NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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|
571659 |
2mcw   |
19456 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 PHE 1 HT1 PHE 1 15.828 -6.820 -1.470
2 H2 PHE 1 HT2 PHE 1 14.897 -7.124 -2.858
3 H3 PHE 1 HT3 PHE 1 14.263 -7.455 -1.317
4 HA PHE 1 HA PHE 1 14.396 -5.063 -0.783
5 HB2 PHE 1 HB2 PHE 1 15.229 -5.002 -3.692
6 HB3 PHE 1 HB1 PHE 1 14.577 -3.586 -2.866
7 HD1 PHE 1 HD2 PHE 1 15.806 -2.499 -1.053
8 HD2 PHE 1 HD1 PHE 1 17.412 -5.926 -3.085
9 HE1 PHE 1 HE2 PHE 1 18.032 -2.045 -0.059
10 HE2 PHE 1 HE1 PHE 1 19.638 -5.472 -2.090
11 HZ PHE 1 HZ PHE 1 19.948 -3.532 -0.578
12 H ILE 2 HN ILE 2 13.276 -6.454 -3.885
13 HA ILE 2 HA ILE 2 10.867 -5.159 -4.144
14 HB ILE 2 HB ILE 2 10.113 -7.135 -5.417
15 HG12 ILE 2 HG12 ILE 2 12.647 -8.398 -4.314
16 HG13 ILE 2 HG11 ILE 2 10.999 -8.869 -3.895
17 HG21 ILE 2 HG21 ILE 2 13.058 -6.643 -5.908
18 HG22 ILE 2 HG22 ILE 2 11.816 -5.453 -6.298
19 HG23 ILE 2 HG23 ILE 2 11.812 -7.025 -7.097
20 HD11 ILE 2 HD11 ILE 2 11.779 -10.401 -5.587
21 HD12 ILE 2 HD12 ILE 2 12.318 -9.072 -6.612
22 HD13 ILE 2 HD13 ILE 2 10.595 -9.334 -6.342
23 H HIS 3 HN HIS 3 11.687 -7.821 -2.016
24 HA HIS 3 HA HIS 3 9.205 -8.779 -1.274
25 HB2 HIS 3 HB2 HIS 3 11.442 -9.598 -0.454
26 HB3 HIS 3 HB1 HIS 3 11.463 -8.232 0.661
27 HD2 HIS 3 HD2 HIS 3 10.093 -8.706 3.025
28 HE1 HIS 3 HE1 HIS 3 7.978 -12.143 1.784
29 HE2 HIS 3 HE2 HIS 3 8.481 -10.625 3.757
30 H HIS 4 HN HIS 4 10.901 -5.934 0.054
31 HA HIS 4 HA HIS 4 8.789 -5.236 1.863
32 HB2 HIS 4 HB2 HIS 4 11.162 -3.711 0.775
33 HB3 HIS 4 HB1 HIS 4 10.018 -3.006 1.919
34 HD2 HIS 4 HD2 HIS 4 9.878 -4.529 4.456
35 HE1 HIS 4 HE1 HIS 4 13.717 -6.205 3.925
36 HE2 HIS 4 HE2 HIS 4 11.842 -5.821 5.594
37 H ILE 5 HN ILE 5 9.761 -4.162 -1.348
38 HA ILE 5 HA ILE 5 7.861 -2.099 -1.676
39 HB ILE 5 HB ILE 5 8.964 -3.835 -3.890
40 HG12 ILE 5 HG12 ILE 5 10.849 -3.145 -2.532
41 HG13 ILE 5 HG11 ILE 5 10.812 -2.126 -3.969
42 HG21 ILE 5 HG21 ILE 5 7.277 -2.327 -4.677
43 HG22 ILE 5 HG22 ILE 5 8.830 -1.612 -5.108
44 HG23 ILE 5 HG23 ILE 5 7.930 -0.996 -3.723
45 HD11 ILE 5 HD11 ILE 5 11.155 -0.586 -2.223
46 HD12 ILE 5 HD12 ILE 5 10.039 -1.420 -1.142
47 HD13 ILE 5 HD13 ILE 5 9.417 -0.486 -2.502
48 H PHE 6 HN PHE 6 7.685 -5.563 -2.159
49 HA PHE 6 HA PHE 6 5.270 -5.672 -3.632
50 HB2 PHE 6 HB2 PHE 6 6.846 -7.587 -3.353
51 HB3 PHE 6 HB1 PHE 6 6.335 -7.717 -1.669
52 HD1 PHE 6 HD1 PHE 6 5.234 -8.010 -5.194
53 HD2 PHE 6 HD2 PHE 6 4.182 -8.629 -1.076
54 HE1 PHE 6 HE1 PHE 6 3.263 -9.342 -5.897
55 HE2 PHE 6 HE2 PHE 6 2.212 -9.961 -1.779
56 HZ PHE 6 HZ PHE 6 1.752 -10.318 -4.190
57 H ARG 7 HN ARG 7 5.984 -5.706 -0.177
58 HA ARG 7 HA ARG 7 3.380 -6.152 0.782
59 HB2 ARG 7 HB2 ARG 7 5.729 -4.690 1.997
60 HB3 ARG 7 HB1 ARG 7 4.225 -4.995 2.866
61 HG2 ARG 7 HG2 ARG 7 4.494 -7.417 2.501
62 HG3 ARG 7 HG1 ARG 7 5.995 -7.123 1.622
63 HD2 ARG 7 HD2 ARG 7 6.966 -6.077 3.642
64 HD3 ARG 7 HD1 ARG 7 5.472 -6.395 4.518
65 HE ARG 7 HE ARG 7 6.561 -8.788 3.374
66 HH11 ARG 7 HH21 ARG 7 6.826 -6.513 5.968
67 HH12 ARG 7 HH22 ARG 7 7.521 -7.648 7.076
68 HH21 ARG 7 HH11 ARG 7 7.472 -10.282 4.820
69 HH22 ARG 7 HH12 ARG 7 7.887 -9.782 6.427
70 H GLY 8 HN GLY 8 5.003 -3.209 -0.274
71 HA2 GLY 8 HA2 GLY 8 3.037 -1.384 0.708
72 HA3 GLY 8 HA1 GLY 8 4.265 -1.038 -0.505
73 H ILE 9 HN ILE 9 3.553 -3.035 -2.377
74 HA ILE 9 HA ILE 9 1.565 -1.675 -3.867
75 HB ILE 9 HB ILE 9 2.661 -4.482 -4.180
76 HG12 ILE 9 HG12 ILE 9 3.281 -1.931 -5.701
77 HG13 ILE 9 HG11 ILE 9 4.257 -2.528 -4.360
78 HG21 ILE 9 HG21 ILE 9 0.918 -2.784 -5.989
79 HG22 ILE 9 HG22 ILE 9 0.544 -4.381 -5.339
80 HG23 ILE 9 HG23 ILE 9 1.810 -4.196 -6.550
81 HD11 ILE 9 HD11 ILE 9 3.720 -3.945 -6.984
82 HD12 ILE 9 HD12 ILE 9 4.544 -4.687 -5.613
83 HD13 ILE 9 HD13 ILE 9 5.263 -3.299 -6.427
84 H VAL 10 HN VAL 10 1.424 -4.810 -2.174
85 HA VAL 10 HA VAL 10 -1.342 -5.236 -2.643
86 HB VAL 10 HB VAL 10 0.141 -7.080 -2.060
87 HG11 VAL 10 HG11 VAL 10 1.243 -7.257 0.039
88 HG12 VAL 10 HG12 VAL 10 0.297 -5.941 0.734
89 HG13 VAL 10 HG13 VAL 10 1.524 -5.598 -0.484
90 HG21 VAL 10 HG21 VAL 10 -1.769 -6.704 0.255
91 HG22 VAL 10 HG22 VAL 10 -1.317 -8.206 -0.552
92 HG23 VAL 10 HG23 VAL 10 -2.342 -7.033 -1.381
93 H HIS 11 HN HIS 11 0.442 -3.829 0.075
94 HA HIS 11 HA HIS 11 -1.804 -3.461 1.772
95 HB2 HIS 11 HB2 HIS 11 0.531 -3.415 2.584
96 HB3 HIS 11 HB1 HIS 11 0.797 -1.912 1.698
97 HD2 HIS 11 HD2 HIS 11 -1.924 -3.022 4.413
98 HE1 HIS 11 HE1 HIS 11 -0.749 0.967 5.141
99 HE2 HIS 11 HE2 HIS 11 -2.230 -0.931 5.947
100 H ALA 12 HN ALA 12 -0.159 -1.313 -0.538
101 HA ALA 12 HA ALA 12 -1.731 0.983 -0.053
102 HB1 ALA 12 HB1 ALA 12 -0.951 1.663 -2.350
103 HB2 ALA 12 HB2 ALA 12 -0.192 0.078 -2.492
104 HB3 ALA 12 HB3 ALA 12 0.346 1.205 -1.247
105 H GLY 13 HN GLY 13 -2.327 -1.929 -1.817
106 HA2 GLY 13 HA2 GLY 13 -4.396 -0.935 -3.537
107 HA3 GLY 13 HA1 GLY 13 -4.091 -2.627 -3.152
108 H ARG 14 HN ARG 14 -4.373 -2.677 -0.454
109 HA ARG 14 HA ARG 14 -7.159 -2.858 -0.098
110 HB2 ARG 14 HB2 ARG 14 -4.893 -2.782 1.901
111 HB3 ARG 14 HB1 ARG 14 -6.573 -3.068 2.355
112 HG2 ARG 14 HG2 ARG 14 -6.672 -5.038 0.922
113 HG3 ARG 14 HG1 ARG 14 -5.038 -4.726 0.333
114 HD2 ARG 14 HD2 ARG 14 -4.972 -6.441 2.077
115 HD3 ARG 14 HD1 ARG 14 -4.178 -4.976 2.649
116 HE ARG 14 HE ARG 14 -6.986 -5.142 3.342
117 HH11 ARG 14 HH21 ARG 14 -3.726 -5.939 4.185
118 HH12 ARG 14 HH22 ARG 14 -4.054 -6.083 5.880
119 HH21 ARG 14 HH11 ARG 14 -7.423 -5.328 5.564
120 HH22 ARG 14 HH12 ARG 14 -6.147 -5.736 6.661
121 H SER 15 HN SER 15 -4.863 -0.303 0.706
122 HA SER 15 HA SER 15 -6.581 1.286 2.292
123 HB2 SER 15 HB2 SER 15 -4.276 1.821 2.364
124 HB3 SER 15 HB1 SER 15 -4.161 1.920 0.608
125 HG SER 15 HG SER 15 -5.033 3.866 0.652
126 H ILE 16 HN ILE 16 -5.929 1.243 -1.182
127 HA ILE 16 HA ILE 16 -7.540 3.463 -1.885
128 HB ILE 16 HB ILE 16 -6.720 1.028 -3.485
129 HG12 ILE 16 HG12 ILE 16 -5.724 3.892 -3.600
130 HG13 ILE 16 HG11 ILE 16 -4.944 2.641 -2.634
131 HG21 ILE 16 HG21 ILE 16 -8.657 1.892 -4.582
132 HG22 ILE 16 HG22 ILE 16 -7.286 2.586 -5.445
133 HG23 ILE 16 HG23 ILE 16 -8.175 3.561 -4.275
134 HD11 ILE 16 HD11 ILE 16 -4.830 1.262 -4.801
135 HD12 ILE 16 HD12 ILE 16 -3.758 2.657 -4.697
136 HD13 ILE 16 HD13 ILE 16 -5.246 2.758 -5.639
137 H GLY 17 HN GLY 17 -8.246 -0.008 -1.682
138 HA2 GLY 17 HA2 GLY 17 -10.928 0.154 -2.612
139 HA3 GLY 17 HA1 GLY 17 -10.233 -1.173 -1.687
140 H ARG 18 HN ARG 18 -9.416 0.478 0.543
141 HA ARG 18 HA ARG 18 -11.707 0.295 2.161
142 HB2 ARG 18 HB2 ARG 18 -9.381 0.266 3.023
143 HB3 ARG 18 HB1 ARG 18 -9.236 1.980 2.632
144 HG2 ARG 18 HG2 ARG 18 -11.080 2.513 4.157
145 HG3 ARG 18 HG1 ARG 18 -11.301 0.799 4.514
146 HD2 ARG 18 HD2 ARG 18 -8.945 0.731 5.364
147 HD3 ARG 18 HD1 ARG 18 -8.852 2.474 5.128
148 HE ARG 18 HE ARG 18 -10.228 2.767 6.998
149 HH11 ARG 18 HH21 ARG 18 -10.080 -0.544 6.002
150 HH12 ARG 18 HH22 ARG 18 -10.857 -1.151 7.426
151 HH21 ARG 18 HH11 ARG 18 -11.247 1.978 8.869
152 HH22 ARG 18 HH12 ARG 18 -11.518 0.277 9.049
153 H PHE 19 HN PHE 19 -10.245 3.072 0.495
154 HA PHE 19 HA PHE 19 -11.964 5.046 1.585
155 HB2 PHE 19 HB2 PHE 19 -10.274 4.929 -0.914
156 HB3 PHE 19 HB1 PHE 19 -11.266 6.334 -0.525
157 HD1 PHE 19 HD2 PHE 19 -11.043 7.182 1.986
158 HD2 PHE 19 HD1 PHE 19 -8.071 4.890 -0.101
159 HE1 PHE 19 HE2 PHE 19 -9.309 8.002 3.557
160 HE2 PHE 19 HE1 PHE 19 -6.337 5.707 1.472
161 HZ PHE 19 HZ PHE 19 -6.955 7.264 3.300
162 H LEU 20 HN LEU 20 -12.230 2.880 -1.181
163 HA LEU 20 HA LEU 20 -14.293 4.044 -2.601
164 HB2 LEU 20 HB2 LEU 20 -13.084 1.949 -3.252
165 HB3 LEU 20 HB1 LEU 20 -14.023 1.082 -2.038
166 HG LEU 20 HG LEU 20 -16.120 1.815 -3.184
167 HD11 LEU 20 HD11 LEU 20 -14.112 3.170 -4.961
168 HD12 LEU 20 HD12 LEU 20 -15.691 3.737 -4.415
169 HD13 LEU 20 HD13 LEU 20 -15.584 2.534 -5.694
170 HD21 LEU 20 HD21 LEU 20 -15.747 0.352 -5.237
171 HD22 LEU 20 HD22 LEU 20 -15.314 -0.383 -3.693
172 HD23 LEU 20 HD23 LEU 20 -14.054 0.250 -4.751
173 H THR 21 HN THR 21 -14.419 2.259 0.426
174 HA THR 21 HA THR 21 -17.125 1.710 0.641
175 HB THR 21 HB THR 21 -15.443 2.763 2.921
176 HG1 THR 21 HG1 THR 21 -14.229 1.099 2.617
177 HG21 THR 21 HG21 THR 21 -17.682 0.726 2.770
178 HG22 THR 21 HG22 THR 21 -17.836 2.372 3.383
179 HG23 THR 21 HG23 THR 21 -16.824 1.204 4.234
180 H GLY 22 HN GLY 22 -18.927 2.887 0.883
181 HA2 GLY 22 HA2 GLY 22 -20.314 4.724 0.946
182 HA3 GLY 22 HA1 GLY 22 -19.221 5.327 2.187
183 HN1 NH2 23 HT1 GLY 22 -17.349 6.372 -1.208
184 HN2 NH2 23 HT2 GLY 22 -17.305 4.798 -0.487
Start of MODEL 2
1 H1 PHE 1 HT1 PHE 1 14.491 -8.677 -1.347
2 H2 PHE 1 HT2 PHE 1 15.845 -8.019 -2.135
3 H3 PHE 1 HT3 PHE 1 14.363 -8.155 -2.955
4 HA PHE 1 HA PHE 1 14.465 -6.578 -0.485
5 HB2 PHE 1 HB2 PHE 1 16.416 -5.883 -1.918
6 HB3 PHE 1 HB1 PHE 1 15.268 -5.510 -3.205
7 HD1 PHE 1 HD2 PHE 1 16.089 -4.731 0.358
8 HD2 PHE 1 HD1 PHE 1 14.131 -3.442 -3.242
9 HE1 PHE 1 HE2 PHE 1 15.652 -2.518 1.388
10 HE2 PHE 1 HE1 PHE 1 13.695 -1.228 -2.212
11 HZ PHE 1 HZ PHE 1 14.454 -0.766 0.102
12 H ILE 2 HN ILE 2 13.286 -7.312 -3.739
13 HA ILE 2 HA ILE 2 11.201 -5.514 -3.981
14 HB ILE 2 HB ILE 2 11.172 -8.423 -4.822
15 HG12 ILE 2 HG12 ILE 2 12.106 -6.002 -6.391
16 HG13 ILE 2 HG11 ILE 2 13.206 -7.079 -5.532
17 HG21 ILE 2 HG21 ILE 2 8.988 -7.398 -5.040
18 HG22 ILE 2 HG22 ILE 2 9.709 -7.489 -6.647
19 HG23 ILE 2 HG23 ILE 2 9.689 -5.957 -5.775
20 HD11 ILE 2 HD11 ILE 2 11.334 -7.813 -7.798
21 HD12 ILE 2 HD12 ILE 2 12.223 -8.999 -6.840
22 HD13 ILE 2 HD13 ILE 2 13.097 -7.828 -7.827
23 H HIS 3 HN HIS 3 11.425 -8.431 -2.052
24 HA HIS 3 HA HIS 3 8.801 -8.998 -1.451
25 HB2 HIS 3 HB2 HIS 3 11.185 -8.970 0.413
26 HB3 HIS 3 HB1 HIS 3 9.635 -9.718 0.795
27 HD2 HIS 3 HD2 HIS 3 12.872 -10.587 -1.091
28 HE1 HIS 3 HE1 HIS 3 10.027 -13.508 -2.190
29 HE2 HIS 3 HE2 HIS 3 12.486 -12.879 -2.283
30 H HIS 4 HN HIS 4 10.842 -6.473 -0.002
31 HA HIS 4 HA HIS 4 8.867 -5.532 1.832
32 HB2 HIS 4 HB2 HIS 4 11.285 -5.070 2.091
33 HB3 HIS 4 HB1 HIS 4 11.231 -4.054 0.650
34 HD2 HIS 4 HD2 HIS 4 10.210 -3.883 4.417
35 HE1 HIS 4 HE1 HIS 4 9.145 -0.207 2.632
36 HE2 HIS 4 HE2 HIS 4 9.356 -1.451 4.836
37 H ILE 5 HN ILE 5 9.938 -4.394 -1.357
38 HA ILE 5 HA ILE 5 8.181 -2.212 -1.591
39 HB ILE 5 HB ILE 5 9.323 -3.988 -3.758
40 HG12 ILE 5 HG12 ILE 5 10.242 -1.272 -2.756
41 HG13 ILE 5 HG11 ILE 5 10.952 -2.798 -2.228
42 HG21 ILE 5 HG21 ILE 5 8.931 -1.895 -5.158
43 HG22 ILE 5 HG22 ILE 5 7.925 -1.301 -3.837
44 HG23 ILE 5 HG23 ILE 5 7.476 -2.775 -4.696
45 HD11 ILE 5 HD11 ILE 5 11.016 -1.544 -4.971
46 HD12 ILE 5 HD12 ILE 5 11.265 -3.278 -4.770
47 HD13 ILE 5 HD13 ILE 5 12.362 -2.137 -4.001
48 H PHE 6 HN PHE 6 7.719 -5.641 -2.137
49 HA PHE 6 HA PHE 6 5.305 -5.509 -3.610
50 HB2 PHE 6 HB2 PHE 6 6.707 -7.551 -3.393
51 HB3 PHE 6 HB1 PHE 6 6.206 -7.682 -1.707
52 HD1 PHE 6 HD2 PHE 6 4.976 -7.689 -5.218
53 HD2 PHE 6 HD1 PHE 6 4.060 -8.548 -1.110
54 HE1 PHE 6 HE2 PHE 6 2.901 -8.849 -5.924
55 HE2 PHE 6 HE1 PHE 6 1.986 -9.709 -1.815
56 HZ PHE 6 HZ PHE 6 1.406 -9.859 -4.221
57 H ARG 7 HN ARG 7 5.947 -5.797 -0.138
58 HA ARG 7 HA ARG 7 3.316 -6.021 0.771
59 HB2 ARG 7 HB2 ARG 7 5.481 -6.211 2.125
60 HB3 ARG 7 HB1 ARG 7 5.446 -4.451 2.228
61 HG2 ARG 7 HG2 ARG 7 4.249 -4.980 4.161
62 HG3 ARG 7 HG1 ARG 7 2.923 -4.886 3.004
63 HD2 ARG 7 HD2 ARG 7 3.014 -7.321 2.673
64 HD3 ARG 7 HD1 ARG 7 4.372 -7.433 3.788
65 HE ARG 7 HE ARG 7 2.507 -6.269 5.337
66 HH11 ARG 7 HH21 ARG 7 2.394 -8.951 3.154
67 HH12 ARG 7 HH22 ARG 7 1.156 -9.788 4.029
68 HH21 ARG 7 HH11 ARG 7 0.884 -7.360 6.490
69 HH22 ARG 7 HH12 ARG 7 0.302 -8.888 5.917
70 H GLY 8 HN GLY 8 5.151 -3.199 -0.233
71 HA2 GLY 8 HA2 GLY 8 3.316 -1.248 0.752
72 HA3 GLY 8 HA1 GLY 8 4.572 -0.979 -0.452
73 H ILE 9 HN ILE 9 3.665 -2.980 -2.308
74 HA ILE 9 HA ILE 9 1.805 -1.444 -3.811
75 HB ILE 9 HB ILE 9 2.734 -4.305 -4.131
76 HG12 ILE 9 HG12 ILE 9 3.476 -1.771 -5.631
77 HG13 ILE 9 HG11 ILE 9 4.450 -2.480 -4.343
78 HG21 ILE 9 HG21 ILE 9 1.885 -3.909 -6.527
79 HG22 ILE 9 HG22 ILE 9 0.993 -2.540 -5.870
80 HG23 ILE 9 HG23 ILE 9 0.653 -4.173 -5.297
81 HD11 ILE 9 HD11 ILE 9 4.599 -4.594 -5.656
82 HD12 ILE 9 HD12 ILE 9 5.313 -3.224 -6.506
83 HD13 ILE 9 HD13 ILE 9 3.714 -3.810 -6.963
84 H VAL 10 HN VAL 10 1.440 -4.583 -2.155
85 HA VAL 10 HA VAL 10 -1.339 -4.845 -2.653
86 HB VAL 10 HB VAL 10 -1.279 -6.570 -0.880
87 HG11 VAL 10 HG11 VAL 10 1.243 -6.752 -2.539
88 HG12 VAL 10 HG12 VAL 10 -0.360 -6.912 -3.257
89 HG13 VAL 10 HG13 VAL 10 0.177 -8.062 -2.033
90 HG21 VAL 10 HG21 VAL 10 1.119 -6.971 0.066
91 HG22 VAL 10 HG22 VAL 10 0.137 -5.698 0.789
92 HG23 VAL 10 HG23 VAL 10 1.399 -5.289 -0.372
93 H HIS 11 HN HIS 11 0.484 -3.515 0.075
94 HA HIS 11 HA HIS 11 -1.755 -3.011 1.748
95 HB2 HIS 11 HB2 HIS 11 0.639 -3.061 2.499
96 HB3 HIS 11 HB1 HIS 11 0.866 -1.503 1.703
97 HD2 HIS 11 HD2 HIS 11 0.296 0.613 3.378
98 HE1 HIS 11 HE1 HIS 11 -2.212 -1.423 6.096
99 HE2 HIS 11 HE2 HIS 11 -1.105 0.802 5.574
100 H ALA 12 HN ALA 12 -0.019 -1.015 -0.621
101 HA ALA 12 HA ALA 12 -1.449 1.378 -0.179
102 HB1 ALA 12 HB1 ALA 12 0.553 1.582 -1.413
103 HB2 ALA 12 HB2 ALA 12 -0.719 1.859 -2.603
104 HB3 ALA 12 HB3 ALA 12 0.095 0.296 -2.531
105 H GLY 13 HN GLY 13 -2.258 -1.546 -1.829
106 HA2 GLY 13 HA2 GLY 13 -4.363 -0.404 -3.456
107 HA3 GLY 13 HA1 GLY 13 -4.023 -2.118 -3.240
108 H ARG 14 HN ARG 14 -4.160 -2.282 -0.457
109 HA ARG 14 HA ARG 14 -6.861 -2.731 0.011
110 HB2 ARG 14 HB2 ARG 14 -4.629 -2.165 1.977
111 HB3 ARG 14 HB1 ARG 14 -6.228 -2.738 2.447
112 HG2 ARG 14 HG2 ARG 14 -4.714 -4.250 0.328
113 HG3 ARG 14 HG1 ARG 14 -4.270 -4.483 2.018
114 HD2 ARG 14 HD2 ARG 14 -6.582 -5.100 2.565
115 HD3 ARG 14 HD1 ARG 14 -7.072 -4.814 0.901
116 HE ARG 14 HE ARG 14 -6.143 -6.864 0.317
117 HH11 ARG 14 HH21 ARG 14 -5.112 -5.855 3.462
118 HH12 ARG 14 HH22 ARG 14 -4.355 -7.364 3.849
119 HH21 ARG 14 HH11 ARG 14 -5.152 -8.846 0.818
120 HH22 ARG 14 HH12 ARG 14 -4.377 -9.057 2.353
121 H SER 15 HN SER 15 -4.940 0.169 0.558
122 HA SER 15 HA SER 15 -6.818 1.613 2.093
123 HB2 SER 15 HB2 SER 15 -4.585 2.436 2.014
124 HB3 SER 15 HB1 SER 15 -4.589 2.486 0.253
125 HG SER 15 HG SER 15 -6.063 4.159 0.335
126 H ILE 16 HN ILE 16 -6.327 1.323 -1.393
127 HA ILE 16 HA ILE 16 -8.213 3.279 -2.189
128 HB ILE 16 HB ILE 16 -7.430 0.777 -3.704
129 HG12 ILE 16 HG12 ILE 16 -5.400 1.959 -2.982
130 HG13 ILE 16 HG11 ILE 16 -5.650 2.254 -4.703
131 HG21 ILE 16 HG21 ILE 16 -8.517 3.483 -4.516
132 HG22 ILE 16 HG22 ILE 16 -9.286 1.913 -4.745
133 HG23 ILE 16 HG23 ILE 16 -7.839 2.328 -5.663
134 HD11 ILE 16 HD11 ILE 16 -6.959 4.383 -3.873
135 HD12 ILE 16 HD12 ILE 16 -5.203 4.422 -3.914
136 HD13 ILE 16 HD13 ILE 16 -6.039 4.138 -2.389
137 H GLY 17 HN GLY 17 -8.512 -0.214 -1.641
138 HA2 GLY 17 HA2 GLY 17 -11.236 -0.412 -2.434
139 HA3 GLY 17 HA1 GLY 17 -10.360 -1.577 -1.446
140 H ARG 18 HN ARG 18 -9.659 0.033 0.718
141 HA ARG 18 HA ARG 18 -12.024 -0.045 2.279
142 HB2 ARG 18 HB2 ARG 18 -9.308 1.185 2.765
143 HB3 ARG 18 HB1 ARG 18 -10.595 1.193 3.972
144 HG2 ARG 18 HG2 ARG 18 -10.702 -1.252 3.920
145 HG3 ARG 18 HG1 ARG 18 -9.476 -1.298 2.653
146 HD2 ARG 18 HD2 ARG 18 -8.429 -1.736 4.816
147 HD3 ARG 18 HD1 ARG 18 -7.874 -0.186 4.191
148 HE ARG 18 HE ARG 18 -10.146 0.208 5.844
149 HH11 ARG 18 HH21 ARG 18 -6.800 -0.663 5.935
150 HH12 ARG 18 HH22 ARG 18 -6.538 -0.043 7.531
151 HH21 ARG 18 HH11 ARG 18 -9.812 1.026 7.936
152 HH22 ARG 18 HH12 ARG 18 -8.244 0.913 8.664
153 H PHE 19 HN PHE 19 -10.304 2.569 0.641
154 HA PHE 19 HA PHE 19 -11.854 4.692 1.745
155 HB2 PHE 19 HB2 PHE 19 -9.910 4.393 -0.515
156 HB3 PHE 19 HB1 PHE 19 -10.959 5.811 -0.517
157 HD1 PHE 19 HD1 PHE 19 -9.333 3.895 2.274
158 HD2 PHE 19 HD2 PHE 19 -9.721 7.656 0.231
159 HE1 PHE 19 HE1 PHE 19 -7.891 4.971 3.979
160 HE2 PHE 19 HE2 PHE 19 -8.277 8.729 1.938
161 HZ PHE 19 HZ PHE 19 -7.363 7.388 3.812
162 H LEU 20 HN LEU 20 -12.180 2.630 -1.091
163 HA LEU 20 HA LEU 20 -14.080 3.996 -2.549
164 HB2 LEU 20 HB2 LEU 20 -13.072 1.911 -3.351
165 HB3 LEU 20 HB1 LEU 20 -13.910 1.004 -2.092
166 HG LEU 20 HG LEU 20 -16.092 1.671 -3.061
167 HD11 LEU 20 HD11 LEU 20 -15.785 3.760 -4.081
168 HD12 LEU 20 HD12 LEU 20 -15.861 2.700 -5.480
169 HD13 LEU 20 HD13 LEU 20 -14.299 3.259 -4.888
170 HD21 LEU 20 HD21 LEU 20 -15.253 -0.409 -3.887
171 HD22 LEU 20 HD22 LEU 20 -14.082 0.398 -4.929
172 HD23 LEU 20 HD23 LEU 20 -15.802 0.483 -5.306
173 H THR 21 HN THR 21 -14.466 2.143 0.399
174 HA THR 21 HA THR 21 -17.200 1.741 0.505
175 HB THR 21 HB THR 21 -15.399 2.614 2.778
176 HG1 THR 21 HG1 THR 21 -16.149 0.066 1.780
177 HG21 THR 21 HG21 THR 21 -17.710 2.842 3.433
178 HG22 THR 21 HG22 THR 21 -17.099 1.349 4.145
179 HG23 THR 21 HG23 THR 21 -18.120 1.288 2.709
180 H GLY 22 HN GLY 22 -15.454 4.635 1.692
181 HA2 GLY 22 HA2 GLY 22 -17.264 6.505 0.652
182 HA3 GLY 22 HA1 GLY 22 -17.754 6.144 2.304
183 HN1 NH2 23 HT1 GLY 22 -13.888 7.143 2.734
184 HN2 NH2 23 HT2 GLY 22 -14.466 5.595 2.216
Start of MODEL 3
1 H1 PHE 1 HT1 PHE 1 15.673 -7.167 -2.719
2 H2 PHE 1 HT2 PHE 1 14.101 -7.771 -2.951
3 H3 PHE 1 HT3 PHE 1 14.815 -7.821 -1.410
4 HA PHE 1 HA PHE 1 14.260 -5.731 -0.928
5 HB2 PHE 1 HB2 PHE 1 14.982 -5.145 -3.813
6 HB3 PHE 1 HB1 PHE 1 14.448 -3.912 -2.672
7 HD1 PHE 1 HD2 PHE 1 17.143 -6.274 -3.536
8 HD2 PHE 1 HD1 PHE 1 15.850 -3.227 -0.797
9 HE1 PHE 1 HE2 PHE 1 19.449 -6.102 -2.637
10 HE2 PHE 1 HE1 PHE 1 18.155 -3.056 0.102
11 HZ PHE 1 HZ PHE 1 19.955 -4.493 -0.818
12 H ILE 2 HN ILE 2 13.089 -6.905 -4.063
13 HA ILE 2 HA ILE 2 10.724 -5.533 -4.315
14 HB ILE 2 HB ILE 2 10.569 -8.460 -4.933
15 HG12 ILE 2 HG12 ILE 2 12.963 -8.109 -5.268
16 HG13 ILE 2 HG11 ILE 2 12.180 -8.191 -6.841
17 HG21 ILE 2 HG21 ILE 2 8.931 -6.815 -5.799
18 HG22 ILE 2 HG22 ILE 2 9.825 -7.580 -7.113
19 HG23 ILE 2 HG23 ILE 2 10.238 -5.944 -6.598
20 HD11 ILE 2 HD11 ILE 2 13.650 -5.969 -5.621
21 HD12 ILE 2 HD12 ILE 2 12.067 -5.465 -6.205
22 HD13 ILE 2 HD13 ILE 2 13.210 -6.221 -7.307
23 H HIS 3 HN HIS 3 11.484 -8.199 -2.171
24 HA HIS 3 HA HIS 3 8.978 -9.052 -1.376
25 HB2 HIS 3 HB2 HIS 3 11.488 -8.651 0.259
26 HB3 HIS 3 HB1 HIS 3 10.056 -9.487 0.865
27 HD2 HIS 3 HD2 HIS 3 9.520 -12.006 -0.410
28 HE1 HIS 3 HE1 HIS 3 13.200 -12.185 -2.471
29 HE2 HIS 3 HE2 HIS 3 11.131 -13.503 -1.817
30 H HIS 4 HN HIS 4 10.828 -6.285 -0.070
31 HA HIS 4 HA HIS 4 8.776 -5.475 1.749
32 HB2 HIS 4 HB2 HIS 4 11.181 -4.038 0.616
33 HB3 HIS 4 HB1 HIS 4 10.109 -3.330 1.825
34 HD2 HIS 4 HD2 HIS 4 10.091 -4.791 4.359
35 HE1 HIS 4 HE1 HIS 4 13.711 -6.809 3.557
36 HE2 HIS 4 HE2 HIS 4 12.013 -6.246 5.360
37 H ILE 5 HN ILE 5 9.826 -4.261 -1.413
38 HA ILE 5 HA ILE 5 7.949 -2.191 -1.678
39 HB ILE 5 HB ILE 5 9.139 -3.878 -3.889
40 HG12 ILE 5 HG12 ILE 5 10.136 -1.249 -2.755
41 HG13 ILE 5 HG11 ILE 5 10.775 -2.815 -2.257
42 HG21 ILE 5 HG21 ILE 5 8.834 -1.645 -5.126
43 HG22 ILE 5 HG22 ILE 5 7.773 -1.181 -3.796
44 HG23 ILE 5 HG23 ILE 5 7.370 -2.573 -4.803
45 HD11 ILE 5 HD11 ILE 5 11.343 -3.307 -4.629
46 HD12 ILE 5 HD12 ILE 5 12.180 -1.874 -4.032
47 HD13 ILE 5 HD13 ILE 5 10.773 -1.701 -5.079
48 H PHE 6 HN PHE 6 7.695 -5.630 -2.291
49 HA PHE 6 HA PHE 6 5.287 -5.609 -3.785
50 HB2 PHE 6 HB2 PHE 6 6.751 -7.577 -3.681
51 HB3 PHE 6 HB1 PHE 6 6.398 -7.757 -1.963
52 HD1 PHE 6 HD2 PHE 6 4.713 -7.555 -5.303
53 HD2 PHE 6 HD1 PHE 6 4.541 -9.025 -1.269
54 HE1 PHE 6 HE2 PHE 6 2.669 -8.841 -5.859
55 HE2 PHE 6 HE1 PHE 6 2.495 -10.311 -1.826
56 HZ PHE 6 HZ PHE 6 1.559 -10.220 -4.120
57 H ARG 7 HN ARG 7 5.950 -5.883 -0.324
58 HA ARG 7 HA ARG 7 3.290 -6.280 0.528
59 HB2 ARG 7 HB2 ARG 7 5.687 -5.085 1.928
60 HB3 ARG 7 HB1 ARG 7 4.142 -5.365 2.733
61 HG2 ARG 7 HG2 ARG 7 4.263 -7.751 2.212
62 HG3 ARG 7 HG1 ARG 7 5.760 -7.502 1.311
63 HD2 ARG 7 HD2 ARG 7 6.312 -8.317 3.534
64 HD3 ARG 7 HD1 ARG 7 6.824 -6.636 3.399
65 HE ARG 7 HE ARG 7 4.182 -6.803 4.460
66 HH11 ARG 7 HH21 ARG 7 7.525 -7.287 5.208
67 HH12 ARG 7 HH22 ARG 7 7.335 -6.973 6.900
68 HH21 ARG 7 HH11 ARG 7 3.923 -6.390 6.679
69 HH22 ARG 7 HH12 ARG 7 5.296 -6.466 7.734
70 H GLY 8 HN GLY 8 5.138 -3.362 -0.172
71 HA2 GLY 8 HA2 GLY 8 3.329 -1.479 0.927
72 HA3 GLY 8 HA1 GLY 8 4.529 -1.148 -0.319
73 H ILE 9 HN ILE 9 3.510 -3.109 -2.168
74 HA ILE 9 HA ILE 9 1.633 -1.498 -3.573
75 HB ILE 9 HB ILE 9 2.427 -4.395 -3.940
76 HG12 ILE 9 HG12 ILE 9 3.165 -1.923 -5.545
77 HG13 ILE 9 HG11 ILE 9 4.176 -2.586 -4.264
78 HG21 ILE 9 HG21 ILE 9 0.664 -2.569 -5.587
79 HG22 ILE 9 HG22 ILE 9 0.290 -4.182 -4.980
80 HG23 ILE 9 HG23 ILE 9 1.461 -3.981 -6.282
81 HD11 ILE 9 HD11 ILE 9 3.626 -3.664 -6.996
82 HD12 ILE 9 HD12 ILE 9 3.820 -4.846 -5.703
83 HD13 ILE 9 HD13 ILE 9 5.115 -3.707 -6.057
84 H VAL 10 HN VAL 10 1.273 -4.508 -1.721
85 HA VAL 10 HA VAL 10 -1.535 -4.736 -2.111
86 HB VAL 10 HB VAL 10 0.244 -5.870 0.060
87 HG11 VAL 10 HG11 VAL 10 -2.015 -5.939 0.859
88 HG12 VAL 10 HG12 VAL 10 -1.669 -7.547 0.223
89 HG13 VAL 10 HG13 VAL 10 -2.629 -6.410 -0.726
90 HG21 VAL 10 HG21 VAL 10 0.680 -6.474 -2.394
91 HG22 VAL 10 HG22 VAL 10 -0.908 -7.244 -2.378
92 HG23 VAL 10 HG23 VAL 10 0.366 -7.826 -1.306
93 H HIS 11 HN HIS 11 0.431 -3.428 0.543
94 HA HIS 11 HA HIS 11 -1.756 -2.723 2.211
95 HB2 HIS 11 HB2 HIS 11 0.577 -2.947 3.018
96 HB3 HIS 11 HB1 HIS 11 1.010 -1.499 2.110
97 HD2 HIS 11 HD2 HIS 11 0.818 0.743 3.695
98 HE1 HIS 11 HE1 HIS 11 -2.145 -0.641 6.365
99 HE2 HIS 11 HE2 HIS 11 -0.620 1.309 5.800
100 H ALA 12 HN ALA 12 0.184 -0.841 -0.114
101 HA ALA 12 HA ALA 12 -1.155 1.620 0.293
102 HB1 ALA 12 HB1 ALA 12 0.320 0.603 -2.148
103 HB2 ALA 12 HB2 ALA 12 1.041 1.476 -0.796
104 HB3 ALA 12 HB3 ALA 12 -0.127 2.282 -1.844
105 H GLY 13 HN GLY 13 -1.871 -1.198 -1.626
106 HA2 GLY 13 HA2 GLY 13 -3.845 0.085 -3.300
107 HA3 GLY 13 HA1 GLY 13 -3.553 -1.647 -3.172
108 H ARG 14 HN ARG 14 -3.915 -2.030 -0.461
109 HA ARG 14 HA ARG 14 -6.632 -2.455 -0.195
110 HB2 ARG 14 HB2 ARG 14 -4.909 -3.471 1.272
111 HB3 ARG 14 HB1 ARG 14 -4.698 -1.911 2.069
112 HG2 ARG 14 HG2 ARG 14 -7.018 -1.924 2.809
113 HG3 ARG 14 HG1 ARG 14 -7.330 -3.412 1.914
114 HD2 ARG 14 HD2 ARG 14 -5.325 -3.140 4.172
115 HD3 ARG 14 HD1 ARG 14 -6.939 -3.825 4.340
116 HE ARG 14 HE ARG 14 -4.642 -5.146 3.257
117 HH11 ARG 14 HH21 ARG 14 -8.076 -4.796 2.996
118 HH12 ARG 14 HH22 ARG 14 -8.327 -6.382 2.348
119 HH21 ARG 14 HH11 ARG 14 -4.964 -7.227 2.407
120 HH22 ARG 14 HH12 ARG 14 -6.565 -7.759 2.013
121 H SER 15 HN SER 15 -4.775 0.427 0.544
122 HA SER 15 HA SER 15 -6.675 1.810 2.100
123 HB2 SER 15 HB2 SER 15 -4.333 2.541 1.859
124 HB3 SER 15 HB1 SER 15 -4.631 2.933 0.167
125 HG SER 15 HG SER 15 -5.458 4.220 2.496
126 H ILE 16 HN ILE 16 -6.163 1.686 -1.403
127 HA ILE 16 HA ILE 16 -8.145 3.587 -2.110
128 HB ILE 16 HB ILE 16 -6.841 1.310 -3.612
129 HG12 ILE 16 HG12 ILE 16 -5.883 3.214 -4.902
130 HG13 ILE 16 HG11 ILE 16 -6.760 4.339 -3.864
131 HG21 ILE 16 HG21 ILE 16 -9.089 3.130 -4.490
132 HG22 ILE 16 HG22 ILE 16 -8.966 1.381 -4.663
133 HG23 ILE 16 HG23 ILE 16 -7.966 2.436 -5.660
134 HD11 ILE 16 HD11 ILE 16 -4.269 3.772 -3.292
135 HD12 ILE 16 HD12 ILE 16 -4.937 2.276 -2.644
136 HD13 ILE 16 HD13 ILE 16 -5.452 3.828 -1.986
137 H GLY 17 HN GLY 17 -8.262 0.045 -1.788
138 HA2 GLY 17 HA2 GLY 17 -10.951 -0.271 -2.609
139 HA3 GLY 17 HA1 GLY 17 -10.031 -1.419 -1.642
140 H ARG 18 HN ARG 18 -9.468 0.311 0.549
141 HA ARG 18 HA ARG 18 -11.787 -0.078 2.115
142 HB2 ARG 18 HB2 ARG 18 -9.284 1.551 2.580
143 HB3 ARG 18 HB1 ARG 18 -10.545 1.361 3.795
144 HG2 ARG 18 HG2 ARG 18 -9.405 -1.102 2.483
145 HG3 ARG 18 HG1 ARG 18 -8.481 -0.307 3.756
146 HD2 ARG 18 HD2 ARG 18 -11.335 -1.312 4.003
147 HD3 ARG 18 HD1 ARG 18 -9.913 -2.069 4.708
148 HE ARG 18 HE ARG 18 -10.079 0.631 5.561
149 HH11 ARG 18 HH21 ARG 18 -11.587 -2.463 5.919
150 HH12 ARG 18 HH22 ARG 18 -12.151 -2.156 7.528
151 HH21 ARG 18 HH11 ARG 18 -10.815 1.041 7.670
152 HH22 ARG 18 HH12 ARG 18 -11.713 -0.172 8.519
153 H PHE 19 HN PHE 19 -10.464 2.775 0.488
154 HA PHE 19 HA PHE 19 -12.324 4.632 1.588
155 HB2 PHE 19 HB2 PHE 19 -10.324 4.630 -0.639
156 HB3 PHE 19 HB1 PHE 19 -11.588 5.856 -0.703
157 HD1 PHE 19 HD2 PHE 19 -9.470 4.289 1.990
158 HD2 PHE 19 HD1 PHE 19 -10.951 7.907 0.208
159 HE1 PHE 19 HE2 PHE 19 -8.266 5.625 3.697
160 HE2 PHE 19 HE1 PHE 19 -9.747 9.240 1.914
161 HZ PHE 19 HZ PHE 19 -8.405 8.099 3.660
162 H LEU 20 HN LEU 20 -12.328 2.552 -1.261
163 HA LEU 20 HA LEU 20 -14.426 3.625 -2.699
164 HB2 LEU 20 HB2 LEU 20 -13.095 1.730 -3.516
165 HB3 LEU 20 HB1 LEU 20 -13.793 0.688 -2.277
166 HG LEU 20 HG LEU 20 -16.039 1.013 -3.254
167 HD11 LEU 20 HD11 LEU 20 -15.936 2.117 -5.667
168 HD12 LEU 20 HD12 LEU 20 -14.528 2.943 -5.000
169 HD13 LEU 20 HD13 LEU 20 -16.106 3.132 -4.235
170 HD21 LEU 20 HD21 LEU 20 -14.558 -0.821 -4.086
171 HD22 LEU 20 HD22 LEU 20 -14.004 0.252 -5.372
172 HD23 LEU 20 HD23 LEU 20 -15.693 -0.251 -5.310
173 H THR 21 HN THR 21 -14.508 1.667 0.213
174 HA THR 21 HA THR 21 -17.149 0.870 0.316
175 HB THR 21 HB THR 21 -16.943 0.904 2.749
176 HG1 THR 21 HG1 THR 21 -15.133 2.869 2.120
177 HG21 THR 21 HG21 THR 21 -14.367 0.197 1.317
178 HG22 THR 21 HG22 THR 21 -15.751 -0.867 1.577
179 HG23 THR 21 HG23 THR 21 -14.782 -0.330 2.950
180 H GLY 22 HN GLY 22 -15.865 3.934 1.667
181 HA2 GLY 22 HA2 GLY 22 -18.001 5.511 0.662
182 HA3 GLY 22 HA1 GLY 22 -18.297 5.096 2.348
183 HN1 NH2 23 HT1 GLY 22 -14.616 6.695 2.473
184 HN2 NH2 23 HT2 GLY 22 -14.983 5.069 2.003
Start of MODEL 4
1 H1 PHE 1 HT1 PHE 1 14.253 -8.616 -2.977
2 H2 PHE 1 HT2 PHE 1 13.826 -9.214 -1.445
3 H3 PHE 1 HT3 PHE 1 15.440 -8.800 -1.779
4 HA PHE 1 HA PHE 1 14.204 -7.142 -0.410
5 HB2 PHE 1 HB2 PHE 1 15.117 -5.233 -1.652
6 HB3 PHE 1 HB1 PHE 1 16.247 -6.586 -1.712
7 HD1 PHE 1 HD2 PHE 1 16.270 -8.082 -3.761
8 HD2 PHE 1 HD1 PHE 1 14.165 -4.340 -3.641
9 HE1 PHE 1 HE2 PHE 1 16.176 -8.055 -6.239
10 HE2 PHE 1 HE1 PHE 1 14.073 -4.312 -6.119
11 HZ PHE 1 HZ PHE 1 15.077 -6.170 -7.418
12 H ILE 2 HN ILE 2 13.025 -7.759 -3.677
13 HA ILE 2 HA ILE 2 11.133 -5.750 -3.942
14 HB ILE 2 HB ILE 2 10.844 -8.626 -4.855
15 HG12 ILE 2 HG12 ILE 2 12.054 -6.287 -6.357
16 HG13 ILE 2 HG11 ILE 2 13.024 -7.459 -5.465
17 HG21 ILE 2 HG21 ILE 2 8.792 -7.279 -5.065
18 HG22 ILE 2 HG22 ILE 2 9.487 -7.597 -6.654
19 HG23 ILE 2 HG23 ILE 2 9.697 -6.017 -5.900
20 HD11 ILE 2 HD11 ILE 2 12.825 -8.037 -7.880
21 HD12 ILE 2 HD12 ILE 2 11.077 -8.167 -7.677
22 HD13 ILE 2 HD13 ILE 2 12.149 -9.282 -6.829
23 H HIS 3 HN HIS 3 11.004 -8.734 -2.094
24 HA HIS 3 HA HIS 3 8.308 -9.015 -1.586
25 HB2 HIS 3 HB2 HIS 3 8.923 -10.111 0.489
26 HB3 HIS 3 HB1 HIS 3 10.118 -10.522 -0.740
27 HD2 HIS 3 HD2 HIS 3 9.867 -8.187 2.449
28 HE1 HIS 3 HE1 HIS 3 13.933 -8.608 1.397
29 HE2 HIS 3 HE2 HIS 3 12.333 -7.660 3.125
30 H HIS 4 HN HIS 4 10.602 -6.877 0.108
31 HA HIS 4 HA HIS 4 8.662 -5.786 1.899
32 HB2 HIS 4 HB2 HIS 4 11.070 -5.709 2.380
33 HB3 HIS 4 HB1 HIS 4 11.319 -4.657 0.986
34 HD2 HIS 4 HD2 HIS 4 11.148 -1.984 1.648
35 HE1 HIS 4 HE1 HIS 4 8.893 -2.383 5.195
36 HE2 HIS 4 HE2 HIS 4 10.085 -0.731 3.678
37 H ILE 5 HN ILE 5 10.129 -4.582 -1.095
38 HA ILE 5 HA ILE 5 8.709 -2.154 -1.240
39 HB ILE 5 HB ILE 5 9.837 -3.858 -3.473
40 HG12 ILE 5 HG12 ILE 5 10.964 -1.378 -2.138
41 HG13 ILE 5 HG11 ILE 5 11.419 -3.019 -1.677
42 HG21 ILE 5 HG21 ILE 5 9.840 -1.620 -4.685
43 HG22 ILE 5 HG22 ILE 5 8.789 -1.017 -3.405
44 HG23 ILE 5 HG23 ILE 5 8.248 -2.338 -4.442
45 HD11 ILE 5 HD11 ILE 5 13.071 -2.266 -3.252
46 HD12 ILE 5 HD12 ILE 5 11.830 -1.680 -4.362
47 HD13 ILE 5 HD13 ILE 5 12.041 -3.414 -4.108
48 H PHE 6 HN PHE 6 7.865 -5.408 -2.200
49 HA PHE 6 HA PHE 6 5.627 -4.774 -3.830
50 HB2 PHE 6 HB2 PHE 6 6.807 -6.989 -3.788
51 HB3 PHE 6 HB1 PHE 6 6.054 -7.301 -2.224
52 HD1 PHE 6 HD2 PHE 6 5.300 -6.508 -5.791
53 HD2 PHE 6 HD1 PHE 6 3.813 -8.064 -2.074
54 HE1 PHE 6 HE2 PHE 6 3.232 -7.262 -6.935
55 HE2 PHE 6 HE1 PHE 6 1.745 -8.817 -3.216
56 HZ PHE 6 HZ PHE 6 1.455 -8.416 -5.647
57 H ARG 7 HN ARG 7 6.035 -5.355 -0.392
58 HA ARG 7 HA ARG 7 3.384 -5.618 0.409
59 HB2 ARG 7 HB2 ARG 7 5.313 -5.909 1.931
60 HB3 ARG 7 HB1 ARG 7 5.587 -4.167 1.899
61 HG2 ARG 7 HG2 ARG 7 3.307 -3.811 2.826
62 HG3 ARG 7 HG1 ARG 7 3.077 -5.558 2.896
63 HD2 ARG 7 HD2 ARG 7 5.291 -4.056 4.321
64 HD3 ARG 7 HD1 ARG 7 3.787 -4.569 5.079
65 HE ARG 7 HE ARG 7 6.012 -6.289 4.286
66 HH11 ARG 7 HH21 ARG 7 2.714 -5.982 5.288
67 HH12 ARG 7 HH22 ARG 7 2.591 -7.611 5.860
68 HH21 ARG 7 HH11 ARG 7 5.858 -8.428 5.035
69 HH22 ARG 7 HH12 ARG 7 4.371 -8.995 5.718
70 H GLY 8 HN GLY 8 5.199 -2.718 -0.439
71 HA2 GLY 8 HA2 GLY 8 3.384 -0.793 0.561
72 HA3 GLY 8 HA1 GLY 8 4.560 -0.527 -0.721
73 H ILE 9 HN ILE 9 3.545 -2.562 -2.467
74 HA ILE 9 HA ILE 9 1.563 -1.048 -3.859
75 HB ILE 9 HB ILE 9 2.681 -3.827 -4.252
76 HG12 ILE 9 HG12 ILE 9 3.626 -2.769 -6.289
77 HG13 ILE 9 HG11 ILE 9 2.856 -1.246 -5.843
78 HG21 ILE 9 HG21 ILE 9 1.436 -3.629 -6.530
79 HG22 ILE 9 HG22 ILE 9 0.427 -2.437 -5.708
80 HG23 ILE 9 HG23 ILE 9 0.493 -4.096 -5.113
81 HD11 ILE 9 HD11 ILE 9 4.267 -0.924 -3.997
82 HD12 ILE 9 HD12 ILE 9 5.359 -1.638 -5.182
83 HD13 ILE 9 HD13 ILE 9 4.685 -2.634 -3.895
84 H VAL 10 HN VAL 10 1.427 -4.035 -1.949
85 HA VAL 10 HA VAL 10 -1.353 -4.494 -2.329
86 HB VAL 10 HB VAL 10 0.507 -5.408 -0.121
87 HG11 VAL 10 HG11 VAL 10 -1.702 -5.660 0.725
88 HG12 VAL 10 HG12 VAL 10 -1.291 -7.240 0.057
89 HG13 VAL 10 HG13 VAL 10 -2.333 -6.144 -0.850
90 HG21 VAL 10 HG21 VAL 10 1.040 -6.085 -2.505
91 HG22 VAL 10 HG22 VAL 10 -0.525 -6.896 -2.552
92 HG23 VAL 10 HG23 VAL 10 0.712 -7.434 -1.416
93 H HIS 11 HN HIS 11 0.485 -2.971 0.307
94 HA HIS 11 HA HIS 11 -1.764 -2.374 1.928
95 HB2 HIS 11 HB2 HIS 11 0.580 -2.400 2.752
96 HB3 HIS 11 HB1 HIS 11 0.899 -0.939 1.816
97 HD2 HIS 11 HD2 HIS 11 -0.982 -1.996 5.090
98 HE1 HIS 11 HE1 HIS 11 -1.236 2.205 4.740
99 HE2 HIS 11 HE2 HIS 11 -1.697 0.226 6.263
100 H ALA 12 HN ALA 12 0.023 -0.462 -0.482
101 HA ALA 12 HA ALA 12 -1.424 1.937 -0.153
102 HB1 ALA 12 HB1 ALA 12 -0.516 2.549 -2.348
103 HB2 ALA 12 HB2 ALA 12 -0.039 0.874 -2.626
104 HB3 ALA 12 HB3 ALA 12 0.730 1.810 -1.344
105 H GLY 13 HN GLY 13 -2.154 -1.031 -1.795
106 HA2 GLY 13 HA2 GLY 13 -4.263 0.085 -3.442
107 HA3 GLY 13 HA1 GLY 13 -3.874 -1.623 -3.254
108 H ARG 14 HN ARG 14 -3.987 -1.655 -0.398
109 HA ARG 14 HA ARG 14 -6.668 -2.303 0.048
110 HB2 ARG 14 HB2 ARG 14 -4.470 -1.556 1.987
111 HB3 ARG 14 HB1 ARG 14 -6.052 -2.134 2.503
112 HG2 ARG 14 HG2 ARG 14 -4.563 -3.745 0.442
113 HG3 ARG 14 HG1 ARG 14 -4.030 -3.847 2.118
114 HD2 ARG 14 HD2 ARG 14 -6.846 -4.381 1.117
115 HD3 ARG 14 HD1 ARG 14 -5.688 -5.604 1.628
116 HE ARG 14 HE ARG 14 -5.869 -3.969 3.802
117 HH11 ARG 14 HH21 ARG 14 -8.153 -5.592 1.769
118 HH12 ARG 14 HH22 ARG 14 -9.329 -5.801 3.025
119 HH21 ARG 14 HH11 ARG 14 -7.406 -4.241 5.452
120 HH22 ARG 14 HH12 ARG 14 -8.905 -5.037 5.109
121 H SER 15 HN SER 15 -4.955 0.741 0.482
122 HA SER 15 HA SER 15 -6.900 2.128 1.972
123 HB2 SER 15 HB2 SER 15 -5.836 4.174 0.980
124 HB3 SER 15 HB1 SER 15 -4.690 3.055 1.715
125 HG SER 15 HG SER 15 -3.796 2.890 -0.169
126 H ILE 16 HN ILE 16 -6.459 1.753 -1.516
127 HA ILE 16 HA ILE 16 -8.603 3.452 -2.294
128 HB ILE 16 HB ILE 16 -7.085 1.241 -3.681
129 HG12 ILE 16 HG12 ILE 16 -6.310 3.093 -5.083
130 HG13 ILE 16 HG11 ILE 16 -7.420 4.200 -4.273
131 HG21 ILE 16 HG21 ILE 16 -9.590 2.653 -4.601
132 HG22 ILE 16 HG22 ILE 16 -9.194 0.938 -4.699
133 HG23 ILE 16 HG23 ILE 16 -8.400 2.087 -5.775
134 HD11 ILE 16 HD11 ILE 16 -4.928 4.143 -3.494
135 HD12 ILE 16 HD12 ILE 16 -5.389 2.652 -2.675
136 HD13 ILE 16 HD13 ILE 16 -6.196 4.167 -2.268
137 H GLY 17 HN GLY 17 -8.403 -0.066 -1.791
138 HA2 GLY 17 HA2 GLY 17 -11.068 -0.665 -2.519
139 HA3 GLY 17 HA1 GLY 17 -10.036 -1.662 -1.498
140 H ARG 18 HN ARG 18 -9.590 0.015 0.651
141 HA ARG 18 HA ARG 18 -11.900 -0.359 2.211
142 HB2 ARG 18 HB2 ARG 18 -9.422 1.314 2.613
143 HB3 ARG 18 HB1 ARG 18 -10.699 1.220 3.826
144 HG2 ARG 18 HG2 ARG 18 -10.445 -1.210 3.951
145 HG3 ARG 18 HG1 ARG 18 -9.228 -1.171 2.675
146 HD2 ARG 18 HD2 ARG 18 -8.154 -1.294 4.880
147 HD3 ARG 18 HD1 ARG 18 -7.777 0.235 4.095
148 HE ARG 18 HE ARG 18 -10.096 0.442 5.771
149 HH11 ARG 18 HH21 ARG 18 -6.638 0.316 5.723
150 HH12 ARG 18 HH22 ARG 18 -6.447 1.215 7.191
151 HH21 ARG 18 HH11 ARG 18 -9.854 1.622 7.697
152 HH22 ARG 18 HH12 ARG 18 -8.267 1.954 8.309
153 H PHE 19 HN PHE 19 -10.665 2.478 0.488
154 HA PHE 19 HA PHE 19 -12.555 4.330 1.531
155 HB2 PHE 19 HB2 PHE 19 -10.654 4.291 -0.799
156 HB3 PHE 19 HB1 PHE 19 -11.901 5.537 -0.746
157 HD1 PHE 19 HD2 PHE 19 -9.981 3.934 2.051
158 HD2 PHE 19 HD1 PHE 19 -10.786 7.533 -0.149
159 HE1 PHE 19 HE2 PHE 19 -8.634 5.222 3.676
160 HE2 PHE 19 HE1 PHE 19 -9.434 8.826 1.478
161 HZ PHE 19 HZ PHE 19 -8.357 7.670 3.391
162 H LEU 20 HN LEU 20 -12.553 2.118 -1.210
163 HA LEU 20 HA LEU 20 -14.676 3.060 -2.697
164 HB2 LEU 20 HB2 LEU 20 -13.209 1.038 -3.182
165 HB3 LEU 20 HB1 LEU 20 -14.249 0.130 -2.084
166 HG LEU 20 HG LEU 20 -16.195 1.182 -3.601
167 HD11 LEU 20 HD11 LEU 20 -15.477 1.333 -5.967
168 HD12 LEU 20 HD12 LEU 20 -13.804 1.092 -5.467
169 HD13 LEU 20 HD13 LEU 20 -14.668 2.546 -4.974
170 HD21 LEU 20 HD21 LEU 20 -16.072 -0.856 -5.037
171 HD22 LEU 20 HD22 LEU 20 -15.810 -1.220 -3.331
172 HD23 LEU 20 HD23 LEU 20 -14.439 -1.150 -4.439
173 H THR 21 HN THR 21 -14.730 1.270 0.334
174 HA THR 21 HA THR 21 -17.376 0.491 0.495
175 HB THR 21 HB THR 21 -17.140 0.655 2.927
176 HG1 THR 21 HG1 THR 21 -15.101 1.592 3.659
177 HG21 THR 21 HG21 THR 21 -15.237 -0.784 3.169
178 HG22 THR 21 HG22 THR 21 -14.475 -0.120 1.724
179 HG23 THR 21 HG23 THR 21 -15.922 -1.118 1.579
180 H GLY 22 HN GLY 22 -16.066 3.583 1.750
181 HA2 GLY 22 HA2 GLY 22 -18.666 4.721 2.115
182 HA3 GLY 22 HA1 GLY 22 -17.127 5.573 2.224
183 HN1 NH2 23 HT1 GLY 22 -17.649 5.229 -1.740
184 HN2 NH2 23 HT2 GLY 22 -17.038 3.986 -0.701
Start of MODEL 5
1 H1 PHE 1 HT1 PHE 1 15.087 -7.258 -3.006
2 H2 PHE 1 HT2 PHE 1 14.223 -7.884 -1.683
3 H3 PHE 1 HT3 PHE 1 15.809 -7.311 -1.473
4 HA PHE 1 HA PHE 1 14.433 -5.629 -0.623
5 HB2 PHE 1 HB2 PHE 1 15.185 -4.943 -3.482
6 HB3 PHE 1 HB1 PHE 1 14.847 -3.776 -2.203
7 HD1 PHE 1 HD2 PHE 1 16.375 -3.520 -0.284
8 HD2 PHE 1 HD1 PHE 1 17.251 -6.213 -3.514
9 HE1 PHE 1 HE2 PHE 1 18.730 -3.676 0.483
10 HE2 PHE 1 HE1 PHE 1 19.604 -6.369 -2.748
11 HZ PHE 1 HZ PHE 1 20.344 -5.100 -0.749
12 H ILE 2 HN ILE 2 13.371 -6.699 -3.839
13 HA ILE 2 HA ILE 2 11.051 -5.240 -4.141
14 HB ILE 2 HB ILE 2 11.284 -8.168 -4.852
15 HG12 ILE 2 HG12 ILE 2 13.337 -7.123 -5.597
16 HG13 ILE 2 HG11 ILE 2 12.289 -7.302 -7.001
17 HG21 ILE 2 HG21 ILE 2 9.099 -6.920 -5.172
18 HG22 ILE 2 HG22 ILE 2 9.789 -7.597 -6.649
19 HG23 ILE 2 HG23 ILE 2 9.951 -5.874 -6.309
20 HD11 ILE 2 HD11 ILE 2 11.491 -4.891 -6.451
21 HD12 ILE 2 HD12 ILE 2 13.087 -5.083 -7.173
22 HD13 ILE 2 HD13 ILE 2 12.928 -4.797 -5.441
23 H HIS 3 HN HIS 3 11.648 -8.032 -2.104
24 HA HIS 3 HA HIS 3 9.086 -8.866 -1.481
25 HB2 HIS 3 HB2 HIS 3 11.121 -9.949 -0.620
26 HB3 HIS 3 HB1 HIS 3 11.414 -8.562 0.431
27 HD2 HIS 3 HD2 HIS 3 10.077 -8.693 2.863
28 HE1 HIS 3 HE1 HIS 3 7.451 -11.855 1.898
29 HE2 HIS 3 HE2 HIS 3 8.244 -10.321 3.761
30 H HIS 4 HN HIS 4 10.927 -6.219 0.062
31 HA HIS 4 HA HIS 4 8.834 -5.461 1.848
32 HB2 HIS 4 HB2 HIS 4 11.186 -4.857 2.240
33 HB3 HIS 4 HB1 HIS 4 11.165 -3.837 0.801
34 HD2 HIS 4 HD2 HIS 4 9.949 -3.726 4.509
35 HE1 HIS 4 HE1 HIS 4 8.784 -0.106 2.672
36 HE2 HIS 4 HE2 HIS 4 8.953 -1.341 4.885
37 H ILE 5 HN ILE 5 9.954 -4.138 -1.237
38 HA ILE 5 HA ILE 5 8.061 -2.067 -1.462
39 HB ILE 5 HB ILE 5 9.475 -3.632 -3.635
40 HG12 ILE 5 HG12 ILE 5 10.050 -0.862 -2.550
41 HG13 ILE 5 HG11 ILE 5 10.842 -2.312 -1.929
42 HG21 ILE 5 HG21 ILE 5 7.763 -1.141 -3.703
43 HG22 ILE 5 HG22 ILE 5 7.615 -2.594 -4.693
44 HG23 ILE 5 HG23 ILE 5 8.960 -1.483 -4.954
45 HD11 ILE 5 HD11 ILE 5 12.273 -1.343 -3.627
46 HD12 ILE 5 HD12 ILE 5 10.934 -1.264 -4.772
47 HD13 ILE 5 HD13 ILE 5 11.582 -2.828 -4.278
48 H PHE 6 HN PHE 6 7.884 -5.475 -2.239
49 HA PHE 6 HA PHE 6 5.532 -5.426 -3.821
50 HB2 PHE 6 HB2 PHE 6 7.100 -7.362 -3.672
51 HB3 PHE 6 HB1 PHE 6 6.508 -7.668 -2.039
52 HD1 PHE 6 HD2 PHE 6 5.465 -7.427 -5.607
53 HD2 PHE 6 HD1 PHE 6 4.439 -8.787 -1.664
54 HE1 PHE 6 HE2 PHE 6 3.536 -8.675 -6.540
55 HE2 PHE 6 HE1 PHE 6 2.510 -10.036 -2.596
56 HZ PHE 6 HZ PHE 6 2.058 -9.980 -5.035
57 H ARG 7 HN ARG 7 6.086 -5.808 -0.357
58 HA ARG 7 HA ARG 7 3.445 -6.355 0.413
59 HB2 ARG 7 HB2 ARG 7 5.811 -6.163 1.775
60 HB3 ARG 7 HB1 ARG 7 5.058 -4.656 2.279
61 HG2 ARG 7 HG2 ARG 7 3.801 -7.410 2.507
62 HG3 ARG 7 HG1 ARG 7 4.496 -6.491 3.842
63 HD2 ARG 7 HD2 ARG 7 2.838 -4.624 3.156
64 HD3 ARG 7 HD1 ARG 7 2.027 -5.874 2.219
65 HE ARG 7 HE ARG 7 2.448 -6.776 4.882
66 HH11 ARG 7 HH21 ARG 7 0.581 -4.585 2.962
67 HH12 ARG 7 HH22 ARG 7 -0.788 -4.604 4.023
68 HH21 ARG 7 HH11 ARG 7 0.658 -6.805 6.280
69 HH22 ARG 7 HH12 ARG 7 -0.745 -5.860 5.901
70 H GLY 8 HN GLY 8 5.090 -3.302 -0.235
71 HA2 GLY 8 HA2 GLY 8 3.152 -1.539 0.795
72 HA3 GLY 8 HA1 GLY 8 4.311 -1.154 -0.473
73 H ILE 9 HN ILE 9 3.400 -3.245 -2.245
74 HA ILE 9 HA ILE 9 1.427 -1.805 -3.695
75 HB ILE 9 HB ILE 9 2.128 -4.734 -4.011
76 HG12 ILE 9 HG12 ILE 9 4.184 -3.418 -4.044
77 HG13 ILE 9 HG11 ILE 9 3.787 -3.890 -5.691
78 HG21 ILE 9 HG21 ILE 9 1.065 -2.663 -5.952
79 HG22 ILE 9 HG22 ILE 9 0.124 -3.979 -5.251
80 HG23 ILE 9 HG23 ILE 9 1.455 -4.335 -6.353
81 HD11 ILE 9 HD11 ILE 9 4.294 -1.608 -5.939
82 HD12 ILE 9 HD12 ILE 9 3.572 -1.179 -4.391
83 HD13 ILE 9 HD13 ILE 9 2.539 -1.562 -5.758
84 H VAL 10 HN VAL 10 1.240 -4.730 -1.691
85 HA VAL 10 HA VAL 10 -1.532 -5.180 -2.055
86 HB VAL 10 HB VAL 10 0.308 -5.963 0.221
87 HG11 VAL 10 HG11 VAL 10 -1.488 -7.715 0.622
88 HG12 VAL 10 HG12 VAL 10 -2.527 -6.790 -0.459
89 HG13 VAL 10 HG13 VAL 10 -1.956 -6.068 1.044
90 HG21 VAL 10 HG21 VAL 10 -0.752 -7.551 -2.138
91 HG22 VAL 10 HG22 VAL 10 0.397 -8.115 -0.924
92 HG23 VAL 10 HG23 VAL 10 0.863 -6.845 -2.058
93 H HIS 11 HN HIS 11 0.287 -3.437 0.446
94 HA HIS 11 HA HIS 11 -1.961 -2.742 2.030
95 HB2 HIS 11 HB2 HIS 11 0.375 -2.659 2.851
96 HB3 HIS 11 HB1 HIS 11 0.684 -1.297 1.773
97 HD2 HIS 11 HD2 HIS 11 0.382 1.057 3.164
98 HE1 HIS 11 HE1 HIS 11 -2.629 -0.189 5.846
99 HE2 HIS 11 HE2 HIS 11 -1.161 1.763 5.148
100 H ALA 12 HN ALA 12 -0.204 -0.990 -0.527
101 HA ALA 12 HA ALA 12 -1.689 1.401 -0.395
102 HB1 ALA 12 HB1 ALA 12 -0.911 1.656 -2.810
103 HB2 ALA 12 HB2 ALA 12 -0.137 0.081 -2.624
104 HB3 ALA 12 HB3 ALA 12 0.359 1.434 -1.605
105 H GLY 13 HN GLY 13 -2.331 -1.688 -1.899
106 HA2 GLY 13 HA2 GLY 13 -4.460 -0.772 -3.597
107 HA3 GLY 13 HA1 GLY 13 -4.090 -2.448 -3.202
108 H ARG 14 HN ARG 14 -4.280 -2.382 -0.457
109 HA ARG 14 HA ARG 14 -7.059 -2.675 -0.040
110 HB2 ARG 14 HB2 ARG 14 -4.765 -2.442 1.914
111 HB3 ARG 14 HB1 ARG 14 -6.423 -2.792 2.404
112 HG2 ARG 14 HG2 ARG 14 -6.451 -4.799 1.004
113 HG3 ARG 14 HG1 ARG 14 -4.830 -4.431 0.415
114 HD2 ARG 14 HD2 ARG 14 -4.728 -6.112 2.204
115 HD3 ARG 14 HD1 ARG 14 -3.950 -4.617 2.717
116 HE ARG 14 HE ARG 14 -6.694 -4.620 3.480
117 HH11 ARG 14 HH21 ARG 14 -3.613 -6.025 4.196
118 HH12 ARG 14 HH22 ARG 14 -3.971 -6.298 5.867
119 HH21 ARG 14 HH11 ARG 14 -7.170 -4.976 5.673
120 HH22 ARG 14 HH12 ARG 14 -5.985 -5.705 6.705
121 H SER 15 HN SER 15 -4.820 -0.043 0.712
122 HA SER 15 HA SER 15 -6.601 1.537 2.242
123 HB2 SER 15 HB2 SER 15 -5.061 3.396 1.709
124 HB3 SER 15 HB1 SER 15 -4.192 1.950 2.214
125 HG SER 15 HG SER 15 -4.461 3.098 -0.336
126 H ILE 16 HN ILE 16 -5.870 1.460 -1.220
127 HA ILE 16 HA ILE 16 -7.539 3.632 -1.955
128 HB ILE 16 HB ILE 16 -6.550 1.247 -3.541
129 HG12 ILE 16 HG12 ILE 16 -5.700 4.149 -3.684
130 HG13 ILE 16 HG11 ILE 16 -4.924 2.998 -2.595
131 HG21 ILE 16 HG21 ILE 16 -8.163 3.673 -4.353
132 HG22 ILE 16 HG22 ILE 16 -8.461 1.980 -4.742
133 HG23 ILE 16 HG23 ILE 16 -7.125 2.835 -5.509
134 HD11 ILE 16 HD11 ILE 16 -5.152 2.701 -5.606
135 HD12 ILE 16 HD12 ILE 16 -4.390 1.542 -4.519
136 HD13 ILE 16 HD13 ILE 16 -3.692 3.148 -4.725
137 H GLY 17 HN GLY 17 -8.105 0.127 -1.822
138 HA2 GLY 17 HA2 GLY 17 -10.762 0.210 -2.829
139 HA3 GLY 17 HA1 GLY 17 -10.040 -1.117 -1.927
140 H ARG 18 HN ARG 18 -9.372 0.472 0.396
141 HA ARG 18 HA ARG 18 -11.707 0.146 1.917
142 HB2 ARG 18 HB2 ARG 18 -9.421 0.198 2.872
143 HB3 ARG 18 HB1 ARG 18 -9.334 1.925 2.526
144 HG2 ARG 18 HG2 ARG 18 -11.234 2.354 4.000
145 HG3 ARG 18 HG1 ARG 18 -11.436 0.626 4.285
146 HD2 ARG 18 HD2 ARG 18 -9.118 0.569 5.233
147 HD3 ARG 18 HD1 ARG 18 -9.049 2.321 5.065
148 HE ARG 18 HE ARG 18 -10.505 2.519 6.887
149 HH11 ARG 18 HH21 ARG 18 -10.262 -0.747 5.771
150 HH12 ARG 18 HH22 ARG 18 -11.090 -1.421 7.135
151 HH21 ARG 18 HH11 ARG 18 -11.591 1.643 8.680
152 HH22 ARG 18 HH12 ARG 18 -11.842 -0.068 8.782
153 H PHE 19 HN PHE 19 -10.313 3.032 0.390
154 HA PHE 19 HA PHE 19 -12.110 4.920 1.481
155 HB2 PHE 19 HB2 PHE 19 -10.275 4.858 -0.907
156 HB3 PHE 19 HB1 PHE 19 -11.445 6.168 -0.772
157 HD1 PHE 19 HD2 PHE 19 -9.376 4.331 1.782
158 HD2 PHE 19 HD1 PHE 19 -10.354 8.104 -0.023
159 HE1 PHE 19 HE2 PHE 19 -7.909 5.485 3.406
160 HE2 PHE 19 HE1 PHE 19 -8.883 9.260 1.604
161 HZ PHE 19 HZ PHE 19 -7.660 7.951 3.319
162 H LEU 20 HN LEU 20 -12.317 2.764 -1.282
163 HA LEU 20 HA LEU 20 -14.406 3.847 -2.711
164 HB2 LEU 20 HB2 LEU 20 -13.067 1.677 -3.151
165 HB3 LEU 20 HB1 LEU 20 -14.276 0.889 -2.139
166 HG LEU 20 HG LEU 20 -15.990 2.160 -3.744
167 HD11 LEU 20 HD11 LEU 20 -15.144 2.375 -6.040
168 HD12 LEU 20 HD12 LEU 20 -13.542 1.860 -5.518
169 HD13 LEU 20 HD13 LEU 20 -14.194 3.395 -4.962
170 HD21 LEU 20 HD21 LEU 20 -15.740 0.147 -5.378
171 HD22 LEU 20 HD22 LEU 20 -16.082 -0.200 -3.685
172 HD23 LEU 20 HD23 LEU 20 -14.440 -0.375 -4.302
173 H THR 21 HN THR 21 -14.515 2.137 0.353
174 HA THR 21 HA THR 21 -17.183 1.475 0.585
175 HB THR 21 HB THR 21 -15.307 1.122 2.290
176 HG1 THR 21 HG1 THR 21 -17.121 1.851 3.990
177 HG21 THR 21 HG21 THR 21 -14.848 2.813 3.894
178 HG22 THR 21 HG22 THR 21 -16.238 3.774 3.390
179 HG23 THR 21 HG23 THR 21 -14.826 3.659 2.345
180 H GLY 22 HN GLY 22 -18.885 2.611 1.891
181 HA2 GLY 22 HA2 GLY 22 -18.892 5.436 2.175
182 HA3 GLY 22 HA1 GLY 22 -19.709 4.981 0.683
183 HN1 NH2 23 HT1 GLY 22 -21.619 2.763 3.429
184 HN2 NH2 23 HT2 GLY 22 -20.090 2.371 2.716
Start of MODEL 6
1 H1 PHE 1 HT1 PHE 1 13.938 -8.115 -1.961
2 H2 PHE 1 HT2 PHE 1 15.430 -7.709 -1.256
3 H3 PHE 1 HT3 PHE 1 15.216 -7.571 -2.937
4 HA PHE 1 HA PHE 1 14.404 -5.777 -0.800
5 HB2 PHE 1 HB2 PHE 1 15.024 -5.432 -3.752
6 HB3 PHE 1 HB1 PHE 1 14.799 -4.122 -2.591
7 HD1 PHE 1 HD2 PHE 1 16.950 -7.007 -3.501
8 HD2 PHE 1 HD1 PHE 1 16.527 -3.509 -1.046
9 HE1 PHE 1 HE2 PHE 1 19.334 -7.181 -2.842
10 HE2 PHE 1 HE1 PHE 1 18.912 -3.684 -0.386
11 HZ PHE 1 HZ PHE 1 20.316 -5.519 -1.284
12 H ILE 2 HN ILE 2 13.144 -7.070 -3.873
13 HA ILE 2 HA ILE 2 10.852 -5.561 -4.148
14 HB ILE 2 HB ILE 2 11.680 -7.283 -5.766
15 HG12 ILE 2 HG12 ILE 2 8.802 -7.756 -4.946
16 HG13 ILE 2 HG11 ILE 2 9.336 -6.295 -5.778
17 HG21 ILE 2 HG21 ILE 2 10.272 -9.247 -3.936
18 HG22 ILE 2 HG22 ILE 2 12.024 -9.041 -3.975
19 HG23 ILE 2 HG23 ILE 2 11.170 -9.614 -5.409
20 HD11 ILE 2 HD11 ILE 2 8.452 -8.056 -7.333
21 HD12 ILE 2 HD12 ILE 2 9.778 -9.104 -6.828
22 HD13 ILE 2 HD13 ILE 2 10.120 -7.594 -7.674
23 H HIS 3 HN HIS 3 11.497 -8.217 -1.952
24 HA HIS 3 HA HIS 3 8.963 -8.956 -1.140
25 HB2 HIS 3 HB2 HIS 3 11.504 -8.636 0.464
26 HB3 HIS 3 HB1 HIS 3 10.035 -9.354 1.126
27 HD2 HIS 3 HD2 HIS 3 9.650 -12.021 0.423
28 HE1 HIS 3 HE1 HIS 3 12.697 -12.272 -2.489
29 HE2 HIS 3 HE2 HIS 3 10.965 -13.600 -1.189
30 H HIS 4 HN HIS 4 10.915 -6.240 0.099
31 HA HIS 4 HA HIS 4 8.907 -5.310 1.906
32 HB2 HIS 4 HB2 HIS 4 11.314 -4.779 2.159
33 HB3 HIS 4 HB1 HIS 4 11.235 -3.798 0.695
34 HD2 HIS 4 HD2 HIS 4 10.255 -1.218 1.091
35 HE1 HIS 4 HE1 HIS 4 8.991 -1.719 5.088
36 HE2 HIS 4 HE2 HIS 4 9.302 -0.034 3.214
37 H ILE 5 HN ILE 5 9.967 -4.229 -1.308
38 HA ILE 5 HA ILE 5 8.148 -2.100 -1.592
39 HB ILE 5 HB ILE 5 9.267 -3.856 -3.790
40 HG12 ILE 5 HG12 ILE 5 10.402 -1.293 -2.629
41 HG13 ILE 5 HG11 ILE 5 10.979 -2.902 -2.193
42 HG21 ILE 5 HG21 ILE 5 7.440 -2.359 -4.501
43 HG22 ILE 5 HG22 ILE 5 8.982 -1.811 -5.155
44 HG23 ILE 5 HG23 ILE 5 8.271 -0.989 -3.767
45 HD11 ILE 5 HD11 ILE 5 10.903 -1.824 -5.025
46 HD12 ILE 5 HD12 ILE 5 11.596 -3.360 -4.502
47 HD13 ILE 5 HD13 ILE 5 12.339 -1.839 -4.003
48 H PHE 6 HN PHE 6 7.807 -5.547 -2.115
49 HA PHE 6 HA PHE 6 5.411 -5.496 -3.621
50 HB2 PHE 6 HB2 PHE 6 6.898 -7.485 -3.394
51 HB3 PHE 6 HB1 PHE 6 6.356 -7.657 -1.725
52 HD1 PHE 6 HD1 PHE 6 5.264 -7.723 -5.272
53 HD2 PHE 6 HD2 PHE 6 4.192 -8.550 -1.196
54 HE1 PHE 6 HE1 PHE 6 3.256 -8.951 -6.050
55 HE2 PHE 6 HE2 PHE 6 2.183 -9.778 -1.974
56 HZ PHE 6 HZ PHE 6 1.714 -9.979 -4.401
57 H ARG 7 HN ARG 7 6.054 -5.606 -0.156
58 HA ARG 7 HA ARG 7 3.409 -6.011 0.725
59 HB2 ARG 7 HB2 ARG 7 5.397 -6.229 2.184
60 HB3 ARG 7 HB1 ARG 7 5.616 -4.480 2.120
61 HG2 ARG 7 HG2 ARG 7 3.433 -4.129 3.154
62 HG3 ARG 7 HG1 ARG 7 3.114 -5.864 3.132
63 HD2 ARG 7 HD2 ARG 7 5.397 -4.539 4.624
64 HD3 ARG 7 HD1 ARG 7 3.891 -5.083 5.360
65 HE ARG 7 HE ARG 7 5.038 -7.242 3.956
66 HH11 ARG 7 HH21 ARG 7 5.582 -5.208 6.701
67 HH12 ARG 7 HH22 ARG 7 6.444 -6.413 7.597
68 HH21 ARG 7 HH11 ARG 7 6.170 -8.829 5.124
69 HH22 ARG 7 HH12 ARG 7 6.778 -8.463 6.703
70 H GLY 8 HN GLY 8 5.149 -3.104 -0.229
71 HA2 GLY 8 HA2 GLY 8 3.231 -1.229 0.743
72 HA3 GLY 8 HA1 GLY 8 4.490 -0.904 -0.446
73 H ILE 9 HN ILE 9 3.678 -2.922 -2.319
74 HA ILE 9 HA ILE 9 1.811 -1.453 -3.864
75 HB ILE 9 HB ILE 9 2.731 -4.329 -4.105
76 HG12 ILE 9 HG12 ILE 9 3.530 -1.837 -5.648
77 HG13 ILE 9 HG11 ILE 9 4.465 -2.519 -4.318
78 HG21 ILE 9 HG21 ILE 9 1.908 -4.096 -6.473
79 HG22 ILE 9 HG22 ILE 9 1.155 -2.569 -6.011
80 HG23 ILE 9 HG23 ILE 9 0.614 -4.079 -5.280
81 HD11 ILE 9 HD11 ILE 9 3.864 -3.780 -6.997
82 HD12 ILE 9 HD12 ILE 9 4.465 -4.715 -5.630
83 HD13 ILE 9 HD13 ILE 9 5.442 -3.410 -6.302
84 H VAL 10 HN VAL 10 1.440 -4.554 -2.140
85 HA VAL 10 HA VAL 10 -1.352 -4.782 -2.632
86 HB VAL 10 HB VAL 10 -0.010 -6.732 -2.049
87 HG11 VAL 10 HG11 VAL 10 1.515 -5.426 -0.503
88 HG12 VAL 10 HG12 VAL 10 1.005 -6.996 0.115
89 HG13 VAL 10 HG13 VAL 10 0.245 -5.524 0.715
90 HG21 VAL 10 HG21 VAL 10 -2.472 -6.540 -1.391
91 HG22 VAL 10 HG22 VAL 10 -1.912 -6.177 0.242
92 HG23 VAL 10 HG23 VAL 10 -1.534 -7.734 -0.494
93 H HIS 11 HN HIS 11 0.531 -3.498 0.085
94 HA HIS 11 HA HIS 11 -1.675 -2.983 1.791
95 HB2 HIS 11 HB2 HIS 11 0.685 -3.069 2.558
96 HB3 HIS 11 HB1 HIS 11 0.999 -1.567 1.691
97 HD2 HIS 11 HD2 HIS 11 0.618 0.630 3.309
98 HE1 HIS 11 HE1 HIS 11 -2.102 -1.086 6.043
99 HE2 HIS 11 HE2 HIS 11 -0.794 1.014 5.471
100 H ALA 12 HN ALA 12 0.115 -0.909 -0.489
101 HA ALA 12 HA ALA 12 -1.406 1.432 -0.010
102 HB1 ALA 12 HB1 ALA 12 0.817 1.437 -1.104
103 HB2 ALA 12 HB2 ALA 12 -0.398 2.269 -2.073
104 HB3 ALA 12 HB3 ALA 12 0.111 0.638 -2.508
105 H GLY 13 HN GLY 13 -1.976 -1.411 -1.898
106 HA2 GLY 13 HA2 GLY 13 -4.011 -0.221 -3.586
107 HA3 GLY 13 HA1 GLY 13 -3.599 -1.930 -3.492
108 H ARG 14 HN ARG 14 -3.925 -2.377 -0.768
109 HA ARG 14 HA ARG 14 -6.655 -2.923 -0.549
110 HB2 ARG 14 HB2 ARG 14 -4.902 -4.037 0.798
111 HB3 ARG 14 HB1 ARG 14 -4.678 -2.544 1.713
112 HG2 ARG 14 HG2 ARG 14 -6.953 -2.633 2.535
113 HG3 ARG 14 HG1 ARG 14 -7.324 -4.007 1.492
114 HD2 ARG 14 HD2 ARG 14 -5.184 -4.064 3.634
115 HD3 ARG 14 HD1 ARG 14 -6.835 -4.621 3.893
116 HE ARG 14 HE ARG 14 -6.020 -5.988 1.665
117 HH11 ARG 14 HH21 ARG 14 -4.787 -5.502 4.861
118 HH12 ARG 14 HH22 ARG 14 -4.010 -7.048 4.945
119 HH21 ARG 14 HH11 ARG 14 -5.003 -8.016 1.766
120 HH22 ARG 14 HH12 ARG 14 -4.132 -8.471 3.193
121 H SER 15 HN SER 15 -4.794 -0.120 0.489
122 HA SER 15 HA SER 15 -6.745 1.108 2.110
123 HB2 SER 15 HB2 SER 15 -4.617 2.418 0.401
124 HB3 SER 15 HB1 SER 15 -5.487 3.180 1.729
125 HG SER 15 HG SER 15 -4.272 0.739 2.259
126 H ILE 16 HN ILE 16 -6.203 1.153 -1.360
127 HA ILE 16 HA ILE 16 -7.969 3.238 -2.056
128 HB ILE 16 HB ILE 16 -7.408 0.752 -3.691
129 HG12 ILE 16 HG12 ILE 16 -5.274 1.682 -2.955
130 HG13 ILE 16 HG11 ILE 16 -5.518 2.138 -4.641
131 HG21 ILE 16 HG21 ILE 16 -8.230 3.588 -4.368
132 HG22 ILE 16 HG22 ILE 16 -9.159 2.116 -4.648
133 HG23 ILE 16 HG23 ILE 16 -7.687 2.418 -5.570
134 HD11 ILE 16 HD11 ILE 16 -5.752 3.855 -2.176
135 HD12 ILE 16 HD12 ILE 16 -6.589 4.307 -3.661
136 HD13 ILE 16 HD13 ILE 16 -4.834 4.166 -3.647
137 H GLY 17 HN GLY 17 -8.528 -0.235 -1.619
138 HA2 GLY 17 HA2 GLY 17 -11.248 -0.227 -2.429
139 HA3 GLY 17 HA1 GLY 17 -10.470 -1.461 -1.442
140 H ARG 18 HN ARG 18 -9.651 0.317 0.677
141 HA ARG 18 HA ARG 18 -11.935 0.198 2.325
142 HB2 ARG 18 HB2 ARG 18 -9.337 1.717 2.626
143 HB3 ARG 18 HB1 ARG 18 -10.557 1.598 3.896
144 HG2 ARG 18 HG2 ARG 18 -10.386 -0.878 3.804
145 HG3 ARG 18 HG1 ARG 18 -9.118 -0.727 2.588
146 HD2 ARG 18 HD2 ARG 18 -8.097 -1.030 4.781
147 HD3 ARG 18 HD1 ARG 18 -7.762 0.597 4.197
148 HE ARG 18 HE ARG 18 -10.123 0.661 5.741
149 HH11 ARG 18 HH21 ARG 18 -6.716 0.126 6.028
150 HH12 ARG 18 HH22 ARG 18 -6.623 0.703 7.659
151 HH21 ARG 18 HH11 ARG 18 -10.008 1.420 7.879
152 HH22 ARG 18 HH12 ARG 18 -8.486 1.436 8.706
153 H PHE 19 HN PHE 19 -10.444 2.883 0.541
154 HA PHE 19 HA PHE 19 -12.108 4.933 1.564
155 HB2 PHE 19 HB2 PHE 19 -10.459 4.666 -0.948
156 HB3 PHE 19 HB1 PHE 19 -11.414 6.110 -0.616
157 HD1 PHE 19 HD2 PHE 19 -11.141 7.020 1.906
158 HD2 PHE 19 HD1 PHE 19 -8.240 4.671 -0.219
159 HE1 PHE 19 HE2 PHE 19 -9.360 7.863 3.408
160 HE2 PHE 19 HE1 PHE 19 -6.457 5.514 1.284
161 HZ PHE 19 HZ PHE 19 -7.017 7.110 3.098
162 H LEU 20 HN LEU 20 -12.472 2.643 -1.070
163 HA LEU 20 HA LEU 20 -14.512 3.788 -2.534
164 HB2 LEU 20 HB2 LEU 20 -13.247 1.401 -2.678
165 HB3 LEU 20 HB1 LEU 20 -14.766 0.862 -1.967
166 HG LEU 20 HG LEU 20 -14.953 0.746 -4.420
167 HD11 LEU 20 HD11 LEU 20 -16.864 1.675 -2.906
168 HD12 LEU 20 HD12 LEU 20 -17.010 1.878 -4.649
169 HD13 LEU 20 HD13 LEU 20 -16.479 3.227 -3.652
170 HD21 LEU 20 HD21 LEU 20 -14.781 3.664 -4.879
171 HD22 LEU 20 HD22 LEU 20 -14.118 2.342 -5.838
172 HD23 LEU 20 HD23 LEU 20 -13.244 2.932 -4.426
173 H THR 21 HN THR 21 -14.699 2.092 0.552
174 HA THR 21 HA THR 21 -17.410 1.656 0.810
175 HB THR 21 HB THR 21 -15.506 1.143 2.474
176 HG1 THR 21 HG1 THR 21 -17.159 1.634 4.258
177 HG21 THR 21 HG21 THR 21 -14.960 2.753 4.113
178 HG22 THR 21 HG22 THR 21 -16.343 3.767 3.702
179 HG23 THR 21 HG23 THR 21 -14.964 3.676 2.611
180 H GLY 22 HN GLY 22 -19.184 2.892 0.990
181 HA2 GLY 22 HA2 GLY 22 -19.675 5.216 2.261
182 HA3 GLY 22 HA1 GLY 22 -18.916 5.778 0.773
183 HN1 NH2 23 HT1 GLY 22 -21.918 3.491 -0.592
184 HN2 NH2 23 HT2 GLY 22 -20.389 2.903 -0.031
Start of MODEL 7
1 H1 PHE 1 HT1 PHE 1 15.656 -7.997 -1.775
2 H2 PHE 1 HT2 PHE 1 14.420 -8.146 -2.931
3 H3 PHE 1 HT3 PHE 1 14.098 -8.459 -1.292
4 HA PHE 1 HA PHE 1 14.376 -6.187 -0.704
5 HB2 PHE 1 HB2 PHE 1 15.116 -5.799 -3.623
6 HB3 PHE 1 HB1 PHE 1 14.961 -4.515 -2.424
7 HD1 PHE 1 HD2 PHE 1 16.468 -4.567 -0.371
8 HD2 PHE 1 HD1 PHE 1 17.117 -7.063 -3.805
9 HE1 PHE 1 HE2 PHE 1 18.808 -4.958 0.355
10 HE2 PHE 1 HE1 PHE 1 19.456 -7.454 -3.079
11 HZ PHE 1 HZ PHE 1 20.302 -6.400 -1.000
12 H ILE 2 HN ILE 2 13.169 -7.147 -3.935
13 HA ILE 2 HA ILE 2 10.967 -5.507 -4.117
14 HB ILE 2 HB ILE 2 9.982 -7.280 -5.553
15 HG12 ILE 2 HG12 ILE 2 12.378 -8.891 -4.614
16 HG13 ILE 2 HG11 ILE 2 10.702 -9.215 -4.175
17 HG21 ILE 2 HG21 ILE 2 12.964 -7.028 -6.009
18 HG22 ILE 2 HG22 ILE 2 11.833 -5.708 -6.303
19 HG23 ILE 2 HG23 ILE 2 11.699 -7.205 -7.223
20 HD11 ILE 2 HD11 ILE 2 11.011 -10.674 -5.971
21 HD12 ILE 2 HD12 ILE 2 12.054 -9.546 -6.836
22 HD13 ILE 2 HD13 ILE 2 10.313 -9.269 -6.776
23 H HIS 3 HN HIS 3 11.367 -8.439 -2.223
24 HA HIS 3 HA HIS 3 8.757 -9.092 -1.595
25 HB2 HIS 3 HB2 HIS 3 11.213 -9.118 0.169
26 HB3 HIS 3 HB1 HIS 3 9.681 -9.868 0.617
27 HD2 HIS 3 HD2 HIS 3 12.793 -10.670 -1.522
28 HE1 HIS 3 HE1 HIS 3 9.911 -13.621 -2.419
29 HE2 HIS 3 HE2 HIS 3 12.343 -12.954 -2.707
30 H HIS 4 HN HIS 4 10.815 -6.645 -0.012
31 HA HIS 4 HA HIS 4 8.798 -5.818 1.845
32 HB2 HIS 4 HB2 HIS 4 11.197 -5.445 2.258
33 HB3 HIS 4 HB1 HIS 4 11.263 -4.344 0.881
34 HD2 HIS 4 HD2 HIS 4 9.694 -4.434 4.509
35 HE1 HIS 4 HE1 HIS 4 9.479 -0.479 3.049
36 HE2 HIS 4 HE2 HIS 4 9.096 -1.956 5.078
37 H ILE 5 HN ILE 5 10.031 -4.505 -1.190
38 HA ILE 5 HA ILE 5 8.379 -2.233 -1.350
39 HB ILE 5 HB ILE 5 9.373 -3.825 -3.719
40 HG12 ILE 5 HG12 ILE 5 11.270 -3.529 -2.240
41 HG13 ILE 5 HG11 ILE 5 11.409 -2.345 -3.536
42 HG21 ILE 5 HG21 ILE 5 7.789 -1.915 -4.095
43 HG22 ILE 5 HG22 ILE 5 9.375 -1.656 -4.820
44 HG23 ILE 5 HG23 ILE 5 8.954 -0.850 -3.309
45 HD11 ILE 5 HD11 ILE 5 10.159 -0.739 -1.910
46 HD12 ILE 5 HD12 ILE 5 11.860 -1.081 -1.601
47 HD13 ILE 5 HD13 ILE 5 10.616 -1.904 -0.665
48 H PHE 6 HN PHE 6 7.831 -5.569 -2.224
49 HA PHE 6 HA PHE 6 5.477 -5.222 -3.772
50 HB2 PHE 6 HB2 PHE 6 6.833 -7.320 -3.707
51 HB3 PHE 6 HB1 PHE 6 6.228 -7.617 -2.076
52 HD1 PHE 6 HD2 PHE 6 5.198 -7.155 -5.623
53 HD2 PHE 6 HD1 PHE 6 4.040 -8.497 -1.710
54 HE1 PHE 6 HE2 PHE 6 3.135 -8.149 -6.575
55 HE2 PHE 6 HE1 PHE 6 1.976 -9.491 -2.661
56 HZ PHE 6 HZ PHE 6 1.524 -9.317 -5.094
57 H ARG 7 HN ARG 7 6.063 -5.746 -0.344
58 HA ARG 7 HA ARG 7 3.438 -6.082 0.544
59 HB2 ARG 7 HB2 ARG 7 5.451 -6.393 1.974
60 HB3 ARG 7 HB1 ARG 7 5.660 -4.641 2.013
61 HG2 ARG 7 HG2 ARG 7 3.427 -4.389 3.034
62 HG3 ARG 7 HG1 ARG 7 3.211 -6.139 2.991
63 HD2 ARG 7 HD2 ARG 7 5.267 -6.363 4.410
64 HD3 ARG 7 HD1 ARG 7 5.309 -4.608 4.550
65 HE ARG 7 HE ARG 7 3.428 -6.410 5.851
66 HH11 ARG 7 HH21 ARG 7 4.217 -3.190 4.857
67 HH12 ARG 7 HH22 ARG 7 3.178 -2.430 6.017
68 HH21 ARG 7 HH11 ARG 7 2.064 -5.422 7.373
69 HH22 ARG 7 HH12 ARG 7 1.958 -3.694 7.440
70 H GLY 8 HN GLY 8 5.207 -3.154 -0.280
71 HA2 GLY 8 HA2 GLY 8 3.335 -1.297 0.799
72 HA3 GLY 8 HA1 GLY 8 4.563 -0.948 -0.413
73 H ILE 9 HN ILE 9 3.643 -2.943 -2.292
74 HA ILE 9 HA ILE 9 1.796 -1.386 -3.776
75 HB ILE 9 HB ILE 9 2.378 -4.338 -4.117
76 HG12 ILE 9 HG12 ILE 9 4.474 -3.104 -4.057
77 HG13 ILE 9 HG11 ILE 9 4.124 -3.546 -5.725
78 HG21 ILE 9 HG21 ILE 9 1.418 -2.191 -6.031
79 HG22 ILE 9 HG22 ILE 9 0.465 -3.546 -5.426
80 HG23 ILE 9 HG23 ILE 9 1.838 -3.839 -6.494
81 HD11 ILE 9 HD11 ILE 9 3.989 -0.847 -4.413
82 HD12 ILE 9 HD12 ILE 9 2.994 -1.171 -5.832
83 HD13 ILE 9 HD13 ILE 9 4.748 -1.303 -5.935
84 H VAL 10 HN VAL 10 1.331 -4.462 -2.031
85 HA VAL 10 HA VAL 10 -1.472 -4.569 -2.465
86 HB VAL 10 HB VAL 10 -0.274 -6.587 -1.900
87 HG11 VAL 10 HG11 VAL 10 0.287 -5.322 0.795
88 HG12 VAL 10 HG12 VAL 10 1.463 -5.429 -0.513
89 HG13 VAL 10 HG13 VAL 10 0.835 -6.898 0.229
90 HG21 VAL 10 HG21 VAL 10 -1.752 -7.471 -0.246
91 HG22 VAL 10 HG22 VAL 10 -2.666 -6.201 -1.057
92 HG23 VAL 10 HG23 VAL 10 -1.949 -5.897 0.525
93 H HIS 11 HN HIS 11 0.494 -3.336 0.215
94 HA HIS 11 HA HIS 11 -1.693 -2.693 1.917
95 HB2 HIS 11 HB2 HIS 11 1.212 -1.950 1.789
96 HB3 HIS 11 HB1 HIS 11 0.154 -1.046 2.869
97 HD2 HIS 11 HD2 HIS 11 -0.542 -2.397 5.215
98 HE1 HIS 11 HE1 HIS 11 1.188 -6.118 4.224
99 HE2 HIS 11 HE2 HIS 11 0.055 -4.791 6.068
100 H ALA 12 HN ALA 12 0.190 -0.776 -0.420
101 HA ALA 12 HA ALA 12 -1.120 1.688 0.061
102 HB1 ALA 12 HB1 ALA 12 1.040 1.511 -1.116
103 HB2 ALA 12 HB2 ALA 12 -0.154 2.381 -2.080
104 HB3 ALA 12 HB3 ALA 12 0.234 0.703 -2.460
105 H GLY 13 HN GLY 13 -1.995 -1.131 -1.748
106 HA2 GLY 13 HA2 GLY 13 -4.010 0.193 -3.365
107 HA3 GLY 13 HA1 GLY 13 -3.718 -1.541 -3.274
108 H ARG 14 HN ARG 14 -3.876 -1.752 -0.449
109 HA ARG 14 HA ARG 14 -6.577 -2.306 -0.061
110 HB2 ARG 14 HB2 ARG 14 -4.735 -3.214 1.350
111 HB3 ARG 14 HB1 ARG 14 -4.567 -1.627 2.101
112 HG2 ARG 14 HG2 ARG 14 -6.924 -1.747 2.862
113 HG3 ARG 14 HG1 ARG 14 -7.068 -3.345 2.133
114 HD2 ARG 14 HD2 ARG 14 -5.064 -2.613 4.285
115 HD3 ARG 14 HD1 ARG 14 -6.599 -3.424 4.586
116 HE ARG 14 HE ARG 14 -4.217 -4.603 3.407
117 HH11 ARG 14 HH21 ARG 14 -7.642 -4.757 3.871
118 HH12 ARG 14 HH22 ARG 14 -7.743 -6.463 3.590
119 HH21 ARG 14 HH11 ARG 14 -4.340 -6.839 3.037
120 HH22 ARG 14 HH12 ARG 14 -5.873 -7.642 3.118
121 H SER 15 HN SER 15 -4.783 0.657 0.537
122 HA SER 15 HA SER 15 -6.691 2.011 2.112
123 HB2 SER 15 HB2 SER 15 -4.626 3.050 0.165
124 HB3 SER 15 HB1 SER 15 -5.570 4.082 1.236
125 HG SER 15 HG SER 15 -4.746 2.578 2.939
126 H ILE 16 HN ILE 16 -6.242 1.861 -1.402
127 HA ILE 16 HA ILE 16 -8.337 3.652 -2.078
128 HB ILE 16 HB ILE 16 -7.020 1.428 -3.647
129 HG12 ILE 16 HG12 ILE 16 -6.028 3.399 -4.854
130 HG13 ILE 16 HG11 ILE 16 -6.791 4.455 -3.669
131 HG21 ILE 16 HG21 ILE 16 -9.168 3.402 -4.440
132 HG22 ILE 16 HG22 ILE 16 -9.148 1.653 -4.671
133 HG23 ILE 16 HG23 ILE 16 -8.083 2.680 -5.630
134 HD11 ILE 16 HD11 ILE 16 -5.045 2.205 -2.714
135 HD12 ILE 16 HD12 ILE 16 -5.398 3.752 -1.941
136 HD13 ILE 16 HD13 ILE 16 -4.301 3.681 -3.319
137 H GLY 17 HN GLY 17 -8.235 0.122 -1.740
138 HA2 GLY 17 HA2 GLY 17 -10.920 -0.353 -2.538
139 HA3 GLY 17 HA1 GLY 17 -9.909 -1.453 -1.605
140 H ARG 18 HN ARG 18 -9.410 0.425 0.547
141 HA ARG 18 HA ARG 18 -11.530 -0.215 2.265
142 HB2 ARG 18 HB2 ARG 18 -9.234 0.376 3.019
143 HB3 ARG 18 HB1 ARG 18 -9.541 2.050 2.554
144 HG2 ARG 18 HG2 ARG 18 -11.427 2.154 4.145
145 HG3 ARG 18 HG1 ARG 18 -11.135 0.476 4.601
146 HD2 ARG 18 HD2 ARG 18 -9.079 2.684 4.870
147 HD3 ARG 18 HD1 ARG 18 -10.130 2.154 6.181
148 HE ARG 18 HE ARG 18 -8.827 -0.111 5.145
149 HH11 ARG 18 HH21 ARG 18 -8.139 2.851 6.797
150 HH12 ARG 18 HH22 ARG 18 -6.752 2.226 7.627
151 HH21 ARG 18 HH11 ARG 18 -7.010 -0.937 6.229
152 HH22 ARG 18 HH12 ARG 18 -6.113 0.081 7.304
153 H PHE 19 HN PHE 19 -10.854 2.769 0.442
154 HA PHE 19 HA PHE 19 -12.991 4.282 1.547
155 HB2 PHE 19 HB2 PHE 19 -11.413 4.533 -1.016
156 HB3 PHE 19 HB1 PHE 19 -12.663 5.686 -0.546
157 HD1 PHE 19 HD1 PHE 19 -12.481 6.522 1.985
158 HD2 PHE 19 HD2 PHE 19 -9.214 4.996 -0.350
159 HE1 PHE 19 HE1 PHE 19 -10.874 7.688 3.470
160 HE2 PHE 19 HE2 PHE 19 -7.607 6.162 1.135
161 HZ PHE 19 HZ PHE 19 -8.436 7.508 3.046
162 H LEU 20 HN LEU 20 -12.725 2.092 -1.206
163 HA LEU 20 HA LEU 20 -15.110 2.681 -2.514
164 HB2 LEU 20 HB2 LEU 20 -13.411 1.146 -3.428
165 HB3 LEU 20 HB1 LEU 20 -13.805 -0.035 -2.182
166 HG LEU 20 HG LEU 20 -16.120 -0.174 -3.050
167 HD11 LEU 20 HD11 LEU 20 -16.665 1.859 -4.039
168 HD12 LEU 20 HD12 LEU 20 -16.332 0.889 -5.467
169 HD13 LEU 20 HD13 LEU 20 -15.109 2.004 -4.860
170 HD21 LEU 20 HD21 LEU 20 -14.412 -1.719 -3.915
171 HD22 LEU 20 HD22 LEU 20 -13.981 -0.556 -5.169
172 HD23 LEU 20 HD23 LEU 20 -15.575 -1.310 -5.175
173 H THR 21 HN THR 21 -14.517 0.769 0.384
174 HA THR 21 HA THR 21 -16.918 -0.597 0.630
175 HB THR 21 HB THR 21 -15.475 0.732 2.930
176 HG1 THR 21 HG1 THR 21 -14.928 -1.712 1.600
177 HG21 THR 21 HG21 THR 21 -17.683 -0.414 3.334
178 HG22 THR 21 HG22 THR 21 -16.328 -1.126 4.210
179 HG23 THR 21 HG23 THR 21 -16.946 -1.908 2.756
180 H GLY 22 HN GLY 22 -18.960 -0.087 1.219
181 HA2 GLY 22 HA2 GLY 22 -20.809 1.180 1.757
182 HA3 GLY 22 HA1 GLY 22 -19.717 2.302 2.562
183 HN1 NH2 23 HT1 GLY 22 -19.284 3.292 -1.303
184 HN2 NH2 23 HT2 GLY 22 -18.501 1.961 -0.520
Start of MODEL 8
1 H1 PHE 1 HT1 PHE 1 15.194 -8.199 -2.812
2 H2 PHE 1 HT2 PHE 1 13.998 -8.875 -1.811
3 H3 PHE 1 HT3 PHE 1 15.592 -8.709 -1.245
4 HA PHE 1 HA PHE 1 14.535 -6.946 -0.231
5 HB2 PHE 1 HB2 PHE 1 16.553 -6.264 -1.537
6 HB3 PHE 1 HB1 PHE 1 15.495 -5.832 -2.881
7 HD1 PHE 1 HD2 PHE 1 16.315 -5.068 0.666
8 HD2 PHE 1 HD1 PHE 1 14.251 -3.793 -2.879
9 HE1 PHE 1 HE2 PHE 1 15.898 -2.856 1.705
10 HE2 PHE 1 HE1 PHE 1 13.833 -1.580 -1.839
11 HZ PHE 1 HZ PHE 1 14.656 -1.112 0.453
12 H ILE 2 HN ILE 2 13.452 -7.392 -3.565
13 HA ILE 2 HA ILE 2 11.461 -5.497 -3.759
14 HB ILE 2 HB ILE 2 10.330 -7.108 -5.308
15 HG12 ILE 2 HG12 ILE 2 12.601 -8.951 -4.498
16 HG13 ILE 2 HG11 ILE 2 10.930 -9.149 -3.971
17 HG21 ILE 2 HG21 ILE 2 12.222 -5.653 -6.028
18 HG22 ILE 2 HG22 ILE 2 12.170 -7.177 -6.916
19 HG23 ILE 2 HG23 ILE 2 13.344 -6.952 -5.619
20 HD11 ILE 2 HD11 ILE 2 11.969 -9.260 -6.811
21 HD12 ILE 2 HD12 ILE 2 10.255 -9.215 -6.401
22 HD13 ILE 2 HD13 ILE 2 11.249 -10.577 -5.886
23 H HIS 3 HN HIS 3 11.477 -8.482 -1.950
24 HA HIS 3 HA HIS 3 8.822 -9.010 -1.502
25 HB2 HIS 3 HB2 HIS 3 9.459 -10.031 0.579
26 HB3 HIS 3 HB1 HIS 3 10.812 -10.250 -0.532
27 HD2 HIS 3 HD2 HIS 3 10.976 -9.764 2.939
28 HE1 HIS 3 HE1 HIS 3 13.297 -6.474 1.674
29 HE2 HIS 3 HE2 HIS 3 12.709 -7.948 3.655
30 H HIS 4 HN HIS 4 10.773 -6.462 0.009
31 HA HIS 4 HA HIS 4 8.704 -5.558 1.778
32 HB2 HIS 4 HB2 HIS 4 11.414 -4.601 0.950
33 HB3 HIS 4 HB1 HIS 4 10.314 -3.405 1.635
34 HD2 HIS 4 HD2 HIS 4 9.981 -6.971 3.134
35 HE1 HIS 4 HE1 HIS 4 12.130 -4.646 5.923
36 HE2 HIS 4 HE2 HIS 4 10.959 -6.868 5.552
37 H ILE 5 HN ILE 5 9.941 -4.452 -1.356
38 HA ILE 5 HA ILE 5 8.223 -2.223 -1.634
39 HB ILE 5 HB ILE 5 9.437 -3.925 -3.823
40 HG12 ILE 5 HG12 ILE 5 10.511 -1.406 -2.512
41 HG13 ILE 5 HG11 ILE 5 11.065 -3.033 -2.115
42 HG21 ILE 5 HG21 ILE 5 8.368 -1.086 -3.757
43 HG22 ILE 5 HG22 ILE 5 7.710 -2.441 -4.677
44 HG23 ILE 5 HG23 ILE 5 9.285 -1.769 -5.101
45 HD11 ILE 5 HD11 ILE 5 11.327 -1.571 -4.747
46 HD12 ILE 5 HD12 ILE 5 11.538 -3.316 -4.621
47 HD13 ILE 5 HD13 ILE 5 12.613 -2.233 -3.739
48 H PHE 6 HN PHE 6 7.828 -5.633 -2.380
49 HA PHE 6 HA PHE 6 5.472 -5.404 -3.948
50 HB2 PHE 6 HB2 PHE 6 6.832 -7.438 -3.963
51 HB3 PHE 6 HB1 PHE 6 6.468 -7.711 -2.259
52 HD1 PHE 6 HD1 PHE 6 4.862 -7.325 -5.613
53 HD2 PHE 6 HD2 PHE 6 4.505 -8.855 -1.615
54 HE1 PHE 6 HE1 PHE 6 2.769 -8.493 -6.247
55 HE2 PHE 6 HE2 PHE 6 2.412 -10.023 -2.249
56 HZ PHE 6 HZ PHE 6 1.544 -9.842 -4.565
57 H ARG 7 HN ARG 7 6.045 -5.821 -0.492
58 HA ARG 7 HA ARG 7 3.396 -6.278 0.324
59 HB2 ARG 7 HB2 ARG 7 5.381 -6.561 1.789
60 HB3 ARG 7 HB1 ARG 7 5.558 -4.807 1.849
61 HG2 ARG 7 HG2 ARG 7 3.322 -4.595 2.845
62 HG3 ARG 7 HG1 ARG 7 3.103 -6.342 2.751
63 HD2 ARG 7 HD2 ARG 7 3.797 -5.755 5.008
64 HD3 ARG 7 HD1 ARG 7 5.102 -6.634 4.214
65 HE ARG 7 HE ARG 7 5.429 -3.832 3.836
66 HH11 ARG 7 HH21 ARG 7 5.653 -6.356 6.193
67 HH12 ARG 7 HH22 ARG 7 6.877 -5.565 7.127
68 HH21 ARG 7 HH11 ARG 7 7.034 -2.787 5.057
69 HH22 ARG 7 HH12 ARG 7 7.659 -3.544 6.485
70 H GLY 8 HN GLY 8 5.144 -3.290 -0.357
71 HA2 GLY 8 HA2 GLY 8 3.256 -1.471 0.696
72 HA3 GLY 8 HA1 GLY 8 4.445 -1.107 -0.553
73 H ILE 9 HN ILE 9 3.498 -3.130 -2.390
74 HA ILE 9 HA ILE 9 1.582 -1.616 -3.827
75 HB ILE 9 HB ILE 9 2.262 -4.548 -4.146
76 HG12 ILE 9 HG12 ILE 9 3.452 -2.110 -5.512
77 HG13 ILE 9 HG11 ILE 9 4.236 -3.003 -4.210
78 HG21 ILE 9 HG21 ILE 9 1.532 -4.149 -6.490
79 HG22 ILE 9 HG22 ILE 9 1.069 -2.506 -6.049
80 HG23 ILE 9 HG23 ILE 9 0.222 -3.881 -5.343
81 HD11 ILE 9 HD11 ILE 9 5.155 -3.929 -6.193
82 HD12 ILE 9 HD12 ILE 9 3.587 -3.958 -6.998
83 HD13 ILE 9 HD13 ILE 9 3.927 -5.092 -5.692
84 H VAL 10 HN VAL 10 1.261 -4.625 -1.951
85 HA VAL 10 HA VAL 10 -1.540 -4.897 -2.336
86 HB VAL 10 HB VAL 10 0.267 -5.961 -0.151
87 HG11 VAL 10 HG11 VAL 10 -2.615 -6.542 -0.870
88 HG12 VAL 10 HG12 VAL 10 -1.977 -6.026 0.691
89 HG13 VAL 10 HG13 VAL 10 -1.630 -7.647 0.090
90 HG21 VAL 10 HG21 VAL 10 0.260 -8.002 -1.469
91 HG22 VAL 10 HG22 VAL 10 0.753 -6.670 -2.515
92 HG23 VAL 10 HG23 VAL 10 -0.889 -7.306 -2.612
93 H HIS 11 HN HIS 11 0.396 -3.487 0.295
94 HA HIS 11 HA HIS 11 -1.748 -2.821 1.994
95 HB2 HIS 11 HB2 HIS 11 0.616 -2.810 2.705
96 HB3 HIS 11 HB1 HIS 11 0.910 -1.407 1.678
97 HD2 HIS 11 HD2 HIS 11 -0.091 1.043 2.692
98 HE1 HIS 11 HE1 HIS 11 -1.564 -0.529 6.322
99 HE2 HIS 11 HE2 HIS 11 -1.090 1.609 5.037
100 H ALA 12 HN ALA 12 -0.063 -0.886 -0.482
101 HA ALA 12 HA ALA 12 -1.571 1.470 -0.142
102 HB1 ALA 12 HB1 ALA 12 -0.394 0.558 -2.764
103 HB2 ALA 12 HB2 ALA 12 0.611 1.156 -1.443
104 HB3 ALA 12 HB3 ALA 12 -0.602 2.208 -2.175
105 H GLY 13 HN GLY 13 -2.254 -1.521 -1.761
106 HA2 GLY 13 HA2 GLY 13 -4.390 -0.496 -3.409
107 HA3 GLY 13 HA1 GLY 13 -4.006 -2.192 -3.132
108 H ARG 14 HN ARG 14 -4.167 -2.302 -0.364
109 HA ARG 14 HA ARG 14 -6.926 -2.673 0.062
110 HB2 ARG 14 HB2 ARG 14 -4.607 -2.457 1.985
111 HB3 ARG 14 HB1 ARG 14 -6.250 -2.838 2.502
112 HG2 ARG 14 HG2 ARG 14 -6.288 -4.805 1.057
113 HG3 ARG 14 HG1 ARG 14 -4.691 -4.404 0.422
114 HD2 ARG 14 HD2 ARG 14 -4.455 -6.113 2.140
115 HD3 ARG 14 HD1 ARG 14 -3.765 -4.604 2.727
116 HE ARG 14 HE ARG 14 -6.491 -4.793 3.505
117 HH11 ARG 14 HH21 ARG 14 -3.343 -6.088 4.122
118 HH12 ARG 14 HH22 ARG 14 -3.677 -6.481 5.776
119 HH21 ARG 14 HH11 ARG 14 -6.938 -5.304 5.673
120 HH22 ARG 14 HH12 ARG 14 -5.711 -6.036 6.654
121 H SER 15 HN SER 15 -4.762 -0.001 0.899
122 HA SER 15 HA SER 15 -6.585 1.474 2.477
123 HB2 SER 15 HB2 SER 15 -4.307 2.108 2.612
124 HB3 SER 15 HB1 SER 15 -4.159 2.250 0.864
125 HG SER 15 HG SER 15 -5.240 3.998 2.732
126 H ILE 16 HN ILE 16 -5.834 1.575 -0.986
127 HA ILE 16 HA ILE 16 -7.570 3.713 -1.646
128 HB ILE 16 HB ILE 16 -6.515 1.418 -3.310
129 HG12 ILE 16 HG12 ILE 16 -5.752 4.349 -3.318
130 HG13 ILE 16 HG11 ILE 16 -4.927 3.156 -2.316
131 HG21 ILE 16 HG21 ILE 16 -7.139 3.024 -5.225
132 HG22 ILE 16 HG22 ILE 16 -8.167 3.841 -4.048
133 HG23 ILE 16 HG23 ILE 16 -8.467 2.152 -4.457
134 HD11 ILE 16 HD11 ILE 16 -3.811 3.569 -4.537
135 HD12 ILE 16 HD12 ILE 16 -5.243 2.899 -5.318
136 HD13 ILE 16 HD13 ILE 16 -4.259 1.885 -4.262
137 H GLY 17 HN GLY 17 -8.042 0.196 -1.623
138 HA2 GLY 17 HA2 GLY 17 -10.678 0.210 -2.657
139 HA3 GLY 17 HA1 GLY 17 -9.941 -1.103 -1.744
140 H ARG 18 HN ARG 18 -9.368 0.572 0.570
141 HA ARG 18 HA ARG 18 -11.633 0.093 2.121
142 HB2 ARG 18 HB2 ARG 18 -9.291 0.572 2.947
143 HB3 ARG 18 HB1 ARG 18 -9.618 2.281 2.659
144 HG2 ARG 18 HG2 ARG 18 -11.533 2.197 4.189
145 HG3 ARG 18 HG1 ARG 18 -11.270 0.471 4.447
146 HD2 ARG 18 HD2 ARG 18 -9.335 2.695 5.152
147 HD3 ARG 18 HD1 ARG 18 -10.290 1.754 6.292
148 HE ARG 18 HE ARG 18 -7.886 0.883 4.908
149 HH11 ARG 18 HH21 ARG 18 -10.763 0.015 6.624
150 HH12 ARG 18 HH22 ARG 18 -10.165 -1.533 7.120
151 HH21 ARG 18 HH11 ARG 18 -7.095 -1.145 5.556
152 HH22 ARG 18 HH12 ARG 18 -8.089 -2.191 6.516
153 H PHE 19 HN PHE 19 -10.678 3.023 0.364
154 HA PHE 19 HA PHE 19 -12.700 4.720 1.388
155 HB2 PHE 19 HB2 PHE 19 -11.043 4.772 -1.132
156 HB3 PHE 19 HB1 PHE 19 -12.243 6.015 -0.779
157 HD1 PHE 19 HD1 PHE 19 -12.057 7.326 1.385
158 HD2 PHE 19 HD2 PHE 19 -8.920 4.776 -0.060
159 HE1 PHE 19 HE1 PHE 19 -10.442 8.465 2.882
160 HE2 PHE 19 HE2 PHE 19 -7.303 5.914 1.438
161 HZ PHE 19 HZ PHE 19 -8.065 7.760 2.909
162 H LEU 20 HN LEU 20 -12.614 2.454 -1.316
163 HA LEU 20 HA LEU 20 -14.940 3.224 -2.667
164 HB2 LEU 20 HB2 LEU 20 -13.865 0.417 -2.304
165 HB3 LEU 20 HB1 LEU 20 -14.978 0.940 -3.562
166 HG LEU 20 HG LEU 20 -12.165 2.007 -3.172
167 HD11 LEU 20 HD11 LEU 20 -13.224 0.356 -5.477
168 HD12 LEU 20 HD12 LEU 20 -12.466 -0.386 -4.070
169 HD13 LEU 20 HD13 LEU 20 -11.545 0.726 -5.085
170 HD21 LEU 20 HD21 LEU 20 -12.795 2.871 -5.611
171 HD22 LEU 20 HD22 LEU 20 -13.289 3.789 -4.191
172 HD23 LEU 20 HD23 LEU 20 -14.443 2.730 -5.003
173 H THR 21 HN THR 21 -14.506 1.304 0.246
174 HA THR 21 HA THR 21 -17.016 0.126 0.471
175 HB THR 21 HB THR 21 -15.449 1.293 2.778
176 HG1 THR 21 HG1 THR 21 -15.101 -1.335 1.988
177 HG21 THR 21 HG21 THR 21 -17.196 -1.174 2.559
178 HG22 THR 21 HG22 THR 21 -17.728 0.369 3.227
179 HG23 THR 21 HG23 THR 21 -16.445 -0.541 4.025
180 H GLY 22 HN GLY 22 -19.009 0.820 1.023
181 HA2 GLY 22 HA2 GLY 22 -20.706 2.230 1.736
182 HA3 GLY 22 HA1 GLY 22 -19.478 3.343 2.337
183 HN1 NH2 23 HT1 GLY 22 -19.338 3.947 -1.630
184 HN2 NH2 23 HT2 GLY 22 -18.571 2.640 -0.791
Start of MODEL 9
1 H1 PHE 1 HT1 PHE 1 15.052 -7.894 -2.735
2 H2 PHE 1 HT2 PHE 1 13.687 -8.160 -1.760
3 H3 PHE 1 HT3 PHE 1 15.191 -7.817 -1.046
4 HA PHE 1 HA PHE 1 14.424 -5.732 -0.922
5 HB2 PHE 1 HB2 PHE 1 15.183 -6.056 -3.831
6 HB3 PHE 1 HB1 PHE 1 14.785 -4.486 -3.133
7 HD1 PHE 1 HD2 PHE 1 16.165 -3.548 -1.285
8 HD2 PHE 1 HD1 PHE 1 17.260 -7.168 -3.324
9 HE1 PHE 1 HE2 PHE 1 18.461 -3.371 -0.366
10 HE2 PHE 1 HE1 PHE 1 19.556 -6.990 -2.405
11 HZ PHE 1 HZ PHE 1 20.157 -5.093 -0.926
12 H ILE 2 HN ILE 2 13.055 -7.052 -3.954
13 HA ILE 2 HA ILE 2 10.850 -5.407 -4.192
14 HB ILE 2 HB ILE 2 11.080 -8.354 -4.859
15 HG12 ILE 2 HG12 ILE 2 11.335 -5.919 -6.649
16 HG13 ILE 2 HG11 ILE 2 12.721 -6.721 -5.909
17 HG21 ILE 2 HG21 ILE 2 9.056 -6.246 -5.665
18 HG22 ILE 2 HG22 ILE 2 8.736 -7.757 -4.814
19 HG23 ILE 2 HG23 ILE 2 9.243 -7.787 -6.500
20 HD11 ILE 2 HD11 ILE 2 12.277 -8.766 -7.073
21 HD12 ILE 2 HD12 ILE 2 12.154 -7.480 -8.274
22 HD13 ILE 2 HD13 ILE 2 10.693 -8.200 -7.599
23 H HIS 3 HN HIS 3 11.321 -8.190 -2.092
24 HA HIS 3 HA HIS 3 8.733 -8.762 -1.307
25 HB2 HIS 3 HB2 HIS 3 11.279 -8.713 0.321
26 HB3 HIS 3 HB1 HIS 3 9.761 -9.391 0.910
27 HD2 HIS 3 HD2 HIS 3 9.233 -11.974 0.005
28 HE1 HIS 3 HE1 HIS 3 12.328 -12.199 -2.856
29 HE2 HIS 3 HE2 HIS 3 10.494 -13.510 -1.688
30 H HIS 4 HN HIS 4 10.911 -6.298 0.092
31 HA HIS 4 HA HIS 4 8.947 -5.300 1.923
32 HB2 HIS 4 HB2 HIS 4 11.569 -4.191 0.913
33 HB3 HIS 4 HB1 HIS 4 10.569 -3.354 2.101
34 HD2 HIS 4 HD2 HIS 4 10.118 -5.000 4.535
35 HE1 HIS 4 HE1 HIS 4 13.631 -7.258 3.908
36 HE2 HIS 4 HE2 HIS 4 11.825 -6.671 5.594
37 H ILE 5 HN ILE 5 10.285 -4.032 -1.113
38 HA ILE 5 HA ILE 5 8.690 -1.745 -1.323
39 HB ILE 5 HB ILE 5 9.718 -3.437 -3.615
40 HG12 ILE 5 HG12 ILE 5 11.065 -1.108 -2.215
41 HG13 ILE 5 HG11 ILE 5 11.448 -2.797 -1.881
42 HG21 ILE 5 HG21 ILE 5 9.689 -1.305 -4.841
43 HG22 ILE 5 HG22 ILE 5 9.080 -0.475 -3.409
44 HG23 ILE 5 HG23 ILE 5 8.077 -1.671 -4.229
45 HD11 ILE 5 HD11 ILE 5 12.985 -1.731 -3.564
46 HD12 ILE 5 HD12 ILE 5 11.599 -1.543 -4.637
47 HD13 ILE 5 HD13 ILE 5 12.143 -3.155 -4.176
48 H PHE 6 HN PHE 6 8.018 -5.080 -2.122
49 HA PHE 6 HA PHE 6 5.663 -4.624 -3.670
50 HB2 PHE 6 HB2 PHE 6 6.865 -6.737 -3.831
51 HB3 PHE 6 HB1 PHE 6 6.553 -7.073 -2.128
52 HD1 PHE 6 HD2 PHE 6 4.909 -6.534 -5.428
53 HD2 PHE 6 HD1 PHE 6 4.479 -7.999 -1.412
54 HE1 PHE 6 HE2 PHE 6 2.718 -7.532 -6.026
55 HE2 PHE 6 HE1 PHE 6 2.289 -8.997 -2.011
56 HZ PHE 6 HZ PHE 6 1.409 -8.764 -4.318
57 H ARG 7 HN ARG 7 6.312 -5.067 -0.258
58 HA ARG 7 HA ARG 7 3.792 -5.582 0.753
59 HB2 ARG 7 HB2 ARG 7 5.858 -5.479 2.124
60 HB3 ARG 7 HB1 ARG 7 5.838 -3.721 1.980
61 HG2 ARG 7 HG2 ARG 7 3.653 -3.625 3.082
62 HG3 ARG 7 HG1 ARG 7 3.604 -5.385 3.176
63 HD2 ARG 7 HD2 ARG 7 5.628 -5.365 4.585
64 HD3 ARG 7 HD1 ARG 7 5.679 -3.608 4.491
65 HE ARG 7 HE ARG 7 3.145 -4.405 5.458
66 HH11 ARG 7 HH21 ARG 7 6.492 -4.321 6.335
67 HH12 ARG 7 HH22 ARG 7 6.186 -4.191 8.035
68 HH21 ARG 7 HH11 ARG 7 2.736 -4.236 7.687
69 HH22 ARG 7 HH12 ARG 7 4.059 -4.143 8.800
70 H GLY 8 HN GLY 8 5.116 -2.538 -0.422
71 HA2 GLY 8 HA2 GLY 8 3.037 -0.852 0.563
72 HA3 GLY 8 HA1 GLY 8 4.180 -0.457 -0.716
73 H ILE 9 HN ILE 9 3.526 -2.637 -2.443
74 HA ILE 9 HA ILE 9 1.389 -1.487 -3.919
75 HB ILE 9 HB ILE 9 2.886 -4.099 -4.124
76 HG12 ILE 9 HG12 ILE 9 3.688 -3.099 -6.212
77 HG13 ILE 9 HG11 ILE 9 2.596 -1.729 -6.004
78 HG21 ILE 9 HG21 ILE 9 0.769 -4.798 -4.913
79 HG22 ILE 9 HG22 ILE 9 1.612 -4.306 -6.382
80 HG23 ILE 9 HG23 ILE 9 0.425 -3.231 -5.643
81 HD11 ILE 9 HD11 ILE 9 4.666 -2.448 -3.928
82 HD12 ILE 9 HD12 ILE 9 3.790 -0.928 -4.111
83 HD13 ILE 9 HD13 ILE 9 5.033 -1.374 -5.278
84 H VAL 10 HN VAL 10 1.534 -4.504 -2.019
85 HA VAL 10 HA VAL 10 -1.231 -5.110 -2.337
86 HB VAL 10 HB VAL 10 0.363 -6.864 -1.799
87 HG11 VAL 10 HG11 VAL 10 1.621 -6.916 0.220
88 HG12 VAL 10 HG12 VAL 10 0.676 -5.609 0.934
89 HG13 VAL 10 HG13 VAL 10 1.792 -5.271 -0.387
90 HG21 VAL 10 HG21 VAL 10 -1.393 -6.469 0.634
91 HG22 VAL 10 HG22 VAL 10 -0.911 -7.988 -0.121
92 HG23 VAL 10 HG23 VAL 10 -2.054 -6.921 -0.938
93 H HIS 11 HN HIS 11 0.629 -3.587 0.282
94 HA HIS 11 HA HIS 11 -1.485 -3.284 2.108
95 HB2 HIS 11 HB2 HIS 11 0.872 -2.961 2.720
96 HB3 HIS 11 HB1 HIS 11 0.943 -1.524 1.700
97 HD2 HIS 11 HD2 HIS 11 0.468 0.745 3.179
98 HE1 HIS 11 HE1 HIS 11 -1.964 -0.966 6.175
99 HE2 HIS 11 HE2 HIS 11 -0.879 1.185 5.372
100 H ALA 12 HN ALA 12 -0.221 -1.004 -0.334
101 HA ALA 12 HA ALA 12 -2.190 0.999 0.203
102 HB1 ALA 12 HB1 ALA 12 -0.434 0.584 -2.229
103 HB2 ALA 12 HB2 ALA 12 -0.024 1.553 -0.813
104 HB3 ALA 12 HB3 ALA 12 -1.354 2.043 -1.864
105 H GLY 13 HN GLY 13 -2.045 -1.827 -1.816
106 HA2 GLY 13 HA2 GLY 13 -4.084 -1.171 -3.669
107 HA3 GLY 13 HA1 GLY 13 -3.573 -2.802 -3.243
108 H ARG 14 HN ARG 14 -4.304 -3.404 -0.893
109 HA ARG 14 HA ARG 14 -7.060 -3.707 -0.858
110 HB2 ARG 14 HB2 ARG 14 -5.060 -3.752 1.406
111 HB3 ARG 14 HB1 ARG 14 -6.756 -4.190 1.614
112 HG2 ARG 14 HG2 ARG 14 -6.526 -5.928 -0.121
113 HG3 ARG 14 HG1 ARG 14 -4.831 -5.491 -0.337
114 HD2 ARG 14 HD2 ARG 14 -6.009 -6.400 2.301
115 HD3 ARG 14 HD1 ARG 14 -5.196 -7.478 1.170
116 HE ARG 14 HE ARG 14 -3.445 -5.365 1.631
117 HH11 ARG 14 HH21 ARG 14 -5.061 -7.845 3.426
118 HH12 ARG 14 HH22 ARG 14 -3.813 -7.985 4.620
119 HH21 ARG 14 HH11 ARG 14 -1.805 -5.544 3.193
120 HH22 ARG 14 HH12 ARG 14 -1.970 -6.683 4.487
121 H SER 15 HN SER 15 -5.111 -1.088 0.392
122 HA SER 15 HA SER 15 -7.058 0.155 2.031
123 HB2 SER 15 HB2 SER 15 -4.676 1.290 0.556
124 HB3 SER 15 HB1 SER 15 -5.657 2.214 1.691
125 HG SER 15 HG SER 15 -4.193 -0.169 2.196
126 H ILE 16 HN ILE 16 -6.386 0.315 -1.400
127 HA ILE 16 HA ILE 16 -7.826 2.574 -2.138
128 HB ILE 16 HB ILE 16 -6.441 0.838 -3.589
129 HG12 ILE 16 HG12 ILE 16 -7.928 1.665 -5.642
130 HG13 ILE 16 HG11 ILE 16 -8.721 2.634 -4.402
131 HG21 ILE 16 HG21 ILE 16 -7.705 -0.755 -4.820
132 HG22 ILE 16 HG22 ILE 16 -9.238 -0.041 -4.322
133 HG23 ILE 16 HG23 ILE 16 -8.267 -0.937 -3.163
134 HD11 ILE 16 HD11 ILE 16 -7.010 4.054 -5.169
135 HD12 ILE 16 HD12 ILE 16 -5.856 2.730 -5.327
136 HD13 ILE 16 HD13 ILE 16 -6.294 3.331 -3.729
137 H GLY 17 HN GLY 17 -9.029 -0.661 -1.405
138 HA2 GLY 17 HA2 GLY 17 -11.714 -0.210 -2.250
139 HA3 GLY 17 HA1 GLY 17 -11.160 -1.509 -1.199
140 H ARG 18 HN ARG 18 -10.017 0.133 0.838
141 HA ARG 18 HA ARG 18 -12.287 0.590 2.452
142 HB2 ARG 18 HB2 ARG 18 -9.912 0.086 3.228
143 HB3 ARG 18 HB1 ARG 18 -9.549 1.781 2.908
144 HG2 ARG 18 HG2 ARG 18 -10.163 1.922 5.152
145 HG3 ARG 18 HG1 ARG 18 -11.728 2.193 4.389
146 HD2 ARG 18 HD2 ARG 18 -12.257 -0.212 4.628
147 HD3 ARG 18 HD1 ARG 18 -10.693 -0.477 5.391
148 HE ARG 18 HE ARG 18 -11.549 0.442 7.349
149 HH11 ARG 18 HH21 ARG 18 -13.594 1.119 4.642
150 HH12 ARG 18 HH22 ARG 18 -14.883 1.765 5.601
151 HH21 ARG 18 HH11 ARG 18 -13.235 1.287 8.615
152 HH22 ARG 18 HH12 ARG 18 -14.681 1.860 7.851
153 H PHE 19 HN PHE 19 -10.229 2.772 0.572
154 HA PHE 19 HA PHE 19 -11.386 5.190 1.517
155 HB2 PHE 19 HB2 PHE 19 -9.166 4.992 0.358
156 HB3 PHE 19 HB1 PHE 19 -10.038 4.715 -1.150
157 HD1 PHE 19 HD2 PHE 19 -9.657 7.138 1.669
158 HD2 PHE 19 HD1 PHE 19 -10.911 6.531 -2.396
159 HE1 PHE 19 HE2 PHE 19 -9.953 9.584 1.394
160 HE2 PHE 19 HE1 PHE 19 -11.208 8.977 -2.669
161 HZ PHE 19 HZ PHE 19 -10.730 10.504 -0.775
162 H LEU 20 HN LEU 20 -12.158 2.971 -1.101
163 HA LEU 20 HA LEU 20 -13.910 4.582 -2.570
164 HB2 LEU 20 HB2 LEU 20 -12.998 2.059 -2.890
165 HB3 LEU 20 HB1 LEU 20 -14.596 1.684 -2.251
166 HG LEU 20 HG LEU 20 -14.011 3.432 -4.661
167 HD11 LEU 20 HD11 LEU 20 -13.712 1.173 -5.318
168 HD12 LEU 20 HD12 LEU 20 -15.370 1.553 -5.780
169 HD13 LEU 20 HD13 LEU 20 -15.055 0.618 -4.319
170 HD21 LEU 20 HD21 LEU 20 -15.974 4.351 -3.766
171 HD22 LEU 20 HD22 LEU 20 -16.533 2.803 -3.132
172 HD23 LEU 20 HD23 LEU 20 -16.615 3.133 -4.863
173 H THR 21 HN THR 21 -14.405 2.738 0.400
174 HA THR 21 HA THR 21 -17.151 2.650 0.585
175 HB THR 21 HB THR 21 -15.286 1.874 2.254
176 HG1 THR 21 HG1 THR 21 -17.507 2.921 3.570
177 HG21 THR 21 HG21 THR 21 -14.698 4.401 2.634
178 HG22 THR 21 HG22 THR 21 -14.717 3.312 4.023
179 HG23 THR 21 HG23 THR 21 -16.089 4.378 3.717
180 H GLY 22 HN GLY 22 -15.103 5.429 0.611
181 HA2 GLY 22 HA2 GLY 22 -17.120 7.303 0.231
182 HA3 GLY 22 HA1 GLY 22 -16.827 7.241 1.966
183 HN1 NH2 23 HT1 GLY 22 -13.525 8.651 1.837
184 HN2 NH2 23 HT2 GLY 22 -14.535 7.563 2.730
Start of MODEL 10
1 H1 PHE 1 HT1 PHE 1 14.935 -7.789 -3.186
2 H2 PHE 1 HT2 PHE 1 14.052 -8.440 -1.889
3 H3 PHE 1 HT3 PHE 1 15.684 -8.018 -1.681
4 HA PHE 1 HA PHE 1 14.478 -6.297 -0.670
5 HB2 PHE 1 HB2 PHE 1 16.330 -5.681 -2.326
6 HB3 PHE 1 HB1 PHE 1 15.042 -5.289 -3.465
7 HD1 PHE 1 HD1 PHE 1 16.620 -4.383 -0.252
8 HD2 PHE 1 HD2 PHE 1 13.592 -3.370 -3.125
9 HE1 PHE 1 HE1 PHE 1 16.328 -2.172 0.833
10 HE2 PHE 1 HE2 PHE 1 13.302 -1.158 -2.039
11 HZ PHE 1 HZ PHE 1 14.670 -0.559 -0.061
12 H ILE 2 HN ILE 2 13.208 -7.174 -3.853
13 HA ILE 2 HA ILE 2 11.050 -5.476 -4.094
14 HB ILE 2 HB ILE 2 11.757 -7.192 -5.774
15 HG12 ILE 2 HG12 ILE 2 8.833 -7.440 -5.015
16 HG13 ILE 2 HG11 ILE 2 9.510 -6.006 -5.785
17 HG21 ILE 2 HG21 ILE 2 10.133 -9.113 -4.086
18 HG22 ILE 2 HG22 ILE 2 11.894 -9.040 -4.026
19 HG23 ILE 2 HG23 ILE 2 11.082 -9.481 -5.526
20 HD11 ILE 2 HD11 ILE 2 10.365 -7.506 -7.630
21 HD12 ILE 2 HD12 ILE 2 8.608 -7.405 -7.534
22 HD13 ILE 2 HD13 ILE 2 9.446 -8.822 -6.901
23 H HIS 3 HN HIS 3 11.434 -8.243 -1.992
24 HA HIS 3 HA HIS 3 8.847 -8.851 -1.264
25 HB2 HIS 3 HB2 HIS 3 11.260 -8.623 0.552
26 HB3 HIS 3 HB1 HIS 3 9.764 -9.467 0.954
27 HD2 HIS 3 HD2 HIS 3 9.509 -12.019 -0.191
28 HE1 HIS 3 HE1 HIS 3 13.071 -11.918 -2.455
29 HE2 HIS 3 HE2 HIS 3 11.147 -13.390 -1.693
30 H HIS 4 HN HIS 4 10.871 -6.210 0.006
31 HA HIS 4 HA HIS 4 8.920 -5.217 1.831
32 HB2 HIS 4 HB2 HIS 4 11.311 -4.688 2.043
33 HB3 HIS 4 HB1 HIS 4 11.250 -3.792 0.524
34 HD2 HIS 4 HD2 HIS 4 10.572 -1.132 0.863
35 HE1 HIS 4 HE1 HIS 4 8.894 -1.436 4.725
36 HE2 HIS 4 HE2 HIS 4 9.530 0.176 2.868
37 H ILE 5 HN ILE 5 9.931 -4.119 -1.398
38 HA ILE 5 HA ILE 5 8.065 -2.027 -1.666
39 HB ILE 5 HB ILE 5 9.230 -3.746 -3.870
40 HG12 ILE 5 HG12 ILE 5 10.247 -1.145 -2.683
41 HG13 ILE 5 HG11 ILE 5 10.923 -2.734 -2.322
42 HG21 ILE 5 HG21 ILE 5 7.338 -2.339 -4.592
43 HG22 ILE 5 HG22 ILE 5 8.852 -1.728 -5.253
44 HG23 ILE 5 HG23 ILE 5 8.109 -0.926 -3.870
45 HD11 ILE 5 HD11 ILE 5 10.800 -1.404 -5.046
46 HD12 ILE 5 HD12 ILE 5 11.357 -3.054 -4.765
47 HD13 ILE 5 HD13 ILE 5 12.248 -1.693 -4.084
48 H PHE 6 HN PHE 6 7.788 -5.477 -2.214
49 HA PHE 6 HA PHE 6 5.373 -5.459 -3.698
50 HB2 PHE 6 HB2 PHE 6 6.904 -7.419 -3.513
51 HB3 PHE 6 HB1 PHE 6 6.390 -7.620 -1.839
52 HD1 PHE 6 HD1 PHE 6 4.970 -7.279 -5.295
53 HD2 PHE 6 HD2 PHE 6 4.527 -8.960 -1.367
54 HE1 PHE 6 HE1 PHE 6 2.975 -8.540 -6.059
55 HE2 PHE 6 HE2 PHE 6 2.534 -10.221 -2.131
56 HZ PHE 6 HZ PHE 6 1.758 -10.011 -4.477
57 H ARG 7 HN ARG 7 6.061 -5.634 -0.238
58 HA ARG 7 HA ARG 7 3.452 -6.100 0.681
59 HB2 ARG 7 HB2 ARG 7 5.759 -4.623 1.970
60 HB3 ARG 7 HB1 ARG 7 4.264 -5.030 2.813
61 HG2 ARG 7 HG2 ARG 7 5.750 -7.213 1.363
62 HG3 ARG 7 HG1 ARG 7 6.344 -6.680 2.935
63 HD2 ARG 7 HD2 ARG 7 4.196 -7.174 3.969
64 HD3 ARG 7 HD1 ARG 7 3.490 -7.564 2.407
65 HE ARG 7 HE ARG 7 5.666 -9.257 2.693
66 HH11 ARG 7 HH21 ARG 7 2.725 -8.525 4.366
67 HH12 ARG 7 HH22 ARG 7 2.525 -10.126 4.996
68 HH21 ARG 7 HH11 ARG 7 5.408 -11.357 3.518
69 HH22 ARG 7 HH12 ARG 7 4.043 -11.729 4.517
70 H GLY 8 HN GLY 8 5.068 -3.138 -0.300
71 HA2 GLY 8 HA2 GLY 8 3.096 -1.333 0.696
72 HA3 GLY 8 HA1 GLY 8 4.318 -0.970 -0.519
73 H ILE 9 HN ILE 9 3.557 -3.018 -2.371
74 HA ILE 9 HA ILE 9 1.605 -1.641 -3.884
75 HB ILE 9 HB ILE 9 2.510 -4.522 -4.154
76 HG12 ILE 9 HG12 ILE 9 4.249 -2.505 -4.232
77 HG13 ILE 9 HG11 ILE 9 4.317 -3.749 -5.477
78 HG21 ILE 9 HG21 ILE 9 1.886 -3.976 -6.618
79 HG22 ILE 9 HG22 ILE 9 0.955 -2.642 -5.934
80 HG23 ILE 9 HG23 ILE 9 0.566 -4.306 -5.496
81 HD11 ILE 9 HD11 ILE 9 4.345 -1.232 -6.221
82 HD12 ILE 9 HD12 ILE 9 2.620 -1.286 -5.881
83 HD13 ILE 9 HD13 ILE 9 3.309 -2.361 -7.093
84 H VAL 10 HN VAL 10 1.371 -4.724 -2.116
85 HA VAL 10 HA VAL 10 -1.417 -5.064 -2.562
86 HB VAL 10 HB VAL 10 -0.031 -6.967 -1.962
87 HG11 VAL 10 HG11 VAL 10 0.308 -5.705 0.766
88 HG12 VAL 10 HG12 VAL 10 1.514 -5.559 -0.511
89 HG13 VAL 10 HG13 VAL 10 1.106 -7.146 0.138
90 HG21 VAL 10 HG21 VAL 10 -1.842 -6.393 0.396
91 HG22 VAL 10 HG22 VAL 10 -1.459 -7.961 -0.314
92 HG23 VAL 10 HG23 VAL 10 -2.465 -6.814 -1.200
93 H HIS 11 HN HIS 11 0.450 -3.687 0.126
94 HA HIS 11 HA HIS 11 -1.718 -3.215 1.865
95 HB2 HIS 11 HB2 HIS 11 0.634 -3.114 2.585
96 HB3 HIS 11 HB1 HIS 11 0.874 -1.671 1.597
97 HD2 HIS 11 HD2 HIS 11 -1.302 -2.687 4.769
98 HE1 HIS 11 HE1 HIS 11 -0.832 1.507 4.704
99 HE2 HIS 11 HE2 HIS 11 -1.758 -0.448 6.032
100 H ALA 12 HN ALA 12 -0.158 -1.104 -0.547
101 HA ALA 12 HA ALA 12 -1.776 1.161 -0.100
102 HB1 ALA 12 HB1 ALA 12 -0.151 0.214 -2.454
103 HB2 ALA 12 HB2 ALA 12 0.201 1.529 -1.334
104 HB3 ALA 12 HB3 ALA 12 -1.087 1.706 -2.523
105 H GLY 13 HN GLY 13 -2.351 -1.810 -1.773
106 HA2 GLY 13 HA2 GLY 13 -4.476 -0.887 -3.466
107 HA3 GLY 13 HA1 GLY 13 -4.106 -2.565 -3.083
108 H ARG 14 HN ARG 14 -4.352 -2.578 -0.348
109 HA ARG 14 HA ARG 14 -7.134 -2.849 0.027
110 HB2 ARG 14 HB2 ARG 14 -4.850 -2.668 1.996
111 HB3 ARG 14 HB1 ARG 14 -6.515 -2.987 2.481
112 HG2 ARG 14 HG2 ARG 14 -6.583 -4.981 1.072
113 HG3 ARG 14 HG1 ARG 14 -4.958 -4.644 0.475
114 HD2 ARG 14 HD2 ARG 14 -4.829 -6.326 2.233
115 HD3 ARG 14 HD1 ARG 14 -4.097 -4.830 2.804
116 HE ARG 14 HE ARG 14 -6.840 -4.884 3.523
117 HH11 ARG 14 HH21 ARG 14 -3.785 -6.349 4.225
118 HH12 ARG 14 HH22 ARG 14 -4.180 -6.709 5.872
119 HH21 ARG 14 HH11 ARG 14 -7.367 -5.354 5.683
120 HH22 ARG 14 HH12 ARG 14 -6.207 -6.145 6.698
121 H SER 15 HN SER 15 -4.904 -0.218 0.767
122 HA SER 15 HA SER 15 -6.658 1.356 2.327
123 HB2 SER 15 HB2 SER 15 -4.365 1.944 2.389
124 HB3 SER 15 HB1 SER 15 -4.253 2.019 0.632
125 HG SER 15 HG SER 15 -5.213 3.933 0.641
126 H ILE 16 HN ILE 16 -6.011 1.275 -1.153
127 HA ILE 16 HA ILE 16 -7.684 3.444 -1.870
128 HB ILE 16 HB ILE 16 -6.785 1.021 -3.443
129 HG12 ILE 16 HG12 ILE 16 -5.895 3.911 -3.628
130 HG13 ILE 16 HG11 ILE 16 -5.088 2.731 -2.597
131 HG21 ILE 16 HG21 ILE 16 -7.405 2.555 -5.419
132 HG22 ILE 16 HG22 ILE 16 -8.357 3.474 -4.253
133 HG23 ILE 16 HG23 ILE 16 -8.740 1.781 -4.566
134 HD11 ILE 16 HD11 ILE 16 -3.999 2.942 -4.831
135 HD12 ILE 16 HD12 ILE 16 -5.502 2.411 -5.584
136 HD13 ILE 16 HD13 ILE 16 -4.610 1.315 -4.530
137 H GLY 17 HN GLY 17 -8.294 -0.050 -1.652
138 HA2 GLY 17 HA2 GLY 17 -10.980 0.054 -2.578
139 HA3 GLY 17 HA1 GLY 17 -10.250 -1.267 -1.672
140 H ARG 18 HN ARG 18 -9.483 0.359 0.596
141 HA ARG 18 HA ARG 18 -11.815 0.127 2.168
142 HB2 ARG 18 HB2 ARG 18 -9.514 0.034 3.086
143 HB3 ARG 18 HB1 ARG 18 -9.325 1.753 2.741
144 HG2 ARG 18 HG2 ARG 18 -11.209 2.279 4.232
145 HG3 ARG 18 HG1 ARG 18 -11.442 0.561 4.557
146 HD2 ARG 18 HD2 ARG 18 -9.096 0.475 5.438
147 HD3 ARG 18 HD1 ARG 18 -9.003 2.223 5.246
148 HE ARG 18 HE ARG 18 -10.521 0.774 7.272
149 HH11 ARG 18 HH21 ARG 18 -9.931 3.731 5.572
150 HH12 ARG 18 HH22 ARG 18 -10.617 4.737 6.802
151 HH21 ARG 18 HH11 ARG 18 -11.423 2.088 8.890
152 HH22 ARG 18 HH12 ARG 18 -11.462 3.807 8.682
153 H PHE 19 HN PHE 19 -10.270 2.915 0.608
154 HA PHE 19 HA PHE 19 -11.990 4.882 1.723
155 HB2 PHE 19 HB2 PHE 19 -9.749 5.322 0.663
156 HB3 PHE 19 HB1 PHE 19 -10.502 5.033 -0.906
157 HD1 PHE 19 HD1 PHE 19 -10.373 7.270 2.025
158 HD2 PHE 19 HD2 PHE 19 -12.111 6.600 -1.845
159 HE1 PHE 19 HE1 PHE 19 -11.216 9.603 2.000
160 HE2 PHE 19 HE2 PHE 19 -12.953 8.932 -1.871
161 HZ PHE 19 HZ PHE 19 -12.507 10.434 0.051
162 H LEU 20 HN LEU 20 -12.125 2.876 -1.169
163 HA LEU 20 HA LEU 20 -14.112 4.122 -2.620
164 HB2 LEU 20 HB2 LEU 20 -12.906 2.108 -3.401
165 HB3 LEU 20 HB1 LEU 20 -13.780 1.136 -2.220
166 HG LEU 20 HG LEU 20 -15.933 1.803 -3.307
167 HD11 LEU 20 HD11 LEU 20 -14.031 3.396 -5.009
168 HD12 LEU 20 HD12 LEU 20 -15.609 3.859 -4.368
169 HD13 LEU 20 HD13 LEU 20 -15.505 2.773 -5.748
170 HD21 LEU 20 HD21 LEU 20 -14.716 -0.275 -3.985
171 HD22 LEU 20 HD22 LEU 20 -13.928 0.645 -5.267
172 HD23 LEU 20 HD23 LEU 20 -15.676 0.412 -5.295
173 H THR 21 HN THR 21 -14.386 2.171 0.282
174 HA THR 21 HA THR 21 -17.083 1.568 0.347
175 HB THR 21 HB THR 21 -15.538 2.580 2.739
176 HG1 THR 21 HG1 THR 21 -14.446 0.961 1.411
177 HG21 THR 21 HG21 THR 21 -16.975 1.035 3.962
178 HG22 THR 21 HG22 THR 21 -17.708 0.484 2.457
179 HG23 THR 21 HG23 THR 21 -17.975 2.136 3.015
180 H GLY 22 HN GLY 22 -15.565 4.550 1.633
181 HA2 GLY 22 HA2 GLY 22 -16.417 6.651 1.990
182 HA3 GLY 22 HA1 GLY 22 -17.470 6.324 0.617
183 HN1 NH2 23 HT1 GLY 22 -19.402 4.522 3.639
184 HN2 NH2 23 HT2 GLY 22 -18.060 3.855 2.770
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