Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
523751 | 2l5r RC | 17281 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -4.460 -14.665 4.788
2 H2 GLY 1 H2 GLY 1 -4.997 -14.981 3.148
3 HA2 GLY 1 HA2 GLY 1 -2.382 -15.841 4.099
4 HA3 GLY 1 HA3 GLY 1 -2.871 -15.520 2.409
5 H LEU 2 H LEU 2 -0.326 -14.663 3.301
6 HA LEU 2 HA LEU 2 -0.441 -11.947 4.234
7 HB2 LEU 2 HB2 LEU 2 1.923 -11.812 3.775
8 HB3 LEU 2 HB3 LEU 2 1.558 -13.426 4.398
9 HG LEU 2 HG LEU 2 1.355 -13.894 1.639
10 HD11 LEU 2 HD11 LEU 2 3.195 -12.741 0.457
11 HD12 LEU 2 HD12 LEU 2 3.637 -11.851 1.936
12 HD13 LEU 2 HD13 LEU 2 2.099 -11.497 1.106
13 HD21 LEU 2 HD21 LEU 2 3.641 -14.886 1.766
14 HD22 LEU 2 HD22 LEU 2 2.667 -15.289 3.203
15 HD23 LEU 2 HD23 LEU 2 3.930 -14.026 3.308
16 H LYS 3 H LYS 3 -1.066 -13.330 1.002
17 HA LYS 3 HA LYS 3 -0.074 -11.065 -0.434
18 HB2 LYS 3 HB2 LYS 3 -0.579 -13.285 -1.497
19 HB3 LYS 3 HB3 LYS 3 -2.319 -13.009 -1.239
20 HG2 LYS 3 HG2 LYS 3 -1.689 -12.543 -3.556
21 HG3 LYS 3 HG3 LYS 3 -2.255 -11.038 -2.800
22 HD2 LYS 3 HD2 LYS 3 -0.007 -10.151 -2.609
23 HD3 LYS 3 HD3 LYS 3 0.754 -11.725 -2.961
24 HE2 LYS 3 HE2 LYS 3 -0.949 -10.158 -4.996
25 HE3 LYS 3 HE3 LYS 3 0.819 -9.992 -4.839
26 HZ1 LYS 3 HZ1 LYS 3 -0.627 -12.543 -5.640
27 HZ2 LYS 3 HZ2 LYS 3 1.080 -12.414 -5.321
28 HZ3 LYS 3 HZ3 LYS 3 0.353 -11.530 -6.624
29 H GLU 4 H GLU 4 -3.438 -11.901 0.808
30 HA GLU 4 HA GLU 4 -4.646 -9.517 -0.208
31 HB2 GLU 4 HB2 GLU 4 -5.270 -11.120 2.356
32 HB3 GLU 4 HB3 GLU 4 -6.261 -9.752 1.794
33 HG2 GLU 4 HG2 GLU 4 -5.761 -12.306 0.136
34 HG3 GLU 4 HG3 GLU 4 -7.215 -11.978 1.108
35 H ILE 5 H ILE 5 -2.887 -10.184 2.925
36 HA ILE 5 HA ILE 5 -3.508 -7.594 4.007
37 HB ILE 5 HB ILE 5 -1.198 -9.516 4.617
38 HG12 ILE 5 HG12 ILE 5 -3.779 -8.885 6.203
39 HG13 ILE 5 HG13 ILE 5 -3.605 -10.286 5.127
40 HG21 ILE 5 HG21 ILE 5 -0.514 -7.186 5.238
41 HG22 ILE 5 HG22 ILE 5 -2.031 -6.984 6.157
42 HG23 ILE 5 HG23 ILE 5 -0.786 -8.149 6.689
43 HD11 ILE 5 HD11 ILE 5 -3.249 -11.075 7.380
44 HD12 ILE 5 HD12 ILE 5 -1.673 -11.125 6.541
45 HD13 ILE 5 HD13 ILE 5 -2.030 -9.832 7.728
46 H PHE 6 H PHE 6 -0.661 -8.846 2.083
47 HA PHE 6 HA PHE 6 0.755 -6.334 2.283
48 HB2 PHE 6 HB2 PHE 6 0.991 -8.630 0.230
49 HB3 PHE 6 HB3 PHE 6 1.939 -7.128 0.164
50 HD1 PHE 6 HD2 PHE 6 1.288 -8.453 3.595
51 HD2 PHE 6 HD1 PHE 6 3.894 -8.635 0.167
52 HE1 PHE 6 HE2 PHE 6 3.066 -9.403 4.990
53 HE2 PHE 6 HE1 PHE 6 5.693 -9.540 1.593
54 HZ PHE 6 HZ PHE 6 5.286 -9.931 4.013
55 H LYS 7 H LYS 7 -1.206 -7.799 -0.451
56 HA LYS 7 HA LYS 7 -0.721 -5.592 -2.115
57 HB2 LYS 7 HB2 LYS 7 -1.666 -7.887 -2.837
58 HB3 LYS 7 HB3 LYS 7 -3.229 -7.374 -2.169
59 HG2 LYS 7 HG2 LYS 7 -3.373 -6.995 -4.514
60 HG3 LYS 7 HG3 LYS 7 -3.105 -5.363 -3.849
61 HD2 LYS 7 HD2 LYS 7 -0.612 -5.625 -4.432
62 HD3 LYS 7 HD3 LYS 7 -0.981 -7.215 -5.141
63 HE2 LYS 7 HE2 LYS 7 -2.069 -4.489 -6.092
64 HE3 LYS 7 HE3 LYS 7 -0.759 -5.429 -6.850
65 HZ1 LYS 7 HZ1 LYS 7 -3.694 -6.195 -6.731
66 HZ2 LYS 7 HZ2 LYS 7 -2.423 -7.281 -7.252
67 HZ3 LYS 7 HZ3 LYS 7 -2.751 -5.811 -8.117
68 H ALA 8 H ALA 8 -3.630 -6.257 0.028
69 HA ALA 8 HA ALA 8 -4.891 -3.777 -0.779
70 HB1 ALA 8 HB1 ALA 8 -5.399 -5.439 1.768
71 HB2 ALA 8 HB2 ALA 8 -6.447 -4.151 1.114
72 HB3 ALA 8 HB3 ALA 8 -6.210 -5.665 0.191
73 H GLY 9 H GLY 9 -2.945 -4.779 2.171
74 HA2 GLY 9 HA2 GLY 9 -3.321 -2.374 3.595
75 HA3 GLY 9 HA3 GLY 9 -1.879 -3.404 3.760
76 H LEU 10 H LEU 10 -0.365 -3.263 1.575
77 HA LEU 10 HA LEU 10 0.581 -0.575 1.734
78 HB2 LEU 10 HB2 LEU 10 2.336 -1.128 0.239
79 HB3 LEU 10 HB3 LEU 10 1.997 -2.562 1.220
80 HG LEU 10 HG LEU 10 0.453 -3.218 -0.942
81 HD11 LEU 10 HD11 LEU 10 2.628 -1.446 -2.220
82 HD12 LEU 10 HD12 LEU 10 0.897 -1.036 -2.193
83 HD13 LEU 10 HD13 LEU 10 1.449 -2.471 -3.083
84 HD21 LEU 10 HD21 LEU 10 2.388 -4.492 -1.873
85 HD22 LEU 10 HD22 LEU 10 2.356 -4.583 -0.095
86 HD23 LEU 10 HD23 LEU 10 3.516 -3.494 -0.908
87 H GLY 11 H GLY 11 -1.710 -2.199 -0.572
88 HA2 GLY 11 HA2 GLY 11 -1.555 -0.285 -2.644
89 HA3 GLY 11 HA3 GLY 11 -3.037 -1.177 -2.224
90 H SER 12 H SER 12 -3.536 -0.223 0.439
91 HA SER 12 HA SER 12 -4.738 2.338 -0.304
92 HB2 SER 12 HB2 SER 12 -5.923 0.772 1.212
93 HB3 SER 12 HB3 SER 12 -4.616 0.918 2.418
94 HG SER 12 HG SER 12 -6.255 3.119 1.560
95 H LEU 13 H LEU 13 -2.097 1.268 2.016
96 HA LEU 13 HA LEU 13 -1.841 3.934 3.089
97 HB2 LEU 13 HB2 LEU 13 0.170 1.618 3.076
98 HB3 LEU 13 HB3 LEU 13 0.373 3.108 4.021
99 HG LEU 13 HG LEU 13 -1.981 1.146 4.421
100 HD11 LEU 13 HD11 LEU 13 -0.757 0.391 6.465
101 HD12 LEU 13 HD12 LEU 13 0.617 1.453 6.041
102 HD13 LEU 13 HD13 LEU 13 0.197 0.062 4.998
103 HD21 LEU 13 HD21 LEU 13 -1.019 3.557 6.088
104 HD22 LEU 13 HD22 LEU 13 -2.252 2.380 6.617
105 HD23 LEU 13 HD23 LEU 13 -2.580 3.426 5.227
106 H VAL 14 H VAL 14 0.033 2.162 0.480
107 HA VAL 14 HA VAL 14 2.049 4.075 0.306
108 HB VAL 14 HB VAL 14 1.978 1.908 -1.024
109 HG11 VAL 14 HG11 VAL 14 -0.338 2.257 -2.094
110 HG12 VAL 14 HG12 VAL 14 0.370 3.534 -3.110
111 HG13 VAL 14 HG13 VAL 14 0.943 1.853 -3.259
112 HG21 VAL 14 HG21 VAL 14 2.711 4.436 -2.627
113 HG22 VAL 14 HG22 VAL 14 3.750 3.637 -1.414
114 HG23 VAL 14 HG23 VAL 14 3.326 2.789 -2.923
115 H LYS 15 H LYS 15 -1.328 4.256 -1.061
116 HA LYS 15 HA LYS 15 -0.712 6.638 -2.582
117 HB2 LYS 15 HB2 LYS 15 -3.398 5.697 -1.438
118 HB3 LYS 15 HB3 LYS 15 -3.188 7.077 -2.559
119 HG2 LYS 15 HG2 LYS 15 -2.126 5.493 -4.239
120 HG3 LYS 15 HG3 LYS 15 -2.508 4.129 -3.165
121 HD2 LYS 15 HD2 LYS 15 -4.529 6.009 -4.560
122 HD3 LYS 15 HD3 LYS 15 -4.136 4.329 -4.982
123 HE2 LYS 15 HE2 LYS 15 -6.066 3.889 -3.779
124 HE3 LYS 15 HE3 LYS 15 -4.932 3.869 -2.414
125 HZ1 LYS 15 HZ1 LYS 15 -6.922 5.202 -1.914
126 HZ2 LYS 15 HZ2 LYS 15 -6.705 6.172 -3.336
127 HZ3 LYS 15 HZ3 LYS 15 -5.603 6.314 -2.013
128 H GLY 16 H GLY 16 -2.291 6.174 0.726
129 HA2 GLY 16 HA2 GLY 16 -2.541 8.933 1.237
130 HA3 GLY 16 HA3 GLY 16 -2.337 7.703 2.509
131 H ILE 17 H ILE 17 0.372 6.790 1.636
132 HA ILE 17 HA ILE 17 1.765 8.939 3.130
133 HB ILE 17 HB ILE 17 2.710 6.172 2.213
134 HG12 ILE 17 HG12 ILE 17 1.904 7.214 5.004
135 HG13 ILE 17 HG13 ILE 17 0.878 6.201 3.964
136 HG21 ILE 17 HG21 ILE 17 4.109 8.209 4.051
137 HG22 ILE 17 HG22 ILE 17 4.719 6.583 3.630
138 HG23 ILE 17 HG23 ILE 17 4.613 7.827 2.381
139 HD11 ILE 17 HD11 ILE 17 2.667 4.386 4.012
140 HD12 ILE 17 HD12 ILE 17 3.540 5.344 5.247
141 HD13 ILE 17 HD13 ILE 17 1.908 4.734 5.591
142 H ALA 18 H ALA 18 2.415 7.081 0.010
143 HA ALA 18 HA ALA 18 4.546 8.780 -0.675
144 HB1 ALA 18 HB1 ALA 18 4.415 7.867 -2.959
145 HB2 ALA 18 HB2 ALA 18 4.132 6.551 -1.787
146 HB3 ALA 18 HB3 ALA 18 2.755 7.273 -2.680
147 H ALA 19 H ALA 19 0.974 9.146 -1.405
148 HA ALA 19 HA ALA 19 1.008 10.946 -3.427
149 HB1 ALA 19 HB1 ALA 19 -0.932 12.183 -2.326
150 HB2 ALA 19 HB2 ALA 19 -1.135 10.413 -2.329
151 HB3 ALA 19 HB3 ALA 19 -0.625 11.251 -0.828
152 H HIS 20 H HIS 20 1.826 11.828 0.051
153 HA HIS 20 HA HIS 20 2.005 14.597 -0.493
154 HB2 HIS 20 HB2 HIS 20 2.109 13.537 1.817
155 HB3 HIS 20 HB3 HIS 20 3.816 13.118 1.518
156 HD1 HIS 20 HD2 HIS 20 5.312 15.344 0.825
157 HD2 HIS 20 HD3 HIS 20 1.628 15.955 2.758
158 HE1 HIS 20 HE2 HIS 20 5.396 17.705 1.731
159 H VAL 21 H VAL 21 4.602 12.008 -0.662
160 HA VAL 21 HA VAL 21 6.486 13.949 -1.807
161 HB VAL 21 HB VAL 21 6.677 10.906 -1.471
162 HG11 VAL 21 HG11 VAL 21 8.787 12.911 -2.486
163 HG12 VAL 21 HG12 VAL 21 9.094 11.200 -2.069
164 HG13 VAL 21 HG13 VAL 21 8.040 11.601 -3.446
165 HG21 VAL 21 HG21 VAL 21 6.703 12.236 0.666
166 HG22 VAL 21 HG22 VAL 21 8.283 11.481 0.325
167 HG23 VAL 21 HG23 VAL 21 8.046 13.226 0.026
168 H ALA 22 H ALA 22 5.105 10.832 -3.233
169 HA ALA 22 HA ALA 22 5.591 11.966 -5.913
170 HB1 ALA 22 HB1 ALA 22 4.357 9.280 -5.068
171 HB2 ALA 22 HB2 ALA 22 4.831 9.757 -6.724
172 HB3 ALA 22 HB3 ALA 22 6.078 9.565 -5.455
173 H SER 23 H SER 23 4.019 13.876 -5.320
174 HA SER 23 HA SER 23 1.171 13.188 -5.253
175 HB2 SER 23 HB2 SER 23 2.045 15.362 -4.341
176 HB3 SER 23 HB3 SER 23 2.538 15.846 -5.986
177 HG SER 23 HG SER 23 -0.180 15.313 -5.206
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -3.201 -15.602 1.992
2 H2 GLY 1 H2 GLY 1 -2.048 -15.641 1.212
3 HA2 GLY 1 HA2 GLY 1 -2.189 -16.674 4.019
4 HA3 GLY 1 HA3 GLY 1 -0.743 -16.956 3.016
5 H LEU 2 H LEU 2 0.210 -14.877 1.911
6 HA LEU 2 HA LEU 2 -0.232 -12.452 3.659
7 HB2 LEU 2 HB2 LEU 2 2.517 -13.420 2.680
8 HB3 LEU 2 HB3 LEU 2 2.130 -11.960 3.620
9 HG LEU 2 HG LEU 2 1.178 -13.648 5.438
10 HD11 LEU 2 HD11 LEU 2 3.138 -15.511 3.935
11 HD12 LEU 2 HD12 LEU 2 1.383 -15.781 4.055
12 HD13 LEU 2 HD13 LEU 2 2.382 -15.846 5.517
13 HD21 LEU 2 HD21 LEU 2 3.171 -12.198 5.804
14 HD22 LEU 2 HD22 LEU 2 4.205 -13.358 4.919
15 HD23 LEU 2 HD23 LEU 2 3.466 -13.818 6.480
16 H LYS 3 H LYS 3 -1.622 -12.950 1.239
17 HA LYS 3 HA LYS 3 -0.244 -10.928 -0.530
18 HB2 LYS 3 HB2 LYS 3 -2.077 -13.224 -1.170
19 HB3 LYS 3 HB3 LYS 3 -2.543 -11.681 -1.899
20 HG2 LYS 3 HG2 LYS 3 -0.117 -11.451 -2.799
21 HG3 LYS 3 HG3 LYS 3 0.128 -13.124 -2.237
22 HD2 LYS 3 HD2 LYS 3 -0.392 -13.236 -4.589
23 HD3 LYS 3 HD3 LYS 3 -1.877 -13.776 -3.763
24 HE2 LYS 3 HE2 LYS 3 -2.891 -11.471 -4.155
25 HE3 LYS 3 HE3 LYS 3 -1.353 -10.927 -4.872
26 HZ1 LYS 3 HZ1 LYS 3 -3.139 -13.131 -5.946
27 HZ2 LYS 3 HZ2 LYS 3 -1.649 -12.584 -6.678
28 HZ3 LYS 3 HZ3 LYS 3 -3.018 -11.515 -6.573
29 H GLU 4 H GLU 4 -3.648 -11.742 0.649
30 HA GLU 4 HA GLU 4 -4.663 -9.243 -0.111
31 HB2 GLU 4 HB2 GLU 4 -5.443 -10.921 2.353
32 HB3 GLU 4 HB3 GLU 4 -6.333 -9.475 1.804
33 HG2 GLU 4 HG2 GLU 4 -6.788 -10.557 -0.414
34 HG3 GLU 4 HG3 GLU 4 -5.959 -12.039 0.120
35 H ILE 5 H ILE 5 -3.001 -10.125 3.041
36 HA ILE 5 HA ILE 5 -3.377 -7.471 4.107
37 HB ILE 5 HB ILE 5 -1.292 -9.613 4.795
38 HG12 ILE 5 HG12 ILE 5 -3.832 -8.696 6.307
39 HG13 ILE 5 HG13 ILE 5 -3.769 -10.121 5.248
40 HG21 ILE 5 HG21 ILE 5 -0.396 -7.342 5.372
41 HG22 ILE 5 HG22 ILE 5 -1.900 -6.973 6.261
42 HG23 ILE 5 HG23 ILE 5 -0.786 -8.248 6.835
43 HD11 ILE 5 HD11 ILE 5 -1.962 -11.123 6.724
44 HD12 ILE 5 HD12 ILE 5 -2.209 -9.776 7.880
45 HD13 ILE 5 HD13 ILE 5 -3.541 -10.897 7.529
46 H PHE 6 H PHE 6 -0.510 -9.046 2.433
47 HA PHE 6 HA PHE 6 1.104 -6.720 2.578
48 HB2 PHE 6 HB2 PHE 6 2.098 -8.860 1.964
49 HB3 PHE 6 HB3 PHE 6 1.063 -9.018 0.539
50 HD1 PHE 6 HD2 PHE 6 3.863 -6.996 1.993
51 HD2 PHE 6 HD1 PHE 6 1.608 -7.907 -1.558
52 HE1 PHE 6 HE2 PHE 6 5.612 -5.928 0.601
53 HE2 PHE 6 HE1 PHE 6 3.357 -6.848 -2.942
54 HZ PHE 6 HZ PHE 6 5.373 -5.871 -1.870
55 H LYS 7 H LYS 7 -0.907 -7.850 -0.274
56 HA LYS 7 HA LYS 7 -0.100 -5.552 -1.784
57 HB2 LYS 7 HB2 LYS 7 -0.814 -7.767 -2.752
58 HB3 LYS 7 HB3 LYS 7 -2.501 -7.408 -2.300
59 HG2 LYS 7 HG2 LYS 7 -2.414 -5.346 -3.768
60 HG3 LYS 7 HG3 LYS 7 -0.724 -5.740 -4.200
61 HD2 LYS 7 HD2 LYS 7 -1.572 -8.009 -5.087
62 HD3 LYS 7 HD3 LYS 7 -3.235 -7.414 -4.844
63 HE2 LYS 7 HE2 LYS 7 -1.083 -6.199 -6.702
64 HE3 LYS 7 HE3 LYS 7 -2.490 -7.168 -7.205
65 HZ1 LYS 7 HZ1 LYS 7 -3.975 -5.377 -6.266
66 HZ2 LYS 7 HZ2 LYS 7 -2.977 -4.845 -7.589
67 HZ3 LYS 7 HZ3 LYS 7 -2.556 -4.388 -5.982
68 H ALA 8 H ALA 8 -3.296 -6.361 -0.088
69 HA ALA 8 HA ALA 8 -4.454 -3.878 -0.996
70 HB1 ALA 8 HB1 ALA 8 -5.327 -5.462 1.496
71 HB2 ALA 8 HB2 ALA 8 -6.268 -4.248 0.600
72 HB3 ALA 8 HB3 ALA 8 -5.867 -5.809 -0.175
73 H GLY 9 H GLY 9 -2.834 -4.902 2.129
74 HA2 GLY 9 HA2 GLY 9 -3.340 -2.537 3.565
75 HA3 GLY 9 HA3 GLY 9 -1.881 -3.533 3.791
76 H LEU 10 H LEU 10 -0.284 -3.303 1.638
77 HA LEU 10 HA LEU 10 0.597 -0.598 1.913
78 HB2 LEU 10 HB2 LEU 10 2.405 -1.057 0.450
79 HB3 LEU 10 HB3 LEU 10 2.080 -2.536 1.370
80 HG LEU 10 HG LEU 10 0.630 -3.191 -0.817
81 HD11 LEU 10 HD11 LEU 10 0.948 -0.934 -2.016
82 HD12 LEU 10 HD12 LEU 10 1.589 -2.304 -2.940
83 HD13 LEU 10 HD13 LEU 10 2.697 -1.239 -2.033
84 HD21 LEU 10 HD21 LEU 10 2.647 -4.270 -1.817
85 HD22 LEU 10 HD22 LEU 10 2.612 -4.460 -0.044
86 HD23 LEU 10 HD23 LEU 10 3.706 -3.260 -0.788
87 H GLY 11 H GLY 11 -1.592 -2.198 -0.496
88 HA2 GLY 11 HA2 GLY 11 -1.457 -0.203 -2.498
89 HA3 GLY 11 HA3 GLY 11 -2.910 -1.167 -2.138
90 H SER 12 H SER 12 -3.486 -0.314 0.543
91 HA SER 12 HA SER 12 -4.783 2.213 -0.140
92 HB2 SER 12 HB2 SER 12 -5.881 0.544 1.344
93 HB3 SER 12 HB3 SER 12 -4.591 0.762 2.569
94 HG SER 12 HG SER 12 -6.453 2.197 2.970
95 H LEU 13 H LEU 13 -2.049 1.209 2.087
96 HA LEU 13 HA LEU 13 -1.900 3.868 3.228
97 HB2 LEU 13 HB2 LEU 13 0.199 1.632 3.155
98 HB3 LEU 13 HB3 LEU 13 0.332 3.103 4.143
99 HG LEU 13 HG LEU 13 -1.941 1.037 4.485
100 HD11 LEU 13 HD11 LEU 13 0.646 1.390 6.115
101 HD12 LEU 13 HD12 LEU 13 0.273 0.022 5.023
102 HD13 LEU 13 HD13 LEU 13 -0.694 0.269 6.499
103 HD21 LEU 13 HD21 LEU 13 -1.073 3.430 6.226
104 HD22 LEU 13 HD22 LEU 13 -2.262 2.189 6.709
105 HD23 LEU 13 HD23 LEU 13 -2.623 3.265 5.349
106 H VAL 14 H VAL 14 -0.056 2.224 0.531
107 HA VAL 14 HA VAL 14 1.919 4.188 0.388
108 HB VAL 14 HB VAL 14 1.938 2.038 -0.935
109 HG11 VAL 14 HG11 VAL 14 0.227 3.580 -2.999
110 HG12 VAL 14 HG12 VAL 14 0.907 1.938 -3.176
111 HG13 VAL 14 HG13 VAL 14 -0.376 2.246 -1.982
112 HG21 VAL 14 HG21 VAL 14 2.544 4.579 -2.566
113 HG22 VAL 14 HG22 VAL 14 3.620 3.848 -1.339
114 HG23 VAL 14 HG23 VAL 14 3.240 2.959 -2.837
115 H LYS 15 H LYS 15 -1.462 4.292 -1.047
116 HA LYS 15 HA LYS 15 -1.032 6.826 -2.311
117 HB2 LYS 15 HB2 LYS 15 -3.546 5.587 -1.053
118 HB3 LYS 15 HB3 LYS 15 -3.569 7.249 -1.664
119 HG2 LYS 15 HG2 LYS 15 -2.840 4.817 -3.408
120 HG3 LYS 15 HG3 LYS 15 -4.463 5.530 -3.248
121 HD2 LYS 15 HD2 LYS 15 -3.417 7.804 -4.018
122 HD3 LYS 15 HD3 LYS 15 -1.968 6.865 -4.449
123 HE2 LYS 15 HE2 LYS 15 -3.229 7.141 -6.456
124 HE3 LYS 15 HE3 LYS 15 -3.429 5.434 -5.982
125 HZ1 LYS 15 HZ1 LYS 15 -5.522 6.551 -6.774
126 HZ2 LYS 15 HZ2 LYS 15 -5.445 7.656 -5.440
127 HZ3 LYS 15 HZ3 LYS 15 -5.712 5.951 -5.176
128 H GLY 16 H GLY 16 -2.372 6.122 1.051
129 HA2 GLY 16 HA2 GLY 16 -2.573 8.815 1.778
130 HA3 GLY 16 HA3 GLY 16 -2.255 7.505 2.944
131 H ILE 17 H ILE 17 0.417 6.764 1.716
132 HA ILE 17 HA ILE 17 1.865 8.870 3.268
133 HB ILE 17 HB ILE 17 2.746 6.088 2.345
134 HG12 ILE 17 HG12 ILE 17 1.949 7.135 5.137
135 HG13 ILE 17 HG13 ILE 17 0.921 6.127 4.094
136 HG21 ILE 17 HG21 ILE 17 4.656 7.738 2.505
137 HG22 ILE 17 HG22 ILE 17 4.173 8.105 4.186
138 HG23 ILE 17 HG23 ILE 17 4.762 6.476 3.740
139 HD11 ILE 17 HD11 ILE 17 3.581 5.260 5.376
140 HD12 ILE 17 HD12 ILE 17 1.945 4.662 5.726
141 HD13 ILE 17 HD13 ILE 17 2.698 4.303 4.146
142 H ALA 18 H ALA 18 2.454 6.980 0.144
143 HA ALA 18 HA ALA 18 4.552 8.712 -0.584
144 HB1 ALA 18 HB1 ALA 18 2.776 7.126 -2.534
145 HB2 ALA 18 HB2 ALA 18 4.406 7.776 -2.858
146 HB3 ALA 18 HB3 ALA 18 4.198 6.468 -1.659
147 H ALA 19 H ALA 19 0.960 8.948 -1.344
148 HA ALA 19 HA ALA 19 0.979 10.707 -3.404
149 HB1 ALA 19 HB1 ALA 19 -1.162 10.101 -2.315
150 HB2 ALA 19 HB2 ALA 19 -0.724 11.050 -0.856
151 HB3 ALA 19 HB3 ALA 19 -1.036 11.878 -2.411
152 H HIS 20 H HIS 20 1.718 11.666 0.066
153 HA HIS 20 HA HIS 20 1.811 14.433 -0.541
154 HB2 HIS 20 HB2 HIS 20 1.894 13.374 1.824
155 HB3 HIS 20 HB3 HIS 20 3.635 13.105 1.552
156 HD1 HIS 20 HD2 HIS 20 1.032 15.853 1.564
157 HD2 HIS 20 HD3 HIS 20 5.182 15.325 1.982
158 HE1 HIS 20 HE2 HIS 20 1.932 18.108 2.245
159 H VAL 21 H VAL 21 4.481 11.917 -0.534
160 HA VAL 21 HA VAL 21 6.397 13.863 -1.585
161 HB VAL 21 HB VAL 21 6.566 10.808 -1.326
162 HG11 VAL 21 HG11 VAL 21 9.001 11.104 -1.831
163 HG12 VAL 21 HG12 VAL 21 7.995 11.544 -3.232
164 HG13 VAL 21 HG13 VAL 21 8.721 12.827 -2.218
165 HG21 VAL 21 HG21 VAL 21 8.114 11.322 0.533
166 HG22 VAL 21 HG22 VAL 21 7.901 13.077 0.276
167 HG23 VAL 21 HG23 VAL 21 6.529 12.080 0.841
168 H ALA 22 H ALA 22 5.012 10.805 -3.116
169 HA ALA 22 HA ALA 22 5.634 11.920 -5.765
170 HB1 ALA 22 HB1 ALA 22 4.723 9.776 -6.610
171 HB2 ALA 22 HB2 ALA 22 5.920 9.490 -5.311
172 HB3 ALA 22 HB3 ALA 22 4.173 9.333 -4.967
173 H SER 23 H SER 23 4.193 13.938 -5.167
174 HA SER 23 HA SER 23 1.285 13.425 -5.291
175 HB2 SER 23 HB2 SER 23 2.240 15.405 -4.080
176 HB3 SER 23 HB3 SER 23 2.828 16.065 -5.631
177 HG SER 23 HG SER 23 0.521 16.099 -6.278
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -3.864 -16.078 3.848
2 H2 GLY 1 H2 GLY 1 -3.676 -14.368 4.009
3 HA2 GLY 1 HA2 GLY 1 -1.387 -16.166 3.543
4 HA3 GLY 1 HA3 GLY 1 -2.208 -15.559 2.068
5 H LEU 2 H LEU 2 0.188 -14.688 1.932
6 HA LEU 2 HA LEU 2 0.405 -12.022 3.374
7 HB2 LEU 2 HB2 LEU 2 2.451 -13.800 1.940
8 HB3 LEU 2 HB3 LEU 2 2.832 -12.237 2.676
9 HG LEU 2 HG LEU 2 1.459 -14.271 4.492
10 HD11 LEU 2 HD11 LEU 2 4.393 -14.607 3.643
11 HD12 LEU 2 HD12 LEU 2 3.051 -15.748 3.321
12 HD13 LEU 2 HD13 LEU 2 3.586 -15.458 4.997
13 HD21 LEU 2 HD21 LEU 2 2.966 -13.294 6.196
14 HD22 LEU 2 HD22 LEU 2 2.146 -11.977 5.311
15 HD23 LEU 2 HD23 LEU 2 3.851 -12.377 4.946
16 H LYS 3 H LYS 3 -1.573 -11.953 1.539
17 HA LYS 3 HA LYS 3 -0.302 -10.499 -0.711
18 HB2 LYS 3 HB2 LYS 3 -0.540 -13.003 -1.303
19 HB3 LYS 3 HB3 LYS 3 -2.300 -12.747 -1.321
20 HG2 LYS 3 HG2 LYS 3 -1.951 -10.910 -3.073
21 HG3 LYS 3 HG3 LYS 3 -0.199 -11.246 -3.008
22 HD2 LYS 3 HD2 LYS 3 -0.679 -13.655 -3.728
23 HD3 LYS 3 HD3 LYS 3 -2.400 -13.213 -3.880
24 HE2 LYS 3 HE2 LYS 3 -1.427 -13.168 -6.088
25 HE3 LYS 3 HE3 LYS 3 -1.759 -11.477 -5.631
26 HZ1 LYS 3 HZ1 LYS 3 0.641 -11.126 -5.196
27 HZ2 LYS 3 HZ2 LYS 3 0.455 -11.833 -6.750
28 HZ3 LYS 3 HZ3 LYS 3 0.965 -12.827 -5.424
29 H GLU 4 H GLU 4 -3.648 -11.720 0.352
30 HA GLU 4 HA GLU 4 -4.967 -9.295 -0.282
31 HB2 GLU 4 HB2 GLU 4 -5.351 -11.144 2.166
32 HB3 GLU 4 HB3 GLU 4 -6.405 -9.749 1.834
33 HG2 GLU 4 HG2 GLU 4 -6.025 -12.103 -0.117
34 HG3 GLU 4 HG3 GLU 4 -7.383 -11.924 1.021
35 H ILE 5 H ILE 5 -3.018 -10.211 2.686
36 HA ILE 5 HA ILE 5 -3.482 -7.671 3.954
37 HB ILE 5 HB ILE 5 -1.075 -9.550 4.282
38 HG12 ILE 5 HG12 ILE 5 -3.042 -10.844 4.910
39 HG13 ILE 5 HG13 ILE 5 -2.211 -10.336 6.383
40 HG21 ILE 5 HG21 ILE 5 -2.013 -7.186 6.020
41 HG22 ILE 5 HG22 ILE 5 -0.775 -8.373 6.512
42 HG23 ILE 5 HG23 ILE 5 -0.488 -7.322 5.114
43 HD11 ILE 5 HD11 ILE 5 -4.814 -9.137 5.235
44 HD12 ILE 5 HD12 ILE 5 -4.625 -10.118 6.703
45 HD13 ILE 5 HD13 ILE 5 -3.954 -8.470 6.658
46 H PHE 6 H PHE 6 -0.807 -8.829 1.720
47 HA PHE 6 HA PHE 6 0.635 -6.349 2.035
48 HB2 PHE 6 HB2 PHE 6 0.718 -8.370 -0.273
49 HB3 PHE 6 HB3 PHE 6 1.730 -6.921 -0.146
50 HD1 PHE 6 HD1 PHE 6 1.245 -8.423 3.181
51 HD2 PHE 6 HD2 PHE 6 3.456 -8.773 -0.504
52 HE1 PHE 6 HE1 PHE 6 3.033 -9.605 4.361
53 HE2 PHE 6 HE2 PHE 6 5.253 -9.963 0.702
54 HZ PHE 6 HZ PHE 6 5.059 -10.364 3.146
55 H LYS 7 H LYS 7 -1.419 -7.425 -0.845
56 HA LYS 7 HA LYS 7 -1.284 -4.854 -1.993
57 HB2 LYS 7 HB2 LYS 7 -3.375 -7.080 -2.255
58 HB3 LYS 7 HB3 LYS 7 -3.568 -5.561 -3.148
59 HG2 LYS 7 HG2 LYS 7 -0.988 -7.212 -3.394
60 HG3 LYS 7 HG3 LYS 7 -2.416 -7.508 -4.418
61 HD2 LYS 7 HD2 LYS 7 -2.371 -5.185 -5.285
62 HD3 LYS 7 HD3 LYS 7 -0.959 -4.787 -4.278
63 HE2 LYS 7 HE2 LYS 7 0.407 -6.502 -5.466
64 HE3 LYS 7 HE3 LYS 7 -0.998 -6.935 -6.479
65 HZ1 LYS 7 HZ1 LYS 7 -1.045 -4.629 -7.372
66 HZ2 LYS 7 HZ2 LYS 7 0.509 -5.366 -7.643
67 HZ3 LYS 7 HZ3 LYS 7 0.317 -4.193 -6.377
68 H ALA 8 H ALA 8 -3.906 -6.143 0.255
69 HA ALA 8 HA ALA 8 -5.455 -3.767 0.016
70 HB1 ALA 8 HB1 ALA 8 -6.328 -5.803 1.187
71 HB2 ALA 8 HB2 ALA 8 -5.194 -5.517 2.542
72 HB3 ALA 8 HB3 ALA 8 -6.484 -4.336 2.195
73 H GLY 9 H GLY 9 -2.779 -4.650 2.357
74 HA2 GLY 9 HA2 GLY 9 -3.004 -2.204 3.839
75 HA3 GLY 9 HA3 GLY 9 -1.578 -3.262 3.816
76 H LEU 10 H LEU 10 -0.239 -3.163 1.596
77 HA LEU 10 HA LEU 10 0.679 -0.480 1.594
78 HB2 LEU 10 HB2 LEU 10 2.321 -1.055 -0.031
79 HB3 LEU 10 HB3 LEU 10 2.092 -2.441 1.047
80 HG LEU 10 HG LEU 10 0.387 -3.240 -0.908
81 HD11 LEU 10 HD11 LEU 10 2.432 -1.556 -2.489
82 HD12 LEU 10 HD12 LEU 10 0.704 -1.157 -2.345
83 HD13 LEU 10 HD13 LEU 10 1.198 -2.649 -3.176
84 HD21 LEU 10 HD21 LEU 10 2.374 -4.518 -0.128
85 HD22 LEU 10 HD22 LEU 10 3.447 -3.497 -1.128
86 HD23 LEU 10 HD23 LEU 10 2.244 -4.573 -1.905
87 H GLY 11 H GLY 11 -1.755 -2.089 -0.571
88 HA2 GLY 11 HA2 GLY 11 -1.639 -0.128 -2.634
89 HA3 GLY 11 HA3 GLY 11 -3.094 -1.061 -2.213
90 H SER 12 H SER 12 -3.573 -0.215 0.478
91 HA SER 12 HA SER 12 -4.817 2.353 -0.129
92 HB2 SER 12 HB2 SER 12 -5.906 0.723 1.412
93 HB3 SER 12 HB3 SER 12 -4.541 0.863 2.551
94 HG SER 12 HG SER 12 -6.261 3.053 1.841
95 H LEU 13 H LEU 13 -2.048 1.260 2.009
96 HA LEU 13 HA LEU 13 -1.766 3.902 3.151
97 HB2 LEU 13 HB2 LEU 13 0.247 1.594 2.999
98 HB3 LEU 13 HB3 LEU 13 0.472 3.056 3.983
99 HG LEU 13 HG LEU 13 -1.859 1.074 4.400
100 HD11 LEU 13 HD11 LEU 13 -0.559 0.247 6.366
101 HD12 LEU 13 HD12 LEU 13 0.806 1.315 5.925
102 HD13 LEU 13 HD13 LEU 13 0.332 -0.033 4.849
103 HD21 LEU 13 HD21 LEU 13 -2.045 2.226 6.642
104 HD22 LEU 13 HD22 LEU 13 -2.412 3.328 5.305
105 HD23 LEU 13 HD23 LEU 13 -0.823 3.419 6.121
106 H VAL 14 H VAL 14 -0.026 2.200 0.402
107 HA VAL 14 HA VAL 14 2.021 4.081 0.216
108 HB VAL 14 HB VAL 14 1.874 1.978 -1.188
109 HG11 VAL 14 HG11 VAL 14 -0.474 2.383 -2.135
110 HG12 VAL 14 HG12 VAL 14 0.196 3.692 -3.138
111 HG13 VAL 14 HG13 VAL 14 0.746 2.012 -3.376
112 HG21 VAL 14 HG21 VAL 14 3.636 3.717 -1.590
113 HG22 VAL 14 HG22 VAL 14 3.144 2.922 -3.107
114 HG23 VAL 14 HG23 VAL 14 2.557 4.563 -2.734
115 H LYS 15 H LYS 15 -1.400 4.375 -1.040
116 HA LYS 15 HA LYS 15 -0.777 6.864 -2.390
117 HB2 LYS 15 HB2 LYS 15 -3.474 5.891 -1.291
118 HB3 LYS 15 HB3 LYS 15 -3.225 7.323 -2.328
119 HG2 LYS 15 HG2 LYS 15 -2.174 5.785 -4.090
120 HG3 LYS 15 HG3 LYS 15 -2.664 4.385 -3.106
121 HD2 LYS 15 HD2 LYS 15 -4.545 6.498 -4.355
122 HD3 LYS 15 HD3 LYS 15 -4.253 4.852 -4.971
123 HE2 LYS 15 HE2 LYS 15 -5.193 3.904 -2.809
124 HE3 LYS 15 HE3 LYS 15 -5.608 5.565 -2.293
125 HZ1 LYS 15 HZ1 LYS 15 -7.541 4.479 -3.306
126 HZ2 LYS 15 HZ2 LYS 15 -6.664 4.187 -4.777
127 HZ3 LYS 15 HZ3 LYS 15 -7.031 5.822 -4.288
128 H GLY 16 H GLY 16 -2.281 6.117 0.896
129 HA2 GLY 16 HA2 GLY 16 -2.513 8.784 1.710
130 HA3 GLY 16 HA3 GLY 16 -2.187 7.439 2.834
131 H ILE 17 H ILE 17 0.484 6.747 1.621
132 HA ILE 17 HA ILE 17 1.936 8.831 3.190
133 HB ILE 17 HB ILE 17 2.833 6.087 2.163
134 HG12 ILE 17 HG12 ILE 17 2.129 7.042 5.010
135 HG13 ILE 17 HG13 ILE 17 1.063 6.066 3.974
136 HG21 ILE 17 HG21 ILE 17 4.731 7.749 2.302
137 HG22 ILE 17 HG22 ILE 17 4.299 8.071 4.004
138 HG23 ILE 17 HG23 ILE 17 4.887 6.460 3.502
139 HD11 ILE 17 HD11 ILE 17 2.842 4.247 3.897
140 HD12 ILE 17 HD12 ILE 17 3.774 5.165 5.120
141 HD13 ILE 17 HD13 ILE 17 2.154 4.552 5.518
142 H ALA 18 H ALA 18 2.477 7.038 0.009
143 HA ALA 18 HA ALA 18 4.542 8.779 -0.735
144 HB1 ALA 18 HB1 ALA 18 4.116 6.573 -1.883
145 HB2 ALA 18 HB2 ALA 18 2.686 7.290 -2.694
146 HB3 ALA 18 HB3 ALA 18 4.319 7.923 -3.035
147 H ALA 19 H ALA 19 0.934 9.105 -1.349
148 HA ALA 19 HA ALA 19 0.879 10.917 -3.348
149 HB1 ALA 19 HB1 ALA 19 -0.662 11.220 -0.696
150 HB2 ALA 19 HB2 ALA 19 -1.035 12.130 -2.191
151 HB3 ALA 19 HB3 ALA 19 -1.213 10.358 -2.170
152 H HIS 20 H HIS 20 1.808 11.796 0.101
153 HA HIS 20 HA HIS 20 1.947 14.572 -0.454
154 HB2 HIS 20 HB2 HIS 20 2.054 13.499 1.846
155 HB3 HIS 20 HB3 HIS 20 3.771 13.112 1.557
156 HD1 HIS 20 HD2 HIS 20 5.326 15.271 1.186
157 HD2 HIS 20 HD3 HIS 20 1.390 16.005 2.467
158 HE1 HIS 20 HE2 HIS 20 5.314 17.661 2.025
159 H VAL 21 H VAL 21 4.553 11.990 -0.656
160 HA VAL 21 HA VAL 21 6.429 13.906 -1.832
161 HB VAL 21 HB VAL 21 6.535 10.846 -1.625
162 HG11 VAL 21 HG11 VAL 21 7.827 11.571 -3.640
163 HG12 VAL 21 HG12 VAL 21 8.664 12.819 -2.671
164 HG13 VAL 21 HG13 VAL 21 8.931 11.085 -2.332
165 HG21 VAL 21 HG21 VAL 21 8.058 13.052 -0.114
166 HG22 VAL 21 HG22 VAL 21 6.712 12.083 0.552
167 HG23 VAL 21 HG23 VAL 21 8.246 11.289 0.106
168 H ALA 22 H ALA 22 4.883 10.897 -3.308
169 HA ALA 22 HA ALA 22 5.314 12.076 -5.970
170 HB1 ALA 22 HB1 ALA 22 5.657 9.640 -5.594
171 HB2 ALA 22 HB2 ALA 22 3.939 9.457 -5.133
172 HB3 ALA 22 HB3 ALA 22 4.370 9.941 -6.800
173 H SER 23 H SER 23 3.897 14.064 -5.237
174 HA SER 23 HA SER 23 0.992 13.538 -5.180
175 HB2 SER 23 HB2 SER 23 0.822 16.026 -5.317
176 HB3 SER 23 HB3 SER 23 1.956 15.518 -4.023
177 HG SER 23 HG SER 23 2.914 17.185 -5.430
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -0.549 -16.668 -0.373
2 H2 GLY 1 H2 GLY 1 0.089 -16.625 -0.225
3 HA2 GLY 1 HA2 GLY 1 -1.829 -15.975 1.681
4 HA3 GLY 1 HA3 GLY 1 -0.491 -16.718 2.611
5 H LEU 2 H LEU 2 -0.893 -14.136 3.308
6 HA LEU 2 HA LEU 2 0.081 -12.011 3.331
7 HB2 LEU 2 HB2 LEU 2 2.444 -13.600 2.189
8 HB3 LEU 2 HB3 LEU 2 2.566 -11.975 2.877
9 HG LEU 2 HG LEU 2 1.344 -14.221 4.580
10 HD11 LEU 2 HD11 LEU 2 4.362 -13.785 4.207
11 HD12 LEU 2 HD12 LEU 2 3.425 -15.237 3.740
12 HD13 LEU 2 HD13 LEU 2 3.602 -14.812 5.461
13 HD21 LEU 2 HD21 LEU 2 3.084 -11.783 5.327
14 HD22 LEU 2 HD22 LEU 2 2.272 -12.893 6.465
15 HD23 LEU 2 HD23 LEU 2 1.300 -11.820 5.425
16 H LYS 3 H LYS 3 -1.742 -12.206 1.453
17 HA LYS 3 HA LYS 3 -0.548 -10.516 -0.722
18 HB2 LYS 3 HB2 LYS 3 -2.374 -12.939 -1.158
19 HB3 LYS 3 HB3 LYS 3 -2.191 -11.604 -2.331
20 HG2 LYS 3 HG2 LYS 3 0.294 -12.006 -2.419
21 HG3 LYS 3 HG3 LYS 3 0.103 -13.380 -1.298
22 HD2 LYS 3 HD2 LYS 3 -1.346 -14.556 -2.975
23 HD3 LYS 3 HD3 LYS 3 -1.220 -13.155 -4.078
24 HE2 LYS 3 HE2 LYS 3 1.279 -13.474 -4.198
25 HE3 LYS 3 HE3 LYS 3 1.142 -14.896 -3.128
26 HZ1 LYS 3 HZ1 LYS 3 -0.281 -16.001 -4.831
27 HZ2 LYS 3 HZ2 LYS 3 1.264 -15.553 -5.499
28 HZ3 LYS 3 HZ3 LYS 3 -0.144 -14.606 -5.870
29 H GLU 4 H GLU 4 -3.833 -11.739 0.503
30 HA GLU 4 HA GLU 4 -5.190 -9.373 -0.136
31 HB2 GLU 4 HB2 GLU 4 -5.463 -11.089 2.416
32 HB3 GLU 4 HB3 GLU 4 -6.571 -9.755 2.014
33 HG2 GLU 4 HG2 GLU 4 -6.160 -12.260 0.257
34 HG3 GLU 4 HG3 GLU 4 -7.525 -11.968 1.356
35 H ILE 5 H ILE 5 -3.099 -10.042 2.804
36 HA ILE 5 HA ILE 5 -3.628 -7.324 3.787
37 HB ILE 5 HB ILE 5 -1.475 -9.307 4.697
38 HG12 ILE 5 HG12 ILE 5 -3.591 -10.434 5.065
39 HG13 ILE 5 HG13 ILE 5 -3.006 -9.814 6.615
40 HG21 ILE 5 HG21 ILE 5 -0.923 -7.006 5.366
41 HG22 ILE 5 HG22 ILE 5 -2.559 -6.740 6.013
42 HG23 ILE 5 HG23 ILE 5 -1.462 -7.911 6.796
43 HD11 ILE 5 HD11 ILE 5 -5.429 -9.469 6.449
44 HD12 ILE 5 HD12 ILE 5 -4.659 -7.864 6.397
45 HD13 ILE 5 HD13 ILE 5 -5.280 -8.620 4.896
46 H PHE 6 H PHE 6 -0.709 -9.014 2.299
47 HA PHE 6 HA PHE 6 0.929 -6.706 2.453
48 HB2 PHE 6 HB2 PHE 6 1.920 -8.862 1.875
49 HB3 PHE 6 HB3 PHE 6 0.919 -9.008 0.426
50 HD1 PHE 6 HD1 PHE 6 3.741 -7.069 1.931
51 HD2 PHE 6 HD2 PHE 6 1.473 -7.834 -1.646
52 HE1 PHE 6 HE1 PHE 6 5.523 -6.017 0.570
53 HE2 PHE 6 HE2 PHE 6 3.261 -6.799 -3.000
54 HZ PHE 6 HZ PHE 6 5.299 -5.902 -1.900
55 H LYS 7 H LYS 7 -1.102 -7.836 -0.390
56 HA LYS 7 HA LYS 7 -0.341 -5.573 -1.950
57 HB2 LYS 7 HB2 LYS 7 -1.261 -7.684 -2.926
58 HB3 LYS 7 HB3 LYS 7 -2.857 -7.309 -2.222
59 HG2 LYS 7 HG2 LYS 7 -2.986 -5.212 -3.620
60 HG3 LYS 7 HG3 LYS 7 -1.349 -5.538 -4.243
61 HD2 LYS 7 HD2 LYS 7 -2.959 -6.197 -5.938
62 HD3 LYS 7 HD3 LYS 7 -2.190 -7.676 -5.310
63 HE2 LYS 7 HE2 LYS 7 -4.231 -8.161 -3.928
64 HE3 LYS 7 HE3 LYS 7 -4.954 -6.608 -4.433
65 HZ1 LYS 7 HZ1 LYS 7 -4.979 -7.421 -6.771
66 HZ2 LYS 7 HZ2 LYS 7 -5.848 -8.498 -5.725
67 HZ3 LYS 7 HZ3 LYS 7 -4.250 -8.925 -6.268
68 H ALA 8 H ALA 8 -3.462 -6.209 -0.049
69 HA ALA 8 HA ALA 8 -4.537 -3.684 -0.944
70 HB1 ALA 8 HB1 ALA 8 -6.317 -3.975 0.720
71 HB2 ALA 8 HB2 ALA 8 -6.011 -5.541 -0.088
72 HB3 ALA 8 HB3 ALA 8 -5.399 -5.243 1.568
73 H GLY 9 H GLY 9 -2.930 -4.760 2.166
74 HA2 GLY 9 HA2 GLY 9 -3.308 -2.396 3.615
75 HA3 GLY 9 HA3 GLY 9 -1.872 -3.434 3.798
76 H LEU 10 H LEU 10 -0.305 -3.226 1.627
77 HA LEU 10 HA LEU 10 0.621 -0.529 1.901
78 HB2 LEU 10 HB2 LEU 10 2.431 -1.017 0.466
79 HB3 LEU 10 HB3 LEU 10 2.073 -2.498 1.369
80 HG LEU 10 HG LEU 10 0.644 -3.121 -0.840
81 HD11 LEU 10 HD11 LEU 10 1.638 -2.225 -2.939
82 HD12 LEU 10 HD12 LEU 10 2.756 -1.189 -2.012
83 HD13 LEU 10 HD13 LEU 10 1.013 -0.851 -2.006
84 HD21 LEU 10 HD21 LEU 10 2.664 -4.211 -1.816
85 HD22 LEU 10 HD22 LEU 10 2.600 -4.421 -0.047
86 HD23 LEU 10 HD23 LEU 10 3.720 -3.226 -0.761
87 H GLY 11 H GLY 11 -1.560 -2.135 -0.521
88 HA2 GLY 11 HA2 GLY 11 -1.374 -0.211 -2.565
89 HA3 GLY 11 HA3 GLY 11 -2.863 -1.107 -2.180
90 H SER 12 H SER 12 -3.486 -0.166 0.429
91 HA SER 12 HA SER 12 -4.650 2.401 -0.348
92 HB2 SER 12 HB2 SER 12 -5.860 0.767 1.091
93 HB3 SER 12 HB3 SER 12 -4.662 0.993 2.394
94 HG SER 12 HG SER 12 -5.379 3.278 2.406
95 H LEU 13 H LEU 13 -2.079 1.310 2.042
96 HA LEU 13 HA LEU 13 -1.868 3.968 3.149
97 HB2 LEU 13 HB2 LEU 13 0.153 1.664 3.172
98 HB3 LEU 13 HB3 LEU 13 0.324 3.147 4.133
99 HG LEU 13 HG LEU 13 -2.044 1.190 4.452
100 HD11 LEU 13 HD11 LEU 13 0.517 1.454 6.136
101 HD12 LEU 13 HD12 LEU 13 0.107 0.080 5.065
102 HD13 LEU 13 HD13 LEU 13 -0.877 0.400 6.515
103 HD21 LEU 13 HD21 LEU 13 -2.360 2.396 6.654
104 HD22 LEU 13 HD22 LEU 13 -2.645 3.465 5.272
105 HD23 LEU 13 HD23 LEU 13 -1.106 3.572 6.175
106 H VAL 14 H VAL 14 0.145 2.213 0.627
107 HA VAL 14 HA VAL 14 2.080 4.201 0.462
108 HB VAL 14 HB VAL 14 2.124 1.991 -0.813
109 HG11 VAL 14 HG11 VAL 14 0.556 3.525 -2.990
110 HG12 VAL 14 HG12 VAL 14 1.198 1.865 -3.094
111 HG13 VAL 14 HG13 VAL 14 -0.142 2.233 -1.987
112 HG21 VAL 14 HG21 VAL 14 3.864 3.774 -1.173
113 HG22 VAL 14 HG22 VAL 14 3.528 2.874 -2.672
114 HG23 VAL 14 HG23 VAL 14 2.847 4.505 -2.446
115 H LYS 15 H LYS 15 -1.259 4.213 -1.005
116 HA LYS 15 HA LYS 15 -0.781 6.532 -2.593
117 HB2 LYS 15 HB2 LYS 15 -2.841 5.200 -2.829
118 HB3 LYS 15 HB3 LYS 15 -3.409 5.702 -1.218
119 HG2 LYS 15 HG2 LYS 15 -3.295 8.146 -2.014
120 HG3 LYS 15 HG3 LYS 15 -2.964 7.535 -3.653
121 HD2 LYS 15 HD2 LYS 15 -5.492 6.987 -1.949
122 HD3 LYS 15 HD3 LYS 15 -5.365 8.137 -3.303
123 HE2 LYS 15 HE2 LYS 15 -4.843 6.195 -4.861
124 HE3 LYS 15 HE3 LYS 15 -5.128 5.068 -3.503
125 HZ1 LYS 15 HZ1 LYS 15 -7.135 5.292 -4.880
126 HZ2 LYS 15 HZ2 LYS 15 -7.167 7.008 -4.637
127 HZ3 LYS 15 HZ3 LYS 15 -7.430 5.935 -3.287
128 H GLY 16 H GLY 16 -2.217 6.295 0.815
129 HA2 GLY 16 HA2 GLY 16 -2.344 9.113 1.112
130 HA3 GLY 16 HA3 GLY 16 -2.262 7.963 2.468
131 H ILE 17 H ILE 17 0.413 6.825 1.744
132 HA ILE 17 HA ILE 17 1.863 8.923 3.223
133 HB ILE 17 HB ILE 17 2.744 6.136 2.301
134 HG12 ILE 17 HG12 ILE 17 1.934 7.194 5.086
135 HG13 ILE 17 HG13 ILE 17 0.899 6.204 4.034
136 HG21 ILE 17 HG21 ILE 17 4.749 6.480 3.741
137 HG22 ILE 17 HG22 ILE 17 4.693 7.735 2.498
138 HG23 ILE 17 HG23 ILE 17 4.183 8.122 4.166
139 HD11 ILE 17 HD11 ILE 17 3.523 5.289 5.355
140 HD12 ILE 17 HD12 ILE 17 1.873 4.714 5.674
141 HD13 ILE 17 HD13 ILE 17 2.649 4.350 4.106
142 H ALA 18 H ALA 18 2.506 7.081 0.091
143 HA ALA 18 HA ALA 18 4.668 8.772 -0.566
144 HB1 ALA 18 HB1 ALA 18 2.880 7.253 -2.566
145 HB2 ALA 18 HB2 ALA 18 4.530 7.871 -2.862
146 HB3 ALA 18 HB3 ALA 18 4.277 6.554 -1.682
147 H ALA 19 H ALA 19 7.105 4.811 3.589
148 HA ALA 19 HA ALA 19 1.158 10.961 -3.319
149 HB1 ALA 19 HB1 ALA 19 -0.799 12.191 -2.227
150 HB2 ALA 19 HB2 ALA 19 -1.010 10.424 -2.282
151 HB3 ALA 19 HB3 ALA 19 -0.526 11.218 -0.748
152 H HIS 20 H HIS 20 1.913 11.802 0.187
153 HA HIS 20 HA HIS 20 2.093 14.576 -0.333
154 HB2 HIS 20 HB2 HIS 20 2.172 13.469 1.974
155 HB3 HIS 20 HB3 HIS 20 3.900 13.124 1.698
156 HD1 HIS 20 HD2 HIS 20 5.256 15.473 0.945
157 HD2 HIS 20 HD3 HIS 20 1.636 15.799 3.061
158 HE1 HIS 20 HE2 HIS 20 5.237 17.809 1.915
159 H VAL 21 H VAL 21 4.689 11.986 -0.473
160 HA VAL 21 HA VAL 21 6.609 13.936 -1.533
161 HB VAL 21 HB VAL 21 6.774 10.886 -1.258
162 HG11 VAL 21 HG11 VAL 21 8.924 12.901 -2.171
163 HG12 VAL 21 HG12 VAL 21 9.210 11.180 -1.788
164 HG13 VAL 21 HG13 VAL 21 8.197 11.620 -3.183
165 HG21 VAL 21 HG21 VAL 21 8.114 13.160 0.324
166 HG22 VAL 21 HG22 VAL 21 6.752 12.162 0.907
167 HG23 VAL 21 HG23 VAL 21 8.336 11.409 0.591
168 H ALA 22 H ALA 22 5.265 10.857 -3.070
169 HA ALA 22 HA ALA 22 5.792 12.084 -5.710
170 HB1 ALA 22 HB1 ALA 22 5.136 9.875 -6.598
171 HB2 ALA 22 HB2 ALA 22 6.369 9.697 -5.313
172 HB3 ALA 22 HB3 ALA 22 4.655 9.327 -4.967
173 H SER 23 H SER 23 4.137 13.914 -5.086
174 HA SER 23 HA SER 23 1.317 13.131 -5.109
175 HB2 SER 23 HB2 SER 23 2.096 15.345 -4.189
176 HB3 SER 23 HB3 SER 23 2.590 15.833 -5.841
177 HG SER 23 HG SER 23 0.359 16.515 -5.332
Start of MODEL 5
1 H1 GLY 1 H GLY 1 -3.696 -15.825 1.733
2 H2 GLY 1 H2 GLY 1 -2.769 -14.518 1.110
3 HA2 GLY 1 HA2 GLY 1 -2.908 -15.125 4.000
4 HA3 GLY 1 HA3 GLY 1 -1.596 -15.935 3.094
5 H LEU 2 H LEU 2 -0.368 -14.377 1.477
6 HA LEU 2 HA LEU 2 0.151 -11.758 2.926
7 HB2 LEU 2 HB2 LEU 2 1.992 -13.400 1.111
8 HB3 LEU 2 HB3 LEU 2 2.450 -11.969 2.062
9 HG LEU 2 HG LEU 2 1.592 -14.694 3.237
10 HD11 LEU 2 HD11 LEU 2 4.375 -13.376 3.077
11 HD12 LEU 2 HD12 LEU 2 3.824 -14.776 2.109
12 HD13 LEU 2 HD13 LEU 2 3.992 -14.928 3.878
13 HD21 LEU 2 HD21 LEU 2 2.426 -13.741 5.428
14 HD22 LEU 2 HD22 LEU 2 0.999 -12.869 4.834
15 HD23 LEU 2 HD23 LEU 2 2.626 -12.148 4.645
16 H LYS 3 H LYS 3 -1.903 -12.463 0.640
17 HA LYS 3 HA LYS 3 -0.863 -10.315 -1.229
18 HB2 LYS 3 HB2 LYS 3 -2.534 -12.809 -1.724
19 HB3 LYS 3 HB3 LYS 3 -2.964 -11.324 -2.601
20 HG2 LYS 3 HG2 LYS 3 -1.437 -12.617 -3.993
21 HG3 LYS 3 HG3 LYS 3 -0.698 -11.081 -3.498
22 HD2 LYS 3 HD2 LYS 3 0.555 -12.421 -1.637
23 HD3 LYS 3 HD3 LYS 3 -0.145 -13.888 -2.354
24 HE2 LYS 3 HE2 LYS 3 2.104 -13.669 -3.205
25 HE3 LYS 3 HE3 LYS 3 1.034 -13.230 -4.560
26 HZ1 LYS 3 HZ1 LYS 3 1.533 -10.829 -4.131
27 HZ2 LYS 3 HZ2 LYS 3 2.992 -11.717 -4.301
28 HZ3 LYS 3 HZ3 LYS 3 2.453 -11.257 -2.717
29 H GLU 4 H GLU 4 -4.062 -11.568 0.141
30 HA GLU 4 HA GLU 4 -5.398 -9.126 -0.247
31 HB2 GLU 4 HB2 GLU 4 -5.651 -11.111 2.101
32 HB3 GLU 4 HB3 GLU 4 -6.674 -9.661 1.942
33 HG2 GLU 4 HG2 GLU 4 -7.895 -11.592 1.056
34 HG3 GLU 4 HG3 GLU 4 -7.557 -10.432 -0.249
35 H ILE 5 H ILE 5 -3.147 -10.107 2.463
36 HA ILE 5 HA ILE 5 -3.536 -7.565 3.819
37 HB ILE 5 HB ILE 5 -1.192 -9.530 4.045
38 HG12 ILE 5 HG12 ILE 5 -3.209 -10.738 4.705
39 HG13 ILE 5 HG13 ILE 5 -2.281 -10.319 6.150
40 HG21 ILE 5 HG21 ILE 5 -0.506 -7.326 4.865
41 HG22 ILE 5 HG22 ILE 5 -1.993 -7.147 5.824
42 HG23 ILE 5 HG23 ILE 5 -0.780 -8.381 6.266
43 HD11 ILE 5 HD11 ILE 5 -4.874 -8.953 5.169
44 HD12 ILE 5 HD12 ILE 5 -4.669 -9.994 6.592
45 HD13 ILE 5 HD13 ILE 5 -3.916 -8.382 6.570
46 H PHE 6 H PHE 6 -0.919 -8.806 1.528
47 HA PHE 6 HA PHE 6 0.534 -6.320 1.791
48 HB2 PHE 6 HB2 PHE 6 0.615 -8.383 -0.484
49 HB3 PHE 6 HB3 PHE 6 1.638 -6.937 -0.375
50 HD1 PHE 6 HD1 PHE 6 1.174 -8.343 2.981
51 HD2 PHE 6 HD2 PHE 6 3.320 -8.844 -0.724
52 HE1 PHE 6 HE1 PHE 6 2.947 -9.543 4.167
53 HE2 PHE 6 HE2 PHE 6 5.094 -10.069 0.482
54 HZ PHE 6 HZ PHE 6 4.925 -10.406 2.939
55 H LYS 7 H LYS 7 -1.556 -7.497 -1.001
56 HA LYS 7 HA LYS 7 -1.386 -5.112 -2.390
57 HB2 LYS 7 HB2 LYS 7 -3.083 -7.470 -2.687
58 HB3 LYS 7 HB3 LYS 7 -4.184 -6.114 -2.597
59 HG2 LYS 7 HG2 LYS 7 -3.707 -6.449 -4.915
60 HG3 LYS 7 HG3 LYS 7 -2.893 -4.946 -4.427
61 HD2 LYS 7 HD2 LYS 7 -1.472 -6.245 -5.934
62 HD3 LYS 7 HD3 LYS 7 -0.673 -6.211 -4.349
63 HE2 LYS 7 HE2 LYS 7 -1.382 -8.544 -3.885
64 HE3 LYS 7 HE3 LYS 7 -2.401 -8.561 -5.352
65 HZ1 LYS 7 HZ1 LYS 7 0.621 -8.292 -5.285
66 HZ2 LYS 7 HZ2 LYS 7 -0.358 -8.311 -6.730
67 HZ3 LYS 7 HZ3 LYS 7 -0.275 -9.718 -5.727
68 H ALA 8 H ALA 8 -3.965 -5.923 0.093
69 HA ALA 8 HA ALA 8 -5.247 -3.379 -0.321
70 HB1 ALA 8 HB1 ALA 8 -6.490 -3.820 1.767
71 HB2 ALA 8 HB2 ALA 8 -6.431 -5.302 0.766
72 HB3 ALA 8 HB3 ALA 8 -5.375 -5.144 2.203
73 H GLY 9 H GLY 9 -2.871 -4.563 2.212
74 HA2 GLY 9 HA2 GLY 9 -2.957 -2.211 3.783
75 HA3 GLY 9 HA3 GLY 9 -1.552 -3.298 3.689
76 H LEU 10 H LEU 10 -0.323 -3.103 1.368
77 HA LEU 10 HA LEU 10 0.701 -0.435 1.483
78 HB2 LEU 10 HB2 LEU 10 2.258 -1.009 -0.228
79 HB3 LEU 10 HB3 LEU 10 2.020 -2.423 0.810
80 HG LEU 10 HG LEU 10 0.198 -3.069 -1.133
81 HD11 LEU 10 HD11 LEU 10 0.967 -2.404 -3.392
82 HD12 LEU 10 HD12 LEU 10 2.270 -1.402 -2.696
83 HD13 LEU 10 HD13 LEU 10 0.566 -0.934 -2.477
84 HD21 LEU 10 HD21 LEU 10 3.233 -3.458 -1.450
85 HD22 LEU 10 HD22 LEU 10 1.962 -4.437 -2.245
86 HD23 LEU 10 HD23 LEU 10 2.138 -4.478 -0.472
87 H GLY 11 H GLY 11 -1.895 -1.913 -0.567
88 HA2 GLY 11 HA2 GLY 11 -1.833 0.085 -2.606
89 HA3 GLY 11 HA3 GLY 11 -3.280 -0.840 -2.137
90 H SER 12 H SER 12 -3.576 -0.018 0.610
91 HA SER 12 HA SER 12 -4.834 2.576 0.089
92 HB2 SER 12 HB2 SER 12 -5.883 0.922 1.604
93 HB3 SER 12 HB3 SER 12 -4.495 1.037 2.732
94 HG SER 12 HG SER 12 -6.242 2.548 3.320
95 H LEU 13 H LEU 13 -2.025 1.381 2.123
96 HA LEU 13 HA LEU 13 -1.623 3.990 3.282
97 HB2 LEU 13 HB2 LEU 13 0.334 1.648 2.964
98 HB3 LEU 13 HB3 LEU 13 0.665 3.089 3.948
99 HG LEU 13 HG LEU 13 -1.690 1.173 4.514
100 HD11 LEU 13 HD11 LEU 13 1.087 1.314 5.841
101 HD12 LEU 13 HD12 LEU 13 0.497 -0.005 4.786
102 HD13 LEU 13 HD13 LEU 13 -0.274 0.281 6.367
103 HD21 LEU 13 HD21 LEU 13 -0.456 3.459 6.176
104 HD22 LEU 13 HD22 LEU 13 -1.673 2.298 6.776
105 HD23 LEU 13 HD23 LEU 13 -2.104 3.429 5.482
106 H VAL 14 H VAL 14 -0.174 2.399 0.320
107 HA VAL 14 HA VAL 14 1.954 4.197 0.141
108 HB VAL 14 HB VAL 14 1.710 2.212 -1.367
109 HG11 VAL 14 HG11 VAL 14 -0.694 2.629 -2.119
110 HG12 VAL 14 HG12 VAL 14 -0.124 4.010 -3.092
111 HG13 VAL 14 HG13 VAL 14 0.429 2.357 -3.473
112 HG21 VAL 14 HG21 VAL 14 2.277 4.865 -2.830
113 HG22 VAL 14 HG22 VAL 14 3.437 3.972 -1.805
114 HG23 VAL 14 HG23 VAL 14 2.843 3.246 -3.321
115 H LYS 15 H LYS 15 -1.513 4.702 -0.977
116 HA LYS 15 HA LYS 15 -0.895 7.302 -2.061
117 HB2 LYS 15 HB2 LYS 15 -3.531 6.263 -0.851
118 HB3 LYS 15 HB3 LYS 15 -3.313 7.889 -1.551
119 HG2 LYS 15 HG2 LYS 15 -2.662 6.891 -3.749
120 HG3 LYS 15 HG3 LYS 15 -2.868 5.249 -3.070
121 HD2 LYS 15 HD2 LYS 15 -5.293 5.651 -2.723
122 HD3 LYS 15 HD3 LYS 15 -5.114 7.372 -3.154
123 HE2 LYS 15 HE2 LYS 15 -6.123 6.161 -5.021
124 HE3 LYS 15 HE3 LYS 15 -4.526 6.789 -5.496
125 HZ1 LYS 15 HZ1 LYS 15 -4.965 4.469 -6.279
126 HZ2 LYS 15 HZ2 LYS 15 -5.068 3.927 -4.630
127 HZ3 LYS 15 HZ3 LYS 15 -3.562 4.549 -5.278
128 H GLY 16 H GLY 16 -2.168 6.299 1.255
129 HA2 GLY 16 HA2 GLY 16 -2.233 8.862 2.338
130 HA3 GLY 16 HA3 GLY 16 -1.841 7.412 3.298
131 H ILE 17 H ILE 17 0.707 6.801 1.812
132 HA ILE 17 HA ILE 17 2.320 8.745 3.421
133 HB ILE 17 HB ILE 17 3.055 6.027 2.215
134 HG12 ILE 17 HG12 ILE 17 2.512 6.868 5.135
135 HG13 ILE 17 HG13 ILE 17 1.382 5.959 4.105
136 HG21 ILE 17 HG21 ILE 17 4.680 7.864 4.078
137 HG22 ILE 17 HG22 ILE 17 5.189 6.265 3.460
138 HG23 ILE 17 HG23 ILE 17 5.012 7.623 2.340
139 HD11 ILE 17 HD11 ILE 17 3.119 4.109 3.878
140 HD12 ILE 17 HD12 ILE 17 4.117 4.958 5.100
141 HD13 ILE 17 HD13 ILE 17 2.502 4.358 5.537
142 H ALA 18 H ALA 18 2.610 7.094 0.124
143 HA ALA 18 HA ALA 18 4.667 8.832 -0.672
144 HB1 ALA 18 HB1 ALA 18 4.106 6.707 -1.911
145 HB2 ALA 18 HB2 ALA 18 2.629 7.492 -2.557
146 HB3 ALA 18 HB3 ALA 18 4.239 8.120 -2.998
147 H ALA 19 H ALA 19 1.042 9.313 -0.884
148 HA ALA 19 HA ALA 19 0.861 11.121 -2.865
149 HB1 ALA 19 HB1 ALA 19 -0.434 11.464 -0.092
150 HB2 ALA 19 HB2 ALA 19 -0.891 12.409 -1.542
151 HB3 ALA 19 HB3 ALA 19 -1.144 10.647 -1.523
152 H HIS 20 H HIS 20 2.087 12.000 0.482
153 HA HIS 20 HA HIS 20 2.261 14.759 -0.061
154 HB2 HIS 20 HB2 HIS 20 2.676 13.589 2.200
155 HB3 HIS 20 HB3 HIS 20 4.345 13.278 1.659
156 HD1 HIS 20 HD2 HIS 20 5.476 15.719 0.704
157 HD2 HIS 20 HD3 HIS 20 2.353 15.822 3.519
158 HE1 HIS 20 HE2 HIS 20 5.593 18.006 1.773
159 H VAL 21 H VAL 21 4.696 12.097 -0.661
160 HA VAL 21 HA VAL 21 6.580 13.992 -1.846
161 HB VAL 21 HB VAL 21 6.544 10.920 -1.866
162 HG11 VAL 21 HG11 VAL 21 8.918 11.107 -2.642
163 HG12 VAL 21 HG12 VAL 21 7.793 11.756 -3.859
164 HG13 VAL 21 HG13 VAL 21 8.727 12.875 -2.824
165 HG21 VAL 21 HG21 VAL 21 6.875 11.957 0.407
166 HG22 VAL 21 HG22 VAL 21 8.352 11.152 -0.180
167 HG23 VAL 21 HG23 VAL 21 8.224 12.932 -0.241
168 H ALA 22 H ALA 22 4.596 11.243 -3.279
169 HA ALA 22 HA ALA 22 4.806 12.704 -5.935
170 HB1 ALA 22 HB1 ALA 22 4.846 9.688 -5.335
171 HB2 ALA 22 HB2 ALA 22 4.893 10.443 -6.957
172 HB3 ALA 22 HB3 ALA 22 6.249 10.685 -5.816
173 H SER 23 H SER 23 2.691 13.767 -4.999
174 HA SER 23 HA SER 23 0.321 12.087 -4.976
175 HB2 SER 23 HB2 SER 23 0.274 14.401 -4.053
176 HB3 SER 23 HB3 SER 23 0.554 15.061 -5.698
177 HG SER 23 HG SER 23 -1.771 14.913 -5.170
Start of MODEL 6
1 H1 GLY 1 H GLY 1 -3.474 -17.176 4.109
2 H2 GLY 1 H2 GLY 1 -3.802 -16.838 3.844
3 HA2 GLY 1 HA2 GLY 1 -1.135 -16.708 3.364
4 HA3 GLY 1 HA3 GLY 1 -2.329 -16.040 2.204
5 H LEU 2 H LEU 2 0.009 -14.783 2.022
6 HA LEU 2 HA LEU 2 -0.427 -12.205 3.543
7 HB2 LEU 2 HB2 LEU 2 1.596 -13.618 4.322
8 HB3 LEU 2 HB3 LEU 2 2.228 -13.466 2.671
9 HG LEU 2 HG LEU 2 2.098 -10.852 3.055
10 HD11 LEU 2 HD11 LEU 2 1.901 -11.765 5.999
11 HD12 LEU 2 HD12 LEU 2 0.642 -10.854 5.125
12 HD13 LEU 2 HD13 LEU 2 2.217 -10.101 5.439
13 HD21 LEU 2 HD21 LEU 2 4.303 -10.832 4.247
14 HD22 LEU 2 HD22 LEU 2 4.252 -12.101 2.999
15 HD23 LEU 2 HD23 LEU 2 4.062 -12.539 4.722
16 H LYS 3 H LYS 3 -1.923 -12.298 1.455
17 HA LYS 3 HA LYS 3 -0.335 -10.847 -0.625
18 HB2 LYS 3 HB2 LYS 3 -0.635 -13.199 -1.352
19 HB3 LYS 3 HB3 LYS 3 -2.406 -12.991 -1.321
20 HG2 LYS 3 HG2 LYS 3 -2.251 -11.175 -3.039
21 HG3 LYS 3 HG3 LYS 3 -0.468 -11.226 -2.976
22 HD2 LYS 3 HD2 LYS 3 -0.486 -13.595 -3.809
23 HD3 LYS 3 HD3 LYS 3 -2.266 -13.527 -3.950
24 HE2 LYS 3 HE2 LYS 3 -2.066 -11.660 -5.615
25 HE3 LYS 3 HE3 LYS 3 -0.291 -11.656 -5.424
26 HZ1 LYS 3 HZ1 LYS 3 -1.923 -13.990 -6.473
27 HZ2 LYS 3 HZ2 LYS 3 -0.188 -13.959 -6.292
28 HZ3 LYS 3 HZ3 LYS 3 -0.961 -12.899 -7.432
29 H GLU 4 H GLU 4 -3.843 -11.703 0.226
30 HA GLU 4 HA GLU 4 -4.862 -9.204 -0.628
31 HB2 GLU 4 HB2 GLU 4 -5.668 -10.829 1.874
32 HB3 GLU 4 HB3 GLU 4 -6.560 -9.407 1.265
33 HG2 GLU 4 HG2 GLU 4 -7.010 -10.572 -0.903
34 HG3 GLU 4 HG3 GLU 4 -6.140 -12.018 -0.332
35 H ILE 5 H ILE 5 -3.215 -10.139 2.510
36 HA ILE 5 HA ILE 5 -3.536 -7.527 3.671
37 HB ILE 5 HB ILE 5 -1.421 -9.690 4.167
38 HG12 ILE 5 HG12 ILE 5 -3.867 -8.819 5.848
39 HG13 ILE 5 HG13 ILE 5 -3.850 -10.223 4.759
40 HG21 ILE 5 HG21 ILE 5 -1.915 -7.109 5.777
41 HG22 ILE 5 HG22 ILE 5 -0.777 -8.410 6.234
42 HG23 ILE 5 HG23 ILE 5 -0.466 -7.451 4.789
43 HD11 ILE 5 HD11 ILE 5 -3.502 -11.058 7.001
44 HD12 ILE 5 HD12 ILE 5 -1.956 -11.236 6.124
45 HD13 ILE 5 HD13 ILE 5 -2.175 -9.924 7.324
46 H PHE 6 H PHE 6 -0.785 -9.028 1.745
47 HA PHE 6 HA PHE 6 0.884 -6.759 1.965
48 HB2 PHE 6 HB2 PHE 6 1.715 -8.907 1.082
49 HB3 PHE 6 HB3 PHE 6 0.669 -8.768 -0.342
50 HD1 PHE 6 HD1 PHE 6 3.544 -7.109 1.420
51 HD2 PHE 6 HD2 PHE 6 1.334 -7.442 -2.260
52 HE1 PHE 6 HE1 PHE 6 5.386 -5.982 0.204
53 HE2 PHE 6 HE2 PHE 6 3.209 -6.393 -3.482
54 HZ PHE 6 HZ PHE 6 5.239 -5.656 -2.254
55 H LYS 7 H LYS 7 -1.378 -7.566 -0.846
56 HA LYS 7 HA LYS 7 -0.821 -5.051 -2.103
57 HB2 LYS 7 HB2 LYS 7 -3.236 -6.941 -2.412
58 HB3 LYS 7 HB3 LYS 7 -3.042 -5.427 -3.335
59 HG2 LYS 7 HG2 LYS 7 -0.869 -6.223 -4.268
60 HG3 LYS 7 HG3 LYS 7 -1.053 -7.778 -3.407
61 HD2 LYS 7 HD2 LYS 7 -3.128 -8.281 -4.686
62 HD3 LYS 7 HD3 LYS 7 -3.090 -6.669 -5.454
63 HE2 LYS 7 HE2 LYS 7 -0.921 -7.225 -6.574
64 HE3 LYS 7 HE3 LYS 7 -0.950 -8.850 -5.832
65 HZ1 LYS 7 HZ1 LYS 7 -3.055 -9.334 -7.036
66 HZ2 LYS 7 HZ2 LYS 7 -1.801 -8.876 -8.152
67 HZ3 LYS 7 HZ3 LYS 7 -3.046 -7.736 -7.739
68 H ALA 8 H ALA 8 -3.696 -6.060 -0.005
69 HA ALA 8 HA ALA 8 -4.986 -3.548 -0.428
70 HB1 ALA 8 HB1 ALA 8 -6.392 -4.068 1.545
71 HB2 ALA 8 HB2 ALA 8 -6.206 -5.520 0.517
72 HB3 ALA 8 HB3 ALA 8 -5.281 -5.374 2.042
73 H GLY 9 H GLY 9 -2.842 -4.702 2.309
74 HA2 GLY 9 HA2 GLY 9 -3.116 -2.379 3.890
75 HA3 GLY 9 HA3 GLY 9 -1.676 -3.426 3.902
76 H LEU 10 H LEU 10 -0.293 -3.160 1.639
77 HA LEU 10 HA LEU 10 0.685 -0.493 1.956
78 HB2 LEU 10 HB2 LEU 10 2.386 -0.945 0.376
79 HB3 LEU 10 HB3 LEU 10 2.066 -2.459 1.239
80 HG LEU 10 HG LEU 10 0.447 -2.930 -0.894
81 HD11 LEU 10 HD11 LEU 10 2.575 -1.052 -2.122
82 HD12 LEU 10 HD12 LEU 10 0.854 -0.630 -1.981
83 HD13 LEU 10 HD13 LEU 10 1.345 -1.989 -3.013
84 HD21 LEU 10 HD21 LEU 10 2.338 -4.069 -2.039
85 HD22 LEU 10 HD22 LEU 10 2.382 -4.351 -0.277
86 HD23 LEU 10 HD23 LEU 10 3.512 -3.181 -1.021
87 H GLY 11 H GLY 11 -1.702 -1.927 -0.364
88 HA2 GLY 11 HA2 GLY 11 -1.543 0.073 -2.357
89 HA3 GLY 11 HA3 GLY 11 -3.033 -0.809 -1.946
90 H SER 12 H SER 12 -3.612 -0.024 0.667
91 HA SER 12 HA SER 12 -4.696 2.613 0.125
92 HB2 SER 12 HB2 SER 12 -5.870 0.982 1.591
93 HB3 SER 12 HB3 SER 12 -4.534 1.073 2.785
94 HG SER 12 HG SER 12 -6.285 2.620 3.278
95 H LEU 13 H LEU 13 -1.968 1.360 2.235
96 HA LEU 13 HA LEU 13 -1.624 3.969 3.447
97 HB2 LEU 13 HB2 LEU 13 0.324 1.616 3.291
98 HB3 LEU 13 HB3 LEU 13 0.588 3.069 4.280
99 HG LEU 13 HG LEU 13 -1.829 1.179 4.657
100 HD11 LEU 13 HD11 LEU 13 0.304 -0.040 5.114
101 HD12 LEU 13 HD12 LEU 13 -0.589 0.262 6.625
102 HD13 LEU 13 HD13 LEU 13 0.826 1.273 6.211
103 HD21 LEU 13 HD21 LEU 13 -1.982 2.304 6.919
104 HD22 LEU 13 HD22 LEU 13 -2.294 3.440 5.596
105 HD23 LEU 13 HD23 LEU 13 -0.707 3.450 6.420
106 H VAL 14 H VAL 14 0.354 2.225 0.861
107 HA VAL 14 HA VAL 14 2.229 4.229 0.609
108 HB VAL 14 HB VAL 14 2.195 2.032 -0.720
109 HG11 VAL 14 HG11 VAL 14 0.604 3.661 -2.814
110 HG12 VAL 14 HG12 VAL 14 1.206 1.991 -2.976
111 HG13 VAL 14 HG13 VAL 14 -0.104 2.358 -1.830
112 HG21 VAL 14 HG21 VAL 14 2.925 4.591 -2.281
113 HG22 VAL 14 HG22 VAL 14 3.958 3.781 -1.069
114 HG23 VAL 14 HG23 VAL 14 3.556 2.952 -2.594
115 H LYS 15 H LYS 15 -1.157 4.259 -0.720
116 HA LYS 15 HA LYS 15 -0.699 6.633 -2.288
117 HB2 LYS 15 HB2 LYS 15 -3.287 5.563 -1.027
118 HB3 LYS 15 HB3 LYS 15 -3.211 6.980 -2.106
119 HG2 LYS 15 HG2 LYS 15 -2.335 5.625 -3.965
120 HG3 LYS 15 HG3 LYS 15 -2.159 4.194 -2.922
121 HD2 LYS 15 HD2 LYS 15 -4.648 4.124 -2.567
122 HD3 LYS 15 HD3 LYS 15 -4.835 5.552 -3.626
123 HE2 LYS 15 HE2 LYS 15 -3.842 4.255 -5.542
124 HE3 LYS 15 HE3 LYS 15 -3.636 2.835 -4.479
125 HZ1 LYS 15 HZ1 LYS 15 -6.083 2.738 -4.157
126 HZ2 LYS 15 HZ2 LYS 15 -5.672 2.644 -5.845
127 HZ3 LYS 15 HZ3 LYS 15 -6.292 4.131 -5.187
128 H GLY 16 H GLY 16 -2.189 6.243 1.081
129 HA2 GLY 16 HA2 GLY 16 -2.350 9.043 1.494
130 HA3 GLY 16 HA3 GLY 16 -2.249 7.839 2.801
131 H ILE 17 H ILE 17 0.467 6.796 1.989
132 HA ILE 17 HA ILE 17 1.886 8.865 3.556
133 HB ILE 17 HB ILE 17 2.838 6.147 2.511
134 HG12 ILE 17 HG12 ILE 17 1.013 5.848 4.158
135 HG13 ILE 17 HG13 ILE 17 2.579 5.277 4.760
136 HG21 ILE 17 HG21 ILE 17 4.770 7.612 2.812
137 HG22 ILE 17 HG22 ILE 17 4.198 8.148 4.411
138 HG23 ILE 17 HG23 ILE 17 4.727 6.457 4.166
139 HD11 ILE 17 HD11 ILE 17 1.182 7.906 5.589
140 HD12 ILE 17 HD12 ILE 17 1.316 6.412 6.543
141 HD13 ILE 17 HD13 ILE 17 2.780 7.358 6.186
142 H ALA 18 H ALA 18 2.518 7.145 0.351
143 HA ALA 18 HA ALA 18 4.636 8.949 -0.251
144 HB1 ALA 18 HB1 ALA 18 4.354 6.722 -1.409
145 HB2 ALA 18 HB2 ALA 18 2.941 7.384 -2.293
146 HB3 ALA 18 HB3 ALA 18 4.564 8.079 -2.553
147 H ALA 19 H ALA 19 1.043 9.313 -0.670
148 HA ALA 19 HA ALA 19 0.918 10.995 -2.792
149 HB1 ALA 19 HB1 ALA 19 -1.158 10.601 -1.528
150 HB2 ALA 19 HB2 ALA 19 -0.488 11.416 -0.079
151 HB3 ALA 19 HB3 ALA 19 -0.884 12.355 -1.550
152 H HIS 20 H HIS 20 2.072 11.949 0.543
153 HA HIS 20 HA HIS 20 2.207 14.710 -0.071
154 HB2 HIS 20 HB2 HIS 20 2.581 13.491 2.255
155 HB3 HIS 20 HB3 HIS 20 4.298 13.447 1.786
156 HD1 HIS 20 HD2 HIS 20 4.814 16.154 0.673
157 HD2 HIS 20 HD3 HIS 20 2.109 15.501 3.827
158 HE1 HIS 20 HE2 HIS 20 4.583 18.381 1.853
159 H VAL 21 H VAL 21 4.694 12.047 -0.430
160 HA VAL 21 HA VAL 21 6.609 13.923 -1.615
161 HB VAL 21 HB VAL 21 6.654 10.861 -1.414
162 HG11 VAL 21 HG11 VAL 21 8.821 12.800 -2.437
163 HG12 VAL 21 HG12 VAL 21 9.055 11.059 -2.106
164 HG13 VAL 21 HG13 VAL 21 7.967 11.572 -3.417
165 HG21 VAL 21 HG21 VAL 21 8.372 11.269 0.325
166 HG22 VAL 21 HG22 VAL 21 8.210 13.035 0.118
167 HG23 VAL 21 HG23 VAL 21 6.853 12.082 0.781
168 H ALA 22 H ALA 22 4.938 10.962 -3.031
169 HA ALA 22 HA ALA 22 5.374 12.226 -5.726
170 HB1 ALA 22 HB1 ALA 22 4.645 9.344 -4.957
171 HB2 ALA 22 HB2 ALA 22 5.030 9.945 -6.597
172 HB3 ALA 22 HB3 ALA 22 6.288 9.945 -5.325
173 H SER 23 H SER 23 3.471 13.749 -4.704
174 HA SER 23 HA SER 23 1.228 14.357 -4.905
175 HB2 SER 23 HB2 SER 23 1.639 12.709 -7.476
176 HB3 SER 23 HB3 SER 23 0.396 13.974 -7.218
177 HG SER 23 HG SER 23 2.373 14.848 -8.234
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -2.318 -15.979 4.401
2 H2 GLY 1 H2 GLY 1 -3.353 -16.619 3.190
3 HA2 GLY 1 HA2 GLY 1 -0.775 -16.427 2.483
4 HA3 GLY 1 HA3 GLY 1 -2.063 -15.759 1.435
5 H LEU 2 H LEU 2 0.350 -14.544 1.133
6 HA LEU 2 HA LEU 2 0.121 -11.984 2.757
7 HB2 LEU 2 HB2 LEU 2 2.545 -13.152 1.297
8 HB3 LEU 2 HB3 LEU 2 2.527 -11.711 2.342
9 HG LEU 2 HG LEU 2 2.023 -14.615 3.268
10 HD11 LEU 2 HD11 LEU 2 4.453 -12.769 3.715
11 HD12 LEU 2 HD12 LEU 2 4.408 -14.178 2.615
12 HD13 LEU 2 HD13 LEU 2 4.253 -14.418 4.374
13 HD21 LEU 2 HD21 LEU 2 2.217 -13.645 5.607
14 HD22 LEU 2 HD22 LEU 2 0.771 -13.064 4.761
15 HD23 LEU 2 HD23 LEU 2 2.204 -12.002 4.903
16 H LYS 3 H LYS 3 -1.622 -12.566 0.540
17 HA LYS 3 HA LYS 3 -0.576 -10.473 -1.391
18 HB2 LYS 3 HB2 LYS 3 -2.200 -12.982 -1.795
19 HB3 LYS 3 HB3 LYS 3 -2.885 -11.525 -2.540
20 HG2 LYS 3 HG2 LYS 3 -1.476 -12.665 -4.161
21 HG3 LYS 3 HG3 LYS 3 -0.782 -11.073 -3.763
22 HD2 LYS 3 HD2 LYS 3 0.878 -12.230 -2.203
23 HD3 LYS 3 HD3 LYS 3 0.164 -13.800 -2.655
24 HE2 LYS 3 HE2 LYS 3 0.823 -13.386 -5.057
25 HE3 LYS 3 HE3 LYS 3 1.487 -11.792 -4.604
26 HZ1 LYS 3 HZ1 LYS 3 3.134 -12.909 -3.140
27 HZ2 LYS 3 HZ2 LYS 3 3.259 -13.480 -4.782
28 HZ3 LYS 3 HZ3 LYS 3 2.487 -14.470 -3.581
29 H GLU 4 H GLU 4 -3.843 -11.578 -0.119
30 HA GLU 4 HA GLU 4 -5.117 -9.162 -0.345
31 HB2 GLU 4 HB2 GLU 4 -5.215 -11.162 1.990
32 HB3 GLU 4 HB3 GLU 4 -6.256 -9.722 1.983
33 HG2 GLU 4 HG2 GLU 4 -6.274 -11.855 -0.240
34 HG3 GLU 4 HG3 GLU 4 -7.446 -11.740 1.097
35 H ILE 5 H ILE 5 -2.912 -10.062 2.440
36 HA ILE 5 HA ILE 5 -3.383 -7.503 3.710
37 HB ILE 5 HB ILE 5 -0.986 -9.388 4.073
38 HG12 ILE 5 HG12 ILE 5 -2.934 -10.705 4.671
39 HG13 ILE 5 HG13 ILE 5 -2.170 -10.157 6.167
40 HG21 ILE 5 HG21 ILE 5 -0.448 -7.136 4.897
41 HG22 ILE 5 HG22 ILE 5 -1.979 -7.040 5.802
42 HG23 ILE 5 HG23 ILE 5 -0.714 -8.203 6.290
43 HD11 ILE 5 HD11 ILE 5 -4.751 -9.030 4.894
44 HD12 ILE 5 HD12 ILE 5 -4.601 -9.979 6.388
45 HD13 ILE 5 HD13 ILE 5 -3.960 -8.317 6.336
46 H PHE 6 H PHE 6 -0.707 -8.745 1.526
47 HA PHE 6 HA PHE 6 0.733 -6.246 1.736
48 HB2 PHE 6 HB2 PHE 6 0.833 -8.420 -0.434
49 HB3 PHE 6 HB3 PHE 6 1.822 -6.941 -0.433
50 HD1 PHE 6 HD1 PHE 6 1.335 -8.278 2.986
51 HD2 PHE 6 HD2 PHE 6 3.627 -8.696 -0.643
52 HE1 PHE 6 HE1 PHE 6 3.134 -9.367 4.243
53 HE2 PHE 6 HE2 PHE 6 5.433 -9.790 0.637
54 HZ PHE 6 HZ PHE 6 5.200 -10.117 3.090
55 H LYS 7 H LYS 7 -1.281 -7.491 -1.091
56 HA LYS 7 HA LYS 7 -1.017 -5.058 -2.456
57 HB2 LYS 7 HB2 LYS 7 -2.792 -5.797 -3.953
58 HB3 LYS 7 HB3 LYS 7 -1.758 -7.170 -3.494
59 HG2 LYS 7 HG2 LYS 7 -3.653 -7.555 -1.611
60 HG3 LYS 7 HG3 LYS 7 -4.661 -6.564 -2.661
61 HD2 LYS 7 HD2 LYS 7 -3.179 -9.190 -3.352
62 HD3 LYS 7 HD3 LYS 7 -4.927 -9.046 -3.056
63 HE2 LYS 7 HE2 LYS 7 -3.403 -7.795 -5.438
64 HE3 LYS 7 HE3 LYS 7 -4.374 -9.283 -5.475
65 HZ1 LYS 7 HZ1 LYS 7 -5.431 -6.487 -4.949
66 HZ2 LYS 7 HZ2 LYS 7 -6.378 -7.951 -4.820
67 HZ3 LYS 7 HZ3 LYS 7 -5.695 -7.468 -6.347
68 H ALA 8 H ALA 8 -3.546 -5.924 0.042
69 HA ALA 8 HA ALA 8 -5.049 -3.493 -0.628
70 HB1 ALA 8 HB1 ALA 8 -6.429 -3.987 1.340
71 HB2 ALA 8 HB2 ALA 8 -6.190 -5.482 0.385
72 HB3 ALA 8 HB3 ALA 8 -5.281 -5.227 1.906
73 H GLY 9 H GLY 9 -2.853 -4.567 2.112
74 HA2 GLY 9 HA2 GLY 9 -3.089 -2.169 3.596
75 HA3 GLY 9 HA3 GLY 9 -1.667 -3.239 3.651
76 H LEU 10 H LEU 10 -0.293 -3.112 1.373
77 HA LEU 10 HA LEU 10 0.723 -0.446 1.529
78 HB2 LEU 10 HB2 LEU 10 2.400 -1.013 -0.045
79 HB3 LEU 10 HB3 LEU 10 2.077 -2.447 0.941
80 HG LEU 10 HG LEU 10 0.427 -3.055 -1.156
81 HD11 LEU 10 HD11 LEU 10 2.581 -1.317 -2.516
82 HD12 LEU 10 HD12 LEU 10 0.861 -0.875 -2.413
83 HD13 LEU 10 HD13 LEU 10 1.349 -2.313 -3.336
84 HD21 LEU 10 HD21 LEU 10 2.341 -4.461 -0.398
85 HD22 LEU 10 HD22 LEU 10 3.485 -3.391 -1.258
86 HD23 LEU 10 HD23 LEU 10 2.297 -4.364 -2.176
87 H GLY 11 H GLY 11 -1.702 -1.969 -0.715
88 HA2 GLY 11 HA2 GLY 11 -1.561 0.021 -2.734
89 HA3 GLY 11 HA3 GLY 11 -3.043 -0.873 -2.315
90 H SER 12 H SER 12 -3.456 -0.025 0.397
91 HA SER 12 HA SER 12 -4.647 2.585 -0.212
92 HB2 SER 12 HB2 SER 12 -5.797 0.908 1.222
93 HB3 SER 12 HB3 SER 12 -4.519 1.051 2.460
94 HG SER 12 HG SER 12 -5.191 3.344 2.625
95 H LEU 13 H LEU 13 -1.988 1.361 2.004
96 HA LEU 13 HA LEU 13 -1.658 3.962 3.200
97 HB2 LEU 13 HB2 LEU 13 0.313 1.621 3.008
98 HB3 LEU 13 HB3 LEU 13 0.573 3.057 4.023
99 HG LEU 13 HG LEU 13 -1.818 1.140 4.404
100 HD11 LEU 13 HD11 LEU 13 0.343 -0.044 4.835
101 HD12 LEU 13 HD12 LEU 13 -0.544 0.236 6.354
102 HD13 LEU 13 HD13 LEU 13 0.850 1.273 5.934
103 HD21 LEU 13 HD21 LEU 13 -0.715 3.421 6.163
104 HD22 LEU 13 HD22 LEU 13 -1.969 2.256 6.668
105 HD23 LEU 13 HD23 LEU 13 -2.308 3.391 5.351
106 H VAL 14 H VAL 14 0.117 2.315 0.438
107 HA VAL 14 HA VAL 14 2.126 4.246 0.296
108 HB VAL 14 HB VAL 14 2.023 2.149 -1.141
109 HG11 VAL 14 HG11 VAL 14 0.345 3.880 -3.088
110 HG12 VAL 14 HG12 VAL 14 0.916 2.210 -3.345
111 HG13 VAL 14 HG13 VAL 14 -0.329 2.548 -2.120
112 HG21 VAL 14 HG21 VAL 14 3.303 3.137 -3.031
113 HG22 VAL 14 HG22 VAL 14 2.694 4.765 -2.627
114 HG23 VAL 14 HG23 VAL 14 3.774 3.904 -1.492
115 H LYS 15 H LYS 15 -1.299 4.458 -0.923
116 HA LYS 15 HA LYS 15 -0.789 6.927 -2.342
117 HB2 LYS 15 HB2 LYS 15 -3.413 5.866 -1.136
118 HB3 LYS 15 HB3 LYS 15 -3.272 7.324 -2.153
119 HG2 LYS 15 HG2 LYS 15 -2.390 5.973 -4.048
120 HG3 LYS 15 HG3 LYS 15 -2.425 4.491 -3.055
121 HD2 LYS 15 HD2 LYS 15 -4.914 4.682 -2.820
122 HD3 LYS 15 HD3 LYS 15 -4.897 6.178 -3.798
123 HE2 LYS 15 HE2 LYS 15 -3.967 4.891 -5.751
124 HE3 LYS 15 HE3 LYS 15 -3.976 3.396 -4.774
125 HZ1 LYS 15 HZ1 LYS 15 -6.432 3.575 -4.557
126 HZ2 LYS 15 HZ2 LYS 15 -5.955 3.532 -6.231
127 HZ3 LYS 15 HZ3 LYS 15 -6.426 5.041 -5.502
128 H GLY 16 H GLY 16 -2.202 6.266 1.006
129 HA2 GLY 16 HA2 GLY 16 -2.439 8.989 1.688
130 HA3 GLY 16 HA3 GLY 16 -2.169 7.687 2.874
131 H ILE 17 H ILE 17 0.509 6.865 1.792
132 HA ILE 17 HA ILE 17 1.957 8.930 3.362
133 HB ILE 17 HB ILE 17 2.861 6.221 2.256
134 HG12 ILE 17 HG12 ILE 17 2.183 7.104 5.134
135 HG13 ILE 17 HG13 ILE 17 1.102 6.157 4.086
136 HG21 ILE 17 HG21 ILE 17 4.337 8.161 4.142
137 HG22 ILE 17 HG22 ILE 17 4.928 6.560 3.611
138 HG23 ILE 17 HG23 ILE 17 4.769 7.870 2.434
139 HD11 ILE 17 HD11 ILE 17 2.875 4.334 3.944
140 HD12 ILE 17 HD12 ILE 17 3.816 5.214 5.188
141 HD13 ILE 17 HD13 ILE 17 2.196 4.597 5.576
142 H ALA 18 H ALA 18 2.487 7.247 0.120
143 HA ALA 18 HA ALA 18 4.570 9.013 -0.558
144 HB1 ALA 18 HB1 ALA 18 4.362 8.209 -2.877
145 HB2 ALA 18 HB2 ALA 18 4.153 6.833 -1.758
146 HB3 ALA 18 HB3 ALA 18 2.726 7.566 -2.560
147 H ALA 19 H ALA 19 0.964 9.393 -1.060
148 HA ALA 19 HA ALA 19 0.882 11.266 -3.023
149 HB1 ALA 19 HB1 ALA 19 -0.983 12.462 -1.756
150 HB2 ALA 19 HB2 ALA 19 -1.194 10.694 -1.820
151 HB3 ALA 19 HB3 ALA 19 -0.588 11.468 -0.319
152 H HIS 20 H HIS 20 1.949 11.998 0.424
153 HA HIS 20 HA HIS 20 2.096 14.790 -0.037
154 HB2 HIS 20 HB2 HIS 20 2.389 13.544 2.224
155 HB3 HIS 20 HB3 HIS 20 4.106 13.351 1.790
156 HD1 HIS 20 HD2 HIS 20 5.040 15.942 0.855
157 HD2 HIS 20 HD3 HIS 20 1.952 15.653 3.694
158 HE1 HIS 20 HE2 HIS 20 4.966 18.185 2.019
159 H VAL 21 H VAL 21 4.644 12.178 -0.437
160 HA VAL 21 HA VAL 21 6.506 14.122 -1.599
161 HB VAL 21 HB VAL 21 6.633 11.063 -1.422
162 HG11 VAL 21 HG11 VAL 21 7.915 11.821 -3.432
163 HG12 VAL 21 HG12 VAL 21 8.743 13.064 -2.450
164 HG13 VAL 21 HG13 VAL 21 9.027 11.329 -2.133
165 HG21 VAL 21 HG21 VAL 21 8.142 13.269 0.109
166 HG22 VAL 21 HG22 VAL 21 6.811 12.280 0.774
167 HG23 VAL 21 HG23 VAL 21 8.349 11.506 0.312
168 H ALA 22 H ALA 22 4.980 11.113 -3.106
169 HA ALA 22 HA ALA 22 5.354 12.396 -5.746
170 HB1 ALA 22 HB1 ALA 22 5.922 9.991 -5.438
171 HB2 ALA 22 HB2 ALA 22 4.225 9.637 -4.999
172 HB3 ALA 22 HB3 ALA 22 4.619 10.218 -6.644
173 H SER 23 H SER 23 3.756 14.219 -4.877
174 HA SER 23 HA SER 23 0.946 13.484 -4.771
175 HB2 SER 23 HB2 SER 23 0.442 15.834 -4.975
176 HB3 SER 23 HB3 SER 23 1.866 15.728 -3.905
177 HG SER 23 HG SER 23 3.123 16.327 -5.880
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -3.195 -15.553 4.656
2 H2 GLY 1 H2 GLY 1 -3.169 -15.827 2.981
3 HA2 GLY 1 HA2 GLY 1 -0.926 -16.583 4.777
4 HA3 GLY 1 HA3 GLY 1 -0.902 -16.505 3.000
5 H LEU 2 H LEU 2 -0.225 -14.460 2.015
6 HA LEU 2 HA LEU 2 -0.301 -12.021 3.684
7 HB2 LEU 2 HB2 LEU 2 2.124 -11.616 3.534
8 HB3 LEU 2 HB3 LEU 2 1.798 -13.042 4.523
9 HG LEU 2 HG LEU 2 2.340 -13.517 1.551
10 HD11 LEU 2 HD11 LEU 2 4.109 -11.901 2.092
11 HD12 LEU 2 HD12 LEU 2 4.821 -13.525 1.945
12 HD13 LEU 2 HD13 LEU 2 4.556 -12.814 3.566
13 HD21 LEU 2 HD21 LEU 2 1.818 -15.470 3.109
14 HD22 LEU 2 HD22 LEU 2 3.250 -15.039 4.077
15 HD23 LEU 2 HD23 LEU 2 3.437 -15.577 2.386
16 H LYS 3 H LYS 3 -1.683 -12.690 1.284
17 HA LYS 3 HA LYS 3 -0.222 -10.941 -0.700
18 HB2 LYS 3 HB2 LYS 3 -0.777 -13.247 -1.462
19 HB3 LYS 3 HB3 LYS 3 -2.509 -12.932 -1.184
20 HG2 LYS 3 HG2 LYS 3 -2.431 -11.028 -2.844
21 HG3 LYS 3 HG3 LYS 3 -0.684 -11.325 -3.079
22 HD2 LYS 3 HD2 LYS 3 -1.185 -13.618 -3.972
23 HD3 LYS 3 HD3 LYS 3 -2.924 -13.356 -3.675
24 HE2 LYS 3 HE2 LYS 3 -2.433 -13.033 -6.053
25 HE3 LYS 3 HE3 LYS 3 -2.948 -11.482 -5.343
26 HZ1 LYS 3 HZ1 LYS 3 -0.998 -11.321 -6.911
27 HZ2 LYS 3 HZ2 LYS 3 -0.047 -12.268 -5.809
28 HZ3 LYS 3 HZ3 LYS 3 -0.639 -10.683 -5.356
29 H GLU 4 H GLU 4 -3.633 -11.630 0.568
30 HA GLU 4 HA GLU 4 -4.606 -9.117 -0.450
31 HB2 GLU 4 HB2 GLU 4 -5.602 -10.835 1.910
32 HB3 GLU 4 HB3 GLU 4 -6.406 -9.345 1.357
33 HG2 GLU 4 HG2 GLU 4 -7.511 -11.347 0.379
34 HG3 GLU 4 HG3 GLU 4 -6.821 -10.300 -0.885
35 H ILE 5 H ILE 5 -3.153 -10.134 2.761
36 HA ILE 5 HA ILE 5 -3.553 -7.580 3.978
37 HB ILE 5 HB ILE 5 -1.368 -9.672 4.486
38 HG12 ILE 5 HG12 ILE 5 -3.902 -8.942 6.110
39 HG13 ILE 5 HG13 ILE 5 -3.801 -10.314 4.987
40 HG21 ILE 5 HG21 ILE 5 -0.848 -8.423 6.602
41 HG22 ILE 5 HG22 ILE 5 -0.537 -7.405 5.200
42 HG23 ILE 5 HG23 ILE 5 -2.029 -7.162 6.147
43 HD11 ILE 5 HD11 ILE 5 -2.214 -10.021 7.607
44 HD12 ILE 5 HD12 ILE 5 -3.488 -11.192 7.215
45 HD13 ILE 5 HD13 ILE 5 -1.911 -11.292 6.382
46 H PHE 6 H PHE 6 -0.686 -8.913 2.089
47 HA PHE 6 HA PHE 6 0.783 -6.453 2.405
48 HB2 PHE 6 HB2 PHE 6 1.034 -8.691 0.309
49 HB3 PHE 6 HB3 PHE 6 1.985 -7.191 0.256
50 HD1 PHE 6 HD2 PHE 6 1.264 -8.590 3.652
51 HD2 PHE 6 HD1 PHE 6 3.983 -8.624 0.310
52 HE1 PHE 6 HE2 PHE 6 3.062 -9.390 5.118
53 HE2 PHE 6 HE1 PHE 6 5.781 -9.440 1.790
54 HZ PHE 6 HZ PHE 6 5.331 -9.819 4.204
55 H LYS 7 H LYS 7 -1.091 -7.691 -0.517
56 HA LYS 7 HA LYS 7 -0.464 -5.325 -1.930
57 HB2 LYS 7 HB2 LYS 7 -1.226 -7.519 -2.919
58 HB3 LYS 7 HB3 LYS 7 -2.909 -7.105 -2.521
59 HG2 LYS 7 HG2 LYS 7 -1.036 -5.370 -4.280
60 HG3 LYS 7 HG3 LYS 7 -2.082 -6.659 -4.924
61 HD2 LYS 7 HD2 LYS 7 -4.121 -5.500 -4.284
62 HD3 LYS 7 HD3 LYS 7 -3.227 -4.250 -3.395
63 HE2 LYS 7 HE2 LYS 7 -3.960 -3.374 -5.557
64 HE3 LYS 7 HE3 LYS 7 -2.183 -3.387 -5.444
65 HZ1 LYS 7 HZ1 LYS 7 -3.811 -5.513 -6.875
66 HZ2 LYS 7 HZ2 LYS 7 -2.068 -5.325 -6.916
67 HZ3 LYS 7 HZ3 LYS 7 -3.074 -4.140 -7.651
68 H ALA 8 H ALA 8 -3.638 -6.222 -0.242
69 HA ALA 8 HA ALA 8 -4.813 -3.709 -0.875
70 HB1 ALA 8 HB1 ALA 8 -6.448 -4.131 0.925
71 HB2 ALA 8 HB2 ALA 8 -6.154 -5.644 0.018
72 HB3 ALA 8 HB3 ALA 8 -5.418 -5.402 1.631
73 H GLY 9 H GLY 9 -2.915 -4.777 2.078
74 HA2 GLY 9 HA2 GLY 9 -3.357 -2.396 3.553
75 HA3 GLY 9 HA3 GLY 9 -1.931 -3.442 3.748
76 H LEU 10 H LEU 10 -0.301 -3.265 1.684
77 HA LEU 10 HA LEU 10 0.665 -0.606 1.923
78 HB2 LEU 10 HB2 LEU 10 2.443 -1.146 0.424
79 HB3 LEU 10 HB3 LEU 10 2.076 -2.584 1.391
80 HG LEU 10 HG LEU 10 0.542 -3.197 -0.785
81 HD11 LEU 10 HD11 LEU 10 1.047 -1.025 -2.031
82 HD12 LEU 10 HD12 LEU 10 1.577 -2.471 -2.915
83 HD13 LEU 10 HD13 LEU 10 2.768 -1.472 -2.040
84 HD21 LEU 10 HD21 LEU 10 2.457 -4.511 -1.703
85 HD22 LEU 10 HD22 LEU 10 2.408 -4.608 0.075
86 HD23 LEU 10 HD23 LEU 10 3.597 -3.540 -0.725
87 H GLY 11 H GLY 11 -1.602 -2.079 -0.482
88 HA2 GLY 11 HA2 GLY 11 -1.315 -0.091 -2.495
89 HA3 GLY 11 HA3 GLY 11 -2.814 -0.997 -2.178
90 H SER 12 H SER 12 -3.542 -0.222 0.418
91 HA SER 12 HA SER 12 -4.698 2.356 -0.188
92 HB2 SER 12 HB2 SER 12 -5.824 0.718 1.309
93 HB3 SER 12 HB3 SER 12 -4.508 0.892 2.515
94 HG SER 12 HG SER 12 -6.324 2.377 2.953
95 H LEU 13 H LEU 13 -1.950 1.281 1.992
96 HA LEU 13 HA LEU 13 -1.729 3.940 3.129
97 HB2 LEU 13 HB2 LEU 13 0.317 1.662 3.081
98 HB3 LEU 13 HB3 LEU 13 0.486 3.150 4.039
99 HG LEU 13 HG LEU 13 -1.824 1.126 4.406
100 HD11 LEU 13 HD11 LEU 13 0.373 0.087 4.976
101 HD12 LEU 13 HD12 LEU 13 -0.597 0.372 6.443
102 HD13 LEU 13 HD13 LEU 13 0.758 1.468 6.046
103 HD21 LEU 13 HD21 LEU 13 -2.488 3.373 5.242
104 HD22 LEU 13 HD22 LEU 13 -0.932 3.539 6.109
105 HD23 LEU 13 HD23 LEU 13 -2.131 2.319 6.619
106 H VAL 14 H VAL 14 0.314 2.179 0.614
107 HA VAL 14 HA VAL 14 2.145 4.242 0.359
108 HB VAL 14 HB VAL 14 2.259 1.995 -0.858
109 HG11 VAL 14 HG11 VAL 14 0.644 3.430 -3.075
110 HG12 VAL 14 HG12 VAL 14 1.324 1.783 -3.129
111 HG13 VAL 14 HG13 VAL 14 -0.023 2.156 -2.029
112 HG21 VAL 14 HG21 VAL 14 3.624 2.872 -2.740
113 HG22 VAL 14 HG22 VAL 14 2.903 4.491 -2.546
114 HG23 VAL 14 HG23 VAL 14 3.937 3.810 -1.257
115 H LYS 15 H LYS 15 -1.204 4.084 -1.051
116 HA LYS 15 HA LYS 15 -0.811 6.355 -2.762
117 HB2 LYS 15 HB2 LYS 15 -3.362 5.316 -1.404
118 HB3 LYS 15 HB3 LYS 15 -3.321 6.686 -2.546
119 HG2 LYS 15 HG2 LYS 15 -2.553 5.278 -4.378
120 HG3 LYS 15 HG3 LYS 15 -2.163 3.932 -3.289
121 HD2 LYS 15 HD2 LYS 15 -4.221 3.426 -4.519
122 HD3 LYS 15 HD3 LYS 15 -4.576 3.564 -2.779
123 HE2 LYS 15 HE2 LYS 15 -5.518 5.855 -3.123
124 HE3 LYS 15 HE3 LYS 15 -5.057 5.804 -4.849
125 HZ1 LYS 15 HZ1 LYS 15 -6.606 3.904 -5.177
126 HZ2 LYS 15 HZ2 LYS 15 -7.440 5.277 -4.516
127 HZ3 LYS 15 HZ3 LYS 15 -7.028 3.937 -3.483
128 H GLY 16 H GLY 16 -2.277 6.193 0.633
129 HA2 GLY 16 HA2 GLY 16 -2.492 9.029 0.798
130 HA3 GLY 16 HA3 GLY 16 -2.438 7.933 2.199
131 H ILE 17 H ILE 17 0.274 6.814 1.649
132 HA ILE 17 HA ILE 17 1.642 8.985 3.083
133 HB ILE 17 HB ILE 17 2.660 6.236 2.190
134 HG12 ILE 17 HG12 ILE 17 0.823 6.000 3.840
135 HG13 ILE 17 HG13 ILE 17 2.391 5.475 4.475
136 HG21 ILE 17 HG21 ILE 17 3.973 8.356 3.989
137 HG22 ILE 17 HG22 ILE 17 4.525 6.660 3.852
138 HG23 ILE 17 HG23 ILE 17 4.571 7.733 2.433
139 HD11 ILE 17 HD11 ILE 17 1.110 6.685 6.197
140 HD12 ILE 17 HD12 ILE 17 2.570 7.621 5.801
141 HD13 ILE 17 HD13 ILE 17 0.972 8.130 5.172
142 H ALA 18 H ALA 18 2.344 7.141 -0.029
143 HA ALA 18 HA ALA 18 4.507 8.877 -0.640
144 HB1 ALA 18 HB1 ALA 18 4.489 7.928 -2.900
145 HB2 ALA 18 HB2 ALA 18 4.197 6.620 -1.721
146 HB3 ALA 18 HB3 ALA 18 2.837 7.289 -2.680
147 H ALA 19 H ALA 19 0.932 9.204 -1.327
148 HA ALA 19 HA ALA 19 0.920 10.967 -3.399
149 HB1 ALA 19 HB1 ALA 19 -0.972 12.240 -2.243
150 HB2 ALA 19 HB2 ALA 19 -1.203 10.477 -2.237
151 HB3 ALA 19 HB3 ALA 19 -0.635 11.305 -0.754
152 H HIS 20 H HIS 20 1.862 11.860 0.042
153 HA HIS 20 HA HIS 20 2.037 14.629 -0.541
154 HB2 HIS 20 HB2 HIS 20 2.190 13.535 1.783
155 HB3 HIS 20 HB3 HIS 20 3.913 13.222 1.455
156 HD1 HIS 20 HD2 HIS 20 5.122 15.645 0.529
157 HD2 HIS 20 HD3 HIS 20 1.718 15.803 2.993
158 HE1 HIS 20 HE2 HIS 20 5.104 17.969 1.522
159 H VAL 21 H VAL 21 4.610 12.010 -0.685
160 HA VAL 21 HA VAL 21 6.513 13.933 -1.829
161 HB VAL 21 HB VAL 21 6.701 10.895 -1.451
162 HG11 VAL 21 HG11 VAL 21 8.827 12.896 -2.445
163 HG12 VAL 21 HG12 VAL 21 9.130 11.190 -2.005
164 HG13 VAL 21 HG13 VAL 21 8.100 11.574 -3.406
165 HG21 VAL 21 HG21 VAL 21 8.035 13.235 0.046
166 HG22 VAL 21 HG22 VAL 21 6.685 12.244 0.670
167 HG23 VAL 21 HG23 VAL 21 8.275 11.495 0.368
168 H ALA 22 H ALA 22 5.130 10.803 -3.222
169 HA ALA 22 HA ALA 22 5.666 11.865 -5.918
170 HB1 ALA 22 HB1 ALA 22 4.812 9.680 -6.694
171 HB2 ALA 22 HB2 ALA 22 6.034 9.453 -5.406
172 HB3 ALA 22 HB3 ALA 22 4.295 9.257 -5.035
173 H SER 23 H SER 23 4.182 13.855 -5.364
174 HA SER 23 HA SER 23 1.299 13.287 -5.323
175 HB2 SER 23 HB2 SER 23 2.233 15.408 -4.379
176 HB3 SER 23 HB3 SER 23 2.778 15.888 -6.019
177 HG SER 23 HG SER 23 0.602 16.731 -5.518
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -3.273 -16.449 1.935
2 H2 GLY 1 H2 GLY 1 -2.451 -15.039 1.374
3 HA2 GLY 1 HA2 GLY 1 -3.143 -15.446 4.216
4 HA3 GLY 1 HA3 GLY 1 -1.552 -16.076 3.714
5 H LEU 2 H LEU 2 0.082 -14.515 2.869
6 HA LEU 2 HA LEU 2 -0.332 -11.824 4.015
7 HB2 LEU 2 HB2 LEU 2 1.990 -11.433 3.593
8 HB3 LEU 2 HB3 LEU 2 1.808 -13.030 4.323
9 HG LEU 2 HG LEU 2 1.731 -13.373 1.393
10 HD11 LEU 2 HD11 LEU 2 3.945 -12.504 0.724
11 HD12 LEU 2 HD12 LEU 2 4.176 -11.774 2.337
12 HD13 LEU 2 HD13 LEU 2 2.887 -11.167 1.249
13 HD21 LEU 2 HD21 LEU 2 2.488 -15.123 3.029
14 HD22 LEU 2 HD22 LEU 2 3.928 -14.136 3.413
15 HD23 LEU 2 HD23 LEU 2 3.713 -14.810 1.772
16 H LYS 3 H LYS 3 -1.040 -13.203 0.880
17 HA LYS 3 HA LYS 3 -0.045 -10.999 -0.684
18 HB2 LYS 3 HB2 LYS 3 -0.729 -13.247 -1.631
19 HB3 LYS 3 HB3 LYS 3 -2.437 -12.822 -1.347
20 HG2 LYS 3 HG2 LYS 3 -2.104 -10.776 -2.868
21 HG3 LYS 3 HG3 LYS 3 -0.434 -11.335 -3.154
22 HD2 LYS 3 HD2 LYS 3 -1.410 -13.539 -4.070
23 HD3 LYS 3 HD3 LYS 3 -3.035 -12.850 -3.828
24 HE2 LYS 3 HE2 LYS 3 -2.510 -12.583 -6.159
25 HE3 LYS 3 HE3 LYS 3 -2.398 -10.956 -5.439
26 HZ1 LYS 3 HZ1 LYS 3 -0.042 -12.798 -6.022
27 HZ2 LYS 3 HZ2 LYS 3 0.074 -11.148 -5.456
28 HZ3 LYS 3 HZ3 LYS 3 -0.554 -11.480 -7.025
29 H GLU 4 H GLU 4 -3.352 -11.766 0.726
30 HA GLU 4 HA GLU 4 -4.552 -9.368 -0.278
31 HB2 GLU 4 HB2 GLU 4 -5.240 -10.970 2.267
32 HB3 GLU 4 HB3 GLU 4 -6.221 -9.626 1.618
33 HG2 GLU 4 HG2 GLU 4 -6.588 -10.874 -0.515
34 HG3 GLU 4 HG3 GLU 4 -5.625 -12.245 0.099
35 H ILE 5 H ILE 5 -2.825 -10.110 2.867
36 HA ILE 5 HA ILE 5 -3.390 -7.511 3.962
37 HB ILE 5 HB ILE 5 -0.981 -9.328 4.536
38 HG12 ILE 5 HG12 ILE 5 -2.962 -10.628 5.107
39 HG13 ILE 5 HG13 ILE 5 -2.240 -10.029 6.602
40 HG21 ILE 5 HG21 ILE 5 -0.481 -7.057 5.292
41 HG22 ILE 5 HG22 ILE 5 -2.066 -6.899 6.087
42 HG23 ILE 5 HG23 ILE 5 -0.847 -8.040 6.721
43 HD11 ILE 5 HD11 ILE 5 -4.032 -8.185 6.660
44 HD12 ILE 5 HD12 ILE 5 -4.782 -8.943 5.220
45 HD13 ILE 5 HD13 ILE 5 -4.678 -9.842 6.748
46 H PHE 6 H PHE 6 -0.671 -8.740 1.863
47 HA PHE 6 HA PHE 6 0.762 -6.232 2.052
48 HB2 PHE 6 HB2 PHE 6 0.890 -8.499 -0.016
49 HB3 PHE 6 HB3 PHE 6 1.758 -6.960 -0.197
50 HD1 PHE 6 HD2 PHE 6 1.374 -8.368 3.269
51 HD2 PHE 6 HD1 PHE 6 3.859 -8.226 -0.251
52 HE1 PHE 6 HE2 PHE 6 3.289 -9.139 4.586
53 HE2 PHE 6 HE1 PHE 6 5.781 -8.999 1.090
54 HZ PHE 6 HZ PHE 6 5.511 -9.437 3.520
55 H LYS 7 H LYS 7 -1.216 -7.509 -0.789
56 HA LYS 7 HA LYS 7 -1.201 -5.074 -2.134
57 HB2 LYS 7 HB2 LYS 7 -3.299 -7.306 -2.007
58 HB3 LYS 7 HB3 LYS 7 -3.632 -5.863 -2.980
59 HG2 LYS 7 HG2 LYS 7 -1.053 -7.477 -3.400
60 HG3 LYS 7 HG3 LYS 7 -2.582 -7.896 -4.213
61 HD2 LYS 7 HD2 LYS 7 -2.729 -5.643 -5.255
62 HD3 LYS 7 HD3 LYS 7 -1.210 -5.141 -4.474
63 HE2 LYS 7 HE2 LYS 7 0.039 -6.909 -5.710
64 HE3 LYS 7 HE3 LYS 7 -1.477 -7.467 -6.473
65 HZ1 LYS 7 HZ1 LYS 7 -0.273 -4.693 -6.792
66 HZ2 LYS 7 HZ2 LYS 7 -1.741 -5.260 -7.546
67 HZ3 LYS 7 HZ3 LYS 7 -0.212 -5.970 -7.968
68 H ALA 8 H ALA 8 -3.831 -6.126 0.219
69 HA ALA 8 HA ALA 8 -5.261 -3.685 -0.142
70 HB1 ALA 8 HB1 ALA 8 -5.215 -5.469 2.375
71 HB2 ALA 8 HB2 ALA 8 -6.429 -4.218 1.988
72 HB3 ALA 8 HB3 ALA 8 -6.291 -5.676 0.962
73 H GLY 9 H GLY 9 -2.790 -4.660 2.387
74 HA2 GLY 9 HA2 GLY 9 -3.055 -2.238 3.874
75 HA3 GLY 9 HA3 GLY 9 -1.630 -3.298 3.910
76 H LEU 10 H LEU 10 -0.217 -3.178 1.712
77 HA LEU 10 HA LEU 10 0.741 -0.504 1.826
78 HB2 LEU 10 HB2 LEU 10 2.449 -1.072 0.271
79 HB3 LEU 10 HB3 LEU 10 2.144 -2.482 1.297
80 HG LEU 10 HG LEU 10 0.515 -3.178 -0.786
81 HD11 LEU 10 HD11 LEU 10 2.682 -1.488 -2.183
82 HD12 LEU 10 HD12 LEU 10 0.957 -1.054 -2.121
83 HD13 LEU 10 HD13 LEU 10 1.467 -2.525 -2.978
84 HD21 LEU 10 HD21 LEU 10 2.396 -4.523 -1.721
85 HD22 LEU 10 HD22 LEU 10 2.419 -4.541 0.061
86 HD23 LEU 10 HD23 LEU 10 3.574 -3.510 -0.832
87 H GLY 11 H GLY 11 -1.632 -2.045 -0.446
88 HA2 GLY 11 HA2 GLY 11 -1.427 -0.046 -2.471
89 HA3 GLY 11 HA3 GLY 11 -2.897 -0.985 -2.123
90 H SER 12 H SER 12 -3.478 -0.196 0.560
91 HA SER 12 HA SER 12 -4.719 2.370 -0.040
92 HB2 SER 12 HB2 SER 12 -5.817 0.695 1.433
93 HB3 SER 12 HB3 SER 12 -4.501 0.869 2.638
94 HG SER 12 HG SER 12 -6.331 2.327 3.100
95 H LEU 13 H LEU 13 -1.943 1.281 2.095
96 HA LEU 13 HA LEU 13 -1.737 3.920 3.287
97 HB2 LEU 13 HB2 LEU 13 0.306 1.640 3.167
98 HB3 LEU 13 HB3 LEU 13 0.492 3.101 4.158
99 HG LEU 13 HG LEU 13 -1.833 1.100 4.516
100 HD11 LEU 13 HD11 LEU 13 0.358 0.011 5.020
101 HD12 LEU 13 HD12 LEU 13 -0.576 0.279 6.513
102 HD13 LEU 13 HD13 LEU 13 0.789 1.362 6.111
103 HD21 LEU 13 HD21 LEU 13 -2.437 3.341 5.416
104 HD22 LEU 13 HD22 LEU 13 -0.865 3.453 6.261
105 HD23 LEU 13 HD23 LEU 13 -2.080 2.245 6.760
106 H VAL 14 H VAL 14 0.126 2.259 0.586
107 HA VAL 14 HA VAL 14 2.059 4.261 0.406
108 HB VAL 14 HB VAL 14 2.059 2.117 -0.957
109 HG11 VAL 14 HG11 VAL 14 0.992 2.065 -3.183
110 HG12 VAL 14 HG12 VAL 14 -0.278 2.369 -1.976
111 HG13 VAL 14 HG13 VAL 14 0.334 3.710 -2.973
112 HG21 VAL 14 HG21 VAL 14 2.645 4.701 -2.532
113 HG22 VAL 14 HG22 VAL 14 3.741 3.935 -1.346
114 HG23 VAL 14 HG23 VAL 14 3.331 3.089 -2.860
115 H LYS 15 H LYS 15 -1.352 4.297 -0.877
116 HA LYS 15 HA LYS 15 -1.020 6.740 -2.331
117 HB2 LYS 15 HB2 LYS 15 -3.491 5.624 -0.879
118 HB3 LYS 15 HB3 LYS 15 -3.506 7.125 -1.833
119 HG2 LYS 15 HG2 LYS 15 -2.909 5.951 -3.877
120 HG3 LYS 15 HG3 LYS 15 -2.614 4.420 -3.015
121 HD2 LYS 15 HD2 LYS 15 -4.966 4.219 -2.367
122 HD3 LYS 15 HD3 LYS 15 -5.373 5.812 -3.053
123 HE2 LYS 15 HE2 LYS 15 -4.298 3.474 -4.753
124 HE3 LYS 15 HE3 LYS 15 -6.032 3.761 -4.459
125 HZ1 LYS 15 HZ1 LYS 15 -5.400 4.725 -6.586
126 HZ2 LYS 15 HZ2 LYS 15 -4.173 5.706 -5.869
127 HZ3 LYS 15 HZ3 LYS 15 -5.852 5.991 -5.490
128 H GLY 16 H GLY 16 -2.244 6.238 1.128
129 HA2 GLY 16 HA2 GLY 16 -2.410 9.016 1.632
130 HA3 GLY 16 HA3 GLY 16 -2.192 7.780 2.895
131 H ILE 17 H ILE 17 0.465 6.805 1.873
132 HA ILE 17 HA ILE 17 1.948 8.877 3.385
133 HB ILE 17 HB ILE 17 2.821 6.128 2.351
134 HG12 ILE 17 HG12 ILE 17 2.101 7.096 5.193
135 HG13 ILE 17 HG13 ILE 17 1.045 6.115 4.153
136 HG21 ILE 17 HG21 ILE 17 4.748 7.758 2.515
137 HG22 ILE 17 HG22 ILE 17 4.304 8.083 4.213
138 HG23 ILE 17 HG23 ILE 17 4.874 6.465 3.712
139 HD11 ILE 17 HD11 ILE 17 2.109 4.604 5.714
140 HD12 ILE 17 HD12 ILE 17 2.832 4.294 4.109
141 HD13 ILE 17 HD13 ILE 17 3.735 5.219 5.349
142 H ALA 18 H ALA 18 2.445 7.117 0.181
143 HA ALA 18 HA ALA 18 4.577 8.874 -0.512
144 HB1 ALA 18 HB1 ALA 18 2.779 7.340 -2.486
145 HB2 ALA 18 HB2 ALA 18 4.405 8.001 -2.809
146 HB3 ALA 18 HB3 ALA 18 4.211 6.657 -1.649
147 H ALA 19 H ALA 19 0.974 9.213 -1.006
148 HA ALA 19 HA ALA 19 0.885 10.947 -3.113
149 HB1 ALA 19 HB1 ALA 19 -0.610 11.274 -0.437
150 HB2 ALA 19 HB2 ALA 19 -0.985 12.235 -1.897
151 HB3 ALA 19 HB3 ALA 19 -1.207 10.471 -1.925
152 H HIS 20 H HIS 20 1.857 11.921 0.293
153 HA HIS 20 HA HIS 20 1.977 14.679 -0.318
154 HB2 HIS 20 HB2 HIS 20 2.170 13.640 2.006
155 HB3 HIS 20 HB3 HIS 20 3.883 13.283 1.661
156 HD1 HIS 20 HD2 HIS 20 5.295 15.538 0.961
157 HD2 HIS 20 HD3 HIS 20 1.583 16.067 2.863
158 HE1 HIS 20 HE2 HIS 20 5.297 17.920 1.822
159 H VAL 21 H VAL 21 4.566 12.095 -0.575
160 HA VAL 21 HA VAL 21 6.417 14.020 -1.794
161 HB VAL 21 HB VAL 21 6.575 10.968 -1.519
162 HG11 VAL 21 HG11 VAL 21 8.664 12.960 -2.600
163 HG12 VAL 21 HG12 VAL 21 8.963 11.237 -2.228
164 HG13 VAL 21 HG13 VAL 21 7.850 11.678 -3.545
165 HG21 VAL 21 HG21 VAL 21 8.052 13.238 -0.049
166 HG22 VAL 21 HG22 VAL 21 6.728 12.255 0.638
167 HG23 VAL 21 HG23 VAL 21 8.277 11.485 0.205
168 H ALA 22 H ALA 22 4.924 10.944 -3.168
169 HA ALA 22 HA ALA 22 5.271 12.152 -5.873
170 HB1 ALA 22 HB1 ALA 22 6.008 9.816 -5.468
171 HB2 ALA 22 HB2 ALA 22 4.339 9.350 -5.031
172 HB3 ALA 22 HB3 ALA 22 4.707 9.896 -6.693
173 H SER 23 H SER 23 3.552 13.880 -5.086
174 HA SER 23 HA SER 23 1.356 14.657 -5.267
175 HB2 SER 23 HB2 SER 23 0.346 14.103 -7.459
176 HB3 SER 23 HB3 SER 23 2.112 14.363 -7.635
177 HG SER 23 HG SER 23 1.388 12.360 -8.710
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -0.286 -18.032 0.606
2 H2 GLY 1 H2 GLY 1 0.567 -16.582 0.075
3 HA2 GLY 1 HA2 GLY 1 -1.492 -16.319 1.958
4 HA3 GLY 1 HA3 GLY 1 -0.085 -16.969 2.860
5 H LEU 2 H LEU 2 -0.797 -14.540 3.744
6 HA LEU 2 HA LEU 2 -0.186 -12.276 3.875
7 HB2 LEU 2 HB2 LEU 2 2.488 -13.330 2.793
8 HB3 LEU 2 HB3 LEU 2 2.239 -11.896 3.819
9 HG LEU 2 HG LEU 2 1.780 -14.838 4.656
10 HD11 LEU 2 HD11 LEU 2 4.019 -12.868 5.437
11 HD12 LEU 2 HD12 LEU 2 4.196 -14.270 4.341
12 HD13 LEU 2 HD13 LEU 2 3.820 -14.531 6.064
13 HD21 LEU 2 HD21 LEU 2 1.593 -12.242 6.319
14 HD22 LEU 2 HD22 LEU 2 1.580 -13.894 7.001
15 HD23 LEU 2 HD23 LEU 2 0.247 -13.364 5.954
16 H LYS 3 H LYS 3 -1.702 -12.764 1.625
17 HA LYS 3 HA LYS 3 -0.265 -11.117 -0.456
18 HB2 LYS 3 HB2 LYS 3 -0.716 -13.528 -1.050
19 HB3 LYS 3 HB3 LYS 3 -2.463 -13.182 -0.983
20 HG2 LYS 3 HG2 LYS 3 -2.152 -11.386 -2.749
21 HG3 LYS 3 HG3 LYS 3 -0.400 -11.731 -2.779
22 HD2 LYS 3 HD2 LYS 3 -0.900 -14.115 -3.490
23 HD3 LYS 3 HD3 LYS 3 -2.634 -13.694 -3.576
24 HE2 LYS 3 HE2 LYS 3 -2.095 -11.930 -5.306
25 HE3 LYS 3 HE3 LYS 3 -0.367 -12.364 -5.205
26 HZ1 LYS 3 HZ1 LYS 3 -2.598 -14.219 -6.098
27 HZ2 LYS 3 HZ2 LYS 3 -0.911 -14.651 -5.979
28 HZ3 LYS 3 HZ3 LYS 3 -1.422 -13.451 -7.127
29 H GLU 4 H GLU 4 -3.676 -11.897 0.790
30 HA GLU 4 HA GLU 4 -4.759 -9.477 -0.268
31 HB2 GLU 4 HB2 GLU 4 -5.518 -10.978 2.322
32 HB3 GLU 4 HB3 GLU 4 -6.448 -9.617 1.645
33 HG2 GLU 4 HG2 GLU 4 -5.962 -12.299 0.189
34 HG3 GLU 4 HG3 GLU 4 -7.454 -11.826 1.031
35 H ILE 5 H ILE 5 -3.082 -10.171 2.922
36 HA ILE 5 HA ILE 5 -3.563 -7.486 3.882
37 HB ILE 5 HB ILE 5 -1.442 -9.542 4.715
38 HG12 ILE 5 HG12 ILE 5 -4.063 -8.648 6.099
39 HG13 ILE 5 HG13 ILE 5 -3.895 -10.127 5.129
40 HG21 ILE 5 HG21 ILE 5 -1.027 -8.081 6.708
41 HG22 ILE 5 HG22 ILE 5 -0.636 -7.216 5.222
42 HG23 ILE 5 HG23 ILE 5 -2.173 -6.870 6.063
43 HD11 ILE 5 HD11 ILE 5 -3.721 -10.768 7.455
44 HD12 ILE 5 HD12 ILE 5 -2.097 -10.948 6.734
45 HD13 ILE 5 HD13 ILE 5 -2.471 -9.556 7.798
46 H PHE 6 H PHE 6 -0.623 -9.079 2.358
47 HA PHE 6 HA PHE 6 0.976 -6.759 2.389
48 HB2 PHE 6 HB2 PHE 6 1.924 -8.922 1.719
49 HB3 PHE 6 HB3 PHE 6 0.827 -9.042 0.332
50 HD1 PHE 6 HD1 PHE 6 3.746 -7.136 1.699
51 HD2 PHE 6 HD2 PHE 6 1.269 -7.837 -1.751
52 HE1 PHE 6 HE1 PHE 6 5.452 -6.072 0.253
53 HE2 PHE 6 HE2 PHE 6 2.981 -6.789 -3.192
54 HZ PHE 6 HZ PHE 6 5.086 -5.921 -2.199
55 H LYS 7 H LYS 7 -1.330 -7.880 -0.229
56 HA LYS 7 HA LYS 7 -0.548 -5.694 -1.914
57 HB2 LYS 7 HB2 LYS 7 -1.531 -7.881 -2.751
58 HB3 LYS 7 HB3 LYS 7 -3.091 -7.421 -2.035
59 HG2 LYS 7 HG2 LYS 7 -3.267 -6.944 -4.354
60 HG3 LYS 7 HG3 LYS 7 -3.089 -5.348 -3.583
61 HD2 LYS 7 HD2 LYS 7 -0.608 -5.390 -4.217
62 HD3 LYS 7 HD3 LYS 7 -0.866 -6.967 -5.006
63 HE2 LYS 7 HE2 LYS 7 -2.162 -4.279 -5.797
64 HE3 LYS 7 HE3 LYS 7 -0.810 -5.089 -6.626
65 HZ1 LYS 7 HZ1 LYS 7 -3.689 -6.039 -6.501
66 HZ2 LYS 7 HZ2 LYS 7 -2.364 -7.025 -7.087
67 HZ3 LYS 7 HZ3 LYS 7 -2.790 -5.539 -7.879
68 H ALA 8 H ALA 8 -3.566 -6.280 0.115
69 HA ALA 8 HA ALA 8 -4.712 -3.765 -0.725
70 HB1 ALA 8 HB1 ALA 8 -6.360 -4.094 1.094
71 HB2 ALA 8 HB2 ALA 8 -6.122 -5.619 0.190
72 HB3 ALA 8 HB3 ALA 8 -5.376 -5.404 1.801
73 H GLY 9 H GLY 9 -2.913 -4.819 2.291
74 HA2 GLY 9 HA2 GLY 9 -3.244 -2.456 3.754
75 HA3 GLY 9 HA3 GLY 9 -1.791 -3.479 3.862
76 H LEU 10 H LEU 10 -0.322 -3.245 1.639
77 HA LEU 10 HA LEU 10 0.559 -0.524 1.851
78 HB2 LEU 10 HB2 LEU 10 2.328 -0.998 0.364
79 HB3 LEU 10 HB3 LEU 10 2.030 -2.475 1.296
80 HG LEU 10 HG LEU 10 0.534 -3.147 -0.855
81 HD11 LEU 10 HD11 LEU 10 1.444 -2.262 -2.998
82 HD12 LEU 10 HD12 LEU 10 2.569 -1.191 -2.120
83 HD13 LEU 10 HD13 LEU 10 0.820 -0.891 -2.063
84 HD21 LEU 10 HD21 LEU 10 2.540 -4.214 -1.891
85 HD22 LEU 10 HD22 LEU 10 2.544 -4.402 -0.117
86 HD23 LEU 10 HD23 LEU 10 3.614 -3.196 -0.886
87 H GLY 11 H GLY 11 -1.687 -2.204 -0.451
88 HA2 GLY 11 HA2 GLY 11 -1.621 -0.308 -2.529
89 HA3 GLY 11 HA3 GLY 11 -3.080 -1.218 -2.064
90 H SER 12 H SER 12 -3.551 -0.227 0.579
91 HA SER 12 HA SER 12 -4.776 2.327 -0.186
92 HB2 SER 12 HB2 SER 12 -5.934 0.703 1.298
93 HB3 SER 12 HB3 SER 12 -4.692 0.929 2.559
94 HG SER 12 HG SER 12 -5.406 3.216 2.589
95 H LEU 13 H LEU 13 -2.146 1.255 2.147
96 HA LEU 13 HA LEU 13 -1.905 3.914 3.229
97 HB2 LEU 13 HB2 LEU 13 0.125 1.614 3.194
98 HB3 LEU 13 HB3 LEU 13 0.325 3.103 4.144
99 HG LEU 13 HG LEU 13 -2.026 1.143 4.561
100 HD11 LEU 13 HD11 LEU 13 0.156 0.047 5.099
101 HD12 LEU 13 HD12 LEU 13 -0.778 0.373 6.581
102 HD13 LEU 13 HD13 LEU 13 0.601 1.426 6.149
103 HD21 LEU 13 HD21 LEU 13 -2.262 2.361 6.763
104 HD22 LEU 13 HD22 LEU 13 -2.600 3.419 5.383
105 HD23 LEU 13 HD23 LEU 13 -1.028 3.537 6.229
106 H VAL 14 H VAL 14 -0.097 2.226 0.533
107 HA VAL 14 HA VAL 14 1.955 4.103 0.418
108 HB VAL 14 HB VAL 14 1.876 2.007 -0.979
109 HG11 VAL 14 HG11 VAL 14 0.803 2.010 -3.200
110 HG12 VAL 14 HG12 VAL 14 -0.450 2.335 -1.978
111 HG13 VAL 14 HG13 VAL 14 0.193 3.671 -2.969
112 HG21 VAL 14 HG21 VAL 14 3.174 2.952 -2.877
113 HG22 VAL 14 HG22 VAL 14 2.549 4.587 -2.529
114 HG23 VAL 14 HG23 VAL 14 3.618 3.767 -1.354
115 H LYS 15 H LYS 15 -1.418 4.400 -1.003
116 HA LYS 15 HA LYS 15 -0.829 6.964 -2.168
117 HB2 LYS 15 HB2 LYS 15 -3.454 5.753 -1.132
118 HB3 LYS 15 HB3 LYS 15 -3.369 7.432 -1.686
119 HG2 LYS 15 HG2 LYS 15 -2.366 5.129 -3.426
120 HG3 LYS 15 HG3 LYS 15 -4.089 5.549 -3.429
121 HD2 LYS 15 HD2 LYS 15 -2.082 7.801 -3.983
122 HD3 LYS 15 HD3 LYS 15 -2.425 6.602 -5.247
123 HE2 LYS 15 HE2 LYS 15 -3.819 8.581 -5.546
124 HE3 LYS 15 HE3 LYS 15 -4.822 7.143 -5.243
125 HZ1 LYS 15 HZ1 LYS 15 -5.610 9.187 -4.076
126 HZ2 LYS 15 HZ2 LYS 15 -4.142 9.243 -3.159
127 HZ3 LYS 15 HZ3 LYS 15 -5.285 7.904 -2.984
128 H GLY 16 H GLY 16 -2.367 6.139 1.087
129 HA2 GLY 16 HA2 GLY 16 -2.550 8.768 1.973
130 HA3 GLY 16 HA3 GLY 16 -2.237 7.396 3.068
131 H ILE 17 H ILE 17 0.451 6.741 1.839
132 HA ILE 17 HA ILE 17 1.883 8.792 3.481
133 HB ILE 17 HB ILE 17 2.774 6.045 2.462
134 HG12 ILE 17 HG12 ILE 17 1.964 6.991 5.285
135 HG13 ILE 17 HG13 ILE 17 0.946 6.013 4.203
136 HG21 ILE 17 HG21 ILE 17 4.787 6.384 3.869
137 HG22 ILE 17 HG22 ILE 17 4.680 7.692 2.684
138 HG23 ILE 17 HG23 ILE 17 4.195 7.994 4.376
139 HD11 ILE 17 HD11 ILE 17 3.606 5.120 5.468
140 HD12 ILE 17 HD12 ILE 17 1.972 4.499 5.791
141 HD13 ILE 17 HD13 ILE 17 2.734 4.199 4.202
142 H ALA 18 H ALA 18 2.469 7.009 0.301
143 HA ALA 18 HA ALA 18 4.564 8.831 -0.365
144 HB1 ALA 18 HB1 ALA 18 2.893 7.181 -2.357
145 HB2 ALA 18 HB2 ALA 18 4.508 7.889 -2.637
146 HB3 ALA 18 HB3 ALA 18 4.313 6.564 -1.452
147 H ALA 19 H ALA 19 0.974 9.097 -0.874
148 HA ALA 19 HA ALA 19 0.875 10.726 -3.077
149 HB1 ALA 19 HB1 ALA 19 -1.216 10.261 -1.861
150 HB2 ALA 19 HB2 ALA 19 -0.641 11.182 -0.431
151 HB3 ALA 19 HB3 ALA 19 -1.026 12.028 -1.958
152 H HIS 20 H HIS 20 1.901 11.789 0.276
153 HA HIS 20 HA HIS 20 1.989 14.534 -0.417
154 HB2 HIS 20 HB2 HIS 20 2.320 13.404 1.972
155 HB3 HIS 20 HB3 HIS 20 4.045 13.357 1.536
156 HD1 HIS 20 HD2 HIS 20 1.105 15.720 1.809
157 HD2 HIS 20 HD3 HIS 20 5.309 15.776 1.894
158 HE1 HIS 20 HE2 HIS 20 1.733 18.071 2.470
159 H VAL 21 H VAL 21 4.550 11.933 -0.615
160 HA VAL 21 HA VAL 21 6.452 13.806 -1.822
161 HB VAL 21 HB VAL 21 6.545 10.751 -1.525
162 HG11 VAL 21 HG11 VAL 21 8.697 12.688 -2.574
163 HG12 VAL 21 HG12 VAL 21 8.950 10.963 -2.181
164 HG13 VAL 21 HG13 VAL 21 7.876 11.416 -3.525
165 HG21 VAL 21 HG21 VAL 21 6.683 12.046 0.627
166 HG22 VAL 21 HG22 VAL 21 8.222 11.240 0.228
167 HG23 VAL 21 HG23 VAL 21 8.042 12.997 -0.038
168 H ALA 22 H ALA 22 4.870 10.769 -3.182
169 HA ALA 22 HA ALA 22 5.347 11.939 -5.901
170 HB1 ALA 22 HB1 ALA 22 4.913 9.648 -6.708
171 HB2 ALA 22 HB2 ALA 22 6.152 9.633 -5.418
172 HB3 ALA 22 HB3 ALA 22 4.478 9.119 -5.056
173 H SER 23 H SER 23 3.475 13.554 -4.888
174 HA SER 23 HA SER 23 1.280 14.271 -5.231
175 HB2 SER 23 HB2 SER 23 1.604 12.472 -7.722
176 HB3 SER 23 HB3 SER 23 0.392 13.762 -7.498
177 HG SER 23 HG SER 23 3.231 14.213 -7.546
Start of MODEL 11
1 H1 GLY 1 H GLY 1 -2.600 -15.422 5.423
2 H2 GLY 1 H2 GLY 1 -3.146 -14.614 4.961
3 HA2 GLY 1 HA2 GLY 1 -1.211 -16.248 3.517
4 HA3 GLY 1 HA3 GLY 1 -2.411 -15.465 2.445
5 H LEU 2 H LEU 2 0.088 -14.656 1.934
6 HA LEU 2 HA LEU 2 0.377 -11.980 3.355
7 HB2 LEU 2 HB2 LEU 2 2.497 -13.692 1.945
8 HB3 LEU 2 HB3 LEU 2 2.783 -12.177 2.833
9 HG LEU 2 HG LEU 2 1.801 -14.835 4.076
10 HD11 LEU 2 HD11 LEU 2 4.095 -14.982 5.057
11 HD12 LEU 2 HD12 LEU 2 4.572 -13.486 4.201
12 HD13 LEU 2 HD13 LEU 2 4.169 -14.963 3.276
13 HD21 LEU 2 HD21 LEU 2 2.310 -13.730 6.287
14 HD22 LEU 2 HD22 LEU 2 0.987 -12.903 5.442
15 HD23 LEU 2 HD23 LEU 2 2.629 -12.192 5.438
16 H LYS 3 H LYS 3 -1.586 -12.074 1.523
17 HA LYS 3 HA LYS 3 -0.343 -10.555 -0.713
18 HB2 LYS 3 HB2 LYS 3 -0.497 -12.982 -1.422
19 HB3 LYS 3 HB3 LYS 3 -2.266 -12.893 -1.246
20 HG2 LYS 3 HG2 LYS 3 -2.295 -10.989 -2.945
21 HG3 LYS 3 HG3 LYS 3 -0.519 -11.132 -3.081
22 HD2 LYS 3 HD2 LYS 3 -0.792 -13.523 -3.893
23 HD3 LYS 3 HD3 LYS 3 -2.561 -13.334 -3.767
24 HE2 LYS 3 HE2 LYS 3 -1.918 -13.070 -6.095
25 HE3 LYS 3 HE3 LYS 3 -2.473 -11.486 -5.497
26 HZ1 LYS 3 HZ1 LYS 3 -0.417 -11.394 -6.921
27 HZ2 LYS 3 HZ2 LYS 3 0.446 -12.314 -5.724
28 HZ3 LYS 3 HZ3 LYS 3 -0.150 -10.708 -5.370
29 H GLU 4 H GLU 4 -3.657 -11.830 0.390
30 HA GLU 4 HA GLU 4 -5.008 -9.424 -0.258
31 HB2 GLU 4 HB2 GLU 4 -5.388 -11.245 2.211
32 HB3 GLU 4 HB3 GLU 4 -6.480 -9.900 1.798
33 HG2 GLU 4 HG2 GLU 4 -5.960 -12.329 -0.038
34 HG3 GLU 4 HG3 GLU 4 -7.363 -12.129 1.035
35 H ILE 5 H ILE 5 -3.044 -10.320 2.702
36 HA ILE 5 HA ILE 5 -3.527 -7.770 3.965
37 HB ILE 5 HB ILE 5 -1.247 -9.784 4.377
38 HG12 ILE 5 HG12 ILE 5 -3.775 -9.188 6.064
39 HG13 ILE 5 HG13 ILE 5 -3.604 -10.565 4.954
40 HG21 ILE 5 HG21 ILE 5 -0.699 -8.523 6.464
41 HG22 ILE 5 HG22 ILE 5 -0.517 -7.467 5.067
42 HG23 ILE 5 HG23 ILE 5 -1.972 -7.325 6.088
43 HD11 ILE 5 HD11 ILE 5 -2.006 -10.127 7.547
44 HD12 ILE 5 HD12 ILE 5 -3.189 -11.399 7.181
45 HD13 ILE 5 HD13 ILE 5 -1.617 -11.384 6.333
46 H PHE 6 H PHE 6 -0.698 -9.045 1.966
47 HA PHE 6 HA PHE 6 0.745 -6.579 2.308
48 HB2 PHE 6 HB2 PHE 6 0.995 -8.698 0.090
49 HB3 PHE 6 HB3 PHE 6 2.007 -7.243 0.219
50 HD1 PHE 6 HD2 PHE 6 1.263 -8.641 3.548
51 HD2 PHE 6 HD1 PHE 6 3.758 -9.073 0.061
52 HE1 PHE 6 HE2 PHE 6 3.000 -9.696 4.917
53 HE2 PHE 6 HE1 PHE 6 5.481 -10.179 1.442
54 HZ PHE 6 HZ PHE 6 5.120 -10.473 3.883
55 H LYS 7 H LYS 7 -1.163 -7.769 -0.613
56 HA LYS 7 HA LYS 7 -0.561 -5.381 -1.984
57 HB2 LYS 7 HB2 LYS 7 -1.440 -7.575 -3.051
58 HB3 LYS 7 HB3 LYS 7 -3.056 -7.092 -2.485
59 HG2 LYS 7 HG2 LYS 7 -2.967 -6.374 -4.759
60 HG3 LYS 7 HG3 LYS 7 -2.676 -4.873 -3.848
61 HD2 LYS 7 HD2 LYS 7 -0.116 -5.319 -4.231
62 HD3 LYS 7 HD3 LYS 7 -0.604 -6.654 -5.296
63 HE2 LYS 7 HE2 LYS 7 -1.261 -3.657 -5.648
64 HE3 LYS 7 HE3 LYS 7 -0.043 -4.593 -6.552
65 HZ1 LYS 7 HZ1 LYS 7 -3.056 -4.933 -6.698
66 HZ2 LYS 7 HZ2 LYS 7 -1.904 -6.027 -7.440
67 HZ3 LYS 7 HZ3 LYS 7 -1.994 -4.360 -7.930
68 H ALA 8 H ALA 8 -3.566 -6.263 -0.050
69 HA ALA 8 HA ALA 8 -4.867 -3.795 -0.745
70 HB1 ALA 8 HB1 ALA 8 -6.401 -4.202 1.138
71 HB2 ALA 8 HB2 ALA 8 -6.122 -5.733 0.255
72 HB3 ALA 8 HB3 ALA 8 -5.313 -5.436 1.825
73 H GLY 9 H GLY 9 -2.849 -4.792 2.153
74 HA2 GLY 9 HA2 GLY 9 -3.210 -2.376 3.586
75 HA3 GLY 9 HA3 GLY 9 -1.778 -3.423 3.735
76 H LEU 10 H LEU 10 -0.287 -3.310 1.546
77 HA LEU 10 HA LEU 10 0.716 -0.648 1.673
78 HB2 LEU 10 HB2 LEU 10 2.396 -1.236 0.084
79 HB3 LEU 10 HB3 LEU 10 2.084 -2.647 1.110
80 HG LEU 10 HG LEU 10 0.412 -3.305 -0.942
81 HD11 LEU 10 HD11 LEU 10 2.574 -1.648 -2.388
82 HD12 LEU 10 HD12 LEU 10 0.863 -1.175 -2.279
83 HD13 LEU 10 HD13 LEU 10 1.314 -2.653 -3.155
84 HD21 LEU 10 HD21 LEU 10 3.464 -3.677 -1.064
85 HD22 LEU 10 HD22 LEU 10 2.256 -4.665 -1.940
86 HD23 LEU 10 HD23 LEU 10 2.317 -4.707 -0.160
87 H GLY 11 H GLY 11 -1.711 -2.157 -0.561
88 HA2 GLY 11 HA2 GLY 11 -1.485 -0.225 -2.637
89 HA3 GLY 11 HA3 GLY 11 -2.979 -1.103 -2.231
90 H SER 12 H SER 12 -3.611 -0.234 0.350
91 HA SER 12 HA SER 12 -4.709 2.370 -0.318
92 HB2 SER 12 HB2 SER 12 -5.917 0.782 1.165
93 HB3 SER 12 HB3 SER 12 -4.621 0.916 2.395
94 HG SER 12 HG SER 12 -6.389 2.466 2.792
95 H LEU 13 H LEU 13 -2.076 1.215 1.955
96 HA LEU 13 HA LEU 13 -1.770 3.854 3.089
97 HB2 LEU 13 HB2 LEU 13 0.201 1.504 3.014
98 HB3 LEU 13 HB3 LEU 13 0.432 2.973 3.985
99 HG LEU 13 HG LEU 13 -1.954 1.051 4.366
100 HD11 LEU 13 HD11 LEU 13 0.205 -0.091 4.892
101 HD12 LEU 13 HD12 LEU 13 -0.727 0.227 6.377
102 HD13 LEU 13 HD13 LEU 13 0.670 1.264 5.965
103 HD21 LEU 13 HD21 LEU 13 -0.924 3.403 6.075
104 HD22 LEU 13 HD22 LEU 13 -2.174 2.237 6.589
105 HD23 LEU 13 HD23 LEU 13 -2.496 3.321 5.225
106 H VAL 14 H VAL 14 0.124 2.083 0.481
107 HA VAL 14 HA VAL 14 2.090 4.056 0.321
108 HB VAL 14 HB VAL 14 2.124 1.847 -0.964
109 HG11 VAL 14 HG11 VAL 14 0.606 3.423 -3.155
110 HG12 VAL 14 HG12 VAL 14 1.216 1.751 -3.255
111 HG13 VAL 14 HG13 VAL 14 -0.135 2.143 -2.169
112 HG21 VAL 14 HG21 VAL 14 3.878 3.601 -1.280
113 HG22 VAL 14 HG22 VAL 14 3.544 2.737 -2.802
114 HG23 VAL 14 HG23 VAL 14 2.889 4.377 -2.550
115 H LYS 15 H LYS 15 -1.261 4.070 -1.123
116 HA LYS 15 HA LYS 15 -0.728 6.324 -2.785
117 HB2 LYS 15 HB2 LYS 15 -2.823 5.001 -3.019
118 HB3 LYS 15 HB3 LYS 15 -3.390 5.598 -1.439
119 HG2 LYS 15 HG2 LYS 15 -3.329 7.980 -2.337
120 HG3 LYS 15 HG3 LYS 15 -2.711 7.356 -3.886
121 HD2 LYS 15 HD2 LYS 15 -5.066 7.824 -4.157
122 HD3 LYS 15 HD3 LYS 15 -4.862 6.055 -4.205
123 HE2 LYS 15 HE2 LYS 15 -5.707 5.884 -1.850
124 HE3 LYS 15 HE3 LYS 15 -5.754 7.664 -1.720
125 HZ1 LYS 15 HZ1 LYS 15 -7.400 5.984 -3.641
126 HZ2 LYS 15 HZ2 LYS 15 -7.472 7.723 -3.495
127 HZ3 LYS 15 HZ3 LYS 15 -7.979 6.716 -2.173
128 H GLY 16 H GLY 16 -2.187 6.188 0.615
129 HA2 GLY 16 HA2 GLY 16 -2.330 9.029 0.807
130 HA3 GLY 16 HA3 GLY 16 -2.295 7.918 2.197
131 H ILE 17 H ILE 17 0.368 6.723 1.644
132 HA ILE 17 HA ILE 17 1.823 8.820 3.072
133 HB ILE 17 HB ILE 17 2.730 6.064 2.081
134 HG12 ILE 17 HG12 ILE 17 2.024 7.075 4.914
135 HG13 ILE 17 HG13 ILE 17 0.946 6.103 3.889
136 HG21 ILE 17 HG21 ILE 17 4.776 6.413 3.460
137 HG22 ILE 17 HG22 ILE 17 4.670 7.670 2.226
138 HG23 ILE 17 HG23 ILE 17 4.215 8.049 3.910
139 HD11 ILE 17 HD11 ILE 17 3.625 5.171 5.084
140 HD12 ILE 17 HD12 ILE 17 1.990 4.588 5.460
141 HD13 ILE 17 HD13 ILE 17 2.702 4.251 3.855
142 H ALA 18 H ALA 18 2.392 7.063 -0.108
143 HA ALA 18 HA ALA 18 4.522 8.822 -0.809
144 HB1 ALA 18 HB1 ALA 18 4.146 6.595 -1.924
145 HB2 ALA 18 HB2 ALA 18 2.712 7.272 -2.761
146 HB3 ALA 18 HB3 ALA 18 4.340 7.928 -3.095
147 H ALA 19 H ALA 19 0.928 9.212 -1.187
148 HA ALA 19 HA ALA 19 0.796 10.982 -3.293
149 HB1 ALA 19 HB1 ALA 19 -1.266 10.492 -2.017
150 HB2 ALA 19 HB2 ALA 19 -0.608 11.306 -0.565
151 HB3 ALA 19 HB3 ALA 19 -1.020 12.253 -2.026
152 H HIS 20 H HIS 20 1.928 11.821 0.104
153 HA HIS 20 HA HIS 20 2.061 14.595 -0.453
154 HB2 HIS 20 HB2 HIS 20 2.387 13.388 1.849
155 HB3 HIS 20 HB3 HIS 20 4.110 13.274 1.412
156 HD1 HIS 20 HD2 HIS 20 4.815 15.929 0.341
157 HD2 HIS 20 HD3 HIS 20 1.921 15.462 3.355
158 HE1 HIS 20 HE2 HIS 20 4.644 18.178 1.479
159 H VAL 21 H VAL 21 4.604 11.969 -0.791
160 HA VAL 21 HA VAL 21 6.460 13.893 -2.009
161 HB VAL 21 HB VAL 21 6.634 10.848 -1.702
162 HG11 VAL 21 HG11 VAL 21 8.718 12.846 -2.789
163 HG12 VAL 21 HG12 VAL 21 9.024 11.127 -2.404
164 HG13 VAL 21 HG13 VAL 21 7.914 11.554 -3.729
165 HG21 VAL 21 HG21 VAL 21 6.764 12.151 0.438
166 HG22 VAL 21 HG22 VAL 21 8.323 11.391 0.023
167 HG23 VAL 21 HG23 VAL 21 8.085 13.141 -0.247
168 H ALA 22 H ALA 22 5.051 10.786 -3.397
169 HA ALA 22 HA ALA 22 5.343 11.987 -6.090
170 HB1 ALA 22 HB1 ALA 22 4.592 9.781 -6.904
171 HB2 ALA 22 HB2 ALA 22 5.906 9.593 -5.705
172 HB3 ALA 22 HB3 ALA 22 4.214 9.259 -5.237
173 H SER 23 H SER 23 3.771 13.850 -5.378
174 HA SER 23 HA SER 23 0.943 13.131 -5.161
175 HB2 SER 23 HB2 SER 23 0.542 15.554 -5.614
176 HB3 SER 23 HB3 SER 23 1.785 15.323 -4.340
177 HG SER 23 HG SER 23 2.508 16.853 -6.024
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -1.469 -15.995 -0.386
2 H2 GLY 1 H2 GLY 1 -0.716 -16.084 -0.391
3 HA2 GLY 1 HA2 GLY 1 -2.072 -15.408 1.976
4 HA3 GLY 1 HA3 GLY 1 -0.673 -16.414 2.463
5 H LEU 2 H LEU 2 -0.703 -13.757 3.353
6 HA LEU 2 HA LEU 2 0.456 -11.712 3.193
7 HB2 LEU 2 HB2 LEU 2 2.550 -13.469 1.777
8 HB3 LEU 2 HB3 LEU 2 2.843 -11.965 2.674
9 HG LEU 2 HG LEU 2 1.884 -14.646 3.868
10 HD11 LEU 2 HD11 LEU 2 4.596 -13.192 4.109
11 HD12 LEU 2 HD12 LEU 2 4.282 -14.655 3.129
12 HD13 LEU 2 HD13 LEU 2 4.155 -14.730 4.906
13 HD21 LEU 2 HD21 LEU 2 2.313 -13.539 6.113
14 HD22 LEU 2 HD22 LEU 2 0.951 -12.800 5.248
15 HD23 LEU 2 HD23 LEU 2 2.541 -11.977 5.274
16 H LYS 3 H LYS 3 -1.537 -11.721 1.445
17 HA LYS 3 HA LYS 3 -0.328 -10.516 -1.002
18 HB2 LYS 3 HB2 LYS 3 -0.518 -12.945 -1.404
19 HB3 LYS 3 HB3 LYS 3 -2.269 -12.901 -1.099
20 HG2 LYS 3 HG2 LYS 3 -2.528 -11.230 -2.991
21 HG3 LYS 3 HG3 LYS 3 -0.788 -11.344 -3.329
22 HD2 LYS 3 HD2 LYS 3 -2.886 -13.596 -3.564
23 HD3 LYS 3 HD3 LYS 3 -2.084 -12.740 -4.905
24 HE2 LYS 3 HE2 LYS 3 -0.779 -14.731 -2.939
25 HE3 LYS 3 HE3 LYS 3 -1.112 -14.958 -4.664
26 HZ1 LYS 3 HZ1 LYS 3 1.227 -14.474 -4.392
27 HZ2 LYS 3 HZ2 LYS 3 0.932 -13.046 -3.480
28 HZ3 LYS 3 HZ3 LYS 3 0.491 -13.104 -5.172
29 H GLU 4 H GLU 4 -3.663 -11.559 0.264
30 HA GLU 4 HA GLU 4 -4.887 -9.133 -0.622
31 HB2 GLU 4 HB2 GLU 4 -5.552 -10.816 1.884
32 HB3 GLU 4 HB3 GLU 4 -6.542 -9.463 1.276
33 HG2 GLU 4 HG2 GLU 4 -6.924 -10.670 -0.884
34 HG3 GLU 4 HG3 GLU 4 -5.944 -12.043 -0.311
35 H ILE 5 H ILE 5 -3.167 -10.018 2.487
36 HA ILE 5 HA ILE 5 -3.598 -7.446 3.686
37 HB ILE 5 HB ILE 5 -1.241 -9.376 4.098
38 HG12 ILE 5 HG12 ILE 5 -3.272 -10.582 4.724
39 HG13 ILE 5 HG13 ILE 5 -2.413 -10.097 6.189
40 HG21 ILE 5 HG21 ILE 5 -0.580 -7.162 4.892
41 HG22 ILE 5 HG22 ILE 5 -2.121 -6.934 5.754
42 HG23 ILE 5 HG23 ILE 5 -0.946 -8.157 6.313
43 HD11 ILE 5 HD11 ILE 5 -4.968 -8.791 5.047
44 HD12 ILE 5 HD12 ILE 5 -4.816 -9.776 6.516
45 HD13 ILE 5 HD13 ILE 5 -4.073 -8.159 6.464
46 H PHE 6 H PHE 6 -0.953 -8.682 1.471
47 HA PHE 6 HA PHE 6 0.559 -6.237 1.762
48 HB2 PHE 6 HB2 PHE 6 0.573 -8.308 -0.499
49 HB3 PHE 6 HB3 PHE 6 1.585 -6.851 -0.458
50 HD1 PHE 6 HD2 PHE 6 1.104 -8.357 2.904
51 HD2 PHE 6 HD1 PHE 6 3.390 -8.592 -0.744
52 HE1 PHE 6 HE2 PHE 6 2.927 -9.449 4.114
53 HE2 PHE 6 HE1 PHE 6 5.220 -9.699 0.490
54 HZ PHE 6 HZ PHE 6 5.010 -10.103 2.933
55 H LYS 7 H LYS 7 -1.528 -7.263 -1.118
56 HA LYS 7 HA LYS 7 -1.437 -4.735 -2.282
57 HB2 LYS 7 HB2 LYS 7 -3.551 -6.943 -2.337
58 HB3 LYS 7 HB3 LYS 7 -3.982 -5.390 -3.065
59 HG2 LYS 7 HG2 LYS 7 -1.414 -6.835 -3.902
60 HG3 LYS 7 HG3 LYS 7 -3.000 -7.168 -4.648
61 HD2 LYS 7 HD2 LYS 7 -3.263 -4.821 -5.371
62 HD3 LYS 7 HD3 LYS 7 -1.763 -4.342 -4.549
63 HE2 LYS 7 HE2 LYS 7 -1.353 -4.525 -6.933
64 HE3 LYS 7 HE3 LYS 7 -0.421 -5.784 -6.083
65 HZ1 LYS 7 HZ1 LYS 7 -3.091 -6.257 -7.464
66 HZ2 LYS 7 HZ2 LYS 7 -2.020 -7.483 -6.812
67 HZ3 LYS 7 HZ3 LYS 7 -1.539 -6.558 -8.184
68 H ALA 8 H ALA 8 -4.055 -5.873 0.050
69 HA ALA 8 HA ALA 8 -5.429 -3.386 -0.108
70 HB1 ALA 8 HB1 ALA 8 -5.315 -5.300 2.309
71 HB2 ALA 8 HB2 ALA 8 -6.515 -4.003 2.042
72 HB3 ALA 8 HB3 ALA 8 -6.458 -5.408 0.938
73 H GLY 9 H GLY 9 -2.871 -4.542 2.246
74 HA2 GLY 9 HA2 GLY 9 -3.002 -2.186 3.861
75 HA3 GLY 9 HA3 GLY 9 -1.619 -3.298 3.792
76 H LEU 10 H LEU 10 -0.273 -3.120 1.561
77 HA LEU 10 HA LEU 10 0.772 -0.485 1.755
78 HB2 LEU 10 HB2 LEU 10 2.405 -1.020 0.115
79 HB3 LEU 10 HB3 LEU 10 2.093 -2.473 1.077
80 HG LEU 10 HG LEU 10 0.395 -3.036 -0.979
81 HD11 LEU 10 HD11 LEU 10 2.518 -1.284 -2.372
82 HD12 LEU 10 HD12 LEU 10 0.806 -0.834 -2.212
83 HD13 LEU 10 HD13 LEU 10 1.256 -2.261 -3.170
84 HD21 LEU 10 HD21 LEU 10 2.226 -4.331 -2.072
85 HD22 LEU 10 HD22 LEU 10 2.323 -4.453 -0.297
86 HD23 LEU 10 HD23 LEU 10 3.446 -3.376 -1.176
87 H GLY 11 H GLY 11 -1.683 -1.884 -0.531
88 HA2 GLY 11 HA2 GLY 11 -1.541 0.205 -2.455
89 HA3 GLY 11 HA3 GLY 11 -3.018 -0.714 -2.081
90 H SER 12 H SER 12 -3.502 -0.050 0.636
91 HA SER 12 HA SER 12 -4.705 2.554 0.216
92 HB2 SER 12 HB2 SER 12 -5.733 0.858 1.712
93 HB3 SER 12 HB3 SER 12 -4.337 0.974 2.832
94 HG SER 12 HG SER 12 -6.106 2.447 3.456
95 H LEU 13 H LEU 13 -1.825 1.375 2.160
96 HA LEU 13 HA LEU 13 -1.506 3.987 3.383
97 HB2 LEU 13 HB2 LEU 13 0.491 1.678 3.126
98 HB3 LEU 13 HB3 LEU 13 0.757 3.127 4.119
99 HG LEU 13 HG LEU 13 -1.585 1.160 4.572
100 HD11 LEU 13 HD11 LEU 13 -0.245 0.279 6.484
101 HD12 LEU 13 HD12 LEU 13 1.121 1.340 6.029
102 HD13 LEU 13 HD13 LEU 13 0.603 0.018 4.939
103 HD21 LEU 13 HD21 LEU 13 -1.689 2.268 6.845
104 HD22 LEU 13 HD22 LEU 13 -2.094 3.397 5.542
105 HD23 LEU 13 HD23 LEU 13 -0.477 3.461 6.304
106 H VAL 14 H VAL 14 0.346 2.303 0.676
107 HA VAL 14 HA VAL 14 2.212 4.322 0.382
108 HB VAL 14 HB VAL 14 2.145 2.145 -0.966
109 HG11 VAL 14 HG11 VAL 14 -0.213 2.465 -1.945
110 HG12 VAL 14 HG12 VAL 14 0.434 3.767 -2.970
111 HG13 VAL 14 HG13 VAL 14 1.033 2.098 -3.160
112 HG21 VAL 14 HG21 VAL 14 2.764 4.721 -2.546
113 HG22 VAL 14 HG22 VAL 14 3.860 3.918 -1.386
114 HG23 VAL 14 HG23 VAL 14 3.396 3.090 -2.896
115 H LYS 15 H LYS 15 -1.236 4.350 -0.755
116 HA LYS 15 HA LYS 15 -0.893 6.671 -2.409
117 HB2 LYS 15 HB2 LYS 15 -3.363 5.668 -0.891
118 HB3 LYS 15 HB3 LYS 15 -3.386 7.051 -2.013
119 HG2 LYS 15 HG2 LYS 15 -2.746 5.659 -3.914
120 HG3 LYS 15 HG3 LYS 15 -2.372 4.269 -2.874
121 HD2 LYS 15 HD2 LYS 15 -4.792 4.113 -2.187
122 HD3 LYS 15 HD3 LYS 15 -5.177 5.485 -3.266
123 HE2 LYS 15 HE2 LYS 15 -4.386 4.143 -5.242
124 HE3 LYS 15 HE3 LYS 15 -3.961 2.787 -4.160
125 HZ1 LYS 15 HZ1 LYS 15 -6.755 3.914 -4.549
126 HZ2 LYS 15 HZ2 LYS 15 -6.330 2.581 -3.504
127 HZ3 LYS 15 HZ3 LYS 15 -6.147 2.431 -5.227
128 H GLY 16 H GLY 16 -2.101 6.422 1.083
129 HA2 GLY 16 HA2 GLY 16 -2.171 9.267 1.358
130 HA3 GLY 16 HA3 GLY 16 -2.106 8.112 2.711
131 H ILE 17 H ILE 17 0.510 6.873 1.969
132 HA ILE 17 HA ILE 17 2.077 8.889 3.409
133 HB ILE 17 HB ILE 17 2.924 6.183 2.245
134 HG12 ILE 17 HG12 ILE 17 1.222 5.871 4.015
135 HG13 ILE 17 HG13 ILE 17 2.818 5.272 4.495
136 HG21 ILE 17 HG21 ILE 17 4.899 7.604 2.438
137 HG22 ILE 17 HG22 ILE 17 4.449 8.126 4.079
138 HG23 ILE 17 HG23 ILE 17 4.930 6.430 3.775
139 HD11 ILE 17 HD11 ILE 17 3.147 7.328 5.937
140 HD12 ILE 17 HD12 ILE 17 1.515 7.899 5.469
141 HD13 ILE 17 HD13 ILE 17 1.704 6.389 6.385
142 H ALA 18 H ALA 18 2.450 7.250 0.136
143 HA ALA 18 HA ALA 18 4.556 9.078 -0.568
144 HB1 ALA 18 HB1 ALA 18 4.393 8.204 -2.845
145 HB2 ALA 18 HB2 ALA 18 4.222 6.842 -1.702
146 HB3 ALA 18 HB3 ALA 18 2.779 7.511 -2.530
147 H ALA 19 H ALA 19 0.981 9.499 -0.603
148 HA ALA 19 HA ALA 19 0.645 11.210 -2.742
149 HB1 ALA 19 HB1 ALA 19 -1.274 10.842 -1.217
150 HB2 ALA 19 HB2 ALA 19 -0.418 11.667 0.120
151 HB3 ALA 19 HB3 ALA 19 -0.962 12.588 -1.314
152 H HIS 20 H HIS 20 2.171 12.036 0.482
153 HA HIS 20 HA HIS 20 2.324 14.807 -0.128
154 HB2 HIS 20 HB2 HIS 20 2.783 13.569 2.193
155 HB3 HIS 20 HB3 HIS 20 4.466 13.479 1.620
156 HD1 HIS 20 HD2 HIS 20 1.638 15.933 2.170
157 HD2 HIS 20 HD3 HIS 20 5.838 15.835 1.992
158 HE1 HIS 20 HE2 HIS 20 2.394 18.236 2.863
159 H VAL 21 H VAL 21 4.702 12.079 -0.651
160 HA VAL 21 HA VAL 21 6.596 13.939 -1.923
161 HB VAL 21 HB VAL 21 6.638 10.882 -1.675
162 HG11 VAL 21 HG11 VAL 21 7.853 11.564 -3.749
163 HG12 VAL 21 HG12 VAL 21 8.759 12.799 -2.827
164 HG13 VAL 21 HG13 VAL 21 9.001 11.062 -2.484
165 HG21 VAL 21 HG21 VAL 21 8.265 13.075 -0.251
166 HG22 VAL 21 HG22 VAL 21 6.934 12.135 0.482
167 HG23 VAL 21 HG23 VAL 21 8.431 11.311 -0.025
168 H ALA 22 H ALA 22 4.918 10.942 -3.251
169 HA ALA 22 HA ALA 22 5.202 12.168 -5.958
170 HB1 ALA 22 HB1 ALA 22 4.214 9.387 -5.117
171 HB2 ALA 22 HB2 ALA 22 4.546 9.940 -6.783
172 HB3 ALA 22 HB3 ALA 22 5.883 9.804 -5.601
173 H SER 23 H SER 23 3.560 13.936 -5.043
174 HA SER 23 HA SER 23 1.388 14.786 -5.189
175 HB2 SER 23 HB2 SER 23 1.274 12.715 -7.465
176 HB3 SER 23 HB3 SER 23 0.225 14.158 -7.285
177 HG SER 23 HG SER 23 2.128 14.588 -8.662
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -3.117 -15.199 4.483
2 H2 GLY 1 H2 GLY 1 -2.441 -15.072 4.960
3 HA2 GLY 1 HA2 GLY 1 -0.794 -16.419 3.066
4 HA3 GLY 1 HA3 GLY 1 -2.207 -15.730 2.211
5 H LEU 2 H LEU 2 0.175 -14.707 1.418
6 HA LEU 2 HA LEU 2 0.376 -12.024 2.843
7 HB2 LEU 2 HB2 LEU 2 2.465 -13.514 1.154
8 HB3 LEU 2 HB3 LEU 2 2.698 -11.970 2.009
9 HG LEU 2 HG LEU 2 2.176 -14.711 3.341
10 HD11 LEU 2 HD11 LEU 2 4.772 -13.058 3.139
11 HD12 LEU 2 HD12 LEU 2 4.426 -14.570 2.248
12 HD13 LEU 2 HD13 LEU 2 4.577 -14.599 4.024
13 HD21 LEU 2 HD21 LEU 2 2.851 -13.522 5.479
14 HD22 LEU 2 HD22 LEU 2 1.327 -12.897 4.823
15 HD23 LEU 2 HD23 LEU 2 2.840 -11.968 4.597
16 H LYS 3 H LYS 3 -1.777 -12.193 1.302
17 HA LYS 3 HA LYS 3 -0.877 -10.773 -1.170
18 HB2 LYS 3 HB2 LYS 3 -1.562 -13.327 -1.490
19 HB3 LYS 3 HB3 LYS 3 -3.216 -12.727 -1.260
20 HG2 LYS 3 HG2 LYS 3 -2.899 -12.696 -3.636
21 HG3 LYS 3 HG3 LYS 3 -2.663 -10.994 -3.163
22 HD2 LYS 3 HD2 LYS 3 -0.111 -11.423 -3.224
23 HD3 LYS 3 HD3 LYS 3 -0.454 -13.099 -3.711
24 HE2 LYS 3 HE2 LYS 3 -1.581 -12.239 -5.794
25 HE3 LYS 3 HE3 LYS 3 -1.231 -10.564 -5.282
26 HZ1 LYS 3 HZ1 LYS 3 0.447 -11.367 -6.890
27 HZ2 LYS 3 HZ2 LYS 3 0.850 -12.706 -5.854
28 HZ3 LYS 3 HZ3 LYS 3 1.194 -11.071 -5.351
29 H GLU 4 H GLU 4 -3.945 -11.566 0.757
30 HA GLU 4 HA GLU 4 -5.217 -9.139 0.043
31 HB2 GLU 4 HB2 GLU 4 -5.219 -10.579 2.777
32 HB3 GLU 4 HB3 GLU 4 -6.259 -9.184 2.394
33 HG2 GLU 4 HG2 GLU 4 -6.331 -11.876 0.880
34 HG3 GLU 4 HG3 GLU 4 -7.473 -11.364 2.143
35 H ILE 5 H ILE 5 -2.772 -9.814 2.700
36 HA ILE 5 HA ILE 5 -2.828 -7.071 3.597
37 HB ILE 5 HB ILE 5 -0.548 -9.105 3.884
38 HG12 ILE 5 HG12 ILE 5 -2.483 -10.107 4.971
39 HG13 ILE 5 HG13 ILE 5 -1.393 -9.479 6.210
40 HG21 ILE 5 HG21 ILE 5 0.173 -7.641 5.818
41 HG22 ILE 5 HG22 ILE 5 0.289 -6.822 4.248
42 HG23 ILE 5 HG23 ILE 5 -1.058 -6.439 5.343
43 HD11 ILE 5 HD11 ILE 5 -2.930 -7.447 6.472
44 HD12 ILE 5 HD12 ILE 5 -4.047 -8.195 5.288
45 HD13 ILE 5 HD13 ILE 5 -3.715 -9.003 6.836
46 H PHE 6 H PHE 6 -0.553 -8.868 1.335
47 HA PHE 6 HA PHE 6 0.986 -6.455 0.891
48 HB2 PHE 6 HB2 PHE 6 0.733 -8.977 -0.843
49 HB3 PHE 6 HB3 PHE 6 1.838 -7.623 -1.171
50 HD1 PHE 6 HD1 PHE 6 1.628 -8.291 2.453
51 HD2 PHE 6 HD2 PHE 6 3.483 -9.532 -1.237
52 HE1 PHE 6 HE1 PHE 6 3.467 -9.298 3.713
53 HE2 PHE 6 HE2 PHE 6 5.363 -10.489 0.046
54 HZ PHE 6 HZ PHE 6 5.370 -10.366 2.528
55 H LYS 7 H LYS 7 -2.212 -7.387 -0.300
56 HA LYS 7 HA LYS 7 -1.964 -5.110 -2.286
57 HB2 LYS 7 HB2 LYS 7 -2.417 -7.667 -2.973
58 HB3 LYS 7 HB3 LYS 7 -4.085 -7.301 -2.479
59 HG2 LYS 7 HG2 LYS 7 -2.357 -5.869 -4.623
60 HG3 LYS 7 HG3 LYS 7 -3.680 -7.021 -4.934
61 HD2 LYS 7 HD2 LYS 7 -5.329 -5.411 -3.924
62 HD3 LYS 7 HD3 LYS 7 -4.009 -4.231 -3.660
63 HE2 LYS 7 HE2 LYS 7 -3.548 -4.171 -6.122
64 HE3 LYS 7 HE3 LYS 7 -4.851 -5.357 -6.406
65 HZ1 LYS 7 HZ1 LYS 7 -6.492 -3.753 -5.503
66 HZ2 LYS 7 HZ2 LYS 7 -5.615 -3.066 -6.841
67 HZ3 LYS 7 HZ3 LYS 7 -5.221 -2.588 -5.215
68 H ALA 8 H ALA 8 -2.193 -4.552 0.438
69 HA ALA 8 HA ALA 8 -4.680 -3.053 0.308
70 HB1 ALA 8 HB1 ALA 8 -5.721 -3.908 2.397
71 HB2 ALA 8 HB2 ALA 8 -5.646 -5.202 1.171
72 HB3 ALA 8 HB3 ALA 8 -4.486 -5.185 2.531
73 H GLY 9 H GLY 9 -2.267 -4.296 2.846
74 HA2 GLY 9 HA2 GLY 9 -2.251 -1.770 4.216
75 HA3 GLY 9 HA3 GLY 9 -0.944 -2.974 4.286
76 H LEU 10 H LEU 10 0.595 -3.081 2.297
77 HA LEU 10 HA LEU 10 1.480 -0.440 1.720
78 HB2 LEU 10 HB2 LEU 10 3.114 -1.394 0.213
79 HB3 LEU 10 HB3 LEU 10 2.935 -2.416 1.650
80 HG LEU 10 HG LEU 10 1.218 -3.779 0.063
81 HD11 LEU 10 HD11 LEU 10 1.431 -2.170 -1.929
82 HD12 LEU 10 HD12 LEU 10 1.948 -3.821 -2.325
83 HD13 LEU 10 HD13 LEU 10 3.163 -2.556 -2.011
84 HD21 LEU 10 HD21 LEU 10 4.271 -4.015 -0.174
85 HD22 LEU 10 HD22 LEU 10 3.095 -5.282 -0.629
86 HD23 LEU 10 HD23 LEU 10 3.244 -4.781 1.073
87 H GLY 11 H GLY 11 -0.930 -2.517 -0.000
88 HA2 GLY 11 HA2 GLY 11 -0.823 -1.154 -2.493
89 HA3 GLY 11 HA3 GLY 11 -2.260 -1.978 -1.847
90 H SER 12 H SER 12 -2.891 -0.474 0.455
91 HA SER 12 HA SER 12 -3.988 1.926 -0.919
92 HB2 SER 12 HB2 SER 12 -5.457 0.444 0.457
93 HB3 SER 12 HB3 SER 12 -4.536 0.875 1.923
94 HG SER 12 HG SER 12 -5.220 3.123 1.474
95 H LEU 13 H LEU 13 -1.971 1.133 2.053
96 HA LEU 13 HA LEU 13 -1.867 3.831 2.925
97 HB2 LEU 13 HB2 LEU 13 0.285 1.666 3.268
98 HB3 LEU 13 HB3 LEU 13 0.270 3.212 4.141
99 HG LEU 13 HG LEU 13 -1.930 1.061 4.430
100 HD11 LEU 13 HD11 LEU 13 -0.899 0.606 6.646
101 HD12 LEU 13 HD12 LEU 13 0.392 1.797 6.311
102 HD13 LEU 13 HD13 LEU 13 0.272 0.300 5.338
103 HD21 LEU 13 HD21 LEU 13 -2.880 3.286 4.940
104 HD22 LEU 13 HD22 LEU 13 -1.457 3.703 5.943
105 HD23 LEU 13 HD23 LEU 13 -2.590 2.423 6.459
106 H VAL 14 H VAL 14 0.324 2.090 0.538
107 HA VAL 14 HA VAL 14 2.235 4.117 0.454
108 HB VAL 14 HB VAL 14 2.386 1.992 -0.896
109 HG11 VAL 14 HG11 VAL 14 0.677 3.469 -3.013
110 HG12 VAL 14 HG12 VAL 14 1.377 1.834 -3.137
111 HG13 VAL 14 HG13 VAL 14 0.060 2.155 -1.980
112 HG21 VAL 14 HG21 VAL 14 3.998 3.869 -1.260
113 HG22 VAL 14 HG22 VAL 14 3.674 2.984 -2.774
114 HG23 VAL 14 HG23 VAL 14 2.918 4.575 -2.496
115 H LYS 15 H LYS 15 -1.087 4.112 -1.056
116 HA LYS 15 HA LYS 15 -0.549 6.536 -2.537
117 HB2 LYS 15 HB2 LYS 15 -3.262 5.457 -1.566
118 HB3 LYS 15 HB3 LYS 15 -3.014 6.818 -2.688
119 HG2 LYS 15 HG2 LYS 15 -1.845 5.283 -4.304
120 HG3 LYS 15 HG3 LYS 15 -2.095 3.908 -3.195
121 HD2 LYS 15 HD2 LYS 15 -4.587 4.214 -3.367
122 HD3 LYS 15 HD3 LYS 15 -4.337 5.575 -4.498
123 HE2 LYS 15 HE2 LYS 15 -3.165 4.017 -6.100
124 HE3 LYS 15 HE3 LYS 15 -3.440 2.660 -4.972
125 HZ1 LYS 15 HZ1 LYS 15 -5.883 2.990 -5.208
126 HZ2 LYS 15 HZ2 LYS 15 -5.135 2.698 -6.751
127 HZ3 LYS 15 HZ3 LYS 15 -5.610 4.314 -6.314
128 H GLY 16 H GLY 16 -2.313 5.962 0.665
129 HA2 GLY 16 HA2 GLY 16 -2.741 8.710 1.140
130 HA3 GLY 16 HA3 GLY 16 -2.599 7.487 2.428
131 H ILE 17 H ILE 17 0.232 6.725 1.766
132 HA ILE 17 HA ILE 17 1.381 8.942 3.385
133 HB ILE 17 HB ILE 17 2.539 6.221 2.592
134 HG12 ILE 17 HG12 ILE 17 0.575 5.947 4.078
135 HG13 ILE 17 HG13 ILE 17 2.097 5.458 4.847
136 HG21 ILE 17 HG21 ILE 17 4.370 7.790 2.977
137 HG22 ILE 17 HG22 ILE 17 3.631 8.389 4.483
138 HG23 ILE 17 HG23 ILE 17 4.250 6.713 4.390
139 HD11 ILE 17 HD11 ILE 17 2.111 7.609 6.177
140 HD12 ILE 17 HD12 ILE 17 0.559 8.079 5.414
141 HD13 ILE 17 HD13 ILE 17 0.645 6.639 6.452
142 H ALA 18 H ALA 18 2.369 7.084 0.353
143 HA ALA 18 HA ALA 18 4.504 8.906 -0.128
144 HB1 ALA 18 HB1 ALA 18 4.651 8.007 -2.408
145 HB2 ALA 18 HB2 ALA 18 4.334 6.658 -1.277
146 HB3 ALA 18 HB3 ALA 18 3.013 7.311 -2.301
147 H ALA 19 H ALA 19 0.971 9.124 -0.995
148 HA ALA 19 HA ALA 19 1.108 10.805 -3.157
149 HB1 ALA 19 HB1 ALA 19 -1.115 10.242 -2.263
150 HB2 ALA 19 HB2 ALA 19 -0.776 11.125 -0.738
151 HB3 ALA 19 HB3 ALA 19 -0.975 12.016 -2.278
152 H HIS 20 H HIS 20 1.622 11.827 0.321
153 HA HIS 20 HA HIS 20 1.686 14.588 -0.284
154 HB2 HIS 20 HB2 HIS 20 1.747 13.494 2.088
155 HB3 HIS 20 HB3 HIS 20 3.506 13.319 1.851
156 HD1 HIS 20 HD2 HIS 20 0.756 15.923 1.806
157 HD2 HIS 20 HD3 HIS 20 4.912 15.615 2.373
158 HE1 HIS 20 HE2 HIS 20 1.506 18.215 2.544
159 H VAL 21 H VAL 21 4.349 12.089 -0.311
160 HA VAL 21 HA VAL 21 6.293 14.083 -1.237
161 HB VAL 21 HB VAL 21 6.487 11.027 -1.021
162 HG11 VAL 21 HG11 VAL 21 8.655 13.092 -1.751
163 HG12 VAL 21 HG12 VAL 21 8.941 11.365 -1.387
164 HG13 VAL 21 HG13 VAL 21 8.007 11.822 -2.831
165 HG21 VAL 21 HG21 VAL 21 7.932 11.525 0.930
166 HG22 VAL 21 HG22 VAL 21 7.698 13.280 0.699
167 HG23 VAL 21 HG23 VAL 21 6.320 12.246 1.174
168 H ALA 22 H ALA 22 4.946 11.046 -2.836
169 HA ALA 22 HA ALA 22 5.670 12.342 -5.464
170 HB1 ALA 22 HB1 ALA 22 5.739 10.037 -6.336
171 HB2 ALA 22 HB2 ALA 22 6.787 10.186 -4.894
172 HB3 ALA 22 HB3 ALA 22 5.189 9.395 -4.759
173 H SER 23 H SER 23 3.393 13.523 -4.516
174 HA SER 23 HA SER 23 1.157 13.862 -5.118
175 HB2 SER 23 HB2 SER 23 2.241 12.598 -7.712
176 HB3 SER 23 HB3 SER 23 0.817 13.668 -7.585
177 HG SER 23 HG SER 23 2.371 15.330 -6.834
Start of MODEL 14
1 H1 GLY 1 H GLY 1 -1.319 -15.893 -0.815
2 H2 GLY 1 H2 GLY 1 -0.224 -15.943 -1.101
3 HA2 GLY 1 HA2 GLY 1 -1.175 -16.180 1.658
4 HA3 GLY 1 HA3 GLY 1 0.471 -16.825 1.389
5 H LEU 2 H LEU 2 -0.320 -14.353 2.981
6 HA LEU 2 HA LEU 2 0.260 -12.081 3.100
7 HB2 LEU 2 HB2 LEU 2 2.689 -13.016 1.472
8 HB3 LEU 2 HB3 LEU 2 2.622 -11.648 2.607
9 HG LEU 2 HG LEU 2 2.378 -14.634 3.358
10 HD11 LEU 2 HD11 LEU 2 4.647 -14.337 4.362
11 HD12 LEU 2 HD12 LEU 2 4.694 -12.643 3.792
12 HD13 LEU 2 HD13 LEU 2 4.679 -13.989 2.614
13 HD21 LEU 2 HD21 LEU 2 1.103 -13.257 5.000
14 HD22 LEU 2 HD22 LEU 2 2.479 -12.122 5.154
15 HD23 LEU 2 HD23 LEU 2 2.621 -13.804 5.742
16 H LYS 3 H LYS 3 -1.569 -12.675 0.953
17 HA LYS 3 HA LYS 3 -0.525 -10.858 -1.212
18 HB2 LYS 3 HB2 LYS 3 -1.270 -13.110 -1.912
19 HB3 LYS 3 HB3 LYS 3 -2.900 -12.795 -1.272
20 HG2 LYS 3 HG2 LYS 3 -3.119 -10.813 -2.842
21 HG3 LYS 3 HG3 LYS 3 -1.481 -11.160 -3.465
22 HD2 LYS 3 HD2 LYS 3 -2.268 -13.420 -4.266
23 HD3 LYS 3 HD3 LYS 3 -3.886 -13.084 -3.597
24 HE2 LYS 3 HE2 LYS 3 -3.931 -12.720 -6.007
25 HE3 LYS 3 HE3 LYS 3 -4.152 -11.153 -5.190
26 HZ1 LYS 3 HZ1 LYS 3 -1.511 -12.146 -6.325
27 HZ2 LYS 3 HZ2 LYS 3 -1.840 -10.535 -5.719
28 HZ3 LYS 3 HZ3 LYS 3 -2.608 -11.085 -7.155
29 H GLU 4 H GLU 4 -3.658 -11.534 0.633
30 HA GLU 4 HA GLU 4 -4.917 -9.139 -0.083
31 HB2 GLU 4 HB2 GLU 4 -4.998 -10.619 2.615
32 HB3 GLU 4 HB3 GLU 4 -6.036 -9.222 2.252
33 HG2 GLU 4 HG2 GLU 4 -6.041 -11.862 0.657
34 HG3 GLU 4 HG3 GLU 4 -7.240 -11.379 1.880
35 H ILE 5 H ILE 5 -2.514 -9.725 2.613
36 HA ILE 5 HA ILE 5 -2.723 -6.988 3.535
37 HB ILE 5 HB ILE 5 -0.374 -8.926 3.881
38 HG12 ILE 5 HG12 ILE 5 -2.282 -10.038 4.890
39 HG13 ILE 5 HG13 ILE 5 -1.307 -9.338 6.186
40 HG21 ILE 5 HG21 ILE 5 -1.068 -6.306 5.352
41 HG22 ILE 5 HG22 ILE 5 0.209 -7.450 5.851
42 HG23 ILE 5 HG23 ILE 5 0.332 -6.605 4.295
43 HD11 ILE 5 HD11 ILE 5 -3.683 -9.001 6.679
44 HD12 ILE 5 HD12 ILE 5 -2.986 -7.400 6.329
45 HD13 ILE 5 HD13 ILE 5 -3.984 -8.240 5.102
46 H PHE 6 H PHE 6 -0.441 -8.686 1.213
47 HA PHE 6 HA PHE 6 1.100 -6.253 0.901
48 HB2 PHE 6 HB2 PHE 6 0.933 -8.731 -0.893
49 HB3 PHE 6 HB3 PHE 6 2.011 -7.342 -1.174
50 HD1 PHE 6 HD2 PHE 6 1.712 -8.066 2.439
51 HD2 PHE 6 HD1 PHE 6 3.740 -9.177 -1.201
52 HE1 PHE 6 HE2 PHE 6 3.522 -9.054 3.748
53 HE2 PHE 6 HE1 PHE 6 5.583 -10.132 0.136
54 HZ PHE 6 HZ PHE 6 5.480 -10.081 2.618
55 H LYS 7 H LYS 7 -2.035 -7.229 -0.576
56 HA LYS 7 HA LYS 7 -1.737 -4.774 -2.313
57 HB2 LYS 7 HB2 LYS 7 -3.716 -5.431 -3.463
58 HB3 LYS 7 HB3 LYS 7 -2.553 -6.774 -3.514
59 HG2 LYS 7 HG2 LYS 7 -3.899 -8.186 -2.192
60 HG3 LYS 7 HG3 LYS 7 -4.577 -6.847 -1.238
61 HD2 LYS 7 HD2 LYS 7 -6.354 -7.836 -2.563
62 HD3 LYS 7 HD3 LYS 7 -6.047 -6.169 -3.110
63 HE2 LYS 7 HE2 LYS 7 -4.678 -7.108 -5.055
64 HE3 LYS 7 HE3 LYS 7 -5.067 -8.753 -4.486
65 HZ1 LYS 7 HZ1 LYS 7 -6.588 -8.038 -6.286
66 HZ2 LYS 7 HZ2 LYS 7 -7.073 -6.642 -5.370
67 HZ3 LYS 7 HZ3 LYS 7 -7.483 -8.242 -4.810
68 H ALA 8 H ALA 8 -1.897 -4.520 0.663
69 HA ALA 8 HA ALA 8 -4.229 -2.697 0.612
70 HB1 ALA 8 HB1 ALA 8 -5.291 -3.668 2.637
71 HB2 ALA 8 HB2 ALA 8 -5.305 -4.835 1.280
72 HB3 ALA 8 HB3 ALA 8 -4.139 -5.032 2.617
73 H GLY 9 H GLY 9 -1.927 -4.246 3.082
74 HA2 GLY 9 HA2 GLY 9 -1.648 -1.841 4.567
75 HA3 GLY 9 HA3 GLY 9 -0.394 -3.101 4.458
76 H LEU 10 H LEU 10 0.935 -3.136 2.293
77 HA LEU 10 HA LEU 10 1.792 -0.378 1.815
78 HB2 LEU 10 HB2 LEU 10 3.595 -1.287 0.542
79 HB3 LEU 10 HB3 LEU 10 3.345 -2.316 1.961
80 HG LEU 10 HG LEU 10 1.729 -3.603 0.047
81 HD11 LEU 10 HD11 LEU 10 4.222 -2.619 -1.475
82 HD12 LEU 10 HD12 LEU 10 2.553 -2.076 -1.798
83 HD13 LEU 10 HD13 LEU 10 3.003 -3.778 -2.071
84 HD21 LEU 10 HD21 LEU 10 3.306 -4.763 1.557
85 HD22 LEU 10 HD22 LEU 10 4.696 -4.163 0.604
86 HD23 LEU 10 HD23 LEU 10 3.534 -5.312 -0.123
87 H GLY 11 H GLY 11 -0.652 -2.448 0.261
88 HA2 GLY 11 HA2 GLY 11 -0.263 -1.352 -2.396
89 HA3 GLY 11 HA3 GLY 11 -1.725 -2.171 -1.810
90 H SER 12 H SER 12 -2.709 -0.649 0.258
91 HA SER 12 HA SER 12 -3.702 1.655 -1.317
92 HB2 SER 12 HB2 SER 12 -5.314 0.233 -0.053
93 HB3 SER 12 HB3 SER 12 -4.498 0.652 1.478
94 HG SER 12 HG SER 12 -5.780 2.580 -0.219
95 H LEU 13 H LEU 13 -1.916 1.091 1.860
96 HA LEU 13 HA LEU 13 -2.176 3.856 2.584
97 HB2 LEU 13 HB2 LEU 13 0.081 1.976 3.465
98 HB3 LEU 13 HB3 LEU 13 -0.359 3.520 4.215
99 HG LEU 13 HG LEU 13 -2.179 1.021 4.203
100 HD11 LEU 13 HD11 LEU 13 -1.622 0.886 6.618
101 HD12 LEU 13 HD12 LEU 13 -0.529 2.293 6.469
102 HD13 LEU 13 HD13 LEU 13 -0.141 0.760 5.634
103 HD21 LEU 13 HD21 LEU 13 -2.549 3.777 5.522
104 HD22 LEU 13 HD22 LEU 13 -3.528 2.328 5.890
105 HD23 LEU 13 HD23 LEU 13 -3.595 3.042 4.267
106 H VAL 14 H VAL 14 0.423 2.095 0.685
107 HA VAL 14 HA VAL 14 2.249 4.210 0.770
108 HB VAL 14 HB VAL 14 2.702 2.003 -0.369
109 HG11 VAL 14 HG11 VAL 14 0.593 1.984 -1.844
110 HG12 VAL 14 HG12 VAL 14 1.334 3.255 -2.851
111 HG13 VAL 14 HG13 VAL 14 2.102 1.651 -2.734
112 HG21 VAL 14 HG21 VAL 14 4.254 2.932 -2.076
113 HG22 VAL 14 HG22 VAL 14 3.405 4.500 -2.042
114 HG23 VAL 14 HG23 VAL 14 4.285 3.927 -0.596
115 H LYS 15 H LYS 15 -0.773 3.905 -1.252
116 HA LYS 15 HA LYS 15 -0.065 6.109 -2.930
117 HB2 LYS 15 HB2 LYS 15 -1.880 4.547 -3.528
118 HB3 LYS 15 HB3 LYS 15 -2.868 5.133 -2.153
119 HG2 LYS 15 HG2 LYS 15 -3.032 7.385 -3.143
120 HG3 LYS 15 HG3 LYS 15 -1.858 6.959 -4.414
121 HD2 LYS 15 HD2 LYS 15 -4.121 7.009 -5.311
122 HD3 LYS 15 HD3 LYS 15 -3.450 5.370 -5.461
123 HE2 LYS 15 HE2 LYS 15 -5.194 6.020 -3.026
124 HE3 LYS 15 HE3 LYS 15 -5.981 5.821 -4.607
125 HZ1 LYS 15 HZ1 LYS 15 -4.266 3.658 -3.341
126 HZ2 LYS 15 HZ2 LYS 15 -5.085 3.586 -4.863
127 HZ3 LYS 15 HZ3 LYS 15 -5.987 3.725 -3.387
128 H GLY 16 H GLY 16 -2.201 5.984 0.087
129 HA2 GLY 16 HA2 GLY 16 -2.629 8.813 0.053
130 HA3 GLY 16 HA3 GLY 16 -2.826 7.770 1.481
131 H ILE 17 H ILE 17 -0.044 6.792 1.656
132 HA ILE 17 HA ILE 17 0.908 9.075 3.205
133 HB ILE 17 HB ILE 17 2.222 6.369 2.601
134 HG12 ILE 17 HG12 ILE 17 0.875 7.462 5.159
135 HG13 ILE 17 HG13 ILE 17 0.116 6.334 4.013
136 HG21 ILE 17 HG21 ILE 17 3.148 8.570 4.547
137 HG22 ILE 17 HG22 ILE 17 3.916 6.970 4.327
138 HG23 ILE 17 HG23 ILE 17 3.964 8.149 3.014
139 HD11 ILE 17 HD11 ILE 17 0.943 5.029 5.884
140 HD12 ILE 17 HD12 ILE 17 1.985 4.659 4.478
141 HD13 ILE 17 HD13 ILE 17 2.566 5.738 5.784
142 H ALA 18 H ALA 18 2.286 7.245 0.330
143 HA ALA 18 HA ALA 18 4.352 9.167 -0.040
144 HB1 ALA 18 HB1 ALA 18 3.099 7.420 -2.247
145 HB2 ALA 18 HB2 ALA 18 4.709 8.193 -2.270
146 HB3 ALA 18 HB3 ALA 18 4.376 6.876 -1.110
147 H ALA 19 H ALA 19 0.870 9.282 -1.030
148 HA ALA 19 HA ALA 19 0.997 10.896 -3.250
149 HB1 ALA 19 HB1 ALA 19 -1.078 12.119 -2.420
150 HB2 ALA 19 HB2 ALA 19 -1.227 10.352 -2.292
151 HB3 ALA 19 HB3 ALA 19 -0.873 11.324 -0.832
152 H HIS 20 H HIS 20 1.460 11.994 0.214
153 HA HIS 20 HA HIS 20 1.538 14.745 -0.459
154 HB2 HIS 20 HB2 HIS 20 1.481 13.670 1.919
155 HB3 HIS 20 HB3 HIS 20 3.258 13.597 1.815
156 HD1 HIS 20 HD2 HIS 20 4.121 16.212 0.827
157 HD2 HIS 20 HD3 HIS 20 0.648 15.800 3.160
158 HE1 HIS 20 HE2 HIS 20 3.674 18.502 1.797
159 H VAL 21 H VAL 21 4.230 12.265 -0.211
160 HA VAL 21 HA VAL 21 6.185 14.270 -1.101
161 HB VAL 21 HB VAL 21 6.462 11.246 -0.668
162 HG11 VAL 21 HG11 VAL 21 8.925 11.659 -0.881
163 HG12 VAL 21 HG12 VAL 21 8.088 11.990 -2.416
164 HG13 VAL 21 HG13 VAL 21 8.608 13.347 -1.374
165 HG21 VAL 21 HG21 VAL 21 7.457 13.650 0.978
166 HG22 VAL 21 HG22 VAL 21 6.084 12.593 1.417
167 HG23 VAL 21 HG23 VAL 21 7.734 11.923 1.343
168 H ALA 22 H ALA 22 5.175 11.071 -2.619
169 HA ALA 22 HA ALA 22 6.010 12.228 -5.243
170 HB1 ALA 22 HB1 ALA 22 5.126 9.384 -4.502
171 HB2 ALA 22 HB2 ALA 22 5.810 9.913 -6.066
172 HB3 ALA 22 HB3 ALA 22 6.813 9.969 -4.585
173 H SER 23 H SER 23 4.006 13.822 -4.811
174 HA SER 23 HA SER 23 1.880 14.433 -5.554
175 HB2 SER 23 HB2 SER 23 2.563 12.330 -7.703
176 HB3 SER 23 HB3 SER 23 1.397 13.670 -7.879
177 HG SER 23 HG SER 23 3.297 15.104 -7.596
Start of MODEL 15
1 H1 GLY 1 H GLY 1 0.127 -16.826 -0.373
2 H2 GLY 1 H2 GLY 1 0.484 -16.682 -0.183
3 HA2 GLY 1 HA2 GLY 1 -1.869 -15.824 0.766
4 HA3 GLY 1 HA3 GLY 1 -1.041 -16.222 2.298
5 H LEU 2 H LEU 2 -0.708 -13.994 3.063
6 HA LEU 2 HA LEU 2 0.166 -11.817 3.011
7 HB2 LEU 2 HB2 LEU 2 2.345 -13.083 1.254
8 HB3 LEU 2 HB3 LEU 2 2.505 -11.672 2.323
9 HG LEU 2 HG LEU 2 2.020 -14.591 3.220
10 HD11 LEU 2 HD11 LEU 2 4.378 -14.498 4.037
11 HD12 LEU 2 HD12 LEU 2 4.552 -12.839 3.393
12 HD13 LEU 2 HD13 LEU 2 4.307 -14.215 2.278
13 HD21 LEU 2 HD21 LEU 2 2.528 -13.714 5.541
14 HD22 LEU 2 HD22 LEU 2 1.021 -13.034 4.891
15 HD23 LEU 2 HD23 LEU 2 2.514 -12.045 4.898
16 H LYS 3 H LYS 3 -1.939 -12.156 1.245
17 HA LYS 3 HA LYS 3 -0.962 -10.652 -1.173
18 HB2 LYS 3 HB2 LYS 3 -1.675 -13.118 -1.514
19 HB3 LYS 3 HB3 LYS 3 -3.319 -12.604 -1.092
20 HG2 LYS 3 HG2 LYS 3 -3.234 -12.587 -3.480
21 HG3 LYS 3 HG3 LYS 3 -3.142 -10.867 -3.022
22 HD2 LYS 3 HD2 LYS 3 -0.635 -10.920 -3.426
23 HD3 LYS 3 HD3 LYS 3 -0.725 -12.669 -3.758
24 HE2 LYS 3 HE2 LYS 3 -2.166 -12.212 -5.756
25 HE3 LYS 3 HE3 LYS 3 -2.139 -10.472 -5.373
26 HZ1 LYS 3 HZ1 LYS 3 -0.500 -11.019 -7.119
27 HZ2 LYS 3 HZ2 LYS 3 0.285 -12.164 -6.068
28 HZ3 LYS 3 HZ3 LYS 3 0.320 -10.457 -5.694
29 H GLU 4 H GLU 4 -4.041 -11.292 0.778
30 HA GLU 4 HA GLU 4 -5.250 -8.840 -0.018
31 HB2 GLU 4 HB2 GLU 4 -5.445 -10.302 2.695
32 HB3 GLU 4 HB3 GLU 4 -6.457 -8.911 2.226
33 HG2 GLU 4 HG2 GLU 4 -7.414 -10.189 0.310
34 HG3 GLU 4 HG3 GLU 4 -6.404 -11.600 0.708
35 H ILE 5 H ILE 5 -2.887 -9.612 2.672
36 HA ILE 5 HA ILE 5 -2.921 -6.934 3.711
37 HB ILE 5 HB ILE 5 -0.609 -8.946 3.778
38 HG12 ILE 5 HG12 ILE 5 -2.494 -9.998 4.917
39 HG13 ILE 5 HG13 ILE 5 -1.335 -9.434 6.124
40 HG21 ILE 5 HG21 ILE 5 0.198 -7.563 5.746
41 HG22 ILE 5 HG22 ILE 5 0.246 -6.685 4.204
42 HG23 ILE 5 HG23 ILE 5 -1.054 -6.345 5.369
43 HD11 ILE 5 HD11 ILE 5 -3.610 -8.982 6.906
44 HD12 ILE 5 HD12 ILE 5 -2.848 -7.411 6.564
45 HD13 ILE 5 HD13 ILE 5 -4.036 -8.109 5.420
46 H PHE 6 H PHE 6 -0.788 -8.551 1.199
47 HA PHE 6 HA PHE 6 0.715 -6.112 0.811
48 HB2 PHE 6 HB2 PHE 6 0.339 -8.523 -1.047
49 HB3 PHE 6 HB3 PHE 6 1.399 -7.134 -1.387
50 HD1 PHE 6 HD2 PHE 6 1.440 -8.008 2.211
51 HD2 PHE 6 HD1 PHE 6 3.105 -8.972 -1.649
52 HE1 PHE 6 HE2 PHE 6 3.351 -9.068 3.300
53 HE2 PHE 6 HE1 PHE 6 5.054 -9.997 -0.533
54 HZ PHE 6 HZ PHE 6 5.183 -10.059 1.948
55 H LYS 7 H LYS 7 -2.513 -7.124 -0.381
56 HA LYS 7 HA LYS 7 -2.549 -4.516 -1.931
57 HB2 LYS 7 HB2 LYS 7 -4.380 -6.971 -2.069
58 HB3 LYS 7 HB3 LYS 7 -4.651 -5.428 -2.927
59 HG2 LYS 7 HG2 LYS 7 -2.477 -5.652 -4.121
60 HG3 LYS 7 HG3 LYS 7 -2.149 -7.197 -3.287
61 HD2 LYS 7 HD2 LYS 7 -4.085 -8.267 -4.383
62 HD3 LYS 7 HD3 LYS 7 -4.624 -6.710 -5.076
63 HE2 LYS 7 HE2 LYS 7 -2.572 -6.554 -6.467
64 HE3 LYS 7 HE3 LYS 7 -1.944 -8.063 -5.761
65 HZ1 LYS 7 HZ1 LYS 7 -2.988 -8.475 -7.950
66 HZ2 LYS 7 HZ2 LYS 7 -4.487 -7.779 -7.411
67 HZ3 LYS 7 HZ3 LYS 7 -3.919 -9.269 -6.715
68 H ALA 8 H ALA 8 -2.344 -4.273 0.840
69 HA ALA 8 HA ALA 8 -4.792 -2.707 1.150
70 HB1 ALA 8 HB1 ALA 8 -5.477 -3.673 3.351
71 HB2 ALA 8 HB2 ALA 8 -5.663 -4.864 2.033
72 HB3 ALA 8 HB3 ALA 8 -4.285 -4.986 3.160
73 H GLY 9 H GLY 9 -2.061 -4.068 3.273
74 HA2 GLY 9 HA2 GLY 9 -1.759 -1.544 4.622
75 HA3 GLY 9 HA3 GLY 9 -0.515 -2.807 4.530
76 H LEU 10 H LEU 10 0.831 -2.944 2.447
77 HA LEU 10 HA LEU 10 1.662 -0.308 1.721
78 HB2 LEU 10 HB2 LEU 10 3.226 -1.321 0.185
79 HB3 LEU 10 HB3 LEU 10 3.122 -2.302 1.657
80 HG LEU 10 HG LEU 10 1.285 -3.662 0.171
81 HD11 LEU 10 HD11 LEU 10 1.511 -2.135 -1.870
82 HD12 LEU 10 HD12 LEU 10 1.962 -3.818 -2.222
83 HD13 LEU 10 HD13 LEU 10 3.229 -2.587 -1.978
84 HD21 LEU 10 HD21 LEU 10 3.089 -5.263 -0.501
85 HD22 LEU 10 HD22 LEU 10 3.273 -4.716 1.184
86 HD23 LEU 10 HD23 LEU 10 4.322 -4.033 -0.094
87 H GLY 11 H GLY 11 -0.906 -2.409 0.323
88 HA2 GLY 11 HA2 GLY 11 -0.892 -1.208 -2.276
89 HA3 GLY 11 HA3 GLY 11 -2.292 -1.997 -1.521
90 H SER 12 H SER 12 -3.000 -0.483 0.656
91 HA SER 12 HA SER 12 -4.077 1.876 -0.774
92 HB2 SER 12 HB2 SER 12 -5.573 0.479 0.671
93 HB3 SER 12 HB3 SER 12 -4.591 0.910 2.098
94 HG SER 12 HG SER 12 -6.013 2.831 0.513
95 H LEU 13 H LEU 13 -1.975 1.209 2.171
96 HA LEU 13 HA LEU 13 -2.045 3.955 2.977
97 HB2 LEU 13 HB2 LEU 13 0.201 1.935 3.526
98 HB3 LEU 13 HB3 LEU 13 -0.023 3.492 4.351
99 HG LEU 13 HG LEU 13 -2.003 1.126 4.537
100 HD11 LEU 13 HD11 LEU 13 0.016 2.220 6.586
101 HD12 LEU 13 HD12 LEU 13 0.177 0.684 5.681
102 HD13 LEU 13 HD13 LEU 13 -1.146 0.889 6.857
103 HD21 LEU 13 HD21 LEU 13 -2.000 3.868 5.938
104 HD22 LEU 13 HD22 LEU 13 -3.016 2.479 6.420
105 HD23 LEU 13 HD23 LEU 13 -3.257 3.230 4.833
106 H VAL 14 H VAL 14 0.241 2.209 0.706
107 HA VAL 14 HA VAL 14 2.143 4.250 0.635
108 HB VAL 14 HB VAL 14 2.340 2.107 -0.673
109 HG11 VAL 14 HG11 VAL 14 1.363 1.888 -2.923
110 HG12 VAL 14 HG12 VAL 14 0.027 2.232 -1.792
111 HG13 VAL 14 HG13 VAL 14 0.652 3.523 -2.850
112 HG21 VAL 14 HG21 VAL 14 2.869 4.657 -2.328
113 HG22 VAL 14 HG22 VAL 14 3.935 3.999 -1.053
114 HG23 VAL 14 HG23 VAL 14 3.649 3.068 -2.548
115 H LYS 15 H LYS 15 -1.150 4.203 -0.933
116 HA LYS 15 HA LYS 15 -0.604 6.571 -2.485
117 HB2 LYS 15 HB2 LYS 15 -3.307 5.527 -1.445
118 HB3 LYS 15 HB3 LYS 15 -3.092 6.886 -2.579
119 HG2 LYS 15 HG2 LYS 15 -1.985 5.379 -4.232
120 HG3 LYS 15 HG3 LYS 15 -2.127 3.997 -3.112
121 HD2 LYS 15 HD2 LYS 15 -4.626 4.180 -3.171
122 HD3 LYS 15 HD3 LYS 15 -4.506 5.578 -4.278
123 HE2 LYS 15 HE2 LYS 15 -3.371 4.132 -5.992
124 HE3 LYS 15 HE3 LYS 15 -3.472 2.734 -4.886
125 HZ1 LYS 15 HZ1 LYS 15 -5.844 4.262 -6.016
126 HZ2 LYS 15 HZ2 LYS 15 -5.936 2.886 -4.944
127 HZ3 LYS 15 HZ3 LYS 15 -5.286 2.702 -6.547
128 H GLY 16 H GLY 16 -2.327 6.137 0.759
129 HA2 GLY 16 HA2 GLY 16 -2.686 8.913 1.150
130 HA3 GLY 16 HA3 GLY 16 -2.560 7.727 2.473
131 H ILE 17 H ILE 17 0.224 6.847 1.850
132 HA ILE 17 HA ILE 17 1.444 9.040 3.410
133 HB ILE 17 HB ILE 17 2.543 6.307 2.563
134 HG12 ILE 17 HG12 ILE 17 1.553 7.337 5.300
135 HG13 ILE 17 HG13 ILE 17 0.610 6.299 4.208
136 HG21 ILE 17 HG21 ILE 17 4.379 8.021 2.824
137 HG22 ILE 17 HG22 ILE 17 3.770 8.400 4.461
138 HG23 ILE 17 HG23 ILE 17 4.449 6.788 4.089
139 HD11 ILE 17 HD11 ILE 17 2.423 4.521 4.366
140 HD12 ILE 17 HD12 ILE 17 3.227 5.508 5.626
141 HD13 ILE 17 HD13 ILE 17 1.593 4.874 5.909
142 H ALA 18 H ALA 18 2.364 7.222 0.339
143 HA ALA 18 HA ALA 18 4.453 9.057 -0.231
144 HB1 ALA 18 HB1 ALA 18 4.249 6.814 -1.371
145 HB2 ALA 18 HB2 ALA 18 2.859 7.440 -2.316
146 HB3 ALA 18 HB3 ALA 18 4.480 8.157 -2.529
147 H ALA 19 H ALA 19 0.886 9.298 -0.930
148 HA ALA 19 HA ALA 19 0.945 10.997 -3.090
149 HB1 ALA 19 HB1 ALA 19 -1.244 10.432 -2.119
150 HB2 ALA 19 HB2 ALA 19 -0.845 11.296 -0.599
151 HB3 ALA 19 HB3 ALA 19 -1.094 12.204 -2.123
152 H HIS 20 H HIS 20 1.577 11.979 0.382
153 HA HIS 20 HA HIS 20 1.683 14.749 -0.202
154 HB2 HIS 20 HB2 HIS 20 1.724 13.687 2.124
155 HB3 HIS 20 HB3 HIS 20 3.465 13.373 1.903
156 HD1 HIS 20 HD2 HIS 20 4.828 15.708 1.226
157 HD2 HIS 20 HD3 HIS 20 1.071 16.048 3.082
158 HE1 HIS 20 HE2 HIS 20 4.728 18.065 2.141
159 H VAL 21 H VAL 21 4.302 12.192 -0.308
160 HA VAL 21 HA VAL 21 6.247 14.181 -1.255
161 HB VAL 21 HB VAL 21 6.443 11.130 -1.009
162 HG11 VAL 21 HG11 VAL 21 8.896 11.474 -1.397
163 HG12 VAL 21 HG12 VAL 21 7.953 11.916 -2.840
164 HG13 VAL 21 HG13 VAL 21 8.604 13.196 -1.775
165 HG21 VAL 21 HG21 VAL 21 7.657 13.404 0.677
166 HG22 VAL 21 HG22 VAL 21 6.287 12.370 1.172
167 HG23 VAL 21 HG23 VAL 21 7.900 11.652 0.926
168 H ALA 22 H ALA 22 4.932 11.123 -2.843
169 HA ALA 22 HA ALA 22 5.604 12.445 -5.471
170 HB1 ALA 22 HB1 ALA 22 5.724 10.149 -6.356
171 HB2 ALA 22 HB2 ALA 22 6.769 10.310 -4.915
172 HB3 ALA 22 HB3 ALA 22 5.187 9.488 -4.783
173 H SER 23 H SER 23 3.274 13.533 -4.436
174 HA SER 23 HA SER 23 1.029 13.818 -5.036
175 HB2 SER 23 HB2 SER 23 2.200 12.747 -7.676
176 HB3 SER 23 HB3 SER 23 0.709 13.729 -7.499
177 HG SER 23 HG SER 23 2.632 15.076 -7.944
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -3.164 -15.551 3.341
2 H2 GLY 1 H2 GLY 1 -2.627 -15.751 1.842
3 HA2 GLY 1 HA2 GLY 1 -1.085 -16.576 4.277
4 HA3 GLY 1 HA3 GLY 1 -0.485 -16.650 2.600
5 H LEU 2 H LEU 2 -0.335 -14.463 1.377
6 HA LEU 2 HA LEU 2 -0.269 -12.084 3.142
7 HB2 LEU 2 HB2 LEU 2 2.090 -11.566 2.661
8 HB3 LEU 2 HB3 LEU 2 1.974 -13.064 3.587
9 HG LEU 2 HG LEU 2 2.019 -13.378 0.554
10 HD11 LEU 2 HD11 LEU 2 4.526 -13.229 0.479
11 HD12 LEU 2 HD12 LEU 2 4.528 -12.585 2.149
12 HD13 LEU 2 HD13 LEU 2 3.748 -11.666 0.825
13 HD21 LEU 2 HD21 LEU 2 1.907 -15.396 2.110
14 HD22 LEU 2 HD22 LEU 2 3.479 -14.911 2.797
15 HD23 LEU 2 HD23 LEU 2 3.359 -15.390 1.082
16 H LYS 3 H LYS 3 -1.868 -12.866 0.734
17 HA LYS 3 HA LYS 3 -0.853 -10.775 -1.170
18 HB2 LYS 3 HB2 LYS 3 -3.103 -12.845 -1.361
19 HB3 LYS 3 HB3 LYS 3 -3.047 -11.406 -2.409
20 HG2 LYS 3 HG2 LYS 3 -0.813 -11.991 -3.257
21 HG3 LYS 3 HG3 LYS 3 -0.741 -13.418 -2.182
22 HD2 LYS 3 HD2 LYS 3 -2.536 -14.528 -3.414
23 HD3 LYS 3 HD3 LYS 3 -2.983 -13.030 -4.270
24 HE2 LYS 3 HE2 LYS 3 -1.770 -14.577 -5.775
25 HE3 LYS 3 HE3 LYS 3 -0.905 -13.033 -5.577
26 HZ1 LYS 3 HZ1 LYS 3 0.696 -14.093 -4.064
27 HZ2 LYS 3 HZ2 LYS 3 0.584 -15.021 -5.515
28 HZ3 LYS 3 HZ3 LYS 3 -0.222 -15.585 -4.079
29 H GLU 4 H GLU 4 -3.899 -11.519 0.791
30 HA GLU 4 HA GLU 4 -5.129 -9.061 0.214
31 HB2 GLU 4 HB2 GLU 4 -5.157 -10.601 2.886
32 HB3 GLU 4 HB3 GLU 4 -6.195 -9.195 2.531
33 HG2 GLU 4 HG2 GLU 4 -7.233 -10.406 0.595
34 HG3 GLU 4 HG3 GLU 4 -6.259 -11.852 0.957
35 H ILE 5 H ILE 5 -2.673 -9.812 2.842
36 HA ILE 5 HA ILE 5 -2.758 -7.093 3.819
37 HB ILE 5 HB ILE 5 -0.475 -9.126 4.066
38 HG12 ILE 5 HG12 ILE 5 -2.415 -10.150 5.121
39 HG13 ILE 5 HG13 ILE 5 -1.335 -9.544 6.382
40 HG21 ILE 5 HG21 ILE 5 0.232 -7.699 6.040
41 HG22 ILE 5 HG22 ILE 5 0.367 -6.854 4.486
42 HG23 ILE 5 HG23 ILE 5 -0.993 -6.487 5.573
43 HD11 ILE 5 HD11 ILE 5 -3.659 -9.083 7.001
44 HD12 ILE 5 HD12 ILE 5 -2.882 -7.517 6.660
45 HD13 ILE 5 HD13 ILE 5 -3.990 -8.258 5.463
46 H PHE 6 H PHE 6 -0.498 -8.797 1.469
47 HA PHE 6 HA PHE 6 1.019 -6.349 1.129
48 HB2 PHE 6 HB2 PHE 6 0.869 -8.848 -0.640
49 HB3 PHE 6 HB3 PHE 6 1.835 -7.415 -1.029
50 HD1 PHE 6 HD1 PHE 6 1.627 -8.459 2.584
51 HD2 PHE 6 HD2 PHE 6 3.874 -8.719 -1.086
52 HE1 PHE 6 HE1 PHE 6 3.582 -9.232 3.833
53 HE2 PHE 6 HE2 PHE 6 5.861 -9.416 0.196
54 HZ PHE 6 HZ PHE 6 5.723 -9.691 2.662
55 H LYS 7 H LYS 7 -2.174 -7.268 -0.070
56 HA LYS 7 HA LYS 7 -1.945 -4.940 -1.987
57 HB2 LYS 7 HB2 LYS 7 -2.501 -7.548 -2.664
58 HB3 LYS 7 HB3 LYS 7 -4.147 -7.003 -2.297
59 HG2 LYS 7 HG2 LYS 7 -2.127 -5.779 -4.308
60 HG3 LYS 7 HG3 LYS 7 -3.525 -6.810 -4.713
61 HD2 LYS 7 HD2 LYS 7 -5.109 -5.065 -3.978
62 HD3 LYS 7 HD3 LYS 7 -3.779 -4.037 -3.381
63 HE2 LYS 7 HE2 LYS 7 -4.587 -3.215 -5.558
64 HE3 LYS 7 HE3 LYS 7 -2.881 -3.720 -5.653
65 HZ1 LYS 7 HZ1 LYS 7 -5.208 -5.448 -6.554
66 HZ2 LYS 7 HZ2 LYS 7 -3.503 -5.748 -6.840
67 HZ3 LYS 7 HZ3 LYS 7 -4.276 -4.419 -7.605
68 H ALA 8 H ALA 8 -2.187 -4.578 0.815
69 HA ALA 8 HA ALA 8 -4.656 -3.002 0.713
70 HB1 ALA 8 HB1 ALA 8 -4.421 -5.191 2.877
71 HB2 ALA 8 HB2 ALA 8 -5.663 -3.911 2.798
72 HB3 ALA 8 HB3 ALA 8 -5.601 -5.170 1.530
73 H GLY 9 H GLY 9 -2.215 -4.290 3.209
74 HA2 GLY 9 HA2 GLY 9 -2.094 -1.740 4.533
75 HA3 GLY 9 HA3 GLY 9 -0.817 -2.978 4.596
76 H LEU 10 H LEU 10 0.736 -3.122 2.653
77 HA LEU 10 HA LEU 10 1.578 -0.489 1.955
78 HB2 LEU 10 HB2 LEU 10 3.271 -1.474 0.543
79 HB3 LEU 10 HB3 LEU 10 3.077 -2.441 2.015
80 HG LEU 10 HG LEU 10 1.431 -3.903 0.447
81 HD11 LEU 10 HD11 LEU 10 3.384 -2.697 -1.628
82 HD12 LEU 10 HD12 LEU 10 1.631 -2.393 -1.611
83 HD13 LEU 10 HD13 LEU 10 2.240 -4.030 -1.930
84 HD21 LEU 10 HD21 LEU 10 3.363 -5.393 -0.149
85 HD22 LEU 10 HD22 LEU 10 3.464 -4.823 1.535
86 HD23 LEU 10 HD23 LEU 10 4.496 -4.078 0.278
87 H GLY 11 H GLY 11 -0.774 -2.699 0.339
88 HA2 GLY 11 HA2 GLY 11 -0.655 -1.501 -2.239
89 HA3 GLY 11 HA3 GLY 11 -2.090 -2.300 -1.558
90 H SER 12 H SER 12 -2.905 -0.725 0.562
91 HA SER 12 HA SER 12 -3.946 1.578 -0.987
92 HB2 SER 12 HB2 SER 12 -5.477 0.163 0.398
93 HB3 SER 12 HB3 SER 12 -4.616 0.699 1.877
94 HG SER 12 HG SER 12 -6.468 2.103 1.374
95 H LEU 13 H LEU 13 -2.020 1.005 2.087
96 HA LEU 13 HA LEU 13 -2.101 3.736 2.869
97 HB2 LEU 13 HB2 LEU 13 0.157 1.720 3.372
98 HB3 LEU 13 HB3 LEU 13 0.009 3.288 4.188
99 HG LEU 13 HG LEU 13 -2.089 1.036 4.460
100 HD11 LEU 13 HD11 LEU 13 0.142 1.897 6.393
101 HD12 LEU 13 HD12 LEU 13 0.110 0.374 5.455
102 HD13 LEU 13 HD13 LEU 13 -1.111 0.665 6.719
103 HD21 LEU 13 HD21 LEU 13 -3.134 3.244 4.894
104 HD22 LEU 13 HD22 LEU 13 -1.768 3.716 5.947
105 HD23 LEU 13 HD23 LEU 13 -2.876 2.404 6.432
106 H VAL 14 H VAL 14 0.330 1.997 0.720
107 HA VAL 14 HA VAL 14 2.103 4.142 0.598
108 HB VAL 14 HB VAL 14 2.463 1.917 -0.560
109 HG11 VAL 14 HG11 VAL 14 1.638 1.538 -2.847
110 HG12 VAL 14 HG12 VAL 14 0.216 1.894 -1.836
111 HG13 VAL 14 HG13 VAL 14 0.871 3.145 -2.916
112 HG21 VAL 14 HG21 VAL 14 4.013 3.845 -0.946
113 HG22 VAL 14 HG22 VAL 14 3.855 2.832 -2.404
114 HG23 VAL 14 HG23 VAL 14 3.004 4.395 -2.313
115 H LYS 15 H LYS 15 -1.123 3.824 -1.057
116 HA LYS 15 HA LYS 15 -0.561 5.922 -2.906
117 HB2 LYS 15 HB2 LYS 15 -2.549 4.217 -2.912
118 HB3 LYS 15 HB3 LYS 15 -3.410 5.399 -1.905
119 HG2 LYS 15 HG2 LYS 15 -2.241 5.820 -4.740
120 HG3 LYS 15 HG3 LYS 15 -3.955 5.581 -4.314
121 HD2 LYS 15 HD2 LYS 15 -3.980 7.757 -3.074
122 HD3 LYS 15 HD3 LYS 15 -2.251 7.994 -3.448
123 HE2 LYS 15 HE2 LYS 15 -3.597 9.346 -4.963
124 HE3 LYS 15 HE3 LYS 15 -2.692 8.107 -5.868
125 HZ1 LYS 15 HZ1 LYS 15 -5.055 8.432 -6.624
126 HZ2 LYS 15 HZ2 LYS 15 -5.615 7.843 -5.084
127 HZ3 LYS 15 HZ3 LYS 15 -4.729 6.806 -6.184
128 H GLY 16 H GLY 16 -2.500 6.026 0.254
129 HA2 GLY 16 HA2 GLY 16 -2.697 8.876 0.155
130 HA3 GLY 16 HA3 GLY 16 -2.921 7.890 1.617
131 H ILE 17 H ILE 17 -0.175 6.708 1.662
132 HA ILE 17 HA ILE 17 0.974 8.936 3.161
133 HB ILE 17 HB ILE 17 2.140 6.193 2.454
134 HG12 ILE 17 HG12 ILE 17 0.138 6.042 3.951
135 HG13 ILE 17 HG13 ILE 17 1.643 5.480 4.703
136 HG21 ILE 17 HG21 ILE 17 4.016 7.705 2.827
137 HG22 ILE 17 HG22 ILE 17 3.260 8.393 4.285
138 HG23 ILE 17 HG23 ILE 17 3.834 6.699 4.283
139 HD11 ILE 17 HD11 ILE 17 0.270 8.190 5.271
140 HD12 ILE 17 HD12 ILE 17 0.265 6.747 6.309
141 HD13 ILE 17 HD13 ILE 17 1.789 7.618 6.028
142 H ALA 18 H ALA 18 2.105 7.072 0.196
143 HA ALA 18 HA ALA 18 4.231 8.935 -0.242
144 HB1 ALA 18 HB1 ALA 18 2.854 7.232 -2.408
145 HB2 ALA 18 HB2 ALA 18 4.483 7.957 -2.480
146 HB3 ALA 18 HB3 ALA 18 4.150 6.645 -1.315
147 H ALA 19 H ALA 19 0.714 9.131 -1.070
148 HA ALA 19 HA ALA 19 0.772 10.771 -3.280
149 HB1 ALA 19 HB1 ALA 19 -1.408 10.240 -2.195
150 HB2 ALA 19 HB2 ALA 19 -0.968 11.228 -0.771
151 HB3 ALA 19 HB3 ALA 19 -1.245 12.005 -2.357
152 H HIS 20 H HIS 20 1.464 11.788 0.173
153 HA HIS 20 HA HIS 20 1.582 14.551 -0.496
154 HB2 HIS 20 HB2 HIS 20 1.591 13.418 1.897
155 HB3 HIS 20 HB3 HIS 20 3.362 13.416 1.727
156 HD1 HIS 20 HD2 HIS 20 3.993 16.097 0.616
157 HD2 HIS 20 HD3 HIS 20 0.799 15.471 3.277
158 HE1 HIS 20 HE2 HIS 20 3.503 18.355 1.644
159 H VAL 21 H VAL 21 4.195 11.980 -0.324
160 HA VAL 21 HA VAL 21 6.197 13.915 -1.240
161 HB VAL 21 HB VAL 21 6.357 10.874 -0.887
162 HG11 VAL 21 HG11 VAL 21 8.570 12.889 -1.626
163 HG12 VAL 21 HG12 VAL 21 8.835 11.181 -1.174
164 HG13 VAL 21 HG13 VAL 21 7.962 11.576 -2.673
165 HG21 VAL 21 HG21 VAL 21 7.730 11.450 1.098
166 HG22 VAL 21 HG22 VAL 21 7.520 13.193 0.773
167 HG23 VAL 21 HG23 VAL 21 6.117 12.194 1.244
168 H ALA 22 H ALA 22 5.019 10.795 -2.807
169 HA ALA 22 HA ALA 22 5.826 11.977 -5.425
170 HB1 ALA 22 HB1 ALA 22 6.504 9.649 -4.846
171 HB2 ALA 22 HB2 ALA 22 4.786 9.172 -4.731
172 HB3 ALA 22 HB3 ALA 22 5.461 9.704 -6.298
173 H SER 23 H SER 23 3.905 13.661 -4.801
174 HA SER 23 HA SER 23 1.766 14.392 -5.398
175 HB2 SER 23 HB2 SER 23 2.380 12.519 -7.765
176 HB3 SER 23 HB3 SER 23 1.212 13.880 -7.765
177 HG SER 23 HG SER 23 3.363 14.535 -8.573
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -3.292 -14.662 4.314
2 H2 GLY 1 H2 GLY 1 -2.689 -14.484 4.799
3 HA2 GLY 1 HA2 GLY 1 -0.912 -16.096 3.225
4 HA3 GLY 1 HA3 GLY 1 -2.230 -15.455 2.198
5 H LEU 2 H LEU 2 0.043 -14.512 1.324
6 HA LEU 2 HA LEU 2 0.449 -11.789 2.624
7 HB2 LEU 2 HB2 LEU 2 2.350 -13.461 0.884
8 HB3 LEU 2 HB3 LEU 2 2.724 -11.900 1.654
9 HG LEU 2 HG LEU 2 2.101 -14.534 3.153
10 HD11 LEU 2 HD11 LEU 2 4.541 -14.576 3.686
11 HD12 LEU 2 HD12 LEU 2 4.797 -13.107 2.698
12 HD13 LEU 2 HD13 LEU 2 4.280 -14.634 1.924
13 HD21 LEU 2 HD21 LEU 2 1.488 -12.584 4.582
14 HD22 LEU 2 HD22 LEU 2 3.054 -11.798 4.219
15 HD23 LEU 2 HD23 LEU 2 2.995 -13.303 5.180
16 H LYS 3 H LYS 3 -1.790 -11.877 1.277
17 HA LYS 3 HA LYS 3 -1.103 -10.702 -1.387
18 HB2 LYS 3 HB2 LYS 3 -2.153 -13.369 -1.038
19 HB3 LYS 3 HB3 LYS 3 -3.543 -12.375 -1.503
20 HG2 LYS 3 HG2 LYS 3 -2.622 -13.299 -3.500
21 HG3 LYS 3 HG3 LYS 3 -2.233 -11.560 -3.530
22 HD2 LYS 3 HD2 LYS 3 0.123 -12.088 -2.780
23 HD3 LYS 3 HD3 LYS 3 -0.283 -13.815 -2.669
24 HE2 LYS 3 HE2 LYS 3 -0.366 -12.128 -5.256
25 HE3 LYS 3 HE3 LYS 3 1.010 -13.134 -4.737
26 HZ1 LYS 3 HZ1 LYS 3 -1.742 -14.157 -5.509
27 HZ2 LYS 3 HZ2 LYS 3 -0.476 -15.137 -4.806
28 HZ3 LYS 3 HZ3 LYS 3 -0.255 -14.371 -6.348
29 H GLU 4 H GLU 4 -4.040 -11.448 0.733
30 HA GLU 4 HA GLU 4 -5.336 -9.020 0.018
31 HB2 GLU 4 HB2 GLU 4 -5.339 -10.491 2.734
32 HB3 GLU 4 HB3 GLU 4 -6.398 -9.112 2.350
33 HG2 GLU 4 HG2 GLU 4 -6.412 -11.797 0.823
34 HG3 GLU 4 HG3 GLU 4 -7.579 -11.305 2.071
35 H ILE 5 H ILE 5 -2.861 -9.726 2.629
36 HA ILE 5 HA ILE 5 -2.919 -7.017 3.608
37 HB ILE 5 HB ILE 5 -0.590 -9.009 3.735
38 HG12 ILE 5 HG12 ILE 5 -2.446 -10.087 4.876
39 HG13 ILE 5 HG13 ILE 5 -1.342 -9.442 6.095
40 HG21 ILE 5 HG21 ILE 5 0.184 -7.583 5.676
41 HG22 ILE 5 HG22 ILE 5 0.215 -6.719 4.127
42 HG23 ILE 5 HG23 ILE 5 -1.092 -6.396 5.288
43 HD11 ILE 5 HD11 ILE 5 -4.068 -8.246 5.267
44 HD12 ILE 5 HD12 ILE 5 -3.654 -9.043 6.799
45 HD13 ILE 5 HD13 ILE 5 -2.942 -7.457 6.414
46 H PHE 6 H PHE 6 -0.767 -8.699 1.154
47 HA PHE 6 HA PHE 6 0.728 -6.270 0.712
48 HB2 PHE 6 HB2 PHE 6 0.376 -8.726 -1.085
49 HB3 PHE 6 HB3 PHE 6 1.439 -7.344 -1.446
50 HD1 PHE 6 HD1 PHE 6 1.443 -8.122 2.173
51 HD2 PHE 6 HD2 PHE 6 3.135 -9.211 -1.641
52 HE1 PHE 6 HE1 PHE 6 3.340 -9.154 3.309
53 HE2 PHE 6 HE2 PHE 6 5.081 -10.190 -0.479
54 HZ PHE 6 HZ PHE 6 5.195 -10.163 2.004
55 H LYS 7 H LYS 7 -2.491 -7.308 -0.434
56 HA LYS 7 HA LYS 7 -2.543 -4.803 -2.138
57 HB2 LYS 7 HB2 LYS 7 -4.396 -7.244 -2.029
58 HB3 LYS 7 HB3 LYS 7 -4.665 -5.851 -3.082
59 HG2 LYS 7 HG2 LYS 7 -2.219 -7.716 -3.190
60 HG3 LYS 7 HG3 LYS 7 -3.625 -7.801 -4.273
61 HD2 LYS 7 HD2 LYS 7 -1.553 -5.503 -4.177
62 HD3 LYS 7 HD3 LYS 7 -1.745 -6.770 -5.393
63 HE2 LYS 7 HE2 LYS 7 -2.863 -5.103 -6.528
64 HE3 LYS 7 HE3 LYS 7 -4.249 -5.743 -5.627
65 HZ1 LYS 7 HZ1 LYS 7 -4.143 -3.291 -5.576
66 HZ2 LYS 7 HZ2 LYS 7 -2.539 -3.322 -4.906
67 HZ3 LYS 7 HZ3 LYS 7 -3.896 -3.836 -3.968
68 H ALA 8 H ALA 8 -2.366 -4.448 0.659
69 HA ALA 8 HA ALA 8 -4.816 -2.872 0.879
70 HB1 ALA 8 HB1 ALA 8 -5.572 -3.797 3.073
71 HB2 ALA 8 HB2 ALA 8 -5.721 -5.012 1.771
72 HB3 ALA 8 HB3 ALA 8 -4.379 -5.119 2.943
73 H GLY 9 H GLY 9 -2.160 -4.216 3.104
74 HA2 GLY 9 HA2 GLY 9 -1.887 -1.663 4.416
75 HA3 GLY 9 HA3 GLY 9 -0.659 -2.945 4.408
76 H LEU 10 H LEU 10 0.797 -3.134 2.410
77 HA LEU 10 HA LEU 10 1.685 -0.537 1.655
78 HB2 LEU 10 HB2 LEU 10 3.271 -1.590 0.165
79 HB3 LEU 10 HB3 LEU 10 3.118 -2.544 1.650
80 HG LEU 10 HG LEU 10 1.327 -3.933 0.162
81 HD11 LEU 10 HD11 LEU 10 1.528 -2.442 -1.904
82 HD12 LEU 10 HD12 LEU 10 2.015 -4.118 -2.231
83 HD13 LEU 10 HD13 LEU 10 3.255 -2.858 -1.998
84 HD21 LEU 10 HD21 LEU 10 3.162 -5.518 -0.493
85 HD22 LEU 10 HD22 LEU 10 3.347 -4.948 1.183
86 HD23 LEU 10 HD23 LEU 10 4.374 -4.261 -0.110
87 H GLY 11 H GLY 11 -0.824 -2.658 0.164
88 HA2 GLY 11 HA2 GLY 11 -0.764 -1.469 -2.425
89 HA3 GLY 11 HA3 GLY 11 -2.193 -2.218 -1.684
90 H SER 12 H SER 12 -2.980 -0.678 0.407
91 HA SER 12 HA SER 12 -3.950 1.676 -1.085
92 HB2 SER 12 HB2 SER 12 -5.487 0.324 0.343
93 HB3 SER 12 HB3 SER 12 -4.562 0.813 1.798
94 HG SER 12 HG SER 12 -6.372 2.291 1.369
95 H LEU 13 H LEU 13 -1.959 1.051 1.938
96 HA LEU 13 HA LEU 13 -1.999 3.785 2.728
97 HB2 LEU 13 HB2 LEU 13 0.230 1.735 3.236
98 HB3 LEU 13 HB3 LEU 13 0.085 3.298 4.061
99 HG LEU 13 HG LEU 13 -2.007 1.038 4.304
100 HD11 LEU 13 HD11 LEU 13 0.182 0.411 5.333
101 HD12 LEU 13 HD12 LEU 13 -1.063 0.687 6.577
102 HD13 LEU 13 HD13 LEU 13 0.179 1.935 6.270
103 HD21 LEU 13 HD21 LEU 13 -1.742 3.732 5.778
104 HD22 LEU 13 HD22 LEU 13 -2.839 2.409 6.259
105 HD23 LEU 13 HD23 LEU 13 -3.087 3.231 4.710
106 H VAL 14 H VAL 14 0.366 2.017 0.541
107 HA VAL 14 HA VAL 14 2.266 4.046 0.559
108 HB VAL 14 HB VAL 14 2.537 1.862 -0.673
109 HG11 VAL 14 HG11 VAL 14 1.748 1.588 -2.980
110 HG12 VAL 14 HG12 VAL 14 0.324 1.984 -1.986
111 HG13 VAL 14 HG13 VAL 14 1.061 3.233 -3.020
112 HG21 VAL 14 HG21 VAL 14 4.010 2.766 -2.460
113 HG22 VAL 14 HG22 VAL 14 3.238 4.368 -2.338
114 HG23 VAL 14 HG23 VAL 14 4.189 3.728 -0.970
115 H LYS 15 H LYS 15 -0.887 4.026 -1.285
116 HA LYS 15 HA LYS 15 -0.011 6.224 -2.935
117 HB2 LYS 15 HB2 LYS 15 -1.815 4.664 -3.595
118 HB3 LYS 15 HB3 LYS 15 -2.880 5.320 -2.321
119 HG2 LYS 15 HG2 LYS 15 -2.951 7.527 -3.427
120 HG3 LYS 15 HG3 LYS 15 -1.626 7.084 -4.520
121 HD2 LYS 15 HD2 LYS 15 -3.734 7.022 -5.766
122 HD3 LYS 15 HD3 LYS 15 -2.985 5.411 -5.686
123 HE2 LYS 15 HE2 LYS 15 -5.400 5.212 -5.425
124 HE3 LYS 15 HE3 LYS 15 -4.629 4.726 -3.902
125 HZ1 LYS 15 HZ1 LYS 15 -6.635 6.162 -3.591
126 HZ2 LYS 15 HZ2 LYS 15 -5.860 7.454 -4.456
127 HZ3 LYS 15 HZ3 LYS 15 -5.229 6.909 -2.917
128 H GLY 16 H GLY 16 -2.155 6.054 0.049
129 HA2 GLY 16 HA2 GLY 16 -2.544 8.898 0.125
130 HA3 GLY 16 HA3 GLY 16 -2.753 7.797 1.506
131 H ILE 17 H ILE 17 -0.022 6.728 1.648
132 HA ILE 17 HA ILE 17 1.048 8.918 3.247
133 HB ILE 17 HB ILE 17 2.277 6.225 2.448
134 HG12 ILE 17 HG12 ILE 17 0.251 5.998 3.907
135 HG13 ILE 17 HG13 ILE 17 1.748 5.407 4.654
136 HG21 ILE 17 HG21 ILE 17 4.129 7.736 2.917
137 HG22 ILE 17 HG22 ILE 17 3.340 8.363 4.384
138 HG23 ILE 17 HG23 ILE 17 3.931 6.675 4.331
139 HD11 ILE 17 HD11 ILE 17 0.343 6.596 6.299
140 HD12 ILE 17 HD12 ILE 17 1.871 7.477 6.080
141 HD13 ILE 17 HD13 ILE 17 0.364 8.086 5.330
142 H ALA 18 H ALA 18 2.208 7.228 0.200
143 HA ALA 18 HA ALA 18 4.384 9.019 -0.144
144 HB1 ALA 18 HB1 ALA 18 4.154 6.880 -1.461
145 HB2 ALA 18 HB2 ALA 18 2.813 7.620 -2.397
146 HB3 ALA 18 HB3 ALA 18 4.463 8.292 -2.511
147 H ALA 19 H ALA 19 0.877 9.564 -0.749
148 HA ALA 19 HA ALA 19 0.800 11.233 -2.864
149 HB1 ALA 19 HB1 ALA 19 -1.192 10.875 -1.427
150 HB2 ALA 19 HB2 ALA 19 -0.484 11.904 -0.149
151 HB3 ALA 19 HB3 ALA 19 -0.944 12.619 -1.722
152 H HIS 20 H HIS 20 1.874 12.468 0.451
153 HA HIS 20 HA HIS 20 2.457 15.076 -0.485
154 HB2 HIS 20 HB2 HIS 20 3.562 13.428 1.843
155 HB3 HIS 20 HB3 HIS 20 4.469 14.862 1.335
156 HD1 HIS 20 HD2 HIS 20 0.785 14.180 2.042
157 HD2 HIS 20 HD3 HIS 20 3.811 17.057 2.533
158 HE1 HIS 20 HE2 HIS 20 -0.286 16.091 3.310
159 H VAL 21 H VAL 21 4.694 12.169 -0.351
160 HA VAL 21 HA VAL 21 6.840 13.791 -1.436
161 HB VAL 21 HB VAL 21 6.624 10.744 -1.168
162 HG11 VAL 21 HG11 VAL 21 9.049 12.520 -1.882
163 HG12 VAL 21 HG12 VAL 21 9.118 10.773 -1.514
164 HG13 VAL 21 HG13 VAL 21 8.263 11.339 -2.968
165 HG21 VAL 21 HG21 VAL 21 8.145 11.085 0.786
166 HG22 VAL 21 HG22 VAL 21 8.097 12.853 0.540
167 HG23 VAL 21 HG23 VAL 21 6.627 11.975 1.039
168 H ALA 22 H ALA 22 4.843 11.075 -2.913
169 HA ALA 22 HA ALA 22 5.485 12.292 -5.614
170 HB1 ALA 22 HB1 ALA 22 5.718 9.342 -4.773
171 HB2 ALA 22 HB2 ALA 22 5.939 9.980 -6.432
172 HB3 ALA 22 HB3 ALA 22 7.081 10.441 -5.135
173 H SER 23 H SER 23 3.157 13.176 -5.005
174 HA SER 23 HA SER 23 0.991 11.278 -5.298
175 HB2 SER 23 HB2 SER 23 0.528 13.608 -4.543
176 HB3 SER 23 HB3 SER 23 1.085 14.240 -6.125
177 HG SER 23 HG SER 23 -1.275 13.899 -6.066
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -2.418 -17.182 4.826
2 H2 GLY 1 H2 GLY 1 -1.854 -15.675 5.554
3 HA2 GLY 1 HA2 GLY 1 -0.611 -16.616 3.185
4 HA3 GLY 1 HA3 GLY 1 -2.175 -15.872 2.721
5 H LEU 2 H LEU 2 -0.516 -14.348 1.571
6 HA LEU 2 HA LEU 2 -0.220 -11.974 3.331
7 HB2 LEU 2 HB2 LEU 2 2.161 -11.655 2.744
8 HB3 LEU 2 HB3 LEU 2 1.949 -13.106 3.732
9 HG LEU 2 HG LEU 2 1.907 -13.501 0.700
10 HD11 LEU 2 HD11 LEU 2 4.412 -13.614 0.609
11 HD12 LEU 2 HD12 LEU 2 4.494 -12.939 2.265
12 HD13 LEU 2 HD13 LEU 2 3.804 -11.972 0.925
13 HD21 LEU 2 HD21 LEU 2 3.054 -15.624 1.260
14 HD22 LEU 2 HD22 LEU 2 1.610 -15.473 2.288
15 HD23 LEU 2 HD23 LEU 2 3.222 -15.131 2.968
16 H LYS 3 H LYS 3 -2.072 -12.426 1.269
17 HA LYS 3 HA LYS 3 -0.900 -10.724 -0.922
18 HB2 LYS 3 HB2 LYS 3 -1.706 -13.272 -1.336
19 HB3 LYS 3 HB3 LYS 3 -3.306 -12.509 -1.340
20 HG2 LYS 3 HG2 LYS 3 -2.788 -12.357 -3.621
21 HG3 LYS 3 HG3 LYS 3 -2.106 -10.803 -3.101
22 HD2 LYS 3 HD2 LYS 3 -0.615 -13.473 -3.605
23 HD3 LYS 3 HD3 LYS 3 -0.579 -12.025 -4.640
24 HE2 LYS 3 HE2 LYS 3 0.603 -10.760 -2.797
25 HE3 LYS 3 HE3 LYS 3 0.640 -12.267 -1.819
26 HZ1 LYS 3 HZ1 LYS 3 1.945 -11.898 -4.524
27 HZ2 LYS 3 HZ2 LYS 3 1.952 -13.365 -3.578
28 HZ3 LYS 3 HZ3 LYS 3 2.748 -11.940 -2.982
29 H GLU 4 H GLU 4 -4.107 -11.433 0.771
30 HA GLU 4 HA GLU 4 -5.268 -8.961 0.029
31 HB2 GLU 4 HB2 GLU 4 -5.406 -10.430 2.745
32 HB3 GLU 4 HB3 GLU 4 -6.392 -9.000 2.355
33 HG2 GLU 4 HG2 GLU 4 -6.503 -11.648 0.770
34 HG3 GLU 4 HG3 GLU 4 -7.651 -11.153 2.034
35 H ILE 5 H ILE 5 -2.890 -9.736 2.707
36 HA ILE 5 HA ILE 5 -2.945 -7.047 3.733
37 HB ILE 5 HB ILE 5 -0.772 -9.196 3.953
38 HG12 ILE 5 HG12 ILE 5 -2.875 -8.231 6.013
39 HG13 ILE 5 HG13 ILE 5 -3.067 -9.685 5.013
40 HG21 ILE 5 HG21 ILE 5 0.218 -6.893 4.262
41 HG22 ILE 5 HG22 ILE 5 -1.021 -6.536 5.494
42 HG23 ILE 5 HG23 ILE 5 0.218 -7.792 5.779
43 HD11 ILE 5 HD11 ILE 5 -0.918 -9.280 7.178
44 HD12 ILE 5 HD12 ILE 5 -2.294 -10.402 7.189
45 HD13 ILE 5 HD13 ILE 5 -0.957 -10.657 6.032
46 H PHE 6 H PHE 6 -0.635 -8.746 1.421
47 HA PHE 6 HA PHE 6 0.884 -6.314 1.057
48 HB2 PHE 6 HB2 PHE 6 0.684 -8.820 -0.710
49 HB3 PHE 6 HB3 PHE 6 1.699 -7.409 -1.084
50 HD1 PHE 6 HD1 PHE 6 1.487 -8.334 2.538
51 HD2 PHE 6 HD2 PHE 6 3.613 -8.949 -1.162
52 HE1 PHE 6 HE1 PHE 6 3.415 -9.174 3.784
53 HE2 PHE 6 HE2 PHE 6 5.579 -9.721 0.113
54 HZ PHE 6 HZ PHE 6 5.487 -9.850 2.593
55 H LYS 7 H LYS 7 -2.264 -7.332 -0.253
56 HA LYS 7 HA LYS 7 -2.099 -4.960 -2.131
57 HB2 LYS 7 HB2 LYS 7 -2.511 -7.326 -3.039
58 HB3 LYS 7 HB3 LYS 7 -4.078 -7.302 -2.186
59 HG2 LYS 7 HG2 LYS 7 -4.744 -5.263 -3.548
60 HG3 LYS 7 HG3 LYS 7 -3.144 -5.276 -4.337
61 HD2 LYS 7 HD2 LYS 7 -3.618 -7.558 -5.283
62 HD3 LYS 7 HD3 LYS 7 -5.222 -7.551 -4.498
63 HE2 LYS 7 HE2 LYS 7 -5.881 -5.541 -5.852
64 HE3 LYS 7 HE3 LYS 7 -4.265 -5.516 -6.614
65 HZ1 LYS 7 HZ1 LYS 7 -4.697 -7.748 -7.577
66 HZ2 LYS 7 HZ2 LYS 7 -5.924 -6.614 -8.061
67 HZ3 LYS 7 HZ3 LYS 7 -6.274 -7.786 -6.826
68 H ALA 8 H ALA 8 -2.234 -4.418 0.607
69 HA ALA 8 HA ALA 8 -4.733 -2.923 0.555
70 HB1 ALA 8 HB1 ALA 8 -5.669 -5.048 1.463
71 HB2 ALA 8 HB2 ALA 8 -4.434 -5.064 2.755
72 HB3 ALA 8 HB3 ALA 8 -5.664 -3.772 2.709
73 H GLY 9 H GLY 9 -2.236 -4.123 3.034
74 HA2 GLY 9 HA2 GLY 9 -2.183 -1.547 4.326
75 HA3 GLY 9 HA3 GLY 9 -0.904 -2.773 4.439
76 H LEU 10 H LEU 10 0.686 -2.947 2.534
77 HA LEU 10 HA LEU 10 1.571 -0.342 1.818
78 HB2 LEU 10 HB2 LEU 10 3.248 -1.384 0.416
79 HB3 LEU 10 HB3 LEU 10 3.030 -2.328 1.899
80 HG LEU 10 HG LEU 10 1.327 -3.746 0.328
81 HD11 LEU 10 HD11 LEU 10 1.646 -2.266 -1.737
82 HD12 LEU 10 HD12 LEU 10 2.160 -3.942 -2.020
83 HD13 LEU 10 HD13 LEU 10 3.377 -2.673 -1.725
84 HD21 LEU 10 HD21 LEU 10 3.196 -5.326 -0.202
85 HD22 LEU 10 HD22 LEU 10 3.281 -4.737 1.476
86 HD23 LEU 10 HD23 LEU 10 4.383 -4.063 0.239
87 H GLY 11 H GLY 11 -0.852 -2.470 0.211
88 HA2 GLY 11 HA2 GLY 11 -0.640 -1.276 -2.378
89 HA3 GLY 11 HA3 GLY 11 -2.095 -2.063 -1.732
90 H SER 12 H SER 12 -3.011 -0.544 0.343
91 HA SER 12 HA SER 12 -3.954 1.806 -1.173
92 HB2 SER 12 HB2 SER 12 -5.550 0.440 0.194
93 HB3 SER 12 HB3 SER 12 -4.658 0.882 1.675
94 HG SER 12 HG SER 12 -5.965 2.792 -0.018
95 H LEU 13 H LEU 13 -2.066 1.180 1.913
96 HA LEU 13 HA LEU 13 -2.178 3.918 2.710
97 HB2 LEU 13 HB2 LEU 13 0.031 1.881 3.348
98 HB3 LEU 13 HB3 LEU 13 -0.194 3.441 4.167
99 HG LEU 13 HG LEU 13 -2.251 1.137 4.271
100 HD11 LEU 13 HD11 LEU 13 -1.456 0.820 6.604
101 HD12 LEU 13 HD12 LEU 13 -0.226 2.098 6.380
102 HD13 LEU 13 HD13 LEU 13 -0.120 0.573 5.451
103 HD21 LEU 13 HD21 LEU 13 -3.412 3.296 4.586
104 HD22 LEU 13 HD22 LEU 13 -2.157 3.842 5.740
105 HD23 LEU 13 HD23 LEU 13 -3.248 2.490 6.156
106 H VAL 14 H VAL 14 0.284 2.173 0.620
107 HA VAL 14 HA VAL 14 2.151 4.248 0.685
108 HB VAL 14 HB VAL 14 2.506 2.055 -0.516
109 HG11 VAL 14 HG11 VAL 14 1.084 3.393 -2.917
110 HG12 VAL 14 HG12 VAL 14 1.808 1.764 -2.856
111 HG13 VAL 14 HG13 VAL 14 0.343 2.127 -1.908
112 HG21 VAL 14 HG21 VAL 14 4.022 2.978 -2.254
113 HG22 VAL 14 HG22 VAL 14 3.216 4.566 -2.166
114 HG23 VAL 14 HG23 VAL 14 4.130 3.948 -0.761
115 H LYS 15 H LYS 15 -0.959 4.098 -1.207
116 HA LYS 15 HA LYS 15 -0.259 6.316 -2.873
117 HB2 LYS 15 HB2 LYS 15 -2.158 4.777 -3.350
118 HB3 LYS 15 HB3 LYS 15 -3.071 5.441 -1.969
119 HG2 LYS 15 HG2 LYS 15 -3.051 7.717 -3.049
120 HG3 LYS 15 HG3 LYS 15 -2.109 7.059 -4.417
121 HD2 LYS 15 HD2 LYS 15 -4.002 5.467 -4.942
122 HD3 LYS 15 HD3 LYS 15 -4.947 6.160 -3.594
123 HE2 LYS 15 HE2 LYS 15 -4.897 8.409 -4.726
124 HE3 LYS 15 HE3 LYS 15 -3.946 7.713 -6.068
125 HZ1 LYS 15 HZ1 LYS 15 -6.752 6.864 -5.270
126 HZ2 LYS 15 HZ2 LYS 15 -5.819 6.179 -6.578
127 HZ3 LYS 15 HZ3 LYS 15 -6.329 7.840 -6.646
128 H GLY 16 H GLY 16 -2.157 6.143 0.274
129 HA2 GLY 16 HA2 GLY 16 -2.551 8.984 0.374
130 HA3 GLY 16 HA3 GLY 16 -2.681 7.880 1.761
131 H ILE 17 H ILE 17 0.126 6.851 1.639
132 HA ILE 17 HA ILE 17 1.225 9.042 3.239
133 HB ILE 17 HB ILE 17 2.424 6.344 2.416
134 HG12 ILE 17 HG12 ILE 17 1.280 7.343 5.110
135 HG13 ILE 17 HG13 ILE 17 0.407 6.299 3.969
136 HG21 ILE 17 HG21 ILE 17 4.229 8.061 2.797
137 HG22 ILE 17 HG22 ILE 17 3.530 8.425 4.397
138 HG23 ILE 17 HG23 ILE 17 4.240 6.823 4.054
139 HD11 ILE 17 HD11 ILE 17 2.227 4.540 4.224
140 HD12 ILE 17 HD12 ILE 17 2.951 5.534 5.526
141 HD13 ILE 17 HD13 ILE 17 1.312 4.884 5.720
142 H ALA 18 H ALA 18 2.276 7.352 0.148
143 HA ALA 18 HA ALA 18 4.310 9.262 -0.385
144 HB1 ALA 18 HB1 ALA 18 4.297 8.433 -2.722
145 HB2 ALA 18 HB2 ALA 18 4.142 7.058 -1.593
146 HB3 ALA 18 HB3 ALA 18 2.705 7.666 -2.474
147 H ALA 19 H ALA 19 0.770 9.665 -0.653
148 HA ALA 19 HA ALA 19 0.441 11.328 -2.782
149 HB1 ALA 19 HB1 ALA 19 -0.602 11.949 0.043
150 HB2 ALA 19 HB2 ALA 19 -1.215 12.661 -1.477
151 HB3 ALA 19 HB3 ALA 19 -1.400 10.911 -1.175
152 H HIS 20 H HIS 20 1.817 12.456 0.446
153 HA HIS 20 HA HIS 20 2.402 15.086 -0.579
154 HB2 HIS 20 HB2 HIS 20 3.388 13.524 1.861
155 HB3 HIS 20 HB3 HIS 20 4.342 14.908 1.305
156 HD1 HIS 20 HD2 HIS 20 0.634 14.335 1.963
157 HD2 HIS 20 HD3 HIS 20 3.699 17.186 2.343
158 HE1 HIS 20 HE2 HIS 20 -0.425 16.336 3.094
159 H VAL 21 H VAL 21 4.518 12.088 -0.266
160 HA VAL 21 HA VAL 21 6.798 13.629 -1.097
161 HB VAL 21 HB VAL 21 6.450 10.587 -1.060
162 HG11 VAL 21 HG11 VAL 21 8.967 10.530 -1.197
163 HG12 VAL 21 HG12 VAL 21 8.248 11.206 -2.676
164 HG13 VAL 21 HG13 VAL 21 8.986 12.298 -1.467
165 HG21 VAL 21 HG21 VAL 21 7.833 10.742 1.026
166 HG22 VAL 21 HG22 VAL 21 7.865 12.522 0.896
167 HG23 VAL 21 HG23 VAL 21 6.331 11.672 1.227
168 H ALA 22 H ALA 22 4.881 11.090 -2.953
169 HA ALA 22 HA ALA 22 5.586 12.616 -5.453
170 HB1 ALA 22 HB1 ALA 22 6.141 9.628 -4.966
171 HB2 ALA 22 HB2 ALA 22 6.381 10.497 -6.515
172 HB3 ALA 22 HB3 ALA 22 7.388 10.904 -5.097
173 H SER 23 H SER 23 3.106 12.847 -4.317
174 HA SER 23 HA SER 23 0.864 12.530 -4.900
175 HB2 SER 23 HB2 SER 23 2.141 11.779 -7.598
176 HB3 SER 23 HB3 SER 23 0.456 12.319 -7.324
177 HG SER 23 HG SER 23 1.905 14.136 -7.884
Start of MODEL 19
1 H1 GLY 1 H GLY 1 -1.986 -17.223 4.923
2 H2 GLY 1 H2 GLY 1 -1.154 -15.802 5.557
3 HA2 GLY 1 HA2 GLY 1 -0.637 -16.610 2.916
4 HA3 GLY 1 HA3 GLY 1 -2.238 -15.804 2.888
5 H LEU 2 H LEU 2 -0.635 -14.384 1.399
6 HA LEU 2 HA LEU 2 -0.118 -11.984 3.027
7 HB2 LEU 2 HB2 LEU 2 2.206 -11.701 2.272
8 HB3 LEU 2 HB3 LEU 2 2.064 -13.079 3.372
9 HG LEU 2 HG LEU 2 1.970 -13.589 0.344
10 HD11 LEU 2 HD11 LEU 2 4.533 -13.181 2.006
11 HD12 LEU 2 HD12 LEU 2 3.975 -12.171 0.640
12 HD13 LEU 2 HD13 LEU 2 4.478 -13.851 0.348
13 HD21 LEU 2 HD21 LEU 2 3.015 -15.764 0.984
14 HD22 LEU 2 HD22 LEU 2 1.507 -15.543 1.888
15 HD23 LEU 2 HD23 LEU 2 3.071 -15.259 2.694
16 H LYS 3 H LYS 3 -2.140 -12.259 1.332
17 HA LYS 3 HA LYS 3 -1.182 -10.804 -1.125
18 HB2 LYS 3 HB2 LYS 3 -2.387 -13.381 -1.070
19 HB3 LYS 3 HB3 LYS 3 -3.747 -12.308 -1.382
20 HG2 LYS 3 HG2 LYS 3 -2.888 -12.989 -3.530
21 HG3 LYS 3 HG3 LYS 3 -2.484 -11.271 -3.309
22 HD2 LYS 3 HD2 LYS 3 -0.630 -12.486 -4.372
23 HD3 LYS 3 HD3 LYS 3 -0.072 -11.927 -2.787
24 HE2 LYS 3 HE2 LYS 3 -0.365 -14.222 -1.838
25 HE3 LYS 3 HE3 LYS 3 -1.065 -14.781 -3.386
26 HZ1 LYS 3 HZ1 LYS 3 1.301 -15.401 -3.176
27 HZ2 LYS 3 HZ2 LYS 3 1.757 -13.736 -2.961
28 HZ3 LYS 3 HZ3 LYS 3 1.104 -14.280 -4.486
29 H GLU 4 H GLU 4 -4.231 -11.365 0.879
30 HA GLU 4 HA GLU 4 -5.347 -8.872 0.038
31 HB2 GLU 4 HB2 GLU 4 -5.705 -10.415 2.682
32 HB3 GLU 4 HB3 GLU 4 -6.565 -8.900 2.316
33 HG2 GLU 4 HG2 GLU 4 -7.995 -10.868 1.786
34 HG3 GLU 4 HG3 GLU 4 -7.664 -9.876 0.345
35 H ILE 5 H ILE 5 -3.103 -9.720 2.816
36 HA ILE 5 HA ILE 5 -3.080 -7.042 3.841
37 HB ILE 5 HB ILE 5 -0.930 -9.221 4.007
38 HG12 ILE 5 HG12 ILE 5 -2.983 -8.236 6.102
39 HG13 ILE 5 HG13 ILE 5 -3.184 -9.703 5.121
40 HG21 ILE 5 HG21 ILE 5 0.101 -6.924 4.303
41 HG22 ILE 5 HG22 ILE 5 -1.100 -6.566 5.571
42 HG23 ILE 5 HG23 ILE 5 0.132 -7.839 5.809
43 HD11 ILE 5 HD11 ILE 5 -1.044 -10.646 6.120
44 HD12 ILE 5 HD12 ILE 5 -1.017 -9.264 7.259
45 HD13 ILE 5 HD13 ILE 5 -2.376 -10.405 7.286
46 H PHE 6 H PHE 6 -0.841 -8.757 1.479
47 HA PHE 6 HA PHE 6 0.720 -6.355 1.096
48 HB2 PHE 6 HB2 PHE 6 0.433 -8.861 -0.654
49 HB3 PHE 6 HB3 PHE 6 1.457 -7.472 -1.071
50 HD1 PHE 6 HD1 PHE 6 1.315 -8.396 2.561
51 HD2 PHE 6 HD2 PHE 6 3.365 -9.006 -1.178
52 HE1 PHE 6 HE1 PHE 6 3.269 -9.232 3.768
53 HE2 PHE 6 HE2 PHE 6 5.352 -9.787 0.054
54 HZ PHE 6 HZ PHE 6 5.308 -9.923 2.534
55 H LYS 7 H LYS 7 -2.470 -7.302 -0.169
56 HA LYS 7 HA LYS 7 -2.252 -4.978 -2.090
57 HB2 LYS 7 HB2 LYS 7 -2.864 -7.465 -2.823
58 HB3 LYS 7 HB3 LYS 7 -4.419 -7.129 -2.041
59 HG2 LYS 7 HG2 LYS 7 -4.693 -6.679 -4.394
60 HG3 LYS 7 HG3 LYS 7 -4.614 -5.070 -3.626
61 HD2 LYS 7 HD2 LYS 7 -2.259 -4.782 -4.420
62 HD3 LYS 7 HD3 LYS 7 -2.183 -6.493 -4.913
63 HE2 LYS 7 HE2 LYS 7 -2.420 -5.070 -6.879
64 HE3 LYS 7 HE3 LYS 7 -3.868 -6.091 -6.700
65 HZ1 LYS 7 HZ1 LYS 7 -4.375 -3.733 -7.316
66 HZ2 LYS 7 HZ2 LYS 7 -3.677 -3.184 -5.820
67 HZ3 LYS 7 HZ3 LYS 7 -5.122 -4.169 -5.821
68 H ALA 8 H ALA 8 -2.363 -4.433 0.691
69 HA ALA 8 HA ALA 8 -4.831 -2.860 0.649
70 HB1 ALA 8 HB1 ALA 8 -5.769 -4.988 1.553
71 HB2 ALA 8 HB2 ALA 8 -4.524 -5.014 2.837
72 HB3 ALA 8 HB3 ALA 8 -5.750 -3.717 2.807
73 H GLY 9 H GLY 9 -2.306 -4.085 3.091
74 HA2 GLY 9 HA2 GLY 9 -2.196 -1.516 4.382
75 HA3 GLY 9 HA3 GLY 9 -0.906 -2.738 4.439
76 H LEU 10 H LEU 10 0.619 -2.887 2.479
77 HA LEU 10 HA LEU 10 1.435 -0.278 1.703
78 HB2 LEU 10 HB2 LEU 10 3.053 -1.314 0.219
79 HB3 LEU 10 HB3 LEU 10 2.923 -2.232 1.729
80 HG LEU 10 HG LEU 10 1.185 -3.727 0.290
81 HD11 LEU 10 HD11 LEU 10 3.064 -2.635 -1.912
82 HD12 LEU 10 HD12 LEU 10 1.326 -2.269 -1.819
83 HD13 LEU 10 HD13 LEU 10 1.863 -3.937 -2.111
84 HD21 LEU 10 HD21 LEU 10 3.053 -5.267 -0.335
85 HD22 LEU 10 HD22 LEU 10 3.241 -4.637 1.320
86 HD23 LEU 10 HD23 LEU 10 4.231 -3.960 -0.008
87 H GLY 11 H GLY 11 -0.978 -2.499 0.197
88 HA2 GLY 11 HA2 GLY 11 -0.965 -1.349 -2.395
89 HA3 GLY 11 HA3 GLY 11 -2.384 -2.106 -1.637
90 H SER 12 H SER 12 -3.010 -0.441 0.517
91 HA SER 12 HA SER 12 -4.073 1.872 -1.023
92 HB2 SER 12 HB2 SER 12 -5.608 0.520 0.426
93 HB3 SER 12 HB3 SER 12 -4.652 0.979 1.860
94 HG SER 12 HG SER 12 -6.024 2.869 0.197
95 H LEU 13 H LEU 13 -2.091 1.250 2.006
96 HA LEU 13 HA LEU 13 -2.038 3.974 2.781
97 HB2 LEU 13 HB2 LEU 13 0.157 1.864 3.187
98 HB3 LEU 13 HB3 LEU 13 0.119 3.430 4.019
99 HG LEU 13 HG LEU 13 -2.069 1.278 4.374
100 HD11 LEU 13 HD11 LEU 13 0.138 0.514 5.271
101 HD12 LEU 13 HD12 LEU 13 -1.012 0.857 6.587
102 HD13 LEU 13 HD13 LEU 13 0.281 2.031 6.208
103 HD21 LEU 13 HD21 LEU 13 -2.991 3.532 4.855
104 HD22 LEU 13 HD22 LEU 13 -1.559 3.937 5.847
105 HD23 LEU 13 HD23 LEU 13 -2.706 2.677 6.380
106 H VAL 14 H VAL 14 0.104 2.228 0.381
107 HA VAL 14 HA VAL 14 2.073 4.184 0.290
108 HB VAL 14 HB VAL 14 2.170 2.100 -1.072
109 HG11 VAL 14 HG11 VAL 14 -0.189 2.235 -2.064
110 HG12 VAL 14 HG12 VAL 14 0.368 3.557 -3.123
111 HG13 VAL 14 HG13 VAL 14 1.080 1.930 -3.276
112 HG21 VAL 14 HG21 VAL 14 3.394 3.074 -3.004
113 HG22 VAL 14 HG22 VAL 14 2.644 4.666 -2.713
114 HG23 VAL 14 HG23 VAL 14 3.770 3.972 -1.511
115 H LYS 15 H LYS 15 -1.245 4.351 -1.287
116 HA LYS 15 HA LYS 15 -0.627 6.910 -2.497
117 HB2 LYS 15 HB2 LYS 15 -3.357 5.745 -1.675
118 HB3 LYS 15 HB3 LYS 15 -3.119 7.287 -2.539
119 HG2 LYS 15 HG2 LYS 15 -1.981 6.088 -4.419
120 HG3 LYS 15 HG3 LYS 15 -2.212 4.527 -3.582
121 HD2 LYS 15 HD2 LYS 15 -4.698 4.818 -3.689
122 HD3 LYS 15 HD3 LYS 15 -4.495 6.416 -4.462
123 HE2 LYS 15 HE2 LYS 15 -3.357 5.338 -6.423
124 HE3 LYS 15 HE3 LYS 15 -3.558 3.735 -5.662
125 HZ1 LYS 15 HZ1 LYS 15 -6.013 4.027 -5.744
126 HZ2 LYS 15 HZ2 LYS 15 -5.316 4.173 -7.332
127 HZ3 LYS 15 HZ3 LYS 15 -5.818 5.601 -6.476
128 H GLY 16 H GLY 16 -2.389 6.010 0.615
129 HA2 GLY 16 HA2 GLY 16 -2.889 8.623 1.443
130 HA3 GLY 16 HA3 GLY 16 -2.566 7.288 2.577
131 H ILE 17 H ILE 17 0.271 6.857 1.597
132 HA ILE 17 HA ILE 17 1.389 9.092 3.272
133 HB ILE 17 HB ILE 17 2.564 6.358 2.554
134 HG12 ILE 17 HG12 ILE 17 0.580 6.044 3.978
135 HG13 ILE 17 HG13 ILE 17 2.084 5.639 4.826
136 HG21 ILE 17 HG21 ILE 17 4.229 6.899 4.369
137 HG22 ILE 17 HG22 ILE 17 4.350 7.981 2.960
138 HG23 ILE 17 HG23 ILE 17 3.572 8.559 4.454
139 HD11 ILE 17 HD11 ILE 17 0.522 6.811 6.329
140 HD12 ILE 17 HD12 ILE 17 1.953 7.837 6.080
141 HD13 ILE 17 HD13 ILE 17 0.417 8.209 5.237
142 H ALA 18 H ALA 18 2.349 7.127 0.292
143 HA ALA 18 HA ALA 18 4.503 8.908 -0.225
144 HB1 ALA 18 HB1 ALA 18 4.307 6.616 -1.290
145 HB2 ALA 18 HB2 ALA 18 3.033 7.264 -2.373
146 HB3 ALA 18 HB3 ALA 18 4.691 7.915 -2.454
147 H ALA 19 H ALA 19 0.990 9.119 -1.211
148 HA ALA 19 HA ALA 19 1.139 10.836 -3.348
149 HB1 ALA 19 HB1 ALA 19 -0.906 12.049 -2.452
150 HB2 ALA 19 HB2 ALA 19 -1.066 10.276 -2.366
151 HB3 ALA 19 HB3 ALA 19 -0.684 11.214 -0.885
152 H HIS 20 H HIS 20 1.762 11.788 0.139
153 HA HIS 20 HA HIS 20 1.899 14.550 -0.458
154 HB2 HIS 20 HB2 HIS 20 2.120 13.224 1.943
155 HB3 HIS 20 HB3 HIS 20 3.846 13.520 1.651
156 HD1 HIS 20 HD2 HIS 20 0.508 15.253 1.867
157 HD2 HIS 20 HD3 HIS 20 4.613 16.125 2.135
158 HE1 HIS 20 HE2 HIS 20 0.640 17.641 2.673
159 H VAL 21 H VAL 21 4.543 12.019 -0.360
160 HA VAL 21 HA VAL 21 6.488 13.943 -1.417
161 HB VAL 21 HB VAL 21 6.674 10.909 -0.991
162 HG11 VAL 21 HG11 VAL 21 8.846 12.906 -1.885
163 HG12 VAL 21 HG12 VAL 21 9.126 11.207 -1.403
164 HG13 VAL 21 HG13 VAL 21 8.184 11.568 -2.869
165 HG21 VAL 21 HG21 VAL 21 6.526 12.286 1.110
166 HG22 VAL 21 HG22 VAL 21 8.131 11.537 0.908
167 HG23 VAL 21 HG23 VAL 21 7.907 13.273 0.553
168 H ALA 22 H ALA 22 5.264 10.772 -2.840
169 HA ALA 22 HA ALA 22 5.932 11.806 -5.522
170 HB1 ALA 22 HB1 ALA 22 4.527 9.200 -4.682
171 HB2 ALA 22 HB2 ALA 22 5.143 9.596 -6.312
172 HB3 ALA 22 HB3 ALA 22 6.282 9.404 -4.946
173 H SER 23 H SER 23 4.400 13.792 -5.093
174 HA SER 23 HA SER 23 1.524 13.200 -5.266
175 HB2 SER 23 HB2 SER 23 1.316 15.657 -5.697
176 HB3 SER 23 HB3 SER 23 2.339 15.325 -4.259
177 HG SER 23 HG SER 23 3.382 16.858 -5.759
Start of MODEL 20
1 H1 GLY 1 H GLY 1 -0.645 -16.235 -0.908
2 H2 GLY 1 H2 GLY 1 0.271 -16.152 -0.817
3 HA2 GLY 1 HA2 GLY 1 -1.495 -16.109 1.435
4 HA3 GLY 1 HA3 GLY 1 0.100 -16.744 1.938
5 H LEU 2 H LEU 2 -0.648 -14.387 3.133
6 HA LEU 2 HA LEU 2 -0.052 -12.146 3.395
7 HB2 LEU 2 HB2 LEU 2 2.389 -12.857 1.684
8 HB3 LEU 2 HB3 LEU 2 2.287 -11.632 2.969
9 HG LEU 2 HG LEU 2 2.131 -14.695 3.377
10 HD11 LEU 2 HD11 LEU 2 4.404 -13.935 2.661
11 HD12 LEU 2 HD12 LEU 2 4.414 -14.464 4.363
12 HD13 LEU 2 HD13 LEU 2 4.424 -12.720 3.971
13 HD21 LEU 2 HD21 LEU 2 0.862 -13.511 5.174
14 HD22 LEU 2 HD22 LEU 2 2.244 -12.405 5.443
15 HD23 LEU 2 HD23 LEU 2 2.389 -14.146 5.825
16 H LYS 3 H LYS 3 -1.705 -12.855 0.899
17 HA LYS 3 HA LYS 3 -0.573 -10.877 -1.020
18 HB2 LYS 3 HB2 LYS 3 -1.425 -13.066 -1.855
19 HB3 LYS 3 HB3 LYS 3 -3.068 -12.633 -1.312
20 HG2 LYS 3 HG2 LYS 3 -3.006 -10.587 -2.788
21 HG3 LYS 3 HG3 LYS 3 -1.362 -11.024 -3.330
22 HD2 LYS 3 HD2 LYS 3 -2.295 -13.189 -4.278
23 HD3 LYS 3 HD3 LYS 3 -3.931 -12.661 -3.794
24 HE2 LYS 3 HE2 LYS 3 -3.663 -10.601 -5.258
25 HE3 LYS 3 HE3 LYS 3 -2.053 -11.187 -5.758
26 HZ1 LYS 3 HZ1 LYS 3 -3.751 -11.758 -7.430
27 HZ2 LYS 3 HZ2 LYS 3 -4.693 -12.609 -6.245
28 HZ3 LYS 3 HZ3 LYS 3 -3.124 -13.216 -6.709
29 H GLU 4 H GLU 4 -3.704 -11.449 0.857
30 HA GLU 4 HA GLU 4 -4.895 -9.020 -0.000
31 HB2 GLU 4 HB2 GLU 4 -5.211 -10.446 2.713
32 HB3 GLU 4 HB3 GLU 4 -6.205 -9.067 2.171
33 HG2 GLU 4 HG2 GLU 4 -7.001 -10.388 0.186
34 HG3 GLU 4 HG3 GLU 4 -6.077 -11.804 0.745
35 H ILE 5 H ILE 5 -2.618 -9.690 2.789
36 HA ILE 5 HA ILE 5 -2.753 -6.990 3.762
37 HB ILE 5 HB ILE 5 -0.375 -8.919 3.930
38 HG12 ILE 5 HG12 ILE 5 -2.240 -10.029 5.041
39 HG13 ILE 5 HG13 ILE 5 -1.151 -9.381 6.272
40 HG21 ILE 5 HG21 ILE 5 0.374 -6.615 4.334
41 HG22 ILE 5 HG22 ILE 5 -0.963 -6.313 5.465
42 HG23 ILE 5 HG23 ILE 5 0.329 -7.470 5.888
43 HD11 ILE 5 HD11 ILE 5 -3.883 -8.204 5.438
44 HD12 ILE 5 HD12 ILE 5 -3.471 -9.016 6.962
45 HD13 ILE 5 HD13 ILE 5 -2.771 -7.419 6.603
46 H PHE 6 H PHE 6 -0.503 -8.602 1.350
47 HA PHE 6 HA PHE 6 0.910 -6.125 0.895
48 HB2 PHE 6 HB2 PHE 6 0.602 -8.563 -0.937
49 HB3 PHE 6 HB3 PHE 6 1.700 -7.189 -1.222
50 HD1 PHE 6 HD2 PHE 6 1.722 -7.844 2.367
51 HD2 PHE 6 HD1 PHE 6 3.230 -9.276 -1.412
52 HE1 PHE 6 HE2 PHE 6 3.502 -9.042 3.530
53 HE2 PHE 6 HE1 PHE 6 5.065 -10.427 -0.223
54 HZ PHE 6 HZ PHE 6 5.194 -10.338 2.257
55 H LYS 7 H LYS 7 -2.263 -7.291 -0.290
56 HA LYS 7 HA LYS 7 -2.357 -4.851 -2.063
57 HB2 LYS 7 HB2 LYS 7 -4.269 -7.212 -1.766
58 HB3 LYS 7 HB3 LYS 7 -4.470 -5.913 -2.959
59 HG2 LYS 7 HG2 LYS 7 -1.867 -7.533 -3.017
60 HG3 LYS 7 HG3 LYS 7 -3.365 -8.287 -3.602
61 HD2 LYS 7 HD2 LYS 7 -2.125 -7.342 -5.468
62 HD3 LYS 7 HD3 LYS 7 -3.728 -6.583 -5.306
63 HE2 LYS 7 HE2 LYS 7 -2.731 -4.537 -4.352
64 HE3 LYS 7 HE3 LYS 7 -1.114 -5.312 -4.279
65 HZ1 LYS 7 HZ1 LYS 7 -1.350 -3.810 -6.223
66 HZ2 LYS 7 HZ2 LYS 7 -2.707 -4.737 -6.805
67 HZ3 LYS 7 HZ3 LYS 7 -1.113 -5.445 -6.748
68 H ALA 8 H ALA 8 -2.202 -4.448 0.805
69 HA ALA 8 HA ALA 8 -4.661 -2.861 0.978
70 HB1 ALA 8 HB1 ALA 8 -4.219 -5.099 3.050
71 HB2 ALA 8 HB2 ALA 8 -5.434 -3.795 3.159
72 HB3 ALA 8 HB3 ALA 8 -5.545 -5.016 1.859
73 H GLY 9 H GLY 9 -2.011 -4.160 3.243
74 HA2 GLY 9 HA2 GLY 9 -1.775 -1.612 4.549
75 HA3 GLY 9 HA3 GLY 9 -0.510 -2.858 4.514
76 H LEU 10 H LEU 10 0.919 -2.992 2.488
77 HA LEU 10 HA LEU 10 1.685 -0.355 1.700
78 HB2 LEU 10 HB2 LEU 10 3.308 -1.352 0.219
79 HB3 LEU 10 HB3 LEU 10 3.210 -2.296 1.716
80 HG LEU 10 HG LEU 10 1.484 -3.790 0.265
81 HD11 LEU 10 HD11 LEU 10 3.342 -2.657 -1.930
82 HD12 LEU 10 HD12 LEU 10 1.602 -2.306 -1.821
83 HD13 LEU 10 HD13 LEU 10 2.149 -3.968 -2.130
84 HD21 LEU 10 HD21 LEU 10 4.537 -3.974 -0.028
85 HD22 LEU 10 HD22 LEU 10 3.381 -5.291 -0.386
86 HD23 LEU 10 HD23 LEU 10 3.549 -4.689 1.281
87 H GLY 11 H GLY 11 -0.720 -2.636 0.276
88 HA2 GLY 11 HA2 GLY 11 -0.761 -1.535 -2.335
89 HA3 GLY 11 HA3 GLY 11 -2.158 -2.290 -1.539
90 H SER 12 H SER 12 -2.855 -0.648 0.555
91 HA SER 12 HA SER 12 -3.926 1.639 -1.017
92 HB2 SER 12 HB2 SER 12 -5.470 0.249 0.386
93 HB3 SER 12 HB3 SER 12 -4.573 0.741 1.849
94 HG SER 12 HG SER 12 -5.943 2.585 0.132
95 H LEU 13 H LEU 13 -1.988 1.082 2.062
96 HA LEU 13 HA LEU 13 -2.107 3.832 2.804
97 HB2 LEU 13 HB2 LEU 13 0.169 1.862 3.417
98 HB3 LEU 13 HB3 LEU 13 -0.079 3.431 4.212
99 HG LEU 13 HG LEU 13 -2.050 1.062 4.424
100 HD11 LEU 13 HD11 LEU 13 -0.017 2.163 6.457
101 HD12 LEU 13 HD12 LEU 13 0.128 0.617 5.569
102 HD13 LEU 13 HD13 LEU 13 -1.190 0.845 6.746
103 HD21 LEU 13 HD21 LEU 13 -2.027 3.814 5.810
104 HD22 LEU 13 HD22 LEU 13 -3.055 2.435 6.295
105 HD23 LEU 13 HD23 LEU 13 -3.288 3.184 4.705
106 H VAL 14 H VAL 14 0.220 2.111 0.571
107 HA VAL 14 HA VAL 14 2.131 4.135 0.519
108 HB VAL 14 HB VAL 14 2.323 2.015 -0.805
109 HG11 VAL 14 HG11 VAL 14 0.604 3.425 -2.955
110 HG12 VAL 14 HG12 VAL 14 1.330 1.797 -3.045
111 HG13 VAL 14 HG13 VAL 14 0.005 2.121 -1.895
112 HG21 VAL 14 HG21 VAL 14 2.828 4.572 -2.461
113 HG22 VAL 14 HG22 VAL 14 3.908 3.917 -1.195
114 HG23 VAL 14 HG23 VAL 14 3.614 2.987 -2.690
115 H LYS 15 H LYS 15 -1.149 4.155 -1.103
116 HA LYS 15 HA LYS 15 -0.558 6.604 -2.515
117 HB2 LYS 15 HB2 LYS 15 -3.299 5.531 -1.610
118 HB3 LYS 15 HB3 LYS 15 -3.014 6.968 -2.631
119 HG2 LYS 15 HG2 LYS 15 -1.915 5.545 -4.376
120 HG3 LYS 15 HG3 LYS 15 -2.076 4.111 -3.333
121 HD2 LYS 15 HD2 LYS 15 -3.799 4.048 -5.051
122 HD3 LYS 15 HD3 LYS 15 -4.576 4.261 -3.461
123 HE2 LYS 15 HE2 LYS 15 -4.955 6.681 -3.939
124 HE3 LYS 15 HE3 LYS 15 -4.006 6.560 -5.448
125 HZ1 LYS 15 HZ1 LYS 15 -6.607 5.102 -4.867
126 HZ2 LYS 15 HZ2 LYS 15 -5.706 5.016 -6.360
127 HZ3 LYS 15 HZ3 LYS 15 -6.433 6.514 -5.867
128 H GLY 16 H GLY 16 -2.369 5.984 0.647
129 HA2 GLY 16 HA2 GLY 16 -2.791 8.698 1.213
130 HA3 GLY 16 HA3 GLY 16 -2.596 7.449 2.470
131 H ILE 17 H ILE 17 0.226 6.747 1.732
132 HA ILE 17 HA ILE 17 1.378 8.958 3.354
133 HB ILE 17 HB ILE 17 2.516 6.226 2.563
134 HG12 ILE 17 HG12 ILE 17 1.413 7.261 5.253
135 HG13 ILE 17 HG13 ILE 17 0.532 6.193 4.137
136 HG21 ILE 17 HG21 ILE 17 3.654 8.342 4.491
137 HG22 ILE 17 HG22 ILE 17 4.367 6.742 4.139
138 HG23 ILE 17 HG23 ILE 17 4.316 7.974 2.875
139 HD11 ILE 17 HD11 ILE 17 1.477 4.803 5.885
140 HD12 ILE 17 HD12 ILE 17 2.374 4.455 4.379
141 HD13 ILE 17 HD13 ILE 17 3.108 5.469 5.661
142 H ALA 18 H ALA 18 2.374 7.098 0.327
143 HA ALA 18 HA ALA 18 4.468 8.949 -0.191
144 HB1 ALA 18 HB1 ALA 18 4.346 6.667 -1.272
145 HB2 ALA 18 HB2 ALA 18 3.010 7.256 -2.311
146 HB3 ALA 18 HB3 ALA 18 4.633 7.983 -2.446
147 H ALA 19 H ALA 19 0.940 9.084 -1.107
148 HA ALA 19 HA ALA 19 1.035 10.741 -3.285
149 HB1 ALA 19 HB1 ALA 19 -0.804 11.091 -0.836
150 HB2 ALA 19 HB2 ALA 19 -1.038 11.952 -2.385
151 HB3 ALA 19 HB3 ALA 19 -1.164 10.178 -2.337
152 H HIS 20 H HIS 20 1.555 11.825 0.182
153 HA HIS 20 HA HIS 20 1.624 14.573 -0.502
154 HB2 HIS 20 HB2 HIS 20 1.620 13.525 1.903
155 HB3 HIS 20 HB3 HIS 20 3.389 13.405 1.730
156 HD1 HIS 20 HD2 HIS 20 0.548 15.897 1.529
157 HD2 HIS 20 HD3 HIS 20 4.693 15.773 2.221
158 HE1 HIS 20 HE2 HIS 20 1.187 18.237 2.223
159 H VAL 21 H VAL 21 4.302 12.085 -0.336
160 HA VAL 21 HA VAL 21 6.262 14.049 -1.285
161 HB VAL 21 HB VAL 21 6.458 11.003 -0.948
162 HG11 VAL 21 HG11 VAL 21 8.637 13.038 -1.721
163 HG12 VAL 21 HG12 VAL 21 8.918 11.328 -1.282
164 HG13 VAL 21 HG13 VAL 21 8.011 11.725 -2.762
165 HG21 VAL 21 HG21 VAL 21 7.634 13.324 0.700
166 HG22 VAL 21 HG22 VAL 21 6.245 12.313 1.189
167 HG23 VAL 21 HG23 VAL 21 7.860 11.580 1.009
168 H ALA 22 H ALA 22 5.072 10.924 -2.832
169 HA ALA 22 HA ALA 22 5.813 12.126 -5.466
170 HB1 ALA 22 HB1 ALA 22 4.907 9.284 -4.741
171 HB2 ALA 22 HB2 ALA 22 5.522 9.830 -6.329
172 HB3 ALA 22 HB3 ALA 22 6.600 9.835 -4.902
173 H SER 23 H SER 23 3.844 13.733 -4.827
174 HA SER 23 HA SER 23 1.675 14.390 -5.403
175 HB2 SER 23 HB2 SER 23 2.817 14.205 -7.618
176 HB3 SER 23 HB3 SER 23 2.304 12.492 -7.747
177 HG SER 23 HG SER 23 0.748 13.966 -8.794