Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
610724 | 2n9r RC | 25916 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H2 PRO 1 HT1 PRO 1 1.817 1.288 -1.055
2 H3 PRO 1 HT2 PRO 1 0.884 1.240 -2.475
3 HA PRO 1 HA PRO 1 2.630 1.750 -3.703
4 HB2 PRO 1 HB2 PRO 1 3.600 4.006 -2.051
5 HB3 PRO 1 HB1 PRO 1 3.122 3.979 -3.762
6 HG2 PRO 1 HG2 PRO 1 1.589 5.095 -1.870
7 HG3 PRO 1 HG1 PRO 1 0.912 4.282 -3.291
8 HD2 PRO 1 HD2 PRO 1 1.072 3.308 -0.463
9 HD3 PRO 1 HD1 PRO 1 -0.189 3.024 -1.679
10 H LYS 2 HN LYS 2 5.143 2.930 -2.848
11 HA LYS 2 HA LYS 2 6.496 0.610 -1.975
12 HB2 LYS 2 HB2 LYS 2 8.135 2.804 -1.305
13 HB3 LYS 2 HB1 LYS 2 8.221 1.815 -2.755
14 HG2 LYS 2 HG2 LYS 2 8.011 4.055 -3.530
15 HG3 LYS 2 HG1 LYS 2 6.414 3.341 -3.742
16 HD2 LYS 2 HD2 LYS 2 5.483 4.799 -2.279
17 HD3 LYS 2 HD1 LYS 2 6.722 4.478 -1.069
18 HE2 LYS 2 HE2 LYS 2 6.938 6.390 -3.410
19 HE3 LYS 2 HE1 LYS 2 6.803 6.827 -1.708
20 HZ1 LYS 2 HZ1 LYS 2 9.119 6.527 -3.029
21 HZ2 LYS 2 HZ2 LYS 2 8.960 5.001 -2.306
22 HZ3 LYS 2 HZ3 LYS 2 8.952 6.400 -1.345
23 H ILE 3 HN ILE 3 6.013 -0.268 -0.044
24 HA ILE 3 HA ILE 3 5.364 1.361 2.237
25 HB ILE 3 HB ILE 3 5.349 -0.843 3.462
26 HG12 ILE 3 HG12 ILE 3 6.998 -1.838 1.663
27 HG13 ILE 3 HG11 ILE 3 5.755 -2.861 2.375
28 HG21 ILE 3 HG21 ILE 3 3.299 0.064 2.554
29 HG22 ILE 3 HG22 ILE 3 3.325 -1.664 2.204
30 HG23 ILE 3 HG23 ILE 3 3.711 -0.501 0.937
31 HD11 ILE 3 HD11 ILE 3 4.710 -3.135 0.401
32 HD12 ILE 3 HD12 ILE 3 6.144 -2.439 -0.346
33 HD13 ILE 3 HD13 ILE 3 4.763 -1.413 0.039
34 H LEU 4 HN LEU 4 6.546 0.352 4.375
35 HA LEU 4 HA LEU 4 8.948 1.687 4.619
36 HB2 LEU 4 HB2 LEU 4 9.250 -0.191 6.504
37 HB3 LEU 4 HB1 LEU 4 8.089 1.128 6.662
38 HG LEU 4 HG LEU 4 7.111 -1.235 5.160
39 HD11 LEU 4 HD11 LEU 4 8.273 -2.482 6.825
40 HD12 LEU 4 HD12 LEU 4 6.591 -2.401 7.361
41 HD13 LEU 4 HD13 LEU 4 7.809 -1.353 8.095
42 HD21 LEU 4 HD21 LEU 4 5.920 0.964 6.053
43 HD22 LEU 4 HD22 LEU 4 5.777 0.021 7.534
44 HD23 LEU 4 HD23 LEU 4 5.064 -0.580 6.039
45 H ASN 5 HN ASN 5 8.463 -1.765 3.942
46 HA ASN 5 HA ASN 5 11.145 -2.564 4.028
47 HB2 ASN 5 HB2 ASN 5 9.450 -3.796 1.918
48 HB3 ASN 5 HB1 ASN 5 10.466 -4.558 3.141
49 HD21 ASN 5 HD21 ASN 5 7.244 -3.994 2.316
50 HD22 ASN 5 HD22 ASN 5 6.552 -4.251 3.846
51 H LYS 6 HN LYS 6 9.262 -1.181 1.380
52 HA LYS 6 HA LYS 6 11.277 -1.441 -0.601
53 HB2 LYS 6 HB2 LYS 6 9.194 0.739 -0.534
54 HB3 LYS 6 HB1 LYS 6 9.919 -0.041 -1.939
55 HG2 LYS 6 HG2 LYS 6 7.891 -1.176 -0.006
56 HG3 LYS 6 HG1 LYS 6 7.758 -1.031 -1.751
57 HD2 LYS 6 HD2 LYS 6 9.714 -2.860 -0.319
58 HD3 LYS 6 HD1 LYS 6 8.189 -3.372 -1.029
59 HE2 LYS 6 HE2 LYS 6 10.596 -2.239 -2.480
60 HE3 LYS 6 HE1 LYS 6 9.907 -3.853 -2.644
61 HZ1 LYS 6 HZ1 LYS 6 9.182 -2.543 -4.469
62 HZ2 LYS 6 HZ2 LYS 6 8.669 -1.286 -3.456
63 HZ3 LYS 6 HZ3 LYS 6 7.848 -2.773 -3.454
64 H ILE 7 HN ILE 7 10.318 1.276 1.517
65 HA ILE 7 HA ILE 7 12.301 3.070 0.619
66 HB ILE 7 HB ILE 7 11.562 3.045 3.514
67 HG12 ILE 7 HG12 ILE 7 9.420 2.510 2.591
68 HG13 ILE 7 HG11 ILE 7 9.419 4.248 2.860
69 HG21 ILE 7 HG21 ILE 7 11.871 5.143 1.352
70 HG22 ILE 7 HG22 ILE 7 12.936 4.857 2.729
71 HG23 ILE 7 HG23 ILE 7 11.319 5.513 2.987
72 HD11 ILE 7 HD11 ILE 7 8.610 4.190 0.696
73 HD12 ILE 7 HD12 ILE 7 9.519 2.740 0.278
74 HD13 ILE 7 HD13 ILE 7 10.337 4.299 0.370
75 H LEU 8 HN LEU 8 12.231 0.629 3.130
76 HA LEU 8 HA LEU 8 14.823 1.019 4.173
77 HB2 LEU 8 HB2 LEU 8 12.747 -0.987 4.397
78 HB3 LEU 8 HB1 LEU 8 14.322 -1.754 4.238
79 HG LEU 8 HG LEU 8 13.885 -1.359 6.591
80 HD11 LEU 8 HD11 LEU 8 16.164 -0.698 5.324
81 HD12 LEU 8 HD12 LEU 8 15.961 -0.526 7.069
82 HD13 LEU 8 HD13 LEU 8 15.755 0.874 6.016
83 HD21 LEU 8 HD21 LEU 8 12.444 0.814 5.791
84 HD22 LEU 8 HD22 LEU 8 13.926 1.591 6.348
85 HD23 LEU 8 HD23 LEU 8 13.005 0.562 7.446
86 H GLY 9 HN GLY 9 13.586 -1.020 1.564
87 HA2 GLY 9 HA2 GLY 9 15.988 -2.246 0.790
88 HA3 GLY 9 HA1 GLY 9 14.618 -1.938 -0.279
89 H LYS 10 HN LYS 10 14.616 0.931 0.088
90 HA LYS 10 HA LYS 10 16.440 1.643 -1.962
91 HB2 LYS 10 HB2 LYS 10 14.346 2.927 -0.487
92 HB3 LYS 10 HB1 LYS 10 15.769 3.964 -0.447
93 HG2 LYS 10 HG2 LYS 10 14.511 4.537 -2.426
94 HG3 LYS 10 HG1 LYS 10 15.953 3.669 -2.952
95 HD2 LYS 10 HD2 LYS 10 14.747 1.696 -3.418
96 HD3 LYS 10 HD1 LYS 10 13.375 2.190 -2.424
97 HE2 LYS 10 HE2 LYS 10 12.931 2.372 -4.886
98 HE3 LYS 10 HE1 LYS 10 12.764 3.906 -4.033
99 HZ1 LYS 10 HZ1 LYS 10 15.105 3.005 -5.624
100 HZ2 LYS 10 HZ2 LYS 10 15.081 4.418 -4.689
101 HZ3 LYS 10 HZ3 LYS 10 14.031 4.256 -6.012
102 H ILE 11 HN ILE 11 16.490 2.053 1.561
103 HA ILE 11 HA ILE 11 18.928 3.457 1.711
104 HB ILE 11 HB ILE 11 18.149 1.444 3.797
105 HG12 ILE 11 HG12 ILE 11 16.002 2.389 3.270
106 HG13 ILE 11 HG11 ILE 11 16.582 3.237 4.700
107 HG21 ILE 11 HG21 ILE 11 18.815 3.391 5.270
108 HG22 ILE 11 HG22 ILE 11 19.270 4.263 3.806
109 HG23 ILE 11 HG23 ILE 11 20.117 2.782 4.252
110 HD11 ILE 11 HD11 ILE 11 16.351 4.232 1.879
111 HD12 ILE 11 HD12 ILE 11 17.601 4.906 2.922
112 HD13 ILE 11 HD13 ILE 11 15.906 5.030 3.387
113 H LEU 12 HN LEU 12 18.194 -0.015 1.887
114 HA LEU 12 HA LEU 12 20.769 -1.011 2.236
115 HB2 LEU 12 HB2 LEU 12 18.263 -2.057 1.001
116 HB3 LEU 12 HB1 LEU 12 19.760 -2.921 0.665
117 HG LEU 12 HG LEU 12 18.713 -3.891 2.642
118 HD11 LEU 12 HD11 LEU 12 20.645 -4.012 3.878
119 HD12 LEU 12 HD12 LEU 12 20.865 -2.264 3.898
120 HD13 LEU 12 HD13 LEU 12 21.305 -3.189 2.463
121 HD21 LEU 12 HD21 LEU 12 18.848 -1.073 3.761
122 HD22 LEU 12 HD22 LEU 12 18.398 -2.507 4.681
123 HD23 LEU 12 HD23 LEU 12 17.381 -1.955 3.352
124 H ARG 13 HN ARG 13 19.054 -0.156 -0.741
125 HA ARG 13 HA ARG 13 20.999 -0.956 -2.582
126 HB2 ARG 13 HB2 ARG 13 18.679 0.847 -2.584
127 HB3 ARG 13 HB1 ARG 13 19.933 1.318 -3.729
128 HG2 ARG 13 HG2 ARG 13 18.210 -0.281 -4.661
129 HG3 ARG 13 HG1 ARG 13 19.874 -0.843 -4.799
130 HD2 ARG 13 HD2 ARG 13 19.601 -2.481 -3.166
131 HD3 ARG 13 HD1 ARG 13 18.316 -1.602 -2.350
132 HE ARG 13 HE ARG 13 16.799 -2.711 -3.686
133 HH11 ARG 13 HH11 ARG 13 16.201 -4.115 -5.374
134 HH12 ARG 13 HH12 ARG 13 17.356 -4.556 -6.586
135 HH21 ARG 13 HH21 ARG 13 19.959 -2.776 -5.155
136 HH22 ARG 13 HH22 ARG 13 19.480 -3.813 -6.455
137 H LEU 14 HN LEU 14 20.611 2.193 -0.936
138 HA LEU 14 HA LEU 14 22.988 3.289 -2.106
139 HB2 LEU 14 HB2 LEU 14 21.792 4.249 0.479
140 HB3 LEU 14 HB1 LEU 14 22.610 5.183 -0.772
141 HG LEU 14 HG LEU 14 19.873 3.910 -0.982
142 HD11 LEU 14 HD11 LEU 14 20.837 6.774 -0.893
143 HD12 LEU 14 HD12 LEU 14 19.794 5.957 0.275
144 HD13 LEU 14 HD13 LEU 14 19.200 6.306 -1.349
145 HD21 LEU 14 HD21 LEU 14 20.867 3.700 -3.148
146 HD22 LEU 14 HD22 LEU 14 21.613 5.292 -3.025
147 HD23 LEU 14 HD23 LEU 14 19.867 5.156 -3.219
148 H ALA 15 HN ALA 15 22.135 1.696 0.889
149 HA ALA 15 HA ALA 15 24.466 2.063 2.352
150 HB1 ALA 15 HB1 ALA 15 22.948 -0.541 2.281
151 HB2 ALA 15 HB2 ALA 15 22.303 0.898 3.072
152 HB3 ALA 15 HB3 ALA 15 23.809 0.176 3.645
153 H ALA 16 HN ALA 16 23.763 -0.061 -0.315
154 HA ALA 16 HA ALA 16 26.030 -1.738 -0.137
155 HB1 ALA 16 HB1 ALA 16 25.474 -2.488 -2.284
156 HB2 ALA 16 HB2 ALA 16 24.871 -0.908 -2.790
157 HB3 ALA 16 HB3 ALA 16 23.916 -1.909 -1.695
158 H ALA 17 HN ALA 17 25.411 1.414 -1.525
159 HA ALA 17 HA ALA 17 27.921 1.684 -2.821
160 HB1 ALA 17 HB1 ALA 17 26.151 3.931 -1.857
161 HB2 ALA 17 HB2 ALA 17 25.824 3.026 -3.333
162 HB3 ALA 17 HB3 ALA 17 27.304 3.972 -3.187
163 H PHE 18 HN PHE 18 26.616 2.565 0.319
164 HA PHE 18 HA PHE 18 28.952 3.974 1.200
165 HB2 PHE 18 HB2 PHE 18 26.868 2.726 2.987
166 HB3 PHE 18 HB1 PHE 18 27.888 4.126 3.318
167 HD1 PHE 18 HD1 PHE 18 27.521 5.234 0.359
168 HD2 PHE 18 HD2 PHE 18 24.811 3.991 3.456
169 HE1 PHE 18 HE1 PHE 18 25.776 6.733 -0.568
170 HE2 PHE 18 HE2 PHE 18 23.068 5.490 2.528
171 HZ PHE 18 HZ PHE 18 23.551 6.858 0.521
172 H LYS 19 HN LYS 19 27.636 0.752 1.787
173 HA LYS 19 HA LYS 19 29.684 -0.151 3.505
174 HB2 LYS 19 HB2 LYS 19 27.901 -1.695 1.600
175 HB3 LYS 19 HB1 LYS 19 28.935 -2.442 2.814
176 HG2 LYS 19 HG2 LYS 19 26.811 -0.377 3.476
177 HG3 LYS 19 HG1 LYS 19 26.520 -2.109 3.544
178 HD2 LYS 19 HD2 LYS 19 28.500 -0.506 5.191
179 HD3 LYS 19 HD1 LYS 19 27.076 -1.353 5.779
180 HE2 LYS 19 HE2 LYS 19 29.655 -2.536 4.749
181 HE3 LYS 19 HE1 LYS 19 28.894 -2.774 6.319
182 HZ1 LYS 19 HZ1 LYS 19 27.339 -4.190 5.454
183 HZ2 LYS 19 HZ2 LYS 19 28.671 -4.559 4.471
184 HZ3 LYS 19 HZ3 LYS 19 27.441 -3.552 3.887
185 HN1 NH2 20 H2 LYS 19 30.997 -0.934 -0.306
186 HN2 NH2 20 H1 LYS 19 29.342 -0.649 -0.055
Start of MODEL 2
1 H2 PRO 1 HT1 PRO 1 3.512 3.405 -2.521
2 H3 PRO 1 HT2 PRO 1 1.852 3.111 -2.329
3 HA PRO 1 HA PRO 1 2.020 0.993 -2.931
4 HB2 PRO 1 HB2 PRO 1 4.087 1.454 -5.037
5 HB3 PRO 1 HB1 PRO 1 2.590 0.502 -5.104
6 HG2 PRO 1 HG2 PRO 1 2.772 2.913 -6.239
7 HG3 PRO 1 HG1 PRO 1 1.276 2.336 -5.488
8 HD2 PRO 1 HD2 PRO 1 3.201 4.377 -4.501
9 HD3 PRO 1 HD1 PRO 1 1.463 4.246 -4.198
10 H LYS 2 HN LYS 2 5.149 2.701 -3.027
11 HA LYS 2 HA LYS 2 6.646 0.432 -2.092
12 HB2 LYS 2 HB2 LYS 2 7.240 3.349 -2.532
13 HB3 LYS 2 HB1 LYS 2 8.359 2.359 -1.598
14 HG2 LYS 2 HG2 LYS 2 9.021 2.366 -3.955
15 HG3 LYS 2 HG1 LYS 2 8.494 0.747 -3.487
16 HD2 LYS 2 HD2 LYS 2 6.506 0.905 -4.709
17 HD3 LYS 2 HD1 LYS 2 6.489 2.670 -4.643
18 HE2 LYS 2 HE2 LYS 2 7.184 1.372 -6.873
19 HE3 LYS 2 HE1 LYS 2 7.955 2.890 -6.416
20 HZ1 LYS 2 HZ1 LYS 2 9.382 0.811 -7.009
21 HZ2 LYS 2 HZ2 LYS 2 9.065 0.361 -5.404
22 HZ3 LYS 2 HZ3 LYS 2 9.854 1.827 -5.744
23 H ILE 3 HN ILE 3 6.003 -0.335 -0.136
24 HA ILE 3 HA ILE 3 5.225 1.465 1.976
25 HB ILE 3 HB ILE 3 5.046 -0.705 3.317
26 HG12 ILE 3 HG12 ILE 3 6.650 -1.860 1.591
27 HG13 ILE 3 HG11 ILE 3 5.296 -2.765 2.260
28 HG21 ILE 3 HG21 ILE 3 3.122 0.401 2.282
29 HG22 ILE 3 HG22 ILE 3 2.976 -1.349 2.124
30 HG23 ILE 3 HG23 ILE 3 3.479 -0.379 0.739
31 HD11 ILE 3 HD11 ILE 3 4.339 -3.002 0.237
32 HD12 ILE 3 HD12 ILE 3 5.829 -2.368 -0.460
33 HD13 ILE 3 HD13 ILE 3 4.487 -1.281 -0.108
34 H LEU 4 HN LEU 4 6.169 0.337 4.255
35 HA LEU 4 HA LEU 4 8.512 1.689 4.774
36 HB2 LEU 4 HB2 LEU 4 8.632 -0.329 6.598
37 HB3 LEU 4 HB1 LEU 4 7.604 1.095 6.754
38 HG LEU 4 HG LEU 4 6.549 -1.219 5.165
39 HD11 LEU 4 HD11 LEU 4 6.840 -2.653 6.882
40 HD12 LEU 4 HD12 LEU 4 5.652 -1.689 7.757
41 HD13 LEU 4 HD13 LEU 4 7.373 -1.370 7.964
42 HD21 LEU 4 HD21 LEU 4 5.066 0.341 7.260
43 HD22 LEU 4 HD22 LEU 4 4.479 -0.318 5.735
44 HD23 LEU 4 HD23 LEU 4 5.468 1.141 5.739
45 H ASN 5 HN ASN 5 8.230 -1.790 4.001
46 HA ASN 5 HA ASN 5 10.957 -2.394 4.337
47 HB2 ASN 5 HB2 ASN 5 10.484 -4.239 2.595
48 HB3 ASN 5 HB1 ASN 5 9.580 -4.281 4.106
49 HD21 ASN 5 HD21 ASN 5 7.298 -4.005 3.991
50 HD22 ASN 5 HD22 ASN 5 6.470 -3.823 2.523
51 H LYS 6 HN LYS 6 9.171 -1.246 1.506
52 HA LYS 6 HA LYS 6 11.266 -1.307 -0.352
53 HB2 LYS 6 HB2 LYS 6 9.043 0.735 -0.212
54 HB3 LYS 6 HB1 LYS 6 9.950 0.249 -1.645
55 HG2 LYS 6 HG2 LYS 6 7.910 -1.338 -0.079
56 HG3 LYS 6 HG1 LYS 6 7.956 -1.030 -1.812
57 HD2 LYS 6 HD2 LYS 6 9.938 -2.759 -0.295
58 HD3 LYS 6 HD1 LYS 6 8.605 -3.361 -1.267
59 HE2 LYS 6 HE2 LYS 6 10.443 -1.451 -2.609
60 HE3 LYS 6 HE1 LYS 6 11.097 -3.048 -2.254
61 HZ1 LYS 6 HZ1 LYS 6 8.431 -3.031 -3.374
62 HZ2 LYS 6 HZ2 LYS 6 9.762 -4.019 -3.738
63 HZ3 LYS 6 HZ3 LYS 6 9.639 -2.464 -4.415
64 H ILE 7 HN ILE 7 10.240 1.324 1.837
65 HA ILE 7 HA ILE 7 12.155 3.193 0.990
66 HB ILE 7 HB ILE 7 11.612 3.095 3.905
67 HG12 ILE 7 HG12 ILE 7 9.466 2.288 3.111
68 HG13 ILE 7 HG11 ILE 7 9.311 3.984 3.556
69 HG21 ILE 7 HG21 ILE 7 11.388 5.215 1.750
70 HG22 ILE 7 HG22 ILE 7 12.696 5.035 2.920
71 HG23 ILE 7 HG23 ILE 7 11.083 5.498 3.464
72 HD11 ILE 7 HD11 ILE 7 8.184 3.650 1.431
73 HD12 ILE 7 HD12 ILE 7 9.613 2.884 0.746
74 HD13 ILE 7 HD13 ILE 7 9.641 4.600 1.148
75 H LEU 8 HN LEU 8 12.288 0.603 3.346
76 HA LEU 8 HA LEU 8 14.922 1.047 4.283
77 HB2 LEU 8 HB2 LEU 8 12.923 -1.053 4.477
78 HB3 LEU 8 HB1 LEU 8 14.534 -1.734 4.258
79 HG LEU 8 HG LEU 8 14.112 -1.457 6.633
80 HD11 LEU 8 HD11 LEU 8 16.364 -0.700 5.446
81 HD12 LEU 8 HD12 LEU 8 16.126 -0.441 7.173
82 HD13 LEU 8 HD13 LEU 8 15.881 0.889 6.042
83 HD21 LEU 8 HD21 LEU 8 13.712 1.490 6.055
84 HD22 LEU 8 HD22 LEU 8 13.523 0.665 7.602
85 HD23 LEU 8 HD23 LEU 8 12.389 0.343 6.294
86 H GLY 9 HN GLY 9 13.573 -0.780 1.601
87 HA2 GLY 9 HA2 GLY 9 15.905 -1.968 0.614
88 HA3 GLY 9 HA1 GLY 9 14.508 -1.523 -0.369
89 H LYS 10 HN LYS 10 14.681 1.324 0.344
90 HA LYS 10 HA LYS 10 16.437 2.179 -1.737
91 HB2 LYS 10 HB2 LYS 10 15.240 3.854 0.489
92 HB3 LYS 10 HB1 LYS 10 15.865 4.443 -1.048
93 HG2 LYS 10 HG2 LYS 10 13.527 2.527 -0.776
94 HG3 LYS 10 HG1 LYS 10 13.367 4.264 -1.003
95 HD2 LYS 10 HD2 LYS 10 14.966 3.818 -3.073
96 HD3 LYS 10 HD1 LYS 10 14.327 2.179 -2.935
97 HE2 LYS 10 HE2 LYS 10 13.011 3.637 -4.497
98 HE3 LYS 10 HE1 LYS 10 12.049 2.988 -3.168
99 HZ1 LYS 10 HZ1 LYS 10 13.353 5.537 -2.686
100 HZ2 LYS 10 HZ2 LYS 10 11.802 5.008 -2.244
101 HZ3 LYS 10 HZ3 LYS 10 12.101 5.552 -3.823
102 H ILE 11 HN ILE 11 16.629 2.161 1.790
103 HA ILE 11 HA ILE 11 19.072 3.541 2.045
104 HB ILE 11 HB ILE 11 18.260 1.333 3.920
105 HG12 ILE 11 HG12 ILE 11 16.154 2.438 3.500
106 HG13 ILE 11 HG11 ILE 11 16.772 3.088 5.016
107 HG21 ILE 11 HG21 ILE 11 19.424 2.569 5.495
108 HG22 ILE 11 HG22 ILE 11 19.072 4.106 4.704
109 HG23 ILE 11 HG23 ILE 11 20.315 3.038 4.047
110 HD11 ILE 11 HD11 ILE 11 16.167 5.039 3.879
111 HD12 ILE 11 HD12 ILE 11 16.656 4.396 2.313
112 HD13 ILE 11 HD13 ILE 11 17.877 4.904 3.479
113 H LEU 12 HN LEU 12 18.320 0.108 1.551
114 HA LEU 12 HA LEU 12 20.796 -1.032 1.964
115 HB2 LEU 12 HB2 LEU 12 18.478 -1.663 0.215
116 HB3 LEU 12 HB1 LEU 12 20.007 -2.429 -0.209
117 HG LEU 12 HG LEU 12 18.744 -3.857 1.323
118 HD11 LEU 12 HD11 LEU 12 21.397 -2.981 1.646
119 HD12 LEU 12 HD12 LEU 12 20.691 -4.476 2.255
120 HD13 LEU 12 HD13 LEU 12 20.722 -3.039 3.274
121 HD21 LEU 12 HD21 LEU 12 18.109 -3.134 3.527
122 HD22 LEU 12 HD22 LEU 12 17.525 -1.907 2.408
123 HD23 LEU 12 HD23 LEU 12 18.986 -1.615 3.351
124 H ARG 13 HN ARG 13 19.566 0.616 -0.898
125 HA ARG 13 HA ARG 13 21.745 0.233 -2.600
126 HB2 ARG 13 HB2 ARG 13 19.382 1.796 -2.605
127 HB3 ARG 13 HB1 ARG 13 20.715 2.914 -2.898
128 HG2 ARG 13 HG2 ARG 13 20.230 0.334 -4.422
129 HG3 ARG 13 HG1 ARG 13 19.854 1.952 -5.013
130 HD2 ARG 13 HD2 ARG 13 22.379 2.437 -4.453
131 HD3 ARG 13 HD1 ARG 13 22.534 0.684 -4.541
132 HE ARG 13 HE ARG 13 22.338 0.842 -6.833
133 HH11 ARG 13 HH11 ARG 13 21.991 1.929 -8.785
134 HH12 ARG 13 HH12 ARG 13 21.316 3.524 -8.789
135 HH21 ARG 13 HH21 ARG 13 21.006 3.679 -5.325
136 HH22 ARG 13 HH22 ARG 13 20.753 4.521 -6.821
137 H LEU 14 HN LEU 14 21.201 2.740 -0.126
138 HA LEU 14 HA LEU 14 23.670 4.108 -0.585
139 HB2 LEU 14 HB2 LEU 14 21.780 4.021 1.776
140 HB3 LEU 14 HB1 LEU 14 23.247 4.996 1.759
141 HG LEU 14 HG LEU 14 22.361 5.934 -0.483
142 HD11 LEU 14 HD11 LEU 14 19.659 5.886 -0.053
143 HD12 LEU 14 HD12 LEU 14 20.108 4.252 0.428
144 HD13 LEU 14 HD13 LEU 14 20.496 4.835 -1.190
145 HD21 LEU 14 HD21 LEU 14 20.485 6.876 1.566
146 HD22 LEU 14 HD22 LEU 14 21.777 7.747 0.741
147 HD23 LEU 14 HD23 LEU 14 22.141 6.754 2.151
148 H ALA 15 HN ALA 15 22.538 1.645 1.626
149 HA ALA 15 HA ALA 15 24.880 1.267 3.115
150 HB1 ALA 15 HB1 ALA 15 22.523 0.267 3.466
151 HB2 ALA 15 HB2 ALA 15 23.912 -0.745 3.860
152 HB3 ALA 15 HB3 ALA 15 23.046 -0.991 2.344
153 H ALA 16 HN ALA 16 23.846 0.016 0.014
154 HA ALA 16 HA ALA 16 26.069 -1.758 -0.337
155 HB1 ALA 16 HB1 ALA 16 25.268 -1.662 -2.778
156 HB2 ALA 16 HB2 ALA 16 23.952 -0.653 -2.179
157 HB3 ALA 16 HB3 ALA 16 24.132 -2.306 -1.592
158 H ALA 17 HN ALA 17 25.206 1.510 -1.332
159 HA ALA 17 HA ALA 17 27.459 1.990 -2.965
160 HB1 ALA 17 HB1 ALA 17 26.908 4.395 -2.628
161 HB2 ALA 17 HB2 ALA 17 25.718 3.917 -1.417
162 HB3 ALA 17 HB3 ALA 17 25.511 3.428 -3.099
163 H PHE 18 HN PHE 18 26.819 2.713 0.455
164 HA PHE 18 HA PHE 18 29.565 3.647 0.819
165 HB2 PHE 18 HB2 PHE 18 27.535 3.284 3.011
166 HB3 PHE 18 HB1 PHE 18 28.900 4.394 2.948
167 HD1 PHE 18 HD1 PHE 18 25.925 5.056 3.491
168 HD2 PHE 18 HD2 PHE 18 28.329 5.163 -0.067
169 HE1 PHE 18 HE1 PHE 18 24.471 6.824 2.555
170 HE2 PHE 18 HE2 PHE 18 26.869 6.926 -1.005
171 HZ PHE 18 HZ PHE 18 24.933 7.759 0.309
172 H LYS 19 HN LYS 19 28.063 0.709 0.718
173 HA LYS 19 HA LYS 19 28.647 -1.406 1.352
174 HB2 LYS 19 HB2 LYS 19 31.243 -0.185 2.315
175 HB3 LYS 19 HB1 LYS 19 30.941 -1.879 1.941
176 HG2 LYS 19 HG2 LYS 19 30.746 0.392 -0.066
177 HG3 LYS 19 HG1 LYS 19 32.126 -0.691 0.089
178 HD2 LYS 19 HD2 LYS 19 29.291 -1.588 -0.540
179 HD3 LYS 19 HD1 LYS 19 30.566 -1.385 -1.737
180 HE2 LYS 19 HE2 LYS 19 30.353 -3.435 0.462
181 HE3 LYS 19 HE1 LYS 19 30.648 -3.690 -1.258
182 HZ1 LYS 19 HZ1 LYS 19 32.705 -3.989 -0.225
183 HZ2 LYS 19 HZ2 LYS 19 32.509 -2.650 0.793
184 HZ3 LYS 19 HZ3 LYS 19 32.795 -2.425 -0.868
185 HN1 NH2 20 H2 LYS 19 29.113 0.002 5.180
186 HN2 NH2 20 H1 LYS 19 29.914 0.798 3.908
Start of MODEL 3
1 H2 PRO 1 HT1 PRO 1 1.933 1.544 -1.163
2 H3 PRO 1 HT2 PRO 1 0.939 1.784 -2.520
3 HA PRO 1 HA PRO 1 2.763 1.896 -3.758
4 HB2 PRO 1 HB2 PRO 1 4.048 4.168 -2.429
5 HB3 PRO 1 HB1 PRO 1 3.255 4.108 -4.017
6 HG2 PRO 1 HG2 PRO 1 2.237 5.422 -1.871
7 HG3 PRO 1 HG1 PRO 1 1.246 4.756 -3.182
8 HD2 PRO 1 HD2 PRO 1 1.719 3.659 -0.429
9 HD3 PRO 1 HD1 PRO 1 0.244 3.610 -1.417
10 H LYS 2 HN LYS 2 5.395 2.852 -3.099
11 HA LYS 2 HA LYS 2 6.586 0.544 -2.079
12 HB2 LYS 2 HB2 LYS 2 7.926 3.189 -1.671
13 HB3 LYS 2 HB1 LYS 2 8.604 1.668 -2.238
14 HG2 LYS 2 HG2 LYS 2 8.498 2.656 -4.288
15 HG3 LYS 2 HG1 LYS 2 6.807 2.176 -4.228
16 HD2 LYS 2 HD2 LYS 2 6.144 4.330 -4.207
17 HD3 LYS 2 HD1 LYS 2 7.160 4.675 -2.809
18 HE2 LYS 2 HE2 LYS 2 7.808 6.083 -4.720
19 HE3 LYS 2 HE1 LYS 2 9.106 4.968 -4.306
20 HZ1 LYS 2 HZ1 LYS 2 8.552 5.138 -6.730
21 HZ2 LYS 2 HZ2 LYS 2 7.085 4.369 -6.379
22 HZ3 LYS 2 HZ3 LYS 2 8.551 3.563 -6.101
23 H ILE 3 HN ILE 3 6.011 -0.251 -0.115
24 HA ILE 3 HA ILE 3 5.389 1.476 2.083
25 HB ILE 3 HB ILE 3 5.301 -0.678 3.394
26 HG12 ILE 3 HG12 ILE 3 6.935 -1.727 1.564
27 HG13 ILE 3 HG11 ILE 3 5.762 -2.707 2.432
28 HG21 ILE 3 HG21 ILE 3 3.237 0.068 2.573
29 HG22 ILE 3 HG22 ILE 3 3.356 -1.565 1.917
30 HG23 ILE 3 HG23 ILE 3 3.711 -0.176 0.892
31 HD11 ILE 3 HD11 ILE 3 5.933 -2.762 -0.246
32 HD12 ILE 3 HD12 ILE 3 4.808 -1.412 -0.084
33 HD13 ILE 3 HD13 ILE 3 4.406 -2.983 0.603
34 H LEU 4 HN LEU 4 6.462 0.448 4.294
35 HA LEU 4 HA LEU 4 8.855 1.775 4.624
36 HB2 LEU 4 HB2 LEU 4 9.090 -0.123 6.523
37 HB3 LEU 4 HB1 LEU 4 7.997 1.257 6.657
38 HG LEU 4 HG LEU 4 6.995 -1.174 5.225
39 HD11 LEU 4 HD11 LEU 4 8.056 -2.134 7.221
40 HD12 LEU 4 HD12 LEU 4 6.300 -2.187 7.371
41 HD13 LEU 4 HD13 LEU 4 7.220 -0.963 8.245
42 HD21 LEU 4 HD21 LEU 4 4.950 -0.270 5.709
43 HD22 LEU 4 HD22 LEU 4 5.883 1.213 5.894
44 HD23 LEU 4 HD23 LEU 4 5.443 0.262 7.314
45 H ASN 5 HN ASN 5 8.404 -1.676 3.939
46 HA ASN 5 HA ASN 5 11.106 -2.432 4.131
47 HB2 ASN 5 HB2 ASN 5 9.454 -3.745 2.029
48 HB3 ASN 5 HB1 ASN 5 10.478 -4.460 3.266
49 HD21 ASN 5 HD21 ASN 5 7.231 -3.774 2.438
50 HD22 ASN 5 HD22 ASN 5 6.537 -4.113 3.951
51 H LYS 6 HN LYS 6 9.214 -1.248 1.383
52 HA LYS 6 HA LYS 6 11.225 -1.455 -0.569
53 HB2 LYS 6 HB2 LYS 6 9.139 0.713 -0.443
54 HB3 LYS 6 HB1 LYS 6 9.899 0.024 -1.876
55 HG2 LYS 6 HG2 LYS 6 7.861 -1.241 -0.041
56 HG3 LYS 6 HG1 LYS 6 7.766 -1.024 -1.781
57 HD2 LYS 6 HD2 LYS 6 9.813 -2.830 -0.457
58 HD3 LYS 6 HD1 LYS 6 8.241 -3.396 -1.013
59 HE2 LYS 6 HE2 LYS 6 10.164 -1.927 -2.833
60 HE3 LYS 6 HE1 LYS 6 10.164 -3.682 -2.667
61 HZ1 LYS 6 HZ1 LYS 6 8.794 -2.941 -4.524
62 HZ2 LYS 6 HZ2 LYS 6 7.819 -2.041 -3.462
63 HZ3 LYS 6 HZ3 LYS 6 7.865 -3.735 -3.348
64 H ILE 7 HN ILE 7 10.363 1.249 1.614
65 HA ILE 7 HA ILE 7 12.352 3.025 0.687
66 HB ILE 7 HB ILE 7 11.680 2.939 3.601
67 HG12 ILE 7 HG12 ILE 7 9.497 2.494 2.737
68 HG13 ILE 7 HG11 ILE 7 9.546 4.233 2.990
69 HG21 ILE 7 HG21 ILE 7 11.353 5.473 2.920
70 HG22 ILE 7 HG22 ILE 7 12.272 4.987 1.496
71 HG23 ILE 7 HG23 ILE 7 12.975 4.800 3.102
72 HD11 ILE 7 HD11 ILE 7 10.497 4.047 0.431
73 HD12 ILE 7 HD12 ILE 7 8.808 4.340 0.840
74 HD13 ILE 7 HD13 ILE 7 9.353 2.707 0.470
75 H LEU 8 HN LEU 8 12.304 0.505 3.114
76 HA LEU 8 HA LEU 8 14.931 0.820 4.103
77 HB2 LEU 8 HB2 LEU 8 12.804 -1.095 4.363
78 HB3 LEU 8 HB1 LEU 8 14.314 -1.949 4.065
79 HG LEU 8 HG LEU 8 14.026 -1.638 6.454
80 HD11 LEU 8 HD11 LEU 8 16.291 -1.108 5.112
81 HD12 LEU 8 HD12 LEU 8 16.183 -0.957 6.866
82 HD13 LEU 8 HD13 LEU 8 16.041 0.475 5.848
83 HD21 LEU 8 HD21 LEU 8 14.210 0.921 7.153
84 HD22 LEU 8 HD22 LEU 8 12.647 0.176 6.828
85 HD23 LEU 8 HD23 LEU 8 13.426 1.162 5.592
86 H GLY 9 HN GLY 9 13.569 -1.074 1.457
87 HA2 GLY 9 HA2 GLY 9 15.885 -2.366 0.570
88 HA3 GLY 9 HA1 GLY 9 14.523 -1.920 -0.458
89 H LYS 10 HN LYS 10 14.740 0.942 0.137
90 HA LYS 10 HA LYS 10 16.638 1.621 -1.904
91 HB2 LYS 10 HB2 LYS 10 14.853 3.213 -0.084
92 HB3 LYS 10 HB1 LYS 10 16.124 4.025 -0.994
93 HG2 LYS 10 HG2 LYS 10 14.308 2.109 -2.438
94 HG3 LYS 10 HG1 LYS 10 13.719 3.727 -2.061
95 HD2 LYS 10 HD2 LYS 10 16.362 3.236 -3.465
96 HD3 LYS 10 HD1 LYS 10 14.847 3.472 -4.335
97 HE2 LYS 10 HE2 LYS 10 16.350 5.434 -2.610
98 HE3 LYS 10 HE1 LYS 10 15.737 5.640 -4.253
99 HZ1 LYS 10 HZ1 LYS 10 14.235 5.661 -1.710
100 HZ2 LYS 10 HZ2 LYS 10 13.457 5.331 -3.188
101 HZ3 LYS 10 HZ3 LYS 10 14.245 6.809 -2.956
102 H ILE 11 HN ILE 11 16.531 1.906 1.618
103 HA ILE 11 HA ILE 11 18.984 3.254 1.955
104 HB ILE 11 HB ILE 11 18.013 1.164 3.902
105 HG12 ILE 11 HG12 ILE 11 15.973 2.285 3.357
106 HG13 ILE 11 HG11 ILE 11 16.547 3.031 4.843
107 HG21 ILE 11 HG21 ILE 11 18.703 3.092 5.465
108 HG22 ILE 11 HG22 ILE 11 19.433 3.826 4.037
109 HG23 ILE 11 HG23 ILE 11 19.995 2.254 4.605
110 HD11 ILE 11 HD11 ILE 11 17.772 4.643 3.085
111 HD12 ILE 11 HD12 ILE 11 16.125 4.942 3.641
112 HD13 ILE 11 HD13 ILE 11 16.400 4.153 2.090
113 H LEU 12 HN LEU 12 18.175 -0.218 1.936
114 HA LEU 12 HA LEU 12 20.726 -1.269 2.304
115 HB2 LEU 12 HB2 LEU 12 18.232 -2.191 0.963
116 HB3 LEU 12 HB1 LEU 12 19.714 -3.059 0.565
117 HG LEU 12 HG LEU 12 18.565 -4.110 2.477
118 HD11 LEU 12 HD11 LEU 12 21.226 -3.580 2.281
119 HD12 LEU 12 HD12 LEU 12 20.521 -4.545 3.578
120 HD13 LEU 12 HD13 LEU 12 20.874 -2.838 3.840
121 HD21 LEU 12 HD21 LEU 12 18.321 -2.881 4.587
122 HD22 LEU 12 HD22 LEU 12 17.465 -2.038 3.300
123 HD23 LEU 12 HD23 LEU 12 19.029 -1.444 3.855
124 H ARG 13 HN ARG 13 19.108 -0.247 -0.669
125 HA ARG 13 HA ARG 13 21.103 -0.904 -2.511
126 HB2 ARG 13 HB2 ARG 13 18.695 0.685 -2.493
127 HB3 ARG 13 HB1 ARG 13 19.966 1.543 -3.362
128 HG2 ARG 13 HG2 ARG 13 18.709 0.065 -4.884
129 HG3 ARG 13 HG1 ARG 13 20.386 -0.458 -4.739
130 HD2 ARG 13 HD2 ARG 13 19.115 -1.816 -2.672
131 HD3 ARG 13 HD1 ARG 13 17.927 -1.852 -3.971
132 HE ARG 13 HE ARG 13 20.192 -2.595 -5.253
133 HH11 ARG 13 HH11 ARG 13 21.003 -4.714 -5.341
134 HH12 ARG 13 HH12 ARG 13 20.593 -5.850 -4.100
135 HH21 ARG 13 HH21 ARG 13 18.646 -3.612 -2.313
136 HH22 ARG 13 HH22 ARG 13 19.272 -5.225 -2.378
137 H LEU 14 HN LEU 14 20.646 2.072 -0.594
138 HA LEU 14 HA LEU 14 22.985 3.353 -1.639
139 HB2 LEU 14 HB2 LEU 14 21.600 3.936 0.978
140 HB3 LEU 14 HB1 LEU 14 22.549 5.046 -0.009
141 HG LEU 14 HG LEU 14 20.186 3.735 -1.287
142 HD11 LEU 14 HD11 LEU 14 19.446 6.245 -0.034
143 HD12 LEU 14 HD12 LEU 14 19.899 5.045 1.173
144 HD13 LEU 14 HD13 LEU 14 18.623 4.686 0.014
145 HD21 LEU 14 HD21 LEU 14 21.445 6.485 -1.401
146 HD22 LEU 14 HD22 LEU 14 20.055 5.982 -2.361
147 HD23 LEU 14 HD23 LEU 14 21.620 5.205 -2.602
148 H ALA 15 HN ALA 15 22.178 1.507 1.217
149 HA ALA 15 HA ALA 15 24.541 1.746 2.675
150 HB1 ALA 15 HB1 ALA 15 23.824 -0.128 3.892
151 HB2 ALA 15 HB2 ALA 15 23.056 -0.864 2.486
152 HB3 ALA 15 HB3 ALA 15 22.316 0.535 3.263
153 H ALA 16 HN ALA 16 23.746 -0.180 -0.117
154 HA ALA 16 HA ALA 16 26.098 -1.810 -0.064
155 HB1 ALA 16 HB1 ALA 16 25.270 -1.737 -2.697
156 HB2 ALA 16 HB2 ALA 16 23.778 -1.424 -1.810
157 HB3 ALA 16 HB3 ALA 16 24.708 -2.886 -1.485
158 H ALA 17 HN ALA 17 25.198 1.304 -1.366
159 HA ALA 17 HA ALA 17 27.533 1.603 -3.000
160 HB1 ALA 17 HB1 ALA 17 25.314 2.803 -3.351
161 HB2 ALA 17 HB2 ALA 17 26.756 3.815 -3.437
162 HB3 ALA 17 HB3 ALA 17 25.756 3.824 -1.984
163 H PHE 18 HN PHE 18 26.447 2.876 0.130
164 HA PHE 18 HA PHE 18 28.998 4.171 0.634
165 HB2 PHE 18 HB2 PHE 18 26.836 3.777 2.688
166 HB3 PHE 18 HB1 PHE 18 28.025 5.069 2.573
167 HD1 PHE 18 HD1 PHE 18 27.579 5.276 -0.591
168 HD2 PHE 18 HD2 PHE 18 24.997 5.407 2.844
169 HE1 PHE 18 HE1 PHE 18 25.966 6.661 -1.857
170 HE2 PHE 18 HE2 PHE 18 23.386 6.794 1.578
171 HZ PHE 18 HZ PHE 18 23.872 7.425 -0.774
172 H LYS 19 HN LYS 19 28.072 1.048 0.705
173 HA LYS 19 HA LYS 19 28.836 -0.857 1.734
174 HB2 LYS 19 HB2 LYS 19 31.135 0.794 2.798
175 HB3 LYS 19 HB1 LYS 19 31.115 -0.924 2.417
176 HG2 LYS 19 HG2 LYS 19 31.088 1.409 0.485
177 HG3 LYS 19 HG1 LYS 19 32.278 0.118 0.607
178 HD2 LYS 19 HD2 LYS 19 29.381 -0.339 -0.170
179 HD3 LYS 19 HD1 LYS 19 30.688 -0.141 -1.331
180 HE2 LYS 19 HE2 LYS 19 30.634 -2.270 0.830
181 HE3 LYS 19 HE1 LYS 19 30.159 -2.538 -0.847
182 HZ1 LYS 19 HZ1 LYS 19 32.563 -1.363 -1.114
183 HZ2 LYS 19 HZ2 LYS 19 32.294 -3.037 -1.125
184 HZ3 LYS 19 HZ3 LYS 19 32.791 -2.269 0.303
185 HN1 NH2 20 H2 LYS 19 27.198 0.256 4.861
186 HN2 NH2 20 H1 LYS 19 26.842 0.322 3.199
Start of MODEL 4
1 H2 PRO 1 HT1 PRO 1 2.001 2.609 -1.139
2 H3 PRO 1 HT2 PRO 1 0.918 2.360 -2.423
3 HA PRO 1 HA PRO 1 2.570 1.663 -3.689
4 HB2 PRO 1 HB2 PRO 1 4.338 3.993 -3.354
5 HB3 PRO 1 HB1 PRO 1 3.515 3.407 -4.815
6 HG2 PRO 1 HG2 PRO 1 2.767 5.649 -3.524
7 HG3 PRO 1 HG1 PRO 1 1.625 4.616 -4.397
8 HD2 PRO 1 HD2 PRO 1 2.086 4.835 -1.442
9 HD3 PRO 1 HD1 PRO 1 0.569 4.565 -2.323
10 H LYS 2 HN LYS 2 5.382 2.257 -3.539
11 HA LYS 2 HA LYS 2 6.455 0.297 -2.044
12 HB2 LYS 2 HB2 LYS 2 7.703 3.049 -2.215
13 HB3 LYS 2 HB1 LYS 2 8.548 1.522 -2.002
14 HG2 LYS 2 HG2 LYS 2 8.757 1.496 -4.254
15 HG3 LYS 2 HG1 LYS 2 7.044 1.077 -4.290
16 HD2 LYS 2 HD2 LYS 2 6.397 3.203 -4.899
17 HD3 LYS 2 HD1 LYS 2 7.713 3.970 -4.010
18 HE2 LYS 2 HE2 LYS 2 7.808 4.016 -6.605
19 HE3 LYS 2 HE1 LYS 2 9.277 3.572 -5.731
20 HZ1 LYS 2 HZ1 LYS 2 9.065 1.380 -6.302
21 HZ2 LYS 2 HZ2 LYS 2 8.428 2.115 -7.692
22 HZ3 LYS 2 HZ3 LYS 2 7.386 1.465 -6.516
23 H ILE 3 HN ILE 3 5.829 -0.228 0.012
24 HA ILE 3 HA ILE 3 5.298 1.795 1.986
25 HB ILE 3 HB ILE 3 5.106 -0.225 3.536
26 HG12 ILE 3 HG12 ILE 3 6.577 -1.616 1.865
27 HG13 ILE 3 HG11 ILE 3 5.214 -2.386 2.670
28 HG21 ILE 3 HG21 ILE 3 3.457 0.264 1.076
29 HG22 ILE 3 HG22 ILE 3 3.076 0.618 2.762
30 HG23 ILE 3 HG23 ILE 3 3.031 -1.044 2.175
31 HD11 ILE 3 HD11 ILE 3 4.259 -2.858 0.684
32 HD12 ILE 3 HD12 ILE 3 5.658 -2.166 -0.131
33 HD13 ILE 3 HD13 ILE 3 4.267 -1.150 0.240
34 H LEU 4 HN LEU 4 6.286 0.946 4.303
35 HA LEU 4 HA LEU 4 8.777 2.100 4.529
36 HB2 LEU 4 HB2 LEU 4 8.818 0.451 6.645
37 HB3 LEU 4 HB1 LEU 4 7.774 1.872 6.573
38 HG LEU 4 HG LEU 4 6.722 -0.648 5.361
39 HD11 LEU 4 HD11 LEU 4 6.935 -0.176 8.345
40 HD12 LEU 4 HD12 LEU 4 7.679 -1.490 7.434
41 HD13 LEU 4 HD13 LEU 4 5.925 -1.408 7.591
42 HD21 LEU 4 HD21 LEU 4 5.092 0.903 7.248
43 HD22 LEU 4 HD22 LEU 4 4.751 0.448 5.580
44 HD23 LEU 4 HD23 LEU 4 5.723 1.879 5.923
45 H ASN 5 HN ASN 5 8.045 -1.356 4.251
46 HA ASN 5 HA ASN 5 10.667 -2.310 4.550
47 HB2 ASN 5 HB2 ASN 5 8.978 -3.737 2.575
48 HB3 ASN 5 HB1 ASN 5 9.841 -4.360 3.981
49 HD21 ASN 5 HD21 ASN 5 6.739 -3.609 2.815
50 HD22 ASN 5 HD22 ASN 5 5.930 -3.568 4.309
51 H LYS 6 HN LYS 6 8.938 -1.115 1.731
52 HA LYS 6 HA LYS 6 10.932 -1.788 -0.177
53 HB2 LYS 6 HB2 LYS 6 8.957 0.487 -0.329
54 HB3 LYS 6 HB1 LYS 6 9.742 -0.324 -1.679
55 HG2 LYS 6 HG2 LYS 6 7.506 -1.285 0.082
56 HG3 LYS 6 HG1 LYS 6 7.660 -1.410 -1.661
57 HD2 LYS 6 HD2 LYS 6 9.410 -2.992 0.261
58 HD3 LYS 6 HD1 LYS 6 7.885 -3.599 -0.370
59 HE2 LYS 6 HE2 LYS 6 10.399 -3.838 -1.590
60 HE3 LYS 6 HE1 LYS 6 8.839 -4.190 -2.320
61 HZ1 LYS 6 HZ1 LYS 6 8.788 -1.699 -2.834
62 HZ2 LYS 6 HZ2 LYS 6 9.793 -2.689 -3.766
63 HZ3 LYS 6 HZ3 LYS 6 10.457 -1.736 -2.535
64 H ILE 7 HN ILE 7 10.269 1.186 1.701
65 HA ILE 7 HA ILE 7 12.307 2.756 0.573
66 HB ILE 7 HB ILE 7 11.807 2.993 3.509
67 HG12 ILE 7 HG12 ILE 7 9.567 2.473 2.759
68 HG13 ILE 7 HG11 ILE 7 9.666 4.215 2.998
69 HG21 ILE 7 HG21 ILE 7 11.824 5.360 2.978
70 HG22 ILE 7 HG22 ILE 7 11.777 5.010 1.250
71 HG23 ILE 7 HG23 ILE 7 13.204 4.591 2.196
72 HD11 ILE 7 HD11 ILE 7 8.643 4.118 0.919
73 HD12 ILE 7 HD12 ILE 7 9.511 2.660 0.446
74 HD13 ILE 7 HD13 ILE 7 10.340 4.216 0.450
75 H LEU 8 HN LEU 8 12.281 0.389 3.140
76 HA LEU 8 HA LEU 8 14.909 0.639 4.090
77 HB2 LEU 8 HB2 LEU 8 12.782 -1.298 4.296
78 HB3 LEU 8 HB1 LEU 8 14.308 -2.131 4.021
79 HG LEU 8 HG LEU 8 13.969 -1.833 6.414
80 HD11 LEU 8 HD11 LEU 8 16.150 -1.351 6.746
81 HD12 LEU 8 HD12 LEU 8 15.978 0.276 6.090
82 HD13 LEU 8 HD13 LEU 8 16.237 -1.088 5.004
83 HD21 LEU 8 HD21 LEU 8 13.427 0.202 7.421
84 HD22 LEU 8 HD22 LEU 8 12.530 0.310 5.906
85 HD23 LEU 8 HD23 LEU 8 14.069 1.152 6.082
86 H GLY 9 HN GLY 9 13.548 -1.200 1.402
87 HA2 GLY 9 HA2 GLY 9 15.848 -2.518 0.524
88 HA3 GLY 9 HA1 GLY 9 14.495 -2.048 -0.508
89 H LYS 10 HN LYS 10 14.749 0.817 0.077
90 HA LYS 10 HA LYS 10 16.623 1.503 -1.973
91 HB2 LYS 10 HB2 LYS 10 15.371 3.366 0.063
92 HB3 LYS 10 HB1 LYS 10 16.043 3.802 -1.503
93 HG2 LYS 10 HG2 LYS 10 14.305 2.549 -2.660
94 HG3 LYS 10 HG1 LYS 10 13.679 1.952 -1.122
95 HD2 LYS 10 HD2 LYS 10 12.240 3.735 -1.497
96 HD3 LYS 10 HD1 LYS 10 13.499 4.523 -0.550
97 HE2 LYS 10 HE2 LYS 10 13.265 5.989 -2.358
98 HE3 LYS 10 HE1 LYS 10 14.614 4.977 -2.873
99 HZ1 LYS 10 HZ1 LYS 10 12.868 5.292 -4.577
100 HZ2 LYS 10 HZ2 LYS 10 11.782 4.444 -3.585
101 HZ3 LYS 10 HZ3 LYS 10 13.159 3.667 -4.202
102 H ILE 11 HN ILE 11 16.579 1.770 1.554
103 HA ILE 11 HA ILE 11 19.026 3.107 1.880
104 HB ILE 11 HB ILE 11 18.106 0.974 3.798
105 HG12 ILE 11 HG12 ILE 11 16.041 2.078 3.265
106 HG13 ILE 11 HG11 ILE 11 16.611 2.774 4.777
107 HG21 ILE 11 HG21 ILE 11 19.970 2.022 4.697
108 HG22 ILE 11 HG22 ILE 11 18.694 3.067 5.323
109 HG23 ILE 11 HG23 ILE 11 19.618 3.559 3.904
110 HD11 ILE 11 HD11 ILE 11 16.332 4.773 3.758
111 HD12 ILE 11 HD12 ILE 11 16.270 4.047 2.154
112 HD13 ILE 11 HD13 ILE 11 17.826 4.388 2.905
113 H LEU 12 HN LEU 12 18.265 -0.355 1.659
114 HA LEU 12 HA LEU 12 20.770 -1.442 2.118
115 HB2 LEU 12 HB2 LEU 12 18.388 -2.232 0.534
116 HB3 LEU 12 HB1 LEU 12 19.898 -3.043 0.110
117 HG LEU 12 HG LEU 12 18.699 -4.309 1.850
118 HD11 LEU 12 HD11 LEU 12 20.563 -4.731 3.150
119 HD12 LEU 12 HD12 LEU 12 20.946 -3.024 3.354
120 HD13 LEU 12 HD13 LEU 12 21.316 -3.835 1.832
121 HD21 LEU 12 HD21 LEU 12 18.835 -1.655 3.288
122 HD22 LEU 12 HD22 LEU 12 18.537 -3.172 4.135
123 HD23 LEU 12 HD23 LEU 12 17.405 -2.609 2.903
124 H ARG 13 HN ARG 13 19.441 -0.113 -0.891
125 HA ARG 13 HA ARG 13 21.659 -0.659 -2.529
126 HB2 ARG 13 HB2 ARG 13 19.627 1.574 -2.710
127 HB3 ARG 13 HB1 ARG 13 20.736 1.104 -3.996
128 HG2 ARG 13 HG2 ARG 13 18.671 -0.714 -2.727
129 HG3 ARG 13 HG1 ARG 13 18.493 0.080 -4.291
130 HD2 ARG 13 HD2 ARG 13 20.618 -1.948 -3.537
131 HD3 ARG 13 HD1 ARG 13 19.260 -2.217 -4.619
132 HE ARG 13 HE ARG 13 20.546 -0.128 -5.791
133 HH11 ARG 13 HH11 ARG 13 22.206 -0.383 -7.325
134 HH12 ARG 13 HH12 ARG 13 23.201 -1.801 -7.290
135 HH21 ARG 13 HH21 ARG 13 21.557 -3.209 -4.570
136 HH22 ARG 13 HH22 ARG 13 22.839 -3.407 -5.716
137 H LEU 14 HN LEU 14 20.858 2.109 -0.464
138 HA LEU 14 HA LEU 14 23.152 3.655 -1.183
139 HB2 LEU 14 HB2 LEU 14 21.712 3.790 1.468
140 HB3 LEU 14 HB1 LEU 14 22.547 5.089 0.619
141 HG LEU 14 HG LEU 14 19.985 3.733 -0.263
142 HD11 LEU 14 HD11 LEU 14 20.433 6.618 0.498
143 HD12 LEU 14 HD12 LEU 14 19.911 5.403 1.664
144 HD13 LEU 14 HD13 LEU 14 18.898 5.782 0.271
145 HD21 LEU 14 HD21 LEU 14 20.001 5.515 -2.037
146 HD22 LEU 14 HD22 LEU 14 21.289 4.322 -2.219
147 HD23 LEU 14 HD23 LEU 14 21.645 5.916 -1.552
148 H ALA 15 HN ALA 15 22.316 1.420 1.379
149 HA ALA 15 HA ALA 15 24.637 1.538 2.919
150 HB1 ALA 15 HB1 ALA 15 23.196 -1.052 2.379
151 HB2 ALA 15 HB2 ALA 15 22.444 0.222 3.337
152 HB3 ALA 15 HB3 ALA 15 23.958 -0.504 3.874
153 H ALA 16 HN ALA 16 23.902 -0.149 -0.046
154 HA ALA 16 HA ALA 16 26.354 -1.629 -0.162
155 HB1 ALA 16 HB1 ALA 16 25.557 -1.598 -2.727
156 HB2 ALA 16 HB2 ALA 16 24.036 -1.128 -1.967
157 HB3 ALA 16 HB3 ALA 16 24.808 -2.650 -1.528
158 H ALA 17 HN ALA 17 25.093 1.380 -1.520
159 HA ALA 17 HA ALA 17 27.302 2.036 -3.127
160 HB1 ALA 17 HB1 ALA 17 25.418 3.925 -1.688
161 HB2 ALA 17 HB2 ALA 17 25.094 3.172 -3.249
162 HB3 ALA 17 HB3 ALA 17 26.423 4.318 -3.083
163 H PHE 18 HN PHE 18 26.500 2.875 0.232
164 HA PHE 18 HA PHE 18 29.110 4.141 0.610
165 HB2 PHE 18 HB2 PHE 18 26.975 3.708 2.702
166 HB3 PHE 18 HB1 PHE 18 28.277 4.894 2.711
167 HD1 PHE 18 HD1 PHE 18 25.004 5.002 2.709
168 HD2 PHE 18 HD2 PHE 18 28.140 5.940 -0.071
169 HE1 PHE 18 HE1 PHE 18 23.518 6.642 1.572
170 HE2 PHE 18 HE2 PHE 18 26.665 7.568 -1.200
171 HZ PHE 18 HZ PHE 18 24.355 7.920 -0.389
172 H LYS 19 HN LYS 19 28.149 1.041 0.511
173 HA LYS 19 HA LYS 19 28.894 -0.942 1.403
174 HB2 LYS 19 HB2 LYS 19 31.283 0.717 2.244
175 HB3 LYS 19 HB1 LYS 19 31.236 -1.031 2.046
176 HG2 LYS 19 HG2 LYS 19 30.694 0.948 -0.193
177 HG3 LYS 19 HG1 LYS 19 32.248 0.168 0.088
178 HD2 LYS 19 HD2 LYS 19 29.664 -1.351 -0.376
179 HD3 LYS 19 HD1 LYS 19 30.831 -0.994 -1.646
180 HE2 LYS 19 HE2 LYS 19 31.294 -2.657 0.843
181 HE3 LYS 19 HE1 LYS 19 31.287 -3.220 -0.825
182 HZ1 LYS 19 HZ1 LYS 19 33.365 -1.866 0.652
183 HZ2 LYS 19 HZ2 LYS 19 33.106 -1.251 -0.907
184 HZ3 LYS 19 HZ3 LYS 19 33.484 -2.893 -0.693
185 HN1 NH2 20 H2 LYS 19 27.579 0.146 4.733
186 HN2 NH2 20 H1 LYS 19 27.110 0.408 3.121
Start of MODEL 5
1 H2 PRO 1 HT1 PRO 1 1.589 0.110 -1.134
2 H3 PRO 1 HT2 PRO 1 0.629 0.185 -2.534
3 HA PRO 1 HA PRO 1 2.273 1.220 -3.588
4 HB2 PRO 1 HB2 PRO 1 2.677 3.410 -1.662
5 HB3 PRO 1 HB1 PRO 1 2.076 3.484 -3.334
6 HG2 PRO 1 HG2 PRO 1 0.503 3.881 -1.186
7 HG3 PRO 1 HG1 PRO 1 -0.089 3.197 -2.710
8 HD2 PRO 1 HD2 PRO 1 0.536 1.802 -0.124
9 HD3 PRO 1 HD1 PRO 1 -0.744 1.452 -1.303
10 H LYS 2 HN LYS 2 4.456 2.769 -2.569
11 HA LYS 2 HA LYS 2 6.240 0.710 -1.788
12 HB2 LYS 2 HB2 LYS 2 6.823 3.623 -1.317
13 HB3 LYS 2 HB1 LYS 2 7.925 2.337 -1.805
14 HG2 LYS 2 HG2 LYS 2 7.657 3.265 -3.884
15 HG3 LYS 2 HG1 LYS 2 6.197 2.272 -3.899
16 HD2 LYS 2 HD2 LYS 2 4.872 4.103 -3.910
17 HD3 LYS 2 HD1 LYS 2 5.713 4.787 -2.519
18 HE2 LYS 2 HE2 LYS 2 5.913 6.263 -4.494
19 HE3 LYS 2 HE1 LYS 2 7.489 5.647 -3.995
20 HZ1 LYS 2 HZ1 LYS 2 7.587 5.174 -6.198
21 HZ2 LYS 2 HZ2 LYS 2 5.905 5.022 -6.371
22 HZ3 LYS 2 HZ3 LYS 2 6.810 3.757 -5.695
23 H ILE 3 HN ILE 3 6.421 -0.210 0.193
24 HA ILE 3 HA ILE 3 5.472 1.347 2.497
25 HB ILE 3 HB ILE 3 5.496 -0.885 3.683
26 HG12 ILE 3 HG12 ILE 3 7.062 -1.898 1.884
27 HG13 ILE 3 HG11 ILE 3 5.739 -2.889 2.485
28 HG21 ILE 3 HG21 ILE 3 3.307 -0.881 3.194
29 HG22 ILE 3 HG22 ILE 3 3.612 -1.439 1.551
30 HG23 ILE 3 HG23 ILE 3 3.643 0.283 1.917
31 HD11 ILE 3 HD11 ILE 3 4.821 -3.044 0.436
32 HD12 ILE 3 HD12 ILE 3 6.261 -2.254 -0.202
33 HD13 ILE 3 HD13 ILE 3 4.849 -1.292 0.234
34 H LEU 4 HN LEU 4 6.746 0.156 4.556
35 HA LEU 4 HA LEU 4 9.115 1.543 4.819
36 HB2 LEU 4 HB2 LEU 4 9.520 -0.604 6.473
37 HB3 LEU 4 HB1 LEU 4 8.574 0.822 6.880
38 HG LEU 4 HG LEU 4 7.253 -1.435 5.394
39 HD11 LEU 4 HD11 LEU 4 6.973 -1.527 8.318
40 HD12 LEU 4 HD12 LEU 4 8.594 -1.929 7.751
41 HD13 LEU 4 HD13 LEU 4 7.203 -2.837 7.164
42 HD21 LEU 4 HD21 LEU 4 5.345 -0.314 5.950
43 HD22 LEU 4 HD22 LEU 4 6.415 1.041 6.316
44 HD23 LEU 4 HD23 LEU 4 5.891 -0.041 7.605
45 H ASN 5 HN ASN 5 8.801 -1.922 3.905
46 HA ASN 5 HA ASN 5 11.566 -2.441 3.824
47 HB2 ASN 5 HB2 ASN 5 10.884 -4.190 2.023
48 HB3 ASN 5 HB1 ASN 5 10.292 -4.385 3.668
49 HD21 ASN 5 HD21 ASN 5 8.024 -4.278 3.995
50 HD22 ASN 5 HD22 ASN 5 6.920 -3.998 2.737
51 H LYS 6 HN LYS 6 9.379 -1.217 1.309
52 HA LYS 6 HA LYS 6 11.251 -1.106 -0.790
53 HB2 LYS 6 HB2 LYS 6 9.078 0.939 -0.398
54 HB3 LYS 6 HB1 LYS 6 9.703 0.271 -1.907
55 HG2 LYS 6 HG2 LYS 6 8.062 -1.206 0.181
56 HG3 LYS 6 HG1 LYS 6 7.526 -0.737 -1.426
57 HD2 LYS 6 HD2 LYS 6 9.946 -2.485 -1.092
58 HD3 LYS 6 HD1 LYS 6 8.334 -3.181 -1.040
59 HE2 LYS 6 HE2 LYS 6 8.971 -1.327 -3.296
60 HE3 LYS 6 HE1 LYS 6 9.660 -2.947 -3.334
61 HZ1 LYS 6 HZ1 LYS 6 7.150 -2.271 -4.126
62 HZ2 LYS 6 HZ2 LYS 6 6.896 -2.940 -2.587
63 HZ3 LYS 6 HZ3 LYS 6 7.698 -3.837 -3.785
64 H ILE 7 HN ILE 7 10.346 1.362 1.641
65 HA ILE 7 HA ILE 7 12.181 3.316 0.712
66 HB ILE 7 HB ILE 7 11.606 3.096 3.630
67 HG12 ILE 7 HG12 ILE 7 9.425 2.537 2.870
68 HG13 ILE 7 HG11 ILE 7 9.373 4.272 3.140
69 HG21 ILE 7 HG21 ILE 7 12.380 5.118 1.710
70 HG22 ILE 7 HG22 ILE 7 12.407 5.190 3.470
71 HG23 ILE 7 HG23 ILE 7 10.940 5.627 2.591
72 HD11 ILE 7 HD11 ILE 7 9.205 2.768 0.597
73 HD12 ILE 7 HD12 ILE 7 10.202 4.219 0.554
74 HD13 ILE 7 HD13 ILE 7 8.511 4.326 1.036
75 H LEU 8 HN LEU 8 12.370 0.655 2.970
76 HA LEU 8 HA LEU 8 15.013 1.157 3.906
77 HB2 LEU 8 HB2 LEU 8 13.046 -1.006 4.097
78 HB3 LEU 8 HB1 LEU 8 14.698 -1.600 3.990
79 HG LEU 8 HG LEU 8 14.016 -1.225 6.337
80 HD11 LEU 8 HD11 LEU 8 16.388 -0.804 5.417
81 HD12 LEU 8 HD12 LEU 8 15.995 -0.144 7.004
82 HD13 LEU 8 HD13 LEU 8 16.007 0.911 5.592
83 HD21 LEU 8 HD21 LEU 8 13.857 1.323 6.936
84 HD22 LEU 8 HD22 LEU 8 12.441 0.508 6.269
85 HD23 LEU 8 HD23 LEU 8 13.446 1.515 5.233
86 H GLY 9 HN GLY 9 13.639 -0.790 1.305
87 HA2 GLY 9 HA2 GLY 9 15.987 -1.917 0.281
88 HA3 GLY 9 HA1 GLY 9 14.543 -1.566 -0.667
89 H LYS 10 HN LYS 10 14.583 1.286 -0.039
90 HA LYS 10 HA LYS 10 16.217 2.211 -2.177
91 HB2 LYS 10 HB2 LYS 10 14.448 3.431 -0.145
92 HB3 LYS 10 HB1 LYS 10 15.770 4.462 -0.678
93 HG2 LYS 10 HG2 LYS 10 14.500 3.080 -2.915
94 HG3 LYS 10 HG1 LYS 10 13.349 4.059 -2.010
95 HD2 LYS 10 HD2 LYS 10 15.531 5.739 -2.162
96 HD3 LYS 10 HD1 LYS 10 15.603 4.896 -3.707
97 HE2 LYS 10 HE2 LYS 10 14.213 6.944 -3.854
98 HE3 LYS 10 HE1 LYS 10 13.262 5.492 -4.162
99 HZ1 LYS 10 HZ1 LYS 10 13.426 6.396 -1.394
100 HZ2 LYS 10 HZ2 LYS 10 12.118 5.712 -2.239
101 HZ3 LYS 10 HZ3 LYS 10 12.502 7.349 -2.445
102 H ILE 11 HN ILE 11 16.564 2.196 1.352
103 HA ILE 11 HA ILE 11 19.064 3.566 1.383
104 HB ILE 11 HB ILE 11 18.268 1.604 3.509
105 HG12 ILE 11 HG12 ILE 11 16.167 2.678 3.097
106 HG13 ILE 11 HG11 ILE 11 16.874 3.507 4.478
107 HG21 ILE 11 HG21 ILE 11 19.245 4.440 3.816
108 HG22 ILE 11 HG22 ILE 11 20.376 3.122 3.501
109 HG23 ILE 11 HG23 ILE 11 19.377 3.102 4.956
110 HD11 ILE 11 HD11 ILE 11 16.512 4.480 1.670
111 HD12 ILE 11 HD12 ILE 11 17.899 5.070 2.585
112 HD13 ILE 11 HD13 ILE 11 16.265 5.332 3.194
113 H LEU 12 HN LEU 12 18.126 0.140 1.443
114 HA LEU 12 HA LEU 12 20.554 -1.089 1.842
115 HB2 LEU 12 HB2 LEU 12 18.075 -1.791 0.371
116 HB3 LEU 12 HB1 LEU 12 19.508 -2.731 -0.034
117 HG LEU 12 HG LEU 12 18.210 -3.768 1.810
118 HD11 LEU 12 HD11 LEU 12 20.857 -3.622 1.582
119 HD12 LEU 12 HD12 LEU 12 20.103 -4.385 2.983
120 HD13 LEU 12 HD13 LEU 12 20.701 -2.729 3.097
121 HD21 LEU 12 HD21 LEU 12 17.248 -1.828 2.865
122 HD22 LEU 12 HD22 LEU 12 18.838 -1.132 3.168
123 HD23 LEU 12 HD23 LEU 12 18.325 -2.571 4.044
124 H ARG 13 HN ARG 13 19.226 0.079 -1.236
125 HA ARG 13 HA ARG 13 21.290 -0.730 -2.921
126 HB2 ARG 13 HB2 ARG 13 19.459 1.666 -3.010
127 HB3 ARG 13 HB1 ARG 13 20.584 1.280 -4.310
128 HG2 ARG 13 HG2 ARG 13 18.464 -0.605 -3.244
129 HG3 ARG 13 HG1 ARG 13 18.294 0.374 -4.702
130 HD2 ARG 13 HD2 ARG 13 20.129 -1.952 -4.196
131 HD3 ARG 13 HD1 ARG 13 19.037 -1.675 -5.547
132 HE ARG 13 HE ARG 13 21.748 -0.677 -5.265
133 HH11 ARG 13 HH11 ARG 13 22.562 0.436 -7.075
134 HH12 ARG 13 HH12 ARG 13 21.477 0.950 -8.326
135 HH21 ARG 13 HH21 ARG 13 18.643 -0.284 -6.772
136 HH22 ARG 13 HH22 ARG 13 19.270 0.551 -8.153
137 H LEU 14 HN LEU 14 20.997 2.148 -0.901
138 HA LEU 14 HA LEU 14 23.542 3.206 -1.768
139 HB2 LEU 14 HB2 LEU 14 22.144 4.159 0.702
140 HB3 LEU 14 HB1 LEU 14 23.045 5.075 -0.499
141 HG LEU 14 HG LEU 14 20.321 3.821 -0.938
142 HD11 LEU 14 HD11 LEU 14 19.749 6.342 -1.206
143 HD12 LEU 14 HD12 LEU 14 21.255 6.629 -0.338
144 HD13 LEU 14 HD13 LEU 14 19.960 5.711 0.427
145 HD21 LEU 14 HD21 LEU 14 20.381 4.966 -3.097
146 HD22 LEU 14 HD22 LEU 14 21.787 3.911 -2.963
147 HD23 LEU 14 HD23 LEU 14 21.963 5.649 -2.723
148 H ALA 15 HN ALA 15 22.221 1.525 1.021
149 HA ALA 15 HA ALA 15 24.401 1.650 2.759
150 HB1 ALA 15 HB1 ALA 15 22.061 0.590 3.127
151 HB2 ALA 15 HB2 ALA 15 23.446 -0.170 3.910
152 HB3 ALA 15 HB3 ALA 15 22.778 -0.865 2.435
153 H ALA 16 HN ALA 16 23.845 -0.255 -0.085
154 HA ALA 16 HA ALA 16 26.047 -2.050 0.275
155 HB1 ALA 16 HB1 ALA 16 24.732 -1.334 -2.353
156 HB2 ALA 16 HB2 ALA 16 23.994 -2.447 -1.199
157 HB3 ALA 16 HB3 ALA 16 25.556 -2.834 -1.919
158 H ALA 17 HN ALA 17 25.474 1.032 -1.280
159 HA ALA 17 HA ALA 17 28.032 1.163 -2.567
160 HB1 ALA 17 HB1 ALA 17 25.908 2.426 -3.250
161 HB2 ALA 17 HB2 ALA 17 27.404 3.358 -3.229
162 HB3 ALA 17 HB3 ALA 17 26.254 3.509 -1.901
163 H PHE 18 HN PHE 18 26.572 2.640 0.318
164 HA PHE 18 HA PHE 18 29.099 3.831 1.108
165 HB2 PHE 18 HB2 PHE 18 26.597 3.600 2.785
166 HB3 PHE 18 HB1 PHE 18 27.905 4.768 2.948
167 HD1 PHE 18 HD1 PHE 18 24.742 5.037 2.396
168 HD2 PHE 18 HD2 PHE 18 28.300 5.436 0.014
169 HE1 PHE 18 HE1 PHE 18 23.554 6.591 0.868
170 HE2 PHE 18 HE2 PHE 18 27.113 6.984 -1.501
171 HZ PHE 18 HZ PHE 18 24.743 7.567 -1.086
172 H LYS 19 HN LYS 19 28.068 0.774 1.087
173 HA LYS 19 HA LYS 19 28.463 -1.141 2.306
174 HB2 LYS 19 HB2 LYS 19 30.952 0.516 2.573
175 HB3 LYS 19 HB1 LYS 19 30.837 -1.014 3.442
176 HG2 LYS 19 HG2 LYS 19 30.143 -0.882 0.513
177 HG3 LYS 19 HG1 LYS 19 31.828 -1.011 1.022
178 HD2 LYS 19 HD2 LYS 19 31.598 -3.175 1.662
179 HD3 LYS 19 HD1 LYS 19 30.035 -2.881 2.423
180 HE2 LYS 19 HE2 LYS 19 28.859 -3.260 0.460
181 HE3 LYS 19 HE1 LYS 19 30.229 -2.836 -0.566
182 HZ1 LYS 19 HZ1 LYS 19 29.802 -5.224 -0.545
183 HZ2 LYS 19 HZ2 LYS 19 30.059 -5.264 1.133
184 HZ3 LYS 19 HZ3 LYS 19 31.333 -4.857 0.083
185 HN1 NH2 20 H2 LYS 19 27.030 0.080 5.420
186 HN2 NH2 20 H1 LYS 19 26.614 -0.056 3.776
Start of MODEL 6
1 H2 PRO 1 HT1 PRO 1 0.977 0.501 -0.089
2 H3 PRO 1 HT2 PRO 1 -0.081 0.390 -1.412
3 HA PRO 1 HA PRO 1 1.530 0.872 -2.825
4 HB2 PRO 1 HB2 PRO 1 2.690 3.139 -1.297
5 HB3 PRO 1 HB1 PRO 1 2.087 3.089 -2.966
6 HG2 PRO 1 HG2 PRO 1 0.717 4.271 -0.987
7 HG3 PRO 1 HG1 PRO 1 -0.082 3.456 -2.342
8 HD2 PRO 1 HD2 PRO 1 0.259 2.535 0.487
9 HD3 PRO 1 HD1 PRO 1 -1.080 2.231 -0.637
10 H LYS 2 HN LYS 2 4.124 2.016 -2.249
11 HA LYS 2 HA LYS 2 5.487 -0.334 -1.361
12 HB2 LYS 2 HB2 LYS 2 7.225 1.958 -1.375
13 HB3 LYS 2 HB1 LYS 2 7.201 0.583 -2.468
14 HG2 LYS 2 HG2 LYS 2 6.812 2.387 -3.907
15 HG3 LYS 2 HG1 LYS 2 5.186 1.786 -3.597
16 HD2 LYS 2 HD2 LYS 2 4.573 3.711 -2.555
17 HD3 LYS 2 HD1 LYS 2 6.046 3.741 -1.585
18 HE2 LYS 2 HE2 LYS 2 5.955 5.707 -3.061
19 HE3 LYS 2 HE1 LYS 2 7.299 4.653 -3.512
20 HZ1 LYS 2 HZ1 LYS 2 6.382 4.222 -5.477
21 HZ2 LYS 2 HZ2 LYS 2 5.362 5.546 -5.186
22 HZ3 LYS 2 HZ3 LYS 2 4.839 3.978 -4.827
23 H ILE 3 HN ILE 3 5.556 -0.917 0.732
24 HA ILE 3 HA ILE 3 5.277 1.026 2.834
25 HB ILE 3 HB ILE 3 5.522 -0.902 4.369
26 HG12 ILE 3 HG12 ILE 3 6.959 -2.083 2.330
27 HG13 ILE 3 HG11 ILE 3 6.273 -2.942 3.708
28 HG21 ILE 3 HG21 ILE 3 3.467 -2.124 3.455
29 HG22 ILE 3 HG22 ILE 3 3.594 -1.081 2.041
30 HG23 ILE 3 HG23 ILE 3 3.315 -0.377 3.631
31 HD11 ILE 3 HD11 ILE 3 4.579 -2.448 1.285
32 HD12 ILE 3 HD12 ILE 3 4.450 -3.721 2.499
33 HD13 ILE 3 HD13 ILE 3 5.734 -3.779 1.293
34 H LEU 4 HN LEU 4 6.936 0.231 4.823
35 HA LEU 4 HA LEU 4 9.226 1.734 4.468
36 HB2 LEU 4 HB2 LEU 4 10.033 0.026 6.389
37 HB3 LEU 4 HB1 LEU 4 8.891 1.336 6.682
38 HG LEU 4 HG LEU 4 7.794 -1.275 5.711
39 HD11 LEU 4 HD11 LEU 4 7.667 -1.612 8.417
40 HD12 LEU 4 HD12 LEU 4 9.261 -0.876 8.249
41 HD13 LEU 4 HD13 LEU 4 8.882 -2.366 7.385
42 HD21 LEU 4 HD21 LEU 4 5.839 -0.464 6.584
43 HD22 LEU 4 HD22 LEU 4 6.661 1.091 6.460
44 HD23 LEU 4 HD23 LEU 4 6.637 0.223 7.995
45 H ASN 5 HN ASN 5 8.893 -1.798 4.188
46 HA ASN 5 HA ASN 5 11.597 -2.406 3.799
47 HB2 ASN 5 HB2 ASN 5 9.553 -3.913 2.209
48 HB3 ASN 5 HB1 ASN 5 10.932 -4.520 3.131
49 HD21 ASN 5 HD21 ASN 5 7.569 -4.199 3.218
50 HD22 ASN 5 HD22 ASN 5 7.350 -4.417 4.890
51 H LYS 6 HN LYS 6 9.134 -1.353 1.522
52 HA LYS 6 HA LYS 6 10.694 -1.675 -0.831
53 HB2 LYS 6 HB2 LYS 6 8.524 0.374 -0.534
54 HB3 LYS 6 HB1 LYS 6 8.935 -0.606 -1.941
55 HG2 LYS 6 HG2 LYS 6 7.593 -1.510 0.621
56 HG3 LYS 6 HG1 LYS 6 6.920 -1.547 -0.999
57 HD2 LYS 6 HD2 LYS 6 9.446 -3.067 -0.477
58 HD3 LYS 6 HD1 LYS 6 7.927 -3.736 0.104
59 HE2 LYS 6 HE2 LYS 6 8.353 -2.827 -2.760
60 HE3 LYS 6 HE1 LYS 6 8.591 -4.489 -2.216
61 HZ1 LYS 6 HZ1 LYS 6 6.067 -2.961 -1.908
62 HZ2 LYS 6 HZ2 LYS 6 6.311 -4.587 -1.491
63 HZ3 LYS 6 HZ3 LYS 6 6.357 -4.107 -3.114
64 H ILE 7 HN ILE 7 10.023 1.185 1.223
65 HA ILE 7 HA ILE 7 11.658 2.938 -0.311
66 HB ILE 7 HB ILE 7 11.370 3.411 2.617
67 HG12 ILE 7 HG12 ILE 7 9.171 2.510 2.179
68 HG13 ILE 7 HG11 ILE 7 9.017 4.264 2.178
69 HG21 ILE 7 HG21 ILE 7 10.988 5.680 1.878
70 HG22 ILE 7 HG22 ILE 7 10.801 5.149 0.208
71 HG23 ILE 7 HG23 ILE 7 12.376 5.043 0.992
72 HD11 ILE 7 HD11 ILE 7 7.933 3.873 0.207
73 HD12 ILE 7 HD12 ILE 7 8.769 2.347 -0.071
74 HD13 ILE 7 HD13 ILE 7 9.577 3.873 -0.430
75 H LEU 8 HN LEU 8 12.222 0.777 2.358
76 HA LEU 8 HA LEU 8 14.786 1.563 3.150
77 HB2 LEU 8 HB2 LEU 8 13.124 -0.813 3.399
78 HB3 LEU 8 HB1 LEU 8 14.825 -1.226 3.229
79 HG LEU 8 HG LEU 8 14.290 -0.937 5.590
80 HD11 LEU 8 HD11 LEU 8 15.737 1.600 4.989
81 HD12 LEU 8 HD12 LEU 8 16.432 0.098 4.380
82 HD13 LEU 8 HD13 LEU 8 16.151 0.301 6.107
83 HD21 LEU 8 HD21 LEU 8 12.385 0.480 5.555
84 HD22 LEU 8 HD22 LEU 8 13.232 1.723 4.636
85 HD23 LEU 8 HD23 LEU 8 13.653 1.433 6.323
86 H GLY 9 HN GLY 9 13.685 -0.416 0.484
87 HA2 GLY 9 HA2 GLY 9 16.086 -1.448 -0.471
88 HA3 GLY 9 HA1 GLY 9 14.711 -1.023 -1.488
89 H LYS 10 HN LYS 10 14.764 1.812 -0.712
90 HA LYS 10 HA LYS 10 16.608 2.733 -2.701
91 HB2 LYS 10 HB2 LYS 10 14.454 3.886 -2.189
92 HB3 LYS 10 HB1 LYS 10 15.098 4.328 -0.609
93 HG2 LYS 10 HG2 LYS 10 15.446 6.225 -2.022
94 HG3 LYS 10 HG1 LYS 10 17.023 5.458 -1.834
95 HD2 LYS 10 HD2 LYS 10 16.830 4.376 -3.993
96 HD3 LYS 10 HD1 LYS 10 15.165 4.930 -4.176
97 HE2 LYS 10 HE2 LYS 10 17.657 6.330 -4.762
98 HE3 LYS 10 HE1 LYS 10 16.009 6.721 -5.256
99 HZ1 LYS 10 HZ1 LYS 10 17.153 8.392 -3.794
100 HZ2 LYS 10 HZ2 LYS 10 17.029 7.266 -2.530
101 HZ3 LYS 10 HZ3 LYS 10 15.628 7.877 -3.268
102 H ILE 11 HN ILE 11 16.467 2.834 0.813
103 HA ILE 11 HA ILE 11 18.902 4.257 1.198
104 HB ILE 11 HB ILE 11 17.788 2.349 3.241
105 HG12 ILE 11 HG12 ILE 11 15.762 3.379 2.393
106 HG13 ILE 11 HG11 ILE 11 16.191 4.213 3.887
107 HG21 ILE 11 HG21 ILE 11 19.832 3.847 3.591
108 HG22 ILE 11 HG22 ILE 11 18.551 4.001 4.794
109 HG23 ILE 11 HG23 ILE 11 18.720 5.215 3.527
110 HD11 ILE 11 HD11 ILE 11 16.916 5.201 1.111
111 HD12 ILE 11 HD12 ILE 11 17.196 6.042 2.633
112 HD13 ILE 11 HD13 ILE 11 15.549 5.791 2.058
113 H LEU 12 HN LEU 12 18.014 0.829 1.177
114 HA LEU 12 HA LEU 12 20.331 -0.385 2.013
115 HB2 LEU 12 HB2 LEU 12 18.118 -1.105 0.183
116 HB3 LEU 12 HB1 LEU 12 19.598 -2.044 -0.013
117 HG LEU 12 HG LEU 12 18.111 -3.113 1.603
118 HD11 LEU 12 HD11 LEU 12 19.801 -3.626 3.096
119 HD12 LEU 12 HD12 LEU 12 20.297 -1.946 3.283
120 HD13 LEU 12 HD13 LEU 12 20.735 -2.836 1.825
121 HD21 LEU 12 HD21 LEU 12 17.987 -1.728 3.881
122 HD22 LEU 12 HD22 LEU 12 16.783 -1.508 2.614
123 HD23 LEU 12 HD23 LEU 12 18.103 -0.355 2.781
124 H ARG 13 HN ARG 13 19.567 0.719 -1.278
125 HA ARG 13 HA ARG 13 21.870 -0.144 -2.563
126 HB2 ARG 13 HB2 ARG 13 20.159 2.307 -3.004
127 HB3 ARG 13 HB1 ARG 13 21.467 1.836 -4.091
128 HG2 ARG 13 HG2 ARG 13 19.232 -0.044 -3.316
129 HG3 ARG 13 HG1 ARG 13 19.155 0.999 -4.737
130 HD2 ARG 13 HD2 ARG 13 21.144 -1.203 -4.166
131 HD3 ARG 13 HD1 ARG 13 19.992 -1.108 -5.494
132 HE ARG 13 HE ARG 13 21.429 1.057 -6.015
133 HH11 ARG 13 HH11 ARG 13 23.457 1.192 -7.012
134 HH12 ARG 13 HH12 ARG 13 24.559 -0.145 -6.913
135 HH21 ARG 13 HH21 ARG 13 22.458 -2.099 -4.975
136 HH22 ARG 13 HH22 ARG 13 24.007 -1.992 -5.745
137 H LEU 14 HN LEU 14 21.324 2.789 -0.654
138 HA LEU 14 HA LEU 14 23.949 3.850 -1.120
139 HB2 LEU 14 HB2 LEU 14 22.168 4.505 1.216
140 HB3 LEU 14 HB1 LEU 14 23.340 5.544 0.415
141 HG LEU 14 HG LEU 14 20.837 4.488 -0.926
142 HD11 LEU 14 HD11 LEU 14 21.363 7.249 0.166
143 HD12 LEU 14 HD12 LEU 14 20.374 6.037 0.979
144 HD13 LEU 14 HD13 LEU 14 19.878 6.672 -0.590
145 HD21 LEU 14 HD21 LEU 14 22.115 5.075 -2.725
146 HD22 LEU 14 HD22 LEU 14 23.181 6.094 -1.757
147 HD23 LEU 14 HD23 LEU 14 21.617 6.709 -2.288
148 H ALA 15 HN ALA 15 22.311 2.296 1.571
149 HA ALA 15 HA ALA 15 24.422 2.143 3.368
150 HB1 ALA 15 HB1 ALA 15 22.651 -0.225 3.208
151 HB2 ALA 15 HB2 ALA 15 21.847 1.331 3.408
152 HB3 ALA 15 HB3 ALA 15 23.040 0.797 4.591
153 H ALA 16 HN ALA 16 23.576 0.045 0.686
154 HA ALA 16 HA ALA 16 25.623 -1.888 1.237
155 HB1 ALA 16 HB1 ALA 16 24.792 -3.054 -0.560
156 HB2 ALA 16 HB2 ALA 16 24.528 -1.600 -1.522
157 HB3 ALA 16 HB3 ALA 16 23.391 -2.033 -0.244
158 H ALA 17 HN ALA 17 25.213 0.832 -0.985
159 HA ALA 17 HA ALA 17 27.524 0.586 -2.486
160 HB1 ALA 17 HB1 ALA 17 26.252 3.162 -1.527
161 HB2 ALA 17 HB2 ALA 17 25.747 2.238 -2.944
162 HB3 ALA 17 HB3 ALA 17 27.339 2.989 -2.905
163 H PHE 18 HN PHE 18 27.105 1.842 0.766
164 HA PHE 18 HA PHE 18 29.770 2.931 0.927
165 HB2 PHE 18 HB2 PHE 18 27.921 2.269 3.227
166 HB3 PHE 18 HB1 PHE 18 29.243 3.434 3.214
167 HD1 PHE 18 HD1 PHE 18 28.588 4.488 0.336
168 HD2 PHE 18 HD2 PHE 18 26.204 3.873 3.863
169 HE1 PHE 18 HE1 PHE 18 27.010 6.235 -0.423
170 HE2 PHE 18 HE2 PHE 18 24.627 5.630 3.098
171 HZ PHE 18 HZ PHE 18 25.032 6.811 0.956
172 H LYS 19 HN LYS 19 28.341 -0.162 1.375
173 HA LYS 19 HA LYS 19 30.670 -1.136 2.865
174 HB2 LYS 19 HB2 LYS 19 28.067 -2.528 2.204
175 HB3 LYS 19 HB1 LYS 19 29.353 -3.162 3.232
176 HG2 LYS 19 HG2 LYS 19 27.884 -0.564 3.766
177 HG3 LYS 19 HG1 LYS 19 27.463 -2.099 4.517
178 HD2 LYS 19 HD2 LYS 19 30.187 -0.773 4.730
179 HD3 LYS 19 HD1 LYS 19 28.931 -0.677 5.959
180 HE2 LYS 19 HE2 LYS 19 30.417 -3.147 5.030
181 HE3 LYS 19 HE1 LYS 19 30.378 -2.448 6.646
182 HZ1 LYS 19 HZ1 LYS 19 28.906 -4.235 6.732
183 HZ2 LYS 19 HZ2 LYS 19 28.220 -3.884 5.216
184 HZ3 LYS 19 HZ3 LYS 19 27.894 -2.889 6.550
185 HN1 NH2 20 H2 LYS 19 30.144 -2.606 -0.914
186 HN2 NH2 20 H1 LYS 19 28.890 -1.717 -0.185
Start of MODEL 7
1 H2 PRO 1 HT1 PRO 1 2.014 3.200 -1.652
2 H3 PRO 1 HT2 PRO 1 1.394 3.997 -3.017
3 HA PRO 1 HA PRO 1 3.218 3.415 -4.106
4 HB2 PRO 1 HB2 PRO 1 5.178 4.752 -2.407
5 HB3 PRO 1 HB1 PRO 1 4.612 5.210 -4.023
6 HG2 PRO 1 HG2 PRO 1 4.017 6.608 -1.772
7 HG3 PRO 1 HG1 PRO 1 2.991 6.574 -3.214
8 HD2 PRO 1 HD2 PRO 1 2.649 5.100 -0.625
9 HD3 PRO 1 HD1 PRO 1 1.409 5.803 -1.685
10 H LYS 2 HN LYS 2 5.887 3.013 -3.241
11 HA LYS 2 HA LYS 2 5.856 0.358 -2.365
12 HB2 LYS 2 HB2 LYS 2 8.210 2.118 -1.764
13 HB3 LYS 2 HB1 LYS 2 8.169 0.468 -2.379
14 HG2 LYS 2 HG2 LYS 2 8.604 1.435 -4.395
15 HG3 LYS 2 HG1 LYS 2 6.879 1.801 -4.396
16 HD2 LYS 2 HD2 LYS 2 7.217 4.031 -3.834
17 HD3 LYS 2 HD1 LYS 2 8.722 3.692 -2.982
18 HE2 LYS 2 HE2 LYS 2 9.062 4.915 -5.140
19 HE3 LYS 2 HE1 LYS 2 9.898 3.364 -5.075
20 HZ1 LYS 2 HZ1 LYS 2 7.761 2.468 -6.164
21 HZ2 LYS 2 HZ2 LYS 2 8.859 3.327 -7.134
22 HZ3 LYS 2 HZ3 LYS 2 7.452 4.086 -6.566
23 H ILE 3 HN ILE 3 6.256 -0.590 -0.307
24 HA ILE 3 HA ILE 3 5.363 1.087 1.888
25 HB ILE 3 HB ILE 3 5.367 -1.066 3.178
26 HG12 ILE 3 HG12 ILE 3 7.120 -2.070 1.482
27 HG13 ILE 3 HG11 ILE 3 5.883 -3.108 2.182
28 HG21 ILE 3 HG21 ILE 3 3.423 -1.994 1.912
29 HG22 ILE 3 HG22 ILE 3 3.823 -0.913 0.580
30 HG23 ILE 3 HG23 ILE 3 3.335 -0.248 2.137
31 HD11 ILE 3 HD11 ILE 3 6.362 -2.808 -0.535
32 HD12 ILE 3 HD12 ILE 3 4.962 -1.774 -0.264
33 HD13 ILE 3 HD13 ILE 3 4.896 -3.474 0.181
34 H LEU 4 HN LEU 4 6.479 0.180 4.062
35 HA LEU 4 HA LEU 4 8.810 1.606 4.416
36 HB2 LEU 4 HB2 LEU 4 9.035 -0.303 6.341
37 HB3 LEU 4 HB1 LEU 4 7.965 1.095 6.450
38 HG LEU 4 HG LEU 4 6.959 -1.358 5.031
39 HD11 LEU 4 HD11 LEU 4 8.043 -1.845 7.402
40 HD12 LEU 4 HD12 LEU 4 6.501 -2.563 6.945
41 HD13 LEU 4 HD13 LEU 4 6.535 -1.140 7.984
42 HD21 LEU 4 HD21 LEU 4 4.943 -0.337 5.293
43 HD22 LEU 4 HD22 LEU 4 5.880 1.106 5.677
44 HD23 LEU 4 HD23 LEU 4 5.282 0.077 6.973
45 H ASN 5 HN ASN 5 8.543 -1.897 3.819
46 HA ASN 5 HA ASN 5 11.263 -2.525 4.120
47 HB2 ASN 5 HB2 ASN 5 9.710 -3.893 1.960
48 HB3 ASN 5 HB1 ASN 5 10.787 -4.580 3.176
49 HD21 ASN 5 HD21 ASN 5 7.499 -4.015 2.410
50 HD22 ASN 5 HD22 ASN 5 6.848 -4.404 3.929
51 H LYS 6 HN LYS 6 9.472 -1.342 1.335
52 HA LYS 6 HA LYS 6 11.619 -1.483 -0.515
53 HB2 LYS 6 HB2 LYS 6 9.341 0.486 -0.619
54 HB3 LYS 6 HB1 LYS 6 10.220 -0.243 -1.965
55 HG2 LYS 6 HG2 LYS 6 8.215 -1.544 -0.109
56 HG3 LYS 6 HG1 LYS 6 8.160 -1.448 -1.866
57 HD2 LYS 6 HD2 LYS 6 10.285 -2.981 -0.339
58 HD3 LYS 6 HD1 LYS 6 8.819 -3.711 -0.975
59 HE2 LYS 6 HE2 LYS 6 10.275 -2.082 -2.944
60 HE3 LYS 6 HE1 LYS 6 11.184 -3.476 -2.360
61 HZ1 LYS 6 HZ1 LYS 6 8.584 -3.409 -3.751
62 HZ2 LYS 6 HZ2 LYS 6 9.022 -4.748 -2.798
63 HZ3 LYS 6 HZ3 LYS 6 9.973 -4.307 -4.129
64 H ILE 7 HN ILE 7 10.342 1.193 1.499
65 HA ILE 7 HA ILE 7 12.232 3.111 0.632
66 HB ILE 7 HB ILE 7 11.351 3.119 3.487
67 HG12 ILE 7 HG12 ILE 7 9.293 2.392 2.509
68 HG13 ILE 7 HG11 ILE 7 9.152 4.138 2.677
69 HG21 ILE 7 HG21 ILE 7 11.396 5.440 3.213
70 HG22 ILE 7 HG22 ILE 7 11.082 5.340 1.482
71 HG23 ILE 7 HG23 ILE 7 12.672 4.923 2.114
72 HD11 ILE 7 HD11 ILE 7 9.234 2.505 0.228
73 HD12 ILE 7 HD12 ILE 7 10.292 3.913 0.184
74 HD13 ILE 7 HD13 ILE 7 8.573 4.115 0.487
75 H LEU 8 HN LEU 8 12.237 0.671 3.135
76 HA LEU 8 HA LEU 8 14.773 1.291 4.277
77 HB2 LEU 8 HB2 LEU 8 12.835 -0.895 4.451
78 HB3 LEU 8 HB1 LEU 8 14.491 -1.486 4.466
79 HG LEU 8 HG LEU 8 13.730 -1.046 6.745
80 HD11 LEU 8 HD11 LEU 8 15.775 -0.258 7.311
81 HD12 LEU 8 HD12 LEU 8 15.529 1.257 6.444
82 HD13 LEU 8 HD13 LEU 8 16.078 -0.178 5.578
83 HD21 LEU 8 HD21 LEU 8 12.296 0.664 7.096
84 HD22 LEU 8 HD22 LEU 8 12.589 1.287 5.473
85 HD23 LEU 8 HD23 LEU 8 13.623 1.793 6.809
86 H GLY 9 HN GLY 9 13.694 -0.919 1.736
87 HA2 GLY 9 HA2 GLY 9 16.157 -2.022 1.006
88 HA3 GLY 9 HA1 GLY 9 14.783 -1.813 -0.084
89 H LYS 10 HN LYS 10 14.673 1.088 0.300
90 HA LYS 10 HA LYS 10 16.386 1.897 -1.809
91 HB2 LYS 10 HB2 LYS 10 14.206 3.020 -0.590
92 HB3 LYS 10 HB1 LYS 10 15.507 4.016 0.063
93 HG2 LYS 10 HG2 LYS 10 15.263 3.408 -2.887
94 HG3 LYS 10 HG1 LYS 10 14.480 4.804 -2.148
95 HD2 LYS 10 HD2 LYS 10 16.915 5.210 -1.150
96 HD3 LYS 10 HD1 LYS 10 17.399 4.254 -2.550
97 HE2 LYS 10 HE2 LYS 10 16.066 6.935 -2.454
98 HE3 LYS 10 HE1 LYS 10 17.418 6.401 -3.453
99 HZ1 LYS 10 HZ1 LYS 10 15.935 6.071 -5.056
100 HZ2 LYS 10 HZ2 LYS 10 14.628 6.337 -4.006
101 HZ3 LYS 10 HZ3 LYS 10 15.297 4.785 -4.152
102 H ILE 11 HN ILE 11 16.547 2.271 1.710
103 HA ILE 11 HA ILE 11 18.980 3.709 1.773
104 HB ILE 11 HB ILE 11 18.207 1.790 3.955
105 HG12 ILE 11 HG12 ILE 11 16.067 2.731 3.465
106 HG13 ILE 11 HG11 ILE 11 16.701 3.690 4.801
107 HG21 ILE 11 HG21 ILE 11 19.127 3.495 5.375
108 HG22 ILE 11 HG22 ILE 11 19.111 4.679 4.067
109 HG23 ILE 11 HG23 ILE 11 20.243 3.328 4.016
110 HD11 ILE 11 HD11 ILE 11 16.000 5.373 3.362
111 HD12 ILE 11 HD12 ILE 11 16.378 4.441 1.914
112 HD13 ILE 11 HD13 ILE 11 17.675 5.189 2.850
113 H LEU 12 HN LEU 12 18.194 0.253 1.940
114 HA LEU 12 HA LEU 12 20.721 -0.811 2.371
115 HB2 LEU 12 HB2 LEU 12 18.258 -1.748 0.982
116 HB3 LEU 12 HB1 LEU 12 19.744 -2.620 0.621
117 HG LEU 12 HG LEU 12 18.659 -3.714 2.483
118 HD11 LEU 12 HD11 LEU 12 20.487 -3.853 3.893
119 HD12 LEU 12 HD12 LEU 12 20.759 -2.114 3.897
120 HD13 LEU 12 HD13 LEU 12 21.228 -3.077 2.499
121 HD21 LEU 12 HD21 LEU 12 17.250 -1.827 3.194
122 HD22 LEU 12 HD22 LEU 12 18.673 -0.975 3.793
123 HD23 LEU 12 HD23 LEU 12 18.149 -2.471 4.567
124 H ARG 13 HN ARG 13 19.196 0.198 -0.664
125 HA ARG 13 HA ARG 13 21.207 -0.523 -2.452
126 HB2 ARG 13 HB2 ARG 13 18.831 0.996 -2.559
127 HB3 ARG 13 HB1 ARG 13 20.107 2.058 -3.157
128 HG2 ARG 13 HG2 ARG 13 19.906 -0.797 -4.114
129 HG3 ARG 13 HG1 ARG 13 18.941 0.479 -4.858
130 HD2 ARG 13 HD2 ARG 13 21.813 1.102 -4.469
131 HD3 ARG 13 HD1 ARG 13 21.459 -0.146 -5.662
132 HE ARG 13 HE ARG 13 19.772 1.679 -6.514
133 HH11 ARG 13 HH11 ARG 13 20.165 3.592 -7.690
134 HH12 ARG 13 HH12 ARG 13 21.668 4.432 -7.493
135 HH21 ARG 13 HH21 ARG 13 22.966 2.134 -5.236
136 HH22 ARG 13 HH22 ARG 13 23.258 3.597 -6.115
137 H LEU 14 HN LEU 14 20.831 2.445 -0.526
138 HA LEU 14 HA LEU 14 23.258 3.646 -1.463
139 HB2 LEU 14 HB2 LEU 14 21.920 4.247 1.175
140 HB3 LEU 14 HB1 LEU 14 22.836 5.339 0.140
141 HG LEU 14 HG LEU 14 20.117 4.148 -0.471
142 HD11 LEU 14 HD11 LEU 14 20.218 6.058 1.170
143 HD12 LEU 14 HD12 LEU 14 19.305 6.416 -0.297
144 HD13 LEU 14 HD13 LEU 14 20.946 7.036 -0.098
145 HD21 LEU 14 HD21 LEU 14 20.870 4.342 -2.616
146 HD22 LEU 14 HD22 LEU 14 22.180 5.433 -2.160
147 HD23 LEU 14 HD23 LEU 14 20.543 6.055 -2.361
148 H ALA 15 HN ALA 15 22.258 1.848 1.375
149 HA ALA 15 HA ALA 15 24.660 1.849 2.796
150 HB1 ALA 15 HB1 ALA 15 23.761 0.091 4.054
151 HB2 ALA 15 HB2 ALA 15 22.911 -0.589 2.667
152 HB3 ALA 15 HB3 ALA 15 22.318 0.888 3.427
153 H ALA 16 HN ALA 16 23.539 -0.060 0.102
154 HA ALA 16 HA ALA 16 25.740 -1.887 0.055
155 HB1 ALA 16 HB1 ALA 16 23.597 -1.136 -1.938
156 HB2 ALA 16 HB2 ALA 16 23.755 -2.637 -1.026
157 HB3 ALA 16 HB3 ALA 16 24.882 -2.277 -2.336
158 H ALA 17 HN ALA 17 24.996 1.249 -1.292
159 HA ALA 17 HA ALA 17 27.189 1.346 -3.113
160 HB1 ALA 17 HB1 ALA 17 25.013 2.841 -2.955
161 HB2 ALA 17 HB2 ALA 17 26.521 3.515 -3.576
162 HB3 ALA 17 HB3 ALA 17 26.033 3.831 -1.909
163 H PHE 18 HN PHE 18 26.579 2.588 0.143
164 HA PHE 18 HA PHE 18 29.201 3.669 0.481
165 HB2 PHE 18 HB2 PHE 18 27.337 2.829 2.703
166 HB3 PHE 18 HB1 PHE 18 28.593 4.062 2.750
167 HD1 PHE 18 HD1 PHE 18 25.424 4.155 3.255
168 HD2 PHE 18 HD2 PHE 18 28.016 5.355 0.052
169 HE1 PHE 18 HE1 PHE 18 23.772 5.865 2.553
170 HE2 PHE 18 HE2 PHE 18 26.369 7.062 -0.650
171 HZ PHE 18 HZ PHE 18 24.238 7.320 0.598
172 H LYS 19 HN LYS 19 27.624 0.652 1.306
173 HA LYS 19 HA LYS 19 30.251 -0.515 1.918
174 HB2 LYS 19 HB2 LYS 19 27.635 -0.994 3.358
175 HB3 LYS 19 HB1 LYS 19 29.101 -1.937 3.615
176 HG2 LYS 19 HG2 LYS 19 28.941 1.073 3.969
177 HG3 LYS 19 HG1 LYS 19 28.772 -0.079 5.292
178 HD2 LYS 19 HD2 LYS 19 31.192 0.093 3.465
179 HD3 LYS 19 HD1 LYS 19 31.104 0.813 5.068
180 HE2 LYS 19 HE2 LYS 19 31.011 -2.131 4.352
181 HE3 LYS 19 HE1 LYS 19 32.213 -1.298 5.335
182 HZ1 LYS 19 HZ1 LYS 19 30.919 -2.150 6.971
183 HZ2 LYS 19 HZ2 LYS 19 29.502 -2.141 6.035
184 HZ3 LYS 19 HZ3 LYS 19 30.077 -0.697 6.729
185 HN1 NH2 20 H2 LYS 19 29.050 -2.478 -0.864
186 HN2 NH2 20 H1 LYS 19 29.863 -1.023 -0.548
Start of MODEL 8
1 H2 PRO 1 HT1 PRO 1 2.171 1.859 -1.006
2 H3 PRO 1 HT2 PRO 1 0.694 1.190 -1.522
3 HA PRO 1 HA PRO 1 1.592 0.323 -3.340
4 HB2 PRO 1 HB2 PRO 1 3.417 2.612 -3.907
5 HB3 PRO 1 HB1 PRO 1 2.303 1.756 -4.996
6 HG2 PRO 1 HG2 PRO 1 1.737 4.183 -4.004
7 HG3 PRO 1 HG1 PRO 1 0.488 2.966 -4.308
8 HD2 PRO 1 HD2 PRO 1 1.621 3.891 -1.716
9 HD3 PRO 1 HD1 PRO 1 0.007 3.242 -2.064
10 H LYS 2 HN LYS 2 4.282 2.367 -2.195
11 HA LYS 2 HA LYS 2 5.926 -0.061 -1.911
12 HB2 LYS 2 HB2 LYS 2 6.629 2.876 -2.198
13 HB3 LYS 2 HB1 LYS 2 7.813 1.646 -1.766
14 HG2 LYS 2 HG2 LYS 2 7.996 1.806 -4.126
15 HG3 LYS 2 HG1 LYS 2 6.995 0.379 -3.870
16 HD2 LYS 2 HD2 LYS 2 5.082 1.396 -4.650
17 HD3 LYS 2 HD1 LYS 2 5.583 2.996 -4.101
18 HE2 LYS 2 HE2 LYS 2 5.579 2.724 -6.605
19 HE3 LYS 2 HE1 LYS 2 7.133 3.219 -5.939
20 HZ1 LYS 2 HZ1 LYS 2 6.532 0.362 -6.289
21 HZ2 LYS 2 HZ2 LYS 2 8.039 1.145 -6.256
22 HZ3 LYS 2 HZ3 LYS 2 7.031 1.288 -7.615
23 H ILE 3 HN ILE 3 5.963 -0.871 0.095
24 HA ILE 3 HA ILE 3 5.246 0.787 2.348
25 HB ILE 3 HB ILE 3 5.626 -1.352 3.664
26 HG12 ILE 3 HG12 ILE 3 7.180 -2.225 1.735
27 HG13 ILE 3 HG11 ILE 3 6.120 -3.352 2.574
28 HG21 ILE 3 HG21 ILE 3 3.405 -0.738 2.989
29 HG22 ILE 3 HG22 ILE 3 3.605 -2.450 2.615
30 HG23 ILE 3 HG23 ILE 3 3.712 -1.249 1.328
31 HD11 ILE 3 HD11 ILE 3 4.743 -2.098 0.334
32 HD12 ILE 3 HD12 ILE 3 4.974 -3.808 0.697
33 HD13 ILE 3 HD13 ILE 3 6.213 -2.921 -0.186
34 H LEU 4 HN LEU 4 6.658 -0.024 4.416
35 HA LEU 4 HA LEU 4 8.876 1.614 4.529
36 HB2 LEU 4 HB2 LEU 4 9.471 -0.244 6.414
37 HB3 LEU 4 HB1 LEU 4 8.260 1.018 6.635
38 HG LEU 4 HG LEU 4 7.383 -1.496 5.272
39 HD11 LEU 4 HD11 LEU 4 8.184 -1.292 8.161
40 HD12 LEU 4 HD12 LEU 4 8.476 -2.598 7.014
41 HD13 LEU 4 HD13 LEU 4 6.860 -2.348 7.671
42 HD21 LEU 4 HD21 LEU 4 5.980 -0.056 7.506
43 HD22 LEU 4 HD22 LEU 4 5.289 -0.924 6.138
44 HD23 LEU 4 HD23 LEU 4 6.012 0.668 5.897
45 H ASN 5 HN ASN 5 8.804 -1.886 3.924
46 HA ASN 5 HA ASN 5 11.574 -2.315 3.892
47 HB2 ASN 5 HB2 ASN 5 9.951 -3.835 1.921
48 HB3 ASN 5 HB1 ASN 5 11.109 -4.416 3.120
49 HD21 ASN 5 HD21 ASN 5 7.768 -4.119 2.459
50 HD22 ASN 5 HD22 ASN 5 7.200 -4.468 4.023
51 H LYS 6 HN LYS 6 9.361 -1.219 1.361
52 HA LYS 6 HA LYS 6 11.242 -1.255 -0.761
53 HB2 LYS 6 HB2 LYS 6 8.956 0.688 -0.530
54 HB3 LYS 6 HB1 LYS 6 9.667 -0.000 -1.990
55 HG2 LYS 6 HG2 LYS 6 7.926 -1.379 0.068
56 HG3 LYS 6 HG1 LYS 6 7.619 -1.193 -1.654
57 HD2 LYS 6 HD2 LYS 6 10.013 -2.749 -0.653
58 HD3 LYS 6 HD1 LYS 6 8.430 -3.505 -0.824
59 HE2 LYS 6 HE2 LYS 6 9.633 -1.940 -3.106
60 HE3 LYS 6 HE1 LYS 6 10.076 -3.620 -2.832
61 HZ1 LYS 6 HZ1 LYS 6 7.587 -2.515 -3.789
62 HZ2 LYS 6 HZ2 LYS 6 7.416 -3.752 -2.644
63 HZ3 LYS 6 HZ3 LYS 6 8.284 -4.033 -4.073
64 H ILE 7 HN ILE 7 10.169 1.349 1.446
65 HA ILE 7 HA ILE 7 11.934 3.304 0.372
66 HB ILE 7 HB ILE 7 11.357 3.421 3.281
67 HG12 ILE 7 HG12 ILE 7 9.260 2.442 2.561
68 HG13 ILE 7 HG11 ILE 7 9.008 4.169 2.805
69 HG21 ILE 7 HG21 ILE 7 10.769 5.741 2.686
70 HG22 ILE 7 HG22 ILE 7 10.973 5.358 0.977
71 HG23 ILE 7 HG23 ILE 7 12.361 5.309 2.065
72 HD11 ILE 7 HD11 ILE 7 9.826 3.964 0.139
73 HD12 ILE 7 HD12 ILE 7 8.185 4.245 0.714
74 HD13 ILE 7 HD13 ILE 7 8.725 2.603 0.367
75 H LEU 8 HN LEU 8 12.206 0.919 2.925
76 HA LEU 8 HA LEU 8 14.731 1.615 3.946
77 HB2 LEU 8 HB2 LEU 8 12.953 -0.670 4.086
78 HB3 LEU 8 HB1 LEU 8 14.626 -1.196 3.937
79 HG LEU 8 HG LEU 8 13.995 -0.909 6.293
80 HD11 LEU 8 HD11 LEU 8 16.073 -0.155 6.759
81 HD12 LEU 8 HD12 LEU 8 15.767 1.409 6.008
82 HD13 LEU 8 HD13 LEU 8 16.253 0.035 5.015
83 HD21 LEU 8 HD21 LEU 8 13.686 2.045 5.709
84 HD22 LEU 8 HD22 LEU 8 13.286 1.180 7.190
85 HD23 LEU 8 HD23 LEU 8 12.312 0.945 5.742
86 H GLY 9 HN GLY 9 13.758 -0.348 1.199
87 HA2 GLY 9 HA2 GLY 9 16.224 -1.380 0.413
88 HA3 GLY 9 HA1 GLY 9 14.905 -0.998 -0.696
89 H LYS 10 HN LYS 10 14.834 1.832 0.017
90 HA LYS 10 HA LYS 10 16.712 2.846 -1.861
91 HB2 LYS 10 HB2 LYS 10 14.447 3.846 -0.734
92 HB3 LYS 10 HB1 LYS 10 15.666 4.703 0.210
93 HG2 LYS 10 HG2 LYS 10 15.830 4.543 -2.799
94 HG3 LYS 10 HG1 LYS 10 14.867 5.782 -1.999
95 HD2 LYS 10 HD2 LYS 10 16.696 6.944 -1.302
96 HD3 LYS 10 HD1 LYS 10 17.598 5.483 -0.903
97 HE2 LYS 10 HE2 LYS 10 18.445 6.931 -2.863
98 HE3 LYS 10 HE1 LYS 10 18.328 5.190 -3.125
99 HZ1 LYS 10 HZ1 LYS 10 16.534 5.423 -4.477
100 HZ2 LYS 10 HZ2 LYS 10 17.312 6.894 -4.804
101 HZ3 LYS 10 HZ3 LYS 10 15.993 6.848 -3.733
102 H ILE 11 HN ILE 11 16.610 2.612 1.644
103 HA ILE 11 HA ILE 11 19.060 4.003 2.129
104 HB ILE 11 HB ILE 11 17.996 1.871 3.972
105 HG12 ILE 11 HG12 ILE 11 15.970 2.996 3.286
106 HG13 ILE 11 HG11 ILE 11 16.421 3.639 4.864
107 HG21 ILE 11 HG21 ILE 11 19.518 4.437 4.159
108 HG22 ILE 11 HG22 ILE 11 19.807 2.896 4.968
109 HG23 ILE 11 HG23 ILE 11 18.514 3.959 5.526
110 HD11 ILE 11 HD11 ILE 11 15.833 5.510 3.469
111 HD12 ILE 11 HD12 ILE 11 16.865 4.934 2.162
112 HD13 ILE 11 HD13 ILE 11 17.585 5.529 3.655
113 H LEU 12 HN LEU 12 18.122 0.594 1.848
114 HA LEU 12 HA LEU 12 20.596 -0.603 2.309
115 HB2 LEU 12 HB2 LEU 12 18.165 -1.345 0.755
116 HB3 LEU 12 HB1 LEU 12 19.638 -2.247 0.421
117 HG LEU 12 HG LEU 12 18.362 -3.383 2.170
118 HD11 LEU 12 HD11 LEU 12 21.046 -2.642 2.344
119 HD12 LEU 12 HD12 LEU 12 20.254 -3.902 3.287
120 HD13 LEU 12 HD13 LEU 12 20.402 -2.272 3.944
121 HD21 LEU 12 HD21 LEU 12 18.681 -0.804 3.733
122 HD22 LEU 12 HD22 LEU 12 17.876 -2.269 4.286
123 HD23 LEU 12 HD23 LEU 12 17.182 -1.328 2.969
124 H ARG 13 HN ARG 13 19.239 0.789 -0.627
125 HA ARG 13 HA ARG 13 21.194 0.054 -2.462
126 HB2 ARG 13 HB2 ARG 13 19.010 1.432 -2.807
127 HB3 ARG 13 HB1 ARG 13 20.020 2.831 -2.451
128 HG2 ARG 13 HG2 ARG 13 19.995 2.539 -4.849
129 HG3 ARG 13 HG1 ARG 13 21.595 2.069 -4.273
130 HD2 ARG 13 HD2 ARG 13 21.262 -0.150 -4.760
131 HD3 ARG 13 HD1 ARG 13 19.544 -0.079 -4.383
132 HE ARG 13 HE ARG 13 19.107 0.478 -6.601
133 HH11 ARG 13 HH11 ARG 13 19.750 0.597 -8.777
134 HH12 ARG 13 HH12 ARG 13 21.424 0.787 -9.187
135 HH21 ARG 13 HH21 ARG 13 22.494 0.786 -5.882
136 HH22 ARG 13 HH22 ARG 13 22.989 0.884 -7.541
137 H LEU 14 HN LEU 14 21.202 2.622 -0.046
138 HA LEU 14 HA LEU 14 23.716 3.727 -0.873
139 HB2 LEU 14 HB2 LEU 14 22.590 3.970 1.908
140 HB3 LEU 14 HB1 LEU 14 23.544 5.142 1.002
141 HG LEU 14 HG LEU 14 20.652 4.372 0.533
142 HD11 LEU 14 HD11 LEU 14 20.241 6.736 0.963
143 HD12 LEU 14 HD12 LEU 14 21.971 7.045 1.079
144 HD13 LEU 14 HD13 LEU 14 21.166 6.066 2.305
145 HD21 LEU 14 HD21 LEU 14 20.895 6.174 -1.307
146 HD22 LEU 14 HD22 LEU 14 21.519 4.562 -1.653
147 HD23 LEU 14 HD23 LEU 14 22.625 5.856 -1.193
148 H ALA 15 HN ALA 15 22.591 1.592 1.677
149 HA ALA 15 HA ALA 15 25.033 1.015 2.915
150 HB1 ALA 15 HB1 ALA 15 22.747 -0.913 2.460
151 HB2 ALA 15 HB2 ALA 15 22.779 0.294 3.744
152 HB3 ALA 15 HB3 ALA 15 23.966 -1.012 3.728
153 H ALA 16 HN ALA 16 23.517 -0.226 0.027
154 HA ALA 16 HA ALA 16 25.438 -2.272 -0.506
155 HB1 ALA 16 HB1 ALA 16 24.227 -2.691 -2.436
156 HB2 ALA 16 HB2 ALA 16 23.867 -0.985 -2.701
157 HB3 ALA 16 HB3 ALA 16 22.988 -1.888 -1.468
158 H ALA 17 HN ALA 17 24.894 1.066 -1.514
159 HA ALA 17 HA ALA 17 27.011 1.272 -3.350
160 HB1 ALA 17 HB1 ALA 17 25.935 3.434 -1.521
161 HB2 ALA 17 HB2 ALA 17 25.243 3.004 -3.084
162 HB3 ALA 17 HB3 ALA 17 26.867 3.688 -2.996
163 H PHE 18 HN PHE 18 26.812 1.894 0.125
164 HA PHE 18 HA PHE 18 29.637 2.446 0.405
165 HB2 PHE 18 HB2 PHE 18 27.708 1.740 2.622
166 HB3 PHE 18 HB1 PHE 18 29.189 2.688 2.735
167 HD1 PHE 18 HD1 PHE 18 28.718 4.330 0.163
168 HD2 PHE 18 HD2 PHE 18 26.200 3.383 3.512
169 HE1 PHE 18 HE1 PHE 18 27.434 6.398 -0.225
170 HE2 PHE 18 HE2 PHE 18 24.908 5.468 3.118
171 HZ PHE 18 HZ PHE 18 25.527 6.973 1.246
172 H LYS 19 HN LYS 19 28.120 -0.285 -0.375
173 HA LYS 19 HA LYS 19 28.680 -2.508 -0.329
174 HB2 LYS 19 HB2 LYS 19 31.155 -1.873 1.255
175 HB3 LYS 19 HB1 LYS 19 30.908 -3.141 0.063
176 HG2 LYS 19 HG2 LYS 19 31.201 -0.167 -0.447
177 HG3 LYS 19 HG1 LYS 19 32.307 -1.441 -0.943
178 HD2 LYS 19 HD2 LYS 19 29.508 -0.919 -1.971
179 HD3 LYS 19 HD1 LYS 19 31.014 -0.808 -2.872
180 HE2 LYS 19 HE2 LYS 19 29.625 -3.291 -1.861
181 HE3 LYS 19 HE1 LYS 19 30.046 -2.876 -3.518
182 HZ1 LYS 19 HZ1 LYS 19 32.343 -2.896 -1.829
183 HZ2 LYS 19 HZ2 LYS 19 32.058 -3.735 -3.272
184 HZ3 LYS 19 HZ3 LYS 19 31.542 -4.382 -1.785
185 HN1 NH2 20 H2 LYS 19 28.855 -2.206 3.761
186 HN2 NH2 20 H1 LYS 19 29.742 -1.101 2.822
Start of MODEL 9
1 H2 PRO 1 HT1 PRO 1 1.450 3.244 0.414
2 H3 PRO 1 HT2 PRO 1 0.041 3.011 -0.508
3 HA PRO 1 HA PRO 1 1.197 2.400 -2.284
4 HB2 PRO 1 HB2 PRO 1 3.310 4.476 -2.027
5 HB3 PRO 1 HB1 PRO 1 2.300 4.051 -3.424
6 HG2 PRO 1 HG2 PRO 1 1.836 6.254 -1.988
7 HG3 PRO 1 HG1 PRO 1 0.522 5.301 -2.698
8 HD2 PRO 1 HD2 PRO 1 1.409 5.454 0.157
9 HD3 PRO 1 HD1 PRO 1 -0.226 5.226 -0.499
10 H LYS 2 HN LYS 2 4.161 2.833 -2.535
11 HA LYS 2 HA LYS 2 5.105 0.449 -1.469
12 HB2 LYS 2 HB2 LYS 2 7.293 2.278 -1.522
13 HB3 LYS 2 HB1 LYS 2 6.894 1.027 -2.694
14 HG2 LYS 2 HG2 LYS 2 5.594 3.766 -2.711
15 HG3 LYS 2 HG1 LYS 2 7.055 3.398 -3.622
16 HD2 LYS 2 HD2 LYS 2 5.389 1.295 -4.301
17 HD3 LYS 2 HD1 LYS 2 4.267 2.645 -4.187
18 HE2 LYS 2 HE2 LYS 2 6.746 3.355 -5.586
19 HE3 LYS 2 HE1 LYS 2 5.859 2.059 -6.383
20 HZ1 LYS 2 HZ1 LYS 2 4.942 4.791 -5.745
21 HZ2 LYS 2 HZ2 LYS 2 3.834 3.547 -6.076
22 HZ3 LYS 2 HZ3 LYS 2 4.973 4.015 -7.246
23 H ILE 3 HN ILE 3 5.567 -0.196 0.522
24 HA ILE 3 HA ILE 3 5.526 1.772 2.663
25 HB ILE 3 HB ILE 3 5.492 -0.244 4.148
26 HG12 ILE 3 HG12 ILE 3 6.592 -1.692 2.268
27 HG13 ILE 3 HG11 ILE 3 5.352 -2.416 3.289
28 HG21 ILE 3 HG21 ILE 3 3.168 -0.910 3.434
29 HG22 ILE 3 HG22 ILE 3 3.402 0.065 1.982
30 HG23 ILE 3 HG23 ILE 3 3.423 0.828 3.571
31 HD11 ILE 3 HD11 ILE 3 5.339 -2.158 0.455
32 HD12 ILE 3 HD12 ILE 3 4.053 -1.128 1.082
33 HD13 ILE 3 HD13 ILE 3 4.088 -2.842 1.488
34 H LEU 4 HN LEU 4 7.032 0.781 4.605
35 HA LEU 4 HA LEU 4 9.565 1.777 4.185
36 HB2 LEU 4 HB2 LEU 4 10.058 0.009 6.156
37 HB3 LEU 4 HB1 LEU 4 9.186 1.521 6.418
38 HG LEU 4 HG LEU 4 7.595 -0.833 5.508
39 HD11 LEU 4 HD11 LEU 4 7.382 -1.551 7.912
40 HD12 LEU 4 HD12 LEU 4 8.763 -0.515 8.281
41 HD13 LEU 4 HD13 LEU 4 8.952 -1.889 7.190
42 HD21 LEU 4 HD21 LEU 4 6.867 0.952 7.790
43 HD22 LEU 4 HD22 LEU 4 5.850 0.311 6.502
44 HD23 LEU 4 HD23 LEU 4 6.913 1.682 6.183
45 H ASN 5 HN ASN 5 8.547 -1.623 3.997
46 HA ASN 5 HA ASN 5 11.067 -2.776 3.655
47 HB2 ASN 5 HB2 ASN 5 8.802 -3.853 2.033
48 HB3 ASN 5 HB1 ASN 5 9.979 -4.709 3.020
49 HD21 ASN 5 HD21 ASN 5 6.766 -3.595 2.955
50 HD22 ASN 5 HD22 ASN 5 6.426 -3.769 4.610
51 H LYS 6 HN LYS 6 8.903 -1.294 1.283
52 HA LYS 6 HA LYS 6 10.497 -1.933 -0.985
53 HB2 LYS 6 HB2 LYS 6 8.690 0.463 -0.794
54 HB3 LYS 6 HB1 LYS 6 9.043 -0.537 -2.203
55 HG2 LYS 6 HG2 LYS 6 7.353 -1.251 0.214
56 HG3 LYS 6 HG1 LYS 6 6.845 -1.180 -1.469
57 HD2 LYS 6 HD2 LYS 6 8.921 -3.149 -0.452
58 HD3 LYS 6 HD1 LYS 6 7.206 -3.526 -0.551
59 HE2 LYS 6 HE2 LYS 6 8.788 -2.536 -2.930
60 HE3 LYS 6 HE1 LYS 6 8.620 -4.250 -2.549
61 HZ1 LYS 6 HZ1 LYS 6 6.095 -3.047 -2.415
62 HZ2 LYS 6 HZ2 LYS 6 6.638 -4.232 -3.495
63 HZ3 LYS 6 HZ3 LYS 6 6.810 -2.586 -3.873
64 H ILE 7 HN ILE 7 10.216 1.005 1.036
65 HA ILE 7 HA ILE 7 12.251 2.426 -0.370
66 HB ILE 7 HB ILE 7 11.820 2.985 2.524
67 HG12 ILE 7 HG12 ILE 7 9.546 2.496 1.920
68 HG13 ILE 7 HG11 ILE 7 9.712 4.245 1.876
69 HG21 ILE 7 HG21 ILE 7 13.245 4.412 1.113
70 HG22 ILE 7 HG22 ILE 7 11.833 5.293 1.701
71 HG23 ILE 7 HG23 ILE 7 11.879 4.708 0.039
72 HD11 ILE 7 HD11 ILE 7 10.412 3.585 -0.680
73 HD12 ILE 7 HD12 ILE 7 8.784 4.055 -0.190
74 HD13 ILE 7 HD13 ILE 7 9.210 2.350 -0.319
75 H LEU 8 HN LEU 8 12.241 0.156 2.264
76 HA LEU 8 HA LEU 8 14.756 0.545 3.375
77 HB2 LEU 8 HB2 LEU 8 12.787 -1.545 3.341
78 HB3 LEU 8 HB1 LEU 8 14.384 -2.261 3.153
79 HG LEU 8 HG LEU 8 13.657 -2.009 5.542
80 HD11 LEU 8 HD11 LEU 8 16.021 -0.223 4.955
81 HD12 LEU 8 HD12 LEU 8 16.077 -1.965 4.690
82 HD13 LEU 8 HD13 LEU 8 15.786 -1.335 6.307
83 HD21 LEU 8 HD21 LEU 8 12.919 -0.036 6.353
84 HD22 LEU 8 HD22 LEU 8 12.820 0.503 4.679
85 HD23 LEU 8 HD23 LEU 8 14.260 0.852 5.633
86 H GLY 9 HN GLY 9 13.842 -1.282 0.496
87 HA2 GLY 9 HA2 GLY 9 16.331 -2.381 -0.163
88 HA3 GLY 9 HA1 GLY 9 15.082 -1.966 -1.331
89 H LYS 10 HN LYS 10 15.047 0.864 -0.663
90 HA LYS 10 HA LYS 10 17.151 1.752 -2.387
91 HB2 LYS 10 HB2 LYS 10 15.165 3.058 -2.412
92 HB3 LYS 10 HB1 LYS 10 15.129 3.178 -0.656
93 HG2 LYS 10 HG2 LYS 10 15.915 5.287 -1.450
94 HG3 LYS 10 HG1 LYS 10 17.319 4.454 -0.801
95 HD2 LYS 10 HD2 LYS 10 18.203 3.998 -2.930
96 HD3 LYS 10 HD1 LYS 10 16.645 4.207 -3.730
97 HE2 LYS 10 HE2 LYS 10 18.398 6.373 -2.537
98 HE3 LYS 10 HE1 LYS 10 17.982 6.155 -4.234
99 HZ1 LYS 10 HZ1 LYS 10 16.231 7.435 -3.894
100 HZ2 LYS 10 HZ2 LYS 10 16.568 7.556 -2.236
101 HZ3 LYS 10 HZ3 LYS 10 15.592 6.294 -2.821
102 H ILE 11 HN ILE 11 16.548 1.940 1.108
103 HA ILE 11 HA ILE 11 18.870 3.385 1.787
104 HB ILE 11 HB ILE 11 17.716 1.272 3.591
105 HG12 ILE 11 HG12 ILE 11 15.721 2.260 2.677
106 HG13 ILE 11 HG11 ILE 11 15.999 3.038 4.233
107 HG21 ILE 11 HG21 ILE 11 19.281 2.409 4.830
108 HG22 ILE 11 HG22 ILE 11 17.951 3.549 5.041
109 HG23 ILE 11 HG23 ILE 11 19.185 3.849 3.817
110 HD11 ILE 11 HD11 ILE 11 17.438 4.661 2.555
111 HD12 ILE 11 HD12 ILE 11 15.783 4.978 3.068
112 HD13 ILE 11 HD13 ILE 11 16.093 4.192 1.519
113 H LEU 12 HN LEU 12 18.250 -0.100 1.526
114 HA LEU 12 HA LEU 12 20.724 -1.044 2.412
115 HB2 LEU 12 HB2 LEU 12 18.575 -2.087 0.635
116 HB3 LEU 12 HB1 LEU 12 20.147 -2.865 0.515
117 HG LEU 12 HG LEU 12 18.837 -4.040 2.179
118 HD11 LEU 12 HD11 LEU 12 20.618 -2.404 3.930
119 HD12 LEU 12 HD12 LEU 12 21.356 -3.216 2.550
120 HD13 LEU 12 HD13 LEU 12 20.499 -4.157 3.765
121 HD21 LEU 12 HD21 LEU 12 18.079 -2.794 4.235
122 HD22 LEU 12 HD22 LEU 12 17.227 -2.338 2.764
123 HD23 LEU 12 HD23 LEU 12 18.486 -1.290 3.415
124 H ARG 13 HN ARG 13 19.687 -0.101 -0.853
125 HA ARG 13 HA ARG 13 22.030 -0.726 -2.228
126 HB2 ARG 13 HB2 ARG 13 19.825 1.247 -2.662
127 HB3 ARG 13 HB1 ARG 13 21.265 1.345 -3.677
128 HG2 ARG 13 HG2 ARG 13 19.837 -1.281 -3.240
129 HG3 ARG 13 HG1 ARG 13 19.325 -0.164 -4.504
130 HD2 ARG 13 HD2 ARG 13 22.210 -1.031 -4.249
131 HD3 ARG 13 HD1 ARG 13 21.041 -1.999 -5.136
132 HE ARG 13 HE ARG 13 20.755 -0.160 -6.682
133 HH11 ARG 13 HH11 ARG 13 21.848 1.380 -7.896
134 HH12 ARG 13 HH12 ARG 13 23.319 2.080 -7.308
135 HH21 ARG 13 HH21 ARG 13 23.332 0.205 -4.376
136 HH22 ARG 13 HH22 ARG 13 24.165 1.402 -5.305
137 H LEU 14 HN LEU 14 21.239 2.115 -0.275
138 HA LEU 14 HA LEU 14 23.576 3.600 -1.005
139 HB2 LEU 14 HB2 LEU 14 22.159 3.872 1.638
140 HB3 LEU 14 HB1 LEU 14 22.987 5.114 0.699
141 HG LEU 14 HG LEU 14 20.377 3.753 -0.003
142 HD11 LEU 14 HD11 LEU 14 19.392 5.905 0.324
143 HD12 LEU 14 HD12 LEU 14 20.971 6.676 0.449
144 HD13 LEU 14 HD13 LEU 14 20.407 5.604 1.732
145 HD21 LEU 14 HD21 LEU 14 20.552 5.660 -1.844
146 HD22 LEU 14 HD22 LEU 14 21.260 4.073 -2.117
147 HD23 LEU 14 HD23 LEU 14 22.280 5.414 -1.602
148 H ALA 15 HN ALA 15 22.656 1.630 1.741
149 HA ALA 15 HA ALA 15 25.088 1.686 3.136
150 HB1 ALA 15 HB1 ALA 15 24.257 -0.504 4.097
151 HB2 ALA 15 HB2 ALA 15 22.896 -0.381 2.983
152 HB3 ALA 15 HB3 ALA 15 23.131 0.844 4.226
153 H ALA 16 HN ALA 16 23.943 -0.286 0.490
154 HA ALA 16 HA ALA 16 26.155 -2.099 0.509
155 HB1 ALA 16 HB1 ALA 16 25.224 -3.013 -1.474
156 HB2 ALA 16 HB2 ALA 16 24.351 -1.525 -1.836
157 HB3 ALA 16 HB3 ALA 16 23.845 -2.535 -0.485
158 H ALA 17 HN ALA 17 25.249 0.772 -1.336
159 HA ALA 17 HA ALA 17 27.567 0.693 -2.994
160 HB1 ALA 17 HB1 ALA 17 25.694 1.754 -3.953
161 HB2 ALA 17 HB2 ALA 17 26.797 3.073 -3.564
162 HB3 ALA 17 HB3 ALA 17 25.416 2.741 -2.520
163 H PHE 18 HN PHE 18 26.623 2.609 -0.152
164 HA PHE 18 HA PHE 18 29.224 3.935 -0.176
165 HB2 PHE 18 HB2 PHE 18 27.019 4.300 1.847
166 HB3 PHE 18 HB1 PHE 18 28.344 5.397 1.477
167 HD1 PHE 18 HD1 PHE 18 28.124 4.884 -1.630
168 HD2 PHE 18 HD2 PHE 18 25.296 5.977 1.413
169 HE1 PHE 18 HE1 PHE 18 26.717 6.003 -3.338
170 HE2 PHE 18 HE2 PHE 18 23.890 7.094 -0.293
171 HZ PHE 18 HZ PHE 18 24.600 7.107 -2.670
172 H LYS 19 HN LYS 19 27.375 1.786 1.911
173 HA LYS 19 HA LYS 19 27.971 0.517 3.728
174 HB2 LYS 19 HB2 LYS 19 29.399 -0.430 1.774
175 HB3 LYS 19 HB1 LYS 19 30.748 0.384 2.562
176 HG2 LYS 19 HG2 LYS 19 30.690 -1.887 3.396
177 HG3 LYS 19 HG1 LYS 19 30.144 -0.831 4.693
178 HD2 LYS 19 HD2 LYS 19 28.684 -2.802 4.542
179 HD3 LYS 19 HD1 LYS 19 27.782 -1.350 4.118
180 HE2 LYS 19 HE2 LYS 19 27.312 -3.187 2.531
181 HE3 LYS 19 HE1 LYS 19 28.097 -1.839 1.725
182 HZ1 LYS 19 HZ1 LYS 19 29.344 -4.380 2.605
183 HZ2 LYS 19 HZ2 LYS 19 30.238 -3.036 2.084
184 HZ3 LYS 19 HZ3 LYS 19 29.165 -3.807 1.017
185 HN1 NH2 20 H2 LYS 19 31.167 2.105 5.364
186 HN2 NH2 20 H1 LYS 19 31.157 0.771 4.319
Start of MODEL 10
1 H2 PRO 1 HT1 PRO 1 2.539 3.730 -0.590
2 H3 PRO 1 HT2 PRO 1 0.860 3.709 -0.844
3 HA PRO 1 HA PRO 1 1.018 2.182 -2.407
4 HB2 PRO 1 HB2 PRO 1 3.382 3.343 -3.797
5 HB3 PRO 1 HB1 PRO 1 1.800 2.880 -4.452
6 HG2 PRO 1 HG2 PRO 1 2.485 5.440 -4.061
7 HG3 PRO 1 HG1 PRO 1 0.820 4.862 -3.861
8 HD2 PRO 1 HD2 PRO 1 2.823 5.598 -1.767
9 HD3 PRO 1 HD1 PRO 1 1.054 5.746 -1.729
10 H LYS 2 HN LYS 2 4.495 2.894 -2.608
11 HA LYS 2 HA LYS 2 5.149 0.179 -1.859
12 HB2 LYS 2 HB2 LYS 2 6.781 2.616 -2.592
13 HB3 LYS 2 HB1 LYS 2 7.537 1.126 -2.034
14 HG2 LYS 2 HG2 LYS 2 7.482 1.050 -4.451
15 HG3 LYS 2 HG1 LYS 2 6.284 -0.099 -3.853
16 HD2 LYS 2 HD2 LYS 2 4.501 1.159 -4.571
17 HD3 LYS 2 HD1 LYS 2 5.338 2.687 -4.307
18 HE2 LYS 2 HE2 LYS 2 4.892 2.022 -6.745
19 HE3 LYS 2 HE1 LYS 2 6.541 2.509 -6.348
20 HZ1 LYS 2 HZ1 LYS 2 6.126 -0.278 -5.906
21 HZ2 LYS 2 HZ2 LYS 2 7.295 0.498 -6.855
22 HZ3 LYS 2 HZ3 LYS 2 5.765 0.147 -7.504
23 H ILE 3 HN ILE 3 5.344 -0.487 0.189
24 HA ILE 3 HA ILE 3 5.242 1.411 2.326
25 HB ILE 3 HB ILE 3 5.214 -0.564 3.778
26 HG12 ILE 3 HG12 ILE 3 6.274 -1.789 1.316
27 HG13 ILE 3 HG11 ILE 3 6.412 -2.316 2.985
28 HG21 ILE 3 HG21 ILE 3 3.189 0.325 2.532
29 HG22 ILE 3 HG22 ILE 3 3.082 -1.365 3.021
30 HG23 ILE 3 HG23 ILE 3 3.453 -0.953 1.347
31 HD11 ILE 3 HD11 ILE 3 4.006 -2.710 1.187
32 HD12 ILE 3 HD12 ILE 3 4.092 -3.204 2.878
33 HD13 ILE 3 HD13 ILE 3 5.144 -3.963 1.683
34 H LEU 4 HN LEU 4 6.635 0.507 4.332
35 HA LEU 4 HA LEU 4 9.087 1.745 4.205
36 HB2 LEU 4 HB2 LEU 4 9.516 0.020 6.215
37 HB3 LEU 4 HB1 LEU 4 8.444 1.417 6.364
38 HG LEU 4 HG LEU 4 7.269 -1.102 5.259
39 HD11 LEU 4 HD11 LEU 4 7.367 -0.812 8.223
40 HD12 LEU 4 HD12 LEU 4 8.769 -1.504 7.403
41 HD13 LEU 4 HD13 LEU 4 7.182 -2.258 7.237
42 HD21 LEU 4 HD21 LEU 4 5.286 -0.196 6.024
43 HD22 LEU 4 HD22 LEU 4 6.207 1.299 5.832
44 HD23 LEU 4 HD23 LEU 4 6.051 0.554 7.423
45 H ASN 5 HN ASN 5 8.462 -1.753 3.904
46 HA ASN 5 HA ASN 5 11.129 -2.576 3.869
47 HB2 ASN 5 HB2 ASN 5 9.256 -3.929 1.980
48 HB3 ASN 5 HB1 ASN 5 10.397 -4.625 3.120
49 HD21 ASN 5 HD21 ASN 5 7.091 -3.959 2.630
50 HD22 ASN 5 HD22 ASN 5 6.573 -4.192 4.229
51 H LYS 6 HN LYS 6 9.078 -1.325 1.301
52 HA LYS 6 HA LYS 6 10.918 -1.727 -0.819
53 HB2 LYS 6 HB2 LYS 6 8.849 0.453 -0.671
54 HB3 LYS 6 HB1 LYS 6 9.468 -0.365 -2.104
55 HG2 LYS 6 HG2 LYS 6 7.564 -1.416 -0.010
56 HG3 LYS 6 HG1 LYS 6 7.373 -1.409 -1.759
57 HD2 LYS 6 HD2 LYS 6 9.319 -3.136 -0.188
58 HD3 LYS 6 HD1 LYS 6 7.836 -3.683 -0.961
59 HE2 LYS 6 HE2 LYS 6 8.705 -3.299 -3.147
60 HE3 LYS 6 HE1 LYS 6 10.049 -2.341 -2.528
61 HZ1 LYS 6 HZ1 LYS 6 10.418 -4.801 -3.186
62 HZ2 LYS 6 HZ2 LYS 6 9.746 -5.136 -1.661
63 HZ3 LYS 6 HZ3 LYS 6 11.156 -4.195 -1.786
64 H ILE 7 HN ILE 7 10.159 1.114 1.203
65 HA ILE 7 HA ILE 7 12.134 2.775 0.012
66 HB ILE 7 HB ILE 7 11.558 3.174 2.893
67 HG12 ILE 7 HG12 ILE 7 9.369 2.374 2.190
68 HG13 ILE 7 HG11 ILE 7 9.312 4.125 2.345
69 HG21 ILE 7 HG21 ILE 7 12.783 4.807 1.461
70 HG22 ILE 7 HG22 ILE 7 11.321 5.486 2.174
71 HG23 ILE 7 HG23 ILE 7 11.329 4.994 0.480
72 HD11 ILE 7 HD11 ILE 7 9.825 4.237 -0.149
73 HD12 ILE 7 HD12 ILE 7 8.222 3.647 0.284
74 HD13 ILE 7 HD13 ILE 7 9.476 2.509 -0.202
75 H LEU 8 HN LEU 8 12.138 0.602 2.763
76 HA LEU 8 HA LEU 8 14.680 1.135 3.806
77 HB2 LEU 8 HB2 LEU 8 12.724 -1.006 4.000
78 HB3 LEU 8 HB1 LEU 8 14.370 -1.629 4.045
79 HG LEU 8 HG LEU 8 13.568 -1.074 6.313
80 HD11 LEU 8 HD11 LEU 8 15.554 -0.111 6.993
81 HD12 LEU 8 HD12 LEU 8 15.538 1.089 5.703
82 HD13 LEU 8 HD13 LEU 8 16.001 -0.575 5.353
83 HD21 LEU 8 HD21 LEU 8 12.893 1.112 6.925
84 HD22 LEU 8 HD22 LEU 8 12.076 0.823 5.390
85 HD23 LEU 8 HD23 LEU 8 13.533 1.813 5.441
86 H GLY 9 HN GLY 9 13.685 -1.040 1.219
87 HA2 GLY 9 HA2 GLY 9 16.134 -2.249 0.668
88 HA3 GLY 9 HA1 GLY 9 14.873 -1.964 -0.529
89 H LYS 10 HN LYS 10 14.927 0.955 -0.145
90 HA LYS 10 HA LYS 10 16.952 1.578 -2.070
91 HB2 LYS 10 HB2 LYS 10 15.534 3.585 -0.309
92 HB3 LYS 10 HB1 LYS 10 16.186 3.824 -1.930
93 HG2 LYS 10 HG2 LYS 10 13.914 1.915 -1.310
94 HG3 LYS 10 HG1 LYS 10 13.673 3.576 -1.842
95 HD2 LYS 10 HD2 LYS 10 14.298 3.124 -3.989
96 HD3 LYS 10 HD1 LYS 10 15.540 1.977 -3.499
97 HE2 LYS 10 HE2 LYS 10 12.553 1.455 -3.559
98 HE3 LYS 10 HE1 LYS 10 13.757 0.777 -4.660
99 HZ1 LYS 10 HZ1 LYS 10 13.208 0.116 -1.854
100 HZ2 LYS 10 HZ2 LYS 10 14.824 0.035 -2.390
101 HZ3 LYS 10 HZ3 LYS 10 13.635 -0.893 -3.152
102 H ILE 11 HN ILE 11 16.604 1.990 1.410
103 HA ILE 11 HA ILE 11 18.935 3.504 1.876
104 HB ILE 11 HB ILE 11 17.945 1.426 3.817
105 HG12 ILE 11 HG12 ILE 11 15.895 2.396 2.990
106 HG13 ILE 11 HG11 ILE 11 16.252 3.146 4.541
107 HG21 ILE 11 HG21 ILE 11 19.889 2.922 4.357
108 HG22 ILE 11 HG22 ILE 11 18.520 3.119 5.452
109 HG23 ILE 11 HG23 ILE 11 18.812 4.308 4.183
110 HD11 ILE 11 HD11 ILE 11 17.346 5.042 3.294
111 HD12 ILE 11 HD12 ILE 11 15.611 4.902 3.013
112 HD13 ILE 11 HD13 ILE 11 16.748 4.330 1.797
113 H LEU 12 HN LEU 12 18.369 -0.012 1.961
114 HA LEU 12 HA LEU 12 20.936 -0.870 2.605
115 HB2 LEU 12 HB2 LEU 12 18.649 -2.035 1.086
116 HB3 LEU 12 HB1 LEU 12 20.221 -2.811 0.889
117 HG LEU 12 HG LEU 12 18.926 -3.824 2.750
118 HD11 LEU 12 HD11 LEU 12 20.910 -4.205 3.752
119 HD12 LEU 12 HD12 LEU 12 20.910 -2.580 4.435
120 HD13 LEU 12 HD13 LEU 12 21.603 -2.864 2.838
121 HD21 LEU 12 HD21 LEU 12 19.232 -1.128 4.111
122 HD22 LEU 12 HD22 LEU 12 18.339 -2.529 4.696
123 HD23 LEU 12 HD23 LEU 12 17.749 -1.630 3.304
124 H ARG 13 HN ARG 13 19.539 -0.053 -0.535
125 HA ARG 13 HA ARG 13 21.692 -0.710 -2.182
126 HB2 ARG 13 HB2 ARG 13 19.285 0.896 -2.397
127 HB3 ARG 13 HB1 ARG 13 20.627 1.663 -3.247
128 HG2 ARG 13 HG2 ARG 13 20.194 -1.289 -3.598
129 HG3 ARG 13 HG1 ARG 13 19.141 -0.164 -4.458
130 HD2 ARG 13 HD2 ARG 13 21.883 0.717 -4.677
131 HD3 ARG 13 HD1 ARG 13 21.755 -0.964 -5.192
132 HE ARG 13 HE ARG 13 19.636 0.286 -6.422
133 HH11 ARG 13 HH11 ARG 13 19.773 1.198 -8.498
134 HH12 ARG 13 HH12 ARG 13 21.311 1.699 -9.122
135 HH21 ARG 13 HH21 ARG 13 23.067 0.776 -6.262
136 HH22 ARG 13 HH22 ARG 13 23.182 1.457 -7.850
137 H LEU 14 HN LEU 14 21.069 2.230 -0.294
138 HA LEU 14 HA LEU 14 23.384 3.629 -1.212
139 HB2 LEU 14 HB2 LEU 14 22.045 4.028 1.460
140 HB3 LEU 14 HB1 LEU 14 22.925 5.209 0.495
141 HG LEU 14 HG LEU 14 20.201 4.032 -0.038
142 HD11 LEU 14 HD11 LEU 14 21.090 6.909 -0.131
143 HD12 LEU 14 HD12 LEU 14 20.607 6.139 1.380
144 HD13 LEU 14 HD13 LEU 14 19.455 6.276 0.051
145 HD21 LEU 14 HD21 LEU 14 22.151 5.315 -1.942
146 HD22 LEU 14 HD22 LEU 14 20.414 5.525 -2.172
147 HD23 LEU 14 HD23 LEU 14 21.117 3.908 -2.197
148 H ALA 15 HN ALA 15 22.592 1.690 1.586
149 HA ALA 15 HA ALA 15 24.996 1.835 2.991
150 HB1 ALA 15 HB1 ALA 15 22.840 0.742 3.753
151 HB2 ALA 15 HB2 ALA 15 24.300 -0.189 4.090
152 HB3 ALA 15 HB3 ALA 15 23.265 -0.632 2.732
153 H ALA 16 HN ALA 16 23.989 -0.137 0.289
154 HA ALA 16 HA ALA 16 26.365 -1.735 0.185
155 HB1 ALA 16 HB1 ALA 16 25.523 -2.521 -1.952
156 HB2 ALA 16 HB2 ALA 16 24.367 -1.192 -2.030
157 HB3 ALA 16 HB3 ALA 16 24.179 -2.455 -0.812
158 H ALA 17 HN ALA 17 25.133 1.136 -1.452
159 HA ALA 17 HA ALA 17 27.223 1.497 -3.287
160 HB1 ALA 17 HB1 ALA 17 25.593 3.636 -1.892
161 HB2 ALA 17 HB2 ALA 17 25.086 2.764 -3.339
162 HB3 ALA 17 HB3 ALA 17 26.492 3.827 -3.396
163 H PHE 18 HN PHE 18 26.765 2.722 0.010
164 HA PHE 18 HA PHE 18 29.226 4.143 0.139
165 HB2 PHE 18 HB2 PHE 18 27.686 2.980 2.472
166 HB3 PHE 18 HB1 PHE 18 28.809 4.339 2.507
167 HD1 PHE 18 HD1 PHE 18 25.843 4.308 3.402
168 HD2 PHE 18 HD2 PHE 18 27.765 5.464 -0.269
169 HE1 PHE 18 HE1 PHE 18 23.960 5.851 2.890
170 HE2 PHE 18 HE2 PHE 18 25.894 6.997 -0.774
171 HZ PHE 18 HZ PHE 18 23.992 7.193 0.801
172 H LYS 19 HN LYS 19 28.505 0.813 0.256
173 HA LYS 19 HA LYS 19 30.725 0.025 1.882
174 HB2 LYS 19 HB2 LYS 19 28.479 -1.273 0.797
175 HB3 LYS 19 HB1 LYS 19 29.882 -2.049 0.069
176 HG2 LYS 19 HG2 LYS 19 29.678 -3.263 2.048
177 HG3 LYS 19 HG1 LYS 19 30.829 -2.021 2.526
178 HD2 LYS 19 HD2 LYS 19 27.962 -1.313 2.835
179 HD3 LYS 19 HD1 LYS 19 28.567 -2.565 3.920
180 HE2 LYS 19 HE2 LYS 19 29.702 0.221 3.558
181 HE3 LYS 19 HE1 LYS 19 28.850 -0.384 4.976
182 HZ1 LYS 19 HZ1 LYS 19 31.592 -0.622 4.311
183 HZ2 LYS 19 HZ2 LYS 19 30.914 -2.170 4.463
184 HZ3 LYS 19 HZ3 LYS 19 30.806 -1.061 5.746
185 HN1 NH2 20 H2 LYS 19 31.880 0.390 -1.978
186 HN2 NH2 20 H1 LYS 19 30.308 0.807 -1.492