Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
570263 | 2m8e RC | 19249 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 ALA 1 HT1 ALA 1 77.988 -6.370 -12.793
2 H2 ALA 1 HT2 ALA 1 77.912 -7.954 -13.367
3 H3 ALA 1 HT3 ALA 1 78.124 -7.668 -11.716
4 HA ALA 1 HA ALA 1 75.875 -8.337 -12.170
5 HB1 ALA 1 HB1 ALA 1 76.053 -5.401 -11.493
6 HB2 ALA 1 HB2 ALA 1 76.313 -6.723 -10.357
7 HB3 ALA 1 HB3 ALA 1 74.727 -6.491 -11.092
8 H SER 2 HN SER 2 73.726 -6.936 -12.814
9 HA SER 2 HA SER 2 74.161 -6.081 -15.587
10 HB2 SER 2 HB2 SER 2 71.806 -7.651 -14.512
11 HB3 SER 2 HB1 SER 2 72.026 -7.118 -16.179
12 HG SER 2 HG SER 2 74.145 -8.381 -15.875
13 H MET 3 HN MET 3 72.230 -4.827 -16.399
14 HA MET 3 HA MET 3 71.448 -2.894 -14.355
15 HB2 MET 3 HB2 MET 3 71.006 -1.361 -16.210
16 HB3 MET 3 HB1 MET 3 72.651 -1.967 -16.280
17 HG2 MET 3 HG2 MET 3 70.370 -3.032 -17.937
18 HG3 MET 3 HG1 MET 3 71.514 -1.811 -18.485
19 HE1 MET 3 HE1 MET 3 74.102 -2.276 -18.874
20 HE2 MET 3 HE2 MET 3 74.880 -3.828 -18.561
21 HE3 MET 3 HE3 MET 3 74.263 -2.865 -17.219
22 H GLY 4 HN GLY 4 69.250 -1.777 -15.198
23 HA2 GLY 4 HA2 GLY 4 67.133 -2.446 -16.314
24 HA3 GLY 4 HA1 GLY 4 67.355 -4.007 -15.535
25 H LYS 5 HN LYS 5 66.356 -0.746 -15.166
26 HA LYS 5 HA LYS 5 65.542 -1.321 -12.400
27 HB2 LYS 5 HB2 LYS 5 67.226 0.504 -12.650
28 HB3 LYS 5 HB1 LYS 5 66.074 1.380 -13.645
29 HG2 LYS 5 HG2 LYS 5 64.522 1.459 -11.749
30 HG3 LYS 5 HG1 LYS 5 65.718 0.632 -10.752
31 HD2 LYS 5 HD2 LYS 5 67.303 2.523 -11.351
32 HD3 LYS 5 HD1 LYS 5 65.894 3.367 -11.990
33 HE2 LYS 5 HE2 LYS 5 66.332 4.083 -9.719
34 HE3 LYS 5 HE1 LYS 5 64.811 3.193 -9.792
35 HZ1 LYS 5 HZ1 LYS 5 66.196 2.560 -7.890
36 HZ2 LYS 5 HZ2 LYS 5 67.406 2.025 -8.945
37 HZ3 LYS 5 HZ3 LYS 5 65.903 1.259 -8.924
38 H SER 6 HN SER 6 63.437 -1.732 -12.327
39 HA SER 6 HA SER 6 61.610 0.070 -13.668
40 HB2 SER 6 HB2 SER 6 61.550 -2.924 -14.116
41 HB3 SER 6 HB1 SER 6 60.281 -1.803 -14.611
42 HG SER 6 HG SER 6 62.740 -0.999 -15.449
43 H LYS 7 HN LYS 7 59.380 -0.271 -12.934
44 HA LYS 7 HA LYS 7 59.261 -1.453 -10.248
45 HB2 LYS 7 HB2 LYS 7 57.739 0.425 -9.634
46 HB3 LYS 7 HB1 LYS 7 59.380 0.948 -9.993
47 HG2 LYS 7 HG2 LYS 7 58.596 1.546 -12.295
48 HG3 LYS 7 HG1 LYS 7 56.951 1.207 -11.753
49 HD2 LYS 7 HD2 LYS 7 58.809 3.237 -10.513
50 HD3 LYS 7 HD1 LYS 7 57.523 3.609 -11.659
51 HE2 LYS 7 HE2 LYS 7 55.870 2.724 -10.090
52 HE3 LYS 7 HE1 LYS 7 57.155 2.338 -8.949
53 HZ1 LYS 7 HZ1 LYS 7 56.049 4.420 -8.406
54 HZ2 LYS 7 HZ2 LYS 7 56.475 5.067 -9.906
55 HZ3 LYS 7 HZ3 LYS 7 57.677 4.679 -8.778
56 H GLU 8 HN GLU 8 56.866 -1.724 -9.590
57 HA GLU 8 HA GLU 8 55.296 -2.479 -11.957
58 HB2 GLU 8 HB2 GLU 8 56.315 -4.460 -10.830
59 HB3 GLU 8 HB1 GLU 8 55.426 -4.039 -9.374
60 HG2 GLU 8 HG2 GLU 8 53.327 -4.410 -10.493
61 HG3 GLU 8 HG1 GLU 8 54.155 -4.684 -12.024
62 H ILE 9 HN ILE 9 54.937 -2.218 -8.427
63 HA ILE 9 HA ILE 9 52.500 -0.624 -8.882
64 HB ILE 9 HB ILE 9 52.946 -2.525 -6.557
65 HG12 ILE 9 HG12 ILE 9 51.219 -2.951 -9.009
66 HG13 ILE 9 HG11 ILE 9 52.748 -3.762 -8.693
67 HG21 ILE 9 HG21 ILE 9 51.431 -0.667 -6.080
68 HG22 ILE 9 HG22 ILE 9 50.556 -2.197 -6.133
69 HG23 ILE 9 HG23 ILE 9 50.465 -1.083 -7.496
70 HD11 ILE 9 HD11 ILE 9 50.249 -3.998 -7.032
71 HD12 ILE 9 HD12 ILE 9 51.780 -4.814 -6.713
72 HD13 ILE 9 HD13 ILE 9 50.863 -5.198 -8.170
73 H SER 10 HN SER 10 52.169 1.095 -7.411
74 HA SER 10 HA SER 10 54.469 2.344 -6.380
75 HB2 SER 10 HB2 SER 10 52.474 3.625 -7.016
76 HB3 SER 10 HB1 SER 10 51.548 2.845 -5.737
77 HG SER 10 HG SER 10 53.064 5.025 -5.587
78 H GLN 11 HN GLN 11 55.624 1.412 -4.804
79 HA GLN 11 HA GLN 11 54.563 -0.285 -2.819
80 HB2 GLN 11 HB2 GLN 11 56.957 -0.228 -3.596
81 HB3 GLN 11 HB1 GLN 11 57.163 1.252 -2.671
82 HG2 GLN 11 HG2 GLN 11 56.623 0.053 -0.615
83 HG3 GLN 11 HG1 GLN 11 56.388 -1.430 -1.537
84 HE21 GLN 11 HE21 GLN 11 58.645 -0.812 -3.318
85 HE22 GLN 11 HE22 GLN 11 60.072 -1.124 -2.398
86 H ASP 12 HN ASP 12 55.160 3.150 -2.974
87 HA ASP 12 HA ASP 12 54.857 3.802 -0.261
88 HB2 ASP 12 HB2 ASP 12 55.703 5.429 -1.857
89 HB3 ASP 12 HB1 ASP 12 54.174 5.419 -2.725
90 H LEU 13 HN LEU 13 52.496 3.774 -2.907
91 HA LEU 13 HA LEU 13 50.263 4.526 -1.422
92 HB2 LEU 13 HB2 LEU 13 50.315 4.479 -3.867
93 HB3 LEU 13 HB1 LEU 13 50.408 2.731 -3.841
94 HG LEU 13 HG LEU 13 48.154 2.641 -2.828
95 HD11 LEU 13 HD11 LEU 13 48.130 4.793 -1.710
96 HD12 LEU 13 HD12 LEU 13 46.766 4.661 -2.820
97 HD13 LEU 13 HD13 LEU 13 48.175 5.622 -3.265
98 HD21 LEU 13 HD21 LEU 13 48.422 2.440 -5.240
99 HD22 LEU 13 HD22 LEU 13 48.334 4.194 -5.408
100 HD23 LEU 13 HD23 LEU 13 46.927 3.291 -4.844
101 H ARG 14 HN ARG 14 51.634 1.327 -2.020
102 HA ARG 14 HA ARG 14 49.545 -0.173 -0.873
103 HB2 ARG 14 HB2 ARG 14 52.473 -0.895 -1.082
104 HB3 ARG 14 HB1 ARG 14 51.163 -2.021 -0.756
105 HG2 ARG 14 HG2 ARG 14 50.202 -1.551 -2.946
106 HG3 ARG 14 HG1 ARG 14 51.499 -0.402 -3.272
107 HD2 ARG 14 HD2 ARG 14 52.105 -2.410 -4.363
108 HD3 ARG 14 HD1 ARG 14 53.112 -2.308 -2.921
109 HE ARG 14 HE ARG 14 50.816 -3.785 -2.296
110 HH11 ARG 14 HH11 ARG 14 53.706 -4.060 -4.267
111 HH12 ARG 14 HH12 ARG 14 53.737 -5.785 -4.213
112 HH21 ARG 14 HH21 ARG 14 50.846 -6.080 -2.231
113 HH22 ARG 14 HH22 ARG 14 52.107 -6.941 -3.051
114 H LYS 15 HN LYS 15 52.537 1.099 0.552
115 HA LYS 15 HA LYS 15 52.022 -0.030 3.131
116 HB2 LYS 15 HB2 LYS 15 53.832 2.284 2.403
117 HB3 LYS 15 HB1 LYS 15 53.874 1.371 3.902
118 HG2 LYS 15 HG2 LYS 15 54.513 0.308 1.153
119 HG3 LYS 15 HG1 LYS 15 55.678 0.709 2.414
120 HD2 LYS 15 HD2 LYS 15 53.535 -1.410 2.640
121 HD3 LYS 15 HD1 LYS 15 55.226 -1.717 2.251
122 HE2 LYS 15 HE2 LYS 15 55.888 -0.760 4.411
123 HE3 LYS 15 HE1 LYS 15 54.191 -0.473 4.798
124 HZ1 LYS 15 HZ1 LYS 15 55.456 -3.116 4.336
125 HZ2 LYS 15 HZ2 LYS 15 53.817 -2.864 4.649
126 HZ3 LYS 15 HZ3 LYS 15 54.966 -2.493 5.826
127 H LYS 16 HN LYS 16 51.521 3.086 1.620
128 HA LYS 16 HA LYS 16 50.730 4.541 3.873
129 HB2 LYS 16 HB2 LYS 16 51.445 5.519 1.740
130 HB3 LYS 16 HB1 LYS 16 49.980 4.923 0.983
131 HG2 LYS 16 HG2 LYS 16 48.632 6.453 2.142
132 HG3 LYS 16 HG1 LYS 16 49.916 6.832 3.296
133 HD2 LYS 16 HD2 LYS 16 49.636 8.621 1.638
134 HD3 LYS 16 HD1 LYS 16 51.226 7.869 1.525
135 HE2 LYS 16 HE2 LYS 16 50.190 6.398 -0.304
136 HE3 LYS 16 HE1 LYS 16 48.869 7.565 -0.315
137 HZ1 LYS 16 HZ1 LYS 16 50.615 9.301 -0.706
138 HZ2 LYS 16 HZ2 LYS 16 50.396 8.205 -1.971
139 HZ3 LYS 16 HZ3 LYS 16 51.726 8.037 -0.944
140 H ILE 17 HN ILE 17 48.722 2.874 1.417
141 HA ILE 17 HA ILE 17 46.265 3.639 2.524
142 HB ILE 17 HB ILE 17 46.454 2.682 0.248
143 HG12 ILE 17 HG12 ILE 17 44.439 1.214 0.336
144 HG13 ILE 17 HG11 ILE 17 44.578 1.191 2.090
145 HG21 ILE 17 HG21 ILE 17 46.606 0.261 -0.084
146 HG22 ILE 17 HG22 ILE 17 46.886 0.050 1.645
147 HG23 ILE 17 HG23 ILE 17 48.062 0.920 0.662
148 HD11 ILE 17 HD11 ILE 17 42.894 2.772 1.332
149 HD12 ILE 17 HD12 ILE 17 44.115 3.636 0.398
150 HD13 ILE 17 HD13 ILE 17 44.215 3.594 2.157
151 H VAL 18 HN VAL 18 48.343 0.894 3.244
152 HA VAL 18 HA VAL 18 46.529 -0.417 4.988
153 HB VAL 18 HB VAL 18 49.535 -0.611 4.711
154 HG11 VAL 18 HG11 VAL 18 47.695 -2.326 6.377
155 HG12 VAL 18 HG12 VAL 18 48.915 -1.211 6.990
156 HG13 VAL 18 HG13 VAL 18 49.405 -2.640 6.079
157 HG21 VAL 18 HG21 VAL 18 48.280 -1.423 2.794
158 HG22 VAL 18 HG22 VAL 18 47.290 -2.433 3.848
159 HG23 VAL 18 HG23 VAL 18 49.011 -2.774 3.662
160 H ASP 19 HN ASP 19 49.292 1.738 5.545
161 HA ASP 19 HA ASP 19 49.191 1.709 8.348
162 HB2 ASP 19 HB2 ASP 19 51.131 2.505 7.053
163 HB3 ASP 19 HB1 ASP 19 50.202 3.909 6.538
164 H LEU 20 HN LEU 20 47.608 3.809 5.991
165 HA LEU 20 HA LEU 20 46.494 5.551 7.941
166 HB2 LEU 20 HB2 LEU 20 46.094 5.126 5.030
167 HB3 LEU 20 HB1 LEU 20 44.831 5.968 5.904
168 HG LEU 20 HG LEU 20 46.362 7.546 4.851
169 HD11 LEU 20 HD11 LEU 20 45.293 8.184 6.936
170 HD12 LEU 20 HD12 LEU 20 46.887 8.918 6.773
171 HD13 LEU 20 HD13 LEU 20 46.660 7.537 7.844
172 HD21 LEU 20 HD21 LEU 20 48.378 6.174 4.828
173 HD22 LEU 20 HD22 LEU 20 48.496 6.311 6.583
174 HD23 LEU 20 HD23 LEU 20 48.683 7.744 5.572
175 H HIS 21 HN HIS 21 45.525 2.458 6.704
176 HA HIS 21 HA HIS 21 42.798 2.607 7.500
177 HB2 HIS 21 HB2 HIS 21 44.643 0.316 6.907
178 HB3 HIS 21 HB1 HIS 21 43.073 0.010 7.634
179 HD1 HIS 21 HD1 HIS 21 41.417 2.070 5.995
180 HD2 HIS 21 HD2 HIS 21 44.166 -0.601 4.392
181 HE1 HIS 21 HE1 HIS 21 40.752 1.785 3.596
182 H LYS 22 HN LYS 22 45.759 1.995 9.151
183 HA LYS 22 HA LYS 22 44.524 0.945 11.524
184 HB2 LYS 22 HB2 LYS 22 47.307 2.071 11.226
185 HB3 LYS 22 HB1 LYS 22 46.737 0.965 12.466
186 HG2 LYS 22 HG2 LYS 22 46.994 0.337 9.531
187 HG3 LYS 22 HG1 LYS 22 48.122 -0.151 10.794
188 HD2 LYS 22 HD2 LYS 22 45.207 -0.928 10.734
189 HD3 LYS 22 HD1 LYS 22 46.510 -1.929 10.096
190 HE2 LYS 22 HE2 LYS 22 47.557 -1.882 12.360
191 HE3 LYS 22 HE1 LYS 22 46.120 -1.049 12.952
192 HZ1 LYS 22 HZ1 LYS 22 45.981 -3.414 13.369
193 HZ2 LYS 22 HZ2 LYS 22 46.182 -3.751 11.722
194 HZ3 LYS 22 HZ3 LYS 22 44.794 -2.951 12.261
195 H SER 23 HN SER 23 45.210 4.019 10.198
196 HA SER 23 HA SER 23 45.056 5.466 12.684
197 HB2 SER 23 HB2 SER 23 44.881 6.501 9.840
198 HB3 SER 23 HB1 SER 23 45.210 7.453 11.287
199 HG SER 23 HG SER 23 46.985 5.554 11.316
200 H GLY 24 HN GLY 24 42.980 4.959 9.833
201 HA2 GLY 24 HA2 GLY 24 40.677 4.706 9.790
202 HA3 GLY 24 HA1 GLY 24 40.632 5.042 11.510
203 H SER 25 HN SER 25 41.335 7.476 11.950
204 HA SER 25 HA SER 25 39.212 8.992 10.784
205 HB2 SER 25 HB2 SER 25 41.383 9.906 12.676
206 HB3 SER 25 HB1 SER 25 39.869 10.746 12.340
207 HG SER 25 HG SER 25 40.092 9.232 14.277
208 H SER 26 HN SER 26 42.254 8.402 9.637
209 HA SER 26 HA SER 26 42.351 10.984 8.227
210 HB2 SER 26 HB2 SER 26 44.632 9.058 8.719
211 HB3 SER 26 HB1 SER 26 44.748 10.655 7.978
212 HG SER 26 HG SER 26 44.643 11.560 9.881
213 H LEU 27 HN LEU 27 41.129 8.111 7.764
214 HA LEU 27 HA LEU 27 42.349 7.178 5.369
215 HB2 LEU 27 HB2 LEU 27 41.012 5.771 6.958
216 HB3 LEU 27 HB1 LEU 27 39.572 6.610 6.434
217 HG LEU 27 HG LEU 27 40.017 4.276 5.479
218 HD11 LEU 27 HD11 LEU 27 38.301 5.718 4.579
219 HD12 LEU 27 HD12 LEU 27 39.127 4.859 3.279
220 HD13 LEU 27 HD13 LEU 27 39.495 6.556 3.587
221 HD21 LEU 27 HD21 LEU 27 42.385 4.598 4.966
222 HD22 LEU 27 HD22 LEU 27 41.964 5.831 3.777
223 HD23 LEU 27 HD23 LEU 27 41.468 4.158 3.527
224 H GLY 28 HN GLY 28 39.568 9.223 6.109
225 HA2 GLY 28 HA2 GLY 28 38.605 9.483 3.469
226 HA3 GLY 28 HA1 GLY 28 38.293 10.595 4.795
227 H ALA 29 HN ALA 29 41.262 10.961 5.112
228 HA ALA 29 HA ALA 29 41.523 13.267 3.499
229 HB1 ALA 29 HB1 ALA 29 43.645 11.799 5.063
230 HB2 ALA 29 HB2 ALA 29 42.593 13.067 5.691
231 HB3 ALA 29 HB3 ALA 29 43.772 13.440 4.433
232 H ILE 30 HN ILE 30 43.310 10.163 3.413
233 HA ILE 30 HA ILE 30 44.652 10.847 0.998
234 HB ILE 30 HB ILE 30 45.321 8.478 0.850
235 HG12 ILE 30 HG12 ILE 30 43.719 8.061 3.382
236 HG13 ILE 30 HG11 ILE 30 43.171 7.560 1.786
237 HG21 ILE 30 HG21 ILE 30 46.634 8.407 2.911
238 HG22 ILE 30 HG22 ILE 30 45.610 9.662 3.607
239 HG23 ILE 30 HG23 ILE 30 46.620 10.024 2.206
240 HD11 ILE 30 HD11 ILE 30 45.066 6.060 1.590
241 HD12 ILE 30 HD12 ILE 30 44.139 5.713 3.050
242 HD13 ILE 30 HD13 ILE 30 45.665 6.589 3.161
243 H SER 31 HN SER 31 41.625 9.277 1.712
244 HA SER 31 HA SER 31 41.190 8.305 -0.940
245 HB2 SER 31 HB2 SER 31 39.171 8.778 1.262
246 HB3 SER 31 HB1 SER 31 38.962 7.750 -0.158
247 HG SER 31 HG SER 31 40.461 7.332 2.158
248 H LYS 32 HN LYS 32 41.066 11.347 0.467
249 HA LYS 32 HA LYS 32 39.028 12.424 -1.283
250 HB2 LYS 32 HB2 LYS 32 39.511 13.257 1.065
251 HB3 LYS 32 HB1 LYS 32 41.008 13.924 0.438
252 HG2 LYS 32 HG2 LYS 32 39.460 15.701 0.505
253 HG3 LYS 32 HG1 LYS 32 39.615 15.241 -1.190
254 HD2 LYS 32 HD2 LYS 32 37.311 15.508 -0.888
255 HD3 LYS 32 HD1 LYS 32 37.549 13.768 -0.781
256 HE2 LYS 32 HE2 LYS 32 37.324 15.636 1.588
257 HE3 LYS 32 HE1 LYS 32 36.005 14.668 0.945
258 HZ1 LYS 32 HZ1 LYS 32 38.477 13.712 2.275
259 HZ2 LYS 32 HZ2 LYS 32 37.452 12.680 1.416
260 HZ3 LYS 32 HZ3 LYS 32 36.879 13.497 2.775
261 H ARG 33 HN ARG 33 42.516 12.518 -0.866
262 HA ARG 33 HA ARG 33 42.966 14.210 -3.124
263 HB2 ARG 33 HB2 ARG 33 44.902 12.526 -1.532
264 HB3 ARG 33 HB1 ARG 33 45.351 13.735 -2.724
265 HG2 ARG 33 HG2 ARG 33 44.304 15.470 -1.346
266 HG3 ARG 33 HG1 ARG 33 43.883 14.248 -0.145
267 HD2 ARG 33 HD2 ARG 33 45.904 15.428 0.518
268 HD3 ARG 33 HD1 ARG 33 46.262 13.740 0.160
269 HE ARG 33 HE ARG 33 46.678 15.678 -1.980
270 HH11 ARG 33 HH11 ARG 33 48.099 13.665 0.526
271 HH12 ARG 33 HH12 ARG 33 49.698 13.761 -0.122
272 HH21 ARG 33 HH21 ARG 33 48.810 15.815 -2.833
273 HH22 ARG 33 HH22 ARG 33 50.110 14.992 -2.033
274 H LEU 34 HN LEU 34 43.657 10.748 -2.495
275 HA LEU 34 HA LEU 34 44.322 10.420 -5.322
276 HB2 LEU 34 HB2 LEU 34 44.573 8.455 -3.053
277 HB3 LEU 34 HB1 LEU 34 45.200 8.249 -4.675
278 HG LEU 34 HG LEU 34 46.131 10.297 -2.665
279 HD11 LEU 34 HD11 LEU 34 47.456 7.814 -3.733
280 HD12 LEU 34 HD12 LEU 34 46.818 8.038 -2.105
281 HD13 LEU 34 HD13 LEU 34 48.194 8.994 -2.651
282 HD21 LEU 34 HD21 LEU 34 46.293 11.169 -4.930
283 HD22 LEU 34 HD22 LEU 34 47.117 9.701 -5.454
284 HD23 LEU 34 HD23 LEU 34 47.895 10.786 -4.302
285 H LYS 35 HN LYS 35 41.679 10.018 -3.295
286 HA LYS 35 HA LYS 35 39.883 8.615 -3.218
287 HB2 LYS 35 HB2 LYS 35 38.406 8.868 -5.201
288 HB3 LYS 35 HB1 LYS 35 39.055 10.381 -4.609
289 HG2 LYS 35 HG2 LYS 35 40.327 8.948 -6.919
290 HG3 LYS 35 HG1 LYS 35 38.915 9.975 -7.150
291 HD2 LYS 35 HD2 LYS 35 41.530 10.850 -5.917
292 HD3 LYS 35 HD1 LYS 35 41.040 11.150 -7.583
293 HE2 LYS 35 HE2 LYS 35 39.083 12.411 -6.735
294 HE3 LYS 35 HE1 LYS 35 39.672 12.166 -5.093
295 HZ1 LYS 35 HZ1 LYS 35 40.340 14.306 -5.846
296 HZ2 LYS 35 HZ2 LYS 35 41.015 13.678 -7.258
297 HZ3 LYS 35 HZ3 LYS 35 41.726 13.339 -5.760
298 H VAL 36 HN VAL 36 41.257 6.761 -2.908
299 HA VAL 36 HA VAL 36 41.860 4.935 -4.961
300 HB VAL 36 HB VAL 36 41.379 4.340 -2.029
301 HG11 VAL 36 HG11 VAL 36 41.408 2.329 -3.399
302 HG12 VAL 36 HG12 VAL 36 42.849 2.416 -2.386
303 HG13 VAL 36 HG13 VAL 36 42.951 2.814 -4.102
304 HG21 VAL 36 HG21 VAL 36 43.811 4.595 -1.769
305 HG22 VAL 36 HG22 VAL 36 43.043 6.095 -2.287
306 HG23 VAL 36 HG23 VAL 36 43.928 5.109 -3.452
307 HA PRO 37 HA PRO 37 37.704 3.453 -5.782
308 HB2 PRO 37 HB2 PRO 37 38.468 1.320 -7.332
309 HB3 PRO 37 HB1 PRO 37 38.326 2.975 -7.932
310 HG2 PRO 37 HG2 PRO 37 40.757 1.460 -7.093
311 HG3 PRO 37 HG1 PRO 37 40.547 2.590 -8.443
312 HD2 PRO 37 HD2 PRO 37 41.775 3.288 -6.143
313 HD3 PRO 37 HD1 PRO 37 40.823 4.441 -7.100
314 H ARG 38 HN ARG 38 36.395 1.665 -5.262
315 HA ARG 38 HA ARG 38 36.954 0.433 -2.834
316 HB2 ARG 38 HB2 ARG 38 34.681 0.740 -3.624
317 HB3 ARG 38 HB1 ARG 38 34.961 -0.386 -4.945
318 HG2 ARG 38 HG2 ARG 38 35.327 -2.184 -3.303
319 HG3 ARG 38 HG1 ARG 38 34.961 -1.045 -2.008
320 HD2 ARG 38 HD2 ARG 38 33.104 -1.860 -4.234
321 HD3 ARG 38 HD1 ARG 38 33.027 -2.422 -2.565
322 HE ARG 38 HE ARG 38 32.913 0.419 -2.731
323 HH11 ARG 38 HH11 ARG 38 31.006 -2.491 -3.088
324 HH12 ARG 38 HH12 ARG 38 29.498 -1.701 -2.784
325 HH21 ARG 38 HH21 ARG 38 30.936 1.478 -2.325
326 HH22 ARG 38 HH22 ARG 38 29.455 0.583 -2.334
327 H SER 39 HN SER 39 37.223 -0.849 -6.119
328 HA SER 39 HA SER 39 37.785 -3.480 -5.411
329 HB2 SER 39 HB2 SER 39 37.203 -2.723 -7.711
330 HB3 SER 39 HB1 SER 39 38.810 -2.014 -7.850
331 HG SER 39 HG SER 39 39.327 -3.925 -8.562
332 H SER 40 HN SER 40 39.916 -0.682 -5.689
333 HA SER 40 HA SER 40 42.309 -2.205 -5.445
334 HB2 SER 40 HB2 SER 40 41.805 0.748 -5.054
335 HB3 SER 40 HB1 SER 40 43.400 -0.004 -5.118
336 HG SER 40 HG SER 40 42.841 -0.760 -7.222
337 H VAL 41 HN VAL 41 40.298 -0.408 -3.132
338 HA VAL 41 HA VAL 41 42.132 -0.855 -0.992
339 HB VAL 41 HB VAL 41 40.591 1.068 -0.957
340 HG11 VAL 41 HG11 VAL 41 38.414 -0.957 -0.500
341 HG12 VAL 41 HG12 VAL 41 38.636 0.032 -1.943
342 HG13 VAL 41 HG13 VAL 41 38.238 0.796 -0.403
343 HG21 VAL 41 HG21 VAL 41 39.880 0.881 1.394
344 HG22 VAL 41 HG22 VAL 41 41.535 0.332 1.133
345 HG23 VAL 41 HG23 VAL 41 40.238 -0.846 1.341
346 H GLN 42 HN GLN 42 39.318 -2.557 -2.207
347 HA GLN 42 HA GLN 42 39.030 -4.309 0.023
348 HB2 GLN 42 HB2 GLN 42 37.264 -3.739 -1.712
349 HB3 GLN 42 HB1 GLN 42 38.119 -4.784 -2.830
350 HG2 GLN 42 HG2 GLN 42 37.219 -5.861 -0.195
351 HG3 GLN 42 HG1 GLN 42 36.053 -5.650 -1.495
352 HE21 GLN 42 HE21 GLN 42 37.956 -6.295 -3.607
353 HE22 GLN 42 HE22 GLN 42 38.219 -7.997 -3.508
354 H THR 43 HN THR 43 40.985 -4.387 -2.887
355 HA THR 43 HA THR 43 41.679 -7.146 -2.559
356 HB THR 43 HB THR 43 43.514 -6.521 -4.272
357 HG1 THR 43 HG1 THR 43 41.874 -4.322 -4.862
358 HG21 THR 43 HG21 THR 43 40.591 -6.213 -4.975
359 HG22 THR 43 HG22 THR 43 41.474 -7.735 -4.859
360 HG23 THR 43 HG23 THR 43 41.887 -6.570 -6.117
361 H ILE 44 HN ILE 44 43.152 -4.049 -1.680
362 HA ILE 44 HA ILE 44 45.591 -5.281 -0.861
363 HB ILE 44 HB ILE 44 46.210 -3.106 0.144
364 HG12 ILE 44 HG12 ILE 44 44.563 -1.177 -0.642
365 HG13 ILE 44 HG11 ILE 44 43.362 -2.451 -0.483
366 HG21 ILE 44 HG21 ILE 44 46.731 -3.553 -2.166
367 HG22 ILE 44 HG22 ILE 44 46.321 -1.851 -1.958
368 HG23 ILE 44 HG23 ILE 44 45.147 -2.960 -2.666
369 HD11 ILE 44 HD11 ILE 44 45.202 -1.476 1.690
370 HD12 ILE 44 HD12 ILE 44 44.001 -2.757 1.854
371 HD13 ILE 44 HD13 ILE 44 43.487 -1.101 1.528
372 H VAL 45 HN VAL 45 42.585 -4.526 0.790
373 HA VAL 45 HA VAL 45 43.631 -4.868 3.400
374 HB VAL 45 HB VAL 45 41.277 -5.269 4.141
375 HG11 VAL 45 HG11 VAL 45 42.189 -3.018 4.023
376 HG12 VAL 45 HG12 VAL 45 40.467 -3.040 3.654
377 HG13 VAL 45 HG13 VAL 45 41.644 -2.883 2.350
378 HG21 VAL 45 HG21 VAL 45 40.420 -6.411 2.185
379 HG22 VAL 45 HG22 VAL 45 40.633 -4.950 1.221
380 HG23 VAL 45 HG23 VAL 45 39.455 -4.976 2.534
381 H ARG 46 HN ARG 46 42.495 -7.094 0.968
382 HA ARG 46 HA ARG 46 42.342 -9.397 2.593
383 HB2 ARG 46 HB2 ARG 46 43.006 -9.099 -0.337
384 HB3 ARG 46 HB1 ARG 46 42.776 -10.648 0.457
385 HG2 ARG 46 HG2 ARG 46 40.478 -9.960 1.038
386 HG3 ARG 46 HG1 ARG 46 40.729 -8.474 0.117
387 HD2 ARG 46 HD2 ARG 46 41.147 -9.768 -1.892
388 HD3 ARG 46 HD1 ARG 46 40.967 -11.268 -0.985
389 HE ARG 46 HE ARG 46 38.710 -9.429 -0.993
390 HH11 ARG 46 HH11 ARG 46 40.155 -12.359 -2.264
391 HH12 ARG 46 HH12 ARG 46 38.668 -12.971 -2.898
392 HH21 ARG 46 HH21 ARG 46 36.748 -10.238 -1.815
393 HH22 ARG 46 HH22 ARG 46 36.716 -11.758 -2.637
394 H LYS 47 HN LYS 47 44.974 -8.001 0.689
395 HA LYS 47 HA LYS 47 46.865 -9.991 1.323
396 HB2 LYS 47 HB2 LYS 47 46.952 -7.325 0.052
397 HB3 LYS 47 HB1 LYS 47 48.457 -7.887 0.766
398 HG2 LYS 47 HG2 LYS 47 48.346 -8.468 -1.585
399 HG3 LYS 47 HG1 LYS 47 48.345 -9.921 -0.586
400 HD2 LYS 47 HD2 LYS 47 45.818 -9.892 -0.795
401 HD3 LYS 47 HD1 LYS 47 46.031 -8.657 -2.037
402 HE2 LYS 47 HE2 LYS 47 47.197 -11.440 -2.083
403 HE3 LYS 47 HE1 LYS 47 45.816 -10.887 -3.025
404 HZ1 LYS 47 HZ1 LYS 47 48.555 -9.770 -3.238
405 HZ2 LYS 47 HZ2 LYS 47 47.231 -9.383 -4.218
406 HZ3 LYS 47 HZ3 LYS 47 47.911 -10.931 -4.280
407 H TYR 48 HN TYR 48 46.140 -6.857 2.854
408 HA TYR 48 HA TYR 48 48.252 -6.931 4.655
409 HB2 TYR 48 HB2 TYR 48 47.071 -4.885 4.262
410 HB3 TYR 48 HB1 TYR 48 45.548 -5.605 4.773
411 HD1 TYR 48 HD1 TYR 48 48.952 -5.583 6.262
412 HD2 TYR 48 HD2 TYR 48 44.849 -4.605 6.709
413 HE1 TYR 48 HE1 TYR 48 49.388 -4.874 8.542
414 HE2 TYR 48 HE2 TYR 48 45.261 -3.884 8.996
415 HH TYR 48 HH TYR 48 48.418 -3.414 10.239
416 H LYS 49 HN LYS 49 44.883 -8.026 4.951
417 HA LYS 49 HA LYS 49 45.092 -8.936 7.608
418 HB2 LYS 49 HB2 LYS 49 42.957 -8.503 6.422
419 HB3 LYS 49 HB1 LYS 49 43.252 -9.911 5.415
420 HG2 LYS 49 HG2 LYS 49 43.018 -11.382 7.277
421 HG3 LYS 49 HG1 LYS 49 42.978 -10.028 8.409
422 HD2 LYS 49 HD2 LYS 49 40.732 -10.900 8.025
423 HD3 LYS 49 HD1 LYS 49 40.875 -9.257 7.404
424 HE2 LYS 49 HE2 LYS 49 41.206 -10.162 5.138
425 HE3 LYS 49 HE1 LYS 49 41.024 -11.795 5.777
426 HZ1 LYS 49 HZ1 LYS 49 38.973 -10.985 4.793
427 HZ2 LYS 49 HZ2 LYS 49 38.949 -9.672 5.847
428 HZ3 LYS 49 HZ3 LYS 49 38.772 -11.240 6.451
429 H HIS 50 HN HIS 50 45.868 -10.393 4.538
430 HA HIS 50 HA HIS 50 46.235 -13.058 5.471
431 HB2 HIS 50 HB2 HIS 50 45.828 -12.460 3.094
432 HB3 HIS 50 HB1 HIS 50 47.406 -11.696 3.034
433 HD1 HIS 50 HD1 HIS 50 45.750 -15.051 3.103
434 HD2 HIS 50 HD2 HIS 50 49.568 -13.448 2.780
435 HE1 HIS 50 HE1 HIS 50 47.212 -16.949 2.362
436 H HIS 51 HN HIS 51 48.449 -10.356 4.827
437 HA HIS 51 HA HIS 51 50.777 -11.820 5.700
438 HB2 HIS 51 HB2 HIS 51 50.339 -8.904 5.029
439 HB3 HIS 51 HB1 HIS 51 51.885 -9.528 5.589
440 HD1 HIS 51 HD1 HIS 51 53.410 -9.739 3.624
441 HD2 HIS 51 HD2 HIS 51 49.504 -10.808 2.670
442 HE1 HIS 51 HE1 HIS 51 53.473 -10.453 1.226
443 H GLY 52 HN GLY 52 48.293 -10.120 7.272
444 HA2 GLY 52 HA2 GLY 52 49.631 -9.261 9.590
445 HA3 GLY 52 HA1 GLY 52 47.931 -9.720 9.504
446 H THR 53 HN THR 53 48.403 -12.363 8.571
447 HA THR 53 HA THR 53 49.318 -13.599 11.042
448 HB THR 53 HB THR 53 48.261 -15.671 10.027
449 HG1 THR 53 HG1 THR 53 48.280 -14.391 7.845
450 HG21 THR 53 HG21 THR 53 45.975 -14.945 10.535
451 HG22 THR 53 HG22 THR 53 46.486 -13.261 10.436
452 HG23 THR 53 HG23 THR 53 47.118 -14.300 11.711
453 H THR 54 HN THR 54 51.375 -14.151 11.064
454 HA THR 54 HA THR 54 53.469 -14.693 10.444
455 HB THR 54 HB THR 54 53.724 -16.742 9.010
456 HG1 THR 54 HG1 THR 54 51.226 -16.067 8.288
457 HG21 THR 54 HG21 THR 54 51.669 -16.910 11.218
458 HG22 THR 54 HG22 THR 54 53.420 -16.931 11.428
459 HG23 THR 54 HG23 THR 54 52.616 -18.260 10.593
460 H GLN 55 HN GLN 55 53.600 -12.549 9.457
461 HA GLN 55 HA GLN 55 53.474 -12.209 6.653
462 HB2 GLN 55 HB2 GLN 55 53.343 -10.330 8.246
463 HB3 GLN 55 HB1 GLN 55 55.017 -10.611 8.704
464 HG2 GLN 55 HG2 GLN 55 55.693 -10.136 6.378
465 HG3 GLN 55 HG1 GLN 55 54.015 -9.757 5.997
466 HE21 GLN 55 HE21 GLN 55 56.889 -8.730 7.638
467 HE22 GLN 55 HE22 GLN 55 56.381 -7.114 7.951
468 H HIS 56 HN HIS 56 54.684 -13.573 5.461
469 HA HIS 56 HA HIS 56 57.327 -14.352 6.105
470 HB2 HIS 56 HB2 HIS 56 57.448 -15.246 3.822
471 HB3 HIS 56 HB1 HIS 56 55.929 -15.690 4.584
472 HD1 HIS 56 HD1 HIS 56 57.322 -14.062 1.615
473 HD2 HIS 56 HD2 HIS 56 53.664 -14.160 3.581
474 HE1 HIS 56 HE1 HIS 56 55.651 -13.180 -0.039
475 H HIS 57 HN HIS 57 59.298 -13.653 5.225
476 HA HIS 57 HA HIS 57 59.233 -11.112 3.781
477 HB2 HIS 57 HB2 HIS 57 59.429 -10.681 6.259
478 HB3 HIS 57 HB1 HIS 57 60.950 -11.562 6.233
479 HD1 HIS 57 HD1 HIS 57 63.009 -10.301 5.466
480 HD2 HIS 57 HD2 HIS 57 59.489 -8.171 4.880
481 HE1 HIS 57 HE1 HIS 57 63.730 -7.980 4.859
Start of MODEL 2
1 H1 ALA 1 HT1 ALA 1 49.915 -4.616 -31.713
2 H2 ALA 1 HT2 ALA 1 49.775 -3.001 -32.198
3 H3 ALA 1 HT3 ALA 1 49.005 -3.531 -30.794
4 HA ALA 1 HA ALA 1 51.921 -3.442 -31.214
5 HB1 ALA 1 HB1 ALA 1 50.141 -1.666 -29.547
6 HB2 ALA 1 HB2 ALA 1 50.942 -1.207 -31.049
7 HB3 ALA 1 HB3 ALA 1 51.900 -1.590 -29.621
8 H SER 2 HN SER 2 53.085 -3.733 -29.144
9 HA SER 2 HA SER 2 51.825 -5.883 -27.641
10 HB2 SER 2 HB2 SER 2 54.183 -6.183 -26.732
11 HB3 SER 2 HB1 SER 2 53.986 -6.472 -28.460
12 HG SER 2 HG SER 2 55.322 -4.902 -28.837
13 H MET 3 HN MET 3 52.023 -5.938 -25.305
14 HA MET 3 HA MET 3 51.688 -3.255 -24.194
15 HB2 MET 3 HB2 MET 3 49.781 -4.657 -23.837
16 HB3 MET 3 HB1 MET 3 50.783 -5.961 -23.219
17 HG2 MET 3 HG2 MET 3 51.302 -4.705 -21.245
18 HG3 MET 3 HG1 MET 3 50.485 -3.284 -21.881
19 HE1 MET 3 HE1 MET 3 50.059 -6.948 -20.564
20 HE2 MET 3 HE2 MET 3 49.256 -7.036 -22.133
21 HE3 MET 3 HE3 MET 3 48.311 -7.169 -20.649
22 H GLY 4 HN GLY 4 53.240 -2.417 -23.036
23 HA2 GLY 4 HA2 GLY 4 55.321 -4.164 -21.950
24 HA3 GLY 4 HA1 GLY 4 55.438 -2.421 -22.162
25 H LYS 5 HN LYS 5 54.127 -4.984 -20.187
26 HA LYS 5 HA LYS 5 52.781 -3.318 -18.351
27 HB2 LYS 5 HB2 LYS 5 52.765 -5.285 -16.849
28 HB3 LYS 5 HB1 LYS 5 52.173 -5.636 -18.463
29 HG2 LYS 5 HG2 LYS 5 54.074 -6.874 -19.018
30 HG3 LYS 5 HG1 LYS 5 55.014 -6.196 -17.686
31 HD2 LYS 5 HD2 LYS 5 54.282 -8.539 -17.295
32 HD3 LYS 5 HD1 LYS 5 53.699 -7.409 -16.073
33 HE2 LYS 5 HE2 LYS 5 51.531 -7.310 -17.230
34 HE3 LYS 5 HE1 LYS 5 52.124 -8.468 -18.418
35 HZ1 LYS 5 HZ1 LYS 5 52.343 -10.111 -16.699
36 HZ2 LYS 5 HZ2 LYS 5 50.771 -9.496 -16.665
37 HZ3 LYS 5 HZ3 LYS 5 51.894 -9.000 -15.507
38 H SER 6 HN SER 6 53.389 -2.346 -16.560
39 HA SER 6 HA SER 6 55.886 -2.864 -15.273
40 HB2 SER 6 HB2 SER 6 56.565 -1.422 -17.198
41 HB3 SER 6 HB1 SER 6 55.466 -0.176 -16.611
42 HG SER 6 HG SER 6 57.248 -1.137 -14.730
43 H LYS 7 HN LYS 7 55.083 -2.947 -13.276
44 HA LYS 7 HA LYS 7 52.861 -1.341 -12.469
45 HB2 LYS 7 HB2 LYS 7 54.606 -3.351 -11.085
46 HB3 LYS 7 HB1 LYS 7 53.543 -2.322 -10.139
47 HG2 LYS 7 HG2 LYS 7 52.481 -4.454 -10.571
48 HG3 LYS 7 HG1 LYS 7 51.611 -3.169 -11.406
49 HD2 LYS 7 HD2 LYS 7 52.814 -3.773 -13.490
50 HD3 LYS 7 HD1 LYS 7 53.573 -5.112 -12.629
51 HE2 LYS 7 HE2 LYS 7 51.664 -5.905 -13.909
52 HE3 LYS 7 HE1 LYS 7 51.353 -6.066 -12.182
53 HZ1 LYS 7 HZ1 LYS 7 50.371 -3.825 -13.868
54 HZ2 LYS 7 HZ2 LYS 7 49.989 -4.107 -12.244
55 HZ3 LYS 7 HZ3 LYS 7 49.448 -5.174 -13.435
56 H GLU 8 HN GLU 8 52.843 0.547 -11.490
57 HA GLU 8 HA GLU 8 55.183 2.122 -11.362
58 HB2 GLU 8 HB2 GLU 8 52.899 3.019 -11.762
59 HB3 GLU 8 HB1 GLU 8 52.480 2.634 -10.101
60 HG2 GLU 8 HG2 GLU 8 53.005 5.012 -10.443
61 HG3 GLU 8 HG1 GLU 8 54.071 4.234 -9.273
62 H ILE 9 HN ILE 9 56.367 2.847 -9.614
63 HA ILE 9 HA ILE 9 56.669 1.024 -7.467
64 HB ILE 9 HB ILE 9 57.767 3.840 -7.684
65 HG12 ILE 9 HG12 ILE 9 58.423 2.469 -9.612
66 HG13 ILE 9 HG11 ILE 9 59.803 2.788 -8.571
67 HG21 ILE 9 HG21 ILE 9 59.493 3.053 -6.119
68 HG22 ILE 9 HG22 ILE 9 58.664 1.502 -5.994
69 HG23 ILE 9 HG23 ILE 9 57.879 2.971 -5.413
70 HD11 ILE 9 HD11 ILE 9 58.223 0.227 -8.691
71 HD12 ILE 9 HD12 ILE 9 59.587 0.539 -7.620
72 HD13 ILE 9 HD13 ILE 9 59.829 0.501 -9.366
73 H SER 10 HN SER 10 54.828 0.836 -6.330
74 HA SER 10 HA SER 10 53.667 3.224 -5.115
75 HB2 SER 10 HB2 SER 10 52.581 0.406 -5.189
76 HB3 SER 10 HB1 SER 10 51.712 1.873 -4.732
77 HG SER 10 HG SER 10 52.731 1.184 -7.296
78 H GLN 11 HN GLN 11 56.169 1.649 -4.331
79 HA GLN 11 HA GLN 11 55.773 0.199 -1.996
80 HB2 GLN 11 HB2 GLN 11 57.903 0.344 -3.284
81 HB3 GLN 11 HB1 GLN 11 58.153 1.950 -2.613
82 HG2 GLN 11 HG2 GLN 11 59.456 0.359 -1.380
83 HG3 GLN 11 HG1 GLN 11 58.159 0.970 -0.352
84 HE21 GLN 11 HE21 GLN 11 59.385 -1.751 -2.098
85 HE22 GLN 11 HE22 GLN 11 58.351 -2.939 -1.388
86 H ASP 12 HN ASP 12 56.596 3.656 -2.293
87 HA ASP 12 HA ASP 12 56.505 4.198 0.469
88 HB2 ASP 12 HB2 ASP 12 56.166 6.051 -1.893
89 HB3 ASP 12 HB1 ASP 12 56.279 6.601 -0.227
90 H LEU 13 HN LEU 13 54.093 4.562 -2.071
91 HA LEU 13 HA LEU 13 52.098 5.720 -0.467
92 HB2 LEU 13 HB2 LEU 13 52.050 5.776 -2.913
93 HB3 LEU 13 HB1 LEU 13 51.820 4.041 -2.959
94 HG LEU 13 HG LEU 13 49.635 4.347 -1.798
95 HD11 LEU 13 HD11 LEU 13 50.069 6.471 -0.707
96 HD12 LEU 13 HD12 LEU 13 48.645 6.587 -1.741
97 HD13 LEU 13 HD13 LEU 13 50.180 7.274 -2.274
98 HD21 LEU 13 HD21 LEU 13 49.955 5.846 -4.394
99 HD22 LEU 13 HD22 LEU 13 48.448 5.187 -3.758
100 HD23 LEU 13 HD23 LEU 13 49.758 4.101 -4.225
101 H ARG 14 HN ARG 14 52.865 2.356 -1.223
102 HA ARG 14 HA ARG 14 50.571 1.238 -0.041
103 HB2 ARG 14 HB2 ARG 14 51.923 -0.030 -1.613
104 HB3 ARG 14 HB1 ARG 14 53.282 -0.011 -0.493
105 HG2 ARG 14 HG2 ARG 14 52.050 -1.353 1.088
106 HG3 ARG 14 HG1 ARG 14 50.619 -1.298 0.061
107 HD2 ARG 14 HD2 ARG 14 51.812 -2.513 -1.682
108 HD3 ARG 14 HD1 ARG 14 53.265 -2.541 -0.679
109 HE ARG 14 HE ARG 14 51.688 -3.749 0.969
110 HH11 ARG 14 HH11 ARG 14 51.705 -4.157 -2.522
111 HH12 ARG 14 HH12 ARG 14 51.064 -5.760 -2.464
112 HH21 ARG 14 HH21 ARG 14 50.841 -5.851 1.049
113 HH22 ARG 14 HH22 ARG 14 50.560 -6.736 -0.412
114 H LYS 15 HN LYS 15 53.891 1.566 1.271
115 HA LYS 15 HA LYS 15 53.213 0.437 3.759
116 HB2 LYS 15 HB2 LYS 15 55.317 1.302 4.603
117 HB3 LYS 15 HB1 LYS 15 55.545 0.641 2.995
118 HG2 LYS 15 HG2 LYS 15 55.529 2.920 2.076
119 HG3 LYS 15 HG1 LYS 15 55.343 3.560 3.712
120 HD2 LYS 15 HD2 LYS 15 57.464 2.426 4.338
121 HD3 LYS 15 HD1 LYS 15 57.657 1.938 2.655
122 HE2 LYS 15 HE2 LYS 15 57.674 4.315 1.997
123 HE3 LYS 15 HE1 LYS 15 57.538 4.769 3.694
124 HZ1 LYS 15 HZ1 LYS 15 59.821 4.883 2.990
125 HZ2 LYS 15 HZ2 LYS 15 59.785 3.293 2.438
126 HZ3 LYS 15 HZ3 LYS 15 59.657 3.610 4.089
127 H LYS 16 HN LYS 16 52.916 3.683 2.526
128 HA LYS 16 HA LYS 16 52.354 4.878 5.050
129 HB2 LYS 16 HB2 LYS 16 53.159 6.222 3.161
130 HB3 LYS 16 HB1 LYS 16 51.696 5.847 2.261
131 HG2 LYS 16 HG2 LYS 16 50.382 6.965 4.050
132 HG3 LYS 16 HG1 LYS 16 51.903 7.459 4.793
133 HD2 LYS 16 HD2 LYS 16 52.493 8.723 2.817
134 HD3 LYS 16 HD1 LYS 16 51.041 8.155 1.988
135 HE2 LYS 16 HE2 LYS 16 49.681 9.238 3.776
136 HE3 LYS 16 HE1 LYS 16 51.169 9.913 4.435
137 HZ1 LYS 16 HZ1 LYS 16 50.101 10.414 1.716
138 HZ2 LYS 16 HZ2 LYS 16 51.516 11.078 2.348
139 HZ3 LYS 16 HZ3 LYS 16 50.017 11.491 3.014
140 H ILE 17 HN ILE 17 50.326 3.740 2.336
141 HA ILE 17 HA ILE 17 47.891 4.528 3.486
142 HB ILE 17 HB ILE 17 48.243 3.853 1.051
143 HG12 ILE 17 HG12 ILE 17 45.888 2.620 2.497
144 HG13 ILE 17 HG11 ILE 17 46.027 4.314 2.044
145 HG21 ILE 17 HG21 ILE 17 49.330 1.696 1.469
146 HG22 ILE 17 HG22 ILE 17 47.899 1.521 0.451
147 HG23 ILE 17 HG23 ILE 17 47.828 1.078 2.158
148 HD11 ILE 17 HD11 ILE 17 46.065 3.676 -0.314
149 HD12 ILE 17 HD12 ILE 17 44.607 3.099 0.493
150 HD13 ILE 17 HD13 ILE 17 45.925 1.979 0.145
151 H VAL 18 HN VAL 18 49.899 1.751 4.061
152 HA VAL 18 HA VAL 18 48.009 0.110 5.351
153 HB VAL 18 HB VAL 18 51.005 0.339 5.784
154 HG11 VAL 18 HG11 VAL 18 49.085 -1.748 6.815
155 HG12 VAL 18 HG12 VAL 18 50.000 -0.592 7.783
156 HG13 VAL 18 HG13 VAL 18 50.844 -1.857 6.890
157 HG21 VAL 18 HG21 VAL 18 50.365 -0.417 3.559
158 HG22 VAL 18 HG22 VAL 18 49.340 -1.667 4.263
159 HG23 VAL 18 HG23 VAL 18 51.089 -1.737 4.478
160 H ASP 19 HN ASP 19 50.214 2.600 6.615
161 HA ASP 19 HA ASP 19 49.378 2.421 9.311
162 HB2 ASP 19 HB2 ASP 19 51.463 3.552 8.644
163 HB3 ASP 19 HB1 ASP 19 50.526 4.799 7.828
164 H LEU 20 HN LEU 20 48.297 4.367 6.593
165 HA LEU 20 HA LEU 20 46.444 5.983 7.940
166 HB2 LEU 20 HB2 LEU 20 46.799 5.114 5.112
167 HB3 LEU 20 HB1 LEU 20 45.297 5.895 5.553
168 HG LEU 20 HG LEU 20 46.455 7.911 6.196
169 HD11 LEU 20 HD11 LEU 20 49.011 6.455 5.575
170 HD12 LEU 20 HD12 LEU 20 48.452 6.951 7.173
171 HD13 LEU 20 HD13 LEU 20 48.867 8.169 5.965
172 HD21 LEU 20 HD21 LEU 20 47.484 6.879 3.565
173 HD22 LEU 20 HD22 LEU 20 47.412 8.572 4.055
174 HD23 LEU 20 HD23 LEU 20 45.923 7.650 3.844
175 H HIS 21 HN HIS 21 46.184 2.721 6.697
176 HA HIS 21 HA HIS 21 43.376 2.415 6.980
177 HB2 HIS 21 HB2 HIS 21 45.693 0.561 6.712
178 HB3 HIS 21 HB1 HIS 21 44.179 -0.101 7.313
179 HD1 HIS 21 HD1 HIS 21 45.596 1.629 4.272
180 HD2 HIS 21 HD2 HIS 21 42.253 -0.547 5.420
181 HE1 HIS 21 HE1 HIS 21 44.316 1.190 2.153
182 H LYS 22 HN LYS 22 46.089 1.862 9.108
183 HA LYS 22 HA LYS 22 44.556 0.738 11.224
184 HB2 LYS 22 HB2 LYS 22 47.325 1.940 11.191
185 HB3 LYS 22 HB1 LYS 22 46.639 1.020 12.524
186 HG2 LYS 22 HG2 LYS 22 46.681 -0.983 11.331
187 HG3 LYS 22 HG1 LYS 22 46.823 -0.160 9.777
188 HD2 LYS 22 HD2 LYS 22 49.069 0.537 10.312
189 HD3 LYS 22 HD1 LYS 22 48.948 -0.187 11.921
190 HE2 LYS 22 HE2 LYS 22 48.770 -1.681 9.301
191 HE3 LYS 22 HE1 LYS 22 50.206 -1.593 10.317
192 HZ1 LYS 22 HZ1 LYS 22 48.945 -2.687 12.083
193 HZ2 LYS 22 HZ2 LYS 22 49.022 -3.638 10.692
194 HZ3 LYS 22 HZ3 LYS 22 47.601 -2.807 11.064
195 H SER 23 HN SER 23 45.109 3.908 10.126
196 HA SER 23 HA SER 23 44.509 5.161 12.677
197 HB2 SER 23 HB2 SER 23 44.898 6.431 9.958
198 HB3 SER 23 HB1 SER 23 44.881 7.262 11.514
199 HG SER 23 HG SER 23 46.770 5.295 10.680
200 H GLY 24 HN GLY 24 42.945 4.368 9.649
201 HA2 GLY 24 HA2 GLY 24 40.653 4.073 9.341
202 HA3 GLY 24 HA1 GLY 24 40.364 4.881 10.873
203 H SER 25 HN SER 25 40.875 7.280 10.845
204 HA SER 25 HA SER 25 39.199 8.510 8.963
205 HB2 SER 25 HB2 SER 25 39.684 9.371 11.263
206 HB3 SER 25 HB1 SER 25 41.275 9.872 10.694
207 HG SER 25 HG SER 25 40.406 11.526 9.715
208 H SER 26 HN SER 26 42.701 8.187 9.091
209 HA SER 26 HA SER 26 43.289 10.028 7.039
210 HB2 SER 26 HB2 SER 26 44.971 7.645 7.783
211 HB3 SER 26 HB1 SER 26 45.497 9.220 7.177
212 HG SER 26 HG SER 26 44.434 10.031 9.199
213 H LEU 27 HN LEU 27 42.013 6.850 6.957
214 HA LEU 27 HA LEU 27 42.915 6.057 4.377
215 HB2 LEU 27 HB2 LEU 27 41.912 4.592 6.218
216 HB3 LEU 27 HB1 LEU 27 40.353 5.232 5.761
217 HG LEU 27 HG LEU 27 42.132 3.652 3.888
218 HD11 LEU 27 HD11 LEU 27 40.623 1.779 4.334
219 HD12 LEU 27 HD12 LEU 27 39.799 2.740 5.562
220 HD13 LEU 27 HD13 LEU 27 41.487 2.282 5.786
221 HD21 LEU 27 HD21 LEU 27 39.201 4.375 3.732
222 HD22 LEU 27 HD22 LEU 27 40.085 3.381 2.574
223 HD23 LEU 27 HD23 LEU 27 40.489 5.089 2.762
224 H GLY 28 HN GLY 28 39.940 7.538 5.607
225 HA2 GLY 28 HA2 GLY 28 38.690 7.834 3.086
226 HA3 GLY 28 HA1 GLY 28 38.254 8.678 4.564
227 H ALA 29 HN ALA 29 40.911 9.823 4.896
228 HA ALA 29 HA ALA 29 40.543 12.279 3.664
229 HB1 ALA 29 HB1 ALA 29 42.802 12.819 4.380
230 HB2 ALA 29 HB2 ALA 29 43.148 11.109 4.638
231 HB3 ALA 29 HB3 ALA 29 41.954 11.928 5.643
232 H ILE 30 HN ILE 30 42.913 9.756 2.760
233 HA ILE 30 HA ILE 30 43.675 11.162 0.405
234 HB ILE 30 HB ILE 30 44.910 9.132 -0.235
235 HG12 ILE 30 HG12 ILE 30 43.839 7.914 2.320
236 HG13 ILE 30 HG11 ILE 30 43.228 7.519 0.718
237 HG21 ILE 30 HG21 ILE 30 45.970 10.739 1.218
238 HG22 ILE 30 HG22 ILE 30 46.443 9.109 1.701
239 HG23 ILE 30 HG23 ILE 30 45.236 9.990 2.635
240 HD11 ILE 30 HD11 ILE 30 46.038 7.077 1.698
241 HD12 ILE 30 HD12 ILE 30 45.432 6.682 0.089
242 HD13 ILE 30 HD13 ILE 30 44.790 5.847 1.504
243 H SER 31 HN SER 31 41.310 8.677 1.096
244 HA SER 31 HA SER 31 40.801 7.848 -1.536
245 HB2 SER 31 HB2 SER 31 38.904 7.948 0.821
246 HB3 SER 31 HB1 SER 31 38.640 7.035 -0.664
247 HG SER 31 HG SER 31 40.558 6.612 1.368
248 H LYS 32 HN LYS 32 39.620 10.553 0.330
249 HA LYS 32 HA LYS 32 37.733 11.383 -1.675
250 HB2 LYS 32 HB2 LYS 32 37.577 11.792 0.852
251 HB3 LYS 32 HB1 LYS 32 38.815 13.013 0.635
252 HG2 LYS 32 HG2 LYS 32 36.156 13.070 -0.783
253 HG3 LYS 32 HG1 LYS 32 36.458 13.864 0.759
254 HD2 LYS 32 HD2 LYS 32 38.200 15.227 -0.284
255 HD3 LYS 32 HD1 LYS 32 37.919 14.415 -1.824
256 HE2 LYS 32 HE2 LYS 32 35.550 15.226 -1.705
257 HE3 LYS 32 HE1 LYS 32 36.019 16.191 -0.308
258 HZ1 LYS 32 HZ1 LYS 32 36.101 17.515 -2.297
259 HZ2 LYS 32 HZ2 LYS 32 37.134 16.413 -3.047
260 HZ3 LYS 32 HZ3 LYS 32 37.674 17.302 -1.713
261 H ARG 33 HN ARG 33 40.992 12.230 -0.654
262 HA ARG 33 HA ARG 33 41.213 14.588 -2.208
263 HB2 ARG 33 HB2 ARG 33 42.596 13.898 -0.174
264 HB3 ARG 33 HB1 ARG 33 43.545 12.932 -1.294
265 HG2 ARG 33 HG2 ARG 33 43.939 15.029 -2.614
266 HG3 ARG 33 HG1 ARG 33 43.193 15.916 -1.284
267 HD2 ARG 33 HD2 ARG 33 45.496 16.025 -0.859
268 HD3 ARG 33 HD1 ARG 33 44.898 14.763 0.217
269 HE ARG 33 HE ARG 33 45.924 13.893 -2.357
270 HH11 ARG 33 HH11 ARG 33 46.543 14.328 1.070
271 HH12 ARG 33 HH12 ARG 33 47.935 13.301 1.076
272 HH21 ARG 33 HH21 ARG 33 47.765 12.533 -2.349
273 HH22 ARG 33 HH22 ARG 33 48.635 12.273 -0.878
274 H LEU 34 HN LEU 34 42.858 11.429 -2.695
275 HA LEU 34 HA LEU 34 43.430 12.298 -5.426
276 HB2 LEU 34 HB2 LEU 34 44.999 10.314 -5.455
277 HB3 LEU 34 HB1 LEU 34 45.412 11.630 -4.384
278 HG LEU 34 HG LEU 34 44.313 10.209 -2.531
279 HD11 LEU 34 HD11 LEU 34 44.788 8.062 -4.587
280 HD12 LEU 34 HD12 LEU 34 43.221 8.582 -3.967
281 HD13 LEU 34 HD13 LEU 34 44.383 7.803 -2.891
282 HD21 LEU 34 HD21 LEU 34 46.894 9.340 -3.824
283 HD22 LEU 34 HD22 LEU 34 46.401 8.981 -2.168
284 HD23 LEU 34 HD23 LEU 34 46.695 10.648 -2.657
285 H LYS 35 HN LYS 35 41.101 10.555 -3.931
286 HA LYS 35 HA LYS 35 39.494 9.107 -4.596
287 HB2 LYS 35 HB2 LYS 35 40.351 10.037 -7.342
288 HB3 LYS 35 HB1 LYS 35 38.912 9.084 -7.023
289 HG2 LYS 35 HG2 LYS 35 39.429 11.813 -5.865
290 HG3 LYS 35 HG1 LYS 35 38.486 11.507 -7.324
291 HD2 LYS 35 HD2 LYS 35 36.940 10.115 -6.005
292 HD3 LYS 35 HD1 LYS 35 37.877 10.473 -4.553
293 HE2 LYS 35 HE2 LYS 35 37.379 12.834 -4.785
294 HE3 LYS 35 HE1 LYS 35 36.507 12.526 -6.284
295 HZ1 LYS 35 HZ1 LYS 35 35.011 12.787 -4.404
296 HZ2 LYS 35 HZ2 LYS 35 35.736 11.487 -3.606
297 HZ3 LYS 35 HZ3 LYS 35 34.899 11.231 -5.049
298 H VAL 36 HN VAL 36 40.827 7.390 -3.744
299 HA VAL 36 HA VAL 36 42.171 5.739 -5.723
300 HB VAL 36 HB VAL 36 43.201 6.122 -3.457
301 HG11 VAL 36 HG11 VAL 36 41.168 6.075 -2.117
302 HG12 VAL 36 HG12 VAL 36 42.363 4.928 -1.518
303 HG13 VAL 36 HG13 VAL 36 40.982 4.355 -2.451
304 HG21 VAL 36 HG21 VAL 36 43.925 4.231 -4.775
305 HG22 VAL 36 HG22 VAL 36 42.593 3.254 -4.161
306 HG23 VAL 36 HG23 VAL 36 43.874 3.782 -3.070
307 HA PRO 37 HA PRO 37 38.571 3.191 -6.446
308 HB2 PRO 37 HB2 PRO 37 39.938 0.867 -7.097
309 HB3 PRO 37 HB1 PRO 37 39.598 2.178 -8.230
310 HG2 PRO 37 HG2 PRO 37 42.093 1.606 -6.684
311 HG3 PRO 37 HG1 PRO 37 41.914 2.155 -8.361
312 HD2 PRO 37 HD2 PRO 37 42.599 3.846 -6.414
313 HD3 PRO 37 HD1 PRO 37 41.516 4.351 -7.728
314 H ARG 38 HN ARG 38 37.735 2.992 -4.371
315 HA ARG 38 HA ARG 38 39.028 1.590 -2.300
316 HB2 ARG 38 HB2 ARG 38 37.338 3.394 -1.978
317 HB3 ARG 38 HB1 ARG 38 36.091 2.252 -2.458
318 HG2 ARG 38 HG2 ARG 38 36.459 0.905 -0.552
319 HG3 ARG 38 HG1 ARG 38 37.951 1.758 -0.152
320 HD2 ARG 38 HD2 ARG 38 36.630 3.807 0.218
321 HD3 ARG 38 HD1 ARG 38 35.155 2.885 -0.068
322 HE ARG 38 HE ARG 38 36.025 1.473 1.882
323 HH11 ARG 38 HH11 ARG 38 36.461 4.945 1.569
324 HH12 ARG 38 HH12 ARG 38 36.602 5.211 3.275
325 HH21 ARG 38 HH21 ARG 38 36.192 1.823 4.143
326 HH22 ARG 38 HH22 ARG 38 36.441 3.421 4.751
327 H SER 39 HN SER 39 36.877 0.509 -4.821
328 HA SER 39 HA SER 39 36.096 -1.921 -3.611
329 HB2 SER 39 HB2 SER 39 36.465 -1.380 -6.569
330 HB3 SER 39 HB1 SER 39 35.465 -2.635 -5.841
331 HG SER 39 HG SER 39 33.992 -1.193 -5.285
332 H SER 40 HN SER 40 38.927 -0.905 -5.386
333 HA SER 40 HA SER 40 40.069 -3.525 -5.557
334 HB2 SER 40 HB2 SER 40 40.594 -1.667 -7.171
335 HB3 SER 40 HB1 SER 40 41.438 -0.834 -5.867
336 HG SER 40 HG SER 40 42.073 -3.456 -6.750
337 H VAL 41 HN VAL 41 40.340 -0.713 -3.462
338 HA VAL 41 HA VAL 41 42.494 -1.565 -1.890
339 HB VAL 41 HB VAL 41 40.165 0.205 -1.103
340 HG11 VAL 41 HG11 VAL 41 42.857 -0.142 0.213
341 HG12 VAL 41 HG12 VAL 41 41.305 -0.664 0.867
342 HG13 VAL 41 HG13 VAL 41 41.641 1.054 0.659
343 HG21 VAL 41 HG21 VAL 41 41.710 2.050 -1.582
344 HG22 VAL 41 HG22 VAL 41 41.405 1.065 -3.014
345 HG23 VAL 41 HG23 VAL 41 42.921 0.889 -2.127
346 H GLN 42 HN GLN 42 38.986 -1.938 -1.354
347 HA GLN 42 HA GLN 42 39.228 -3.263 1.112
348 HB2 GLN 42 HB2 GLN 42 36.897 -3.910 0.840
349 HB3 GLN 42 HB1 GLN 42 37.136 -2.229 0.389
350 HG2 GLN 42 HG2 GLN 42 37.121 -2.870 -1.972
351 HG3 GLN 42 HG1 GLN 42 36.863 -4.550 -1.507
352 HE21 GLN 42 HE21 GLN 42 34.925 -4.667 -2.592
353 HE22 GLN 42 HE22 GLN 42 33.492 -3.882 -2.031
354 H THR 43 HN THR 43 39.494 -4.492 -2.148
355 HA THR 43 HA THR 43 39.166 -7.202 -1.249
356 HB THR 43 HB THR 43 38.507 -6.348 -3.588
357 HG1 THR 43 HG1 THR 43 40.109 -8.639 -3.861
358 HG21 THR 43 HG21 THR 43 40.638 -5.266 -4.163
359 HG22 THR 43 HG22 THR 43 40.227 -6.529 -5.322
360 HG23 THR 43 HG23 THR 43 41.451 -6.829 -4.089
361 H ILE 44 HN ILE 44 41.870 -5.038 -1.953
362 HA ILE 44 HA ILE 44 43.781 -7.183 -1.774
363 HB ILE 44 HB ILE 44 45.532 -5.472 -1.876
364 HG12 ILE 44 HG12 ILE 44 43.307 -3.433 -2.020
365 HG13 ILE 44 HG11 ILE 44 44.260 -3.739 -0.573
366 HG21 ILE 44 HG21 ILE 44 44.603 -6.312 -3.949
367 HG22 ILE 44 HG22 ILE 44 45.032 -4.609 -4.117
368 HG23 ILE 44 HG23 ILE 44 43.345 -5.076 -3.911
369 HD11 ILE 44 HD11 ILE 44 46.275 -3.050 -1.749
370 HD12 ILE 44 HD12 ILE 44 45.051 -1.780 -1.775
371 HD13 ILE 44 HD13 ILE 44 45.331 -2.765 -3.212
372 H VAL 45 HN VAL 45 42.403 -4.825 0.431
373 HA VAL 45 HA VAL 45 44.357 -5.175 2.442
374 HB VAL 45 HB VAL 45 42.750 -4.202 4.030
375 HG11 VAL 45 HG11 VAL 45 42.544 -2.022 2.948
376 HG12 VAL 45 HG12 VAL 45 42.916 -2.768 1.394
377 HG13 VAL 45 HG13 VAL 45 44.126 -2.751 2.678
378 HG21 VAL 45 HG21 VAL 45 40.561 -3.407 3.220
379 HG22 VAL 45 HG22 VAL 45 40.683 -5.167 3.225
380 HG23 VAL 45 HG23 VAL 45 40.830 -4.277 1.709
381 H ARG 46 HN ARG 46 41.393 -6.907 1.684
382 HA ARG 46 HA ARG 46 41.316 -8.495 4.014
383 HB2 ARG 46 HB2 ARG 46 40.394 -9.151 1.208
384 HB3 ARG 46 HB1 ARG 46 40.000 -10.098 2.635
385 HG2 ARG 46 HG2 ARG 46 38.804 -8.213 3.583
386 HG3 ARG 46 HG1 ARG 46 39.237 -7.222 2.188
387 HD2 ARG 46 HD2 ARG 46 36.988 -8.017 1.904
388 HD3 ARG 46 HD1 ARG 46 38.030 -8.831 0.739
389 HE ARG 46 HE ARG 46 37.757 -10.349 3.126
390 HH11 ARG 46 HH11 ARG 46 36.101 -9.521 0.142
391 HH12 ARG 46 HH12 ARG 46 35.125 -10.950 0.134
392 HH21 ARG 46 HH21 ARG 46 36.471 -12.255 3.099
393 HH22 ARG 46 HH22 ARG 46 35.338 -12.507 1.814
394 H LYS 47 HN LYS 47 42.995 -8.814 0.962
395 HA LYS 47 HA LYS 47 44.124 -11.372 1.425
396 HB2 LYS 47 HB2 LYS 47 43.906 -10.116 -0.791
397 HB3 LYS 47 HB1 LYS 47 45.294 -9.170 -0.281
398 HG2 LYS 47 HG2 LYS 47 46.086 -10.868 -1.724
399 HG3 LYS 47 HG1 LYS 47 46.567 -11.319 -0.086
400 HD2 LYS 47 HD2 LYS 47 44.700 -12.865 0.061
401 HD3 LYS 47 HD1 LYS 47 44.141 -12.374 -1.538
402 HE2 LYS 47 HE2 LYS 47 45.329 -14.467 -1.699
403 HE3 LYS 47 HE1 LYS 47 46.256 -13.198 -2.496
404 HZ1 LYS 47 HZ1 LYS 47 47.645 -14.635 -1.135
405 HZ2 LYS 47 HZ2 LYS 47 46.759 -14.226 0.242
406 HZ3 LYS 47 HZ3 LYS 47 47.673 -13.051 -0.553
407 H TYR 48 HN TYR 48 45.158 -8.056 2.010
408 HA TYR 48 HA TYR 48 47.752 -8.672 2.920
409 HB2 TYR 48 HB2 TYR 48 47.776 -6.485 2.361
410 HB3 TYR 48 HB1 TYR 48 46.052 -6.301 2.634
411 HD1 TYR 48 HD1 TYR 48 49.355 -6.327 4.324
412 HD2 TYR 48 HD2 TYR 48 45.247 -5.273 4.578
413 HE1 TYR 48 HE1 TYR 48 49.816 -5.044 6.368
414 HE2 TYR 48 HE2 TYR 48 45.686 -3.996 6.612
415 HH TYR 48 HH TYR 48 47.357 -3.935 8.421
416 H LYS 49 HN LYS 49 44.628 -8.405 4.541
417 HA LYS 49 HA LYS 49 45.542 -8.331 7.194
418 HB2 LYS 49 HB2 LYS 49 43.033 -9.589 6.066
419 HB3 LYS 49 HB1 LYS 49 43.339 -9.376 7.782
420 HG2 LYS 49 HG2 LYS 49 43.118 -7.161 5.751
421 HG3 LYS 49 HG1 LYS 49 41.865 -7.647 6.892
422 HD2 LYS 49 HD2 LYS 49 43.347 -7.061 8.758
423 HD3 LYS 49 HD1 LYS 49 44.594 -6.571 7.611
424 HE2 LYS 49 HE2 LYS 49 43.389 -4.629 8.449
425 HE3 LYS 49 HE1 LYS 49 43.098 -4.845 6.724
426 HZ1 LYS 49 HZ1 LYS 49 41.072 -4.306 7.968
427 HZ2 LYS 49 HZ2 LYS 49 41.250 -5.719 8.879
428 HZ3 LYS 49 HZ3 LYS 49 40.962 -5.816 7.219
429 H HIS 50 HN HIS 50 45.126 -10.988 4.968
430 HA HIS 50 HA HIS 50 45.678 -13.033 6.890
431 HB2 HIS 50 HB2 HIS 50 45.555 -12.986 3.883
432 HB3 HIS 50 HB1 HIS 50 46.104 -14.413 4.749
433 HD1 HIS 50 HD1 HIS 50 44.326 -16.030 5.276
434 HD2 HIS 50 HD2 HIS 50 42.819 -12.187 4.818
435 HE1 HIS 50 HE1 HIS 50 41.833 -16.263 5.480
436 H HIS 51 HN HIS 51 47.555 -11.413 4.355
437 HA HIS 51 HA HIS 51 49.930 -12.880 4.842
438 HB2 HIS 51 HB2 HIS 51 49.445 -11.704 2.701
439 HB3 HIS 51 HB1 HIS 51 49.679 -10.167 3.527
440 HD1 HIS 51 HD1 HIS 51 51.601 -13.223 2.397
441 HD2 HIS 51 HD2 HIS 51 52.323 -9.379 3.820
442 HE1 HIS 51 HE1 HIS 51 54.063 -12.854 2.110
443 H GLY 52 HN GLY 52 48.561 -10.067 6.340
444 HA2 GLY 52 HA2 GLY 52 50.939 -9.084 7.545
445 HA3 GLY 52 HA1 GLY 52 49.298 -8.768 8.095
446 H THR 53 HN THR 53 48.796 -11.688 8.312
447 HA THR 53 HA THR 53 49.883 -12.024 10.980
448 HB THR 53 HB THR 53 47.955 -13.829 9.500
449 HG1 THR 53 HG1 THR 53 47.089 -11.937 11.387
450 HG21 THR 53 HG21 THR 53 48.968 -14.798 11.516
451 HG22 THR 53 HG22 THR 53 47.255 -14.468 11.771
452 HG23 THR 53 HG23 THR 53 48.471 -13.387 12.449
453 H THR 54 HN THR 54 50.208 -13.329 7.768
454 HA THR 54 HA THR 54 52.003 -15.432 8.768
455 HB THR 54 HB THR 54 51.568 -16.461 6.460
456 HG1 THR 54 HG1 THR 54 49.232 -14.837 6.544
457 HG21 THR 54 HG21 THR 54 49.271 -16.212 8.412
458 HG22 THR 54 HG22 THR 54 50.599 -17.368 8.519
459 HG23 THR 54 HG23 THR 54 49.446 -17.470 7.188
460 H GLN 55 HN GLN 55 52.775 -12.642 8.269
461 HA GLN 55 HA GLN 55 54.152 -12.517 5.774
462 HB2 GLN 55 HB2 GLN 55 55.151 -10.457 6.608
463 HB3 GLN 55 HB1 GLN 55 53.428 -10.475 6.942
464 HG2 GLN 55 HG2 GLN 55 53.906 -11.123 9.262
465 HG3 GLN 55 HG1 GLN 55 55.632 -11.046 8.910
466 HE21 GLN 55 HE21 GLN 55 56.606 -9.022 8.574
467 HE22 GLN 55 HE22 GLN 55 55.825 -7.565 9.067
468 H HIS 56 HN HIS 56 56.498 -12.273 5.570
469 HA HIS 56 HA HIS 56 57.835 -14.322 7.181
470 HB2 HIS 56 HB2 HIS 56 58.612 -13.079 4.530
471 HB3 HIS 56 HB1 HIS 56 59.544 -14.316 5.365
472 HD1 HIS 56 HD1 HIS 56 58.599 -16.743 5.316
473 HD2 HIS 56 HD2 HIS 56 56.313 -13.979 3.213
474 HE1 HIS 56 HE1 HIS 56 57.001 -18.100 3.941
475 H HIS 57 HN HIS 57 57.459 -12.089 8.568
476 HA HIS 57 HA HIS 57 58.425 -10.536 9.862
477 HB2 HIS 57 HB2 HIS 57 60.961 -11.876 8.919
478 HB3 HIS 57 HB1 HIS 57 60.941 -10.580 10.110
479 HD1 HIS 57 HD1 HIS 57 61.239 -14.036 10.059
480 HD2 HIS 57 HD2 HIS 57 58.848 -11.449 12.256
481 HE1 HIS 57 HE1 HIS 57 60.523 -15.340 12.073
Start of MODEL 3
1 H1 ALA 1 HT1 ALA 1 56.083 21.393 -5.828
2 H2 ALA 1 HT2 ALA 1 57.079 22.737 -6.039
3 H3 ALA 1 HT3 ALA 1 57.751 21.190 -6.005
4 HA ALA 1 HA ALA 1 55.891 22.230 -8.054
5 HB1 ALA 1 HB1 ALA 1 57.797 22.194 -9.562
6 HB2 ALA 1 HB2 ALA 1 58.842 21.637 -8.255
7 HB3 ALA 1 HB3 ALA 1 58.121 23.244 -8.183
8 H SER 2 HN SER 2 56.726 19.528 -6.325
9 HA SER 2 HA SER 2 56.144 17.783 -8.616
10 HB2 SER 2 HB2 SER 2 58.018 17.165 -6.321
11 HB3 SER 2 HB1 SER 2 57.656 16.106 -7.685
12 HG SER 2 HG SER 2 58.468 17.946 -9.010
13 H MET 3 HN MET 3 54.358 18.946 -6.520
14 HA MET 3 HA MET 3 53.734 16.830 -4.707
15 HB2 MET 3 HB2 MET 3 52.303 19.369 -5.430
16 HB3 MET 3 HB1 MET 3 51.598 18.184 -4.343
17 HG2 MET 3 HG2 MET 3 53.585 18.405 -2.887
18 HG3 MET 3 HG1 MET 3 54.176 19.681 -3.949
19 HE1 MET 3 HE1 MET 3 50.261 19.997 -1.516
20 HE2 MET 3 HE2 MET 3 51.274 18.554 -1.574
21 HE3 MET 3 HE3 MET 3 50.382 19.063 -3.006
22 H GLY 4 HN GLY 4 52.891 14.990 -5.274
23 HA2 GLY 4 HA2 GLY 4 51.548 13.410 -6.236
24 HA3 GLY 4 HA1 GLY 4 50.338 14.678 -6.304
25 H LYS 5 HN LYS 5 53.388 14.019 -8.055
26 HA LYS 5 HA LYS 5 52.252 14.906 -10.534
27 HB2 LYS 5 HB2 LYS 5 54.809 13.390 -9.976
28 HB3 LYS 5 HB1 LYS 5 54.361 14.065 -11.533
29 HG2 LYS 5 HG2 LYS 5 54.447 16.303 -10.629
30 HG3 LYS 5 HG1 LYS 5 54.789 15.663 -9.020
31 HD2 LYS 5 HD2 LYS 5 56.839 16.436 -10.074
32 HD3 LYS 5 HD1 LYS 5 56.879 14.687 -9.869
33 HE2 LYS 5 HE2 LYS 5 56.290 14.374 -12.206
34 HE3 LYS 5 HE1 LYS 5 56.149 16.116 -12.425
35 HZ1 LYS 5 HZ1 LYS 5 58.494 16.344 -11.975
36 HZ2 LYS 5 HZ2 LYS 5 58.263 15.240 -13.231
37 HZ3 LYS 5 HZ3 LYS 5 58.645 14.685 -11.683
38 H SER 6 HN SER 6 53.023 11.849 -9.047
39 HA SER 6 HA SER 6 50.951 10.438 -10.329
40 HB2 SER 6 HB2 SER 6 52.665 10.587 -12.203
41 HB3 SER 6 HB1 SER 6 53.772 9.682 -11.174
42 HG SER 6 HG SER 6 52.142 8.636 -12.821
43 H LYS 7 HN LYS 7 51.934 7.872 -9.986
44 HA LYS 7 HA LYS 7 52.111 7.718 -7.135
45 HB2 LYS 7 HB2 LYS 7 52.383 5.232 -7.567
46 HB3 LYS 7 HB1 LYS 7 50.904 5.961 -8.166
47 HG2 LYS 7 HG2 LYS 7 51.981 6.087 -10.425
48 HG3 LYS 7 HG1 LYS 7 53.323 5.151 -9.764
49 HD2 LYS 7 HD2 LYS 7 51.766 3.681 -10.910
50 HD3 LYS 7 HD1 LYS 7 51.742 3.350 -9.176
51 HE2 LYS 7 HE2 LYS 7 49.701 4.649 -8.932
52 HE3 LYS 7 HE1 LYS 7 49.747 5.079 -10.640
53 HZ1 LYS 7 HZ1 LYS 7 49.450 2.333 -9.563
54 HZ2 LYS 7 HZ2 LYS 7 49.442 2.759 -11.199
55 HZ3 LYS 7 HZ3 LYS 7 48.198 3.278 -10.185
56 H GLU 8 HN GLU 8 53.885 8.462 -6.248
57 HA GLU 8 HA GLU 8 56.386 8.595 -7.467
58 HB2 GLU 8 HB2 GLU 8 55.796 8.717 -4.510
59 HB3 GLU 8 HB1 GLU 8 57.230 9.341 -5.317
60 HG2 GLU 8 HG2 GLU 8 55.759 10.882 -6.596
61 HG3 GLU 8 HG1 GLU 8 54.406 10.331 -5.615
62 H ILE 9 HN ILE 9 55.658 6.608 -4.573
63 HA ILE 9 HA ILE 9 57.458 4.591 -5.727
64 HB ILE 9 HB ILE 9 57.304 5.260 -2.772
65 HG12 ILE 9 HG12 ILE 9 59.848 5.767 -3.280
66 HG13 ILE 9 HG11 ILE 9 59.239 6.081 -4.900
67 HG21 ILE 9 HG21 ILE 9 59.129 3.688 -2.500
68 HG22 ILE 9 HG22 ILE 9 59.127 3.360 -4.231
69 HG23 ILE 9 HG23 ILE 9 57.741 2.896 -3.246
70 HD11 ILE 9 HD11 ILE 9 57.710 7.756 -3.984
71 HD12 ILE 9 HD12 ILE 9 59.395 8.128 -3.622
72 HD13 ILE 9 HD13 ILE 9 58.353 7.449 -2.371
73 H SER 10 HN SER 10 56.485 2.713 -6.020
74 HA SER 10 HA SER 10 53.834 2.219 -5.268
75 HB2 SER 10 HB2 SER 10 55.925 0.171 -6.042
76 HB3 SER 10 HB1 SER 10 54.174 -0.012 -6.158
77 HG SER 10 HG SER 10 55.904 1.141 -7.886
78 H GLN 11 HN GLN 11 56.902 1.123 -3.862
79 HA GLN 11 HA GLN 11 55.818 -0.574 -1.889
80 HB2 GLN 11 HB2 GLN 11 58.212 -0.541 -2.544
81 HB3 GLN 11 HB1 GLN 11 58.383 1.023 -1.764
82 HG2 GLN 11 HG2 GLN 11 57.745 -0.028 0.384
83 HG3 GLN 11 HG1 GLN 11 57.716 -1.591 -0.430
84 HE21 GLN 11 HE21 GLN 11 59.695 0.977 0.783
85 HE22 GLN 11 HE22 GLN 11 61.207 0.142 0.667
86 H ASP 12 HN ASP 12 56.567 2.856 -1.902
87 HA ASP 12 HA ASP 12 56.050 3.403 0.807
88 HB2 ASP 12 HB2 ASP 12 57.239 4.972 -0.669
89 HB3 ASP 12 HB1 ASP 12 55.769 5.199 -1.609
90 H LEU 13 HN LEU 13 54.026 3.733 -2.084
91 HA LEU 13 HA LEU 13 51.682 4.566 -0.806
92 HB2 LEU 13 HB2 LEU 13 52.226 4.612 -3.284
93 HB3 LEU 13 HB1 LEU 13 51.846 2.908 -3.330
94 HG LEU 13 HG LEU 13 50.047 4.477 -4.167
95 HD11 LEU 13 HD11 LEU 13 49.522 2.182 -3.587
96 HD12 LEU 13 HD12 LEU 13 48.201 3.259 -3.133
97 HD13 LEU 13 HD13 LEU 13 49.299 2.643 -1.898
98 HD21 LEU 13 HD21 LEU 13 50.305 6.213 -2.462
99 HD22 LEU 13 HD22 LEU 13 49.725 5.089 -1.231
100 HD23 LEU 13 HD23 LEU 13 48.651 5.607 -2.528
101 H ARG 14 HN ARG 14 52.832 1.309 -1.620
102 HA ARG 14 HA ARG 14 50.582 -0.141 -0.818
103 HB2 ARG 14 HB2 ARG 14 53.497 -0.837 -0.976
104 HB3 ARG 14 HB1 ARG 14 52.325 -1.997 -0.371
105 HG2 ARG 14 HG2 ARG 14 52.202 -0.688 -3.081
106 HG3 ARG 14 HG1 ARG 14 52.859 -2.295 -2.761
107 HD2 ARG 14 HD2 ARG 14 50.634 -2.907 -1.782
108 HD3 ARG 14 HD1 ARG 14 50.024 -1.359 -2.360
109 HE ARG 14 HE ARG 14 50.415 -2.117 -4.613
110 HH11 ARG 14 HH11 ARG 14 50.690 -4.600 -2.139
111 HH12 ARG 14 HH12 ARG 14 50.283 -5.893 -3.215
112 HH21 ARG 14 HH21 ARG 14 49.876 -3.855 -6.043
113 HH22 ARG 14 HH22 ARG 14 49.821 -5.472 -5.425
114 H LYS 15 HN LYS 15 53.459 0.730 1.067
115 HA LYS 15 HA LYS 15 52.515 -0.490 3.459
116 HB2 LYS 15 HB2 LYS 15 54.899 -0.052 3.021
117 HB3 LYS 15 HB1 LYS 15 54.583 1.676 3.075
118 HG2 LYS 15 HG2 LYS 15 53.808 1.372 5.434
119 HG3 LYS 15 HG1 LYS 15 54.383 -0.293 5.337
120 HD2 LYS 15 HD2 LYS 15 56.068 1.113 6.380
121 HD3 LYS 15 HD1 LYS 15 56.643 0.540 4.813
122 HE2 LYS 15 HE2 LYS 15 56.105 2.668 3.795
123 HE3 LYS 15 HE1 LYS 15 55.386 3.241 5.296
124 HZ1 LYS 15 HZ1 LYS 15 58.237 2.513 4.942
125 HZ2 LYS 15 HZ2 LYS 15 57.534 3.160 6.339
126 HZ3 LYS 15 HZ3 LYS 15 57.626 4.089 4.929
127 H LYS 16 HN LYS 16 52.389 2.745 2.119
128 HA LYS 16 HA LYS 16 51.487 4.123 4.381
129 HB2 LYS 16 HB2 LYS 16 52.469 5.151 2.370
130 HB3 LYS 16 HB1 LYS 16 51.014 4.759 1.478
131 HG2 LYS 16 HG2 LYS 16 49.732 6.329 2.641
132 HG3 LYS 16 HG1 LYS 16 50.928 6.474 3.932
133 HD2 LYS 16 HD2 LYS 16 51.478 7.263 1.077
134 HD3 LYS 16 HD1 LYS 16 50.865 8.391 2.290
135 HE2 LYS 16 HE2 LYS 16 52.817 8.225 3.589
136 HE3 LYS 16 HE1 LYS 16 53.359 6.772 2.758
137 HZ1 LYS 16 HZ1 LYS 16 53.117 9.394 1.407
138 HZ2 LYS 16 HZ2 LYS 16 53.924 8.000 0.861
139 HZ3 LYS 16 HZ3 LYS 16 54.531 8.874 2.169
140 H ILE 17 HN ILE 17 49.653 2.664 1.692
141 HA ILE 17 HA ILE 17 47.141 3.528 2.602
142 HB ILE 17 HB ILE 17 47.521 2.614 0.310
143 HG12 ILE 17 HG12 ILE 17 45.400 1.294 0.166
144 HG13 ILE 17 HG11 ILE 17 45.355 1.257 1.924
145 HG21 ILE 17 HG21 ILE 17 47.516 0.193 -0.058
146 HG22 ILE 17 HG22 ILE 17 47.594 -0.063 1.686
147 HG23 ILE 17 HG23 ILE 17 48.934 0.722 0.850
148 HD11 ILE 17 HD11 ILE 17 43.883 2.966 1.004
149 HD12 ILE 17 HD12 ILE 17 45.264 3.737 0.223
150 HD13 ILE 17 HD13 ILE 17 45.166 3.676 1.982
151 H VAL 18 HN VAL 18 49.174 0.876 3.568
152 HA VAL 18 HA VAL 18 47.191 -0.569 5.002
153 HB VAL 18 HB VAL 18 50.207 -0.609 5.271
154 HG11 VAL 18 HG11 VAL 18 49.908 -2.730 6.462
155 HG12 VAL 18 HG12 VAL 18 48.159 -2.516 6.402
156 HG13 VAL 18 HG13 VAL 18 49.152 -1.393 7.330
157 HG21 VAL 18 HG21 VAL 18 50.047 -2.701 4.004
158 HG22 VAL 18 HG22 VAL 18 49.409 -1.336 3.087
159 HG23 VAL 18 HG23 VAL 18 48.304 -2.475 3.858
160 H ASP 19 HN ASP 19 49.802 1.643 6.098
161 HA ASP 19 HA ASP 19 48.982 1.502 8.800
162 HB2 ASP 19 HB2 ASP 19 50.510 3.298 9.283
163 HB3 ASP 19 HB1 ASP 19 51.268 2.201 8.144
164 H LEU 20 HN LEU 20 48.018 3.597 6.175
165 HA LEU 20 HA LEU 20 46.607 5.448 7.789
166 HB2 LEU 20 HB2 LEU 20 46.235 4.710 4.889
167 HB3 LEU 20 HB1 LEU 20 45.412 6.041 5.679
168 HG LEU 20 HG LEU 20 48.393 5.793 5.268
169 HD11 LEU 20 HD11 LEU 20 46.376 7.650 4.030
170 HD12 LEU 20 HD12 LEU 20 47.169 6.295 3.225
171 HD13 LEU 20 HD13 LEU 20 48.119 7.681 3.761
172 HD21 LEU 20 HD21 LEU 20 47.939 6.937 7.351
173 HD22 LEU 20 HD22 LEU 20 46.765 7.982 6.552
174 HD23 LEU 20 HD23 LEU 20 48.475 8.100 6.138
175 H HIS 21 HN HIS 21 45.924 2.232 6.849
176 HA HIS 21 HA HIS 21 43.079 2.407 7.231
177 HB2 HIS 21 HB2 HIS 21 45.007 0.213 6.690
178 HB3 HIS 21 HB1 HIS 21 43.524 -0.233 7.529
179 HD1 HIS 21 HD1 HIS 21 44.627 1.474 4.324
180 HD2 HIS 21 HD2 HIS 21 41.376 -0.575 5.898
181 HE1 HIS 21 HE1 HIS 21 43.000 1.232 2.426
182 H LYS 22 HN LYS 22 45.833 2.077 9.240
183 HA LYS 22 HA LYS 22 44.258 1.230 11.533
184 HB2 LYS 22 HB2 LYS 22 47.164 1.989 11.223
185 HB3 LYS 22 HB1 LYS 22 46.434 1.720 12.795
186 HG2 LYS 22 HG2 LYS 22 47.520 -0.288 12.238
187 HG3 LYS 22 HG1 LYS 22 45.806 -0.587 11.964
188 HD2 LYS 22 HD2 LYS 22 46.083 -0.315 9.593
189 HD3 LYS 22 HD1 LYS 22 47.760 0.189 9.807
190 HE2 LYS 22 HE2 LYS 22 46.621 -2.525 10.465
191 HE3 LYS 22 HE1 LYS 22 47.626 -2.131 9.073
192 HZ1 LYS 22 HZ1 LYS 22 48.419 -2.093 11.930
193 HZ2 LYS 22 HZ2 LYS 22 49.373 -1.443 10.703
194 HZ3 LYS 22 HZ3 LYS 22 49.019 -3.094 10.712
195 H SER 23 HN SER 23 45.454 4.116 10.062
196 HA SER 23 HA SER 23 45.188 5.887 12.230
197 HB2 SER 23 HB2 SER 23 44.874 6.527 9.294
198 HB3 SER 23 HB1 SER 23 45.362 7.628 10.582
199 HG SER 23 HG SER 23 47.313 7.028 10.153
200 H GLY 24 HN GLY 24 42.978 5.140 9.525
201 HA2 GLY 24 HA2 GLY 24 40.643 4.881 9.773
202 HA3 GLY 24 HA1 GLY 24 40.733 5.743 11.298
203 H SER 25 HN SER 25 41.160 8.100 11.164
204 HA SER 25 HA SER 25 39.279 9.338 9.501
205 HB2 SER 25 HB2 SER 25 41.595 10.700 10.886
206 HB3 SER 25 HB1 SER 25 40.067 11.430 10.401
207 HG SER 25 HG SER 25 40.655 10.198 12.679
208 H SER 26 HN SER 26 42.782 9.056 9.172
209 HA SER 26 HA SER 26 43.063 10.806 6.987
210 HB2 SER 26 HB2 SER 26 44.943 10.038 8.427
211 HB3 SER 26 HB1 SER 26 44.821 8.444 7.683
212 HG SER 26 HG SER 26 45.131 9.643 5.628
213 H LEU 27 HN LEU 27 41.834 7.593 7.176
214 HA LEU 27 HA LEU 27 42.365 6.776 4.515
215 HB2 LEU 27 HB2 LEU 27 41.740 5.191 6.278
216 HB3 LEU 27 HB1 LEU 27 40.159 5.933 6.402
217 HG LEU 27 HG LEU 27 39.627 5.180 4.118
218 HD11 LEU 27 HD11 LEU 27 41.841 5.149 3.158
219 HD12 LEU 27 HD12 LEU 27 41.107 3.552 3.015
220 HD13 LEU 27 HD13 LEU 27 42.330 3.854 4.249
221 HD21 LEU 27 HD21 LEU 27 40.588 2.986 5.952
222 HD22 LEU 27 HD22 LEU 27 39.437 2.795 4.629
223 HD23 LEU 27 HD23 LEU 27 39.019 3.787 6.026
224 H GLY 28 HN GLY 28 39.718 8.543 6.044
225 HA2 GLY 28 HA2 GLY 28 38.090 8.670 3.704
226 HA3 GLY 28 HA1 GLY 28 37.925 9.675 5.138
227 H ALA 29 HN ALA 29 40.704 10.559 4.988
228 HA ALA 29 HA ALA 29 40.349 12.878 3.419
229 HB1 ALA 29 HB1 ALA 29 42.661 13.402 4.029
230 HB2 ALA 29 HB2 ALA 29 42.872 11.762 4.641
231 HB3 ALA 29 HB3 ALA 29 41.736 12.857 5.428
232 H ILE 30 HN ILE 30 42.482 10.046 3.006
233 HA ILE 30 HA ILE 30 43.480 10.923 0.504
234 HB ILE 30 HB ILE 30 44.377 8.649 0.222
235 HG12 ILE 30 HG12 ILE 30 42.965 8.026 2.826
236 HG13 ILE 30 HG11 ILE 30 42.464 7.435 1.246
237 HG21 ILE 30 HG21 ILE 30 44.768 9.791 2.986
238 HG22 ILE 30 HG22 ILE 30 45.621 10.284 1.524
239 HG23 ILE 30 HG23 ILE 30 45.855 8.663 2.175
240 HD11 ILE 30 HD11 ILE 30 43.687 5.744 2.482
241 HD12 ILE 30 HD12 ILE 30 45.071 6.826 2.616
242 HD13 ILE 30 HD13 ILE 30 44.571 6.226 1.035
243 H SER 31 HN SER 31 40.632 9.159 1.418
244 HA SER 31 HA SER 31 40.069 8.049 -1.122
245 HB2 SER 31 HB2 SER 31 38.212 8.766 1.157
246 HB3 SER 31 HB1 SER 31 37.742 7.827 -0.261
247 HG SER 31 HG SER 31 39.616 7.137 1.762
248 H LYS 32 HN LYS 32 39.608 11.195 0.265
249 HA LYS 32 HA LYS 32 37.839 12.038 -1.873
250 HB2 LYS 32 HB2 LYS 32 37.404 12.837 0.391
251 HB3 LYS 32 HB1 LYS 32 39.006 13.556 0.464
252 HG2 LYS 32 HG2 LYS 32 38.391 15.092 -1.343
253 HG3 LYS 32 HG1 LYS 32 36.779 14.377 -1.389
254 HD2 LYS 32 HD2 LYS 32 36.389 15.077 0.913
255 HD3 LYS 32 HD1 LYS 32 38.015 15.758 0.990
256 HE2 LYS 32 HE2 LYS 32 37.446 17.323 -0.793
257 HE3 LYS 32 HE1 LYS 32 35.826 16.636 -0.883
258 HZ1 LYS 32 HZ1 LYS 32 36.986 18.005 1.478
259 HZ2 LYS 32 HZ2 LYS 32 35.426 17.364 1.378
260 HZ3 LYS 32 HZ3 LYS 32 35.868 18.673 0.402
261 H ARG 33 HN ARG 33 41.125 12.700 -0.727
262 HA ARG 33 HA ARG 33 41.602 14.619 -2.821
263 HB2 ARG 33 HB2 ARG 33 43.538 13.423 -0.838
264 HB3 ARG 33 HB1 ARG 33 43.849 14.809 -1.874
265 HG2 ARG 33 HG2 ARG 33 41.794 14.652 0.323
266 HG3 ARG 33 HG1 ARG 33 43.322 15.531 0.376
267 HD2 ARG 33 HD2 ARG 33 42.587 17.021 -1.362
268 HD3 ARG 33 HD1 ARG 33 41.129 16.066 -1.619
269 HE ARG 33 HE ARG 33 41.171 16.897 1.046
270 HH11 ARG 33 HH11 ARG 33 40.824 18.267 -2.166
271 HH12 ARG 33 HH12 ARG 33 39.848 19.589 -1.632
272 HH21 ARG 33 HH21 ARG 33 39.855 18.633 1.743
273 HH22 ARG 33 HH22 ARG 33 39.287 19.797 0.596
274 H LEU 34 HN LEU 34 42.714 11.308 -2.155
275 HA LEU 34 HA LEU 34 44.105 11.314 -4.722
276 HB2 LEU 34 HB2 LEU 34 44.062 9.325 -2.455
277 HB3 LEU 34 HB1 LEU 34 44.804 8.973 -3.998
278 HG LEU 34 HG LEU 34 46.545 9.577 -2.509
279 HD11 LEU 34 HD11 LEU 34 47.534 11.522 -3.557
280 HD12 LEU 34 HD12 LEU 34 45.971 11.973 -4.233
281 HD13 LEU 34 HD13 LEU 34 46.761 10.485 -4.757
282 HD21 LEU 34 HD21 LEU 34 45.243 10.692 -0.788
283 HD22 LEU 34 HD22 LEU 34 44.983 12.073 -1.853
284 HD23 LEU 34 HD23 LEU 34 46.607 11.696 -1.277
285 H LYS 35 HN LYS 35 41.220 10.195 -3.233
286 HA LYS 35 HA LYS 35 39.437 9.029 -3.946
287 HB2 LYS 35 HB2 LYS 35 40.488 9.884 -6.644
288 HB3 LYS 35 HB1 LYS 35 38.920 9.130 -6.392
289 HG2 LYS 35 HG2 LYS 35 38.202 10.985 -5.031
290 HG3 LYS 35 HG1 LYS 35 39.800 11.723 -5.145
291 HD2 LYS 35 HD2 LYS 35 39.538 12.019 -7.528
292 HD3 LYS 35 HD1 LYS 35 37.997 11.162 -7.493
293 HE2 LYS 35 HE2 LYS 35 37.699 13.591 -7.594
294 HE3 LYS 35 HE1 LYS 35 37.023 12.907 -6.120
295 HZ1 LYS 35 HZ1 LYS 35 39.662 14.239 -6.333
296 HZ2 LYS 35 HZ2 LYS 35 38.962 13.656 -4.908
297 HZ3 LYS 35 HZ3 LYS 35 38.262 14.957 -5.727
298 H VAL 36 HN VAL 36 40.734 7.214 -3.060
299 HA VAL 36 HA VAL 36 41.863 5.393 -4.959
300 HB VAL 36 HB VAL 36 42.076 3.834 -3.007
301 HG11 VAL 36 HG11 VAL 36 43.151 6.623 -2.600
302 HG12 VAL 36 HG12 VAL 36 43.880 5.356 -3.588
303 HG13 VAL 36 HG13 VAL 36 43.778 5.160 -1.838
304 HG21 VAL 36 HG21 VAL 36 40.136 4.598 -1.717
305 HG22 VAL 36 HG22 VAL 36 40.925 6.152 -1.445
306 HG23 VAL 36 HG23 VAL 36 41.613 4.681 -0.756
307 HA PRO 37 HA PRO 37 38.053 3.448 -6.090
308 HB2 PRO 37 HB2 PRO 37 39.174 1.145 -7.110
309 HB3 PRO 37 HB1 PRO 37 39.025 2.662 -8.003
310 HG2 PRO 37 HG2 PRO 37 41.389 1.517 -6.592
311 HG3 PRO 37 HG1 PRO 37 41.317 2.423 -8.112
312 HD2 PRO 37 HD2 PRO 37 42.119 3.533 -5.784
313 HD3 PRO 37 HD1 PRO 37 41.275 4.456 -7.042
314 H ARG 38 HN ARG 38 36.743 2.495 -4.707
315 HA ARG 38 HA ARG 38 37.564 1.186 -2.377
316 HB2 ARG 38 HB2 ARG 38 34.904 1.336 -3.765
317 HB3 ARG 38 HB1 ARG 38 35.113 0.365 -2.319
318 HG2 ARG 38 HG2 ARG 38 34.215 2.500 -1.702
319 HG3 ARG 38 HG1 ARG 38 35.874 2.396 -1.117
320 HD2 ARG 38 HD2 ARG 38 36.630 3.726 -3.022
321 HD3 ARG 38 HD1 ARG 38 34.976 3.799 -3.628
322 HE ARG 38 HE ARG 38 35.160 4.778 -0.971
323 HH11 ARG 38 HH11 ARG 38 35.829 5.666 -4.293
324 HH12 ARG 38 HH12 ARG 38 35.585 7.360 -4.032
325 HH21 ARG 38 HH21 ARG 38 34.846 7.028 -0.609
326 HH22 ARG 38 HH22 ARG 38 35.023 8.131 -1.928
327 H SER 39 HN SER 39 36.724 -0.102 -5.525
328 HA SER 39 HA SER 39 36.506 -2.801 -4.854
329 HB2 SER 39 HB2 SER 39 37.659 -1.654 -7.404
330 HB3 SER 39 HB1 SER 39 36.951 -3.254 -7.193
331 HG SER 39 HG SER 39 35.016 -1.944 -6.461
332 H SER 40 HN SER 40 39.349 -0.810 -5.532
333 HA SER 40 HA SER 40 41.169 -3.007 -5.368
334 HB2 SER 40 HB2 SER 40 41.730 -0.037 -5.225
335 HB3 SER 40 HB1 SER 40 42.911 -1.309 -5.539
336 HG SER 40 HG SER 40 41.572 -1.839 -7.411
337 H VAL 41 HN VAL 41 39.896 -0.577 -3.192
338 HA VAL 41 HA VAL 41 41.688 -0.879 -1.060
339 HB VAL 41 HB VAL 41 38.731 -0.214 -0.946
340 HG11 VAL 41 HG11 VAL 41 39.227 0.793 1.235
341 HG12 VAL 41 HG12 VAL 41 40.887 0.210 1.125
342 HG13 VAL 41 HG13 VAL 41 39.554 -0.939 1.233
343 HG21 VAL 41 HG21 VAL 41 39.995 1.346 -2.324
344 HG22 VAL 41 HG22 VAL 41 41.157 1.579 -1.019
345 HG23 VAL 41 HG23 VAL 41 39.490 2.116 -0.820
346 H GLN 42 HN GLN 42 38.643 -2.558 -1.766
347 HA GLN 42 HA GLN 42 38.649 -4.226 0.493
348 HB2 GLN 42 HB2 GLN 42 37.435 -4.697 -2.231
349 HB3 GLN 42 HB1 GLN 42 37.071 -5.635 -0.789
350 HG2 GLN 42 HG2 GLN 42 36.176 -3.652 0.296
351 HG3 GLN 42 HG1 GLN 42 36.572 -2.688 -1.125
352 HE21 GLN 42 HE21 GLN 42 34.469 -5.086 0.210
353 HE22 GLN 42 HE22 GLN 42 33.271 -5.020 -1.033
354 H THR 43 HN THR 43 40.337 -4.433 -2.530
355 HA THR 43 HA THR 43 41.080 -7.171 -2.293
356 HB THR 43 HB THR 43 42.431 -4.994 -3.908
357 HG1 THR 43 HG1 THR 43 40.866 -5.232 -5.345
358 HG21 THR 43 HG21 THR 43 42.379 -8.001 -4.250
359 HG22 THR 43 HG22 THR 43 43.751 -7.057 -3.668
360 HG23 THR 43 HG23 THR 43 43.179 -6.851 -5.323
361 H ILE 44 HN ILE 44 42.697 -4.069 -1.577
362 HA ILE 44 HA ILE 44 45.076 -5.382 -0.718
363 HB ILE 44 HB ILE 44 45.874 -3.153 0.027
364 HG12 ILE 44 HG12 ILE 44 44.356 -1.222 -0.971
365 HG13 ILE 44 HG11 ILE 44 43.066 -2.376 -0.660
366 HG21 ILE 44 HG21 ILE 44 44.765 -3.291 -2.767
367 HG22 ILE 44 HG22 ILE 44 46.315 -3.923 -2.212
368 HG23 ILE 44 HG23 ILE 44 46.024 -2.183 -2.221
369 HD11 ILE 44 HD11 ILE 44 43.707 -2.450 1.697
370 HD12 ILE 44 HD12 ILE 44 43.311 -0.812 1.177
371 HD13 ILE 44 HD13 ILE 44 44.996 -1.289 1.379
372 H VAL 45 HN VAL 45 42.175 -4.360 0.943
373 HA VAL 45 HA VAL 45 43.314 -4.405 3.540
374 HB VAL 45 HB VAL 45 41.021 -4.644 4.429
375 HG11 VAL 45 HG11 VAL 45 40.124 -2.541 3.573
376 HG12 VAL 45 HG12 VAL 45 41.283 -2.597 2.246
377 HG13 VAL 45 HG13 VAL 45 41.852 -2.440 3.907
378 HG21 VAL 45 HG21 VAL 45 40.029 -6.098 2.791
379 HG22 VAL 45 HG22 VAL 45 40.235 -4.880 1.535
380 HG23 VAL 45 HG23 VAL 45 39.105 -4.596 2.859
381 H ARG 46 HN ARG 46 41.823 -6.887 1.543
382 HA ARG 46 HA ARG 46 42.015 -8.938 3.522
383 HB2 ARG 46 HB2 ARG 46 41.891 -9.216 0.510
384 HB3 ARG 46 HB1 ARG 46 41.575 -10.486 1.678
385 HG2 ARG 46 HG2 ARG 46 39.936 -7.997 1.263
386 HG3 ARG 46 HG1 ARG 46 39.515 -9.629 0.745
387 HD2 ARG 46 HD2 ARG 46 39.501 -10.344 3.099
388 HD3 ARG 46 HD1 ARG 46 39.870 -8.691 3.589
389 HE ARG 46 HE ARG 46 37.544 -8.877 1.936
390 HH11 ARG 46 HH11 ARG 46 38.711 -9.119 5.234
391 HH12 ARG 46 HH12 ARG 46 37.172 -8.790 5.941
392 HH21 ARG 46 HH21 ARG 46 35.503 -8.453 2.872
393 HH22 ARG 46 HH22 ARG 46 35.338 -8.414 4.593
394 H LYS 47 HN LYS 47 44.063 -7.566 1.113
395 HA LYS 47 HA LYS 47 45.980 -9.602 0.883
396 HB2 LYS 47 HB2 LYS 47 45.724 -7.789 -0.754
397 HB3 LYS 47 HB1 LYS 47 46.279 -6.630 0.443
398 HG2 LYS 47 HG2 LYS 47 48.068 -7.125 -1.075
399 HG3 LYS 47 HG1 LYS 47 48.455 -7.794 0.510
400 HD2 LYS 47 HD2 LYS 47 47.738 -10.005 -0.243
401 HD3 LYS 47 HD1 LYS 47 47.321 -9.338 -1.823
402 HE2 LYS 47 HE2 LYS 47 49.666 -8.685 -2.145
403 HE3 LYS 47 HE1 LYS 47 50.067 -9.387 -0.579
404 HZ1 LYS 47 HZ1 LYS 47 50.588 -10.895 -2.369
405 HZ2 LYS 47 HZ2 LYS 47 48.992 -10.861 -2.917
406 HZ3 LYS 47 HZ3 LYS 47 49.359 -11.535 -1.407
407 H TYR 48 HN TYR 48 46.243 -6.481 2.654
408 HA TYR 48 HA TYR 48 48.696 -7.232 3.834
409 HB2 TYR 48 HB2 TYR 48 48.692 -5.189 4.985
410 HB3 TYR 48 HB1 TYR 48 47.769 -4.843 3.536
411 HD1 TYR 48 HD1 TYR 48 47.510 -5.476 7.178
412 HD2 TYR 48 HD2 TYR 48 45.488 -4.080 3.698
413 HE1 TYR 48 HE1 TYR 48 45.713 -4.576 8.587
414 HE2 TYR 48 HE2 TYR 48 43.687 -3.184 5.108
415 HH TYR 48 HH TYR 48 42.733 -3.563 7.327
416 H LYS 49 HN LYS 49 45.401 -7.707 4.830
417 HA LYS 49 HA LYS 49 45.987 -8.347 7.531
418 HB2 LYS 49 HB2 LYS 49 43.735 -7.683 6.790
419 HB3 LYS 49 HB1 LYS 49 43.613 -9.163 5.851
420 HG2 LYS 49 HG2 LYS 49 43.855 -10.453 7.959
421 HG3 LYS 49 HG1 LYS 49 43.800 -8.929 8.844
422 HD2 LYS 49 HD2 LYS 49 41.584 -8.474 7.959
423 HD3 LYS 49 HD1 LYS 49 41.638 -9.962 7.010
424 HE2 LYS 49 HE2 LYS 49 41.906 -11.222 9.150
425 HE3 LYS 49 HE1 LYS 49 41.638 -9.709 10.013
426 HZ1 LYS 49 HZ1 LYS 49 39.609 -10.979 9.850
427 HZ2 LYS 49 HZ2 LYS 49 39.726 -11.019 8.165
428 HZ3 LYS 49 HZ3 LYS 49 39.464 -9.551 8.957
429 H HIS 50 HN HIS 50 45.349 -10.362 4.659
430 HA HIS 50 HA HIS 50 45.773 -12.802 6.072
431 HB2 HIS 50 HB2 HIS 50 44.396 -12.539 3.967
432 HB3 HIS 50 HB1 HIS 50 45.913 -12.431 3.080
433 HD1 HIS 50 HD1 HIS 50 46.821 -14.600 2.266
434 HD2 HIS 50 HD2 HIS 50 44.184 -15.104 5.438
435 HE1 HIS 50 HE1 HIS 50 46.571 -17.082 2.545
436 H HIS 51 HN HIS 51 47.808 -10.710 4.107
437 HA HIS 51 HA HIS 51 50.012 -12.465 3.917
438 HB2 HIS 51 HB2 HIS 51 49.675 -10.364 2.557
439 HB3 HIS 51 HB1 HIS 51 50.108 -9.440 3.989
440 HD1 HIS 51 HD1 HIS 51 51.552 -11.420 1.212
441 HD2 HIS 51 HD2 HIS 51 52.864 -9.616 4.721
442 HE1 HIS 51 HE1 HIS 51 54.054 -11.374 1.045
443 H GLY 52 HN GLY 52 48.962 -10.138 6.323
444 HA2 GLY 52 HA2 GLY 52 51.299 -10.295 7.944
445 HA3 GLY 52 HA1 GLY 52 49.740 -9.639 8.420
446 H THR 53 HN THR 53 48.691 -12.427 7.465
447 HA THR 53 HA THR 53 48.792 -13.631 10.077
448 HB THR 53 HB THR 53 47.572 -14.745 7.534
449 HG1 THR 53 HG1 THR 53 46.743 -12.771 9.322
450 HG21 THR 53 HG21 THR 53 47.853 -16.394 9.329
451 HG22 THR 53 HG22 THR 53 46.148 -16.014 9.083
452 HG23 THR 53 HG23 THR 53 47.017 -15.320 10.450
453 H THR 54 HN THR 54 50.107 -14.233 6.873
454 HA THR 54 HA THR 54 51.372 -16.708 7.680
455 HB THR 54 HB THR 54 51.694 -15.195 5.078
456 HG1 THR 54 HG1 THR 54 49.798 -17.188 5.847
457 HG21 THR 54 HG21 THR 54 53.378 -16.939 5.481
458 HG22 THR 54 HG22 THR 54 52.283 -17.407 4.181
459 HG23 THR 54 HG23 THR 54 52.095 -18.110 5.787
460 H GLN 55 HN GLN 55 52.438 -13.496 6.535
461 HA GLN 55 HA GLN 55 55.166 -14.104 7.429
462 HB2 GLN 55 HB2 GLN 55 54.110 -11.846 5.714
463 HB3 GLN 55 HB1 GLN 55 55.800 -12.114 6.111
464 HG2 GLN 55 HG2 GLN 55 54.082 -14.059 4.589
465 HG3 GLN 55 HG1 GLN 55 55.149 -12.872 3.843
466 HE21 GLN 55 HE21 GLN 55 57.225 -13.153 5.845
467 HE22 GLN 55 HE22 GLN 55 57.986 -14.673 5.542
468 H HIS 56 HN HIS 56 56.233 -12.791 8.905
469 HA HIS 56 HA HIS 56 54.530 -11.222 10.629
470 HB2 HIS 56 HB2 HIS 56 56.221 -12.633 11.684
471 HB3 HIS 56 HB1 HIS 56 57.498 -11.821 10.784
472 HD1 HIS 56 HD1 HIS 56 58.738 -10.249 12.233
473 HD2 HIS 56 HD2 HIS 56 54.719 -10.442 13.280
474 HE1 HIS 56 HE1 HIS 56 58.464 -8.641 14.139
475 H HIS 57 HN HIS 57 53.949 -9.352 9.766
476 HA HIS 57 HA HIS 57 55.877 -7.744 8.311
477 HB2 HIS 57 HB2 HIS 57 53.514 -8.114 7.499
478 HB3 HIS 57 HB1 HIS 57 52.965 -7.151 8.865
479 HD1 HIS 57 HD1 HIS 57 55.055 -6.828 5.736
480 HD2 HIS 57 HD2 HIS 57 52.976 -4.453 8.433
481 HE1 HIS 57 HE1 HIS 57 55.075 -4.521 4.743
Start of MODEL 4
1 H1 ALA 1 HT1 ALA 1 53.753 17.645 -19.184
2 H2 ALA 1 HT2 ALA 1 52.067 17.463 -19.177
3 H3 ALA 1 HT3 ALA 1 53.046 16.255 -19.834
4 HA ALA 1 HA ALA 1 53.017 17.069 -16.999
5 HB1 ALA 1 HB1 ALA 1 51.962 14.895 -16.585
6 HB2 ALA 1 HB2 ALA 1 51.888 14.603 -18.324
7 HB3 ALA 1 HB3 ALA 1 50.958 15.920 -17.609
8 H SER 2 HN SER 2 55.026 16.870 -16.290
9 HA SER 2 HA SER 2 56.798 14.899 -17.476
10 HB2 SER 2 HB2 SER 2 57.580 17.238 -17.107
11 HB3 SER 2 HB1 SER 2 57.376 17.006 -15.374
12 HG SER 2 HG SER 2 59.100 15.491 -17.054
13 H MET 3 HN MET 3 58.051 13.479 -16.093
14 HA MET 3 HA MET 3 56.564 12.690 -13.682
15 HB2 MET 3 HB2 MET 3 57.350 10.389 -14.085
16 HB3 MET 3 HB1 MET 3 56.371 10.988 -15.414
17 HG2 MET 3 HG2 MET 3 58.343 11.376 -16.749
18 HG3 MET 3 HG1 MET 3 59.382 10.920 -15.400
19 HE1 MET 3 HE1 MET 3 59.697 8.470 -14.525
20 HE2 MET 3 HE2 MET 3 58.731 7.098 -15.067
21 HE3 MET 3 HE3 MET 3 57.973 8.406 -14.160
22 H GLY 4 HN GLY 4 57.697 12.291 -11.834
23 HA2 GLY 4 HA2 GLY 4 60.421 13.311 -11.810
24 HA3 GLY 4 HA1 GLY 4 59.421 12.965 -10.403
25 H LYS 5 HN LYS 5 58.919 10.629 -10.070
26 HA LYS 5 HA LYS 5 61.000 8.841 -11.025
27 HB2 LYS 5 HB2 LYS 5 61.863 9.877 -8.959
28 HB3 LYS 5 HB1 LYS 5 60.451 9.300 -8.092
29 HG2 LYS 5 HG2 LYS 5 61.119 6.996 -8.497
30 HG3 LYS 5 HG1 LYS 5 62.517 7.554 -9.419
31 HD2 LYS 5 HD2 LYS 5 61.989 8.127 -6.502
32 HD3 LYS 5 HD1 LYS 5 63.133 6.936 -7.123
33 HE2 LYS 5 HE2 LYS 5 64.416 8.708 -8.198
34 HE3 LYS 5 HE1 LYS 5 63.252 9.909 -7.644
35 HZ1 LYS 5 HZ1 LYS 5 65.144 9.904 -6.209
36 HZ2 LYS 5 HZ2 LYS 5 65.013 8.245 -5.945
37 HZ3 LYS 5 HZ3 LYS 5 63.822 9.286 -5.357
38 H SER 6 HN SER 6 59.829 7.242 -11.865
39 HA SER 6 HA SER 6 57.892 5.868 -10.214
40 HB2 SER 6 HB2 SER 6 57.043 7.033 -12.880
41 HB3 SER 6 HB1 SER 6 56.060 6.015 -11.829
42 HG SER 6 HG SER 6 57.027 8.121 -10.459
43 H LYS 7 HN LYS 7 58.655 3.870 -10.371
44 HA LYS 7 HA LYS 7 59.274 2.825 -13.056
45 HB2 LYS 7 HB2 LYS 7 60.595 2.165 -10.423
46 HB3 LYS 7 HB1 LYS 7 60.831 1.232 -11.891
47 HG2 LYS 7 HG2 LYS 7 61.779 3.204 -12.985
48 HG3 LYS 7 HG1 LYS 7 61.560 4.125 -11.494
49 HD2 LYS 7 HD2 LYS 7 63.055 2.636 -10.312
50 HD3 LYS 7 HD1 LYS 7 63.211 1.616 -11.743
51 HE2 LYS 7 HE2 LYS 7 64.250 3.470 -12.948
52 HE3 LYS 7 HE1 LYS 7 64.084 4.493 -11.519
53 HZ1 LYS 7 HZ1 LYS 7 66.311 3.528 -11.745
54 HZ2 LYS 7 HZ2 LYS 7 65.651 1.978 -11.624
55 HZ3 LYS 7 HZ3 LYS 7 65.550 3.040 -10.319
56 H GLU 8 HN GLU 8 58.718 1.565 -9.798
57 HA GLU 8 HA GLU 8 56.296 0.251 -10.403
58 HB2 GLU 8 HB2 GLU 8 57.065 -2.077 -10.325
59 HB3 GLU 8 HB1 GLU 8 57.719 -1.235 -11.722
60 HG2 GLU 8 HG2 GLU 8 59.859 -1.021 -10.660
61 HG3 GLU 8 HG1 GLU 8 59.223 -1.680 -9.155
62 H ILE 9 HN ILE 9 59.123 0.662 -8.440
63 HA ILE 9 HA ILE 9 58.356 -0.748 -6.164
64 HB ILE 9 HB ILE 9 60.639 -0.094 -6.404
65 HG12 ILE 9 HG12 ILE 9 59.477 1.515 -4.122
66 HG13 ILE 9 HG11 ILE 9 59.814 -0.213 -4.083
67 HG21 ILE 9 HG21 ILE 9 61.416 2.231 -6.356
68 HG22 ILE 9 HG22 ILE 9 59.740 2.778 -6.371
69 HG23 ILE 9 HG23 ILE 9 60.390 1.889 -7.749
70 HD11 ILE 9 HD11 ILE 9 61.551 1.036 -2.954
71 HD12 ILE 9 HD12 ILE 9 61.844 1.985 -4.412
72 HD13 ILE 9 HD13 ILE 9 62.194 0.256 -4.400
73 H SER 10 HN SER 10 56.231 -0.409 -5.710
74 HA SER 10 HA SER 10 55.365 2.277 -4.941
75 HB2 SER 10 HB2 SER 10 53.700 -0.201 -5.418
76 HB3 SER 10 HB1 SER 10 53.102 1.446 -5.198
77 HG SER 10 HG SER 10 54.804 0.573 -7.301
78 H GLN 11 HN GLN 11 57.039 0.373 -3.313
79 HA GLN 11 HA GLN 11 55.604 -0.799 -1.250
80 HB2 GLN 11 HB2 GLN 11 57.664 -0.644 0.085
81 HB3 GLN 11 HB1 GLN 11 57.955 -1.232 -1.544
82 HG2 GLN 11 HG2 GLN 11 58.708 1.026 -2.189
83 HG3 GLN 11 HG1 GLN 11 58.485 1.547 -0.521
84 HE21 GLN 11 HE21 GLN 11 59.649 -1.616 -1.362
85 HE22 GLN 11 HE22 GLN 11 61.273 -1.377 -0.824
86 H ASP 12 HN ASP 12 56.614 2.566 -1.612
87 HA ASP 12 HA ASP 12 55.888 3.322 1.025
88 HB2 ASP 12 HB2 ASP 12 57.411 4.696 -0.351
89 HB3 ASP 12 HB1 ASP 12 56.075 5.077 -1.432
90 H LEU 13 HN LEU 13 54.219 3.475 -2.086
91 HA LEU 13 HA LEU 13 51.870 4.711 -1.232
92 HB2 LEU 13 HB2 LEU 13 52.576 4.249 -3.607
93 HB3 LEU 13 HB1 LEU 13 52.108 2.581 -3.369
94 HG LEU 13 HG LEU 13 50.110 4.813 -3.030
95 HD11 LEU 13 HD11 LEU 13 49.460 4.478 -5.364
96 HD12 LEU 13 HD12 LEU 13 50.831 3.391 -5.589
97 HD13 LEU 13 HD13 LEU 13 51.107 5.096 -5.232
98 HD21 LEU 13 HD21 LEU 13 49.476 2.586 -2.215
99 HD22 LEU 13 HD22 LEU 13 49.833 1.903 -3.801
100 HD23 LEU 13 HD23 LEU 13 48.510 3.054 -3.614
101 H ARG 14 HN ARG 14 52.737 1.273 -1.326
102 HA ARG 14 HA ARG 14 50.281 0.281 -0.358
103 HB2 ARG 14 HB2 ARG 14 51.986 -1.136 -1.435
104 HB3 ARG 14 HB1 ARG 14 53.049 -0.899 -0.057
105 HG2 ARG 14 HG2 ARG 14 51.422 -2.030 1.386
106 HG3 ARG 14 HG1 ARG 14 50.373 -2.284 -0.010
107 HD2 ARG 14 HD2 ARG 14 51.667 -4.287 0.465
108 HD3 ARG 14 HD1 ARG 14 52.128 -3.595 -1.089
109 HE ARG 14 HE ARG 14 53.704 -3.070 1.337
110 HH11 ARG 14 HH11 ARG 14 53.507 -4.266 -1.967
111 HH12 ARG 14 HH12 ARG 14 55.217 -4.463 -2.130
112 HH21 ARG 14 HH21 ARG 14 55.970 -3.334 1.106
113 HH22 ARG 14 HH22 ARG 14 56.624 -3.938 -0.376
114 H LYS 15 HN LYS 15 53.299 1.111 1.294
115 HA LYS 15 HA LYS 15 52.568 0.508 3.911
116 HB2 LYS 15 HB2 LYS 15 54.843 1.032 3.294
117 HB3 LYS 15 HB1 LYS 15 54.373 2.648 2.801
118 HG2 LYS 15 HG2 LYS 15 53.747 3.083 5.198
119 HG3 LYS 15 HG1 LYS 15 54.505 1.538 5.594
120 HD2 LYS 15 HD2 LYS 15 56.090 3.341 5.952
121 HD3 LYS 15 HD1 LYS 15 56.615 2.351 4.589
122 HE2 LYS 15 HE2 LYS 15 55.630 4.001 3.038
123 HE3 LYS 15 HE1 LYS 15 55.156 4.987 4.415
124 HZ1 LYS 15 HZ1 LYS 15 57.217 5.691 3.287
125 HZ2 LYS 15 HZ2 LYS 15 57.962 4.257 3.797
126 HZ3 LYS 15 HZ3 LYS 15 57.419 5.384 4.937
127 H LYS 16 HN LYS 16 52.152 3.489 2.040
128 HA LYS 16 HA LYS 16 51.053 5.055 4.097
129 HB2 LYS 16 HB2 LYS 16 50.732 5.292 1.104
130 HB3 LYS 16 HB1 LYS 16 50.221 6.513 2.257
131 HG2 LYS 16 HG2 LYS 16 53.057 5.563 1.910
132 HG3 LYS 16 HG1 LYS 16 52.379 7.015 1.175
133 HD2 LYS 16 HD2 LYS 16 51.985 7.987 3.341
134 HD3 LYS 16 HD1 LYS 16 52.473 6.494 4.143
135 HE2 LYS 16 HE2 LYS 16 54.241 8.217 4.175
136 HE3 LYS 16 HE1 LYS 16 54.733 6.747 3.340
137 HZ1 LYS 16 HZ1 LYS 16 54.469 7.786 1.253
138 HZ2 LYS 16 HZ2 LYS 16 55.349 8.862 2.216
139 HZ3 LYS 16 HZ3 LYS 16 53.706 9.140 1.932
140 H ILE 17 HN ILE 17 49.403 3.310 1.437
141 HA ILE 17 HA ILE 17 46.838 4.071 2.231
142 HB ILE 17 HB ILE 17 47.288 3.104 0.009
143 HG12 ILE 17 HG12 ILE 17 45.229 1.485 1.520
144 HG13 ILE 17 HG11 ILE 17 44.988 3.138 0.965
145 HG21 ILE 17 HG21 ILE 17 48.830 1.340 0.640
146 HG22 ILE 17 HG22 ILE 17 47.487 0.694 -0.305
147 HG23 ILE 17 HG23 ILE 17 47.525 0.469 1.443
148 HD11 ILE 17 HD11 ILE 17 43.947 1.530 -0.532
149 HD12 ILE 17 HD12 ILE 17 45.510 0.750 -0.791
150 HD13 ILE 17 HD13 ILE 17 45.248 2.402 -1.343
151 H VAL 18 HN VAL 18 48.750 1.259 3.243
152 HA VAL 18 HA VAL 18 46.724 0.052 4.809
153 HB VAL 18 HB VAL 18 49.736 -0.084 5.146
154 HG11 VAL 18 HG11 VAL 18 48.597 -0.741 7.197
155 HG12 VAL 18 HG12 VAL 18 49.323 -2.144 6.411
156 HG13 VAL 18 HG13 VAL 18 47.586 -1.866 6.290
157 HG21 VAL 18 HG21 VAL 18 49.543 -2.229 3.969
158 HG22 VAL 18 HG22 VAL 18 48.999 -0.883 2.969
159 HG23 VAL 18 HG23 VAL 18 47.819 -1.942 3.741
160 H ASP 19 HN ASP 19 49.306 2.345 5.589
161 HA ASP 19 HA ASP 19 48.804 2.533 8.348
162 HB2 ASP 19 HB2 ASP 19 50.891 3.311 7.256
163 HB3 ASP 19 HB1 ASP 19 49.993 4.634 6.524
164 H LEU 20 HN LEU 20 47.569 4.361 5.600
165 HA LEU 20 HA LEU 20 46.122 6.277 7.074
166 HB2 LEU 20 HB2 LEU 20 46.123 5.328 4.263
167 HB3 LEU 20 HB1 LEU 20 44.692 6.176 4.805
168 HG LEU 20 HG LEU 20 46.280 7.663 3.653
169 HD11 LEU 20 HD11 LEU 20 45.989 8.278 6.583
170 HD12 LEU 20 HD12 LEU 20 44.787 8.587 5.329
171 HD13 LEU 20 HD13 LEU 20 46.328 9.443 5.305
172 HD21 LEU 20 HD21 LEU 20 48.391 8.288 4.743
173 HD22 LEU 20 HD22 LEU 20 48.374 6.599 4.240
174 HD23 LEU 20 HD23 LEU 20 48.137 7.014 5.937
175 H HIS 21 HN HIS 21 45.238 3.066 5.881
176 HA HIS 21 HA HIS 21 42.508 3.179 6.603
177 HB2 HIS 21 HB2 HIS 21 44.422 0.887 6.208
178 HB3 HIS 21 HB1 HIS 21 42.796 0.600 6.812
179 HD1 HIS 21 HD1 HIS 21 40.896 1.884 5.130
180 HD2 HIS 21 HD2 HIS 21 44.506 0.599 3.523
181 HE1 HIS 21 HE1 HIS 21 40.519 1.750 2.659
182 H LYS 22 HN LYS 22 45.332 1.939 8.322
183 HA LYS 22 HA LYS 22 43.900 1.281 10.678
184 HB2 LYS 22 HB2 LYS 22 46.847 1.673 10.185
185 HB3 LYS 22 HB1 LYS 22 46.166 1.039 11.680
186 HG2 LYS 22 HG2 LYS 22 45.279 -0.873 10.535
187 HG3 LYS 22 HG1 LYS 22 45.760 -0.214 8.972
188 HD2 LYS 22 HD2 LYS 22 47.303 -1.949 9.724
189 HD3 LYS 22 HD1 LYS 22 48.101 -0.380 9.613
190 HE2 LYS 22 HE2 LYS 22 47.877 -0.088 12.031
191 HE3 LYS 22 HE1 LYS 22 47.045 -1.638 12.147
192 HZ1 LYS 22 HZ1 LYS 22 49.021 -2.765 11.469
193 HZ2 LYS 22 HZ2 LYS 22 49.431 -1.720 12.732
194 HZ3 LYS 22 HZ3 LYS 22 49.813 -1.308 11.142
195 H SER 23 HN SER 23 45.098 4.230 9.455
196 HA SER 23 HA SER 23 45.373 5.637 11.899
197 HB2 SER 23 HB2 SER 23 46.327 6.549 9.843
198 HB3 SER 23 HB1 SER 23 44.730 6.626 9.102
199 HG SER 23 HG SER 23 45.836 8.214 11.148
200 H GLY 24 HN GLY 24 42.718 5.157 9.614
201 HA2 GLY 24 HA2 GLY 24 40.448 5.101 10.013
202 HA3 GLY 24 HA1 GLY 24 40.775 5.396 11.713
203 H SER 25 HN SER 25 41.755 7.715 12.020
204 HA SER 25 HA SER 25 39.653 9.501 11.447
205 HB2 SER 25 HB2 SER 25 41.192 9.567 13.454
206 HB3 SER 25 HB1 SER 25 42.427 10.243 12.396
207 HG SER 25 HG SER 25 41.453 12.108 12.457
208 H SER 26 HN SER 26 42.591 8.753 9.763
209 HA SER 26 HA SER 26 42.324 11.142 8.092
210 HB2 SER 26 HB2 SER 26 44.575 9.130 8.165
211 HB3 SER 26 HB1 SER 26 44.581 10.696 7.352
212 HG SER 26 HG SER 26 44.859 10.076 10.047
213 H LEU 27 HN LEU 27 40.809 8.398 8.037
214 HA LEU 27 HA LEU 27 41.472 7.155 5.581
215 HB2 LEU 27 HB2 LEU 27 40.185 6.043 7.354
216 HB3 LEU 27 HB1 LEU 27 38.852 7.146 7.081
217 HG LEU 27 HG LEU 27 38.602 6.221 4.790
218 HD11 LEU 27 HD11 LEU 27 40.679 4.243 5.714
219 HD12 LEU 27 HD12 LEU 27 40.870 5.440 4.431
220 HD13 LEU 27 HD13 LEU 27 39.724 4.115 4.239
221 HD21 LEU 27 HD21 LEU 27 38.465 4.208 7.031
222 HD22 LEU 27 HD22 LEU 27 37.616 4.091 5.489
223 HD23 LEU 27 HD23 LEU 27 37.224 5.391 6.616
224 H GLY 28 HN GLY 28 39.398 9.846 6.408
225 HA2 GLY 28 HA2 GLY 28 38.005 9.939 3.924
226 HA3 GLY 28 HA1 GLY 28 38.088 11.226 5.120
227 H ALA 29 HN ALA 29 40.991 11.261 5.120
228 HA ALA 29 HA ALA 29 41.413 13.206 3.125
229 HB1 ALA 29 HB1 ALA 29 42.615 13.226 5.242
230 HB2 ALA 29 HB2 ALA 29 43.743 13.184 3.885
231 HB3 ALA 29 HB3 ALA 29 43.422 11.719 4.810
232 H ILE 30 HN ILE 30 42.670 9.879 3.441
233 HA ILE 30 HA ILE 30 44.091 9.932 1.010
234 HB ILE 30 HB ILE 30 44.646 8.277 2.691
235 HG12 ILE 30 HG12 ILE 30 43.591 6.944 0.185
236 HG13 ILE 30 HG11 ILE 30 45.152 7.739 0.343
237 HG21 ILE 30 HG21 ILE 30 42.460 7.874 3.645
238 HG22 ILE 30 HG22 ILE 30 43.198 6.347 3.160
239 HG23 ILE 30 HG23 ILE 30 41.935 7.072 2.165
240 HD11 ILE 30 HD11 ILE 30 45.369 5.329 0.462
241 HD12 ILE 30 HD12 ILE 30 44.264 5.285 1.836
242 HD13 ILE 30 HD13 ILE 30 45.832 6.077 1.990
243 H SER 31 HN SER 31 40.775 9.017 1.755
244 HA SER 31 HA SER 31 40.241 7.914 -0.815
245 HB2 SER 31 HB2 SER 31 38.926 7.327 1.207
246 HB3 SER 31 HB1 SER 31 38.284 8.969 1.243
247 HG SER 31 HG SER 31 36.801 7.742 0.177
248 H LYS 32 HN LYS 32 40.233 11.122 0.497
249 HA LYS 32 HA LYS 32 38.598 12.233 -1.591
250 HB2 LYS 32 HB2 LYS 32 38.641 13.169 0.704
251 HB3 LYS 32 HB1 LYS 32 40.317 13.635 0.461
252 HG2 LYS 32 HG2 LYS 32 38.890 15.546 0.171
253 HG3 LYS 32 HG1 LYS 32 39.611 15.113 -1.381
254 HD2 LYS 32 HD2 LYS 32 37.538 13.959 -2.011
255 HD3 LYS 32 HD1 LYS 32 36.824 14.402 -0.459
256 HE2 LYS 32 HE2 LYS 32 36.067 15.915 -2.198
257 HE3 LYS 32 HE1 LYS 32 37.076 16.773 -1.036
258 HZ1 LYS 32 HZ1 LYS 32 38.013 15.744 -3.659
259 HZ2 LYS 32 HZ2 LYS 32 38.920 16.665 -2.572
260 HZ3 LYS 32 HZ3 LYS 32 37.585 17.346 -3.351
261 H ARG 33 HN ARG 33 42.054 12.104 -0.828
262 HA ARG 33 HA ARG 33 42.639 13.682 -3.186
263 HB2 ARG 33 HB2 ARG 33 43.941 14.149 -1.197
264 HB3 ARG 33 HB1 ARG 33 44.504 12.484 -1.139
265 HG2 ARG 33 HG2 ARG 33 46.187 14.053 -2.043
266 HG3 ARG 33 HG1 ARG 33 45.749 12.776 -3.179
267 HD2 ARG 33 HD2 ARG 33 44.177 14.353 -4.272
268 HD3 ARG 33 HD1 ARG 33 44.744 15.623 -3.193
269 HE ARG 33 HE ARG 33 47.008 15.118 -4.223
270 HH11 ARG 33 HH11 ARG 33 43.977 14.757 -5.973
271 HH12 ARG 33 HH12 ARG 33 44.692 15.054 -7.516
272 HH21 ARG 33 HH21 ARG 33 47.943 15.509 -6.278
273 HH22 ARG 33 HH22 ARG 33 46.945 15.489 -7.694
274 H LEU 34 HN LEU 34 43.468 10.398 -2.040
275 HA LEU 34 HA LEU 34 44.680 9.770 -4.569
276 HB2 LEU 34 HB2 LEU 34 44.108 8.124 -2.112
277 HB3 LEU 34 HB1 LEU 34 44.755 7.414 -3.574
278 HG LEU 34 HG LEU 34 46.559 7.769 -2.045
279 HD11 LEU 34 HD11 LEU 34 46.671 9.887 -4.179
280 HD12 LEU 34 HD12 LEU 34 47.045 8.178 -4.395
281 HD13 LEU 34 HD13 LEU 34 48.047 9.173 -3.340
282 HD21 LEU 34 HD21 LEU 34 45.543 9.492 -0.636
283 HD22 LEU 34 HD22 LEU 34 45.739 10.672 -1.931
284 HD23 LEU 34 HD23 LEU 34 47.159 9.965 -1.161
285 H LYS 35 HN LYS 35 41.628 9.189 -2.981
286 HA LYS 35 HA LYS 35 39.661 8.310 -3.671
287 HB2 LYS 35 HB2 LYS 35 40.662 9.088 -6.416
288 HB3 LYS 35 HB1 LYS 35 38.992 8.756 -5.987
289 HG2 LYS 35 HG2 LYS 35 39.090 10.685 -4.406
290 HG3 LYS 35 HG1 LYS 35 40.695 11.049 -5.039
291 HD2 LYS 35 HD2 LYS 35 39.347 12.441 -6.308
292 HD3 LYS 35 HD1 LYS 35 39.501 11.029 -7.352
293 HE2 LYS 35 HE2 LYS 35 37.181 11.628 -5.511
294 HE3 LYS 35 HE1 LYS 35 37.189 11.856 -7.255
295 HZ1 LYS 35 HZ1 LYS 35 37.604 9.406 -7.428
296 HZ2 LYS 35 HZ2 LYS 35 36.097 9.822 -6.803
297 HZ3 LYS 35 HZ3 LYS 35 37.311 9.290 -5.765
298 H VAL 36 HN VAL 36 41.383 6.372 -3.143
299 HA VAL 36 HA VAL 36 41.974 4.569 -5.195
300 HB VAL 36 HB VAL 36 42.117 2.839 -3.354
301 HG11 VAL 36 HG11 VAL 36 44.064 3.895 -2.287
302 HG12 VAL 36 HG12 VAL 36 43.569 5.453 -2.947
303 HG13 VAL 36 HG13 VAL 36 44.050 4.148 -4.031
304 HG21 VAL 36 HG21 VAL 36 40.407 3.779 -1.868
305 HG22 VAL 36 HG22 VAL 36 41.413 5.205 -1.608
306 HG23 VAL 36 HG23 VAL 36 41.957 3.627 -1.039
307 HA PRO 37 HA PRO 37 38.033 2.970 -6.432
308 HB2 PRO 37 HB2 PRO 37 39.582 0.469 -6.904
309 HB3 PRO 37 HB1 PRO 37 38.534 1.368 -8.007
310 HG2 PRO 37 HG2 PRO 37 41.173 1.490 -8.266
311 HG3 PRO 37 HG1 PRO 37 40.171 2.932 -8.505
312 HD2 PRO 37 HD2 PRO 37 41.872 2.171 -6.169
313 HD3 PRO 37 HD1 PRO 37 41.601 3.766 -6.903
314 H ARG 38 HN ARG 38 36.415 1.888 -5.463
315 HA ARG 38 HA ARG 38 36.680 1.093 -2.806
316 HB2 ARG 38 HB2 ARG 38 34.585 1.875 -4.035
317 HB3 ARG 38 HB1 ARG 38 34.414 0.212 -4.577
318 HG2 ARG 38 HG2 ARG 38 33.031 0.613 -2.633
319 HG3 ARG 38 HG1 ARG 38 34.318 -0.528 -2.236
320 HD2 ARG 38 HD2 ARG 38 35.612 1.253 -1.208
321 HD3 ARG 38 HD1 ARG 38 34.387 2.432 -1.666
322 HE ARG 38 HE ARG 38 33.431 0.271 -0.015
323 HH11 ARG 38 HH11 ARG 38 34.855 3.475 -0.080
324 HH12 ARG 38 HH12 ARG 38 34.292 3.899 1.504
325 HH21 ARG 38 HH21 ARG 38 32.687 0.842 2.103
326 HH22 ARG 38 HH22 ARG 38 33.079 2.402 2.741
327 H SER 39 HN SER 39 36.300 -0.939 -5.705
328 HA SER 39 HA SER 39 36.306 -3.399 -4.354
329 HB2 SER 39 HB2 SER 39 37.228 -2.776 -7.166
330 HB3 SER 39 HB1 SER 39 36.827 -4.376 -6.544
331 HG SER 39 HG SER 39 34.826 -3.958 -6.945
332 H SER 40 HN SER 40 38.884 -1.295 -5.411
333 HA SER 40 HA SER 40 40.962 -3.214 -5.043
334 HB2 SER 40 HB2 SER 40 41.140 -0.202 -5.235
335 HB3 SER 40 HB1 SER 40 42.475 -1.343 -5.422
336 HG SER 40 HG SER 40 40.700 -2.201 -7.077
337 H VAL 41 HN VAL 41 39.391 -0.794 -3.051
338 HA VAL 41 HA VAL 41 41.207 -0.672 -0.924
339 HB VAL 41 HB VAL 41 38.180 -0.482 -0.862
340 HG11 VAL 41 HG11 VAL 41 40.193 0.287 1.247
341 HG12 VAL 41 HG12 VAL 41 39.005 -1.011 1.357
342 HG13 VAL 41 HG13 VAL 41 38.471 0.669 1.296
343 HG21 VAL 41 HG21 VAL 41 39.226 1.216 -2.252
344 HG22 VAL 41 HG22 VAL 41 40.312 1.651 -0.930
345 HG23 VAL 41 HG23 VAL 41 38.579 1.938 -0.778
346 H GLN 42 HN GLN 42 38.354 -2.734 -1.326
347 HA GLN 42 HA GLN 42 38.738 -4.311 0.962
348 HB2 GLN 42 HB2 GLN 42 36.607 -4.212 -0.245
349 HB3 GLN 42 HB1 GLN 42 37.336 -4.960 -1.651
350 HG2 GLN 42 HG2 GLN 42 37.286 -6.405 0.974
351 HG3 GLN 42 HG1 GLN 42 35.852 -6.364 -0.046
352 HE21 GLN 42 HE21 GLN 42 37.404 -6.391 -2.525
353 HE22 GLN 42 HE22 GLN 42 38.014 -7.994 -2.697
354 H THR 43 HN THR 43 40.064 -4.543 -2.264
355 HA THR 43 HA THR 43 41.140 -7.154 -1.940
356 HB THR 43 HB THR 43 41.947 -4.988 -3.896
357 HG1 THR 43 HG1 THR 43 39.855 -5.460 -4.367
358 HG21 THR 43 HG21 THR 43 42.377 -7.983 -3.989
359 HG22 THR 43 HG22 THR 43 43.626 -6.782 -3.666
360 HG23 THR 43 HG23 THR 43 42.835 -6.828 -5.241
361 H ILE 44 HN ILE 44 42.481 -3.873 -1.566
362 HA ILE 44 HA ILE 44 45.118 -4.799 -1.063
363 HB ILE 44 HB ILE 44 44.338 -2.440 -1.862
364 HG12 ILE 44 HG12 ILE 44 46.713 -3.135 -1.448
365 HG13 ILE 44 HG11 ILE 44 46.411 -1.425 -1.187
366 HG21 ILE 44 HG21 ILE 44 44.242 -1.982 1.110
367 HG22 ILE 44 HG22 ILE 44 42.883 -1.899 -0.012
368 HG23 ILE 44 HG23 ILE 44 44.195 -0.726 -0.129
369 HD11 ILE 44 HD11 ILE 44 47.898 -2.331 0.499
370 HD12 ILE 44 HD12 ILE 44 46.684 -3.529 0.949
371 HD13 ILE 44 HD13 ILE 44 46.378 -1.815 1.230
372 H VAL 45 HN VAL 45 42.408 -3.876 1.067
373 HA VAL 45 HA VAL 45 43.896 -4.147 3.464
374 HB VAL 45 HB VAL 45 41.725 -4.272 4.648
375 HG11 VAL 45 HG11 VAL 45 41.848 -2.139 2.528
376 HG12 VAL 45 HG12 VAL 45 42.650 -2.100 4.099
377 HG13 VAL 45 HG13 VAL 45 40.889 -2.064 4.006
378 HG21 VAL 45 HG21 VAL 45 40.453 -5.578 3.051
379 HG22 VAL 45 HG22 VAL 45 40.531 -4.253 1.889
380 HG23 VAL 45 HG23 VAL 45 39.631 -4.053 3.394
381 H ARG 46 HN ARG 46 42.231 -6.375 1.434
382 HA ARG 46 HA ARG 46 42.275 -8.589 3.224
383 HB2 ARG 46 HB2 ARG 46 40.682 -8.624 1.464
384 HB3 ARG 46 HB1 ARG 46 41.904 -8.286 0.252
385 HG2 ARG 46 HG2 ARG 46 42.870 -10.523 0.654
386 HG3 ARG 46 HG1 ARG 46 41.552 -10.852 1.784
387 HD2 ARG 46 HD2 ARG 46 39.922 -10.589 0.040
388 HD3 ARG 46 HD1 ARG 46 41.163 -10.070 -1.097
389 HE ARG 46 HE ARG 46 41.871 -12.601 -0.195
390 HH11 ARG 46 HH11 ARG 46 39.295 -11.096 -2.012
391 HH12 ARG 46 HH12 ARG 46 38.942 -12.500 -2.952
392 HH21 ARG 46 HH21 ARG 46 41.430 -14.486 -1.451
393 HH22 ARG 46 HH22 ARG 46 40.169 -14.440 -2.632
394 H LYS 47 HN LYS 47 44.388 -7.338 0.711
395 HA LYS 47 HA LYS 47 46.074 -9.533 0.421
396 HB2 LYS 47 HB2 LYS 47 46.016 -7.631 -1.141
397 HB3 LYS 47 HB1 LYS 47 46.771 -6.614 0.076
398 HG2 LYS 47 HG2 LYS 47 48.789 -7.945 -0.002
399 HG3 LYS 47 HG1 LYS 47 48.031 -9.076 -1.124
400 HD2 LYS 47 HD2 LYS 47 47.812 -7.278 -2.780
401 HD3 LYS 47 HD1 LYS 47 48.578 -6.155 -1.654
402 HE2 LYS 47 HE2 LYS 47 50.621 -7.480 -1.694
403 HE3 LYS 47 HE1 LYS 47 49.856 -8.655 -2.762
404 HZ1 LYS 47 HZ1 LYS 47 50.322 -5.798 -3.438
405 HZ2 LYS 47 HZ2 LYS 47 49.683 -6.974 -4.465
406 HZ3 LYS 47 HZ3 LYS 47 51.290 -7.084 -3.954
407 H TYR 48 HN TYR 48 46.703 -6.596 2.417
408 HA TYR 48 HA TYR 48 49.048 -7.791 3.502
409 HB2 TYR 48 HB2 TYR 48 49.254 -5.882 4.962
410 HB3 TYR 48 HB1 TYR 48 48.793 -5.329 3.364
411 HD1 TYR 48 HD1 TYR 48 47.515 -5.941 6.799
412 HD2 TYR 48 HD2 TYR 48 46.852 -4.010 3.069
413 HE1 TYR 48 HE1 TYR 48 45.705 -4.620 7.812
414 HE2 TYR 48 HE2 TYR 48 45.040 -2.685 4.072
415 HH TYR 48 HH TYR 48 43.467 -2.888 6.008
416 H LYS 49 HN LYS 49 45.724 -7.836 4.440
417 HA LYS 49 HA LYS 49 46.127 -8.722 7.109
418 HB2 LYS 49 HB2 LYS 49 43.989 -7.744 6.097
419 HB3 LYS 49 HB1 LYS 49 43.727 -9.318 5.366
420 HG2 LYS 49 HG2 LYS 49 44.027 -8.937 8.339
421 HG3 LYS 49 HG1 LYS 49 42.475 -8.827 7.512
422 HD2 LYS 49 HD2 LYS 49 42.804 -11.135 6.672
423 HD3 LYS 49 HD1 LYS 49 44.312 -11.224 7.583
424 HE2 LYS 49 HE2 LYS 49 42.522 -12.300 8.813
425 HE3 LYS 49 HE1 LYS 49 43.067 -10.853 9.659
426 HZ1 LYS 49 HZ1 LYS 49 40.669 -10.986 9.660
427 HZ2 LYS 49 HZ2 LYS 49 40.631 -11.079 7.976
428 HZ3 LYS 49 HZ3 LYS 49 41.156 -9.664 8.728
429 H HIS 50 HN HIS 50 45.346 -10.402 4.080
430 HA HIS 50 HA HIS 50 45.435 -13.013 5.109
431 HB2 HIS 50 HB2 HIS 50 44.403 -12.483 2.950
432 HB3 HIS 50 HB1 HIS 50 45.966 -12.020 2.297
433 HD1 HIS 50 HD1 HIS 50 44.009 -15.065 3.366
434 HD2 HIS 50 HD2 HIS 50 47.510 -14.100 1.337
435 HE1 HIS 50 HE1 HIS 50 44.809 -17.214 2.337
436 H HIS 51 HN HIS 51 47.901 -11.044 3.510
437 HA HIS 51 HA HIS 51 49.927 -12.962 3.414
438 HB2 HIS 51 HB2 HIS 51 49.982 -10.833 2.169
439 HB3 HIS 51 HB1 HIS 51 50.200 -9.961 3.679
440 HD1 HIS 51 HD1 HIS 51 52.552 -9.408 4.197
441 HD2 HIS 51 HD2 HIS 51 52.252 -12.745 1.739
442 HE1 HIS 51 HE1 HIS 51 54.916 -10.051 3.652
443 H GLY 52 HN GLY 52 49.397 -10.420 5.860
444 HA2 GLY 52 HA2 GLY 52 51.603 -11.180 7.454
445 HA3 GLY 52 HA1 GLY 52 50.276 -10.150 7.957
446 H THR 53 HN THR 53 48.183 -12.072 7.628
447 HA THR 53 HA THR 53 48.467 -13.340 10.177
448 HB THR 53 HB THR 53 46.198 -13.748 8.219
449 HG1 THR 53 HG1 THR 53 46.190 -11.594 8.459
450 HG21 THR 53 HG21 THR 53 46.221 -15.242 10.183
451 HG22 THR 53 HG22 THR 53 44.878 -14.102 10.256
452 HG23 THR 53 HG23 THR 53 46.314 -13.837 11.244
453 H THR 54 HN THR 54 48.867 -14.399 6.889
454 HA THR 54 HA THR 54 48.747 -17.211 7.614
455 HB THR 54 HB THR 54 49.564 -15.993 4.956
456 HG1 THR 54 HG1 THR 54 47.493 -15.356 5.236
457 HG21 THR 54 HG21 THR 54 48.521 -18.747 5.649
458 HG22 THR 54 HG22 THR 54 50.199 -18.360 5.266
459 HG23 THR 54 HG23 THR 54 48.948 -18.174 4.036
460 H GLN 55 HN GLN 55 51.060 -14.718 7.517
461 HA GLN 55 HA GLN 55 53.310 -16.515 7.158
462 HB2 GLN 55 HB2 GLN 55 53.308 -14.263 6.124
463 HB3 GLN 55 HB1 GLN 55 53.282 -13.550 7.729
464 HG2 GLN 55 HG2 GLN 55 55.452 -14.456 8.220
465 HG3 GLN 55 HG1 GLN 55 55.469 -15.336 6.692
466 HE21 GLN 55 HE21 GLN 55 57.316 -13.336 7.716
467 HE22 GLN 55 HE22 GLN 55 57.345 -12.065 6.546
468 H HIS 56 HN HIS 56 53.659 -17.770 8.864
469 HA HIS 56 HA HIS 56 53.894 -16.490 11.512
470 HB2 HIS 56 HB2 HIS 56 52.966 -19.266 10.774
471 HB3 HIS 56 HB1 HIS 56 53.496 -18.864 12.396
472 HD1 HIS 56 HD1 HIS 56 50.524 -19.176 10.506
473 HD2 HIS 56 HD2 HIS 56 51.863 -16.479 13.373
474 HE1 HIS 56 HE1 HIS 56 48.457 -18.104 11.436
475 H HIS 57 HN HIS 57 55.023 -19.321 9.686
476 HA HIS 57 HA HIS 57 57.674 -18.931 10.889
477 HB2 HIS 57 HB2 HIS 57 56.310 -21.480 10.014
478 HB3 HIS 57 HB1 HIS 57 58.021 -21.384 10.410
479 HD1 HIS 57 HD1 HIS 57 54.865 -22.167 11.885
480 HD2 HIS 57 HD2 HIS 57 58.361 -20.361 13.214
481 HE1 HIS 57 HE1 HIS 57 54.781 -22.307 14.387
Start of MODEL 5
1 H1 ALA 1 HT1 ALA 1 63.239 6.853 5.366
2 H2 ALA 1 HT2 ALA 1 64.143 5.492 4.958
3 H3 ALA 1 HT3 ALA 1 62.549 5.313 5.490
4 HA ALA 1 HA ALA 1 63.462 6.598 2.992
5 HB1 ALA 1 HB1 ALA 1 63.598 4.146 2.983
6 HB2 ALA 1 HB2 ALA 1 62.393 4.755 1.849
7 HB3 ALA 1 HB3 ALA 1 61.884 4.061 3.388
8 H SER 2 HN SER 2 60.801 5.992 5.224
9 HA SER 2 HA SER 2 58.870 7.207 3.462
10 HB2 SER 2 HB2 SER 2 58.605 6.316 6.342
11 HB3 SER 2 HB1 SER 2 57.277 6.805 5.290
12 HG SER 2 HG SER 2 58.051 5.029 3.856
13 H MET 3 HN MET 3 61.274 8.560 5.227
14 HA MET 3 HA MET 3 59.825 10.678 6.514
15 HB2 MET 3 HB2 MET 3 62.764 10.364 5.897
16 HB3 MET 3 HB1 MET 3 62.107 11.775 6.695
17 HG2 MET 3 HG2 MET 3 61.260 10.310 8.495
18 HG3 MET 3 HG1 MET 3 62.051 8.949 7.707
19 HE1 MET 3 HE1 MET 3 64.777 10.313 6.651
20 HE2 MET 3 HE2 MET 3 64.679 8.728 7.413
21 HE3 MET 3 HE3 MET 3 65.842 9.916 7.999
22 H GLY 4 HN GLY 4 61.446 10.257 3.431
23 HA2 GLY 4 HA2 GLY 4 61.141 13.037 2.700
24 HA3 GLY 4 HA1 GLY 4 61.775 11.752 1.684
25 H LYS 5 HN LYS 5 58.670 12.122 3.341
26 HA LYS 5 HA LYS 5 56.524 12.169 2.663
27 HB2 LYS 5 HB2 LYS 5 57.685 13.119 0.053
28 HB3 LYS 5 HB1 LYS 5 55.966 13.080 0.417
29 HG2 LYS 5 HG2 LYS 5 56.448 14.589 2.361
30 HG3 LYS 5 HG1 LYS 5 58.088 14.752 1.728
31 HD2 LYS 5 HD2 LYS 5 55.549 15.445 0.253
32 HD3 LYS 5 HD1 LYS 5 56.651 16.598 1.001
33 HE2 LYS 5 HE2 LYS 5 58.438 15.836 -0.508
34 HE3 LYS 5 HE1 LYS 5 57.303 14.720 -1.268
35 HZ1 LYS 5 HZ1 LYS 5 57.085 17.676 -1.225
36 HZ2 LYS 5 HZ2 LYS 5 55.947 16.631 -1.903
37 HZ3 LYS 5 HZ3 LYS 5 57.500 16.729 -2.561
38 H SER 6 HN SER 6 55.537 10.319 2.622
39 HA SER 6 HA SER 6 56.288 8.219 0.830
40 HB2 SER 6 HB2 SER 6 54.189 7.132 1.895
41 HB3 SER 6 HB1 SER 6 55.578 7.445 2.935
42 HG SER 6 HG SER 6 54.534 9.110 3.867
43 H LYS 7 HN LYS 7 55.865 8.686 -1.268
44 HA LYS 7 HA LYS 7 53.178 8.691 -2.192
45 HB2 LYS 7 HB2 LYS 7 53.226 11.007 -1.432
46 HB3 LYS 7 HB1 LYS 7 54.687 11.306 -2.360
47 HG2 LYS 7 HG2 LYS 7 52.810 12.251 -3.515
48 HG3 LYS 7 HG1 LYS 7 53.412 10.870 -4.433
49 HD2 LYS 7 HD2 LYS 7 51.628 9.474 -3.478
50 HD3 LYS 7 HD1 LYS 7 51.019 10.873 -2.591
51 HE2 LYS 7 HE2 LYS 7 49.703 10.564 -4.588
52 HE3 LYS 7 HE1 LYS 7 50.664 12.033 -4.744
53 HZ1 LYS 7 HZ1 LYS 7 52.283 10.715 -6.052
54 HZ2 LYS 7 HZ2 LYS 7 50.766 10.829 -6.778
55 HZ3 LYS 7 HZ3 LYS 7 51.216 9.400 -6.004
56 H GLU 8 HN GLU 8 56.557 9.456 -2.932
57 HA GLU 8 HA GLU 8 56.240 9.231 -5.745
58 HB2 GLU 8 HB2 GLU 8 58.066 10.523 -4.690
59 HB3 GLU 8 HB1 GLU 8 58.784 9.016 -4.136
60 HG2 GLU 8 HG2 GLU 8 59.150 8.303 -6.411
61 HG3 GLU 8 HG1 GLU 8 58.321 9.731 -7.023
62 H ILE 9 HN ILE 9 57.789 7.060 -3.388
63 HA ILE 9 HA ILE 9 58.136 5.009 -5.348
64 HB ILE 9 HB ILE 9 58.351 4.844 -2.333
65 HG12 ILE 9 HG12 ILE 9 59.929 6.450 -3.196
66 HG13 ILE 9 HG11 ILE 9 60.800 4.983 -2.765
67 HG21 ILE 9 HG21 ILE 9 58.028 2.649 -3.345
68 HG22 ILE 9 HG22 ILE 9 59.667 2.822 -2.718
69 HG23 ILE 9 HG23 ILE 9 59.367 2.956 -4.451
70 HD11 ILE 9 HD11 ILE 9 60.788 4.334 -5.150
71 HD12 ILE 9 HD12 ILE 9 61.645 5.842 -4.835
72 HD13 ILE 9 HD13 ILE 9 60.027 5.878 -5.534
73 H SER 10 HN SER 10 56.652 3.682 -6.056
74 HA SER 10 HA SER 10 54.004 3.727 -5.308
75 HB2 SER 10 HB2 SER 10 55.495 1.506 -6.703
76 HB3 SER 10 HB1 SER 10 53.744 1.710 -6.684
77 HG SER 10 HG SER 10 55.623 2.964 -8.209
78 H GLN 11 HN GLN 11 56.488 1.385 -4.256
79 HA GLN 11 HA GLN 11 54.644 -0.190 -2.766
80 HB2 GLN 11 HB2 GLN 11 56.855 -1.025 -3.537
81 HB3 GLN 11 HB1 GLN 11 57.630 0.032 -2.365
82 HG2 GLN 11 HG2 GLN 11 56.534 -1.164 -0.546
83 HG3 GLN 11 HG1 GLN 11 55.733 -2.214 -1.714
84 HE21 GLN 11 HE21 GLN 11 58.704 -1.417 -0.149
85 HE22 GLN 11 HE22 GLN 11 59.589 -2.811 -0.654
86 H ASP 12 HN ASP 12 56.703 2.534 -1.981
87 HA ASP 12 HA ASP 12 56.286 2.493 0.826
88 HB2 ASP 12 HB2 ASP 12 58.156 3.694 -0.291
89 HB3 ASP 12 HB1 ASP 12 56.992 4.821 -0.974
90 H LEU 13 HN LEU 13 54.680 4.101 -1.871
91 HA LEU 13 HA LEU 13 52.736 5.485 -0.319
92 HB2 LEU 13 HB2 LEU 13 53.235 6.200 -2.573
93 HB3 LEU 13 HB1 LEU 13 52.789 4.635 -3.217
94 HG LEU 13 HG LEU 13 50.438 5.063 -2.564
95 HD11 LEU 13 HD11 LEU 13 49.756 7.314 -1.928
96 HD12 LEU 13 HD12 LEU 13 51.444 7.814 -1.857
97 HD13 LEU 13 HD13 LEU 13 50.835 6.608 -0.725
98 HD21 LEU 13 HD21 LEU 13 51.226 5.557 -4.821
99 HD22 LEU 13 HD22 LEU 13 51.668 7.187 -4.314
100 HD23 LEU 13 HD23 LEU 13 49.976 6.689 -4.311
101 H ARG 14 HN ARG 14 52.916 2.310 -1.791
102 HA ARG 14 HA ARG 14 50.249 1.488 -1.399
103 HB2 ARG 14 HB2 ARG 14 52.069 0.361 -2.792
104 HB3 ARG 14 HB1 ARG 14 52.687 -0.292 -1.284
105 HG2 ARG 14 HG2 ARG 14 50.525 -1.421 -0.922
106 HG3 ARG 14 HG1 ARG 14 49.977 -0.814 -2.488
107 HD2 ARG 14 HD2 ARG 14 51.998 -1.947 -3.493
108 HD3 ARG 14 HD1 ARG 14 52.237 -2.724 -1.931
109 HE ARG 14 HE ARG 14 49.714 -3.038 -3.414
110 HH11 ARG 14 HH11 ARG 14 52.509 -4.471 -1.824
111 HH12 ARG 14 HH12 ARG 14 51.948 -6.092 -2.047
112 HH21 ARG 14 HH21 ARG 14 48.995 -5.187 -3.702
113 HH22 ARG 14 HH22 ARG 14 49.954 -6.502 -3.110
114 H LYS 15 HN LYS 15 53.102 1.497 0.625
115 HA LYS 15 HA LYS 15 51.903 0.108 2.811
116 HB2 LYS 15 HB2 LYS 15 54.385 0.275 2.329
117 HB3 LYS 15 HB1 LYS 15 54.312 1.947 2.848
118 HG2 LYS 15 HG2 LYS 15 53.404 -0.235 4.687
119 HG3 LYS 15 HG1 LYS 15 55.120 0.107 4.492
120 HD2 LYS 15 HD2 LYS 15 54.638 2.484 5.096
121 HD3 LYS 15 HD1 LYS 15 52.975 2.006 5.445
122 HE2 LYS 15 HE2 LYS 15 53.779 0.438 7.142
123 HE3 LYS 15 HE1 LYS 15 55.441 0.883 6.774
124 HZ1 LYS 15 HZ1 LYS 15 53.356 2.647 7.966
125 HZ2 LYS 15 HZ2 LYS 15 54.880 3.176 7.459
126 HZ3 LYS 15 HZ3 LYS 15 54.757 2.056 8.711
127 H LYS 16 HN LYS 16 52.256 3.442 1.809
128 HA LYS 16 HA LYS 16 51.487 4.764 4.151
129 HB2 LYS 16 HB2 LYS 16 52.441 5.871 2.161
130 HB3 LYS 16 HB1 LYS 16 50.939 5.580 1.297
131 HG2 LYS 16 HG2 LYS 16 49.809 6.925 3.144
132 HG3 LYS 16 HG1 LYS 16 51.439 7.431 3.603
133 HD2 LYS 16 HD2 LYS 16 51.763 8.148 1.208
134 HD3 LYS 16 HD1 LYS 16 50.036 7.873 0.976
135 HE2 LYS 16 HE2 LYS 16 50.427 10.210 1.419
136 HE3 LYS 16 HE1 LYS 16 49.574 9.491 2.783
137 HZ1 LYS 16 HZ1 LYS 16 52.515 9.789 2.736
138 HZ2 LYS 16 HZ2 LYS 16 51.522 9.496 4.072
139 HZ3 LYS 16 HZ3 LYS 16 51.498 11.006 3.314
140 H ILE 17 HN ILE 17 49.475 3.729 1.384
141 HA ILE 17 HA ILE 17 47.041 4.653 2.461
142 HB ILE 17 HB ILE 17 47.329 4.094 0.057
143 HG12 ILE 17 HG12 ILE 17 45.089 2.554 1.390
144 HG13 ILE 17 HG11 ILE 17 45.075 4.277 1.028
145 HG21 ILE 17 HG21 ILE 17 48.627 2.052 0.279
146 HG22 ILE 17 HG22 ILE 17 47.189 1.777 -0.704
147 HG23 ILE 17 HG23 ILE 17 47.231 1.226 0.971
148 HD11 ILE 17 HD11 ILE 17 43.786 3.021 -0.601
149 HD12 ILE 17 HD12 ILE 17 45.205 2.049 -0.993
150 HD13 ILE 17 HD13 ILE 17 45.190 3.774 -1.359
151 H VAL 18 HN VAL 18 48.863 1.768 3.027
152 HA VAL 18 HA VAL 18 46.745 0.384 4.407
153 HB VAL 18 HB VAL 18 49.718 -0.156 4.195
154 HG11 VAL 18 HG11 VAL 18 47.581 -1.857 5.466
155 HG12 VAL 18 HG12 VAL 18 48.879 -1.015 6.313
156 HG13 VAL 18 HG13 VAL 18 49.259 -2.332 5.202
157 HG21 VAL 18 HG21 VAL 18 47.331 -1.522 2.956
158 HG22 VAL 18 HG22 VAL 18 49.011 -2.027 2.777
159 HG23 VAL 18 HG23 VAL 18 48.481 -0.477 2.122
160 H ASP 19 HN ASP 19 49.585 2.284 5.238
161 HA ASP 19 HA ASP 19 49.537 1.941 8.030
162 HB2 ASP 19 HB2 ASP 19 51.425 2.904 6.692
163 HB3 ASP 19 HB1 ASP 19 50.474 4.372 6.497
164 H LEU 20 HN LEU 20 48.210 4.468 5.952
165 HA LEU 20 HA LEU 20 46.975 5.902 8.050
166 HB2 LEU 20 HB2 LEU 20 46.398 5.880 5.088
167 HB3 LEU 20 HB1 LEU 20 45.733 7.041 6.219
168 HG LEU 20 HG LEU 20 48.639 6.714 5.467
169 HD11 LEU 20 HD11 LEU 20 46.689 8.960 5.018
170 HD12 LEU 20 HD12 LEU 20 47.332 7.866 3.793
171 HD13 LEU 20 HD13 LEU 20 48.405 8.996 4.620
172 HD21 LEU 20 HD21 LEU 20 48.514 7.244 7.824
173 HD22 LEU 20 HD22 LEU 20 47.376 8.552 7.498
174 HD23 LEU 20 HD23 LEU 20 49.039 8.667 6.922
175 H HIS 21 HN HIS 21 46.146 3.040 6.404
176 HA HIS 21 HA HIS 21 43.334 3.056 6.866
177 HB2 HIS 21 HB2 HIS 21 45.276 1.270 5.734
178 HB3 HIS 21 HB1 HIS 21 44.279 0.386 6.882
179 HD1 HIS 21 HD1 HIS 21 44.074 2.340 3.697
180 HD2 HIS 21 HD2 HIS 21 41.708 -0.127 6.053
181 HE1 HIS 21 HE1 HIS 21 42.009 1.902 2.335
182 H LYS 22 HN LYS 22 46.149 1.839 8.611
183 HA LYS 22 HA LYS 22 44.593 0.742 10.762
184 HB2 LYS 22 HB2 LYS 22 47.555 1.327 10.600
185 HB3 LYS 22 HB1 LYS 22 46.772 0.388 11.862
186 HG2 LYS 22 HG2 LYS 22 46.940 -0.330 8.942
187 HG3 LYS 22 HG1 LYS 22 47.846 -1.069 10.261
188 HD2 LYS 22 HD2 LYS 22 44.838 -1.121 9.961
189 HD3 LYS 22 HD1 LYS 22 45.929 -2.441 9.556
190 HE2 LYS 22 HE2 LYS 22 46.665 -2.527 11.898
191 HE3 LYS 22 HE1 LYS 22 45.521 -1.245 12.291
192 HZ1 LYS 22 HZ1 LYS 22 43.722 -2.693 11.580
193 HZ2 LYS 22 HZ2 LYS 22 44.611 -3.406 12.822
194 HZ3 LYS 22 HZ3 LYS 22 44.820 -3.928 11.230
195 H SER 23 HN SER 23 45.583 3.811 9.891
196 HA SER 23 HA SER 23 45.864 4.922 12.509
197 HB2 SER 23 HB2 SER 23 45.329 6.293 9.867
198 HB3 SER 23 HB1 SER 23 45.860 7.077 11.354
199 HG SER 23 HG SER 23 47.314 5.065 9.945
200 H GLY 24 HN GLY 24 43.255 4.341 10.273
201 HA2 GLY 24 HA2 GLY 24 40.990 4.231 10.766
202 HA3 GLY 24 HA1 GLY 24 41.331 4.898 12.354
203 H SER 25 HN SER 25 42.275 7.279 12.080
204 HA SER 25 HA SER 25 40.060 8.790 11.083
205 HB2 SER 25 HB2 SER 25 41.452 10.724 11.946
206 HB3 SER 25 HB1 SER 25 41.029 9.488 13.132
207 HG SER 25 HG SER 25 43.385 10.339 12.737
208 H SER 26 HN SER 26 42.540 7.505 9.432
209 HA SER 26 HA SER 26 42.857 9.835 7.675
210 HB2 SER 26 HB2 SER 26 44.618 7.388 7.864
211 HB3 SER 26 HB1 SER 26 44.942 8.855 6.937
212 HG SER 26 HG SER 26 44.735 9.917 9.113
213 H LEU 27 HN LEU 27 40.805 7.457 7.845
214 HA LEU 27 HA LEU 27 41.127 5.997 5.425
215 HB2 LEU 27 HB2 LEU 27 39.055 6.254 7.500
216 HB3 LEU 27 HB1 LEU 27 38.456 5.831 5.911
217 HG LEU 27 HG LEU 27 38.836 3.858 7.327
218 HD11 LEU 27 HD11 LEU 27 40.108 2.550 5.714
219 HD12 LEU 27 HD12 LEU 27 40.703 4.034 4.971
220 HD13 LEU 27 HD13 LEU 27 38.984 3.645 4.911
221 HD21 LEU 27 HD21 LEU 27 41.114 3.159 7.874
222 HD22 LEU 27 HD22 LEU 27 40.704 4.689 8.651
223 HD23 LEU 27 HD23 LEU 27 41.737 4.675 7.222
224 H GLY 28 HN GLY 28 39.004 8.707 6.290
225 HA2 GLY 28 HA2 GLY 28 37.848 8.989 3.725
226 HA3 GLY 28 HA1 GLY 28 37.871 10.218 4.981
227 H ALA 29 HN ALA 29 40.836 10.066 5.069
228 HA ALA 29 HA ALA 29 41.394 12.169 3.284
229 HB1 ALA 29 HB1 ALA 29 43.708 11.940 4.025
230 HB2 ALA 29 HB2 ALA 29 43.325 10.386 4.767
231 HB3 ALA 29 HB3 ALA 29 42.600 11.865 5.395
232 H ILE 30 HN ILE 30 42.767 8.878 3.341
233 HA ILE 30 HA ILE 30 43.947 9.054 0.795
234 HB ILE 30 HB ILE 30 43.989 6.520 0.892
235 HG12 ILE 30 HG12 ILE 30 42.758 7.045 3.611
236 HG13 ILE 30 HG11 ILE 30 41.996 6.188 2.278
237 HG21 ILE 30 HG21 ILE 30 45.854 7.870 1.628
238 HG22 ILE 30 HG22 ILE 30 45.652 6.481 2.696
239 HG23 ILE 30 HG23 ILE 30 45.108 8.076 3.213
240 HD11 ILE 30 HD11 ILE 30 44.466 5.293 3.743
241 HD12 ILE 30 HD12 ILE 30 43.633 4.414 2.459
242 HD13 ILE 30 HD13 ILE 30 42.835 4.683 4.007
243 H SER 31 HN SER 31 40.760 7.986 1.800
244 HA SER 31 HA SER 31 40.000 6.711 -0.574
245 HB2 SER 31 HB2 SER 31 38.788 6.449 1.555
246 HB3 SER 31 HB1 SER 31 38.250 8.123 1.455
247 HG SER 31 HG SER 31 36.646 7.383 0.352
248 H LYS 32 HN LYS 32 39.686 10.111 0.430
249 HA LYS 32 HA LYS 32 38.373 10.704 -2.100
250 HB2 LYS 32 HB2 LYS 32 37.497 11.675 -0.001
251 HB3 LYS 32 HB1 LYS 32 38.996 12.573 0.184
252 HG2 LYS 32 HG2 LYS 32 38.559 13.828 -1.821
253 HG3 LYS 32 HG1 LYS 32 37.132 12.851 -2.163
254 HD2 LYS 32 HD2 LYS 32 37.494 14.639 0.244
255 HD3 LYS 32 HD1 LYS 32 36.554 15.040 -1.194
256 HE2 LYS 32 HE2 LYS 32 36.007 12.784 0.743
257 HE3 LYS 32 HE1 LYS 32 35.089 14.276 0.584
258 HZ1 LYS 32 HZ1 LYS 32 34.495 13.614 -1.673
259 HZ2 LYS 32 HZ2 LYS 32 33.980 12.473 -0.543
260 HZ3 LYS 32 HZ3 LYS 32 35.339 12.161 -1.488
261 H ARG 33 HN ARG 33 41.367 11.546 -0.392
262 HA ARG 33 HA ARG 33 42.305 13.453 -2.228
263 HB2 ARG 33 HB2 ARG 33 43.235 13.156 0.027
264 HB3 ARG 33 HB1 ARG 33 43.898 11.602 -0.453
265 HG2 ARG 33 HG2 ARG 33 45.323 12.722 -2.091
266 HG3 ARG 33 HG1 ARG 33 44.665 14.281 -1.588
267 HD2 ARG 33 HD2 ARG 33 45.485 13.849 0.692
268 HD3 ARG 33 HD1 ARG 33 46.208 12.345 0.127
269 HE ARG 33 HE ARG 33 47.350 14.068 -1.517
270 HH11 ARG 33 HH11 ARG 33 46.816 14.298 1.940
271 HH12 ARG 33 HH12 ARG 33 48.215 15.262 2.229
272 HH21 ARG 33 HH21 ARG 33 49.219 15.355 -1.144
273 HH22 ARG 33 HH22 ARG 33 49.588 15.885 0.458
274 H LEU 34 HN LEU 34 43.221 10.026 -1.926
275 HA LEU 34 HA LEU 34 44.597 10.084 -4.448
276 HB2 LEU 34 HB2 LEU 34 43.806 7.718 -2.746
277 HB3 LEU 34 HB1 LEU 34 44.949 7.698 -4.075
278 HG LEU 34 HG LEU 34 45.323 9.164 -1.461
279 HD11 LEU 34 HD11 LEU 34 46.631 6.668 -2.528
280 HD12 LEU 34 HD12 LEU 34 45.467 6.750 -1.205
281 HD13 LEU 34 HD13 LEU 34 47.055 7.498 -1.030
282 HD21 LEU 34 HD21 LEU 34 47.607 9.559 -2.261
283 HD22 LEU 34 HD22 LEU 34 46.415 10.321 -3.312
284 HD23 LEU 34 HD23 LEU 34 47.193 8.818 -3.806
285 H LYS 35 HN LYS 35 41.462 9.264 -3.253
286 HA LYS 35 HA LYS 35 39.512 8.640 -4.188
287 HB2 LYS 35 HB2 LYS 35 40.082 10.746 -5.514
288 HB3 LYS 35 HB1 LYS 35 40.602 9.675 -6.807
289 HG2 LYS 35 HG2 LYS 35 38.376 8.761 -7.013
290 HG3 LYS 35 HG1 LYS 35 37.830 9.690 -5.617
291 HD2 LYS 35 HD2 LYS 35 37.105 10.766 -7.664
292 HD3 LYS 35 HD1 LYS 35 38.305 11.771 -6.852
293 HE2 LYS 35 HE2 LYS 35 40.034 10.889 -8.366
294 HE3 LYS 35 HE1 LYS 35 38.804 9.931 -9.191
295 HZ1 LYS 35 HZ1 LYS 35 39.281 11.985 -10.366
296 HZ2 LYS 35 HZ2 LYS 35 38.850 12.893 -9.007
297 HZ3 LYS 35 HZ3 LYS 35 37.688 11.974 -9.812
298 H VAL 36 HN VAL 36 41.579 6.702 -4.072
299 HA VAL 36 HA VAL 36 41.579 5.120 -6.441
300 HB VAL 36 HB VAL 36 42.201 4.299 -3.585
301 HG11 VAL 36 HG11 VAL 36 41.737 2.377 -5.020
302 HG12 VAL 36 HG12 VAL 36 43.444 2.443 -4.579
303 HG13 VAL 36 HG13 VAL 36 42.927 2.953 -6.186
304 HG21 VAL 36 HG21 VAL 36 44.546 4.625 -4.189
305 HG22 VAL 36 HG22 VAL 36 43.628 6.124 -4.352
306 HG23 VAL 36 HG23 VAL 36 44.059 5.193 -5.786
307 HA PRO 37 HA PRO 37 37.444 3.469 -6.164
308 HB2 PRO 37 HB2 PRO 37 38.137 0.978 -7.292
309 HB3 PRO 37 HB1 PRO 37 37.547 2.393 -8.167
310 HG2 PRO 37 HG2 PRO 37 40.337 1.427 -7.787
311 HG3 PRO 37 HG1 PRO 37 39.608 2.244 -9.181
312 HD2 PRO 37 HD2 PRO 37 41.244 3.533 -7.515
313 HD3 PRO 37 HD1 PRO 37 39.830 4.345 -8.219
314 H ARG 38 HN ARG 38 36.471 2.503 -4.500
315 HA ARG 38 HA ARG 38 37.952 1.440 -2.381
316 HB2 ARG 38 HB2 ARG 38 35.775 0.828 -1.372
317 HB3 ARG 38 HB1 ARG 38 35.862 2.492 -1.923
318 HG2 ARG 38 HG2 ARG 38 34.641 1.779 -3.986
319 HG3 ARG 38 HG1 ARG 38 34.420 0.202 -3.227
320 HD2 ARG 38 HD2 ARG 38 32.466 1.656 -2.907
321 HD3 ARG 38 HD1 ARG 38 33.232 1.227 -1.376
322 HE ARG 38 HE ARG 38 34.363 3.621 -2.146
323 HH11 ARG 38 HH11 ARG 38 31.130 2.481 -1.360
324 HH12 ARG 38 HH12 ARG 38 30.592 4.018 -0.783
325 HH21 ARG 38 HH21 ARG 38 33.658 5.647 -1.360
326 HH22 ARG 38 HH22 ARG 38 32.034 5.832 -0.786
327 H SER 39 HN SER 39 36.624 -0.151 -5.150
328 HA SER 39 HA SER 39 36.678 -2.787 -4.092
329 HB2 SER 39 HB2 SER 39 36.978 -1.892 -6.973
330 HB3 SER 39 HB1 SER 39 36.560 -3.516 -6.426
331 HG SER 39 HG SER 39 34.965 -1.372 -6.796
332 H SER 40 HN SER 40 39.043 -0.748 -5.744
333 HA SER 40 HA SER 40 41.073 -2.739 -5.921
334 HB2 SER 40 HB2 SER 40 41.046 -0.741 -7.390
335 HB3 SER 40 HB1 SER 40 41.314 0.289 -5.986
336 HG SER 40 HG SER 40 43.107 -1.805 -6.526
337 H VAL 41 HN VAL 41 40.160 -0.273 -3.608
338 HA VAL 41 HA VAL 41 42.386 -0.553 -1.884
339 HB VAL 41 HB VAL 41 39.569 0.344 -1.218
340 HG11 VAL 41 HG11 VAL 41 42.155 0.790 0.263
341 HG12 VAL 41 HG12 VAL 41 40.836 -0.264 0.770
342 HG13 VAL 41 HG13 VAL 41 40.589 1.480 0.688
343 HG21 VAL 41 HG21 VAL 41 40.446 2.619 -1.482
344 HG22 VAL 41 HG22 VAL 41 40.548 1.700 -2.984
345 HG23 VAL 41 HG23 VAL 41 41.994 1.955 -2.007
346 H GLN 42 HN GLN 42 39.191 -2.046 -1.989
347 HA GLN 42 HA GLN 42 39.323 -3.519 0.383
348 HB2 GLN 42 HB2 GLN 42 37.240 -3.202 -0.803
349 HB3 GLN 42 HB1 GLN 42 37.850 -4.085 -2.193
350 HG2 GLN 42 HG2 GLN 42 37.981 -6.116 -0.805
351 HG3 GLN 42 HG1 GLN 42 37.278 -5.210 0.535
352 HE21 GLN 42 HE21 GLN 42 35.128 -4.617 0.448
353 HE22 GLN 42 HE22 GLN 42 34.020 -5.332 -0.667
354 H THR 43 HN THR 43 40.378 -4.393 -2.897
355 HA THR 43 HA THR 43 40.982 -7.056 -2.133
356 HB THR 43 HB THR 43 40.490 -6.512 -4.480
357 HG1 THR 43 HG1 THR 43 42.426 -8.089 -3.576
358 HG21 THR 43 HG21 THR 43 43.200 -5.175 -4.488
359 HG22 THR 43 HG22 THR 43 41.649 -4.344 -4.603
360 HG23 THR 43 HG23 THR 43 42.163 -5.433 -5.891
361 H ILE 44 HN ILE 44 42.869 -4.072 -2.111
362 HA ILE 44 HA ILE 44 45.306 -5.533 -1.683
363 HB ILE 44 HB ILE 44 46.426 -3.377 -1.354
364 HG12 ILE 44 HG12 ILE 44 44.789 -1.350 -2.050
365 HG13 ILE 44 HG11 ILE 44 43.640 -2.355 -1.175
366 HG21 ILE 44 HG21 ILE 44 44.594 -3.420 -3.737
367 HG22 ILE 44 HG22 ILE 44 46.159 -4.218 -3.594
368 HG23 ILE 44 HG23 ILE 44 46.063 -2.456 -3.589
369 HD11 ILE 44 HD11 ILE 44 46.240 -1.285 -0.093
370 HD12 ILE 44 HD12 ILE 44 45.097 -2.298 0.789
371 HD13 ILE 44 HD13 ILE 44 44.626 -0.678 0.275
372 H VAL 45 HN VAL 45 42.914 -3.952 0.344
373 HA VAL 45 HA VAL 45 44.487 -4.220 2.717
374 HB VAL 45 HB VAL 45 42.429 -3.715 3.981
375 HG11 VAL 45 HG11 VAL 45 43.756 -1.881 3.128
376 HG12 VAL 45 HG12 VAL 45 42.041 -1.468 3.111
377 HG13 VAL 45 HG13 VAL 45 42.856 -1.915 1.611
378 HG21 VAL 45 HG21 VAL 45 40.348 -3.177 2.795
379 HG22 VAL 45 HG22 VAL 45 40.794 -4.877 2.639
380 HG23 VAL 45 HG23 VAL 45 41.073 -3.766 1.299
381 H ARG 46 HN ARG 46 42.227 -6.237 0.999
382 HA ARG 46 HA ARG 46 41.712 -8.137 2.999
383 HB2 ARG 46 HB2 ARG 46 40.495 -8.011 0.848
384 HB3 ARG 46 HB1 ARG 46 41.938 -8.563 0.012
385 HG2 ARG 46 HG2 ARG 46 41.822 -10.677 1.292
386 HG3 ARG 46 HG1 ARG 46 40.309 -10.118 2.009
387 HD2 ARG 46 HD2 ARG 46 40.829 -10.521 -0.932
388 HD3 ARG 46 HD1 ARG 46 39.918 -11.612 0.108
389 HE ARG 46 HE ARG 46 38.411 -9.587 0.454
390 HH11 ARG 46 HH11 ARG 46 40.189 -10.156 -2.521
391 HH12 ARG 46 HH12 ARG 46 39.007 -9.403 -3.531
392 HH21 ARG 46 HH21 ARG 46 36.830 -8.580 -0.894
393 HH22 ARG 46 HH22 ARG 46 37.094 -8.494 -2.600
394 H LYS 47 HN LYS 47 44.264 -7.934 0.557
395 HA LYS 47 HA LYS 47 45.585 -10.327 1.265
396 HB2 LYS 47 HB2 LYS 47 46.732 -7.840 -0.021
397 HB3 LYS 47 HB1 LYS 47 47.490 -9.425 0.001
398 HG2 LYS 47 HG2 LYS 47 45.579 -10.313 -1.294
399 HG3 LYS 47 HG1 LYS 47 44.922 -8.678 -1.379
400 HD2 LYS 47 HD2 LYS 47 46.930 -7.926 -2.551
401 HD3 LYS 47 HD1 LYS 47 47.605 -9.554 -2.451
402 HE2 LYS 47 HE2 LYS 47 45.662 -10.387 -3.747
403 HE3 LYS 47 HE1 LYS 47 45.105 -8.724 -3.919
404 HZ1 LYS 47 HZ1 LYS 47 46.335 -9.486 -5.860
405 HZ2 LYS 47 HZ2 LYS 47 47.697 -9.776 -4.907
406 HZ3 LYS 47 HZ3 LYS 47 47.131 -8.195 -5.109
407 H TYR 48 HN TYR 48 45.890 -6.980 2.364
408 HA TYR 48 HA TYR 48 48.168 -7.362 3.929
409 HB2 TYR 48 HB2 TYR 48 47.645 -5.154 3.330
410 HB3 TYR 48 HB1 TYR 48 45.976 -5.314 3.863
411 HD1 TYR 48 HD1 TYR 48 49.434 -5.503 5.228
412 HD2 TYR 48 HD2 TYR 48 45.386 -4.403 5.856
413 HE1 TYR 48 HE1 TYR 48 50.038 -4.574 7.403
414 HE2 TYR 48 HE2 TYR 48 45.948 -3.470 8.014
415 HH TYR 48 HH TYR 48 49.112 -2.800 8.942
416 H LYS 49 HN LYS 49 44.691 -7.483 4.665
417 HA LYS 49 HA LYS 49 44.965 -7.921 7.421
418 HB2 LYS 49 HB2 LYS 49 42.773 -8.733 5.518
419 HB3 LYS 49 HB1 LYS 49 42.675 -8.948 7.259
420 HG2 LYS 49 HG2 LYS 49 42.909 -6.523 7.563
421 HG3 LYS 49 HG1 LYS 49 42.971 -6.322 5.811
422 HD2 LYS 49 HD2 LYS 49 40.734 -5.854 6.604
423 HD3 LYS 49 HD1 LYS 49 40.724 -7.339 5.649
424 HE2 LYS 49 HE2 LYS 49 40.801 -8.650 7.738
425 HE3 LYS 49 HE1 LYS 49 40.751 -7.151 8.660
426 HZ1 LYS 49 HZ1 LYS 49 38.660 -8.105 6.795
427 HZ2 LYS 49 HZ2 LYS 49 38.595 -6.678 7.684
428 HZ3 LYS 49 HZ3 LYS 49 38.568 -8.167 8.478
429 H HIS 50 HN HIS 50 45.047 -10.133 4.690
430 HA HIS 50 HA HIS 50 45.054 -12.503 6.228
431 HB2 HIS 50 HB2 HIS 50 44.685 -12.430 3.747
432 HB3 HIS 50 HB1 HIS 50 46.401 -12.090 3.546
433 HD1 HIS 50 HD1 HIS 50 47.522 -14.162 2.778
434 HD2 HIS 50 HD2 HIS 50 44.585 -14.958 5.598
435 HE1 HIS 50 HE1 HIS 50 47.619 -16.637 3.165
436 H HIS 51 HN HIS 51 47.631 -10.372 5.066
437 HA HIS 51 HA HIS 51 49.778 -11.851 6.199
438 HB2 HIS 51 HB2 HIS 51 49.536 -8.926 5.452
439 HB3 HIS 51 HB1 HIS 51 51.023 -9.635 6.069
440 HD1 HIS 51 HD1 HIS 51 49.848 -8.567 3.019
441 HD2 HIS 51 HD2 HIS 51 51.418 -12.209 4.266
442 HE1 HIS 51 HE1 HIS 51 50.677 -9.683 0.941
443 H GLY 52 HN GLY 52 47.523 -9.503 7.415
444 HA2 GLY 52 HA2 GLY 52 48.818 -9.015 9.899
445 HA3 GLY 52 HA1 GLY 52 47.140 -8.661 9.513
446 H THR 53 HN THR 53 47.241 -11.695 8.678
447 HA THR 53 HA THR 53 46.375 -12.656 11.287
448 HB THR 53 HB THR 53 46.160 -14.079 8.623
449 HG1 THR 53 HG1 THR 53 45.084 -11.934 8.723
450 HG21 THR 53 HG21 THR 53 44.322 -15.270 9.736
451 HG22 THR 53 HG22 THR 53 44.619 -14.348 11.209
452 HG23 THR 53 HG23 THR 53 45.837 -15.475 10.615
453 H THR 54 HN THR 54 48.741 -13.237 8.745
454 HA THR 54 HA THR 54 49.854 -15.543 10.061
455 HB THR 54 HB THR 54 51.590 -15.321 8.195
456 HG1 THR 54 HG1 THR 54 51.081 -13.900 6.537
457 HG21 THR 54 HG21 THR 54 50.042 -16.178 6.489
458 HG22 THR 54 HG22 THR 54 48.675 -15.586 7.435
459 HG23 THR 54 HG23 THR 54 49.695 -16.875 8.072
460 H GLN 55 HN GLN 55 51.393 -12.537 8.927
461 HA GLN 55 HA GLN 55 53.450 -12.760 10.955
462 HB2 GLN 55 HB2 GLN 55 52.953 -10.697 8.804
463 HB3 GLN 55 HB1 GLN 55 54.326 -10.660 9.902
464 HG2 GLN 55 HG2 GLN 55 55.097 -12.797 9.033
465 HG3 GLN 55 HG1 GLN 55 53.701 -12.873 7.963
466 HE21 GLN 55 HE21 GLN 55 55.043 -12.991 6.169
467 HE22 GLN 55 HE22 GLN 55 55.886 -11.608 5.561
468 H HIS 56 HN HIS 56 50.600 -10.917 10.343
469 HA HIS 56 HA HIS 56 49.280 -9.650 11.648
470 HB2 HIS 56 HB2 HIS 56 49.777 -11.351 13.412
471 HB3 HIS 56 HB1 HIS 56 51.086 -10.320 13.975
472 HD1 HIS 56 HD1 HIS 56 47.386 -10.684 14.014
473 HD2 HIS 56 HD2 HIS 56 50.243 -7.967 15.330
474 HE1 HIS 56 HE1 HIS 56 46.173 -9.149 15.578
475 H HIS 57 HN HIS 57 50.015 -7.887 10.374
476 HA HIS 57 HA HIS 57 50.473 -5.684 10.177
477 HB2 HIS 57 HB2 HIS 57 49.306 -5.550 12.362
478 HB3 HIS 57 HB1 HIS 57 50.851 -5.744 13.177
479 HD1 HIS 57 HD1 HIS 57 49.096 -3.322 10.848
480 HD2 HIS 57 HD2 HIS 57 52.164 -3.407 13.648
481 HE1 HIS 57 HE1 HIS 57 49.770 -0.929 11.181
Start of MODEL 6
1 H1 ALA 1 HT1 ALA 1 75.304 5.963 -16.627
2 H2 ALA 1 HT2 ALA 1 73.953 5.012 -16.303
3 H3 ALA 1 HT3 ALA 1 75.292 4.957 -15.269
4 HA ALA 1 HA ALA 1 74.949 7.283 -14.696
5 HB1 ALA 1 HB1 ALA 1 73.837 7.967 -16.750
6 HB2 ALA 1 HB2 ALA 1 72.853 8.368 -15.344
7 HB3 ALA 1 HB3 ALA 1 72.440 6.973 -16.339
8 H SER 2 HN SER 2 73.288 4.304 -14.675
9 HA SER 2 HA SER 2 72.025 3.172 -13.228
10 HB2 SER 2 HB2 SER 2 72.418 3.531 -10.794
11 HB3 SER 2 HB1 SER 2 73.912 3.431 -11.716
12 HG SER 2 HG SER 2 73.236 5.974 -11.661
13 H MET 3 HN MET 3 70.363 3.386 -11.323
14 HA MET 3 HA MET 3 68.314 5.141 -12.325
15 HB2 MET 3 HB2 MET 3 68.317 3.205 -10.002
16 HB3 MET 3 HB1 MET 3 66.905 4.085 -10.565
17 HG2 MET 3 HG2 MET 3 67.043 2.948 -12.713
18 HG3 MET 3 HG1 MET 3 68.478 2.082 -12.168
19 HE1 MET 3 HE1 MET 3 67.344 -0.232 -12.812
20 HE2 MET 3 HE2 MET 3 65.920 0.640 -13.377
21 HE3 MET 3 HE3 MET 3 65.741 -0.719 -12.267
22 H GLY 4 HN GLY 4 68.439 7.230 -11.789
23 HA2 GLY 4 HA2 GLY 4 69.694 8.203 -9.442
24 HA3 GLY 4 HA1 GLY 4 68.651 9.130 -10.515
25 H LYS 5 HN LYS 5 66.320 7.705 -10.346
26 HA LYS 5 HA LYS 5 65.420 6.961 -7.837
27 HB2 LYS 5 HB2 LYS 5 65.954 9.310 -7.200
28 HB3 LYS 5 HB1 LYS 5 64.811 9.872 -8.410
29 HG2 LYS 5 HG2 LYS 5 62.992 8.748 -7.208
30 HG3 LYS 5 HG1 LYS 5 64.145 8.199 -5.991
31 HD2 LYS 5 HD2 LYS 5 63.556 11.085 -6.652
32 HD3 LYS 5 HD1 LYS 5 62.880 10.204 -5.284
33 HE2 LYS 5 HE2 LYS 5 65.817 10.727 -5.765
34 HE3 LYS 5 HE1 LYS 5 64.793 11.601 -4.630
35 HZ1 LYS 5 HZ1 LYS 5 66.030 9.940 -3.462
36 HZ2 LYS 5 HZ2 LYS 5 65.510 8.725 -4.508
37 HZ3 LYS 5 HZ3 LYS 5 64.402 9.472 -3.473
38 H SER 6 HN SER 6 64.371 9.089 -10.492
39 HA SER 6 HA SER 6 62.686 8.980 -11.989
40 HB2 SER 6 HB2 SER 6 63.353 6.639 -12.425
41 HB3 SER 6 HB1 SER 6 62.363 6.097 -11.075
42 HG SER 6 HG SER 6 61.361 7.478 -13.349
43 H LYS 7 HN LYS 7 61.413 6.847 -9.466
44 HA LYS 7 HA LYS 7 59.870 8.872 -8.231
45 HB2 LYS 7 HB2 LYS 7 58.588 8.313 -10.410
46 HB3 LYS 7 HB1 LYS 7 58.228 6.773 -9.644
47 HG2 LYS 7 HG2 LYS 7 56.376 8.267 -9.320
48 HG3 LYS 7 HG1 LYS 7 57.174 7.998 -7.767
49 HD2 LYS 7 HD2 LYS 7 58.360 10.128 -8.005
50 HD3 LYS 7 HD1 LYS 7 57.584 10.390 -9.566
51 HE2 LYS 7 HE2 LYS 7 55.398 10.418 -8.459
52 HE3 LYS 7 HE1 LYS 7 56.187 10.168 -6.902
53 HZ1 LYS 7 HZ1 LYS 7 57.338 12.277 -7.189
54 HZ2 LYS 7 HZ2 LYS 7 55.665 12.496 -7.272
55 HZ3 LYS 7 HZ3 LYS 7 56.584 12.509 -8.685
56 H GLU 8 HN GLU 8 60.556 8.167 -6.284
57 HA GLU 8 HA GLU 8 60.743 5.355 -5.700
58 HB2 GLU 8 HB2 GLU 8 61.514 6.052 -3.490
59 HB3 GLU 8 HB1 GLU 8 62.383 6.888 -4.768
60 HG2 GLU 8 HG2 GLU 8 61.151 8.889 -4.388
61 HG3 GLU 8 HG1 GLU 8 60.069 8.069 -3.263
62 H ILE 9 HN ILE 9 58.252 7.556 -5.649
63 HA ILE 9 HA ILE 9 56.873 6.456 -3.360
64 HB ILE 9 HB ILE 9 55.688 8.288 -5.461
65 HG12 ILE 9 HG12 ILE 9 57.764 9.308 -4.633
66 HG13 ILE 9 HG11 ILE 9 56.357 10.187 -4.048
67 HG21 ILE 9 HG21 ILE 9 54.220 9.001 -3.628
68 HG22 ILE 9 HG22 ILE 9 55.014 7.856 -2.547
69 HG23 ILE 9 HG23 ILE 9 54.086 7.268 -3.925
70 HD11 ILE 9 HD11 ILE 9 56.576 9.061 -1.882
71 HD12 ILE 9 HD12 ILE 9 58.024 9.973 -2.308
72 HD13 ILE 9 HD13 ILE 9 58.004 8.218 -2.476
73 H SER 10 HN SER 10 57.357 4.318 -4.695
74 HA SER 10 HA SER 10 55.098 3.708 -6.450
75 HB2 SER 10 HB2 SER 10 56.450 1.579 -6.859
76 HB3 SER 10 HB1 SER 10 57.162 3.082 -7.445
77 HG SER 10 HG SER 10 58.816 2.317 -6.353
78 H GLN 11 HN GLN 11 56.932 1.764 -4.104
79 HA GLN 11 HA GLN 11 54.592 0.307 -3.323
80 HB2 GLN 11 HB2 GLN 11 56.873 -0.696 -3.342
81 HB3 GLN 11 HB1 GLN 11 57.321 0.362 -2.011
82 HG2 GLN 11 HG2 GLN 11 55.680 -0.701 -0.577
83 HG3 GLN 11 HG1 GLN 11 55.142 -1.716 -1.911
84 HE21 GLN 11 HE21 GLN 11 58.498 -0.929 -1.334
85 HE22 GLN 11 HE22 GLN 11 58.977 -2.522 -0.858
86 H ASP 12 HN ASP 12 56.083 3.197 -2.379
87 HA ASP 12 HA ASP 12 55.335 3.469 0.292
88 HB2 ASP 12 HB2 ASP 12 56.815 5.052 -0.891
89 HB3 ASP 12 HB1 ASP 12 55.444 5.618 -1.837
90 H LEU 13 HN LEU 13 53.496 3.854 -2.667
91 HA LEU 13 HA LEU 13 51.175 5.025 -1.537
92 HB2 LEU 13 HB2 LEU 13 51.427 3.266 -3.982
93 HB3 LEU 13 HB1 LEU 13 50.048 4.268 -3.590
94 HG LEU 13 HG LEU 13 52.813 5.309 -4.217
95 HD11 LEU 13 HD11 LEU 13 51.835 6.038 -6.333
96 HD12 LEU 13 HD12 LEU 13 50.318 5.246 -5.908
97 HD13 LEU 13 HD13 LEU 13 51.772 4.282 -6.166
98 HD21 LEU 13 HD21 LEU 13 51.554 6.782 -2.738
99 HD22 LEU 13 HD22 LEU 13 50.180 6.736 -3.842
100 HD23 LEU 13 HD23 LEU 13 51.695 7.485 -4.349
101 H ARG 14 HN ARG 14 52.254 1.729 -2.010
102 HA ARG 14 HA ARG 14 49.822 0.434 -1.360
103 HB2 ARG 14 HB2 ARG 14 52.673 -0.556 -1.317
104 HB3 ARG 14 HB1 ARG 14 51.268 -1.587 -1.079
105 HG2 ARG 14 HG2 ARG 14 50.500 -1.185 -3.294
106 HG3 ARG 14 HG1 ARG 14 51.700 0.083 -3.540
107 HD2 ARG 14 HD2 ARG 14 52.333 -2.001 -4.656
108 HD3 ARG 14 HD1 ARG 14 53.488 -1.552 -3.407
109 HE ARG 14 HE ARG 14 52.093 -3.231 -2.004
110 HH11 ARG 14 HH11 ARG 14 52.773 -3.553 -5.444
111 HH12 ARG 14 HH12 ARG 14 52.839 -5.280 -5.389
112 HH21 ARG 14 HH21 ARG 14 52.171 -5.522 -1.951
113 HH22 ARG 14 HH22 ARG 14 52.505 -6.401 -3.405
114 H LYS 15 HN LYS 15 52.709 1.200 0.559
115 HA LYS 15 HA LYS 15 51.633 0.026 2.934
116 HB2 LYS 15 HB2 LYS 15 53.510 1.169 4.093
117 HB3 LYS 15 HB1 LYS 15 54.031 0.202 2.721
118 HG2 LYS 15 HG2 LYS 15 54.301 2.167 1.371
119 HG3 LYS 15 HG1 LYS 15 53.624 3.182 2.642
120 HD2 LYS 15 HD2 LYS 15 56.158 1.563 2.898
121 HD3 LYS 15 HD1 LYS 15 56.101 3.283 2.510
122 HE2 LYS 15 HE2 LYS 15 54.882 3.654 4.654
123 HE3 LYS 15 HE1 LYS 15 55.144 1.955 5.043
124 HZ1 LYS 15 HZ1 LYS 15 56.809 3.310 6.086
125 HZ2 LYS 15 HZ2 LYS 15 57.250 3.998 4.605
126 HZ3 LYS 15 HZ3 LYS 15 57.536 2.358 4.893
127 H LYS 16 HN LYS 16 51.450 3.148 1.431
128 HA LYS 16 HA LYS 16 50.659 4.640 3.706
129 HB2 LYS 16 HB2 LYS 16 51.287 5.213 1.073
130 HB3 LYS 16 HB1 LYS 16 49.577 5.603 1.179
131 HG2 LYS 16 HG2 LYS 16 50.862 7.571 1.639
132 HG3 LYS 16 HG1 LYS 16 50.072 7.045 3.126
133 HD2 LYS 16 HD2 LYS 16 52.137 6.013 3.890
134 HD3 LYS 16 HD1 LYS 16 52.933 6.439 2.376
135 HE2 LYS 16 HE2 LYS 16 53.527 7.983 4.174
136 HE3 LYS 16 HE1 LYS 16 52.655 8.801 2.878
137 HZ1 LYS 16 HZ1 LYS 16 51.490 7.896 5.450
138 HZ2 LYS 16 HZ2 LYS 16 50.650 8.684 4.213
139 HZ3 LYS 16 HZ3 LYS 16 51.872 9.491 5.046
140 H ILE 17 HN ILE 17 48.807 3.123 1.075
141 HA ILE 17 HA ILE 17 46.284 3.966 1.964
142 HB ILE 17 HB ILE 17 46.688 3.097 -0.319
143 HG12 ILE 17 HG12 ILE 17 44.624 1.684 -0.502
144 HG13 ILE 17 HG11 ILE 17 44.557 1.650 1.257
145 HG21 ILE 17 HG21 ILE 17 46.869 0.401 1.001
146 HG22 ILE 17 HG22 ILE 17 48.170 1.260 0.177
147 HG23 ILE 17 HG23 ILE 17 46.773 0.686 -0.736
148 HD11 ILE 17 HD11 ILE 17 44.390 4.106 -0.470
149 HD12 ILE 17 HD12 ILE 17 44.325 4.076 1.291
150 HD13 ILE 17 HD13 ILE 17 43.045 3.310 0.348
151 H VAL 18 HN VAL 18 48.296 1.296 2.948
152 HA VAL 18 HA VAL 18 46.214 -0.015 4.445
153 HB VAL 18 HB VAL 18 49.212 -0.453 4.471
154 HG11 VAL 18 HG11 VAL 18 48.708 -2.579 5.580
155 HG12 VAL 18 HG12 VAL 18 47.001 -2.139 5.645
156 HG13 VAL 18 HG13 VAL 18 48.188 -1.204 6.554
157 HG21 VAL 18 HG21 VAL 18 47.000 -1.976 3.093
158 HG22 VAL 18 HG22 VAL 18 48.701 -2.443 3.124
159 HG23 VAL 18 HG23 VAL 18 48.209 -0.957 2.310
160 H ASP 19 HN ASP 19 49.047 1.990 5.195
161 HA ASP 19 HA ASP 19 48.867 1.878 7.982
162 HB2 ASP 19 HB2 ASP 19 50.862 2.725 6.910
163 HB3 ASP 19 HB1 ASP 19 49.963 4.069 6.213
164 H LEU 20 HN LEU 20 47.645 4.431 5.812
165 HA LEU 20 HA LEU 20 46.388 5.853 7.916
166 HB2 LEU 20 HB2 LEU 20 46.140 5.984 4.927
167 HB3 LEU 20 HB1 LEU 20 45.106 6.949 5.958
168 HG LEU 20 HG LEU 20 47.191 7.959 6.958
169 HD11 LEU 20 HD11 LEU 20 49.261 7.800 5.662
170 HD12 LEU 20 HD12 LEU 20 48.521 6.560 4.651
171 HD13 LEU 20 HD13 LEU 20 48.793 6.253 6.365
172 HD21 LEU 20 HD21 LEU 20 46.837 8.358 3.994
173 HD22 LEU 20 HD22 LEU 20 47.554 9.498 5.132
174 HD23 LEU 20 HD23 LEU 20 45.841 9.097 5.247
175 H HIS 21 HN HIS 21 45.442 3.139 6.044
176 HA HIS 21 HA HIS 21 42.640 3.221 6.259
177 HB2 HIS 21 HB2 HIS 21 44.074 1.548 4.930
178 HB3 HIS 21 HB1 HIS 21 44.342 0.741 6.451
179 HD1 HIS 21 HD1 HIS 21 41.419 1.673 4.220
180 HD2 HIS 21 HD2 HIS 21 42.478 -1.098 7.136
181 HE1 HIS 21 HE1 HIS 21 39.504 0.056 4.330
182 H LYS 22 HN LYS 22 45.148 2.074 8.400
183 HA LYS 22 HA LYS 22 43.237 1.088 10.343
184 HB2 LYS 22 HB2 LYS 22 46.251 1.050 10.319
185 HB3 LYS 22 HB1 LYS 22 45.220 0.206 11.469
186 HG2 LYS 22 HG2 LYS 22 44.537 -1.356 9.938
187 HG3 LYS 22 HG1 LYS 22 44.813 -0.287 8.565
188 HD2 LYS 22 HD2 LYS 22 46.505 -1.822 8.342
189 HD3 LYS 22 HD1 LYS 22 47.304 -0.510 9.197
190 HE2 LYS 22 HE2 LYS 22 46.125 -2.942 10.559
191 HE3 LYS 22 HE1 LYS 22 47.815 -2.807 10.093
192 HZ1 LYS 22 HZ1 LYS 22 46.416 -1.011 12.005
193 HZ2 LYS 22 HZ2 LYS 22 48.047 -0.934 11.583
194 HZ3 LYS 22 HZ3 LYS 22 47.459 -2.267 12.424
195 H SER 23 HN SER 23 44.696 4.000 9.664
196 HA SER 23 HA SER 23 45.038 4.876 12.380
197 HB2 SER 23 HB2 SER 23 44.950 6.463 9.804
198 HB3 SER 23 HB1 SER 23 45.450 7.087 11.377
199 HG SER 23 HG SER 23 47.151 5.565 11.364
200 H GLY 24 HN GLY 24 42.483 4.622 10.119
201 HA2 GLY 24 HA2 GLY 24 40.217 4.764 10.596
202 HA3 GLY 24 HA1 GLY 24 40.615 5.489 12.145
203 H SER 25 HN SER 25 41.445 7.773 12.017
204 HA SER 25 HA SER 25 39.482 9.348 10.757
205 HB2 SER 25 HB2 SER 25 40.968 11.259 11.546
206 HB3 SER 25 HB1 SER 25 40.389 10.146 12.788
207 HG SER 25 HG SER 25 42.649 10.654 12.924
208 H SER 26 HN SER 26 42.526 8.210 9.678
209 HA SER 26 HA SER 26 42.867 10.250 7.671
210 HB2 SER 26 HB2 SER 26 44.373 7.656 8.026
211 HB3 SER 26 HB1 SER 26 44.879 9.057 7.080
212 HG SER 26 HG SER 26 44.707 10.228 9.171
213 H LEU 27 HN LEU 27 40.698 7.859 7.861
214 HA LEU 27 HA LEU 27 40.922 6.457 5.417
215 HB2 LEU 27 HB2 LEU 27 39.352 6.140 7.535
216 HB3 LEU 27 HB1 LEU 27 38.248 7.121 6.598
217 HG LEU 27 HG LEU 27 37.738 4.750 6.364
218 HD11 LEU 27 HD11 LEU 27 38.850 5.905 3.819
219 HD12 LEU 27 HD12 LEU 27 37.235 6.176 4.474
220 HD13 LEU 27 HD13 LEU 27 37.709 4.565 3.935
221 HD21 LEU 27 HD21 LEU 27 39.271 3.209 5.270
222 HD22 LEU 27 HD22 LEU 27 39.973 3.854 6.754
223 HD23 LEU 27 HD23 LEU 27 40.497 4.471 5.188
224 H GLY 28 HN GLY 28 39.141 9.403 6.316
225 HA2 GLY 28 HA2 GLY 28 38.107 9.902 3.720
226 HA3 GLY 28 HA1 GLY 28 38.205 11.062 5.037
227 H ALA 29 HN ALA 29 41.204 10.328 5.078
228 HA ALA 29 HA ALA 29 42.023 12.505 3.408
229 HB1 ALA 29 HB1 ALA 29 43.086 12.095 5.582
230 HB2 ALA 29 HB2 ALA 29 44.263 12.073 4.269
231 HB3 ALA 29 HB3 ALA 29 43.708 10.558 4.983
232 H ILE 30 HN ILE 30 42.775 9.014 3.467
233 HA ILE 30 HA ILE 30 44.228 9.018 1.061
234 HB ILE 30 HB ILE 30 43.624 6.526 0.973
235 HG12 ILE 30 HG12 ILE 30 42.486 7.206 3.696
236 HG13 ILE 30 HG11 ILE 30 41.570 6.638 2.307
237 HG21 ILE 30 HG21 ILE 30 45.013 7.635 3.397
238 HG22 ILE 30 HG22 ILE 30 45.736 7.359 1.812
239 HG23 ILE 30 HG23 ILE 30 45.180 5.993 2.779
240 HD11 ILE 30 HD11 ILE 30 41.975 4.884 3.969
241 HD12 ILE 30 HD12 ILE 30 43.711 5.068 3.726
242 HD13 ILE 30 HD13 ILE 30 42.689 4.501 2.405
243 H SER 31 HN SER 31 40.792 8.544 1.683
244 HA SER 31 HA SER 31 40.067 7.804 -0.933
245 HB2 SER 31 HB2 SER 31 38.599 7.545 1.060
246 HB3 SER 31 HB1 SER 31 38.407 9.296 1.122
247 HG SER 31 HG SER 31 36.776 7.883 -0.041
248 H LYS 32 HN LYS 32 40.729 10.880 0.552
249 HA LYS 32 HA LYS 32 39.573 12.453 -1.553
250 HB2 LYS 32 HB2 LYS 32 39.613 13.299 0.730
251 HB3 LYS 32 HB1 LYS 32 41.364 13.211 0.753
252 HG2 LYS 32 HG2 LYS 32 40.687 15.494 0.444
253 HG3 LYS 32 HG1 LYS 32 41.452 14.911 -1.033
254 HD2 LYS 32 HD2 LYS 32 39.477 16.209 -1.575
255 HD3 LYS 32 HD1 LYS 32 39.224 14.517 -2.002
256 HE2 LYS 32 HE2 LYS 32 37.943 14.173 0.036
257 HE3 LYS 32 HE1 LYS 32 38.238 15.841 0.522
258 HZ1 LYS 32 HZ1 LYS 32 36.052 15.546 -0.463
259 HZ2 LYS 32 HZ2 LYS 32 36.749 14.994 -1.900
260 HZ3 LYS 32 HZ3 LYS 32 37.000 16.584 -1.394
261 H ARG 33 HN ARG 33 42.923 12.061 -0.375
262 HA ARG 33 HA ARG 33 43.928 13.440 -2.674
263 HB2 ARG 33 HB2 ARG 33 46.183 12.937 -1.704
264 HB3 ARG 33 HB1 ARG 33 45.096 13.844 -0.670
265 HG2 ARG 33 HG2 ARG 33 44.618 11.855 0.620
266 HG3 ARG 33 HG1 ARG 33 45.630 10.893 -0.457
267 HD2 ARG 33 HD2 ARG 33 46.567 13.196 1.248
268 HD3 ARG 33 HD1 ARG 33 46.801 11.487 1.614
269 HE ARG 33 HE ARG 33 47.846 11.950 -0.921
270 HH11 ARG 33 HH11 ARG 33 48.501 12.939 2.377
271 HH12 ARG 33 HH12 ARG 33 50.197 13.143 2.116
272 HH21 ARG 33 HH21 ARG 33 50.073 12.223 -1.280
273 HH22 ARG 33 HH22 ARG 33 51.099 12.725 0.020
274 H LEU 34 HN LEU 34 43.871 10.027 -1.714
275 HA LEU 34 HA LEU 34 45.505 9.295 -3.979
276 HB2 LEU 34 HB2 LEU 34 44.190 7.775 -1.770
277 HB3 LEU 34 HB1 LEU 34 44.629 6.913 -3.226
278 HG LEU 34 HG LEU 34 46.338 6.632 -1.537
279 HD11 LEU 34 HD11 LEU 34 48.290 7.326 -2.792
280 HD12 LEU 34 HD12 LEU 34 47.307 8.436 -3.743
281 HD13 LEU 34 HD13 LEU 34 47.042 6.697 -3.867
282 HD21 LEU 34 HD21 LEU 34 47.654 8.487 -0.690
283 HD22 LEU 34 HD22 LEU 34 45.952 8.702 -0.281
284 HD23 LEU 34 HD23 LEU 34 46.666 9.626 -1.605
285 H LYS 35 HN LYS 35 42.096 9.296 -3.129
286 HA LYS 35 HA LYS 35 40.204 9.008 -4.354
287 HB2 LYS 35 HB2 LYS 35 41.401 10.767 -5.742
288 HB3 LYS 35 HB1 LYS 35 41.967 9.465 -6.773
289 HG2 LYS 35 HG2 LYS 35 39.519 8.888 -7.133
290 HG3 LYS 35 HG1 LYS 35 39.158 10.445 -6.383
291 HD2 LYS 35 HD2 LYS 35 40.585 11.551 -8.067
292 HD3 LYS 35 HD1 LYS 35 40.857 9.986 -8.832
293 HE2 LYS 35 HE2 LYS 35 39.145 11.101 -10.057
294 HE3 LYS 35 HE1 LYS 35 38.388 9.800 -9.143
295 HZ1 LYS 35 HZ1 LYS 35 37.634 11.392 -7.519
296 HZ2 LYS 35 HZ2 LYS 35 37.138 11.893 -9.057
297 HZ3 LYS 35 HZ3 LYS 35 38.445 12.643 -8.313
298 H VAL 36 HN VAL 36 41.362 6.700 -3.577
299 HA VAL 36 HA VAL 36 41.531 4.952 -5.887
300 HB VAL 36 HB VAL 36 42.134 3.182 -4.178
301 HG11 VAL 36 HG11 VAL 36 44.426 4.097 -3.841
302 HG12 VAL 36 HG12 VAL 36 43.849 5.642 -4.469
303 HG13 VAL 36 HG13 VAL 36 43.841 4.214 -5.499
304 HG21 VAL 36 HG21 VAL 36 41.151 4.268 -2.214
305 HG22 VAL 36 HG22 VAL 36 42.316 5.586 -2.355
306 HG23 VAL 36 HG23 VAL 36 42.870 3.954 -1.977
307 HA PRO 37 HA PRO 37 37.355 3.540 -5.490
308 HB2 PRO 37 HB2 PRO 37 38.384 1.033 -6.673
309 HB3 PRO 37 HB1 PRO 37 37.124 2.118 -7.269
310 HG2 PRO 37 HG2 PRO 37 39.520 1.996 -8.447
311 HG3 PRO 37 HG1 PRO 37 38.635 3.526 -8.300
312 HD2 PRO 37 HD2 PRO 37 40.947 2.507 -6.703
313 HD3 PRO 37 HD1 PRO 37 40.610 4.148 -7.301
314 H ARG 38 HN ARG 38 36.185 2.131 -4.213
315 HA ARG 38 HA ARG 38 37.420 1.181 -1.879
316 HB2 ARG 38 HB2 ARG 38 34.688 0.843 -3.067
317 HB3 ARG 38 HB1 ARG 38 35.147 -0.084 -1.650
318 HG2 ARG 38 HG2 ARG 38 33.900 1.949 -1.075
319 HG3 ARG 38 HG1 ARG 38 35.524 1.954 -0.392
320 HD2 ARG 38 HD2 ARG 38 34.869 4.144 -1.326
321 HD3 ARG 38 HD1 ARG 38 36.287 3.461 -2.119
322 HE ARG 38 HE ARG 38 33.745 2.931 -3.410
323 HH11 ARG 38 HH11 ARG 38 36.581 5.003 -3.240
324 HH12 ARG 38 HH12 ARG 38 36.399 5.617 -4.841
325 HH21 ARG 38 HH21 ARG 38 33.503 3.751 -5.568
326 HH22 ARG 38 HH22 ARG 38 34.635 4.911 -6.163
327 H SER 39 HN SER 39 36.545 -0.376 -4.885
328 HA SER 39 HA SER 39 36.862 -3.043 -4.129
329 HB2 SER 39 HB2 SER 39 37.488 -1.802 -6.816
330 HB3 SER 39 HB1 SER 39 37.127 -3.501 -6.507
331 HG SER 39 HG SER 39 35.047 -2.870 -5.822
332 H SER 40 HN SER 40 39.237 -0.627 -5.166
333 HA SER 40 HA SER 40 41.448 -2.394 -5.273
334 HB2 SER 40 HB2 SER 40 41.400 0.598 -4.794
335 HB3 SER 40 HB1 SER 40 42.811 -0.349 -5.262
336 HG SER 40 HG SER 40 42.147 0.222 -7.181
337 H VAL 41 HN VAL 41 40.099 -0.292 -2.782
338 HA VAL 41 HA VAL 41 42.068 -0.685 -0.818
339 HB VAL 41 HB VAL 41 39.120 -0.132 -0.386
340 HG11 VAL 41 HG11 VAL 41 40.249 -0.849 1.651
341 HG12 VAL 41 HG12 VAL 41 39.836 0.864 1.735
342 HG13 VAL 41 HG13 VAL 41 41.496 0.373 1.404
343 HG21 VAL 41 HG21 VAL 41 41.421 1.789 -0.737
344 HG22 VAL 41 HG22 VAL 41 39.769 2.235 -0.307
345 HG23 VAL 41 HG23 VAL 41 40.107 1.516 -1.882
346 H GLN 42 HN GLN 42 38.976 -2.342 -1.381
347 HA GLN 42 HA GLN 42 39.139 -4.160 0.749
348 HB2 GLN 42 HB2 GLN 42 37.784 -4.501 -1.935
349 HB3 GLN 42 HB1 GLN 42 37.498 -5.507 -0.524
350 HG2 GLN 42 HG2 GLN 42 36.978 -2.545 -0.618
351 HG3 GLN 42 HG1 GLN 42 35.763 -3.775 -0.946
352 HE21 GLN 42 HE21 GLN 42 34.493 -3.101 0.751
353 HE22 GLN 42 HE22 GLN 42 34.901 -3.409 2.402
354 H THR 43 HN THR 43 40.608 -4.181 -2.404
355 HA THR 43 HA THR 43 41.319 -6.942 -2.347
356 HB THR 43 HB THR 43 42.404 -4.698 -4.066
357 HG1 THR 43 HG1 THR 43 40.246 -4.987 -4.519
358 HG21 THR 43 HG21 THR 43 42.607 -7.700 -4.406
359 HG22 THR 43 HG22 THR 43 43.937 -6.620 -3.988
360 HG23 THR 43 HG23 THR 43 43.161 -6.494 -5.567
361 H ILE 44 HN ILE 44 43.036 -3.914 -1.589
362 HA ILE 44 HA ILE 44 45.470 -5.319 -1.071
363 HB ILE 44 HB ILE 44 46.358 -3.156 -0.212
364 HG12 ILE 44 HG12 ILE 44 44.781 -1.148 -0.959
365 HG13 ILE 44 HG11 ILE 44 43.513 -2.315 -0.603
366 HG21 ILE 44 HG21 ILE 44 46.355 -2.018 -2.382
367 HG22 ILE 44 HG22 ILE 44 45.041 -3.068 -2.915
368 HG23 ILE 44 HG23 ILE 44 46.619 -3.755 -2.530
369 HD11 ILE 44 HD11 ILE 44 45.632 -1.365 1.313
370 HD12 ILE 44 HD12 ILE 44 44.366 -2.537 1.676
371 HD13 ILE 44 HD13 ILE 44 43.940 -0.868 1.295
372 H VAL 45 HN VAL 45 42.770 -4.305 0.915
373 HA VAL 45 HA VAL 45 44.146 -4.614 3.378
374 HB VAL 45 HB VAL 45 41.936 -4.686 4.476
375 HG11 VAL 45 HG11 VAL 45 41.189 -2.455 3.836
376 HG12 VAL 45 HG12 VAL 45 42.181 -2.544 2.380
377 HG13 VAL 45 HG13 VAL 45 42.946 -2.543 3.969
378 HG21 VAL 45 HG21 VAL 45 40.842 -4.645 1.672
379 HG22 VAL 45 HG22 VAL 45 39.892 -4.382 3.135
380 HG23 VAL 45 HG23 VAL 45 40.665 -5.943 2.853
381 H ARG 46 HN ARG 46 42.266 -6.839 1.384
382 HA ARG 46 HA ARG 46 42.203 -8.958 3.245
383 HB2 ARG 46 HB2 ARG 46 42.100 -9.018 0.226
384 HB3 ARG 46 HB1 ARG 46 41.792 -10.410 1.256
385 HG2 ARG 46 HG2 ARG 46 39.908 -9.226 2.278
386 HG3 ARG 46 HG1 ARG 46 40.213 -7.851 1.214
387 HD2 ARG 46 HD2 ARG 46 39.838 -9.317 -0.733
388 HD3 ARG 46 HD1 ARG 46 39.458 -10.642 0.367
389 HE ARG 46 HE ARG 46 37.839 -8.421 0.968
390 HH11 ARG 46 HH11 ARG 46 38.220 -10.918 -1.468
391 HH12 ARG 46 HH12 ARG 46 36.556 -10.880 -1.944
392 HH21 ARG 46 HH21 ARG 46 35.650 -8.375 0.352
393 HH22 ARG 46 HH22 ARG 46 35.086 -9.420 -0.909
394 H LYS 47 HN LYS 47 44.533 -8.015 0.798
395 HA LYS 47 HA LYS 47 46.214 -10.269 1.044
396 HB2 LYS 47 HB2 LYS 47 46.770 -7.447 0.136
397 HB3 LYS 47 HB1 LYS 47 47.965 -8.734 0.074
398 HG2 LYS 47 HG2 LYS 47 46.542 -9.999 -1.437
399 HG3 LYS 47 HG1 LYS 47 45.318 -8.729 -1.357
400 HD2 LYS 47 HD2 LYS 47 46.817 -7.150 -2.379
401 HD3 LYS 47 HD1 LYS 47 48.146 -8.310 -2.317
402 HE2 LYS 47 HE2 LYS 47 45.597 -8.641 -3.895
403 HE3 LYS 47 HE1 LYS 47 47.149 -8.148 -4.559
404 HZ1 LYS 47 HZ1 LYS 47 46.516 -10.752 -3.292
405 HZ2 LYS 47 HZ2 LYS 47 48.063 -10.288 -3.791
406 HZ3 LYS 47 HZ3 LYS 47 46.831 -10.478 -4.929
407 H TYR 48 HN TYR 48 46.173 -7.103 2.653
408 HA TYR 48 HA TYR 48 48.518 -7.531 4.104
409 HB2 TYR 48 HB2 TYR 48 47.782 -5.300 3.743
410 HB3 TYR 48 HB1 TYR 48 46.204 -5.638 4.455
411 HD1 TYR 48 HD1 TYR 48 49.815 -5.530 5.251
412 HD2 TYR 48 HD2 TYR 48 45.837 -5.273 6.694
413 HE1 TYR 48 HE1 TYR 48 50.665 -4.900 7.443
414 HE2 TYR 48 HE2 TYR 48 46.652 -4.632 8.884
415 HH TYR 48 HH TYR 48 49.802 -3.632 9.462
416 H LYS 49 HN LYS 49 45.076 -8.004 4.878
417 HA LYS 49 HA LYS 49 45.414 -8.656 7.584
418 HB2 LYS 49 HB2 LYS 49 43.301 -9.589 5.635
419 HB3 LYS 49 HB1 LYS 49 43.224 -9.850 7.368
420 HG2 LYS 49 HG2 LYS 49 43.295 -7.154 6.021
421 HG3 LYS 49 HG1 LYS 49 41.846 -7.956 6.621
422 HD2 LYS 49 HD2 LYS 49 44.218 -7.174 8.324
423 HD3 LYS 49 HD1 LYS 49 42.732 -6.237 8.174
424 HE2 LYS 49 HE2 LYS 49 41.469 -8.190 9.028
425 HE3 LYS 49 HE1 LYS 49 42.996 -9.036 9.268
426 HZ1 LYS 49 HZ1 LYS 49 42.220 -6.490 10.574
427 HZ2 LYS 49 HZ2 LYS 49 43.661 -7.330 10.833
428 HZ3 LYS 49 HZ3 LYS 49 42.188 -8.009 11.302
429 H HIS 50 HN HIS 50 45.429 -10.700 4.701
430 HA HIS 50 HA HIS 50 45.826 -13.129 6.136
431 HB2 HIS 50 HB2 HIS 50 44.891 -12.949 3.802
432 HB3 HIS 50 HB1 HIS 50 46.512 -12.560 3.242
433 HD1 HIS 50 HD1 HIS 50 48.213 -14.492 3.112
434 HD2 HIS 50 HD2 HIS 50 44.465 -15.641 4.481
435 HE1 HIS 50 HE1 HIS 50 48.226 -16.998 3.065
436 H HIS 51 HN HIS 51 47.919 -10.658 4.846
437 HA HIS 51 HA HIS 51 50.344 -12.157 5.063
438 HB2 HIS 51 HB2 HIS 51 50.054 -10.204 3.535
439 HB3 HIS 51 HB1 HIS 51 49.985 -9.155 4.943
440 HD1 HIS 51 HD1 HIS 51 52.147 -8.055 5.418
441 HD2 HIS 51 HD2 HIS 51 52.669 -11.760 3.613
442 HE1 HIS 51 HE1 HIS 51 54.625 -8.313 5.128
443 H GLY 52 HN GLY 52 48.475 -10.144 7.193
444 HA2 GLY 52 HA2 GLY 52 50.461 -9.599 9.122
445 HA3 GLY 52 HA1 GLY 52 48.726 -9.580 9.401
446 H THR 53 HN THR 53 48.399 -12.379 8.602
447 HA THR 53 HA THR 53 49.127 -13.554 11.138
448 HB THR 53 HB THR 53 47.822 -15.545 10.127
449 HG1 THR 53 HG1 THR 53 47.451 -15.190 8.059
450 HG21 THR 53 HG21 THR 53 46.910 -14.052 11.845
451 HG22 THR 53 HG22 THR 53 45.672 -14.496 10.670
452 HG23 THR 53 HG23 THR 53 46.429 -12.905 10.595
453 H THR 54 HN THR 54 49.846 -14.018 7.697
454 HA THR 54 HA THR 54 51.366 -16.376 8.046
455 HB THR 54 HB THR 54 52.325 -15.775 5.771
456 HG1 THR 54 HG1 THR 54 50.484 -14.002 5.073
457 HG21 THR 54 HG21 THR 54 50.212 -16.215 4.601
458 HG22 THR 54 HG22 THR 54 49.320 -15.829 6.073
459 HG23 THR 54 HG23 THR 54 50.382 -17.236 6.029
460 H GLN 55 HN GLN 55 52.224 -12.952 7.938
461 HA GLN 55 HA GLN 55 55.025 -13.530 8.338
462 HB2 GLN 55 HB2 GLN 55 54.318 -11.560 7.026
463 HB3 GLN 55 HB1 GLN 55 53.537 -10.897 8.453
464 HG2 GLN 55 HG2 GLN 55 55.748 -10.839 9.574
465 HG3 GLN 55 HG1 GLN 55 56.483 -11.369 8.062
466 HE21 GLN 55 HE21 GLN 55 57.701 -9.506 7.880
467 HE22 GLN 55 HE22 GLN 55 57.010 -7.975 7.464
468 H HIS 56 HN HIS 56 55.400 -14.467 10.254
469 HA HIS 56 HA HIS 56 54.775 -12.895 12.618
470 HB2 HIS 56 HB2 HIS 56 54.241 -15.049 13.873
471 HB3 HIS 56 HB1 HIS 56 53.017 -14.479 12.753
472 HD1 HIS 56 HD1 HIS 56 52.242 -16.096 10.998
473 HD2 HIS 56 HD2 HIS 56 55.733 -17.355 12.873
474 HE1 HIS 56 HE1 HIS 56 52.640 -18.430 10.176
475 H HIS 57 HN HIS 57 56.547 -12.490 13.676
476 HA HIS 57 HA HIS 57 58.938 -14.019 13.142
477 HB2 HIS 57 HB2 HIS 57 58.962 -11.518 13.336
478 HB3 HIS 57 HB1 HIS 57 58.564 -11.690 15.041
479 HD1 HIS 57 HD1 HIS 57 60.438 -12.825 16.564
480 HD2 HIS 57 HD2 HIS 57 61.618 -11.809 12.710
481 HE1 HIS 57 HE1 HIS 57 62.944 -12.899 16.589
Start of MODEL 7
1 H1 ALA 1 HT1 ALA 1 67.200 8.660 -13.993
2 H2 ALA 1 HT2 ALA 1 68.505 8.933 -12.962
3 H3 ALA 1 HT3 ALA 1 67.392 7.711 -12.614
4 HA ALA 1 HA ALA 1 68.041 6.479 -14.540
5 HB1 ALA 1 HB1 ALA 1 68.610 8.410 -15.936
6 HB2 ALA 1 HB2 ALA 1 69.901 7.207 -15.921
7 HB3 ALA 1 HB3 ALA 1 70.056 8.681 -14.964
8 H SER 2 HN SER 2 69.179 7.617 -11.670
9 HA SER 2 HA SER 2 71.428 5.740 -11.658
10 HB2 SER 2 HB2 SER 2 70.996 8.120 -9.848
11 HB3 SER 2 HB1 SER 2 72.422 7.083 -9.894
12 HG SER 2 HG SER 2 72.549 9.122 -11.094
13 H MET 3 HN MET 3 69.361 7.206 -9.129
14 HA MET 3 HA MET 3 69.366 4.646 -7.742
15 HB2 MET 3 HB2 MET 3 69.865 6.668 -6.457
16 HB3 MET 3 HB1 MET 3 68.302 7.341 -6.889
17 HG2 MET 3 HG2 MET 3 67.188 5.540 -5.674
18 HG3 MET 3 HG1 MET 3 68.757 4.866 -5.239
19 HE1 MET 3 HE1 MET 3 67.963 4.887 -2.676
20 HE2 MET 3 HE2 MET 3 66.422 5.589 -3.171
21 HE3 MET 3 HE3 MET 3 67.349 6.329 -1.866
22 H GLY 4 HN GLY 4 67.275 6.539 -9.695
23 HA2 GLY 4 HA2 GLY 4 64.807 5.457 -8.703
24 HA3 GLY 4 HA1 GLY 4 65.012 6.432 -10.148
25 H LYS 5 HN LYS 5 66.898 3.543 -9.741
26 HA LYS 5 HA LYS 5 65.701 2.389 -12.084
27 HB2 LYS 5 HB2 LYS 5 67.853 1.379 -10.219
28 HB3 LYS 5 HB1 LYS 5 67.325 0.524 -11.664
29 HG2 LYS 5 HG2 LYS 5 68.041 2.382 -13.049
30 HG3 LYS 5 HG1 LYS 5 68.526 3.284 -11.613
31 HD2 LYS 5 HD2 LYS 5 70.181 1.559 -11.090
32 HD3 LYS 5 HD1 LYS 5 69.685 0.648 -12.517
33 HE2 LYS 5 HE2 LYS 5 70.404 2.438 -13.964
34 HE3 LYS 5 HE1 LYS 5 70.775 3.458 -12.577
35 HZ1 LYS 5 HZ1 LYS 5 72.499 1.904 -11.934
36 HZ2 LYS 5 HZ2 LYS 5 72.758 2.447 -13.517
37 HZ3 LYS 5 HZ3 LYS 5 72.128 0.905 -13.248
38 H SER 6 HN SER 6 63.783 1.545 -11.903
39 HA SER 6 HA SER 6 62.030 0.294 -11.260
40 HB2 SER 6 HB2 SER 6 63.985 -1.258 -9.551
41 HB3 SER 6 HB1 SER 6 62.403 -1.801 -10.105
42 HG SER 6 HG SER 6 63.966 -0.978 -12.169
43 H LYS 7 HN LYS 7 61.530 2.384 -10.209
44 HA LYS 7 HA LYS 7 61.379 2.064 -7.299
45 HB2 LYS 7 HB2 LYS 7 62.631 4.067 -8.022
46 HB3 LYS 7 HB1 LYS 7 61.230 4.610 -8.932
47 HG2 LYS 7 HG2 LYS 7 61.437 5.804 -6.818
48 HG3 LYS 7 HG1 LYS 7 59.958 4.844 -6.865
49 HD2 LYS 7 HD2 LYS 7 61.018 3.111 -5.523
50 HD3 LYS 7 HD1 LYS 7 62.532 4.017 -5.519
51 HE2 LYS 7 HE2 LYS 7 61.441 5.839 -4.314
52 HE3 LYS 7 HE1 LYS 7 59.913 4.960 -4.351
53 HZ1 LYS 7 HZ1 LYS 7 60.921 3.222 -3.016
54 HZ2 LYS 7 HZ2 LYS 7 61.039 4.709 -2.231
55 HZ3 LYS 7 HZ3 LYS 7 62.390 4.052 -2.994
56 H GLU 8 HN GLU 8 59.542 0.870 -7.218
57 HA GLU 8 HA GLU 8 57.195 1.656 -8.668
58 HB2 GLU 8 HB2 GLU 8 57.741 -0.507 -6.645
59 HB3 GLU 8 HB1 GLU 8 56.127 -0.190 -7.259
60 HG2 GLU 8 HG2 GLU 8 57.056 -2.012 -8.489
61 HG3 GLU 8 HG1 GLU 8 56.974 -0.615 -9.556
62 H ILE 9 HN ILE 9 56.061 3.344 -8.064
63 HA ILE 9 HA ILE 9 56.161 4.479 -5.462
64 HB ILE 9 HB ILE 9 54.329 5.952 -6.239
65 HG12 ILE 9 HG12 ILE 9 54.479 4.343 -8.800
66 HG13 ILE 9 HG11 ILE 9 53.166 4.253 -7.634
67 HG21 ILE 9 HG21 ILE 9 56.598 5.606 -8.198
68 HG22 ILE 9 HG22 ILE 9 56.637 6.548 -6.709
69 HG23 ILE 9 HG23 ILE 9 55.594 7.048 -8.039
70 HD11 ILE 9 HD11 ILE 9 52.622 6.582 -8.061
71 HD12 ILE 9 HD12 ILE 9 52.590 5.633 -9.548
72 HD13 ILE 9 HD13 ILE 9 53.960 6.689 -9.204
73 H SER 10 HN SER 10 54.270 2.001 -6.880
74 HA SER 10 HA SER 10 51.966 2.193 -5.252
75 HB2 SER 10 HB2 SER 10 53.128 -0.260 -6.585
76 HB3 SER 10 HB1 SER 10 51.475 -0.080 -5.998
77 HG SER 10 HG SER 10 52.637 1.615 -7.952
78 H GLN 11 HN GLN 11 55.144 0.925 -4.737
79 HA GLN 11 HA GLN 11 54.602 -0.758 -2.534
80 HB2 GLN 11 HB2 GLN 11 56.725 -0.802 -3.795
81 HB3 GLN 11 HB1 GLN 11 57.108 0.803 -3.192
82 HG2 GLN 11 HG2 GLN 11 57.038 -0.147 -0.880
83 HG3 GLN 11 HG1 GLN 11 56.895 -1.744 -1.615
84 HE21 GLN 11 HE21 GLN 11 58.639 -2.575 -2.765
85 HE22 GLN 11 HE22 GLN 11 60.240 -1.955 -2.571
86 H ASP 12 HN ASP 12 55.642 2.619 -2.787
87 HA ASP 12 HA ASP 12 55.582 3.157 -0.006
88 HB2 ASP 12 HB2 ASP 12 56.871 4.569 -1.507
89 HB3 ASP 12 HB1 ASP 12 55.411 5.024 -2.379
90 H LEU 13 HN LEU 13 53.289 3.608 -2.635
91 HA LEU 13 HA LEU 13 51.262 4.926 -1.280
92 HB2 LEU 13 HB2 LEU 13 51.293 4.537 -3.711
93 HB3 LEU 13 HB1 LEU 13 51.003 2.832 -3.439
94 HG LEU 13 HG LEU 13 48.803 3.393 -2.444
95 HD11 LEU 13 HD11 LEU 13 49.470 6.188 -3.351
96 HD12 LEU 13 HD12 LEU 13 49.281 5.645 -1.684
97 HD13 LEU 13 HD13 LEU 13 47.897 5.641 -2.774
98 HD21 LEU 13 HD21 LEU 13 48.971 2.760 -4.788
99 HD22 LEU 13 HD22 LEU 13 49.272 4.439 -5.235
100 HD23 LEU 13 HD23 LEU 13 47.712 3.973 -4.559
101 H ARG 14 HN ARG 14 51.698 1.418 -1.737
102 HA ARG 14 HA ARG 14 49.549 0.574 -0.160
103 HB2 ARG 14 HB2 ARG 14 50.565 -1.035 -1.570
104 HB3 ARG 14 HB1 ARG 14 52.159 -0.734 -0.901
105 HG2 ARG 14 HG2 ARG 14 50.460 -1.595 1.213
106 HG3 ARG 14 HG1 ARG 14 50.273 -2.707 -0.145
107 HD2 ARG 14 HD2 ARG 14 52.619 -3.138 -0.214
108 HD3 ARG 14 HD1 ARG 14 52.949 -1.836 0.925
109 HE ARG 14 HE ARG 14 51.463 -3.366 2.451
110 HH11 ARG 14 HH11 ARG 14 53.910 -4.395 0.168
111 HH12 ARG 14 HH12 ARG 14 54.422 -5.740 1.122
112 HH21 ARG 14 HH21 ARG 14 52.147 -5.155 3.726
113 HH22 ARG 14 HH22 ARG 14 53.418 -6.177 3.151
114 H LYS 15 HN LYS 15 52.880 1.336 0.703
115 HA LYS 15 HA LYS 15 52.834 0.444 3.354
116 HB2 LYS 15 HB2 LYS 15 54.848 1.155 1.997
117 HB3 LYS 15 HB1 LYS 15 54.381 2.818 2.306
118 HG2 LYS 15 HG2 LYS 15 56.145 2.088 3.812
119 HG3 LYS 15 HG1 LYS 15 54.665 2.466 4.699
120 HD2 LYS 15 HD2 LYS 15 54.145 0.139 4.948
121 HD3 LYS 15 HD1 LYS 15 55.455 -0.323 3.859
122 HE2 LYS 15 HE2 LYS 15 56.014 -0.682 6.237
123 HE3 LYS 15 HE1 LYS 15 57.099 0.458 5.447
124 HZ1 LYS 15 HZ1 LYS 15 55.920 2.271 6.460
125 HZ2 LYS 15 HZ2 LYS 15 56.392 1.186 7.663
126 HZ3 LYS 15 HZ3 LYS 15 54.788 1.225 7.145
127 H LYS 16 HN LYS 16 51.804 3.470 1.878
128 HA LYS 16 HA LYS 16 51.183 4.726 4.383
129 HB2 LYS 16 HB2 LYS 16 50.396 5.447 1.558
130 HB3 LYS 16 HB1 LYS 16 50.060 6.437 2.971
131 HG2 LYS 16 HG2 LYS 16 52.505 6.590 3.369
132 HG3 LYS 16 HG1 LYS 16 52.758 5.735 1.845
133 HD2 LYS 16 HD2 LYS 16 51.565 7.511 0.656
134 HD3 LYS 16 HD1 LYS 16 51.308 8.360 2.180
135 HE2 LYS 16 HE2 LYS 16 53.956 7.762 0.869
136 HE3 LYS 16 HE1 LYS 16 53.174 9.337 0.992
137 HZ1 LYS 16 HZ1 LYS 16 54.225 7.701 3.235
138 HZ2 LYS 16 HZ2 LYS 16 53.360 9.138 3.430
139 HZ3 LYS 16 HZ3 LYS 16 54.861 9.157 2.657
140 H ILE 17 HN ILE 17 49.387 3.095 1.822
141 HA ILE 17 HA ILE 17 46.788 3.508 2.641
142 HB ILE 17 HB ILE 17 48.023 1.041 1.399
143 HG12 ILE 17 HG12 ILE 17 48.134 3.054 0.013
144 HG13 ILE 17 HG11 ILE 17 47.022 1.882 -0.680
145 HG21 ILE 17 HG21 ILE 17 45.755 0.356 0.762
146 HG22 ILE 17 HG22 ILE 17 45.098 1.666 1.743
147 HG23 ILE 17 HG23 ILE 17 45.996 0.353 2.507
148 HD11 ILE 17 HD11 ILE 17 45.137 3.164 0.246
149 HD12 ILE 17 HD12 ILE 17 46.121 4.108 -0.872
150 HD13 ILE 17 HD13 ILE 17 46.278 4.359 0.866
151 H VAL 18 HN VAL 18 48.952 0.885 3.689
152 HA VAL 18 HA VAL 18 47.145 -0.327 5.473
153 HB VAL 18 HB VAL 18 50.168 -0.285 5.671
154 HG11 VAL 18 HG11 VAL 18 49.905 -2.397 6.889
155 HG12 VAL 18 HG12 VAL 18 48.152 -2.227 6.801
156 HG13 VAL 18 HG13 VAL 18 49.105 -1.064 7.722
157 HG21 VAL 18 HG21 VAL 18 50.086 -2.400 4.427
158 HG22 VAL 18 HG22 VAL 18 49.436 -1.063 3.482
159 HG23 VAL 18 HG23 VAL 18 48.343 -2.218 4.244
160 H ASP 19 HN ASP 19 49.658 2.109 6.023
161 HA ASP 19 HA ASP 19 49.370 2.342 8.808
162 HB2 ASP 19 HB2 ASP 19 51.305 3.213 7.572
163 HB3 ASP 19 HB1 ASP 19 50.282 4.423 6.811
164 H LEU 20 HN LEU 20 47.918 4.212 6.175
165 HA LEU 20 HA LEU 20 46.467 5.970 7.831
166 HB2 LEU 20 HB2 LEU 20 46.388 5.257 4.943
167 HB3 LEU 20 HB1 LEU 20 45.031 6.134 5.612
168 HG LEU 20 HG LEU 20 46.635 7.640 4.538
169 HD11 LEU 20 HD11 LEU 20 46.566 7.971 7.521
170 HD12 LEU 20 HD12 LEU 20 45.305 8.457 6.389
171 HD13 LEU 20 HD13 LEU 20 46.886 9.235 6.335
172 HD21 LEU 20 HD21 LEU 20 48.687 6.375 4.900
173 HD22 LEU 20 HD22 LEU 20 48.584 6.689 6.633
174 HD23 LEU 20 HD23 LEU 20 48.847 8.023 5.509
175 H HIS 21 HN HIS 21 45.684 2.808 6.487
176 HA HIS 21 HA HIS 21 42.932 2.892 7.185
177 HB2 HIS 21 HB2 HIS 21 44.821 0.713 6.434
178 HB3 HIS 21 HB1 HIS 21 43.324 0.259 7.243
179 HD1 HIS 21 HD1 HIS 21 41.078 1.011 6.004
180 HD2 HIS 21 HD2 HIS 21 44.568 1.272 3.777
181 HE1 HIS 21 HE1 HIS 21 40.337 1.292 3.615
182 H LYS 22 HN LYS 22 45.821 1.966 8.922
183 HA LYS 22 HA LYS 22 44.411 0.975 11.202
184 HB2 LYS 22 HB2 LYS 22 47.268 1.928 10.915
185 HB3 LYS 22 HB1 LYS 22 46.621 1.109 12.326
186 HG2 LYS 22 HG2 LYS 22 46.821 -0.057 9.553
187 HG3 LYS 22 HG1 LYS 22 47.899 -0.405 10.902
188 HD2 LYS 22 HD2 LYS 22 44.935 -0.997 10.806
189 HD3 LYS 22 HD1 LYS 22 46.228 -2.176 10.596
190 HE2 LYS 22 HE2 LYS 22 45.687 -0.551 13.085
191 HE3 LYS 22 HE1 LYS 22 45.308 -2.254 12.858
192 HZ1 LYS 22 HZ1 LYS 22 47.355 -1.954 14.102
193 HZ2 LYS 22 HZ2 LYS 22 48.042 -1.090 12.825
194 HZ3 LYS 22 HZ3 LYS 22 47.665 -2.720 12.629
195 H SER 23 HN SER 23 45.224 4.067 10.010
196 HA SER 23 HA SER 23 45.102 5.455 12.517
197 HB2 SER 23 HB2 SER 23 44.936 6.536 9.696
198 HB3 SER 23 HB1 SER 23 45.237 7.482 11.154
199 HG SER 23 HG SER 23 46.913 5.312 10.457
200 H GLY 24 HN GLY 24 42.841 4.363 10.150
201 HA2 GLY 24 HA2 GLY 24 40.543 4.231 10.324
202 HA3 GLY 24 HA1 GLY 24 40.640 5.125 11.829
203 H SER 25 HN SER 25 40.612 7.403 11.774
204 HA SER 25 HA SER 25 38.818 8.470 9.890
205 HB2 SER 25 HB2 SER 25 40.622 9.931 11.818
206 HB3 SER 25 HB1 SER 25 39.206 10.607 11.013
207 HG SER 25 HG SER 25 38.345 8.428 12.141
208 H SER 26 HN SER 26 42.331 8.810 10.203
209 HA SER 26 HA SER 26 42.724 10.785 8.276
210 HB2 SER 26 HB2 SER 26 44.660 8.555 8.877
211 HB3 SER 26 HB1 SER 26 45.027 10.211 8.388
212 HG SER 26 HG SER 26 44.891 10.807 10.398
213 H LEU 27 HN LEU 27 41.957 7.445 7.893
214 HA LEU 27 HA LEU 27 43.033 6.959 5.333
215 HB2 LEU 27 HB2 LEU 27 42.235 5.204 6.891
216 HB3 LEU 27 HB1 LEU 27 40.592 5.746 6.654
217 HG LEU 27 HG LEU 27 41.360 3.623 5.438
218 HD11 LEU 27 HD11 LEU 27 40.071 5.828 3.845
219 HD12 LEU 27 HD12 LEU 27 39.252 4.712 4.938
220 HD13 LEU 27 HD13 LEU 27 40.011 4.107 3.465
221 HD21 LEU 27 HD21 LEU 27 43.488 4.490 4.619
222 HD22 LEU 27 HD22 LEU 27 42.628 5.675 3.633
223 HD23 LEU 27 HD23 LEU 27 42.458 3.952 3.292
224 H GLY 28 HN GLY 28 40.044 8.442 6.424
225 HA2 GLY 28 HA2 GLY 28 38.690 8.443 3.953
226 HA3 GLY 28 HA1 GLY 28 38.379 9.535 5.294
227 H ALA 29 HN ALA 29 41.053 10.613 5.349
228 HA ALA 29 HA ALA 29 40.700 12.772 3.595
229 HB1 ALA 29 HB1 ALA 29 42.895 13.515 4.333
230 HB2 ALA 29 HB2 ALA 29 43.212 11.927 5.030
231 HB3 ALA 29 HB3 ALA 29 41.938 12.944 5.699
232 H ILE 30 HN ILE 30 43.022 10.053 3.459
233 HA ILE 30 HA ILE 30 44.130 10.930 0.991
234 HB ILE 30 HB ILE 30 45.265 8.782 0.843
235 HG12 ILE 30 HG12 ILE 30 43.827 7.907 3.347
236 HG13 ILE 30 HG11 ILE 30 43.252 7.479 1.740
237 HG21 ILE 30 HG21 ILE 30 45.269 9.834 3.668
238 HG22 ILE 30 HG22 ILE 30 46.182 10.503 2.316
239 HG23 ILE 30 HG23 ILE 30 46.546 8.883 2.908
240 HD11 ILE 30 HD11 ILE 30 45.932 6.759 2.908
241 HD12 ILE 30 HD12 ILE 30 45.361 6.334 1.297
242 HD13 ILE 30 HD13 ILE 30 44.551 5.680 2.719
243 H SER 31 HN SER 31 41.435 8.882 1.826
244 HA SER 31 HA SER 31 41.129 7.626 -0.677
245 HB2 SER 31 HB2 SER 31 40.015 6.961 1.511
246 HB3 SER 31 HB1 SER 31 38.888 8.292 1.245
247 HG SER 31 HG SER 31 37.886 7.143 -0.209
248 H LYS 32 HN LYS 32 39.980 10.694 0.621
249 HA LYS 32 HA LYS 32 38.346 11.351 -1.633
250 HB2 LYS 32 HB2 LYS 32 39.532 13.112 0.519
251 HB3 LYS 32 HB1 LYS 32 38.328 13.627 -0.651
252 HG2 LYS 32 HG2 LYS 32 36.701 12.123 0.279
253 HG3 LYS 32 HG1 LYS 32 37.912 11.429 1.361
254 HD2 LYS 32 HD2 LYS 32 38.175 13.612 2.452
255 HD3 LYS 32 HD1 LYS 32 36.950 14.289 1.379
256 HE2 LYS 32 HE2 LYS 32 35.277 12.795 2.299
257 HE3 LYS 32 HE1 LYS 32 36.496 12.017 3.310
258 HZ1 LYS 32 HZ1 LYS 32 36.797 14.066 4.509
259 HZ2 LYS 32 HZ2 LYS 32 35.156 13.663 4.521
260 HZ3 LYS 32 HZ3 LYS 32 35.720 14.880 3.498
261 H ARG 33 HN ARG 33 41.666 11.946 -0.691
262 HA ARG 33 HA ARG 33 42.217 13.874 -2.730
263 HB2 ARG 33 HB2 ARG 33 44.078 12.209 -1.039
264 HB3 ARG 33 HB1 ARG 33 44.589 13.521 -2.090
265 HG2 ARG 33 HG2 ARG 33 43.323 15.103 -0.756
266 HG3 ARG 33 HG1 ARG 33 42.742 13.790 0.270
267 HD2 ARG 33 HD2 ARG 33 45.055 13.294 0.922
268 HD3 ARG 33 HD1 ARG 33 45.620 14.626 -0.085
269 HE ARG 33 HE ARG 33 43.857 15.831 1.546
270 HH11 ARG 33 HH11 ARG 33 46.626 13.755 2.127
271 HH12 ARG 33 HH12 ARG 33 46.953 14.402 3.698
272 HH21 ARG 33 HH21 ARG 33 44.290 16.699 3.646
273 HH22 ARG 33 HH22 ARG 33 45.624 16.090 4.564
274 H LEU 34 HN LEU 34 43.025 10.438 -2.349
275 HA LEU 34 HA LEU 34 44.326 10.370 -4.921
276 HB2 LEU 34 HB2 LEU 34 43.686 8.138 -3.005
277 HB3 LEU 34 HB1 LEU 34 44.725 8.018 -4.412
278 HG LEU 34 HG LEU 34 45.280 9.775 -2.027
279 HD11 LEU 34 HD11 LEU 34 45.378 7.435 -1.402
280 HD12 LEU 34 HD12 LEU 34 47.003 8.123 -1.470
281 HD13 LEU 34 HD13 LEU 34 46.423 7.094 -2.780
282 HD21 LEU 34 HD21 LEU 34 47.525 9.946 -3.011
283 HD22 LEU 34 HD22 LEU 34 46.289 10.608 -4.078
284 HD23 LEU 34 HD23 LEU 34 46.977 9.017 -4.405
285 H LYS 35 HN LYS 35 41.232 9.455 -3.580
286 HA LYS 35 HA LYS 35 39.329 8.647 -4.486
287 HB2 LYS 35 HB2 LYS 35 40.573 9.911 -6.920
288 HB3 LYS 35 HB1 LYS 35 38.997 9.139 -6.985
289 HG2 LYS 35 HG2 LYS 35 39.731 11.435 -5.178
290 HG3 LYS 35 HG1 LYS 35 38.850 11.572 -6.703
291 HD2 LYS 35 HD2 LYS 35 37.108 10.066 -5.765
292 HD3 LYS 35 HD1 LYS 35 37.965 10.096 -4.225
293 HE2 LYS 35 HE2 LYS 35 37.651 12.498 -4.073
294 HE3 LYS 35 HE1 LYS 35 36.854 12.509 -5.646
295 HZ1 LYS 35 HZ1 LYS 35 35.117 11.099 -4.719
296 HZ2 LYS 35 HZ2 LYS 35 35.242 12.550 -3.866
297 HZ3 LYS 35 HZ3 LYS 35 35.875 11.131 -3.209
298 H VAL 36 HN VAL 36 41.565 6.850 -4.256
299 HA VAL 36 HA VAL 36 41.714 5.143 -6.516
300 HB VAL 36 HB VAL 36 42.242 4.446 -3.611
301 HG11 VAL 36 HG11 VAL 36 41.990 2.474 -5.028
302 HG12 VAL 36 HG12 VAL 36 43.663 2.665 -4.503
303 HG13 VAL 36 HG13 VAL 36 43.198 3.113 -6.144
304 HG21 VAL 36 HG21 VAL 36 44.140 5.452 -5.728
305 HG22 VAL 36 HG22 VAL 36 44.596 4.912 -4.110
306 HG23 VAL 36 HG23 VAL 36 43.586 6.345 -4.312
307 HA PRO 37 HA PRO 37 37.653 3.309 -6.450
308 HB2 PRO 37 HB2 PRO 37 39.256 0.975 -7.412
309 HB3 PRO 37 HB1 PRO 37 37.748 1.640 -8.052
310 HG2 PRO 37 HG2 PRO 37 40.055 2.140 -9.266
311 HG3 PRO 37 HG1 PRO 37 38.819 3.401 -9.115
312 HD2 PRO 37 HD2 PRO 37 41.390 3.085 -7.650
313 HD3 PRO 37 HD1 PRO 37 40.519 4.563 -8.109
314 H ARG 38 HN ARG 38 36.627 2.411 -4.803
315 HA ARG 38 HA ARG 38 37.876 1.430 -2.521
316 HB2 ARG 38 HB2 ARG 38 35.593 2.374 -2.587
317 HB3 ARG 38 HB1 ARG 38 35.034 0.930 -3.418
318 HG2 ARG 38 HG2 ARG 38 35.505 -0.425 -1.489
319 HG3 ARG 38 HG1 ARG 38 36.245 0.946 -0.661
320 HD2 ARG 38 HD2 ARG 38 34.095 2.121 -0.704
321 HD3 ARG 38 HD1 ARG 38 33.362 0.741 -1.515
322 HE ARG 38 HE ARG 38 34.014 -0.539 0.562
323 HH11 ARG 38 HH11 ARG 38 33.295 2.913 0.640
324 HH12 ARG 38 HH12 ARG 38 32.797 2.889 2.292
325 HH21 ARG 38 HH21 ARG 38 33.329 -0.552 2.759
326 HH22 ARG 38 HH22 ARG 38 32.808 0.928 3.497
327 H SER 39 HN SER 39 36.632 -0.287 -5.324
328 HA SER 39 HA SER 39 36.765 -2.887 -4.264
329 HB2 SER 39 HB2 SER 39 37.116 -2.027 -7.141
330 HB3 SER 39 HB1 SER 39 36.678 -3.640 -6.580
331 HG SER 39 HG SER 39 34.973 -1.963 -7.268
332 H SER 40 HN SER 40 39.183 -0.850 -5.822
333 HA SER 40 HA SER 40 41.166 -2.890 -6.000
334 HB2 SER 40 HB2 SER 40 41.557 0.109 -6.029
335 HB3 SER 40 HB1 SER 40 42.647 -1.113 -6.687
336 HG SER 40 HG SER 40 41.525 -0.458 -8.421
337 H VAL 41 HN VAL 41 40.338 -0.366 -3.693
338 HA VAL 41 HA VAL 41 42.594 -0.639 -2.007
339 HB VAL 41 HB VAL 41 39.798 0.291 -1.282
340 HG11 VAL 41 HG11 VAL 41 41.117 -0.273 0.684
341 HG12 VAL 41 HG12 VAL 41 40.888 1.472 0.566
342 HG13 VAL 41 HG13 VAL 41 42.432 0.753 0.112
343 HG21 VAL 41 HG21 VAL 41 42.204 1.878 -2.177
344 HG22 VAL 41 HG22 VAL 41 40.674 2.556 -1.626
345 HG23 VAL 41 HG23 VAL 41 40.732 1.604 -3.108
346 H GLN 42 HN GLN 42 39.428 -2.179 -2.096
347 HA GLN 42 HA GLN 42 39.530 -3.604 0.303
348 HB2 GLN 42 HB2 GLN 42 37.505 -3.373 -1.070
349 HB3 GLN 42 HB1 GLN 42 38.222 -4.396 -2.306
350 HG2 GLN 42 HG2 GLN 42 38.234 -6.277 -0.766
351 HG3 GLN 42 HG1 GLN 42 37.561 -5.254 0.504
352 HE21 GLN 42 HE21 GLN 42 36.932 -6.894 -2.487
353 HE22 GLN 42 HE22 GLN 42 35.210 -6.779 -2.422
354 H THR 43 HN THR 43 40.884 -4.341 -2.858
355 HA THR 43 HA THR 43 41.667 -6.987 -2.299
356 HB THR 43 HB THR 43 42.972 -5.035 -4.206
357 HG1 THR 43 HG1 THR 43 40.804 -6.851 -4.642
358 HG21 THR 43 HG21 THR 43 43.572 -7.068 -5.458
359 HG22 THR 43 HG22 THR 43 42.840 -8.053 -4.190
360 HG23 THR 43 HG23 THR 43 44.266 -7.081 -3.835
361 H ILE 44 HN ILE 44 43.316 -3.864 -1.974
362 HA ILE 44 HA ILE 44 45.829 -4.863 -1.151
363 HB ILE 44 HB ILE 44 44.547 -2.168 -0.639
364 HG12 ILE 44 HG12 ILE 44 44.959 -2.724 -3.018
365 HG13 ILE 44 HG11 ILE 44 45.932 -1.369 -2.465
366 HG21 ILE 44 HG21 ILE 44 46.251 -2.565 1.040
367 HG22 ILE 44 HG22 ILE 44 46.812 -1.356 -0.115
368 HG23 ILE 44 HG23 ILE 44 47.412 -3.012 -0.212
369 HD11 ILE 44 HD11 ILE 44 47.230 -2.846 -3.883
370 HD12 ILE 44 HD12 ILE 44 46.883 -4.206 -2.818
371 HD13 ILE 44 HD13 ILE 44 47.862 -2.862 -2.237
372 H VAL 45 HN VAL 45 43.079 -3.580 0.722
373 HA VAL 45 HA VAL 45 44.307 -3.866 3.218
374 HB VAL 45 HB VAL 45 42.079 -3.666 4.234
375 HG11 VAL 45 HG11 VAL 45 43.233 -1.663 3.536
376 HG12 VAL 45 HG12 VAL 45 41.496 -1.481 3.298
377 HG13 VAL 45 HG13 VAL 45 42.547 -1.806 1.919
378 HG21 VAL 45 HG21 VAL 45 41.078 -3.874 1.409
379 HG22 VAL 45 HG22 VAL 45 40.103 -3.355 2.783
380 HG23 VAL 45 HG23 VAL 45 40.750 -4.997 2.729
381 H ARG 46 HN ARG 46 42.283 -6.125 1.416
382 HA ARG 46 HA ARG 46 42.172 -8.030 3.521
383 HB2 ARG 46 HB2 ARG 46 40.520 -7.958 1.708
384 HB3 ARG 46 HB1 ARG 46 41.765 -8.413 0.555
385 HG2 ARG 46 HG2 ARG 46 42.021 -10.564 1.627
386 HG3 ARG 46 HG1 ARG 46 40.855 -10.107 2.870
387 HD2 ARG 46 HD2 ARG 46 40.272 -10.295 -0.078
388 HD3 ARG 46 HD1 ARG 46 39.867 -11.527 1.115
389 HE ARG 46 HE ARG 46 38.715 -9.253 2.077
390 HH11 ARG 46 HH11 ARG 46 38.523 -10.998 -0.966
391 HH12 ARG 46 HH12 ARG 46 36.882 -10.543 -1.269
392 HH21 ARG 46 HH21 ARG 46 36.538 -8.634 1.659
393 HH22 ARG 46 HH22 ARG 46 35.748 -9.200 0.231
394 H LYS 47 HN LYS 47 44.427 -7.378 0.938
395 HA LYS 47 HA LYS 47 45.742 -9.883 1.058
396 HB2 LYS 47 HB2 LYS 47 45.839 -8.328 -0.894
397 HB3 LYS 47 HB1 LYS 47 46.877 -7.271 0.053
398 HG2 LYS 47 HG2 LYS 47 48.627 -8.860 0.090
399 HG3 LYS 47 HG1 LYS 47 47.572 -10.141 -0.507
400 HD2 LYS 47 HD2 LYS 47 49.018 -9.370 -2.293
401 HD3 LYS 47 HD1 LYS 47 47.348 -8.923 -2.643
402 HE2 LYS 47 HE2 LYS 47 47.804 -6.653 -1.807
403 HE3 LYS 47 HE1 LYS 47 49.479 -7.117 -1.505
404 HZ1 LYS 47 HZ1 LYS 47 49.318 -5.964 -3.592
405 HZ2 LYS 47 HZ2 LYS 47 48.119 -7.018 -4.139
406 HZ3 LYS 47 HZ3 LYS 47 49.686 -7.585 -3.900
407 H TYR 48 HN TYR 48 46.327 -6.758 2.694
408 HA TYR 48 HA TYR 48 48.684 -7.828 3.929
409 HB2 TYR 48 HB2 TYR 48 48.932 -5.780 5.145
410 HB3 TYR 48 HB1 TYR 48 48.424 -5.358 3.524
411 HD1 TYR 48 HD1 TYR 48 46.882 -6.015 6.890
412 HD2 TYR 48 HD2 TYR 48 46.859 -3.665 3.343
413 HE1 TYR 48 HE1 TYR 48 45.146 -4.579 7.862
414 HE2 TYR 48 HE2 TYR 48 45.113 -2.226 4.309
415 HH TYR 48 HH TYR 48 44.190 -2.450 7.645
416 H LYS 49 HN LYS 49 45.339 -7.915 4.597
417 HA LYS 49 HA LYS 49 45.532 -8.545 7.363
418 HB2 LYS 49 HB2 LYS 49 43.378 -9.074 5.314
419 HB3 LYS 49 HB1 LYS 49 43.221 -9.533 7.004
420 HG2 LYS 49 HG2 LYS 49 43.382 -7.227 7.689
421 HG3 LYS 49 HG1 LYS 49 43.671 -6.724 6.025
422 HD2 LYS 49 HD2 LYS 49 41.449 -7.575 5.402
423 HD3 LYS 49 HD1 LYS 49 41.165 -8.029 7.082
424 HE2 LYS 49 HE2 LYS 49 41.681 -5.233 6.073
425 HE3 LYS 49 HE1 LYS 49 40.104 -5.889 6.508
426 HZ1 LYS 49 HZ1 LYS 49 42.402 -5.552 8.364
427 HZ2 LYS 49 HZ2 LYS 49 40.887 -6.164 8.779
428 HZ3 LYS 49 HZ3 LYS 49 41.041 -4.552 8.289
429 H HIS 50 HN HIS 50 45.555 -10.406 4.379
430 HA HIS 50 HA HIS 50 45.660 -12.953 5.660
431 HB2 HIS 50 HB2 HIS 50 44.979 -12.675 3.284
432 HB3 HIS 50 HB1 HIS 50 46.624 -12.187 2.892
433 HD1 HIS 50 HD1 HIS 50 48.065 -14.024 2.075
434 HD2 HIS 50 HD2 HIS 50 44.978 -15.431 4.468
435 HE1 HIS 50 HE1 HIS 50 48.288 -16.522 2.048
436 H HIS 51 HN HIS 51 48.037 -10.603 4.614
437 HA HIS 51 HA HIS 51 50.355 -12.105 5.032
438 HB2 HIS 51 HB2 HIS 51 50.379 -9.892 3.952
439 HB3 HIS 51 HB1 HIS 51 49.919 -9.138 5.471
440 HD1 HIS 51 HD1 HIS 51 51.767 -8.687 7.173
441 HD2 HIS 51 HD2 HIS 51 53.072 -10.808 3.841
442 HE1 HIS 51 HE1 HIS 51 54.274 -8.696 7.322
443 H GLY 52 HN GLY 52 48.360 -10.221 7.232
444 HA2 GLY 52 HA2 GLY 52 50.022 -10.647 9.517
445 HA3 GLY 52 HA1 GLY 52 48.387 -10.005 9.521
446 H THR 53 HN THR 53 47.894 -12.655 7.852
447 HA THR 53 HA THR 53 46.763 -14.070 10.037
448 HB THR 53 HB THR 53 47.168 -15.087 7.210
449 HG1 THR 53 HG1 THR 53 45.749 -13.024 8.017
450 HG21 THR 53 HG21 THR 53 45.236 -16.514 7.725
451 HG22 THR 53 HG22 THR 53 45.182 -15.859 9.360
452 HG23 THR 53 HG23 THR 53 46.563 -16.826 8.843
453 H THR 54 HN THR 54 49.109 -15.464 7.640
454 HA THR 54 HA THR 54 50.617 -16.368 10.005
455 HB THR 54 HB THR 54 50.100 -18.254 7.700
456 HG1 THR 54 HG1 THR 54 48.635 -17.907 10.127
457 HG21 THR 54 HG21 THR 54 50.745 -19.960 9.339
458 HG22 THR 54 HG22 THR 54 50.947 -18.717 10.572
459 HG23 THR 54 HG23 THR 54 52.020 -18.753 9.171
460 H GLN 55 HN GLN 55 50.743 -14.780 7.124
461 HA GLN 55 HA GLN 55 53.310 -15.768 6.246
462 HB2 GLN 55 HB2 GLN 55 51.444 -13.648 5.222
463 HB3 GLN 55 HB1 GLN 55 53.080 -13.791 4.597
464 HG2 GLN 55 HG2 GLN 55 51.533 -14.923 3.137
465 HG3 GLN 55 HG1 GLN 55 52.597 -16.096 3.904
466 HE21 GLN 55 HE21 GLN 55 51.216 -17.782 3.598
467 HE22 GLN 55 HE22 GLN 55 49.729 -17.972 4.459
468 H HIS 56 HN HIS 56 54.488 -15.326 8.150
469 HA HIS 56 HA HIS 56 55.922 -14.171 9.461
470 HB2 HIS 56 HB2 HIS 56 55.833 -12.226 7.143
471 HB3 HIS 56 HB1 HIS 56 56.926 -12.052 8.509
472 HD1 HIS 56 HD1 HIS 56 59.160 -13.065 8.163
473 HD2 HIS 56 HD2 HIS 56 56.268 -14.865 5.785
474 HE1 HIS 56 HE1 HIS 56 60.397 -14.738 6.761
475 H HIS 57 HN HIS 57 53.837 -14.069 10.711
476 HA HIS 57 HA HIS 57 52.360 -11.681 10.947
477 HB2 HIS 57 HB2 HIS 57 51.492 -13.827 11.730
478 HB3 HIS 57 HB1 HIS 57 52.771 -13.932 12.932
479 HD1 HIS 57 HD1 HIS 57 49.395 -12.558 12.355
480 HD2 HIS 57 HD2 HIS 57 52.465 -12.075 15.116
481 HE1 HIS 57 HE1 HIS 57 48.355 -11.402 14.318
Start of MODEL 8
1 H1 ALA 1 HT1 ALA 1 52.291 -1.322 -25.759
2 H2 ALA 1 HT2 ALA 1 50.926 -0.694 -24.983
3 H3 ALA 1 HT3 ALA 1 51.106 -2.369 -25.165
4 HA ALA 1 HA ALA 1 52.868 -0.625 -23.560
5 HB1 ALA 1 HB1 ALA 1 51.870 -1.658 -21.611
6 HB2 ALA 1 HB2 ALA 1 50.825 -2.642 -22.633
7 HB3 ALA 1 HB3 ALA 1 50.614 -0.894 -22.584
8 H SER 2 HN SER 2 54.859 -1.452 -23.838
9 HA SER 2 HA SER 2 55.227 -4.261 -24.359
10 HB2 SER 2 HB2 SER 2 57.677 -3.603 -24.360
11 HB3 SER 2 HB1 SER 2 56.668 -2.797 -25.560
12 HG SER 2 HG SER 2 57.781 -1.176 -24.655
13 H MET 3 HN MET 3 56.016 -2.003 -21.763
14 HA MET 3 HA MET 3 56.906 -4.227 -20.081
15 HB2 MET 3 HB2 MET 3 56.952 -1.249 -19.576
16 HB3 MET 3 HB1 MET 3 57.663 -2.474 -18.535
17 HG2 MET 3 HG2 MET 3 59.266 -3.054 -20.228
18 HG3 MET 3 HG1 MET 3 58.496 -1.967 -21.381
19 HE1 MET 3 HE1 MET 3 60.800 -0.584 -17.622
20 HE2 MET 3 HE2 MET 3 60.671 -2.266 -18.133
21 HE3 MET 3 HE3 MET 3 59.247 -1.414 -17.539
22 H GLY 4 HN GLY 4 54.087 -2.930 -20.880
23 HA2 GLY 4 HA2 GLY 4 52.047 -3.527 -19.820
24 HA3 GLY 4 HA1 GLY 4 52.893 -3.550 -18.276
25 H LYS 5 HN LYS 5 50.469 -2.197 -18.690
26 HA LYS 5 HA LYS 5 51.122 0.597 -19.005
27 HB2 LYS 5 HB2 LYS 5 48.991 -0.170 -19.871
28 HB3 LYS 5 HB1 LYS 5 48.520 -0.756 -18.281
29 HG2 LYS 5 HG2 LYS 5 48.535 1.534 -17.432
30 HG3 LYS 5 HG1 LYS 5 49.013 2.121 -19.024
31 HD2 LYS 5 HD2 LYS 5 46.940 1.298 -19.976
32 HD3 LYS 5 HD1 LYS 5 46.471 0.621 -18.415
33 HE2 LYS 5 HE2 LYS 5 46.966 3.547 -18.954
34 HE3 LYS 5 HE1 LYS 5 45.376 2.791 -18.904
35 HZ1 LYS 5 HZ1 LYS 5 45.726 2.227 -16.604
36 HZ2 LYS 5 HZ2 LYS 5 45.983 3.885 -16.809
37 HZ3 LYS 5 HZ3 LYS 5 47.300 2.843 -16.642
38 H SER 6 HN SER 6 52.374 1.271 -17.393
39 HA SER 6 HA SER 6 51.150 1.817 -14.889
40 HB2 SER 6 HB2 SER 6 51.884 -0.508 -14.462
41 HB3 SER 6 HB1 SER 6 53.530 -0.059 -14.904
42 HG SER 6 HG SER 6 53.686 0.335 -12.843
43 H LYS 7 HN LYS 7 51.706 3.864 -14.714
44 HA LYS 7 HA LYS 7 54.251 4.777 -15.761
45 HB2 LYS 7 HB2 LYS 7 52.276 6.098 -16.286
46 HB3 LYS 7 HB1 LYS 7 51.910 6.279 -14.579
47 HG2 LYS 7 HG2 LYS 7 52.884 8.310 -15.484
48 HG3 LYS 7 HG1 LYS 7 53.942 7.590 -14.271
49 HD2 LYS 7 HD2 LYS 7 55.291 6.589 -16.070
50 HD3 LYS 7 HD1 LYS 7 54.246 7.361 -17.264
51 HE2 LYS 7 HE2 LYS 7 54.860 9.556 -16.335
52 HE3 LYS 7 HE1 LYS 7 55.944 8.752 -15.202
53 HZ1 LYS 7 HZ1 LYS 7 57.061 9.641 -17.185
54 HZ2 LYS 7 HZ2 LYS 7 56.180 8.571 -18.152
55 HZ3 LYS 7 HZ3 LYS 7 57.274 7.973 -17.012
56 H GLU 8 HN GLU 8 52.724 4.069 -12.741
57 HA GLU 8 HA GLU 8 55.209 4.626 -11.364
58 HB2 GLU 8 HB2 GLU 8 53.887 6.751 -11.314
59 HB3 GLU 8 HB1 GLU 8 52.630 5.890 -10.437
60 HG2 GLU 8 HG2 GLU 8 54.322 5.383 -8.675
61 HG3 GLU 8 HG1 GLU 8 55.440 6.446 -9.527
62 H ILE 9 HN ILE 9 55.574 2.839 -10.256
63 HA ILE 9 HA ILE 9 53.375 1.203 -9.336
64 HB ILE 9 HB ILE 9 55.240 0.018 -10.308
65 HG12 ILE 9 HG12 ILE 9 55.297 -0.399 -7.310
66 HG13 ILE 9 HG11 ILE 9 54.076 -1.051 -8.396
67 HG21 ILE 9 HG21 ILE 9 56.981 1.314 -8.225
68 HG22 ILE 9 HG22 ILE 9 56.992 1.642 -9.957
69 HG23 ILE 9 HG23 ILE 9 57.494 0.062 -9.355
70 HD11 ILE 9 HD11 ILE 9 55.718 -2.733 -7.816
71 HD12 ILE 9 HD12 ILE 9 57.014 -1.706 -8.431
72 HD13 ILE 9 HD13 ILE 9 55.802 -2.354 -9.537
73 H SER 10 HN SER 10 52.839 0.865 -7.189
74 HA SER 10 HA SER 10 53.512 3.116 -5.500
75 HB2 SER 10 HB2 SER 10 51.450 0.955 -5.114
76 HB3 SER 10 HB1 SER 10 51.592 2.437 -4.172
77 HG SER 10 HG SER 10 51.538 3.102 -6.739
78 H GLN 11 HN GLN 11 55.468 2.770 -4.507
79 HA GLN 11 HA GLN 11 55.747 0.385 -2.834
80 HB2 GLN 11 HB2 GLN 11 57.664 2.606 -3.543
81 HB3 GLN 11 HB1 GLN 11 57.987 1.519 -2.209
82 HG2 GLN 11 HG2 GLN 11 59.179 0.658 -4.019
83 HG3 GLN 11 HG1 GLN 11 57.757 -0.370 -3.872
84 HE21 GLN 11 HE21 GLN 11 57.808 2.856 -5.236
85 HE22 GLN 11 HE22 GLN 11 57.419 2.377 -6.847
86 H ASP 12 HN ASP 12 56.252 3.866 -2.390
87 HA ASP 12 HA ASP 12 56.011 3.839 0.412
88 HB2 ASP 12 HB2 ASP 12 57.132 5.669 -0.700
89 HB3 ASP 12 HB1 ASP 12 55.662 6.096 -1.569
90 H LEU 13 HN LEU 13 53.684 4.643 -2.125
91 HA LEU 13 HA LEU 13 51.574 5.405 -0.458
92 HB2 LEU 13 HB2 LEU 13 51.653 5.829 -2.877
93 HB3 LEU 13 HB1 LEU 13 51.432 4.121 -3.182
94 HG LEU 13 HG LEU 13 49.203 4.275 -2.050
95 HD11 LEU 13 HD11 LEU 13 49.758 7.235 -2.181
96 HD12 LEU 13 HD12 LEU 13 49.604 6.266 -0.716
97 HD13 LEU 13 HD13 LEU 13 48.211 6.494 -1.773
98 HD21 LEU 13 HD21 LEU 13 48.095 5.357 -3.949
99 HD22 LEU 13 HD22 LEU 13 49.398 4.292 -4.475
100 HD23 LEU 13 HD23 LEU 13 49.640 6.039 -4.456
101 H ARG 14 HN ARG 14 52.683 2.233 -1.447
102 HA ARG 14 HA ARG 14 50.344 0.835 -0.636
103 HB2 ARG 14 HB2 ARG 14 51.952 -0.113 -2.241
104 HB3 ARG 14 HB1 ARG 14 53.167 -0.195 -0.975
105 HG2 ARG 14 HG2 ARG 14 51.961 -1.871 0.194
106 HG3 ARG 14 HG1 ARG 14 50.536 -1.642 -0.821
107 HD2 ARG 14 HD2 ARG 14 51.805 -3.663 -1.422
108 HD3 ARG 14 HD1 ARG 14 51.722 -2.501 -2.744
109 HE ARG 14 HE ARG 14 54.076 -1.976 -1.388
110 HH11 ARG 14 HH11 ARG 14 52.679 -4.653 -3.168
111 HH12 ARG 14 HH12 ARG 14 54.203 -5.274 -3.694
112 HH21 ARG 14 HH21 ARG 14 56.105 -2.793 -2.083
113 HH22 ARG 14 HH22 ARG 14 56.164 -4.207 -3.075
114 H LYS 15 HN LYS 15 53.258 1.874 0.982
115 HA LYS 15 HA LYS 15 52.624 0.440 3.398
116 HB2 LYS 15 HB2 LYS 15 54.760 2.342 2.565
117 HB3 LYS 15 HB1 LYS 15 54.422 2.195 4.283
118 HG2 LYS 15 HG2 LYS 15 56.239 0.737 3.661
119 HG3 LYS 15 HG1 LYS 15 54.843 -0.220 4.146
120 HD2 LYS 15 HD2 LYS 15 54.283 -0.574 1.777
121 HD3 LYS 15 HD1 LYS 15 55.702 0.364 1.312
122 HE2 LYS 15 HE2 LYS 15 56.107 -2.065 1.204
123 HE3 LYS 15 HE1 LYS 15 57.165 -1.255 2.355
124 HZ1 LYS 15 HZ1 LYS 15 55.777 -2.027 4.152
125 HZ2 LYS 15 HZ2 LYS 15 56.253 -3.344 3.209
126 HZ3 LYS 15 HZ3 LYS 15 54.687 -2.731 3.068
127 H LYS 16 HN LYS 16 52.113 3.622 2.065
128 HA LYS 16 HA LYS 16 51.245 4.906 4.422
129 HB2 LYS 16 HB2 LYS 16 50.623 5.443 1.519
130 HB3 LYS 16 HB1 LYS 16 50.059 6.468 2.829
131 HG2 LYS 16 HG2 LYS 16 52.944 5.896 2.190
132 HG3 LYS 16 HG1 LYS 16 52.057 7.349 1.734
133 HD2 LYS 16 HD2 LYS 16 51.662 7.839 4.109
134 HD3 LYS 16 HD1 LYS 16 52.585 6.402 4.545
135 HE2 LYS 16 HE2 LYS 16 54.546 7.360 3.392
136 HE3 LYS 16 HE1 LYS 16 53.611 8.819 3.070
137 HZ1 LYS 16 HZ1 LYS 16 55.005 9.090 5.010
138 HZ2 LYS 16 HZ2 LYS 16 54.291 7.752 5.755
139 HZ3 LYS 16 HZ3 LYS 16 53.377 9.138 5.454
140 H ILE 17 HN ILE 17 49.425 3.292 1.823
141 HA ILE 17 HA ILE 17 46.888 3.715 2.904
142 HB ILE 17 HB ILE 17 47.315 2.891 0.579
143 HG12 ILE 17 HG12 ILE 17 45.385 1.284 0.506
144 HG13 ILE 17 HG11 ILE 17 45.396 1.280 2.266
145 HG21 ILE 17 HG21 ILE 17 48.981 1.198 1.059
146 HG22 ILE 17 HG22 ILE 17 47.624 0.506 0.170
147 HG23 ILE 17 HG23 ILE 17 47.776 0.231 1.905
148 HD11 ILE 17 HD11 ILE 17 44.894 3.648 2.298
149 HD12 ILE 17 HD12 ILE 17 43.698 2.776 1.341
150 HD13 ILE 17 HD13 ILE 17 44.963 3.704 0.537
151 H VAL 18 HN VAL 18 49.325 1.351 3.685
152 HA VAL 18 HA VAL 18 47.631 -0.290 5.305
153 HB VAL 18 HB VAL 18 50.632 -0.104 5.000
154 HG11 VAL 18 HG11 VAL 18 49.096 -2.015 6.761
155 HG12 VAL 18 HG12 VAL 18 50.164 -0.726 7.318
156 HG13 VAL 18 HG13 VAL 18 50.823 -2.091 6.415
157 HG21 VAL 18 HG21 VAL 18 50.357 -2.347 4.024
158 HG22 VAL 18 HG22 VAL 18 49.437 -1.121 3.149
159 HG23 VAL 18 HG23 VAL 18 48.613 -2.219 4.256
160 H ASP 19 HN ASP 19 50.160 2.115 6.022
161 HA ASP 19 HA ASP 19 49.903 2.002 8.826
162 HB2 ASP 19 HB2 ASP 19 51.877 2.933 7.704
163 HB3 ASP 19 HB1 ASP 19 50.912 4.278 7.109
164 H LEU 20 HN LEU 20 48.300 3.989 6.411
165 HA LEU 20 HA LEU 20 46.984 5.615 8.368
166 HB2 LEU 20 HB2 LEU 20 46.496 5.316 5.411
167 HB3 LEU 20 HB1 LEU 20 45.726 6.513 6.434
168 HG LEU 20 HG LEU 20 48.692 6.324 5.884
169 HD11 LEU 20 HD11 LEU 20 48.379 8.398 4.645
170 HD12 LEU 20 HD12 LEU 20 46.638 8.291 4.911
171 HD13 LEU 20 HD13 LEU 20 47.460 7.069 3.941
172 HD21 LEU 20 HD21 LEU 20 48.810 8.494 7.031
173 HD22 LEU 20 HD22 LEU 20 48.268 7.204 8.101
174 HD23 LEU 20 HD23 LEU 20 47.103 8.357 7.449
175 H HIS 21 HN HIS 21 46.423 2.512 7.126
176 HA HIS 21 HA HIS 21 43.574 2.544 7.674
177 HB2 HIS 21 HB2 HIS 21 45.463 0.618 6.506
178 HB3 HIS 21 HB1 HIS 21 44.251 -0.115 7.546
179 HD1 HIS 21 HD1 HIS 21 44.553 1.895 4.386
180 HD2 HIS 21 HD2 HIS 21 41.699 -0.233 6.517
181 HE1 HIS 21 HE1 HIS 21 42.538 1.784 2.882
182 H LYS 22 HN LYS 22 46.456 2.169 9.354
183 HA LYS 22 HA LYS 22 45.459 0.544 11.476
184 HB2 LYS 22 HB2 LYS 22 47.955 1.435 10.667
185 HB3 LYS 22 HB1 LYS 22 47.661 2.340 12.144
186 HG2 LYS 22 HG2 LYS 22 48.859 0.332 12.667
187 HG3 LYS 22 HG1 LYS 22 47.222 0.215 13.314
188 HD2 LYS 22 HD2 LYS 22 46.548 -1.213 11.495
189 HD3 LYS 22 HD1 LYS 22 48.096 -0.979 10.683
190 HE2 LYS 22 HE2 LYS 22 49.244 -2.085 12.536
191 HE3 LYS 22 HE1 LYS 22 47.707 -2.291 13.373
192 HZ1 LYS 22 HZ1 LYS 22 46.960 -3.754 11.657
193 HZ2 LYS 22 HZ2 LYS 22 48.471 -4.291 12.181
194 HZ3 LYS 22 HZ3 LYS 22 48.334 -3.464 10.716
195 H SER 23 HN SER 23 45.928 3.988 10.881
196 HA SER 23 HA SER 23 44.769 4.761 13.381
197 HB2 SER 23 HB2 SER 23 44.786 7.062 12.255
198 HB3 SER 23 HB1 SER 23 46.355 6.281 12.468
199 HG SER 23 HG SER 23 46.329 6.962 10.388
200 H GLY 24 HN GLY 24 43.733 4.606 10.001
201 HA2 GLY 24 HA2 GLY 24 41.622 4.132 9.180
202 HA3 GLY 24 HA1 GLY 24 41.005 4.138 10.822
203 H SER 25 HN SER 25 42.094 6.858 11.316
204 HA SER 25 HA SER 25 39.772 8.270 10.502
205 HB2 SER 25 HB2 SER 25 41.101 10.223 11.575
206 HB3 SER 25 HB1 SER 25 40.565 8.886 12.595
207 HG SER 25 HG SER 25 42.678 9.197 13.079
208 H SER 26 HN SER 26 42.693 7.693 8.930
209 HA SER 26 HA SER 26 42.524 10.158 7.349
210 HB2 SER 26 HB2 SER 26 44.679 8.047 7.277
211 HB3 SER 26 HB1 SER 26 44.760 9.682 6.621
212 HG SER 26 HG SER 26 44.163 10.066 9.080
213 H LEU 27 HN LEU 27 41.160 7.218 7.260
214 HA LEU 27 HA LEU 27 41.768 6.147 4.740
215 HB2 LEU 27 HB2 LEU 27 40.579 4.981 6.613
216 HB3 LEU 27 HB1 LEU 27 39.148 5.908 6.223
217 HG LEU 27 HG LEU 27 40.421 4.119 4.161
218 HD11 LEU 27 HD11 LEU 27 38.882 2.345 4.876
219 HD12 LEU 27 HD12 LEU 27 38.428 3.320 6.275
220 HD13 LEU 27 HD13 LEU 27 40.080 2.727 6.112
221 HD21 LEU 27 HD21 LEU 27 38.698 5.693 3.405
222 HD22 LEU 27 HD22 LEU 27 37.580 5.054 4.611
223 HD23 LEU 27 HD23 LEU 27 38.134 4.025 3.288
224 H GLY 28 HN GLY 28 38.958 8.150 5.675
225 HA2 GLY 28 HA2 GLY 28 37.903 8.340 3.060
226 HA3 GLY 28 HA1 GLY 28 37.496 9.383 4.413
227 H ALA 29 HN ALA 29 40.389 10.120 4.666
228 HA ALA 29 HA ALA 29 40.284 12.438 3.027
229 HB1 ALA 29 HB1 ALA 29 42.434 13.007 4.008
230 HB2 ALA 29 HB2 ALA 29 42.597 11.370 4.644
231 HB3 ALA 29 HB3 ALA 29 41.326 12.430 5.253
232 H ILE 30 HN ILE 30 42.533 9.672 3.073
233 HA ILE 30 HA ILE 30 43.907 10.504 0.739
234 HB ILE 30 HB ILE 30 44.877 8.201 0.721
235 HG12 ILE 30 HG12 ILE 30 43.153 7.850 3.188
236 HG13 ILE 30 HG11 ILE 30 42.956 6.993 1.666
237 HG21 ILE 30 HG21 ILE 30 45.939 10.021 1.916
238 HG22 ILE 30 HG22 ILE 30 46.142 8.507 2.795
239 HG23 ILE 30 HG23 ILE 30 44.952 9.690 3.338
240 HD11 ILE 30 HD11 ILE 30 44.035 5.606 3.336
241 HD12 ILE 30 HD12 ILE 30 45.323 6.798 3.512
242 HD13 ILE 30 HD13 ILE 30 45.126 5.930 1.989
243 H SER 31 HN SER 31 41.223 8.270 1.240
244 HA SER 31 HA SER 31 41.228 7.211 -1.376
245 HB2 SER 31 HB2 SER 31 38.832 6.590 -0.839
246 HB3 SER 31 HB1 SER 31 40.035 6.014 0.315
247 HG SER 31 HG SER 31 39.311 7.369 1.793
248 H LYS 32 HN LYS 32 39.989 10.133 -0.010
249 HA LYS 32 HA LYS 32 38.351 10.783 -2.291
250 HB2 LYS 32 HB2 LYS 32 37.743 11.476 -0.010
251 HB3 LYS 32 HB1 LYS 32 39.190 12.462 0.070
252 HG2 LYS 32 HG2 LYS 32 38.346 13.836 -1.771
253 HG3 LYS 32 HG1 LYS 32 36.883 12.855 -1.821
254 HD2 LYS 32 HD2 LYS 32 37.774 14.286 0.674
255 HD3 LYS 32 HD1 LYS 32 36.769 15.067 -0.544
256 HE2 LYS 32 HE2 LYS 32 35.303 14.230 1.139
257 HE3 LYS 32 HE1 LYS 32 35.127 13.189 -0.266
258 HZ1 LYS 32 HZ1 LYS 32 36.340 11.479 0.794
259 HZ2 LYS 32 HZ2 LYS 32 35.270 12.055 1.961
260 HZ3 LYS 32 HZ3 LYS 32 36.892 12.503 2.018
261 H ARG 33 HN ARG 33 41.372 11.979 -0.841
262 HA ARG 33 HA ARG 33 41.845 13.983 -2.746
263 HB2 ARG 33 HB2 ARG 33 42.989 14.065 -0.639
264 HB3 ARG 33 HB1 ARG 33 43.764 12.517 -0.937
265 HG2 ARG 33 HG2 ARG 33 45.112 13.452 -2.680
266 HG3 ARG 33 HG1 ARG 33 44.231 14.976 -2.607
267 HD2 ARG 33 HD2 ARG 33 46.418 15.098 -1.488
268 HD3 ARG 33 HD1 ARG 33 45.082 15.403 -0.386
269 HE ARG 33 HE ARG 33 45.490 13.354 0.667
270 HH11 ARG 33 HH11 ARG 33 47.730 13.893 -1.969
271 HH12 ARG 33 HH12 ARG 33 48.911 12.784 -1.376
272 HH21 ARG 33 HH21 ARG 33 47.069 11.890 1.485
273 HH22 ARG 33 HH22 ARG 33 48.539 11.641 0.607
274 H LEU 34 HN LEU 34 43.119 10.653 -2.611
275 HA LEU 34 HA LEU 34 44.416 11.069 -5.187
276 HB2 LEU 34 HB2 LEU 34 44.361 8.666 -3.357
277 HB3 LEU 34 HB1 LEU 34 45.191 8.696 -4.893
278 HG LEU 34 HG LEU 34 46.859 9.006 -3.282
279 HD11 LEU 34 HD11 LEU 34 47.729 11.236 -3.665
280 HD12 LEU 34 HD12 LEU 34 46.155 11.760 -4.261
281 HD13 LEU 34 HD13 LEU 34 47.072 10.540 -5.146
282 HD21 LEU 34 HD21 LEU 34 45.453 9.478 -1.361
283 HD22 LEU 34 HD22 LEU 34 45.127 11.097 -1.977
284 HD23 LEU 34 HD23 LEU 34 46.760 10.658 -1.478
285 H LYS 35 HN LYS 35 41.383 10.216 -4.169
286 HA LYS 35 HA LYS 35 39.597 9.136 -5.038
287 HB2 LYS 35 HB2 LYS 35 41.056 9.712 -7.631
288 HB3 LYS 35 HB1 LYS 35 39.440 9.030 -7.563
289 HG2 LYS 35 HG2 LYS 35 39.044 11.280 -7.921
290 HG3 LYS 35 HG1 LYS 35 38.857 11.128 -6.175
291 HD2 LYS 35 HD2 LYS 35 41.163 11.919 -5.874
292 HD3 LYS 35 HD1 LYS 35 41.321 12.092 -7.624
293 HE2 LYS 35 HE2 LYS 35 39.447 13.700 -7.594
294 HE3 LYS 35 HE1 LYS 35 39.397 13.571 -5.836
295 HZ1 LYS 35 HZ1 LYS 35 40.647 15.503 -6.530
296 HZ2 LYS 35 HZ2 LYS 35 41.688 14.547 -7.448
297 HZ3 LYS 35 HZ3 LYS 35 41.676 14.401 -5.765
298 H VAL 36 HN VAL 36 40.803 7.371 -3.854
299 HA VAL 36 HA VAL 36 41.966 5.296 -5.474
300 HB VAL 36 HB VAL 36 41.181 5.214 -2.550
301 HG11 VAL 36 HG11 VAL 36 43.087 3.478 -4.115
302 HG12 VAL 36 HG12 VAL 36 41.489 3.004 -3.545
303 HG13 VAL 36 HG13 VAL 36 42.765 3.367 -2.384
304 HG21 VAL 36 HG21 VAL 36 42.765 7.019 -2.969
305 HG22 VAL 36 HG22 VAL 36 43.840 5.897 -3.803
306 HG23 VAL 36 HG23 VAL 36 43.536 5.707 -2.076
307 HA PRO 37 HA PRO 37 38.079 3.356 -6.520
308 HB2 PRO 37 HB2 PRO 37 39.803 0.949 -6.780
309 HB3 PRO 37 HB1 PRO 37 38.695 1.663 -7.953
310 HG2 PRO 37 HG2 PRO 37 41.332 1.919 -8.235
311 HG3 PRO 37 HG1 PRO 37 40.233 3.246 -8.649
312 HD2 PRO 37 HD2 PRO 37 41.978 2.902 -6.249
313 HD3 PRO 37 HD1 PRO 37 41.584 4.374 -7.165
314 H ARG 38 HN ARG 38 36.695 2.790 -5.019
315 HA ARG 38 HA ARG 38 37.288 1.930 -2.457
316 HB2 ARG 38 HB2 ARG 38 34.839 1.394 -2.300
317 HB3 ARG 38 HB1 ARG 38 35.226 3.013 -2.854
318 HG2 ARG 38 HG2 ARG 38 34.910 2.124 -5.212
319 HG3 ARG 38 HG1 ARG 38 34.198 0.694 -4.458
320 HD2 ARG 38 HD2 ARG 38 32.483 2.313 -5.112
321 HD3 ARG 38 HD1 ARG 38 32.529 2.096 -3.362
322 HE ARG 38 HE ARG 38 34.086 4.217 -3.598
323 HH11 ARG 38 HH11 ARG 38 31.050 3.560 -5.226
324 HH12 ARG 38 HH12 ARG 38 30.603 5.223 -5.341
325 HH21 ARG 38 HH21 ARG 38 33.502 6.406 -3.737
326 HH22 ARG 38 HH22 ARG 38 32.016 6.862 -4.497
327 H SER 39 HN SER 39 36.632 -0.034 -5.293
328 HA SER 39 HA SER 39 36.418 -2.449 -3.772
329 HB2 SER 39 HB2 SER 39 36.790 -2.017 -6.742
330 HB3 SER 39 HB1 SER 39 36.429 -3.565 -5.978
331 HG SER 39 HG SER 39 34.551 -2.491 -6.773
332 H SER 40 HN SER 40 38.960 -0.839 -5.628
333 HA SER 40 HA SER 40 40.794 -3.007 -5.465
334 HB2 SER 40 HB2 SER 40 41.357 -0.095 -6.029
335 HB3 SER 40 HB1 SER 40 42.421 -1.456 -6.379
336 HG SER 40 HG SER 40 40.389 -2.224 -7.586
337 H VAL 41 HN VAL 41 40.167 -0.189 -3.449
338 HA VAL 41 HA VAL 41 42.518 -0.477 -1.876
339 HB VAL 41 HB VAL 41 41.172 1.634 -1.957
340 HG11 VAL 41 HG11 VAL 41 39.247 0.139 -0.191
341 HG12 VAL 41 HG12 VAL 41 38.942 0.685 -1.839
342 HG13 VAL 41 HG13 VAL 41 39.192 1.866 -0.553
343 HG21 VAL 41 HG21 VAL 41 41.612 0.481 0.795
344 HG22 VAL 41 HG22 VAL 41 41.418 2.194 0.422
345 HG23 VAL 41 HG23 VAL 41 42.812 1.308 -0.199
346 H GLN 42 HN GLN 42 39.390 -1.968 -1.859
347 HA GLN 42 HA GLN 42 39.637 -3.134 0.745
348 HB2 GLN 42 HB2 GLN 42 37.466 -2.687 -0.472
349 HB3 GLN 42 HB1 GLN 42 37.864 -4.033 -1.528
350 HG2 GLN 42 HG2 GLN 42 37.843 -5.553 0.366
351 HG3 GLN 42 HG1 GLN 42 37.498 -4.211 1.455
352 HE21 GLN 42 HE21 GLN 42 36.129 -4.569 -1.742
353 HE22 GLN 42 HE22 GLN 42 34.507 -4.840 -1.222
354 H THR 43 HN THR 43 40.594 -3.923 -2.486
355 HA THR 43 HA THR 43 41.047 -6.687 -2.150
356 HB THR 43 HB THR 43 42.420 -4.774 -4.056
357 HG1 THR 43 HG1 THR 43 39.860 -5.771 -3.927
358 HG21 THR 43 HG21 THR 43 43.523 -6.962 -3.904
359 HG22 THR 43 HG22 THR 43 42.717 -6.773 -5.460
360 HG23 THR 43 HG23 THR 43 41.982 -7.764 -4.201
361 H ILE 44 HN ILE 44 43.179 -3.847 -1.872
362 HA ILE 44 HA ILE 44 45.487 -5.375 -1.292
363 HB ILE 44 HB ILE 44 45.569 -3.070 -2.235
364 HG12 ILE 44 HG12 ILE 44 47.529 -4.170 -0.964
365 HG13 ILE 44 HG11 ILE 44 47.618 -2.443 -1.264
366 HG21 ILE 44 HG21 ILE 44 45.364 -1.118 -0.782
367 HG22 ILE 44 HG22 ILE 44 44.820 -2.164 0.529
368 HG23 ILE 44 HG23 ILE 44 43.846 -2.008 -0.933
369 HD11 ILE 44 HD11 ILE 44 46.837 -3.754 1.336
370 HD12 ILE 44 HD12 ILE 44 46.927 -2.016 1.047
371 HD13 ILE 44 HD13 ILE 44 48.389 -3.000 0.972
372 H VAL 45 HN VAL 45 43.060 -3.823 0.780
373 HA VAL 45 HA VAL 45 44.512 -4.348 3.173
374 HB VAL 45 HB VAL 45 42.504 -3.729 4.401
375 HG11 VAL 45 HG11 VAL 45 42.222 -1.459 3.535
376 HG12 VAL 45 HG12 VAL 45 43.014 -1.943 2.036
377 HG13 VAL 45 HG13 VAL 45 43.914 -1.958 3.551
378 HG21 VAL 45 HG21 VAL 45 40.450 -3.062 3.172
379 HG22 VAL 45 HG22 VAL 45 40.793 -4.790 3.097
380 HG23 VAL 45 HG23 VAL 45 41.156 -3.760 1.713
381 H ARG 46 HN ARG 46 42.365 -6.229 1.216
382 HA ARG 46 HA ARG 46 41.649 -8.099 3.224
383 HB2 ARG 46 HB2 ARG 46 40.358 -7.863 1.138
384 HB3 ARG 46 HB1 ARG 46 41.726 -8.490 0.227
385 HG2 ARG 46 HG2 ARG 46 41.545 -10.621 1.307
386 HG3 ARG 46 HG1 ARG 46 40.299 -10.006 2.390
387 HD2 ARG 46 HD2 ARG 46 38.829 -9.640 0.464
388 HD3 ARG 46 HD1 ARG 46 40.075 -10.288 -0.600
389 HE ARG 46 HE ARG 46 39.849 -12.389 0.754
390 HH11 ARG 46 HH11 ARG 46 37.155 -10.154 0.446
391 HH12 ARG 46 HH12 ARG 46 35.957 -11.383 0.659
392 HH21 ARG 46 HH21 ARG 46 38.251 -14.005 1.036
393 HH22 ARG 46 HH22 ARG 46 36.576 -13.569 0.989
394 H LYS 47 HN LYS 47 44.149 -8.126 0.681
395 HA LYS 47 HA LYS 47 45.235 -10.603 1.562
396 HB2 LYS 47 HB2 LYS 47 47.156 -10.107 0.121
397 HB3 LYS 47 HB1 LYS 47 45.641 -9.830 -0.719
398 HG2 LYS 47 HG2 LYS 47 45.884 -7.447 -0.454
399 HG3 LYS 47 HG1 LYS 47 47.346 -7.677 0.510
400 HD2 LYS 47 HD2 LYS 47 48.442 -8.728 -1.404
401 HD3 LYS 47 HD1 LYS 47 46.979 -8.512 -2.364
402 HE2 LYS 47 HE2 LYS 47 47.182 -6.102 -2.168
403 HE3 LYS 47 HE1 LYS 47 48.600 -6.287 -1.137
404 HZ1 LYS 47 HZ1 LYS 47 48.404 -7.194 -3.951
405 HZ2 LYS 47 HZ2 LYS 47 49.772 -7.301 -2.965
406 HZ3 LYS 47 HZ3 LYS 47 49.186 -5.789 -3.437
407 H TYR 48 HN TYR 48 45.713 -7.282 2.438
408 HA TYR 48 HA TYR 48 48.071 -7.534 3.947
409 HB2 TYR 48 HB2 TYR 48 47.294 -5.340 3.404
410 HB3 TYR 48 HB1 TYR 48 45.718 -5.649 4.119
411 HD1 TYR 48 HD1 TYR 48 49.294 -5.767 5.243
412 HD2 TYR 48 HD2 TYR 48 45.313 -4.517 6.068
413 HE1 TYR 48 HE1 TYR 48 50.054 -4.744 7.345
414 HE2 TYR 48 HE2 TYR 48 46.057 -3.492 8.169
415 HH TYR 48 HH TYR 48 49.377 -3.049 8.904
416 H LYS 49 HN LYS 49 44.671 -8.015 4.744
417 HA LYS 49 HA LYS 49 45.031 -8.537 7.496
418 HB2 LYS 49 HB2 LYS 49 42.847 -7.982 6.549
419 HB3 LYS 49 HB1 LYS 49 42.856 -9.467 5.611
420 HG2 LYS 49 HG2 LYS 49 42.872 -10.759 7.716
421 HG3 LYS 49 HG1 LYS 49 42.764 -9.246 8.613
422 HD2 LYS 49 HD2 LYS 49 40.742 -10.226 6.598
423 HD3 LYS 49 HD1 LYS 49 40.578 -10.351 8.349
424 HE2 LYS 49 HE2 LYS 49 40.663 -7.905 8.523
425 HE3 LYS 49 HE1 LYS 49 40.821 -7.791 6.772
426 HZ1 LYS 49 HZ1 LYS 49 38.494 -8.882 8.256
427 HZ2 LYS 49 HZ2 LYS 49 38.654 -8.884 6.578
428 HZ3 LYS 49 HZ3 LYS 49 38.547 -7.421 7.404
429 H HIS 50 HN HIS 50 44.840 -10.646 4.650
430 HA HIS 50 HA HIS 50 45.120 -13.084 6.042
431 HB2 HIS 50 HB2 HIS 50 44.308 -12.914 3.695
432 HB3 HIS 50 HB1 HIS 50 45.936 -12.482 3.187
433 HD1 HIS 50 HD1 HIS 50 47.169 -14.408 2.240
434 HD2 HIS 50 HD2 HIS 50 44.425 -15.620 5.116
435 HE1 HIS 50 HE1 HIS 50 47.350 -16.908 2.335
436 H HIS 51 HN HIS 51 47.471 -10.796 4.785
437 HA HIS 51 HA HIS 51 49.750 -12.435 5.249
438 HB2 HIS 51 HB2 HIS 51 49.447 -9.446 4.939
439 HB3 HIS 51 HB1 HIS 51 51.007 -10.214 5.201
440 HD1 HIS 51 HD1 HIS 51 51.027 -8.789 2.687
441 HD2 HIS 51 HD2 HIS 51 49.356 -12.588 2.927
442 HE1 HIS 51 HE1 HIS 51 50.974 -9.650 0.327
443 H GLY 52 HN GLY 52 47.747 -10.492 7.255
444 HA2 GLY 52 HA2 GLY 52 49.618 -10.413 9.458
445 HA3 GLY 52 HA1 GLY 52 47.948 -9.859 9.480
446 H THR 53 HN THR 53 47.438 -12.610 8.153
447 HA THR 53 HA THR 53 46.676 -13.966 10.539
448 HB THR 53 HB THR 53 46.678 -15.044 7.708
449 HG1 THR 53 HG1 THR 53 45.019 -13.217 9.035
450 HG21 THR 53 HG21 THR 53 44.837 -16.456 8.562
451 HG22 THR 53 HG22 THR 53 45.084 -15.778 10.172
452 HG23 THR 53 HG23 THR 53 46.349 -16.751 9.420
453 H THR 54 HN THR 54 48.832 -15.006 7.811
454 HA THR 54 HA THR 54 50.660 -15.911 9.911
455 HB THR 54 HB THR 54 49.913 -17.662 7.560
456 HG1 THR 54 HG1 THR 54 48.736 -17.290 9.978
457 HG21 THR 54 HG21 THR 54 52.197 -18.007 8.329
458 HG22 THR 54 HG22 THR 54 51.189 -19.379 8.790
459 HG23 THR 54 HG23 THR 54 51.633 -18.168 9.993
460 H GLN 55 HN GLN 55 50.402 -15.947 6.344
461 HA GLN 55 HA GLN 55 51.742 -15.222 4.684
462 HB2 GLN 55 HB2 GLN 55 51.624 -13.036 5.865
463 HB3 GLN 55 HB1 GLN 55 53.073 -13.465 6.759
464 HG2 GLN 55 HG2 GLN 55 54.295 -13.623 4.604
465 HG3 GLN 55 HG1 GLN 55 52.846 -13.050 3.785
466 HE21 GLN 55 HE21 GLN 55 55.465 -12.212 5.884
467 HE22 GLN 55 HE22 GLN 55 55.267 -10.498 5.788
468 H HIS 56 HN HIS 56 52.536 -17.394 4.704
469 HA HIS 56 HA HIS 56 54.143 -18.972 4.536
470 HB2 HIS 56 HB2 HIS 56 54.989 -17.259 2.948
471 HB3 HIS 56 HB1 HIS 56 55.989 -16.595 4.230
472 HD1 HIS 56 HD1 HIS 56 58.294 -17.506 4.360
473 HD2 HIS 56 HD2 HIS 56 55.726 -20.069 2.340
474 HE1 HIS 56 HE1 HIS 56 59.745 -19.354 3.483
475 H HIS 57 HN HIS 57 53.750 -19.470 6.841
476 HA HIS 57 HA HIS 57 56.296 -19.584 8.215
477 HB2 HIS 57 HB2 HIS 57 53.887 -18.217 9.404
478 HB3 HIS 57 HB1 HIS 57 55.047 -19.037 10.439
479 HD1 HIS 57 HD1 HIS 57 57.549 -18.068 10.331
480 HD2 HIS 57 HD2 HIS 57 54.601 -15.685 8.636
481 HE1 HIS 57 HE1 HIS 57 58.574 -15.790 10.120
Start of MODEL 9
1 H1 ALA 1 HT1 ALA 1 73.257 -11.441 -15.693
2 H2 ALA 1 HT2 ALA 1 72.688 -9.875 -15.959
3 H3 ALA 1 HT3 ALA 1 72.081 -11.162 -16.870
4 HA ALA 1 HA ALA 1 70.529 -10.465 -15.167
5 HB1 ALA 1 HB1 ALA 1 71.727 -13.188 -14.671
6 HB2 ALA 1 HB2 ALA 1 70.542 -12.797 -15.918
7 HB3 ALA 1 HB3 ALA 1 70.106 -12.667 -14.213
8 H SER 2 HN SER 2 70.920 -8.962 -13.645
9 HA SER 2 HA SER 2 72.290 -9.895 -11.236
10 HB2 SER 2 HB2 SER 2 73.769 -8.404 -12.684
11 HB3 SER 2 HB1 SER 2 72.642 -7.100 -12.320
12 HG SER 2 HG SER 2 74.471 -8.408 -10.672
13 H MET 3 HN MET 3 70.909 -9.785 -9.621
14 HA MET 3 HA MET 3 68.939 -7.605 -9.572
15 HB2 MET 3 HB2 MET 3 67.345 -9.183 -8.505
16 HB3 MET 3 HB1 MET 3 67.748 -9.619 -10.160
17 HG2 MET 3 HG2 MET 3 69.269 -11.329 -9.364
18 HG3 MET 3 HG1 MET 3 68.953 -10.860 -7.696
19 HE1 MET 3 HE1 MET 3 67.259 -14.399 -8.121
20 HE2 MET 3 HE2 MET 3 68.499 -13.477 -7.271
21 HE3 MET 3 HE3 MET 3 68.693 -13.844 -8.984
22 H GLY 4 HN GLY 4 68.492 -6.714 -7.596
23 HA2 GLY 4 HA2 GLY 4 69.475 -7.798 -5.143
24 HA3 GLY 4 HA1 GLY 4 70.454 -6.454 -5.716
25 H LYS 5 HN LYS 5 68.281 -7.035 -3.535
26 HA LYS 5 HA LYS 5 66.756 -5.861 -2.369
27 HB2 LYS 5 HB2 LYS 5 68.364 -4.038 -2.417
28 HB3 LYS 5 HB1 LYS 5 67.792 -3.536 -4.000
29 HG2 LYS 5 HG2 LYS 5 65.669 -2.878 -3.083
30 HG3 LYS 5 HG1 LYS 5 66.121 -3.518 -1.502
31 HD2 LYS 5 HD2 LYS 5 67.873 -1.871 -1.288
32 HD3 LYS 5 HD1 LYS 5 67.564 -1.289 -2.924
33 HE2 LYS 5 HE2 LYS 5 66.571 0.185 -1.247
34 HE3 LYS 5 HE1 LYS 5 65.345 -0.560 -2.270
35 HZ1 LYS 5 HZ1 LYS 5 64.709 -0.564 0.065
36 HZ2 LYS 5 HZ2 LYS 5 66.079 -1.455 0.464
37 HZ3 LYS 5 HZ3 LYS 5 64.881 -2.145 -0.504
38 H SER 6 HN SER 6 64.864 -6.702 -2.892
39 HA SER 6 HA SER 6 63.618 -6.139 -5.430
40 HB2 SER 6 HB2 SER 6 63.488 -8.404 -4.535
41 HB3 SER 6 HB1 SER 6 62.696 -7.808 -3.078
42 HG SER 6 HG SER 6 61.667 -8.279 -5.596
43 H LYS 7 HN LYS 7 62.730 -4.191 -5.622
44 HA LYS 7 HA LYS 7 61.290 -2.995 -3.406
45 HB2 LYS 7 HB2 LYS 7 62.751 -1.599 -4.861
46 HB3 LYS 7 HB1 LYS 7 61.716 -1.969 -6.229
47 HG2 LYS 7 HG2 LYS 7 59.852 -0.823 -5.132
48 HG3 LYS 7 HG1 LYS 7 60.891 -0.459 -3.751
49 HD2 LYS 7 HD2 LYS 7 62.377 0.830 -5.208
50 HD3 LYS 7 HD1 LYS 7 61.347 0.464 -6.591
51 HE2 LYS 7 HE2 LYS 7 59.483 1.629 -5.484
52 HE3 LYS 7 HE1 LYS 7 60.549 2.018 -4.134
53 HZ1 LYS 7 HZ1 LYS 7 61.949 3.269 -5.659
54 HZ2 LYS 7 HZ2 LYS 7 60.374 3.873 -5.661
55 HZ3 LYS 7 HZ3 LYS 7 60.911 2.914 -6.941
56 H GLU 8 HN GLU 8 60.313 -2.933 -6.800
57 HA GLU 8 HA GLU 8 58.455 -3.525 -7.919
58 HB2 GLU 8 HB2 GLU 8 58.255 -5.626 -5.766
59 HB3 GLU 8 HB1 GLU 8 57.275 -5.599 -7.227
60 HG2 GLU 8 HG2 GLU 8 59.257 -5.821 -8.597
61 HG3 GLU 8 HG1 GLU 8 60.278 -5.764 -7.164
62 H ILE 9 HN ILE 9 56.847 -2.168 -8.039
63 HA ILE 9 HA ILE 9 54.894 -1.083 -7.609
64 HB ILE 9 HB ILE 9 54.720 -2.795 -5.099
65 HG12 ILE 9 HG12 ILE 9 54.692 -4.152 -7.147
66 HG13 ILE 9 HG11 ILE 9 53.124 -4.177 -6.349
67 HG21 ILE 9 HG21 ILE 9 52.591 -1.124 -6.431
68 HG22 ILE 9 HG22 ILE 9 53.365 -0.789 -4.883
69 HG23 ILE 9 HG23 ILE 9 52.338 -2.210 -5.064
70 HD11 ILE 9 HD11 ILE 9 52.298 -2.533 -7.969
71 HD12 ILE 9 HD12 ILE 9 52.871 -4.008 -8.748
72 HD13 ILE 9 HD13 ILE 9 53.868 -2.554 -8.772
73 H SER 10 HN SER 10 54.298 0.818 -6.532
74 HA SER 10 HA SER 10 56.312 2.298 -5.334
75 HB2 SER 10 HB2 SER 10 53.324 2.709 -5.065
76 HB3 SER 10 HB1 SER 10 54.571 3.929 -4.799
77 HG SER 10 HG SER 10 54.591 4.277 -6.848
78 H GLN 11 HN GLN 11 57.302 1.568 -3.556
79 HA GLN 11 HA GLN 11 56.064 0.140 -1.470
80 HB2 GLN 11 HB2 GLN 11 58.171 0.564 -0.216
81 HB3 GLN 11 HB1 GLN 11 58.421 -0.114 -1.819
82 HG2 GLN 11 HG2 GLN 11 59.136 1.967 -2.684
83 HG3 GLN 11 HG1 GLN 11 58.612 2.823 -1.235
84 HE21 GLN 11 HE21 GLN 11 60.653 3.690 -0.951
85 HE22 GLN 11 HE22 GLN 11 61.976 2.746 -0.356
86 H ASP 12 HN ASP 12 56.670 3.554 -1.982
87 HA ASP 12 HA ASP 12 56.152 4.404 0.652
88 HB2 ASP 12 HB2 ASP 12 57.163 5.832 -1.149
89 HB3 ASP 12 HB1 ASP 12 55.559 5.965 -1.867
90 H LEU 13 HN LEU 13 54.032 4.384 -2.195
91 HA LEU 13 HA LEU 13 51.678 5.064 -0.875
92 HB2 LEU 13 HB2 LEU 13 51.922 5.089 -3.308
93 HB3 LEU 13 HB1 LEU 13 52.047 3.342 -3.327
94 HG LEU 13 HG LEU 13 49.724 3.177 -2.520
95 HD11 LEU 13 HD11 LEU 13 49.728 6.179 -2.808
96 HD12 LEU 13 HD12 LEU 13 49.573 5.270 -1.303
97 HD13 LEU 13 HD13 LEU 13 48.305 5.177 -2.526
98 HD21 LEU 13 HD21 LEU 13 48.649 3.905 -4.595
99 HD22 LEU 13 HD22 LEU 13 50.189 3.108 -4.913
100 HD23 LEU 13 HD23 LEU 13 50.072 4.866 -4.996
101 H ARG 14 HN ARG 14 53.086 1.887 -1.540
102 HA ARG 14 HA ARG 14 50.972 0.345 -0.526
103 HB2 ARG 14 HB2 ARG 14 52.542 -0.732 -1.934
104 HB3 ARG 14 HB1 ARG 14 53.898 -0.238 -0.935
105 HG2 ARG 14 HG2 ARG 14 53.418 -1.835 0.707
106 HG3 ARG 14 HG1 ARG 14 51.783 -2.095 0.099
107 HD2 ARG 14 HD2 ARG 14 53.438 -3.923 -0.425
108 HD3 ARG 14 HD1 ARG 14 52.576 -3.258 -1.807
109 HE ARG 14 HE ARG 14 54.605 -1.998 -2.336
110 HH11 ARG 14 HH11 ARG 14 54.961 -4.681 -0.102
111 HH12 ARG 14 HH12 ARG 14 56.608 -4.986 -0.530
112 HH21 ARG 14 HH21 ARG 14 56.801 -2.436 -2.934
113 HH22 ARG 14 HH22 ARG 14 57.653 -3.706 -2.143
114 H LYS 15 HN LYS 15 53.873 1.607 1.096
115 HA LYS 15 HA LYS 15 53.218 0.310 3.569
116 HB2 LYS 15 HB2 LYS 15 55.549 0.891 2.905
117 HB3 LYS 15 HB1 LYS 15 55.143 2.590 3.085
118 HG2 LYS 15 HG2 LYS 15 54.688 2.234 5.460
119 HG3 LYS 15 HG1 LYS 15 55.089 0.526 5.279
120 HD2 LYS 15 HD2 LYS 15 57.362 1.177 4.548
121 HD3 LYS 15 HD1 LYS 15 56.945 2.868 4.846
122 HE2 LYS 15 HE2 LYS 15 56.521 2.336 7.203
123 HE3 LYS 15 HE1 LYS 15 56.954 0.656 6.899
124 HZ1 LYS 15 HZ1 LYS 15 58.809 1.807 7.846
125 HZ2 LYS 15 HZ2 LYS 15 58.740 3.015 6.670
126 HZ3 LYS 15 HZ3 LYS 15 59.177 1.440 6.238
127 H LYS 16 HN LYS 16 52.774 3.519 2.204
128 HA LYS 16 HA LYS 16 51.867 4.724 4.602
129 HB2 LYS 16 HB2 LYS 16 51.990 5.521 1.753
130 HB3 LYS 16 HB1 LYS 16 50.831 6.371 2.764
131 HG2 LYS 16 HG2 LYS 16 52.984 7.540 2.605
132 HG3 LYS 16 HG1 LYS 16 52.598 7.081 4.260
133 HD2 LYS 16 HD2 LYS 16 54.094 5.124 4.026
134 HD3 LYS 16 HD1 LYS 16 54.510 5.668 2.400
135 HE2 LYS 16 HE2 LYS 16 54.982 7.209 4.953
136 HE3 LYS 16 HE1 LYS 16 56.207 6.329 4.043
137 HZ1 LYS 16 HZ1 LYS 16 55.856 7.809 2.176
138 HZ2 LYS 16 HZ2 LYS 16 56.244 8.700 3.565
139 HZ3 LYS 16 HZ3 LYS 16 54.646 8.641 3.026
140 H ILE 17 HN ILE 17 50.148 3.168 1.905
141 HA ILE 17 HA ILE 17 47.580 3.941 2.791
142 HB ILE 17 HB ILE 17 48.014 3.035 0.495
143 HG12 ILE 17 HG12 ILE 17 45.889 1.532 2.039
144 HG13 ILE 17 HG11 ILE 17 45.730 3.179 1.440
145 HG21 ILE 17 HG21 ILE 17 48.073 0.607 0.148
146 HG22 ILE 17 HG22 ILE 17 48.139 0.365 1.894
147 HG23 ILE 17 HG23 ILE 17 49.471 1.170 1.065
148 HD11 ILE 17 HD11 ILE 17 45.933 2.359 -0.852
149 HD12 ILE 17 HD12 ILE 17 44.586 1.600 -0.003
150 HD13 ILE 17 HD13 ILE 17 46.090 0.711 -0.246
151 H VAL 18 HN VAL 18 49.647 1.221 3.612
152 HA VAL 18 HA VAL 18 47.725 -0.115 5.246
153 HB VAL 18 HB VAL 18 50.757 -0.268 5.236
154 HG11 VAL 18 HG11 VAL 18 50.503 -2.352 6.500
155 HG12 VAL 18 HG12 VAL 18 48.764 -2.077 6.603
156 HG13 VAL 18 HG13 VAL 18 49.880 -0.970 7.403
157 HG21 VAL 18 HG21 VAL 18 49.746 -1.015 3.155
158 HG22 VAL 18 HG22 VAL 18 48.663 -2.085 4.044
159 HG23 VAL 18 HG23 VAL 18 50.400 -2.388 4.046
160 H ASP 19 HN ASP 19 50.214 2.284 5.761
161 HA ASP 19 HA ASP 19 50.198 2.422 8.556
162 HB2 ASP 19 HB2 ASP 19 51.921 3.474 7.180
163 HB3 ASP 19 HB1 ASP 19 50.732 4.580 6.509
164 H LEU 20 HN LEU 20 48.273 4.105 6.129
165 HA LEU 20 HA LEU 20 46.872 5.756 7.967
166 HB2 LEU 20 HB2 LEU 20 46.180 4.957 5.144
167 HB3 LEU 20 HB1 LEU 20 45.367 6.215 6.050
168 HG LEU 20 HG LEU 20 48.257 6.232 5.175
169 HD11 LEU 20 HD11 LEU 20 46.725 6.625 3.348
170 HD12 LEU 20 HD12 LEU 20 47.573 8.111 3.773
171 HD13 LEU 20 HD13 LEU 20 45.901 7.875 4.279
172 HD21 LEU 20 HD21 LEU 20 46.689 8.296 6.721
173 HD22 LEU 20 HD22 LEU 20 48.300 8.532 6.051
174 HD23 LEU 20 HD23 LEU 20 48.041 7.339 7.323
175 H HIS 21 HN HIS 21 46.529 2.477 7.114
176 HA HIS 21 HA HIS 21 43.744 2.240 7.856
177 HB2 HIS 21 HB2 HIS 21 45.913 0.331 7.098
178 HB3 HIS 21 HB1 HIS 21 44.523 -0.285 7.977
179 HD1 HIS 21 HD1 HIS 21 45.487 1.173 4.656
180 HD2 HIS 21 HD2 HIS 21 42.138 -0.412 6.542
181 HE1 HIS 21 HE1 HIS 21 43.805 0.790 2.833
182 H LYS 22 HN LYS 22 46.748 2.336 9.417
183 HA LYS 22 HA LYS 22 45.719 1.041 11.819
184 HB2 LYS 22 HB2 LYS 22 48.498 1.915 11.036
185 HB3 LYS 22 HB1 LYS 22 48.089 1.191 12.586
186 HG2 LYS 22 HG2 LYS 22 47.532 -0.879 11.583
187 HG3 LYS 22 HG1 LYS 22 47.540 -0.177 9.964
188 HD2 LYS 22 HD2 LYS 22 49.902 0.150 10.054
189 HD3 LYS 22 HD1 LYS 22 49.968 -0.363 11.745
190 HE2 LYS 22 HE2 LYS 22 49.223 -2.064 9.360
191 HE3 LYS 22 HE1 LYS 22 50.728 -2.150 10.269
192 HZ1 LYS 22 HZ1 LYS 22 48.009 -2.870 11.201
193 HZ2 LYS 22 HZ2 LYS 22 49.330 -2.729 12.244
194 HZ3 LYS 22 HZ3 LYS 22 49.339 -3.897 11.023
195 H SER 23 HN SER 23 46.379 4.148 10.497
196 HA SER 23 HA SER 23 46.681 5.509 12.981
197 HB2 SER 23 HB2 SER 23 46.166 7.552 11.510
198 HB3 SER 23 HB1 SER 23 47.610 6.623 11.119
199 HG SER 23 HG SER 23 45.636 7.210 9.520
200 H GLY 24 HN GLY 24 43.966 5.091 10.692
201 HA2 GLY 24 HA2 GLY 24 41.929 4.491 12.191
202 HA3 GLY 24 HA1 GLY 24 42.196 6.113 12.801
203 H SER 25 HN SER 25 41.287 7.765 11.787
204 HA SER 25 HA SER 25 39.309 7.163 9.789
205 HB2 SER 25 HB2 SER 25 40.013 9.842 10.990
206 HB3 SER 25 HB1 SER 25 38.505 9.394 10.192
207 HG SER 25 HG SER 25 39.491 8.624 12.717
208 H SER 26 HN SER 26 42.346 7.315 9.154
209 HA SER 26 HA SER 26 42.628 9.504 7.358
210 HB2 SER 26 HB2 SER 26 44.248 6.967 7.509
211 HB3 SER 26 HB1 SER 26 44.739 8.496 6.778
212 HG SER 26 HG SER 26 44.450 9.411 8.942
213 H LEU 27 HN LEU 27 41.052 6.506 7.094
214 HA LEU 27 HA LEU 27 41.479 5.773 4.433
215 HB2 LEU 27 HB2 LEU 27 39.204 5.349 6.329
216 HB3 LEU 27 HB1 LEU 27 39.025 4.879 4.654
217 HG LEU 27 HG LEU 27 39.628 2.964 5.994
218 HD11 LEU 27 HD11 LEU 27 40.478 3.097 3.704
219 HD12 LEU 27 HD12 LEU 27 41.541 2.173 4.763
220 HD13 LEU 27 HD13 LEU 27 41.969 3.821 4.309
221 HD21 LEU 27 HD21 LEU 27 41.780 2.818 7.151
222 HD22 LEU 27 HD22 LEU 27 40.768 4.095 7.825
223 HD23 LEU 27 HD23 LEU 27 42.108 4.505 6.755
224 H GLY 28 HN GLY 28 39.084 7.997 5.790
225 HA2 GLY 28 HA2 GLY 28 37.675 8.541 3.431
226 HA3 GLY 28 HA1 GLY 28 37.800 9.627 4.809
227 H ALA 29 HN ALA 29 40.598 10.000 4.748
228 HA ALA 29 HA ALA 29 40.790 12.133 2.917
229 HB1 ALA 29 HB1 ALA 29 43.010 10.728 4.400
230 HB2 ALA 29 HB2 ALA 29 42.039 12.059 5.028
231 HB3 ALA 29 HB3 ALA 29 43.107 12.319 3.648
232 H ILE 30 HN ILE 30 41.872 8.794 2.808
233 HA ILE 30 HA ILE 30 43.484 8.961 0.501
234 HB ILE 30 HB ILE 30 41.823 6.608 1.442
235 HG12 ILE 30 HG12 ILE 30 44.711 7.295 2.022
236 HG13 ILE 30 HG11 ILE 30 43.382 7.439 3.166
237 HG21 ILE 30 HG21 ILE 30 42.553 6.357 -0.870
238 HG22 ILE 30 HG22 ILE 30 43.418 5.235 0.180
239 HG23 ILE 30 HG23 ILE 30 44.218 6.696 -0.396
240 HD11 ILE 30 HD11 ILE 30 43.037 5.016 3.040
241 HD12 ILE 30 HD12 ILE 30 44.661 5.432 3.587
242 HD13 ILE 30 HD13 ILE 30 44.400 4.891 1.928
243 H SER 31 HN SER 31 40.045 8.333 0.969
244 HA SER 31 HA SER 31 39.452 7.909 -1.765
245 HB2 SER 31 HB2 SER 31 37.589 8.792 0.450
246 HB3 SER 31 HB1 SER 31 37.130 8.031 -1.076
247 HG SER 31 HG SER 31 38.840 6.389 -0.103
248 H LYS 32 HN LYS 32 39.680 10.765 0.242
249 HA LYS 32 HA LYS 32 38.333 12.483 -1.625
250 HB2 LYS 32 HB2 LYS 32 40.070 13.142 0.756
251 HB3 LYS 32 HB1 LYS 32 39.159 14.321 -0.173
252 HG2 LYS 32 HG2 LYS 32 37.975 12.030 1.385
253 HG3 LYS 32 HG1 LYS 32 38.036 13.714 1.910
254 HD2 LYS 32 HD2 LYS 32 36.667 14.356 -0.021
255 HD3 LYS 32 HD1 LYS 32 36.605 12.670 -0.535
256 HE2 LYS 32 HE2 LYS 32 34.565 13.298 0.644
257 HE3 LYS 32 HE1 LYS 32 35.463 12.073 1.536
258 HZ1 LYS 32 HZ1 LYS 32 35.540 14.981 2.125
259 HZ2 LYS 32 HZ2 LYS 32 36.275 13.756 3.023
260 HZ3 LYS 32 HZ3 LYS 32 34.593 13.857 2.952
261 H ARG 33 HN ARG 33 41.728 11.917 -0.753
262 HA ARG 33 HA ARG 33 42.626 13.866 -2.679
263 HB2 ARG 33 HB2 ARG 33 44.185 11.931 -0.973
264 HB3 ARG 33 HB1 ARG 33 44.902 13.165 -1.996
265 HG2 ARG 33 HG2 ARG 33 43.657 14.871 -0.656
266 HG3 ARG 33 HG1 ARG 33 43.190 13.568 0.440
267 HD2 ARG 33 HD2 ARG 33 46.025 14.350 -0.237
268 HD3 ARG 33 HD1 ARG 33 45.171 14.798 1.236
269 HE ARG 33 HE ARG 33 45.169 12.477 1.875
270 HH11 ARG 33 HH11 ARG 33 47.245 13.243 -0.867
271 HH12 ARG 33 HH12 ARG 33 48.277 11.879 -0.627
272 HH21 ARG 33 HH21 ARG 33 46.544 10.666 2.179
273 HH22 ARG 33 HH22 ARG 33 47.875 10.405 1.099
274 H LEU 34 HN LEU 34 43.129 10.356 -2.324
275 HA LEU 34 HA LEU 34 44.316 10.228 -4.942
276 HB2 LEU 34 HB2 LEU 34 43.647 8.063 -2.952
277 HB3 LEU 34 HB1 LEU 34 44.412 7.765 -4.496
278 HG LEU 34 HG LEU 34 46.284 9.314 -3.695
279 HD11 LEU 34 HD11 LEU 34 46.564 9.513 -1.286
280 HD12 LEU 34 HD12 LEU 34 44.976 8.788 -1.038
281 HD13 LEU 34 HD13 LEU 34 45.115 10.350 -1.841
282 HD21 LEU 34 HD21 LEU 34 47.367 7.512 -2.452
283 HD22 LEU 34 HD22 LEU 34 46.524 6.904 -3.877
284 HD23 LEU 34 HD23 LEU 34 45.812 6.700 -2.276
285 H LYS 35 HN LYS 35 41.223 9.514 -3.491
286 HA LYS 35 HA LYS 35 39.255 8.742 -4.313
287 HB2 LYS 35 HB2 LYS 35 40.305 9.987 -6.861
288 HB3 LYS 35 HB1 LYS 35 38.636 9.516 -6.581
289 HG2 LYS 35 HG2 LYS 35 38.523 11.140 -4.732
290 HG3 LYS 35 HG1 LYS 35 40.171 11.644 -5.114
291 HD2 LYS 35 HD2 LYS 35 39.433 12.246 -7.378
292 HD3 LYS 35 HD1 LYS 35 37.785 11.798 -6.944
293 HE2 LYS 35 HE2 LYS 35 37.774 13.510 -5.202
294 HE3 LYS 35 HE1 LYS 35 39.428 13.954 -5.624
295 HZ1 LYS 35 HZ1 LYS 35 37.085 14.142 -7.435
296 HZ2 LYS 35 HZ2 LYS 35 38.668 14.600 -7.812
297 HZ3 LYS 35 HZ3 LYS 35 37.805 15.441 -6.627
298 H VAL 36 HN VAL 36 40.921 6.719 -4.077
299 HA VAL 36 HA VAL 36 41.314 5.296 -6.535
300 HB VAL 36 HB VAL 36 42.071 3.418 -5.083
301 HG11 VAL 36 HG11 VAL 36 43.282 6.097 -4.425
302 HG12 VAL 36 HG12 VAL 36 43.655 5.108 -5.836
303 HG13 VAL 36 HG13 VAL 36 44.070 4.533 -4.221
304 HG21 VAL 36 HG21 VAL 36 41.454 5.327 -2.823
305 HG22 VAL 36 HG22 VAL 36 42.304 3.790 -2.668
306 HG23 VAL 36 HG23 VAL 36 40.613 3.815 -3.165
307 HA PRO 37 HA PRO 37 37.471 3.120 -6.857
308 HB2 PRO 37 HB2 PRO 37 39.065 0.680 -7.420
309 HB3 PRO 37 HB1 PRO 37 37.831 1.466 -8.413
310 HG2 PRO 37 HG2 PRO 37 40.413 1.627 -9.059
311 HG3 PRO 37 HG1 PRO 37 39.326 3.011 -9.280
312 HD2 PRO 37 HD2 PRO 37 41.346 2.509 -7.131
313 HD3 PRO 37 HD1 PRO 37 40.947 4.019 -7.977
314 H ARG 38 HN ARG 38 36.193 2.146 -5.394
315 HA ARG 38 HA ARG 38 37.181 1.372 -2.885
316 HB2 ARG 38 HB2 ARG 38 34.495 0.799 -4.142
317 HB3 ARG 38 HB1 ARG 38 34.880 0.552 -2.445
318 HG2 ARG 38 HG2 ARG 38 35.357 2.958 -2.228
319 HG3 ARG 38 HG1 ARG 38 34.884 3.179 -3.914
320 HD2 ARG 38 HD2 ARG 38 32.652 2.284 -3.367
321 HD3 ARG 38 HD1 ARG 38 33.140 2.158 -1.678
322 HE ARG 38 HE ARG 38 33.403 4.784 -2.870
323 HH11 ARG 38 HH11 ARG 38 31.403 2.611 -0.966
324 HH12 ARG 38 HH12 ARG 38 30.441 3.878 -0.295
325 HH21 ARG 38 HH21 ARG 38 32.126 6.468 -1.983
326 HH22 ARG 38 HH22 ARG 38 30.852 6.082 -0.878
327 H SER 39 HN SER 39 36.563 -0.449 -5.780
328 HA SER 39 HA SER 39 36.598 -3.029 -4.665
329 HB2 SER 39 HB2 SER 39 35.851 -2.508 -6.989
330 HB3 SER 39 HB1 SER 39 37.528 -2.182 -7.424
331 HG SER 39 HG SER 39 36.222 -4.554 -7.168
332 H SER 40 HN SER 40 39.168 -0.879 -5.814
333 HA SER 40 HA SER 40 41.283 -2.711 -5.426
334 HB2 SER 40 HB2 SER 40 41.330 0.320 -5.429
335 HB3 SER 40 HB1 SER 40 42.741 -0.728 -5.581
336 HG SER 40 HG SER 40 41.718 -1.593 -7.497
337 H VAL 41 HN VAL 41 39.653 -0.368 -3.391
338 HA VAL 41 HA VAL 41 41.371 -0.469 -1.169
339 HB VAL 41 HB VAL 41 38.374 -0.000 -1.194
340 HG11 VAL 41 HG11 VAL 41 38.738 1.162 0.937
341 HG12 VAL 41 HG12 VAL 41 40.437 0.693 0.898
342 HG13 VAL 41 HG13 VAL 41 39.185 -0.540 1.039
343 HG21 VAL 41 HG21 VAL 41 40.659 1.967 -1.315
344 HG22 VAL 41 HG22 VAL 41 38.949 2.383 -1.189
345 HG23 VAL 41 HG23 VAL 41 39.557 1.571 -2.633
346 H GLN 42 HN GLN 42 38.440 -2.328 -1.960
347 HA GLN 42 HA GLN 42 38.477 -3.952 0.346
348 HB2 GLN 42 HB2 GLN 42 37.373 -4.642 -2.384
349 HB3 GLN 42 HB1 GLN 42 36.972 -5.446 -0.875
350 HG2 GLN 42 HG2 GLN 42 36.334 -2.603 -1.626
351 HG3 GLN 42 HG1 GLN 42 35.202 -3.947 -1.516
352 HE21 GLN 42 HE21 GLN 42 35.231 -1.388 -0.142
353 HE22 GLN 42 HE22 GLN 42 35.221 -1.743 1.548
354 H THR 43 HN THR 43 40.132 -4.157 -2.708
355 HA THR 43 HA THR 43 41.027 -6.832 -2.432
356 HB THR 43 HB THR 43 42.180 -4.576 -4.097
357 HG1 THR 43 HG1 THR 43 40.074 -5.032 -4.740
358 HG21 THR 43 HG21 THR 43 42.582 -7.571 -4.306
359 HG22 THR 43 HG22 THR 43 43.795 -6.401 -3.782
360 HG23 THR 43 HG23 THR 43 43.197 -6.368 -5.442
361 H ILE 44 HN ILE 44 42.547 -3.672 -1.719
362 HA ILE 44 HA ILE 44 44.979 -4.866 -0.865
363 HB ILE 44 HB ILE 44 44.935 -2.543 -1.696
364 HG12 ILE 44 HG12 ILE 44 46.386 -1.529 0.061
365 HG13 ILE 44 HG11 ILE 44 45.917 -2.827 1.152
366 HG21 ILE 44 HG21 ILE 44 44.128 -0.716 -0.302
367 HG22 ILE 44 HG22 ILE 44 43.521 -1.879 0.876
368 HG23 ILE 44 HG23 ILE 44 42.824 -1.819 -0.742
369 HD11 ILE 44 HD11 ILE 44 46.949 -4.458 -0.330
370 HD12 ILE 44 HD12 ILE 44 48.105 -3.218 0.152
371 HD13 ILE 44 HD13 ILE 44 47.383 -3.172 -1.457
372 H VAL 45 HN VAL 45 42.050 -3.843 0.855
373 HA VAL 45 HA VAL 45 43.174 -4.185 3.437
374 HB VAL 45 HB VAL 45 40.902 -4.202 4.330
375 HG11 VAL 45 HG11 VAL 45 40.114 -2.050 3.456
376 HG12 VAL 45 HG12 VAL 45 41.277 -2.183 2.139
377 HG13 VAL 45 HG13 VAL 45 41.841 -2.058 3.807
378 HG21 VAL 45 HG21 VAL 45 40.018 -4.396 1.463
379 HG22 VAL 45 HG22 VAL 45 38.950 -4.031 2.818
380 HG23 VAL 45 HG23 VAL 45 39.767 -5.593 2.732
381 H ARG 46 HN ARG 46 41.634 -6.369 1.179
382 HA ARG 46 HA ARG 46 41.407 -8.564 2.960
383 HB2 ARG 46 HB2 ARG 46 40.092 -8.497 0.907
384 HB3 ARG 46 HB1 ARG 46 41.549 -8.462 -0.067
385 HG2 ARG 46 HG2 ARG 46 41.107 -10.786 1.751
386 HG3 ARG 46 HG1 ARG 46 40.168 -10.679 0.262
387 HD2 ARG 46 HD2 ARG 46 42.179 -10.593 -1.059
388 HD3 ARG 46 HD1 ARG 46 43.176 -10.503 0.391
389 HE ARG 46 HE ARG 46 41.680 -12.849 0.540
390 HH11 ARG 46 HH11 ARG 46 44.162 -11.460 -1.504
391 HH12 ARG 46 HH12 ARG 46 44.865 -12.985 -1.916
392 HH21 ARG 46 HH21 ARG 46 42.627 -14.887 0.010
393 HH22 ARG 46 HH22 ARG 46 43.997 -14.936 -1.046
394 H LYS 47 HN LYS 47 43.821 -7.566 0.600
395 HA LYS 47 HA LYS 47 45.585 -9.723 0.940
396 HB2 LYS 47 HB2 LYS 47 45.620 -8.070 -0.933
397 HB3 LYS 47 HB1 LYS 47 46.245 -6.871 0.182
398 HG2 LYS 47 HG2 LYS 47 48.277 -8.122 0.472
399 HG3 LYS 47 HG1 LYS 47 47.639 -9.452 -0.502
400 HD2 LYS 47 HD2 LYS 47 47.502 -7.956 -2.444
401 HD3 LYS 47 HD1 LYS 47 48.148 -6.636 -1.470
402 HE2 LYS 47 HE2 LYS 47 49.872 -7.660 -2.874
403 HE3 LYS 47 HE1 LYS 47 50.226 -7.855 -1.160
404 HZ1 LYS 47 HZ1 LYS 47 50.619 -9.875 -2.466
405 HZ2 LYS 47 HZ2 LYS 47 48.984 -9.941 -2.876
406 HZ3 LYS 47 HZ3 LYS 47 49.464 -10.114 -1.260
407 H TYR 48 HN TYR 48 45.412 -6.542 2.489
408 HA TYR 48 HA TYR 48 47.683 -6.717 4.087
409 HB2 TYR 48 HB2 TYR 48 46.749 -4.583 3.953
410 HB3 TYR 48 HB1 TYR 48 45.125 -5.162 4.303
411 HD1 TYR 48 HD1 TYR 48 48.479 -4.727 5.898
412 HD2 TYR 48 HD2 TYR 48 44.266 -4.961 6.455
413 HE1 TYR 48 HE1 TYR 48 48.758 -4.127 8.270
414 HE2 TYR 48 HE2 TYR 48 44.538 -4.363 8.820
415 HH TYR 48 HH TYR 48 46.238 -4.454 10.540
416 H LYS 49 HN LYS 49 44.299 -7.390 5.078
417 HA LYS 49 HA LYS 49 45.102 -8.270 7.638
418 HB2 LYS 49 HB2 LYS 49 42.804 -9.064 7.941
419 HB3 LYS 49 HB1 LYS 49 42.853 -7.435 7.292
420 HG2 LYS 49 HG2 LYS 49 42.379 -8.340 5.053
421 HG3 LYS 49 HG1 LYS 49 42.269 -9.957 5.754
422 HD2 LYS 49 HD2 LYS 49 40.409 -9.259 7.147
423 HD3 LYS 49 HD1 LYS 49 40.554 -7.605 6.552
424 HE2 LYS 49 HE2 LYS 49 39.991 -8.344 4.309
425 HE3 LYS 49 HE1 LYS 49 39.908 -10.016 4.860
426 HZ1 LYS 49 HZ1 LYS 49 38.057 -9.418 6.284
427 HZ2 LYS 49 HZ2 LYS 49 37.715 -9.005 4.681
428 HZ3 LYS 49 HZ3 LYS 49 38.152 -7.808 5.785
429 H HIS 50 HN HIS 50 44.671 -9.965 4.610
430 HA HIS 50 HA HIS 50 44.707 -12.569 5.743
431 HB2 HIS 50 HB2 HIS 50 43.873 -12.092 3.447
432 HB3 HIS 50 HB1 HIS 50 45.521 -11.736 2.947
433 HD1 HIS 50 HD1 HIS 50 43.315 -14.594 3.994
434 HD2 HIS 50 HD2 HIS 50 47.091 -13.959 2.383
435 HE1 HIS 50 HE1 HIS 50 44.125 -16.859 3.274
436 H HIS 51 HN HIS 51 47.212 -10.443 4.428
437 HA HIS 51 HA HIS 51 49.295 -12.363 4.785
438 HB2 HIS 51 HB2 HIS 51 49.270 -10.395 3.142
439 HB3 HIS 51 HB1 HIS 51 49.681 -9.384 4.522
440 HD1 HIS 51 HD1 HIS 51 51.135 -11.551 1.984
441 HD2 HIS 51 HD2 HIS 51 52.279 -10.054 5.687
442 HE1 HIS 51 HE1 HIS 51 53.622 -11.886 2.100
443 H GLY 52 HN GLY 52 48.078 -9.607 6.602
444 HA2 GLY 52 HA2 GLY 52 50.095 -9.573 8.579
445 HA3 GLY 52 HA1 GLY 52 48.489 -8.878 8.731
446 H THR 53 HN THR 53 47.180 -11.457 8.221
447 HA THR 53 HA THR 53 47.366 -12.463 10.935
448 HB THR 53 HB THR 53 45.474 -13.308 8.719
449 HG1 THR 53 HG1 THR 53 45.102 -11.156 9.242
450 HG21 THR 53 HG21 THR 53 45.340 -13.723 11.711
451 HG22 THR 53 HG22 THR 53 45.721 -14.968 10.522
452 HG23 THR 53 HG23 THR 53 44.122 -14.222 10.538
453 H THR 54 HN THR 54 46.958 -14.314 7.867
454 HA THR 54 HA THR 54 49.480 -15.649 8.390
455 HB THR 54 HB THR 54 46.954 -17.309 8.148
456 HG1 THR 54 HG1 THR 54 48.385 -16.358 10.385
457 HG21 THR 54 HG21 THR 54 49.792 -18.066 8.864
458 HG22 THR 54 HG22 THR 54 49.012 -18.371 7.313
459 HG23 THR 54 HG23 THR 54 48.417 -19.167 8.769
460 H GLN 55 HN GLN 55 50.375 -15.214 6.466
461 HA GLN 55 HA GLN 55 48.805 -15.225 4.045
462 HB2 GLN 55 HB2 GLN 55 50.682 -14.281 2.965
463 HB3 GLN 55 HB1 GLN 55 50.673 -13.577 4.569
464 HG2 GLN 55 HG2 GLN 55 52.434 -15.858 3.692
465 HG3 GLN 55 HG1 GLN 55 52.926 -14.171 3.791
466 HE21 GLN 55 HE21 GLN 55 53.996 -16.501 5.149
467 HE22 GLN 55 HE22 GLN 55 53.868 -16.180 6.840
468 H HIS 56 HN HIS 56 50.789 -17.438 5.747
469 HA HIS 56 HA HIS 56 51.430 -19.571 5.374
470 HB2 HIS 56 HB2 HIS 56 49.798 -19.392 2.816
471 HB3 HIS 56 HB1 HIS 56 50.513 -20.866 3.454
472 HD1 HIS 56 HD1 HIS 56 47.532 -18.749 3.655
473 HD2 HIS 56 HD2 HIS 56 49.284 -21.749 5.936
474 HE1 HIS 56 HE1 HIS 56 45.745 -19.514 5.235
475 H HIS 57 HN HIS 57 51.329 -18.577 1.982
476 HA HIS 57 HA HIS 57 52.920 -18.478 0.370
477 HB2 HIS 57 HB2 HIS 57 53.316 -16.380 1.723
478 HB3 HIS 57 HB1 HIS 57 54.632 -17.222 2.523
479 HD1 HIS 57 HD1 HIS 57 53.769 -15.351 -0.516
480 HD2 HIS 57 HD2 HIS 57 56.871 -17.800 0.773
481 HE1 HIS 57 HE1 HIS 57 55.657 -14.945 -2.124
Start of MODEL 10
1 H1 ALA 1 HT1 ALA 1 61.157 9.072 -20.062
2 H2 ALA 1 HT2 ALA 1 61.360 10.680 -19.599
3 H3 ALA 1 HT3 ALA 1 61.849 10.178 -21.137
4 HA ALA 1 HA ALA 1 59.801 11.405 -21.263
5 HB1 ALA 1 HB1 ALA 1 59.455 8.461 -21.793
6 HB2 ALA 1 HB2 ALA 1 60.194 9.632 -22.880
7 HB3 ALA 1 HB3 ALA 1 58.480 9.752 -22.489
8 H SER 2 HN SER 2 57.502 11.467 -20.820
9 HA SER 2 HA SER 2 56.968 10.696 -18.061
10 HB2 SER 2 HB2 SER 2 55.238 12.362 -19.894
11 HB3 SER 2 HB1 SER 2 55.173 12.283 -18.135
12 HG SER 2 HG SER 2 57.650 12.943 -18.862
13 H MET 3 HN MET 3 55.292 10.524 -21.197
14 HA MET 3 HA MET 3 53.482 8.498 -20.122
15 HB2 MET 3 HB2 MET 3 52.645 10.526 -21.385
16 HB3 MET 3 HB1 MET 3 53.388 9.853 -22.823
17 HG2 MET 3 HG2 MET 3 51.290 8.403 -21.228
18 HG3 MET 3 HG1 MET 3 50.910 9.485 -22.563
19 HE1 MET 3 HE1 MET 3 49.838 6.543 -22.523
20 HE2 MET 3 HE2 MET 3 50.186 6.020 -24.172
21 HE3 MET 3 HE3 MET 3 49.583 7.649 -23.873
22 H GLY 4 HN GLY 4 55.490 9.005 -23.030
23 HA2 GLY 4 HA2 GLY 4 55.279 6.274 -23.871
24 HA3 GLY 4 HA1 GLY 4 56.335 7.496 -24.559
25 H LYS 5 HN LYS 5 55.970 5.545 -21.653
26 HA LYS 5 HA LYS 5 58.513 4.349 -21.785
27 HB2 LYS 5 HB2 LYS 5 59.242 6.656 -21.190
28 HB3 LYS 5 HB1 LYS 5 58.264 6.569 -19.735
29 HG2 LYS 5 HG2 LYS 5 60.572 6.170 -19.196
30 HG3 LYS 5 HG1 LYS 5 59.650 4.685 -18.956
31 HD2 LYS 5 HD2 LYS 5 60.445 3.802 -21.057
32 HD3 LYS 5 HD1 LYS 5 61.255 5.324 -21.431
33 HE2 LYS 5 HE2 LYS 5 62.854 3.676 -20.641
34 HE3 LYS 5 HE1 LYS 5 62.721 5.009 -19.497
35 HZ1 LYS 5 HZ1 LYS 5 62.768 2.844 -18.410
36 HZ2 LYS 5 HZ2 LYS 5 61.366 2.382 -19.224
37 HZ3 LYS 5 HZ3 LYS 5 61.317 3.647 -18.102
38 H SER 6 HN SER 6 55.774 5.439 -19.937
39 HA SER 6 HA SER 6 54.357 4.418 -18.526
40 HB2 SER 6 HB2 SER 6 55.989 1.908 -18.989
41 HB3 SER 6 HB1 SER 6 54.411 1.984 -18.203
42 HG SER 6 HG SER 6 54.877 1.685 -20.745
43 H LYS 7 HN LYS 7 54.205 3.727 -16.304
44 HA LYS 7 HA LYS 7 56.728 3.968 -14.834
45 HB2 LYS 7 HB2 LYS 7 54.196 5.511 -14.258
46 HB3 LYS 7 HB1 LYS 7 55.587 5.444 -13.187
47 HG2 LYS 7 HG2 LYS 7 56.962 6.523 -14.876
48 HG3 LYS 7 HG1 LYS 7 55.594 6.550 -15.989
49 HD2 LYS 7 HD2 LYS 7 54.362 7.988 -14.448
50 HD3 LYS 7 HD1 LYS 7 55.711 7.937 -13.311
51 HE2 LYS 7 HE2 LYS 7 57.150 9.004 -14.972
52 HE3 LYS 7 HE1 LYS 7 55.809 9.043 -16.115
53 HZ1 LYS 7 HZ1 LYS 7 56.146 11.166 -14.958
54 HZ2 LYS 7 HZ2 LYS 7 55.820 10.416 -13.483
55 HZ3 LYS 7 HZ3 LYS 7 54.620 10.514 -14.661
56 H GLU 8 HN GLU 8 56.764 3.000 -12.830
57 HA GLU 8 HA GLU 8 54.745 0.936 -12.467
58 HB2 GLU 8 HB2 GLU 8 56.459 0.077 -10.744
59 HB3 GLU 8 HB1 GLU 8 56.861 -0.061 -12.446
60 HG2 GLU 8 HG2 GLU 8 57.808 2.267 -10.809
61 HG3 GLU 8 HG1 GLU 8 58.674 0.731 -10.810
62 H ILE 9 HN ILE 9 54.151 0.401 -10.193
63 HA ILE 9 HA ILE 9 53.294 2.843 -8.882
64 HB ILE 9 HB ILE 9 52.619 -0.053 -8.298
65 HG12 ILE 9 HG12 ILE 9 51.740 0.715 -10.453
66 HG13 ILE 9 HG11 ILE 9 50.435 0.475 -9.297
67 HG21 ILE 9 HG21 ILE 9 51.395 2.453 -7.147
68 HG22 ILE 9 HG22 ILE 9 52.419 1.307 -6.283
69 HG23 ILE 9 HG23 ILE 9 50.831 0.806 -6.865
70 HD11 ILE 9 HD11 ILE 9 50.065 2.476 -10.596
71 HD12 ILE 9 HD12 ILE 9 51.633 3.114 -10.109
72 HD13 ILE 9 HD13 ILE 9 50.358 2.898 -8.909
73 H SER 10 HN SER 10 53.976 3.549 -6.951
74 HA SER 10 HA SER 10 56.363 2.359 -5.839
75 HB2 SER 10 HB2 SER 10 54.822 4.818 -4.982
76 HB3 SER 10 HB1 SER 10 56.437 4.363 -4.442
77 HG SER 10 HG SER 10 56.360 4.387 -7.125
78 H GLN 11 HN GLN 11 56.556 1.478 -3.792
79 HA GLN 11 HA GLN 11 54.239 0.226 -2.723
80 HB2 GLN 11 HB2 GLN 11 57.067 0.434 -1.684
81 HB3 GLN 11 HB1 GLN 11 55.808 -0.469 -0.858
82 HG2 GLN 11 HG2 GLN 11 57.084 -2.023 -2.107
83 HG3 GLN 11 HG1 GLN 11 55.541 -1.835 -2.936
84 HE21 GLN 11 HE21 GLN 11 56.335 -2.509 -4.885
85 HE22 GLN 11 HE22 GLN 11 57.424 -1.564 -5.838
86 H ASP 12 HN ASP 12 55.762 3.222 -2.219
87 HA ASP 12 HA ASP 12 55.131 3.931 0.374
88 HB2 ASP 12 HB2 ASP 12 56.414 5.372 -1.122
89 HB3 ASP 12 HB1 ASP 12 54.998 5.630 -2.128
90 H LEU 13 HN LEU 13 53.077 4.016 -2.497
91 HA LEU 13 HA LEU 13 50.808 5.148 -1.250
92 HB2 LEU 13 HB2 LEU 13 51.243 5.108 -3.710
93 HB3 LEU 13 HB1 LEU 13 50.945 3.387 -3.710
94 HG LEU 13 HG LEU 13 49.079 4.913 -4.557
95 HD11 LEU 13 HD11 LEU 13 48.693 2.570 -4.076
96 HD12 LEU 13 HD12 LEU 13 47.305 3.544 -3.586
97 HD13 LEU 13 HD13 LEU 13 48.435 2.943 -2.371
98 HD21 LEU 13 HD21 LEU 13 49.202 6.595 -2.797
99 HD22 LEU 13 HD22 LEU 13 48.726 5.389 -1.600
100 HD23 LEU 13 HD23 LEU 13 47.598 5.864 -2.868
101 H ARG 14 HN ARG 14 51.773 1.808 -1.921
102 HA ARG 14 HA ARG 14 49.416 0.581 -0.976
103 HB2 ARG 14 HB2 ARG 14 51.160 -0.503 -2.423
104 HB3 ARG 14 HB1 ARG 14 52.189 -0.621 -1.003
105 HG2 ARG 14 HG2 ARG 14 50.530 -2.040 0.090
106 HG3 ARG 14 HG1 ARG 14 49.485 -1.911 -1.325
107 HD2 ARG 14 HD2 ARG 14 50.642 -3.995 -1.468
108 HD3 ARG 14 HD1 ARG 14 51.329 -2.915 -2.680
109 HE ARG 14 HE ARG 14 52.767 -2.841 -0.209
110 HH11 ARG 14 HH11 ARG 14 52.376 -4.660 -3.188
111 HH12 ARG 14 HH12 ARG 14 53.964 -5.344 -3.131
112 HH21 ARG 14 HH21 ARG 14 54.853 -3.773 -0.104
113 HH22 ARG 14 HH22 ARG 14 55.391 -4.842 -1.350
114 H LYS 15 HN LYS 15 52.444 1.431 0.607
115 HA LYS 15 HA LYS 15 51.791 0.244 3.114
116 HB2 LYS 15 HB2 LYS 15 53.780 2.393 2.374
117 HB3 LYS 15 HB1 LYS 15 53.669 1.656 3.965
118 HG2 LYS 15 HG2 LYS 15 54.328 -0.470 3.113
119 HG3 LYS 15 HG1 LYS 15 54.198 0.099 1.447
120 HD2 LYS 15 HD2 LYS 15 56.535 0.001 2.190
121 HD3 LYS 15 HD1 LYS 15 56.041 1.652 1.820
122 HE2 LYS 15 HE2 LYS 15 55.697 2.076 4.211
123 HE3 LYS 15 HE1 LYS 15 56.201 0.425 4.573
124 HZ1 LYS 15 HZ1 LYS 15 58.372 0.937 3.631
125 HZ2 LYS 15 HZ2 LYS 15 57.998 1.976 4.908
126 HZ3 LYS 15 HZ3 LYS 15 57.880 2.525 3.316
127 H LYS 16 HN LYS 16 51.360 3.413 1.688
128 HA LYS 16 HA LYS 16 50.666 4.856 3.983
129 HB2 LYS 16 HB2 LYS 16 51.239 5.901 1.840
130 HB3 LYS 16 HB1 LYS 16 49.760 5.276 1.132
131 HG2 LYS 16 HG2 LYS 16 48.432 6.651 2.634
132 HG3 LYS 16 HG1 LYS 16 49.901 7.245 3.410
133 HD2 LYS 16 HD2 LYS 16 49.160 7.639 0.506
134 HD3 LYS 16 HD1 LYS 16 49.020 8.856 1.777
135 HE2 LYS 16 HE2 LYS 16 51.461 8.688 2.146
136 HE3 LYS 16 HE1 LYS 16 51.563 7.559 0.799
137 HZ1 LYS 16 HZ1 LYS 16 52.141 9.808 0.149
138 HZ2 LYS 16 HZ2 LYS 16 50.617 10.366 0.611
139 HZ3 LYS 16 HZ3 LYS 16 50.765 9.277 -0.674
140 H ILE 17 HN ILE 17 48.565 3.271 1.577
141 HA ILE 17 HA ILE 17 46.168 3.939 2.851
142 HB ILE 17 HB ILE 17 46.234 3.150 0.521
143 HG12 ILE 17 HG12 ILE 17 44.277 1.589 0.610
144 HG13 ILE 17 HG11 ILE 17 44.506 1.476 2.350
145 HG21 ILE 17 HG21 ILE 17 46.825 0.433 1.667
146 HG22 ILE 17 HG22 ILE 17 47.917 1.425 0.700
147 HG23 ILE 17 HG23 ILE 17 46.442 0.777 -0.020
148 HD11 ILE 17 HD11 ILE 17 44.078 3.865 2.565
149 HD12 ILE 17 HD12 ILE 17 42.736 3.037 1.776
150 HD13 ILE 17 HD13 ILE 17 43.872 3.988 0.818
151 H VAL 18 HN VAL 18 48.305 1.150 3.296
152 HA VAL 18 HA VAL 18 46.623 -0.305 5.034
153 HB VAL 18 HB VAL 18 49.649 -0.303 4.854
154 HG11 VAL 18 HG11 VAL 18 49.550 -2.472 5.991
155 HG12 VAL 18 HG12 VAL 18 47.808 -2.286 6.194
156 HG13 VAL 18 HG13 VAL 18 48.914 -1.181 7.010
157 HG21 VAL 18 HG21 VAL 18 48.568 -0.966 2.782
158 HG22 VAL 18 HG22 VAL 18 47.579 -2.137 3.654
159 HG23 VAL 18 HG23 VAL 18 49.326 -2.359 3.553
160 H ASP 19 HN ASP 19 49.284 1.965 5.710
161 HA ASP 19 HA ASP 19 49.103 1.791 8.506
162 HB2 ASP 19 HB2 ASP 19 50.350 3.760 6.648
163 HB3 ASP 19 HB1 ASP 19 50.212 4.166 8.354
164 H LEU 20 HN LEU 20 47.456 3.924 6.241
165 HA LEU 20 HA LEU 20 46.290 5.484 8.309
166 HB2 LEU 20 HB2 LEU 20 45.882 5.261 5.379
167 HB3 LEU 20 HB1 LEU 20 44.586 5.969 6.322
168 HG LEU 20 HG LEU 20 45.977 7.735 5.444
169 HD11 LEU 20 HD11 LEU 20 46.521 8.921 7.452
170 HD12 LEU 20 HD12 LEU 20 46.560 7.425 8.378
171 HD13 LEU 20 HD13 LEU 20 45.036 8.004 7.703
172 HD21 LEU 20 HD21 LEU 20 48.338 7.950 6.019
173 HD22 LEU 20 HD22 LEU 20 48.039 6.467 5.115
174 HD23 LEU 20 HD23 LEU 20 48.283 6.402 6.860
175 H HIS 21 HN HIS 21 45.393 2.484 6.784
176 HA HIS 21 HA HIS 21 42.709 2.413 7.748
177 HB2 HIS 21 HB2 HIS 21 44.622 0.334 6.751
178 HB3 HIS 21 HB1 HIS 21 43.171 -0.184 7.599
179 HD1 HIS 21 HD1 HIS 21 40.891 1.086 6.509
180 HD2 HIS 21 HD2 HIS 21 44.211 0.453 4.099
181 HE1 HIS 21 HE1 HIS 21 40.047 1.242 4.153
182 H LYS 22 HN LYS 22 45.780 1.257 8.989
183 HA LYS 22 HA LYS 22 44.871 -0.032 11.291
184 HB2 LYS 22 HB2 LYS 22 47.471 1.377 10.701
185 HB3 LYS 22 HB1 LYS 22 47.195 0.403 12.138
186 HG2 LYS 22 HG2 LYS 22 47.109 -1.579 10.940
187 HG3 LYS 22 HG1 LYS 22 46.728 -0.762 9.424
188 HD2 LYS 22 HD2 LYS 22 49.035 -1.644 9.497
189 HD3 LYS 22 HD1 LYS 22 48.971 0.101 9.274
190 HE2 LYS 22 HE2 LYS 22 49.326 0.339 11.743
191 HE3 LYS 22 HE1 LYS 22 49.585 -1.403 11.809
192 HZ1 LYS 22 HZ1 LYS 22 51.671 -0.219 11.683
193 HZ2 LYS 22 HZ2 LYS 22 51.201 0.538 10.245
194 HZ3 LYS 22 HZ3 LYS 22 51.444 -1.134 10.279
195 H SER 23 HN SER 23 45.868 3.345 10.802
196 HA SER 23 HA SER 23 45.329 4.113 13.491
197 HB2 SER 23 HB2 SER 23 45.515 5.849 11.017
198 HB3 SER 23 HB1 SER 23 45.653 6.394 12.690
199 HG SER 23 HG SER 23 47.452 4.780 12.771
200 H GLY 24 HN GLY 24 43.517 4.230 10.458
201 HA2 GLY 24 HA2 GLY 24 41.270 4.385 10.056
202 HA3 GLY 24 HA1 GLY 24 41.014 4.053 11.758
203 H SER 25 HN SER 25 42.225 6.728 9.726
204 HA SER 25 HA SER 25 40.278 8.460 11.004
205 HB2 SER 25 HB2 SER 25 42.263 8.688 12.430
206 HB3 SER 25 HB1 SER 25 43.233 9.121 11.023
207 HG SER 25 HG SER 25 41.922 10.759 12.559
208 H SER 26 HN SER 26 43.159 9.069 8.968
209 HA SER 26 HA SER 26 41.704 10.968 7.400
210 HB2 SER 26 HB2 SER 26 44.491 9.910 6.942
211 HB3 SER 26 HB1 SER 26 43.810 11.423 6.342
212 HG SER 26 HG SER 26 43.652 12.149 8.474
213 H LEU 27 HN LEU 27 40.604 8.313 7.053
214 HA LEU 27 HA LEU 27 41.474 7.244 4.549
215 HB2 LEU 27 HB2 LEU 27 38.964 6.854 6.165
216 HB3 LEU 27 HB1 LEU 27 39.155 6.123 4.588
217 HG LEU 27 HG LEU 27 39.652 4.464 6.214
218 HD11 LEU 27 HD11 LEU 27 41.102 4.483 4.251
219 HD12 LEU 27 HD12 LEU 27 41.919 3.839 5.674
220 HD13 LEU 27 HD13 LEU 27 42.268 5.477 5.126
221 HD21 LEU 27 HD21 LEU 27 41.607 6.412 7.423
222 HD22 LEU 27 HD22 LEU 27 41.397 4.731 7.914
223 HD23 LEU 27 HD23 LEU 27 40.080 5.885 8.131
224 H GLY 28 HN GLY 28 38.992 9.525 5.540
225 HA2 GLY 28 HA2 GLY 28 37.747 9.863 3.044
226 HA3 GLY 28 HA1 GLY 28 37.766 11.046 4.348
227 H ALA 29 HN ALA 29 40.638 11.256 4.438
228 HA ALA 29 HA ALA 29 41.045 13.293 2.533
229 HB1 ALA 29 HB1 ALA 29 43.072 11.796 4.196
230 HB2 ALA 29 HB2 ALA 29 42.213 13.257 4.679
231 HB3 ALA 29 HB3 ALA 29 43.362 13.310 3.343
232 H ILE 30 HN ILE 30 42.221 9.958 2.757
233 HA ILE 30 HA ILE 30 43.797 9.937 0.434
234 HB ILE 30 HB ILE 30 42.254 7.602 1.598
235 HG12 ILE 30 HG12 ILE 30 45.058 8.554 2.223
236 HG13 ILE 30 HG11 ILE 30 43.666 8.718 3.287
237 HG21 ILE 30 HG21 ILE 30 43.136 7.182 -0.647
238 HG22 ILE 30 HG22 ILE 30 43.979 6.217 0.564
239 HG23 ILE 30 HG23 ILE 30 44.746 7.655 -0.105
240 HD11 ILE 30 HD11 ILE 30 44.879 6.128 2.357
241 HD12 ILE 30 HD12 ILE 30 43.488 6.290 3.428
242 HD13 ILE 30 HD13 ILE 30 45.075 6.856 3.949
243 H SER 31 HN SER 31 40.365 9.517 0.930
244 HA SER 31 HA SER 31 39.658 8.426 -1.542
245 HB2 SER 31 HB2 SER 31 38.036 10.280 0.214
246 HB3 SER 31 HB1 SER 31 37.394 9.245 -1.060
247 HG SER 31 HG SER 31 38.862 8.229 1.160
248 H LYS 32 HN LYS 32 40.252 11.795 -0.620
249 HA LYS 32 HA LYS 32 39.482 12.639 -3.308
250 HB2 LYS 32 HB2 LYS 32 40.022 14.157 -0.783
251 HB3 LYS 32 HB1 LYS 32 40.095 14.978 -2.332
252 HG2 LYS 32 HG2 LYS 32 37.926 15.387 -1.734
253 HG3 LYS 32 HG1 LYS 32 37.727 13.911 -2.672
254 HD2 LYS 32 HD2 LYS 32 36.428 13.658 -0.703
255 HD3 LYS 32 HD1 LYS 32 37.860 12.647 -0.493
256 HE2 LYS 32 HE2 LYS 32 38.885 14.325 0.915
257 HE3 LYS 32 HE1 LYS 32 37.553 15.438 0.611
258 HZ1 LYS 32 HZ1 LYS 32 37.311 12.824 1.992
259 HZ2 LYS 32 HZ2 LYS 32 36.065 13.940 1.757
260 HZ3 LYS 32 HZ3 LYS 32 37.365 14.328 2.760
261 H ARG 33 HN ARG 33 42.347 12.346 -1.301
262 HA ARG 33 HA ARG 33 43.972 13.827 -3.158
263 HB2 ARG 33 HB2 ARG 33 44.815 12.142 -0.802
264 HB3 ARG 33 HB1 ARG 33 45.859 13.225 -1.712
265 HG2 ARG 33 HG2 ARG 33 44.325 15.097 -1.053
266 HG3 ARG 33 HG1 ARG 33 43.517 13.958 0.024
267 HD2 ARG 33 HD2 ARG 33 46.410 14.800 0.120
268 HD3 ARG 33 HD1 ARG 33 45.145 15.249 1.257
269 HE ARG 33 HE ARG 33 45.927 12.435 0.921
270 HH11 ARG 33 HH11 ARG 33 45.578 15.268 2.956
271 HH12 ARG 33 HH12 ARG 33 45.931 14.418 4.419
272 HH21 ARG 33 HH21 ARG 33 46.421 11.312 2.867
273 HH22 ARG 33 HH22 ARG 33 46.421 12.171 4.371
274 H LEU 34 HN LEU 34 43.245 10.436 -2.651
275 HA LEU 34 HA LEU 34 45.127 9.816 -4.833
276 HB2 LEU 34 HB2 LEU 34 44.376 8.166 -2.436
277 HB3 LEU 34 HB1 LEU 34 45.064 7.438 -3.869
278 HG LEU 34 HG LEU 34 46.830 7.702 -2.327
279 HD11 LEU 34 HD11 LEU 34 47.393 8.284 -4.627
280 HD12 LEU 34 HD12 LEU 34 48.376 9.165 -3.460
281 HD13 LEU 34 HD13 LEU 34 47.047 9.980 -4.281
282 HD21 LEU 34 HD21 LEU 34 45.811 9.296 -0.814
283 HD22 LEU 34 HD22 LEU 34 45.995 10.576 -2.012
284 HD23 LEU 34 HD23 LEU 34 47.422 9.834 -1.289
285 H LYS 35 HN LYS 35 41.923 10.127 -4.163
286 HA LYS 35 HA LYS 35 39.959 9.279 -4.969
287 HB2 LYS 35 HB2 LYS 35 39.810 9.261 -7.413
288 HB3 LYS 35 HB1 LYS 35 40.762 10.625 -6.858
289 HG2 LYS 35 HG2 LYS 35 42.815 9.404 -7.448
290 HG3 LYS 35 HG1 LYS 35 41.826 8.071 -8.046
291 HD2 LYS 35 HD2 LYS 35 40.797 9.586 -9.682
292 HD3 LYS 35 HD1 LYS 35 41.816 10.900 -9.091
293 HE2 LYS 35 HE2 LYS 35 42.782 8.331 -10.342
294 HE3 LYS 35 HE1 LYS 35 42.732 9.908 -11.127
295 HZ1 LYS 35 HZ1 LYS 35 44.354 9.218 -8.734
296 HZ2 LYS 35 HZ2 LYS 35 44.315 10.728 -9.496
297 HZ3 LYS 35 HZ3 LYS 35 44.938 9.387 -10.309
298 H VAL 36 HN VAL 36 41.439 7.276 -3.745
299 HA VAL 36 HA VAL 36 41.620 4.950 -5.366
300 HB VAL 36 HB VAL 36 43.077 5.241 -3.426
301 HG11 VAL 36 HG11 VAL 36 42.240 5.008 -1.140
302 HG12 VAL 36 HG12 VAL 36 40.587 4.975 -1.751
303 HG13 VAL 36 HG13 VAL 36 41.568 6.427 -1.942
304 HG21 VAL 36 HG21 VAL 36 42.666 2.978 -4.170
305 HG22 VAL 36 HG22 VAL 36 41.225 2.876 -3.157
306 HG23 VAL 36 HG23 VAL 36 42.819 3.007 -2.413
307 HA PRO 37 HA PRO 37 37.331 3.808 -4.913
308 HB2 PRO 37 HB2 PRO 37 37.361 1.734 -6.608
309 HB3 PRO 37 HB1 PRO 37 37.442 3.398 -7.195
310 HG2 PRO 37 HG2 PRO 37 39.625 1.387 -6.886
311 HG3 PRO 37 HG1 PRO 37 39.369 2.582 -8.170
312 HD2 PRO 37 HD2 PRO 37 41.124 2.884 -6.049
313 HD3 PRO 37 HD1 PRO 37 40.459 4.216 -7.013
314 H ARG 38 HN ARG 38 36.157 2.004 -4.068
315 HA ARG 38 HA ARG 38 37.435 0.675 -1.960
316 HB2 ARG 38 HB2 ARG 38 34.776 0.201 -3.295
317 HB3 ARG 38 HB1 ARG 38 35.322 -0.769 -1.938
318 HG2 ARG 38 HG2 ARG 38 34.927 2.220 -1.909
319 HG3 ARG 38 HG1 ARG 38 33.825 1.022 -1.224
320 HD2 ARG 38 HD2 ARG 38 35.661 0.264 0.267
321 HD3 ARG 38 HD1 ARG 38 36.665 1.567 -0.361
322 HE ARG 38 HE ARG 38 34.158 2.477 0.694
323 HH11 ARG 38 HH11 ARG 38 37.443 1.605 1.513
324 HH12 ARG 38 HH12 ARG 38 37.483 2.537 2.965
325 HH21 ARG 38 HH21 ARG 38 34.195 3.733 2.631
326 HH22 ARG 38 HH22 ARG 38 35.628 3.764 3.596
327 H SER 39 HN SER 39 37.050 -0.186 -5.291
328 HA SER 39 HA SER 39 37.503 -2.918 -5.237
329 HB2 SER 39 HB2 SER 39 38.743 -1.003 -7.220
330 HB3 SER 39 HB1 SER 39 38.303 -2.690 -7.489
331 HG SER 39 HG SER 39 36.157 -2.142 -7.388
332 H SER 40 HN SER 40 39.808 -0.229 -5.031
333 HA SER 40 HA SER 40 42.090 -1.995 -4.947
334 HB2 SER 40 HB2 SER 40 41.966 0.971 -4.387
335 HB3 SER 40 HB1 SER 40 43.400 0.024 -4.789
336 HG SER 40 HG SER 40 42.021 -0.498 -6.781
337 H VAL 41 HN VAL 41 40.025 -0.341 -2.693
338 HA VAL 41 HA VAL 41 41.760 -0.486 -0.443
339 HB VAL 41 HB VAL 41 38.746 -0.210 -0.525
340 HG11 VAL 41 HG11 VAL 41 38.961 0.678 1.750
341 HG12 VAL 41 HG12 VAL 41 40.684 0.305 1.727
342 HG13 VAL 41 HG13 VAL 41 39.499 -0.998 1.645
343 HG21 VAL 41 HG21 VAL 41 39.872 1.606 -1.691
344 HG22 VAL 41 HG22 VAL 41 40.912 1.880 -0.295
345 HG23 VAL 41 HG23 VAL 41 39.179 2.184 -0.176
346 H GLN 42 HN GLN 42 38.837 -2.338 -1.281
347 HA GLN 42 HA GLN 42 38.996 -4.144 0.839
348 HB2 GLN 42 HB2 GLN 42 37.514 -4.003 -1.714
349 HB3 GLN 42 HB1 GLN 42 37.654 -5.600 -0.994
350 HG2 GLN 42 HG2 GLN 42 35.589 -4.448 -0.340
351 HG3 GLN 42 HG1 GLN 42 36.610 -4.832 1.038
352 HE21 GLN 42 HE21 GLN 42 35.716 -3.285 2.345
353 HE22 GLN 42 HE22 GLN 42 35.981 -1.590 2.125
354 H THR 43 HN THR 43 40.547 -4.264 -2.317
355 HA THR 43 HA THR 43 41.336 -6.993 -2.032
356 HB THR 43 HB THR 43 42.931 -6.415 -3.945
357 HG1 THR 43 HG1 THR 43 41.424 -4.146 -4.472
358 HG21 THR 43 HG21 THR 43 41.110 -6.326 -5.591
359 HG22 THR 43 HG22 THR 43 39.976 -5.893 -4.312
360 HG23 THR 43 HG23 THR 43 40.750 -7.476 -4.304
361 H ILE 44 HN ILE 44 42.694 -3.925 -1.083
362 HA ILE 44 HA ILE 44 45.305 -5.061 -0.614
363 HB ILE 44 HB ILE 44 44.576 -2.530 -1.238
364 HG12 ILE 44 HG12 ILE 44 46.852 -3.423 -1.376
365 HG13 ILE 44 HG11 ILE 44 46.849 -1.819 -0.658
366 HG21 ILE 44 HG21 ILE 44 44.929 -1.032 0.665
367 HG22 ILE 44 HG22 ILE 44 44.974 -2.427 1.744
368 HG23 ILE 44 HG23 ILE 44 43.494 -2.039 0.867
369 HD11 ILE 44 HD11 ILE 44 47.116 -2.811 1.554
370 HD12 ILE 44 HD12 ILE 44 48.413 -3.299 0.463
371 HD13 ILE 44 HD13 ILE 44 47.103 -4.421 0.834
372 H VAL 45 HN VAL 45 42.506 -4.079 1.333
373 HA VAL 45 HA VAL 45 43.769 -4.420 3.836
374 HB VAL 45 HB VAL 45 41.481 -4.537 4.810
375 HG11 VAL 45 HG11 VAL 45 40.794 -2.278 4.157
376 HG12 VAL 45 HG12 VAL 45 41.911 -2.343 2.794
377 HG13 VAL 45 HG13 VAL 45 42.529 -2.385 4.445
378 HG21 VAL 45 HG21 VAL 45 40.602 -4.398 1.938
379 HG22 VAL 45 HG22 VAL 45 39.545 -4.179 3.333
380 HG23 VAL 45 HG23 VAL 45 40.331 -5.735 3.055
381 H ARG 46 HN ARG 46 42.079 -6.630 1.732
382 HA ARG 46 HA ARG 46 42.013 -8.799 3.575
383 HB2 ARG 46 HB2 ARG 46 41.688 -8.593 0.589
384 HB3 ARG 46 HB1 ARG 46 41.658 -10.142 1.420
385 HG2 ARG 46 HG2 ARG 46 39.834 -7.910 2.234
386 HG3 ARG 46 HG1 ARG 46 39.430 -8.994 0.901
387 HD2 ARG 46 HD2 ARG 46 40.082 -9.863 3.716
388 HD3 ARG 46 HD1 ARG 46 38.455 -9.721 3.050
389 HE ARG 46 HE ARG 46 39.891 -11.368 1.340
390 HH11 ARG 46 HH11 ARG 46 38.800 -11.446 4.668
391 HH12 ARG 46 HH12 ARG 46 38.701 -13.173 4.726
392 HH21 ARG 46 HH21 ARG 46 39.737 -13.632 1.400
393 HH22 ARG 46 HH22 ARG 46 39.220 -14.428 2.850
394 H LYS 47 HN LYS 47 44.333 -7.554 1.321
395 HA LYS 47 HA LYS 47 45.889 -9.904 1.068
396 HB2 LYS 47 HB2 LYS 47 45.970 -8.153 -0.615
397 HB3 LYS 47 HB1 LYS 47 46.623 -7.019 0.558
398 HG2 LYS 47 HG2 LYS 47 48.652 -8.354 0.747
399 HG3 LYS 47 HG1 LYS 47 47.993 -9.533 -0.387
400 HD2 LYS 47 HD2 LYS 47 48.487 -6.625 -1.037
401 HD3 LYS 47 HD1 LYS 47 49.606 -7.934 -1.413
402 HE2 LYS 47 HE2 LYS 47 47.808 -9.009 -2.754
403 HE3 LYS 47 HE1 LYS 47 46.793 -7.601 -2.453
404 HZ1 LYS 47 HZ1 LYS 47 49.429 -7.515 -3.815
405 HZ2 LYS 47 HZ2 LYS 47 48.355 -6.223 -3.615
406 HZ3 LYS 47 HZ3 LYS 47 47.938 -7.524 -4.604
407 H TYR 48 HN TYR 48 46.513 -6.900 2.958
408 HA TYR 48 HA TYR 48 48.885 -8.002 4.034
409 HB2 TYR 48 HB2 TYR 48 49.071 -6.060 5.457
410 HB3 TYR 48 HB1 TYR 48 48.587 -5.565 3.846
411 HD1 TYR 48 HD1 TYR 48 47.295 -6.158 7.287
412 HD2 TYR 48 HD2 TYR 48 46.677 -4.221 3.552
413 HE1 TYR 48 HE1 TYR 48 45.478 -4.842 8.280
414 HE2 TYR 48 HE2 TYR 48 44.852 -2.899 4.538
415 HH TYR 48 HH TYR 48 44.287 -2.796 7.920
416 H LYS 49 HN LYS 49 45.581 -8.028 5.229
417 HA LYS 49 HA LYS 49 46.316 -8.902 7.847
418 HB2 LYS 49 HB2 LYS 49 43.974 -9.338 8.224
419 HB3 LYS 49 HB1 LYS 49 44.128 -7.822 7.352
420 HG2 LYS 49 HG2 LYS 49 43.418 -8.833 5.314
421 HG3 LYS 49 HG1 LYS 49 43.498 -10.446 6.023
422 HD2 LYS 49 HD2 LYS 49 41.191 -9.713 5.908
423 HD3 LYS 49 HD1 LYS 49 41.700 -9.816 7.593
424 HE2 LYS 49 HE2 LYS 49 42.068 -7.392 7.618
425 HE3 LYS 49 HE1 LYS 49 41.540 -7.297 5.939
426 HZ1 LYS 49 HZ1 LYS 49 39.378 -8.176 6.647
427 HZ2 LYS 49 HZ2 LYS 49 39.749 -6.710 7.393
428 HZ3 LYS 49 HZ3 LYS 49 39.900 -8.155 8.256
429 H HIS 50 HN HIS 50 45.660 -10.475 4.822
430 HA HIS 50 HA HIS 50 45.410 -13.118 5.881
431 HB2 HIS 50 HB2 HIS 50 44.487 -12.309 3.667
432 HB3 HIS 50 HB1 HIS 50 46.135 -12.310 3.059
433 HD1 HIS 50 HD1 HIS 50 43.221 -14.426 3.471
434 HD2 HIS 50 HD2 HIS 50 47.306 -15.003 3.023
435 HE1 HIS 50 HE1 HIS 50 43.480 -16.821 2.769
436 H HIS 51 HN HIS 51 47.967 -11.270 4.297
437 HA HIS 51 HA HIS 51 49.901 -13.262 4.114
438 HB2 HIS 51 HB2 HIS 51 49.968 -10.982 3.041
439 HB3 HIS 51 HB1 HIS 51 50.450 -10.328 4.601
440 HD1 HIS 51 HD1 HIS 51 51.751 -12.076 1.617
441 HD2 HIS 51 HD2 HIS 51 53.089 -11.108 5.436
442 HE1 HIS 51 HE1 HIS 51 54.233 -12.440 1.571
443 H GLY 52 HN GLY 52 49.406 -10.893 6.729
444 HA2 GLY 52 HA2 GLY 52 51.638 -11.735 8.250
445 HA3 GLY 52 HA1 GLY 52 50.300 -10.768 8.836
446 H THR 53 HN THR 53 48.335 -12.933 8.166
447 HA THR 53 HA THR 53 48.704 -14.286 10.700
448 HB THR 53 HB THR 53 46.525 -13.206 10.122
449 HG1 THR 53 HG1 THR 53 46.306 -14.670 11.710
450 HG21 THR 53 HG21 THR 53 44.978 -14.413 8.646
451 HG22 THR 53 HG22 THR 53 46.263 -15.544 8.224
452 HG23 THR 53 HG23 THR 53 46.397 -13.847 7.763
453 H THR 54 HN THR 54 49.055 -15.140 7.346
454 HA THR 54 HA THR 54 48.937 -17.961 8.150
455 HB THR 54 HB THR 54 47.359 -17.301 6.332
456 HG1 THR 54 HG1 THR 54 48.280 -19.477 6.580
457 HG21 THR 54 HG21 THR 54 49.894 -16.975 4.722
458 HG22 THR 54 HG22 THR 54 48.772 -15.687 5.159
459 HG23 THR 54 HG23 THR 54 48.257 -16.973 4.067
460 H GLN 55 HN GLN 55 51.104 -15.566 6.784
461 HA GLN 55 HA GLN 55 52.978 -17.481 5.795
462 HB2 GLN 55 HB2 GLN 55 53.361 -14.559 6.443
463 HB3 GLN 55 HB1 GLN 55 54.548 -15.568 5.633
464 HG2 GLN 55 HG2 GLN 55 51.833 -14.768 4.615
465 HG3 GLN 55 HG1 GLN 55 53.402 -14.262 3.996
466 HE21 GLN 55 HE21 GLN 55 54.652 -15.763 2.835
467 HE22 GLN 55 HE22 GLN 55 53.933 -17.150 2.099
468 H HIS 56 HN HIS 56 52.435 -16.018 8.894
469 HA HIS 56 HA HIS 56 54.479 -17.742 10.007
470 HB2 HIS 56 HB2 HIS 56 55.447 -15.901 11.404
471 HB3 HIS 56 HB1 HIS 56 55.796 -15.757 9.688
472 HD1 HIS 56 HD1 HIS 56 54.161 -14.011 12.520
473 HD2 HIS 56 HD2 HIS 56 54.439 -13.605 8.391
474 HE1 HIS 56 HE1 HIS 56 53.359 -11.693 12.022
475 H HIS 57 HN HIS 57 54.162 -18.300 12.129
476 HA HIS 57 HA HIS 57 51.482 -17.666 13.151
477 HB2 HIS 57 HB2 HIS 57 53.304 -20.015 13.729
478 HB3 HIS 57 HB1 HIS 57 51.744 -19.748 14.495
479 HD1 HIS 57 HD1 HIS 57 49.716 -20.572 13.269
480 HD2 HIS 57 HD2 HIS 57 53.137 -20.651 10.926
481 HE1 HIS 57 HE1 HIS 57 49.063 -21.797 11.191
Start of MODEL 11
1 H1 ALA 1 HT1 ALA 1 57.643 16.747 -10.756
2 H2 ALA 1 HT2 ALA 1 57.278 15.553 -11.892
3 H3 ALA 1 HT3 ALA 1 57.747 17.090 -12.405
4 HA ALA 1 HA ALA 1 59.926 16.793 -11.481
5 HB1 ALA 1 HB1 ALA 1 58.955 14.020 -10.792
6 HB2 ALA 1 HB2 ALA 1 59.286 15.313 -9.639
7 HB3 ALA 1 HB3 ALA 1 60.599 14.624 -10.593
8 H SER 2 HN SER 2 61.618 15.748 -12.686
9 HA SER 2 HA SER 2 60.691 14.859 -15.308
10 HB2 SER 2 HB2 SER 2 63.489 15.595 -14.407
11 HB3 SER 2 HB1 SER 2 62.957 15.330 -16.067
12 HG SER 2 HG SER 2 61.817 17.304 -14.384
13 H MET 3 HN MET 3 63.218 13.970 -12.954
14 HA MET 3 HA MET 3 62.816 11.163 -13.744
15 HB2 MET 3 HB2 MET 3 65.034 12.020 -14.444
16 HB3 MET 3 HB1 MET 3 65.382 12.450 -12.775
17 HG2 MET 3 HG2 MET 3 65.270 10.107 -12.130
18 HG3 MET 3 HG1 MET 3 64.878 9.659 -13.788
19 HE1 MET 3 HE1 MET 3 66.848 7.891 -13.784
20 HE2 MET 3 HE2 MET 3 67.246 8.328 -12.124
21 HE3 MET 3 HE3 MET 3 68.512 8.277 -13.349
22 H GLY 4 HN GLY 4 62.251 9.822 -12.161
23 HA2 GLY 4 HA2 GLY 4 62.271 9.035 -9.915
24 HA3 GLY 4 HA1 GLY 4 62.658 10.668 -9.381
25 H LYS 5 HN LYS 5 60.214 9.863 -11.725
26 HA LYS 5 HA LYS 5 58.226 11.367 -10.323
27 HB2 LYS 5 HB2 LYS 5 57.909 9.528 -12.698
28 HB3 LYS 5 HB1 LYS 5 56.764 10.748 -12.168
29 HG2 LYS 5 HG2 LYS 5 58.381 12.504 -12.695
30 HG3 LYS 5 HG1 LYS 5 59.536 11.279 -13.221
31 HD2 LYS 5 HD2 LYS 5 56.813 11.757 -14.444
32 HD3 LYS 5 HD1 LYS 5 58.345 12.316 -15.116
33 HE2 LYS 5 HE2 LYS 5 59.094 9.991 -15.336
34 HE3 LYS 5 HE1 LYS 5 57.568 9.433 -14.654
35 HZ1 LYS 5 HZ1 LYS 5 57.887 10.939 -17.189
36 HZ2 LYS 5 HZ2 LYS 5 56.417 10.428 -16.537
37 HZ3 LYS 5 HZ3 LYS 5 57.550 9.287 -17.053
38 H SER 6 HN SER 6 55.967 10.309 -10.112
39 HA SER 6 HA SER 6 56.221 8.114 -8.293
40 HB2 SER 6 HB2 SER 6 54.573 9.981 -7.999
41 HB3 SER 6 HB1 SER 6 53.697 9.377 -9.403
42 HG SER 6 HG SER 6 52.998 7.700 -8.281
43 H LYS 7 HN LYS 7 54.843 8.631 -11.509
44 HA LYS 7 HA LYS 7 54.437 7.277 -13.264
45 HB2 LYS 7 HB2 LYS 7 56.707 6.380 -12.776
46 HB3 LYS 7 HB1 LYS 7 55.978 5.158 -11.748
47 HG2 LYS 7 HG2 LYS 7 54.838 4.196 -13.663
48 HG3 LYS 7 HG1 LYS 7 55.488 5.462 -14.707
49 HD2 LYS 7 HD2 LYS 7 57.764 4.696 -14.213
50 HD3 LYS 7 HD1 LYS 7 57.112 3.428 -13.176
51 HE2 LYS 7 HE2 LYS 7 56.578 3.720 -16.131
52 HE3 LYS 7 HE1 LYS 7 57.730 2.597 -15.411
53 HZ1 LYS 7 HZ1 LYS 7 55.907 1.497 -14.280
54 HZ2 LYS 7 HZ2 LYS 7 55.633 1.528 -15.946
55 HZ3 LYS 7 HZ3 LYS 7 54.797 2.593 -14.941
56 H GLU 8 HN GLU 8 54.327 4.859 -10.666
57 HA GLU 8 HA GLU 8 51.446 4.514 -11.181
58 HB2 GLU 8 HB2 GLU 8 53.536 2.363 -10.779
59 HB3 GLU 8 HB1 GLU 8 51.808 2.068 -10.708
60 HG2 GLU 8 HG2 GLU 8 53.299 3.099 -13.105
61 HG3 GLU 8 HG1 GLU 8 52.787 1.433 -12.855
62 H ILE 9 HN ILE 9 50.949 2.630 -9.213
63 HA ILE 9 HA ILE 9 51.294 4.192 -6.810
64 HB ILE 9 HB ILE 9 49.926 1.513 -7.232
65 HG12 ILE 9 HG12 ILE 9 48.754 4.281 -6.855
66 HG13 ILE 9 HG11 ILE 9 48.839 3.416 -8.384
67 HG21 ILE 9 HG21 ILE 9 49.909 3.319 -4.808
68 HG22 ILE 9 HG22 ILE 9 50.702 1.748 -4.930
69 HG23 ILE 9 HG23 ILE 9 48.943 1.856 -5.009
70 HD11 ILE 9 HD11 ILE 9 46.617 3.286 -7.419
71 HD12 ILE 9 HD12 ILE 9 47.281 2.563 -5.954
72 HD13 ILE 9 HD13 ILE 9 47.363 1.689 -7.482
73 H SER 10 HN SER 10 53.372 4.124 -6.203
74 HA SER 10 HA SER 10 55.104 1.927 -6.423
75 HB2 SER 10 HB2 SER 10 56.582 3.251 -4.960
76 HB3 SER 10 HB1 SER 10 55.886 4.236 -6.247
77 HG SER 10 HG SER 10 55.213 5.476 -4.698
78 H GLN 11 HN GLN 11 56.220 0.911 -4.533
79 HA GLN 11 HA GLN 11 54.366 -0.387 -2.837
80 HB2 GLN 11 HB2 GLN 11 57.373 -0.190 -2.560
81 HB3 GLN 11 HB1 GLN 11 56.341 -1.366 -1.764
82 HG2 GLN 11 HG2 GLN 11 55.732 -2.305 -3.939
83 HG3 GLN 11 HG1 GLN 11 56.776 -1.129 -4.733
84 HE21 GLN 11 HE21 GLN 11 58.800 -1.319 -2.619
85 HE22 GLN 11 HE22 GLN 11 59.609 -2.821 -2.879
86 H ASP 12 HN ASP 12 56.353 2.435 -2.601
87 HA ASP 12 HA ASP 12 56.202 2.869 0.184
88 HB2 ASP 12 HB2 ASP 12 56.479 4.907 -2.037
89 HB3 ASP 12 HB1 ASP 12 56.842 5.177 -0.337
90 H LEU 13 HN LEU 13 54.234 3.941 -2.548
91 HA LEU 13 HA LEU 13 52.412 5.432 -0.950
92 HB2 LEU 13 HB2 LEU 13 52.772 5.861 -3.355
93 HB3 LEU 13 HB1 LEU 13 52.057 4.306 -3.731
94 HG LEU 13 HG LEU 13 49.901 5.082 -2.820
95 HD11 LEU 13 HD11 LEU 13 49.587 7.457 -2.304
96 HD12 LEU 13 HD12 LEU 13 51.321 7.721 -2.481
97 HD13 LEU 13 HD13 LEU 13 50.714 6.688 -1.188
98 HD21 LEU 13 HD21 LEU 13 50.371 5.329 -5.202
99 HD22 LEU 13 HD22 LEU 13 51.090 6.910 -4.904
100 HD23 LEU 13 HD23 LEU 13 49.370 6.655 -4.614
101 H ARG 14 HN ARG 14 52.573 2.124 -2.083
102 HA ARG 14 HA ARG 14 49.956 1.311 -1.493
103 HB2 ARG 14 HB2 ARG 14 51.534 -0.055 -2.792
104 HB3 ARG 14 HB1 ARG 14 52.516 -0.299 -1.356
105 HG2 ARG 14 HG2 ARG 14 50.730 -1.557 -0.308
106 HG3 ARG 14 HG1 ARG 14 49.672 -1.244 -1.685
107 HD2 ARG 14 HD2 ARG 14 51.203 -2.470 -3.144
108 HD3 ARG 14 HD1 ARG 14 52.278 -2.766 -1.781
109 HE ARG 14 HE ARG 14 50.034 -3.853 -0.877
110 HH11 ARG 14 HH11 ARG 14 51.576 -4.163 -4.008
111 HH12 ARG 14 HH12 ARG 14 50.949 -5.743 -4.313
112 HH21 ARG 14 HH21 ARG 14 49.222 -5.971 -1.267
113 HH22 ARG 14 HH22 ARG 14 49.611 -6.776 -2.748
114 H LYS 15 HN LYS 15 52.852 1.462 0.536
115 HA LYS 15 HA LYS 15 51.682 0.305 2.843
116 HB2 LYS 15 HB2 LYS 15 54.019 2.197 2.606
117 HB3 LYS 15 HB1 LYS 15 53.589 1.313 4.061
118 HG2 LYS 15 HG2 LYS 15 53.963 -0.801 2.855
119 HG3 LYS 15 HG1 LYS 15 54.463 0.124 1.437
120 HD2 LYS 15 HD2 LYS 15 55.792 0.176 4.148
121 HD3 LYS 15 HD1 LYS 15 56.397 -0.657 2.715
122 HE2 LYS 15 HE2 LYS 15 56.573 1.494 1.554
123 HE3 LYS 15 HE1 LYS 15 55.983 2.322 2.993
124 HZ1 LYS 15 HZ1 LYS 15 58.496 0.764 2.774
125 HZ2 LYS 15 HZ2 LYS 15 57.920 1.484 4.193
126 HZ3 LYS 15 HZ3 LYS 15 58.364 2.447 2.877
127 H LYS 16 HN LYS 16 51.513 3.456 1.458
128 HA LYS 16 HA LYS 16 50.852 4.918 3.788
129 HB2 LYS 16 HB2 LYS 16 51.587 5.901 1.574
130 HB3 LYS 16 HB1 LYS 16 49.997 5.519 0.943
131 HG2 LYS 16 HG2 LYS 16 50.245 7.219 3.389
132 HG3 LYS 16 HG1 LYS 16 50.541 7.920 1.798
133 HD2 LYS 16 HD2 LYS 16 48.315 7.294 1.071
134 HD3 LYS 16 HD1 LYS 16 48.023 6.454 2.596
135 HE2 LYS 16 HE2 LYS 16 46.951 8.660 2.558
136 HE3 LYS 16 HE1 LYS 16 48.190 8.555 3.806
137 HZ1 LYS 16 HZ1 LYS 16 48.557 9.823 1.146
138 HZ2 LYS 16 HZ2 LYS 16 49.702 9.767 2.391
139 HZ3 LYS 16 HZ3 LYS 16 48.278 10.644 2.594
140 H ILE 17 HN ILE 17 48.929 3.267 1.336
141 HA ILE 17 HA ILE 17 46.408 3.905 2.414
142 HB ILE 17 HB ILE 17 47.378 1.734 0.563
143 HG12 ILE 17 HG12 ILE 17 45.730 2.848 -0.988
144 HG13 ILE 17 HG11 ILE 17 45.467 4.059 0.258
145 HG21 ILE 17 HG21 ILE 17 44.565 1.960 1.606
146 HG22 ILE 17 HG22 ILE 17 45.693 0.633 1.887
147 HG23 ILE 17 HG23 ILE 17 45.079 0.940 0.262
148 HD11 ILE 17 HD11 ILE 17 47.819 4.704 0.112
149 HD12 ILE 17 HD12 ILE 17 46.995 4.858 -1.440
150 HD13 ILE 17 HD13 ILE 17 48.069 3.491 -1.143
151 H VAL 18 HN VAL 18 48.527 1.111 2.863
152 HA VAL 18 HA VAL 18 46.886 -0.412 4.533
153 HB VAL 18 HB VAL 18 49.909 -0.288 4.454
154 HG11 VAL 18 HG11 VAL 18 49.149 -1.320 6.521
155 HG12 VAL 18 HG12 VAL 18 49.854 -2.529 5.447
156 HG13 VAL 18 HG13 VAL 18 48.102 -2.409 5.611
157 HG21 VAL 18 HG21 VAL 18 48.924 -0.854 2.301
158 HG22 VAL 18 HG22 VAL 18 47.961 -2.123 3.058
159 HG23 VAL 18 HG23 VAL 18 49.718 -2.262 3.007
160 H ASP 19 HN ASP 19 49.545 1.773 5.473
161 HA ASP 19 HA ASP 19 49.191 1.412 8.247
162 HB2 ASP 19 HB2 ASP 19 51.298 2.199 7.289
163 HB3 ASP 19 HB1 ASP 19 50.521 3.700 6.796
164 H LEU 20 HN LEU 20 47.995 3.941 6.056
165 HA LEU 20 HA LEU 20 46.887 5.470 8.173
166 HB2 LEU 20 HB2 LEU 20 46.623 5.570 5.203
167 HB3 LEU 20 HB1 LEU 20 45.508 6.489 6.193
168 HG LEU 20 HG LEU 20 47.335 7.902 5.429
169 HD11 LEU 20 HD11 LEU 20 48.108 8.777 7.576
170 HD12 LEU 20 HD12 LEU 20 47.483 7.338 8.377
171 HD13 LEU 20 HD13 LEU 20 46.380 8.444 7.562
172 HD21 LEU 20 HD21 LEU 20 49.635 7.548 6.168
173 HD22 LEU 20 HD22 LEU 20 49.072 6.209 5.165
174 HD23 LEU 20 HD23 LEU 20 49.164 6.022 6.916
175 H HIS 21 HN HIS 21 45.732 2.702 6.452
176 HA HIS 21 HA HIS 21 42.976 2.966 7.067
177 HB2 HIS 21 HB2 HIS 21 44.752 0.681 6.361
178 HB3 HIS 21 HB1 HIS 21 43.280 0.292 7.228
179 HD1 HIS 21 HD1 HIS 21 41.025 1.456 6.051
180 HD2 HIS 21 HD2 HIS 21 44.350 0.722 3.674
181 HE1 HIS 21 HE1 HIS 21 40.174 1.447 3.696
182 H LYS 22 HN LYS 22 45.759 1.962 8.854
183 HA LYS 22 HA LYS 22 44.275 0.931 11.088
184 HB2 LYS 22 HB2 LYS 22 47.207 1.637 10.920
185 HB3 LYS 22 HB1 LYS 22 46.442 0.576 12.096
186 HG2 LYS 22 HG2 LYS 22 46.112 -0.132 9.239
187 HG3 LYS 22 HG1 LYS 22 47.719 -0.327 9.929
188 HD2 LYS 22 HD2 LYS 22 46.254 -2.357 9.995
189 HD3 LYS 22 HD1 LYS 22 46.923 -1.877 11.555
190 HE2 LYS 22 HE2 LYS 22 44.616 -2.518 11.844
191 HE3 LYS 22 HE1 LYS 22 44.749 -0.778 12.068
192 HZ1 LYS 22 HZ1 LYS 22 43.923 -0.478 9.802
193 HZ2 LYS 22 HZ2 LYS 22 42.827 -1.347 10.740
194 HZ3 LYS 22 HZ3 LYS 22 43.794 -2.155 9.618
195 H SER 23 HN SER 23 45.285 3.979 10.006
196 HA SER 23 HA SER 23 45.383 5.257 12.575
197 HB2 SER 23 HB2 SER 23 45.083 6.489 9.823
198 HB3 SER 23 HB1 SER 23 45.576 7.321 11.299
199 HG SER 23 HG SER 23 47.275 5.480 11.233
200 H GLY 24 HN GLY 24 43.035 4.950 9.934
201 HA2 GLY 24 HA2 GLY 24 40.730 4.662 10.266
202 HA3 GLY 24 HA1 GLY 24 40.904 5.300 11.889
203 H SER 25 HN SER 25 41.522 7.699 11.933
204 HA SER 25 HA SER 25 39.366 9.077 10.750
205 HB2 SER 25 HB2 SER 25 40.319 9.731 12.914
206 HB3 SER 25 HB1 SER 25 41.821 10.199 12.124
207 HG SER 25 HG SER 25 39.377 11.326 11.303
208 H SER 26 HN SER 26 42.593 8.540 9.650
209 HA SER 26 HA SER 26 42.605 10.764 7.828
210 HB2 SER 26 HB2 SER 26 44.470 8.405 8.002
211 HB3 SER 26 HB1 SER 26 44.764 9.907 7.119
212 HG SER 26 HG SER 26 44.945 11.000 9.003
213 H LEU 27 HN LEU 27 40.833 8.047 7.715
214 HA LEU 27 HA LEU 27 41.347 7.033 5.117
215 HB2 LEU 27 HB2 LEU 27 40.093 5.792 6.845
216 HB3 LEU 27 HB1 LEU 27 38.782 6.946 6.708
217 HG LEU 27 HG LEU 27 38.418 6.233 4.368
218 HD11 LEU 27 HD11 LEU 27 39.499 4.188 3.559
219 HD12 LEU 27 HD12 LEU 27 40.527 4.172 4.991
220 HD13 LEU 27 HD13 LEU 27 40.661 5.488 3.825
221 HD21 LEU 27 HD21 LEU 27 38.372 4.004 6.400
222 HD22 LEU 27 HD22 LEU 27 37.453 4.046 4.896
223 HD23 LEU 27 HD23 LEU 27 37.123 5.225 6.165
224 H GLY 28 HN GLY 28 39.481 9.723 6.310
225 HA2 GLY 28 HA2 GLY 28 37.959 10.169 3.946
226 HA3 GLY 28 HA1 GLY 28 38.233 11.335 5.232
227 H ALA 29 HN ALA 29 41.171 11.030 4.947
228 HA ALA 29 HA ALA 29 41.569 13.064 2.996
229 HB1 ALA 29 HB1 ALA 29 43.940 12.873 3.574
230 HB2 ALA 29 HB2 ALA 29 43.606 11.396 4.479
231 HB3 ALA 29 HB3 ALA 29 42.941 12.935 5.026
232 H ILE 30 HN ILE 30 42.209 9.609 3.177
233 HA ILE 30 HA ILE 30 43.596 9.357 0.733
234 HB ILE 30 HB ILE 30 41.890 7.264 2.111
235 HG12 ILE 30 HG12 ILE 30 44.849 7.837 2.411
236 HG13 ILE 30 HG11 ILE 30 43.615 8.225 3.605
237 HG21 ILE 30 HG21 ILE 30 43.322 5.647 0.942
238 HG22 ILE 30 HG22 ILE 30 44.156 6.974 0.135
239 HG23 ILE 30 HG23 ILE 30 42.450 6.679 -0.192
240 HD11 ILE 30 HD11 ILE 30 43.130 5.851 3.877
241 HD12 ILE 30 HD12 ILE 30 44.828 6.203 4.194
242 HD13 ILE 30 HD13 ILE 30 44.353 5.461 2.668
243 H SER 31 HN SER 31 40.168 9.147 1.562
244 HA SER 31 HA SER 31 39.354 8.326 -1.031
245 HB2 SER 31 HB2 SER 31 37.044 9.040 -0.113
246 HB3 SER 31 HB1 SER 31 37.879 7.698 0.667
247 HG SER 31 HG SER 31 38.230 8.888 2.401
248 H LYS 32 HN LYS 32 39.763 11.439 0.502
249 HA LYS 32 HA LYS 32 38.368 12.848 -1.580
250 HB2 LYS 32 HB2 LYS 32 38.530 13.628 0.816
251 HB3 LYS 32 HB1 LYS 32 40.223 13.983 0.530
252 HG2 LYS 32 HG2 LYS 32 38.049 15.238 -1.127
253 HG3 LYS 32 HG1 LYS 32 38.546 15.915 0.421
254 HD2 LYS 32 HD2 LYS 32 40.829 16.168 -0.408
255 HD3 LYS 32 HD1 LYS 32 40.367 15.428 -1.941
256 HE2 LYS 32 HE2 LYS 32 40.437 17.823 -2.202
257 HE3 LYS 32 HE1 LYS 32 38.766 17.277 -2.305
258 HZ1 LYS 32 HZ1 LYS 32 40.041 18.480 0.091
259 HZ2 LYS 32 HZ2 LYS 32 38.431 17.974 -0.014
260 HZ3 LYS 32 HZ3 LYS 32 38.973 19.264 -0.956
261 H ARG 33 HN ARG 33 41.776 12.412 -0.660
262 HA ARG 33 HA ARG 33 42.677 14.021 -2.876
263 HB2 ARG 33 HB2 ARG 33 44.288 12.364 -0.940
264 HB3 ARG 33 HB1 ARG 33 44.922 13.573 -2.047
265 HG2 ARG 33 HG2 ARG 33 43.628 15.299 -0.871
266 HG3 ARG 33 HG1 ARG 33 43.057 14.072 0.261
267 HD2 ARG 33 HD2 ARG 33 45.410 13.609 0.875
268 HD3 ARG 33 HD1 ARG 33 45.909 14.930 -0.182
269 HE ARG 33 HE ARG 33 44.044 15.436 2.026
270 HH11 ARG 33 HH11 ARG 33 47.162 15.992 0.506
271 HH12 ARG 33 HH12 ARG 33 47.567 17.316 1.542
272 HH21 ARG 33 HH21 ARG 33 44.602 17.184 3.406
273 HH22 ARG 33 HH22 ARG 33 46.117 17.989 3.199
274 H LEU 34 HN LEU 34 42.927 10.571 -2.017
275 HA LEU 34 HA LEU 34 44.111 10.051 -4.636
276 HB2 LEU 34 HB2 LEU 34 45.141 9.086 -2.601
277 HB3 LEU 34 HB1 LEU 34 43.674 8.178 -2.309
278 HG LEU 34 HG LEU 34 44.044 6.975 -4.460
279 HD11 LEU 34 HD11 LEU 34 46.683 8.433 -4.426
280 HD12 LEU 34 HD12 LEU 34 45.392 8.629 -5.613
281 HD13 LEU 34 HD13 LEU 34 46.262 7.099 -5.499
282 HD21 LEU 34 HD21 LEU 34 44.733 5.992 -2.345
283 HD22 LEU 34 HD22 LEU 34 46.286 6.819 -2.450
284 HD23 LEU 34 HD23 LEU 34 45.869 5.572 -3.626
285 H LYS 35 HN LYS 35 41.087 10.120 -3.245
286 HA LYS 35 HA LYS 35 39.012 9.590 -3.990
287 HB2 LYS 35 HB2 LYS 35 40.310 8.368 -6.438
288 HB3 LYS 35 HB1 LYS 35 38.628 8.839 -6.267
289 HG2 LYS 35 HG2 LYS 35 41.006 10.692 -6.313
290 HG3 LYS 35 HG1 LYS 35 39.839 10.451 -7.612
291 HD2 LYS 35 HD2 LYS 35 38.060 11.330 -6.168
292 HD3 LYS 35 HD1 LYS 35 39.233 11.565 -4.871
293 HE2 LYS 35 HE2 LYS 35 40.478 13.135 -6.280
294 HE3 LYS 35 HE1 LYS 35 39.308 12.897 -7.577
295 HZ1 LYS 35 HZ1 LYS 35 38.671 13.996 -4.894
296 HZ2 LYS 35 HZ2 LYS 35 37.597 13.832 -6.185
297 HZ3 LYS 35 HZ3 LYS 35 38.884 14.918 -6.297
298 H VAL 36 HN VAL 36 41.347 7.439 -3.244
299 HA VAL 36 HA VAL 36 41.559 5.250 -2.780
300 HB VAL 36 HB VAL 36 40.437 6.138 -0.775
301 HG11 VAL 36 HG11 VAL 36 38.281 6.764 -1.710
302 HG12 VAL 36 HG12 VAL 36 38.091 5.700 -0.315
303 HG13 VAL 36 HG13 VAL 36 37.882 5.062 -1.945
304 HG21 VAL 36 HG21 VAL 36 39.736 3.289 -1.456
305 HG22 VAL 36 HG22 VAL 36 39.728 3.973 0.169
306 HG23 VAL 36 HG23 VAL 36 41.237 3.871 -0.736
307 HA PRO 37 HA PRO 37 39.476 3.139 -6.216
308 HB2 PRO 37 HB2 PRO 37 41.819 1.371 -5.832
309 HB3 PRO 37 HB1 PRO 37 41.249 2.160 -7.307
310 HG2 PRO 37 HG2 PRO 37 43.460 2.999 -6.061
311 HG3 PRO 37 HG1 PRO 37 42.343 4.145 -6.824
312 HD2 PRO 37 HD2 PRO 37 42.653 3.445 -3.928
313 HD3 PRO 37 HD1 PRO 37 42.402 5.034 -4.685
314 H ARG 38 HN ARG 38 37.790 2.389 -4.961
315 HA ARG 38 HA ARG 38 37.869 0.910 -2.650
316 HB2 ARG 38 HB2 ARG 38 35.891 2.062 -3.565
317 HB3 ARG 38 HB1 ARG 38 35.718 0.781 -4.752
318 HG2 ARG 38 HG2 ARG 38 35.287 -0.832 -3.011
319 HG3 ARG 38 HG1 ARG 38 35.588 0.386 -1.770
320 HD2 ARG 38 HD2 ARG 38 33.375 0.443 -3.821
321 HD3 ARG 38 HD1 ARG 38 33.193 0.055 -2.112
322 HE ARG 38 HE ARG 38 34.362 2.647 -2.648
323 HH11 ARG 38 HH11 ARG 38 31.399 0.862 -2.056
324 HH12 ARG 38 HH12 ARG 38 30.502 2.258 -1.575
325 HH21 ARG 38 HH21 ARG 38 33.179 4.498 -2.016
326 HH22 ARG 38 HH22 ARG 38 31.520 4.338 -1.552
327 H SER 39 HN SER 39 37.468 -0.440 -5.925
328 HA SER 39 HA SER 39 37.231 -3.112 -5.072
329 HB2 SER 39 HB2 SER 39 38.252 -2.171 -7.753
330 HB3 SER 39 HB1 SER 39 37.452 -3.698 -7.383
331 HG SER 39 HG SER 39 36.332 -1.440 -8.137
332 H SER 40 HN SER 40 40.028 -1.213 -6.077
333 HA SER 40 HA SER 40 41.821 -3.428 -6.022
334 HB2 SER 40 HB2 SER 40 42.431 -0.470 -6.033
335 HB3 SER 40 HB1 SER 40 43.547 -1.770 -6.450
336 HG SER 40 HG SER 40 41.613 -2.283 -7.983
337 H VAL 41 HN VAL 41 41.053 -0.793 -3.784
338 HA VAL 41 HA VAL 41 43.061 -1.411 -1.893
339 HB VAL 41 HB VAL 41 40.450 0.094 -1.579
340 HG11 VAL 41 HG11 VAL 41 41.100 -0.823 0.588
341 HG12 VAL 41 HG12 VAL 41 41.338 0.924 0.553
342 HG13 VAL 41 HG13 VAL 41 42.722 -0.157 0.395
343 HG21 VAL 41 HG21 VAL 41 42.084 1.155 -3.040
344 HG22 VAL 41 HG22 VAL 41 43.313 1.024 -1.782
345 HG23 VAL 41 HG23 VAL 41 41.911 2.063 -1.540
346 H GLN 42 HN GLN 42 39.729 -2.508 -2.294
347 HA GLN 42 HA GLN 42 39.442 -3.876 0.139
348 HB2 GLN 42 HB2 GLN 42 37.737 -3.397 -1.813
349 HB3 GLN 42 HB1 GLN 42 38.273 -4.954 -2.417
350 HG2 GLN 42 HG2 GLN 42 37.183 -4.564 0.361
351 HG3 GLN 42 HG1 GLN 42 36.167 -4.935 -1.024
352 HE21 GLN 42 HE21 GLN 42 38.075 -6.732 -2.260
353 HE22 GLN 42 HE22 GLN 42 38.098 -8.162 -1.295
354 H THR 43 HN THR 43 40.879 -4.839 -2.929
355 HA THR 43 HA THR 43 41.406 -7.526 -2.207
356 HB THR 43 HB THR 43 42.893 -5.837 -4.238
357 HG1 THR 43 HG1 THR 43 40.918 -5.765 -5.083
358 HG21 THR 43 HG21 THR 43 43.964 -7.989 -3.708
359 HG22 THR 43 HG22 THR 43 43.305 -7.990 -5.344
360 HG23 THR 43 HG23 THR 43 42.449 -8.825 -4.049
361 H ILE 44 HN ILE 44 43.098 -4.499 -1.728
362 HA ILE 44 HA ILE 44 45.589 -5.646 -0.921
363 HB ILE 44 HB ILE 44 44.475 -2.867 -0.470
364 HG12 ILE 44 HG12 ILE 44 44.814 -3.382 -2.828
365 HG13 ILE 44 HG11 ILE 44 46.012 -2.213 -2.284
366 HG21 ILE 44 HG21 ILE 44 46.149 -3.358 1.214
367 HG22 ILE 44 HG22 ILE 44 46.784 -2.198 0.047
368 HG23 ILE 44 HG23 ILE 44 47.280 -3.889 -0.032
369 HD11 ILE 44 HD11 ILE 44 46.449 -5.158 -2.738
370 HD12 ILE 44 HD12 ILE 44 47.653 -4.049 -2.087
371 HD13 ILE 44 HD13 ILE 44 47.051 -3.829 -3.729
372 H VAL 45 HN VAL 45 42.849 -4.193 0.849
373 HA VAL 45 HA VAL 45 43.943 -4.584 3.406
374 HB VAL 45 HB VAL 45 41.652 -4.309 4.305
375 HG11 VAL 45 HG11 VAL 45 41.241 -2.056 3.418
376 HG12 VAL 45 HG12 VAL 45 42.387 -2.378 2.117
377 HG13 VAL 45 HG13 VAL 45 42.941 -2.339 3.790
378 HG21 VAL 45 HG21 VAL 45 40.364 -5.508 2.662
379 HG22 VAL 45 HG22 VAL 45 40.833 -4.354 1.415
380 HG23 VAL 45 HG23 VAL 45 39.795 -3.837 2.746
381 H ARG 46 HN ARG 46 41.997 -6.696 1.386
382 HA ARG 46 HA ARG 46 41.642 -8.715 3.352
383 HB2 ARG 46 HB2 ARG 46 41.419 -8.673 0.357
384 HB3 ARG 46 HB1 ARG 46 41.231 -10.165 1.264
385 HG2 ARG 46 HG2 ARG 46 39.583 -7.692 1.721
386 HG3 ARG 46 HG1 ARG 46 39.099 -9.037 0.687
387 HD2 ARG 46 HD2 ARG 46 39.343 -10.544 2.643
388 HD3 ARG 46 HD1 ARG 46 39.648 -9.128 3.646
389 HE ARG 46 HE ARG 46 37.321 -8.467 2.586
390 HH11 ARG 46 HH11 ARG 46 38.382 -11.523 3.958
391 HH12 ARG 46 HH12 ARG 46 36.795 -12.007 4.449
392 HH21 ARG 46 HH21 ARG 46 35.200 -9.110 3.251
393 HH22 ARG 46 HH22 ARG 46 34.980 -10.632 4.043
394 H LYS 47 HN LYS 47 44.307 -7.784 1.434
395 HA LYS 47 HA LYS 47 45.486 -10.427 1.481
396 HB2 LYS 47 HB2 LYS 47 45.660 -8.923 -0.516
397 HB3 LYS 47 HB1 LYS 47 46.718 -7.889 0.434
398 HG2 LYS 47 HG2 LYS 47 48.331 -9.656 0.656
399 HG3 LYS 47 HG1 LYS 47 47.252 -10.791 -0.147
400 HD2 LYS 47 HD2 LYS 47 47.333 -9.291 -2.159
401 HD3 LYS 47 HD1 LYS 47 48.601 -8.377 -1.338
402 HE2 LYS 47 HE2 LYS 47 49.576 -10.001 -2.863
403 HE3 LYS 47 HE1 LYS 47 49.962 -10.410 -1.193
404 HZ1 LYS 47 HZ1 LYS 47 47.820 -11.665 -2.826
405 HZ2 LYS 47 HZ2 LYS 47 48.190 -12.062 -1.230
406 HZ3 LYS 47 HZ3 LYS 47 49.313 -12.362 -2.450
407 H TYR 48 HN TYR 48 46.428 -7.162 2.672
408 HA TYR 48 HA TYR 48 48.670 -8.254 4.029
409 HB2 TYR 48 HB2 TYR 48 49.152 -6.098 4.887
410 HB3 TYR 48 HB1 TYR 48 48.516 -5.855 3.272
411 HD1 TYR 48 HD1 TYR 48 47.741 -5.557 6.880
412 HD2 TYR 48 HD2 TYR 48 46.567 -4.525 2.926
413 HE1 TYR 48 HE1 TYR 48 46.179 -3.893 7.787
414 HE2 TYR 48 HE2 TYR 48 44.996 -2.859 3.825
415 HH TYR 48 HH TYR 48 45.089 -1.810 7.016
416 H LYS 49 HN LYS 49 45.367 -7.858 4.959
417 HA LYS 49 HA LYS 49 45.886 -8.223 7.756
418 HB2 LYS 49 HB2 LYS 49 43.357 -8.446 6.126
419 HB3 LYS 49 HB1 LYS 49 43.411 -8.684 7.866
420 HG2 LYS 49 HG2 LYS 49 44.191 -6.401 8.171
421 HG3 LYS 49 HG1 LYS 49 44.191 -6.160 6.424
422 HD2 LYS 49 HD2 LYS 49 42.185 -5.211 7.470
423 HD3 LYS 49 HD1 LYS 49 41.782 -6.517 6.357
424 HE2 LYS 49 HE2 LYS 49 41.459 -8.048 8.173
425 HE3 LYS 49 HE1 LYS 49 42.069 -6.874 9.334
426 HZ1 LYS 49 HZ1 LYS 49 40.163 -5.462 8.808
427 HZ2 LYS 49 HZ2 LYS 49 39.683 -6.963 9.403
428 HZ3 LYS 49 HZ3 LYS 49 39.574 -6.640 7.748
429 H HIS 50 HN HIS 50 44.992 -10.270 5.046
430 HA HIS 50 HA HIS 50 44.642 -12.640 6.581
431 HB2 HIS 50 HB2 HIS 50 43.639 -12.295 4.346
432 HB3 HIS 50 HB1 HIS 50 45.245 -12.323 3.633
433 HD1 HIS 50 HD1 HIS 50 45.702 -14.474 2.555
434 HD2 HIS 50 HD2 HIS 50 43.275 -14.925 5.899
435 HE1 HIS 50 HE1 HIS 50 45.201 -16.926 2.691
436 H HIS 51 HN HIS 51 47.330 -11.234 4.786
437 HA HIS 51 HA HIS 51 49.082 -13.455 5.276
438 HB2 HIS 51 HB2 HIS 51 49.382 -12.056 3.290
439 HB3 HIS 51 HB1 HIS 51 49.663 -10.645 4.302
440 HD1 HIS 51 HD1 HIS 51 52.059 -10.070 4.393
441 HD2 HIS 51 HD2 HIS 51 51.487 -14.173 4.055
442 HE1 HIS 51 HE1 HIS 51 54.361 -11.067 4.345
443 H GLY 52 HN GLY 52 48.487 -10.317 6.753
444 HA2 GLY 52 HA2 GLY 52 50.772 -10.341 8.449
445 HA3 GLY 52 HA1 GLY 52 49.377 -9.288 8.596
446 H THR 53 HN THR 53 47.761 -11.972 8.685
447 HA THR 53 HA THR 53 47.991 -12.185 11.577
448 HB THR 53 HB THR 53 45.871 -13.613 11.293
449 HG1 THR 53 HG1 THR 53 45.525 -12.231 8.869
450 HG21 THR 53 HG21 THR 53 44.461 -11.603 11.132
451 HG22 THR 53 HG22 THR 53 45.842 -10.689 10.527
452 HG23 THR 53 HG23 THR 53 45.859 -11.328 12.171
453 H THR 54 HN THR 54 49.447 -13.629 9.114
454 HA THR 54 HA THR 54 49.708 -16.153 10.595
455 HB THR 54 HB THR 54 49.827 -15.937 7.573
456 HG1 THR 54 HG1 THR 54 47.707 -16.565 9.354
457 HG21 THR 54 HG21 THR 54 51.110 -17.797 8.538
458 HG22 THR 54 HG22 THR 54 49.692 -18.390 7.670
459 HG23 THR 54 HG23 THR 54 49.681 -18.319 9.431
460 H GLN 55 HN GLN 55 51.182 -13.765 8.456
461 HA GLN 55 HA GLN 55 53.839 -14.612 9.399
462 HB2 GLN 55 HB2 GLN 55 53.068 -13.564 6.665
463 HB3 GLN 55 HB1 GLN 55 54.721 -13.813 7.205
464 HG2 GLN 55 HG2 GLN 55 52.637 -15.969 6.956
465 HG3 GLN 55 HG1 GLN 55 53.896 -15.627 5.772
466 HE21 GLN 55 HE21 GLN 55 53.372 -18.038 7.310
467 HE22 GLN 55 HE22 GLN 55 54.820 -18.372 8.198
468 H HIS 56 HN HIS 56 55.359 -12.562 8.525
469 HA HIS 56 HA HIS 56 54.512 -10.384 10.216
470 HB2 HIS 56 HB2 HIS 56 56.703 -9.463 9.918
471 HB3 HIS 56 HB1 HIS 56 56.902 -11.200 10.089
472 HD1 HIS 56 HD1 HIS 56 57.257 -8.401 7.594
473 HD2 HIS 56 HD2 HIS 56 57.904 -12.509 7.804
474 HE1 HIS 56 HE1 HIS 56 58.621 -8.974 5.572
475 H HIS 57 HN HIS 57 54.794 -8.099 9.416
476 HA HIS 57 HA HIS 57 53.983 -7.850 6.617
477 HB2 HIS 57 HB2 HIS 57 52.541 -5.896 7.278
478 HB3 HIS 57 HB1 HIS 57 51.969 -7.442 7.878
479 HD1 HIS 57 HD1 HIS 57 52.184 -7.839 10.487
480 HD2 HIS 57 HD2 HIS 57 53.142 -3.999 9.216
481 HE1 HIS 57 HE1 HIS 57 52.153 -6.428 12.548
Start of MODEL 12
1 H1 ALA 1 HT1 ALA 1 32.554 -5.628 -10.586
2 H2 ALA 1 HT2 ALA 1 31.827 -6.417 -9.284
3 H3 ALA 1 HT3 ALA 1 33.173 -7.102 -10.038
4 HA ALA 1 HA ALA 1 33.143 -4.558 -8.537
5 HB1 ALA 1 HB1 ALA 1 32.855 -6.528 -7.102
6 HB2 ALA 1 HB2 ALA 1 34.401 -5.726 -6.830
7 HB3 ALA 1 HB3 ALA 1 34.335 -7.217 -7.768
8 H SER 2 HN SER 2 34.365 -5.909 -11.212
9 HA SER 2 HA SER 2 36.228 -5.824 -12.441
10 HB2 SER 2 HB2 SER 2 37.529 -3.679 -12.360
11 HB3 SER 2 HB1 SER 2 35.792 -3.461 -12.521
12 HG SER 2 HG SER 2 36.351 -3.506 -9.934
13 H MET 3 HN MET 3 37.364 -7.580 -11.852
14 HA MET 3 HA MET 3 39.002 -7.730 -9.532
15 HB2 MET 3 HB2 MET 3 39.840 -9.812 -10.465
16 HB3 MET 3 HB1 MET 3 38.096 -9.725 -10.659
17 HG2 MET 3 HG2 MET 3 38.355 -9.128 -12.994
18 HG3 MET 3 HG1 MET 3 40.108 -9.111 -12.815
19 HE1 MET 3 HE1 MET 3 36.865 -11.299 -12.871
20 HE2 MET 3 HE2 MET 3 37.514 -11.677 -11.276
21 HE3 MET 3 HE3 MET 3 37.497 -12.910 -12.537
22 H GLY 4 HN GLY 4 39.443 -6.306 -12.593
23 HA2 GLY 4 HA2 GLY 4 41.181 -5.087 -13.448
24 HA3 GLY 4 HA1 GLY 4 41.996 -5.273 -11.902
25 H LYS 5 HN LYS 5 43.939 -6.014 -12.271
26 HA LYS 5 HA LYS 5 44.505 -8.589 -13.169
27 HB2 LYS 5 HB2 LYS 5 43.904 -7.750 -15.397
28 HB3 LYS 5 HB1 LYS 5 45.042 -6.425 -15.220
29 HG2 LYS 5 HG2 LYS 5 46.895 -7.984 -15.216
30 HG3 LYS 5 HG1 LYS 5 45.772 -9.343 -15.309
31 HD2 LYS 5 HD2 LYS 5 44.962 -8.527 -17.465
32 HD3 LYS 5 HD1 LYS 5 46.078 -7.163 -17.371
33 HE2 LYS 5 HE2 LYS 5 47.968 -8.682 -17.389
34 HE3 LYS 5 HE1 LYS 5 46.878 -10.067 -17.404
35 HZ1 LYS 5 HZ1 LYS 5 47.087 -8.016 -19.536
36 HZ2 LYS 5 HZ2 LYS 5 46.049 -9.350 -19.548
37 HZ3 LYS 5 HZ3 LYS 5 47.714 -9.583 -19.603
38 H SER 6 HN SER 6 45.796 -5.308 -13.398
39 HA SER 6 HA SER 6 47.700 -5.716 -11.321
40 HB2 SER 6 HB2 SER 6 48.769 -6.825 -13.366
41 HB3 SER 6 HB1 SER 6 48.830 -5.219 -14.090
42 HG SER 6 HG SER 6 50.158 -6.191 -11.797
43 H LYS 7 HN LYS 7 46.992 -3.855 -10.362
44 HA LYS 7 HA LYS 7 47.316 -1.382 -11.893
45 HB2 LYS 7 HB2 LYS 7 45.189 -0.526 -10.901
46 HB3 LYS 7 HB1 LYS 7 44.979 -1.814 -12.076
47 HG2 LYS 7 HG2 LYS 7 44.720 -3.424 -10.231
48 HG3 LYS 7 HG1 LYS 7 44.858 -2.092 -9.081
49 HD2 LYS 7 HD2 LYS 7 42.872 -1.055 -10.012
50 HD3 LYS 7 HD1 LYS 7 42.762 -2.323 -11.233
51 HE2 LYS 7 HE2 LYS 7 42.446 -3.987 -9.460
52 HE3 LYS 7 HE1 LYS 7 42.533 -2.707 -8.250
53 HZ1 LYS 7 HZ1 LYS 7 40.244 -3.296 -8.765
54 HZ2 LYS 7 HZ2 LYS 7 40.498 -2.913 -10.396
55 HZ3 LYS 7 HZ3 LYS 7 40.582 -1.703 -9.224
56 H GLU 8 HN GLU 8 48.068 0.310 -10.801
57 HA GLU 8 HA GLU 8 49.016 1.558 -9.179
58 HB2 GLU 8 HB2 GLU 8 46.648 0.975 -8.153
59 HB3 GLU 8 HB1 GLU 8 47.581 0.015 -7.027
60 HG2 GLU 8 HG2 GLU 8 47.771 2.983 -7.477
61 HG3 GLU 8 HG1 GLU 8 47.105 2.158 -6.070
62 H ILE 9 HN ILE 9 48.742 -1.107 -6.929
63 HA ILE 9 HA ILE 9 50.261 -2.319 -5.775
64 HB ILE 9 HB ILE 9 51.728 -2.719 -8.381
65 HG12 ILE 9 HG12 ILE 9 49.182 -4.095 -7.494
66 HG13 ILE 9 HG11 ILE 9 49.276 -2.885 -8.767
67 HG21 ILE 9 HG21 ILE 9 52.679 -3.757 -6.366
68 HG22 ILE 9 HG22 ILE 9 52.070 -4.979 -7.484
69 HG23 ILE 9 HG23 ILE 9 51.139 -4.557 -6.047
70 HD11 ILE 9 HD11 ILE 9 50.737 -4.370 -10.048
71 HD12 ILE 9 HD12 ILE 9 49.176 -5.109 -9.698
72 HD13 ILE 9 HD13 ILE 9 50.602 -5.582 -8.775
73 H SER 10 HN SER 10 50.900 0.291 -5.353
74 HA SER 10 HA SER 10 53.815 0.365 -5.618
75 HB2 SER 10 HB2 SER 10 51.896 2.490 -4.635
76 HB3 SER 10 HB1 SER 10 53.639 2.692 -4.804
77 HG SER 10 HG SER 10 51.636 2.548 -6.729
78 H GLN 11 HN GLN 11 55.076 -0.163 -3.999
79 HA GLN 11 HA GLN 11 54.171 -1.423 -1.691
80 HB2 GLN 11 HB2 GLN 11 56.848 -0.170 -2.315
81 HB3 GLN 11 HB1 GLN 11 56.543 -1.083 -0.849
82 HG2 GLN 11 HG2 GLN 11 57.659 -2.493 -2.429
83 HG3 GLN 11 HG1 GLN 11 56.005 -3.061 -2.242
84 HE21 GLN 11 HE21 GLN 11 54.598 -2.903 -3.965
85 HE22 GLN 11 HE22 GLN 11 55.125 -2.548 -5.573
86 H ASP 12 HN ASP 12 55.429 1.847 -2.100
87 HA ASP 12 HA ASP 12 55.258 2.598 0.615
88 HB2 ASP 12 HB2 ASP 12 55.181 4.379 -1.826
89 HB3 ASP 12 HB1 ASP 12 55.537 4.891 -0.182
90 H LEU 13 HN LEU 13 53.007 2.894 -2.074
91 HA LEU 13 HA LEU 13 51.125 4.505 -0.701
92 HB2 LEU 13 HB2 LEU 13 51.285 4.263 -3.191
93 HB3 LEU 13 HB1 LEU 13 50.642 2.645 -3.035
94 HG LEU 13 HG LEU 13 49.043 4.503 -3.784
95 HD11 LEU 13 HD11 LEU 13 48.246 2.309 -3.140
96 HD12 LEU 13 HD12 LEU 13 47.151 3.561 -2.549
97 HD13 LEU 13 HD13 LEU 13 48.275 2.776 -1.439
98 HD21 LEU 13 HD21 LEU 13 49.721 6.168 -2.115
99 HD22 LEU 13 HD22 LEU 13 49.096 5.131 -0.834
100 HD23 LEU 13 HD23 LEU 13 47.995 5.817 -2.028
101 H ARG 14 HN ARG 14 51.414 1.019 -1.230
102 HA ARG 14 HA ARG 14 49.011 0.347 0.067
103 HB2 ARG 14 HB2 ARG 14 51.486 -1.263 -0.519
104 HB3 ARG 14 HB1 ARG 14 50.068 -1.955 0.263
105 HG2 ARG 14 HG2 ARG 14 48.701 -1.321 -1.668
106 HG3 ARG 14 HG1 ARG 14 50.133 -0.659 -2.454
107 HD2 ARG 14 HD2 ARG 14 51.141 -2.837 -2.560
108 HD3 ARG 14 HD1 ARG 14 49.836 -3.534 -1.597
109 HE ARG 14 HE ARG 14 48.851 -2.269 -3.942
110 HH11 ARG 14 HH11 ARG 14 50.417 -5.196 -2.843
111 HH12 ARG 14 HH12 ARG 14 49.753 -6.180 -4.097
112 HH21 ARG 14 HH21 ARG 14 47.959 -3.570 -5.605
113 HH22 ARG 14 HH22 ARG 14 48.342 -5.253 -5.676
114 H LYS 15 HN LYS 15 52.322 0.646 1.275
115 HA LYS 15 HA LYS 15 51.702 -0.172 3.938
116 HB2 LYS 15 HB2 LYS 15 53.937 1.574 2.874
117 HB3 LYS 15 HB1 LYS 15 53.844 0.986 4.525
118 HG2 LYS 15 HG2 LYS 15 54.017 -0.774 2.089
119 HG3 LYS 15 HG1 LYS 15 55.387 -0.298 3.091
120 HD2 LYS 15 HD2 LYS 15 54.196 -1.327 5.043
121 HD3 LYS 15 HD1 LYS 15 53.006 -1.957 3.902
122 HE2 LYS 15 HE2 LYS 15 54.701 -3.636 4.425
123 HE3 LYS 15 HE1 LYS 15 54.765 -3.174 2.726
124 HZ1 LYS 15 HZ1 LYS 15 56.972 -3.334 3.778
125 HZ2 LYS 15 HZ2 LYS 15 56.554 -2.081 4.830
126 HZ3 LYS 15 HZ3 LYS 15 56.656 -1.789 3.173
127 H LYS 16 HN LYS 16 51.450 2.813 2.188
128 HA LYS 16 HA LYS 16 51.131 4.510 4.438
129 HB2 LYS 16 HB2 LYS 16 51.799 5.399 2.265
130 HB3 LYS 16 HB1 LYS 16 50.284 4.866 1.557
131 HG2 LYS 16 HG2 LYS 16 50.247 7.255 1.959
132 HG3 LYS 16 HG1 LYS 16 49.060 6.439 2.975
133 HD2 LYS 16 HD2 LYS 16 50.232 8.150 4.249
134 HD3 LYS 16 HD1 LYS 16 50.633 6.548 4.868
135 HE2 LYS 16 HE2 LYS 16 52.735 6.586 3.639
136 HE3 LYS 16 HE1 LYS 16 52.326 8.164 2.968
137 HZ1 LYS 16 HZ1 LYS 16 52.365 9.087 5.183
138 HZ2 LYS 16 HZ2 LYS 16 53.836 8.323 4.845
139 HZ3 LYS 16 HZ3 LYS 16 52.702 7.566 5.844
140 H ILE 17 HN ILE 17 48.780 3.176 2.107
141 HA ILE 17 HA ILE 17 46.534 4.247 3.388
142 HB ILE 17 HB ILE 17 46.445 3.491 1.064
143 HG12 ILE 17 HG12 ILE 17 44.476 1.983 2.801
144 HG13 ILE 17 HG11 ILE 17 44.358 3.689 2.385
145 HG21 ILE 17 HG21 ILE 17 46.269 1.119 0.496
146 HG22 ILE 17 HG22 ILE 17 46.577 0.695 2.180
147 HG23 ILE 17 HG23 ILE 17 47.826 1.501 1.233
148 HD11 ILE 17 HD11 ILE 17 42.877 2.341 1.017
149 HD12 ILE 17 HD12 ILE 17 44.248 1.386 0.450
150 HD13 ILE 17 HD13 ILE 17 44.128 3.094 0.027
151 H VAL 18 HN VAL 18 48.123 1.094 3.869
152 HA VAL 18 HA VAL 18 46.118 0.055 5.577
153 HB VAL 18 HB VAL 18 47.808 -1.578 6.357
154 HG11 VAL 18 HG11 VAL 18 48.257 -2.634 4.200
155 HG12 VAL 18 HG12 VAL 18 47.821 -1.135 3.381
156 HG13 VAL 18 HG13 VAL 18 46.607 -2.021 4.303
157 HG21 VAL 18 HG21 VAL 18 49.765 -0.151 6.439
158 HG22 VAL 18 HG22 VAL 18 49.740 0.013 4.684
159 HG23 VAL 18 HG23 VAL 18 50.073 -1.556 5.417
160 H ASP 19 HN ASP 19 48.901 2.078 6.151
161 HA ASP 19 HA ASP 19 48.740 1.951 9.002
162 HB2 ASP 19 HB2 ASP 19 50.812 2.540 7.717
163 HB3 ASP 19 HB1 ASP 19 50.057 4.074 7.297
164 H LEU 20 HN LEU 20 47.556 4.083 6.478
165 HA LEU 20 HA LEU 20 46.472 6.069 8.185
166 HB2 LEU 20 HB2 LEU 20 45.667 5.337 5.370
167 HB3 LEU 20 HB1 LEU 20 45.203 6.802 6.210
168 HG LEU 20 HG LEU 20 47.970 6.028 5.303
169 HD11 LEU 20 HD11 LEU 20 46.615 6.822 3.513
170 HD12 LEU 20 HD12 LEU 20 47.762 8.086 3.954
171 HD13 LEU 20 HD13 LEU 20 46.078 8.205 4.464
172 HD21 LEU 20 HD21 LEU 20 48.159 7.133 7.439
173 HD22 LEU 20 HD22 LEU 20 47.088 8.424 6.903
174 HD23 LEU 20 HD23 LEU 20 48.674 8.227 6.158
175 H HIS 21 HN HIS 21 45.297 3.007 6.993
176 HA HIS 21 HA HIS 21 42.573 3.278 7.618
177 HB2 HIS 21 HB2 HIS 21 44.424 0.928 7.422
178 HB3 HIS 21 HB1 HIS 21 42.818 0.701 8.097
179 HD1 HIS 21 HD1 HIS 21 40.978 2.140 6.313
180 HD2 HIS 21 HD2 HIS 21 44.303 0.141 4.820
181 HE1 HIS 21 HE1 HIS 21 40.458 1.678 3.906
182 H LYS 22 HN LYS 22 45.356 2.477 9.553
183 HA LYS 22 HA LYS 22 43.835 1.865 11.895
184 HB2 LYS 22 HB2 LYS 22 46.782 2.427 11.562
185 HB3 LYS 22 HB1 LYS 22 46.019 1.752 12.998
186 HG2 LYS 22 HG2 LYS 22 45.383 -0.232 11.800
187 HG3 LYS 22 HG1 LYS 22 45.960 0.453 10.281
188 HD2 LYS 22 HD2 LYS 22 47.569 -1.128 11.156
189 HD3 LYS 22 HD1 LYS 22 48.235 0.505 11.188
190 HE2 LYS 22 HE2 LYS 22 47.624 0.673 13.577
191 HE3 LYS 22 HE1 LYS 22 47.041 -0.989 13.523
192 HZ1 LYS 22 HZ1 LYS 22 49.826 -0.116 13.018
193 HZ2 LYS 22 HZ2 LYS 22 49.281 -1.713 12.994
194 HZ3 LYS 22 HZ3 LYS 22 49.265 -0.831 14.437
195 H SER 23 HN SER 23 45.245 4.711 10.500
196 HA SER 23 HA SER 23 45.101 6.314 12.856
197 HB2 SER 23 HB2 SER 23 45.085 7.211 9.961
198 HB3 SER 23 HB1 SER 23 45.514 8.188 11.365
199 HG SER 23 HG SER 23 47.149 6.378 11.674
200 H GLY 24 HN GLY 24 43.083 6.012 9.932
201 HA2 GLY 24 HA2 GLY 24 40.691 5.783 10.188
202 HA3 GLY 24 HA1 GLY 24 40.789 6.847 11.576
203 H SER 25 HN SER 25 41.289 9.099 11.185
204 HA SER 25 HA SER 25 39.571 10.201 9.284
205 HB2 SER 25 HB2 SER 25 40.188 11.315 11.393
206 HB3 SER 25 HB1 SER 25 41.815 11.579 10.772
207 HG SER 25 HG SER 25 39.377 12.729 9.931
208 H SER 26 HN SER 26 43.025 9.575 9.073
209 HA SER 26 HA SER 26 43.589 11.235 6.885
210 HB2 SER 26 HB2 SER 26 45.522 9.589 6.559
211 HB3 SER 26 HB1 SER 26 45.434 10.452 8.094
212 HG SER 26 HG SER 26 45.807 8.250 8.438
213 H LEU 27 HN LEU 27 41.997 8.166 7.050
214 HA LEU 27 HA LEU 27 42.393 7.347 4.366
215 HB2 LEU 27 HB2 LEU 27 41.584 5.893 6.263
216 HB3 LEU 27 HB1 LEU 27 40.047 6.719 6.176
217 HG LEU 27 HG LEU 27 40.163 4.421 5.110
218 HD11 LEU 27 HD11 LEU 27 38.795 5.027 3.180
219 HD12 LEU 27 HD12 LEU 27 39.292 6.709 3.358
220 HD13 LEU 27 HD13 LEU 27 38.335 5.934 4.621
221 HD21 LEU 27 HD21 LEU 27 41.698 5.902 2.982
222 HD22 LEU 27 HD22 LEU 27 41.111 4.242 2.882
223 HD23 LEU 27 HD23 LEU 27 42.357 4.668 4.056
224 H GLY 28 HN GLY 28 39.950 9.306 5.995
225 HA2 GLY 28 HA2 GLY 28 38.284 9.705 3.735
226 HA3 GLY 28 HA1 GLY 28 38.328 10.714 5.177
227 H ALA 29 HN ALA 29 41.196 11.223 4.872
228 HA ALA 29 HA ALA 29 41.060 13.560 3.293
229 HB1 ALA 29 HB1 ALA 29 43.481 12.142 4.399
230 HB2 ALA 29 HB2 ALA 29 42.539 13.380 5.228
231 HB3 ALA 29 HB3 ALA 29 43.447 13.790 3.772
232 H ILE 30 HN ILE 30 42.795 10.473 2.815
233 HA ILE 30 HA ILE 30 43.700 11.207 0.226
234 HB ILE 30 HB ILE 30 44.272 8.804 -0.088
235 HG12 ILE 30 HG12 ILE 30 43.241 8.487 2.737
236 HG13 ILE 30 HG11 ILE 30 42.434 7.871 1.299
237 HG21 ILE 30 HG21 ILE 30 46.010 8.754 1.648
238 HG22 ILE 30 HG22 ILE 30 45.197 10.087 2.469
239 HG23 ILE 30 HG23 ILE 30 45.877 10.325 0.859
240 HD11 ILE 30 HD11 ILE 30 44.288 6.392 0.853
241 HD12 ILE 30 HD12 ILE 30 43.715 6.147 2.503
242 HD13 ILE 30 HD13 ILE 30 45.187 7.070 2.206
243 H SER 31 HN SER 31 40.793 9.693 1.390
244 HA SER 31 HA SER 31 39.897 8.606 -1.042
245 HB2 SER 31 HB2 SER 31 38.865 8.094 1.159
246 HB3 SER 31 HB1 SER 31 38.228 9.738 1.222
247 HG SER 31 HG SER 31 36.582 8.757 0.311
248 H LYS 32 HN LYS 32 39.445 11.791 0.417
249 HA LYS 32 HA LYS 32 37.911 12.831 -1.761
250 HB2 LYS 32 HB2 LYS 32 37.696 13.750 0.482
251 HB3 LYS 32 HB1 LYS 32 39.397 14.186 0.491
252 HG2 LYS 32 HG2 LYS 32 38.917 15.733 -1.427
253 HG3 LYS 32 HG1 LYS 32 37.202 15.394 -1.181
254 HD2 LYS 32 HD2 LYS 32 37.762 17.439 -0.037
255 HD3 LYS 32 HD1 LYS 32 37.436 16.186 1.162
256 HE2 LYS 32 HE2 LYS 32 39.883 15.810 1.371
257 HE3 LYS 32 HE1 LYS 32 40.151 17.141 0.248
258 HZ1 LYS 32 HZ1 LYS 32 40.386 17.839 2.543
259 HZ2 LYS 32 HZ2 LYS 32 38.813 17.340 2.885
260 HZ3 LYS 32 HZ3 LYS 32 39.076 18.623 1.818
261 H ARG 33 HN ARG 33 41.274 12.666 -0.908
262 HA ARG 33 HA ARG 33 42.155 14.671 -2.746
263 HB2 ARG 33 HB2 ARG 33 43.359 14.237 -0.676
264 HB3 ARG 33 HB1 ARG 33 43.705 12.600 -1.206
265 HG2 ARG 33 HG2 ARG 33 45.049 13.478 -3.047
266 HG3 ARG 33 HG1 ARG 33 44.704 15.122 -2.506
267 HD2 ARG 33 HD2 ARG 33 45.806 14.681 -0.388
268 HD3 ARG 33 HD1 ARG 33 46.095 13.009 -0.866
269 HE ARG 33 HE ARG 33 47.234 14.589 -2.824
270 HH11 ARG 33 HH11 ARG 33 47.662 14.092 0.627
271 HH12 ARG 33 HH12 ARG 33 49.352 14.451 0.600
272 HH21 ARG 33 HH21 ARG 33 49.471 15.055 -2.867
273 HH22 ARG 33 HH22 ARG 33 50.390 15.010 -1.403
274 H LEU 34 HN LEU 34 42.789 11.121 -2.667
275 HA LEU 34 HA LEU 34 43.441 11.380 -5.521
276 HB2 LEU 34 HB2 LEU 34 44.856 9.341 -5.188
277 HB3 LEU 34 HB1 LEU 34 45.410 10.785 -4.371
278 HG LEU 34 HG LEU 34 44.226 9.795 -2.283
279 HD11 LEU 34 HD11 LEU 34 43.019 8.013 -3.412
280 HD12 LEU 34 HD12 LEU 34 44.137 7.360 -2.214
281 HD13 LEU 34 HD13 LEU 34 44.545 7.291 -3.928
282 HD21 LEU 34 HD21 LEU 34 46.634 10.050 -2.490
283 HD22 LEU 34 HD22 LEU 34 46.731 8.539 -3.395
284 HD23 LEU 34 HD23 LEU 34 46.235 8.524 -1.703
285 H LYS 35 HN LYS 35 41.087 10.279 -3.546
286 HA LYS 35 HA LYS 35 39.268 8.966 -3.824
287 HB2 LYS 35 HB2 LYS 35 39.141 9.913 -6.080
288 HB3 LYS 35 HB1 LYS 35 40.245 8.681 -6.671
289 HG2 LYS 35 HG2 LYS 35 38.528 6.977 -5.911
290 HG3 LYS 35 HG1 LYS 35 37.422 8.335 -5.707
291 HD2 LYS 35 HD2 LYS 35 38.804 7.505 -8.258
292 HD3 LYS 35 HD1 LYS 35 37.093 7.312 -7.878
293 HE2 LYS 35 HE2 LYS 35 36.857 9.745 -7.743
294 HE3 LYS 35 HE1 LYS 35 38.566 9.930 -8.137
295 HZ1 LYS 35 HZ1 LYS 35 38.127 8.829 -10.262
296 HZ2 LYS 35 HZ2 LYS 35 37.208 10.238 -10.085
297 HZ3 LYS 35 HZ3 LYS 35 36.487 8.732 -9.870
298 H VAL 36 HN VAL 36 39.801 7.350 -2.461
299 HA VAL 36 HA VAL 36 41.539 5.215 -3.176
300 HB VAL 36 HB VAL 36 40.612 4.040 -1.155
301 HG11 VAL 36 HG11 VAL 36 42.565 5.471 -0.991
302 HG12 VAL 36 HG12 VAL 36 41.573 5.610 0.460
303 HG13 VAL 36 HG13 VAL 36 41.533 6.881 -0.760
304 HG21 VAL 36 HG21 VAL 36 38.350 4.964 -1.175
305 HG22 VAL 36 HG22 VAL 36 38.991 6.575 -0.855
306 HG23 VAL 36 HG23 VAL 36 39.148 5.306 0.361
307 HA PRO 37 HA PRO 37 38.452 3.172 -5.728
308 HB2 PRO 37 HB2 PRO 37 40.554 1.209 -6.265
309 HB3 PRO 37 HB1 PRO 37 39.770 2.326 -7.384
310 HG2 PRO 37 HG2 PRO 37 42.356 2.599 -6.613
311 HG3 PRO 37 HG1 PRO 37 41.325 3.979 -7.034
312 HD2 PRO 37 HD2 PRO 37 42.106 2.945 -4.335
313 HD3 PRO 37 HD1 PRO 37 41.960 4.621 -4.912
314 H ARG 38 HN ARG 38 36.987 1.803 -4.936
315 HA ARG 38 HA ARG 38 37.346 0.361 -2.566
316 HB2 ARG 38 HB2 ARG 38 35.230 0.207 -4.688
317 HB3 ARG 38 HB1 ARG 38 35.208 -0.871 -3.301
318 HG2 ARG 38 HG2 ARG 38 33.794 0.892 -2.716
319 HG3 ARG 38 HG1 ARG 38 35.303 1.233 -1.869
320 HD2 ARG 38 HD2 ARG 38 34.549 3.279 -2.809
321 HD3 ARG 38 HD1 ARG 38 35.913 2.737 -3.781
322 HE ARG 38 HE ARG 38 34.378 2.087 -5.500
323 HH11 ARG 38 HH11 ARG 38 32.945 3.922 -2.875
324 HH12 ARG 38 HH12 ARG 38 31.577 4.423 -3.803
325 HH21 ARG 38 HH21 ARG 38 32.567 2.734 -6.721
326 HH22 ARG 38 HH22 ARG 38 31.353 3.738 -6.005
327 H SER 39 HN SER 39 37.473 -0.728 -5.908
328 HA SER 39 HA SER 39 37.762 -3.460 -5.373
329 HB2 SER 39 HB2 SER 39 37.183 -2.699 -7.590
330 HB3 SER 39 HB1 SER 39 38.689 -1.792 -7.718
331 HG SER 39 HG SER 39 38.238 -4.315 -8.398
332 H SER 40 HN SER 40 40.093 -0.833 -5.446
333 HA SER 40 HA SER 40 42.352 -2.609 -5.364
334 HB2 SER 40 HB2 SER 40 42.243 0.383 -4.947
335 HB3 SER 40 HB1 SER 40 43.694 -0.579 -5.235
336 HG SER 40 HG SER 40 43.172 0.129 -7.211
337 H VAL 41 HN VAL 41 40.713 -0.453 -3.043
338 HA VAL 41 HA VAL 41 42.557 -0.933 -0.965
339 HB VAL 41 HB VAL 41 41.106 1.024 -0.880
340 HG11 VAL 41 HG11 VAL 41 39.105 0.069 -1.871
341 HG12 VAL 41 HG12 VAL 41 38.740 0.871 -0.343
342 HG13 VAL 41 HG13 VAL 41 38.829 -0.890 -0.418
343 HG21 VAL 41 HG21 VAL 41 42.005 0.196 1.220
344 HG22 VAL 41 HG22 VAL 41 40.601 -0.851 1.425
345 HG23 VAL 41 HG23 VAL 41 40.408 0.903 1.464
346 H GLN 42 HN GLN 42 39.516 -2.550 -1.810
347 HA GLN 42 HA GLN 42 39.514 -4.151 0.539
348 HB2 GLN 42 HB2 GLN 42 38.009 -4.461 -2.052
349 HB3 GLN 42 HB1 GLN 42 37.754 -5.468 -0.632
350 HG2 GLN 42 HG2 GLN 42 37.181 -3.446 0.658
351 HG3 GLN 42 HG1 GLN 42 37.348 -2.493 -0.812
352 HE21 GLN 42 HE21 GLN 42 35.994 -5.707 -0.747
353 HE22 GLN 42 HE22 GLN 42 34.371 -5.233 -1.105
354 H THR 43 HN THR 43 41.046 -4.514 -2.565
355 HA THR 43 HA THR 43 41.513 -7.319 -2.169
356 HB THR 43 HB THR 43 43.207 -6.957 -4.088
357 HG1 THR 43 HG1 THR 43 41.752 -4.689 -4.765
358 HG21 THR 43 HG21 THR 43 41.410 -6.939 -5.763
359 HG22 THR 43 HG22 THR 43 40.272 -6.403 -4.527
360 HG23 THR 43 HG23 THR 43 41.023 -7.996 -4.406
361 H ILE 44 HN ILE 44 43.328 -4.322 -1.680
362 HA ILE 44 HA ILE 44 45.716 -5.723 -1.001
363 HB ILE 44 HB ILE 44 46.651 -3.562 -0.286
364 HG12 ILE 44 HG12 ILE 44 45.053 -1.546 -1.041
365 HG13 ILE 44 HG11 ILE 44 43.814 -2.680 -0.521
366 HG21 ILE 44 HG21 ILE 44 46.802 -4.205 -2.597
367 HG22 ILE 44 HG22 ILE 44 46.576 -2.460 -2.474
368 HG23 ILE 44 HG23 ILE 44 45.223 -3.496 -2.930
369 HD11 ILE 44 HD11 ILE 44 46.095 -1.661 1.162
370 HD12 ILE 44 HD12 ILE 44 44.849 -2.794 1.687
371 HD13 ILE 44 HD13 ILE 44 44.412 -1.140 1.258
372 H VAL 45 HN VAL 45 43.022 -4.442 0.897
373 HA VAL 45 HA VAL 45 44.307 -4.739 3.398
374 HB VAL 45 HB VAL 45 42.054 -4.732 4.435
375 HG11 VAL 45 HG11 VAL 45 42.465 -2.623 2.330
376 HG12 VAL 45 HG12 VAL 45 43.155 -2.633 3.953
377 HG13 VAL 45 HG13 VAL 45 41.411 -2.482 3.737
378 HG21 VAL 45 HG21 VAL 45 40.779 -5.957 2.815
379 HG22 VAL 45 HG22 VAL 45 41.087 -4.731 1.588
380 HG23 VAL 45 HG23 VAL 45 40.079 -4.346 2.983
381 H ARG 46 HN ARG 46 42.556 -6.963 1.375
382 HA ARG 46 HA ARG 46 42.538 -9.050 3.354
383 HB2 ARG 46 HB2 ARG 46 41.933 -9.041 0.396
384 HB3 ARG 46 HB1 ARG 46 41.801 -10.470 1.411
385 HG2 ARG 46 HG2 ARG 46 40.044 -9.499 2.687
386 HG3 ARG 46 HG1 ARG 46 40.291 -7.924 1.931
387 HD2 ARG 46 HD2 ARG 46 38.343 -9.089 1.010
388 HD3 ARG 46 HD1 ARG 46 39.585 -8.811 -0.211
389 HE ARG 46 HE ARG 46 39.600 -11.400 1.115
390 HH11 ARG 46 HH11 ARG 46 38.690 -9.520 -1.709
391 HH12 ARG 46 HH12 ARG 46 38.453 -10.901 -2.720
392 HH21 ARG 46 HH21 ARG 46 39.281 -13.244 -0.239
393 HH22 ARG 46 HH22 ARG 46 38.782 -13.022 -1.879
394 H LYS 47 HN LYS 47 44.539 -8.048 0.673
395 HA LYS 47 HA LYS 47 46.008 -10.455 0.459
396 HB2 LYS 47 HB2 LYS 47 45.735 -8.447 -1.212
397 HB3 LYS 47 HB1 LYS 47 47.158 -7.829 -0.389
398 HG2 LYS 47 HG2 LYS 47 47.067 -10.585 -1.579
399 HG3 LYS 47 HG1 LYS 47 47.532 -9.168 -2.514
400 HD2 LYS 47 HD2 LYS 47 49.404 -8.757 -1.067
401 HD3 LYS 47 HD1 LYS 47 48.868 -10.011 0.054
402 HE2 LYS 47 HE2 LYS 47 50.732 -10.747 -1.388
403 HE3 LYS 47 HE1 LYS 47 49.280 -11.722 -1.600
404 HZ1 LYS 47 HZ1 LYS 47 50.382 -11.123 -3.703
405 HZ2 LYS 47 HZ2 LYS 47 50.064 -9.490 -3.401
406 HZ3 LYS 47 HZ3 LYS 47 48.788 -10.574 -3.620
407 H TYR 48 HN TYR 48 46.741 -7.336 2.105
408 HA TYR 48 HA TYR 48 49.270 -8.287 2.973
409 HB2 TYR 48 HB2 TYR 48 49.590 -6.263 4.065
410 HB3 TYR 48 HB1 TYR 48 48.424 -5.810 2.838
411 HD1 TYR 48 HD1 TYR 48 48.956 -6.387 6.425
412 HD2 TYR 48 HD2 TYR 48 46.191 -5.121 3.463
413 HE1 TYR 48 HE1 TYR 48 47.529 -5.435 8.181
414 HE2 TYR 48 HE2 TYR 48 44.748 -4.168 5.218
415 HH TYR 48 HH TYR 48 44.329 -4.443 7.596
416 H LYS 49 HN LYS 49 46.056 -8.573 4.257
417 HA LYS 49 HA LYS 49 46.829 -9.500 6.838
418 HB2 LYS 49 HB2 LYS 49 44.290 -9.753 5.240
419 HB3 LYS 49 HB1 LYS 49 44.474 -10.532 6.801
420 HG2 LYS 49 HG2 LYS 49 44.716 -7.574 6.296
421 HG3 LYS 49 HG1 LYS 49 43.295 -8.390 6.945
422 HD2 LYS 49 HD2 LYS 49 44.748 -9.223 8.815
423 HD3 LYS 49 HD1 LYS 49 46.025 -8.173 8.203
424 HE2 LYS 49 HE2 LYS 49 44.814 -7.100 10.024
425 HE3 LYS 49 HE1 LYS 49 44.581 -6.228 8.510
426 HZ1 LYS 49 HZ1 LYS 49 42.421 -7.258 8.269
427 HZ2 LYS 49 HZ2 LYS 49 42.513 -6.482 9.767
428 HZ3 LYS 49 HZ3 LYS 49 42.654 -8.163 9.677
429 H HIS 50 HN HIS 50 46.077 -11.060 3.769
430 HA HIS 50 HA HIS 50 46.376 -13.727 4.688
431 HB2 HIS 50 HB2 HIS 50 45.186 -13.100 2.591
432 HB3 HIS 50 HB1 HIS 50 46.727 -12.639 1.881
433 HD1 HIS 50 HD1 HIS 50 44.782 -15.665 2.987
434 HD2 HIS 50 HD2 HIS 50 48.225 -14.737 0.859
435 HE1 HIS 50 HE1 HIS 50 45.518 -17.819 1.939
436 H HIS 51 HN HIS 51 48.579 -11.275 3.619
437 HA HIS 51 HA HIS 51 50.846 -13.056 3.401
438 HB2 HIS 51 HB2 HIS 51 50.563 -10.891 2.079
439 HB3 HIS 51 HB1 HIS 51 50.906 -10.038 3.579
440 HD1 HIS 51 HD1 HIS 51 53.335 -9.618 4.087
441 HD2 HIS 51 HD2 HIS 51 52.809 -12.581 1.216
442 HE1 HIS 51 HE1 HIS 51 55.630 -10.148 3.245
443 H GLY 52 HN GLY 52 49.140 -11.674 5.918
444 HA2 GLY 52 HA2 GLY 52 51.091 -10.908 7.756
445 HA3 GLY 52 HA1 GLY 52 49.513 -11.557 8.173
446 H THR 53 HN THR 53 50.009 -14.107 6.835
447 HA THR 53 HA THR 53 51.183 -15.476 9.009
448 HB THR 53 HB THR 53 49.400 -16.484 7.647
449 HG1 THR 53 HG1 THR 53 51.401 -17.705 8.640
450 HG21 THR 53 HG21 THR 53 51.499 -16.641 5.479
451 HG22 THR 53 HG22 THR 53 50.038 -15.655 5.446
452 HG23 THR 53 HG23 THR 53 49.915 -17.414 5.421
453 H THR 54 HN THR 54 52.461 -14.248 6.012
454 HA THR 54 HA THR 54 55.040 -15.525 6.609
455 HB THR 54 HB THR 54 55.500 -14.994 4.129
456 HG1 THR 54 HG1 THR 54 53.450 -15.043 2.919
457 HG21 THR 54 HG21 THR 54 53.448 -17.090 4.869
458 HG22 THR 54 HG22 THR 54 55.198 -17.270 4.984
459 HG23 THR 54 HG23 THR 54 54.432 -17.092 3.406
460 H GLN 55 HN GLN 55 53.586 -12.866 7.278
461 HA GLN 55 HA GLN 55 55.250 -10.827 6.182
462 HB2 GLN 55 HB2 GLN 55 52.933 -10.421 6.955
463 HB3 GLN 55 HB1 GLN 55 53.449 -10.721 8.608
464 HG2 GLN 55 HG2 GLN 55 53.316 -8.366 8.275
465 HG3 GLN 55 HG1 GLN 55 55.018 -8.810 8.405
466 HE21 GLN 55 HE21 GLN 55 55.740 -7.023 7.302
467 HE22 GLN 55 HE22 GLN 55 55.507 -6.824 5.599
468 H HIS 56 HN HIS 56 57.213 -10.309 6.782
469 HA HIS 56 HA HIS 56 58.162 -11.096 9.449
470 HB2 HIS 56 HB2 HIS 56 59.637 -10.643 6.847
471 HB3 HIS 56 HB1 HIS 56 60.464 -10.718 8.396
472 HD1 HIS 56 HD1 HIS 56 61.481 -12.936 8.739
473 HD2 HIS 56 HD2 HIS 56 57.915 -13.206 6.621
474 HE1 HIS 56 HE1 HIS 56 61.173 -15.377 8.258
475 H HIS 57 HN HIS 57 59.667 -9.562 10.465
476 HA HIS 57 HA HIS 57 58.694 -6.850 10.120
477 HB2 HIS 57 HB2 HIS 57 58.876 -7.844 12.398
478 HB3 HIS 57 HB1 HIS 57 60.619 -7.961 12.179
479 HD1 HIS 57 HD1 HIS 57 61.992 -5.882 12.637
480 HD2 HIS 57 HD2 HIS 57 57.897 -5.160 12.638
481 HE1 HIS 57 HE1 HIS 57 61.726 -3.535 13.486
Start of MODEL 13
1 H1 ALA 1 HT1 ALA 1 65.945 16.812 -15.280
2 H2 ALA 1 HT2 ALA 1 66.340 16.224 -13.749
3 H3 ALA 1 HT3 ALA 1 65.714 17.785 -13.920
4 HA ALA 1 HA ALA 1 64.043 16.287 -13.091
5 HB1 ALA 1 HB1 ALA 1 63.350 18.157 -14.489
6 HB2 ALA 1 HB2 ALA 1 62.317 16.753 -14.765
7 HB3 ALA 1 HB3 ALA 1 63.570 17.171 -15.933
8 H SER 2 HN SER 2 63.329 14.253 -12.978
9 HA SER 2 HA SER 2 64.371 12.330 -14.901
10 HB2 SER 2 HB2 SER 2 62.906 11.850 -12.297
11 HB3 SER 2 HB1 SER 2 63.781 10.650 -13.247
12 HG SER 2 HG SER 2 65.431 12.681 -12.761
13 H MET 3 HN MET 3 63.124 11.366 -16.403
14 HA MET 3 HA MET 3 60.400 12.176 -16.749
15 HB2 MET 3 HB2 MET 3 60.414 10.770 -18.733
16 HB3 MET 3 HB1 MET 3 61.874 11.745 -18.670
17 HG2 MET 3 HG2 MET 3 63.165 9.852 -17.928
18 HG3 MET 3 HG1 MET 3 61.712 8.862 -17.819
19 HE1 MET 3 HE1 MET 3 60.098 9.632 -20.455
20 HE2 MET 3 HE2 MET 3 60.345 7.999 -19.838
21 HE3 MET 3 HE3 MET 3 60.699 8.365 -21.525
22 H GLY 4 HN GLY 4 61.870 9.714 -14.979
23 HA2 GLY 4 HA2 GLY 4 60.253 8.613 -13.431
24 HA3 GLY 4 HA1 GLY 4 59.330 8.222 -14.879
25 H LYS 5 HN LYS 5 59.556 6.005 -14.104
26 HA LYS 5 HA LYS 5 62.145 4.885 -14.937
27 HB2 LYS 5 HB2 LYS 5 60.363 3.860 -12.726
28 HB3 LYS 5 HB1 LYS 5 61.871 3.131 -13.253
29 HG2 LYS 5 HG2 LYS 5 63.101 5.090 -12.514
30 HG3 LYS 5 HG1 LYS 5 61.594 5.867 -12.029
31 HD2 LYS 5 HD2 LYS 5 62.704 3.301 -10.891
32 HD3 LYS 5 HD1 LYS 5 62.764 4.881 -10.113
33 HE2 LYS 5 HE2 LYS 5 60.283 3.299 -10.801
34 HE3 LYS 5 HE1 LYS 5 60.950 3.562 -9.194
35 HZ1 LYS 5 HZ1 LYS 5 59.109 5.049 -9.595
36 HZ2 LYS 5 HZ2 LYS 5 59.838 5.658 -10.985
37 HZ3 LYS 5 HZ3 LYS 5 60.535 5.946 -9.474
38 H SER 6 HN SER 6 61.986 2.620 -15.635
39 HA SER 6 HA SER 6 59.926 2.263 -17.533
40 HB2 SER 6 HB2 SER 6 62.296 1.332 -17.641
41 HB3 SER 6 HB1 SER 6 61.776 0.114 -16.479
42 HG SER 6 HG SER 6 60.388 0.566 -18.896
43 H LYS 7 HN LYS 7 60.576 0.886 -14.348
44 HA LYS 7 HA LYS 7 57.775 0.030 -14.261
45 HB2 LYS 7 HB2 LYS 7 59.354 -1.910 -14.439
46 HB3 LYS 7 HB1 LYS 7 60.087 -1.394 -12.929
47 HG2 LYS 7 HG2 LYS 7 58.032 -1.787 -11.737
48 HG3 LYS 7 HG1 LYS 7 57.195 -2.167 -13.242
49 HD2 LYS 7 HD2 LYS 7 59.525 -3.722 -12.114
50 HD3 LYS 7 HD1 LYS 7 57.829 -4.177 -11.949
51 HE2 LYS 7 HE2 LYS 7 57.671 -4.247 -14.433
52 HE3 LYS 7 HE1 LYS 7 59.405 -3.944 -14.510
53 HZ1 LYS 7 HZ1 LYS 7 58.893 -6.305 -14.704
54 HZ2 LYS 7 HZ2 LYS 7 58.134 -6.287 -13.199
55 HZ3 LYS 7 HZ3 LYS 7 59.791 -5.996 -13.306
56 H GLU 8 HN GLU 8 56.706 0.490 -12.373
57 HA GLU 8 HA GLU 8 57.823 2.654 -10.877
58 HB2 GLU 8 HB2 GLU 8 55.601 2.623 -9.693
59 HB3 GLU 8 HB1 GLU 8 55.533 2.868 -11.427
60 HG2 GLU 8 HG2 GLU 8 53.749 1.396 -10.722
61 HG3 GLU 8 HG1 GLU 8 54.889 0.514 -11.731
62 H ILE 9 HN ILE 9 57.230 2.653 -8.445
63 HA ILE 9 HA ILE 9 57.687 0.115 -7.159
64 HB ILE 9 HB ILE 9 59.966 0.894 -7.389
65 HG12 ILE 9 HG12 ILE 9 59.005 1.396 -4.561
66 HG13 ILE 9 HG11 ILE 9 59.378 -0.179 -5.254
67 HG21 ILE 9 HG21 ILE 9 59.118 3.470 -6.085
68 HG22 ILE 9 HG22 ILE 9 59.530 3.253 -7.784
69 HG23 ILE 9 HG23 ILE 9 60.763 3.028 -6.543
70 HD11 ILE 9 HD11 ILE 9 61.712 0.496 -5.517
71 HD12 ILE 9 HD12 ILE 9 61.183 0.612 -3.839
72 HD13 ILE 9 HD13 ILE 9 61.333 2.069 -4.819
73 H SER 10 HN SER 10 55.462 0.507 -6.735
74 HA SER 10 HA SER 10 54.651 2.760 -5.157
75 HB2 SER 10 HB2 SER 10 53.148 0.225 -5.834
76 HB3 SER 10 HB1 SER 10 52.445 1.699 -5.170
77 HG SER 10 HG SER 10 53.626 1.286 -7.720
78 H GLN 11 HN GLN 11 56.676 0.780 -4.073
79 HA GLN 11 HA GLN 11 55.571 -0.696 -1.969
80 HB2 GLN 11 HB2 GLN 11 58.296 0.561 -2.266
81 HB3 GLN 11 HB1 GLN 11 57.867 -0.522 -0.950
82 HG2 GLN 11 HG2 GLN 11 57.857 -1.199 -3.882
83 HG3 GLN 11 HG1 GLN 11 59.066 -1.697 -2.699
84 HE21 GLN 11 HE21 GLN 11 58.494 -3.208 -1.121
85 HE22 GLN 11 HE22 GLN 11 57.132 -4.253 -1.320
86 H ASP 12 HN ASP 12 56.874 2.601 -2.018
87 HA ASP 12 HA ASP 12 56.450 3.186 0.695
88 HB2 ASP 12 HB2 ASP 12 56.499 5.034 -1.699
89 HB3 ASP 12 HB1 ASP 12 56.526 5.576 -0.025
90 H LEU 13 HN LEU 13 54.376 3.493 -2.116
91 HA LEU 13 HA LEU 13 52.281 4.885 -0.807
92 HB2 LEU 13 HB2 LEU 13 52.756 4.754 -3.312
93 HB3 LEU 13 HB1 LEU 13 52.030 3.165 -3.278
94 HG LEU 13 HG LEU 13 50.550 5.019 -4.116
95 HD11 LEU 13 HD11 LEU 13 49.558 3.520 -1.702
96 HD12 LEU 13 HD12 LEU 13 49.583 2.930 -3.363
97 HD13 LEU 13 HD13 LEU 13 48.549 4.289 -2.926
98 HD21 LEU 13 HD21 LEU 13 49.516 6.515 -2.503
99 HD22 LEU 13 HD22 LEU 13 51.265 6.752 -2.542
100 HD23 LEU 13 HD23 LEU 13 50.524 5.852 -1.218
101 H ARG 14 HN ARG 14 52.860 1.454 -1.531
102 HA ARG 14 HA ARG 14 50.369 0.559 -0.548
103 HB2 ARG 14 HB2 ARG 14 51.575 -0.844 -2.061
104 HB3 ARG 14 HB1 ARG 14 52.966 -0.904 -0.990
105 HG2 ARG 14 HG2 ARG 14 51.956 -2.394 0.457
106 HG3 ARG 14 HG1 ARG 14 50.329 -1.939 -0.047
107 HD2 ARG 14 HD2 ARG 14 51.085 -4.197 -0.827
108 HD3 ARG 14 HD1 ARG 14 50.551 -3.109 -2.104
109 HE ARG 14 HE ARG 14 53.380 -3.007 -1.665
110 HH11 ARG 14 HH11 ARG 14 50.821 -4.817 -3.232
111 HH12 ARG 14 HH12 ARG 14 51.825 -5.409 -4.506
112 HH21 ARG 14 HH21 ARG 14 54.740 -3.788 -3.370
113 HH22 ARG 14 HH22 ARG 14 54.066 -4.829 -4.580
114 H LYS 15 HN LYS 15 53.515 0.967 1.011
115 HA LYS 15 HA LYS 15 52.672 -0.172 3.481
116 HB2 LYS 15 HB2 LYS 15 54.893 1.800 2.912
117 HB3 LYS 15 HB1 LYS 15 54.658 0.974 4.444
118 HG2 LYS 15 HG2 LYS 15 54.955 -1.195 3.244
119 HG3 LYS 15 HG1 LYS 15 55.366 -0.271 1.796
120 HD2 LYS 15 HD2 LYS 15 56.830 -0.170 4.439
121 HD3 LYS 15 HD1 LYS 15 57.376 -1.013 2.989
122 HE2 LYS 15 HE2 LYS 15 57.522 1.106 1.793
123 HE3 LYS 15 HE1 LYS 15 56.909 1.964 3.205
124 HZ1 LYS 15 HZ1 LYS 15 59.319 2.118 3.028
125 HZ2 LYS 15 HZ2 LYS 15 59.455 0.440 3.094
126 HZ3 LYS 15 HZ3 LYS 15 58.871 1.292 4.432
127 H LYS 16 HN LYS 16 52.315 2.906 1.976
128 HA LYS 16 HA LYS 16 51.664 4.359 4.345
129 HB2 LYS 16 HB2 LYS 16 52.614 5.413 2.311
130 HB3 LYS 16 HB1 LYS 16 51.111 5.073 1.466
131 HG2 LYS 16 HG2 LYS 16 49.900 6.513 2.989
132 HG3 LYS 16 HG1 LYS 16 51.377 6.814 3.904
133 HD2 LYS 16 HD2 LYS 16 52.378 7.741 1.802
134 HD3 LYS 16 HD1 LYS 16 50.780 7.611 1.063
135 HE2 LYS 16 HE2 LYS 16 51.133 9.861 1.883
136 HE3 LYS 16 HE1 LYS 16 49.870 9.068 2.821
137 HZ1 LYS 16 HZ1 LYS 16 51.419 10.294 4.223
138 HZ2 LYS 16 HZ2 LYS 16 52.703 9.356 3.662
139 HZ3 LYS 16 HZ3 LYS 16 51.471 8.640 4.570
140 H ILE 17 HN ILE 17 49.766 2.904 1.693
141 HA ILE 17 HA ILE 17 47.268 3.830 2.581
142 HB ILE 17 HB ILE 17 47.565 2.871 0.323
143 HG12 ILE 17 HG12 ILE 17 45.488 1.472 0.254
144 HG13 ILE 17 HG11 ILE 17 45.485 1.473 2.012
145 HG21 ILE 17 HG21 ILE 17 49.052 1.031 0.887
146 HG22 ILE 17 HG22 ILE 17 47.663 0.478 -0.049
147 HG23 ILE 17 HG23 ILE 17 47.723 0.199 1.691
148 HD11 ILE 17 HD11 ILE 17 43.939 3.110 1.094
149 HD12 ILE 17 HD12 ILE 17 45.273 3.908 0.259
150 HD13 ILE 17 HD13 ILE 17 45.222 3.884 2.022
151 H VAL 18 HN VAL 18 49.105 0.955 3.474
152 HA VAL 18 HA VAL 18 47.084 -0.167 5.134
153 HB VAL 18 HB VAL 18 50.087 -0.552 5.306
154 HG11 VAL 18 HG11 VAL 18 48.964 -1.278 7.328
155 HG12 VAL 18 HG12 VAL 18 49.520 -2.678 6.410
156 HG13 VAL 18 HG13 VAL 18 47.817 -2.222 6.379
157 HG21 VAL 18 HG21 VAL 18 48.006 -2.139 3.805
158 HG22 VAL 18 HG22 VAL 18 49.703 -2.586 3.978
159 HG23 VAL 18 HG23 VAL 18 49.260 -1.126 3.093
160 H ASP 19 HN ASP 19 49.737 2.075 5.634
161 HA ASP 19 HA ASP 19 49.658 2.253 8.435
162 HB2 ASP 19 HB2 ASP 19 51.519 3.154 7.156
163 HB3 ASP 19 HB1 ASP 19 50.455 4.315 6.371
164 H LEU 20 HN LEU 20 47.984 4.107 5.929
165 HA LEU 20 HA LEU 20 46.594 5.794 7.730
166 HB2 LEU 20 HB2 LEU 20 46.364 5.169 4.832
167 HB3 LEU 20 HB1 LEU 20 44.997 5.935 5.610
168 HG LEU 20 HG LEU 20 46.423 7.581 4.509
169 HD11 LEU 20 HD11 LEU 20 45.197 8.254 6.493
170 HD12 LEU 20 HD12 LEU 20 46.730 9.116 6.364
171 HD13 LEU 20 HD13 LEU 20 46.560 7.787 7.509
172 HD21 LEU 20 HD21 LEU 20 48.554 6.412 4.661
173 HD22 LEU 20 HD22 LEU 20 48.576 6.662 6.406
174 HD23 LEU 20 HD23 LEU 20 48.678 8.045 5.314
175 H HIS 21 HN HIS 21 45.998 2.573 6.581
176 HA HIS 21 HA HIS 21 43.255 2.503 7.353
177 HB2 HIS 21 HB2 HIS 21 45.261 0.441 6.576
178 HB3 HIS 21 HB1 HIS 21 43.849 -0.096 7.481
179 HD1 HIS 21 HD1 HIS 21 41.480 0.796 6.357
180 HD2 HIS 21 HD2 HIS 21 44.814 0.508 3.895
181 HE1 HIS 21 HE1 HIS 21 40.590 0.831 4.013
182 H LYS 22 HN LYS 22 46.250 2.173 9.023
183 HA LYS 22 HA LYS 22 45.051 1.120 11.423
184 HB2 LYS 22 HB2 LYS 22 47.772 2.341 10.929
185 HB3 LYS 22 HB1 LYS 22 47.275 1.588 12.436
186 HG2 LYS 22 HG2 LYS 22 47.508 0.213 9.764
187 HG3 LYS 22 HG1 LYS 22 48.651 0.088 11.102
188 HD2 LYS 22 HD2 LYS 22 46.834 -0.853 12.505
189 HD3 LYS 22 HD1 LYS 22 45.770 -0.814 11.099
190 HE2 LYS 22 HE2 LYS 22 47.314 -2.313 9.910
191 HE3 LYS 22 HE1 LYS 22 48.342 -2.369 11.339
192 HZ1 LYS 22 HZ1 LYS 22 46.472 -3.327 12.566
193 HZ2 LYS 22 HZ2 LYS 22 46.929 -4.293 11.262
194 HZ3 LYS 22 HZ3 LYS 22 45.541 -3.338 11.154
195 H SER 23 HN SER 23 45.331 4.117 9.915
196 HA SER 23 HA SER 23 45.068 5.713 12.305
197 HB2 SER 23 HB2 SER 23 46.256 6.591 10.303
198 HB3 SER 23 HB1 SER 23 44.761 6.474 9.379
199 HG SER 23 HG SER 23 45.567 8.522 10.712
200 H GLY 24 HN GLY 24 43.058 4.765 9.531
201 HA2 GLY 24 HA2 GLY 24 40.830 4.125 9.555
202 HA3 GLY 24 HA1 GLY 24 40.749 4.558 11.253
203 H SER 25 HN SER 25 40.909 7.012 11.622
204 HA SER 25 HA SER 25 38.627 8.106 10.333
205 HB2 SER 25 HB2 SER 25 40.575 9.449 12.206
206 HB3 SER 25 HB1 SER 25 38.953 10.015 11.806
207 HG SER 25 HG SER 25 38.081 8.249 12.824
208 H SER 26 HN SER 26 41.921 8.192 9.495
209 HA SER 26 HA SER 26 41.616 10.674 7.974
210 HB2 SER 26 HB2 SER 26 43.652 10.298 9.403
211 HB3 SER 26 HB1 SER 26 44.104 8.986 8.318
212 HG SER 26 HG SER 26 43.883 10.708 6.619
213 H LEU 27 HN LEU 27 40.665 7.706 7.453
214 HA LEU 27 HA LEU 27 41.919 6.913 5.036
215 HB2 LEU 27 HB2 LEU 27 40.227 5.726 6.810
216 HB3 LEU 27 HB1 LEU 27 39.127 6.070 5.493
217 HG LEU 27 HG LEU 27 40.004 3.791 5.372
218 HD11 LEU 27 HD11 LEU 27 39.402 4.881 3.294
219 HD12 LEU 27 HD12 LEU 27 40.779 3.804 3.059
220 HD13 LEU 27 HD13 LEU 27 41.029 5.547 3.154
221 HD21 LEU 27 HD21 LEU 27 42.707 5.082 5.034
222 HD22 LEU 27 HD22 LEU 27 42.349 3.361 4.909
223 HD23 LEU 27 HD23 LEU 27 42.159 4.192 6.453
224 H GLY 28 HN GLY 28 39.051 8.832 5.783
225 HA2 GLY 28 HA2 GLY 28 37.968 8.988 3.201
226 HA3 GLY 28 HA1 GLY 28 37.733 10.175 4.476
227 H ALA 29 HN ALA 29 40.408 10.957 4.797
228 HA ALA 29 HA ALA 29 40.655 13.022 2.976
229 HB1 ALA 29 HB1 ALA 29 42.901 13.340 3.847
230 HB2 ALA 29 HB2 ALA 29 42.878 11.722 4.545
231 HB3 ALA 29 HB3 ALA 29 41.783 12.961 5.157
232 H ILE 30 HN ILE 30 42.564 10.004 3.054
233 HA ILE 30 HA ILE 30 43.860 10.587 0.597
234 HB ILE 30 HB ILE 30 44.637 8.233 0.631
235 HG12 ILE 30 HG12 ILE 30 43.045 8.034 3.198
236 HG13 ILE 30 HG11 ILE 30 42.595 7.270 1.678
237 HG21 ILE 30 HG21 ILE 30 46.001 8.441 2.650
238 HG22 ILE 30 HG22 ILE 30 44.927 9.707 3.246
239 HG23 ILE 30 HG23 ILE 30 45.883 9.976 1.790
240 HD11 ILE 30 HD11 ILE 30 44.649 5.950 1.753
241 HD12 ILE 30 HD12 ILE 30 43.632 5.683 3.168
242 HD13 ILE 30 HD13 ILE 30 45.066 6.702 3.291
243 H SER 31 HN SER 31 40.905 8.886 1.396
244 HA SER 31 HA SER 31 40.562 7.528 -1.052
245 HB2 SER 31 HB2 SER 31 38.466 8.513 0.897
246 HB3 SER 31 HB1 SER 31 38.187 7.352 -0.400
247 HG SER 31 HG SER 31 39.870 7.049 1.867
248 H LYS 32 HN LYS 32 39.647 10.760 0.008
249 HA LYS 32 HA LYS 32 38.289 11.340 -2.473
250 HB2 LYS 32 HB2 LYS 32 37.457 12.313 -0.397
251 HB3 LYS 32 HB1 LYS 32 39.002 13.083 -0.101
252 HG2 LYS 32 HG2 LYS 32 37.510 13.757 -2.600
253 HG3 LYS 32 HG1 LYS 32 36.964 14.432 -1.067
254 HD2 LYS 32 HD2 LYS 32 39.778 14.689 -2.144
255 HD3 LYS 32 HD1 LYS 32 38.527 15.919 -2.325
256 HE2 LYS 32 HE2 LYS 32 38.372 16.134 0.101
257 HE3 LYS 32 HE1 LYS 32 39.581 14.872 0.307
258 HZ1 LYS 32 HZ1 LYS 32 41.197 16.276 -0.788
259 HZ2 LYS 32 HZ2 LYS 32 40.538 17.072 0.541
260 HZ3 LYS 32 HZ3 LYS 32 40.042 17.488 -1.020
261 H ARG 33 HN ARG 33 41.340 12.185 -0.923
262 HA ARG 33 HA ARG 33 42.179 14.077 -2.817
263 HB2 ARG 33 HB2 ARG 33 43.159 13.958 -0.617
264 HB3 ARG 33 HB1 ARG 33 43.791 12.355 -0.950
265 HG2 ARG 33 HG2 ARG 33 45.270 13.266 -2.645
266 HG3 ARG 33 HG1 ARG 33 44.606 14.879 -2.370
267 HD2 ARG 33 HD2 ARG 33 45.437 14.910 -0.135
268 HD3 ARG 33 HD1 ARG 33 45.933 13.222 -0.240
269 HE ARG 33 HE ARG 33 47.323 14.376 -2.230
270 HH11 ARG 33 HH11 ARG 33 46.895 15.246 1.131
271 HH12 ARG 33 HH12 ARG 33 48.490 15.896 1.299
272 HH21 ARG 33 HH21 ARG 33 49.440 15.245 -2.013
273 HH22 ARG 33 HH22 ARG 33 49.938 15.899 -0.491
274 H LEU 34 HN LEU 34 43.301 10.695 -2.458
275 HA LEU 34 HA LEU 34 44.569 10.874 -5.062
276 HB2 LEU 34 HB2 LEU 34 44.434 8.636 -3.040
277 HB3 LEU 34 HB1 LEU 34 45.218 8.476 -4.595
278 HG LEU 34 HG LEU 34 46.695 10.445 -3.857
279 HD11 LEU 34 HD11 LEU 34 45.619 9.627 -1.165
280 HD12 LEU 34 HD12 LEU 34 45.355 11.177 -1.964
281 HD13 LEU 34 HD13 LEU 34 46.978 10.714 -1.453
282 HD21 LEU 34 HD21 LEU 34 46.891 7.794 -2.437
283 HD22 LEU 34 HD22 LEU 34 48.205 8.950 -2.646
284 HD23 LEU 34 HD23 LEU 34 47.496 8.158 -4.052
285 H LYS 35 HN LYS 35 41.558 10.122 -3.890
286 HA LYS 35 HA LYS 35 39.712 9.099 -4.655
287 HB2 LYS 35 HB2 LYS 35 40.079 10.616 -6.589
288 HB3 LYS 35 HB1 LYS 35 41.012 9.349 -7.378
289 HG2 LYS 35 HG2 LYS 35 38.991 7.896 -7.290
290 HG3 LYS 35 HG1 LYS 35 38.087 9.277 -6.671
291 HD2 LYS 35 HD2 LYS 35 38.589 10.526 -8.703
292 HD3 LYS 35 HD1 LYS 35 39.532 9.164 -9.315
293 HE2 LYS 35 HE2 LYS 35 37.510 7.761 -9.211
294 HE3 LYS 35 HE1 LYS 35 36.583 9.164 -8.691
295 HZ1 LYS 35 HZ1 LYS 35 37.187 10.243 -10.802
296 HZ2 LYS 35 HZ2 LYS 35 36.299 8.825 -11.023
297 HZ3 LYS 35 HZ3 LYS 35 37.966 8.820 -11.293
298 H VAL 36 HN VAL 36 40.414 7.241 -3.496
299 HA VAL 36 HA VAL 36 41.343 5.044 -5.209
300 HB VAL 36 HB VAL 36 41.319 5.130 -2.183
301 HG11 VAL 36 HG11 VAL 36 42.813 3.193 -2.356
302 HG12 VAL 36 HG12 VAL 36 42.657 3.234 -4.112
303 HG13 VAL 36 HG13 VAL 36 41.250 2.878 -3.111
304 HG21 VAL 36 HG21 VAL 36 42.850 6.819 -3.034
305 HG22 VAL 36 HG22 VAL 36 43.613 5.624 -4.083
306 HG23 VAL 36 HG23 VAL 36 43.750 5.474 -2.331
307 HA PRO 37 HA PRO 37 36.985 3.826 -4.980
308 HB2 PRO 37 HB2 PRO 37 38.114 1.554 -6.535
309 HB3 PRO 37 HB1 PRO 37 36.735 2.594 -6.910
310 HG2 PRO 37 HG2 PRO 37 39.021 2.867 -8.230
311 HG3 PRO 37 HG1 PRO 37 38.071 4.287 -7.761
312 HD2 PRO 37 HD2 PRO 37 40.546 3.167 -6.510
313 HD3 PRO 37 HD1 PRO 37 40.095 4.860 -6.805
314 H ARG 38 HN ARG 38 35.974 2.425 -3.607
315 HA ARG 38 HA ARG 38 37.491 1.134 -1.633
316 HB2 ARG 38 HB2 ARG 38 35.362 0.225 -0.798
317 HB3 ARG 38 HB1 ARG 38 35.269 1.946 -1.131
318 HG2 ARG 38 HG2 ARG 38 34.105 1.493 -3.214
319 HG3 ARG 38 HG1 ARG 38 34.229 -0.242 -2.912
320 HD2 ARG 38 HD2 ARG 38 32.918 0.034 -0.861
321 HD3 ARG 38 HD1 ARG 38 32.782 1.762 -1.186
322 HE ARG 38 HE ARG 38 31.847 0.426 -3.427
323 HH11 ARG 38 HH11 ARG 38 30.958 0.753 -0.046
324 HH12 ARG 38 HH12 ARG 38 29.267 0.521 -0.343
325 HH21 ARG 38 HH21 ARG 38 29.602 0.112 -3.814
326 HH22 ARG 38 HH22 ARG 38 28.496 0.156 -2.482
327 H SER 39 HN SER 39 36.223 -0.033 -4.654
328 HA SER 39 HA SER 39 36.443 -2.789 -4.173
329 HB2 SER 39 HB2 SER 39 36.862 -1.273 -6.766
330 HB3 SER 39 HB1 SER 39 36.555 -3.004 -6.626
331 HG SER 39 HG SER 39 34.531 -2.547 -5.769
332 H SER 40 HN SER 40 38.792 -0.351 -5.149
333 HA SER 40 HA SER 40 40.949 -2.186 -5.505
334 HB2 SER 40 HB2 SER 40 40.888 0.053 -6.597
335 HB3 SER 40 HB1 SER 40 41.030 0.808 -5.010
336 HG SER 40 HG SER 40 42.916 -0.844 -6.332
337 H VAL 41 HN VAL 41 39.720 -0.161 -2.903
338 HA VAL 41 HA VAL 41 41.768 -0.511 -1.033
339 HB VAL 41 HB VAL 41 38.795 -0.179 -0.536
340 HG11 VAL 41 HG11 VAL 41 39.919 -1.058 1.438
341 HG12 VAL 41 HG12 VAL 41 39.428 0.618 1.689
342 HG13 VAL 41 HG13 VAL 41 41.115 0.235 1.347
343 HG21 VAL 41 HG21 VAL 41 39.343 2.188 -0.201
344 HG22 VAL 41 HG22 VAL 41 39.749 1.649 -1.832
345 HG23 VAL 41 HG23 VAL 41 41.022 1.854 -0.628
346 H GLN 42 HN GLN 42 38.790 -2.388 -1.548
347 HA GLN 42 HA GLN 42 39.126 -4.320 0.427
348 HB2 GLN 42 HB2 GLN 42 37.063 -4.120 -0.852
349 HB3 GLN 42 HB1 GLN 42 37.894 -4.611 -2.321
350 HG2 GLN 42 HG2 GLN 42 38.403 -6.790 -1.164
351 HG3 GLN 42 HG1 GLN 42 37.294 -6.280 0.103
352 HE21 GLN 42 HE21 GLN 42 35.497 -4.944 -1.783
353 HE22 GLN 42 HE22 GLN 42 34.653 -6.216 -2.593
354 H THR 43 HN THR 43 40.482 -4.108 -2.789
355 HA THR 43 HA THR 43 41.512 -6.705 -2.988
356 HB THR 43 HB THR 43 42.579 -4.182 -4.284
357 HG1 THR 43 HG1 THR 43 40.302 -4.591 -4.683
358 HG21 THR 43 HG21 THR 43 43.387 -5.707 -6.033
359 HG22 THR 43 HG22 THR 43 42.783 -7.085 -5.115
360 HG23 THR 43 HG23 THR 43 44.101 -6.106 -4.471
361 H ILE 44 HN ILE 44 42.982 -3.693 -1.758
362 HA ILE 44 HA ILE 44 45.448 -5.083 -1.240
363 HB ILE 44 HB ILE 44 46.277 -2.937 -0.283
364 HG12 ILE 44 HG12 ILE 44 44.673 -0.947 -1.115
365 HG13 ILE 44 HG11 ILE 44 43.443 -2.140 -0.714
366 HG21 ILE 44 HG21 ILE 44 46.361 -1.742 -2.421
367 HG22 ILE 44 HG22 ILE 44 45.093 -2.800 -3.044
368 HG23 ILE 44 HG23 ILE 44 46.661 -3.471 -2.594
369 HD11 ILE 44 HD11 ILE 44 43.848 -0.650 1.150
370 HD12 ILE 44 HD12 ILE 44 45.559 -1.080 1.145
371 HD13 ILE 44 HD13 ILE 44 44.347 -2.292 1.555
372 H VAL 45 HN VAL 45 42.719 -3.959 0.718
373 HA VAL 45 HA VAL 45 44.016 -4.369 3.199
374 HB VAL 45 HB VAL 45 41.766 -4.400 4.251
375 HG11 VAL 45 HG11 VAL 45 42.242 -2.197 2.264
376 HG12 VAL 45 HG12 VAL 45 42.871 -2.294 3.909
377 HG13 VAL 45 HG13 VAL 45 41.140 -2.109 3.636
378 HG21 VAL 45 HG21 VAL 45 39.794 -3.941 2.881
379 HG22 VAL 45 HG22 VAL 45 40.510 -5.510 2.500
380 HG23 VAL 45 HG23 VAL 45 40.778 -4.130 1.430
381 H ARG 46 HN ARG 46 42.075 -6.514 1.195
382 HA ARG 46 HA ARG 46 41.936 -8.589 3.108
383 HB2 ARG 46 HB2 ARG 46 40.410 -8.439 1.178
384 HB3 ARG 46 HB1 ARG 46 41.757 -8.773 0.098
385 HG2 ARG 46 HG2 ARG 46 42.032 -10.976 1.103
386 HG3 ARG 46 HG1 ARG 46 40.704 -10.637 2.213
387 HD2 ARG 46 HD2 ARG 46 39.190 -10.387 0.294
388 HD3 ARG 46 HD1 ARG 46 40.523 -10.779 -0.791
389 HE ARG 46 HE ARG 46 40.286 -12.836 1.082
390 HH11 ARG 46 HH11 ARG 46 38.488 -11.467 -1.599
391 HH12 ARG 46 HH12 ARG 46 37.705 -12.952 -2.012
392 HH21 ARG 46 HH21 ARG 46 39.239 -14.824 0.541
393 HH22 ARG 46 HH22 ARG 46 38.130 -14.865 -0.784
394 H LYS 47 HN LYS 47 44.228 -7.741 0.621
395 HA LYS 47 HA LYS 47 45.684 -10.157 0.675
396 HB2 LYS 47 HB2 LYS 47 45.749 -8.537 -1.192
397 HB3 LYS 47 HB1 LYS 47 46.631 -7.417 -0.165
398 HG2 LYS 47 HG2 LYS 47 48.466 -9.026 0.014
399 HG3 LYS 47 HG1 LYS 47 47.580 -10.146 -1.019
400 HD2 LYS 47 HD2 LYS 47 48.506 -7.383 -1.812
401 HD3 LYS 47 HD1 LYS 47 49.291 -8.895 -2.265
402 HE2 LYS 47 HE2 LYS 47 46.505 -8.018 -3.027
403 HE3 LYS 47 HE1 LYS 47 47.909 -8.077 -4.086
404 HZ1 LYS 47 HZ1 LYS 47 46.577 -10.408 -2.806
405 HZ2 LYS 47 HZ2 LYS 47 47.983 -10.493 -3.743
406 HZ3 LYS 47 HZ3 LYS 47 46.533 -9.993 -4.445
407 H TYR 48 HN TYR 48 46.282 -6.989 2.265
408 HA TYR 48 HA TYR 48 48.638 -8.031 3.488
409 HB2 TYR 48 HB2 TYR 48 49.018 -5.928 4.481
410 HB3 TYR 48 HB1 TYR 48 48.287 -5.569 2.932
411 HD1 TYR 48 HD1 TYR 48 47.442 -5.915 6.561
412 HD2 TYR 48 HD2 TYR 48 46.475 -4.087 2.846
413 HE1 TYR 48 HE1 TYR 48 45.825 -4.465 7.706
414 HE2 TYR 48 HE2 TYR 48 44.852 -2.635 3.983
415 HH TYR 48 HH TYR 48 43.486 -2.692 6.075
416 H LYS 49 HN LYS 49 45.290 -7.803 4.502
417 HA LYS 49 HA LYS 49 45.899 -8.247 7.252
418 HB2 LYS 49 HB2 LYS 49 43.580 -8.412 7.661
419 HB3 LYS 49 HB1 LYS 49 43.739 -7.233 6.371
420 HG2 LYS 49 HG2 LYS 49 43.127 -8.987 4.741
421 HG3 LYS 49 HG1 LYS 49 42.891 -10.112 6.081
422 HD2 LYS 49 HD2 LYS 49 41.203 -8.541 7.027
423 HD3 LYS 49 HD1 LYS 49 41.377 -7.546 5.583
424 HE2 LYS 49 HE2 LYS 49 39.431 -8.960 5.354
425 HE3 LYS 49 HE1 LYS 49 40.661 -9.483 4.210
426 HZ1 LYS 49 HZ1 LYS 49 41.262 -11.260 5.733
427 HZ2 LYS 49 HZ2 LYS 49 39.633 -11.355 5.308
428 HZ3 LYS 49 HZ3 LYS 49 40.072 -10.755 6.822
429 H HIS 50 HN HIS 50 45.572 -10.307 4.507
430 HA HIS 50 HA HIS 50 45.086 -12.703 5.993
431 HB2 HIS 50 HB2 HIS 50 44.462 -12.442 3.591
432 HB3 HIS 50 HB1 HIS 50 46.175 -12.434 3.183
433 HD1 HIS 50 HD1 HIS 50 46.738 -14.638 2.177
434 HD2 HIS 50 HD2 HIS 50 44.090 -15.010 5.362
435 HE1 HIS 50 HE1 HIS 50 46.366 -17.101 2.459
436 H HIS 51 HN HIS 51 47.943 -11.163 4.614
437 HA HIS 51 HA HIS 51 49.689 -13.265 5.575
438 HB2 HIS 51 HB2 HIS 51 50.243 -10.589 4.283
439 HB3 HIS 51 HB1 HIS 51 51.519 -11.657 4.848
440 HD1 HIS 51 HD1 HIS 51 52.058 -13.717 3.418
441 HD2 HIS 51 HD2 HIS 51 48.887 -11.455 1.957
442 HE1 HIS 51 HE1 HIS 51 51.634 -14.577 1.101
443 H GLY 52 HN GLY 52 48.757 -10.024 6.522
444 HA2 GLY 52 HA2 GLY 52 50.694 -9.920 8.646
445 HA3 GLY 52 HA1 GLY 52 49.476 -8.716 8.272
446 H THR 53 HN THR 53 48.385 -11.971 8.644
447 HA THR 53 HA THR 53 46.873 -11.287 10.975
448 HB THR 53 HB THR 53 47.393 -14.091 9.951
449 HG1 THR 53 HG1 THR 53 45.983 -12.013 8.777
450 HG21 THR 53 HG21 THR 53 45.154 -14.526 10.870
451 HG22 THR 53 HG22 THR 53 45.052 -12.850 11.406
452 HG23 THR 53 HG23 THR 53 46.256 -13.929 12.111
453 H THR 54 HN THR 54 49.316 -13.796 10.400
454 HA THR 54 HA THR 54 50.448 -13.286 13.068
455 HB THR 54 HB THR 54 50.487 -16.060 11.945
456 HG1 THR 54 HG1 THR 54 48.341 -15.740 11.724
457 HG21 THR 54 HG21 THR 54 51.641 -15.520 14.051
458 HG22 THR 54 HG22 THR 54 50.323 -16.661 14.317
459 HG23 THR 54 HG23 THR 54 50.116 -14.962 14.740
460 H GLN 55 HN GLN 55 51.002 -12.742 10.042
461 HA GLN 55 HA GLN 55 52.797 -12.414 8.721
462 HB2 GLN 55 HB2 GLN 55 54.147 -11.944 10.726
463 HB3 GLN 55 HB1 GLN 55 54.432 -13.663 10.946
464 HG2 GLN 55 HG2 GLN 55 55.733 -13.773 8.951
465 HG3 GLN 55 HG1 GLN 55 55.297 -12.123 8.512
466 HE21 GLN 55 HE21 GLN 55 56.243 -10.417 9.598
467 HE22 GLN 55 HE22 GLN 55 57.660 -10.605 10.568
468 H HIS 56 HN HIS 56 53.182 -15.528 10.373
469 HA HIS 56 HA HIS 56 53.282 -16.780 7.718
470 HB2 HIS 56 HB2 HIS 56 55.263 -17.142 9.249
471 HB3 HIS 56 HB1 HIS 56 54.181 -17.985 10.348
472 HD1 HIS 56 HD1 HIS 56 56.290 -18.485 7.406
473 HD2 HIS 56 HD2 HIS 56 53.100 -20.443 9.212
474 HE1 HIS 56 HE1 HIS 56 56.290 -20.795 6.445
475 H HIS 57 HN HIS 57 50.995 -16.582 7.604
476 HA HIS 57 HA HIS 57 48.888 -17.374 7.669
477 HB2 HIS 57 HB2 HIS 57 49.828 -19.605 7.362
478 HB3 HIS 57 HB1 HIS 57 50.141 -19.743 9.087
479 HD1 HIS 57 HD1 HIS 57 47.126 -19.281 6.801
480 HD2 HIS 57 HD2 HIS 57 48.167 -21.046 10.417
481 HE1 HIS 57 HE1 HIS 57 45.071 -20.495 7.570
Start of MODEL 14
1 H1 ALA 1 HT1 ALA 1 43.215 -1.314 -19.535
2 H2 ALA 1 HT2 ALA 1 43.303 -0.915 -17.895
3 H3 ALA 1 HT3 ALA 1 41.955 -1.735 -18.490
4 HA ALA 1 HA ALA 1 43.378 -3.229 -17.292
5 HB1 ALA 1 HB1 ALA 1 43.417 -3.738 -20.262
6 HB2 ALA 1 HB2 ALA 1 42.056 -4.052 -19.187
7 HB3 ALA 1 HB3 ALA 1 43.561 -4.947 -18.987
8 H SER 2 HN SER 2 45.070 -0.823 -18.649
9 HA SER 2 HA SER 2 47.520 -2.229 -19.210
10 HB2 SER 2 HB2 SER 2 47.031 0.739 -18.894
11 HB3 SER 2 HB1 SER 2 48.459 -0.018 -19.600
12 HG SER 2 HG SER 2 46.341 -0.999 -20.850
13 H MET 3 HN MET 3 46.100 -0.425 -16.567
14 HA MET 3 HA MET 3 46.591 -0.227 -14.374
15 HB2 MET 3 HB2 MET 3 48.624 -2.381 -14.961
16 HB3 MET 3 HB1 MET 3 48.331 -1.737 -13.353
17 HG2 MET 3 HG2 MET 3 46.314 -3.138 -15.090
18 HG3 MET 3 HG1 MET 3 47.160 -3.837 -13.711
19 HE1 MET 3 HE1 MET 3 43.516 -3.494 -12.359
20 HE2 MET 3 HE2 MET 3 44.889 -4.575 -12.592
21 HE3 MET 3 HE3 MET 3 44.023 -3.936 -13.989
22 H GLY 4 HN GLY 4 49.748 -0.672 -15.939
23 HA2 GLY 4 HA2 GLY 4 51.278 1.108 -16.309
24 HA3 GLY 4 HA1 GLY 4 50.475 2.023 -15.037
25 H LYS 5 HN LYS 5 53.158 1.877 -14.969
26 HA LYS 5 HA LYS 5 53.701 -0.121 -12.883
27 HB2 LYS 5 HB2 LYS 5 55.622 1.221 -14.789
28 HB3 LYS 5 HB1 LYS 5 56.090 0.123 -13.499
29 HG2 LYS 5 HG2 LYS 5 54.760 -1.647 -14.554
30 HG3 LYS 5 HG1 LYS 5 54.373 -0.544 -15.875
31 HD2 LYS 5 HD2 LYS 5 56.736 -0.379 -16.436
32 HD3 LYS 5 HD1 LYS 5 57.142 -1.437 -15.083
33 HE2 LYS 5 HE2 LYS 5 55.487 -2.154 -17.499
34 HE3 LYS 5 HE1 LYS 5 57.124 -2.707 -17.148
35 HZ1 LYS 5 HZ1 LYS 5 56.269 -3.829 -15.175
36 HZ2 LYS 5 HZ2 LYS 5 55.502 -4.389 -16.573
37 HZ3 LYS 5 HZ3 LYS 5 54.698 -3.321 -15.543
38 H SER 6 HN SER 6 53.756 0.679 -10.933
39 HA SER 6 HA SER 6 54.165 1.993 -9.141
40 HB2 SER 6 HB2 SER 6 56.469 2.132 -10.035
41 HB3 SER 6 HB1 SER 6 56.004 3.531 -11.001
42 HG SER 6 HG SER 6 55.441 4.547 -8.958
43 H LYS 7 HN LYS 7 52.246 2.744 -11.454
44 HA LYS 7 HA LYS 7 51.847 5.563 -10.817
45 HB2 LYS 7 HB2 LYS 7 50.656 3.781 -12.936
46 HB3 LYS 7 HB1 LYS 7 50.109 5.427 -12.644
47 HG2 LYS 7 HG2 LYS 7 52.284 6.300 -13.206
48 HG3 LYS 7 HG1 LYS 7 52.929 4.666 -13.372
49 HD2 LYS 7 HD2 LYS 7 51.488 4.241 -15.252
50 HD3 LYS 7 HD1 LYS 7 50.685 5.797 -15.033
51 HE2 LYS 7 HE2 LYS 7 53.622 5.488 -15.640
52 HE3 LYS 7 HE1 LYS 7 52.388 5.740 -16.871
53 HZ1 LYS 7 HZ1 LYS 7 53.031 7.593 -14.642
54 HZ2 LYS 7 HZ2 LYS 7 51.808 7.827 -15.787
55 HZ3 LYS 7 HZ3 LYS 7 53.424 7.812 -16.271
56 H GLU 8 HN GLU 8 50.009 2.525 -10.887
57 HA GLU 8 HA GLU 8 47.945 3.765 -9.258
58 HB2 GLU 8 HB2 GLU 8 48.122 1.034 -10.534
59 HB3 GLU 8 HB1 GLU 8 46.778 1.564 -9.533
60 HG2 GLU 8 HG2 GLU 8 47.652 2.792 -12.135
61 HG3 GLU 8 HG1 GLU 8 46.235 1.775 -11.877
62 H ILE 9 HN ILE 9 49.714 0.681 -9.105
63 HA ILE 9 HA ILE 9 49.542 0.883 -6.184
64 HB ILE 9 HB ILE 9 50.160 -1.584 -7.833
65 HG12 ILE 9 HG12 ILE 9 47.578 -0.800 -6.451
66 HG13 ILE 9 HG11 ILE 9 47.847 -0.752 -8.190
67 HG21 ILE 9 HG21 ILE 9 51.094 -1.651 -5.574
68 HG22 ILE 9 HG22 ILE 9 49.760 -2.794 -5.730
69 HG23 ILE 9 HG23 ILE 9 49.513 -1.260 -4.897
70 HD11 ILE 9 HD11 ILE 9 47.896 -3.218 -6.462
71 HD12 ILE 9 HD12 ILE 9 48.166 -3.174 -8.203
72 HD13 ILE 9 HD13 ILE 9 46.593 -2.728 -7.545
73 H SER 10 HN SER 10 51.301 2.183 -5.793
74 HA SER 10 HA SER 10 53.900 1.286 -6.749
75 HB2 SER 10 HB2 SER 10 54.686 3.429 -5.673
76 HB3 SER 10 HB1 SER 10 53.528 3.645 -6.986
77 HG SER 10 HG SER 10 52.385 4.696 -5.608
78 H GLN 11 HN GLN 11 55.700 1.309 -5.115
79 HA GLN 11 HA GLN 11 55.158 -0.492 -3.036
80 HB2 GLN 11 HB2 GLN 11 57.389 -0.193 -4.089
81 HB3 GLN 11 HB1 GLN 11 57.528 1.371 -3.301
82 HG2 GLN 11 HG2 GLN 11 57.457 0.285 -1.117
83 HG3 GLN 11 HG1 GLN 11 57.296 -1.283 -1.902
84 HE21 GLN 11 HE21 GLN 11 59.348 1.265 -3.113
85 HE22 GLN 11 HE22 GLN 11 60.844 0.480 -2.759
86 H ASP 12 HN ASP 12 55.523 3.000 -3.104
87 HA ASP 12 HA ASP 12 55.359 3.458 -0.326
88 HB2 ASP 12 HB2 ASP 12 54.903 5.178 -2.738
89 HB3 ASP 12 HB1 ASP 12 54.505 5.781 -1.136
90 H LEU 13 HN LEU 13 52.873 3.697 -2.869
91 HA LEU 13 HA LEU 13 50.776 4.445 -1.195
92 HB2 LEU 13 HB2 LEU 13 50.752 4.576 -3.677
93 HB3 LEU 13 HB1 LEU 13 50.575 2.838 -3.745
94 HG LEU 13 HG LEU 13 48.518 4.447 -2.269
95 HD11 LEU 13 HD11 LEU 13 48.600 4.062 -5.256
96 HD12 LEU 13 HD12 LEU 13 48.787 5.596 -4.404
97 HD13 LEU 13 HD13 LEU 13 47.253 4.728 -4.334
98 HD21 LEU 13 HD21 LEU 13 47.045 2.651 -3.043
99 HD22 LEU 13 HD22 LEU 13 48.431 1.999 -2.167
100 HD23 LEU 13 HD23 LEU 13 48.387 1.925 -3.929
101 H ARG 14 HN ARG 14 51.786 1.197 -2.215
102 HA ARG 14 HA ARG 14 49.703 -0.192 -0.943
103 HB2 ARG 14 HB2 ARG 14 51.130 -1.218 -2.641
104 HB3 ARG 14 HB1 ARG 14 52.511 -1.121 -1.559
105 HG2 ARG 14 HG2 ARG 14 51.533 -2.725 -0.068
106 HG3 ARG 14 HG1 ARG 14 50.024 -2.722 -0.985
107 HD2 ARG 14 HD2 ARG 14 51.444 -4.684 -1.481
108 HD3 ARG 14 HD1 ARG 14 51.137 -3.680 -2.898
109 HE ARG 14 HE ARG 14 53.614 -3.278 -1.397
110 HH11 ARG 14 HH11 ARG 14 52.031 -4.495 -4.284
111 HH12 ARG 14 HH12 ARG 14 53.478 -4.508 -5.228
112 HH21 ARG 14 HH21 ARG 14 55.533 -3.306 -2.637
113 HH22 ARG 14 HH22 ARG 14 55.486 -3.844 -4.286
114 H LYS 15 HN LYS 15 52.824 0.905 0.259
115 HA LYS 15 HA LYS 15 52.610 -0.445 2.763
116 HB2 LYS 15 HB2 LYS 15 54.382 1.724 1.702
117 HB3 LYS 15 HB1 LYS 15 54.395 1.325 3.413
118 HG2 LYS 15 HG2 LYS 15 54.995 -0.971 2.880
119 HG3 LYS 15 HG1 LYS 15 54.958 -0.579 1.160
120 HD2 LYS 15 HD2 LYS 15 56.837 0.815 1.326
121 HD3 LYS 15 HD1 LYS 15 56.718 0.911 3.084
122 HE2 LYS 15 HE2 LYS 15 57.370 -1.585 1.523
123 HE3 LYS 15 HE1 LYS 15 58.558 -0.551 2.313
124 HZ1 LYS 15 HZ1 LYS 15 57.529 -1.034 4.439
125 HZ2 LYS 15 HZ2 LYS 15 57.978 -2.470 3.680
126 HZ3 LYS 15 HZ3 LYS 15 56.357 -1.999 3.701
127 H LYS 16 HN LYS 16 52.058 2.889 1.717
128 HA LYS 16 HA LYS 16 51.375 3.842 4.282
129 HB2 LYS 16 HB2 LYS 16 50.733 4.975 1.562
130 HB3 LYS 16 HB1 LYS 16 50.470 5.818 3.081
131 HG2 LYS 16 HG2 LYS 16 53.126 4.923 1.973
132 HG3 LYS 16 HG1 LYS 16 52.514 6.577 2.029
133 HD2 LYS 16 HD2 LYS 16 52.489 6.480 4.481
134 HD3 LYS 16 HD1 LYS 16 53.100 4.827 4.422
135 HE2 LYS 16 HE2 LYS 16 54.930 6.317 4.872
136 HE3 LYS 16 HE1 LYS 16 55.113 5.659 3.247
137 HZ1 LYS 16 HZ1 LYS 16 54.116 8.360 3.972
138 HZ2 LYS 16 HZ2 LYS 16 54.112 7.736 2.402
139 HZ3 LYS 16 HZ3 LYS 16 55.578 7.985 3.204
140 H ILE 17 HN ILE 17 49.380 2.609 1.611
141 HA ILE 17 HA ILE 17 46.907 3.352 2.679
142 HB ILE 17 HB ILE 17 47.226 2.485 0.346
143 HG12 ILE 17 HG12 ILE 17 45.087 1.218 0.239
144 HG13 ILE 17 HG11 ILE 17 45.102 1.101 1.993
145 HG21 ILE 17 HG21 ILE 17 47.173 0.066 -0.047
146 HG22 ILE 17 HG22 ILE 17 47.323 -0.204 1.689
147 HG23 ILE 17 HG23 ILE 17 48.632 0.576 0.803
148 HD11 ILE 17 HD11 ILE 17 43.617 2.862 1.194
149 HD12 ILE 17 HD12 ILE 17 44.982 3.659 0.413
150 HD13 ILE 17 HD13 ILE 17 44.930 3.516 2.169
151 H VAL 18 HN VAL 18 48.943 0.570 3.385
152 HA VAL 18 HA VAL 18 47.073 -0.847 4.960
153 HB VAL 18 HB VAL 18 50.102 -0.833 5.113
154 HG11 VAL 18 HG11 VAL 18 48.134 -2.783 6.312
155 HG12 VAL 18 HG12 VAL 18 49.139 -1.641 7.205
156 HG13 VAL 18 HG13 VAL 18 49.888 -2.962 6.309
157 HG21 VAL 18 HG21 VAL 18 48.182 -2.724 3.755
158 HG22 VAL 18 HG22 VAL 18 49.929 -2.938 3.855
159 HG23 VAL 18 HG23 VAL 18 49.258 -1.576 2.957
160 H ASP 19 HN ASP 19 49.626 1.474 5.820
161 HA ASP 19 HA ASP 19 49.060 1.481 8.593
162 HB2 ASP 19 HB2 ASP 19 50.591 3.355 6.818
163 HB3 ASP 19 HB1 ASP 19 50.346 3.700 8.527
164 H LEU 20 HN LEU 20 47.805 3.344 5.921
165 HA LEU 20 HA LEU 20 46.453 5.262 7.504
166 HB2 LEU 20 HB2 LEU 20 45.820 4.283 4.719
167 HB3 LEU 20 HB1 LEU 20 45.117 5.703 5.470
168 HG LEU 20 HG LEU 20 48.034 5.333 4.778
169 HD11 LEU 20 HD11 LEU 20 45.945 7.119 3.565
170 HD12 LEU 20 HD12 LEU 20 46.604 5.657 2.831
171 HD13 LEU 20 HD13 LEU 20 47.647 7.051 3.115
172 HD21 LEU 20 HD21 LEU 20 47.786 6.694 6.777
173 HD22 LEU 20 HD22 LEU 20 46.593 7.704 5.961
174 HD23 LEU 20 HD23 LEU 20 48.267 7.695 5.407
175 H HIS 21 HN HIS 21 45.608 2.048 6.359
176 HA HIS 21 HA HIS 21 42.901 2.175 7.300
177 HB2 HIS 21 HB2 HIS 21 44.674 -0.033 6.333
178 HB3 HIS 21 HB1 HIS 21 43.187 -0.434 7.189
179 HD1 HIS 21 HD1 HIS 21 40.926 0.604 6.101
180 HD2 HIS 21 HD2 HIS 21 44.307 0.516 3.687
181 HE1 HIS 21 HE1 HIS 21 40.096 1.003 3.773
182 H LYS 22 HN LYS 22 45.954 1.427 8.682
183 HA LYS 22 HA LYS 22 44.915 0.231 11.071
184 HB2 LYS 22 HB2 LYS 22 47.627 1.327 10.325
185 HB3 LYS 22 HB1 LYS 22 47.278 0.599 11.888
186 HG2 LYS 22 HG2 LYS 22 47.026 -1.518 10.997
187 HG3 LYS 22 HG1 LYS 22 46.689 -0.908 9.377
188 HD2 LYS 22 HD2 LYS 22 48.904 -1.961 9.558
189 HD3 LYS 22 HD1 LYS 22 48.997 -0.268 9.096
190 HE2 LYS 22 HE2 LYS 22 49.443 0.284 11.498
191 HE3 LYS 22 HE1 LYS 22 49.511 -1.446 11.827
192 HZ1 LYS 22 HZ1 LYS 22 51.316 0.102 10.043
193 HZ2 LYS 22 HZ2 LYS 22 51.343 -1.583 10.192
194 HZ3 LYS 22 HZ3 LYS 22 51.715 -0.612 11.525
195 H SER 23 HN SER 23 44.903 3.289 9.860
196 HA SER 23 HA SER 23 44.834 4.543 12.505
197 HB2 SER 23 HB2 SER 23 44.969 5.859 9.781
198 HB3 SER 23 HB1 SER 23 45.124 6.662 11.345
199 HG SER 23 HG SER 23 46.894 4.777 10.168
200 H GLY 24 HN GLY 24 43.043 4.109 9.482
201 HA2 GLY 24 HA2 GLY 24 40.746 3.813 9.255
202 HA3 GLY 24 HA1 GLY 24 40.546 4.253 10.941
203 H SER 25 HN SER 25 41.256 6.672 11.304
204 HA SER 25 HA SER 25 39.304 8.204 9.931
205 HB2 SER 25 HB2 SER 25 40.363 10.105 11.292
206 HB3 SER 25 HB1 SER 25 39.644 8.765 12.186
207 HG SER 25 HG SER 25 41.545 8.202 12.895
208 H SER 26 HN SER 26 42.371 7.372 8.989
209 HA SER 26 HA SER 26 43.048 9.852 7.675
210 HB2 SER 26 HB2 SER 26 44.352 7.136 7.440
211 HB3 SER 26 HB1 SER 26 45.035 8.684 6.937
212 HG SER 26 HG SER 26 45.056 9.335 9.086
213 H LEU 27 HN LEU 27 40.998 7.296 7.006
214 HA LEU 27 HA LEU 27 41.453 6.923 4.231
215 HB2 LEU 27 HB2 LEU 27 40.246 5.287 5.587
216 HB3 LEU 27 HB1 LEU 27 38.967 6.446 5.878
217 HG LEU 27 HG LEU 27 38.445 6.425 3.446
218 HD11 LEU 27 HD11 LEU 27 40.596 5.758 2.570
219 HD12 LEU 27 HD12 LEU 27 39.358 4.606 2.071
220 HD13 LEU 27 HD13 LEU 27 40.471 4.196 3.377
221 HD21 LEU 27 HD21 LEU 27 37.194 5.035 5.007
222 HD22 LEU 27 HD22 LEU 27 38.376 3.741 4.817
223 HD23 LEU 27 HD23 LEU 27 37.375 4.228 3.450
224 H GLY 28 HN GLY 28 39.426 9.114 6.081
225 HA2 GLY 28 HA2 GLY 28 37.817 10.115 4.045
226 HA3 GLY 28 HA1 GLY 28 38.288 11.010 5.482
227 H ALA 29 HN ALA 29 40.998 11.232 5.104
228 HA ALA 29 HA ALA 29 41.186 13.465 3.439
229 HB1 ALA 29 HB1 ALA 29 43.607 13.319 3.826
230 HB2 ALA 29 HB2 ALA 29 43.390 11.715 4.523
231 HB3 ALA 29 HB3 ALA 29 42.684 13.124 5.315
232 H ILE 30 HN ILE 30 42.603 10.220 2.944
233 HA ILE 30 HA ILE 30 43.579 10.827 0.374
234 HB ILE 30 HB ILE 30 43.838 8.382 0.052
235 HG12 ILE 30 HG12 ILE 30 42.640 8.176 2.826
236 HG13 ILE 30 HG11 ILE 30 41.819 7.704 1.343
237 HG21 ILE 30 HG21 ILE 30 44.806 9.439 2.705
238 HG22 ILE 30 HG22 ILE 30 45.563 9.723 1.137
239 HG23 ILE 30 HG23 ILE 30 45.506 8.093 1.805
240 HD11 ILE 30 HD11 ILE 30 44.353 6.483 2.414
241 HD12 ILE 30 HD12 ILE 30 43.506 5.995 0.947
242 HD13 ILE 30 HD13 ILE 30 42.740 5.782 2.520
243 H SER 31 HN SER 31 40.458 9.684 1.435
244 HA SER 31 HA SER 31 39.567 8.754 -1.077
245 HB2 SER 31 HB2 SER 31 38.490 8.179 1.099
246 HB3 SER 31 HB1 SER 31 37.888 9.833 1.204
247 HG SER 31 HG SER 31 36.406 8.224 0.311
248 H LYS 32 HN LYS 32 39.430 11.940 0.482
249 HA LYS 32 HA LYS 32 37.864 12.992 -1.702
250 HB2 LYS 32 HB2 LYS 32 38.015 15.159 -0.496
251 HB3 LYS 32 HB1 LYS 32 37.324 13.856 0.455
252 HG2 LYS 32 HG2 LYS 32 39.527 13.562 1.556
253 HG3 LYS 32 HG1 LYS 32 40.110 14.974 0.673
254 HD2 LYS 32 HD2 LYS 32 37.697 15.021 2.477
255 HD3 LYS 32 HD1 LYS 32 39.324 15.410 3.029
256 HE2 LYS 32 HE2 LYS 32 37.858 16.825 0.799
257 HE3 LYS 32 HE1 LYS 32 37.997 17.413 2.454
258 HZ1 LYS 32 HZ1 LYS 32 40.242 16.976 0.560
259 HZ2 LYS 32 HZ2 LYS 32 40.408 17.467 2.172
260 HZ3 LYS 32 HZ3 LYS 32 39.625 18.466 1.065
261 H ARG 33 HN ARG 33 41.244 13.022 -0.748
262 HA ARG 33 HA ARG 33 41.797 15.019 -2.789
263 HB2 ARG 33 HB2 ARG 33 44.073 15.087 -1.967
264 HB3 ARG 33 HB1 ARG 33 42.953 15.209 -0.626
265 HG2 ARG 33 HG2 ARG 33 43.343 12.880 -0.057
266 HG3 ARG 33 HG1 ARG 33 44.427 12.711 -1.438
267 HD2 ARG 33 HD2 ARG 33 44.839 14.587 0.888
268 HD3 ARG 33 HD1 ARG 33 45.632 13.027 0.690
269 HE ARG 33 HE ARG 33 46.042 14.772 -1.548
270 HH11 ARG 33 HH11 ARG 33 47.190 13.929 1.660
271 HH12 ARG 33 HH12 ARG 33 48.758 14.623 1.419
272 HH21 ARG 33 HH21 ARG 33 48.152 15.666 -1.868
273 HH22 ARG 33 HH22 ARG 33 49.307 15.591 -0.582
274 H LEU 34 HN LEU 34 42.707 11.622 -2.168
275 HA LEU 34 HA LEU 34 44.023 11.550 -4.776
276 HB2 LEU 34 HB2 LEU 34 45.254 10.718 -2.827
277 HB3 LEU 34 HB1 LEU 34 43.996 9.538 -2.530
278 HG LEU 34 HG LEU 34 44.543 8.484 -4.728
279 HD11 LEU 34 HD11 LEU 34 46.677 9.042 -5.784
280 HD12 LEU 34 HD12 LEU 34 46.877 10.389 -4.665
281 HD13 LEU 34 HD13 LEU 34 45.552 10.399 -5.828
282 HD21 LEU 34 HD21 LEU 34 45.424 7.584 -2.643
283 HD22 LEU 34 HD22 LEU 34 46.803 8.679 -2.739
284 HD23 LEU 34 HD23 LEU 34 46.599 7.411 -3.947
285 H LYS 35 HN LYS 35 41.129 10.545 -3.237
286 HA LYS 35 HA LYS 35 39.566 8.964 -3.661
287 HB2 LYS 35 HB2 LYS 35 38.415 9.254 -5.858
288 HB3 LYS 35 HB1 LYS 35 38.679 10.747 -4.991
289 HG2 LYS 35 HG2 LYS 35 40.515 9.855 -7.203
290 HG3 LYS 35 HG1 LYS 35 39.020 10.724 -7.532
291 HD2 LYS 35 HD2 LYS 35 41.353 11.700 -5.873
292 HD3 LYS 35 HD1 LYS 35 40.888 12.276 -7.473
293 HE2 LYS 35 HE2 LYS 35 38.715 13.014 -6.498
294 HE3 LYS 35 HE1 LYS 35 39.326 12.559 -4.910
295 HZ1 LYS 35 HZ1 LYS 35 41.180 14.139 -5.287
296 HZ2 LYS 35 HZ2 LYS 35 39.662 14.872 -5.193
297 HZ3 LYS 35 HZ3 LYS 35 40.405 14.662 -6.696
298 H VAL 36 HN VAL 36 41.272 7.378 -3.309
299 HA VAL 36 HA VAL 36 42.326 5.908 -5.496
300 HB VAL 36 HB VAL 36 43.507 5.941 -3.373
301 HG11 VAL 36 HG11 VAL 36 41.112 4.541 -2.203
302 HG12 VAL 36 HG12 VAL 36 41.648 6.183 -1.850
303 HG13 VAL 36 HG13 VAL 36 42.645 4.808 -1.374
304 HG21 VAL 36 HG21 VAL 36 43.870 3.964 -4.719
305 HG22 VAL 36 HG22 VAL 36 42.462 3.181 -4.005
306 HG23 VAL 36 HG23 VAL 36 43.878 3.522 -3.012
307 HA PRO 37 HA PRO 37 38.788 3.469 -6.656
308 HB2 PRO 37 HB2 PRO 37 40.253 1.237 -7.486
309 HB3 PRO 37 HB1 PRO 37 39.835 2.624 -8.495
310 HG2 PRO 37 HG2 PRO 37 42.371 2.033 -7.036
311 HG3 PRO 37 HG1 PRO 37 42.138 2.784 -8.625
312 HD2 PRO 37 HD2 PRO 37 42.762 4.246 -6.486
313 HD3 PRO 37 HD1 PRO 37 41.625 4.855 -7.707
314 H ARG 38 HN ARG 38 37.506 2.366 -5.345
315 HA ARG 38 HA ARG 38 38.349 1.247 -2.916
316 HB2 ARG 38 HB2 ARG 38 36.048 0.293 -2.775
317 HB3 ARG 38 HB1 ARG 38 36.097 2.018 -3.101
318 HG2 ARG 38 HG2 ARG 38 35.532 1.679 -5.389
319 HG3 ARG 38 HG1 ARG 38 35.737 -0.067 -5.238
320 HD2 ARG 38 HD2 ARG 38 33.368 0.673 -5.238
321 HD3 ARG 38 HD1 ARG 38 33.834 -0.229 -3.799
322 HE ARG 38 HE ARG 38 34.084 2.060 -2.740
323 HH11 ARG 38 HH11 ARG 38 31.815 1.448 -5.343
324 HH12 ARG 38 HH12 ARG 38 30.695 2.656 -4.813
325 HH21 ARG 38 HH21 ARG 38 32.598 3.640 -2.037
326 HH22 ARG 38 HH22 ARG 38 31.140 3.906 -2.937
327 H SER 39 HN SER 39 38.019 -0.160 -6.082
328 HA SER 39 HA SER 39 37.904 -2.866 -5.388
329 HB2 SER 39 HB2 SER 39 38.913 -3.228 -7.672
330 HB3 SER 39 HB1 SER 39 37.481 -2.197 -7.659
331 HG SER 39 HG SER 39 39.781 -1.610 -8.692
332 H SER 40 HN SER 40 40.600 -0.636 -5.645
333 HA SER 40 HA SER 40 42.579 -2.681 -5.220
334 HB2 SER 40 HB2 SER 40 43.076 -0.651 -6.563
335 HB3 SER 40 HB1 SER 40 42.860 0.337 -5.119
336 HG SER 40 HG SER 40 44.567 -1.460 -4.391
337 H VAL 41 HN VAL 41 40.860 -0.286 -3.341
338 HA VAL 41 HA VAL 41 42.380 -0.404 -0.983
339 HB VAL 41 HB VAL 41 39.432 0.200 -1.327
340 HG11 VAL 41 HG11 VAL 41 39.590 1.353 0.824
341 HG12 VAL 41 HG12 VAL 41 41.258 0.804 0.994
342 HG13 VAL 41 HG13 VAL 41 39.940 -0.368 0.985
343 HG21 VAL 41 HG21 VAL 41 40.851 1.695 -2.615
344 HG22 VAL 41 HG22 VAL 41 41.823 2.033 -1.183
345 HG23 VAL 41 HG23 VAL 41 40.138 2.548 -1.246
346 H GLN 42 HN GLN 42 39.392 -2.116 -1.880
347 HA GLN 42 HA GLN 42 39.192 -3.534 0.556
348 HB2 GLN 42 HB2 GLN 42 37.971 -4.307 -2.092
349 HB3 GLN 42 HB1 GLN 42 37.437 -4.814 -0.498
350 HG2 GLN 42 HG2 GLN 42 37.310 -2.033 -1.649
351 HG3 GLN 42 HG1 GLN 42 35.958 -3.120 -1.346
352 HE21 GLN 42 HE21 GLN 42 37.031 -4.001 1.233
353 HE22 GLN 42 HE22 GLN 42 36.767 -2.692 2.327
354 H THR 43 HN THR 43 40.889 -4.291 -2.437
355 HA THR 43 HA THR 43 41.227 -7.036 -1.689
356 HB THR 43 HB THR 43 41.278 -6.332 -4.091
357 HG1 THR 43 HG1 THR 43 43.471 -7.533 -4.394
358 HG21 THR 43 HG21 THR 43 42.616 -4.287 -3.849
359 HG22 THR 43 HG22 THR 43 43.347 -5.393 -5.010
360 HG23 THR 43 HG23 THR 43 44.013 -5.255 -3.384
361 H ILE 44 HN ILE 44 42.927 -4.081 -1.056
362 HA ILE 44 HA ILE 44 45.349 -5.389 -0.235
363 HB ILE 44 HB ILE 44 44.409 -2.537 0.129
364 HG12 ILE 44 HG12 ILE 44 44.933 -3.135 -2.185
365 HG13 ILE 44 HG11 ILE 44 46.134 -2.019 -1.549
366 HG21 ILE 44 HG21 ILE 44 45.886 -3.100 1.971
367 HG22 ILE 44 HG22 ILE 44 46.705 -2.015 0.845
368 HG23 ILE 44 HG23 ILE 44 47.085 -3.736 0.844
369 HD11 ILE 44 HD11 ILE 44 47.660 -3.915 -1.181
370 HD12 ILE 44 HD12 ILE 44 47.198 -3.729 -2.873
371 HD13 ILE 44 HD13 ILE 44 46.460 -4.995 -1.894
372 H VAL 45 HN VAL 45 42.496 -4.042 1.382
373 HA VAL 45 HA VAL 45 43.474 -4.263 3.994
374 HB VAL 45 HB VAL 45 41.139 -4.193 4.781
375 HG11 VAL 45 HG11 VAL 45 41.729 -2.298 2.527
376 HG12 VAL 45 HG12 VAL 45 42.255 -2.132 4.203
377 HG13 VAL 45 HG13 VAL 45 40.540 -2.041 3.803
378 HG21 VAL 45 HG21 VAL 45 40.442 -4.421 1.867
379 HG22 VAL 45 HG22 VAL 45 39.310 -3.995 3.150
380 HG23 VAL 45 HG23 VAL 45 40.066 -5.592 3.132
381 H ARG 46 HN ARG 46 41.786 -6.637 2.013
382 HA ARG 46 HA ARG 46 41.717 -8.564 4.133
383 HB2 ARG 46 HB2 ARG 46 40.892 -10.132 2.423
384 HB3 ARG 46 HB1 ARG 46 40.003 -8.620 2.396
385 HG2 ARG 46 HG2 ARG 46 40.295 -8.996 0.155
386 HG3 ARG 46 HG1 ARG 46 41.708 -8.001 0.503
387 HD2 ARG 46 HD2 ARG 46 42.998 -10.144 0.823
388 HD3 ARG 46 HD1 ARG 46 41.589 -10.998 0.196
389 HE ARG 46 HE ARG 46 42.537 -8.886 -1.512
390 HH11 ARG 46 HH11 ARG 46 42.857 -12.284 -0.702
391 HH12 ARG 46 HH12 ARG 46 43.543 -12.710 -2.231
392 HH21 ARG 46 HH21 ARG 46 43.429 -9.449 -3.532
393 HH22 ARG 46 HH22 ARG 46 43.875 -11.096 -3.847
394 H LYS 47 HN LYS 47 44.025 -7.566 1.826
395 HA LYS 47 HA LYS 47 45.431 -10.073 1.784
396 HB2 LYS 47 HB2 LYS 47 45.340 -8.495 -0.168
397 HB3 LYS 47 HB1 LYS 47 46.393 -7.418 0.739
398 HG2 LYS 47 HG2 LYS 47 48.098 -9.162 0.828
399 HG3 LYS 47 HG1 LYS 47 47.045 -10.231 -0.098
400 HD2 LYS 47 HD2 LYS 47 47.058 -8.540 -1.928
401 HD3 LYS 47 HD1 LYS 47 48.250 -7.621 -1.004
402 HE2 LYS 47 HE2 LYS 47 48.556 -10.425 -2.072
403 HE3 LYS 47 HE1 LYS 47 49.377 -8.979 -2.655
404 HZ1 LYS 47 HZ1 LYS 47 50.471 -8.793 -0.501
405 HZ2 LYS 47 HZ2 LYS 47 50.812 -10.274 -1.239
406 HZ3 LYS 47 HZ3 LYS 47 49.701 -10.204 0.029
407 H TYR 48 HN TYR 48 46.004 -6.817 3.165
408 HA TYR 48 HA TYR 48 48.515 -7.537 4.235
409 HB2 TYR 48 HB2 TYR 48 48.604 -5.446 5.322
410 HB3 TYR 48 HB1 TYR 48 47.676 -5.146 3.867
411 HD1 TYR 48 HD1 TYR 48 47.253 -5.835 7.522
412 HD2 TYR 48 HD2 TYR 48 45.629 -4.016 4.038
413 HE1 TYR 48 HE1 TYR 48 45.516 -4.779 8.895
414 HE2 TYR 48 HE2 TYR 48 43.878 -2.956 5.413
415 HH TYR 48 HH TYR 48 43.994 -2.968 8.858
416 H LYS 49 HN LYS 49 45.269 -7.886 5.479
417 HA LYS 49 HA LYS 49 46.068 -8.435 8.136
418 HB2 LYS 49 HB2 LYS 49 43.833 -9.377 8.469
419 HB3 LYS 49 HB1 LYS 49 43.760 -7.833 7.640
420 HG2 LYS 49 HG2 LYS 49 43.334 -8.931 5.541
421 HG3 LYS 49 HG1 LYS 49 43.555 -10.514 6.290
422 HD2 LYS 49 HD2 LYS 49 41.189 -10.025 6.041
423 HD3 LYS 49 HD1 LYS 49 41.625 -10.078 7.747
424 HE2 LYS 49 HE2 LYS 49 41.775 -7.602 7.740
425 HE3 LYS 49 HE1 LYS 49 41.224 -7.602 6.066
426 HZ1 LYS 49 HZ1 LYS 49 39.710 -8.618 8.405
427 HZ2 LYS 49 HZ2 LYS 49 39.168 -8.663 6.807
428 HZ3 LYS 49 HZ3 LYS 49 39.409 -7.180 7.573
429 H HIS 50 HN HIS 50 45.617 -10.479 5.291
430 HA HIS 50 HA HIS 50 46.081 -12.929 6.665
431 HB2 HIS 50 HB2 HIS 50 46.249 -12.165 3.750
432 HB3 HIS 50 HB1 HIS 50 46.649 -13.783 4.312
433 HD1 HIS 50 HD1 HIS 50 44.091 -12.521 2.559
434 HD2 HIS 50 HD2 HIS 50 44.130 -14.305 6.311
435 HE1 HIS 50 HE1 HIS 50 41.763 -13.389 2.907
436 H HIS 51 HN HIS 51 48.123 -10.574 5.091
437 HA HIS 51 HA HIS 51 50.529 -12.097 5.291
438 HB2 HIS 51 HB2 HIS 51 50.249 -10.282 3.629
439 HB3 HIS 51 HB1 HIS 51 50.132 -9.109 4.930
440 HD1 HIS 51 HD1 HIS 51 52.573 -10.985 2.874
441 HD2 HIS 51 HD2 HIS 51 52.618 -8.568 6.256
442 HE1 HIS 51 HE1 HIS 51 54.980 -10.368 3.228
443 H GLY 52 HN GLY 52 48.684 -10.240 7.480
444 HA2 GLY 52 HA2 GLY 52 50.950 -9.763 9.241
445 HA3 GLY 52 HA1 GLY 52 49.323 -9.148 9.457
446 H THR 53 HN THR 53 47.987 -11.682 9.161
447 HA THR 53 HA THR 53 48.519 -12.611 11.862
448 HB THR 53 HB THR 53 46.198 -11.968 11.182
449 HG1 THR 53 HG1 THR 53 46.608 -13.441 12.927
450 HG21 THR 53 HG21 THR 53 46.169 -12.870 8.914
451 HG22 THR 53 HG22 THR 53 44.870 -13.582 9.870
452 HG23 THR 53 HG23 THR 53 46.335 -14.508 9.545
453 H THR 54 HN THR 54 48.791 -13.801 8.587
454 HA THR 54 HA THR 54 49.307 -16.503 9.621
455 HB THR 54 HB THR 54 48.860 -15.749 6.731
456 HG1 THR 54 HG1 THR 54 47.049 -16.239 8.832
457 HG21 THR 54 HG21 THR 54 48.278 -18.128 6.511
458 HG22 THR 54 HG22 THR 54 48.614 -18.368 8.226
459 HG23 THR 54 HG23 THR 54 49.919 -17.927 7.124
460 H GLN 55 HN GLN 55 50.537 -14.252 7.151
461 HA GLN 55 HA GLN 55 52.922 -15.784 6.769
462 HB2 GLN 55 HB2 GLN 55 52.357 -12.977 5.810
463 HB3 GLN 55 HB1 GLN 55 53.555 -14.094 5.174
464 HG2 GLN 55 HG2 GLN 55 50.563 -14.415 5.019
465 HG3 GLN 55 HG1 GLN 55 51.638 -13.963 3.699
466 HE21 GLN 55 HE21 GLN 55 52.909 -15.533 2.733
467 HE22 GLN 55 HE22 GLN 55 52.658 -17.222 2.998
468 H HIS 56 HN HIS 56 54.701 -15.711 7.939
469 HA HIS 56 HA HIS 56 55.048 -13.751 10.000
470 HB2 HIS 56 HB2 HIS 56 56.863 -15.961 8.999
471 HB3 HIS 56 HB1 HIS 56 57.274 -14.900 10.339
472 HD1 HIS 56 HD1 HIS 56 57.050 -16.278 12.399
473 HD2 HIS 56 HD2 HIS 56 53.909 -16.929 9.750
474 HE1 HIS 56 HE1 HIS 56 55.477 -17.828 13.584
475 H HIS 57 HN HIS 57 55.741 -11.801 9.648
476 HA HIS 57 HA HIS 57 57.484 -11.318 7.341
477 HB2 HIS 57 HB2 HIS 57 56.540 -8.953 7.420
478 HB3 HIS 57 HB1 HIS 57 55.428 -10.212 6.903
479 HD1 HIS 57 HD1 HIS 57 53.611 -10.974 8.743
480 HD2 HIS 57 HD2 HIS 57 55.708 -7.476 9.580
481 HE1 HIS 57 HE1 HIS 57 52.333 -9.844 10.582
Start of MODEL 15
1 H1 ALA 1 HT1 ALA 1 46.252 -2.244 -14.060
2 H2 ALA 1 HT2 ALA 1 47.469 -1.246 -13.446
3 H3 ALA 1 HT3 ALA 1 47.709 -2.921 -13.526
4 HA ALA 1 HA ALA 1 48.915 -1.799 -15.258
5 HB1 ALA 1 HB1 ALA 1 48.103 -3.124 -17.134
6 HB2 ALA 1 HB2 ALA 1 46.575 -3.390 -16.298
7 HB3 ALA 1 HB3 ALA 1 48.067 -4.067 -15.644
8 H SER 2 HN SER 2 48.321 -1.190 -17.699
9 HA SER 2 HA SER 2 47.845 0.494 -19.076
10 HB2 SER 2 HB2 SER 2 45.441 1.094 -19.359
11 HB3 SER 2 HB1 SER 2 45.732 -0.641 -19.327
12 HG SER 2 HG SER 2 43.913 0.247 -18.033
13 H MET 3 HN MET 3 45.520 1.792 -16.784
14 HA MET 3 HA MET 3 47.017 4.302 -16.846
15 HB2 MET 3 HB2 MET 3 44.255 3.661 -15.804
16 HB3 MET 3 HB1 MET 3 44.991 5.254 -15.742
17 HG2 MET 3 HG2 MET 3 45.084 5.330 -18.166
18 HG3 MET 3 HG1 MET 3 44.408 3.705 -18.255
19 HE1 MET 3 HE1 MET 3 43.767 7.447 -17.303
20 HE2 MET 3 HE2 MET 3 43.392 6.634 -15.783
21 HE3 MET 3 HE3 MET 3 42.107 7.406 -16.709
22 H GLY 4 HN GLY 4 46.308 1.683 -14.733
23 HA2 GLY 4 HA2 GLY 4 47.336 3.230 -12.448
24 HA3 GLY 4 HA1 GLY 4 46.302 1.816 -12.315
25 H LYS 5 HN LYS 5 49.512 2.982 -12.638
26 HA LYS 5 HA LYS 5 50.470 0.263 -12.175
27 HB2 LYS 5 HB2 LYS 5 52.345 0.498 -13.653
28 HB3 LYS 5 HB1 LYS 5 50.903 0.885 -14.570
29 HG2 LYS 5 HG2 LYS 5 52.665 2.998 -13.350
30 HG3 LYS 5 HG1 LYS 5 52.940 2.339 -14.960
31 HD2 LYS 5 HD2 LYS 5 50.669 3.062 -15.607
32 HD3 LYS 5 HD1 LYS 5 50.461 3.772 -14.004
33 HE2 LYS 5 HE2 LYS 5 51.097 5.472 -15.630
34 HE3 LYS 5 HE1 LYS 5 52.358 5.262 -14.417
35 HZ1 LYS 5 HZ1 LYS 5 53.279 5.432 -16.643
36 HZ2 LYS 5 HZ2 LYS 5 52.380 4.106 -17.159
37 HZ3 LYS 5 HZ3 LYS 5 53.594 3.904 -16.000
38 H SER 6 HN SER 6 52.100 0.082 -10.712
39 HA SER 6 HA SER 6 53.010 2.583 -9.478
40 HB2 SER 6 HB2 SER 6 52.893 1.314 -7.284
41 HB3 SER 6 HB1 SER 6 51.344 1.734 -8.015
42 HG SER 6 HG SER 6 51.979 -0.585 -7.222
43 H LYS 7 HN LYS 7 54.211 0.616 -11.424
44 HA LYS 7 HA LYS 7 56.284 -0.174 -11.922
45 HB2 LYS 7 HB2 LYS 7 56.940 2.012 -10.808
46 HB3 LYS 7 HB1 LYS 7 57.219 1.093 -9.340
47 HG2 LYS 7 HG2 LYS 7 58.942 -0.211 -10.492
48 HG3 LYS 7 HG1 LYS 7 58.659 0.726 -11.961
49 HD2 LYS 7 HD2 LYS 7 59.293 2.771 -10.771
50 HD3 LYS 7 HD1 LYS 7 59.583 1.826 -9.310
51 HE2 LYS 7 HE2 LYS 7 61.347 0.591 -10.432
52 HE3 LYS 7 HE1 LYS 7 61.027 1.463 -11.931
53 HZ1 LYS 7 HZ1 LYS 7 61.971 2.684 -9.392
54 HZ2 LYS 7 HZ2 LYS 7 61.667 3.515 -10.833
55 HZ3 LYS 7 HZ3 LYS 7 62.919 2.386 -10.761
56 H GLU 8 HN GLU 8 54.372 -1.538 -9.998
57 HA GLU 8 HA GLU 8 54.179 -3.546 -8.984
58 HB2 GLU 8 HB2 GLU 8 57.056 -3.937 -9.812
59 HB3 GLU 8 HB1 GLU 8 56.041 -5.187 -9.106
60 HG2 GLU 8 HG2 GLU 8 54.566 -5.136 -10.990
61 HG3 GLU 8 HG1 GLU 8 55.409 -3.744 -11.667
62 H ILE 9 HN ILE 9 57.338 -2.130 -8.164
63 HA ILE 9 HA ILE 9 57.158 -3.042 -5.453
64 HB ILE 9 HB ILE 9 59.159 -1.516 -5.090
65 HG12 ILE 9 HG12 ILE 9 59.000 -1.282 -8.110
66 HG13 ILE 9 HG11 ILE 9 58.714 0.029 -6.972
67 HG21 ILE 9 HG21 ILE 9 59.370 -3.902 -5.468
68 HG22 ILE 9 HG22 ILE 9 60.686 -3.031 -6.253
69 HG23 ILE 9 HG23 ILE 9 59.339 -3.647 -7.211
70 HD11 ILE 9 HD11 ILE 9 61.030 -0.126 -6.218
71 HD12 ILE 9 HD12 ILE 9 60.927 0.172 -7.954
72 HD13 ILE 9 HD13 ILE 9 61.311 -1.442 -7.357
73 H SER 10 HN SER 10 55.129 -2.193 -4.912
74 HA SER 10 HA SER 10 54.853 0.697 -4.682
75 HB2 SER 10 HB2 SER 10 52.850 -1.383 -3.834
76 HB3 SER 10 HB1 SER 10 52.559 0.282 -4.342
77 HG SER 10 HG SER 10 53.833 -0.921 -6.310
78 H GLN 11 HN GLN 11 56.854 -0.383 -3.080
79 HA GLN 11 HA GLN 11 56.219 -1.232 -0.524
80 HB2 GLN 11 HB2 GLN 11 58.507 0.482 -1.476
81 HB3 GLN 11 HB1 GLN 11 58.402 -0.175 0.149
82 HG2 GLN 11 HG2 GLN 11 58.433 -2.429 -0.736
83 HG3 GLN 11 HG1 GLN 11 58.466 -1.799 -2.382
84 HE21 GLN 11 HE21 GLN 11 60.403 -2.866 -2.784
85 HE22 GLN 11 HE22 GLN 11 61.910 -2.305 -2.152
86 H ASP 12 HN ASP 12 56.796 2.112 -1.582
87 HA ASP 12 HA ASP 12 56.228 3.273 0.924
88 HB2 ASP 12 HB2 ASP 12 57.516 4.430 -0.830
89 HB3 ASP 12 HB1 ASP 12 56.068 4.528 -1.824
90 H LEU 13 HN LEU 13 54.265 2.853 -1.988
91 HA LEU 13 HA LEU 13 51.945 4.149 -1.149
92 HB2 LEU 13 HB2 LEU 13 52.492 3.273 -3.460
93 HB3 LEU 13 HB1 LEU 13 52.056 1.680 -2.889
94 HG LEU 13 HG LEU 13 50.079 3.956 -2.816
95 HD11 LEU 13 HD11 LEU 13 49.241 3.174 -4.980
96 HD12 LEU 13 HD12 LEU 13 50.599 2.054 -5.098
97 HD13 LEU 13 HD13 LEU 13 50.887 3.794 -5.105
98 HD21 LEU 13 HD21 LEU 13 48.444 2.135 -2.911
99 HD22 LEU 13 HD22 LEU 13 49.524 1.940 -1.531
100 HD23 LEU 13 HD23 LEU 13 49.753 0.954 -2.976
101 H ARG 14 HN ARG 14 52.860 0.744 -0.805
102 HA ARG 14 HA ARG 14 50.568 -0.160 0.527
103 HB2 ARG 14 HB2 ARG 14 53.414 -1.084 0.434
104 HB3 ARG 14 HB1 ARG 14 52.264 -1.871 1.503
105 HG2 ARG 14 HG2 ARG 14 51.036 -2.745 -0.244
106 HG3 ARG 14 HG1 ARG 14 51.613 -1.531 -1.390
107 HD2 ARG 14 HD2 ARG 14 52.539 -3.907 -1.613
108 HD3 ARG 14 HD1 ARG 14 53.688 -2.571 -1.631
109 HE ARG 14 HE ARG 14 53.197 -3.850 0.939
110 HH11 ARG 14 HH11 ARG 14 55.261 -3.621 -1.896
111 HH12 ARG 14 HH12 ARG 14 56.660 -4.235 -1.077
112 HH21 ARG 14 HH21 ARG 14 55.052 -4.644 2.007
113 HH22 ARG 14 HH22 ARG 14 56.539 -4.821 1.138
114 H LYS 15 HN LYS 15 53.642 1.040 1.819
115 HA LYS 15 HA LYS 15 53.022 0.712 4.527
116 HB2 LYS 15 HB2 LYS 15 54.899 2.620 3.145
117 HB3 LYS 15 HB1 LYS 15 54.812 2.441 4.892
118 HG2 LYS 15 HG2 LYS 15 55.489 0.137 4.741
119 HG3 LYS 15 HG1 LYS 15 55.432 0.201 2.980
120 HD2 LYS 15 HD2 LYS 15 57.726 0.366 3.787
121 HD3 LYS 15 HD1 LYS 15 57.234 1.856 2.983
122 HE2 LYS 15 HE2 LYS 15 56.870 2.931 5.111
123 HE3 LYS 15 HE1 LYS 15 57.196 1.425 5.964
124 HZ1 LYS 15 HZ1 LYS 15 59.106 2.885 6.003
125 HZ2 LYS 15 HZ2 LYS 15 59.145 2.936 4.315
126 HZ3 LYS 15 HZ3 LYS 15 59.457 1.486 5.123
127 H LYS 16 HN LYS 16 52.250 3.285 2.292
128 HA LYS 16 HA LYS 16 51.376 5.126 4.294
129 HB2 LYS 16 HB2 LYS 16 50.759 5.045 1.336
130 HB3 LYS 16 HB1 LYS 16 50.418 6.394 2.408
131 HG2 LYS 16 HG2 LYS 16 53.168 5.321 1.811
132 HG3 LYS 16 HG1 LYS 16 52.435 6.725 1.035
133 HD2 LYS 16 HD2 LYS 16 52.324 7.882 3.152
134 HD3 LYS 16 HD1 LYS 16 52.921 6.454 3.998
135 HE2 LYS 16 HE2 LYS 16 54.658 8.196 3.607
136 HE3 LYS 16 HE1 LYS 16 55.050 6.622 2.918
137 HZ1 LYS 16 HZ1 LYS 16 54.581 7.376 0.764
138 HZ2 LYS 16 HZ2 LYS 16 55.464 8.633 1.476
139 HZ3 LYS 16 HZ3 LYS 16 53.790 8.765 1.320
140 H ILE 17 HN ILE 17 49.605 3.114 1.931
141 HA ILE 17 HA ILE 17 47.058 3.840 2.857
142 HB ILE 17 HB ILE 17 47.405 2.838 0.636
143 HG12 ILE 17 HG12 ILE 17 45.466 1.262 0.650
144 HG13 ILE 17 HG11 ILE 17 45.504 1.295 2.408
145 HG21 ILE 17 HG21 ILE 17 47.707 0.431 0.355
146 HG22 ILE 17 HG22 ILE 17 47.887 0.253 2.101
147 HG23 ILE 17 HG23 ILE 17 49.077 1.175 1.181
148 HD11 ILE 17 HD11 ILE 17 43.789 2.770 1.501
149 HD12 ILE 17 HD12 ILE 17 45.026 3.673 0.625
150 HD13 ILE 17 HD13 ILE 17 45.015 3.675 2.388
151 H VAL 18 HN VAL 18 49.124 1.101 3.784
152 HA VAL 18 HA VAL 18 47.196 -0.143 5.443
153 HB VAL 18 HB VAL 18 50.222 -0.324 5.519
154 HG11 VAL 18 HG11 VAL 18 49.284 -0.973 7.674
155 HG12 VAL 18 HG12 VAL 18 49.899 -2.384 6.812
156 HG13 VAL 18 HG13 VAL 18 48.164 -2.072 6.869
157 HG21 VAL 18 HG21 VAL 18 49.252 -1.105 3.426
158 HG22 VAL 18 HG22 VAL 18 48.139 -2.147 4.314
159 HG23 VAL 18 HG23 VAL 18 49.873 -2.463 4.365
160 H ASP 19 HN ASP 19 49.761 2.203 6.096
161 HA ASP 19 HA ASP 19 49.534 2.276 8.890
162 HB2 ASP 19 HB2 ASP 19 51.435 3.267 7.757
163 HB3 ASP 19 HB1 ASP 19 50.394 4.438 6.960
164 H LEU 20 HN LEU 20 47.987 4.282 6.414
165 HA LEU 20 HA LEU 20 46.551 5.886 8.238
166 HB2 LEU 20 HB2 LEU 20 46.439 5.419 5.310
167 HB3 LEU 20 HB1 LEU 20 45.062 6.190 6.068
168 HG LEU 20 HG LEU 20 46.576 7.845 5.127
169 HD11 LEU 20 HD11 LEU 20 45.301 8.405 7.127
170 HD12 LEU 20 HD12 LEU 20 46.834 9.271 7.053
171 HD13 LEU 20 HD13 LEU 20 46.653 7.889 8.133
172 HD21 LEU 20 HD21 LEU 20 48.667 6.612 5.266
173 HD22 LEU 20 HD22 LEU 20 48.636 6.733 7.025
174 HD23 LEU 20 HD23 LEU 20 48.818 8.188 6.043
175 H HIS 21 HN HIS 21 45.900 2.728 6.946
176 HA HIS 21 HA HIS 21 43.103 2.764 7.429
177 HB2 HIS 21 HB2 HIS 21 45.079 0.635 6.828
178 HB3 HIS 21 HB1 HIS 21 43.583 0.132 7.610
179 HD1 HIS 21 HD1 HIS 21 41.385 1.453 6.275
180 HD2 HIS 21 HD2 HIS 21 44.804 0.418 4.153
181 HE1 HIS 21 HE1 HIS 21 40.693 1.413 3.869
182 H LYS 22 HN LYS 22 45.843 2.218 9.490
183 HA LYS 22 HA LYS 22 44.107 1.326 11.642
184 HB2 LYS 22 HB2 LYS 22 47.049 1.494 11.277
185 HB3 LYS 22 HB1 LYS 22 46.441 1.664 12.916
186 HG2 LYS 22 HG2 LYS 22 46.929 -0.620 12.656
187 HG3 LYS 22 HG1 LYS 22 45.176 -0.496 12.534
188 HD2 LYS 22 HD2 LYS 22 45.802 -1.953 10.800
189 HD3 LYS 22 HD1 LYS 22 45.532 -0.400 10.007
190 HE2 LYS 22 HE2 LYS 22 47.559 -1.422 9.163
191 HE3 LYS 22 HE1 LYS 22 47.954 0.034 10.073
192 HZ1 LYS 22 HZ1 LYS 22 49.450 -1.782 10.605
193 HZ2 LYS 22 HZ2 LYS 22 48.157 -2.751 11.085
194 HZ3 LYS 22 HZ3 LYS 22 48.543 -1.363 11.968
195 H SER 23 HN SER 23 45.146 4.215 10.327
196 HA SER 23 HA SER 23 45.020 5.749 12.762
197 HB2 SER 23 HB2 SER 23 45.002 6.742 9.900
198 HB3 SER 23 HB1 SER 23 45.405 7.661 11.352
199 HG SER 23 HG SER 23 47.105 5.961 11.612
200 H GLY 24 HN GLY 24 43.052 5.410 9.802
201 HA2 GLY 24 HA2 GLY 24 40.749 5.244 9.643
202 HA3 GLY 24 HA1 GLY 24 40.634 5.507 11.370
203 H SER 25 HN SER 25 41.709 7.981 11.710
204 HA SER 25 HA SER 25 39.539 9.612 11.114
205 HB2 SER 25 HB2 SER 25 41.109 10.020 12.976
206 HB3 SER 25 HB1 SER 25 42.333 10.523 11.815
207 HG SER 25 HG SER 25 41.027 12.230 12.839
208 H SER 26 HN SER 26 42.657 9.409 9.413
209 HA SER 26 HA SER 26 41.710 11.401 7.498
210 HB2 SER 26 HB2 SER 26 44.418 10.081 7.750
211 HB3 SER 26 HB1 SER 26 44.013 11.397 6.648
212 HG SER 26 HG SER 26 43.261 12.373 8.832
213 H LEU 27 HN LEU 27 40.730 8.520 7.656
214 HA LEU 27 HA LEU 27 41.734 7.170 5.365
215 HB2 LEU 27 HB2 LEU 27 40.372 6.268 7.406
216 HB3 LEU 27 HB1 LEU 27 38.973 6.731 6.465
217 HG LEU 27 HG LEU 27 39.543 4.319 6.298
218 HD11 LEU 27 HD11 LEU 27 39.762 5.836 3.710
219 HD12 LEU 27 HD12 LEU 27 38.270 5.362 4.521
220 HD13 LEU 27 HD13 LEU 27 39.354 4.128 3.878
221 HD21 LEU 27 HD21 LEU 27 41.984 4.574 6.429
222 HD22 LEU 27 HD22 LEU 27 41.980 5.272 4.808
223 HD23 LEU 27 HD23 LEU 27 41.478 3.602 5.050
224 H GLY 28 HN GLY 28 38.844 9.145 5.947
225 HA2 GLY 28 HA2 GLY 28 37.798 9.000 3.335
226 HA3 GLY 28 HA1 GLY 28 37.459 10.271 4.501
227 H ALA 29 HN ALA 29 40.157 11.119 4.810
228 HA ALA 29 HA ALA 29 40.338 13.022 2.768
229 HB1 ALA 29 HB1 ALA 29 42.474 13.629 3.757
230 HB2 ALA 29 HB2 ALA 29 42.496 12.121 4.671
231 HB3 ALA 29 HB3 ALA 29 41.270 13.341 5.014
232 H ILE 30 HN ILE 30 42.331 10.107 3.359
233 HA ILE 30 HA ILE 30 43.882 10.536 1.016
234 HB ILE 30 HB ILE 30 44.817 8.300 1.359
235 HG12 ILE 30 HG12 ILE 30 42.985 8.073 3.752
236 HG13 ILE 30 HG11 ILE 30 42.661 7.289 2.211
237 HG21 ILE 30 HG21 ILE 30 45.727 10.218 2.563
238 HG22 ILE 30 HG22 ILE 30 45.873 8.737 3.504
239 HG23 ILE 30 HG23 ILE 30 44.617 9.911 3.899
240 HD11 ILE 30 HD11 ILE 30 45.067 6.822 3.952
241 HD12 ILE 30 HD12 ILE 30 44.728 6.022 2.418
242 HD13 ILE 30 HD13 ILE 30 43.670 5.758 3.804
243 H SER 31 HN SER 31 40.975 8.644 1.640
244 HA SER 31 HA SER 31 41.103 7.150 -0.751
245 HB2 SER 31 HB2 SER 31 38.584 6.872 -0.376
246 HB3 SER 31 HB1 SER 31 39.649 6.299 0.905
247 HG SER 31 HG SER 31 39.121 8.005 2.142
248 H LYS 32 HN LYS 32 39.884 10.344 -0.024
249 HA LYS 32 HA LYS 32 38.746 10.688 -2.660
250 HB2 LYS 32 HB2 LYS 32 39.215 12.647 -0.406
251 HB3 LYS 32 HB1 LYS 32 38.395 13.042 -1.909
252 HG2 LYS 32 HG2 LYS 32 36.626 11.486 -1.409
253 HG3 LYS 32 HG1 LYS 32 37.476 10.938 0.037
254 HD2 LYS 32 HD2 LYS 32 37.286 13.193 0.990
255 HD3 LYS 32 HD1 LYS 32 36.418 13.723 -0.452
256 HE2 LYS 32 HE2 LYS 32 34.628 12.151 0.018
257 HE3 LYS 32 HE1 LYS 32 35.511 11.531 1.412
258 HZ1 LYS 32 HZ1 LYS 32 33.774 13.119 2.030
259 HZ2 LYS 32 HZ2 LYS 32 34.542 14.324 1.126
260 HZ3 LYS 32 HZ3 LYS 32 35.309 13.663 2.475
261 H ARG 33 HN ARG 33 41.634 11.698 -0.908
262 HA ARG 33 HA ARG 33 42.736 13.389 -2.874
263 HB2 ARG 33 HB2 ARG 33 43.620 13.518 -0.682
264 HB3 ARG 33 HB1 ARG 33 43.937 11.793 -0.625
265 HG2 ARG 33 HG2 ARG 33 45.699 12.090 -2.324
266 HG3 ARG 33 HG1 ARG 33 45.407 13.831 -2.283
267 HD2 ARG 33 HD2 ARG 33 46.116 13.993 -0.039
268 HD3 ARG 33 HD1 ARG 33 46.086 12.243 0.176
269 HE ARG 33 HE ARG 33 47.915 13.097 -1.856
270 HH11 ARG 33 HH11 ARG 33 47.519 12.680 1.607
271 HH12 ARG 33 HH12 ARG 33 49.202 12.425 1.909
272 HH21 ARG 33 HH21 ARG 33 50.157 12.758 -1.464
273 HH22 ARG 33 HH22 ARG 33 50.717 12.494 0.148
274 H LEU 34 HN LEU 34 43.161 9.923 -2.280
275 HA LEU 34 HA LEU 34 44.926 9.625 -4.546
276 HB2 LEU 34 HB2 LEU 34 45.203 8.259 -2.515
277 HB3 LEU 34 HB1 LEU 34 43.619 7.558 -2.771
278 HG LEU 34 HG LEU 34 44.448 6.549 -4.886
279 HD11 LEU 34 HD11 LEU 34 47.115 7.598 -3.954
280 HD12 LEU 34 HD12 LEU 34 46.231 8.113 -5.391
281 HD13 LEU 34 HD13 LEU 34 46.862 6.470 -5.285
282 HD21 LEU 34 HD21 LEU 34 46.019 5.858 -2.405
283 HD22 LEU 34 HD22 LEU 34 45.805 4.817 -3.813
284 HD23 LEU 34 HD23 LEU 34 44.415 5.257 -2.822
285 H LYS 35 HN LYS 35 41.569 9.424 -3.852
286 HA LYS 35 HA LYS 35 39.724 8.901 -5.026
287 HB2 LYS 35 HB2 LYS 35 40.670 10.656 -6.523
288 HB3 LYS 35 HB1 LYS 35 41.465 9.398 -7.455
289 HG2 LYS 35 HG2 LYS 35 39.300 8.463 -8.069
290 HG3 LYS 35 HG1 LYS 35 38.486 9.694 -7.103
291 HD2 LYS 35 HD2 LYS 35 40.286 10.261 -9.460
292 HD3 LYS 35 HD1 LYS 35 38.523 10.221 -9.526
293 HE2 LYS 35 HE2 LYS 35 38.413 12.050 -7.915
294 HE3 LYS 35 HE1 LYS 35 40.171 12.072 -7.806
295 HZ1 LYS 35 HZ1 LYS 35 39.319 13.795 -9.270
296 HZ2 LYS 35 HZ2 LYS 35 38.609 12.628 -10.262
297 HZ3 LYS 35 HZ3 LYS 35 40.292 12.701 -10.114
298 H VAL 36 HN VAL 36 40.319 6.768 -4.085
299 HA VAL 36 HA VAL 36 40.786 4.806 -6.211
300 HB VAL 36 HB VAL 36 42.592 4.706 -4.612
301 HG11 VAL 36 HG11 VAL 36 40.494 4.370 -2.474
302 HG12 VAL 36 HG12 VAL 36 41.539 5.771 -2.711
303 HG13 VAL 36 HG13 VAL 36 42.235 4.224 -2.232
304 HG21 VAL 36 HG21 VAL 36 42.415 2.382 -3.830
305 HG22 VAL 36 HG22 VAL 36 41.850 2.566 -5.491
306 HG23 VAL 36 HG23 VAL 36 40.685 2.408 -4.176
307 HA PRO 37 HA PRO 37 36.509 3.708 -5.599
308 HB2 PRO 37 HB2 PRO 37 36.708 1.258 -6.897
309 HB3 PRO 37 HB1 PRO 37 36.388 2.803 -7.689
310 HG2 PRO 37 HG2 PRO 37 38.950 1.300 -7.425
311 HG3 PRO 37 HG1 PRO 37 38.340 2.248 -8.792
312 HD2 PRO 37 HD2 PRO 37 40.238 3.187 -7.144
313 HD3 PRO 37 HD1 PRO 37 39.012 4.255 -7.859
314 H ARG 38 HN ARG 38 35.356 2.418 -4.248
315 HA ARG 38 HA ARG 38 36.550 1.390 -1.965
316 HB2 ARG 38 HB2 ARG 38 34.206 2.105 -2.106
317 HB3 ARG 38 HB1 ARG 38 33.840 0.728 -3.128
318 HG2 ARG 38 HG2 ARG 38 34.356 -0.787 -1.288
319 HG3 ARG 38 HG1 ARG 38 34.749 0.594 -0.260
320 HD2 ARG 38 HD2 ARG 38 32.470 -0.251 0.144
321 HD3 ARG 38 HD1 ARG 38 32.472 1.414 -0.439
322 HE ARG 38 HE ARG 38 32.189 -0.533 -2.531
323 HH11 ARG 38 HH11 ARG 38 30.436 1.351 -0.146
324 HH12 ARG 38 HH12 ARG 38 28.937 1.273 -0.997
325 HH21 ARG 38 HH21 ARG 38 30.199 -0.629 -3.669
326 HH22 ARG 38 HH22 ARG 38 28.800 0.147 -3.017
327 H SER 39 HN SER 39 35.444 -0.304 -4.863
328 HA SER 39 HA SER 39 35.856 -2.926 -3.975
329 HB2 SER 39 HB2 SER 39 36.125 -1.917 -6.808
330 HB3 SER 39 HB1 SER 39 35.694 -3.549 -6.290
331 HG SER 39 HG SER 39 33.860 -2.312 -6.881
332 H SER 40 HN SER 40 38.098 -0.539 -5.214
333 HA SER 40 HA SER 40 40.210 -2.455 -5.627
334 HB2 SER 40 HB2 SER 40 40.075 -0.440 -7.040
335 HB3 SER 40 HB1 SER 40 40.305 0.575 -5.617
336 HG SER 40 HG SER 40 42.345 -0.637 -5.354
337 H VAL 41 HN VAL 41 39.095 -0.344 -3.109
338 HA VAL 41 HA VAL 41 41.445 -0.395 -1.516
339 HB VAL 41 HB VAL 41 38.565 -0.025 -0.632
340 HG11 VAL 41 HG11 VAL 41 39.524 1.113 1.319
341 HG12 VAL 41 HG12 VAL 41 41.145 0.706 0.754
342 HG13 VAL 41 HG13 VAL 41 40.030 -0.575 1.232
343 HG21 VAL 41 HG21 VAL 41 39.194 1.619 -2.313
344 HG22 VAL 41 HG22 VAL 41 40.642 2.027 -1.394
345 HG23 VAL 41 HG23 VAL 41 39.048 2.381 -0.729
346 H GLN 42 HN GLN 42 38.512 -2.353 -1.648
347 HA GLN 42 HA GLN 42 38.988 -3.984 0.561
348 HB2 GLN 42 HB2 GLN 42 36.836 -3.829 -0.653
349 HB3 GLN 42 HB1 GLN 42 37.547 -4.721 -1.990
350 HG2 GLN 42 HG2 GLN 42 36.170 -6.148 -0.574
351 HG3 GLN 42 HG1 GLN 42 37.858 -6.658 -0.570
352 HE21 GLN 42 HE21 GLN 42 37.684 -7.710 1.369
353 HE22 GLN 42 HE22 GLN 42 37.516 -6.889 2.881
354 H THR 43 HN THR 43 40.053 -4.342 -2.810
355 HA THR 43 HA THR 43 41.148 -6.923 -2.452
356 HB THR 43 HB THR 43 42.504 -6.295 -4.557
357 HG1 THR 43 HG1 THR 43 42.110 -3.943 -4.126
358 HG21 THR 43 HG21 THR 43 40.519 -6.544 -5.987
359 HG22 THR 43 HG22 THR 43 39.483 -6.184 -4.606
360 HG23 THR 43 HG23 THR 43 40.466 -7.648 -4.612
361 H ILE 44 HN ILE 44 42.319 -3.766 -1.672
362 HA ILE 44 HA ILE 44 45.079 -4.627 -1.464
363 HB ILE 44 HB ILE 44 43.777 -2.003 -0.694
364 HG12 ILE 44 HG12 ILE 44 43.749 -2.390 -3.106
365 HG13 ILE 44 HG11 ILE 44 44.897 -1.118 -2.706
366 HG21 ILE 44 HG21 ILE 44 46.705 -2.724 -0.806
367 HG22 ILE 44 HG22 ILE 44 45.766 -2.392 0.650
368 HG23 ILE 44 HG23 ILE 44 46.055 -1.109 -0.525
369 HD11 ILE 44 HD11 ILE 44 45.558 -3.979 -3.382
370 HD12 ILE 44 HD12 ILE 44 46.730 -2.749 -2.913
371 HD13 ILE 44 HD13 ILE 44 45.810 -2.565 -4.406
372 H VAL 45 HN VAL 45 42.446 -3.667 0.730
373 HA VAL 45 HA VAL 45 43.960 -3.970 3.088
374 HB VAL 45 HB VAL 45 41.806 -4.015 4.308
375 HG11 VAL 45 HG11 VAL 45 41.031 -1.797 3.607
376 HG12 VAL 45 HG12 VAL 45 41.999 -1.939 2.140
377 HG13 VAL 45 HG13 VAL 45 42.787 -1.890 3.716
378 HG21 VAL 45 HG21 VAL 45 39.712 -3.720 3.050
379 HG22 VAL 45 HG22 VAL 45 40.459 -5.295 2.769
380 HG23 VAL 45 HG23 VAL 45 40.602 -4.021 1.557
381 H ARG 46 HN ARG 46 41.951 -6.227 1.295
382 HA ARG 46 HA ARG 46 42.150 -8.326 3.208
383 HB2 ARG 46 HB2 ARG 46 40.337 -8.211 1.561
384 HB3 ARG 46 HB1 ARG 46 41.495 -8.397 0.256
385 HG2 ARG 46 HG2 ARG 46 41.992 -10.647 0.956
386 HG3 ARG 46 HG1 ARG 46 40.961 -10.466 2.378
387 HD2 ARG 46 HD2 ARG 46 39.010 -10.217 0.993
388 HD3 ARG 46 HD1 ARG 46 39.997 -10.217 -0.466
389 HE ARG 46 HE ARG 46 40.555 -12.599 0.760
390 HH11 ARG 46 HH11 ARG 46 37.623 -11.026 -0.344
391 HH12 ARG 46 HH12 ARG 46 36.833 -12.501 -0.769
392 HH21 ARG 46 HH21 ARG 46 39.522 -14.557 0.190
393 HH22 ARG 46 HH22 ARG 46 37.926 -14.529 -0.477
394 H LYS 47 HN LYS 47 44.153 -7.156 0.640
395 HA LYS 47 HA LYS 47 45.680 -9.491 0.225
396 HB2 LYS 47 HB2 LYS 47 45.606 -7.642 -1.396
397 HB3 LYS 47 HB1 LYS 47 46.456 -6.613 -0.253
398 HG2 LYS 47 HG2 LYS 47 48.408 -8.032 -0.369
399 HG3 LYS 47 HG1 LYS 47 47.558 -9.155 -1.430
400 HD2 LYS 47 HD2 LYS 47 47.329 -7.353 -3.100
401 HD3 LYS 47 HD1 LYS 47 48.256 -6.286 -2.043
402 HE2 LYS 47 HE2 LYS 47 50.178 -7.738 -2.195
403 HE3 LYS 47 HE1 LYS 47 49.258 -8.912 -3.133
404 HZ1 LYS 47 HZ1 LYS 47 49.950 -6.157 -3.984
405 HZ2 LYS 47 HZ2 LYS 47 49.025 -7.248 -4.878
406 HZ3 LYS 47 HZ3 LYS 47 50.647 -7.587 -4.559
407 H TYR 48 HN TYR 48 46.209 -6.620 2.296
408 HA TYR 48 HA TYR 48 48.673 -7.733 3.230
409 HB2 TYR 48 HB2 TYR 48 48.952 -5.819 4.638
410 HB3 TYR 48 HB1 TYR 48 48.344 -5.265 3.093
411 HD1 TYR 48 HD1 TYR 48 47.234 -6.074 6.565
412 HD2 TYR 48 HD2 TYR 48 46.516 -3.804 3.040
413 HE1 TYR 48 HE1 TYR 48 45.529 -4.775 7.759
414 HE2 TYR 48 HE2 TYR 48 44.799 -2.501 4.228
415 HH TYR 48 HH TYR 48 43.308 -2.751 6.189
416 H LYS 49 HN LYS 49 45.472 -8.311 4.024
417 HA LYS 49 HA LYS 49 45.767 -8.986 6.763
418 HB2 LYS 49 HB2 LYS 49 43.842 -9.946 4.643
419 HB3 LYS 49 HB1 LYS 49 43.769 -10.504 6.306
420 HG2 LYS 49 HG2 LYS 49 43.520 -7.632 5.441
421 HG3 LYS 49 HG1 LYS 49 42.168 -8.704 5.810
422 HD2 LYS 49 HD2 LYS 49 43.061 -8.995 8.092
423 HD3 LYS 49 HD1 LYS 49 44.353 -7.855 7.712
424 HE2 LYS 49 HE2 LYS 49 42.712 -6.106 7.313
425 HE3 LYS 49 HE1 LYS 49 41.404 -7.244 7.631
426 HZ1 LYS 49 HZ1 LYS 49 43.473 -6.410 9.589
427 HZ2 LYS 49 HZ2 LYS 49 42.203 -7.480 9.893
428 HZ3 LYS 49 HZ3 LYS 49 41.879 -5.858 9.548
429 H HIS 50 HN HIS 50 45.958 -10.892 3.790
430 HA HIS 50 HA HIS 50 46.785 -13.267 5.169
431 HB2 HIS 50 HB2 HIS 50 45.521 -13.304 3.010
432 HB3 HIS 50 HB1 HIS 50 46.942 -12.652 2.207
433 HD1 HIS 50 HD1 HIS 50 45.401 -15.802 3.277
434 HD2 HIS 50 HD2 HIS 50 49.198 -14.502 2.194
435 HE1 HIS 50 HE1 HIS 50 46.707 -17.884 2.781
436 H HIS 51 HN HIS 51 48.392 -10.850 3.118
437 HA HIS 51 HA HIS 51 50.938 -12.071 3.230
438 HB2 HIS 51 HB2 HIS 51 49.953 -9.381 2.402
439 HB3 HIS 51 HB1 HIS 51 51.681 -9.607 2.647
440 HD1 HIS 51 HD1 HIS 51 48.835 -10.781 0.445
441 HD2 HIS 51 HD2 HIS 51 52.985 -11.033 0.669
442 HE1 HIS 51 HE1 HIS 51 49.570 -11.753 -1.740
443 H GLY 52 HN GLY 52 49.402 -9.668 5.292
444 HA2 GLY 52 HA2 GLY 52 51.766 -9.024 6.735
445 HA3 GLY 52 HA1 GLY 52 50.116 -8.699 7.243
446 H THR 53 HN THR 53 49.952 -11.851 6.696
447 HA THR 53 HA THR 53 50.767 -12.501 9.446
448 HB THR 53 HB THR 53 48.530 -13.819 7.901
449 HG1 THR 53 HG1 THR 53 47.562 -11.949 8.268
450 HG21 THR 53 HG21 THR 53 49.218 -13.776 10.849
451 HG22 THR 53 HG22 THR 53 49.470 -15.136 9.755
452 HG23 THR 53 HG23 THR 53 47.833 -14.593 10.126
453 H THR 54 HN THR 54 50.580 -13.763 6.116
454 HA THR 54 HA THR 54 52.000 -16.162 7.008
455 HB THR 54 HB THR 54 50.705 -15.724 4.317
456 HG1 THR 54 HG1 THR 54 49.668 -16.872 6.720
457 HG21 THR 54 HG21 THR 54 50.666 -18.187 4.274
458 HG22 THR 54 HG22 THR 54 51.484 -18.226 5.836
459 HG23 THR 54 HG23 THR 54 52.315 -17.580 4.422
460 H GLN 55 HN GLN 55 52.611 -13.260 5.192
461 HA GLN 55 HA GLN 55 54.587 -14.236 3.434
462 HB2 GLN 55 HB2 GLN 55 53.627 -12.036 3.107
463 HB3 GLN 55 HB1 GLN 55 54.291 -11.485 4.634
464 HG2 GLN 55 HG2 GLN 55 56.563 -11.844 3.719
465 HG3 GLN 55 HG1 GLN 55 55.829 -12.246 2.167
466 HE21 GLN 55 HE21 GLN 55 56.454 -9.729 4.477
467 HE22 GLN 55 HE22 GLN 55 56.108 -8.405 3.425
468 H HIS 56 HN HIS 56 54.959 -12.729 6.642
469 HA HIS 56 HA HIS 56 57.740 -13.550 6.690
470 HB2 HIS 56 HB2 HIS 56 57.227 -11.376 7.657
471 HB3 HIS 56 HB1 HIS 56 56.063 -12.101 8.757
472 HD1 HIS 56 HD1 HIS 56 59.797 -12.297 8.053
473 HD2 HIS 56 HD2 HIS 56 57.105 -12.704 11.190
474 HE1 HIS 56 HE1 HIS 56 61.204 -12.662 10.097
475 H HIS 57 HN HIS 57 54.682 -14.373 8.187
476 HA HIS 57 HA HIS 57 53.937 -16.214 9.253
477 HB2 HIS 57 HB2 HIS 57 55.030 -17.448 7.394
478 HB3 HIS 57 HB1 HIS 57 56.516 -17.517 8.333
479 HD1 HIS 57 HD1 HIS 57 56.766 -19.461 9.879
480 HD2 HIS 57 HD2 HIS 57 52.850 -18.953 8.599
481 HE1 HIS 57 HE1 HIS 57 55.521 -21.470 10.723