13.762
738 HB2 SER 107 1HB SER 107 13.537 32.049 -15.197
739 HB3 SER 107 2HB SER 107 12.558 31.332 -16.476
740 HG SER 107 HG SER 107 10.920 32.956 -15.741
741 H GLY 108 H GLY 108 9.383 31.646 -14.886
742 HA2 GLY 108 1HA GLY 108 8.439 29.012 -15.599
743 HA3 GLY 108 2HA GLY 108 7.478 30.482 -15.521
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -5.646 -29.242 9.516
2 HA2 GLY 1 1HA GLY 1 -3.775 -29.934 7.547
3 HA3 GLY 1 2HA GLY 1 -4.760 -31.352 7.876
4 H SER 2 H SER 2 -4.447 -28.903 5.797
5 HA SER 2 HA SER 2 -7.343 -28.563 5.400
6 HB2 SER 2 1HB SER 2 -6.909 -26.500 4.321
7 HB3 SER 2 2HB SER 2 -5.837 -26.514 5.722
8 HG SER 2 HG SER 2 -5.098 -27.244 3.079
9 H SER 3 H SER 3 -8.190 -28.688 3.260
10 HA SER 3 HA SER 3 -6.788 -30.663 1.636
11 HB2 SER 3 1HB SER 3 -9.166 -31.038 2.232
12 HB3 SER 3 2HB SER 3 -9.600 -29.575 1.348
13 HG SER 3 HG SER 3 -9.863 -31.101 -0.146
14 H GLY 4 H GLY 4 -6.327 -30.395 -0.555
15 HA2 GLY 4 1HA GLY 4 -5.650 -29.250 -2.425
16 HA3 GLY 4 2HA GLY 4 -6.997 -28.166 -2.115
17 H SER 5 H SER 5 -3.699 -28.862 -0.973
18 HA SER 5 HA SER 5 -3.395 -26.082 -0.149
19 HB2 SER 5 1HB SER 5 -1.747 -28.571 0.239
20 HB3 SER 5 2HB SER 5 -1.074 -26.975 0.570
21 HG SER 5 HG SER 5 -2.500 -28.407 2.194
22 H SER 6 H SER 6 -3.705 -26.449 -2.908
23 HA SER 6 HA SER 6 -1.252 -25.231 -3.844
24 HB2 SER 6 1HB SER 6 -0.959 -26.779 -5.732
25 HB3 SER 6 2HB SER 6 -0.793 -27.622 -4.192
26 HG SER 6 HG SER 6 -2.561 -28.043 -6.188
27 H GLY 7 H GLY 7 -1.526 -24.735 -6.312
28 HA2 GLY 7 1HA GLY 7 -2.691 -23.591 -7.924
29 HA3 GLY 7 2HA GLY 7 -4.093 -24.535 -7.441
30 H LEU 8 H LEU 8 -2.428 -21.513 -7.149
31 HA LEU 8 HA LEU 8 -4.776 -20.410 -5.761
32 HB2 LEU 8 1HB LEU 8 -1.884 -20.097 -5.125
33 HB3 LEU 8 2HB LEU 8 -2.961 -18.729 -4.852
34 HG LEU 8 HG LEU 8 -3.408 -21.454 -3.646
35 HD11 LEU 8 1HD1 LEU 8 -2.581 -20.274 -1.541
36 HD12 LEU 8 2HD1 LEU 8 -1.848 -19.099 -2.632
37 HD13 LEU 8 3HD1 LEU 8 -1.367 -20.794 -2.710
38 HD21 LEU 8 3HD2 LEU 8 -5.157 -19.413 -3.932
39 HD22 LEU 8 1HD2 LEU 8 -4.420 -18.997 -2.384
40 HD23 LEU 8 2HD2 LEU 8 -5.193 -20.568 -2.599
41 H ALA 9 H ALA 9 -5.656 -18.676 -6.705
42 HA ALA 9 HA ALA 9 -4.100 -17.306 -8.802
43 HB1 ALA 9 3HB ALA 9 -6.372 -16.868 -9.860
44 HB2 ALA 9 1HB ALA 9 -5.753 -18.517 -9.950
45 HB3 ALA 9 2HB ALA 9 -6.996 -18.105 -8.768
46 HA PRO 10 HA PRO 10 -4.771 -13.574 -6.566
47 HB2 PRO 10 1HB PRO 10 -4.465 -11.794 -8.593
48 HB3 PRO 10 2HB PRO 10 -3.110 -12.670 -7.871
49 HG2 PRO 10 1HG PRO 10 -4.605 -13.244 -10.400
50 HG3 PRO 10 2HG PRO 10 -2.859 -13.297 -10.097
51 HD2 PRO 10 1HD PRO 10 -4.396 -15.525 -10.150
52 HD3 PRO 10 2HD PRO 10 -2.966 -15.376 -9.108
53 HA PRO 11 HA PRO 11 -9.090 -12.733 -7.135
54 HB2 PRO 11 1HB PRO 11 -9.271 -10.678 -5.369
55 HB3 PRO 11 2HB PRO 11 -9.152 -12.369 -4.867
56 HG2 PRO 11 1HG PRO 11 -7.011 -10.281 -5.011
57 HG3 PRO 11 2HG PRO 11 -7.319 -11.483 -3.744
58 HD2 PRO 11 1HD PRO 11 -5.395 -11.806 -5.622
59 HD3 PRO 11 2HD PRO 11 -6.284 -13.173 -4.920
60 H ARG 12 H ARG 12 -6.938 -9.893 -6.880
61 HA ARG 12 HA ARG 12 -7.964 -8.867 -9.390
62 HB2 ARG 12 1HB ARG 12 -8.440 -7.512 -6.746
63 HB3 ARG 12 2HB ARG 12 -8.366 -6.594 -8.243
64 HG2 ARG 12 1HG ARG 12 -10.261 -8.879 -7.751
65 HG3 ARG 12 2HG ARG 12 -10.664 -7.176 -7.523
66 HD2 ARG 12 1HD ARG 12 -9.993 -6.823 -9.930
67 HD3 ARG 12 2HD ARG 12 -9.929 -8.579 -10.082
68 HE ARG 12 HE ARG 12 -12.410 -8.012 -9.037
69 HH11 ARG 12 1HH1 ARG 12 -10.633 -7.186 -11.915
70 HH12 ARG 12 2HH1 ARG 12 -12.049 -7.031 -12.901
71 HH21 ARG 12 1HH2 ARG 12 -14.281 -7.810 -10.325
72 HH22 ARG 12 2HH2 ARG 12 -14.123 -7.385 -11.996
73 H HIS 13 H HIS 13 -6.907 -6.532 -9.688
74 HA HIS 13 HA HIS 13 -4.049 -6.921 -9.137
75 HB2 HIS 13 1HB HIS 13 -5.560 -5.506 -11.311
76 HB3 HIS 13 2HB HIS 13 -3.885 -5.079 -10.975
77 HD1 HIS 13 1HD HIS 13 -6.001 -7.937 -12.203
78 HD2 HIS 13 2HD HIS 13 -1.996 -6.876 -11.897
79 HE1 HIS 13 1HE HIS 13 -4.746 -9.658 -13.539
80 HE2 HIS 13 2HE HIS 13 -2.318 -9.045 -13.269
81 H LEU 14 H LEU 14 -2.802 -4.766 -9.025
82 HA LEU 14 HA LEU 14 -4.209 -3.021 -7.118
83 HB2 LEU 14 1HB LEU 14 -1.401 -3.984 -7.322
84 HB3 LEU 14 2HB LEU 14 -1.693 -2.395 -6.618
85 HG LEU 14 HG LEU 14 -2.847 -4.995 -5.610
86 HD11 LEU 14 1HD1 LEU 14 -0.892 -5.280 -4.603
87 HD12 LEU 14 2HD1 LEU 14 -1.213 -3.811 -3.683
88 HD13 LEU 14 3HD1 LEU 14 -0.299 -3.725 -5.188
89 HD21 LEU 14 3HD2 LEU 14 -3.350 -3.486 -3.608
90 HD22 LEU 14 1HD2 LEU 14 -4.379 -3.324 -5.031
91 HD23 LEU 14 2HD2 LEU 14 -3.109 -2.139 -4.722
92 H GLY 15 H GLY 15 -3.457 -0.733 -7.083
93 HA2 GLY 15 1HA GLY 15 -2.456 0.222 -9.670
94 HA3 GLY 15 2HA GLY 15 -4.023 0.799 -9.122
95 H PHE 16 H PHE 16 -1.363 2.139 -9.607
96 HA PHE 16 HA PHE 16 -1.267 3.556 -7.035
97 HB2 PHE 16 1HB PHE 16 1.121 2.752 -8.709
98 HB3 PHE 16 2HB PHE 16 1.187 3.811 -7.304
99 HD1 PHE 16 1HD PHE 16 0.854 2.927 -5.063
100 HD2 PHE 16 2HD PHE 16 0.831 0.381 -8.473
101 HE1 PHE 16 1HE PHE 16 1.118 0.968 -3.597
102 HE2 PHE 16 2HE PHE 16 1.095 -1.582 -7.013
103 HZ PHE 16 HZ PHE 16 1.238 -1.290 -4.572
104 H SER 17 H SER 17 -1.894 5.575 -7.364
105 HA SER 17 HA SER 17 -0.923 6.990 -9.747
106 HB2 SER 17 1HB SER 17 -3.404 6.144 -9.837
107 HB3 SER 17 2HB SER 17 -3.708 7.506 -8.759
108 HG SER 17 HG SER 17 -2.152 8.168 -10.903
109 H ASP 18 H ASP 18 -1.323 9.411 -9.519
110 HA ASP 18 HA ASP 18 -0.704 11.317 -8.429
111 HB2 ASP 18 1HB ASP 18 -2.378 10.132 -6.205
112 HB3 ASP 18 2HB ASP 18 -1.978 11.834 -6.419
113 H VAL 19 H VAL 19 0.982 8.900 -8.069
114 HA VAL 19 HA VAL 19 1.982 8.800 -5.428
115 HB VAL 19 HB VAL 19 3.374 8.088 -8.014
116 HG11 VAL 19 1HG1 VAL 19 4.670 6.560 -6.409
117 HG12 VAL 19 2HG1 VAL 19 5.085 8.275 -6.436
118 HG13 VAL 19 3HG1 VAL 19 4.083 7.629 -5.136
119 HG21 VAL 19 3HG2 VAL 19 1.574 6.654 -7.967
120 HG22 VAL 19 1HG2 VAL 19 2.768 5.729 -7.055
121 HG23 VAL 19 2HG2 VAL 19 1.507 6.622 -6.205
122 H SER 20 H SER 20 3.678 9.823 -4.441
123 HA SER 20 HA SER 20 5.040 11.951 -5.944
124 HB2 SER 20 1HB SER 20 3.663 12.194 -3.268
125 HB3 SER 20 2HB SER 20 4.880 13.347 -3.815
126 HG SER 20 HG SER 20 3.396 13.358 -5.804
127 H HIS 21 H HIS 21 6.853 12.898 -4.415
128 HA HIS 21 HA HIS 21 8.554 10.651 -3.773
129 HB2 HIS 21 1HB HIS 21 10.290 12.389 -3.407
130 HB3 HIS 21 2HB HIS 21 9.526 12.509 -4.990
131 HD1 HIS 21 1HD HIS 21 7.780 14.490 -5.287
132 HD2 HIS 21 2HD HIS 21 10.084 14.629 -1.833
133 HE1 HIS 21 1HE HIS 21 7.542 16.836 -4.414
134 HE2 HIS 21 2HE HIS 21 9.012 16.921 -2.371
135 H ASP 22 H ASP 22 6.201 12.113 -2.102
136 HA ASP 22 HA ASP 22 7.531 11.598 0.469
137 HB2 ASP 22 1HB ASP 22 6.005 13.495 1.358
138 HB3 ASP 22 2HB ASP 22 7.478 13.933 0.499
139 H ALA 23 H ALA 23 5.272 10.562 -1.560
140 HA ALA 23 HA ALA 23 3.886 9.038 0.375
141 HB1 ALA 23 3HB ALA 23 1.616 10.240 -0.554
142 HB2 ALA 23 1HB ALA 23 2.366 10.550 1.012
143 HB3 ALA 23 2HB ALA 23 2.707 11.611 -0.355
144 H ALA 24 H ALA 24 1.979 7.851 -0.664
145 HA ALA 24 HA ALA 24 1.969 7.718 -3.542
146 HB1 ALA 24 3HB ALA 24 2.720 5.420 -3.732
147 HB2 ALA 24 1HB ALA 24 3.981 6.415 -3.002
148 HB3 ALA 24 2HB ALA 24 3.004 5.347 -1.992
149 H ARG 25 H ARG 25 -0.005 7.161 -4.208
150 HA ARG 25 HA ARG 25 -1.909 6.170 -2.238
151 HB2 ARG 25 1HB ARG 25 -2.382 8.144 -3.758
152 HB3 ARG 25 2HB ARG 25 -2.476 6.993 -5.084
153 HG2 ARG 25 1HG ARG 25 -4.320 5.848 -3.961
154 HG3 ARG 25 2HG ARG 25 -4.224 7.006 -2.633
155 HD2 ARG 25 1HD ARG 25 -4.576 7.977 -5.437
156 HD3 ARG 25 2HD ARG 25 -5.962 7.349 -4.546
157 HE ARG 25 HE ARG 25 -4.501 9.305 -3.060
158 HH11 ARG 25 1HH1 ARG 25 -6.902 8.861 -5.542
159 HH12 ARG 25 2HH1 ARG 25 -7.659 10.395 -5.266
160 HH21 ARG 25 1HH2 ARG 25 -5.489 11.328 -2.688
161 HH22 ARG 25 2HH2 ARG 25 -6.853 11.798 -3.644
162 H VAL 26 H VAL 26 -2.699 4.159 -2.202
163 HA VAL 26 HA VAL 26 -2.159 2.413 -4.516
164 HB VAL 26 HB VAL 26 -0.658 1.780 -2.726
165 HG11 VAL 26 1HG1 VAL 26 -1.204 1.993 -0.586
166 HG12 VAL 26 2HG1 VAL 26 -2.831 2.485 -1.062
167 HG13 VAL 26 3HG1 VAL 26 -2.473 0.783 -0.767
168 HG21 VAL 26 3HG2 VAL 26 -1.086 -0.209 -3.683
169 HG22 VAL 26 1HG2 VAL 26 -1.964 -0.542 -2.190
170 HG23 VAL 26 2HG2 VAL 26 -2.833 0.021 -3.618
171 H PHE 27 H PHE 27 -4.020 1.909 -5.455
172 HA PHE 27 HA PHE 27 -6.352 1.359 -3.739
173 HB2 PHE 27 1HB PHE 27 -7.803 2.256 -5.415
174 HB3 PHE 27 2HB PHE 27 -6.526 3.440 -5.152
175 HD1 PHE 27 1HD PHE 27 -4.674 3.629 -6.811
176 HD2 PHE 27 2HD PHE 27 -8.141 1.265 -7.524
177 HE1 PHE 27 1HE PHE 27 -4.169 3.621 -9.219
178 HE2 PHE 27 2HE PHE 27 -7.641 1.252 -9.932
179 HZ PHE 27 HZ PHE 27 -5.652 2.430 -10.783
180 H TRP 28 H TRP 28 -7.874 -0.220 -4.578
181 HA TRP 28 HA TRP 28 -6.641 -2.145 -6.435
182 HB2 TRP 28 1HB TRP 28 -7.902 -3.897 -4.990
183 HB3 TRP 28 2HB TRP 28 -6.378 -3.244 -4.395
184 HD1 TRP 28 HD TRP 28 -9.982 -3.616 -3.473
185 HE1 TRP 28 1HE TRP 28 -10.434 -2.456 -1.220
186 HE3 TRP 28 3HE TRP 28 -5.586 -1.052 -2.983
187 HZ2 TRP 28 2HZ TRP 28 -9.104 -0.688 0.532
188 HZ3 TRP 28 3HZ TRP 28 -5.255 0.352 -0.989
189 HH2 TRP 28 HH TRP 28 -6.979 0.529 0.731
190 H GLU 29 H GLU 29 -8.240 -3.669 -7.398
191 HA GLU 29 HA GLU 29 -10.512 -2.173 -8.358
192 HB2 GLU 29 1HB GLU 29 -9.177 -4.737 -9.081
193 HB3 GLU 29 2HB GLU 29 -10.854 -4.520 -9.559
194 HG2 GLU 29 1HG GLU 29 -10.366 -2.791 -10.997
195 HG3 GLU 29 2HG GLU 29 -8.861 -2.390 -10.172
196 H GLY 30 H GLY 30 -10.240 -3.407 -5.530
197 HA2 GLY 30 1HA GLY 30 -11.879 -3.977 -3.991
198 HA3 GLY 30 2HA GLY 30 -13.028 -4.115 -5.314
199 H ALA 31 H ALA 31 -13.619 -5.995 -3.840
200 HA ALA 31 HA ALA 31 -12.153 -8.376 -4.763
201 HB1 ALA 31 3HB ALA 31 -12.030 -7.571 -2.205
202 HB2 ALA 31 1HB ALA 31 -13.486 -8.565 -2.137
203 HB3 ALA 31 2HB ALA 31 -11.966 -9.264 -2.695
204 HA PRO 32 HA PRO 32 -16.007 -10.000 -6.094
205 HB2 PRO 32 1HB PRO 32 -15.687 -12.651 -5.608
206 HB3 PRO 32 2HB PRO 32 -14.842 -11.804 -6.909
207 HG2 PRO 32 1HG PRO 32 -13.854 -12.562 -4.186
208 HG3 PRO 32 2HG PRO 32 -13.027 -12.683 -5.750
209 HD2 PRO 32 1HD PRO 32 -12.549 -10.673 -4.000
210 HD3 PRO 32 2HD PRO 32 -12.450 -10.451 -5.758
211 H ARG 33 H ARG 33 -15.188 -9.877 -2.877
212 HA ARG 33 HA ARG 33 -17.907 -10.619 -2.086
213 HB2 ARG 33 1HB ARG 33 -17.257 -12.025 -0.339
214 HB3 ARG 33 2HB ARG 33 -16.186 -12.492 -1.654
215 HG2 ARG 33 1HG ARG 33 -14.362 -11.300 -0.698
216 HG3 ARG 33 2HG ARG 33 -15.412 -10.546 0.504
217 HD2 ARG 33 1HD ARG 33 -15.190 -13.525 0.352
218 HD3 ARG 33 2HD ARG 33 -13.942 -12.585 1.169
219 HE ARG 33 HE ARG 33 -16.268 -11.679 2.252
220 HH11 ARG 33 1HH1 ARG 33 -14.810 -14.818 1.874
221 HH12 ARG 33 2HH1 ARG 33 -15.532 -15.470 3.307
222 HH21 ARG 33 1HH2 ARG 33 -17.225 -12.527 4.141
223 HH22 ARG 33 2HH2 ARG 33 -16.907 -14.166 4.595
224 HA PRO 34 HA PRO 34 -17.786 -6.911 0.262
225 HB2 PRO 34 1HB PRO 34 -19.469 -7.535 2.300
226 HB3 PRO 34 2HB PRO 34 -20.028 -7.230 0.651
227 HG2 PRO 34 1HG PRO 34 -19.550 -9.840 2.038
228 HG3 PRO 34 2HG PRO 34 -20.896 -9.362 0.987
229 HD2 PRO 34 1HD PRO 34 -18.827 -10.872 0.109
230 HD3 PRO 34 2HD PRO 34 -19.685 -9.725 -0.941
231 H VAL 35 H VAL 35 -16.649 -5.983 1.899
232 HA VAL 35 HA VAL 35 -15.423 -7.789 3.882
233 HB VAL 35 HB VAL 35 -14.214 -5.468 2.398
234 HG11 VAL 35 1HG1 VAL 35 -13.146 -6.783 4.894
235 HG12 VAL 35 2HG1 VAL 35 -12.283 -5.609 3.898
236 HG13 VAL 35 3HG1 VAL 35 -13.742 -5.128 4.765
237 HG21 VAL 35 3HG2 VAL 35 -13.075 -8.205 2.901
238 HG22 VAL 35 1HG2 VAL 35 -14.121 -7.849 1.527
239 HG23 VAL 35 2HG2 VAL 35 -12.576 -7.016 1.698
240 H ARG 36 H ARG 36 -14.939 -6.869 5.954
241 HA ARG 36 HA ARG 36 -16.888 -4.832 6.721
242 HB2 ARG 36 1HB ARG 36 -16.375 -5.547 9.038
243 HB3 ARG 36 2HB ARG 36 -16.929 -6.871 8.022
244 HG2 ARG 36 1HG ARG 36 -14.735 -7.754 7.827
245 HG3 ARG 36 2HG ARG 36 -14.025 -6.315 8.562
246 HD2 ARG 36 1HD ARG 36 -15.261 -6.849 10.652
247 HD3 ARG 36 2HD ARG 36 -15.802 -8.349 9.901
248 HE ARG 36 HE ARG 36 -12.953 -8.038 9.875
249 HH11 ARG 36 1HH1 ARG 36 -15.684 -9.077 11.767
250 HH12 ARG 36 2HH1 ARG 36 -14.756 -10.159 12.751
251 HH21 ARG 36 1HH2 ARG 36 -11.720 -9.460 11.164
252 HH22 ARG 36 2HH2 ARG 36 -12.501 -10.376 12.408
253 H LEU 37 H LEU 37 -13.421 -5.481 6.829
254 HA LEU 37 HA LEU 37 -12.874 -2.649 6.976
255 HB2 LEU 37 1HB LEU 37 -13.164 -3.275 9.337
256 HB3 LEU 37 2HB LEU 37 -11.905 -4.495 9.155
257 HG LEU 37 HG LEU 37 -10.431 -2.444 8.464
258 HD11 LEU 37 1HD1 LEU 37 -12.497 -1.104 10.201
259 HD12 LEU 37 2HD1 LEU 37 -12.354 -0.874 8.458
260 HD13 LEU 37 3HD1 LEU 37 -11.038 -0.381 9.523
261 HD21 LEU 37 3HD2 LEU 37 -10.527 -3.980 10.621
262 HD22 LEU 37 1HD2 LEU 37 -11.056 -2.472 11.367
263 HD23 LEU 37 2HD2 LEU 37 -9.499 -2.548 10.541
264 H VAL 38 H VAL 38 -10.629 -2.143 6.594
265 HA VAL 38 HA VAL 38 -9.077 -4.387 5.483
266 HB VAL 38 HB VAL 38 -9.347 -1.637 4.260
267 HG11 VAL 38 1HG1 VAL 38 -7.127 -2.376 3.886
268 HG12 VAL 38 2HG1 VAL 38 -7.661 -4.017 3.517
269 HG13 VAL 38 3HG1 VAL 38 -8.017 -2.701 2.398
270 HG21 VAL 38 3HG2 VAL 38 -11.241 -3.401 4.036
271 HG22 VAL 38 1HG2 VAL 38 -10.668 -2.556 2.598
272 HG23 VAL 38 2HG2 VAL 38 -10.125 -4.201 2.929
273 H ARG 39 H ARG 39 -6.805 -4.171 5.555
274 HA ARG 39 HA ARG 39 -5.743 -1.933 7.118
275 HB2 ARG 39 1HB ARG 39 -6.295 -4.180 8.434
276 HB3 ARG 39 2HB ARG 39 -4.735 -4.657 7.777
277 HG2 ARG 39 1HG ARG 39 -3.747 -2.616 8.788
278 HG3 ARG 39 2HG ARG 39 -5.307 -2.292 9.547
279 HD2 ARG 39 1HD ARG 39 -4.083 -4.976 9.925
280 HD3 ARG 39 2HD ARG 39 -3.391 -3.614 10.804
281 HE ARG 39 HE ARG 39 -6.098 -3.462 11.238
282 HH11 ARG 39 1HH1 ARG 39 -3.595 -5.818 11.788
283 HH12 ARG 39 2HH1 ARG 39 -4.363 -6.501 13.183
284 HH21 ARG 39 1HH2 ARG 39 -7.120 -4.353 13.072
285 HH22 ARG 39 2HH2 ARG 39 -6.369 -5.668 13.911
286 H VAL 40 H VAL 40 -4.337 -1.051 5.745
287 HA VAL 40 HA VAL 40 -2.806 -2.716 3.916
288 HB VAL 40 HB VAL 40 -2.755 0.289 4.217
289 HG11 VAL 40 1HG1 VAL 40 -1.950 0.088 1.803
290 HG12 VAL 40 2HG1 VAL 40 -0.809 -0.355 3.074
291 HG13 VAL 40 3HG1 VAL 40 -1.654 -1.611 2.168
292 HG21 VAL 40 3HG2 VAL 40 -4.376 0.453 2.518
293 HG22 VAL 40 1HG2 VAL 40 -4.246 -1.259 2.116
294 HG23 VAL 40 2HG2 VAL 40 -4.999 -0.764 3.631
295 H THR 41 H THR 41 -0.511 -2.622 3.759
296 HA THR 41 HA THR 41 0.980 -1.440 5.953
297 HB THR 41 HB THR 41 2.176 -3.763 6.208
298 HG1 THR 41 1HG THR 41 0.202 -5.318 6.145
299 HG21 THR 41 3HG2 THR 41 1.146 -2.691 8.077
300 HG22 THR 41 1HG2 THR 41 0.552 -4.351 8.038
301 HG23 THR 41 2HG2 THR 41 -0.470 -3.035 7.460
302 H TYR 42 H TYR 42 2.592 -0.427 4.970
303 HA TYR 42 HA TYR 42 3.798 -1.664 2.586
304 HB2 TYR 42 1HB TYR 42 4.681 0.757 2.258
305 HB3 TYR 42 2HB TYR 42 2.998 0.407 1.881
306 HD1 TYR 42 2HD TYR 42 1.246 0.950 3.666
307 HD2 TYR 42 1HD TYR 42 5.231 2.436 3.793
308 HE1 TYR 42 2HE TYR 42 0.527 2.730 5.203
309 HE2 TYR 42 1HE TYR 42 4.523 4.220 5.331
310 HH TYR 42 HH TYR 42 1.293 5.003 5.876
311 H VAL 43 H VAL 43 6.147 -1.106 2.273
312 HA VAL 43 HA VAL 43 7.715 -0.518 4.605
313 HB VAL 43 HB VAL 43 7.138 -2.886 5.026
314 HG11 VAL 43 1HG1 VAL 43 8.650 -3.426 2.472
315 HG12 VAL 43 2HG1 VAL 43 8.003 -4.638 3.580
316 HG13 VAL 43 3HG1 VAL 43 6.906 -3.586 2.683
317 HG21 VAL 43 3HG2 VAL 43 9.943 -2.007 4.535
318 HG22 VAL 43 1HG2 VAL 43 9.123 -2.368 6.054
319 HG23 VAL 43 2HG2 VAL 43 9.642 -3.681 4.997
320 H SER 44 H SER 44 9.842 -0.032 4.117
321 HA SER 44 HA SER 44 10.388 0.735 1.452
322 HB2 SER 44 1HB SER 44 11.462 2.026 3.095
323 HB3 SER 44 2HB SER 44 12.046 0.605 3.961
324 HG SER 44 HG SER 44 13.680 0.428 2.604
325 H SER 45 H SER 45 12.174 0.019 0.114
326 HA SER 45 HA SER 45 12.119 -2.689 -0.471
327 HB2 SER 45 1HB SER 45 13.016 -0.649 -1.847
328 HB3 SER 45 2HB SER 45 14.561 -1.062 -1.104
329 HG SER 45 HG SER 45 13.081 -3.125 -2.261
330 H GLU 46 H GLU 46 14.681 -0.884 1.226
331 HA GLU 46 HA GLU 46 15.946 -3.382 2.019
332 HB2 GLU 46 1HB GLU 46 17.704 -1.937 2.962
333 HB3 GLU 46 2HB GLU 46 17.391 -1.575 1.270
334 HG2 GLU 46 1HG GLU 46 17.460 0.538 2.066
335 HG3 GLU 46 2HG GLU 46 15.752 0.207 2.346
336 H GLY 47 H GLY 47 13.436 -3.180 3.106
337 HA2 GLY 47 1HA GLY 47 12.248 -3.031 5.088
338 HA3 GLY 47 2HA GLY 47 13.680 -3.835 5.713
339 H GLY 48 H GLY 48 13.504 -0.535 4.467
340 HA2 GLY 48 1HA GLY 48 14.749 0.460 6.869
341 HA3 GLY 48 2HA GLY 48 14.300 1.404 5.457
342 H HIS 49 H HIS 49 12.184 2.236 5.292
343 HA HIS 49 HA HIS 49 10.895 2.584 7.893
344 HB2 HIS 49 1HB HIS 49 11.207 4.687 6.971
345 HB3 HIS 49 2HB HIS 49 10.904 4.127 5.329
346 HD1 HIS 49 1HD HIS 49 8.757 4.924 4.426
347 HD2 HIS 49 2HD HIS 49 8.616 4.489 8.556
348 HE1 HIS 49 1HE HIS 49 6.451 5.666 5.102
349 HE2 HIS 49 2HE HIS 49 6.418 5.475 7.613
350 H SER 50 H SER 50 8.792 2.041 8.308
351 HA SER 50 HA SER 50 7.228 0.808 6.158
352 HB2 SER 50 1HB SER 50 6.657 -1.109 7.564
353 HB3 SER 50 2HB SER 50 8.404 -1.017 7.346
354 HG SER 50 HG SER 50 7.024 -1.019 9.618
355 H GLY 51 H GLY 51 4.938 0.580 6.683
356 HA2 GLY 51 1HA GLY 51 4.016 2.206 8.943
357 HA3 GLY 51 2HA GLY 51 3.529 2.688 7.325
358 H GLN 52 H GLN 52 1.414 2.333 8.614
359 HA GLN 52 HA GLN 52 0.170 0.017 7.558
360 HB2 GLN 52 1HB GLN 52 1.215 -1.165 9.364
361 HB3 GLN 52 2HB GLN 52 0.721 0.060 10.525
362 HG2 GLN 52 1HG GLN 52 -1.609 -0.560 10.212
363 HG3 GLN 52 2HG GLN 52 -1.136 -1.765 9.016
364 HE21 GLN 52 1HE2 GLN 52 -2.326 -1.665 11.897
365 HE22 GLN 52 2HE2 GLN 52 -1.486 -2.949 12.691
366 H THR 53 H THR 53 -1.683 0.889 6.930
367 HA THR 53 HA THR 53 -3.153 2.587 8.837
368 HB THR 53 HB THR 53 -2.094 3.828 6.858
369 HG1 THR 53 1HG THR 53 -3.591 5.158 7.525
370 HG21 THR 53 3HG2 THR 53 -3.364 3.753 4.763
371 HG22 THR 53 1HG2 THR 53 -4.360 2.451 5.410
372 HG23 THR 53 2HG2 THR 53 -2.640 2.187 5.126
373 H GLU 54 H GLU 54 -5.304 2.200 9.053
374 HA GLU 54 HA GLU 54 -6.370 -0.092 7.557
375 HB2 GLU 54 1HB GLU 54 -6.665 -0.721 9.728
376 HB3 GLU 54 2HB GLU 54 -6.742 0.936 10.310
377 HG2 GLU 54 1HG GLU 54 -8.970 -0.322 8.743
378 HG3 GLU 54 2HG GLU 54 -8.851 -0.451 10.497
379 H ALA 55 H ALA 55 -8.588 -0.050 6.859
380 HA ALA 55 HA ALA 55 -9.864 2.567 6.681
381 HB1 ALA 55 3HB ALA 55 -9.528 2.920 4.509
382 HB2 ALA 55 1HB ALA 55 -8.298 1.658 4.589
383 HB3 ALA 55 2HB ALA 55 -9.944 1.256 4.097
384 HA PRO 56 HA PRO 56 -13.641 0.351 6.951
385 HB2 PRO 56 1HB PRO 56 -15.270 1.671 5.226
386 HB3 PRO 56 2HB PRO 56 -14.747 2.357 6.768
387 HG2 PRO 56 1HG PRO 56 -13.675 2.847 4.017
388 HG3 PRO 56 2HG PRO 56 -13.999 4.011 5.315
389 HD2 PRO 56 1HD PRO 56 -11.511 3.091 4.770
390 HD3 PRO 56 2HD PRO 56 -12.030 3.526 6.411
391 H GLY 57 H GLY 57 -15.088 -1.112 5.900
392 HA2 GLY 57 1HA GLY 57 -13.914 -2.729 3.937
393 HA3 GLY 57 2HA GLY 57 -15.601 -2.794 4.425
394 H ASN 58 H ASN 58 -15.595 0.211 3.585
395 HA ASN 58 HA ASN 58 -16.295 -0.364 0.799
396 HB2 ASN 58 1HB ASN 58 -16.921 2.134 2.381
397 HB3 ASN 58 2HB ASN 58 -17.643 1.624 0.858
398 HD21 ASN 58 1HD2 ASN 58 -17.486 1.061 4.289
399 HD22 ASN 58 2HD2 ASN 58 -18.927 0.115 4.401
400 H ALA 59 H ALA 59 -13.556 0.277 2.097
401 HA ALA 59 HA ALA 59 -12.828 2.646 0.544
402 HB1 ALA 59 3HB ALA 59 -12.121 2.075 3.020
403 HB2 ALA 59 1HB ALA 59 -10.842 1.179 2.200
404 HB3 ALA 59 2HB ALA 59 -11.024 2.911 1.921
405 H THR 60 H THR 60 -12.099 2.403 -1.454
406 HA THR 60 HA THR 60 -10.781 -0.129 -2.181
407 HB THR 60 HB THR 60 -11.408 0.368 -4.515
408 HG1 THR 60 1HG THR 60 -12.319 2.721 -3.313
409 HG21 THR 60 3HG2 THR 60 -12.899 -1.049 -3.279
410 HG22 THR 60 1HG2 THR 60 -13.877 0.060 -4.239
411 HG23 THR 60 2HG2 THR 60 -13.664 0.341 -2.511
412 H SER 61 H SER 61 -9.808 2.646 -1.122
413 HA SER 61 HA SER 61 -7.320 2.601 -2.503
414 HB2 SER 61 1HB SER 61 -7.471 4.959 -3.377
415 HB3 SER 61 2HB SER 61 -8.476 3.795 -4.239
416 HG SER 61 HG SER 61 -10.083 4.605 -2.477
417 H ALA 62 H ALA 62 -5.734 3.563 -1.320
418 HA ALA 62 HA ALA 62 -6.417 5.471 0.764
419 HB1 ALA 62 3HB ALA 62 -4.983 3.966 2.367
420 HB2 ALA 62 1HB ALA 62 -6.712 3.682 2.164
421 HB3 ALA 62 2HB ALA 62 -5.546 2.675 1.305
422 H MET 63 H MET 63 -4.708 6.762 1.390
423 HA MET 63 HA MET 63 -2.380 6.654 -0.349
424 HB2 MET 63 1HB MET 63 -3.365 8.721 1.619
425 HB3 MET 63 2HB MET 63 -1.856 8.875 0.730
426 HG2 MET 63 1HG MET 63 -3.369 8.511 -1.355
427 HG3 MET 63 2HG MET 63 -4.661 9.005 -0.264
428 HE1 MET 63 3HE MET 63 -1.197 11.522 -1.853
429 HE2 MET 63 1HE MET 63 -1.205 9.776 -1.607
430 HE3 MET 63 2HE MET 63 -2.193 10.491 -2.881
431 H LEU 64 H LEU 64 -0.212 7.101 0.597
432 HA LEU 64 HA LEU 64 0.121 6.037 3.309
433 HB2 LEU 64 1HB LEU 64 1.871 5.143 1.037
434 HB3 LEU 64 2HB LEU 64 1.785 4.488 2.671
435 HG LEU 64 HG LEU 64 -0.457 4.267 0.669
436 HD11 LEU 64 1HD1 LEU 64 2.020 2.720 0.964
437 HD12 LEU 64 2HD1 LEU 64 0.925 2.867 -0.411
438 HD13 LEU 64 3HD1 LEU 64 0.541 1.761 0.908
439 HD21 LEU 64 3HD2 LEU 64 -1.566 3.037 2.210
440 HD22 LEU 64 1HD2 LEU 64 -0.606 4.003 3.331
441 HD23 LEU 64 2HD2 LEU 64 -0.088 2.371 2.906
442 H GLY 65 H GLY 65 1.822 6.885 4.450
443 HA2 GLY 65 1HA GLY 65 4.138 8.030 3.674
444 HA3 GLY 65 2HA GLY 65 2.974 9.312 3.373
445 HA PRO 66 HA PRO 66 4.687 10.674 3.944
446 HB2 PRO 66 1HB PRO 66 6.967 11.331 5.261
447 HB3 PRO 66 2HB PRO 66 5.473 12.264 5.404
448 HG2 PRO 66 1HG PRO 66 6.600 10.198 7.254
449 HG3 PRO 66 2HG PRO 66 5.849 11.757 7.642
450 HD2 PRO 66 1HD PRO 66 4.515 9.409 7.839
451 HD3 PRO 66 2HD PRO 66 3.711 10.930 7.401
452 H LEU 67 H LEU 67 5.792 9.660 2.395
453 HA LEU 67 HA LEU 67 7.391 7.311 3.112
454 HB2 LEU 67 1HB LEU 67 6.469 8.200 0.386
455 HB3 LEU 67 2HB LEU 67 7.192 6.649 0.806
456 HG LEU 67 HG LEU 67 4.479 7.638 1.682
457 HD11 LEU 67 1HD1 LEU 67 3.540 6.400 0.032
458 HD12 LEU 67 2HD1 LEU 67 4.851 5.220 0.015
459 HD13 LEU 67 3HD1 LEU 67 5.063 6.785 -0.772
460 HD21 LEU 67 3HD2 LEU 67 5.525 6.230 3.376
461 HD22 LEU 67 1HD2 LEU 67 5.855 4.996 2.161
462 HD23 LEU 67 2HD2 LEU 67 4.189 5.387 2.591
463 H SER 68 H SER 68 9.174 6.994 1.221
464 HA SER 68 HA SER 68 10.905 9.348 1.485
465 HB2 SER 68 1HB SER 68 11.554 6.928 2.236
466 HB3 SER 68 2HB SER 68 11.865 6.673 0.519
467 HG SER 68 HG SER 68 12.944 8.916 1.826
468 H SER 69 H SER 69 12.633 9.288 -0.448
469 HA SER 69 HA SER 69 11.024 9.476 -2.903
470 HB2 SER 69 1HB SER 69 12.878 11.006 -3.684
471 HB3 SER 69 2HB SER 69 11.943 11.610 -2.316
472 HG SER 69 HG SER 69 14.522 10.438 -2.280
473 H SER 70 H SER 70 11.876 8.733 -4.881
474 HA SER 70 HA SER 70 12.753 7.030 -6.137
475 HB2 SER 70 1HB SER 70 14.560 8.668 -6.243
476 HB3 SER 70 2HB SER 70 15.247 8.039 -4.746
477 HG SER 70 HG SER 70 16.373 6.973 -6.236
478 H THR 71 H THR 71 11.767 6.241 -3.509
479 HA THR 71 HA THR 71 13.448 3.856 -3.084
480 HB THR 71 HB THR 71 11.785 5.293 -1.005
481 HG1 THR 71 1HG THR 71 14.053 6.035 -1.837
482 HG21 THR 71 3HG2 THR 71 12.052 3.537 0.361
483 HG22 THR 71 1HG2 THR 71 13.742 3.332 -0.098
484 HG23 THR 71 2HG2 THR 71 12.467 2.621 -1.087
485 H THR 72 H THR 72 12.485 1.960 -3.416
486 HA THR 72 HA THR 72 9.723 1.865 -4.201
487 HB THR 72 HB THR 72 11.548 -0.498 -3.748
488 HG1 THR 72 1HG THR 72 11.281 1.213 -6.010
489 HG21 THR 72 3HG2 THR 72 9.860 -0.853 -5.964
490 HG22 THR 72 1HG2 THR 72 8.849 -0.172 -4.689
491 HG23 THR 72 2HG2 THR 72 9.757 -1.656 -4.397
492 H TYR 73 H TYR 73 8.018 1.419 -2.969
493 HA TYR 73 HA TYR 73 8.496 0.287 -0.290
494 HB2 TYR 73 1HB TYR 73 6.618 2.406 -1.261
495 HB3 TYR 73 2HB TYR 73 6.172 1.436 0.138
496 HD1 TYR 73 2HD TYR 73 7.404 1.625 2.229
497 HD2 TYR 73 1HD TYR 73 8.452 3.991 -1.149
498 HE1 TYR 73 2HE TYR 73 8.756 3.083 3.677
499 HE2 TYR 73 1HE TYR 73 9.808 5.454 0.290
500 HH TYR 73 HH TYR 73 9.756 6.061 2.869
501 H THR 74 H THR 74 7.789 -1.715 -0.053
502 HA THR 74 HA THR 74 5.981 -2.908 -1.947
503 HB THR 74 HB THR 74 7.047 -4.113 0.612
504 HG1 THR 74 1HG THR 74 8.115 -4.150 -2.033
505 HG21 THR 74 3HG2 THR 74 5.697 -5.802 0.052
506 HG22 THR 74 1HG2 THR 74 6.746 -6.071 -1.340
507 HG23 THR 74 2HG2 THR 74 5.306 -5.065 -1.501
508 H VAL 75 H VAL 75 3.984 -1.936 -1.719
509 HA VAL 75 HA VAL 75 2.705 -1.625 0.823
510 HB VAL 75 HB VAL 75 1.580 -1.456 -1.976
511 HG11 VAL 75 1HG1 VAL 75 0.345 -0.798 0.691
512 HG12 VAL 75 2HG1 VAL 75 -0.293 -0.224 -0.851
513 HG13 VAL 75 3HG1 VAL 75 -0.231 -1.954 -0.509
514 HG21 VAL 75 3HG2 VAL 75 2.320 0.734 -0.038
515 HG22 VAL 75 1HG2 VAL 75 3.307 0.221 -1.407
516 HG23 VAL 75 2HG2 VAL 75 1.720 0.938 -1.684
517 H ARG 76 H ARG 76 0.920 -2.756 1.637
518 HA ARG 76 HA ARG 76 0.232 -5.287 0.333
519 HB2 ARG 76 1HB ARG 76 2.060 -5.542 2.132
520 HB3 ARG 76 2HB ARG 76 0.782 -5.192 3.289
521 HG2 ARG 76 1HG ARG 76 -0.489 -7.116 2.438
522 HG3 ARG 76 2HG ARG 76 0.839 -7.481 1.333
523 HD2 ARG 76 1HD ARG 76 1.337 -8.878 3.085
524 HD3 ARG 76 2HD ARG 76 2.267 -7.447 3.527
525 HE ARG 76 HE ARG 76 -0.058 -7.012 4.788
526 HH11 ARG 76 1HH1 ARG 76 2.016 -9.804 4.634
527 HH12 ARG 76 2HH1 ARG 76 1.588 -10.371 6.215
528 HH21 ARG 76 1HH2 ARG 76 -0.629 -7.749 6.870
529 HH22 ARG 76 2HH2 ARG 76 0.083 -9.202 7.485
530 H VAL 77 H VAL 77 -1.879 -5.054 -0.027
531 HA VAL 77 HA VAL 77 -3.551 -3.673 1.930
532 HB VAL 77 HB VAL 77 -4.263 -4.713 -0.816
533 HG11 VAL 77 1HG1 VAL 77 -5.940 -4.032 1.294
534 HG12 VAL 77 2HG1 VAL 77 -5.933 -2.609 0.251
535 HG13 VAL 77 3HG1 VAL 77 -6.385 -4.182 -0.406
536 HG21 VAL 77 3HG2 VAL 77 -3.054 -2.204 0.135
537 HG22 VAL 77 1HG2 VAL 77 -2.982 -2.972 -1.451
538 HG23 VAL 77 2HG2 VAL 77 -4.394 -2.018 -0.996
539 H THR 78 H THR 78 -4.060 -5.006 3.576
540 HA THR 78 HA THR 78 -4.897 -7.750 2.994
541 HB THR 78 HB THR 78 -4.639 -6.562 5.748
542 HG1 THR 78 1HG THR 78 -2.528 -7.968 4.509
543 HG21 THR 78 3HG2 THR 78 -4.866 -8.672 6.492
544 HG22 THR 78 1HG2 THR 78 -3.840 -9.332 5.219
545 HG23 THR 78 2HG2 THR 78 -5.541 -8.998 4.896
546 H CYS 79 H CYS 79 -6.981 -8.148 2.703
547 HA CYS 79 HA CYS 79 -8.957 -6.338 3.906
548 HB2 CYS 79 1HB CYS 79 -9.391 -8.364 1.704
549 HB3 CYS 79 2HB CYS 79 -10.509 -7.108 2.223
550 HG CYS 79 HG CYS 79 -9.001 -4.995 1.265
551 H LEU 80 H LEU 80 -9.838 -7.019 5.735
552 HA LEU 80 HA LEU 80 -9.911 -9.868 6.347
553 HB2 LEU 80 1HB LEU 80 -10.276 -7.362 7.938
554 HB3 LEU 80 2HB LEU 80 -10.847 -8.905 8.569
555 HG LEU 80 HG LEU 80 -8.727 -8.527 9.537
556 HD11 LEU 80 1HD1 LEU 80 -9.190 -10.806 8.553
557 HD12 LEU 80 2HD1 LEU 80 -7.496 -10.422 8.854
558 HD13 LEU 80 3HD1 LEU 80 -8.139 -10.343 7.214
559 HD21 LEU 80 3HD2 LEU 80 -6.933 -7.562 8.544
560 HD22 LEU 80 1HD2 LEU 80 -8.183 -6.898 7.492
561 HD23 LEU 80 2HD2 LEU 80 -7.256 -8.308 6.978
562 H TYR 81 H TYR 81 -11.617 -10.954 5.620
563 HA TYR 81 HA TYR 81 -14.147 -9.675 5.129
564 HB2 TYR 81 1HB TYR 81 -13.396 -12.602 4.991
565 HB3 TYR 81 2HB TYR 81 -14.875 -11.887 4.360
566 HD1 TYR 81 2HD TYR 81 -14.415 -9.835 2.689
567 HD2 TYR 81 1HD TYR 81 -11.702 -13.015 3.486
568 HE1 TYR 81 2HE TYR 81 -13.298 -9.413 0.539
569 HE2 TYR 81 1HE TYR 81 -10.577 -12.601 1.338
570 HH TYR 81 HH TYR 81 -10.596 -10.047 -0.285
571 HA PRO 82 HA PRO 82 -16.049 -10.411 9.027
572 HB2 PRO 82 1HB PRO 82 -18.649 -10.456 8.250
573 HB3 PRO 82 2HB PRO 82 -17.696 -8.970 8.329
574 HG2 PRO 82 1HG PRO 82 -18.360 -10.670 5.956
575 HG3 PRO 82 2HG PRO 82 -18.367 -8.903 6.103
576 HD2 PRO 82 1HD PRO 82 -16.333 -10.261 4.941
577 HD3 PRO 82 2HD PRO 82 -16.084 -8.746 5.833
578 H GLY 83 H GLY 83 -15.837 -12.689 6.623
579 HA2 GLY 83 1HA GLY 83 -17.452 -14.660 8.108
580 HA3 GLY 83 2HA GLY 83 -16.986 -14.806 6.419
581 H GLY 84 H GLY 84 -15.862 -16.679 6.421
582 HA2 GLY 84 1HA GLY 84 -13.647 -16.923 8.356
583 HA3 GLY 84 2HA GLY 84 -14.454 -18.281 7.586
584 H GLY 85 H GLY 85 -12.503 -15.405 6.818
585 HA2 GLY 85 1HA GLY 85 -10.522 -16.750 5.416
586 HA3 GLY 85 2HA GLY 85 -11.748 -16.312 4.235
587 H SER 86 H SER 86 -9.425 -15.258 3.706
588 HA SER 86 HA SER 86 -9.852 -12.447 3.981
589 HB2 SER 86 1HB SER 86 -7.596 -12.009 5.048
590 HB3 SER 86 2HB SER 86 -8.817 -12.687 6.124
591 HG SER 86 HG SER 86 -7.851 -14.749 5.745
592 H SER 87 H SER 87 -8.210 -11.182 2.800
593 HA SER 87 HA SER 87 -6.552 -12.730 0.958
594 HB2 SER 87 1HB SER 87 -8.874 -10.998 0.180
595 HB3 SER 87 2HB SER 87 -7.484 -11.130 -0.896
596 HG SER 87 HG SER 87 -9.334 -12.704 -1.097
597 H THR 88 H THR 88 -4.691 -11.729 0.402
598 HA THR 88 HA THR 88 -4.372 -8.911 1.204
599 HB THR 88 HB THR 88 -2.309 -11.106 1.482
600 HG1 THR 88 1HG THR 88 -3.094 -11.301 3.429
601 HG21 THR 88 3HG2 THR 88 -0.772 -9.498 1.557
602 HG22 THR 88 1HG2 THR 88 -1.627 -8.745 2.903
603 HG23 THR 88 2HG2 THR 88 -2.012 -8.284 1.245
604 H LEU 89 H LEU 89 -3.713 -7.604 -0.370
605 HA LEU 89 HA LEU 89 -2.513 -8.810 -2.773
606 HB2 LEU 89 1HB LEU 89 -4.333 -6.471 -2.372
607 HB3 LEU 89 2HB LEU 89 -3.293 -6.551 -3.793
608 HG LEU 89 HG LEU 89 -5.067 -8.868 -3.185
609 HD11 LEU 89 1HD1 LEU 89 -6.950 -7.873 -4.246
610 HD12 LEU 89 2HD1 LEU 89 -6.043 -6.409 -4.621
611 HD13 LEU 89 3HD1 LEU 89 -6.446 -6.792 -2.947
612 HD21 LEU 89 3HD2 LEU 89 -3.306 -8.647 -5.068
613 HD22 LEU 89 1HD2 LEU 89 -4.508 -7.617 -5.846
614 HD23 LEU 89 2HD2 LEU 89 -4.901 -9.292 -5.458
615 H THR 90 H THR 90 -0.361 -8.633 -2.499
616 HA THR 90 HA THR 90 0.805 -6.226 -1.373
617 HB THR 90 HB THR 90 2.514 -8.345 -2.583
618 HG1 THR 90 1HG THR 90 2.172 -9.686 -0.782
619 HG21 THR 90 3HG2 THR 90 2.644 -6.867 0.048
620 HG22 THR 90 1HG2 THR 90 3.459 -6.366 -1.433
621 HG23 THR 90 2HG2 THR 90 3.904 -7.884 -0.651
622 H GLY 91 H GLY 91 2.421 -4.969 -2.461
623 HA2 GLY 91 1HA GLY 91 2.675 -5.261 -5.341
624 HA3 GLY 91 2HA GLY 91 1.811 -3.828 -4.804
625 H ARG 92 H ARG 92 3.544 -2.674 -5.913
626 HA ARG 92 HA ARG 92 5.637 -1.969 -4.051
627 HB2 ARG 92 1HB ARG 92 6.263 -3.189 -6.740
628 HB3 ARG 92 2HB ARG 92 7.422 -2.236 -5.823
629 HG2 ARG 92 1HG ARG 92 7.330 -3.835 -3.999
630 HG3 ARG 92 2HG ARG 92 6.117 -4.776 -4.870
631 HD2 ARG 92 1HD ARG 92 7.773 -5.074 -6.710
632 HD3 ARG 92 2HD ARG 92 8.975 -4.283 -5.690
633 HE ARG 92 HE ARG 92 7.985 -6.974 -5.443
634 HH11 ARG 92 1HH1 ARG 92 9.507 -4.308 -3.801
635 HH12 ARG 92 2HH1 ARG 92 10.242 -5.304 -2.589
636 HH21 ARG 92 1HH2 ARG 92 8.947 -8.297 -3.852
637 HH22 ARG 92 2HH2 ARG 92 9.924 -7.573 -2.619
638 H VAL 93 H VAL 93 5.627 0.171 -4.024
639 HA VAL 93 HA VAL 93 5.077 1.611 -6.539
640 HB VAL 93 HB VAL 93 3.231 2.024 -5.108
641 HG11 VAL 93 1HG1 VAL 93 5.309 2.295 -2.975
642 HG12 VAL 93 2HG1 VAL 93 3.739 3.077 -2.788
643 HG13 VAL 93 3HG1 VAL 93 3.836 1.327 -2.987
644 HG21 VAL 93 3HG2 VAL 93 3.254 4.195 -5.584
645 HG22 VAL 93 1HG2 VAL 93 4.415 4.506 -4.293
646 HG23 VAL 93 2HG2 VAL 93 4.983 4.070 -5.905
647 H THR 94 H THR 94 6.708 2.790 -7.273
648 HA THR 94 HA THR 94 8.974 3.352 -5.527
649 HB THR 94 HB THR 94 8.669 3.755 -8.509
650 HG1 THR 94 1HG THR 94 8.744 1.565 -7.996
651 HG21 THR 94 3HG2 THR 94 10.762 4.610 -8.597
652 HG22 THR 94 1HG2 THR 94 11.341 3.609 -7.267
653 HG23 THR 94 2HG2 THR 94 10.421 5.076 -6.931
654 H THR 95 H THR 95 8.742 5.144 -4.338
655 HA THR 95 HA THR 95 7.138 7.345 -4.914
656 HB THR 95 HB THR 95 8.770 8.573 -3.309
657 HG1 THR 95 1HG THR 95 10.382 7.424 -2.522
658 HG21 THR 95 3HG2 THR 95 6.859 6.389 -2.800
659 HG22 THR 95 1HG2 THR 95 6.896 8.033 -2.166
660 HG23 THR 95 2HG2 THR 95 7.925 6.790 -1.454
661 H LYS 96 H LYS 96 7.556 9.401 -5.732
662 HA LYS 96 HA LYS 96 9.361 9.517 -7.916
663 HB2 LYS 96 1HB LYS 96 7.948 11.833 -6.588
664 HB3 LYS 96 2HB LYS 96 8.574 11.776 -8.231
665 HG2 LYS 96 1HG LYS 96 6.912 9.729 -8.409
666 HG3 LYS 96 2HG LYS 96 6.106 10.587 -7.094
667 HD2 LYS 96 1HD LYS 96 5.639 12.431 -8.411
668 HD3 LYS 96 2HD LYS 96 6.942 12.078 -9.547
669 HE2 LYS 96 1HE LYS 96 5.691 10.171 -10.406
670 HE3 LYS 96 2HE LYS 96 4.401 10.479 -9.244
671 HZ1 LYS 96 3HZ LYS 96 4.692 12.858 -10.521
672 HZ2 LYS 96 1HZ LYS 96 3.499 11.704 -10.849
673 HZ3 LYS 96 2HZ LYS 96 4.919 11.736 -11.767
674 H LYS 97 H LYS 97 10.940 11.346 -8.195
675 HA LYS 97 HA LYS 97 12.865 11.237 -6.073
676 HB2 LYS 97 1HB LYS 97 12.774 12.406 -8.820
677 HB3 LYS 97 2HB LYS 97 14.003 12.983 -7.702
678 HG2 LYS 97 1HG LYS 97 15.025 10.889 -7.560
679 HG3 LYS 97 2HG LYS 97 13.617 10.057 -8.222
680 HD2 LYS 97 1HD LYS 97 15.156 12.072 -9.830
681 HD3 LYS 97 2HD LYS 97 15.650 10.379 -9.753
682 HE2 LYS 97 1HE LYS 97 13.403 9.727 -10.547
683 HE3 LYS 97 2HE LYS 97 12.984 11.433 -10.695
684 HZ1 LYS 97 3HZ LYS 97 13.927 11.481 -12.681
685 HZ2 LYS 97 1HZ LYS 97 14.249 9.823 -12.574
686 HZ3 LYS 97 2HZ LYS 97 15.402 10.944 -12.050
687 H ALA 98 H ALA 98 13.329 12.724 -4.558
688 HA ALA 98 HA ALA 98 11.491 14.878 -4.122
689 HB1 ALA 98 3HB ALA 98 12.220 13.861 -2.158
690 HB2 ALA 98 1HB ALA 98 13.908 13.867 -2.668
691 HB3 ALA 98 2HB ALA 98 13.123 15.375 -2.199
692 HA PRO 99 HA PRO 99 13.609 18.102 -6.243
693 HB2 PRO 99 1HB PRO 99 12.648 20.233 -4.862
694 HB3 PRO 99 2HB PRO 99 11.672 19.318 -6.017
695 HG2 PRO 99 1HG PRO 99 11.746 19.127 -3.030
696 HG3 PRO 99 2HG PRO 99 10.345 19.118 -4.118
697 HD2 PRO 99 1HD PRO 99 11.371 16.853 -3.045
698 HD3 PRO 99 2HD PRO 99 10.614 16.892 -4.650
699 H SER 100 H SER 100 15.585 18.974 -6.097
700 HA SER 100 HA SER 100 17.301 18.593 -3.985
701 HB2 SER 100 1HB SER 100 17.321 20.614 -6.219
702 HB3 SER 100 2HB SER 100 18.621 20.547 -5.029
703 HG SER 100 HG SER 100 17.793 18.495 -6.802
704 HA PRO 101 HA PRO 101 16.304 21.534 -0.879
705 HB2 PRO 101 1HB PRO 101 18.753 21.935 0.220
706 HB3 PRO 101 2HB PRO 101 17.829 20.446 0.451
707 HG2 PRO 101 1HG PRO 101 20.077 21.005 -1.445
708 HG3 PRO 101 2HG PRO 101 19.790 19.572 -0.441
709 HD2 PRO 101 1HD PRO 101 19.196 19.643 -3.082
710 HD3 PRO 101 2HD PRO 101 18.255 18.690 -1.917
711 H SER 102 H SER 102 15.674 23.364 -2.032
712 HA SER 102 HA SER 102 17.614 25.520 -2.044
713 HB2 SER 102 1HB SER 102 16.230 24.574 -4.560
714 HB3 SER 102 2HB SER 102 16.973 26.166 -4.404
715 HG SER 102 HG SER 102 18.809 25.252 -4.804
716 H SER 103 H SER 103 16.663 27.200 -1.125
717 HA SER 103 HA SER 103 13.939 27.313 -0.490
718 HB2 SER 103 1HB SER 103 14.369 29.497 0.378
719 HB3 SER 103 2HB SER 103 15.833 28.553 0.655
720 HG SER 103 HG SER 103 15.642 30.838 -0.605
721 H GLY 104 H GLY 104 12.266 28.685 -1.244
722 HA2 GLY 104 1HA GLY 104 12.676 29.778 -3.952
723 HA3 GLY 104 2HA GLY 104 11.313 28.721 -3.616
724 HA PRO 105 HA PRO 105 10.763 33.239 -1.854
725 HB2 PRO 105 1HB PRO 105 11.090 34.981 -3.911
726 HB3 PRO 105 2HB PRO 105 12.398 34.545 -2.804
727 HG2 PRO 105 1HG PRO 105 11.815 33.506 -5.551
728 HG3 PRO 105 2HG PRO 105 13.372 33.960 -4.833
729 HD2 PRO 105 1HD PRO 105 12.559 31.385 -5.039
730 HD3 PRO 105 2HD PRO 105 13.577 31.961 -3.704
731 H SER 106 H SER 106 8.651 32.320 -1.864
732 HA SER 106 HA SER 106 7.016 32.192 -4.170
733 HB2 SER 106 1HB SER 106 6.188 32.365 -1.263
734 HB3 SER 106 2HB SER 106 5.162 31.848 -2.601
735 HG SER 106 HG SER 106 7.073 30.460 -1.221
736 H SER 107 H SER 107 5.007 33.450 -4.482
737 HA SER 107 HA SER 107 5.553 36.300 -4.066
738 HB2 SER 107 1HB SER 107 5.192 35.448 -6.394
739 HB3 SER 107 2HB SER 107 3.541 35.029 -5.936
740 HG SER 107 HG SER 107 3.287 37.017 -6.708
741 H GLY 108 H GLY 108 3.565 37.703 -3.798
742 HA2 GLY 108 1HA GLY 108 1.325 37.933 -2.962
743 HA3 GLY 108 2HA GLY 108 1.503 36.375 -2.170
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -0.808 -26.735 15.540
2 HA2 GLY 1 1HA GLY 1 0.216 -25.097 13.900
3 HA3 GLY 1 2HA GLY 1 -0.132 -26.679 13.221
4 H SER 2 H SER 2 0.022 -24.125 11.851
5 HA SER 2 HA SER 2 -2.702 -24.078 10.739
6 HB2 SER 2 1HB SER 2 -2.181 -22.048 12.159
7 HB3 SER 2 2HB SER 2 -0.943 -21.631 10.975
8 HG SER 2 HG SER 2 -3.530 -22.171 10.062
9 H SER 3 H SER 3 -2.803 -24.370 8.606
10 HA SER 3 HA SER 3 -0.286 -24.439 7.108
11 HB2 SER 3 1HB SER 3 -3.014 -25.591 6.480
12 HB3 SER 3 2HB SER 3 -1.616 -25.705 5.411
13 HG SER 3 HG SER 3 -1.800 -27.567 6.692
14 H GLY 4 H GLY 4 -3.659 -23.378 6.605
15 HA2 GLY 4 1HA GLY 4 -3.964 -21.011 5.952
16 HA3 GLY 4 2HA GLY 4 -2.593 -21.231 4.875
17 H SER 5 H SER 5 -3.192 -21.315 2.826
18 HA SER 5 HA SER 5 -5.571 -22.887 2.119
19 HB2 SER 5 1HB SER 5 -6.166 -21.168 0.421
20 HB3 SER 5 2HB SER 5 -6.273 -20.559 2.073
21 HG SER 5 HG SER 5 -5.172 -19.030 0.946
22 H SER 6 H SER 6 -5.509 -23.899 0.105
23 HA SER 6 HA SER 6 -2.830 -24.358 -0.908
24 HB2 SER 6 1HB SER 6 -5.501 -25.643 -1.485
25 HB3 SER 6 2HB SER 6 -4.028 -26.072 -2.355
26 HG SER 6 HG SER 6 -3.983 -26.075 0.443
27 H GLY 7 H GLY 7 -1.994 -23.287 -2.566
28 HA2 GLY 7 1HA GLY 7 -1.819 -22.168 -4.568
29 HA3 GLY 7 2HA GLY 7 -3.435 -22.743 -4.955
30 H LEU 8 H LEU 8 -1.554 -20.150 -3.596
31 HA LEU 8 HA LEU 8 -3.861 -18.547 -2.930
32 HB2 LEU 8 1HB LEU 8 -1.450 -18.568 -1.884
33 HB3 LEU 8 2HB LEU 8 -1.114 -17.416 -3.174
34 HG LEU 8 HG LEU 8 -3.219 -16.186 -2.194
35 HD11 LEU 8 1HD1 LEU 8 -2.326 -17.043 0.444
36 HD12 LEU 8 2HD1 LEU 8 -3.145 -18.312 -0.466
37 HD13 LEU 8 3HD1 LEU 8 -3.956 -16.774 -0.173
38 HD21 LEU 8 3HD2 LEU 8 -0.453 -16.191 -1.004
39 HD22 LEU 8 1HD2 LEU 8 -1.678 -14.982 -0.620
40 HD23 LEU 8 2HD2 LEU 8 -1.084 -15.141 -2.273
41 H ALA 9 H ALA 9 -4.922 -18.450 -4.962
42 HA ALA 9 HA ALA 9 -3.615 -17.298 -7.247
43 HB1 ALA 9 3HB ALA 9 -6.586 -17.534 -6.949
44 HB2 ALA 9 1HB ALA 9 -5.598 -17.658 -8.405
45 HB3 ALA 9 2HB ALA 9 -5.583 -18.960 -7.215
46 HA PRO 10 HA PRO 10 -4.227 -13.038 -6.319
47 HB2 PRO 10 1HB PRO 10 -4.175 -12.036 -8.841
48 HB3 PRO 10 2HB PRO 10 -2.727 -12.611 -8.006
49 HG2 PRO 10 1HG PRO 10 -4.419 -14.007 -10.042
50 HG3 PRO 10 2HG PRO 10 -2.652 -13.943 -9.910
51 HD2 PRO 10 1HD PRO 10 -4.099 -16.072 -9.071
52 HD3 PRO 10 2HD PRO 10 -2.588 -15.573 -8.283
53 HA PRO 11 HA PRO 11 -8.694 -12.845 -6.805
54 HB2 PRO 11 1HB PRO 11 -9.033 -10.793 -5.060
55 HB3 PRO 11 2HB PRO 11 -8.793 -12.465 -4.541
56 HG2 PRO 11 1HG PRO 11 -6.811 -10.227 -4.697
57 HG3 PRO 11 2HG PRO 11 -7.035 -11.436 -3.419
58 HD2 PRO 11 1HD PRO 11 -5.084 -11.634 -5.286
59 HD3 PRO 11 2HD PRO 11 -5.873 -13.057 -4.575
60 H ARG 12 H ARG 12 -6.692 -9.895 -6.637
61 HA ARG 12 HA ARG 12 -7.899 -8.944 -9.105
62 HB2 ARG 12 1HB ARG 12 -8.231 -7.595 -6.444
63 HB3 ARG 12 2HB ARG 12 -8.199 -6.645 -7.924
64 HG2 ARG 12 1HG ARG 12 -10.136 -8.856 -7.269
65 HG3 ARG 12 2HG ARG 12 -10.477 -7.124 -7.263
66 HD2 ARG 12 1HD ARG 12 -9.641 -7.241 -9.731
67 HD3 ARG 12 2HD ARG 12 -10.001 -8.960 -9.572
68 HE ARG 12 HE ARG 12 -12.219 -7.513 -8.676
69 HH11 ARG 12 1HH1 ARG 12 -10.476 -8.129 -11.627
70 HH12 ARG 12 2HH1 ARG 12 -11.865 -7.926 -12.643
71 HH21 ARG 12 1HH2 ARG 12 -14.054 -7.243 -10.003
72 HH22 ARG 12 2HH2 ARG 12 -13.899 -7.422 -11.718
73 H HIS 13 H HIS 13 -6.899 -6.609 -9.532
74 HA HIS 13 HA HIS 13 -4.003 -6.931 -9.154
75 HB2 HIS 13 1HB HIS 13 -5.229 -6.753 -11.490
76 HB3 HIS 13 2HB HIS 13 -5.152 -5.026 -11.150
77 HD1 HIS 13 1HD HIS 13 -2.920 -8.004 -11.734
78 HD2 HIS 13 2HD HIS 13 -2.677 -3.863 -11.503
79 HE1 HIS 13 1HE HIS 13 -0.603 -7.422 -12.519
80 HE2 HIS 13 2HE HIS 13 -0.450 -4.919 -12.290
81 H LEU 14 H LEU 14 -2.703 -5.055 -8.747
82 HA LEU 14 HA LEU 14 -4.116 -3.080 -7.107
83 HB2 LEU 14 1HB LEU 14 -1.380 -4.222 -7.127
84 HB3 LEU 14 2HB LEU 14 -1.557 -2.554 -6.584
85 HG LEU 14 HG LEU 14 -2.970 -4.935 -5.383
86 HD11 LEU 14 1HD1 LEU 14 -0.839 -5.268 -4.637
87 HD12 LEU 14 2HD1 LEU 14 -1.407 -4.124 -3.422
88 HD13 LEU 14 3HD1 LEU 14 -0.407 -3.562 -4.762
89 HD21 LEU 14 3HD2 LEU 14 -2.936 -2.003 -4.720
90 HD22 LEU 14 1HD2 LEU 14 -3.393 -3.235 -3.544
91 HD23 LEU 14 2HD2 LEU 14 -4.327 -3.044 -5.028
92 H GLY 15 H GLY 15 -3.456 -0.826 -7.209
93 HA2 GLY 15 1HA GLY 15 -2.121 0.000 -9.678
94 HA3 GLY 15 2HA GLY 15 -3.782 0.525 -9.444
95 H PHE 16 H PHE 16 -0.815 1.667 -9.333
96 HA PHE 16 HA PHE 16 -1.260 3.295 -6.920
97 HB2 PHE 16 1HB PHE 16 1.332 2.728 -8.375
98 HB3 PHE 16 2HB PHE 16 1.164 3.726 -6.934
99 HD1 PHE 16 1HD PHE 16 0.654 2.711 -4.771
100 HD2 PHE 16 2HD PHE 16 1.291 0.341 -8.249
101 HE1 PHE 16 1HE PHE 16 0.959 0.721 -3.356
102 HE2 PHE 16 2HE PHE 16 1.596 -1.652 -6.840
103 HZ PHE 16 HZ PHE 16 1.429 -1.464 -4.390
104 H SER 17 H SER 17 -2.030 5.247 -7.340
105 HA SER 17 HA SER 17 -1.015 6.685 -9.698
106 HB2 SER 17 1HB SER 17 -3.288 5.867 -10.183
107 HB3 SER 17 2HB SER 17 -3.887 6.674 -8.733
108 HG SER 17 HG SER 17 -2.836 8.616 -9.841
109 H ASP 18 H ASP 18 -0.947 8.967 -9.511
110 HA ASP 18 HA ASP 18 -0.630 10.959 -8.455
111 HB2 ASP 18 1HB ASP 18 -2.173 9.913 -6.090
112 HB3 ASP 18 2HB ASP 18 -2.034 11.573 -6.662
113 H VAL 19 H VAL 19 1.085 8.559 -8.014
114 HA VAL 19 HA VAL 19 2.059 8.513 -5.374
115 HB VAL 19 HB VAL 19 3.576 7.876 -7.908
116 HG11 VAL 19 1HG1 VAL 19 5.179 8.006 -6.224
117 HG12 VAL 19 2HG1 VAL 19 4.092 7.338 -5.005
118 HG13 VAL 19 3HG1 VAL 19 4.760 6.294 -6.260
119 HG21 VAL 19 3HG2 VAL 19 2.297 6.075 -8.134
120 HG22 VAL 19 1HG2 VAL 19 2.705 5.564 -6.496
121 HG23 VAL 19 2HG2 VAL 19 1.312 6.609 -6.772
122 H SER 20 H SER 20 3.480 9.752 -4.296
123 HA SER 20 HA SER 20 4.761 11.955 -5.778
124 HB2 SER 20 1HB SER 20 3.480 11.874 -3.062
125 HB3 SER 20 2HB SER 20 4.727 13.068 -3.421
126 HG SER 20 HG SER 20 2.637 12.767 -5.248
127 H HIS 21 H HIS 21 6.553 12.914 -4.099
128 HA HIS 21 HA HIS 21 8.505 10.781 -3.928
129 HB2 HIS 21 1HB HIS 21 10.053 12.668 -3.278
130 HB3 HIS 21 2HB HIS 21 9.309 12.822 -4.867
131 HD1 HIS 21 1HD HIS 21 7.633 14.743 -5.210
132 HD2 HIS 21 2HD HIS 21 9.225 14.565 -1.377
133 HE1 HIS 21 1HE HIS 21 7.000 16.918 -4.118
134 HE2 HIS 21 2HE HIS 21 8.047 16.823 -1.829
135 H ASP 22 H ASP 22 6.255 12.204 -1.870
136 HA ASP 22 HA ASP 22 7.608 11.035 0.462
137 HB2 ASP 22 1HB ASP 22 6.704 12.927 1.843
138 HB3 ASP 22 2HB ASP 22 7.959 13.398 0.699
139 H ALA 23 H ALA 23 5.311 10.361 -1.440
140 HA ALA 23 HA ALA 23 3.651 9.111 0.486
141 HB1 ALA 23 3HB ALA 23 2.748 11.706 -0.635
142 HB2 ALA 23 1HB ALA 23 1.552 10.419 -0.474
143 HB3 ALA 23 2HB ALA 23 2.438 10.982 0.943
144 H ALA 24 H ALA 24 1.803 7.957 -0.548
145 HA ALA 24 HA ALA 24 1.780 7.734 -3.416
146 HB1 ALA 24 3HB ALA 24 2.367 5.107 -2.255
147 HB2 ALA 24 1HB ALA 24 2.942 5.845 -3.750
148 HB3 ALA 24 2HB ALA 24 3.711 6.247 -2.214
149 H ARG 25 H ARG 25 -0.222 7.241 -4.035
150 HA ARG 25 HA ARG 25 -2.104 6.268 -2.026
151 HB2 ARG 25 1HB ARG 25 -2.621 8.302 -3.387
152 HB3 ARG 25 2HB ARG 25 -2.670 7.278 -4.816
153 HG2 ARG 25 1HG ARG 25 -4.463 5.943 -3.589
154 HG3 ARG 25 2HG ARG 25 -4.541 7.310 -2.475
155 HD2 ARG 25 1HD ARG 25 -5.281 8.774 -4.145
156 HD3 ARG 25 2HD ARG 25 -4.767 7.695 -5.441
157 HE ARG 25 HE ARG 25 -6.692 6.323 -4.019
158 HH11 ARG 25 1HH1 ARG 25 -6.494 9.290 -5.830
159 HH12 ARG 25 2HH1 ARG 25 -8.155 9.254 -6.320
160 HH21 ARG 25 1HH2 ARG 25 -8.881 6.265 -4.657
161 HH22 ARG 25 2HH2 ARG 25 -9.513 7.534 -5.652
162 H VAL 26 H VAL 26 -2.965 4.285 -2.045
163 HA VAL 26 HA VAL 26 -2.412 2.570 -4.379
164 HB VAL 26 HB VAL 26 -1.164 1.631 -2.639
165 HG11 VAL 26 1HG1 VAL 26 -3.528 2.132 -0.835
166 HG12 VAL 26 2HG1 VAL 26 -2.073 1.253 -0.362
167 HG13 VAL 26 3HG1 VAL 26 -1.970 2.958 -0.800
168 HG21 VAL 26 3HG2 VAL 26 -2.288 -0.470 -2.093
169 HG22 VAL 26 1HG2 VAL 26 -3.835 0.228 -2.574
170 HG23 VAL 26 2HG2 VAL 26 -2.566 -0.018 -3.775
171 H PHE 27 H PHE 27 -4.123 1.845 -5.449
172 HA PHE 27 HA PHE 27 -6.689 1.611 -4.028
173 HB2 PHE 27 1HB PHE 27 -7.874 2.507 -5.928
174 HB3 PHE 27 2HB PHE 27 -6.624 3.655 -5.461
175 HD1 PHE 27 2HD PHE 27 -7.575 1.104 -7.941
176 HD2 PHE 27 1HD PHE 27 -4.860 4.224 -6.937
177 HE1 PHE 27 2HE PHE 27 -6.704 1.082 -10.242
178 HE2 PHE 27 1HE PHE 27 -3.985 4.207 -9.236
179 HZ PHE 27 HZ PHE 27 -4.906 2.634 -10.892
180 H TRP 28 H TRP 28 -7.949 -0.135 -4.542
181 HA TRP 28 HA TRP 28 -6.810 -2.035 -6.486
182 HB2 TRP 28 1HB TRP 28 -7.923 -3.799 -4.976
183 HB3 TRP 28 2HB TRP 28 -6.439 -3.046 -4.399
184 HD1 TRP 28 HD TRP 28 -9.970 -3.681 -3.412
185 HE1 TRP 28 1HE TRP 28 -10.500 -2.487 -1.195
186 HE3 TRP 28 3HE TRP 28 -5.832 -0.697 -3.089
187 HZ2 TRP 28 2HZ TRP 28 -9.320 -0.536 0.471
188 HZ3 TRP 28 3HZ TRP 28 -5.609 0.805 -1.153
189 HH2 TRP 28 HH TRP 28 -7.319 0.882 0.589
190 H GLU 29 H GLU 29 -8.427 -3.618 -7.334
191 HA GLU 29 HA GLU 29 -10.760 -2.181 -8.237
192 HB2 GLU 29 1HB GLU 29 -9.723 -4.952 -8.849
193 HB3 GLU 29 2HB GLU 29 -11.166 -4.264 -9.580
194 HG2 GLU 29 1HG GLU 29 -9.672 -3.744 -11.195
195 HG3 GLU 29 2HG GLU 29 -9.483 -2.313 -10.183
196 H GLY 30 H GLY 30 -10.343 -3.341 -5.392
197 HA2 GLY 30 1HA GLY 30 -11.938 -3.853 -3.777
198 HA3 GLY 30 2HA GLY 30 -13.112 -4.114 -5.059
199 H ALA 31 H ALA 31 -13.751 -5.980 -3.773
200 HA ALA 31 HA ALA 31 -12.125 -8.321 -4.472
201 HB1 ALA 31 3HB ALA 31 -12.867 -7.419 -1.770
202 HB2 ALA 31 1HB ALA 31 -13.122 -9.133 -2.099
203 HB3 ALA 31 2HB ALA 31 -11.520 -8.424 -2.305
204 HA PRO 32 HA PRO 32 -15.889 -10.155 -5.788
205 HB2 PRO 32 1HB PRO 32 -15.478 -12.768 -5.175
206 HB3 PRO 32 2HB PRO 32 -14.641 -11.949 -6.499
207 HG2 PRO 32 1HG PRO 32 -13.676 -12.543 -3.728
208 HG3 PRO 32 2HG PRO 32 -12.816 -12.702 -5.270
209 HD2 PRO 32 1HD PRO 32 -12.447 -10.598 -3.607
210 HD3 PRO 32 2HD PRO 32 -12.324 -10.453 -5.372
211 H ARG 33 H ARG 33 -15.021 -10.098 -2.515
212 HA ARG 33 HA ARG 33 -17.764 -10.825 -1.750
213 HB2 ARG 33 1HB ARG 33 -17.021 -12.042 0.160
214 HB3 ARG 33 2HB ARG 33 -16.128 -12.663 -1.221
215 HG2 ARG 33 1HG ARG 33 -14.365 -10.856 -0.442
216 HG3 ARG 33 2HG ARG 33 -15.176 -11.093 1.107
217 HD2 ARG 33 1HD ARG 33 -13.594 -13.026 -0.527
218 HD3 ARG 33 2HD ARG 33 -13.498 -12.676 1.198
219 HE ARG 33 HE ARG 33 -15.134 -14.638 -0.057
220 HH11 ARG 33 1HH1 ARG 33 -15.005 -12.412 2.617
221 HH12 ARG 33 2HH1 ARG 33 -16.083 -13.338 3.609
222 HH21 ARG 33 1HH2 ARG 33 -16.554 -15.865 1.239
223 HH22 ARG 33 2HH2 ARG 33 -16.963 -15.302 2.824
224 HA PRO 34 HA PRO 34 -17.817 -7.033 0.463
225 HB2 PRO 34 1HB PRO 34 -19.525 -7.644 2.482
226 HB3 PRO 34 2HB PRO 34 -20.056 -7.414 0.812
227 HG2 PRO 34 1HG PRO 34 -19.525 -9.959 2.297
228 HG3 PRO 34 2HG PRO 34 -20.861 -9.560 1.200
229 HD2 PRO 34 1HD PRO 34 -18.724 -11.029 0.420
230 HD3 PRO 34 2HD PRO 34 -19.594 -9.947 -0.686
231 H VAL 35 H VAL 35 -16.743 -6.014 2.088
232 HA VAL 35 HA VAL 35 -15.573 -7.693 4.209
233 HB VAL 35 HB VAL 35 -13.705 -7.247 2.900
234 HG11 VAL 35 1HG1 VAL 35 -14.408 -5.830 1.216
235 HG12 VAL 35 2HG1 VAL 35 -15.023 -4.622 2.346
236 HG13 VAL 35 3HG1 VAL 35 -13.285 -4.806 2.109
237 HG21 VAL 35 3HG2 VAL 35 -13.394 -6.562 5.254
238 HG22 VAL 35 1HG2 VAL 35 -12.351 -5.676 4.142
239 HG23 VAL 35 2HG2 VAL 35 -13.795 -4.906 4.801
240 H ARG 36 H ARG 36 -15.143 -6.634 6.214
241 HA ARG 36 HA ARG 36 -16.976 -4.401 6.707
242 HB2 ARG 36 1HB ARG 36 -16.595 -5.025 9.132
243 HB3 ARG 36 2HB ARG 36 -17.423 -6.226 8.151
244 HG2 ARG 36 1HG ARG 36 -15.665 -7.689 8.205
245 HG3 ARG 36 2HG ARG 36 -14.469 -6.412 8.434
246 HD2 ARG 36 1HD ARG 36 -15.007 -7.973 10.413
247 HD3 ARG 36 2HD ARG 36 -14.906 -6.237 10.708
248 HE ARG 36 HE ARG 36 -17.568 -6.971 10.113
249 HH11 ARG 36 1HH1 ARG 36 -15.174 -7.191 12.631
250 HH12 ARG 36 2HH1 ARG 36 -16.338 -7.259 13.912
251 HH21 ARG 36 1HH2 ARG 36 -19.111 -7.060 11.791
252 HH22 ARG 36 2HH2 ARG 36 -18.577 -7.186 13.433
253 H LEU 37 H LEU 37 -13.614 -5.376 7.084
254 HA LEU 37 HA LEU 37 -12.871 -2.569 7.362
255 HB2 LEU 37 1HB LEU 37 -13.082 -3.464 9.650
256 HB3 LEU 37 2HB LEU 37 -11.898 -4.708 9.252
257 HG LEU 37 HG LEU 37 -10.351 -2.671 8.729
258 HD11 LEU 37 1HD1 LEU 37 -11.931 -0.901 8.903
259 HD12 LEU 37 2HD1 LEU 37 -10.851 -0.781 10.291
260 HD13 LEU 37 3HD1 LEU 37 -12.469 -1.455 10.489
261 HD21 LEU 37 3HD2 LEU 37 -10.970 -3.139 11.625
262 HD22 LEU 37 1HD2 LEU 37 -9.407 -2.886 10.848
263 HD23 LEU 37 2HD2 LEU 37 -10.268 -4.409 10.621
264 H VAL 38 H VAL 38 -10.610 -2.166 6.920
265 HA VAL 38 HA VAL 38 -9.230 -4.364 5.539
266 HB VAL 38 HB VAL 38 -9.555 -1.559 4.462
267 HG11 VAL 38 1HG1 VAL 38 -7.922 -3.892 3.482
268 HG12 VAL 38 2HG1 VAL 38 -8.315 -2.487 2.490
269 HG13 VAL 38 3HG1 VAL 38 -7.347 -2.293 3.951
270 HG21 VAL 38 3HG2 VAL 38 -10.675 -4.222 3.630
271 HG22 VAL 38 1HG2 VAL 38 -11.543 -2.733 4.004
272 HG23 VAL 38 2HG2 VAL 38 -10.587 -2.849 2.526
273 H ARG 39 H ARG 39 -6.978 -4.271 5.555
274 HA ARG 39 HA ARG 39 -5.752 -2.105 7.111
275 HB2 ARG 39 1HB ARG 39 -5.889 -4.965 7.803
276 HB3 ARG 39 2HB ARG 39 -4.284 -4.257 7.919
277 HG2 ARG 39 1HG ARG 39 -5.365 -2.425 9.314
278 HG3 ARG 39 2HG ARG 39 -6.772 -3.487 9.404
279 HD2 ARG 39 1HD ARG 39 -5.005 -5.267 10.147
280 HD3 ARG 39 2HD ARG 39 -4.038 -3.848 10.549
281 HE ARG 39 HE ARG 39 -6.459 -3.378 11.717
282 HH11 ARG 39 1HH1 ARG 39 -4.109 -5.941 11.867
283 HH12 ARG 39 2HH1 ARG 39 -4.485 -6.368 13.504
284 HH21 ARG 39 1HH2 ARG 39 -6.964 -3.930 13.872
285 HH22 ARG 39 2HH2 ARG 39 -6.110 -5.223 14.643
286 H VAL 40 H VAL 40 -3.934 -1.341 6.232
287 HA VAL 40 HA VAL 40 -2.643 -2.944 4.119
288 HB VAL 40 HB VAL 40 -2.722 0.070 4.299
289 HG11 VAL 40 1HG1 VAL 40 -0.839 -0.341 3.065
290 HG12 VAL 40 2HG1 VAL 40 -1.445 -1.880 2.449
291 HG13 VAL 40 3HG1 VAL 40 -2.056 -0.362 1.788
292 HG21 VAL 40 3HG2 VAL 40 -4.931 -0.589 3.799
293 HG22 VAL 40 1HG2 VAL 40 -4.197 -0.180 2.248
294 HG23 VAL 40 2HG2 VAL 40 -4.388 -1.870 2.716
295 H THR 41 H THR 41 -0.385 -2.895 3.964
296 HA THR 41 HA THR 41 1.080 -1.591 6.142
297 HB THR 41 HB THR 41 2.480 -3.747 6.302
298 HG1 THR 41 1HG THR 41 1.533 -4.854 4.550
299 HG21 THR 41 3HG2 THR 41 0.972 -4.698 7.992
300 HG22 THR 41 1HG2 THR 41 -0.346 -3.706 7.370
301 HG23 THR 41 2HG2 THR 41 1.058 -2.941 8.115
302 H TYR 42 H TYR 42 2.537 -0.345 5.181
303 HA TYR 42 HA TYR 42 3.797 -1.298 2.697
304 HB2 TYR 42 1HB TYR 42 4.370 1.140 2.359
305 HB3 TYR 42 2HB TYR 42 2.654 0.755 2.288
306 HD1 TYR 42 2HD TYR 42 1.346 1.042 4.544
307 HD2 TYR 42 1HD TYR 42 5.074 2.904 3.685
308 HE1 TYR 42 2HE TYR 42 0.890 2.738 6.266
309 HE2 TYR 42 1HE TYR 42 4.629 4.604 5.406
310 HH TYR 42 HH TYR 42 1.537 4.753 7.084
311 H VAL 43 H VAL 43 6.041 -1.068 2.419
312 HA VAL 43 HA VAL 43 7.652 -0.238 4.695
313 HB VAL 43 HB VAL 43 7.237 -2.602 5.166
314 HG11 VAL 43 1HG1 VAL 43 7.908 -2.868 2.315
315 HG12 VAL 43 2HG1 VAL 43 8.597 -4.101 3.372
316 HG13 VAL 43 3HG1 VAL 43 6.851 -3.848 3.330
317 HG21 VAL 43 3HG2 VAL 43 10.065 -2.346 4.181
318 HG22 VAL 43 1HG2 VAL 43 9.473 -1.465 5.590
319 HG23 VAL 43 2HG2 VAL 43 9.467 -3.228 5.586
320 H SER 44 H SER 44 9.947 -0.100 4.178
321 HA SER 44 HA SER 44 10.398 1.069 1.653
322 HB2 SER 44 1HB SER 44 12.756 1.189 2.344
323 HB3 SER 44 2HB SER 44 11.686 1.694 3.652
324 HG SER 44 HG SER 44 13.523 0.033 3.976
325 H SER 45 H SER 45 12.271 -1.667 2.932
326 HA SER 45 HA SER 45 11.676 -3.425 0.792
327 HB2 SER 45 1HB SER 45 13.749 -3.355 -0.447
328 HB3 SER 45 2HB SER 45 13.066 -1.730 -0.420
329 HG SER 45 HG SER 45 14.537 -1.175 1.182
330 H GLU 46 H GLU 46 12.019 -5.411 1.534
331 HA GLU 46 HA GLU 46 12.539 -6.996 3.131
332 HB2 GLU 46 1HB GLU 46 15.311 -6.098 2.328
333 HB3 GLU 46 2HB GLU 46 14.870 -7.671 2.979
334 HG2 GLU 46 1HG GLU 46 13.392 -7.957 0.957
335 HG3 GLU 46 2HG GLU 46 14.168 -6.519 0.297
336 H GLY 47 H GLY 47 11.935 -4.633 4.445
337 HA2 GLY 47 1HA GLY 47 12.112 -4.406 6.853
338 HA3 GLY 47 2HA GLY 47 13.826 -4.765 6.705
339 H GLY 48 H GLY 48 12.271 -2.441 7.853
340 HA2 GLY 48 1HA GLY 48 13.760 -0.365 7.926
341 HA3 GLY 48 2HA GLY 48 13.429 -0.288 6.202
342 H HIS 49 H HIS 49 12.632 1.881 6.788
343 HA HIS 49 HA HIS 49 10.581 2.549 8.438
344 HB2 HIS 49 1HB HIS 49 11.630 4.259 7.147
345 HB3 HIS 49 2HB HIS 49 11.141 3.506 5.631
346 HD1 HIS 49 1HD HIS 49 9.494 5.016 4.580
347 HD2 HIS 49 2HD HIS 49 8.878 4.674 8.674
348 HE1 HIS 49 1HE HIS 49 7.419 6.352 5.061
349 HE2 HIS 49 2HE HIS 49 7.114 6.201 7.557
350 H SER 50 H SER 50 8.859 1.271 8.788
351 HA SER 50 HA SER 50 7.128 0.687 6.479
352 HB2 SER 50 1HB SER 50 6.529 -1.467 7.505
353 HB3 SER 50 2HB SER 50 8.260 -1.381 7.177
354 HG SER 50 HG SER 50 8.660 -1.448 9.251
355 H GLY 51 H GLY 51 4.867 0.566 6.936
356 HA2 GLY 51 1HA GLY 51 4.058 1.652 9.549
357 HA3 GLY 51 2HA GLY 51 3.531 2.455 8.078
358 H GLN 52 H GLN 52 1.387 2.005 9.060
359 HA GLN 52 HA GLN 52 0.174 -0.210 7.763
360 HB2 GLN 52 1HB GLN 52 1.084 -1.477 9.614
361 HB3 GLN 52 2HB GLN 52 0.420 -0.331 10.772
362 HG2 GLN 52 1HG GLN 52 -1.857 -0.959 9.969
363 HG3 GLN 52 2HG GLN 52 -1.102 -2.227 9.006
364 HE21 GLN 52 1HE2 GLN 52 -2.606 -1.592 11.848
365 HE22 GLN 52 2HE2 GLN 52 -2.017 -2.912 12.794
366 H THR 53 H THR 53 -1.633 0.695 7.060
367 HA THR 53 HA THR 53 -3.164 2.404 8.911
368 HB THR 53 HB THR 53 -1.992 3.603 6.959
369 HG1 THR 53 1HG THR 53 -3.492 5.049 7.329
370 HG21 THR 53 3HG2 THR 53 -3.122 3.544 4.821
371 HG22 THR 53 1HG2 THR 53 -4.294 2.379 5.435
372 HG23 THR 53 2HG2 THR 53 -2.604 1.914 5.249
373 H GLU 54 H GLU 54 -5.298 1.991 9.100
374 HA GLU 54 HA GLU 54 -6.369 -0.222 7.489
375 HB2 GLU 54 1HB GLU 54 -6.652 -0.955 9.636
376 HB3 GLU 54 2HB GLU 54 -6.768 0.672 10.291
377 HG2 GLU 54 1HG GLU 54 -8.958 -0.495 8.616
378 HG3 GLU 54 2HG GLU 54 -8.850 -0.807 10.347
379 H ALA 55 H ALA 55 -8.578 -0.123 6.778
380 HA ALA 55 HA ALA 55 -9.867 2.487 6.770
381 HB1 ALA 55 3HB ALA 55 -10.028 1.613 4.093
382 HB2 ALA 55 1HB ALA 55 -9.236 3.057 4.723
383 HB3 ALA 55 2HB ALA 55 -8.328 1.554 4.557
384 HA PRO 56 HA PRO 56 -13.621 0.216 6.746
385 HB2 PRO 56 1HB PRO 56 -15.221 1.656 5.092
386 HB3 PRO 56 2HB PRO 56 -14.748 2.217 6.700
387 HG2 PRO 56 1HG PRO 56 -13.610 2.947 4.029
388 HG3 PRO 56 2HG PRO 56 -13.985 3.995 5.410
389 HD2 PRO 56 1HD PRO 56 -11.471 3.152 4.860
390 HD3 PRO 56 2HD PRO 56 -12.040 3.444 6.516
391 H GLY 57 H GLY 57 -14.779 -1.362 5.658
392 HA2 GLY 57 1HA GLY 57 -13.573 -2.620 3.472
393 HA3 GLY 57 2HA GLY 57 -15.201 -2.943 4.050
394 H ASN 58 H ASN 58 -15.649 0.089 3.523
395 HA ASN 58 HA ASN 58 -16.603 -0.317 0.806
396 HB2 ASN 58 1HB ASN 58 -17.911 1.679 1.138
397 HB3 ASN 58 2HB ASN 58 -18.067 0.676 2.578
398 HD21 ASN 58 1HD2 ASN 58 -17.679 1.579 4.476
399 HD22 ASN 58 2HD2 ASN 58 -16.907 3.104 4.726
400 H ALA 59 H ALA 59 -13.776 0.657 2.101
401 HA ALA 59 HA ALA 59 -13.291 2.829 0.198
402 HB1 ALA 59 3HB ALA 59 -10.958 2.593 1.535
403 HB2 ALA 59 1HB ALA 59 -12.306 3.595 2.072
404 HB3 ALA 59 2HB ALA 59 -12.085 1.980 2.745
405 H THR 60 H THR 60 -12.510 2.339 -1.734
406 HA THR 60 HA THR 60 -11.024 -0.165 -2.088
407 HB THR 60 HB THR 60 -11.376 0.294 -4.552
408 HG1 THR 60 1HG THR 60 -12.689 1.935 -5.141
409 HG21 THR 60 3HG2 THR 60 -12.805 -1.335 -3.770
410 HG22 THR 60 1HG2 THR 60 -13.960 -0.118 -4.312
411 HG23 THR 60 2HG2 THR 60 -13.565 -0.258 -2.598
412 H SER 61 H SER 61 -10.031 2.545 -1.068
413 HA SER 61 HA SER 61 -7.490 2.441 -2.359
414 HB2 SER 61 1HB SER 61 -7.551 4.843 -3.148
415 HB3 SER 61 2HB SER 61 -8.526 3.722 -4.098
416 HG SER 61 HG SER 61 -10.221 4.486 -2.416
417 H ALA 62 H ALA 62 -5.926 3.871 -1.373
418 HA ALA 62 HA ALA 62 -6.696 5.458 0.902
419 HB1 ALA 62 3HB ALA 62 -5.550 4.184 2.592
420 HB2 ALA 62 1HB ALA 62 -6.757 3.158 1.817
421 HB3 ALA 62 2HB ALA 62 -5.051 2.982 1.403
422 H MET 63 H MET 63 -4.834 6.518 1.920
423 HA MET 63 HA MET 63 -2.653 6.861 -0.020
424 HB2 MET 63 1HB MET 63 -3.749 8.712 2.099
425 HB3 MET 63 2HB MET 63 -2.279 9.042 1.192
426 HG2 MET 63 1HG MET 63 -3.898 8.620 -0.861
427 HG3 MET 63 2HG MET 63 -5.108 9.116 0.321
428 HE1 MET 63 3HE MET 63 -1.436 10.105 -0.668
429 HE2 MET 63 1HE MET 63 -2.375 10.259 -2.153
430 HE3 MET 63 2HE MET 63 -1.706 11.697 -1.381
431 H LEU 64 H LEU 64 -0.491 7.246 0.817
432 HA LEU 64 HA LEU 64 -0.005 6.180 3.505
433 HB2 LEU 64 1HB LEU 64 1.634 5.325 1.136
434 HB3 LEU 64 2HB LEU 64 1.660 4.670 2.772
435 HG LEU 64 HG LEU 64 -0.742 4.417 0.980
436 HD11 LEU 64 1HD1 LEU 64 1.698 3.336 0.363
437 HD12 LEU 64 2HD1 LEU 64 0.134 2.702 -0.148
438 HD13 LEU 64 3HD1 LEU 64 0.926 2.045 1.284
439 HD21 LEU 64 3HD2 LEU 64 -0.927 2.331 2.525
440 HD22 LEU 64 1HD2 LEU 64 -1.408 3.916 3.131
441 HD23 LEU 64 2HD2 LEU 64 0.160 3.242 3.575
442 H GLY 65 H GLY 65 2.015 6.793 4.430
443 HA2 GLY 65 1HA GLY 65 4.180 8.023 3.678
444 HA3 GLY 65 2HA GLY 65 3.036 9.297 3.283
445 HA PRO 66 HA PRO 66 4.716 10.701 3.774
446 HB2 PRO 66 1HB PRO 66 6.987 11.457 5.055
447 HB3 PRO 66 2HB PRO 66 5.485 12.387 5.131
448 HG2 PRO 66 1HG PRO 66 6.618 10.451 7.114
449 HG3 PRO 66 2HG PRO 66 5.855 12.027 7.399
450 HD2 PRO 66 1HD PRO 66 4.537 9.687 7.741
451 HD3 PRO 66 2HD PRO 66 3.724 11.171 7.204
452 H LEU 67 H LEU 67 6.095 9.821 2.323
453 HA LEU 67 HA LEU 67 7.675 7.496 3.204
454 HB2 LEU 67 1HB LEU 67 6.740 8.032 0.398
455 HB3 LEU 67 2HB LEU 67 7.383 6.531 1.061
456 HG LEU 67 HG LEU 67 4.693 7.756 1.670
457 HD11 LEU 67 1HD1 LEU 67 4.476 6.790 -0.421
458 HD12 LEU 67 2HD1 LEU 67 4.008 5.477 0.658
459 HD13 LEU 67 3HD1 LEU 67 5.619 5.497 -0.058
460 HD21 LEU 67 3HD2 LEU 67 5.748 5.099 2.608
461 HD22 LEU 67 1HD2 LEU 67 4.265 5.920 3.096
462 HD23 LEU 67 2HD2 LEU 67 5.833 6.565 3.586
463 H SER 68 H SER 68 9.412 7.071 1.289
464 HA SER 68 HA SER 68 11.083 9.471 1.330
465 HB2 SER 68 1HB SER 68 11.715 6.564 0.793
466 HB3 SER 68 2HB SER 68 12.897 7.861 0.621
467 HG SER 68 HG SER 68 12.114 8.349 2.919
468 H SER 69 H SER 69 12.685 9.412 -0.701
469 HA SER 69 HA SER 69 10.943 9.399 -3.078
470 HB2 SER 69 1HB SER 69 12.485 11.150 -3.978
471 HB3 SER 69 2HB SER 69 11.628 11.652 -2.522
472 HG SER 69 HG SER 69 14.112 10.434 -2.193
473 H SER 70 H SER 70 11.841 8.751 -5.084
474 HA SER 70 HA SER 70 12.920 7.208 -6.375
475 HB2 SER 70 1HB SER 70 14.597 9.004 -6.343
476 HB3 SER 70 2HB SER 70 15.310 8.319 -4.883
477 HG SER 70 HG SER 70 16.246 6.812 -6.038
478 H THR 71 H THR 71 11.962 6.312 -3.737
479 HA THR 71 HA THR 71 13.736 3.980 -3.427
480 HB THR 71 HB THR 71 12.308 5.531 -1.269
481 HG1 THR 71 1HG THR 71 14.410 6.240 -1.767
482 HG21 THR 71 3HG2 THR 71 11.993 3.623 -0.157
483 HG22 THR 71 1HG2 THR 71 13.745 3.439 -0.090
484 HG23 THR 71 2HG2 THR 71 12.829 2.697 -1.403
485 H THR 72 H THR 72 12.786 2.011 -3.422
486 HA THR 72 HA THR 72 10.052 1.832 -4.275
487 HB THR 72 HB THR 72 11.985 -0.380 -3.551
488 HG1 THR 72 1HG THR 72 12.303 1.209 -5.460
489 HG21 THR 72 3HG2 THR 72 10.204 -1.716 -3.729
490 HG22 THR 72 1HG2 THR 72 10.148 -1.288 -5.438
491 HG23 THR 72 2HG2 THR 72 9.181 -0.386 -4.271
492 H TYR 73 H TYR 73 8.294 1.092 -3.166
493 HA TYR 73 HA TYR 73 8.672 0.397 -0.333
494 HB2 TYR 73 1HB TYR 73 6.907 2.487 -1.535
495 HB3 TYR 73 2HB TYR 73 6.342 1.625 -0.108
496 HD1 TYR 73 1HD TYR 73 9.065 3.773 -1.409
497 HD2 TYR 73 2HD TYR 73 7.177 2.149 2.041
498 HE1 TYR 73 1HE TYR 73 10.386 5.280 0.016
499 HE2 TYR 73 2HE TYR 73 8.492 3.652 3.476
500 HH TYR 73 HH TYR 73 10.966 4.904 3.050
501 H THR 74 H THR 74 7.882 -1.546 0.079
502 HA THR 74 HA THR 74 6.061 -2.824 -1.770
503 HB THR 74 HB THR 74 7.103 -3.948 0.832
504 HG1 THR 74 1HG THR 74 8.894 -4.579 -0.243
505 HG21 THR 74 3HG2 THR 74 6.881 -6.059 -0.755
506 HG22 THR 74 1HG2 THR 74 5.677 -5.039 -1.542
507 HG23 THR 74 2HG2 THR 74 5.506 -5.448 0.165
508 H VAL 75 H VAL 75 3.946 -2.492 -1.625
509 HA VAL 75 HA VAL 75 2.758 -1.950 1.007
510 HB VAL 75 HB VAL 75 1.523 -1.547 -1.720
511 HG11 VAL 75 1HG1 VAL 75 0.639 -0.913 1.075
512 HG12 VAL 75 2HG1 VAL 75 0.016 -0.019 -0.313
513 HG13 VAL 75 3HG1 VAL 75 -0.237 -1.761 -0.199
514 HG21 VAL 75 3HG2 VAL 75 1.971 0.824 -1.409
515 HG22 VAL 75 1HG2 VAL 75 2.767 0.487 0.129
516 HG23 VAL 75 2HG2 VAL 75 3.475 -0.096 -1.377
517 H ARG 76 H ARG 76 0.839 -3.017 1.654
518 HA ARG 76 HA ARG 76 0.036 -5.378 0.136
519 HB2 ARG 76 1HB ARG 76 1.885 -5.827 1.958
520 HB3 ARG 76 2HB ARG 76 0.522 -5.728 3.065
521 HG2 ARG 76 1HG ARG 76 -0.444 -7.647 2.269
522 HG3 ARG 76 2HG ARG 76 0.313 -7.498 0.682
523 HD2 ARG 76 1HD ARG 76 1.574 -9.195 1.535
524 HD3 ARG 76 2HD ARG 76 2.518 -7.820 2.109
525 HE ARG 76 HE ARG 76 0.921 -9.634 3.706
526 HH11 ARG 76 1HH1 ARG 76 2.612 -6.595 3.542
527 HH12 ARG 76 2HH1 ARG 76 2.781 -6.448 5.260
528 HH21 ARG 76 1HH2 ARG 76 1.137 -9.451 5.969
529 HH22 ARG 76 2HH2 ARG 76 1.943 -8.073 6.640
530 H VAL 77 H VAL 77 -2.077 -5.085 -0.116
531 HA VAL 77 HA VAL 77 -3.631 -3.745 1.958
532 HB VAL 77 HB VAL 77 -4.480 -4.662 -0.793
533 HG11 VAL 77 1HG1 VAL 77 -5.867 -2.962 1.273
534 HG12 VAL 77 2HG1 VAL 77 -6.397 -3.121 -0.403
535 HG13 VAL 77 3HG1 VAL 77 -6.385 -4.531 0.657
536 HG21 VAL 77 3HG2 VAL 77 -3.783 -2.706 -1.647
537 HG22 VAL 77 1HG2 VAL 77 -4.297 -1.794 -0.228
538 HG23 VAL 77 2HG2 VAL 77 -2.747 -2.636 -0.222
539 H THR 78 H THR 78 -3.950 -5.217 3.575
540 HA THR 78 HA THR 78 -5.040 -7.846 2.893
541 HB THR 78 HB THR 78 -4.247 -6.810 5.620
542 HG1 THR 78 1HG THR 78 -2.701 -8.640 4.142
543 HG21 THR 78 3HG2 THR 78 -4.528 -8.956 6.418
544 HG22 THR 78 1HG2 THR 78 -4.339 -9.688 4.825
545 HG23 THR 78 2HG2 THR 78 -5.839 -8.860 5.242
546 H CYS 79 H CYS 79 -7.177 -7.687 2.494
547 HA CYS 79 HA CYS 79 -8.870 -5.966 4.094
548 HB2 CYS 79 1HB CYS 79 -9.665 -7.921 1.928
549 HB3 CYS 79 2HB CYS 79 -10.652 -6.622 2.588
550 HG CYS 79 HG CYS 79 -10.045 -5.073 0.638
551 H LEU 80 H LEU 80 -9.693 -6.590 5.967
552 HA LEU 80 HA LEU 80 -9.804 -9.419 6.640
553 HB2 LEU 80 1HB LEU 80 -10.027 -6.865 8.171
554 HB3 LEU 80 2HB LEU 80 -10.653 -8.357 8.871
555 HG LEU 80 HG LEU 80 -8.464 -7.989 9.742
556 HD11 LEU 80 1HD1 LEU 80 -7.603 -10.074 9.402
557 HD12 LEU 80 2HD1 LEU 80 -7.853 -10.017 7.658
558 HD13 LEU 80 3HD1 LEU 80 -9.219 -10.307 8.735
559 HD21 LEU 80 3HD2 LEU 80 -7.853 -6.538 7.666
560 HD22 LEU 80 1HD2 LEU 80 -7.230 -8.057 7.023
561 HD23 LEU 80 2HD2 LEU 80 -6.588 -7.410 8.533
562 H TYR 81 H TYR 81 -11.551 -10.482 5.964
563 HA TYR 81 HA TYR 81 -14.086 -9.185 5.581
564 HB2 TYR 81 1HB TYR 81 -13.357 -12.118 5.446
565 HB3 TYR 81 2HB TYR 81 -14.872 -11.412 4.894
566 HD1 TYR 81 2HD TYR 81 -14.547 -9.415 3.153
567 HD2 TYR 81 1HD TYR 81 -11.724 -12.517 3.869
568 HE1 TYR 81 2HE TYR 81 -13.560 -9.021 0.935
569 HE2 TYR 81 1HE TYR 81 -10.729 -12.131 1.653
570 HH TYR 81 HH TYR 81 -11.289 -11.174 -0.476
571 HA PRO 82 HA PRO 82 -15.871 -9.861 9.540
572 HB2 PRO 82 1HB PRO 82 -18.492 -10.026 8.852
573 HB3 PRO 82 2HB PRO 82 -17.590 -8.506 8.840
574 HG2 PRO 82 1HG PRO 82 -18.269 -10.323 6.560
575 HG3 PRO 82 2HG PRO 82 -18.334 -8.553 6.638
576 HD2 PRO 82 1HD PRO 82 -16.291 -9.886 5.463
577 HD3 PRO 82 2HD PRO 82 -16.067 -8.329 6.286
578 H GLY 83 H GLY 83 -15.974 -12.186 7.058
579 HA2 GLY 83 1HA GLY 83 -17.480 -14.149 8.583
580 HA3 GLY 83 2HA GLY 83 -16.766 -14.384 6.995
581 H GLY 84 H GLY 84 -14.292 -14.381 7.005
582 HA2 GLY 84 1HA GLY 84 -12.887 -15.061 9.365
583 HA3 GLY 84 2HA GLY 84 -13.382 -16.528 8.532
584 H GLY 85 H GLY 85 -13.072 -15.882 5.903
585 HA2 GLY 85 1HA GLY 85 -10.320 -16.237 5.501
586 HA3 GLY 85 2HA GLY 85 -11.481 -15.812 4.252
587 H SER 86 H SER 86 -9.488 -14.642 3.488
588 HA SER 86 HA SER 86 -9.806 -11.874 3.895
589 HB2 SER 86 1HB SER 86 -7.725 -11.311 5.018
590 HB3 SER 86 2HB SER 86 -8.659 -12.404 6.039
591 HG SER 86 HG SER 86 -7.332 -14.106 5.313
592 H SER 87 H SER 87 -8.472 -10.611 2.510
593 HA SER 87 HA SER 87 -7.029 -12.207 0.494
594 HB2 SER 87 1HB SER 87 -9.091 -11.289 -0.433
595 HB3 SER 87 2HB SER 87 -8.637 -9.671 0.102
596 HG SER 87 HG SER 87 -8.182 -10.226 -2.164
597 H THR 88 H THR 88 -5.057 -11.502 -0.207
598 HA THR 88 HA THR 88 -4.006 -9.025 0.987
599 HB THR 88 HB THR 88 -2.458 -11.610 0.739
600 HG1 THR 88 1HG THR 88 -3.126 -10.382 3.187
601 HG21 THR 88 3HG2 THR 88 -1.204 -9.881 2.528
602 HG22 THR 88 1HG2 THR 88 -1.683 -8.855 1.176
603 HG23 THR 88 2HG2 THR 88 -0.674 -10.274 0.893
604 H LEU 89 H LEU 89 -3.363 -7.667 -0.540
605 HA LEU 89 HA LEU 89 -2.485 -8.761 -3.127
606 HB2 LEU 89 1HB LEU 89 -3.888 -6.241 -2.348
607 HB3 LEU 89 2HB LEU 89 -2.933 -6.291 -3.828
608 HG LEU 89 HG LEU 89 -5.062 -8.339 -3.356
609 HD11 LEU 89 1HD1 LEU 89 -6.103 -6.151 -2.930
610 HD12 LEU 89 2HD1 LEU 89 -6.704 -6.906 -4.406
611 HD13 LEU 89 3HD1 LEU 89 -5.533 -5.591 -4.502
612 HD21 LEU 89 3HD2 LEU 89 -3.252 -8.140 -5.295
613 HD22 LEU 89 1HD2 LEU 89 -4.481 -7.072 -5.972
614 HD23 LEU 89 2HD2 LEU 89 -4.884 -8.745 -5.584
615 H THR 90 H THR 90 -0.328 -8.912 -3.106
616 HA THR 90 HA THR 90 1.280 -6.869 -1.791
617 HB THR 90 HB THR 90 3.182 -8.309 -2.181
618 HG1 THR 90 1HG THR 90 1.389 -9.608 -3.925
619 HG21 THR 90 3HG2 THR 90 1.315 -8.852 -0.418
620 HG22 THR 90 1HG2 THR 90 2.635 -9.987 -0.696
621 HG23 THR 90 2HG2 THR 90 1.057 -10.270 -1.433
622 H GLY 91 H GLY 91 2.577 -5.417 -2.814
623 HA2 GLY 91 1HA GLY 91 3.041 -5.621 -5.676
624 HA3 GLY 91 2HA GLY 91 2.032 -4.273 -5.171
625 H ARG 92 H ARG 92 3.705 -2.925 -6.107
626 HA ARG 92 HA ARG 92 5.602 -2.092 -4.109
627 HB2 ARG 92 1HB ARG 92 6.569 -3.178 -6.759
628 HB3 ARG 92 2HB ARG 92 7.561 -2.239 -5.651
629 HG2 ARG 92 1HG ARG 92 7.252 -3.973 -3.935
630 HG3 ARG 92 2HG ARG 92 6.315 -4.922 -5.091
631 HD2 ARG 92 1HD ARG 92 8.312 -4.891 -6.601
632 HD3 ARG 92 2HD ARG 92 9.219 -4.143 -5.286
633 HE ARG 92 HE ARG 92 7.960 -6.544 -4.436
634 HH11 ARG 92 1HH1 ARG 92 10.667 -5.324 -6.254
635 HH12 ARG 92 2HH1 ARG 92 11.655 -6.719 -5.968
636 HH21 ARG 92 1HH2 ARG 92 9.252 -8.385 -4.052
637 HH22 ARG 92 2HH2 ARG 92 10.848 -8.459 -4.716
638 H VAL 93 H VAL 93 6.104 0.041 -4.292
639 HA VAL 93 HA VAL 93 5.387 1.433 -6.776
640 HB VAL 93 HB VAL 93 3.466 1.715 -5.324
641 HG11 VAL 93 1HG1 VAL 93 5.421 1.799 -3.275
642 HG12 VAL 93 2HG1 VAL 93 4.532 3.323 -3.235
643 HG13 VAL 93 3HG1 VAL 93 3.665 1.792 -3.115
644 HG21 VAL 93 3HG2 VAL 93 3.861 4.325 -4.897
645 HG22 VAL 93 1HG2 VAL 93 5.228 4.003 -5.963
646 HG23 VAL 93 2HG2 VAL 93 3.587 3.650 -6.503
647 H THR 94 H THR 94 7.047 2.602 -7.450
648 HA THR 94 HA THR 94 9.218 3.241 -5.631
649 HB THR 94 HB THR 94 8.971 3.742 -8.604
650 HG1 THR 94 1HG THR 94 10.571 1.937 -8.552
651 HG21 THR 94 3HG2 THR 94 11.307 4.233 -8.594
652 HG22 THR 94 1HG2 THR 94 11.456 3.784 -6.896
653 HG23 THR 94 2HG2 THR 94 10.561 5.235 -7.349
654 H THR 95 H THR 95 8.977 5.007 -4.417
655 HA THR 95 HA THR 95 7.283 7.155 -4.889
656 HB THR 95 HB THR 95 8.947 8.419 -3.336
657 HG1 THR 95 1HG THR 95 10.645 7.323 -2.696
658 HG21 THR 95 3HG2 THR 95 6.777 6.910 -2.852
659 HG22 THR 95 1HG2 THR 95 7.715 7.684 -1.576
660 HG23 THR 95 2HG2 THR 95 7.984 5.984 -1.960
661 H LYS 96 H LYS 96 7.642 9.291 -5.595
662 HA LYS 96 HA LYS 96 9.367 9.498 -7.867
663 HB2 LYS 96 1HB LYS 96 7.816 11.706 -6.507
664 HB3 LYS 96 2HB LYS 96 8.431 11.706 -8.155
665 HG2 LYS 96 1HG LYS 96 6.911 9.558 -8.350
666 HG3 LYS 96 2HG LYS 96 6.062 10.333 -7.009
667 HD2 LYS 96 1HD LYS 96 5.398 12.122 -8.287
668 HD3 LYS 96 2HD LYS 96 6.761 11.971 -9.399
669 HE2 LYS 96 1HE LYS 96 5.755 9.989 -10.388
670 HE3 LYS 96 2HE LYS 96 4.419 10.075 -9.242
671 HZ1 LYS 96 3HZ LYS 96 3.373 11.441 -10.611
672 HZ2 LYS 96 1HZ LYS 96 4.647 11.342 -11.719
673 HZ3 LYS 96 2HZ LYS 96 4.647 12.550 -10.536
674 H LYS 97 H LYS 97 10.813 11.436 -8.154
675 HA LYS 97 HA LYS 97 12.774 11.438 -6.063
676 HB2 LYS 97 1HB LYS 97 12.556 12.630 -8.793
677 HB3 LYS 97 2HB LYS 97 13.761 13.279 -7.688
678 HG2 LYS 97 1HG LYS 97 14.884 11.655 -8.942
679 HG3 LYS 97 2HG LYS 97 14.557 10.888 -7.386
680 HD2 LYS 97 1HD LYS 97 13.938 9.231 -8.874
681 HD3 LYS 97 2HD LYS 97 12.398 10.036 -8.567
682 HE2 LYS 97 1HE LYS 97 12.392 9.869 -10.867
683 HE3 LYS 97 2HE LYS 97 13.054 11.485 -10.626
684 HZ1 LYS 97 3HZ LYS 97 14.333 10.267 -12.258
685 HZ2 LYS 97 1HZ LYS 97 14.626 9.020 -11.152
686 HZ3 LYS 97 2HZ LYS 97 15.280 10.558 -10.887
687 H ALA 98 H ALA 98 13.158 12.936 -4.536
688 HA ALA 98 HA ALA 98 11.185 14.964 -4.062
689 HB1 ALA 98 3HB ALA 98 12.638 13.519 -2.386
690 HB2 ALA 98 1HB ALA 98 13.716 14.910 -2.510
691 HB3 ALA 98 2HB ALA 98 12.053 15.128 -1.961
692 HA PRO 99 HA PRO 99 13.098 18.393 -6.038
693 HB2 PRO 99 1HB PRO 99 12.198 20.415 -4.466
694 HB3 PRO 99 2HB PRO 99 11.160 19.549 -5.604
695 HG2 PRO 99 1HG PRO 99 11.448 19.182 -2.647
696 HG3 PRO 99 2HG PRO 99 9.974 19.206 -3.634
697 HD2 PRO 99 1HD PRO 99 11.115 16.906 -2.774
698 HD3 PRO 99 2HD PRO 99 10.246 17.022 -4.318
699 H SER 100 H SER 100 13.445 18.143 -2.524
700 HA SER 100 HA SER 100 16.253 18.634 -2.657
701 HB2 SER 100 1HB SER 100 15.143 20.961 -2.819
702 HB3 SER 100 2HB SER 100 14.726 20.728 -1.121
703 HG SER 100 HG SER 100 17.179 21.223 -2.295
704 HA PRO 101 HA PRO 101 15.962 16.235 1.023
705 HB2 PRO 101 1HB PRO 101 18.461 16.656 1.998
706 HB3 PRO 101 2HB PRO 101 18.135 15.615 0.607
707 HG2 PRO 101 1HG PRO 101 19.093 18.450 0.667
708 HG3 PRO 101 2HG PRO 101 19.645 17.104 -0.346
709 HD2 PRO 101 1HD PRO 101 17.945 19.008 -1.252
710 HD3 PRO 101 2HD PRO 101 17.886 17.326 -1.819
711 H SER 102 H SER 102 17.106 19.568 1.195
712 HA SER 102 HA SER 102 16.295 19.698 4.015
713 HB2 SER 102 1HB SER 102 17.600 21.767 4.130
714 HB3 SER 102 2HB SER 102 18.590 20.453 3.493
715 HG SER 102 HG SER 102 17.195 22.160 1.743
716 H SER 103 H SER 103 15.067 21.542 4.747
717 HA SER 103 HA SER 103 13.022 22.284 2.811
718 HB2 SER 103 1HB SER 103 11.922 23.276 4.906
719 HB3 SER 103 2HB SER 103 12.096 21.522 4.851
720 HG SER 103 HG SER 103 13.155 23.303 6.597
721 H GLY 104 H GLY 104 15.075 23.942 5.214
722 HA2 GLY 104 1HA GLY 104 16.259 25.939 4.863
723 HA3 GLY 104 2HA GLY 104 15.352 26.191 3.379
724 HA PRO 105 HA PRO 105 13.727 29.159 6.526
725 HB2 PRO 105 1HB PRO 105 13.599 31.258 4.809
726 HB3 PRO 105 2HB PRO 105 15.064 30.838 5.705
727 HG2 PRO 105 1HG PRO 105 14.332 30.212 2.870
728 HG3 PRO 105 2HG PRO 105 15.883 30.763 3.530
729 HD2 PRO 105 1HD PRO 105 15.400 28.170 2.917
730 HD3 PRO 105 2HD PRO 105 16.471 28.653 4.248
731 H SER 106 H SER 106 11.637 28.701 6.847
732 HA SER 106 HA SER 106 9.763 29.172 4.627
733 HB2 SER 106 1HB SER 106 10.115 26.719 5.077
734 HB3 SER 106 2HB SER 106 9.444 26.979 6.687
735 HG SER 106 HG SER 106 8.105 27.571 4.254
736 H SER 107 H SER 107 7.481 29.469 5.433
737 HA SER 107 HA SER 107 7.526 31.017 7.939
738 HB2 SER 107 1HB SER 107 5.952 31.431 5.395
739 HB3 SER 107 2HB SER 107 5.554 32.250 6.906
740 HG SER 107 HG SER 107 6.987 33.410 5.423
741 H GLY 108 H GLY 108 5.844 30.792 9.401
742 HA2 GLY 108 1HA GLY 108 4.317 29.556 10.600
743 HA3 GLY 108 2HA GLY 108 3.416 29.553 9.091
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