Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
587278 | 2muj RC | 25215 | cing | 1-original | 6 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 TYR 1 H TYR 1 -19.625 -5.682 1.358
2 HA TYR 1 HA TYR 1 -18.465 -3.698 1.626
3 HB2 TYR 1 HB3 TYR 1 -18.174 -4.236 4.632
4 HB3 TYR 1 HB2 TYR 1 -17.764 -2.745 3.800
5 HD1 TYR 1 HD2 TYR 1 -19.621 -1.376 2.641
6 HD2 TYR 1 HD3 TYR 1 -20.499 -4.653 5.290
7 HE1 TYR 1 HE2 TYR 1 -21.910 -0.532 2.940
8 HE2 TYR 1 HE3 TYR 1 -22.782 -3.796 5.581
9 HH TYR 1 HH TYR 1 -24.248 -2.220 5.037
10 H ASP 2 H ASP 2 -16.684 -3.823 0.497
11 HA ASP 2 HA ASP 2 -14.080 -4.570 1.836
12 HB2 ASP 2 HB3 ASP 2 -14.913 -6.707 0.734
13 HB3 ASP 2 HB2 ASP 2 -14.905 -5.913 -0.829
14 HD2 ASP 2 HD2 ASP 2 -11.490 -6.175 -1.296
15 H ASN 3 H ASN 3 -12.411 -3.326 1.088
16 HA ASN 3 HA ASN 3 -12.517 -1.728 -1.327
17 HB2 ASN 3 HB3 ASN 3 -12.612 -0.154 1.336
18 HB3 ASN 3 HB2 ASN 3 -12.086 0.521 -0.188
19 HD21 ASN 3 HD22 ASN 3 -14.838 -0.133 1.717
20 HD22 ASN 3 HD21 ASN 3 -16.078 0.419 0.482
21 H ILE 4 H ILE 4 -10.921 -3.539 -1.238
22 HA ILE 4 HA ILE 4 -8.490 -3.204 0.286
23 HB ILE 4 HB ILE 4 -9.327 -5.363 -0.498
24 HG12 ILE 4 HG12 ILE 4 -6.437 -4.920 -1.440
25 HG13 ILE 4 HG11 ILE 4 -6.914 -4.931 0.249
26 HG21 ILE 4 HG21 ILE 4 -8.948 -6.211 -2.787
27 HG22 ILE 4 HG22 ILE 4 -9.975 -4.768 -2.859
28 HG23 ILE 4 HG23 ILE 4 -8.253 -4.649 -3.301
29 HD11 ILE 4 HD11 ILE 4 -6.040 -7.142 -0.339
30 HD12 ILE 4 HD12 ILE 4 -7.203 -7.327 -1.670
31 HD13 ILE 4 HD13 ILE 4 -7.775 -7.306 0.020
32 H LEU 5 H LEU 5 -9.396 -1.800 -2.762
33 HA LEU 5 HA LEU 5 -6.721 -1.211 -3.737
34 HB2 LEU 5 HB3 LEU 5 -8.886 -1.341 -5.168
35 HB3 LEU 5 HB2 LEU 5 -9.387 0.181 -4.475
36 HG LEU 5 HG LEU 5 -7.343 1.287 -5.495
37 HD11 LEU 5 HD21 LEU 5 -6.093 0.121 -7.339
38 HD12 LEU 5 HD22 LEU 5 -5.805 -0.665 -5.780
39 HD13 LEU 5 HD23 LEU 5 -6.922 -1.409 -6.951
40 HD21 LEU 5 HD11 LEU 5 -9.565 1.399 -6.615
41 HD22 LEU 5 HD12 LEU 5 -8.259 1.349 -7.813
42 HD23 LEU 5 HD13 LEU 5 -9.228 -0.113 -7.495
43 H VAL 6 H VAL 6 -8.974 0.839 -1.918
44 HA VAL 6 HA VAL 6 -7.286 3.237 -1.852
45 HB VAL 6 HB VAL 6 -9.859 2.935 -1.236
46 HG11 VAL 6 HG11 VAL 6 -9.659 1.370 0.651
47 HG12 VAL 6 HG12 VAL 6 -8.863 2.641 1.621
48 HG13 VAL 6 HG13 VAL 6 -10.536 2.866 1.046
49 HG21 VAL 6 HG21 VAL 6 -8.104 4.850 0.434
50 HG22 VAL 6 HG22 VAL 6 -9.831 5.070 0.047
51 HG23 VAL 6 HG23 VAL 6 -8.615 5.138 -1.250
52 H LYS 7 H LYS 7 -7.538 0.703 0.472
53 HA LYS 7 HA LYS 7 -5.383 1.535 2.259
54 HB2 LYS 7 HB2 LYS 7 -6.168 -1.407 1.765
55 HB3 LYS 7 HB3 LYS 7 -5.318 -0.780 3.158
56 HG2 LYS 7 HG2 LYS 7 -8.285 -0.318 2.456
57 HG3 LYS 7 HG3 LYS 7 -7.620 -1.351 3.701
58 HD2 LYS 7 HD2 LYS 7 -6.677 0.687 4.916
59 HD3 LYS 7 HD3 LYS 7 -7.362 1.717 3.668
60 HE2 LYS 7 HE3 LYS 7 -8.891 1.823 5.505
61 HE3 LYS 7 HE2 LYS 7 -9.704 0.880 4.259
62 HZ2 LYS 7 HZ2 LYS 7 -9.076 -1.135 5.460
63 HZ3 LYS 7 HZ3 LYS 7 -9.962 -0.133 6.400
64 H MET 8 H MET 8 -5.155 -0.595 -0.602
65 HA MET 8 HA MET 8 -2.299 -1.117 -0.321
66 HB2 MET 8 HB2 MET 8 -4.008 -1.515 -2.746
67 HB3 MET 8 HB3 MET 8 -2.340 -2.008 -2.614
68 HG2 MET 8 HG3 MET 8 -4.759 -3.282 -1.239
69 HG3 MET 8 HG2 MET 8 -3.452 -3.976 -2.194
70 HE1 MET 8 HE1 MET 8 -2.857 -5.682 1.310
71 HE2 MET 8 HE2 MET 8 -4.459 -5.193 0.686
72 HE3 MET 8 HE3 MET 8 -3.258 -5.940 -0.414
73 H PHE 9 H PHE 9 -3.852 1.752 -1.591
74 HA PHE 9 HA PHE 9 -1.666 2.543 -3.440
75 HB2 PHE 9 HB2 PHE 9 -3.779 4.313 -2.079
76 HB3 PHE 9 HB3 PHE 9 -2.625 4.895 -3.246
77 HD1 PHE 9 HD1 PHE 9 -2.649 2.944 -5.495
78 HD2 PHE 9 HD2 PHE 9 -5.880 4.534 -3.132
79 HE1 PHE 9 HE1 PHE 9 -4.177 2.704 -7.400
80 HE2 PHE 9 HE2 PHE 9 -7.390 4.284 -5.052
81 HZ PHE 9 HZ PHE 9 -6.543 3.386 -7.192
82 H LYS 10 H LYS 10 -2.526 3.652 -0.186
83 HA LYS 10 HA LYS 10 0.070 5.043 0.211
84 HB2 LYS 10 HB2 LYS 10 -1.940 4.192 2.452
85 HB3 LYS 10 HB3 LYS 10 -0.632 5.271 2.732
86 HG2 LYS 10 HG3 LYS 10 -2.065 6.919 2.426
87 HG3 LYS 10 HG2 LYS 10 -1.908 6.750 0.710
88 HD2 LYS 10 HD3 LYS 10 -3.892 5.139 0.688
89 HD3 LYS 10 HD2 LYS 10 -4.079 5.387 2.428
90 HE2 LYS 10 HE3 LYS 10 -4.456 7.867 2.044
91 HE3 LYS 10 HE2 LYS 10 -4.250 7.634 0.301
92 HZ2 LYS 10 HZ2 LYS 10 -6.158 6.165 0.308
93 HZ3 LYS 10 HZ3 LYS 10 -6.554 7.641 0.888
94 H THR 11 H THR 11 -0.952 1.776 1.196
95 HA THR 11 HA THR 11 1.335 1.193 2.851
96 HB THR 11 HB THR 11 -0.431 -0.763 1.273
97 HG1 THR 11 HG1 THR 11 -1.469 -0.919 3.274
98 HG21 THR 11 HG21 THR 11 0.182 -2.444 3.021
99 HG22 THR 11 HG22 THR 11 1.352 -1.305 3.738
100 HG23 THR 11 HG23 THR 11 1.619 -1.951 2.097
101 H ASN 12 H ASN 12 0.802 0.420 -0.585
102 HA ASN 12 HA ASN 12 3.455 -0.612 -1.092
103 HB2 ASN 12 HB2 ASN 12 1.298 -1.051 -2.476
104 HB3 ASN 12 HB3 ASN 12 1.446 0.544 -3.155
105 HD21 ASN 12 HD22 ASN 12 2.926 -2.660 -3.010
106 HD22 ASN 12 HD21 ASN 12 3.906 -2.464 -4.549
107 H GLU 13 H GLU 13 2.219 2.776 -1.445
108 HA GLU 13 HA GLU 13 4.556 3.776 -2.830
109 HB2 GLU 13 HB2 GLU 13 2.322 4.882 -2.896
110 HB3 GLU 13 HB3 GLU 13 2.455 5.295 -1.196
111 HG2 GLU 13 HG3 GLU 13 2.932 7.268 -2.532
112 HG3 GLU 13 HG2 GLU 13 4.396 6.815 -1.685
113 HE2 GLU 13 HE2 GLU 13 4.120 6.615 -5.730
114 H ASN 14 H ASN 14 3.652 4.102 0.595
115 HA ASN 14 HA ASN 14 6.163 5.302 1.418
116 HB2 ASN 14 HB2 ASN 14 3.989 4.009 3.158
117 HB3 ASN 14 HB3 ASN 14 5.400 4.802 3.816
118 HD21 ASN 14 HD22 ASN 14 2.240 5.373 2.809
119 HD22 ASN 14 HD21 ASN 14 2.334 7.205 2.823
120 H ASN 15 H ASN 15 5.031 1.971 2.045
121 HA ASN 15 HA ASN 15 7.648 1.117 3.069
122 HB2 ASN 15 HB2 ASN 15 5.340 0.152 3.814
123 HB3 ASN 15 HB3 ASN 15 5.279 -0.722 2.309
124 HD21 ASN 15 HD22 ASN 15 6.382 -2.682 2.245
125 HD22 ASN 15 HD21 ASN 15 7.424 -3.307 3.620
126 H ASP 16 H ASP 16 5.923 0.118 0.089
127 HA ASP 16 HA ASP 16 6.741 -0.739 -1.936
128 HB2 ASP 16 HB2 ASP 16 7.608 1.666 -1.984
129 HB3 ASP 16 HB3 ASP 16 9.167 1.060 -1.455
130 HD2 ASP 16 HD2 ASP 16 9.341 2.395 -3.350
131 H LYS 17 H LYS 17 6.914 -2.584 -0.255
132 HA LYS 17 HA LYS 17 7.724 -4.649 0.239
133 HB2 LYS 17 HB3 LYS 17 8.331 -4.756 -2.150
134 HB3 LYS 17 HB2 LYS 17 9.901 -4.097 -1.786
135 HG2 LYS 17 HG3 LYS 17 10.089 -6.500 -2.155
136 HG3 LYS 17 HG2 LYS 17 10.475 -6.190 -0.467
137 HD2 LYS 17 HD3 LYS 17 8.148 -6.895 0.211
138 HD3 LYS 17 HD2 LYS 17 7.704 -7.119 -1.482
139 HE2 LYS 17 HE2 LYS 17 9.483 -8.943 -1.695
140 HE3 LYS 17 HE3 LYS 17 9.914 -8.712 0.006
141 HZ2 LYS 17 HZ2 LYS 17 7.235 -9.524 -0.982
142 HZ3 LYS 17 HZ3 LYS 17 7.622 -9.299 0.590
143 H SER 18 H SER 18 10.306 -2.238 0.461
144 HA SER 18 HA SER 18 11.088 -3.406 3.185
145 HB2 SER 18 HB3 SER 18 12.923 -3.945 1.328
146 HB3 SER 18 HB2 SER 18 13.134 -2.211 1.178
147 HG SER 18 HG SER 18 14.556 -3.140 2.652
148 H GLU 19 H GLU 19 12.252 -0.428 1.600
149 HA GLU 19 HA GLU 19 10.334 1.305 3.058
150 HB2 GLU 19 HB2 GLU 19 11.973 0.773 4.870
151 HB3 GLU 19 HB3 GLU 19 13.330 1.269 3.862
152 HG2 GLU 19 HG3 GLU 19 12.490 3.603 3.806
153 HG3 GLU 19 HG2 GLU 19 11.028 3.138 4.681
154 HE2 GLU 19 HE2 GLU 19 11.182 2.569 6.732
155 H LEU 20 H LEU 20 9.840 1.976 1.045
156 HA LEU 20 HA LEU 20 10.014 3.146 -1.216
157 HB2 LEU 20 HB3 LEU 20 10.168 4.886 0.822
158 HB3 LEU 20 HB2 LEU 20 11.869 4.877 0.485
159 HG LEU 20 HG LEU 20 11.299 5.638 -1.946
160 HD11 LEU 20 HD21 LEU 20 8.892 4.927 -2.051
161 HD12 LEU 20 HD22 LEU 20 9.042 6.669 -2.323
162 HD13 LEU 20 HD23 LEU 20 8.478 6.065 -0.746
163 HD21 LEU 20 HD11 LEU 20 10.456 7.502 0.364
164 HD22 LEU 20 HD12 LEU 20 12.120 7.231 -0.209
165 HD23 LEU 20 HD13 LEU 20 10.936 8.008 -1.275
166 H ILE 21 H ILE 21 11.542 0.881 -1.470
167 HA ILE 21 HA ILE 21 14.070 1.767 -2.816
168 HB ILE 21 HB ILE 21 14.421 -0.693 -3.033
169 HG12 ILE 21 HG11 ILE 21 12.238 -1.157 -0.934
170 HG13 ILE 21 HG12 ILE 21 11.965 -1.429 -2.642
171 HG21 ILE 21 HG21 ILE 21 14.192 0.359 -0.145
172 HG22 ILE 21 HG22 ILE 21 15.271 -0.941 -0.704
173 HG23 ILE 21 HG23 ILE 21 15.521 0.715 -1.274
174 HD11 ILE 21 HD11 ILE 21 13.790 -3.153 -2.730
175 HD12 ILE 21 HD12 ILE 21 12.517 -3.560 -1.554
176 HD13 ILE 21 HD13 ILE 21 14.078 -2.933 -0.983
Start of MODEL 2
1 H1 TYR 1 H TYR 1 -15.199 -6.522 -2.565
2 HA TYR 1 HA TYR 1 -13.190 -7.532 -0.501
3 HB2 TYR 1 HB3 TYR 1 -12.388 -5.606 -2.781
4 HB3 TYR 1 HB2 TYR 1 -11.417 -5.976 -1.360
5 HD1 TYR 1 HD2 TYR 1 -10.561 -8.378 -0.979
6 HD2 TYR 1 HD3 TYR 1 -12.297 -7.116 -4.710
7 HE1 TYR 1 HE2 TYR 1 -9.507 -10.280 -2.122
8 HE2 TYR 1 HE3 TYR 1 -11.238 -9.022 -5.839
9 HH TYR 1 HH TYR 1 -9.945 -10.814 -5.621
10 H ASP 2 H ASP 2 -13.270 -6.352 1.232
11 HA ASP 2 HA ASP 2 -14.991 -3.857 1.337
12 HB2 ASP 2 HB2 ASP 2 -15.319 -5.724 3.017
13 HB3 ASP 2 HB3 ASP 2 -13.762 -5.343 3.742
14 HD2 ASP 2 HD2 ASP 2 -14.962 -2.754 5.611
15 H ASN 3 H ASN 3 -13.901 -2.116 0.677
16 HA ASN 3 HA ASN 3 -12.509 -0.350 0.558
17 HB2 ASN 3 HB2 ASN 3 -11.588 0.735 2.428
18 HB3 ASN 3 HB3 ASN 3 -13.151 0.105 2.822
19 HD21 ASN 3 HD21 ASN 3 -9.807 0.085 3.698
20 HD22 ASN 3 HD22 ASN 3 -10.016 -0.960 5.192
21 H ILE 4 H ILE 4 -11.576 -2.146 -0.917
22 HA ILE 4 HA ILE 4 -8.808 -2.830 -0.508
23 HB ILE 4 HB ILE 4 -10.263 -4.125 -1.942
24 HG12 ILE 4 HG12 ILE 4 -7.785 -3.228 -3.520
25 HG13 ILE 4 HG11 ILE 4 -7.697 -4.193 -2.058
26 HG21 ILE 4 HG21 ILE 4 -10.813 -3.524 -4.269
27 HG22 ILE 4 HG22 ILE 4 -9.979 -1.955 -4.112
28 HG23 ILE 4 HG23 ILE 4 -11.461 -2.285 -3.179
29 HD11 ILE 4 HD11 ILE 4 -9.031 -6.039 -3.120
30 HD12 ILE 4 HD12 ILE 4 -7.549 -5.664 -4.027
31 HD13 ILE 4 HD13 ILE 4 -9.122 -5.105 -4.637
32 H LEU 5 H LEU 5 -10.216 -0.024 -2.128
33 HA LEU 5 HA LEU 5 -7.637 1.015 -3.065
34 HB2 LEU 5 HB3 LEU 5 -10.355 2.473 -2.788
35 HB3 LEU 5 HB2 LEU 5 -8.962 3.222 -3.518
36 HG LEU 5 HG LEU 5 -10.309 0.679 -4.617
37 HD11 LEU 5 HD11 LEU 5 -11.825 2.658 -4.763
38 HD12 LEU 5 HD12 LEU 5 -10.560 3.598 -5.593
39 HD13 LEU 5 HD13 LEU 5 -11.273 2.164 -6.374
40 HD21 LEU 5 HD21 LEU 5 -8.135 2.469 -5.905
41 HD22 LEU 5 HD22 LEU 5 -8.982 1.125 -6.710
42 HD23 LEU 5 HD23 LEU 5 -7.913 0.795 -5.339
43 H VAL 6 H VAL 6 -9.629 1.809 -0.238
44 HA VAL 6 HA VAL 6 -7.928 3.936 0.804
45 HB VAL 6 HB VAL 6 -9.668 2.103 2.572
46 HG11 VAL 6 HG21 VAL 6 -8.732 5.011 3.019
47 HG12 VAL 6 HG22 VAL 6 -9.813 4.079 4.088
48 HG13 VAL 6 HG23 VAL 6 -8.128 3.579 3.886
49 HG21 VAL 6 HG11 VAL 6 -11.129 2.950 0.796
50 HG22 VAL 6 HG12 VAL 6 -10.567 4.620 1.071
51 HG23 VAL 6 HG13 VAL 6 -11.501 3.748 2.330
52 H LYS 7 H LYS 7 -7.867 0.450 1.412
53 HA LYS 7 HA LYS 7 -5.574 0.465 3.254
54 HB2 LYS 7 HB2 LYS 7 -7.219 -1.377 3.267
55 HB3 LYS 7 HB3 LYS 7 -6.843 -1.807 1.611
56 HG2 LYS 7 HG1 LYS 7 -5.922 -3.436 3.165
57 HG3 LYS 7 HG2 LYS 7 -4.631 -2.698 2.240
58 HD2 LYS 7 HD3 LYS 7 -4.105 -1.186 4.238
59 HD3 LYS 7 HD2 LYS 7 -5.404 -1.964 5.148
60 HE2 LYS 7 HE3 LYS 7 -4.203 -4.201 4.935
61 HE3 LYS 7 HE2 LYS 7 -2.912 -3.419 4.010
62 HZ2 LYS 7 HZ2 LYS 7 -2.364 -3.646 6.340
63 HZ3 LYS 7 HZ3 LYS 7 -3.671 -2.783 6.808
64 H MET 8 H MET 8 -5.738 -0.170 -0.277
65 HA MET 8 HA MET 8 -2.866 -0.650 -0.557
66 HB2 MET 8 HB3 MET 8 -4.819 -0.090 -2.750
67 HB3 MET 8 HB2 MET 8 -3.154 -0.566 -2.977
68 HG2 MET 8 HG3 MET 8 -5.477 -2.314 -2.036
69 HG3 MET 8 HG2 MET 8 -4.248 -2.569 -3.275
70 HE1 MET 8 HE1 MET 8 -5.179 -4.731 -0.983
71 HE2 MET 8 HE2 MET 8 -3.590 -5.473 -0.632
72 HE3 MET 8 HE3 MET 8 -4.049 -5.108 -2.322
73 H PHE 9 H PHE 9 -4.543 2.369 -0.315
74 HA PHE 9 HA PHE 9 -2.671 4.006 -1.916
75 HB2 PHE 9 HB3 PHE 9 -5.012 4.716 -1.438
76 HB3 PHE 9 HB2 PHE 9 -4.684 4.803 0.272
77 HD1 PHE 9 HD2 PHE 9 -3.867 6.363 -3.054
78 HD2 PHE 9 HD1 PHE 9 -3.585 6.797 1.220
79 HE1 PHE 9 HE2 PHE 9 -3.167 8.707 -3.326
80 HE2 PHE 9 HE1 PHE 9 -2.883 9.136 0.927
81 HZ PHE 9 HZ PHE 9 -2.672 10.096 -1.341
82 H LYS 10 H LYS 10 -3.057 3.666 1.595
83 HA LYS 10 HA LYS 10 -0.406 4.872 2.147
84 HB2 LYS 10 HB3 LYS 10 -2.239 3.454 4.175
85 HB3 LYS 10 HB2 LYS 10 -0.744 4.175 4.652
86 HG2 LYS 10 HG3 LYS 10 -3.155 5.647 3.415
87 HG3 LYS 10 HG2 LYS 10 -2.554 5.666 5.063
88 HD2 LYS 10 HD3 LYS 10 -0.443 6.832 4.326
89 HD3 LYS 10 HD2 LYS 10 -1.080 6.897 2.677
90 HE2 LYS 10 HE2 LYS 10 -3.075 8.243 3.487
91 HE3 LYS 10 HE3 LYS 10 -2.424 8.209 5.133
92 HZ2 LYS 10 HZ2 LYS 10 -0.468 9.371 4.345
93 HZ3 LYS 10 HZ3 LYS 10 -1.823 10.225 4.020
94 H THR 11 H THR 11 -1.378 1.454 1.886
95 HA THR 11 HA THR 11 1.013 0.321 3.046
96 HB THR 11 HB THR 11 -0.913 -0.908 0.996
97 HG1 THR 11 HG1 THR 11 -0.731 -1.087 3.820
98 HG21 THR 11 HG21 THR 11 1.179 -2.289 1.092
99 HG22 THR 11 HG22 THR 11 -0.173 -3.126 1.888
100 HG23 THR 11 HG23 THR 11 1.085 -2.333 2.874
101 H ASN 12 H ASN 12 0.219 0.937 -0.372
102 HA ASN 12 HA ASN 12 2.849 0.243 -1.375
103 HB2 ASN 12 HB2 ASN 12 0.610 0.235 -2.704
104 HB3 ASN 12 HB3 ASN 12 0.718 1.967 -2.833
105 HD21 ASN 12 HD21 ASN 12 2.274 2.816 -4.332
106 HD22 ASN 12 HD22 ASN 12 3.168 1.730 -5.509
107 H GLU 13 H GLU 13 1.452 3.478 -0.516
108 HA GLU 13 HA GLU 13 3.692 4.996 -1.529
109 HB2 GLU 13 HB3 GLU 13 1.370 5.899 -1.156
110 HB3 GLU 13 HB2 GLU 13 1.614 5.811 0.579
111 HG2 GLU 13 HG2 GLU 13 1.862 8.111 -0.205
112 HG3 GLU 13 HG3 GLU 13 3.392 7.567 0.450
113 HE2 GLU 13 HE2 GLU 13 5.143 8.217 -2.413
114 H ASN 14 H ASN 14 3.162 3.665 1.711
115 HA ASN 14 HA ASN 14 5.678 4.848 2.735
116 HB2 ASN 14 HB2 ASN 14 3.622 3.081 4.156
117 HB3 ASN 14 HB3 ASN 14 5.097 3.641 4.903
118 HD21 ASN 14 HD22 ASN 14 1.879 4.521 4.253
119 HD22 ASN 14 HD21 ASN 14 2.013 6.249 4.856
120 H ASN 15 H ASN 15 4.565 1.456 2.671
121 HA ASN 15 HA ASN 15 7.257 0.418 3.030
122 HB2 ASN 15 HB2 ASN 15 5.009 -0.657 3.834
123 HB3 ASN 15 HB3 ASN 15 4.751 -1.195 2.201
124 HD21 ASN 15 HD22 ASN 15 6.806 -1.559 5.048
125 HD22 ASN 15 HD21 ASN 15 7.485 -3.190 4.555
126 H ASP 16 H ASP 16 5.476 0.935 0.035
127 HA ASP 16 HA ASP 16 7.522 -0.634 -1.500
128 HB2 ASP 16 HB2 ASP 16 5.126 -1.611 -1.593
129 HB3 ASP 16 HB3 ASP 16 4.654 -0.167 -2.465
130 HD2 ASP 16 HD2 ASP 16 6.892 -3.080 -4.177
131 H LYS 17 H LYS 17 8.117 1.834 -0.689
132 HA LYS 17 HA LYS 17 8.400 3.278 -3.282
133 HB2 LYS 17 HB2 LYS 17 6.709 4.183 -1.227
134 HB3 LYS 17 HB3 LYS 17 8.162 5.058 -0.847
135 HG2 LYS 17 HG3 LYS 17 6.920 6.507 -2.227
136 HG3 LYS 17 HG2 LYS 17 8.169 5.907 -3.314
137 HD2 LYS 17 HD2 LYS 17 6.528 4.220 -4.259
138 HD3 LYS 17 HD3 LYS 17 5.307 4.743 -3.103
139 HE2 LYS 17 HE3 LYS 17 5.347 7.086 -4.147
140 HE3 LYS 17 HE2 LYS 17 6.539 6.520 -5.326
141 HZ2 LYS 17 HZ2 LYS 17 4.934 4.907 -6.117
142 HZ3 LYS 17 HZ3 LYS 17 4.334 6.424 -6.223
143 H SER 18 H SER 18 9.686 3.491 0.010
144 HA SER 18 HA SER 18 12.411 4.256 -1.040
145 HB2 SER 18 HB3 SER 18 11.433 5.255 1.227
146 HB3 SER 18 HB2 SER 18 11.707 3.665 1.920
147 HG SER 18 HG SER 18 13.436 5.076 2.209
148 H GLU 19 H GLU 19 11.334 1.480 0.959
149 HA GLU 19 HA GLU 19 13.514 -0.213 -0.332
150 HB2 GLU 19 HB2 GLU 19 14.238 0.404 1.967
151 HB3 GLU 19 HB3 GLU 19 12.737 -0.202 2.665
152 HG2 GLU 19 HG2 GLU 19 13.274 -2.522 1.892
153 HG3 GLU 19 HG3 GLU 19 14.737 -1.940 1.096
154 HE2 GLU 19 HE2 GLU 19 13.136 -2.459 4.018
155 H LEU 20 H LEU 20 11.858 -0.727 -1.784
156 HA LEU 20 HA LEU 20 9.349 -1.871 -1.281
157 HB2 LEU 20 HB3 LEU 20 11.187 -2.564 -3.671
158 HB3 LEU 20 HB2 LEU 20 9.509 -2.966 -3.485
159 HG LEU 20 HG LEU 20 8.900 -0.508 -3.356
160 HD11 LEU 20 HD21 LEU 20 10.497 1.134 -4.461
161 HD12 LEU 20 HD22 LEU 20 11.800 -0.074 -4.345
162 HD13 LEU 20 HD23 LEU 20 11.063 0.617 -2.877
163 HD21 LEU 20 HD11 LEU 20 10.178 -1.516 -5.977
164 HD22 LEU 20 HD12 LEU 20 8.947 -0.235 -5.830
165 HD23 LEU 20 HD13 LEU 20 8.540 -1.903 -5.397
166 H ILE 21 H ILE 21 12.295 -3.795 -1.785
167 HA ILE 21 HA ILE 21 10.906 -6.231 -0.514
168 HB ILE 21 HB ILE 21 13.381 -6.297 -2.323
169 HG12 ILE 21 HG12 ILE 21 10.540 -7.341 -2.950
170 HG13 ILE 21 HG11 ILE 21 11.140 -5.798 -3.520
171 HG21 ILE 21 HG21 ILE 21 13.160 -8.793 -2.196
172 HG22 ILE 21 HG22 ILE 21 13.413 -8.123 -0.586
173 HG23 ILE 21 HG23 ILE 21 11.783 -8.638 -1.076
174 HD11 ILE 21 HD11 ILE 21 11.374 -7.407 -5.326
175 HD12 ILE 21 HD12 ILE 21 12.332 -8.516 -4.324
176 HD13 ILE 21 HD13 ILE 21 13.004 -6.931 -4.794
Start of MODEL 3
1 H1 TYR 1 H TYR 1 -12.565 -6.951 3.265
2 HA TYR 1 HA TYR 1 -15.078 -5.785 1.926
3 HB2 TYR 1 HB3 TYR 1 -13.131 -4.247 3.762
4 HB3 TYR 1 HB2 TYR 1 -14.305 -3.491 2.693
5 HD1 TYR 1 HD3 TYR 1 -16.799 -3.773 3.095
6 HD2 TYR 1 HD2 TYR 1 -13.891 -5.236 5.911
7 HE1 TYR 1 HE3 TYR 1 -18.540 -3.934 4.821
8 HE2 TYR 1 HE2 TYR 1 -15.641 -5.393 7.626
9 HH TYR 1 HH TYR 1 -19.015 -4.477 6.922
10 H ASP 2 H ASP 2 -14.603 -5.738 -0.112
11 HA ASP 2 HA ASP 2 -11.751 -5.439 -1.127
12 HB2 ASP 2 HB3 ASP 2 -13.284 -7.245 -2.061
13 HB3 ASP 2 HB2 ASP 2 -14.260 -6.004 -2.833
14 HD2 ASP 2 HD2 ASP 2 -12.044 -5.399 -5.399
15 H ASN 3 H ASN 3 -11.013 -3.408 -1.494
16 HA ASN 3 HA ASN 3 -12.538 -1.356 -2.841
17 HB2 ASN 3 HB3 ASN 3 -11.685 -0.729 0.077
18 HB3 ASN 3 HB2 ASN 3 -12.082 0.483 -1.120
19 HD21 ASN 3 HD22 ASN 3 -13.399 -1.505 1.284
20 HD22 ASN 3 HD21 ASN 3 -15.161 -1.142 0.924
21 H ILE 4 H ILE 4 -10.972 -1.274 -4.293
22 HA ILE 4 HA ILE 4 -8.212 -1.766 -3.968
23 HB ILE 4 HB ILE 4 -9.419 -1.815 -6.116
24 HG12 ILE 4 HG12 ILE 4 -7.609 -0.999 -7.632
25 HG13 ILE 4 HG11 ILE 4 -6.826 -0.171 -6.299
26 HG21 ILE 4 HG21 ILE 4 -9.729 0.183 -7.526
27 HG22 ILE 4 HG22 ILE 4 -9.086 1.244 -6.244
28 HG23 ILE 4 HG23 ILE 4 -10.625 0.380 -6.006
29 HD11 ILE 4 HD11 ILE 4 -7.272 -3.234 -6.484
30 HD12 ILE 4 HD12 ILE 4 -5.752 -2.377 -6.835
31 HD13 ILE 4 HD13 ILE 4 -6.386 -2.403 -5.177
32 H LEU 5 H LEU 5 -9.692 1.243 -3.147
33 HA LEU 5 HA LEU 5 -7.145 2.773 -3.187
34 HB2 LEU 5 HB2 LEU 5 -9.951 3.653 -2.227
35 HB3 LEU 5 HB3 LEU 5 -8.566 4.708 -2.163
36 HG LEU 5 HG LEU 5 -9.716 3.537 -4.771
37 HD11 LEU 5 HD21 LEU 5 -10.044 6.369 -3.584
38 HD12 LEU 5 HD22 LEU 5 -11.311 5.120 -3.679
39 HD13 LEU 5 HD23 LEU 5 -10.645 5.818 -5.168
40 HD21 LEU 5 HD11 LEU 5 -8.294 5.259 -5.938
41 HD22 LEU 5 HD12 LEU 5 -7.293 4.093 -5.062
42 HD23 LEU 5 HD13 LEU 5 -7.554 5.720 -4.385
43 H VAL 6 H VAL 6 -9.346 1.509 -0.711
44 HA VAL 6 HA VAL 6 -7.804 2.384 1.605
45 HB VAL 6 HB VAL 6 -9.595 -0.130 1.565
46 HG11 VAL 6 HG11 VAL 6 -9.914 0.333 3.999
47 HG12 VAL 6 HG12 VAL 6 -8.203 0.053 3.645
48 HG13 VAL 6 HG13 VAL 6 -8.788 1.712 3.911
49 HG21 VAL 6 HG21 VAL 6 -10.936 1.748 0.709
50 HG22 VAL 6 HG22 VAL 6 -10.463 2.763 2.094
51 HG23 VAL 6 HG23 VAL 6 -11.460 1.291 2.335
52 H LYS 7 H LYS 7 -7.632 -0.623 -0.243
53 HA LYS 7 HA LYS 7 -5.428 -1.850 1.319
54 HB2 LYS 7 HB3 LYS 7 -6.221 -2.521 -1.585
55 HB3 LYS 7 HB2 LYS 7 -5.201 -3.492 -0.549
56 HG2 LYS 7 HG3 LYS 7 -8.238 -3.056 -0.238
57 HG3 LYS 7 HG2 LYS 7 -7.404 -4.489 -0.791
58 HD2 LYS 7 HD2 LYS 7 -6.340 -4.812 1.467
59 HD3 LYS 7 HD3 LYS 7 -7.138 -3.351 2.063
60 HE2 LYS 7 HE2 LYS 7 -9.404 -4.379 1.620
61 HE3 LYS 7 HE3 LYS 7 -8.632 -5.851 1.009
62 HZ2 LYS 7 HZ2 LYS 7 -7.629 -6.180 3.172
63 HZ3 LYS 7 HZ3 LYS 7 -9.258 -6.099 3.293
64 H MET 8 H MET 8 -5.366 0.032 -1.736
65 HA MET 8 HA MET 8 -2.453 -0.161 -2.013
66 HB2 MET 8 HB3 MET 8 -4.312 1.686 -3.451
67 HB3 MET 8 HB2 MET 8 -2.608 1.518 -3.791
68 HG2 MET 8 HG2 MET 8 -4.837 -0.464 -4.439
69 HG3 MET 8 HG3 MET 8 -3.538 0.182 -5.432
70 HE1 MET 8 HE1 MET 8 -0.403 -1.965 -4.586
71 HE2 MET 8 HE2 MET 8 -1.170 -0.848 -5.754
72 HE3 MET 8 HE3 MET 8 -0.751 -0.279 -4.107
73 H PHE 9 H PHE 9 -4.309 1.946 0.021
74 HA PHE 9 HA PHE 9 -2.426 4.220 0.043
75 HB2 PHE 9 HB2 PHE 9 -4.816 4.444 0.741
76 HB3 PHE 9 HB3 PHE 9 -4.544 3.415 2.124
77 HD1 PHE 9 HD2 PHE 9 -3.732 6.754 0.614
78 HD2 PHE 9 HD1 PHE 9 -3.404 4.318 4.148
79 HE1 PHE 9 HE2 PHE 9 -3.018 8.717 1.916
80 HE2 PHE 9 HE1 PHE 9 -2.685 6.290 5.429
81 HZ PHE 9 HZ PHE 9 -2.491 8.490 4.320
82 H LYS 10 H LYS 10 -2.982 1.712 2.506
83 HA LYS 10 HA LYS 10 -0.417 2.216 3.848
84 HB2 LYS 10 HB2 LYS 10 -2.168 -0.373 4.061
85 HB3 LYS 10 HB3 LYS 10 -0.842 -0.074 5.132
86 HG2 LYS 10 HG3 LYS 10 -1.960 1.948 6.107
87 HG3 LYS 10 HG2 LYS 10 -3.297 1.789 4.964
88 HD2 LYS 10 HD3 LYS 10 -3.859 -0.474 5.916
89 HD3 LYS 10 HD2 LYS 10 -2.503 -0.345 7.044
90 HE2 LYS 10 HE3 LYS 10 -3.570 1.718 8.089
91 HE3 LYS 10 HE2 LYS 10 -4.930 1.583 6.964
92 HZ2 LYS 10 HZ2 LYS 10 -5.439 -0.579 7.893
93 HZ3 LYS 10 HZ3 LYS 10 -5.448 0.570 9.056
94 H THR 11 H THR 11 -1.107 -0.116 1.258
95 HA THR 11 HA THR 11 1.352 -1.613 1.486
96 HB THR 11 HB THR 11 -0.405 -1.172 -0.994
97 HG1 THR 11 HG1 THR 11 -0.320 -3.228 0.954
98 HG21 THR 11 HG21 THR 11 1.636 -3.421 -0.426
99 HG22 THR 11 HG22 THR 11 1.797 -2.161 -1.679
100 HG23 THR 11 HG23 THR 11 0.493 -3.364 -1.795
101 H ASN 12 H ASN 12 0.558 1.040 -0.756
102 HA ASN 12 HA ASN 12 3.254 1.452 -1.706
103 HB2 ASN 12 HB3 ASN 12 1.004 2.133 -2.849
104 HB3 ASN 12 HB2 ASN 12 0.924 3.496 -1.774
105 HD21 ASN 12 HD22 ASN 12 2.502 2.146 -4.573
106 HD22 ASN 12 HD21 ASN 12 3.420 3.667 -5.031
107 H GLU 13 H GLU 13 1.523 3.098 1.014
108 HA GLU 13 HA GLU 13 3.528 5.128 1.472
109 HB2 GLU 13 HB3 GLU 13 1.143 5.244 2.195
110 HB3 GLU 13 HB2 GLU 13 1.428 3.994 3.405
111 HG2 GLU 13 HG2 GLU 13 3.013 5.550 4.619
112 HG3 GLU 13 HG3 GLU 13 2.826 6.754 3.346
113 HE2 GLU 13 HE2 GLU 13 1.205 4.940 5.727
114 H ASN 14 H ASN 14 3.153 1.927 2.978
115 HA ASN 14 HA ASN 14 5.542 2.262 4.661
116 HB2 ASN 14 HB2 ASN 14 3.492 1.080 5.452
117 HB3 ASN 14 HB3 ASN 14 3.751 -0.200 4.289
118 HD21 ASN 14 HD22 ASN 14 5.168 -1.851 4.896
119 HD22 ASN 14 HD21 ASN 14 6.084 -1.861 6.485
120 H ASN 15 H ASN 15 4.787 -0.211 2.206
121 HA ASN 15 HA ASN 15 7.542 -1.100 1.961
122 HB2 ASN 15 HB2 ASN 15 5.152 -1.745 0.089
123 HB3 ASN 15 HB3 ASN 15 6.697 -2.518 -0.019
124 HD21 ASN 15 HD22 ASN 15 3.707 -2.549 1.642
125 HD22 ASN 15 HD21 ASN 15 4.116 -3.946 2.760
126 H ASP 16 H ASP 16 5.813 1.277 0.019
127 HA ASP 16 HA ASP 16 8.043 1.325 -1.979
128 HB2 ASP 16 HB3 ASP 16 5.741 0.622 -2.929
129 HB3 ASP 16 HB2 ASP 16 5.193 2.255 -2.619
130 HD2 ASP 16 HD2 ASP 16 5.867 3.794 -3.851
131 H LYS 17 H LYS 17 8.420 2.477 0.389
132 HA LYS 17 HA LYS 17 8.838 5.325 -0.358
133 HB2 LYS 17 HB2 LYS 17 6.818 5.184 1.087
134 HB3 LYS 17 HB3 LYS 17 7.703 4.326 2.335
135 HG2 LYS 17 HG2 LYS 17 8.373 7.207 1.426
136 HG3 LYS 17 HG3 LYS 17 7.217 6.810 2.693
137 HD2 LYS 17 HD3 LYS 17 9.076 5.517 3.916
138 HD3 LYS 17 HD2 LYS 17 10.217 6.155 2.733
139 HE2 LYS 17 HE3 LYS 17 9.619 8.533 3.398
140 HE3 LYS 17 HE2 LYS 17 8.472 7.910 4.595
141 HZ2 LYS 17 HZ2 LYS 17 11.397 7.412 4.574
142 HZ3 LYS 17 HZ3 LYS 17 10.609 8.449 5.561
143 H SER 18 H SER 18 9.603 3.135 2.327
144 HA SER 18 HA SER 18 12.486 3.923 2.326
145 HB2 SER 18 HB2 SER 18 11.241 3.070 4.522
146 HB3 SER 18 HB3 SER 18 11.288 1.466 3.801
147 HG SER 18 HG SER 18 13.028 1.895 5.165
148 H GLU 19 H GLU 19 10.854 0.950 1.194
149 HA GLU 19 HA GLU 19 13.402 0.097 -0.255
150 HB2 GLU 19 HB2 GLU 19 12.477 -1.425 1.627
151 HB3 GLU 19 HB3 GLU 19 11.036 -1.690 0.644
152 HG2 GLU 19 HG2 GLU 19 12.461 -2.703 -1.173
153 HG3 GLU 19 HG3 GLU 19 13.899 -2.435 -0.186
154 HE2 GLU 19 HE2 GLU 19 14.136 -3.545 1.606
155 H LEU 20 H LEU 20 11.114 -1.467 -1.434
156 HA LEU 20 HA LEU 20 9.740 0.451 -3.299
157 HB2 LEU 20 HB3 LEU 20 12.193 -0.114 -4.335
158 HB3 LEU 20 HB2 LEU 20 11.484 -1.651 -4.724
159 HG LEU 20 HG LEU 20 9.620 -0.352 -6.010
160 HD11 LEU 20 HD11 LEU 20 10.155 1.990 -6.734
161 HD12 LEU 20 HD12 LEU 20 11.584 2.023 -5.671
162 HD13 LEU 20 HD13 LEU 20 9.951 1.935 -4.977
163 HD21 LEU 20 HD21 LEU 20 11.521 -1.510 -7.175
164 HD22 LEU 20 HD22 LEU 20 12.531 -0.055 -7.011
165 HD23 LEU 20 HD23 LEU 20 11.064 -0.020 -8.020
166 H ILE 21 H ILE 21 10.422 -3.036 -3.619
167 HA ILE 21 HA ILE 21 7.439 -3.599 -3.086
168 HB ILE 21 HB ILE 21 9.244 -5.313 -4.894
169 HG12 ILE 21 HG12 ILE 21 7.250 -4.527 -6.616
170 HG13 ILE 21 HG11 ILE 21 7.242 -3.103 -5.600
171 HG21 ILE 21 HG21 ILE 21 7.151 -6.557 -5.435
172 HG22 ILE 21 HG22 ILE 21 6.229 -5.556 -4.285
173 HG23 ILE 21 HG23 ILE 21 7.506 -6.653 -3.707
174 HD11 ILE 21 HD11 ILE 21 9.656 -4.258 -7.170
175 HD12 ILE 21 HD12 ILE 21 8.719 -2.801 -7.580
176 HD13 ILE 21 HD13 ILE 21 9.754 -2.815 -6.136
Start of MODEL 4
1 H1 TYR 1 H TYR 1 -14.306 -4.898 3.714
2 HA TYR 1 HA TYR 1 -15.967 -3.851 1.477
3 HB2 TYR 1 HB2 TYR 1 -15.940 -1.367 2.334
4 HB3 TYR 1 HB3 TYR 1 -17.020 -2.464 3.178
5 HD1 TYR 1 HD3 TYR 1 -16.587 -3.048 5.583
6 HD2 TYR 1 HD2 TYR 1 -13.946 -0.402 3.452
7 HE1 TYR 1 HE3 TYR 1 -15.607 -2.301 7.709
8 HE2 TYR 1 HE2 TYR 1 -12.969 0.330 5.583
9 HH TYR 1 HH TYR 1 -12.997 0.126 7.795
10 H ASP 2 H ASP 2 -14.754 -3.107 -0.100
11 HA ASP 2 HA ASP 2 -11.981 -2.033 0.340
12 HB2 ASP 2 HB3 ASP 2 -11.702 -4.579 0.197
13 HB3 ASP 2 HB2 ASP 2 -12.345 -4.540 -1.432
14 HD2 ASP 2 HD2 ASP 2 -8.543 -3.566 -0.597
15 H ASN 3 H ASN 3 -11.915 -0.255 -0.892
16 HA ASN 3 HA ASN 3 -12.783 -0.210 -3.661
17 HB2 ASN 3 HB2 ASN 3 -14.487 1.540 -3.636
18 HB3 ASN 3 HB3 ASN 3 -15.011 0.067 -2.875
19 HD21 ASN 3 HD21 ASN 3 -14.723 3.458 -2.424
20 HD22 ASN 3 HD22 ASN 3 -15.317 3.467 -0.691
21 H ILE 4 H ILE 4 -10.892 0.418 -4.193
22 HA ILE 4 HA ILE 4 -9.035 1.526 -4.685
23 HB ILE 4 HB ILE 4 -10.848 2.952 -5.563
24 HG12 ILE 4 HG11 ILE 4 -8.629 2.905 -6.550
25 HG13 ILE 4 HG12 ILE 4 -9.406 4.457 -6.709
26 HG21 ILE 4 HG21 ILE 4 -10.915 5.372 -4.960
27 HG22 ILE 4 HG22 ILE 4 -11.544 4.344 -3.670
28 HG23 ILE 4 HG23 ILE 4 -9.916 5.053 -3.521
29 HD11 ILE 4 HD11 ILE 4 -7.029 4.811 -6.282
30 HD12 ILE 4 HD12 ILE 4 -7.054 3.822 -4.813
31 HD13 ILE 4 HD13 ILE 4 -7.904 5.390 -4.848
32 H LEU 5 H LEU 5 -10.099 3.043 -1.744
33 HA LEU 5 HA LEU 5 -7.329 3.753 -0.966
34 HB2 LEU 5 HB2 LEU 5 -9.343 5.313 -0.509
35 HB3 LEU 5 HB3 LEU 5 -9.947 4.147 0.638
36 HG LEU 5 HG LEU 5 -7.898 4.505 2.085
37 HD11 LEU 5 HD11 LEU 5 -7.168 6.744 0.077
38 HD12 LEU 5 HD12 LEU 5 -6.404 6.485 1.666
39 HD13 LEU 5 HD13 LEU 5 -6.220 5.269 0.393
40 HD21 LEU 5 HD21 LEU 5 -8.592 6.743 2.931
41 HD22 LEU 5 HD22 LEU 5 -10.010 5.763 2.512
42 HD23 LEU 5 HD23 LEU 5 -9.482 7.069 1.422
43 H VAL 6 H VAL 6 -9.634 1.300 0.136
44 HA VAL 6 HA VAL 6 -8.094 0.440 2.477
45 HB VAL 6 HB VAL 6 -10.000 -1.387 0.897
46 HG11 VAL 6 HG11 VAL 6 -8.610 -2.635 2.567
47 HG12 VAL 6 HG12 VAL 6 -10.306 -2.578 3.064
48 HG13 VAL 6 HG13 VAL 6 -9.115 -1.510 3.850
49 HG21 VAL 6 HG21 VAL 6 -11.257 0.633 1.448
50 HG22 VAL 6 HG22 VAL 6 -11.784 -0.710 2.468
51 HG23 VAL 6 HG23 VAL 6 -10.717 0.559 3.148
52 H LYS 7 H LYS 7 -8.050 -0.781 -0.844
53 HA LYS 7 HA LYS 7 -5.783 -2.643 -0.330
54 HB2 LYS 7 HB3 LYS 7 -5.706 -3.098 -2.760
55 HB3 LYS 7 HB2 LYS 7 -7.245 -3.414 -1.999
56 HG2 LYS 7 HG3 LYS 7 -8.242 -1.368 -2.952
57 HG3 LYS 7 HG2 LYS 7 -6.700 -0.867 -3.657
58 HD2 LYS 7 HD2 LYS 7 -6.661 -2.867 -5.128
59 HD3 LYS 7 HD3 LYS 7 -8.120 -3.516 -4.398
60 HE2 LYS 7 HE3 LYS 7 -8.015 -0.815 -5.920
61 HE3 LYS 7 HE2 LYS 7 -8.411 -2.359 -6.673
62 HZ2 LYS 7 HZ2 LYS 7 -10.286 -2.577 -5.149
63 HZ3 LYS 7 HZ3 LYS 7 -9.938 -1.146 -4.440
64 H MET 8 H MET 8 -5.887 0.615 -1.827
65 HA MET 8 HA MET 8 -3.036 0.563 -2.500
66 HB2 MET 8 HB2 MET 8 -4.822 2.956 -2.550
67 HB3 MET 8 HB3 MET 8 -3.192 2.880 -3.164
68 HG2 MET 8 HG2 MET 8 -5.700 1.657 -4.396
69 HG3 MET 8 HG3 MET 8 -4.410 2.634 -5.102
70 HE1 MET 8 HE1 MET 8 -4.214 -0.857 -7.027
71 HE2 MET 8 HE2 MET 8 -5.700 -0.143 -6.334
72 HE3 MET 8 HE3 MET 8 -4.528 0.895 -7.205
73 H PHE 9 H PHE 9 -4.573 1.358 0.521
74 HA PHE 9 HA PHE 9 -2.523 3.252 1.505
75 HB2 PHE 9 HB2 PHE 9 -4.825 3.215 2.422
76 HB3 PHE 9 HB3 PHE 9 -4.624 1.584 3.009
77 HD1 PHE 9 HD1 PHE 9 -3.490 5.139 3.473
78 HD2 PHE 9 HD2 PHE 9 -3.466 1.175 5.151
79 HE1 PHE 9 HE1 PHE 9 -2.637 6.033 5.602
80 HE2 PHE 9 HE2 PHE 9 -2.610 2.086 7.268
81 HZ PHE 9 HZ PHE 9 -2.193 4.513 7.500
82 H LYS 10 H LYS 10 -3.120 -0.162 2.260
83 HA LYS 10 HA LYS 10 -0.480 -0.504 3.548
84 HB2 LYS 10 HB2 LYS 10 -2.439 -2.743 2.751
85 HB3 LYS 10 HB3 LYS 10 -0.965 -3.084 3.579
86 HG2 LYS 10 HG3 LYS 10 -3.259 -1.330 4.660
87 HG3 LYS 10 HG2 LYS 10 -2.782 -2.954 5.116
88 HD2 LYS 10 HD2 LYS 10 -0.577 -2.077 6.035
89 HD3 LYS 10 HD3 LYS 10 -1.111 -0.448 5.649
90 HE2 LYS 10 HE3 LYS 10 -1.540 -0.714 7.976
91 HE3 LYS 10 HE2 LYS 10 -3.118 -0.722 7.193
92 HZ2 LYS 10 HZ2 LYS 10 -3.075 -3.168 7.337
93 HZ3 LYS 10 HZ3 LYS 10 -1.612 -3.136 8.066
94 H THR 11 H THR 11 -1.479 -1.152 0.193
95 HA THR 11 HA THR 11 0.867 -2.680 -0.548
96 HB THR 11 HB THR 11 -1.025 -1.052 -2.332
97 HG1 THR 11 HG1 THR 11 -1.917 -3.099 -2.662
98 HG21 THR 11 HG21 THR 11 0.933 -3.310 -3.121
99 HG22 THR 11 HG22 THR 11 1.061 -1.600 -3.615
100 HG23 THR 11 HG23 THR 11 -0.308 -2.584 -4.178
101 H ASN 12 H ASN 12 0.131 0.768 -1.083
102 HA ASN 12 HA ASN 12 2.760 1.506 -2.016
103 HB2 ASN 12 HB3 ASN 12 0.523 2.802 -2.355
104 HB3 ASN 12 HB2 ASN 12 0.658 3.382 -0.721
105 HD21 ASN 12 HD22 ASN 12 2.119 3.501 -3.939
106 HD22 ASN 12 HD21 ASN 12 3.036 5.064 -3.651
107 H GLU 13 H GLU 13 1.520 1.448 1.376
108 HA GLU 13 HA GLU 13 3.769 2.882 2.512
109 HB2 GLU 13 HB2 GLU 13 1.504 2.684 3.544
110 HB3 GLU 13 HB3 GLU 13 1.787 0.992 3.908
111 HG2 GLU 13 HG3 GLU 13 3.496 3.338 5.002
112 HG3 GLU 13 HG2 GLU 13 2.063 2.725 5.800
113 HE2 GLU 13 HE2 GLU 13 5.235 2.500 5.538
114 H ASN 14 H ASN 14 3.061 -0.613 2.507
115 HA ASN 14 HA ASN 14 5.636 -1.383 3.586
116 HB2 ASN 14 HB2 ASN 14 3.506 -2.700 3.844
117 HB3 ASN 14 HB3 ASN 14 3.577 -3.150 2.157
118 HD21 ASN 14 HD22 ASN 14 5.142 -3.560 5.300
119 HD22 ASN 14 HD21 ASN 14 6.016 -5.109 4.848
120 H ASN 15 H ASN 15 4.432 -1.970 0.281
121 HA ASN 15 HA ASN 15 7.063 -2.731 -0.714
122 HB2 ASN 15 HB2 ASN 15 4.490 -2.160 -2.343
123 HB3 ASN 15 HB3 ASN 15 5.930 -2.822 -3.039
124 HD21 ASN 15 HD21 ASN 15 6.621 -4.984 -2.360
125 HD22 ASN 15 HD22 ASN 15 5.352 -6.151 -1.732
126 H ASP 16 H ASP 16 5.424 0.402 -0.891
127 HA ASP 16 HA ASP 16 7.757 1.447 -2.485
128 HB2 ASP 16 HB2 ASP 16 4.832 2.323 -2.873
129 HB3 ASP 16 HB3 ASP 16 6.200 3.153 -3.581
130 HD2 ASP 16 HD2 ASP 16 7.549 2.034 -4.903
131 H LYS 17 H LYS 17 7.788 1.411 0.243
132 HA LYS 17 HA LYS 17 8.621 4.132 0.734
133 HB2 LYS 17 HB3 LYS 17 5.938 3.664 1.544
134 HB3 LYS 17 HB2 LYS 17 6.816 3.375 3.018
135 HG2 LYS 17 HG3 LYS 17 6.162 5.671 3.027
136 HG3 LYS 17 HG2 LYS 17 7.906 5.686 2.777
137 HD2 LYS 17 HD2 LYS 17 7.577 6.004 0.312
138 HD3 LYS 17 HD3 LYS 17 5.843 5.851 0.472
139 HE2 LYS 17 HE3 LYS 17 7.535 8.121 1.761
140 HE3 LYS 17 HE2 LYS 17 6.727 8.247 0.200
141 HZ2 LYS 17 HZ2 LYS 17 5.334 7.760 2.771
142 HZ3 LYS 17 HZ3 LYS 17 4.603 7.879 1.314
143 H SER 18 H SER 18 7.862 1.109 2.412
144 HA SER 18 HA SER 18 10.295 1.288 4.158
145 HB2 SER 18 HB3 SER 18 8.097 -0.018 4.911
146 HB3 SER 18 HB2 SER 18 8.552 -1.245 3.738
147 HG SER 18 HG SER 18 9.315 -1.659 5.814
148 H GLU 19 H GLU 19 9.494 -0.890 1.425
149 HA GLU 19 HA GLU 19 12.497 -1.263 0.966
150 HB2 GLU 19 HB2 GLU 19 11.366 -3.321 1.871
151 HB3 GLU 19 HB3 GLU 19 10.258 -3.357 0.499
152 HG2 GLU 19 HG3 GLU 19 12.152 -3.693 -1.080
153 HG3 GLU 19 HG2 GLU 19 13.314 -3.547 0.243
154 HE2 GLU 19 HE2 GLU 19 10.810 -5.356 -1.119
155 H LEU 20 H LEU 20 12.180 0.714 -0.180
156 HA LEU 20 HA LEU 20 10.772 0.629 -2.865
157 HB2 LEU 20 HB3 LEU 20 10.864 2.820 -1.341
158 HB3 LEU 20 HB2 LEU 20 12.538 2.936 -1.796
159 HG LEU 20 HG LEU 20 11.078 4.458 -2.995
160 HD11 LEU 20 HD21 LEU 20 12.248 2.523 -5.075
161 HD12 LEU 20 HD22 LEU 20 11.892 4.250 -5.279
162 HD13 LEU 20 HD23 LEU 20 13.173 3.743 -4.163
163 HD21 LEU 20 HD11 LEU 20 9.671 2.068 -4.332
164 HD22 LEU 20 HD12 LEU 20 8.975 3.182 -3.127
165 HD23 LEU 20 HD13 LEU 20 9.431 3.786 -4.725
166 H ILE 21 H ILE 21 14.151 1.416 -2.024
167 HA ILE 21 HA ILE 21 15.092 -0.516 -4.143
168 HB ILE 21 HB ILE 21 14.836 1.631 -5.366
169 HG12 ILE 21 HG12 ILE 21 17.120 1.734 -6.436
170 HG13 ILE 21 HG11 ILE 21 17.759 0.688 -5.179
171 HG21 ILE 21 HG21 ILE 21 15.429 3.291 -3.547
172 HG22 ILE 21 HG22 ILE 21 17.138 2.822 -3.696
173 HG23 ILE 21 HG23 ILE 21 16.295 3.578 -5.067
174 HD11 ILE 21 HD11 ILE 21 15.509 -0.086 -7.170
175 HD12 ILE 21 HD12 ILE 21 16.247 -1.184 -5.972
176 HD13 ILE 21 HD13 ILE 21 17.223 -0.543 -7.309
Start of MODEL 5
1 H1 TYR 1 H TYR 1 -13.928 -8.751 2.176
2 HA TYR 1 HA TYR 1 -15.523 -6.142 2.168
3 HB2 TYR 1 HB3 TYR 1 -13.473 -6.865 4.363
4 HB3 TYR 1 HB2 TYR 1 -14.079 -5.242 4.059
5 HD1 TYR 1 HD2 TYR 1 -16.579 -4.724 4.369
6 HD2 TYR 1 HD1 TYR 1 -14.842 -8.438 5.676
7 HE1 TYR 1 HE2 TYR 1 -18.511 -5.121 5.833
8 HE2 TYR 1 HE1 TYR 1 -16.780 -8.823 7.135
9 HH TYR 1 HH TYR 1 -19.466 -6.483 7.304
10 H ASP 2 H ASP 2 -14.734 -5.193 0.453
11 HA ASP 2 HA ASP 2 -11.754 -4.753 0.166
12 HB2 ASP 2 HB2 ASP 2 -12.370 -6.823 -1.216
13 HB3 ASP 2 HB3 ASP 2 -13.394 -5.815 -2.226
14 HD2 ASP 2 HD2 ASP 2 -10.775 -4.451 -4.022
15 H ASN 3 H ASN 3 -11.251 -2.782 -0.726
16 HA ASN 3 HA ASN 3 -13.174 -1.022 -1.981
17 HB2 ASN 3 HB2 ASN 3 -12.154 -0.207 0.829
18 HB3 ASN 3 HB3 ASN 3 -12.736 0.945 -0.347
19 HD21 ASN 3 HD22 ASN 3 -15.012 0.916 -0.912
20 HD22 ASN 3 HD21 ASN 3 -16.220 0.167 0.248
21 H ILE 4 H ILE 4 -11.817 -0.760 -3.577
22 HA ILE 4 HA ILE 4 -9.061 -1.015 -3.728
23 HB ILE 4 HB ILE 4 -10.601 -0.897 -5.650
24 HG12 ILE 4 HG12 ILE 4 -9.074 0.149 -7.337
25 HG13 ILE 4 HG11 ILE 4 -8.099 0.843 -6.056
26 HG21 ILE 4 HG21 ILE 4 -11.183 1.212 -6.776
27 HG22 ILE 4 HG22 ILE 4 -10.361 2.168 -5.513
28 HG23 ILE 4 HG23 ILE 4 -11.820 1.227 -5.118
29 HD11 ILE 4 HD11 ILE 4 -7.098 -1.256 -7.003
30 HD12 ILE 4 HD12 ILE 4 -8.537 -2.191 -6.530
31 HD13 ILE 4 HD13 ILE 4 -7.468 -1.494 -5.283
32 H LEU 5 H LEU 5 -10.459 1.928 -2.475
33 HA LEU 5 HA LEU 5 -7.933 3.453 -2.702
34 HB2 LEU 5 HB3 LEU 5 -10.297 4.524 -2.891
35 HB3 LEU 5 HB2 LEU 5 -10.529 4.251 -1.194
36 HG LEU 5 HG LEU 5 -10.012 6.569 -1.828
37 HD11 LEU 5 HD11 LEU 5 -9.456 5.812 0.506
38 HD12 LEU 5 HD12 LEU 5 -7.761 5.575 0.012
39 HD13 LEU 5 HD13 LEU 5 -8.487 7.192 -0.046
40 HD21 LEU 5 HD21 LEU 5 -7.802 7.368 -2.565
41 HD22 LEU 5 HD22 LEU 5 -8.435 6.192 -3.734
42 HD23 LEU 5 HD23 LEU 5 -7.155 5.711 -2.592
43 H VAL 6 H VAL 6 -9.806 2.034 -0.039
44 HA VAL 6 HA VAL 6 -7.916 2.597 2.101
45 HB VAL 6 HB VAL 6 -9.803 0.152 2.055
46 HG11 VAL 6 HG21 VAL 6 -8.617 1.712 4.442
47 HG12 VAL 6 HG22 VAL 6 -9.779 0.363 4.543
48 HG13 VAL 6 HG23 VAL 6 -8.145 0.074 3.932
49 HG21 VAL 6 HG11 VAL 6 -11.180 2.129 1.583
50 HG22 VAL 6 HG12 VAL 6 -11.488 1.536 3.220
51 HG23 VAL 6 HG13 VAL 6 -10.479 2.998 2.973
52 H LYS 7 H LYS 7 -8.131 -0.187 -0.056
53 HA LYS 7 HA LYS 7 -5.817 -1.674 1.057
54 HB2 LYS 7 HB3 LYS 7 -7.008 -1.979 -1.772
55 HB3 LYS 7 HB2 LYS 7 -5.930 -3.107 -0.982
56 HG2 LYS 7 HG2 LYS 7 -8.871 -2.559 -0.240
57 HG3 LYS 7 HG3 LYS 7 -8.215 -3.960 -1.043
58 HD2 LYS 7 HD2 LYS 7 -6.969 -4.668 0.965
59 HD3 LYS 7 HD3 LYS 7 -7.405 -3.213 1.844
60 HE2 LYS 7 HE3 LYS 7 -9.484 -5.273 0.828
61 HE3 LYS 7 HE2 LYS 7 -8.747 -5.319 2.428
62 HZ2 LYS 7 HZ2 LYS 7 -9.642 -3.109 2.869
63 HZ3 LYS 7 HZ3 LYS 7 -10.337 -3.042 1.391
64 H MET 8 H MET 8 -6.044 0.542 -1.765
65 HA MET 8 HA MET 8 -3.190 0.273 -2.405
66 HB2 MET 8 HB2 MET 8 -5.108 2.316 -3.447
67 HB3 MET 8 HB3 MET 8 -3.463 2.116 -3.992
68 HG2 MET 8 HG2 MET 8 -5.843 0.295 -4.559
69 HG3 MET 8 HG3 MET 8 -4.629 0.980 -5.631
70 HE1 MET 8 HE1 MET 8 -1.744 0.285 -4.683
71 HE2 MET 8 HE2 MET 8 -2.367 -0.116 -6.315
72 HE3 MET 8 HE3 MET 8 -1.534 -1.364 -5.341
73 H PHE 9 H PHE 9 -4.723 2.246 0.009
74 HA PHE 9 HA PHE 9 -2.734 4.431 0.024
75 HB2 PHE 9 HB3 PHE 9 -5.025 4.712 0.972
76 HB3 PHE 9 HB2 PHE 9 -4.696 3.534 2.217
77 HD1 PHE 9 HD1 PHE 9 -3.753 6.949 0.946
78 HD2 PHE 9 HD2 PHE 9 -3.389 4.180 4.222
79 HE1 PHE 9 HE1 PHE 9 -2.798 8.725 2.358
80 HE2 PHE 9 HE2 PHE 9 -2.433 5.968 5.614
81 HZ PHE 9 HZ PHE 9 -2.135 8.239 4.689
82 H LYS 10 H LYS 10 -3.181 1.711 2.274
83 HA LYS 10 HA LYS 10 -0.486 1.990 3.418
84 HB2 LYS 10 HB2 LYS 10 -2.323 -0.546 3.537
85 HB3 LYS 10 HB3 LYS 10 -0.896 -0.402 4.506
86 HG2 LYS 10 HG2 LYS 10 -1.837 1.545 5.774
87 HG3 LYS 10 HG3 LYS 10 -3.274 1.551 4.747
88 HD2 LYS 10 HD2 LYS 10 -3.842 -0.784 5.513
89 HD3 LYS 10 HD3 LYS 10 -2.396 -0.808 6.530
90 HE2 LYS 10 HE3 LYS 10 -3.298 1.169 7.858
91 HE3 LYS 10 HE2 LYS 10 -4.746 1.190 6.840
92 HZ2 LYS 10 HZ2 LYS 10 -3.871 -1.059 8.566
93 HZ3 LYS 10 HZ3 LYS 10 -5.084 -0.013 8.895
94 H THR 11 H THR 11 -1.511 -0.044 0.691
95 HA THR 11 HA THR 11 0.894 -1.636 0.536
96 HB THR 11 HB THR 11 -1.081 -0.889 -1.694
97 HG1 THR 11 HG1 THR 11 -0.859 -3.148 0.002
98 HG21 THR 11 HG21 THR 11 0.998 -1.844 -2.720
99 HG22 THR 11 HG22 THR 11 0.932 -3.230 -1.598
100 HG23 THR 11 HG23 THR 11 -0.350 -2.998 -2.817
101 H ASN 12 H ASN 12 0.004 1.230 -1.380
102 HA ASN 12 HA ASN 12 2.616 1.674 -2.518
103 HB2 ASN 12 HB2 ASN 12 0.326 2.505 -3.404
104 HB3 ASN 12 HB3 ASN 12 0.313 3.735 -2.175
105 HD21 ASN 12 HD21 ASN 12 1.538 5.624 -2.598
106 HD22 ASN 12 HD22 ASN 12 2.478 5.863 -4.154
107 H GLU 13 H GLU 13 1.215 3.100 0.503
108 HA GLU 13 HA GLU 13 3.335 5.032 0.906
109 HB2 GLU 13 HB3 GLU 13 1.042 5.214 1.855
110 HB3 GLU 13 HB2 GLU 13 1.359 3.863 2.940
111 HG2 GLU 13 HG2 GLU 13 3.142 5.219 4.103
112 HG3 GLU 13 HG3 GLU 13 2.928 6.533 2.949
113 HE2 GLU 13 HE2 GLU 13 1.257 7.754 3.062
114 H ASN 14 H ASN 14 2.794 1.886 2.486
115 HA ASN 14 HA ASN 14 5.231 1.812 3.995
116 HB2 ASN 14 HB2 ASN 14 3.164 0.380 4.365
117 HB3 ASN 14 HB3 ASN 14 3.638 -0.630 3.018
118 HD21 ASN 14 HD21 ASN 14 5.202 -2.242 3.459
119 HD22 ASN 14 HD22 ASN 14 5.936 -2.478 5.122
120 H ASN 15 H ASN 15 4.699 0.543 0.727
121 HA ASN 15 HA ASN 15 7.391 -0.545 0.442
122 HB2 ASN 15 HB2 ASN 15 5.196 -1.298 -0.758
123 HB3 ASN 15 HB3 ASN 15 5.310 0.112 -1.775
124 HD21 ASN 15 HD22 ASN 15 5.416 -2.852 -2.268
125 HD22 ASN 15 HD21 ASN 15 6.886 -3.054 -3.348
126 H ASP 16 H ASP 16 6.074 2.618 -0.484
127 HA ASP 16 HA ASP 16 8.655 3.301 -1.839
128 HB2 ASP 16 HB3 ASP 16 6.481 3.438 -3.233
129 HB3 ASP 16 HB2 ASP 16 5.992 4.783 -2.220
130 HD2 ASP 16 HD2 ASP 16 8.966 5.103 -4.982
131 H LYS 17 H LYS 17 8.409 3.337 1.010
132 HA LYS 17 HA LYS 17 9.409 6.084 1.476
133 HB2 LYS 17 HB2 LYS 17 8.510 5.910 3.651
134 HB3 LYS 17 HB3 LYS 17 7.223 5.234 2.686
135 HG2 LYS 17 HG3 LYS 17 8.084 2.898 3.333
136 HG3 LYS 17 HG2 LYS 17 9.205 3.676 4.449
137 HD2 LYS 17 HD3 LYS 17 7.244 4.805 5.609
138 HD3 LYS 17 HD2 LYS 17 6.140 3.951 4.528
139 HE2 LYS 17 HE3 LYS 17 7.072 1.715 5.406
140 HE3 LYS 17 HE2 LYS 17 8.098 2.617 6.529
141 HZ2 LYS 17 HZ2 LYS 17 5.133 2.760 6.442
142 HZ3 LYS 17 HZ3 LYS 17 6.081 3.588 7.485
143 H SER 18 H SER 18 10.284 2.715 2.093
144 HA SER 18 HA SER 18 13.138 3.659 2.739
145 HB2 SER 18 HB2 SER 18 11.832 2.630 4.819
146 HB3 SER 18 HB3 SER 18 11.785 1.129 3.916
147 HG SER 18 HG SER 18 14.121 2.603 4.567
148 H GLU 19 H GLU 19 12.130 0.297 2.068
149 HA GLU 19 HA GLU 19 12.908 0.325 -0.716
150 HB2 GLU 19 HB2 GLU 19 15.199 0.626 0.300
151 HB3 GLU 19 HB3 GLU 19 14.999 -0.805 1.298
152 HG2 GLU 19 HG3 GLU 19 14.850 -2.251 -0.715
153 HG3 GLU 19 HG2 GLU 19 14.901 -0.836 -1.773
154 HE2 GLU 19 HE2 GLU 19 18.244 -2.329 -0.022
155 H LEU 20 H LEU 20 11.189 -0.963 -1.093
156 HA LEU 20 HA LEU 20 11.201 -3.823 0.034
157 HB2 LEU 20 HB2 LEU 20 9.512 -2.086 1.253
158 HB3 LEU 20 HB3 LEU 20 8.644 -2.150 -0.253
159 HG LEU 20 HG LEU 20 8.413 -4.705 0.049
160 HD11 LEU 20 HD21 LEU 20 10.291 -5.123 1.664
161 HD12 LEU 20 HD22 LEU 20 8.746 -5.635 2.361
162 HD13 LEU 20 HD23 LEU 20 9.494 -4.107 2.889
163 HD21 LEU 20 HD11 LEU 20 6.570 -4.483 1.733
164 HD22 LEU 20 HD12 LEU 20 6.550 -3.137 0.579
165 HD23 LEU 20 HD13 LEU 20 7.187 -2.884 2.222
166 H ILE 21 H ILE 21 12.303 -3.337 -2.425
167 HA ILE 21 HA ILE 21 10.275 -4.689 -4.283
168 HB ILE 21 HB ILE 21 12.379 -2.646 -5.224
169 HG12 ILE 21 HG12 ILE 21 10.072 -1.516 -6.139
170 HG13 ILE 21 HG11 ILE 21 9.360 -2.321 -4.761
171 HG21 ILE 21 HG21 ILE 21 11.349 -2.940 -7.479
172 HG22 ILE 21 HG22 ILE 21 10.246 -4.185 -6.839
173 HG23 ILE 21 HG23 ILE 21 12.001 -4.470 -6.886
174 HD11 ILE 21 HD11 ILE 21 10.952 -0.998 -3.242
175 HD12 ILE 21 HD12 ILE 21 9.998 0.062 -4.296
176 HD13 ILE 21 HD13 ILE 21 11.698 -0.278 -4.690
Start of MODEL 6
1 H1 TYR 1 H TYR 1 -20.621 -5.260 1.791
2 HA TYR 1 HA TYR 1 -19.657 -3.397 -0.461
3 HB2 TYR 1 HB3 TYR 1 -20.127 -2.591 2.479
4 HB3 TYR 1 HB2 TYR 1 -19.202 -1.647 1.320
5 HD1 TYR 1 HD2 TYR 1 -20.338 -0.616 -0.714
6 HD2 TYR 1 HD3 TYR 1 -22.607 -2.534 2.400
7 HE1 TYR 1 HE2 TYR 1 -22.383 0.489 -1.512
8 HE2 TYR 1 HE3 TYR 1 -24.642 -1.424 1.591
9 HH TYR 1 HH TYR 1 -25.524 -0.045 0.090
10 H ASP 2 H ASP 2 -17.768 -4.233 -0.934
11 HA ASP 2 HA ASP 2 -15.642 -4.537 1.207
12 HB2 ASP 2 HB3 ASP 2 -16.730 -6.823 0.949
13 HB3 ASP 2 HB2 ASP 2 -16.273 -6.857 -0.743
14 HD2 ASP 2 HD2 ASP 2 -12.978 -7.706 -0.150
15 H ASN 3 H ASN 3 -14.078 -3.257 0.481
16 HA ASN 3 HA ASN 3 -13.014 -3.396 -2.232
17 HB2 ASN 3 HB3 ASN 3 -14.287 -0.715 -1.365
18 HB3 ASN 3 HB2 ASN 3 -13.044 -0.811 -2.584
19 HD21 ASN 3 HD22 ASN 3 -13.528 -1.900 -4.608
20 HD22 ASN 3 HD21 ASN 3 -15.276 -2.047 -5.146
21 H ILE 4 H ILE 4 -11.143 -3.987 -1.315
22 HA ILE 4 HA ILE 4 -9.925 -2.595 0.931
23 HB ILE 4 HB ILE 4 -9.860 -5.072 0.444
24 HG12 ILE 4 HG11 ILE 4 -7.580 -5.516 1.334
25 HG13 ILE 4 HG12 ILE 4 -7.144 -3.830 1.158
26 HG21 ILE 4 HG21 ILE 4 -8.103 -6.026 -0.984
27 HG22 ILE 4 HG22 ILE 4 -9.157 -4.980 -1.960
28 HG23 ILE 4 HG23 ILE 4 -7.546 -4.403 -1.472
29 HD11 ILE 4 HD11 ILE 4 -7.807 -4.418 3.504
30 HD12 ILE 4 HD12 ILE 4 -8.927 -3.203 2.857
31 HD13 ILE 4 HD13 ILE 4 -9.426 -4.914 2.956
32 H LEU 5 H LEU 5 -10.152 -1.034 -1.723
33 HA LEU 5 HA LEU 5 -7.484 -0.332 -2.524
34 HB2 LEU 5 HB2 LEU 5 -10.152 1.210 -2.866
35 HB3 LEU 5 HB3 LEU 5 -8.646 1.846 -3.456
36 HG LEU 5 HG LEU 5 -8.304 -0.277 -4.855
37 HD11 LEU 5 HD11 LEU 5 -11.297 -0.750 -4.216
38 HD12 LEU 5 HD12 LEU 5 -10.393 -1.544 -5.527
39 HD13 LEU 5 HD13 LEU 5 -9.952 -1.860 -3.848
40 HD21 LEU 5 HD21 LEU 5 -9.774 0.577 -6.686
41 HD22 LEU 5 HD22 LEU 5 -10.710 1.542 -5.517
42 HD23 LEU 5 HD23 LEU 5 -8.997 1.916 -5.826
43 H VAL 6 H VAL 6 -9.432 1.226 -0.003
44 HA VAL 6 HA VAL 6 -7.655 3.502 0.442
45 HB VAL 6 HB VAL 6 -9.452 2.271 2.623
46 HG11 VAL 6 HG21 VAL 6 -9.498 4.585 3.563
47 HG12 VAL 6 HG22 VAL 6 -8.389 5.154 2.288
48 HG13 VAL 6 HG23 VAL 6 -7.836 3.981 3.507
49 HG21 VAL 6 HG11 VAL 6 -10.246 4.338 0.506
50 HG22 VAL 6 HG12 VAL 6 -10.885 2.682 0.683
51 HG23 VAL 6 HG13 VAL 6 -11.209 3.877 1.947
52 H LYS 7 H LYS 7 -7.706 0.311 1.976
53 HA LYS 7 HA LYS 7 -5.307 0.768 3.671
54 HB2 LYS 7 HB2 LYS 7 -6.459 -1.963 2.827
55 HB3 LYS 7 HB3 LYS 7 -5.303 -1.686 4.108
56 HG2 LYS 7 HG3 LYS 7 -8.282 -0.893 4.123
57 HG3 LYS 7 HG2 LYS 7 -7.492 -2.169 5.024
58 HD2 LYS 7 HD3 LYS 7 -6.129 -0.464 6.311
59 HD3 LYS 7 HD2 LYS 7 -6.949 0.837 5.439
60 HE2 LYS 7 HE2 LYS 7 -9.185 0.056 6.365
61 HE3 LYS 7 HE3 LYS 7 -8.366 -1.245 7.243
62 HZ2 LYS 7 HZ2 LYS 7 -7.121 0.411 8.468
63 HZ3 LYS 7 HZ3 LYS 7 -8.729 0.638 8.653
64 H MET 8 H MET 8 -5.666 -0.826 0.483
65 HA MET 8 HA MET 8 -2.845 -1.546 0.265
66 HB2 MET 8 HB3 MET 8 -4.855 -1.419 -1.948
67 HB3 MET 8 HB2 MET 8 -3.232 -2.046 -2.093
68 HG2 MET 8 HG3 MET 8 -5.610 -3.348 -0.691
69 HG3 MET 8 HG2 MET 8 -4.446 -3.977 -1.856
70 HE1 MET 8 HE1 MET 8 -3.647 -6.297 1.191
71 HE2 MET 8 HE2 MET 8 -3.988 -6.230 -0.563
72 HE3 MET 8 HE3 MET 8 -5.242 -5.730 0.614
73 H PHE 9 H PHE 9 -4.324 1.556 -0.257
74 HA PHE 9 HA PHE 9 -2.397 2.565 -2.270
75 HB2 PHE 9 HB2 PHE 9 -4.699 3.513 -1.973
76 HB3 PHE 9 HB3 PHE 9 -4.291 4.085 -0.378
77 HD1 PHE 9 HD2 PHE 9 -3.554 4.513 -4.040
78 HD2 PHE 9 HD1 PHE 9 -3.021 6.190 -0.111
79 HE1 PHE 9 HE2 PHE 9 -2.745 6.614 -5.034
80 HE2 PHE 9 HE1 PHE 9 -2.215 8.282 -1.125
81 HZ PHE 9 HZ PHE 9 -2.074 8.499 -3.583
82 H LYS 10 H LYS 10 -2.740 3.211 1.204
83 HA LYS 10 HA LYS 10 -0.031 4.371 1.432
84 HB2 LYS 10 HB2 LYS 10 -1.841 3.331 3.768
85 HB3 LYS 10 HB3 LYS 10 -0.403 4.247 4.059
86 HG2 LYS 10 HG2 LYS 10 -1.344 6.273 2.932
87 HG3 LYS 10 HG3 LYS 10 -2.794 5.379 2.468
88 HD2 LYS 10 HD2 LYS 10 -3.336 4.972 4.889
89 HD3 LYS 10 HD3 LYS 10 -1.901 5.854 5.389
90 HE2 LYS 10 HE3 LYS 10 -4.243 7.080 3.765
91 HE3 LYS 10 HE2 LYS 10 -4.094 7.156 5.518
92 HZ2 LYS 10 HZ2 LYS 10 -2.005 8.359 5.250
93 HZ3 LYS 10 HZ3 LYS 10 -2.125 8.299 3.621
94 H THR 11 H THR 11 -1.103 1.023 1.984
95 HA THR 11 HA THR 11 1.315 0.127 3.295
96 HB THR 11 HB THR 11 -0.711 -1.511 1.671
97 HG1 THR 11 HG1 THR 11 -0.445 -0.989 4.444
98 HG21 THR 11 HG21 THR 11 0.034 -3.456 3.058
99 HG22 THR 11 HG22 THR 11 1.329 -2.468 3.787
100 HG23 THR 11 HG23 THR 11 1.371 -2.863 2.047
101 H ASN 12 H ASN 12 0.335 -0.195 -0.115
102 HA ASN 12 HA ASN 12 2.849 -1.156 -1.127
103 HB2 ASN 12 HB3 ASN 12 0.520 -1.282 -2.269
104 HB3 ASN 12 HB2 ASN 12 0.660 0.401 -2.683
105 HD21 ASN 12 HD21 ASN 12 1.965 -2.821 -3.297
106 HD22 ASN 12 HD22 ASN 12 2.754 -2.383 -4.894
107 H GLU 13 H GLU 13 1.733 2.282 -0.828
108 HA GLU 13 HA GLU 13 3.961 3.429 -2.273
109 HB2 GLU 13 HB3 GLU 13 1.774 4.582 -1.943
110 HB3 GLU 13 HB2 GLU 13 2.084 4.721 -0.223
111 HG2 GLU 13 HG2 GLU 13 2.501 6.866 -1.282
112 HG3 GLU 13 HG3 GLU 13 4.025 6.258 -0.672
113 HE2 GLU 13 HE2 GLU 13 2.072 6.708 -3.399
114 H ASN 14 H ASN 14 3.407 3.214 1.238
115 HA ASN 14 HA ASN 14 5.940 4.241 2.094
116 HB2 ASN 14 HB3 ASN 14 3.872 4.000 3.521
117 HB3 ASN 14 HB2 ASN 14 4.132 2.274 3.622
118 HD21 ASN 14 HD22 ASN 14 5.537 1.568 5.239
119 HD22 ASN 14 HD21 ASN 14 6.474 2.702 6.336
120 H ASN 15 H ASN 15 5.079 0.804 1.714
121 HA ASN 15 HA ASN 15 7.682 -0.246 2.440
122 HB2 ASN 15 HB3 ASN 15 5.356 -1.547 0.875
123 HB3 ASN 15 HB2 ASN 15 6.828 -2.418 1.175
124 HD21 ASN 15 HD22 ASN 15 7.405 -2.978 3.359
125 HD22 ASN 15 HD21 ASN 15 6.108 -3.028 4.656
126 H ASP 16 H ASP 16 6.549 0.883 -0.697
127 HA ASP 16 HA ASP 16 9.060 -0.100 -2.019
128 HB2 ASP 16 HB3 ASP 16 6.824 -1.003 -2.964
129 HB3 ASP 16 HB2 ASP 16 6.448 0.634 -3.467
130 HD2 ASP 16 HD2 ASP 16 9.190 -1.663 -5.376
131 H LYS 17 H LYS 17 9.137 2.084 -0.341
132 HA LYS 17 HA LYS 17 10.276 4.119 -2.160
133 HB2 LYS 17 HB3 LYS 17 7.974 4.887 -1.690
134 HB3 LYS 17 HB2 LYS 17 8.195 4.725 0.040
135 HG2 LYS 17 HG3 LYS 17 9.815 6.700 -1.710
136 HG3 LYS 17 HG2 LYS 17 8.244 7.071 -1.012
137 HD2 LYS 17 HD3 LYS 17 9.228 6.485 1.324
138 HD3 LYS 17 HD2 LYS 17 10.794 6.387 0.548
139 HE2 LYS 17 HE2 LYS 17 10.709 8.576 1.508
140 HE3 LYS 17 HE3 LYS 17 10.580 8.813 -0.234
141 HZ2 LYS 17 HZ2 LYS 17 8.159 9.024 0.064
142 HZ3 LYS 17 HZ3 LYS 17 8.299 8.799 1.677
143 H SER 18 H SER 18 9.737 3.462 1.289
144 HA SER 18 HA SER 18 12.525 4.243 2.041
145 HB2 SER 18 HB3 SER 18 10.489 4.424 3.749
146 HB3 SER 18 HB2 SER 18 10.543 2.670 3.841
147 HG SER 18 HG SER 18 12.728 2.850 4.491
148 H GLU 19 H GLU 19 10.931 1.042 1.945
149 HA GLU 19 HA GLU 19 13.688 -0.287 1.914
150 HB2 GLU 19 HB3 GLU 19 12.029 -0.937 3.751
151 HB3 GLU 19 HB2 GLU 19 10.961 -1.602 2.518
152 HG2 GLU 19 HG2 GLU 19 12.137 -3.402 3.437
153 HG3 GLU 19 HG3 GLU 19 12.737 -3.189 1.796
154 HE2 GLU 19 HE2 GLU 19 13.343 -2.678 5.097
155 H LEU 20 H LEU 20 13.692 0.689 -0.227
156 HA LEU 20 HA LEU 20 12.157 -0.743 -2.417
157 HB2 LEU 20 HB3 LEU 20 12.679 1.878 -2.503
158 HB3 LEU 20 HB2 LEU 20 14.336 1.416 -2.802
159 HG LEU 20 HG LEU 20 13.581 0.157 -4.897
160 HD11 LEU 20 HD21 LEU 20 10.871 1.561 -4.376
161 HD12 LEU 20 HD22 LEU 20 11.333 0.716 -5.874
162 HD13 LEU 20 HD23 LEU 20 11.154 -0.197 -4.369
163 HD21 LEU 20 HD11 LEU 20 13.335 2.234 -6.259
164 HD22 LEU 20 HD12 LEU 20 14.574 2.445 -5.008
165 HD23 LEU 20 HD13 LEU 20 12.967 3.182 -4.796
166 H ILE 21 H ILE 21 15.632 -0.156 -2.054
167 HA ILE 21 HA ILE 21 16.217 -2.675 -3.578
168 HB ILE 21 HB ILE 21 17.617 -0.627 -3.950
169 HG12 ILE 21 HG12 ILE 21 19.809 -1.870 -4.233
170 HG13 ILE 21 HG11 ILE 21 19.135 -3.237 -3.364
171 HG21 ILE 21 HG21 ILE 21 18.179 0.034 -1.555
172 HG22 ILE 21 HG22 ILE 21 19.605 -0.123 -2.596
173 HG23 ILE 21 HG23 ILE 21 19.230 -1.399 -1.431
174 HD11 ILE 21 HD11 ILE 21 17.434 -3.566 -5.211
175 HD12 ILE 21 HD12 ILE 21 18.022 -2.088 -6.022
176 HD13 ILE 21 HD13 ILE 21 19.081 -3.510 -5.869
Start of MODEL 7
1 H1 TYR 1 H TYR 1 -12.147 -6.273 3.921
2 HA TYR 1 HA TYR 1 -14.802 -5.283 2.725
3 HB2 TYR 1 HB2 TYR 1 -12.749 -3.552 4.245
4 HB3 TYR 1 HB3 TYR 1 -14.035 -2.914 3.230
5 HD1 TYR 1 HD2 TYR 1 -16.479 -3.252 3.869
6 HD2 TYR 1 HD3 TYR 1 -13.281 -4.352 6.531
7 HE1 TYR 1 HE2 TYR 1 -18.057 -3.316 5.751
8 HE2 TYR 1 HE3 TYR 1 -14.870 -4.412 8.403
9 HH TYR 1 HH TYR 1 -16.978 -4.146 9.047
10 H ASP 2 H ASP 2 -14.543 -5.305 0.656
11 HA ASP 2 HA ASP 2 -11.815 -5.102 -0.665
12 HB2 ASP 2 HB3 ASP 2 -13.481 -6.895 -1.378
13 HB3 ASP 2 HB2 ASP 2 -14.503 -5.646 -2.076
14 HD2 ASP 2 HD2 ASP 2 -11.046 -6.821 -3.819
15 H ASN 3 H ASN 3 -11.068 -3.113 -1.224
16 HA ASN 3 HA ASN 3 -12.702 -1.045 -2.411
17 HB2 ASN 3 HB3 ASN 3 -11.446 -0.405 0.349
18 HB3 ASN 3 HB2 ASN 3 -11.926 0.814 -0.808
19 HD21 ASN 3 HD22 ASN 3 -14.205 1.131 -1.213
20 HD22 ASN 3 HD21 ASN 3 -15.437 0.557 0.020
21 H ILE 4 H ILE 4 -11.350 -1.075 -4.070
22 HA ILE 4 HA ILE 4 -8.560 -1.589 -4.106
23 HB ILE 4 HB ILE 4 -10.102 -1.759 -5.999
24 HG12 ILE 4 HG11 ILE 4 -7.610 -1.930 -6.274
25 HG13 ILE 4 HG12 ILE 4 -8.585 -1.668 -7.694
26 HG21 ILE 4 HG21 ILE 4 -11.285 0.407 -5.919
27 HG22 ILE 4 HG22 ILE 4 -10.582 0.121 -7.528
28 HG23 ILE 4 HG23 ILE 4 -9.806 1.271 -6.404
29 HD11 ILE 4 HD11 ILE 4 -7.857 0.725 -7.848
30 HD12 ILE 4 HD12 ILE 4 -6.860 0.535 -6.387
31 HD13 ILE 4 HD13 ILE 4 -6.480 -0.395 -7.846
32 H LEU 5 H LEU 5 -9.997 1.451 -3.308
33 HA LEU 5 HA LEU 5 -7.504 3.007 -3.717
34 HB2 LEU 5 HB3 LEU 5 -9.865 3.986 -4.199
35 HB3 LEU 5 HB2 LEU 5 -10.184 3.991 -2.494
36 HG LEU 5 HG LEU 5 -9.661 6.183 -3.483
37 HD11 LEU 5 HD11 LEU 5 -7.515 5.559 -1.375
38 HD12 LEU 5 HD12 LEU 5 -9.239 5.840 -1.028
39 HD13 LEU 5 HD13 LEU 5 -8.253 7.128 -1.748
40 HD21 LEU 5 HD21 LEU 5 -7.420 6.896 -4.217
41 HD22 LEU 5 HD22 LEU 5 -6.754 5.271 -3.926
42 HD23 LEU 5 HD23 LEU 5 -7.968 5.526 -5.205
43 H VAL 6 H VAL 6 -9.481 2.053 -0.914
44 HA VAL 6 HA VAL 6 -7.653 3.022 1.136
45 HB VAL 6 HB VAL 6 -9.511 0.586 1.495
46 HG11 VAL 6 HG21 VAL 6 -9.536 1.236 3.910
47 HG12 VAL 6 HG22 VAL 6 -7.890 0.855 3.390
48 HG13 VAL 6 HG23 VAL 6 -8.378 2.554 3.591
49 HG21 VAL 6 HG11 VAL 6 -10.881 2.451 0.656
50 HG22 VAL 6 HG12 VAL 6 -10.217 3.543 1.897
51 HG23 VAL 6 HG13 VAL 6 -11.229 2.136 2.360
52 H LYS 7 H LYS 7 -7.778 -0.098 -0.490
53 HA LYS 7 HA LYS 7 -5.541 -1.360 0.919
54 HB2 LYS 7 HB3 LYS 7 -7.266 -2.700 -0.248
55 HB3 LYS 7 HB2 LYS 7 -6.831 -2.017 -1.800
56 HG2 LYS 7 HG2 LYS 7 -6.044 -4.309 -1.607
57 HG3 LYS 7 HG3 LYS 7 -4.680 -3.237 -1.840
58 HD2 LYS 7 HD3 LYS 7 -4.213 -3.338 0.671
59 HD3 LYS 7 HD2 LYS 7 -5.562 -4.442 0.883
60 HE2 LYS 7 HE2 LYS 7 -3.070 -5.007 -0.880
61 HE3 LYS 7 HE3 LYS 7 -3.248 -5.522 0.794
62 HZ2 LYS 7 HZ2 LYS 7 -3.816 -7.268 -0.748
63 HZ3 LYS 7 HZ3 LYS 7 -4.991 -6.371 -1.447
64 H MET 8 H MET 8 -5.594 0.309 -2.280
65 HA MET 8 HA MET 8 -2.694 0.020 -2.652
66 HB2 MET 8 HB2 MET 8 -4.514 1.794 -4.236
67 HB3 MET 8 HB3 MET 8 -2.834 1.488 -4.585
68 HG2 MET 8 HG3 MET 8 -5.198 -0.408 -4.954
69 HG3 MET 8 HG2 MET 8 -3.899 0.047 -6.052
70 HE1 MET 8 HE1 MET 8 -0.882 -2.206 -5.089
71 HE2 MET 8 HE2 MET 8 -1.637 -1.195 -6.357
72 HE3 MET 8 HE3 MET 8 -1.105 -0.454 -4.815
73 H PHE 9 H PHE 9 -4.472 2.419 -0.848
74 HA PHE 9 HA PHE 9 -2.340 4.509 -1.019
75 HB2 PHE 9 HB2 PHE 9 -4.752 5.125 -0.682
76 HB3 PHE 9 HB3 PHE 9 -4.780 4.290 0.849
77 HD1 PHE 9 HD2 PHE 9 -3.362 7.244 -0.979
78 HD2 PHE 9 HD1 PHE 9 -3.755 5.342 2.864
79 HE1 PHE 9 HE2 PHE 9 -2.554 9.288 0.129
80 HE2 PHE 9 HE1 PHE 9 -2.941 7.393 3.950
81 HZ PHE 9 HZ PHE 9 -2.342 9.367 2.590
82 H LYS 10 H LYS 10 -3.515 2.282 1.483
83 HA LYS 10 HA LYS 10 -1.204 2.702 3.255
84 HB2 LYS 10 HB2 LYS 10 -3.167 0.256 3.272
85 HB3 LYS 10 HB3 LYS 10 -2.067 0.563 4.573
86 HG2 LYS 10 HG3 LYS 10 -3.211 2.704 5.166
87 HG3 LYS 10 HG2 LYS 10 -4.287 2.554 3.775
88 HD2 LYS 10 HD2 LYS 10 -5.203 0.389 4.702
89 HD3 LYS 10 HD3 LYS 10 -4.143 0.544 6.109
90 HE2 LYS 10 HE2 LYS 10 -5.282 2.731 6.730
91 HE3 LYS 10 HE3 LYS 10 -6.333 2.589 5.313
92 HZ2 LYS 10 HZ2 LYS 10 -7.167 0.494 6.223
93 HZ3 LYS 10 HZ3 LYS 10 -6.197 0.622 7.532
94 H THR 11 H THR 11 -1.671 0.185 0.762
95 HA THR 11 HA THR 11 0.633 -1.398 1.541
96 HB THR 11 HB THR 11 -0.788 -1.243 -1.173
97 HG1 THR 11 HG1 THR 11 -0.970 -3.047 1.007
98 HG21 THR 11 HG21 THR 11 0.136 -3.532 -1.587
99 HG22 THR 11 HG22 THR 11 1.119 -3.425 -0.102
100 HG23 THR 11 HG23 THR 11 1.448 -2.337 -1.478
101 H ASN 12 H ASN 12 0.264 1.048 -1.025
102 HA ASN 12 HA ASN 12 3.060 1.202 -1.700
103 HB2 ASN 12 HB3 ASN 12 1.031 1.978 -3.133
104 HB3 ASN 12 HB2 ASN 12 0.920 3.403 -2.144
105 HD21 ASN 12 HD21 ASN 12 2.853 1.727 -4.560
106 HD22 ASN 12 HD22 ASN 12 3.863 3.187 -5.025
107 H GLU 13 H GLU 13 1.201 3.250 0.670
108 HA GLU 13 HA GLU 13 3.364 5.099 1.181
109 HB2 GLU 13 HB2 GLU 13 0.936 5.547 1.567
110 HB3 GLU 13 HB3 GLU 13 0.929 4.425 2.927
111 HG2 GLU 13 HG3 GLU 13 2.528 5.936 4.173
112 HG3 GLU 13 HG2 GLU 13 2.652 6.989 2.766
113 HE2 GLU 13 HE2 GLU 13 0.481 5.630 5.022
114 H ASN 14 H ASN 14 2.471 2.124 2.905
115 HA ASN 14 HA ASN 14 4.710 2.419 4.815
116 HB2 ASN 14 HB3 ASN 14 2.588 0.221 4.615
117 HB3 ASN 14 HB2 ASN 14 3.869 0.233 5.800
118 HD21 ASN 14 HD21 ASN 14 0.774 1.554 5.056
119 HD22 ASN 14 HD22 ASN 14 0.644 2.577 6.573
120 H ASN 15 H ASN 15 3.859 -0.274 2.629
121 HA ASN 15 HA ASN 15 6.496 -1.491 2.856
122 HB2 ASN 15 HB2 ASN 15 4.221 -2.179 0.871
123 HB3 ASN 15 HB3 ASN 15 5.672 -3.113 1.011
124 HD21 ASN 15 HD21 ASN 15 6.072 -4.292 3.013
125 HD22 ASN 15 HD22 ASN 15 4.642 -4.757 4.065
126 H ASP 16 H ASP 16 5.382 0.868 0.512
127 HA ASP 16 HA ASP 16 7.758 0.325 -1.225
128 HB2 ASP 16 HB3 ASP 16 5.535 -0.187 -2.419
129 HB3 ASP 16 HB2 ASP 16 5.141 1.515 -2.288
130 HD2 ASP 16 HD2 ASP 16 7.207 -0.810 -3.571
131 H LYS 17 H LYS 17 8.149 1.607 0.944
132 HA LYS 17 HA LYS 17 8.725 4.407 0.081
133 HB2 LYS 17 HB2 LYS 17 6.851 3.777 2.087
134 HB3 LYS 17 HB3 LYS 17 8.274 4.043 3.049
135 HG2 LYS 17 HG2 LYS 17 7.151 6.120 2.965
136 HG3 LYS 17 HG3 LYS 17 8.532 6.348 1.896
137 HD2 LYS 17 HD3 LYS 17 7.067 5.945 -0.110
138 HD3 LYS 17 HD2 LYS 17 5.691 5.575 0.905
139 HE2 LYS 17 HE3 LYS 17 7.122 8.329 0.837
140 HE3 LYS 17 HE2 LYS 17 5.705 7.916 -0.127
141 HZ2 LYS 17 HZ2 LYS 17 5.778 7.893 2.837
142 HZ3 LYS 17 HZ3 LYS 17 4.475 7.512 1.925
143 H SER 18 H SER 18 9.668 2.222 2.698
144 HA SER 18 HA SER 18 12.499 3.237 2.647
145 HB2 SER 18 HB3 SER 18 11.334 2.387 4.887
146 HB3 SER 18 HB2 SER 18 11.489 0.766 4.227
147 HG SER 18 HG SER 18 13.598 2.622 4.620
148 H GLU 19 H GLU 19 11.109 0.028 1.867
149 HA GLU 19 HA GLU 19 13.449 -0.477 -0.014
150 HB2 GLU 19 HB3 GLU 19 13.759 -1.861 2.031
151 HB3 GLU 19 HB2 GLU 19 12.140 -2.545 1.884
152 HG2 GLU 19 HG3 GLU 19 12.746 -3.601 -0.303
153 HG3 GLU 19 HG2 GLU 19 14.346 -2.860 -0.243
154 HE2 GLU 19 HE2 GLU 19 13.409 -6.119 1.966
155 H LEU 20 H LEU 20 12.081 0.481 -1.528
156 HA LEU 20 HA LEU 20 9.475 -0.224 -2.274
157 HB2 LEU 20 HB2 LEU 20 11.687 0.760 -4.199
158 HB3 LEU 20 HB3 LEU 20 10.000 0.617 -4.537
159 HG LEU 20 HG LEU 20 9.473 2.249 -2.629
160 HD11 LEU 20 HD21 LEU 20 11.313 3.905 -2.051
161 HD12 LEU 20 HD22 LEU 20 11.615 2.312 -1.359
162 HD13 LEU 20 HD23 LEU 20 12.510 2.828 -2.810
163 HD21 LEU 20 HD11 LEU 20 9.908 4.229 -4.078
164 HD22 LEU 20 HD12 LEU 20 9.347 2.859 -5.051
165 HD23 LEU 20 HD13 LEU 20 11.072 3.295 -5.053
166 H ILE 21 H ILE 21 12.345 -1.608 -3.866
167 HA ILE 21 HA ILE 21 10.620 -3.908 -4.939
168 HB ILE 21 HB ILE 21 13.454 -3.187 -5.879
169 HG12 ILE 21 HG12 ILE 21 12.099 -2.858 -8.156
170 HG13 ILE 21 HG11 ILE 21 10.695 -2.623 -7.137
171 HG21 ILE 21 HG21 ILE 21 13.077 -4.904 -7.652
172 HG22 ILE 21 HG22 ILE 21 13.009 -5.641 -6.051
173 HG23 ILE 21 HG23 ILE 21 11.500 -5.330 -6.939
174 HD11 ILE 21 HD11 ILE 21 11.816 -0.487 -7.890
175 HD12 ILE 21 HD12 ILE 21 13.305 -0.943 -7.031
176 HD13 ILE 21 HD13 ILE 21 11.814 -0.583 -6.123
Start of MODEL 8
1 H1 TYR 1 H TYR 1 -18.420 -5.540 0.434
2 HA TYR 1 HA TYR 1 -16.665 -5.592 -1.031
3 HB2 TYR 1 HB2 TYR 1 -18.353 -4.187 -3.163
4 HB3 TYR 1 HB3 TYR 1 -16.801 -4.962 -3.398
5 HD1 TYR 1 HD2 TYR 1 -16.555 -7.491 -3.083
6 HD2 TYR 1 HD3 TYR 1 -20.406 -5.567 -3.093
7 HE1 TYR 1 HE2 TYR 1 -17.642 -9.650 -3.520
8 HE2 TYR 1 HE3 TYR 1 -21.478 -7.732 -3.528
9 HH TYR 1 HH TYR 1 -19.559 -10.721 -3.849
10 H ASP 2 H ASP 2 -15.497 -4.366 0.377
11 HA ASP 2 HA ASP 2 -15.131 -1.401 -0.158
12 HB2 ASP 2 HB3 ASP 2 -15.323 -2.283 2.229
13 HB3 ASP 2 HB2 ASP 2 -13.751 -3.050 2.053
14 HD2 ASP 2 HD2 ASP 2 -15.471 -0.125 1.979
15 H ASN 3 H ASN 3 -13.233 -0.501 -0.839
16 HA ASN 3 HA ASN 3 -10.849 -2.018 -1.534
17 HB2 ASN 3 HB3 ASN 3 -12.276 -2.604 -3.544
18 HB3 ASN 3 HB2 ASN 3 -12.479 -0.904 -3.907
19 HD21 ASN 3 HD21 ASN 3 -9.925 -3.395 -3.502
20 HD22 ASN 3 HD22 ASN 3 -8.834 -2.685 -4.795
21 H ILE 4 H ILE 4 -10.651 -0.408 0.239
22 HA ILE 4 HA ILE 4 -9.502 2.150 -0.760
23 HB ILE 4 HB ILE 4 -11.265 1.800 1.626
24 HG12 ILE 4 HG11 ILE 4 -12.660 2.053 -0.370
25 HG13 ILE 4 HG12 ILE 4 -12.845 3.393 0.724
26 HG21 ILE 4 HG21 ILE 4 -9.719 4.319 0.826
27 HG22 ILE 4 HG22 ILE 4 -9.452 3.321 2.273
28 HG23 ILE 4 HG23 ILE 4 -10.963 4.234 2.117
29 HD11 ILE 4 HD11 ILE 4 -11.164 3.520 -1.875
30 HD12 ILE 4 HD12 ILE 4 -11.472 4.881 -0.770
31 HD13 ILE 4 HD13 ILE 4 -12.816 4.141 -1.664
32 H LEU 5 H LEU 5 -9.678 0.774 2.492
33 HA LEU 5 HA LEU 5 -6.887 0.935 2.991
34 HB2 LEU 5 HB3 LEU 5 -8.905 -0.900 4.491
35 HB3 LEU 5 HB2 LEU 5 -7.322 -0.502 5.069
36 HG LEU 5 HG LEU 5 -8.712 0.773 6.349
37 HD11 LEU 5 HD21 LEU 5 -8.158 3.142 5.973
38 HD12 LEU 5 HD22 LEU 5 -6.764 2.126 5.550
39 HD13 LEU 5 HD23 LEU 5 -7.774 2.833 4.263
40 HD21 LEU 5 HD11 LEU 5 -10.572 2.214 5.699
41 HD22 LEU 5 HD12 LEU 5 -10.301 1.899 3.974
42 HD23 LEU 5 HD13 LEU 5 -10.830 0.584 5.048
43 H VAL 6 H VAL 6 -8.534 -1.906 1.671
44 HA VAL 6 HA VAL 6 -6.376 -3.820 2.195
45 HB VAL 6 HB VAL 6 -8.407 -4.097 -0.109
46 HG11 VAL 6 HG11 VAL 6 -6.776 -6.240 1.406
47 HG12 VAL 6 HG12 VAL 6 -6.483 -5.708 -0.267
48 HG13 VAL 6 HG13 VAL 6 -7.990 -6.543 0.136
49 HG21 VAL 6 HG21 VAL 6 -9.695 -3.769 1.941
50 HG22 VAL 6 HG22 VAL 6 -8.737 -5.010 2.793
51 HG23 VAL 6 HG23 VAL 6 -9.793 -5.455 1.413
52 H LYS 7 H LYS 7 -7.052 -1.866 -0.694
53 HA LYS 7 HA LYS 7 -4.513 -2.657 -2.023
54 HB2 LYS 7 HB2 LYS 7 -4.951 -1.110 -3.800
55 HB3 LYS 7 HB3 LYS 7 -6.351 -2.105 -3.476
56 HG2 LYS 7 HG3 LYS 7 -7.525 -0.217 -2.363
57 HG3 LYS 7 HG2 LYS 7 -6.093 0.811 -2.488
58 HD2 LYS 7 HD2 LYS 7 -6.193 0.636 -5.021
59 HD3 LYS 7 HD3 LYS 7 -7.663 -0.330 -4.879
60 HE2 LYS 7 HE2 LYS 7 -8.786 1.639 -3.666
61 HE3 LYS 7 HE3 LYS 7 -7.314 2.590 -3.893
62 HZ2 LYS 7 HZ2 LYS 7 -7.580 2.361 -6.277
63 HZ3 LYS 7 HZ3 LYS 7 -8.903 3.050 -5.607
64 H MET 8 H MET 8 -5.387 0.244 -0.117
65 HA MET 8 HA MET 8 -2.826 1.578 -0.550
66 HB2 MET 8 HB3 MET 8 -4.867 2.195 1.547
67 HB3 MET 8 HB2 MET 8 -3.446 3.151 1.212
68 HG2 MET 8 HG2 MET 8 -5.986 2.937 -0.455
69 HG3 MET 8 HG3 MET 8 -5.049 4.336 0.049
70 HE1 MET 8 HE1 MET 8 -3.151 5.487 -1.311
71 HE2 MET 8 HE2 MET 8 -2.088 4.126 -0.832
72 HE3 MET 8 HE3 MET 8 -2.164 4.643 -2.542
73 H PHE 9 H PHE 9 -3.562 -1.019 1.644
74 HA PHE 9 HA PHE 9 -1.516 -0.343 3.683
75 HB2 PHE 9 HB3 PHE 9 -3.456 -1.796 4.232
76 HB3 PHE 9 HB2 PHE 9 -2.926 -3.012 3.098
77 HD1 PHE 9 HD1 PHE 9 -2.033 -1.280 6.323
78 HD2 PHE 9 HD2 PHE 9 -1.159 -4.613 3.743
79 HE1 PHE 9 HE1 PHE 9 -0.645 -2.294 8.084
80 HE2 PHE 9 HE2 PHE 9 0.226 -5.609 5.516
81 HZ PHE 9 HZ PHE 9 0.486 -4.456 7.685
82 H LYS 10 H LYS 10 -1.560 -2.865 1.174
83 HA LYS 10 HA LYS 10 1.348 -3.267 1.281
84 HB2 LYS 10 HB3 LYS 10 -0.566 -4.051 -1.070
85 HB3 LYS 10 HB2 LYS 10 1.072 -4.608 -1.002
86 HG2 LYS 10 HG3 LYS 10 0.631 -5.915 1.096
87 HG3 LYS 10 HG2 LYS 10 -1.017 -5.284 1.172
88 HD2 LYS 10 HD2 LYS 10 -1.538 -6.356 -1.051
89 HD3 LYS 10 HD3 LYS 10 0.115 -6.977 -1.144
90 HE2 LYS 10 HE3 LYS 10 -0.270 -8.322 0.983
91 HE3 LYS 10 HE2 LYS 10 -1.924 -7.699 1.076
92 HZ2 LYS 10 HZ2 LYS 10 -1.879 -9.840 0.039
93 HZ3 LYS 10 HZ3 LYS 10 -2.398 -8.732 -1.046
94 H THR 11 H THR 11 -0.461 -1.045 -0.829
95 HA THR 11 HA THR 11 1.729 -0.449 -2.619
96 HB THR 11 HB THR 11 -0.686 1.294 -1.871
97 HG1 THR 11 HG1 THR 11 -0.176 -0.475 -4.026
98 HG21 THR 11 HG21 THR 11 -0.366 2.386 -4.098
99 HG22 THR 11 HG22 THR 11 1.025 2.708 -3.039
100 HG23 THR 11 HG23 THR 11 1.160 1.494 -4.340
101 H ASN 12 H ASN 12 0.578 1.424 0.186
102 HA ASN 12 HA ASN 12 2.862 3.177 0.335
103 HB2 ASN 12 HB3 ASN 12 0.487 3.563 1.305
104 HB3 ASN 12 HB2 ASN 12 0.853 2.461 2.600
105 HD21 ASN 12 HD22 ASN 12 1.924 3.340 4.378
106 HD22 ASN 12 HD21 ASN 12 2.534 5.069 4.447
107 H GLU 13 H GLU 13 2.338 0.051 2.077
108 HA GLU 13 HA GLU 13 4.611 0.363 3.845
109 HB2 GLU 13 HB3 GLU 13 2.612 -1.050 4.312
110 HB3 GLU 13 HB2 GLU 13 3.099 -2.188 3.059
111 HG2 GLU 13 HG3 GLU 13 5.180 -2.744 4.376
112 HG3 GLU 13 HG2 GLU 13 4.772 -1.521 5.577
113 HE2 GLU 13 HE2 GLU 13 2.450 -3.428 7.249
114 H ASN 14 H ASN 14 4.268 -1.619 0.905
115 HA ASN 14 HA ASN 14 7.032 -2.512 0.882
116 HB2 ASN 14 HB2 ASN 14 4.962 -2.640 -1.377
117 HB3 ASN 14 HB3 ASN 14 6.581 -3.273 -1.533
118 HD21 ASN 14 HD21 ASN 14 3.462 -3.995 -0.280
119 HD22 ASN 14 HD22 ASN 14 3.930 -5.613 0.445
120 H ASN 15 H ASN 15 5.495 0.028 -1.097
121 HA ASN 15 HA ASN 15 8.010 0.797 -2.413
122 HB2 ASN 15 HB2 ASN 15 5.307 2.295 -2.340
123 HB3 ASN 15 HB3 ASN 15 6.695 2.884 -3.197
124 HD21 ASN 15 HD22 ASN 15 4.025 0.800 -3.455
125 HD22 ASN 15 HD21 ASN 15 4.478 0.084 -5.083
126 H ASP 16 H ASP 16 6.071 2.590 -0.022
127 HA ASP 16 HA ASP 16 6.706 4.208 1.559
128 HB2 ASP 16 HB2 ASP 16 7.859 2.177 2.509
129 HB3 ASP 16 HB3 ASP 16 9.350 2.702 1.757
130 HD2 ASP 16 HD2 ASP 16 10.400 4.298 2.602
131 H LYS 17 H LYS 17 6.577 5.331 -0.591
132 HA LYS 17 HA LYS 17 6.934 7.311 -1.628
133 HB2 LYS 17 HB3 LYS 17 7.981 8.219 0.408
134 HB3 LYS 17 HB2 LYS 17 9.517 7.575 -0.107
135 HG2 LYS 17 HG3 LYS 17 9.414 10.002 -0.525
136 HG3 LYS 17 HG2 LYS 17 9.540 9.172 -2.072
137 HD2 LYS 17 HD2 LYS 17 7.044 9.420 -2.429
138 HD3 LYS 17 HD3 LYS 17 6.877 10.124 -0.833
139 HE2 LYS 17 HE2 LYS 17 6.804 11.961 -2.393
140 HE3 LYS 17 HE3 LYS 17 8.351 12.097 -1.559
141 HZ2 LYS 17 HZ2 LYS 17 9.388 11.010 -3.492
142 HZ3 LYS 17 HZ3 LYS 17 7.944 10.894 -4.250
143 H SER 18 H SER 18 9.904 5.370 -1.629
144 HA SER 18 HA SER 18 9.815 5.326 -4.694
145 HB2 SER 18 HB2 SER 18 11.727 6.970 -3.829
146 HB3 SER 18 HB3 SER 18 12.456 5.569 -3.070
147 HG SER 18 HG SER 18 11.805 5.817 -5.821
148 H GLU 19 H GLU 19 12.180 3.625 -2.674
149 HA GLU 19 HA GLU 19 10.514 1.142 -2.489
150 HB2 GLU 19 HB3 GLU 19 11.426 1.056 -4.813
151 HB3 GLU 19 HB2 GLU 19 13.071 1.297 -4.230
152 HG2 GLU 19 HG3 GLU 19 12.988 -0.871 -2.999
153 HG3 GLU 19 HG2 GLU 19 11.294 -1.089 -3.448
154 HE2 GLU 19 HE2 GLU 19 14.312 -1.805 -6.059
155 H LEU 20 H LEU 20 10.770 1.582 -0.203
156 HA LEU 20 HA LEU 20 13.626 1.451 0.882
157 HB2 LEU 20 HB3 LEU 20 11.762 3.198 1.770
158 HB3 LEU 20 HB2 LEU 20 11.189 1.830 2.682
159 HG LEU 20 HG LEU 20 12.573 3.299 3.993
160 HD11 LEU 20 HD11 LEU 20 14.158 1.766 5.070
161 HD12 LEU 20 HD12 LEU 20 14.171 0.691 3.654
162 HD13 LEU 20 HD13 LEU 20 12.687 0.882 4.622
163 HD21 LEU 20 HD21 LEU 20 14.030 4.268 2.202
164 HD22 LEU 20 HD22 LEU 20 14.992 2.770 2.161
165 HD23 LEU 20 HD23 LEU 20 14.959 3.771 3.630
166 H ILE 21 H ILE 21 10.647 -0.148 2.019
167 HA ILE 21 HA ILE 21 11.972 -2.829 1.707
168 HB ILE 21 HB ILE 21 12.837 -2.072 3.896
169 HG12 ILE 21 HG12 ILE 21 12.229 -4.082 5.294
170 HG13 ILE 21 HG11 ILE 21 10.960 -4.496 4.154
171 HG21 ILE 21 HG21 ILE 21 9.986 -2.179 5.062
172 HG22 ILE 21 HG22 ILE 21 10.889 -0.684 4.726
173 HG23 ILE 21 HG23 ILE 21 11.499 -1.833 5.929
174 HD11 ILE 21 HD11 ILE 21 13.065 -5.832 3.811
175 HD12 ILE 21 HD12 ILE 21 13.983 -4.345 3.477
176 HD13 ILE 21 HD13 ILE 21 12.702 -4.882 2.356
Start of MODEL 9
1 H1 TYR 1 H TYR 1 -15.045 0.943 2.706
2 HA TYR 1 HA TYR 1 -16.484 -0.748 0.605
3 HB2 TYR 1 HB3 TYR 1 -14.708 1.680 -0.097
4 HB3 TYR 1 HB2 TYR 1 -15.164 0.423 -1.239
5 HD1 TYR 1 HD2 TYR 1 -17.627 0.072 -1.857
6 HD2 TYR 1 HD3 TYR 1 -16.321 3.473 0.434
7 HE1 TYR 1 HE2 TYR 1 -19.719 1.246 -2.391
8 HE2 TYR 1 HE3 TYR 1 -18.416 4.634 -0.107
9 HH TYR 1 HH TYR 1 -20.364 4.533 -1.169
10 H ASP 2 H ASP 2 -15.464 -2.573 0.611
11 HA ASP 2 HA ASP 2 -12.407 -2.717 0.966
12 HB2 ASP 2 HB2 ASP 2 -13.707 -3.646 2.926
13 HB3 ASP 2 HB3 ASP 2 -14.456 -4.837 1.877
14 HD2 ASP 2 HD2 ASP 2 -13.231 -6.354 0.994
15 H ASN 3 H ASN 3 -12.005 -2.531 -1.217
16 HA ASN 3 HA ASN 3 -12.232 -4.942 -2.811
17 HB2 ASN 3 HB2 ASN 3 -13.464 -4.117 -4.780
18 HB3 ASN 3 HB3 ASN 3 -14.459 -4.317 -3.367
19 HD21 ASN 3 HD22 ASN 3 -13.678 -2.165 -5.849
20 HD22 ASN 3 HD21 ASN 3 -14.582 -0.715 -5.179
21 H ILE 4 H ILE 4 -10.132 -4.885 -2.967
22 HA ILE 4 HA ILE 4 -8.023 -4.484 -3.495
23 HB ILE 4 HB ILE 4 -9.113 -4.893 -5.651
24 HG12 ILE 4 HG12 ILE 4 -6.403 -3.457 -5.915
25 HG13 ILE 4 HG11 ILE 4 -6.593 -5.013 -5.132
26 HG21 ILE 4 HG21 ILE 4 -8.546 -1.917 -6.263
27 HG22 ILE 4 HG22 ILE 4 -8.963 -3.150 -7.479
28 HG23 ILE 4 HG23 ILE 4 -10.139 -2.719 -6.245
29 HD11 ILE 4 HD11 ILE 4 -7.501 -6.028 -7.263
30 HD12 ILE 4 HD12 ILE 4 -7.210 -4.479 -8.101
31 HD13 ILE 4 HD13 ILE 4 -5.847 -5.392 -7.422
32 H LEU 5 H LEU 5 -9.548 -1.362 -3.509
33 HA LEU 5 HA LEU 5 -6.979 0.080 -3.365
34 HB2 LEU 5 HB2 LEU 5 -9.862 1.153 -3.048
35 HB3 LEU 5 HB3 LEU 5 -8.468 2.197 -3.065
36 HG LEU 5 HG LEU 5 -9.314 0.417 -5.430
37 HD11 LEU 5 HD21 LEU 5 -9.675 3.456 -5.028
38 HD12 LEU 5 HD22 LEU 5 -10.968 2.233 -4.978
39 HD13 LEU 5 HD23 LEU 5 -10.094 2.533 -6.492
40 HD21 LEU 5 HD11 LEU 5 -7.689 1.781 -6.786
41 HD22 LEU 5 HD12 LEU 5 -6.853 0.862 -5.525
42 HD23 LEU 5 HD13 LEU 5 -7.131 2.608 -5.310
43 H VAL 6 H VAL 6 -9.356 -0.747 -0.874
44 HA VAL 6 HA VAL 6 -8.229 0.996 1.194
45 HB VAL 6 HB VAL 6 -10.553 -0.298 1.142
46 HG11 VAL 6 HG21 VAL 6 -9.787 -2.626 1.124
47 HG12 VAL 6 HG22 VAL 6 -9.070 -2.413 2.751
48 HG13 VAL 6 HG23 VAL 6 -10.824 -2.238 2.519
49 HG21 VAL 6 HG11 VAL 6 -9.818 1.330 2.927
50 HG22 VAL 6 HG12 VAL 6 -8.991 0.009 3.792
51 HG23 VAL 6 HG13 VAL 6 -10.766 -0.009 3.610
52 H LYS 7 H LYS 7 -7.600 -2.359 0.636
53 HA LYS 7 HA LYS 7 -5.340 -2.546 2.527
54 HB2 LYS 7 HB3 LYS 7 -4.811 -4.782 1.560
55 HB3 LYS 7 HB2 LYS 7 -6.440 -4.586 2.163
56 HG2 LYS 7 HG LYS 7 -7.359 -4.379 -0.113
57 HG3 LYS 7 HG3 LYS 7 -5.746 -4.429 -0.838
58 HD2 LYS 7 HD2 LYS 7 -5.425 -6.785 0.055
59 HD3 LYS 7 HD3 LYS 7 -7.001 -6.701 0.827
60 HE2 LYS 7 HE3 LYS 7 -7.314 -7.973 -1.186
61 HE3 LYS 7 HE2 LYS 7 -8.116 -6.428 -1.452
62 HZ2 LYS 7 HZ2 LYS 7 -6.192 -5.708 -2.732
63 HZ3 LYS 7 HZ3 LYS 7 -6.837 -7.075 -3.356
64 H MET 8 H MET 8 -5.304 -1.999 -1.009
65 HA MET 8 HA MET 8 -2.375 -2.015 -1.179
66 HB2 MET 8 HB2 MET 8 -4.295 -1.002 -3.235
67 HB3 MET 8 HB3 MET 8 -2.573 -1.169 -3.455
68 HG2 MET 8 HG3 MET 8 -4.648 -3.412 -3.327
69 HG3 MET 8 HG2 MET 8 -3.362 -3.064 -4.486
70 HE1 MET 8 HE1 MET 8 -2.048 -6.491 -3.169
71 HE2 MET 8 HE2 MET 8 -2.307 -5.473 -4.617
72 HE3 MET 8 HE3 MET 8 -3.704 -5.993 -3.625
73 H PHE 9 H PHE 9 -4.495 0.526 -0.122
74 HA PHE 9 HA PHE 9 -2.782 2.799 -0.936
75 HB2 PHE 9 HB2 PHE 9 -5.204 3.103 -0.498
76 HB3 PHE 9 HB3 PHE 9 -5.014 2.637 1.172
77 HD1 PHE 9 HD2 PHE 9 -4.131 5.290 -1.351
78 HD2 PHE 9 HD1 PHE 9 -4.209 4.280 2.833
79 HE1 PHE 9 HE2 PHE 9 -3.633 7.628 -0.764
80 HE2 PHE 9 HE1 PHE 9 -3.704 6.620 3.397
81 HZ PHE 9 HZ PHE 9 -3.417 8.297 1.606
82 H LYS 10 H LYS 10 -3.340 1.339 2.256
83 HA LYS 10 HA LYS 10 -0.926 2.580 3.407
84 HB2 LYS 10 HB3 LYS 10 -2.610 0.336 4.673
85 HB3 LYS 10 HB2 LYS 10 -1.264 1.032 5.501
86 HG2 LYS 10 HG3 LYS 10 -3.809 2.522 4.599
87 HG3 LYS 10 HG2 LYS 10 -3.284 2.069 6.211
88 HD2 LYS 10 HD2 LYS 10 -1.335 3.671 6.067
89 HD3 LYS 10 HD3 LYS 10 -1.920 4.202 4.484
90 HE2 LYS 10 HE2 LYS 10 -4.113 4.938 5.523
91 HE3 LYS 10 HE3 LYS 10 -3.523 4.438 7.116
92 HZ2 LYS 10 HZ2 LYS 10 -1.693 6.020 6.857
93 HZ3 LYS 10 HZ3 LYS 10 -2.237 6.480 5.386
94 H THR 11 H THR 11 -1.271 -0.616 1.891
95 HA THR 11 HA THR 11 1.230 -1.707 2.864
96 HB THR 11 HB THR 11 -0.364 -2.443 0.346
97 HG1 THR 11 HG1 THR 11 -1.091 -4.087 1.707
98 HG21 THR 11 HG21 THR 11 0.746 -4.679 0.509
99 HG22 THR 11 HG22 THR 11 1.945 -3.410 0.172
100 HG23 THR 11 HG23 THR 11 1.802 -4.084 1.819
101 H ASN 12 H ASN 12 0.472 -0.213 -0.282
102 HA ASN 12 HA ASN 12 3.206 0.012 -1.182
103 HB2 ASN 12 HB3 ASN 12 1.021 0.044 -2.616
104 HB3 ASN 12 HB2 ASN 12 0.793 1.702 -2.149
105 HD21 ASN 12 HD21 ASN 12 2.642 -0.484 -4.134
106 HD22 ASN 12 HD22 ASN 12 3.521 0.815 -5.087
107 H GLU 13 H GLU 13 1.178 2.441 0.574
108 HA GLU 13 HA GLU 13 3.031 4.641 0.350
109 HB2 GLU 13 HB3 GLU 13 0.591 4.825 0.845
110 HB3 GLU 13 HB2 GLU 13 0.841 4.125 2.444
111 HG2 GLU 13 HG3 GLU 13 2.240 6.151 3.080
112 HG3 GLU 13 HG2 GLU 13 2.042 6.798 1.453
113 HE2 GLU 13 HE2 GLU 13 0.429 5.801 4.277
114 H ASN 14 H ASN 14 2.748 2.180 2.895
115 HA ASN 14 HA ASN 14 4.944 3.341 4.480
116 HB2 ASN 14 HB2 ASN 14 2.898 2.386 5.536
117 HB3 ASN 14 HB3 ASN 14 3.322 0.787 4.969
118 HD21 ASN 14 HD22 ASN 14 4.740 -0.400 6.258
119 HD22 ASN 14 HD21 ASN 14 5.520 0.263 7.781
120 H ASN 15 H ASN 15 4.550 0.060 3.142
121 HA ASN 15 HA ASN 15 7.382 -0.581 3.406
122 HB2 ASN 15 HB2 ASN 15 5.130 -2.154 1.977
123 HB3 ASN 15 HB3 ASN 15 6.739 -2.777 2.157
124 HD21 ASN 15 HD21 ASN 15 7.524 -3.278 4.320
125 HD22 ASN 15 HD22 ASN 15 6.308 -3.632 5.647
126 H ASP 16 H ASP 16 5.760 0.866 0.695
127 HA ASP 16 HA ASP 16 8.063 0.233 -1.098
128 HB2 ASP 16 HB3 ASP 16 6.003 -1.010 -1.912
129 HB3 ASP 16 HB2 ASP 16 5.193 0.526 -2.146
130 HD2 ASP 16 HD2 ASP 16 5.608 1.621 -3.819
131 H LYS 17 H LYS 17 8.364 2.106 0.551
132 HA LYS 17 HA LYS 17 8.313 4.588 -1.105
133 HB2 LYS 17 HB2 LYS 17 6.793 4.295 1.252
134 HB3 LYS 17 HB3 LYS 17 8.222 5.060 1.876
135 HG2 LYS 17 HG2 LYS 17 6.703 6.809 1.382
136 HG3 LYS 17 HG3 LYS 17 7.923 6.922 0.117
137 HD2 LYS 17 HD2 LYS 17 6.363 5.704 -1.487
138 HD3 LYS 17 HD3 LYS 17 5.211 5.468 -0.191
139 HE2 LYS 17 HE2 LYS 17 4.369 7.290 -1.514
140 HE3 LYS 17 HE3 LYS 17 4.904 7.998 0.008
141 HZ2 LYS 17 HZ2 LYS 17 6.938 8.708 -1.099
142 HZ3 LYS 17 HZ3 LYS 17 5.617 9.309 -1.852
143 H SER 18 H SER 18 9.856 3.500 1.881
144 HA SER 18 HA SER 18 12.456 4.794 1.122
145 HB2 SER 18 HB2 SER 18 11.672 4.544 3.656
146 HB3 SER 18 HB3 SER 18 12.037 2.832 3.489
147 HG SER 18 HG SER 18 13.828 4.981 3.018
148 H GLU 19 H GLU 19 11.468 1.362 1.284
149 HA GLU 19 HA GLU 19 13.924 0.621 -0.344
150 HB2 GLU 19 HB3 GLU 19 14.226 -0.223 1.975
151 HB3 GLU 19 HB2 GLU 19 12.669 -1.049 1.940
152 HG2 GLU 19 HG2 GLU 19 13.451 -2.528 0.084
153 HG3 GLU 19 HG3 GLU 19 14.993 -1.673 0.012
154 HE2 GLU 19 HE2 GLU 19 16.363 -3.198 2.805
155 H LEU 20 H LEU 20 12.600 1.062 -2.095
156 HA LEU 20 HA LEU 20 10.077 0.039 -2.744
157 HB2 LEU 20 HB2 LEU 20 12.336 0.548 -4.784
158 HB3 LEU 20 HB3 LEU 20 10.641 0.411 -5.104
159 HG LEU 20 HG LEU 20 11.199 2.665 -5.302
160 HD11 LEU 20 HD21 LEU 20 9.631 2.434 -2.672
161 HD12 LEU 20 HD22 LEU 20 9.607 3.813 -3.795
162 HD13 LEU 20 HD23 LEU 20 8.948 2.245 -4.306
163 HD21 LEU 20 HD11 LEU 20 12.248 2.884 -2.419
164 HD22 LEU 20 HD12 LEU 20 13.271 2.765 -3.874
165 HD23 LEU 20 HD13 LEU 20 12.186 4.152 -3.657
166 H ILE 21 H ILE 21 13.118 -1.543 -3.696
167 HA ILE 21 HA ILE 21 11.737 -4.222 -3.635
168 HB ILE 21 HB ILE 21 11.403 -3.523 -5.959
169 HG12 ILE 21 HG11 ILE 21 13.353 -5.897 -5.819
170 HG13 ILE 21 HG12 ILE 21 11.703 -5.951 -5.226
171 HG21 ILE 21 HG21 ILE 21 13.474 -2.114 -6.362
172 HG22 ILE 21 HG22 ILE 21 14.455 -3.598 -6.438
173 HG23 ILE 21 HG23 ILE 21 13.186 -3.297 -7.645
174 HD11 ILE 21 HD11 ILE 21 12.483 -5.480 -8.171
175 HD12 ILE 21 HD12 ILE 21 11.767 -6.944 -7.463
176 HD13 ILE 21 HD13 ILE 21 10.812 -5.445 -7.542
Start of MODEL 10
1 H1 TYR 1 H TYR 1 -17.314 -5.081 3.326
2 HA TYR 1 HA TYR 1 -18.878 -3.639 1.100
3 HB2 TYR 1 HB2 TYR 1 -17.499 -2.301 3.514
4 HB3 TYR 1 HB3 TYR 1 -18.031 -1.452 2.070
5 HD1 TYR 1 HD3 TYR 1 -20.506 -1.295 1.494
6 HD2 TYR 1 HD2 TYR 1 -19.166 -2.954 5.232
7 HE1 TYR 1 HE3 TYR 1 -22.758 -1.017 2.434
8 HE2 TYR 1 HE2 TYR 1 -21.422 -2.671 6.159
9 HH TYR 1 HH TYR 1 -24.067 -1.287 4.208
10 H ASP 2 H ASP 2 -17.658 -3.917 -0.650
11 HA ASP 2 HA ASP 2 -14.698 -4.228 -0.508
12 HB2 ASP 2 HB3 ASP 2 -14.892 -4.792 -2.870
13 HB3 ASP 2 HB2 ASP 2 -16.153 -5.705 -2.097
14 HD2 ASP 2 HD2 ASP 2 -15.353 -3.339 -4.265
15 H ASN 3 H ASN 3 -13.153 -2.823 -1.171
16 HA ASN 3 HA ASN 3 -13.632 -0.399 -2.622
17 HB2 ASN 3 HB2 ASN 3 -14.544 0.409 -0.376
18 HB3 ASN 3 HB3 ASN 3 -13.011 0.049 0.379
19 HD21 ASN 3 HD22 ASN 3 -14.600 2.121 -2.028
20 HD22 ASN 3 HD21 ASN 3 -13.349 3.460 -1.939
21 H ILE 4 H ILE 4 -11.953 -0.874 -3.842
22 HA ILE 4 HA ILE 4 -9.569 -2.240 -3.151
23 HB ILE 4 HB ILE 4 -10.501 -2.010 -5.414
24 HG12 ILE 4 HG11 ILE 4 -7.505 -1.336 -5.393
25 HG13 ILE 4 HG12 ILE 4 -8.151 -2.888 -4.890
26 HG21 ILE 4 HG21 ILE 4 -10.855 0.487 -5.488
27 HG22 ILE 4 HG22 ILE 4 -9.960 -0.110 -6.898
28 HG23 ILE 4 HG23 ILE 4 -9.093 0.731 -5.584
29 HD11 ILE 4 HD11 ILE 4 -9.169 -3.250 -7.179
30 HD12 ILE 4 HD12 ILE 4 -7.401 -3.051 -7.220
31 HD13 ILE 4 HD13 ILE 4 -8.452 -1.709 -7.724
32 H LEU 5 H LEU 5 -10.126 1.068 -2.457
33 HA LEU 5 HA LEU 5 -7.305 1.909 -2.429
34 HB2 LEU 5 HB2 LEU 5 -9.270 3.443 -3.047
35 HB3 LEU 5 HB3 LEU 5 -9.805 3.433 -1.401
36 HG LEU 5 HG LEU 5 -8.618 5.469 -2.276
37 HD11 LEU 5 HD11 LEU 5 -8.938 5.150 0.171
38 HD12 LEU 5 HD12 LEU 5 -7.493 6.104 -0.215
39 HD13 LEU 5 HD13 LEU 5 -7.323 4.417 0.303
40 HD21 LEU 5 HD21 LEU 5 -5.981 3.904 -2.023
41 HD22 LEU 5 HD22 LEU 5 -6.745 4.424 -3.545
42 HD23 LEU 5 HD23 LEU 5 -6.161 5.636 -2.386
43 H VAL 6 H VAL 6 -9.479 0.704 0.098
44 HA VAL 6 HA VAL 6 -7.933 1.666 2.382
45 HB VAL 6 HB VAL 6 -9.668 -0.886 2.432
46 HG11 VAL 6 HG21 VAL 6 -8.195 -0.651 4.458
47 HG12 VAL 6 HG22 VAL 6 -9.898 -0.401 4.868
48 HG13 VAL 6 HG23 VAL 6 -8.805 0.999 4.724
49 HG21 VAL 6 HG11 VAL 6 -11.069 0.911 1.600
50 HG22 VAL 6 HG12 VAL 6 -10.553 1.999 2.915
51 HG23 VAL 6 HG13 VAL 6 -11.511 0.523 3.266
52 H LYS 7 H LYS 7 -7.708 -1.461 0.722
53 HA LYS 7 HA LYS 7 -5.241 -2.205 2.235
54 HB2 LYS 7 HB3 LYS 7 -5.073 -4.245 0.986
55 HB3 LYS 7 HB2 LYS 7 -6.672 -4.033 1.658
56 HG2 LYS 7 HG2 LYS 7 -7.551 -3.346 -0.580
57 HG3 LYS 7 HG3 LYS 7 -5.971 -3.557 -1.319
58 HD2 LYS 7 HD2 LYS 7 -7.590 -5.827 0.037
59 HD3 LYS 7 HD3 LYS 7 -7.659 -5.419 -1.660
60 HE2 LYS 7 HE3 LYS 7 -6.206 -7.252 -1.651
61 HE3 LYS 7 HE2 LYS 7 -5.118 -5.884 -1.851
62 HZ2 LYS 7 HZ2 LYS 7 -4.606 -6.025 0.514
63 HZ3 LYS 7 HZ3 LYS 7 -4.279 -7.433 -0.249
64 H MET 8 H MET 8 -5.722 -0.941 -1.085
65 HA MET 8 HA MET 8 -2.893 -1.200 -1.792
66 HB2 MET 8 HB3 MET 8 -4.959 0.375 -3.268
67 HB3 MET 8 HB2 MET 8 -3.337 0.039 -3.818
68 HG2 MET 8 HG2 MET 8 -5.700 -1.886 -3.690
69 HG3 MET 8 HG3 MET 8 -4.543 -1.538 -4.975
70 HE1 MET 8 HE1 MET 8 -5.473 -4.509 -4.096
71 HE2 MET 8 HE2 MET 8 -3.907 -5.365 -4.210
72 HE3 MET 8 HE3 MET 8 -4.363 -4.171 -5.461
73 H PHE 9 H PHE 9 -4.476 1.306 0.032
74 HA PHE 9 HA PHE 9 -2.640 3.510 -0.717
75 HB2 PHE 9 HB3 PHE 9 -4.928 3.940 0.162
76 HB3 PHE 9 HB2 PHE 9 -4.523 3.223 1.700
77 HD1 PHE 9 HD2 PHE 9 -3.949 6.159 -0.546
78 HD2 PHE 9 HD1 PHE 9 -3.166 4.514 3.354
79 HE1 PHE 9 HE2 PHE 9 -3.172 8.359 0.239
80 HE2 PHE 9 HE1 PHE 9 -2.387 6.718 4.118
81 HZ PHE 9 HZ PHE 9 -2.388 8.643 2.566
82 H LYS 10 H LYS 10 -2.903 1.603 2.272
83 HA LYS 10 HA LYS 10 -0.184 2.375 3.144
84 HB2 LYS 10 HB2 LYS 10 -1.966 0.209 4.403
85 HB3 LYS 10 HB3 LYS 10 -0.401 0.561 5.039
86 HG2 LYS 10 HG2 LYS 10 -2.732 2.567 4.826
87 HG3 LYS 10 HG3 LYS 10 -2.089 1.759 6.240
88 HD2 LYS 10 HD3 LYS 10 0.101 3.001 6.005
89 HD3 LYS 10 HD2 LYS 10 -0.571 3.886 4.630
90 HE2 LYS 10 HE3 LYS 10 -2.416 4.811 6.103
91 HE3 LYS 10 HE2 LYS 10 -1.721 3.964 7.495
92 HZ2 LYS 10 HZ2 LYS 10 0.310 5.228 7.201
93 HZ3 LYS 10 HZ3 LYS 10 -0.971 6.223 7.410
94 H THR 11 H THR 11 -1.187 -0.450 1.240
95 HA THR 11 HA THR 11 1.247 -1.974 1.645
96 HB THR 11 HB THR 11 -0.790 -2.099 -0.643
97 HG1 THR 11 HG1 THR 11 -1.516 -2.567 1.463
98 HG21 THR 11 HG21 THR 11 0.038 -4.424 -1.042
99 HG22 THR 11 HG22 THR 11 1.312 -3.237 -1.396
100 HG23 THR 11 HG23 THR 11 1.366 -4.174 0.123
101 H ASN 12 H ASN 12 0.277 0.078 -1.108
102 HA ASN 12 HA ASN 12 2.882 0.148 -2.351
103 HB2 ASN 12 HB3 ASN 12 0.579 0.631 -3.453
104 HB3 ASN 12 HB2 ASN 12 0.576 2.203 -2.709
105 HD21 ASN 12 HD22 ASN 12 1.799 3.825 -3.744
106 HD22 ASN 12 HD21 ASN 12 2.753 3.531 -5.283
107 H GLU 13 H GLU 13 1.475 2.435 0.054
108 HA GLU 13 HA GLU 13 3.490 4.495 -0.183
109 HB2 GLU 13 HB2 GLU 13 1.274 4.901 0.738
110 HB3 GLU 13 HB3 GLU 13 1.538 3.815 2.090
111 HG2 GLU 13 HG2 GLU 13 3.224 6.369 1.652
112 HG3 GLU 13 HG3 GLU 13 1.663 6.401 2.450
113 HE2 GLU 13 HE2 GLU 13 1.368 4.945 4.160
114 H ASN 14 H ASN 14 3.150 1.980 2.302
115 HA ASN 14 HA ASN 14 5.699 2.494 3.572
116 HB2 ASN 14 HB3 ASN 14 3.939 -0.008 3.789
117 HB3 ASN 14 HB2 ASN 14 5.373 0.240 4.753
118 HD21 ASN 14 HD21 ASN 14 5.398 2.009 6.308
119 HD22 ASN 14 HD22 ASN 14 3.807 2.647 6.961
120 H ASN 15 H ASN 15 4.894 -0.056 1.224
121 HA ASN 15 HA ASN 15 7.528 -1.255 1.178
122 HB2 ASN 15 HB2 ASN 15 5.304 -2.334 0.362
123 HB3 ASN 15 HB3 ASN 15 5.405 -1.361 -1.078
124 HD21 ASN 15 HD21 ASN 15 6.918 -4.009 0.706
125 HD22 ASN 15 HD22 ASN 15 7.814 -4.692 -0.742
126 H ASP 16 H ASP 16 6.320 1.519 -0.630
127 HA ASP 16 HA ASP 16 8.804 1.606 -2.314
128 HB2 ASP 16 HB3 ASP 16 6.149 3.025 -2.928
129 HB3 ASP 16 HB2 ASP 16 7.623 3.207 -3.842
130 HD2 ASP 16 HD2 ASP 16 5.249 0.035 -4.418
131 H LYS 17 H LYS 17 8.874 2.298 0.413
132 HA LYS 17 HA LYS 17 10.036 5.010 0.184
133 HB2 LYS 17 HB2 LYS 17 7.704 5.350 0.906
134 HB3 LYS 17 HB3 LYS 17 7.860 4.193 2.212
135 HG2 LYS 17 HG2 LYS 17 9.520 6.800 2.094
136 HG3 LYS 17 HG3 LYS 17 7.878 6.736 2.723
137 HD2 LYS 17 HD3 LYS 17 8.618 4.892 4.354
138 HD3 LYS 17 HD2 LYS 17 10.278 5.179 3.842
139 HE2 LYS 17 HE2 LYS 17 10.122 7.603 4.582
140 HE3 LYS 17 HE3 LYS 17 8.452 7.334 5.108
141 HZ2 LYS 17 HZ2 LYS 17 9.965 7.140 6.937
142 HZ3 LYS 17 HZ3 LYS 17 9.245 5.695 6.680
143 H SER 18 H SER 18 9.486 2.372 2.498
144 HA SER 18 HA SER 18 12.182 2.819 3.764
145 HB2 SER 18 HB3 SER 18 10.050 2.085 5.181
146 HB3 SER 18 HB2 SER 18 10.234 0.507 4.431
147 HG SER 18 HG SER 18 12.368 0.451 5.248
148 H GLU 19 H GLU 19 10.818 -0.031 2.054
149 HA GLU 19 HA GLU 19 13.649 -0.789 1.237
150 HB2 GLU 19 HB3 GLU 19 13.009 -2.122 3.247
151 HB3 GLU 19 HB2 GLU 19 11.541 -2.696 2.459
152 HG2 GLU 19 HG2 GLU 19 12.885 -3.880 0.730
153 HG3 GLU 19 HG3 GLU 19 14.383 -3.224 1.396
154 HE2 GLU 19 HE2 GLU 19 14.569 -5.428 4.062
155 H LEU 20 H LEU 20 13.132 0.204 -0.641
156 HA LEU 20 HA LEU 20 10.974 -0.969 -2.469
157 HB2 LEU 20 HB3 LEU 20 11.412 1.663 -2.208
158 HB3 LEU 20 HB2 LEU 20 12.820 1.399 -3.196
159 HG LEU 20 HG LEU 20 9.930 0.689 -4.016
160 HD11 LEU 20 HD11 LEU 20 11.587 3.182 -4.790
161 HD12 LEU 20 HD12 LEU 20 10.226 3.162 -3.646
162 HD13 LEU 20 HD13 LEU 20 9.942 2.791 -5.354
163 HD21 LEU 20 HD21 LEU 20 11.497 -0.616 -5.432
164 HD22 LEU 20 HD22 LEU 20 10.779 0.678 -6.394
165 HD23 LEU 20 HD23 LEU 20 12.449 0.846 -5.798
166 H ILE 21 H ILE 21 14.363 -0.071 -3.131
167 HA ILE 21 HA ILE 21 14.930 -2.895 -4.022
168 HB ILE 21 HB ILE 21 14.029 -1.814 -6.065
169 HG12 ILE 21 HG12 ILE 21 15.881 -2.416 -7.673
170 HG13 ILE 21 HG11 ILE 21 16.995 -2.588 -6.328
171 HG21 ILE 21 HG21 ILE 21 15.203 -0.093 -7.360
172 HG22 ILE 21 HG22 ILE 21 14.840 0.561 -5.754
173 HG23 ILE 21 HG23 ILE 21 16.494 0.037 -6.144
174 HD11 ILE 21 HD11 ILE 21 15.621 -4.523 -5.440
175 HD12 ILE 21 HD12 ILE 21 14.422 -4.271 -6.738
176 HD13 ILE 21 HD13 ILE 21 16.078 -4.789 -7.135
Start of MODEL 11
1 H1 TYR 1 H TYR 1 -19.926 -0.017 -1.054
2 HA TYR 1 HA TYR 1 -19.041 -2.946 -1.077
3 HB2 TYR 1 HB3 TYR 1 -18.436 -0.975 -3.377
4 HB3 TYR 1 HB2 TYR 1 -17.604 -2.503 -3.124
5 HD1 TYR 1 HD3 TYR 1 -18.888 -4.716 -3.293
6 HD2 TYR 1 HD2 TYR 1 -20.652 -0.968 -4.463
7 HE1 TYR 1 HE3 TYR 1 -20.599 -5.916 -4.585
8 HE2 TYR 1 HE2 TYR 1 -22.357 -2.181 -5.750
9 HH TYR 1 HH TYR 1 -22.386 -5.744 -5.891
10 H ASP 2 H ASP 2 -17.702 -2.923 0.543
11 HA ASP 2 HA ASP 2 -15.915 -0.537 1.159
12 HB2 ASP 2 HB3 ASP 2 -17.289 -1.652 3.001
13 HB3 ASP 2 HB2 ASP 2 -16.257 -3.070 2.884
14 HD2 ASP 2 HD2 ASP 2 -16.455 0.222 3.589
15 H ASN 3 H ASN 3 -13.934 -0.501 0.242
16 HA ASN 3 HA ASN 3 -12.272 -2.958 -0.061
17 HB2 ASN 3 HB2 ASN 3 -12.847 -1.041 -2.390
18 HB3 ASN 3 HB3 ASN 3 -11.599 -2.264 -2.383
19 HD21 ASN 3 HD22 ASN 3 -14.800 -1.725 -3.232
20 HD22 ASN 3 HD21 ASN 3 -15.249 -3.478 -3.534
21 H ILE 4 H ILE 4 -10.831 -0.765 -1.518
22 HA ILE 4 HA ILE 4 -8.881 0.420 -1.255
23 HB ILE 4 HB ILE 4 -10.684 1.989 -0.646
24 HG12 ILE 4 HG12 ILE 4 -7.920 2.855 0.401
25 HG13 ILE 4 HG11 ILE 4 -8.256 2.576 -1.298
26 HG21 ILE 4 HG21 ILE 4 -11.216 1.431 1.702
27 HG22 ILE 4 HG22 ILE 4 -9.552 1.803 2.225
28 HG23 ILE 4 HG23 ILE 4 -10.638 3.091 1.643
29 HD11 ILE 4 HD11 ILE 4 -10.039 4.371 -1.285
30 HD12 ILE 4 HD12 ILE 4 -9.631 4.736 0.414
31 HD13 ILE 4 HD13 ILE 4 -8.419 4.971 -0.862
32 H LEU 5 H LEU 5 -9.437 -1.265 1.736
33 HA LEU 5 HA LEU 5 -6.766 -0.758 2.797
34 HB2 LEU 5 HB3 LEU 5 -8.801 -2.959 3.567
35 HB3 LEU 5 HB2 LEU 5 -7.326 -2.698 4.457
36 HG LEU 5 HG LEU 5 -9.545 -0.581 4.168
37 HD11 LEU 5 HD11 LEU 5 -10.145 -1.153 6.521
38 HD12 LEU 5 HD12 LEU 5 -10.330 -2.565 5.465
39 HD13 LEU 5 HD13 LEU 5 -8.921 -2.447 6.548
40 HD21 LEU 5 HD21 LEU 5 -7.050 -0.586 6.003
41 HD22 LEU 5 HD22 LEU 5 -7.337 0.509 4.628
42 HD23 LEU 5 HD23 LEU 5 -8.375 0.604 6.058
43 H VAL 6 H VAL 6 -8.015 -3.534 0.975
44 HA VAL 6 HA VAL 6 -5.594 -5.160 1.156
45 HB VAL 6 HB VAL 6 -7.586 -5.286 -1.197
46 HG11 VAL 6 HG21 VAL 6 -5.485 -6.600 -1.601
47 HG12 VAL 6 HG22 VAL 6 -5.697 -7.448 -0.050
48 HG13 VAL 6 HG23 VAL 6 -6.872 -7.674 -1.372
49 HG21 VAL 6 HG11 VAL 6 -8.789 -7.063 0.037
50 HG22 VAL 6 HG12 VAL 6 -8.907 -5.497 0.853
51 HG23 VAL 6 HG13 VAL 6 -7.796 -6.737 1.495
52 H LYS 7 H LYS 7 -6.565 -2.778 -1.269
53 HA LYS 7 HA LYS 7 -4.094 -2.979 -2.903
54 HB2 LYS 7 HB3 LYS 7 -6.048 -0.595 -2.816
55 HB3 LYS 7 HB2 LYS 7 -4.831 -0.885 -4.038
56 HG2 LYS 7 HG3 LYS 7 -7.423 -2.501 -3.611
57 HG3 LYS 7 HG2 LYS 7 -7.049 -1.370 -4.893
58 HD2 LYS 7 HD2 LYS 7 -5.198 -2.880 -5.735
59 HD3 LYS 7 HD3 LYS 7 -5.588 -4.051 -4.469
60 HE2 LYS 7 HE3 LYS 7 -7.935 -4.301 -5.411
61 HE3 LYS 7 HE2 LYS 7 -7.551 -3.130 -6.681
62 HZ2 LYS 7 HZ2 LYS 7 -5.778 -4.621 -7.426
63 HZ3 LYS 7 HZ3 LYS 7 -6.132 -5.703 -6.253
64 H MET 8 H MET 8 -5.013 -0.677 -0.311
65 HA MET 8 HA MET 8 -2.519 0.844 -0.512
66 HB2 MET 8 HB2 MET 8 -4.535 0.925 1.692
67 HB3 MET 8 HB3 MET 8 -3.159 1.988 1.553
68 HG2 MET 8 HG2 MET 8 -5.709 2.021 -0.115
69 HG3 MET 8 HG3 MET 8 -4.838 3.318 0.692
70 HE1 MET 8 HE1 MET 8 -1.864 3.428 -0.200
71 HE2 MET 8 HE2 MET 8 -1.969 4.316 -1.748
72 HE3 MET 8 HE3 MET 8 -2.979 4.821 -0.361
73 H PHE 9 H PHE 9 -3.098 -2.182 1.069
74 HA PHE 9 HA PHE 9 -1.121 -1.912 3.241
75 HB2 PHE 9 HB2 PHE 9 -2.991 -3.571 3.273
76 HB3 PHE 9 HB3 PHE 9 -2.299 -4.432 1.924
77 HD1 PHE 9 HD1 PHE 9 -1.768 -3.508 5.533
78 HD2 PHE 9 HD2 PHE 9 -0.460 -6.036 2.303
79 HE1 PHE 9 HE1 PHE 9 -0.463 -4.872 7.113
80 HE2 PHE 9 HE2 PHE 9 0.838 -7.385 3.898
81 HZ PHE 9 HZ PHE 9 0.840 -6.809 6.302
82 H LYS 10 H LYS 10 -0.909 -3.686 0.172
83 HA LYS 10 HA LYS 10 2.039 -3.893 0.314
84 HB2 LYS 10 HB2 LYS 10 0.236 -4.332 -2.209
85 HB3 LYS 10 HB3 LYS 10 1.916 -4.748 -2.199
86 HG2 LYS 10 HG3 LYS 10 1.581 -6.498 -0.447
87 HG3 LYS 10 HG2 LYS 10 -0.117 -6.048 -0.274
88 HD2 LYS 10 HD2 LYS 10 -0.546 -6.654 -2.669
89 HD3 LYS 10 HD3 LYS 10 1.140 -7.092 -2.898
90 HE2 LYS 10 HE3 LYS 10 -0.774 -8.476 -0.887
91 HE3 LYS 10 HE2 LYS 10 -0.465 -9.045 -2.525
92 HZ2 LYS 10 HZ2 LYS 10 0.893 -10.213 -0.970
93 HZ3 LYS 10 HZ3 LYS 10 1.851 -9.351 -1.976
94 H THR 11 H THR 11 0.018 -1.476 -1.339
95 HA THR 11 HA THR 11 2.118 -0.283 -2.916
96 HB THR 11 HB THR 11 -0.442 1.020 -1.832
97 HG1 THR 11 HG1 THR 11 0.184 -0.219 -4.302
98 HG21 THR 11 HG21 THR 11 1.325 1.891 -4.212
99 HG22 THR 11 HG22 THR 11 -0.272 2.565 -3.792
100 HG23 THR 11 HG23 THR 11 1.104 2.799 -2.692
101 H ASN 12 H ASN 12 0.864 0.731 0.260
102 HA ASN 12 HA ASN 12 2.874 2.739 0.772
103 HB2 ASN 12 HB2 ASN 12 0.534 2.534 1.866
104 HB3 ASN 12 HB3 ASN 12 1.122 1.221 2.845
105 HD21 ASN 12 HD22 ASN 12 2.232 1.789 4.735
106 HD22 ASN 12 HD21 ASN 12 2.582 3.525 5.216
107 H GLU 13 H GLU 13 2.858 -0.754 1.731
108 HA GLU 13 HA GLU 13 5.212 -0.586 3.408
109 HB2 GLU 13 HB2 GLU 13 3.511 -2.384 3.612
110 HB3 GLU 13 HB3 GLU 13 3.937 -3.008 2.029
111 HG2 GLU 13 HG2 GLU 13 4.910 -4.431 3.744
112 HG3 GLU 13 HG3 GLU 13 6.208 -3.668 2.851
113 HE2 GLU 13 HE2 GLU 13 5.566 -2.880 6.777
114 H ASN 14 H ASN 14 4.882 -1.807 0.082
115 HA ASN 14 HA ASN 14 7.703 -2.230 -0.362
116 HB2 ASN 14 HB3 ASN 14 5.472 -1.953 -2.440
117 HB3 ASN 14 HB2 ASN 14 7.121 -2.323 -2.874
118 HD21 ASN 14 HD21 ASN 14 8.080 -4.334 -2.070
119 HD22 ASN 14 HD22 ASN 14 6.968 -5.748 -1.709
120 H ASN 15 H ASN 15 5.744 0.572 -1.361
121 HA ASN 15 HA ASN 15 8.056 1.986 -2.527
122 HB2 ASN 15 HB3 ASN 15 5.200 3.025 -1.970
123 HB3 ASN 15 HB2 ASN 15 6.440 4.002 -2.688
124 HD21 ASN 15 HD22 ASN 15 7.222 3.439 -4.831
125 HD22 ASN 15 HD21 ASN 15 6.156 2.439 -5.940
126 H ASP 16 H ASP 16 5.972 2.935 0.205
127 HA ASP 16 HA ASP 16 6.454 4.117 2.170
128 HB2 ASP 16 HB2 ASP 16 7.694 1.957 2.628
129 HB3 ASP 16 HB3 ASP 16 9.172 2.748 2.120
130 HD2 ASP 16 HD2 ASP 16 6.702 2.559 4.379
131 H LYS 17 H LYS 17 6.348 5.765 0.390
132 HA LYS 17 HA LYS 17 6.688 7.929 -0.179
133 HB2 LYS 17 HB2 LYS 17 7.471 8.348 2.120
134 HB3 LYS 17 HB3 LYS 17 9.090 7.930 1.637
135 HG2 LYS 17 HG3 LYS 17 8.865 10.370 1.811
136 HG3 LYS 17 HG2 LYS 17 9.175 9.968 0.126
137 HD2 LYS 17 HD3 LYS 17 6.727 10.188 -0.408
138 HD3 LYS 17 HD2 LYS 17 6.356 10.470 1.293
139 HE2 LYS 17 HE3 LYS 17 7.758 12.606 1.237
140 HE3 LYS 17 HE2 LYS 17 8.128 12.313 -0.469
141 HZ2 LYS 17 HZ2 LYS 17 6.305 13.828 -0.239
142 HZ3 LYS 17 HZ3 LYS 17 5.778 12.463 -0.969
143 H SER 18 H SER 18 9.758 6.164 -0.349
144 HA SER 18 HA SER 18 10.012 6.981 -3.299
145 HB2 SER 18 HB2 SER 18 11.776 8.266 -1.768
146 HB3 SER 18 HB3 SER 18 12.430 6.691 -1.365
147 HG SER 18 HG SER 18 12.730 6.313 -3.603
148 H GLU 19 H GLU 19 12.199 4.719 -1.674
149 HA GLU 19 HA GLU 19 10.525 2.322 -2.324
150 HB2 GLU 19 HB3 GLU 19 11.570 2.898 -4.516
151 HB3 GLU 19 HB2 GLU 19 13.178 2.931 -3.799
152 HG2 GLU 19 HG3 GLU 19 13.027 0.502 -3.261
153 HG3 GLU 19 HG2 GLU 19 11.359 0.451 -3.839
154 HE2 GLU 19 HE2 GLU 19 14.511 0.479 -6.390
155 H LEU 20 H LEU 20 10.660 2.058 0.013
156 HA LEU 20 HA LEU 20 13.430 1.635 1.188
157 HB2 LEU 20 HB2 LEU 20 11.468 2.824 2.541
158 HB3 LEU 20 HB3 LEU 20 10.767 1.227 2.660
159 HG LEU 20 HG LEU 20 12.898 0.405 3.816
160 HD11 LEU 20 HD11 LEU 20 14.431 2.119 4.838
161 HD12 LEU 20 HD12 LEU 20 13.623 3.413 3.919
162 HD13 LEU 20 HD13 LEU 20 14.543 2.146 3.073
163 HD21 LEU 20 HD21 LEU 20 10.827 1.021 5.086
164 HD22 LEU 20 HD22 LEU 20 11.398 2.702 5.224
165 HD23 LEU 20 HD23 LEU 20 12.296 1.383 6.012
166 H ILE 21 H ILE 21 10.856 -0.638 2.020
167 HA ILE 21 HA ILE 21 12.376 -2.869 0.568
168 HB ILE 21 HB ILE 21 11.532 -3.092 3.513
169 HG12 ILE 21 HG12 ILE 21 14.406 -3.152 2.379
170 HG13 ILE 21 HG11 ILE 21 13.688 -1.736 3.117
171 HG21 ILE 21 HG21 ILE 21 12.940 -5.184 1.708
172 HG22 ILE 21 HG22 ILE 21 12.556 -5.389 3.434
173 HG23 ILE 21 HG23 ILE 21 11.252 -5.271 2.257
174 HD11 ILE 21 HD11 ILE 21 14.229 -4.361 4.614
175 HD12 ILE 21 HD12 ILE 21 13.381 -2.950 5.305
176 HD13 ILE 21 HD13 ILE 21 15.077 -2.811 4.785
Start of MODEL 12
1 H1 TYR 1 H TYR 1 -19.258 -3.027 3.001
2 HA TYR 1 HA TYR 1 -18.070 -0.723 1.381
3 HB2 TYR 1 HB3 TYR 1 -16.976 -1.593 4.135
4 HB3 TYR 1 HB2 TYR 1 -16.094 -0.605 2.978
5 HD1 TYR 1 HD3 TYR 1 -16.984 1.716 2.326
6 HD2 TYR 1 HD2 TYR 1 -18.675 -0.540 5.578
7 HE1 TYR 1 HE3 TYR 1 -18.009 3.761 3.222
8 HE2 TYR 1 HE2 TYR 1 -19.695 1.512 6.461
9 HH TYR 1 HH TYR 1 -19.262 4.651 4.824
10 H ASP 2 H ASP 2 -17.276 -1.757 -0.283
11 HA ASP 2 HA ASP 2 -15.321 -4.048 0.086
12 HB2 ASP 2 HB2 ASP 2 -17.610 -5.106 -0.275
13 HB3 ASP 2 HB3 ASP 2 -17.730 -4.308 -1.833
14 HD2 ASP 2 HD2 ASP 2 -15.336 -7.525 -1.225
15 H ASN 3 H ASN 3 -13.550 -3.131 -0.792
16 HA ASN 3 HA ASN 3 -13.363 -2.393 -3.514
17 HB2 ASN 3 HB2 ASN 3 -12.760 -0.081 -3.548
18 HB3 ASN 3 HB3 ASN 3 -14.400 -0.249 -2.984
19 HD21 ASN 3 HD22 ASN 3 -11.636 1.456 -2.466
20 HD22 ASN 3 HD21 ASN 3 -11.979 2.019 -0.754
21 H ILE 4 H ILE 4 -11.587 -3.384 -3.786
22 HA ILE 4 HA ILE 4 -9.568 -4.114 -1.997
23 HB ILE 4 HB ILE 4 -9.995 -5.092 -4.242
24 HG12 ILE 4 HG11 ILE 4 -7.687 -5.822 -4.810
25 HG13 ILE 4 HG12 ILE 4 -7.005 -4.621 -3.733
26 HG21 ILE 4 HG21 ILE 4 -8.860 -4.276 -6.271
27 HG22 ILE 4 HG22 ILE 4 -8.178 -2.884 -5.386
28 HG23 ILE 4 HG23 ILE 4 -9.936 -3.012 -5.639
29 HD11 ILE 4 HD11 ILE 4 -8.852 -6.953 -2.858
30 HD12 ILE 4 HD12 ILE 4 -7.079 -6.920 -2.712
31 HD13 ILE 4 HD13 ILE 4 -8.063 -5.794 -1.754
32 H LEU 5 H LEU 5 -9.715 -0.934 -3.224
33 HA LEU 5 HA LEU 5 -6.929 -0.163 -3.080
34 HB2 LEU 5 HB3 LEU 5 -9.488 1.570 -2.941
35 HB3 LEU 5 HB2 LEU 5 -7.898 2.262 -3.084
36 HG LEU 5 HG LEU 5 -9.138 0.394 -5.194
37 HD11 LEU 5 HD11 LEU 5 -9.488 2.459 -6.546
38 HD12 LEU 5 HD12 LEU 5 -8.873 3.470 -5.214
39 HD13 LEU 5 HD13 LEU 5 -10.385 2.549 -5.019
40 HD21 LEU 5 HD21 LEU 5 -6.557 2.098 -5.340
41 HD22 LEU 5 HD22 LEU 5 -7.287 1.203 -6.696
42 HD23 LEU 5 HD23 LEU 5 -6.637 0.319 -5.308
43 H VAL 6 H VAL 6 -9.221 -0.452 -0.421
44 HA VAL 6 HA VAL 6 -7.917 1.460 1.384
45 HB VAL 6 HB VAL 6 -9.559 -0.966 2.346
46 HG11 VAL 6 HG21 VAL 6 -9.985 0.433 4.364
47 HG12 VAL 6 HG22 VAL 6 -8.246 0.163 4.173
48 HG13 VAL 6 HG23 VAL 6 -8.950 1.733 3.720
49 HG21 VAL 6 HG11 VAL 6 -11.517 0.536 2.441
50 HG22 VAL 6 HG12 VAL 6 -10.598 1.800 1.561
51 HG23 VAL 6 HG13 VAL 6 -10.970 0.235 0.787
52 H LYS 7 H LYS 7 -7.499 -2.063 1.072
53 HA LYS 7 HA LYS 7 -5.130 -2.074 2.873
54 HB2 LYS 7 HB3 LYS 7 -4.805 -4.407 2.455
55 HB3 LYS 7 HB2 LYS 7 -6.472 -4.077 2.859
56 HG2 LYS 7 HG3 LYS 7 -7.148 -4.313 0.469
57 HG3 LYS 7 HG2 LYS 7 -5.489 -4.590 -0.034
58 HD2 LYS 7 HD2 LYS 7 -7.039 -6.407 1.927
59 HD3 LYS 7 HD3 LYS 7 -6.953 -6.661 0.190
60 HE2 LYS 7 HE2 LYS 7 -4.425 -6.898 0.321
61 HE3 LYS 7 HE3 LYS 7 -4.500 -6.691 2.076
62 HZ2 LYS 7 HZ2 LYS 7 -5.866 -8.843 0.560
63 HZ3 LYS 7 HZ3 LYS 7 -5.936 -8.649 2.181
64 H MET 8 H MET 8 -5.419 -1.975 -0.695
65 HA MET 8 HA MET 8 -2.547 -2.314 -1.146
66 HB2 MET 8 HB3 MET 8 -4.570 -1.310 -3.106
67 HB3 MET 8 HB2 MET 8 -2.907 -1.701 -3.467
68 HG2 MET 8 HG3 MET 8 -5.200 -3.633 -2.904
69 HG3 MET 8 HG2 MET 8 -3.983 -3.609 -4.181
70 HE1 MET 8 HE1 MET 8 -3.823 -6.286 -3.790
71 HE2 MET 8 HE2 MET 8 -3.296 -7.017 -2.244
72 HE3 MET 8 HE3 MET 8 -4.895 -6.224 -2.354
73 H PHE 9 H PHE 9 -4.293 0.539 -0.191
74 HA PHE 9 HA PHE 9 -2.417 2.505 -1.396
75 HB2 PHE 9 HB3 PHE 9 -4.790 3.077 -0.865
76 HB3 PHE 9 HB2 PHE 9 -4.503 2.846 0.840
77 HD1 PHE 9 HD1 PHE 9 -3.646 4.995 -2.125
78 HD2 PHE 9 HD2 PHE 9 -3.436 4.644 2.161
79 HE1 PHE 9 HE1 PHE 9 -2.983 7.359 -1.952
80 HE2 PHE 9 HE2 PHE 9 -2.773 7.008 2.312
81 HZ PHE 9 HZ PHE 9 -2.545 8.369 0.261
82 H LYS 10 H LYS 10 -2.931 1.424 1.948
83 HA LYS 10 HA LYS 10 -0.355 2.508 2.888
84 HB2 LYS 10 HB2 LYS 10 -2.106 0.328 4.300
85 HB3 LYS 10 HB3 LYS 10 -0.771 1.089 5.097
86 HG2 LYS 10 HG3 LYS 10 -1.881 3.333 5.026
87 HG3 LYS 10 HG2 LYS 10 -3.223 2.671 4.090
88 HD2 LYS 10 HD3 LYS 10 -3.786 1.106 5.985
89 HD3 LYS 10 HD2 LYS 10 -2.432 1.747 6.924
90 HE2 LYS 10 HE2 LYS 10 -3.501 4.057 6.889
91 HE3 LYS 10 HE3 LYS 10 -4.855 3.416 5.946
92 HZ2 LYS 10 HZ2 LYS 10 -5.341 3.511 8.299
93 HZ3 LYS 10 HZ3 LYS 10 -4.074 2.548 8.675
94 H THR 11 H THR 11 -1.082 -0.768 1.696
95 HA THR 11 HA THR 11 1.399 -1.975 2.580
96 HB THR 11 HB THR 11 -0.456 -2.797 0.277
97 HG1 THR 11 HG1 THR 11 -0.192 -3.679 2.959
98 HG21 THR 11 HG21 THR 11 1.745 -3.971 0.011
99 HG22 THR 11 HG22 THR 11 1.696 -4.480 1.721
100 HG23 THR 11 HG23 THR 11 0.485 -5.097 0.565
101 H ASN 12 H ASN 12 0.504 -0.703 -0.625
102 HA ASN 12 HA ASN 12 3.125 -0.836 -1.803
103 HB2 ASN 12 HB3 ASN 12 0.849 -0.617 -3.016
104 HB3 ASN 12 HB2 ASN 12 0.792 1.068 -2.583
105 HD21 ASN 12 HD22 ASN 12 1.911 2.490 -3.939
106 HD22 ASN 12 HD21 ASN 12 2.918 1.941 -5.372
107 H GLU 13 H GLU 13 1.624 1.928 0.004
108 HA GLU 13 HA GLU 13 3.697 3.851 -0.592
109 HB2 GLU 13 HB3 GLU 13 1.403 4.475 0.154
110 HB3 GLU 13 HB2 GLU 13 1.704 3.783 1.737
111 HG2 GLU 13 HG3 GLU 13 1.874 6.195 1.882
112 HG3 GLU 13 HG2 GLU 13 3.464 5.529 2.191
113 HE2 GLU 13 HE2 GLU 13 4.988 7.044 -0.507
114 H ASN 14 H ASN 14 3.193 1.914 2.353
115 HA ASN 14 HA ASN 14 5.618 2.630 3.703
116 HB2 ASN 14 HB3 ASN 14 3.597 1.513 4.743
117 HB3 ASN 14 HB2 ASN 14 4.056 -0.007 4.010
118 HD21 ASN 14 HD22 ASN 14 5.552 -1.250 5.153
119 HD22 ASN 14 HD21 ASN 14 6.367 -0.692 6.699
120 H ASN 15 H ASN 15 5.098 -0.157 1.558
121 HA ASN 15 HA ASN 15 7.746 -1.293 1.796
122 HB2 ASN 15 HB3 ASN 15 5.594 -2.473 0.930
123 HB3 ASN 15 HB2 ASN 15 5.765 -1.610 -0.572
124 HD21 ASN 15 HD21 ASN 15 7.189 -4.098 1.489
125 HD22 ASN 15 HD22 ASN 15 8.186 -4.870 0.156
126 H ASP 16 H ASP 16 6.645 1.336 -0.272
127 HA ASP 16 HA ASP 16 9.287 1.414 -1.672
128 HB2 ASP 16 HB2 ASP 16 7.364 0.772 -3.257
129 HB3 ASP 16 HB3 ASP 16 6.674 2.360 -2.976
130 HD2 ASP 16 HD2 ASP 16 9.300 0.580 -4.140
131 H LYS 17 H LYS 17 9.137 2.418 0.725
132 HA LYS 17 HA LYS 17 9.607 5.318 0.273
133 HB2 LYS 17 HB2 LYS 17 7.375 5.186 1.198
134 HB3 LYS 17 HB3 LYS 17 7.858 4.125 2.510
135 HG2 LYS 17 HG3 LYS 17 8.918 7.016 2.224
136 HG3 LYS 17 HG2 LYS 17 7.372 6.633 2.971
137 HD2 LYS 17 HD2 LYS 17 8.580 5.055 4.593
138 HD3 LYS 17 HD3 LYS 17 10.112 5.638 3.948
139 HE2 LYS 17 HE2 LYS 17 9.519 8.016 4.625
140 HE3 LYS 17 HE3 LYS 17 7.982 7.440 5.288
141 HZ2 LYS 17 HZ2 LYS 17 9.684 7.655 6.973
142 HZ3 LYS 17 HZ3 LYS 17 10.683 6.616 6.201
143 H SER 18 H SER 18 9.983 2.748 2.693
144 HA SER 18 HA SER 18 12.615 3.855 3.630
145 HB2 SER 18 HB2 SER 18 10.988 2.500 5.246
146 HB3 SER 18 HB3 SER 18 11.466 1.065 4.350
147 HG SER 18 HG SER 18 13.211 2.871 5.670
148 H GLU 19 H GLU 19 11.806 0.825 1.892
149 HA GLU 19 HA GLU 19 14.561 0.895 0.601
150 HB2 GLU 19 HB3 GLU 19 14.602 -0.799 2.429
151 HB3 GLU 19 HB2 GLU 19 13.169 -1.603 1.789
152 HG2 GLU 19 HG3 GLU 19 14.392 -2.181 -0.315
153 HG3 GLU 19 HG2 GLU 19 15.820 -1.307 0.242
154 HE2 GLU 19 HE2 GLU 19 16.893 -3.772 2.433
155 H LEU 20 H LEU 20 13.433 1.974 -1.050
156 HA LEU 20 HA LEU 20 11.198 1.089 -2.510
157 HB2 LEU 20 HB3 LEU 20 13.573 2.695 -3.672
158 HB3 LEU 20 HB2 LEU 20 12.024 2.418 -4.403
159 HG LEU 20 HG LEU 20 10.901 3.566 -2.385
160 HD11 LEU 20 HD21 LEU 20 12.777 3.692 -0.743
161 HD12 LEU 20 HD22 LEU 20 13.782 4.595 -1.902
162 HD13 LEU 20 HD23 LEU 20 12.309 5.324 -1.216
163 HD21 LEU 20 HD11 LEU 20 12.665 5.249 -4.276
164 HD22 LEU 20 HD12 LEU 20 11.059 4.585 -4.659
165 HD23 LEU 20 HD13 LEU 20 11.222 5.819 -3.399
166 H ILE 21 H ILE 21 14.559 0.376 -3.414
167 HA ILE 21 HA ILE 21 13.571 -1.841 -5.306
168 HB ILE 21 HB ILE 21 16.340 -0.523 -5.346
169 HG12 ILE 21 HG11 ILE 21 14.079 -0.265 -7.439
170 HG13 ILE 21 HG12 ILE 21 14.399 0.949 -6.218
171 HG21 ILE 21 HG21 ILE 21 16.726 -1.864 -7.430
172 HG22 ILE 21 HG22 ILE 21 15.130 -2.634 -7.260
173 HG23 ILE 21 HG23 ILE 21 16.414 -2.937 -6.067
174 HD11 ILE 21 HD11 ILE 21 15.444 1.675 -8.288
175 HD12 ILE 21 HD12 ILE 21 16.376 0.172 -8.441
176 HD13 ILE 21 HD13 ILE 21 16.733 1.314 -7.116
Start of MODEL 13
1 H1 TYR 1 H TYR 1 -18.685 -5.248 2.681
2 HA TYR 1 HA TYR 1 -17.811 -2.324 2.291
3 HB2 TYR 1 HB3 TYR 1 -16.464 -4.380 4.156
4 HB3 TYR 1 HB2 TYR 1 -15.725 -2.872 3.633
5 HD1 TYR 1 HD2 TYR 1 -16.706 -0.632 4.343
6 HD2 TYR 1 HD3 TYR 1 -18.173 -4.344 5.955
7 HE1 TYR 1 HE2 TYR 1 -17.770 0.583 6.194
8 HE2 TYR 1 HE3 TYR 1 -19.233 -3.115 7.799
9 HH TYR 1 HH TYR 1 -19.610 -1.132 8.722
10 H ASP 2 H ASP 2 -17.138 -2.298 0.286
11 HA ASP 2 HA ASP 2 -15.024 -4.261 -0.663
12 HB2 ASP 2 HB2 ASP 2 -17.276 -5.192 -1.405
13 HB3 ASP 2 HB3 ASP 2 -17.575 -3.729 -2.326
14 HD2 ASP 2 HD2 ASP 2 -14.974 -6.580 -3.571
15 H ASN 3 H ASN 3 -13.394 -2.862 -1.000
16 HA ASN 3 HA ASN 3 -13.521 -0.785 -2.973
17 HB2 ASN 3 HB2 ASN 3 -14.540 0.567 -1.068
18 HB3 ASN 3 HB3 ASN 3 -13.132 0.256 -0.083
19 HD21 ASN 3 HD21 ASN 3 -14.241 1.862 -3.056
20 HD22 ASN 3 HD22 ASN 3 -12.883 3.095 -3.086
21 H ILE 4 H ILE 4 -11.797 -1.668 -3.888
22 HA ILE 4 HA ILE 4 -9.609 -2.975 -2.628
23 HB ILE 4 HB ILE 4 -10.335 -3.302 -4.954
24 HG12 ILE 4 HG11 ILE 4 -7.305 -2.830 -4.808
25 HG13 ILE 4 HG12 ILE 4 -8.119 -4.152 -3.988
26 HG21 ILE 4 HG21 ILE 4 -10.469 -0.899 -5.710
27 HG22 ILE 4 HG22 ILE 4 -9.517 -1.903 -6.819
28 HG23 ILE 4 HG23 ILE 4 -8.692 -0.796 -5.688
29 HD11 ILE 4 HD11 ILE 4 -8.081 -3.749 -7.045
30 HD12 ILE 4 HD12 ILE 4 -8.973 -5.042 -6.200
31 HD13 ILE 4 HD13 ILE 4 -7.198 -4.972 -6.108
32 H LEU 5 H LEU 5 -9.957 0.415 -2.854
33 HA LEU 5 HA LEU 5 -7.096 1.100 -2.801
34 HB2 LEU 5 HB3 LEU 5 -8.924 2.560 -3.913
35 HB3 LEU 5 HB2 LEU 5 -9.532 2.943 -2.325
36 HG LEU 5 HG LEU 5 -7.355 4.096 -1.758
37 HD11 LEU 5 HD21 LEU 5 -6.566 3.553 -4.701
38 HD12 LEU 5 HD22 LEU 5 -5.711 4.643 -3.580
39 HD13 LEU 5 HD23 LEU 5 -5.745 2.904 -3.260
40 HD21 LEU 5 HD11 LEU 5 -8.725 5.123 -4.324
41 HD22 LEU 5 HD12 LEU 5 -7.755 6.094 -3.187
42 HD23 LEU 5 HD13 LEU 5 -9.292 5.386 -2.656
43 H VAL 6 H VAL 6 -9.423 0.495 -0.220
44 HA VAL 6 HA VAL 6 -8.014 1.993 1.873
45 HB VAL 6 HB VAL 6 -9.797 -0.464 2.418
46 HG11 VAL 6 HG21 VAL 6 -8.429 0.245 4.406
47 HG12 VAL 6 HG22 VAL 6 -10.147 0.590 4.650
48 HG13 VAL 6 HG23 VAL 6 -9.027 1.912 4.236
49 HG21 VAL 6 HG11 VAL 6 -11.659 1.115 2.786
50 HG22 VAL 6 HG12 VAL 6 -11.124 1.083 1.101
51 HG23 VAL 6 HG13 VAL 6 -10.658 2.457 2.139
52 H LYS 7 H LYS 7 -7.782 -1.431 0.970
53 HA LYS 7 HA LYS 7 -5.391 -1.854 2.713
54 HB2 LYS 7 HB3 LYS 7 -5.272 -4.154 1.951
55 HB3 LYS 7 HB2 LYS 7 -6.855 -3.724 2.557
56 HG2 LYS 7 HG2 LYS 7 -7.750 -3.566 0.225
57 HG3 LYS 7 HG3 LYS 7 -6.162 -3.957 -0.444
58 HD2 LYS 7 HD2 LYS 7 -6.213 -6.193 0.726
59 HD3 LYS 7 HD3 LYS 7 -7.793 -5.802 1.417
60 HE2 LYS 7 HE2 LYS 7 -8.778 -5.628 -0.922
61 HE3 LYS 7 HE3 LYS 7 -7.199 -6.018 -1.617
62 HZ2 LYS 7 HZ2 LYS 7 -8.565 -7.961 -1.465
63 HZ3 LYS 7 HZ3 LYS 7 -7.267 -8.145 -0.489
64 H MET 8 H MET 8 -5.742 -1.482 -0.840
65 HA MET 8 HA MET 8 -2.901 -1.933 -1.344
66 HB2 MET 8 HB2 MET 8 -4.894 -0.779 -3.252
67 HB3 MET 8 HB3 MET 8 -3.260 -1.242 -3.645
68 HG2 MET 8 HG3 MET 8 -5.632 -3.083 -3.103
69 HG3 MET 8 HG2 MET 8 -4.435 -3.063 -4.399
70 HE1 MET 8 HE1 MET 8 -5.322 -5.753 -2.978
71 HE2 MET 8 HE2 MET 8 -4.077 -5.708 -4.264
72 HE3 MET 8 HE3 MET 8 -3.748 -6.564 -2.729
73 H PHE 9 H PHE 9 -4.470 1.024 -0.329
74 HA PHE 9 HA PHE 9 -2.469 2.849 -1.554
75 HB2 PHE 9 HB2 PHE 9 -4.766 3.633 -0.976
76 HB3 PHE 9 HB3 PHE 9 -4.458 3.391 0.725
77 HD1 PHE 9 HD1 PHE 9 -3.534 5.440 -2.281
78 HD2 PHE 9 HD2 PHE 9 -3.114 5.066 1.987
79 HE1 PHE 9 HE1 PHE 9 -2.614 7.720 -2.160
80 HE2 PHE 9 HE2 PHE 9 -2.195 7.345 2.086
81 HZ PHE 9 HZ PHE 9 -1.944 8.676 0.019
82 H LYS 10 H LYS 10 -3.000 1.837 1.817
83 HA LYS 10 HA LYS 10 -0.325 2.711 2.671
84 HB2 LYS 10 HB3 LYS 10 -2.185 0.661 4.137
85 HB3 LYS 10 HB2 LYS 10 -0.770 1.315 4.892
86 HG2 LYS 10 HG2 LYS 10 -1.720 3.637 4.856
87 HG3 LYS 10 HG3 LYS 10 -3.137 3.073 3.968
88 HD2 LYS 10 HD3 LYS 10 -3.737 1.541 5.870
89 HD3 LYS 10 HD2 LYS 10 -2.333 2.074 6.782
90 HE2 LYS 10 HE2 LYS 10 -4.654 3.927 5.882
91 HE3 LYS 10 HE3 LYS 10 -4.552 3.143 7.456
92 HZ2 LYS 10 HZ2 LYS 10 -2.554 5.069 6.415
93 HZ3 LYS 10 HZ3 LYS 10 -2.480 4.332 7.872
94 H THR 11 H THR 11 -1.289 -0.506 1.486
95 HA THR 11 HA THR 11 1.122 -1.870 2.334
96 HB THR 11 HB THR 11 -0.810 -2.559 0.053
97 HG1 THR 11 HG1 THR 11 -0.548 -3.481 2.722
98 HG21 THR 11 HG21 THR 11 1.268 -4.378 1.439
99 HG22 THR 11 HG22 THR 11 -0.001 -4.913 0.304
100 HG23 THR 11 HG23 THR 11 1.310 -3.858 -0.268
101 H ASN 12 H ASN 12 0.281 -0.562 -0.871
102 HA ASN 12 HA ASN 12 2.920 -0.801 -2.005
103 HB2 ASN 12 HB2 ASN 12 0.663 -0.582 -3.262
104 HB3 ASN 12 HB3 ASN 12 0.640 1.119 -2.894
105 HD21 ASN 12 HD22 ASN 12 1.797 2.460 -4.295
106 HD22 ASN 12 HD21 ASN 12 2.821 1.835 -5.683
107 H GLU 13 H GLU 13 1.442 2.077 -0.355
108 HA GLU 13 HA GLU 13 3.576 3.905 -1.043
109 HB2 GLU 13 HB2 GLU 13 1.245 4.573 -0.461
110 HB3 GLU 13 HB3 GLU 13 1.513 4.107 1.218
111 HG2 GLU 13 HG2 GLU 13 3.275 5.906 1.431
112 HG3 GLU 13 HG3 GLU 13 3.104 6.304 -0.276
113 HE2 GLU 13 HE2 GLU 13 1.464 7.375 -0.930
114 H ASN 14 H ASN 14 2.953 2.189 2.016
115 HA ASN 14 HA ASN 14 5.354 3.058 3.369
116 HB2 ASN 14 HB2 ASN 14 3.705 0.540 3.956
117 HB3 ASN 14 HB3 ASN 14 4.983 1.146 4.991
118 HD21 ASN 14 HD22 ASN 14 2.287 0.750 5.753
119 HD22 ASN 14 HD21 ASN 14 1.658 2.385 6.301
120 H ASN 15 H ASN 15 4.816 0.025 1.589
121 HA ASN 15 HA ASN 15 7.438 -1.097 2.056
122 HB2 ASN 15 HB3 ASN 15 5.308 -2.367 1.271
123 HB3 ASN 15 HB2 ASN 15 5.550 -1.715 -0.325
124 HD21 ASN 15 HD22 ASN 15 6.887 -3.892 2.120
125 HD22 ASN 15 HD21 ASN 15 7.922 -4.847 0.945
126 H ASP 16 H ASP 16 6.414 1.186 -0.429
127 HA ASP 16 HA ASP 16 9.054 0.979 -1.841
128 HB2 ASP 16 HB2 ASP 16 6.933 0.577 -3.247
129 HB3 ASP 16 HB3 ASP 16 6.479 2.245 -2.952
130 HD2 ASP 16 HD2 ASP 16 8.767 0.131 -4.277
131 H LYS 17 H LYS 17 8.947 2.128 0.602
132 HA LYS 17 HA LYS 17 10.034 4.823 -0.011
133 HB2 LYS 17 HB3 LYS 17 7.571 4.526 1.332
134 HB3 LYS 17 HB2 LYS 17 8.658 4.636 2.679
135 HG2 LYS 17 HG3 LYS 17 7.909 6.847 2.251
136 HG3 LYS 17 HG2 LYS 17 9.572 6.836 1.671
137 HD2 LYS 17 HD3 LYS 17 8.743 6.521 -0.701
138 HD3 LYS 17 HD2 LYS 17 7.082 6.423 -0.122
139 HE2 LYS 17 HE2 LYS 17 7.246 8.817 0.750
140 HE3 LYS 17 HE3 LYS 17 8.919 8.909 0.177
141 HZ2 LYS 17 HZ2 LYS 17 6.553 8.411 -1.547
142 HZ3 LYS 17 HZ3 LYS 17 8.097 8.498 -2.076
143 H SER 18 H SER 18 9.766 2.678 2.792
144 HA SER 18 HA SER 18 12.590 3.216 3.630
145 HB2 SER 18 HB3 SER 18 10.680 2.591 5.379
146 HB3 SER 18 HB2 SER 18 10.774 0.956 4.740
147 HG SER 18 HG SER 18 12.924 2.456 5.827
148 H GLU 19 H GLU 19 11.051 0.294 2.258
149 HA GLU 19 HA GLU 19 13.822 -0.817 1.584
150 HB2 GLU 19 HB3 GLU 19 12.301 -2.227 3.097
151 HB3 GLU 19 HB2 GLU 19 11.155 -2.368 1.768
152 HG2 GLU 19 HG2 GLU 19 12.382 -4.337 1.753
153 HG3 GLU 19 HG3 GLU 19 12.928 -3.435 0.344
154 HE2 GLU 19 HE2 GLU 19 16.224 -3.245 1.359
155 H LEU 20 H LEU 20 13.734 0.884 0.003
156 HA LEU 20 HA LEU 20 12.107 0.270 -2.557
157 HB2 LEU 20 HB2 LEU 20 12.042 2.644 -1.245
158 HB3 LEU 20 HB3 LEU 20 13.567 2.921 -2.047
159 HG LEU 20 HG LEU 20 10.852 2.290 -3.349
160 HD11 LEU 20 HD21 LEU 20 10.830 4.678 -4.045
161 HD12 LEU 20 HD22 LEU 20 10.998 4.565 -2.284
162 HD13 LEU 20 HD23 LEU 20 12.417 4.952 -3.282
163 HD21 LEU 20 HD11 LEU 20 11.833 2.931 -5.571
164 HD22 LEU 20 HD12 LEU 20 13.454 3.038 -4.838
165 HD23 LEU 20 HD13 LEU 20 12.601 1.475 -4.924
166 H ILE 21 H ILE 21 14.025 -1.595 -2.458
167 HA ILE 21 HA ILE 21 15.869 -0.767 -4.650
168 HB ILE 21 HB ILE 21 17.195 -0.171 -2.675
169 HG12 ILE 21 HG12 ILE 21 18.447 -2.601 -4.080
170 HG13 ILE 21 HG11 ILE 21 18.209 -1.043 -4.853
171 HG21 ILE 21 HG21 ILE 21 16.349 -1.829 -0.974
172 HG22 ILE 21 HG22 ILE 21 18.114 -1.777 -1.043
173 HG23 ILE 21 HG23 ILE 21 17.244 -3.131 -1.796
174 HD11 ILE 21 HD11 ILE 21 20.524 -1.188 -4.068
175 HD12 ILE 21 HD12 ILE 21 20.013 -1.514 -2.399
176 HD13 ILE 21 HD13 ILE 21 19.693 0.079 -3.135