Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | in_dress | stage | position | program | type |
|
|
2767 | 1ckw RC | 4595 | cing | dress | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H MET 1 1H MET 1 -15.554 -2.865 9.976
2 2H MET 1 2H MET 1 -13.942 -2.531 10.386
3 3H MET 1 3H MET 1 -15.150 -1.374 10.685
4 HA MET 1 HA MET 1 -14.415 -0.477 8.753
5 1HB MET 1 1HB MET 1 -13.262 -2.036 7.083
6 2HB MET 1 2HB MET 1 -12.495 -1.916 8.667
7 1HG MET 1 1HG MET 1 -13.065 -4.058 9.259
8 2HG MET 1 2HG MET 1 -14.581 -4.015 8.358
9 1HE MET 1 1HE MET 1 -14.386 -6.118 7.868
10 2HE MET 1 2HE MET 1 -14.534 -5.984 6.118
11 3HE MET 1 3HE MET 1 -13.252 -6.972 6.813
12 HA PRO 2 HA PRO 2 -18.335 -2.479 7.150
13 1HB PRO 2 1HB PRO 2 -20.074 -0.492 7.858
14 2HB PRO 2 2HB PRO 2 -19.671 -1.847 8.931
15 1HG PRO 2 1HG PRO 2 -18.688 0.954 8.971
16 2HG PRO 2 2HG PRO 2 -19.036 -0.141 10.316
17 1HD PRO 2 1HD PRO 2 -16.511 0.419 9.376
18 2HD PRO 2 2HD PRO 2 -16.948 -1.050 10.275
19 H GLY 3 H GLY 3 -16.414 0.199 6.624
20 1HA GLY 3 1HA GLY 3 -17.376 0.536 3.905
21 2HA GLY 3 2HA GLY 3 -17.763 1.928 4.917
22 H THR 4 H THR 4 -14.873 -0.072 5.270
23 HA THR 4 HA THR 4 -13.211 2.017 3.993
24 HB THR 4 HB THR 4 -13.534 2.612 6.449
25 HG1 THR 4 HG1 THR 4 -11.522 2.834 4.956
26 1HG2 THR 4 1HG2 THR 4 -12.953 -0.130 6.751
27 2HG2 THR 4 2HG2 THR 4 -11.556 0.733 7.397
28 3HG2 THR 4 3HG2 THR 4 -13.168 1.061 8.034
29 H ILE 5 H ILE 5 -13.648 -0.526 3.029
30 HA ILE 5 HA ILE 5 -11.391 -2.215 3.940
31 HB ILE 5 HB ILE 5 -13.489 -2.738 1.812
32 1HG1 ILE 5 1HG1 ILE 5 -13.328 -3.733 4.675
33 2HG1 ILE 5 2HG1 ILE 5 -14.401 -2.445 4.128
34 1HG2 ILE 5 1HG2 ILE 5 -11.426 -4.493 3.173
35 2HG2 ILE 5 2HG2 ILE 5 -12.764 -5.125 2.214
36 3HG2 ILE 5 3HG2 ILE 5 -11.535 -4.114 1.454
37 1HD1 ILE 5 1HD1 ILE 5 -14.956 -4.401 2.301
38 2HD1 ILE 5 2HD1 ILE 5 -14.614 -5.364 3.739
39 3HD1 ILE 5 3HD1 ILE 5 -15.881 -4.138 3.780
40 H LYS 6 H LYS 6 -12.483 -0.432 1.068
41 HA LYS 6 HA LYS 6 -10.024 -1.168 -0.390
42 1HB LYS 6 1HB LYS 6 -12.534 -0.659 -1.271
43 2HB LYS 6 2HB LYS 6 -11.824 0.946 -1.448
44 1HG LYS 6 1HG LYS 6 -9.917 -0.958 -2.394
45 2HG LYS 6 2HG LYS 6 -11.472 -1.333 -3.139
46 1HD LYS 6 1HD LYS 6 -11.253 1.480 -3.199
47 2HD LYS 6 2HD LYS 6 -9.678 0.863 -3.703
48 1HE LYS 6 1HE LYS 6 -12.151 -0.392 -4.864
49 2HE LYS 6 2HE LYS 6 -11.587 1.163 -5.506
50 1HZ LYS 6 1HZ LYS 6 -9.334 0.166 -5.644
51 2HZ LYS 6 2HZ LYS 6 -10.011 -1.340 -5.242
52 3HZ LYS 6 3HZ LYS 6 -10.459 -0.563 -6.685
53 H GLU 7 H GLU 7 -11.521 1.716 1.058
54 HA GLU 7 HA GLU 7 -9.534 3.599 0.291
55 1HB GLU 7 1HB GLU 7 -11.819 3.983 1.466
56 2HB GLU 7 2HB GLU 7 -10.932 3.692 2.963
57 1HG GLU 7 1HG GLU 7 -10.985 6.095 2.474
58 2HG GLU 7 2HG GLU 7 -9.334 5.487 2.345
59 H ASN 8 H ASN 8 -9.360 0.949 2.451
60 HA ASN 8 HA ASN 8 -7.151 2.090 4.035
61 1HB ASN 8 1HB ASN 8 -8.992 0.368 4.805
62 2HB ASN 8 2HB ASN 8 -7.906 -0.816 4.074
63 1HD2 ASN 8 2HD2 ASN 8 -7.680 2.032 6.293
64 2HD2 ASN 8 1HD2 ASN 8 -6.523 1.323 7.314
65 H ILE 9 H ILE 9 -7.635 -0.422 1.555
66 HA ILE 9 HA ILE 9 -4.925 -1.312 1.457
67 HB ILE 9 HB ILE 9 -6.854 -1.183 -0.878
68 1HG1 ILE 9 1HG1 ILE 9 -8.043 -2.210 0.952
69 2HG1 ILE 9 2HG1 ILE 9 -7.477 -3.515 -0.091
70 1HG2 ILE 9 1HG2 ILE 9 -4.208 -2.070 -0.669
71 2HG2 ILE 9 2HG2 ILE 9 -5.174 -3.543 -0.570
72 3HG2 ILE 9 3HG2 ILE 9 -5.344 -2.469 -1.958
73 1HD1 ILE 9 1HD1 ILE 9 -5.371 -3.495 1.469
74 2HD1 ILE 9 2HD1 ILE 9 -6.440 -2.664 2.600
75 3HD1 ILE 9 3HD1 ILE 9 -6.847 -4.282 2.028
76 H ILE 10 H ILE 10 -6.615 1.313 -0.248
77 HA ILE 10 HA ILE 10 -4.643 2.097 -2.069
78 HB ILE 10 HB ILE 10 -6.600 3.695 -0.414
79 1HG1 ILE 10 1HG1 ILE 10 -6.477 3.527 -3.410
80 2HG1 ILE 10 2HG1 ILE 10 -7.109 2.155 -2.498
81 1HG2 ILE 10 1HG2 ILE 10 -4.468 4.689 -2.303
82 2HG2 ILE 10 2HG2 ILE 10 -5.974 5.579 -2.084
83 3HG2 ILE 10 3HG2 ILE 10 -4.902 5.310 -0.711
84 1HD1 ILE 10 1HD1 ILE 10 -8.099 5.008 -2.221
85 2HD1 ILE 10 2HD1 ILE 10 -8.899 3.757 -3.173
86 3HD1 ILE 10 3HD1 ILE 10 -8.770 3.586 -1.422
87 H GLY 11 H GLY 11 -4.705 2.476 1.425
88 1HA GLY 11 1HA GLY 11 -2.314 4.195 1.413
89 2HA GLY 11 2HA GLY 11 -3.170 3.620 2.845
90 H VAL 12 H VAL 12 -3.162 0.818 2.007
91 HA VAL 12 HA VAL 12 -0.587 0.062 3.080
92 HB VAL 12 HB VAL 12 -2.833 -1.517 1.805
93 1HG1 VAL 12 1HG1 VAL 12 -0.094 -2.347 2.683
94 2HG1 VAL 12 2HG1 VAL 12 -1.442 -3.434 3.016
95 3HG1 VAL 12 3HG1 VAL 12 -1.078 -2.963 1.356
96 1HG2 VAL 12 1HG2 VAL 12 -3.171 -0.482 4.072
97 2HG2 VAL 12 2HG2 VAL 12 -3.245 -2.243 4.090
98 3HG2 VAL 12 3HG2 VAL 12 -1.794 -1.416 4.655
99 H SER 13 H SER 13 -1.980 0.139 -0.181
100 HA SER 13 HA SER 13 0.341 -1.128 -1.404
101 1HB SER 13 1HB SER 13 -2.269 -0.210 -2.248
102 2HB SER 13 2HB SER 13 -1.032 0.368 -3.361
103 HG SER 13 HG SER 13 -1.984 -1.852 -3.647
104 H TYR 14 H TYR 14 -0.846 2.215 -1.077
105 HA TYR 14 HA TYR 14 1.031 3.576 -2.636
106 1HB TYR 14 1HB TYR 14 -0.843 4.272 -0.659
107 2HB TYR 14 2HB TYR 14 0.693 4.920 -0.083
108 HD1 TYR 14 HD1 TYR 14 2.167 6.115 -1.943
109 HD2 TYR 14 HD2 TYR 14 -2.083 5.532 -2.180
110 HE1 TYR 14 HE1 TYR 14 2.005 7.964 -3.588
111 HE2 TYR 14 HE2 TYR 14 -2.244 7.381 -3.824
112 HH TYR 14 HH TYR 14 0.007 8.472 -5.591
113 H ASP 15 H ASP 15 1.553 1.798 0.303
114 HA ASP 15 HA ASP 15 4.229 3.012 0.686
115 1HB ASP 15 1HB ASP 15 3.027 2.653 2.733
116 2HB ASP 15 2HB ASP 15 2.624 0.997 2.276
117 H GLU 16 H GLU 16 2.891 -0.307 0.367
118 HA GLU 16 HA GLU 16 5.253 -1.727 0.039
119 1HB GLU 16 1HB GLU 16 2.499 -2.166 -0.521
120 2HB GLU 16 2HB GLU 16 3.403 -2.643 -1.957
121 1HG GLU 16 1HG GLU 16 4.587 -4.297 -0.833
122 2HG GLU 16 2HG GLU 16 4.410 -3.502 0.732
123 H TYR 17 H TYR 17 3.537 0.217 -2.370
124 HA TYR 17 HA TYR 17 5.269 -0.429 -4.577
125 1HB TYR 17 1HB TYR 17 3.657 0.749 -5.635
126 2HB TYR 17 2HB TYR 17 2.995 1.249 -4.084
127 HD1 TYR 17 HD1 TYR 17 5.735 2.073 -6.501
128 HD2 TYR 17 HD2 TYR 17 3.073 3.504 -3.450
129 HE1 TYR 17 HE1 TYR 17 6.491 4.396 -6.933
130 HE2 TYR 17 HE2 TYR 17 3.826 5.830 -3.884
131 HH TYR 17 HH TYR 17 5.132 6.892 -6.430
132 H ARG 18 H ARG 18 5.139 2.470 -2.493
133 HA ARG 18 HA ARG 18 7.642 3.531 -3.438
134 1HB ARG 18 1HB ARG 18 5.598 4.519 -1.915
135 2HB ARG 18 2HB ARG 18 6.828 4.229 -0.684
136 1HG ARG 18 1HG ARG 18 8.461 5.440 -2.240
137 2HG ARG 18 2HG ARG 18 7.044 5.958 -3.154
138 1HD ARG 18 1HD ARG 18 6.269 6.563 -0.605
139 2HD ARG 18 2HD ARG 18 8.006 6.849 -0.506
140 HE ARG 18 HE ARG 18 6.104 8.335 -2.219
141 1HH1 ARG 18 1HH2 ARG 18 8.216 9.364 -0.191
142 2HH1 ARG 18 2HH2 ARG 18 9.370 10.060 -1.278
143 1HH2 ARG 18 1HH1 ARG 18 8.068 8.495 -4.085
144 2HH2 ARG 18 2HH1 ARG 18 9.285 9.571 -3.482
145 H TYR 19 H TYR 19 7.061 0.780 -1.681
146 HA TYR 19 HA TYR 19 9.672 0.933 -0.252
147 1HB TYR 19 1HB TYR 19 6.988 -0.142 0.413
148 2HB TYR 19 2HB TYR 19 8.361 -1.113 0.913
149 HD1 TYR 19 HD1 TYR 19 6.754 2.210 1.196
150 HD2 TYR 19 HD2 TYR 19 9.854 -0.385 2.638
151 HE1 TYR 19 HE1 TYR 19 7.159 3.749 3.103
152 HE2 TYR 19 HE2 TYR 19 10.262 1.149 4.544
153 HH TYR 19 HH TYR 19 8.289 3.233 5.672
154 H ARG 20 H ARG 20 7.949 -0.446 -2.805
155 HA ARG 20 HA ARG 20 8.834 -3.150 -2.796
156 1HB ARG 20 1HB ARG 20 7.049 -2.677 -4.239
157 2HB ARG 20 2HB ARG 20 7.844 -1.257 -4.914
158 1HG ARG 20 1HG ARG 20 9.021 -2.479 -6.435
159 2HG ARG 20 2HG ARG 20 9.287 -3.810 -5.309
160 1HD ARG 20 1HD ARG 20 6.784 -4.332 -5.596
161 2HD ARG 20 2HD ARG 20 6.837 -3.244 -6.983
162 HE ARG 20 HE ARG 20 8.096 -5.900 -6.820
163 1HH1 ARG 20 1HH2 ARG 20 6.465 -4.629 -9.107
164 2HH1 ARG 20 2HH2 ARG 20 7.707 -4.403 -10.293
165 1HH2 ARG 20 1HH1 ARG 20 10.306 -4.842 -8.039
166 2HH2 ARG 20 2HH1 ARG 20 9.882 -4.522 -9.688
167 H SER 21 H SER 21 10.302 -0.281 -4.396
168 HA SER 21 HA SER 21 12.764 -1.946 -4.697
169 1HB SER 21 1HB SER 21 11.364 -1.370 -6.815
170 2HB SER 21 2HB SER 21 12.037 0.244 -6.619
171 HG SER 21 HG SER 21 13.582 -0.692 -7.770
172 H VAL 22 H VAL 22 12.476 -0.404 -2.461
173 HA VAL 22 HA VAL 22 14.448 1.762 -2.959
174 HB VAL 22 HB VAL 22 12.497 3.020 -2.770
175 1HG1 VAL 22 1HG1 VAL 22 11.583 0.662 -1.307
176 2HG1 VAL 22 2HG1 VAL 22 11.004 2.174 -0.617
177 3HG1 VAL 22 3HG1 VAL 22 10.669 1.790 -2.306
178 1HG2 VAL 22 1HG2 VAL 22 14.261 3.240 -0.741
179 2HG2 VAL 22 2HG2 VAL 22 12.816 4.247 -0.854
180 3HG2 VAL 22 3HG2 VAL 22 12.815 2.816 0.177
181 H ILE 23 H ILE 23 12.911 -0.436 -0.626
182 HA ILE 23 HA ILE 23 14.578 0.148 1.601
183 HB ILE 23 HB ILE 23 13.451 -2.576 0.903
184 1HG1 ILE 23 1HG1 ILE 23 11.932 -0.746 2.668
185 2HG1 ILE 23 2HG1 ILE 23 11.962 -0.289 0.965
186 1HG2 ILE 23 1HG2 ILE 23 15.072 -2.196 2.880
187 2HG2 ILE 23 2HG2 ILE 23 13.748 -1.294 3.618
188 3HG2 ILE 23 3HG2 ILE 23 13.542 -3.001 3.228
189 1HD1 ILE 23 1HD1 ILE 23 11.372 -2.766 0.498
190 2HD1 ILE 23 2HD1 ILE 23 10.933 -2.836 2.205
191 3HD1 ILE 23 3HD1 ILE 23 10.096 -1.723 1.125
192 H LYS 24 H LYS 24 14.978 -2.284 -0.986
193 HA LYS 24 HA LYS 24 17.364 -3.473 -0.088
194 1HB LYS 24 1HB LYS 24 16.282 -4.390 -2.024
195 2HB LYS 24 2HB LYS 24 16.404 -2.860 -2.893
196 1HG LYS 24 1HG LYS 24 18.885 -3.051 -2.830
197 2HG LYS 24 2HG LYS 24 18.721 -4.624 -2.048
198 1HD LYS 24 1HD LYS 24 17.429 -3.985 -4.707
199 2HD LYS 24 2HD LYS 24 19.044 -4.682 -4.576
200 1HE LYS 24 1HE LYS 24 17.274 -6.168 -2.864
201 2HE LYS 24 2HE LYS 24 16.563 -6.071 -4.488
202 1HZ LYS 24 1HZ LYS 24 19.447 -6.528 -4.262
203 2HZ LYS 24 2HZ LYS 24 18.414 -7.836 -3.932
204 3HZ LYS 24 3HZ LYS 24 18.360 -7.068 -5.447
205 H ALA 25 H ALA 25 18.733 -1.899 0.879
206 HA ALA 25 HA ALA 25 19.744 0.278 -0.869
207 1HB ALA 25 1HB ALA 25 19.190 0.132 1.868
208 2HB ALA 25 2HB ALA 25 20.952 0.104 1.778
209 3HB ALA 25 3HB ALA 25 20.053 1.433 1.047
Start of MODEL 2
1 1H MET 1 1H MET 1 -16.658 -2.203 4.570
2 2H MET 1 2H MET 1 -17.709 -1.986 5.887
3 3H MET 1 3H MET 1 -18.141 -1.410 4.348
4 HA MET 1 HA MET 1 -17.426 0.540 5.302
5 1HB MET 1 1HB MET 1 -16.406 -1.389 7.112
6 2HB MET 1 2HB MET 1 -15.048 -0.348 6.681
7 1HG MET 1 1HG MET 1 -15.870 1.328 7.939
8 2HG MET 1 2HG MET 1 -17.417 1.252 7.094
9 1HE MET 1 1HE MET 1 -17.122 2.223 9.693
10 2HE MET 1 2HE MET 1 -18.829 1.787 9.669
11 3HE MET 1 3HE MET 1 -17.804 1.291 11.024
12 HA PRO 2 HA PRO 2 -14.458 0.421 1.898
13 1HB PRO 2 1HB PRO 2 -15.113 2.896 0.936
14 2HB PRO 2 2HB PRO 2 -16.050 1.437 0.562
15 1HG PRO 2 1HG PRO 2 -16.623 3.609 2.503
16 2HG PRO 2 2HG PRO 2 -17.733 2.674 1.491
17 1HD PRO 2 1HD PRO 2 -17.331 2.227 4.173
18 2HD PRO 2 2HD PRO 2 -17.926 1.004 3.030
19 H GLY 3 H GLY 3 -14.558 2.072 4.776
20 1HA GLY 3 1HA GLY 3 -12.472 4.055 4.182
21 2HA GLY 3 2HA GLY 3 -13.165 3.723 5.772
22 H THR 4 H THR 4 -12.658 0.753 5.208
23 HA THR 4 HA THR 4 -9.700 0.776 5.637
24 HB THR 4 HB THR 4 -10.962 0.494 7.787
25 HG1 THR 4 HG1 THR 4 -9.096 -0.489 7.987
26 1HG2 THR 4 1HG2 THR 4 -11.913 -2.053 6.445
27 2HG2 THR 4 2HG2 THR 4 -12.181 -1.623 8.134
28 3HG2 THR 4 3HG2 THR 4 -12.924 -0.666 6.853
29 H ILE 5 H ILE 5 -12.542 -0.936 4.451
30 HA ILE 5 HA ILE 5 -11.215 -3.349 3.650
31 HB ILE 5 HB ILE 5 -13.665 -2.010 2.461
32 1HG1 ILE 5 1HG1 ILE 5 -13.676 -2.553 4.956
33 2HG1 ILE 5 2HG1 ILE 5 -14.945 -3.324 4.005
34 1HG2 ILE 5 1HG2 ILE 5 -12.346 -4.672 2.075
35 2HG2 ILE 5 2HG2 ILE 5 -14.107 -4.589 2.029
36 3HG2 ILE 5 3HG2 ILE 5 -13.150 -3.639 0.892
37 1HD1 ILE 5 1HD1 ILE 5 -12.384 -4.816 4.245
38 2HD1 ILE 5 2HD1 ILE 5 -13.364 -4.699 5.707
39 3HD1 ILE 5 3HD1 ILE 5 -14.042 -5.417 4.247
40 H LYS 6 H LYS 6 -11.104 -0.155 2.395
41 HA LYS 6 HA LYS 6 -9.718 -1.201 -0.038
42 1HB LYS 6 1HB LYS 6 -12.035 -0.148 -0.423
43 2HB LYS 6 2HB LYS 6 -11.276 1.386 0.006
44 1HG LYS 6 1HG LYS 6 -10.786 1.486 -2.217
45 2HG LYS 6 2HG LYS 6 -9.463 0.405 -1.779
46 1HD LYS 6 1HD LYS 6 -11.650 -1.300 -2.075
47 2HD LYS 6 2HD LYS 6 -11.831 -0.140 -3.392
48 1HE LYS 6 1HE LYS 6 -9.114 -1.319 -2.867
49 2HE LYS 6 2HE LYS 6 -10.318 -2.269 -3.760
50 1HZ LYS 6 1HZ LYS 6 -10.709 -0.059 -5.005
51 2HZ LYS 6 2HZ LYS 6 -9.164 0.358 -4.435
52 3HZ LYS 6 3HZ LYS 6 -9.361 -1.004 -5.425
53 H GLU 7 H GLU 7 -9.843 1.190 2.530
54 HA GLU 7 HA GLU 7 -7.551 2.689 1.482
55 1HB GLU 7 1HB GLU 7 -9.561 3.093 3.481
56 2HB GLU 7 2HB GLU 7 -7.979 3.236 4.250
57 1HG GLU 7 1HG GLU 7 -7.511 5.172 3.173
58 2HG GLU 7 2HG GLU 7 -8.101 4.550 1.632
59 H ASN 8 H ASN 8 -8.118 0.069 3.747
60 HA ASN 8 HA ASN 8 -5.567 0.190 5.071
61 1HB ASN 8 1HB ASN 8 -7.730 -1.159 5.683
62 2HB ASN 8 2HB ASN 8 -7.049 -2.388 4.618
63 1HD2 ASN 8 2HD2 ASN 8 -5.390 -0.146 6.901
64 2HD2 ASN 8 1HD2 ASN 8 -4.649 -1.379 7.803
65 H ILE 9 H ILE 9 -6.757 -1.774 2.330
66 HA ILE 9 HA ILE 9 -4.336 -3.147 1.801
67 HB ILE 9 HB ILE 9 -6.427 -2.207 -0.187
68 1HG1 ILE 9 1HG1 ILE 9 -7.334 -3.552 1.702
69 2HG1 ILE 9 2HG1 ILE 9 -7.428 -4.419 0.169
70 1HG2 ILE 9 1HG2 ILE 9 -4.292 -4.355 -0.312
71 2HG2 ILE 9 2HG2 ILE 9 -5.606 -4.202 -1.479
72 3HG2 ILE 9 3HG2 ILE 9 -4.407 -2.918 -1.327
73 1HD1 ILE 9 1HD1 ILE 9 -4.887 -5.031 1.212
74 2HD1 ILE 9 2HD1 ILE 9 -5.994 -5.140 2.581
75 3HD1 ILE 9 3HD1 ILE 9 -6.285 -6.104 1.133
76 H ILE 10 H ILE 10 -5.437 0.072 0.779
77 HA ILE 10 HA ILE 10 -3.429 0.668 -1.109
78 HB ILE 10 HB ILE 10 -4.822 2.427 0.928
79 1HG1 ILE 10 1HG1 ILE 10 -5.100 2.174 -2.085
80 2HG1 ILE 10 2HG1 ILE 10 -6.173 1.407 -0.913
81 1HG2 ILE 10 1HG2 ILE 10 -2.612 3.390 0.328
82 2HG2 ILE 10 2HG2 ILE 10 -3.039 3.267 -1.379
83 3HG2 ILE 10 3HG2 ILE 10 -3.943 4.350 -0.320
84 1HD1 ILE 10 1HD1 ILE 10 -6.448 3.816 0.050
85 2HD1 ILE 10 2HD1 ILE 10 -5.827 4.335 -1.518
86 3HD1 ILE 10 3HD1 ILE 10 -7.314 3.392 -1.426
87 H GLY 11 H GLY 11 -3.354 0.980 2.442
88 1HA GLY 11 1HA GLY 11 -0.639 1.971 2.524
89 2HA GLY 11 2HA GLY 11 -1.523 1.288 3.892
90 H VAL 12 H VAL 12 -1.986 -1.086 1.875
91 HA VAL 12 HA VAL 12 0.476 -2.528 2.713
92 HB VAL 12 HB VAL 12 -2.221 -3.472 1.703
93 1HG1 VAL 12 1HG1 VAL 12 0.403 -4.829 1.844
94 2HG1 VAL 12 2HG1 VAL 12 -0.932 -5.715 2.580
95 3HG1 VAL 12 3HG1 VAL 12 -1.023 -5.230 0.887
96 1HG2 VAL 12 1HG2 VAL 12 -1.181 -2.852 4.279
97 2HG2 VAL 12 2HG2 VAL 12 -2.736 -3.588 3.894
98 3HG2 VAL 12 3HG2 VAL 12 -1.328 -4.607 4.190
99 H SER 13 H SER 13 -0.901 -1.023 -0.006
100 HA SER 13 HA SER 13 0.926 -2.560 -1.812
101 1HB SER 13 1HB SER 13 -0.627 -2.347 -3.576
102 2HB SER 13 2HB SER 13 -1.642 -2.705 -2.182
103 HG SER 13 HG SER 13 -2.119 -0.533 -2.009
104 H TYR 14 H TYR 14 -0.357 0.605 -0.902
105 HA TYR 14 HA TYR 14 1.245 2.037 -2.871
106 1HB TYR 14 1HB TYR 14 -0.956 2.713 -1.435
107 2HB TYR 14 2HB TYR 14 0.298 3.468 -0.451
108 HD1 TYR 14 HD1 TYR 14 -1.077 3.248 -3.905
109 HD2 TYR 14 HD2 TYR 14 1.436 5.426 -1.185
110 HE1 TYR 14 HE1 TYR 14 -0.888 5.089 -5.554
111 HE2 TYR 14 HE2 TYR 14 1.626 7.267 -2.836
112 HH TYR 14 HH TYR 14 0.386 6.943 -6.097
113 H ASP 15 H ASP 15 1.494 1.378 0.622
114 HA ASP 15 HA ASP 15 3.871 2.900 1.071
115 1HB ASP 15 1HB ASP 15 2.469 0.661 2.462
116 2HB ASP 15 2HB ASP 15 4.147 0.968 2.907
117 H GLU 16 H GLU 16 3.486 -0.616 0.484
118 HA GLU 16 HA GLU 16 6.236 -1.249 0.315
119 1HB GLU 16 1HB GLU 16 3.795 -2.580 -0.170
120 2HB GLU 16 2HB GLU 16 4.720 -2.722 -1.666
121 1HG GLU 16 1HG GLU 16 6.703 -3.403 -0.173
122 2HG GLU 16 2HG GLU 16 5.511 -3.612 1.110
123 H TYR 17 H TYR 17 4.000 -0.118 -2.218
124 HA TYR 17 HA TYR 17 5.876 -0.191 -4.369
125 1HB TYR 17 1HB TYR 17 3.921 0.324 -5.394
126 2HB TYR 17 2HB TYR 17 3.200 0.847 -3.877
127 HD1 TYR 17 HD1 TYR 17 5.771 2.025 -6.345
128 HD2 TYR 17 HD2 TYR 17 2.546 3.078 -3.714
129 HE1 TYR 17 HE1 TYR 17 5.929 4.384 -7.099
130 HE2 TYR 17 HE2 TYR 17 2.700 5.437 -4.469
131 HH TYR 17 HH TYR 17 4.805 6.382 -7.126
132 H ARG 18 H ARG 18 4.813 2.588 -2.388
133 HA ARG 18 HA ARG 18 6.802 4.405 -3.296
134 1HB ARG 18 1HB ARG 18 4.673 4.581 -1.599
135 2HB ARG 18 2HB ARG 18 6.008 4.612 -0.448
136 1HG ARG 18 1HG ARG 18 7.051 6.378 -2.047
137 2HG ARG 18 2HG ARG 18 5.418 6.529 -2.696
138 1HD ARG 18 1HD ARG 18 5.768 6.611 0.274
139 2HD ARG 18 2HD ARG 18 6.221 8.039 -0.658
140 HE ARG 18 HE ARG 18 3.827 7.873 -1.615
141 1HH1 ARG 18 1HH1 ARG 18 3.067 5.441 -0.028
142 2HH1 ARG 18 2HH1 ARG 18 2.248 6.139 1.330
143 1HH2 ARG 18 1HH2 ARG 18 3.512 9.321 0.798
144 2HH2 ARG 18 2HH2 ARG 18 2.500 8.332 1.796
145 H TYR 19 H TYR 19 7.058 1.614 -1.343
146 HA TYR 19 HA TYR 19 9.577 2.489 -0.069
147 1HB TYR 19 1HB TYR 19 7.618 0.247 0.266
148 2HB TYR 19 2HB TYR 19 9.267 0.022 0.826
149 HD1 TYR 19 HD1 TYR 19 7.369 3.213 0.732
150 HD2 TYR 19 HD2 TYR 19 8.959 0.072 3.189
151 HE1 TYR 19 HE1 TYR 19 6.852 4.540 2.765
152 HE2 TYR 19 HE2 TYR 19 8.444 1.396 5.223
153 HH TYR 19 HH TYR 19 7.850 3.444 5.979
154 H ARG 20 H ARG 20 8.342 0.408 -2.612
155 HA ARG 20 HA ARG 20 10.664 -1.243 -2.929
156 1HB ARG 20 1HB ARG 20 8.170 -0.762 -4.342
157 2HB ARG 20 2HB ARG 20 9.514 -0.967 -5.467
158 1HG ARG 20 1HG ARG 20 9.800 -2.898 -3.376
159 2HG ARG 20 2HG ARG 20 8.147 -2.986 -3.986
160 1HD ARG 20 1HD ARG 20 9.725 -2.698 -6.279
161 2HD ARG 20 2HD ARG 20 10.621 -3.827 -5.261
162 HE ARG 20 HE ARG 20 7.927 -4.288 -6.398
163 1HH1 ARG 20 1HH2 ARG 20 10.479 -6.047 -6.498
164 2HH1 ARG 20 2HH2 ARG 20 9.999 -7.341 -5.451
165 1HH2 ARG 20 1HH1 ARG 20 7.310 -5.610 -4.108
166 2HH2 ARG 20 2HH1 ARG 20 8.206 -7.093 -4.095
167 H SER 21 H SER 21 10.229 2.072 -3.506
168 HA SER 21 HA SER 21 12.479 2.077 -5.466
169 1HB SER 21 1HB SER 21 10.214 3.204 -6.030
170 2HB SER 21 2HB SER 21 10.704 4.438 -4.874
171 HG SER 21 HG SER 21 11.957 5.205 -6.362
172 H VAL 22 H VAL 22 12.267 2.056 -2.357
173 HA VAL 22 HA VAL 22 14.425 4.022 -1.961
174 HB VAL 22 HB VAL 22 12.740 5.397 -1.241
175 1HG1 VAL 22 1HG1 VAL 22 11.251 2.845 -0.800
176 2HG1 VAL 22 2HG1 VAL 22 10.678 4.319 -0.017
177 3HG1 VAL 22 3HG1 VAL 22 10.809 4.247 -1.775
178 1HG2 VAL 22 1HG2 VAL 22 14.177 4.682 0.766
179 2HG2 VAL 22 2HG2 VAL 22 12.623 5.424 1.144
180 3HG2 VAL 22 3HG2 VAL 22 12.811 3.673 1.240
181 H ILE 23 H ILE 23 12.462 1.369 -0.621
182 HA ILE 23 HA ILE 23 14.530 0.762 1.384
183 HB ILE 23 HB ILE 23 12.181 -1.006 0.725
184 1HG1 ILE 23 1HG1 ILE 23 11.480 1.443 0.912
185 2HG1 ILE 23 2HG1 ILE 23 10.739 0.353 2.078
186 1HG2 ILE 23 1HG2 ILE 23 13.726 -0.313 3.240
187 2HG2 ILE 23 2HG2 ILE 23 12.298 -1.348 3.210
188 3HG2 ILE 23 3HG2 ILE 23 13.765 -1.843 2.365
189 1HD1 ILE 23 1HD1 ILE 23 13.293 1.799 2.746
190 2HD1 ILE 23 2HD1 ILE 23 11.731 2.592 2.950
191 3HD1 ILE 23 3HD1 ILE 23 12.093 1.115 3.843
192 H LYS 24 H LYS 24 12.901 -1.359 -1.002
193 HA LYS 24 HA LYS 24 15.163 -3.148 -1.113
194 1HB LYS 24 1HB LYS 24 12.557 -3.385 -1.827
195 2HB LYS 24 2HB LYS 24 13.284 -3.099 -3.409
196 1HG LYS 24 1HG LYS 24 14.987 -4.918 -2.061
197 2HG LYS 24 2HG LYS 24 13.339 -5.499 -1.820
198 1HD LYS 24 1HD LYS 24 13.636 -4.602 -4.537
199 2HD LYS 24 2HD LYS 24 14.928 -5.742 -4.155
200 1HE LYS 24 1HE LYS 24 12.972 -7.151 -3.072
201 2HE LYS 24 2HE LYS 24 11.957 -6.191 -4.167
202 1HZ LYS 24 1HZ LYS 24 13.745 -6.729 -5.896
203 2HZ LYS 24 2HZ LYS 24 14.218 -7.972 -4.839
204 3HZ LYS 24 3HZ LYS 24 12.651 -7.963 -5.486
205 H ALA 25 H ALA 25 15.907 -3.653 -3.598
206 HA ALA 25 HA ALA 25 17.670 -1.554 -4.319
207 1HB ALA 25 1HB ALA 25 17.593 -4.099 -5.024
208 2HB ALA 25 2HB ALA 25 16.683 -3.476 -6.400
209 3HB ALA 25 3HB ALA 25 18.324 -2.906 -6.098
Start of MODEL 3
1 1H MET 1 1H MET 1 -18.329 0.437 10.951
2 2H MET 1 2H MET 1 -16.867 0.067 11.733
3 3H MET 1 3H MET 1 -17.130 1.628 11.125
4 HA MET 1 HA MET 1 -15.807 0.764 9.468
5 1HB MET 1 1HB MET 1 -16.160 -1.485 10.860
6 2HB MET 1 2HB MET 1 -17.232 -1.869 9.513
7 1HG MET 1 1HG MET 1 -15.483 -1.733 7.929
8 2HG MET 1 2HG MET 1 -14.433 -0.848 9.035
9 1HE MET 1 1HE MET 1 -16.089 -3.763 7.871
10 2HE MET 1 2HE MET 1 -14.513 -4.453 7.494
11 3HE MET 1 3HE MET 1 -15.514 -5.193 8.741
12 HA PRO 2 HA PRO 2 -19.726 1.602 7.188
13 1HB PRO 2 1HB PRO 2 -18.839 3.901 6.001
14 2HB PRO 2 2HB PRO 2 -19.581 3.870 7.613
15 1HG PRO 2 1HG PRO 2 -16.714 4.051 6.854
16 2HG PRO 2 2HG PRO 2 -17.582 4.826 8.187
17 1HD PRO 2 1HD PRO 2 -15.980 2.618 8.472
18 2HD PRO 2 2HD PRO 2 -17.314 3.034 9.571
19 H GLY 3 H GLY 3 -16.631 0.634 6.494
20 1HA GLY 3 1HA GLY 3 -16.726 -0.804 4.320
21 2HA GLY 3 2HA GLY 3 -17.017 0.753 3.540
22 H THR 4 H THR 4 -15.233 1.794 2.821
23 HA THR 4 HA THR 4 -12.941 2.088 2.338
24 HB THR 4 HB THR 4 -13.241 3.628 4.199
25 HG1 THR 4 HG1 THR 4 -10.944 2.222 3.801
26 1HG2 THR 4 1HG2 THR 4 -12.780 1.178 5.913
27 2HG2 THR 4 2HG2 THR 4 -12.778 2.829 6.532
28 3HG2 THR 4 3HG2 THR 4 -14.246 2.154 5.827
29 H ILE 5 H ILE 5 -13.822 -0.706 2.755
30 HA ILE 5 HA ILE 5 -11.718 -2.060 4.241
31 HB ILE 5 HB ILE 5 -13.565 -3.213 2.130
32 1HG1 ILE 5 1HG1 ILE 5 -13.997 -3.101 5.129
33 2HG1 ILE 5 2HG1 ILE 5 -14.720 -1.947 4.008
34 1HG2 ILE 5 1HG2 ILE 5 -11.444 -4.426 3.200
35 2HG2 ILE 5 2HG2 ILE 5 -12.566 -4.683 4.536
36 3HG2 ILE 5 3HG2 ILE 5 -12.953 -5.298 2.930
37 1HD1 ILE 5 1HD1 ILE 5 -15.414 -4.245 2.777
38 2HD1 ILE 5 2HD1 ILE 5 -15.358 -4.818 4.443
39 3HD1 ILE 5 3HD1 ILE 5 -16.423 -3.482 4.005
40 H LYS 6 H LYS 6 -11.965 -0.690 1.102
41 HA LYS 6 HA LYS 6 -9.618 -2.284 0.173
42 1HB LYS 6 1HB LYS 6 -10.204 -1.624 -2.072
43 2HB LYS 6 2HB LYS 6 -11.679 -2.189 -1.289
44 1HG LYS 6 1HG LYS 6 -12.073 0.280 -0.655
45 2HG LYS 6 2HG LYS 6 -10.834 0.653 -1.854
46 1HD LYS 6 1HD LYS 6 -12.428 -1.121 -3.223
47 2HD LYS 6 2HD LYS 6 -13.609 -0.244 -2.248
48 1HE LYS 6 1HE LYS 6 -12.360 1.899 -3.061
49 2HE LYS 6 2HE LYS 6 -11.713 0.841 -4.330
50 1HZ LYS 6 1HZ LYS 6 -14.506 0.412 -3.865
51 2HZ LYS 6 2HZ LYS 6 -14.185 2.010 -4.334
52 3HZ LYS 6 3HZ LYS 6 -13.690 0.722 -5.323
53 H GLU 7 H GLU 7 -10.757 0.962 0.901
54 HA GLU 7 HA GLU 7 -8.592 2.422 -0.262
55 1HB GLU 7 1HB GLU 7 -10.389 3.000 2.107
56 2HB GLU 7 2HB GLU 7 -9.182 4.148 1.524
57 1HG GLU 7 1HG GLU 7 -10.643 3.205 -0.739
58 2HG GLU 7 2HG GLU 7 -11.811 3.673 0.497
59 H ASN 8 H ASN 8 -8.800 0.423 2.564
60 HA ASN 8 HA ASN 8 -6.424 1.556 3.846
61 1HB ASN 8 1HB ASN 8 -8.100 0.526 5.269
62 2HB ASN 8 2HB ASN 8 -8.004 -0.981 4.360
63 1HD2 ASN 8 2HD2 ASN 8 -5.617 1.238 5.940
64 2HD2 ASN 8 1HD2 ASN 8 -4.750 -0.008 6.700
65 H ILE 9 H ILE 9 -7.176 -1.540 2.201
66 HA ILE 9 HA ILE 9 -4.481 -2.500 2.207
67 HB ILE 9 HB ILE 9 -6.667 -3.103 0.193
68 1HG1 ILE 9 1HG1 ILE 9 -7.484 -3.510 2.450
69 2HG1 ILE 9 2HG1 ILE 9 -7.110 -5.061 1.698
70 1HG2 ILE 9 1HG2 ILE 9 -3.961 -3.888 0.312
71 2HG2 ILE 9 2HG2 ILE 9 -4.885 -5.274 0.889
72 3HG2 ILE 9 3HG2 ILE 9 -5.227 -4.586 -0.699
73 1HD1 ILE 9 1HD1 ILE 9 -4.762 -4.761 2.783
74 2HD1 ILE 9 2HD1 ILE 9 -5.563 -3.573 3.811
75 3HD1 ILE 9 3HD1 ILE 9 -6.106 -5.251 3.814
76 H ILE 10 H ILE 10 -6.335 -0.707 -0.269
77 HA ILE 10 HA ILE 10 -4.455 -0.619 -2.325
78 HB ILE 10 HB ILE 10 -6.344 1.516 -1.312
79 1HG1 ILE 10 1HG1 ILE 10 -6.441 -0.032 -3.901
80 2HG1 ILE 10 2HG1 ILE 10 -7.099 -0.708 -2.411
81 1HG2 ILE 10 1HG2 ILE 10 -4.466 1.544 -3.682
82 2HG2 ILE 10 2HG2 ILE 10 -5.923 2.537 -3.627
83 3HG2 ILE 10 3HG2 ILE 10 -4.651 2.770 -2.427
84 1HD1 ILE 10 1HD1 ILE 10 -8.000 2.003 -2.661
85 2HD1 ILE 10 2HD1 ILE 10 -8.333 1.158 -4.172
86 3HD1 ILE 10 3HD1 ILE 10 -8.964 0.525 -2.651
87 H GLY 11 H GLY 11 -4.373 1.006 0.778
88 1HA GLY 11 1HA GLY 11 -2.120 2.728 0.033
89 2HA GLY 11 2HA GLY 11 -2.803 2.556 1.653
90 H VAL 12 H VAL 12 -2.613 -0.455 1.337
91 HA VAL 12 HA VAL 12 -0.073 -0.806 2.623
92 HB VAL 12 HB VAL 12 -1.932 -2.808 1.304
93 1HG1 VAL 12 1HG1 VAL 12 0.712 -3.085 2.605
94 2HG1 VAL 12 2HG1 VAL 12 -0.527 -4.201 3.180
95 3HG1 VAL 12 3HG1 VAL 12 -0.102 -4.161 1.469
96 1HG2 VAL 12 1HG2 VAL 12 -2.547 -1.329 3.415
97 2HG2 VAL 12 2HG2 VAL 12 -2.942 -3.048 3.386
98 3HG2 VAL 12 3HG2 VAL 12 -1.514 -2.484 4.257
99 H SER 13 H SER 13 -1.143 -1.109 -0.727
100 HA SER 13 HA SER 13 1.336 -2.318 -1.655
101 1HB SER 13 1HB SER 13 -1.219 -1.565 -2.785
102 2HB SER 13 2HB SER 13 0.093 -0.987 -3.811
103 HG SER 13 HG SER 13 0.907 -3.295 -3.274
104 H TYR 14 H TYR 14 0.120 0.954 -1.237
105 HA TYR 14 HA TYR 14 1.965 2.372 -2.848
106 1HB TYR 14 1HB TYR 14 0.475 3.021 -0.321
107 2HB TYR 14 2HB TYR 14 1.676 4.154 -0.940
108 HD1 TYR 14 HD1 TYR 14 -0.586 1.886 -2.857
109 HD2 TYR 14 HD2 TYR 14 0.381 5.935 -1.800
110 HE1 TYR 14 HE1 TYR 14 -2.221 2.712 -4.529
111 HE2 TYR 14 HE2 TYR 14 -1.253 6.762 -3.473
112 HH TYR 14 HH TYR 14 -3.443 5.723 -4.571
113 H ASP 15 H ASP 15 2.261 1.294 0.541
114 HA ASP 15 HA ASP 15 4.811 2.388 1.078
115 1HB ASP 15 1HB ASP 15 3.336 -0.031 2.088
116 2HB ASP 15 2HB ASP 15 5.001 0.257 2.593
117 H GLU 16 H GLU 16 3.954 -0.764 -0.360
118 HA GLU 16 HA GLU 16 6.527 -1.851 -0.660
119 1HB GLU 16 1HB GLU 16 3.982 -2.492 -1.569
120 2HB GLU 16 2HB GLU 16 4.874 -2.185 -3.059
121 1HG GLU 16 1HG GLU 16 5.974 -4.137 -2.862
122 2HG GLU 16 2HG GLU 16 6.512 -3.711 -1.237
123 H TYR 17 H TYR 17 4.830 0.492 -2.726
124 HA TYR 17 HA TYR 17 6.906 0.701 -4.699
125 1HB TYR 17 1HB TYR 17 5.117 1.784 -5.603
126 2HB TYR 17 2HB TYR 17 4.404 2.082 -4.023
127 HD1 TYR 17 HD1 TYR 17 7.551 3.182 -5.760
128 HD2 TYR 17 HD2 TYR 17 4.002 4.341 -3.636
129 HE1 TYR 17 HE1 TYR 17 8.245 5.558 -5.897
130 HE2 TYR 17 HE2 TYR 17 4.698 6.719 -3.772
131 HH TYR 17 HH TYR 17 7.180 7.793 -5.820
132 H ARG 18 H ARG 18 6.033 2.995 -2.096
133 HA ARG 18 HA ARG 18 8.386 4.553 -2.230
134 1HB ARG 18 1HB ARG 18 6.178 4.759 -0.755
135 2HB ARG 18 2HB ARG 18 7.190 3.961 0.450
136 1HG ARG 18 1HG ARG 18 8.396 5.835 0.806
137 2HG ARG 18 2HG ARG 18 8.617 6.100 -0.924
138 1HD ARG 18 1HD ARG 18 5.907 6.642 -0.456
139 2HD ARG 18 2HD ARG 18 6.758 7.382 0.900
140 HE ARG 18 HE ARG 18 7.446 7.971 -1.954
141 1HH1 ARG 18 1HH1 ARG 18 8.156 8.641 1.264
142 2HH1 ARG 18 2HH1 ARG 18 8.104 10.364 1.098
143 1HH2 ARG 18 1HH2 ARG 18 6.884 10.279 -2.145
144 2HH2 ARG 18 2HH2 ARG 18 7.385 11.291 -0.832
145 H TYR 19 H TYR 19 7.881 1.340 -1.109
146 HA TYR 19 HA TYR 19 10.347 1.233 0.477
147 1HB TYR 19 1HB TYR 19 8.132 -0.664 -0.265
148 2HB TYR 19 2HB TYR 19 9.623 -1.274 0.420
149 HD1 TYR 19 HD1 TYR 19 9.810 1.601 2.050
150 HD2 TYR 19 HD2 TYR 19 7.024 -1.660 1.759
151 HE1 TYR 19 HE1 TYR 19 8.957 2.128 4.309
152 HE2 TYR 19 HE2 TYR 19 6.173 -1.129 4.024
153 HH TYR 19 HH TYR 19 6.290 1.426 5.476
154 H ARG 20 H ARG 20 9.246 0.638 -2.755
155 HA ARG 20 HA ARG 20 11.253 -1.255 -3.555
156 1HB ARG 20 1HB ARG 20 9.192 -0.840 -4.857
157 2HB ARG 20 2HB ARG 20 9.762 0.788 -5.228
158 1HG ARG 20 1HG ARG 20 10.351 -0.536 -7.120
159 2HG ARG 20 2HG ARG 20 11.847 -0.323 -6.209
160 1HD ARG 20 1HD ARG 20 11.646 -2.664 -6.848
161 2HD ARG 20 2HD ARG 20 11.433 -2.528 -5.103
162 HE ARG 20 HE ARG 20 8.872 -2.367 -6.360
163 1HH1 ARG 20 1HH1 ARG 20 10.972 -4.655 -7.356
164 2HH1 ARG 20 2HH1 ARG 20 10.192 -6.012 -6.617
165 1HH2 ARG 20 1HH2 ARG 20 8.055 -4.072 -4.693
166 2HH2 ARG 20 2HH2 ARG 20 8.539 -5.682 -5.109
167 H SER 21 H SER 21 11.398 2.143 -2.931
168 HA SER 21 HA SER 21 13.971 2.328 -4.428
169 1HB SER 21 1HB SER 21 12.036 4.049 -4.706
170 2HB SER 21 2HB SER 21 12.573 4.662 -3.144
171 HG SER 21 HG SER 21 14.437 4.177 -5.191
172 H VAL 22 H VAL 22 13.275 1.210 -1.609
173 HA VAL 22 HA VAL 22 15.628 2.393 -0.301
174 HB VAL 22 HB VAL 22 14.132 3.789 0.720
175 1HG1 VAL 22 1HG1 VAL 22 12.113 1.647 0.152
176 2HG1 VAL 22 2HG1 VAL 22 11.729 2.989 1.230
177 3HG1 VAL 22 3HG1 VAL 22 12.167 3.302 -0.450
178 1HG2 VAL 22 1HG2 VAL 22 15.007 1.928 2.383
179 2HG2 VAL 22 2HG2 VAL 22 13.799 3.096 2.923
180 3HG2 VAL 22 3HG2 VAL 22 13.302 1.476 2.435
181 H ILE 23 H ILE 23 12.965 0.015 -0.055
182 HA ILE 23 HA ILE 23 14.507 -1.690 1.741
183 HB ILE 23 HB ILE 23 12.053 -2.501 0.181
184 1HG1 ILE 23 1HG1 ILE 23 11.738 -0.247 1.271
185 2HG1 ILE 23 2HG1 ILE 23 10.688 -1.501 1.920
186 1HG2 ILE 23 1HG2 ILE 23 13.679 -3.679 2.215
187 2HG2 ILE 23 2HG2 ILE 23 12.107 -3.310 2.923
188 3HG2 ILE 23 3HG2 ILE 23 12.209 -4.327 1.486
189 1HD1 ILE 23 1HD1 ILE 23 13.360 -0.857 3.168
190 2HD1 ILE 23 2HD1 ILE 23 11.884 -0.012 3.633
191 3HD1 ILE 23 3HD1 ILE 23 12.016 -1.753 3.875
192 H LYS 24 H LYS 24 13.132 -2.384 -1.502
193 HA LYS 24 HA LYS 24 15.126 -4.483 -1.912
194 1HB LYS 24 1HB LYS 24 12.826 -4.690 -2.814
195 2HB LYS 24 2HB LYS 24 13.120 -3.297 -3.855
196 1HG LYS 24 1HG LYS 24 15.292 -5.111 -4.209
197 2HG LYS 24 2HG LYS 24 13.797 -6.036 -4.335
198 1HD LYS 24 1HD LYS 24 13.470 -5.208 -6.400
199 2HD LYS 24 2HD LYS 24 13.400 -3.580 -5.725
200 1HE LYS 24 1HE LYS 24 15.718 -3.210 -6.069
201 2HE LYS 24 2HE LYS 24 16.047 -4.943 -6.272
202 1HZ LYS 24 1HZ LYS 24 14.200 -4.608 -8.131
203 2HZ LYS 24 2HZ LYS 24 14.872 -3.048 -8.153
204 3HZ LYS 24 3HZ LYS 24 15.856 -4.397 -8.450
205 H ALA 25 H ALA 25 15.076 -1.119 -2.331
206 HA ALA 25 HA ALA 25 17.421 -1.320 -4.175
207 1HB ALA 25 1HB ALA 25 15.127 -0.334 -5.074
208 2HB ALA 25 2HB ALA 25 15.667 1.109 -4.216
209 3HB ALA 25 3HB ALA 25 16.659 0.426 -5.504
Start of MODEL 4
1 1H MET 1 1H MET 1 -19.750 3.014 8.775
2 2H MET 1 2H MET 1 -21.131 3.232 7.810
3 3H MET 1 3H MET 1 -20.915 1.786 8.676
4 HA MET 1 HA MET 1 -19.971 0.907 6.867
5 1HB MET 1 1HB MET 1 -19.647 2.402 4.887
6 2HB MET 1 2HB MET 1 -21.235 2.605 5.629
7 1HG MET 1 1HG MET 1 -20.813 4.767 6.099
8 2HG MET 1 2HG MET 1 -19.292 4.350 6.887
9 1HE MET 1 1HE MET 1 -20.793 6.442 4.582
10 2HE MET 1 2HE MET 1 -19.393 7.081 5.439
11 3HE MET 1 3HE MET 1 -19.419 7.060 3.669
12 HA PRO 2 HA PRO 2 -15.877 2.587 8.379
13 1HB PRO 2 1HB PRO 2 -15.317 0.693 10.264
14 2HB PRO 2 2HB PRO 2 -16.219 2.176 10.626
15 1HG PRO 2 1HG PRO 2 -17.197 -0.592 10.292
16 2HG PRO 2 2HG PRO 2 -17.828 0.719 11.296
17 1HD PRO 2 1HD PRO 2 -18.875 -0.117 8.848
18 2HD PRO 2 2HD PRO 2 -19.241 1.413 9.673
19 H GLY 3 H GLY 3 -17.018 0.212 6.531
20 1HA GLY 3 1HA GLY 3 -15.247 -1.943 6.504
21 2HA GLY 3 2HA GLY 3 -15.961 -1.265 5.040
22 H THR 4 H THR 4 -13.057 -1.975 6.427
23 HA THR 4 HA THR 4 -11.670 0.281 5.034
24 HB THR 4 HB THR 4 -11.101 0.185 7.403
25 HG1 THR 4 HG1 THR 4 -8.985 0.243 7.078
26 1HG2 THR 4 1HG2 THR 4 -10.493 -2.719 6.804
27 2HG2 THR 4 2HG2 THR 4 -9.980 -1.902 8.281
28 3HG2 THR 4 3HG2 THR 4 -11.698 -2.090 7.927
29 H ILE 5 H ILE 5 -12.711 -2.018 3.643
30 HA ILE 5 HA ILE 5 -10.430 -3.801 3.144
31 HB ILE 5 HB ILE 5 -12.864 -3.698 1.391
32 1HG1 ILE 5 1HG1 ILE 5 -13.837 -3.505 3.597
33 2HG1 ILE 5 2HG1 ILE 5 -13.991 -5.190 3.099
34 1HG2 ILE 5 1HG2 ILE 5 -10.858 -5.295 1.140
35 2HG2 ILE 5 2HG2 ILE 5 -11.447 -6.072 2.609
36 3HG2 ILE 5 3HG2 ILE 5 -12.462 -6.028 1.168
37 1HD1 ILE 5 1HD1 ILE 5 -11.891 -5.706 4.358
38 2HD1 ILE 5 2HD1 ILE 5 -11.873 -4.042 4.942
39 3HD1 ILE 5 3HD1 ILE 5 -13.191 -5.122 5.397
40 H LYS 6 H LYS 6 -11.470 -0.763 2.032
41 HA LYS 6 HA LYS 6 -9.882 -1.086 -0.485
42 1HB LYS 6 1HB LYS 6 -12.031 0.950 0.181
43 2HB LYS 6 2HB LYS 6 -11.145 0.857 -1.342
44 1HG LYS 6 1HG LYS 6 -12.464 -0.804 -2.108
45 2HG LYS 6 2HG LYS 6 -12.298 -1.717 -0.607
46 1HD LYS 6 1HD LYS 6 -14.045 0.730 -0.692
47 2HD LYS 6 2HD LYS 6 -14.660 -0.815 -1.281
48 1HE LYS 6 1HE LYS 6 -13.571 -1.622 1.076
49 2HE LYS 6 2HE LYS 6 -14.060 0.032 1.501
50 1HZ LYS 6 1HZ LYS 6 -16.193 -0.564 0.225
51 2HZ LYS 6 2HZ LYS 6 -15.723 -2.178 0.470
52 3HZ LYS 6 3HZ LYS 6 -16.006 -1.168 1.802
53 H GLU 7 H GLU 7 -10.170 0.585 2.537
54 HA GLU 7 HA GLU 7 -8.301 2.721 1.757
55 1HB GLU 7 1HB GLU 7 -10.178 3.090 3.390
56 2HB GLU 7 2HB GLU 7 -9.343 2.017 4.514
57 1HG GLU 7 1HG GLU 7 -7.554 4.047 3.429
58 2HG GLU 7 2HG GLU 7 -8.934 4.764 4.261
59 H ASN 8 H ASN 8 -8.083 -0.490 2.840
60 HA ASN 8 HA ASN 8 -5.454 -0.060 4.146
61 1HB ASN 8 1HB ASN 8 -7.209 -1.632 5.109
62 2HB ASN 8 2HB ASN 8 -6.908 -2.682 3.723
63 1HD2 ASN 8 2HD2 ASN 8 -5.798 -1.861 6.868
64 2HD2 ASN 8 1HD2 ASN 8 -4.336 -2.722 6.825
65 H ILE 9 H ILE 9 -6.869 -1.960 1.468
66 HA ILE 9 HA ILE 9 -4.386 -2.953 0.468
67 HB ILE 9 HB ILE 9 -6.946 -2.351 -1.048
68 1HG1 ILE 9 1HG1 ILE 9 -7.309 -3.852 0.864
69 2HG1 ILE 9 2HG1 ILE 9 -7.413 -4.760 -0.645
70 1HG2 ILE 9 1HG2 ILE 9 -4.442 -3.903 -1.693
71 2HG2 ILE 9 2HG2 ILE 9 -5.981 -4.320 -2.446
72 3HG2 ILE 9 3HG2 ILE 9 -5.289 -2.716 -2.685
73 1HD1 ILE 9 1HD1 ILE 9 -4.985 -5.374 -0.352
74 2HD1 ILE 9 2HD1 ILE 9 -5.050 -4.632 1.247
75 3HD1 ILE 9 3HD1 ILE 9 -6.049 -6.040 0.886
76 H ILE 10 H ILE 10 -6.123 0.076 -0.103
77 HA ILE 10 HA ILE 10 -4.773 1.048 -2.349
78 HB ILE 10 HB ILE 10 -6.614 2.155 -0.839
79 1HG1 ILE 10 1HG1 ILE 10 -4.432 3.869 -2.061
80 2HG1 ILE 10 2HG1 ILE 10 -5.677 3.037 -2.992
81 1HG2 ILE 10 1HG2 ILE 10 -5.045 2.286 1.145
82 2HG2 ILE 10 2HG2 ILE 10 -4.136 3.509 0.259
83 3HG2 ILE 10 3HG2 ILE 10 -5.812 3.814 0.714
84 1HD1 ILE 10 1HD1 ILE 10 -7.140 4.341 -1.040
85 2HD1 ILE 10 2HD1 ILE 10 -5.864 5.500 -1.411
86 3HD1 ILE 10 3HD1 ILE 10 -6.918 4.907 -2.696
87 H GLY 11 H GLY 11 -3.641 0.821 0.985
88 1HA GLY 11 1HA GLY 11 -1.175 2.287 0.476
89 2HA GLY 11 2HA GLY 11 -1.533 1.337 1.920
90 H VAL 12 H VAL 12 -2.133 -1.130 0.633
91 HA VAL 12 HA VAL 12 0.414 -2.324 0.435
92 HB VAL 12 HB VAL 12 -2.249 -3.159 -0.745
93 1HG1 VAL 12 1HG1 VAL 12 0.469 -4.370 -0.921
94 2HG1 VAL 12 2HG1 VAL 12 -0.873 -5.464 -0.590
95 3HG1 VAL 12 3HG1 VAL 12 -0.882 -4.475 -2.048
96 1HG2 VAL 12 1HG2 VAL 12 -1.869 -2.998 1.790
97 2HG2 VAL 12 2HG2 VAL 12 -2.424 -4.557 1.181
98 3HG2 VAL 12 3HG2 VAL 12 -0.725 -4.325 1.593
99 H SER 13 H SER 13 -1.567 -0.752 -2.015
100 HA SER 13 HA SER 13 0.403 -1.468 -4.117
101 1HB SER 13 1HB SER 13 -2.413 -0.846 -4.078
102 2HB SER 13 2HB SER 13 -1.577 0.270 -5.154
103 HG SER 13 HG SER 13 -2.263 -1.804 -6.078
104 H TYR 14 H TYR 14 -0.046 0.920 -1.819
105 HA TYR 14 HA TYR 14 1.284 2.973 -3.532
106 1HB TYR 14 1HB TYR 14 -0.728 3.115 -1.372
107 2HB TYR 14 2HB TYR 14 0.555 4.320 -1.271
108 HD1 TYR 14 HD1 TYR 14 1.230 5.209 -3.803
109 HD2 TYR 14 HD2 TYR 14 -2.627 3.842 -2.500
110 HE1 TYR 14 HE1 TYR 14 0.156 6.511 -5.619
111 HE2 TYR 14 HE2 TYR 14 -3.703 5.144 -4.316
112 HH TYR 14 HH TYR 14 -1.837 7.340 -6.353
113 H ASP 15 H ASP 15 1.247 1.844 -0.123
114 HA ASP 15 HA ASP 15 3.743 2.995 0.594
115 1HB ASP 15 1HB ASP 15 1.932 1.803 2.068
116 2HB ASP 15 2HB ASP 15 2.851 0.342 1.705
117 H GLU 16 H GLU 16 2.989 -0.256 -0.677
118 HA GLU 16 HA GLU 16 5.624 -1.294 -0.655
119 1HB GLU 16 1HB GLU 16 3.159 -2.194 -1.523
120 2HB GLU 16 2HB GLU 16 4.064 -2.037 -3.029
121 1HG GLU 16 1HG GLU 16 4.518 -4.242 -2.241
122 2HG GLU 16 2HG GLU 16 5.957 -3.296 -1.857
123 H TYR 17 H TYR 17 3.914 0.492 -3.233
124 HA TYR 17 HA TYR 17 6.024 0.527 -5.121
125 1HB TYR 17 1HB TYR 17 4.479 1.720 -6.264
126 2HB TYR 17 2HB TYR 17 3.476 1.748 -4.820
127 HD1 TYR 17 HD1 TYR 17 6.469 3.492 -6.265
128 HD2 TYR 17 HD2 TYR 17 2.895 3.821 -3.910
129 HE1 TYR 17 HE1 TYR 17 6.814 5.942 -6.087
130 HE2 TYR 17 HE2 TYR 17 3.237 6.271 -3.731
131 HH TYR 17 HH TYR 17 4.554 8.065 -5.310
132 H ARG 18 H ARG 18 5.176 2.983 -2.693
133 HA ARG 18 HA ARG 18 7.481 4.614 -3.025
134 1HB ARG 18 1HB ARG 18 5.290 4.967 -1.604
135 2HB ARG 18 2HB ARG 18 6.229 4.203 -0.322
136 1HG ARG 18 1HG ARG 18 7.688 5.963 -0.143
137 2HG ARG 18 2HG ARG 18 7.586 6.359 -1.860
138 1HD ARG 18 1HD ARG 18 5.045 6.730 -0.441
139 2HD ARG 18 2HD ARG 18 6.339 7.758 0.174
140 HE ARG 18 HE ARG 18 4.961 8.329 -2.170
141 1HH1 ARG 18 1HH2 ARG 18 7.097 10.139 -1.313
142 2HH1 ARG 18 2HH2 ARG 18 8.293 9.968 -2.556
143 1HH2 ARG 18 1HH1 ARG 18 6.972 7.004 -3.783
144 2HH2 ARG 18 2HH1 ARG 18 8.218 8.194 -3.958
145 H TYR 19 H TYR 19 7.142 1.473 -1.724
146 HA TYR 19 HA TYR 19 9.652 1.680 -0.157
147 1HB TYR 19 1HB TYR 19 7.246 -0.058 -0.179
148 2HB TYR 19 2HB TYR 19 8.769 -0.830 0.244
149 HD1 TYR 19 HD1 TYR 19 7.397 2.602 0.865
150 HD2 TYR 19 HD2 TYR 19 8.918 -1.041 2.550
151 HE1 TYR 19 HE1 TYR 19 7.283 3.600 3.135
152 HE2 TYR 19 HE2 TYR 19 8.806 -0.047 4.821
153 HH TYR 19 HH TYR 19 7.788 1.693 6.011
154 H ARG 20 H ARG 20 8.433 0.549 -3.177
155 HA ARG 20 HA ARG 20 10.251 -1.653 -3.578
156 1HB ARG 20 1HB ARG 20 8.149 -0.364 -5.038
157 2HB ARG 20 2HB ARG 20 9.560 -0.502 -6.089
158 1HG ARG 20 1HG ARG 20 9.366 -2.952 -4.674
159 2HG ARG 20 2HG ARG 20 7.743 -2.570 -5.249
160 1HD ARG 20 1HD ARG 20 8.447 -3.466 -7.213
161 2HD ARG 20 2HD ARG 20 9.273 -1.924 -7.436
162 HE ARG 20 HE ARG 20 10.678 -4.188 -6.090
163 1HH1 ARG 20 1HH1 ARG 20 11.143 -1.221 -7.488
164 2HH1 ARG 20 2HH1 ARG 20 12.388 -1.713 -8.588
165 1HH2 ARG 20 1HH2 ARG 20 11.958 -5.099 -7.976
166 2HH2 ARG 20 2HH2 ARG 20 12.850 -3.909 -8.864
167 H SER 21 H SER 21 10.667 1.800 -3.838
168 HA SER 21 HA SER 21 13.315 1.294 -5.135
169 1HB SER 21 1HB SER 21 11.496 2.612 -6.431
170 2HB SER 21 2HB SER 21 11.836 3.912 -5.295
171 HG SER 21 HG SER 21 13.337 4.314 -6.748
172 H VAL 22 H VAL 22 12.970 1.205 -2.313
173 HA VAL 22 HA VAL 22 14.757 3.387 -1.530
174 HB VAL 22 HB VAL 22 12.797 4.530 -1.082
175 1HG1 VAL 22 1HG1 VAL 22 11.661 1.805 -0.612
176 2HG1 VAL 22 2HG1 VAL 22 10.826 3.219 0.027
177 3HG1 VAL 22 3HG1 VAL 22 11.105 3.068 -1.707
178 1HG2 VAL 22 1HG2 VAL 22 14.190 3.659 1.090
179 2HG2 VAL 22 2HG2 VAL 22 12.847 4.798 1.185
180 3HG2 VAL 22 3HG2 VAL 22 12.569 3.082 1.483
181 H ILE 23 H ILE 23 12.938 0.472 -0.595
182 HA ILE 23 HA ILE 23 14.452 0.015 1.822
183 HB ILE 23 HB ILE 23 12.984 -2.067 0.185
184 1HG1 ILE 23 1HG1 ILE 23 11.641 0.055 0.644
185 2HG1 ILE 23 2HG1 ILE 23 10.959 -1.430 1.299
186 1HG2 ILE 23 1HG2 ILE 23 14.317 -1.999 2.757
187 2HG2 ILE 23 2HG2 ILE 23 12.607 -2.384 2.956
188 3HG2 ILE 23 3HG2 ILE 23 13.620 -3.376 1.905
189 1HD1 ILE 23 1HD1 ILE 23 12.784 0.334 2.935
190 2HD1 ILE 23 2HD1 ILE 23 11.042 0.602 2.877
191 3HD1 ILE 23 3HD1 ILE 23 11.681 -0.918 3.504
192 H LYS 24 H LYS 24 14.490 -1.763 -1.295
193 HA LYS 24 HA LYS 24 17.338 -1.764 -1.518
194 1HB LYS 24 1HB LYS 24 16.199 -3.741 0.298
195 2HB LYS 24 2HB LYS 24 17.093 -4.502 -1.020
196 1HG LYS 24 1HG LYS 24 18.634 -2.275 -0.190
197 2HG LYS 24 2HG LYS 24 18.123 -3.104 1.281
198 1HD LYS 24 1HD LYS 24 18.814 -5.222 -0.310
199 2HD LYS 24 2HD LYS 24 19.973 -4.001 -0.838
200 1HE LYS 24 1HE LYS 24 20.174 -3.632 1.827
201 2HE LYS 24 2HE LYS 24 19.727 -5.350 1.807
202 1HZ LYS 24 1HZ LYS 24 21.446 -5.244 -0.228
203 2HZ LYS 24 2HZ LYS 24 22.115 -4.051 0.777
204 3HZ LYS 24 3HZ LYS 24 21.905 -5.633 1.360
205 H ALA 25 H ALA 25 15.069 -4.494 -1.935
206 HA ALA 25 HA ALA 25 14.801 -3.939 -4.801
207 1HB ALA 25 1HB ALA 25 16.755 -5.897 -3.754
208 2HB ALA 25 2HB ALA 25 15.695 -6.514 -5.021
209 3HB ALA 25 3HB ALA 25 16.697 -5.094 -5.324
Start of MODEL 5
1 1H MET 1 1H MET 1 -18.992 0.702 0.032
2 2H MET 1 2H MET 1 -17.459 0.965 -0.643
3 3H MET 1 3H MET 1 -18.169 -0.577 -0.723
4 HA MET 1 HA MET 1 -17.942 -0.910 1.613
5 1HB MET 1 1HB MET 1 -15.484 0.352 0.352
6 2HB MET 1 2HB MET 1 -15.473 -0.790 1.697
7 1HG MET 1 1HG MET 1 -17.003 -2.116 -0.164
8 2HG MET 1 2HG MET 1 -15.824 -1.289 -1.181
9 1HE MET 1 1HE MET 1 -16.469 -2.883 1.969
10 2HE MET 1 2HE MET 1 -15.807 -4.501 1.699
11 3HE MET 1 3HE MET 1 -14.895 -3.316 2.630
12 HA PRO 2 HA PRO 2 -18.416 3.272 3.386
13 1HB PRO 2 1HB PRO 2 -20.051 2.470 5.427
14 2HB PRO 2 2HB PRO 2 -20.653 2.839 3.798
15 1HG PRO 2 1HG PRO 2 -20.120 0.204 5.066
16 2HG PRO 2 2HG PRO 2 -21.417 0.684 3.962
17 1HD PRO 2 1HD PRO 2 -19.206 -0.737 3.195
18 2HD PRO 2 2HD PRO 2 -20.149 0.299 2.102
19 H GLY 3 H GLY 3 -16.887 0.448 4.277
20 1HA GLY 3 1HA GLY 3 -16.089 1.470 6.960
21 2HA GLY 3 2HA GLY 3 -15.835 -0.179 6.387
22 H THR 4 H THR 4 -13.561 0.196 7.073
23 HA THR 4 HA THR 4 -12.044 1.670 4.955
24 HB THR 4 HB THR 4 -11.944 2.808 7.179
25 HG1 THR 4 HG1 THR 4 -9.422 1.682 6.807
26 1HG2 THR 4 1HG2 THR 4 -11.751 0.174 8.123
27 2HG2 THR 4 2HG2 THR 4 -10.163 0.881 8.415
28 3HG2 THR 4 3HG2 THR 4 -11.605 1.649 9.079
29 H ILE 5 H ILE 5 -12.827 -1.134 4.956
30 HA ILE 5 HA ILE 5 -10.455 -2.671 5.732
31 HB ILE 5 HB ILE 5 -12.749 -3.587 3.983
32 1HG1 ILE 5 1HG1 ILE 5 -13.590 -2.557 6.092
33 2HG1 ILE 5 2HG1 ILE 5 -13.869 -4.298 6.044
34 1HG2 ILE 5 1HG2 ILE 5 -10.607 -4.909 5.635
35 2HG2 ILE 5 2HG2 ILE 5 -12.117 -5.752 5.292
36 3HG2 ILE 5 3HG2 ILE 5 -11.075 -5.234 3.966
37 1HD1 ILE 5 1HD1 ILE 5 -11.261 -3.730 7.163
38 2HD1 ILE 5 2HD1 ILE 5 -12.513 -2.859 8.049
39 3HD1 ILE 5 3HD1 ILE 5 -12.608 -4.612 7.883
40 H LYS 6 H LYS 6 -11.766 -1.217 2.807
41 HA LYS 6 HA LYS 6 -9.751 -2.539 1.108
42 1HB LYS 6 1HB LYS 6 -12.100 -2.026 0.321
43 2HB LYS 6 2HB LYS 6 -11.671 -0.315 0.366
44 1HG LYS 6 1HG LYS 6 -10.011 -0.578 -1.320
45 2HG LYS 6 2HG LYS 6 -10.032 -2.336 -1.173
46 1HD LYS 6 1HD LYS 6 -11.293 -1.893 -3.132
47 2HD LYS 6 2HD LYS 6 -12.505 -2.188 -1.885
48 1HE LYS 6 1HE LYS 6 -12.302 0.442 -1.529
49 2HE LYS 6 2HE LYS 6 -11.756 0.389 -3.216
50 1HZ LYS 6 1HZ LYS 6 -13.749 -1.263 -3.434
51 2HZ LYS 6 2HZ LYS 6 -14.334 -0.429 -2.074
52 3HZ LYS 6 3HZ LYS 6 -14.013 0.411 -3.515
53 H GLU 7 H GLU 7 -10.275 0.555 2.689
54 HA GLU 7 HA GLU 7 -8.189 1.948 1.220
55 1HB GLU 7 1HB GLU 7 -9.844 2.511 3.658
56 2HB GLU 7 2HB GLU 7 -8.406 3.486 3.359
57 1HG GLU 7 1HG GLU 7 -9.782 3.251 0.882
58 2HG GLU 7 2HG GLU 7 -10.980 3.678 2.104
59 H ASN 8 H ASN 8 -8.388 0.472 4.465
60 HA ASN 8 HA ASN 8 -5.833 1.055 5.423
61 1HB ASN 8 1HB ASN 8 -7.565 -0.196 6.700
62 2HB ASN 8 2HB ASN 8 -7.269 -1.607 5.684
63 1HD2 ASN 8 2HD2 ASN 8 -6.568 -0.576 8.687
64 2HD2 ASN 8 1HD2 ASN 8 -5.007 -1.213 8.887
65 H ILE 9 H ILE 9 -6.793 -1.352 3.018
66 HA ILE 9 HA ILE 9 -4.207 -2.630 2.866
67 HB ILE 9 HB ILE 9 -6.305 -2.452 0.684
68 1HG1 ILE 9 1HG1 ILE 9 -7.235 -3.241 2.874
69 2HG1 ILE 9 2HG1 ILE 9 -7.250 -4.493 1.631
70 1HG2 ILE 9 1HG2 ILE 9 -3.943 -3.331 0.197
71 2HG2 ILE 9 2HG2 ILE 9 -4.335 -4.669 1.277
72 3HG2 ILE 9 3HG2 ILE 9 -5.276 -4.416 -0.193
73 1HD1 ILE 9 1HD1 ILE 9 -4.966 -4.201 3.590
74 2HD1 ILE 9 2HD1 ILE 9 -6.379 -5.199 3.936
75 3HD1 ILE 9 3HD1 ILE 9 -5.344 -5.582 2.559
76 H ILE 10 H ILE 10 -5.674 0.175 1.298
77 HA ILE 10 HA ILE 10 -3.727 0.524 -0.753
78 HB ILE 10 HB ILE 10 -6.008 1.814 -0.163
79 1HG1 ILE 10 1HG1 ILE 10 -3.598 2.916 -1.628
80 2HG1 ILE 10 2HG1 ILE 10 -4.911 1.954 -2.308
81 1HG2 ILE 10 1HG2 ILE 10 -4.841 2.898 1.847
82 2HG2 ILE 10 2HG2 ILE 10 -3.914 3.830 0.674
83 3HG2 ILE 10 3HG2 ILE 10 -5.668 3.996 0.742
84 1HD1 ILE 10 1HD1 ILE 10 -6.262 4.051 -1.126
85 2HD1 ILE 10 2HD1 ILE 10 -4.805 4.834 -1.738
86 3HD1 ILE 10 3HD1 ILE 10 -5.857 3.944 -2.839
87 H GLY 11 H GLY 11 -3.798 1.570 2.642
88 1HA GLY 11 1HA GLY 11 -1.380 3.111 2.560
89 2HA GLY 11 2HA GLY 11 -2.057 2.366 4.012
90 H VAL 12 H VAL 12 -2.015 -0.276 2.474
91 HA VAL 12 HA VAL 12 0.724 -1.020 3.284
92 HB VAL 12 HB VAL 12 -1.684 -2.608 2.361
93 1HG1 VAL 12 1HG1 VAL 12 1.067 -3.318 2.156
94 2HG1 VAL 12 2HG1 VAL 12 0.379 -4.247 3.487
95 3HG1 VAL 12 3HG1 VAL 12 -0.341 -4.344 1.880
96 1HG2 VAL 12 1HG2 VAL 12 -1.487 -1.586 4.723
97 2HG2 VAL 12 2HG2 VAL 12 -1.827 -3.314 4.622
98 3HG2 VAL 12 3HG2 VAL 12 -0.194 -2.756 4.984
99 H SER 13 H SER 13 -1.200 -0.580 0.386
100 HA SER 13 HA SER 13 0.973 -1.683 -1.305
101 1HB SER 13 1HB SER 13 -1.310 -2.308 -1.916
102 2HB SER 13 2HB SER 13 -1.780 -0.612 -1.998
103 HG SER 13 HG SER 13 -1.236 -0.917 -4.029
104 H TYR 14 H TYR 14 0.314 1.201 0.171
105 HA TYR 14 HA TYR 14 1.245 2.862 -2.112
106 1HB TYR 14 1HB TYR 14 -0.698 3.381 -0.305
107 2HB TYR 14 2HB TYR 14 0.678 4.103 0.527
108 HD1 TYR 14 HD1 TYR 14 -0.146 3.815 -3.118
109 HD2 TYR 14 HD2 TYR 14 0.576 6.421 0.219
110 HE1 TYR 14 HE1 TYR 14 -0.259 5.778 -4.627
111 HE2 TYR 14 HE2 TYR 14 0.464 8.386 -1.291
112 HH TYR 14 HH TYR 14 -0.359 8.016 -4.727
113 H ASP 15 H ASP 15 2.383 1.338 0.745
114 HA ASP 15 HA ASP 15 4.714 3.164 0.958
115 1HB ASP 15 1HB ASP 15 3.399 2.178 2.972
116 2HB ASP 15 2HB ASP 15 4.271 0.686 2.619
117 H GLU 16 H GLU 16 4.138 -0.369 0.632
118 HA GLU 16 HA GLU 16 6.787 -1.130 0.072
119 1HB GLU 16 1HB GLU 16 4.279 -2.375 0.002
120 2HB GLU 16 2HB GLU 16 4.898 -2.537 -1.642
121 1HG GLU 16 1HG GLU 16 7.135 -3.114 -0.180
122 2HG GLU 16 2HG GLU 16 5.869 -3.764 0.862
123 H TYR 17 H TYR 17 4.299 0.133 -2.126
124 HA TYR 17 HA TYR 17 5.769 -0.121 -4.551
125 1HB TYR 17 1HB TYR 17 3.844 0.756 -5.351
126 2HB TYR 17 2HB TYR 17 3.308 1.023 -3.698
127 HD1 TYR 17 HD1 TYR 17 5.532 2.567 -6.296
128 HD2 TYR 17 HD2 TYR 17 2.851 3.207 -3.002
129 HE1 TYR 17 HE1 TYR 17 5.680 5.017 -6.653
130 HE2 TYR 17 HE2 TYR 17 2.997 5.658 -3.360
131 HH TYR 17 HH TYR 17 5.025 7.017 -5.963
132 H ARG 18 H ARG 18 5.421 2.700 -2.405
133 HA ARG 18 HA ARG 18 7.464 4.257 -3.700
134 1HB ARG 18 1HB ARG 18 5.553 4.786 -1.820
135 2HB ARG 18 2HB ARG 18 6.999 4.725 -0.815
136 1HG ARG 18 1HG ARG 18 8.075 6.267 -2.579
137 2HG ARG 18 2HG ARG 18 6.431 6.539 -3.157
138 1HD ARG 18 1HD ARG 18 7.153 6.869 -0.245
139 2HD ARG 18 2HD ARG 18 7.338 8.190 -1.398
140 HE ARG 18 HE ARG 18 4.752 7.417 -1.836
141 1HH1 ARG 18 1HH1 ARG 18 5.815 6.730 1.205
142 2HH1 ARG 18 2HH1 ARG 18 4.809 7.869 2.037
143 1HH2 ARG 18 1HH2 ARG 18 3.777 9.477 -0.855
144 2HH2 ARG 18 2HH2 ARG 18 3.655 9.422 0.872
145 H TYR 19 H TYR 19 7.699 1.463 -1.849
146 HA TYR 19 HA TYR 19 10.384 2.181 -0.799
147 1HB TYR 19 1HB TYR 19 8.204 0.324 -0.003
148 2HB TYR 19 2HB TYR 19 9.850 -0.224 0.274
149 HD1 TYR 19 HD1 TYR 19 8.557 3.269 0.332
150 HD2 TYR 19 HD2 TYR 19 10.084 -0.028 2.621
151 HE1 TYR 19 HE1 TYR 19 8.704 4.725 2.337
152 HE2 TYR 19 HE2 TYR 19 10.230 1.425 4.626
153 HH TYR 19 HH TYR 19 9.956 3.470 5.434
154 H ARG 20 H ARG 20 8.757 0.354 -3.223
155 HA ARG 20 HA ARG 20 10.767 -1.717 -3.537
156 1HB ARG 20 1HB ARG 20 8.300 -0.860 -4.919
157 2HB ARG 20 2HB ARG 20 9.514 -1.598 -5.964
158 1HG ARG 20 1HG ARG 20 8.982 -2.945 -3.361
159 2HG ARG 20 2HG ARG 20 7.726 -3.065 -4.594
160 1HD ARG 20 1HD ARG 20 9.826 -3.622 -6.148
161 2HD ARG 20 2HD ARG 20 10.510 -4.149 -4.611
162 HE ARG 20 HE ARG 20 7.971 -5.310 -4.713
163 1HH1 ARG 20 1HH1 ARG 20 10.671 -5.151 -6.849
164 2HH1 ARG 20 2HH1 ARG 20 10.520 -6.794 -7.376
165 1HH2 ARG 20 1HH2 ARG 20 7.835 -7.497 -5.298
166 2HH2 ARG 20 2HH2 ARG 20 8.915 -8.121 -6.500
167 H SER 21 H SER 21 10.484 1.580 -4.601
168 HA SER 21 HA SER 21 12.708 1.132 -6.534
169 1HB SER 21 1HB SER 21 10.555 2.279 -7.295
170 2HB SER 21 2HB SER 21 11.034 3.632 -6.276
171 HG SER 21 HG SER 21 11.873 2.992 -8.729
172 H VAL 22 H VAL 22 12.870 1.422 -3.533
173 HA VAL 22 HA VAL 22 14.983 3.471 -3.540
174 HB VAL 22 HB VAL 22 13.355 4.852 -2.718
175 1HG1 VAL 22 1HG1 VAL 22 12.005 2.309 -2.050
176 2HG1 VAL 22 2HG1 VAL 22 11.574 3.703 -1.059
177 3HG1 VAL 22 3HG1 VAL 22 11.365 3.765 -2.809
178 1HG2 VAL 22 1HG2 VAL 22 14.086 3.258 -0.246
179 2HG2 VAL 22 2HG2 VAL 22 14.996 4.621 -0.901
180 3HG2 VAL 22 3HG2 VAL 22 13.383 4.875 -0.235
181 H ILE 23 H ILE 23 13.247 1.065 -1.520
182 HA ILE 23 HA ILE 23 15.834 0.441 -0.187
183 HB ILE 23 HB ILE 23 12.981 -0.338 0.487
184 1HG1 ILE 23 1HG1 ILE 23 14.281 1.049 2.583
185 2HG1 ILE 23 2HG1 ILE 23 14.646 1.941 1.105
186 1HG2 ILE 23 1HG2 ILE 23 14.668 -2.091 1.074
187 2HG2 ILE 23 2HG2 ILE 23 15.535 -0.887 2.027
188 3HG2 ILE 23 3HG2 ILE 23 13.903 -1.370 2.491
189 1HD1 ILE 23 1HD1 ILE 23 11.846 1.031 1.334
190 2HD1 ILE 23 2HD1 ILE 23 12.331 2.231 2.532
191 3HD1 ILE 23 3HD1 ILE 23 12.484 2.589 0.811
192 H LYS 24 H LYS 24 13.042 -1.316 -1.595
193 HA LYS 24 HA LYS 24 14.665 -3.742 -1.883
194 1HB LYS 24 1HB LYS 24 11.817 -2.981 -2.300
195 2HB LYS 24 2HB LYS 24 12.433 -4.304 -3.293
196 1HG LYS 24 1HG LYS 24 13.455 -5.029 -0.899
197 2HG LYS 24 2HG LYS 24 12.009 -4.182 -0.354
198 1HD LYS 24 1HD LYS 24 10.799 -5.586 -2.200
199 2HD LYS 24 2HD LYS 24 12.221 -6.625 -2.096
200 1HE LYS 24 1HE LYS 24 11.146 -5.882 0.541
201 2HE LYS 24 2HE LYS 24 10.016 -6.832 -0.445
202 1HZ LYS 24 1HZ LYS 24 12.090 -8.213 -1.009
203 2HZ LYS 24 2HZ LYS 24 12.768 -7.513 0.383
204 3HZ LYS 24 3HZ LYS 24 11.357 -8.452 0.502
205 H ALA 25 H ALA 25 16.244 -2.362 -3.265
206 HA ALA 25 HA ALA 25 15.305 -2.236 -6.097
207 1HB ALA 25 1HB ALA 25 17.010 -0.544 -4.476
208 2HB ALA 25 2HB ALA 25 17.876 -1.102 -5.907
209 3HB ALA 25 3HB ALA 25 16.348 -0.238 -6.082
Start of MODEL 6
1 1H MET 1 1H MET 1 -12.077 7.728 4.598
2 2H MET 1 2H MET 1 -11.687 8.012 2.969
3 3H MET 1 3H MET 1 -13.311 7.878 3.440
4 HA MET 1 HA MET 1 -13.044 5.773 2.646
5 1HB MET 1 1HB MET 1 -10.245 6.616 3.075
6 2HB MET 1 2HB MET 1 -10.513 4.878 3.218
7 1HG MET 1 1HG MET 1 -10.555 4.737 0.974
8 2HG MET 1 2HG MET 1 -12.005 5.740 0.969
9 1HE MET 1 1HE MET 1 -11.887 6.929 -0.994
10 2HE MET 1 2HE MET 1 -10.539 7.839 -1.673
11 3HE MET 1 3HE MET 1 -10.470 6.079 -1.626
12 HA PRO 2 HA PRO 2 -13.379 4.892 7.195
13 1HB PRO 2 1HB PRO 2 -16.066 4.379 7.182
14 2HB PRO 2 2HB PRO 2 -15.395 6.008 7.398
15 1HG PRO 2 1HG PRO 2 -16.571 4.752 4.973
16 2HG PRO 2 2HG PRO 2 -16.697 6.419 5.556
17 1HD PRO 2 1HD PRO 2 -15.035 5.625 3.529
18 2HD PRO 2 2HD PRO 2 -14.746 7.050 4.551
19 H GLY 3 H GLY 3 -13.646 3.283 4.287
20 1HA GLY 3 1HA GLY 3 -14.610 0.722 5.381
21 2HA GLY 3 2HA GLY 3 -14.112 1.014 3.713
22 H THR 4 H THR 4 -13.059 0.007 6.862
23 HA THR 4 HA THR 4 -10.236 0.206 6.511
24 HB THR 4 HB THR 4 -11.518 -0.383 8.650
25 HG1 THR 4 HG1 THR 4 -9.690 -1.154 9.384
26 1HG2 THR 4 1HG2 THR 4 -12.532 -2.423 7.164
27 2HG2 THR 4 2HG2 THR 4 -11.210 -3.250 7.989
28 3HG2 THR 4 3HG2 THR 4 -12.463 -2.437 8.927
29 H ILE 5 H ILE 5 -12.589 -2.054 5.248
30 HA ILE 5 HA ILE 5 -10.813 -4.185 4.560
31 HB ILE 5 HB ILE 5 -13.283 -3.310 3.034
32 1HG1 ILE 5 1HG1 ILE 5 -13.896 -5.430 4.778
33 2HG1 ILE 5 2HG1 ILE 5 -12.965 -4.289 5.749
34 1HG2 ILE 5 1HG2 ILE 5 -11.815 -5.044 1.979
35 2HG2 ILE 5 2HG2 ILE 5 -12.022 -6.041 3.419
36 3HG2 ILE 5 3HG2 ILE 5 -13.412 -5.660 2.404
37 1HD1 ILE 5 1HD1 ILE 5 -14.610 -2.588 4.383
38 2HD1 ILE 5 2HD1 ILE 5 -15.656 -3.996 4.563
39 3HD1 ILE 5 3HD1 ILE 5 -14.963 -3.224 5.990
40 H LYS 6 H LYS 6 -11.284 -1.031 3.204
41 HA LYS 6 HA LYS 6 -9.754 -1.800 0.763
42 1HB LYS 6 1HB LYS 6 -11.490 0.566 1.472
43 2HB LYS 6 2HB LYS 6 -10.365 0.636 0.115
44 1HG LYS 6 1HG LYS 6 -11.977 -1.820 0.166
45 2HG LYS 6 2HG LYS 6 -12.940 -0.354 -0.012
46 1HD LYS 6 1HD LYS 6 -11.481 0.359 -1.890
47 2HD LYS 6 2HD LYS 6 -10.572 -1.145 -1.735
48 1HE LYS 6 1HE LYS 6 -12.734 -2.403 -2.118
49 2HE LYS 6 2HE LYS 6 -13.496 -0.845 -2.498
50 1HZ LYS 6 1HZ LYS 6 -10.937 -1.564 -3.760
51 2HZ LYS 6 2HZ LYS 6 -12.380 -2.203 -4.389
52 3HZ LYS 6 3HZ LYS 6 -12.151 -0.520 -4.320
53 H GLU 7 H GLU 7 -9.732 0.469 3.504
54 HA GLU 7 HA GLU 7 -7.264 1.759 2.771
55 1HB GLU 7 1HB GLU 7 -8.715 1.468 5.413
56 2HB GLU 7 2HB GLU 7 -7.238 2.415 5.229
57 1HG GLU 7 1HG GLU 7 -9.035 3.133 3.118
58 2HG GLU 7 2HG GLU 7 -9.910 3.216 4.648
59 H ASN 8 H ASN 8 -7.937 -1.362 3.935
60 HA ASN 8 HA ASN 8 -5.346 -1.687 5.307
61 1HB ASN 8 1HB ASN 8 -7.332 -2.877 6.168
62 2HB ASN 8 2HB ASN 8 -7.498 -3.717 4.625
63 1HD2 ASN 8 2HD2 ASN 8 -6.715 -4.623 7.524
64 2HD2 ASN 8 1HD2 ASN 8 -5.330 -5.569 7.265
65 H ILE 9 H ILE 9 -6.964 -3.036 2.414
66 HA ILE 9 HA ILE 9 -4.578 -4.379 1.483
67 HB ILE 9 HB ILE 9 -6.946 -3.505 -0.192
68 1HG1 ILE 9 1HG1 ILE 9 -7.659 -4.700 1.893
69 2HG1 ILE 9 2HG1 ILE 9 -8.010 -5.614 0.426
70 1HG2 ILE 9 1HG2 ILE 9 -4.905 -4.414 -1.339
71 2HG2 ILE 9 2HG2 ILE 9 -5.101 -5.902 -0.413
72 3HG2 ILE 9 3HG2 ILE 9 -6.341 -5.412 -1.568
73 1HD1 ILE 9 1HD1 ILE 9 -5.354 -6.266 1.272
74 2HD1 ILE 9 2HD1 ILE 9 -6.431 -6.423 2.659
75 3HD1 ILE 9 3HD1 ILE 9 -6.762 -7.324 1.180
76 H ILE 10 H ILE 10 -5.696 -1.123 1.369
77 HA ILE 10 HA ILE 10 -4.357 -0.268 -1.023
78 HB ILE 10 HB ILE 10 -5.509 1.069 1.385
79 1HG1 ILE 10 1HG1 ILE 10 -6.897 0.493 -0.551
80 2HG1 ILE 10 2HG1 ILE 10 -6.741 2.237 -0.416
81 1HG2 ILE 10 1HG2 ILE 10 -3.472 2.265 -0.490
82 2HG2 ILE 10 2HG2 ILE 10 -4.756 3.270 0.181
83 3HG2 ILE 10 3HG2 ILE 10 -3.616 2.461 1.257
84 1HD1 ILE 10 1HD1 ILE 10 -4.557 1.501 -1.974
85 2HD1 ILE 10 2HD1 ILE 10 -5.871 0.486 -2.566
86 3HD1 ILE 10 3HD1 ILE 10 -6.047 2.240 -2.559
87 H GLY 11 H GLY 11 -3.409 0.115 2.416
88 1HA GLY 11 1HA GLY 11 -0.797 1.081 1.937
89 2HA GLY 11 2HA GLY 11 -1.268 0.183 3.382
90 H VAL 12 H VAL 12 -2.135 -2.072 1.478
91 HA VAL 12 HA VAL 12 0.490 -3.412 1.467
92 HB VAL 12 HB VAL 12 -2.301 -4.379 0.775
93 1HG1 VAL 12 1HG1 VAL 12 -0.361 -5.516 -0.450
94 2HG1 VAL 12 2HG1 VAL 12 0.184 -6.066 1.135
95 3HG1 VAL 12 3HG1 VAL 12 -1.390 -6.570 0.519
96 1HG2 VAL 12 1HG2 VAL 12 -0.857 -4.030 3.236
97 2HG2 VAL 12 2HG2 VAL 12 -2.483 -4.674 3.001
98 3HG2 VAL 12 3HG2 VAL 12 -1.089 -5.755 2.953
99 H SER 13 H SER 13 -1.633 -1.823 -0.765
100 HA SER 13 HA SER 13 0.029 -2.852 -3.032
101 1HB SER 13 1HB SER 13 -1.833 -2.947 -4.355
102 2HB SER 13 2HB SER 13 -2.667 -3.077 -2.809
103 HG SER 13 HG SER 13 -3.606 -1.418 -3.953
104 H TYR 14 H TYR 14 -0.269 -0.249 -1.056
105 HA TYR 14 HA TYR 14 0.532 1.629 -3.242
106 1HB TYR 14 1HB TYR 14 -1.592 1.868 -1.302
107 2HB TYR 14 2HB TYR 14 -0.404 3.145 -1.046
108 HD1 TYR 14 HD1 TYR 14 -2.662 1.587 -3.547
109 HD2 TYR 14 HD2 TYR 14 -0.102 4.914 -2.638
110 HE1 TYR 14 HE1 TYR 14 -3.536 2.799 -5.525
111 HE2 TYR 14 HE2 TYR 14 -0.976 6.126 -4.617
112 HH TYR 14 HH TYR 14 -3.733 5.006 -6.387
113 H ASP 15 H ASP 15 0.980 0.611 0.119
114 HA ASP 15 HA ASP 15 3.149 2.496 0.605
115 1HB ASP 15 1HB ASP 15 1.549 0.966 2.228
116 2HB ASP 15 2HB ASP 15 3.057 0.052 2.258
117 H GLU 16 H GLU 16 2.906 -0.922 -0.326
118 HA GLU 16 HA GLU 16 5.658 -1.593 -0.138
119 1HB GLU 16 1HB GLU 16 3.282 -2.766 -1.213
120 2HB GLU 16 2HB GLU 16 4.542 -2.865 -2.444
121 1HG GLU 16 1HG GLU 16 5.836 -3.509 -0.040
122 2HG GLU 16 2HG GLU 16 4.289 -4.353 0.037
123 H TYR 17 H TYR 17 3.826 -0.134 -2.834
124 HA TYR 17 HA TYR 17 6.031 -0.045 -4.658
125 1HB TYR 17 1HB TYR 17 4.365 0.688 -5.999
126 2HB TYR 17 2HB TYR 17 3.303 0.828 -4.604
127 HD1 TYR 17 HD1 TYR 17 6.054 2.650 -6.376
128 HD2 TYR 17 HD2 TYR 17 2.525 2.941 -3.948
129 HE1 TYR 17 HE1 TYR 17 6.109 5.119 -6.596
130 HE2 TYR 17 HE2 TYR 17 2.580 5.412 -4.164
131 HH TYR 17 HH TYR 17 3.683 7.162 -4.960
132 H ARG 18 H ARG 18 4.635 2.578 -2.665
133 HA ARG 18 HA ARG 18 6.698 4.466 -3.049
134 1HB ARG 18 1HB ARG 18 4.399 4.543 -1.681
135 2HB ARG 18 2HB ARG 18 5.479 4.212 -0.327
136 1HG ARG 18 1HG ARG 18 6.751 6.186 -0.722
137 2HG ARG 18 2HG ARG 18 6.029 6.419 -2.315
138 1HD ARG 18 1HD ARG 18 4.007 6.284 -0.221
139 2HD ARG 18 2HD ARG 18 5.161 7.585 0.066
140 HE ARG 18 HE ARG 18 4.615 8.122 -2.472
141 1HH1 ARG 18 1HH1 ARG 18 2.315 6.119 -2.321
142 2HH1 ARG 18 2HH1 ARG 18 0.979 7.174 -1.994
143 1HH2 ARG 18 1HH2 ARG 18 2.977 9.846 -1.053
144 2HH2 ARG 18 2HH2 ARG 18 1.355 9.285 -1.277
145 H TYR 19 H TYR 19 6.664 1.501 -1.297
146 HA TYR 19 HA TYR 19 9.046 2.170 0.298
147 1HB TYR 19 1HB TYR 19 7.039 -0.037 0.157
148 2HB TYR 19 2HB TYR 19 8.625 -0.410 0.814
149 HD1 TYR 19 HD1 TYR 19 7.151 2.953 1.050
150 HD2 TYR 19 HD2 TYR 19 7.811 -0.769 3.091
151 HE1 TYR 19 HE1 TYR 19 6.503 4.015 3.198
152 HE2 TYR 19 HE2 TYR 19 7.163 0.292 5.239
153 HH TYR 19 HH TYR 19 6.823 2.306 6.264
154 H ARG 20 H ARG 20 8.281 0.899 -2.771
155 HA ARG 20 HA ARG 20 10.480 -0.980 -3.014
156 1HB ARG 20 1HB ARG 20 8.620 -1.283 -4.490
157 2HB ARG 20 2HB ARG 20 8.694 0.392 -5.036
158 1HG ARG 20 1HG ARG 20 10.502 0.010 -6.417
159 2HG ARG 20 2HG ARG 20 11.140 -1.282 -5.400
160 1HD ARG 20 1HD ARG 20 9.958 -2.883 -6.492
161 2HD ARG 20 2HD ARG 20 8.508 -1.884 -6.571
162 HE ARG 20 HE ARG 20 9.136 -1.518 -8.805
163 1HH1 ARG 20 1HH1 ARG 20 11.771 -3.109 -7.729
164 2HH1 ARG 20 2HH1 ARG 20 12.959 -2.156 -8.555
165 1HH2 ARG 20 1HH2 ARG 20 10.719 0.329 -9.467
166 2HH2 ARG 20 2HH2 ARG 20 12.364 -0.210 -9.537
167 H SER 21 H SER 21 10.045 2.462 -3.741
168 HA SER 21 HA SER 21 12.741 2.589 -4.924
169 1HB SER 21 1HB SER 21 10.947 3.926 -5.950
170 2HB SER 21 2HB SER 21 10.697 4.767 -4.423
171 HG SER 21 HG SER 21 12.672 5.708 -4.620
172 H VAL 22 H VAL 22 12.128 2.039 -1.987
173 HA VAL 22 HA VAL 22 14.158 3.881 -0.933
174 HB VAL 22 HB VAL 22 12.352 5.157 -0.299
175 1HG1 VAL 22 1HG1 VAL 22 10.809 2.575 -0.141
176 2HG1 VAL 22 2HG1 VAL 22 10.144 4.118 0.388
177 3HG1 VAL 22 3HG1 VAL 22 10.604 3.888 -1.299
178 1HG2 VAL 22 1HG2 VAL 22 13.525 3.759 1.731
179 2HG2 VAL 22 2HG2 VAL 22 12.348 5.048 1.983
180 3HG2 VAL 22 3HG2 VAL 22 11.826 3.364 1.988
181 H ILE 23 H ILE 23 11.958 1.142 -0.267
182 HA ILE 23 HA ILE 23 13.849 0.117 1.765
183 HB ILE 23 HB ILE 23 11.346 -1.289 0.864
184 1HG1 ILE 23 1HG1 ILE 23 10.939 1.213 1.284
185 2HG1 ILE 23 2HG1 ILE 23 9.985 0.094 2.249
186 1HG2 ILE 23 1HG2 ILE 23 12.847 -1.022 3.485
187 2HG2 ILE 23 2HG2 ILE 23 11.321 -1.886 3.302
188 3HG2 ILE 23 3HG2 ILE 23 12.762 -2.453 2.458
189 1HD1 ILE 23 1HD1 ILE 23 12.626 1.123 3.266
190 2HD1 ILE 23 2HD1 ILE 23 11.155 2.074 3.464
191 3HD1 ILE 23 3HD1 ILE 23 11.270 0.469 4.185
192 H LYS 24 H LYS 24 12.107 -1.379 -0.991
193 HA LYS 24 HA LYS 24 12.834 -3.000 -2.525
194 1HB LYS 24 1HB LYS 24 14.605 -1.142 -2.842
195 2HB LYS 24 2HB LYS 24 15.659 -2.164 -1.864
196 1HG LYS 24 1HG LYS 24 14.463 -3.880 -3.759
197 2HG LYS 24 2HG LYS 24 14.950 -2.439 -4.652
198 1HD LYS 24 1HD LYS 24 17.082 -2.972 -2.899
199 2HD LYS 24 2HD LYS 24 16.607 -4.545 -3.544
200 1HE LYS 24 1HE LYS 24 16.577 -2.607 -5.681
201 2HE LYS 24 2HE LYS 24 18.150 -2.564 -4.860
202 1HZ LYS 24 1HZ LYS 24 16.869 -5.156 -5.393
203 2HZ LYS 24 2HZ LYS 24 17.688 -4.372 -6.658
204 3HZ LYS 24 3HZ LYS 24 18.519 -4.784 -5.239
205 H ALA 25 H ALA 25 12.439 -3.760 0.225
206 HA ALA 25 HA ALA 25 14.434 -5.241 1.472
207 1HB ALA 25 1HB ALA 25 11.496 -5.385 1.333
208 2HB ALA 25 2HB ALA 25 12.268 -6.920 1.733
209 3HB ALA 25 3HB ALA 25 12.562 -5.498 2.734
Start of MODEL 7
1 1H MET 1 1H MET 1 -18.598 0.637 1.929
2 2H MET 1 2H MET 1 -18.680 2.266 1.456
3 3H MET 1 3H MET 1 -17.676 1.190 0.615
4 HA MET 1 HA MET 1 -16.012 1.331 2.117
5 1HB MET 1 1HB MET 1 -16.433 3.615 1.507
6 2HB MET 1 2HB MET 1 -17.811 3.718 2.604
7 1HG MET 1 1HG MET 1 -16.412 3.646 4.533
8 2HG MET 1 2HG MET 1 -15.011 3.145 3.586
9 1HE MET 1 1HE MET 1 -16.903 5.484 5.241
10 2HE MET 1 2HE MET 1 -16.246 7.089 4.927
11 3HE MET 1 3HE MET 1 -17.565 6.459 3.930
12 HA PRO 2 HA PRO 2 -18.050 -0.472 5.779
13 1HB PRO 2 1HB PRO 2 -16.126 -2.369 6.198
14 2HB PRO 2 2HB PRO 2 -17.467 -2.589 5.057
15 1HG PRO 2 1HG PRO 2 -14.634 -1.860 4.529
16 2HG PRO 2 2HG PRO 2 -15.730 -2.889 3.593
17 1HD PRO 2 1HD PRO 2 -15.120 -0.300 2.933
18 2HD PRO 2 2HD PRO 2 -16.621 -1.123 2.458
19 H GLY 3 H GLY 3 -15.330 1.366 5.228
20 1HA GLY 3 1HA GLY 3 -14.850 2.771 7.360
21 2HA GLY 3 2HA GLY 3 -14.423 1.214 8.069
22 H THR 4 H THR 4 -12.326 0.578 7.872
23 HA THR 4 HA THR 4 -10.631 2.056 5.900
24 HB THR 4 HB THR 4 -10.095 2.372 8.340
25 HG1 THR 4 HG1 THR 4 -8.537 2.198 6.435
26 1HG2 THR 4 1HG2 THR 4 -10.324 -0.502 8.268
27 2HG2 THR 4 2HG2 THR 4 -8.717 -0.044 8.834
28 3HG2 THR 4 3HG2 THR 4 -10.150 0.559 9.666
29 H ILE 5 H ILE 5 -11.928 -0.995 6.680
30 HA ILE 5 HA ILE 5 -9.923 -2.819 5.949
31 HB ILE 5 HB ILE 5 -12.803 -3.064 5.051
32 1HG1 ILE 5 1HG1 ILE 5 -12.575 -4.335 7.511
33 2HG1 ILE 5 2HG1 ILE 5 -11.679 -2.833 7.748
34 1HG2 ILE 5 1HG2 ILE 5 -10.478 -4.871 5.430
35 2HG2 ILE 5 2HG2 ILE 5 -12.033 -5.488 5.991
36 3HG2 ILE 5 3HG2 ILE 5 -11.833 -4.999 4.308
37 1HD1 ILE 5 1HD1 ILE 5 -14.175 -2.425 6.276
38 2HD1 ILE 5 2HD1 ILE 5 -14.441 -3.108 7.879
39 3HD1 ILE 5 3HD1 ILE 5 -13.566 -1.586 7.704
40 H LYS 6 H LYS 6 -11.568 -0.491 3.984
41 HA LYS 6 HA LYS 6 -10.727 -1.824 1.476
42 1HB LYS 6 1HB LYS 6 -12.963 -0.451 1.981
43 2HB LYS 6 2HB LYS 6 -11.942 0.905 1.499
44 1HG LYS 6 1HG LYS 6 -11.376 -0.286 -0.602
45 2HG LYS 6 2HG LYS 6 -12.448 -1.605 -0.128
46 1HD LYS 6 1HD LYS 6 -13.678 -0.148 -1.619
47 2HD LYS 6 2HD LYS 6 -14.325 0.069 0.008
48 1HE LYS 6 1HE LYS 6 -13.352 2.185 0.257
49 2HE LYS 6 2HE LYS 6 -12.100 1.857 -0.957
50 1HZ LYS 6 1HZ LYS 6 -14.097 1.560 -2.531
51 2HZ LYS 6 2HZ LYS 6 -14.962 2.444 -1.366
52 3HZ LYS 6 3HZ LYS 6 -13.613 3.136 -2.131
53 H GLU 7 H GLU 7 -10.391 1.469 2.858
54 HA GLU 7 HA GLU 7 -8.299 2.291 1.126
55 1HB GLU 7 1HB GLU 7 -9.626 3.800 2.630
56 2HB GLU 7 2HB GLU 7 -8.713 3.166 3.999
57 1HG GLU 7 1HG GLU 7 -6.814 4.303 3.434
58 2HG GLU 7 2HG GLU 7 -7.093 4.109 1.702
59 H ASN 8 H ASN 8 -8.246 0.238 3.947
60 HA ASN 8 HA ASN 8 -5.489 0.499 4.640
61 1HB ASN 8 1HB ASN 8 -7.384 -0.763 5.883
62 2HB ASN 8 2HB ASN 8 -6.991 -2.110 4.814
63 1HD2 ASN 8 2HD2 ASN 8 -5.403 0.171 7.108
64 2HD2 ASN 8 1HD2 ASN 8 -4.210 -0.930 7.607
65 H ILE 9 H ILE 9 -7.124 -1.731 2.377
66 HA ILE 9 HA ILE 9 -4.683 -3.047 1.572
67 HB ILE 9 HB ILE 9 -7.194 -2.799 -0.096
68 1HG1 ILE 9 1HG1 ILE 9 -7.909 -3.417 2.144
69 2HG1 ILE 9 2HG1 ILE 9 -7.947 -4.861 1.131
70 1HG2 ILE 9 1HG2 ILE 9 -4.827 -4.002 -0.662
71 2HG2 ILE 9 2HG2 ILE 9 -5.652 -5.320 0.171
72 3HG2 ILE 9 3HG2 ILE 9 -6.378 -4.590 -1.261
73 1HD1 ILE 9 1HD1 ILE 9 -5.338 -4.788 2.137
74 2HD1 ILE 9 2HD1 ILE 9 -6.350 -4.322 3.504
75 3HD1 ILE 9 3HD1 ILE 9 -6.637 -5.853 2.676
76 H ILE 10 H ILE 10 -6.663 -0.485 0.047
77 HA ILE 10 HA ILE 10 -5.200 -0.041 -2.276
78 HB ILE 10 HB ILE 10 -6.315 2.095 -0.429
79 1HG1 ILE 10 1HG1 ILE 10 -7.574 0.601 -2.754
80 2HG1 ILE 10 2HG1 ILE 10 -7.972 0.364 -1.052
81 1HG2 ILE 10 1HG2 ILE 10 -4.732 2.838 -2.272
82 2HG2 ILE 10 2HG2 ILE 10 -5.895 2.186 -3.427
83 3HG2 ILE 10 3HG2 ILE 10 -6.357 3.517 -2.365
84 1HD1 ILE 10 1HD1 ILE 10 -8.100 3.154 -2.090
85 2HD1 ILE 10 2HD1 ILE 10 -9.363 2.044 -2.621
86 3HD1 ILE 10 3HD1 ILE 10 -9.123 2.349 -0.901
87 H GLY 11 H GLY 11 -4.275 0.637 1.023
88 1HA GLY 11 1HA GLY 11 -1.942 2.238 0.200
89 2HA GLY 11 2HA GLY 11 -2.375 1.817 1.857
90 H VAL 12 H VAL 12 -2.722 -1.061 1.057
91 HA VAL 12 HA VAL 12 -0.121 -2.000 1.737
92 HB VAL 12 HB VAL 12 -2.436 -3.402 0.370
93 1HG1 VAL 12 1HG1 VAL 12 -0.206 -4.481 -0.063
94 2HG1 VAL 12 2HG1 VAL 12 0.007 -4.629 1.682
95 3HG1 VAL 12 3HG1 VAL 12 -1.307 -5.489 0.878
96 1HG2 VAL 12 1HG2 VAL 12 -2.749 -2.510 2.715
97 2HG2 VAL 12 2HG2 VAL 12 -2.913 -4.261 2.581
98 3HG2 VAL 12 3HG2 VAL 12 -1.428 -3.562 3.226
99 H SER 13 H SER 13 -1.761 -1.834 -1.434
100 HA SER 13 HA SER 13 0.607 -2.776 -2.854
101 1HB SER 13 1HB SER 13 -1.843 -2.990 -3.618
102 2HB SER 13 2HB SER 13 -1.727 -1.292 -4.075
103 HG SER 13 HG SER 13 0.351 -2.172 -5.135
104 H TYR 14 H TYR 14 -0.471 0.230 -1.608
105 HA TYR 14 HA TYR 14 1.092 1.853 -3.502
106 1HB TYR 14 1HB TYR 14 -0.930 2.329 -1.454
107 2HB TYR 14 2HB TYR 14 0.421 3.455 -1.311
108 HD1 TYR 14 HD1 TYR 14 1.328 3.828 -4.042
109 HD2 TYR 14 HD2 TYR 14 -2.678 3.453 -2.539
110 HE1 TYR 14 HE1 TYR 14 0.477 5.101 -5.993
111 HE2 TYR 14 HE2 TYR 14 -3.529 4.726 -4.490
112 HH TYR 14 HH TYR 14 -2.299 6.583 -6.150
113 H ASP 15 H ASP 15 1.501 0.321 -0.408
114 HA ASP 15 HA ASP 15 3.770 1.947 0.424
115 1HB ASP 15 1HB ASP 15 2.549 -0.640 1.370
116 2HB ASP 15 2HB ASP 15 4.102 -0.096 2.004
117 H GLU 16 H GLU 16 3.501 -1.449 -0.730
118 HA GLU 16 HA GLU 16 6.183 -2.114 -0.926
119 1HB GLU 16 1HB GLU 16 3.759 -3.052 -2.072
120 2HB GLU 16 2HB GLU 16 4.910 -2.879 -3.395
121 1HG GLU 16 1HG GLU 16 6.502 -4.016 -1.500
122 2HG GLU 16 2HG GLU 16 4.946 -4.745 -1.099
123 H TYR 17 H TYR 17 4.347 0.089 -2.955
124 HA TYR 17 HA TYR 17 6.338 0.425 -5.007
125 1HB TYR 17 1HB TYR 17 4.305 1.310 -5.682
126 2HB TYR 17 2HB TYR 17 3.920 1.925 -4.076
127 HD1 TYR 17 HD1 TYR 17 6.738 2.395 -6.514
128 HD2 TYR 17 HD2 TYR 17 3.803 4.234 -3.980
129 HE1 TYR 17 HE1 TYR 17 7.574 4.638 -7.178
130 HE2 TYR 17 HE2 TYR 17 4.638 6.480 -4.637
131 HH TYR 17 HH TYR 17 6.963 7.383 -5.528
132 H ARG 18 H ARG 18 5.582 2.280 -2.051
133 HA ARG 18 HA ARG 18 7.881 4.034 -2.333
134 1HB ARG 18 1HB ARG 18 5.606 4.212 -0.900
135 2HB ARG 18 2HB ARG 18 6.669 3.562 0.348
136 1HG ARG 18 1HG ARG 18 8.148 5.401 0.209
137 2HG ARG 18 2HG ARG 18 7.506 5.908 -1.354
138 1HD ARG 18 1HD ARG 18 5.371 6.515 -0.303
139 2HD ARG 18 2HD ARG 18 5.972 5.968 1.261
140 HE ARG 18 HE ARG 18 7.699 7.979 0.078
141 1HH1 ARG 18 1HH1 ARG 18 7.288 7.902 2.973
142 2HH1 ARG 18 2HH1 ARG 18 6.194 9.214 3.259
143 1HH2 ARG 18 1HH2 ARG 18 5.204 9.461 -0.054
144 2HH2 ARG 18 2HH2 ARG 18 5.014 10.096 1.546
145 H TYR 19 H TYR 19 7.786 0.822 -1.810
146 HA TYR 19 HA TYR 19 10.103 0.814 0.043
147 1HB TYR 19 1HB TYR 19 7.781 -1.033 -0.451
148 2HB TYR 19 2HB TYR 19 9.254 -1.626 0.291
149 HD1 TYR 19 HD1 TYR 19 7.118 1.452 0.576
150 HD2 TYR 19 HD2 TYR 19 9.191 -1.710 2.607
151 HE1 TYR 19 HE1 TYR 19 6.397 2.383 2.760
152 HE2 TYR 19 HE2 TYR 19 8.471 -0.782 4.794
153 HH TYR 19 HH TYR 19 7.340 2.270 5.205
154 H ARG 20 H ARG 20 9.124 0.440 -3.149
155 HA ARG 20 HA ARG 20 11.015 -1.746 -3.779
156 1HB ARG 20 1HB ARG 20 8.567 -1.160 -4.778
157 2HB ARG 20 2HB ARG 20 9.583 -0.326 -5.953
158 1HG ARG 20 1HG ARG 20 9.250 -2.579 -6.746
159 2HG ARG 20 2HG ARG 20 10.918 -2.453 -6.184
160 1HD ARG 20 1HD ARG 20 9.713 -3.210 -3.879
161 2HD ARG 20 2HD ARG 20 8.648 -3.994 -5.046
162 HE ARG 20 HE ARG 20 11.176 -4.682 -5.924
163 1HH1 ARG 20 1HH1 ARG 20 8.964 -5.485 -3.491
164 2HH1 ARG 20 2HH1 ARG 20 10.008 -6.608 -2.684
165 1HH2 ARG 20 1HH2 ARG 20 12.769 -5.854 -4.644
166 2HH2 ARG 20 2HH2 ARG 20 12.163 -6.816 -3.337
167 H SER 21 H SER 21 10.378 1.400 -5.397
168 HA SER 21 HA SER 21 13.168 1.463 -6.290
169 1HB SER 21 1HB SER 21 11.241 2.178 -7.739
170 2HB SER 21 2HB SER 21 11.030 3.565 -6.675
171 HG SER 21 HG SER 21 12.832 3.153 -8.655
172 H VAL 22 H VAL 22 12.303 1.905 -3.387
173 HA VAL 22 HA VAL 22 13.925 4.357 -2.991
174 HB VAL 22 HB VAL 22 11.942 5.298 -2.423
175 1HG1 VAL 22 1HG1 VAL 22 10.693 3.350 -3.303
176 2HG1 VAL 22 2HG1 VAL 22 10.825 2.584 -1.720
177 3HG1 VAL 22 3HG1 VAL 22 9.910 4.080 -1.902
178 1HG2 VAL 22 1HG2 VAL 22 13.250 4.644 -0.201
179 2HG2 VAL 22 2HG2 VAL 22 11.656 5.394 -0.117
180 3HG2 VAL 22 3HG2 VAL 22 11.820 3.649 0.071
181 H ILE 23 H ILE 23 12.369 1.782 -1.031
182 HA ILE 23 HA ILE 23 14.797 1.634 0.638
183 HB ILE 23 HB ILE 23 12.114 0.234 0.758
184 1HG1 ILE 23 1HG1 ILE 23 12.969 1.726 3.090
185 2HG1 ILE 23 2HG1 ILE 23 13.034 2.745 1.652
186 1HG2 ILE 23 1HG2 ILE 23 14.661 -0.190 2.305
187 2HG2 ILE 23 2HG2 ILE 23 13.101 -0.451 3.085
188 3HG2 ILE 23 3HG2 ILE 23 13.543 -1.393 1.661
189 1HD1 ILE 23 1HD1 ILE 23 10.627 1.034 1.888
190 2HD1 ILE 23 2HD1 ILE 23 10.762 2.323 3.084
191 3HD1 ILE 23 3HD1 ILE 23 10.771 2.712 1.364
192 H LYS 24 H LYS 24 13.116 -0.252 -1.820
193 HA LYS 24 HA LYS 24 13.691 -2.303 -2.832
194 1HB LYS 24 1HB LYS 24 15.566 -0.455 -3.379
195 2HB LYS 24 2HB LYS 24 16.575 -1.619 -2.521
196 1HG LYS 24 1HG LYS 24 14.697 -2.515 -4.703
197 2HG LYS 24 2HG LYS 24 16.309 -1.908 -5.085
198 1HD LYS 24 1HD LYS 24 16.968 -3.625 -3.124
199 2HD LYS 24 2HD LYS 24 15.509 -4.424 -3.712
200 1HE LYS 24 1HE LYS 24 16.489 -5.022 -5.691
201 2HE LYS 24 2HE LYS 24 17.364 -3.484 -5.828
202 1HZ LYS 24 1HZ LYS 24 18.028 -5.472 -3.740
203 2HZ LYS 24 2HZ LYS 24 18.738 -5.539 -5.282
204 3HZ LYS 24 3HZ LYS 24 18.969 -4.175 -4.296
205 H ALA 25 H ALA 25 13.077 -3.060 -0.422
206 HA ALA 25 HA ALA 25 14.640 -5.317 0.188
207 1HB ALA 25 1HB ALA 25 15.637 -2.805 1.373
208 2HB ALA 25 2HB ALA 25 15.410 -4.115 2.532
209 3HB ALA 25 3HB ALA 25 16.466 -4.343 1.137
Start of MODEL 8
1 1H MET 1 1H MET 1 -15.023 1.509 11.669
2 2H MET 1 2H MET 1 -13.336 1.444 11.487
3 3H MET 1 3H MET 1 -14.108 2.938 11.702
4 HA MET 1 HA MET 1 -15.180 2.769 9.559
5 1HB MET 1 1HB MET 1 -12.274 2.614 10.069
6 2HB MET 1 2HB MET 1 -12.735 2.317 8.391
7 1HG MET 1 1HG MET 1 -14.139 4.426 8.514
8 2HG MET 1 2HG MET 1 -13.381 4.752 10.072
9 1HE MET 1 1HE MET 1 -13.590 4.838 6.661
10 2HE MET 1 2HE MET 1 -12.319 5.953 6.141
11 3HE MET 1 3HE MET 1 -12.077 4.213 6.010
12 HA PRO 2 HA PRO 2 -15.256 -1.792 8.891
13 1HB PRO 2 1HB PRO 2 -17.972 -2.046 8.756
14 2HB PRO 2 2HB PRO 2 -17.076 -2.091 10.287
15 1HG PRO 2 1HG PRO 2 -18.717 0.074 9.125
16 2HG PRO 2 2HG PRO 2 -18.414 -0.334 10.819
17 1HD PRO 2 1HD PRO 2 -17.205 1.736 9.383
18 2HD PRO 2 2HD PRO 2 -16.659 1.083 10.940
19 H GLY 3 H GLY 3 -15.776 0.940 7.152
20 1HA GLY 3 1HA GLY 3 -16.674 -0.584 4.736
21 2HA GLY 3 2HA GLY 3 -17.070 1.115 4.994
22 H THR 4 H THR 4 -14.057 -0.823 5.168
23 HA THR 4 HA THR 4 -12.882 0.907 3.076
24 HB THR 4 HB THR 4 -12.437 2.012 5.299
25 HG1 THR 4 HG1 THR 4 -10.289 0.942 3.798
26 1HG2 THR 4 1HG2 THR 4 -12.134 -0.455 6.291
27 2HG2 THR 4 2HG2 THR 4 -10.446 -0.122 5.901
28 3HG2 THR 4 3HG2 THR 4 -11.323 0.941 7.002
29 H ILE 5 H ILE 5 -13.511 -1.716 2.704
30 HA ILE 5 HA ILE 5 -11.327 -3.500 3.419
31 HB ILE 5 HB ILE 5 -13.501 -3.772 1.317
32 1HG1 ILE 5 1HG1 ILE 5 -14.504 -3.626 3.496
33 2HG1 ILE 5 2HG1 ILE 5 -14.451 -5.341 3.087
34 1HG2 ILE 5 1HG2 ILE 5 -11.518 -5.749 2.475
35 2HG2 ILE 5 2HG2 ILE 5 -12.944 -6.225 1.553
36 3HG2 ILE 5 3HG2 ILE 5 -11.679 -5.264 0.787
37 1HD1 ILE 5 1HD1 ILE 5 -12.129 -5.289 4.298
38 2HD1 ILE 5 2HD1 ILE 5 -12.746 -3.809 5.033
39 3HD1 ILE 5 3HD1 ILE 5 -13.602 -5.334 5.268
40 H LYS 6 H LYS 6 -12.062 -1.362 0.749
41 HA LYS 6 HA LYS 6 -9.653 -2.354 -0.706
42 1HB LYS 6 1HB LYS 6 -11.865 -0.524 -1.690
43 2HB LYS 6 2HB LYS 6 -10.565 -1.211 -2.664
44 1HG LYS 6 1HG LYS 6 -11.471 -3.505 -1.776
45 2HG LYS 6 2HG LYS 6 -12.941 -2.589 -1.444
46 1HD LYS 6 1HD LYS 6 -13.514 -2.769 -3.611
47 2HD LYS 6 2HD LYS 6 -12.074 -1.847 -4.046
48 1HE LYS 6 1HE LYS 6 -10.741 -3.880 -4.182
49 2HE LYS 6 2HE LYS 6 -12.102 -4.851 -3.583
50 1HZ LYS 6 1HZ LYS 6 -13.423 -4.028 -5.469
51 2HZ LYS 6 2HZ LYS 6 -12.051 -3.228 -6.074
52 3HZ LYS 6 3HZ LYS 6 -12.076 -4.924 -5.979
53 H GLU 7 H GLU 7 -11.181 0.539 0.657
54 HA GLU 7 HA GLU 7 -9.174 2.401 -0.206
55 1HB GLU 7 1HB GLU 7 -11.558 2.506 1.299
56 2HB GLU 7 2HB GLU 7 -10.290 3.105 2.371
57 1HG GLU 7 1HG GLU 7 -9.708 4.277 -0.095
58 2HG GLU 7 2HG GLU 7 -11.467 4.369 0.024
59 H ASN 8 H ASN 8 -9.147 -0.100 2.121
60 HA ASN 8 HA ASN 8 -7.118 1.079 3.859
61 1HB ASN 8 1HB ASN 8 -8.786 -0.705 4.561
62 2HB ASN 8 2HB ASN 8 -7.852 -1.848 3.595
63 1HD2 ASN 8 2HD2 ASN 8 -8.187 -1.772 6.583
64 2HD2 ASN 8 1HD2 ASN 8 -6.613 -1.656 7.211
65 H ILE 9 H ILE 9 -7.102 -1.621 1.498
66 HA ILE 9 HA ILE 9 -4.229 -1.866 1.522
67 HB ILE 9 HB ILE 9 -6.245 -2.722 -0.579
68 1HG1 ILE 9 1HG1 ILE 9 -6.603 -3.696 1.683
69 2HG1 ILE 9 2HG1 ILE 9 -6.084 -4.915 0.519
70 1HG2 ILE 9 1HG2 ILE 9 -3.753 -2.518 -1.231
71 2HG2 ILE 9 2HG2 ILE 9 -3.486 -3.860 -0.119
72 3HG2 ILE 9 3HG2 ILE 9 -4.538 -4.070 -1.519
73 1HD1 ILE 9 1HD1 ILE 9 -3.751 -4.664 1.319
74 2HD1 ILE 9 2HD1 ILE 9 -4.297 -3.486 2.511
75 3HD1 ILE 9 3HD1 ILE 9 -4.833 -5.163 2.619
76 H ILE 10 H ILE 10 -6.497 0.092 -0.311
77 HA ILE 10 HA ILE 10 -4.933 0.884 -2.489
78 HB ILE 10 HB ILE 10 -7.030 2.250 -0.856
79 1HG1 ILE 10 1HG1 ILE 10 -7.422 0.496 -2.653
80 2HG1 ILE 10 2HG1 ILE 10 -8.256 2.022 -2.894
81 1HG2 ILE 10 1HG2 ILE 10 -5.229 3.531 -2.919
82 2HG2 ILE 10 2HG2 ILE 10 -6.880 4.097 -2.669
83 3HG2 ILE 10 3HG2 ILE 10 -5.714 4.165 -1.347
84 1HD1 ILE 10 1HD1 ILE 10 -5.536 1.636 -4.087
85 2HD1 ILE 10 2HD1 ILE 10 -6.948 0.957 -4.898
86 3HD1 ILE 10 3HD1 ILE 10 -6.841 2.695 -4.620
87 H GLY 11 H GLY 11 -4.763 1.946 0.881
88 1HA GLY 11 1HA GLY 11 -2.610 3.865 0.244
89 2HA GLY 11 2HA GLY 11 -3.330 3.610 1.833
90 H VAL 12 H VAL 12 -3.047 0.687 1.706
91 HA VAL 12 HA VAL 12 -0.371 0.487 2.780
92 HB VAL 12 HB VAL 12 -2.459 -1.584 2.061
93 1HG1 VAL 12 1HG1 VAL 12 0.393 -1.882 2.756
94 2HG1 VAL 12 2HG1 VAL 12 -0.703 -2.837 3.754
95 3HG1 VAL 12 3HG1 VAL 12 -0.709 -3.035 2.001
96 1HG2 VAL 12 1HG2 VAL 12 -1.525 -0.198 4.564
97 2HG2 VAL 12 2HG2 VAL 12 -3.173 -0.452 3.986
98 3HG2 VAL 12 3HG2 VAL 12 -2.259 -1.798 4.667
99 H SER 13 H SER 13 -1.875 -0.403 -0.305
100 HA SER 13 HA SER 13 0.467 -1.746 -1.344
101 1HB SER 13 1HB SER 13 -2.180 -1.416 -2.164
102 2HB SER 13 2HB SER 13 -1.247 -0.537 -3.373
103 HG SER 13 HG SER 13 -0.754 -2.418 -4.145
104 H TYR 14 H TYR 14 -0.293 1.536 -0.818
105 HA TYR 14 HA TYR 14 1.278 2.618 -3.027
106 1HB TYR 14 1HB TYR 14 -0.250 3.686 -0.729
107 2HB TYR 14 2HB TYR 14 1.140 4.656 -1.219
108 HD1 TYR 14 HD1 TYR 14 -1.407 2.593 -3.054
109 HD2 TYR 14 HD2 TYR 14 0.528 6.404 -2.627
110 HE1 TYR 14 HE1 TYR 14 -2.695 3.464 -4.987
111 HE2 TYR 14 HE2 TYR 14 -0.759 7.275 -4.559
112 HH TYR 14 HH TYR 14 -1.983 5.819 -6.757
113 H ASP 15 H ASP 15 1.783 2.307 0.508
114 HA ASP 15 HA ASP 15 4.413 3.359 0.576
115 1HB ASP 15 1HB ASP 15 2.737 2.363 2.465
116 2HB ASP 15 2HB ASP 15 3.872 1.019 2.324
117 H GLU 16 H GLU 16 3.318 -0.004 0.057
118 HA GLU 16 HA GLU 16 5.775 -1.311 -0.114
119 1HB GLU 16 1HB GLU 16 3.119 -1.851 -0.930
120 2HB GLU 16 2HB GLU 16 4.127 -2.109 -2.355
121 1HG GLU 16 1HG GLU 16 4.163 -4.197 -1.249
122 2HG GLU 16 2HG GLU 16 5.683 -3.438 -0.774
123 H TYR 17 H TYR 17 4.201 0.764 -2.507
124 HA TYR 17 HA TYR 17 6.139 0.404 -4.595
125 1HB TYR 17 1HB TYR 17 4.327 1.493 -5.491
126 2HB TYR 17 2HB TYR 17 3.923 2.278 -3.969
127 HD1 TYR 17 HD1 TYR 17 6.547 2.339 -6.645
128 HD2 TYR 17 HD2 TYR 17 4.306 4.571 -3.740
129 HE1 TYR 17 HE1 TYR 17 7.584 4.440 -7.463
130 HE2 TYR 17 HE2 TYR 17 5.344 6.674 -4.555
131 HH TYR 17 HH TYR 17 6.965 6.915 -7.463
132 H ARG 18 H ARG 18 5.702 3.151 -2.347
133 HA ARG 18 HA ARG 18 8.169 4.426 -2.818
134 1HB ARG 18 1HB ARG 18 6.290 5.299 -1.372
135 2HB ARG 18 2HB ARG 18 6.796 4.163 -0.124
136 1HG ARG 18 1HG ARG 18 9.001 5.204 -0.013
137 2HG ARG 18 2HG ARG 18 8.581 6.292 -1.336
138 1HD ARG 18 1HD ARG 18 6.778 7.270 0.033
139 2HD ARG 18 2HD ARG 18 7.186 6.177 1.355
140 HE ARG 18 HE ARG 18 8.633 7.969 1.918
141 1HH1 ARG 18 1HH1 ARG 18 10.582 6.439 0.133
142 2HH1 ARG 18 2HH1 ARG 18 11.195 7.718 -0.861
143 1HH2 ARG 18 1HH2 ARG 18 8.658 9.933 -0.034
144 2HH2 ARG 18 2HH2 ARG 18 10.105 9.698 -0.956
145 H TYR 19 H TYR 19 7.429 1.464 -1.206
146 HA TYR 19 HA TYR 19 10.037 1.282 0.141
147 1HB TYR 19 1HB TYR 19 7.518 -0.364 0.013
148 2HB TYR 19 2HB TYR 19 8.989 -1.030 0.692
149 HD1 TYR 19 HD1 TYR 19 8.906 2.503 1.104
150 HD2 TYR 19 HD2 TYR 19 7.379 -1.156 2.757
151 HE1 TYR 19 HE1 TYR 19 8.446 3.662 3.251
152 HE2 TYR 19 HE2 TYR 19 6.921 0.002 4.903
153 HH TYR 19 HH TYR 19 6.748 3.236 5.242
154 H ARG 20 H ARG 20 8.734 0.614 -2.913
155 HA ARG 20 HA ARG 20 10.159 -1.850 -3.476
156 1HB ARG 20 1HB ARG 20 8.156 -1.255 -4.744
157 2HB ARG 20 2HB ARG 20 8.937 0.214 -5.328
158 1HG ARG 20 1HG ARG 20 10.740 -1.848 -5.935
159 2HG ARG 20 2HG ARG 20 9.151 -2.495 -6.345
160 1HD ARG 20 1HD ARG 20 8.775 -0.915 -7.983
161 2HD ARG 20 2HD ARG 20 9.751 0.310 -7.172
162 HE ARG 20 HE ARG 20 11.014 -2.020 -8.558
163 1HH1 ARG 20 1HH1 ARG 20 10.187 1.150 -9.126
164 2HH1 ARG 20 2HH1 ARG 20 11.791 1.708 -9.467
165 1HH2 ARG 20 1HH2 ARG 20 13.318 -1.232 -8.444
166 2HH2 ARG 20 2HH2 ARG 20 13.562 0.361 -9.079
167 H SER 21 H SER 21 10.946 1.569 -3.702
168 HA SER 21 HA SER 21 13.477 0.853 -5.102
169 1HB SER 21 1HB SER 21 11.932 2.709 -5.984
170 2HB SER 21 2HB SER 21 12.467 3.651 -4.595
171 HG SER 21 HG SER 21 14.225 4.040 -5.658
172 H VAL 22 H VAL 22 12.928 0.443 -2.201
173 HA VAL 22 HA VAL 22 15.362 1.713 -1.198
174 HB VAL 22 HB VAL 22 13.961 3.439 -0.567
175 1HG1 VAL 22 1HG1 VAL 22 11.824 1.345 -0.223
176 2HG1 VAL 22 2HG1 VAL 22 11.599 3.039 0.211
177 3HG1 VAL 22 3HG1 VAL 22 11.911 2.591 -1.466
178 1HG2 VAL 22 1HG2 VAL 22 14.962 2.173 1.455
179 2HG2 VAL 22 2HG2 VAL 22 13.661 3.320 1.779
180 3HG2 VAL 22 3HG2 VAL 22 13.318 1.591 1.724
181 H ILE 23 H ILE 23 12.523 -0.334 -0.520
182 HA ILE 23 HA ILE 23 14.207 -1.930 1.358
183 HB ILE 23 HB ILE 23 11.201 -1.713 1.024
184 1HG1 ILE 23 1HG1 ILE 23 12.394 -1.356 3.673
185 2HG1 ILE 23 2HG1 ILE 23 13.013 -0.196 2.496
186 1HG2 ILE 23 1HG2 ILE 23 12.879 -3.593 2.701
187 2HG2 ILE 23 2HG2 ILE 23 11.174 -3.277 3.024
188 3HG2 ILE 23 3HG2 ILE 23 11.661 -4.022 1.501
189 1HD1 ILE 23 1HD1 ILE 23 10.681 0.380 1.867
190 2HD1 ILE 23 2HD1 ILE 23 10.090 -0.735 3.098
191 3HD1 ILE 23 3HD1 ILE 23 10.999 0.700 3.572
192 H LYS 24 H LYS 24 12.286 -2.051 -1.576
193 HA LYS 24 HA LYS 24 11.901 -3.810 -3.097
194 1HB LYS 24 1HB LYS 24 14.727 -4.546 -2.286
195 2HB LYS 24 2HB LYS 24 13.936 -4.901 -3.821
196 1HG LYS 24 1HG LYS 24 13.746 -2.473 -4.274
197 2HG LYS 24 2HG LYS 24 14.577 -2.134 -2.755
198 1HD LYS 24 1HD LYS 24 16.395 -3.779 -3.757
199 2HD LYS 24 2HD LYS 24 15.664 -3.303 -5.291
200 1HE LYS 24 1HE LYS 24 15.968 -0.904 -3.830
201 2HE LYS 24 2HE LYS 24 17.489 -1.797 -3.628
202 1HZ LYS 24 1HZ LYS 24 17.342 -2.276 -6.076
203 2HZ LYS 24 2HZ LYS 24 16.108 -1.111 -6.161
204 3HZ LYS 24 3HZ LYS 24 17.668 -0.658 -5.674
205 H ALA 25 H ALA 25 10.454 -4.659 -1.195
206 HA ALA 25 HA ALA 25 9.669 -6.512 0.012
207 1HB ALA 25 1HB ALA 25 10.667 -7.446 -2.391
208 2HB ALA 25 2HB ALA 25 11.511 -8.445 -1.209
209 3HB ALA 25 3HB ALA 25 9.748 -8.405 -1.233
Start of MODEL 9
1 1H MET 1 1H MET 1 -20.604 4.318 2.076
2 2H MET 1 2H MET 1 -19.973 5.851 2.434
3 3H MET 1 3H MET 1 -19.401 4.994 1.083
4 HA MET 1 HA MET 1 -17.734 4.728 2.714
5 1HB MET 1 1HB MET 1 -19.432 5.586 4.440
6 2HB MET 1 2HB MET 1 -19.946 3.907 4.612
7 1HG MET 1 1HG MET 1 -18.299 3.762 6.168
8 2HG MET 1 2HG MET 1 -17.207 3.689 4.784
9 1HE MET 1 1HE MET 1 -19.285 5.975 6.989
10 2HE MET 1 2HE MET 1 -17.958 5.488 8.040
11 3HE MET 1 3HE MET 1 -18.128 7.178 7.575
12 HA PRO 2 HA PRO 2 -18.507 0.512 1.201
13 1HB PRO 2 1HB PRO 2 -15.954 0.117 0.296
14 2HB PRO 2 2HB PRO 2 -17.197 0.958 -0.652
15 1HG PRO 2 1HG PRO 2 -14.947 2.076 0.932
16 2HG PRO 2 2HG PRO 2 -15.633 2.628 -0.603
17 1HD PRO 2 1HD PRO 2 -16.151 3.793 1.826
18 2HD PRO 2 2HD PRO 2 -17.239 3.880 0.423
19 H GLY 3 H GLY 3 -16.801 1.834 3.735
20 1HA GLY 3 1HA GLY 3 -16.462 0.564 5.789
21 2HA GLY 3 2HA GLY 3 -16.169 -0.872 4.807
22 H THR 4 H THR 4 -14.216 -0.809 6.389
23 HA THR 4 HA THR 4 -12.074 0.999 5.384
24 HB THR 4 HB THR 4 -12.476 0.825 7.856
25 HG1 THR 4 HG1 THR 4 -10.080 0.141 6.604
26 1HG2 THR 4 1HG2 THR 4 -12.245 -2.016 7.178
27 2HG2 THR 4 2HG2 THR 4 -11.230 -1.547 8.542
28 3HG2 THR 4 3HG2 THR 4 -12.967 -1.254 8.595
29 H ILE 5 H ILE 5 -13.094 -1.329 3.863
30 HA ILE 5 HA ILE 5 -11.103 -3.442 4.093
31 HB ILE 5 HB ILE 5 -13.136 -2.795 1.939
32 1HG1 ILE 5 1HG1 ILE 5 -13.922 -3.514 4.254
33 2HG1 ILE 5 2HG1 ILE 5 -14.435 -4.558 2.926
34 1HG2 ILE 5 1HG2 ILE 5 -10.903 -4.698 2.022
35 2HG2 ILE 5 2HG2 ILE 5 -12.459 -5.471 1.713
36 3HG2 ILE 5 3HG2 ILE 5 -11.888 -4.182 0.653
37 1HD1 ILE 5 1HD1 ILE 5 -11.889 -5.118 4.441
38 2HD1 ILE 5 2HD1 ILE 5 -13.446 -5.693 5.038
39 3HD1 ILE 5 3HD1 ILE 5 -12.855 -6.224 3.465
40 H LYS 6 H LYS 6 -11.646 -0.711 1.868
41 HA LYS 6 HA LYS 6 -9.003 -1.289 0.623
42 1HB LYS 6 1HB LYS 6 -11.422 0.282 -0.228
43 2HB LYS 6 2HB LYS 6 -9.851 0.616 -0.957
44 1HG LYS 6 1HG LYS 6 -10.242 -1.111 -2.354
45 2HG LYS 6 2HG LYS 6 -10.042 -2.175 -0.962
46 1HD LYS 6 1HD LYS 6 -12.430 -2.056 -0.475
47 2HD LYS 6 2HD LYS 6 -12.664 -0.893 -1.783
48 1HE LYS 6 1HE LYS 6 -11.383 -3.539 -2.417
49 2HE LYS 6 2HE LYS 6 -13.147 -3.450 -2.233
50 1HZ LYS 6 1HZ LYS 6 -11.786 -1.368 -3.789
51 2HZ LYS 6 2HZ LYS 6 -12.023 -2.882 -4.516
52 3HZ LYS 6 3HZ LYS 6 -13.358 -1.990 -3.960
53 H GLU 7 H GLU 7 -10.507 0.801 2.886
54 HA GLU 7 HA GLU 7 -8.843 3.128 2.454
55 1HB GLU 7 1HB GLU 7 -10.767 2.198 4.505
56 2HB GLU 7 2HB GLU 7 -9.523 3.304 5.085
57 1HG GLU 7 1HG GLU 7 -10.172 5.010 3.583
58 2HG GLU 7 2HG GLU 7 -11.086 3.889 2.571
59 H ASN 8 H ASN 8 -8.457 0.127 4.241
60 HA ASN 8 HA ASN 8 -5.983 1.149 5.515
61 1HB ASN 8 1HB ASN 8 -7.718 -0.321 6.717
62 2HB ASN 8 2HB ASN 8 -7.091 -1.651 5.744
63 1HD2 ASN 8 2HD2 ASN 8 -6.803 -1.607 8.606
64 2HD2 ASN 8 1HD2 ASN 8 -5.152 -1.452 8.966
65 H ILE 9 H ILE 9 -7.031 -1.241 3.108
66 HA ILE 9 HA ILE 9 -4.439 -2.404 2.695
67 HB ILE 9 HB ILE 9 -6.658 -2.141 0.647
68 1HG1 ILE 9 1HG1 ILE 9 -7.390 -3.063 2.899
69 2HG1 ILE 9 2HG1 ILE 9 -7.590 -4.175 1.543
70 1HG2 ILE 9 1HG2 ILE 9 -4.458 -2.940 -0.182
71 2HG2 ILE 9 2HG2 ILE 9 -4.471 -4.209 1.045
72 3HG2 ILE 9 3HG2 ILE 9 -5.678 -4.212 -0.242
73 1HD1 ILE 9 1HD1 ILE 9 -5.079 -4.181 3.216
74 2HD1 ILE 9 2HD1 ILE 9 -6.502 -5.108 3.694
75 3HD1 ILE 9 3HD1 ILE 9 -5.699 -5.453 2.162
76 H ILE 10 H ILE 10 -6.123 0.324 1.131
77 HA ILE 10 HA ILE 10 -4.317 0.892 -0.932
78 HB ILE 10 HB ILE 10 -5.954 2.700 0.857
79 1HG1 ILE 10 1HG1 ILE 10 -6.107 1.956 -2.083
80 2HG1 ILE 10 2HG1 ILE 10 -7.126 1.293 -0.807
81 1HG2 ILE 10 1HG2 ILE 10 -3.943 3.962 0.148
82 2HG2 ILE 10 2HG2 ILE 10 -4.266 3.523 -1.530
83 3HG2 ILE 10 3HG2 ILE 10 -5.391 4.563 -0.657
84 1HD1 ILE 10 1HD1 ILE 10 -7.890 3.634 -0.294
85 2HD1 ILE 10 2HD1 ILE 10 -6.998 4.182 -1.713
86 3HD1 ILE 10 3HD1 ILE 10 -8.356 3.073 -1.901
87 H GLY 11 H GLY 11 -4.088 1.744 2.514
88 1HA GLY 11 1HA GLY 11 -1.599 3.188 2.248
89 2HA GLY 11 2HA GLY 11 -2.252 2.543 3.757
90 H VAL 12 H VAL 12 -2.483 -0.180 2.701
91 HA VAL 12 HA VAL 12 0.198 -1.101 3.321
92 HB VAL 12 HB VAL 12 -2.202 -2.613 2.232
93 1HG1 VAL 12 1HG1 VAL 12 0.509 -3.443 3.232
94 2HG1 VAL 12 2HG1 VAL 12 -0.876 -4.509 3.473
95 3HG1 VAL 12 3HG1 VAL 12 -0.394 -4.043 1.841
96 1HG2 VAL 12 1HG2 VAL 12 -1.665 -1.443 4.794
97 2HG2 VAL 12 2HG2 VAL 12 -3.048 -2.423 4.311
98 3HG2 VAL 12 3HG2 VAL 12 -1.602 -3.198 4.961
99 H SER 13 H SER 13 -1.696 -0.614 0.392
100 HA SER 13 HA SER 13 0.425 -1.819 -1.281
101 1HB SER 13 1HB SER 13 -2.395 -1.023 -1.649
102 2HB SER 13 2HB SER 13 -1.355 -0.688 -3.031
103 HG SER 13 HG SER 13 -2.340 -3.027 -2.188
104 H TYR 14 H TYR 14 0.537 0.828 0.348
105 HA TYR 14 HA TYR 14 1.451 2.544 -1.930
106 1HB TYR 14 1HB TYR 14 -0.257 3.115 0.361
107 2HB TYR 14 2HB TYR 14 1.136 4.196 0.307
108 HD1 TYR 14 HD1 TYR 14 1.718 4.706 -2.412
109 HD2 TYR 14 HD2 TYR 14 -2.131 4.091 -0.609
110 HE1 TYR 14 HE1 TYR 14 0.654 5.990 -4.247
111 HE2 TYR 14 HE2 TYR 14 -3.197 5.374 -2.444
112 HH TYR 14 HH TYR 14 -2.513 7.137 -4.091
113 H ASP 15 H ASP 15 2.223 1.087 1.138
114 HA ASP 15 HA ASP 15 4.789 2.564 1.303
115 1HB ASP 15 1HB ASP 15 3.044 1.269 3.193
116 2HB ASP 15 2HB ASP 15 4.651 0.547 3.293
117 H GLU 16 H GLU 16 3.648 -0.828 1.168
118 HA GLU 16 HA GLU 16 6.130 -2.118 0.958
119 1HB GLU 16 1HB GLU 16 3.391 -2.780 0.489
120 2HB GLU 16 2HB GLU 16 4.334 -3.362 -0.882
121 1HG GLU 16 1HG GLU 16 5.850 -4.554 0.613
122 2HG GLU 16 2HG GLU 16 5.016 -3.900 2.022
123 H TYR 17 H TYR 17 4.330 -0.348 -1.499
124 HA TYR 17 HA TYR 17 6.169 -1.149 -3.639
125 1HB TYR 17 1HB TYR 17 4.129 1.086 -3.668
126 2HB TYR 17 2HB TYR 17 4.812 0.236 -5.056
127 HD1 TYR 17 HD1 TYR 17 4.677 -2.428 -3.084
128 HD2 TYR 17 HD2 TYR 17 1.913 0.404 -4.751
129 HE1 TYR 17 HE1 TYR 17 2.864 -4.120 -2.957
130 HE2 TYR 17 HE2 TYR 17 0.099 -1.286 -4.626
131 HH TYR 17 HH TYR 17 0.728 -4.605 -3.955
132 H ARG 18 H ARG 18 5.347 2.031 -2.163
133 HA ARG 18 HA ARG 18 7.538 3.452 -3.229
134 1HB ARG 18 1HB ARG 18 5.567 4.073 -1.432
135 2HB ARG 18 2HB ARG 18 6.970 3.985 -0.366
136 1HG ARG 18 1HG ARG 18 8.188 5.502 -1.962
137 2HG ARG 18 2HG ARG 18 6.675 5.699 -2.847
138 1HD ARG 18 1HD ARG 18 6.263 7.417 -1.434
139 2HD ARG 18 2HD ARG 18 5.919 6.176 -0.229
140 HE ARG 18 HE ARG 18 8.607 6.422 0.039
141 1HH1 ARG 18 1HH1 ARG 18 8.235 9.141 -1.314
142 2HH1 ARG 18 2HH1 ARG 18 8.101 10.178 0.067
143 1HH2 ARG 18 1HH2 ARG 18 7.500 7.581 2.288
144 2HH2 ARG 18 2HH2 ARG 18 7.685 9.294 2.108
145 H TYR 19 H TYR 19 7.334 0.957 -0.852
146 HA TYR 19 HA TYR 19 9.804 1.234 0.519
147 1HB TYR 19 1HB TYR 19 7.716 -0.744 0.203
148 2HB TYR 19 2HB TYR 19 9.295 -1.519 0.141
149 HD1 TYR 19 HD1 TYR 19 10.863 0.335 1.833
150 HD2 TYR 19 HD2 TYR 19 6.936 -1.299 2.382
151 HE1 TYR 19 HE1 TYR 19 11.121 0.569 4.291
152 HE2 TYR 19 HE2 TYR 19 7.186 -1.069 4.846
153 HH TYR 19 HH TYR 19 9.147 0.817 6.323
154 H ARG 20 H ARG 20 8.965 -0.206 -2.610
155 HA ARG 20 HA ARG 20 11.527 -1.444 -3.073
156 1HB ARG 20 1HB ARG 20 9.532 -0.463 -5.139
157 2HB ARG 20 2HB ARG 20 10.785 -1.680 -5.377
158 1HG ARG 20 1HG ARG 20 9.585 -2.863 -3.338
159 2HG ARG 20 2HG ARG 20 8.209 -1.889 -3.858
160 1HD ARG 20 1HD ARG 20 8.010 -3.945 -5.048
161 2HD ARG 20 2HD ARG 20 8.652 -2.789 -6.215
162 HE ARG 20 HE ARG 20 10.597 -4.473 -4.738
163 1HH1 ARG 20 1HH1 ARG 20 8.510 -5.050 -7.241
164 2HH1 ARG 20 2HH1 ARG 20 9.721 -5.322 -8.449
165 1HH2 ARG 20 1HH2 ARG 20 12.338 -4.221 -6.455
166 2HH2 ARG 20 2HH2 ARG 20 11.888 -4.849 -8.005
167 H SER 21 H SER 21 10.286 1.800 -3.497
168 HA SER 21 HA SER 21 12.664 2.589 -5.066
169 1HB SER 21 1HB SER 21 10.260 3.466 -5.470
170 2HB SER 21 2HB SER 21 10.537 4.464 -4.046
171 HG SER 21 HG SER 21 12.286 5.399 -5.083
172 H VAL 22 H VAL 22 12.857 1.685 -2.276
173 HA VAL 22 HA VAL 22 14.402 3.957 -1.235
174 HB VAL 22 HB VAL 22 12.423 4.455 -0.136
175 1HG1 VAL 22 1HG1 VAL 22 11.410 2.229 -1.088
176 2HG1 VAL 22 2HG1 VAL 22 11.765 1.614 0.519
177 3HG1 VAL 22 3HG1 VAL 22 10.683 2.992 0.320
178 1HG2 VAL 22 1HG2 VAL 22 14.417 3.421 1.398
179 2HG2 VAL 22 2HG2 VAL 22 12.956 4.155 2.061
180 3HG2 VAL 22 3HG2 VAL 22 13.062 2.403 1.888
181 H ILE 23 H ILE 23 13.344 0.568 -0.841
182 HA ILE 23 HA ILE 23 15.723 -0.050 0.784
183 HB ILE 23 HB ILE 23 13.922 -2.145 -0.412
184 1HG1 ILE 23 1HG1 ILE 23 13.227 -0.892 2.220
185 2HG1 ILE 23 2HG1 ILE 23 12.668 -0.108 0.743
186 1HG2 ILE 23 1HG2 ILE 23 16.056 -2.486 1.070
187 2HG2 ILE 23 2HG2 ILE 23 14.990 -2.013 2.393
188 3HG2 ILE 23 3HG2 ILE 23 14.606 -3.429 1.416
189 1HD1 ILE 23 1HD1 ILE 23 11.996 -2.629 0.131
190 2HD1 ILE 23 2HD1 ILE 23 11.910 -2.753 1.888
191 3HD1 ILE 23 3HD1 ILE 23 10.916 -1.572 1.037
192 H LYS 24 H LYS 24 14.411 -1.214 -2.350
193 HA LYS 24 HA LYS 24 16.806 -2.548 -3.149
194 1HB LYS 24 1HB LYS 24 14.696 -2.991 -4.285
195 2HB LYS 24 2HB LYS 24 14.595 -1.314 -4.820
196 1HG LYS 24 1HG LYS 24 17.146 -2.394 -5.592
197 2HG LYS 24 2HG LYS 24 15.867 -3.473 -6.149
198 1HD LYS 24 1HD LYS 24 14.902 -0.890 -6.663
199 2HD LYS 24 2HD LYS 24 16.598 -0.843 -7.139
200 1HE LYS 24 1HE LYS 24 16.325 -2.640 -8.687
201 2HE LYS 24 2HE LYS 24 14.747 -3.080 -8.008
202 1HZ LYS 24 1HZ LYS 24 14.467 -0.444 -8.578
203 2HZ LYS 24 2HZ LYS 24 15.407 -0.995 -9.881
204 3HZ LYS 24 3HZ LYS 24 13.906 -1.715 -9.549
205 H ALA 25 H ALA 25 18.544 -1.822 -4.460
206 HA ALA 25 HA ALA 25 19.099 1.054 -4.236
207 1HB ALA 25 1HB ALA 25 20.726 -1.187 -5.479
208 2HB ALA 25 2HB ALA 25 21.300 0.454 -5.189
209 3HB ALA 25 3HB ALA 25 20.893 -0.591 -3.827
Start of MODEL 10
1 1H MET 1 1H MET 1 -21.281 -1.911 3.986
2 2H MET 1 2H MET 1 -21.945 -2.692 2.632
3 3H MET 1 3H MET 1 -21.074 -3.584 3.781
4 HA MET 1 HA MET 1 -19.131 -3.157 2.790
5 1HB MET 1 1HB MET 1 -19.375 -2.430 0.446
6 2HB MET 1 2HB MET 1 -20.679 -3.535 0.881
7 1HG MET 1 1HG MET 1 -21.595 -0.967 1.593
8 2HG MET 1 2HG MET 1 -20.849 -0.782 0.004
9 1HE MET 1 1HE MET 1 -23.885 -0.583 1.181
10 2HE MET 1 2HE MET 1 -23.556 -0.054 -0.467
11 3HE MET 1 3HE MET 1 -24.870 -1.194 -0.145
12 HA PRO 2 HA PRO 2 -18.979 1.246 4.240
13 1HB PRO 2 1HB PRO 2 -17.108 0.830 6.191
14 2HB PRO 2 2HB PRO 2 -18.851 0.644 6.471
15 1HG PRO 2 1HG PRO 2 -16.779 -1.435 5.990
16 2HG PRO 2 2HG PRO 2 -18.178 -1.465 7.074
17 1HD PRO 2 1HD PRO 2 -18.107 -2.727 4.649
18 2HD PRO 2 2HD PRO 2 -19.602 -2.159 5.425
19 H GLY 3 H GLY 3 -16.843 -1.079 2.984
20 1HA GLY 3 1HA GLY 3 -14.694 -0.933 2.012
21 2HA GLY 3 2HA GLY 3 -15.351 0.560 1.338
22 H THR 4 H THR 4 -14.244 -0.475 4.595
23 HA THR 4 HA THR 4 -12.657 2.060 4.678
24 HB THR 4 HB THR 4 -14.318 2.219 6.377
25 HG1 THR 4 HG1 THR 4 -13.055 2.091 8.255
26 1HG2 THR 4 1HG2 THR 4 -13.850 -0.698 6.577
27 2HG2 THR 4 2HG2 THR 4 -14.194 0.127 8.098
28 3HG2 THR 4 3HG2 THR 4 -15.344 0.220 6.765
29 H ILE 5 H ILE 5 -12.662 -1.410 5.315
30 HA ILE 5 HA ILE 5 -10.026 -1.481 6.502
31 HB ILE 5 HB ILE 5 -11.474 -3.702 5.028
32 1HG1 ILE 5 1HG1 ILE 5 -11.517 -3.542 7.992
33 2HG1 ILE 5 2HG1 ILE 5 -12.505 -2.349 7.147
34 1HG2 ILE 5 1HG2 ILE 5 -8.923 -3.509 6.333
35 2HG2 ILE 5 2HG2 ILE 5 -9.963 -4.582 7.271
36 3HG2 ILE 5 3HG2 ILE 5 -9.659 -4.917 5.566
37 1HD1 ILE 5 1HD1 ILE 5 -13.471 -4.267 5.794
38 2HD1 ILE 5 2HD1 ILE 5 -12.652 -5.364 6.907
39 3HD1 ILE 5 3HD1 ILE 5 -13.902 -4.272 7.504
40 H LYS 6 H LYS 6 -11.263 -1.700 3.201
41 HA LYS 6 HA LYS 6 -8.688 -2.412 2.048
42 1HB LYS 6 1HB LYS 6 -9.803 -1.877 -0.113
43 2HB LYS 6 2HB LYS 6 -10.766 -2.975 0.876
44 1HG LYS 6 1HG LYS 6 -12.463 -1.507 0.597
45 2HG LYS 6 2HG LYS 6 -11.594 -0.464 1.722
46 1HD LYS 6 1HD LYS 6 -11.263 1.035 0.080
47 2HD LYS 6 2HD LYS 6 -10.386 -0.179 -0.850
48 1HE LYS 6 1HE LYS 6 -13.402 -0.204 -0.825
49 2HE LYS 6 2HE LYS 6 -12.522 0.881 -1.922
50 1HZ LYS 6 1HZ LYS 6 -11.603 -1.889 -1.691
51 2HZ LYS 6 2HZ LYS 6 -13.017 -1.605 -2.585
52 3HZ LYS 6 3HZ LYS 6 -11.565 -0.845 -3.031
53 H GLU 7 H GLU 7 -10.330 0.557 2.889
54 HA GLU 7 HA GLU 7 -8.789 2.342 1.248
55 1HB GLU 7 1HB GLU 7 -10.958 2.758 2.684
56 2HB GLU 7 2HB GLU 7 -9.803 3.146 3.959
57 1HG GLU 7 1HG GLU 7 -8.750 4.526 1.840
58 2HG GLU 7 2HG GLU 7 -10.478 4.651 1.512
59 H ASN 8 H ASN 8 -8.132 0.679 4.236
60 HA ASN 8 HA ASN 8 -5.832 2.378 4.911
61 1HB ASN 8 1HB ASN 8 -7.282 1.192 6.625
62 2HB ASN 8 2HB ASN 8 -6.564 -0.322 6.073
63 1HD2 ASN 8 2HD2 ASN 8 -5.087 2.924 6.626
64 2HD2 ASN 8 1HD2 ASN 8 -3.904 2.362 7.706
65 H ILE 9 H ILE 9 -6.346 -0.986 3.798
66 HA ILE 9 HA ILE 9 -3.674 -1.796 3.576
67 HB ILE 9 HB ILE 9 -5.829 -2.385 1.524
68 1HG1 ILE 9 1HG1 ILE 9 -6.720 -2.812 3.754
69 2HG1 ILE 9 2HG1 ILE 9 -6.323 -4.355 2.997
70 1HG2 ILE 9 1HG2 ILE 9 -3.264 -3.734 2.387
71 2HG2 ILE 9 2HG2 ILE 9 -4.531 -4.608 1.524
72 3HG2 ILE 9 3HG2 ILE 9 -3.736 -3.229 0.765
73 1HD1 ILE 9 1HD1 ILE 9 -4.542 -2.851 4.938
74 2HD1 ILE 9 2HD1 ILE 9 -5.517 -4.266 5.336
75 3HD1 ILE 9 3HD1 ILE 9 -4.178 -4.410 4.198
76 H ILE 10 H ILE 10 -5.577 0.231 1.379
77 HA ILE 10 HA ILE 10 -3.818 0.401 -0.801
78 HB ILE 10 HB ILE 10 -5.654 2.427 0.484
79 1HG1 ILE 10 1HG1 ILE 10 -5.682 0.986 -2.189
80 2HG1 ILE 10 2HG1 ILE 10 -6.611 0.504 -0.769
81 1HG2 ILE 10 1HG2 ILE 10 -3.953 2.794 -2.004
82 2HG2 ILE 10 2HG2 ILE 10 -5.266 3.866 -1.514
83 3HG2 ILE 10 3HG2 ILE 10 -3.825 3.719 -0.508
84 1HD1 ILE 10 1HD1 ILE 10 -7.159 3.239 -1.112
85 2HD1 ILE 10 2HD1 ILE 10 -7.215 2.548 -2.733
86 3HD1 ILE 10 3HD1 ILE 10 -8.244 1.893 -1.461
87 H GLY 11 H GLY 11 -3.705 2.113 2.312
88 1HA GLY 11 1HA GLY 11 -1.391 3.709 1.643
89 2HA GLY 11 2HA GLY 11 -1.978 3.390 3.278
90 H VAL 12 H VAL 12 -1.870 0.509 3.062
91 HA VAL 12 HA VAL 12 0.935 0.117 3.715
92 HB VAL 12 HB VAL 12 -1.370 -1.827 3.392
93 1HG1 VAL 12 1HG1 VAL 12 1.530 -2.208 4.039
94 2HG1 VAL 12 2HG1 VAL 12 0.342 -3.213 4.870
95 3HG1 VAL 12 3HG1 VAL 12 0.445 -3.243 3.111
96 1HG2 VAL 12 1HG2 VAL 12 -1.345 -0.067 5.273
97 2HG2 VAL 12 2HG2 VAL 12 -1.530 -1.750 5.764
98 3HG2 VAL 12 3HG2 VAL 12 0.035 -0.952 5.922
99 H SER 13 H SER 13 -0.795 0.169 0.813
100 HA SER 13 HA SER 13 1.117 -1.681 -0.528
101 1HB SER 13 1HB SER 13 -1.647 -0.759 -1.085
102 2HB SER 13 2HB SER 13 -0.608 -0.954 -2.492
103 HG SER 13 HG SER 13 -1.064 -2.994 -2.271
104 H TYR 14 H TYR 14 -0.254 1.608 -0.847
105 HA TYR 14 HA TYR 14 1.308 2.484 -3.025
106 1HB TYR 14 1HB TYR 14 -0.352 3.692 -1.009
107 2HB TYR 14 2HB TYR 14 1.109 4.659 -1.215
108 HD1 TYR 14 HD1 TYR 14 -1.425 2.825 -3.292
109 HD2 TYR 14 HD2 TYR 14 1.147 6.245 -2.922
110 HE1 TYR 14 HE1 TYR 14 -2.327 3.732 -5.417
111 HE2 TYR 14 HE2 TYR 14 0.244 7.153 -5.046
112 HH TYR 14 HH TYR 14 -0.908 6.518 -6.974
113 H ASP 15 H ASP 15 2.106 2.437 0.440
114 HA ASP 15 HA ASP 15 4.663 3.732 0.127
115 1HB ASP 15 1HB ASP 15 3.125 3.032 2.283
116 2HB ASP 15 2HB ASP 15 4.387 1.801 2.349
117 H GLU 16 H GLU 16 3.695 0.304 0.420
118 HA GLU 16 HA GLU 16 6.195 -0.926 0.320
119 1HB GLU 16 1HB GLU 16 3.504 -1.703 -0.140
120 2HB GLU 16 2HB GLU 16 4.441 -2.285 -1.515
121 1HG GLU 16 1HG GLU 16 6.090 -2.872 0.620
122 2HG GLU 16 2HG GLU 16 4.485 -3.176 1.283
123 H TYR 17 H TYR 17 4.434 0.699 -2.249
124 HA TYR 17 HA TYR 17 6.177 -0.191 -4.388
125 1HB TYR 17 1HB TYR 17 4.332 0.609 -5.449
126 2HB TYR 17 2HB TYR 17 3.866 1.593 -4.067
127 HD1 TYR 17 HD1 TYR 17 6.371 1.472 -6.849
128 HD2 TYR 17 HD2 TYR 17 4.058 3.923 -4.188
129 HE1 TYR 17 HE1 TYR 17 7.161 3.502 -8.036
130 HE2 TYR 17 HE2 TYR 17 4.845 5.956 -5.376
131 HH TYR 17 HH TYR 17 7.323 5.779 -7.876
132 H ARG 18 H ARG 18 5.779 3.089 -2.986
133 HA ARG 18 HA ARG 18 8.129 4.231 -3.988
134 1HB ARG 18 1HB ARG 18 6.261 5.196 -2.371
135 2HB ARG 18 2HB ARG 18 7.407 4.734 -1.116
136 1HG ARG 18 1HG ARG 18 9.175 6.037 -2.324
137 2HG ARG 18 2HG ARG 18 7.934 6.599 -3.446
138 1HD ARG 18 1HD ARG 18 7.869 8.327 -1.912
139 2HD ARG 18 2HD ARG 18 6.689 7.241 -1.178
140 HE ARG 18 HE ARG 18 8.628 6.418 0.263
141 1HH1 ARG 18 1HH1 ARG 18 10.858 7.893 -0.939
142 2HH1 ARG 18 2HH1 ARG 18 10.971 9.315 0.042
143 1HH2 ARG 18 1HH2 ARG 18 7.801 8.953 1.399
144 2HH2 ARG 18 2HH2 ARG 18 9.238 9.917 1.364
145 H TYR 19 H TYR 19 7.690 1.827 -1.543
146 HA TYR 19 HA TYR 19 10.241 1.964 -0.263
147 1HB TYR 19 1HB TYR 19 7.941 0.116 -0.433
148 2HB TYR 19 2HB TYR 19 9.480 -0.650 -0.057
149 HD1 TYR 19 HD1 TYR 19 8.514 2.829 0.787
150 HD2 TYR 19 HD2 TYR 19 9.134 -1.159 2.250
151 HE1 TYR 19 HE1 TYR 19 8.367 3.661 3.122
152 HE2 TYR 19 HE2 TYR 19 8.988 -0.332 4.585
153 HH TYR 19 HH TYR 19 7.658 2.290 5.521
154 H ARG 20 H ARG 20 9.016 -0.091 -2.926
155 HA ARG 20 HA ARG 20 11.352 -1.586 -3.406
156 1HB ARG 20 1HB ARG 20 8.942 -0.851 -4.915
157 2HB ARG 20 2HB ARG 20 10.346 -1.140 -5.943
158 1HG ARG 20 1HG ARG 20 10.701 -3.290 -4.588
159 2HG ARG 20 2HG ARG 20 9.076 -3.027 -3.952
160 1HD ARG 20 1HD ARG 20 8.818 -2.658 -6.717
161 2HD ARG 20 2HD ARG 20 9.883 -4.054 -6.549
162 HE ARG 20 HE ARG 20 7.101 -3.882 -5.505
163 1HH1 ARG 20 1HH2 ARG 20 8.950 -5.752 -7.435
164 2HH1 ARG 20 2HH2 ARG 20 8.735 -7.240 -6.575
165 1HH2 ARG 20 1HH1 ARG 20 7.275 -5.743 -3.809
166 2HH2 ARG 20 2HH1 ARG 20 7.789 -7.236 -4.524
167 H SER 21 H SER 21 10.782 1.782 -3.917
168 HA SER 21 HA SER 21 12.971 2.048 -5.867
169 1HB SER 21 1HB SER 21 10.767 3.459 -5.730
170 2HB SER 21 2HB SER 21 11.658 4.374 -4.516
171 HG SER 21 HG SER 21 13.268 4.745 -6.056
172 H VAL 22 H VAL 22 12.558 2.210 -2.460
173 HA VAL 22 HA VAL 22 15.281 3.379 -2.221
174 HB VAL 22 HB VAL 22 14.264 4.998 -1.059
175 1HG1 VAL 22 1HG1 VAL 22 11.816 3.234 -1.059
176 2HG1 VAL 22 2HG1 VAL 22 11.835 4.896 -0.469
177 3HG1 VAL 22 3HG1 VAL 22 12.173 4.558 -2.167
178 1HG2 VAL 22 1HG2 VAL 22 13.575 2.754 0.859
179 2HG2 VAL 22 2HG2 VAL 22 15.007 3.782 0.915
180 3HG2 VAL 22 3HG2 VAL 22 13.417 4.468 1.248
181 H ILE 23 H ILE 23 13.411 0.602 -1.713
182 HA ILE 23 HA ILE 23 15.347 -0.338 0.369
183 HB ILE 23 HB ILE 23 12.468 -1.147 -0.111
184 1HG1 ILE 23 1HG1 ILE 23 13.082 -0.473 2.587
185 2HG1 ILE 23 2HG1 ILE 23 13.766 0.790 1.564
186 1HG2 ILE 23 1HG2 ILE 23 14.669 -2.387 1.533
187 2HG2 ILE 23 2HG2 ILE 23 12.984 -2.536 2.031
188 3HG2 ILE 23 3HG2 ILE 23 13.503 -3.180 0.473
189 1HD1 ILE 23 1HD1 ILE 23 11.049 -0.119 0.826
190 2HD1 ILE 23 2HD1 ILE 23 11.169 0.755 2.352
191 3HD1 ILE 23 3HD1 ILE 23 11.719 1.511 0.857
192 H LYS 24 H LYS 24 13.687 -1.114 -2.649
193 HA LYS 24 HA LYS 24 15.216 -3.657 -2.830
194 1HB LYS 24 1HB LYS 24 12.838 -2.516 -4.263
195 2HB LYS 24 2HB LYS 24 13.803 -3.765 -5.050
196 1HG LYS 24 1HG LYS 24 12.559 -3.995 -2.292
197 2HG LYS 24 2HG LYS 24 11.932 -4.751 -3.759
198 1HD LYS 24 1HD LYS 24 14.437 -5.675 -3.903
199 2HD LYS 24 2HD LYS 24 14.356 -5.444 -2.156
200 1HE LYS 24 1HE LYS 24 12.147 -6.895 -3.628
201 2HE LYS 24 2HE LYS 24 13.597 -7.749 -3.063
202 1HZ LYS 24 1HZ LYS 24 12.881 -6.106 -0.982
203 2HZ LYS 24 2HZ LYS 24 11.405 -6.733 -1.540
204 3HZ LYS 24 3HZ LYS 24 12.645 -7.786 -1.063
205 H ALA 25 H ALA 25 16.008 -4.057 -5.230
206 HA ALA 25 HA ALA 25 17.548 -3.453 -6.893
207 1HB ALA 25 1HB ALA 25 15.618 -1.315 -6.729
208 2HB ALA 25 2HB ALA 25 17.212 -0.648 -7.081
209 3HB ALA 25 3HB ALA 25 16.520 -1.881 -8.134
Start of MODEL 11
1 1H MET 1 1H MET 1 -17.627 7.787 2.909
2 2H MET 1 2H MET 1 -16.318 8.537 2.127
3 3H MET 1 3H MET 1 -17.592 7.888 1.214
4 HA MET 1 HA MET 1 -16.775 5.806 1.284
5 1HB MET 1 1HB MET 1 -14.357 7.283 2.358
6 2HB MET 1 2HB MET 1 -14.364 5.879 1.290
7 1HG MET 1 1HG MET 1 -15.754 7.417 -0.305
8 2HG MET 1 2HG MET 1 -15.087 8.731 0.663
9 1HE MET 1 1HE MET 1 -13.711 9.971 -0.687
10 2HE MET 1 2HE MET 1 -12.552 9.418 -1.904
11 3HE MET 1 3HE MET 1 -14.279 9.172 -2.150
12 HA PRO 2 HA PRO 2 -17.119 5.215 5.871
13 1HB PRO 2 1HB PRO 2 -19.281 3.544 5.781
14 2HB PRO 2 2HB PRO 2 -19.431 5.311 5.844
15 1HG PRO 2 1HG PRO 2 -19.702 3.471 3.528
16 2HG PRO 2 2HG PRO 2 -20.593 4.952 3.906
17 1HD PRO 2 1HD PRO 2 -18.560 4.798 2.068
18 2HD PRO 2 2HD PRO 2 -19.041 6.289 2.906
19 H GLY 3 H GLY 3 -16.313 3.469 3.163
20 1HA GLY 3 1HA GLY 3 -16.170 0.822 4.446
21 2HA GLY 3 2HA GLY 3 -15.649 1.206 2.804
22 H THR 4 H THR 4 -14.370 0.035 5.459
23 HA THR 4 HA THR 4 -11.825 1.574 5.140
24 HB THR 4 HB THR 4 -13.038 1.930 7.357
25 HG1 THR 4 HG1 THR 4 -10.475 0.720 7.317
26 1HG2 THR 4 1HG2 THR 4 -13.752 -0.521 7.454
27 2HG2 THR 4 2HG2 THR 4 -12.092 -0.884 7.929
28 3HG2 THR 4 3HG2 THR 4 -13.094 0.151 8.947
29 H ILE 5 H ILE 5 -13.106 -1.128 4.157
30 HA ILE 5 HA ILE 5 -11.205 -3.093 5.224
31 HB ILE 5 HB ILE 5 -12.949 -3.461 2.787
32 1HG1 ILE 5 1HG1 ILE 5 -13.781 -3.818 5.684
33 2HG1 ILE 5 2HG1 ILE 5 -14.297 -2.478 4.658
34 1HG2 ILE 5 1HG2 ILE 5 -11.260 -5.115 4.453
35 2HG2 ILE 5 2HG2 ILE 5 -12.923 -5.701 4.503
36 3HG2 ILE 5 3HG2 ILE 5 -12.094 -5.536 2.956
37 1HD1 ILE 5 1HD1 ILE 5 -14.986 -4.452 3.018
38 2HD1 ILE 5 2HD1 ILE 5 -15.049 -5.371 4.522
39 3HD1 ILE 5 3HD1 ILE 5 -16.061 -3.940 4.319
40 H LYS 6 H LYS 6 -11.503 -1.007 2.418
41 HA LYS 6 HA LYS 6 -9.321 -2.344 0.978
42 1HB LYS 6 1HB LYS 6 -10.386 0.402 0.339
43 2HB LYS 6 2HB LYS 6 -9.732 -0.811 -0.760
44 1HG LYS 6 1HG LYS 6 -11.840 -2.164 0.352
45 2HG LYS 6 2HG LYS 6 -12.467 -0.516 0.295
46 1HD LYS 6 1HD LYS 6 -12.568 -0.503 -1.976
47 2HD LYS 6 2HD LYS 6 -11.031 -1.353 -2.141
48 1HE LYS 6 1HE LYS 6 -13.531 -2.774 -1.191
49 2HE LYS 6 2HE LYS 6 -13.109 -2.653 -2.911
50 1HZ LYS 6 1HZ LYS 6 -10.864 -3.483 -2.306
51 2HZ LYS 6 2HZ LYS 6 -11.430 -3.779 -0.735
52 3HZ LYS 6 3HZ LYS 6 -12.098 -4.624 -2.050
53 H GLU 7 H GLU 7 -9.786 0.732 2.730
54 HA GLU 7 HA GLU 7 -7.249 1.865 2.340
55 1HB GLU 7 1HB GLU 7 -9.340 2.703 3.708
56 2HB GLU 7 2HB GLU 7 -8.503 1.952 5.067
57 1HG GLU 7 1HG GLU 7 -6.431 3.292 4.017
58 2HG GLU 7 2HG GLU 7 -7.736 4.339 3.454
59 H ASN 8 H ASN 8 -8.105 -0.979 4.116
60 HA ASN 8 HA ASN 8 -5.604 -0.986 5.675
61 1HB ASN 8 1HB ASN 8 -7.805 -1.916 6.538
62 2HB ASN 8 2HB ASN 8 -7.616 -3.229 5.376
63 1HD2 ASN 8 2HD2 ASN 8 -5.279 -1.570 7.583
64 2HD2 ASN 8 1HD2 ASN 8 -4.714 -3.004 8.292
65 H ILE 9 H ILE 9 -7.036 -2.784 2.947
66 HA ILE 9 HA ILE 9 -4.645 -4.423 2.611
67 HB ILE 9 HB ILE 9 -6.817 -3.977 0.556
68 1HG1 ILE 9 1HG1 ILE 9 -7.964 -4.503 2.626
69 2HG1 ILE 9 2HG1 ILE 9 -7.925 -5.969 1.645
70 1HG2 ILE 9 1HG2 ILE 9 -4.764 -5.241 -0.091
71 2HG2 ILE 9 2HG2 ILE 9 -5.080 -6.374 1.224
72 3HG2 ILE 9 3HG2 ILE 9 -6.212 -6.247 -0.124
73 1HD1 ILE 9 1HD1 ILE 9 -5.535 -6.034 3.105
74 2HD1 ILE 9 2HD1 ILE 9 -6.751 -5.484 4.259
75 3HD1 ILE 9 3HD1 ILE 9 -6.974 -7.010 3.403
76 H ILE 10 H ILE 10 -5.997 -1.519 1.066
77 HA ILE 10 HA ILE 10 -4.215 -1.310 -1.111
78 HB ILE 10 HB ILE 10 -5.672 0.718 0.573
79 1HG1 ILE 10 1HG1 ILE 10 -6.127 0.946 -2.221
80 2HG1 ILE 10 2HG1 ILE 10 -6.118 -0.778 -1.844
81 1HG2 ILE 10 1HG2 ILE 10 -3.506 1.764 -0.054
82 2HG2 ILE 10 2HG2 ILE 10 -3.817 1.363 -1.743
83 3HG2 ILE 10 3HG2 ILE 10 -4.861 2.510 -0.901
84 1HD1 ILE 10 1HD1 ILE 10 -7.629 1.097 -0.055
85 2HD1 ILE 10 2HD1 ILE 10 -8.346 0.608 -1.591
86 3HD1 ILE 10 3HD1 ILE 10 -7.923 -0.609 -0.388
87 H GLY 11 H GLY 11 -3.784 -0.283 2.273
88 1HA GLY 11 1HA GLY 11 -1.256 0.979 1.960
89 2HA GLY 11 2HA GLY 11 -1.819 0.228 3.454
90 H VAL 12 H VAL 12 -2.138 -2.426 2.352
91 HA VAL 12 HA VAL 12 0.454 -3.491 2.800
92 HB VAL 12 HB VAL 12 -2.022 -4.607 1.472
93 1HG1 VAL 12 1HG1 VAL 12 0.707 -5.607 1.320
94 2HG1 VAL 12 2HG1 VAL 12 -0.351 -6.750 2.146
95 3HG1 VAL 12 3HG1 VAL 12 -0.745 -6.202 0.517
96 1HG2 VAL 12 1HG2 VAL 12 -1.456 -4.162 4.090
97 2HG2 VAL 12 2HG2 VAL 12 -2.484 -5.484 3.537
98 3HG2 VAL 12 3HG2 VAL 12 -0.785 -5.782 3.902
99 H SER 13 H SER 13 -1.235 -2.740 -0.253
100 HA SER 13 HA SER 13 1.101 -3.586 -1.830
101 1HB SER 13 1HB SER 13 -1.337 -3.809 -2.581
102 2HB SER 13 2HB SER 13 -1.316 -2.065 -2.828
103 HG SER 13 HG SER 13 0.726 -2.624 -4.069
104 H TYR 14 H TYR 14 -0.070 -0.708 -0.337
105 HA TYR 14 HA TYR 14 1.345 1.150 -2.090
106 1HB TYR 14 1HB TYR 14 -0.340 1.307 0.330
107 2HB TYR 14 2HB TYR 14 0.929 2.530 0.243
108 HD1 TYR 14 HD1 TYR 14 -0.940 0.882 -2.536
109 HD2 TYR 14 HD2 TYR 14 -0.207 4.515 -0.365
110 HE1 TYR 14 HE1 TYR 14 -2.277 2.145 -4.200
111 HE2 TYR 14 HE2 TYR 14 -1.543 5.779 -2.029
112 HH TYR 14 HH TYR 14 -3.445 4.176 -4.459
113 H ASP 15 H ASP 15 2.144 -0.807 0.656
114 HA ASP 15 HA ASP 15 4.436 0.753 1.526
115 1HB ASP 15 1HB ASP 15 3.757 -2.172 1.970
116 2HB ASP 15 2HB ASP 15 5.017 -1.278 2.822
117 H GLU 16 H GLU 16 4.165 -2.359 -0.241
118 HA GLU 16 HA GLU 16 6.875 -2.710 -0.870
119 1HB GLU 16 1HB GLU 16 4.471 -3.911 -1.624
120 2HB GLU 16 2HB GLU 16 5.150 -3.332 -3.144
121 1HG GLU 16 1HG GLU 16 5.970 -5.591 -2.690
122 2HG GLU 16 2HG GLU 16 7.304 -4.442 -2.571
123 H TYR 17 H TYR 17 4.441 -0.734 -2.540
124 HA TYR 17 HA TYR 17 6.204 0.099 -4.664
125 1HB TYR 17 1HB TYR 17 4.205 0.852 -5.407
126 2HB TYR 17 2HB TYR 17 3.484 0.587 -3.826
127 HD1 TYR 17 HD1 TYR 17 5.747 3.004 -5.587
128 HD2 TYR 17 HD2 TYR 17 2.672 2.428 -2.646
129 HE1 TYR 17 HE1 TYR 17 5.611 5.458 -5.251
130 HE2 TYR 17 HE2 TYR 17 2.533 4.883 -2.311
131 HH TYR 17 HH TYR 17 4.099 6.870 -2.636
132 H ARG 18 H ARG 18 5.009 1.949 -1.840
133 HA ARG 18 HA ARG 18 6.808 4.102 -2.023
134 1HB ARG 18 1HB ARG 18 4.854 3.488 -0.284
135 2HB ARG 18 2HB ARG 18 6.240 3.008 0.697
136 1HG ARG 18 1HG ARG 18 6.482 5.619 -0.692
137 2HG ARG 18 2HG ARG 18 5.300 5.546 0.616
138 1HD ARG 18 1HD ARG 18 7.087 4.548 2.079
139 2HD ARG 18 2HD ARG 18 8.244 4.851 0.784
140 HE ARG 18 HE ARG 18 7.624 7.303 1.044
141 1HH1 ARG 18 1HH1 ARG 18 5.504 6.210 3.151
142 2HH1 ARG 18 2HH1 ARG 18 6.222 6.836 4.597
143 1HH2 ARG 18 1HH2 ARG 18 9.248 7.592 3.082
144 2HH2 ARG 18 2HH2 ARG 18 8.342 7.618 4.558
145 H TYR 19 H TYR 19 7.344 0.806 -1.144
146 HA TYR 19 HA TYR 19 9.924 1.294 0.142
147 1HB TYR 19 1HB TYR 19 8.139 -1.014 -0.430
148 2HB TYR 19 2HB TYR 19 9.855 -1.361 -0.272
149 HD1 TYR 19 HD1 TYR 19 7.615 1.125 1.410
150 HD2 TYR 19 HD2 TYR 19 10.263 -2.225 1.853
151 HE1 TYR 19 HE1 TYR 19 7.424 1.299 3.879
152 HE2 TYR 19 HE2 TYR 19 10.074 -2.054 4.323
153 HH TYR 19 HH TYR 19 8.445 0.645 5.854
154 H ARG 20 H ARG 20 8.684 0.480 -3.035
155 HA ARG 20 HA ARG 20 11.268 -0.402 -4.075
156 1HB ARG 20 1HB ARG 20 8.518 -0.024 -5.126
157 2HB ARG 20 2HB ARG 20 9.822 0.171 -6.298
158 1HG ARG 20 1HG ARG 20 10.567 -2.090 -4.856
159 2HG ARG 20 2HG ARG 20 8.820 -2.264 -5.035
160 1HD ARG 20 1HD ARG 20 9.516 -1.426 -7.539
161 2HD ARG 20 2HD ARG 20 10.941 -2.361 -7.089
162 HE ARG 20 HE ARG 20 8.466 -3.774 -6.508
163 1HH1 ARG 20 1HH1 ARG 20 11.042 -5.017 -7.468
164 2HH1 ARG 20 2HH1 ARG 20 10.625 -5.489 -9.081
165 1HH2 ARG 20 1HH2 ARG 20 7.805 -3.476 -9.224
166 2HH2 ARG 20 2HH2 ARG 20 8.791 -4.619 -10.074
167 H SER 21 H SER 21 10.324 2.542 -3.054
168 HA SER 21 HA SER 21 11.683 3.975 -5.290
169 1HB SER 21 1HB SER 21 9.278 4.591 -4.530
170 2HB SER 21 2HB SER 21 10.076 5.328 -3.144
171 HG SER 21 HG SER 21 10.142 6.938 -4.553
172 H VAL 22 H VAL 22 11.741 3.412 -1.834
173 HA VAL 22 HA VAL 22 14.121 5.168 -1.645
174 HB VAL 22 HB VAL 22 13.222 5.941 0.252
175 1HG1 VAL 22 1HG1 VAL 22 11.165 5.635 -1.139
176 2HG1 VAL 22 2HG1 VAL 22 10.877 4.121 -0.283
177 3HG1 VAL 22 3HG1 VAL 22 10.852 5.649 0.597
178 1HG2 VAL 22 1HG2 VAL 22 12.671 3.075 1.070
179 2HG2 VAL 22 2HG2 VAL 22 14.084 4.027 1.524
180 3HG2 VAL 22 3HG2 VAL 22 12.489 4.475 2.127
181 H ILE 23 H ILE 23 12.887 1.935 -0.814
182 HA ILE 23 HA ILE 23 15.482 1.157 0.323
183 HB ILE 23 HB ILE 23 13.011 -0.487 -0.300
184 1HG1 ILE 23 1HG1 ILE 23 13.424 -0.307 2.460
185 2HG1 ILE 23 2HG1 ILE 23 13.751 1.322 1.866
186 1HG2 ILE 23 1HG2 ILE 23 15.534 -1.124 1.260
187 2HG2 ILE 23 2HG2 ILE 23 14.085 -2.132 1.250
188 3HG2 ILE 23 3HG2 ILE 23 15.003 -1.892 -0.237
189 1HD1 ILE 23 1HD1 ILE 23 11.310 -0.207 0.970
190 2HD1 ILE 23 2HD1 ILE 23 11.302 0.742 2.457
191 3HD1 ILE 23 3HD1 ILE 23 11.602 1.532 0.909
192 H LYS 24 H LYS 24 13.576 0.352 -2.591
193 HA LYS 24 HA LYS 24 16.095 -0.772 -3.752
194 1HB LYS 24 1HB LYS 24 13.335 -1.440 -4.759
195 2HB LYS 24 2HB LYS 24 14.830 -2.355 -4.949
196 1HG LYS 24 1HG LYS 24 14.362 -2.046 -2.152
197 2HG LYS 24 2HG LYS 24 12.858 -2.601 -2.888
198 1HD LYS 24 1HD LYS 24 14.006 -4.476 -3.934
199 2HD LYS 24 2HD LYS 24 15.564 -3.888 -3.351
200 1HE LYS 24 1HE LYS 24 14.433 -4.034 -0.979
201 2HE LYS 24 2HE LYS 24 13.326 -5.156 -1.793
202 1HZ LYS 24 1HZ LYS 24 15.625 -5.986 -2.789
203 2HZ LYS 24 2HZ LYS 24 16.190 -5.414 -1.296
204 3HZ LYS 24 3HZ LYS 24 14.985 -6.612 -1.345
205 H ALA 25 H ALA 25 16.433 -0.344 -6.048
206 HA ALA 25 HA ALA 25 16.581 1.168 -7.838
207 1HB ALA 25 1HB ALA 25 14.106 0.191 -7.877
208 2HB ALA 25 2HB ALA 25 13.692 1.859 -7.484
209 3HB ALA 25 3HB ALA 25 14.582 1.497 -8.962
Start of MODEL 12
1 1H MET 1 1H MET 1 -15.483 -1.947 12.871
2 2H MET 1 2H MET 1 -16.521 -3.277 12.703
3 3H MET 1 3H MET 1 -14.865 -3.446 12.363
4 HA MET 1 HA MET 1 -15.613 -3.213 10.231
5 1HB MET 1 1HB MET 1 -17.712 -1.967 9.784
6 2HB MET 1 2HB MET 1 -17.940 -3.172 11.051
7 1HG MET 1 1HG MET 1 -17.091 -0.921 12.444
8 2HG MET 1 2HG MET 1 -18.154 -0.260 11.203
9 1HE MET 1 1HE MET 1 -20.249 -1.394 10.501
10 2HE MET 1 2HE MET 1 -20.091 -3.105 10.891
11 3HE MET 1 3HE MET 1 -21.415 -2.154 11.580
12 HA PRO 2 HA PRO 2 -13.344 0.794 10.716
13 1HB PRO 2 1HB PRO 2 -11.029 -0.047 9.524
14 2HB PRO 2 2HB PRO 2 -11.350 -0.247 11.259
15 1HG PRO 2 1HG PRO 2 -11.545 -2.234 9.057
16 2HG PRO 2 2HG PRO 2 -11.001 -2.447 10.728
17 1HD PRO 2 1HD PRO 2 -13.477 -3.189 9.811
18 2HD PRO 2 2HD PRO 2 -13.118 -2.789 11.505
19 H GLY 3 H GLY 3 -14.475 -1.201 8.253
20 1HA GLY 3 1HA GLY 3 -14.955 -0.833 5.984
21 2HA GLY 3 2HA GLY 3 -14.912 0.883 6.387
22 H THR 4 H THR 4 -13.551 1.904 5.017
23 HA THR 4 HA THR 4 -11.765 2.222 3.512
24 HB THR 4 HB THR 4 -10.688 2.835 5.594
25 HG1 THR 4 HG1 THR 4 -8.746 2.661 4.788
26 1HG2 THR 4 1HG2 THR 4 -10.222 -0.140 5.928
27 2HG2 THR 4 2HG2 THR 4 -9.499 1.105 6.945
28 3HG2 THR 4 3HG2 THR 4 -11.247 0.882 6.934
29 H ILE 5 H ILE 5 -13.124 -0.312 3.231
30 HA ILE 5 HA ILE 5 -11.275 -2.490 2.985
31 HB ILE 5 HB ILE 5 -13.780 -2.049 1.339
32 1HG1 ILE 5 1HG1 ILE 5 -14.346 -3.727 3.517
33 2HG1 ILE 5 2HG1 ILE 5 -13.428 -2.389 4.207
34 1HG2 ILE 5 1HG2 ILE 5 -11.919 -4.022 1.136
35 2HG2 ILE 5 2HG2 ILE 5 -12.979 -4.712 2.366
36 3HG2 ILE 5 3HG2 ILE 5 -13.633 -4.263 0.790
37 1HD1 ILE 5 1HD1 ILE 5 -15.439 -1.543 2.238
38 2HD1 ILE 5 2HD1 ILE 5 -16.127 -2.326 3.659
39 3HD1 ILE 5 3HD1 ILE 5 -15.102 -0.903 3.845
40 H LYS 6 H LYS 6 -11.724 0.343 1.090
41 HA LYS 6 HA LYS 6 -10.137 -0.900 -1.122
42 1HB LYS 6 1HB LYS 6 -12.568 0.260 -1.404
43 2HB LYS 6 2HB LYS 6 -11.534 1.675 -1.607
44 1HG LYS 6 1HG LYS 6 -10.276 0.551 -3.374
45 2HG LYS 6 2HG LYS 6 -11.211 -0.925 -3.134
46 1HD LYS 6 1HD LYS 6 -13.218 0.875 -3.508
47 2HD LYS 6 2HD LYS 6 -11.960 1.576 -4.528
48 1HE LYS 6 1HE LYS 6 -11.677 -0.610 -5.673
49 2HE LYS 6 2HE LYS 6 -12.983 -1.283 -4.678
50 1HZ LYS 6 1HZ LYS 6 -13.360 1.228 -6.183
51 2HZ LYS 6 2HZ LYS 6 -13.602 -0.274 -6.938
52 3HZ LYS 6 3HZ LYS 6 -14.539 0.157 -5.591
53 H GLU 7 H GLU 7 -10.418 1.804 1.109
54 HA GLU 7 HA GLU 7 -8.174 3.266 -0.056
55 1HB GLU 7 1HB GLU 7 -10.113 3.661 2.095
56 2HB GLU 7 2HB GLU 7 -8.490 4.173 2.557
57 1HG GLU 7 1HG GLU 7 -9.404 4.961 -0.162
58 2HG GLU 7 2HG GLU 7 -10.176 5.777 1.198
59 H ASN 8 H ASN 8 -8.597 0.763 2.341
60 HA ASN 8 HA ASN 8 -5.931 1.153 3.502
61 1HB ASN 8 1HB ASN 8 -8.092 0.124 4.607
62 2HB ASN 8 2HB ASN 8 -7.536 -1.363 3.839
63 1HD2 ASN 8 1HD2 ASN 8 -5.003 -1.724 4.230
64 2HD2 ASN 8 2HD2 ASN 8 -4.478 -1.447 5.821
65 H ILE 9 H ILE 9 -7.396 -0.728 0.944
66 HA ILE 9 HA ILE 9 -5.063 -2.506 0.706
67 HB ILE 9 HB ILE 9 -7.329 -2.187 -1.273
68 1HG1 ILE 9 1HG1 ILE 9 -8.273 -2.570 0.972
69 2HG1 ILE 9 2HG1 ILE 9 -8.456 -4.010 -0.029
70 1HG2 ILE 9 1HG2 ILE 9 -5.188 -3.510 -1.795
71 2HG2 ILE 9 2HG2 ILE 9 -5.725 -4.649 -0.560
72 3HG2 ILE 9 3HG2 ILE 9 -6.715 -4.370 -1.993
73 1HD1 ILE 9 1HD1 ILE 9 -5.930 -4.254 1.193
74 2HD1 ILE 9 2HD1 ILE 9 -7.023 -3.707 2.465
75 3HD1 ILE 9 3HD1 ILE 9 -7.382 -5.180 1.564
76 H ILE 10 H ILE 10 -6.580 0.087 -1.238
77 HA ILE 10 HA ILE 10 -4.796 0.158 -3.377
78 HB ILE 10 HB ILE 10 -6.849 1.750 -2.529
79 1HG1 ILE 10 1HG1 ILE 10 -6.017 1.195 -4.836
80 2HG1 ILE 10 2HG1 ILE 10 -6.542 2.860 -4.639
81 1HG2 ILE 10 1HG2 ILE 10 -5.094 3.017 -1.122
82 2HG2 ILE 10 2HG2 ILE 10 -4.467 3.605 -2.661
83 3HG2 ILE 10 3HG2 ILE 10 -6.122 3.980 -2.181
84 1HD1 ILE 10 1HD1 ILE 10 -3.669 1.935 -4.428
85 2HD1 ILE 10 2HD1 ILE 10 -4.374 2.683 -5.860
86 3HD1 ILE 10 3HD1 ILE 10 -4.236 3.603 -4.362
87 H GLY 11 H GLY 11 -4.288 1.243 -0.075
88 1HA GLY 11 1HA GLY 11 -1.768 2.584 -0.645
89 2HA GLY 11 2HA GLY 11 -2.376 2.161 0.958
90 H VAL 12 H VAL 12 -2.792 -0.674 0.093
91 HA VAL 12 HA VAL 12 -0.375 -1.806 1.022
92 HB VAL 12 HB VAL 12 -2.579 -2.949 -0.713
93 1HG1 VAL 12 1HG1 VAL 12 -0.234 -4.369 0.587
94 2HG1 VAL 12 2HG1 VAL 12 -1.613 -5.170 -0.164
95 3HG1 VAL 12 3HG1 VAL 12 -0.514 -4.201 -1.145
96 1HG2 VAL 12 1HG2 VAL 12 -2.625 -2.244 1.912
97 2HG2 VAL 12 2HG2 VAL 12 -3.570 -3.579 1.253
98 3HG2 VAL 12 3HG2 VAL 12 -2.026 -3.898 2.045
99 H SER 13 H SER 13 -1.308 -0.736 -2.172
100 HA SER 13 HA SER 13 1.229 -1.857 -3.276
101 1HB SER 13 1HB SER 13 -1.361 -1.909 -4.300
102 2HB SER 13 2HB SER 13 -0.582 -0.613 -5.204
103 HG SER 13 HG SER 13 0.668 -3.113 -4.781
104 H TYR 14 H TYR 14 -0.036 0.966 -2.014
105 HA TYR 14 HA TYR 14 1.537 2.716 -3.833
106 1HB TYR 14 1HB TYR 14 -0.864 3.044 -2.236
107 2HB TYR 14 2HB TYR 14 0.323 4.292 -1.853
108 HD1 TYR 14 HD1 TYR 14 -0.112 2.512 -5.095
109 HD2 TYR 14 HD2 TYR 14 -0.595 6.200 -2.946
110 HE1 TYR 14 HE1 TYR 14 -0.650 3.677 -7.216
111 HE2 TYR 14 HE2 TYR 14 -1.132 7.365 -5.070
112 HH TYR 14 HH TYR 14 -0.406 6.368 -7.946
113 H ASP 15 H ASP 15 1.611 1.294 -0.674
114 HA ASP 15 HA ASP 15 3.718 3.178 0.236
115 1HB ASP 15 1HB ASP 15 3.481 2.161 2.401
116 2HB ASP 15 2HB ASP 15 1.848 2.389 1.774
117 H GLU 16 H GLU 16 3.263 -0.309 -0.404
118 HA GLU 16 HA GLU 16 5.899 -1.149 0.204
119 1HB GLU 16 1HB GLU 16 3.585 -2.243 -1.104
120 2HB GLU 16 2HB GLU 16 5.013 -2.610 -2.068
121 1HG GLU 16 1HG GLU 16 5.263 -4.343 -0.611
122 2HG GLU 16 2HG GLU 16 5.948 -3.111 0.449
123 H TYR 17 H TYR 17 4.542 0.071 -2.871
124 HA TYR 17 HA TYR 17 6.947 -0.162 -4.387
125 1HB TYR 17 1HB TYR 17 5.651 0.718 -6.024
126 2HB TYR 17 2HB TYR 17 4.346 0.761 -4.845
127 HD1 TYR 17 HD1 TYR 17 7.308 2.759 -5.984
128 HD2 TYR 17 HD2 TYR 17 3.357 2.802 -4.307
129 HE1 TYR 17 HE1 TYR 17 7.285 5.238 -6.104
130 HE2 TYR 17 HE2 TYR 17 3.330 5.282 -4.428
131 HH TYR 17 HH TYR 17 4.939 7.051 -6.197
132 H ARG 18 H ARG 18 5.580 2.695 -2.734
133 HA ARG 18 HA ARG 18 7.803 4.411 -3.029
134 1HB ARG 18 1HB ARG 18 5.373 4.452 -1.605
135 2HB ARG 18 2HB ARG 18 6.626 4.670 -0.384
136 1HG ARG 18 1HG ARG 18 7.366 6.254 -2.625
137 2HG ARG 18 2HG ARG 18 5.660 6.571 -2.308
138 1HD ARG 18 1HD ARG 18 6.219 7.837 -0.537
139 2HD ARG 18 2HD ARG 18 7.018 6.452 0.205
140 HE ARG 18 HE ARG 18 9.059 7.149 -1.170
141 1HH1 ARG 18 1HH1 ARG 18 7.841 9.372 -2.691
142 2HH1 ARG 18 2HH1 ARG 18 8.261 10.761 -1.744
143 1HH2 ARG 18 1HH2 ARG 18 9.034 8.923 1.091
144 2HH2 ARG 18 2HH2 ARG 18 8.930 10.506 0.398
145 H TYR 19 H TYR 19 7.386 1.567 -1.140
146 HA TYR 19 HA TYR 19 9.672 2.118 0.629
147 1HB TYR 19 1HB TYR 19 7.510 0.088 0.386
148 2HB TYR 19 2HB TYR 19 9.020 -0.446 1.106
149 HD1 TYR 19 HD1 TYR 19 8.116 3.076 1.380
150 HD2 TYR 19 HD2 TYR 19 7.838 -0.769 3.275
151 HE1 TYR 19 HE1 TYR 19 7.481 4.172 3.514
152 HE2 TYR 19 HE2 TYR 19 7.206 0.327 5.409
153 HH TYR 19 HH TYR 19 6.078 2.609 6.035
154 H ARG 20 H ARG 20 9.068 0.790 -2.452
155 HA ARG 20 HA ARG 20 11.105 -1.254 -2.490
156 1HB ARG 20 1HB ARG 20 9.200 -1.150 -4.092
157 2HB ARG 20 2HB ARG 20 9.918 0.293 -4.810
158 1HG ARG 20 1HG ARG 20 11.998 -1.591 -4.703
159 2HG ARG 20 2HG ARG 20 10.584 -2.490 -5.256
160 1HD ARG 20 1HD ARG 20 10.190 -0.597 -6.916
161 2HD ARG 20 2HD ARG 20 11.795 -0.007 -6.486
162 HE ARG 20 HE ARG 20 12.401 -2.544 -7.139
163 1HH1 ARG 20 1HH2 ARG 20 12.389 -0.085 -9.076
164 2HH1 ARG 20 2HH2 ARG 20 11.640 -0.809 -10.460
165 1HH2 ARG 20 1HH1 ARG 20 10.500 -3.586 -8.722
166 2HH2 ARG 20 2HH1 ARG 20 10.571 -2.791 -10.260
167 H SER 21 H SER 21 11.117 2.221 -3.152
168 HA SER 21 HA SER 21 13.921 2.028 -4.088
169 1HB SER 21 1HB SER 21 12.055 3.531 -5.142
170 2HB SER 21 2HB SER 21 12.414 4.609 -3.796
171 HG SER 21 HG SER 21 14.330 3.553 -5.610
172 H VAL 22 H VAL 22 12.997 1.618 -1.244
173 HA VAL 22 HA VAL 22 15.008 3.371 -0.012
174 HB VAL 22 HB VAL 22 13.217 4.748 0.423
175 1HG1 VAL 22 1HG1 VAL 22 11.599 2.237 0.256
176 2HG1 VAL 22 2HG1 VAL 22 10.910 3.671 1.013
177 3HG1 VAL 22 3HG1 VAL 22 11.440 3.728 -0.667
178 1HG2 VAL 22 1HG2 VAL 22 14.108 3.327 2.572
179 2HG2 VAL 22 2HG2 VAL 22 12.971 4.669 2.695
180 3HG2 VAL 22 3HG2 VAL 22 12.375 3.010 2.661
181 H ILE 23 H ILE 23 12.654 0.725 0.377
182 HA ILE 23 HA ILE 23 14.438 -0.440 2.471
183 HB ILE 23 HB ILE 23 11.496 -0.860 1.874
184 1HG1 ILE 23 1HG1 ILE 23 12.498 -0.185 4.580
185 2HG1 ILE 23 2HG1 ILE 23 12.703 1.078 3.365
186 1HG2 ILE 23 1HG2 ILE 23 13.388 -2.352 3.704
187 2HG2 ILE 23 2HG2 ILE 23 11.642 -2.355 3.945
188 3HG2 ILE 23 3HG2 ILE 23 12.327 -3.021 2.462
189 1HD1 ILE 23 1HD1 ILE 23 10.067 -0.348 3.628
190 2HD1 ILE 23 2HD1 ILE 23 10.466 0.984 4.713
191 3HD1 ILE 23 3HD1 ILE 23 10.399 1.254 2.970
192 H LYS 24 H LYS 24 12.224 -1.585 -0.111
193 HA LYS 24 HA LYS 24 13.862 -4.006 -0.441
194 1HB LYS 24 1HB LYS 24 11.332 -2.994 -1.757
195 2HB LYS 24 2HB LYS 24 12.153 -4.462 -2.288
196 1HG LYS 24 1HG LYS 24 12.033 -4.776 0.462
197 2HG LYS 24 2HG LYS 24 10.487 -4.017 0.078
198 1HD LYS 24 1HD LYS 24 10.174 -6.398 -0.112
199 2HD LYS 24 2HD LYS 24 10.204 -5.744 -1.750
200 1HE LYS 24 1HE LYS 24 11.667 -7.594 -1.910
201 2HE LYS 24 2HE LYS 24 12.788 -6.250 -1.610
202 1HZ LYS 24 1HZ LYS 24 11.997 -6.889 0.877
203 2HZ LYS 24 2HZ LYS 24 12.008 -8.419 0.139
204 3HZ LYS 24 3HZ LYS 24 13.417 -7.468 0.152
205 H ALA 25 H ALA 25 14.068 -4.531 -3.032
206 HA ALA 25 HA ALA 25 14.775 -2.270 -4.694
207 1HB ALA 25 1HB ALA 25 16.927 -3.710 -3.162
208 2HB ALA 25 2HB ALA 25 17.274 -3.046 -4.759
209 3HB ALA 25 3HB ALA 25 16.746 -1.982 -3.456
Start of MODEL 13
1 1H MET 1 1H MET 1 -18.966 1.019 8.964
2 2H MET 1 2H MET 1 -19.639 2.574 8.895
3 3H MET 1 3H MET 1 -20.088 1.404 7.748
4 HA MET 1 HA MET 1 -18.579 2.755 6.595
5 1HB MET 1 1HB MET 1 -17.981 3.803 8.866
6 2HB MET 1 2HB MET 1 -16.752 2.543 8.996
7 1HG MET 1 1HG MET 1 -16.231 3.420 6.493
8 2HG MET 1 2HG MET 1 -16.852 4.909 7.203
9 1HE MET 1 1HE MET 1 -15.289 6.410 7.458
10 2HE MET 1 2HE MET 1 -13.654 6.287 8.104
11 3HE MET 1 3HE MET 1 -14.030 5.622 6.510
12 HA PRO 2 HA PRO 2 -16.841 -1.500 6.239
13 1HB PRO 2 1HB PRO 2 -17.943 -2.074 3.809
14 2HB PRO 2 2HB PRO 2 -18.794 -2.346 5.343
15 1HG PRO 2 1HG PRO 2 -19.151 -0.195 3.343
16 2HG PRO 2 2HG PRO 2 -20.335 -0.954 4.415
17 1HD PRO 2 1HD PRO 2 -19.148 1.531 4.812
18 2HD PRO 2 2HD PRO 2 -19.986 0.573 6.050
19 H GLY 3 H GLY 3 -16.199 1.436 5.031
20 1HA GLY 3 1HA GLY 3 -14.699 0.639 2.626
21 2HA GLY 3 2HA GLY 3 -14.818 2.273 3.279
22 H THR 4 H THR 4 -13.904 -0.549 5.196
23 HA THR 4 HA THR 4 -11.414 0.806 5.959
24 HB THR 4 HB THR 4 -12.599 -0.321 7.730
25 HG1 THR 4 HG1 THR 4 -10.653 -0.814 8.321
26 1HG2 THR 4 1HG2 THR 4 -13.108 -2.245 5.647
27 2HG2 THR 4 2HG2 THR 4 -12.425 -3.061 7.054
28 3HG2 THR 4 3HG2 THR 4 -13.888 -2.090 7.222
29 H ILE 5 H ILE 5 -12.409 -1.420 3.580
30 HA ILE 5 HA ILE 5 -9.682 -2.577 3.316
31 HB ILE 5 HB ILE 5 -12.169 -3.222 1.707
32 1HG1 ILE 5 1HG1 ILE 5 -11.053 -4.566 4.191
33 2HG1 ILE 5 2HG1 ILE 5 -12.564 -3.662 4.099
34 1HG2 ILE 5 1HG2 ILE 5 -9.864 -3.829 0.815
35 2HG2 ILE 5 2HG2 ILE 5 -9.693 -4.886 2.216
36 3HG2 ILE 5 3HG2 ILE 5 -10.969 -5.186 1.037
37 1HD1 ILE 5 1HD1 ILE 5 -12.244 -5.826 2.100
38 2HD1 ILE 5 2HD1 ILE 5 -12.420 -6.352 3.774
39 3HD1 ILE 5 3HD1 ILE 5 -13.667 -5.352 3.028
40 H LYS 6 H LYS 6 -11.753 -0.172 1.974
41 HA LYS 6 HA LYS 6 -10.078 0.012 -0.484
42 1HB LYS 6 1HB LYS 6 -12.854 0.462 0.078
43 2HB LYS 6 2HB LYS 6 -12.138 1.984 -0.452
44 1HG LYS 6 1HG LYS 6 -11.159 0.801 -2.417
45 2HG LYS 6 2HG LYS 6 -11.992 -0.669 -1.910
46 1HD LYS 6 1HD LYS 6 -13.674 0.092 -3.240
47 2HD LYS 6 2HD LYS 6 -14.043 1.141 -1.870
48 1HE LYS 6 1HE LYS 6 -12.575 2.903 -2.842
49 2HE LYS 6 2HE LYS 6 -12.295 1.860 -4.250
50 1HZ LYS 6 1HZ LYS 6 -14.749 1.706 -4.481
51 2HZ LYS 6 2HZ LYS 6 -14.903 2.897 -3.279
52 3HZ LYS 6 3HZ LYS 6 -14.139 3.270 -4.748
53 H GLU 7 H GLU 7 -9.483 0.935 2.424
54 HA GLU 7 HA GLU 7 -8.547 3.646 1.610
55 1HB GLU 7 1HB GLU 7 -10.564 3.944 3.002
56 2HB GLU 7 2HB GLU 7 -9.833 2.959 4.271
57 1HG GLU 7 1HG GLU 7 -7.946 4.974 3.544
58 2HG GLU 7 2HG GLU 7 -9.503 5.762 3.802
59 H ASN 8 H ASN 8 -8.247 0.923 3.873
60 HA ASN 8 HA ASN 8 -5.524 1.834 4.613
61 1HB ASN 8 1HB ASN 8 -7.130 0.971 6.352
62 2HB ASN 8 2HB ASN 8 -7.033 -0.612 5.578
63 1HD2 ASN 8 2HD2 ASN 8 -5.058 1.852 7.265
64 2HD2 ASN 8 1HD2 ASN 8 -3.827 0.778 7.724
65 H ILE 9 H ILE 9 -7.075 -1.141 3.352
66 HA ILE 9 HA ILE 9 -4.697 -2.543 2.745
67 HB ILE 9 HB ILE 9 -7.241 -2.608 1.097
68 1HG1 ILE 9 1HG1 ILE 9 -7.834 -2.842 3.454
69 2HG1 ILE 9 2HG1 ILE 9 -7.924 -4.427 2.683
70 1HG2 ILE 9 1HG2 ILE 9 -4.773 -4.012 0.953
71 2HG2 ILE 9 2HG2 ILE 9 -5.973 -5.143 1.577
72 3HG2 ILE 9 3HG2 ILE 9 -6.248 -4.326 0.038
73 1HD1 ILE 9 1HD1 ILE 9 -5.257 -4.172 3.542
74 2HD1 ILE 9 2HD1 ILE 9 -6.238 -3.561 4.875
75 3HD1 ILE 9 3HD1 ILE 9 -6.507 -5.191 4.258
76 H ILE 10 H ILE 10 -6.100 0.230 1.224
77 HA ILE 10 HA ILE 10 -4.881 -0.082 -1.372
78 HB ILE 10 HB ILE 10 -5.952 2.298 0.155
79 1HG1 ILE 10 1HG1 ILE 10 -6.835 0.826 -2.350
80 2HG1 ILE 10 2HG1 ILE 10 -7.582 0.693 -0.757
81 1HG2 ILE 10 1HG2 ILE 10 -4.081 3.071 -1.263
82 2HG2 ILE 10 2HG2 ILE 10 -4.799 2.255 -2.653
83 3HG2 ILE 10 3HG2 ILE 10 -5.630 3.620 -1.906
84 1HD1 ILE 10 1HD1 ILE 10 -7.808 3.297 -0.934
85 2HD1 ILE 10 2HD1 ILE 10 -7.600 3.019 -2.663
86 3HD1 ILE 10 3HD1 ILE 10 -8.950 2.276 -1.806
87 H GLY 11 H GLY 11 -3.883 1.593 1.615
88 1HA GLY 11 1HA GLY 11 -1.442 2.652 0.536
89 2HA GLY 11 2HA GLY 11 -1.780 2.422 2.253
90 H VAL 12 H VAL 12 -2.319 -0.457 1.932
91 HA VAL 12 HA VAL 12 0.280 -1.484 2.432
92 HB VAL 12 HB VAL 12 -2.305 -2.820 1.605
93 1HG1 VAL 12 1HG1 VAL 12 -0.333 -4.158 0.844
94 2HG1 VAL 12 2HG1 VAL 12 0.261 -4.167 2.505
95 3HG1 VAL 12 3HG1 VAL 12 -1.261 -4.965 2.107
96 1HG2 VAL 12 1HG2 VAL 12 -1.675 -1.674 3.950
97 2HG2 VAL 12 2HG2 VAL 12 -2.644 -3.144 3.863
98 3HG2 VAL 12 3HG2 VAL 12 -0.919 -3.246 4.214
99 H SER 13 H SER 13 -1.490 -1.044 -0.565
100 HA SER 13 HA SER 13 0.436 -2.656 -2.102
101 1HB SER 13 1HB SER 13 -1.977 -0.996 -2.842
102 2HB SER 13 2HB SER 13 -0.913 -1.687 -4.065
103 HG SER 13 HG SER 13 -2.452 -3.015 -2.089
104 H TYR 14 H TYR 14 -0.256 0.740 -1.446
105 HA TYR 14 HA TYR 14 1.638 1.739 -3.413
106 1HB TYR 14 1HB TYR 14 -0.372 2.849 -1.782
107 2HB TYR 14 2HB TYR 14 1.135 3.585 -1.237
108 HD1 TYR 14 HD1 TYR 14 -1.095 3.059 -4.145
109 HD2 TYR 14 HD2 TYR 14 2.413 5.053 -2.670
110 HE1 TYR 14 HE1 TYR 14 -1.080 4.517 -6.151
111 HE2 TYR 14 HE2 TYR 14 2.428 6.511 -4.676
112 HH TYR 14 HH TYR 14 0.467 5.879 -7.421
113 H ASP 15 H ASP 15 1.783 0.721 -0.074
114 HA ASP 15 HA ASP 15 4.210 2.017 0.681
115 1HB ASP 15 1HB ASP 15 2.576 -0.235 1.654
116 2HB ASP 15 2HB ASP 15 4.293 -0.378 2.030
117 H GLU 16 H GLU 16 3.627 -1.158 -0.843
118 HA GLU 16 HA GLU 16 6.349 -1.990 -0.953
119 1HB GLU 16 1HB GLU 16 3.841 -2.916 -1.939
120 2HB GLU 16 2HB GLU 16 4.957 -2.869 -3.305
121 1HG GLU 16 1HG GLU 16 6.023 -4.696 -2.544
122 2HG GLU 16 2HG GLU 16 6.329 -3.906 -0.997
123 H TYR 17 H TYR 17 4.398 -0.053 -3.215
124 HA TYR 17 HA TYR 17 6.452 0.173 -5.224
125 1HB TYR 17 1HB TYR 17 4.376 2.299 -4.727
126 2HB TYR 17 2HB TYR 17 5.037 1.739 -6.264
127 HD1 TYR 17 HD1 TYR 17 4.873 -1.285 -5.362
128 HD2 TYR 17 HD2 TYR 17 2.062 1.959 -5.465
129 HE1 TYR 17 HE1 TYR 17 3.009 -2.907 -5.584
130 HE2 TYR 17 HE2 TYR 17 0.195 0.338 -5.688
131 HH TYR 17 HH TYR 17 -0.358 -1.799 -5.953
132 H ARG 18 H ARG 18 5.524 2.191 -2.451
133 HA ARG 18 HA ARG 18 7.678 4.109 -2.975
134 1HB ARG 18 1HB ARG 18 5.315 4.202 -1.533
135 2HB ARG 18 2HB ARG 18 6.536 4.076 -0.268
136 1HG ARG 18 1HG ARG 18 7.588 5.909 -2.122
137 2HG ARG 18 2HG ARG 18 5.886 6.343 -1.953
138 1HD ARG 18 1HD ARG 18 6.781 7.522 -0.169
139 2HD ARG 18 2HD ARG 18 6.403 5.994 0.628
140 HE ARG 18 HE ARG 18 9.001 5.669 -0.326
141 1HH1 ARG 18 1HH1 ARG 18 8.607 8.741 0.411
142 2HH1 ARG 18 2HH1 ARG 18 9.405 8.747 1.948
143 1HH2 ARG 18 1HH2 ARG 18 9.477 5.290 2.220
144 2HH2 ARG 18 2HH2 ARG 18 9.896 6.794 2.973
145 H TYR 19 H TYR 19 7.809 1.010 -2.098
146 HA TYR 19 HA TYR 19 9.792 1.318 0.088
147 1HB TYR 19 1HB TYR 19 7.991 -0.839 -0.937
148 2HB TYR 19 2HB TYR 19 9.500 -1.322 -0.184
149 HD1 TYR 19 HD1 TYR 19 8.188 1.831 0.969
150 HD2 TYR 19 HD2 TYR 19 7.981 -2.419 1.544
151 HE1 TYR 19 HE1 TYR 19 7.197 2.183 3.218
152 HE2 TYR 19 HE2 TYR 19 6.992 -2.071 3.792
153 HH TYR 19 HH TYR 19 7.193 0.401 5.527
154 H ARG 20 H ARG 20 9.332 -0.134 -3.128
155 HA ARG 20 HA ARG 20 11.867 -1.330 -3.436
156 1HB ARG 20 1HB ARG 20 9.959 -0.098 -5.430
157 2HB ARG 20 2HB ARG 20 11.451 -0.894 -5.931
158 1HG ARG 20 1HG ARG 20 10.652 -2.888 -4.501
159 2HG ARG 20 2HG ARG 20 9.075 -2.098 -4.512
160 1HD ARG 20 1HD ARG 20 9.383 -3.787 -6.357
161 2HD ARG 20 2HD ARG 20 8.982 -2.167 -6.927
162 HE ARG 20 HE ARG 20 11.810 -3.139 -6.880
163 1HH1 ARG 20 1HH2 ARG 20 10.428 -3.852 -9.376
164 2HH1 ARG 20 2HH2 ARG 20 10.683 -2.464 -10.380
165 1HH2 ARG 20 1HH1 ARG 20 11.573 -0.393 -7.745
166 2HH2 ARG 20 2HH1 ARG 20 11.333 -0.506 -9.456
167 H SER 21 H SER 21 10.899 2.049 -3.848
168 HA SER 21 HA SER 21 13.512 2.782 -4.951
169 1HB SER 21 1HB SER 21 11.391 3.956 -5.596
170 2HB SER 21 2HB SER 21 11.303 4.593 -3.956
171 HG SER 21 HG SER 21 13.107 5.159 -6.026
172 H VAL 22 H VAL 22 12.876 1.774 -2.017
173 HA VAL 22 HA VAL 22 14.843 3.586 -0.792
174 HB VAL 22 HB VAL 22 13.069 4.690 0.082
175 1HG1 VAL 22 1HG1 VAL 22 11.448 2.163 -0.183
176 2HG1 VAL 22 2HG1 VAL 22 10.819 3.698 0.406
177 3HG1 VAL 22 3HG1 VAL 22 11.402 3.562 -1.252
178 1HG2 VAL 22 1HG2 VAL 22 14.149 3.023 1.906
179 2HG2 VAL 22 2HG2 VAL 22 12.863 4.161 2.309
180 3HG2 VAL 22 3HG2 VAL 22 12.474 2.476 1.970
181 H ILE 23 H ILE 23 12.693 1.143 0.677
182 HA ILE 23 HA ILE 23 14.561 -0.113 2.276
183 HB ILE 23 HB ILE 23 12.222 -1.285 0.757
184 1HG1 ILE 23 1HG1 ILE 23 11.857 -1.392 3.536
185 2HG1 ILE 23 2HG1 ILE 23 12.633 0.165 3.248
186 1HG2 ILE 23 1HG2 ILE 23 14.371 -2.661 2.141
187 2HG2 ILE 23 2HG2 ILE 23 12.827 -2.938 2.947
188 3HG2 ILE 23 3HG2 ILE 23 13.015 -3.340 1.240
189 1HD1 ILE 23 1HD1 ILE 23 10.763 -0.026 1.196
190 2HD1 ILE 23 2HD1 ILE 23 9.925 -0.702 2.593
191 3HD1 ILE 23 3HD1 ILE 23 10.589 0.929 2.668
192 H LYS 24 H LYS 24 14.256 -0.331 -1.191
193 HA LYS 24 HA LYS 24 16.480 -2.335 -1.214
194 1HB LYS 24 1HB LYS 24 14.052 -2.019 -2.851
195 2HB LYS 24 2HB LYS 24 15.522 -2.284 -3.789
196 1HG LYS 24 1HG LYS 24 16.006 -4.324 -2.623
197 2HG LYS 24 2HG LYS 24 14.756 -4.005 -1.421
198 1HD LYS 24 1HD LYS 24 13.075 -4.722 -2.784
199 2HD LYS 24 2HD LYS 24 13.819 -4.030 -4.226
200 1HE LYS 24 1HE LYS 24 13.797 -6.523 -4.312
201 2HE LYS 24 2HE LYS 24 15.457 -5.895 -4.272
202 1HZ LYS 24 1HZ LYS 24 13.931 -6.606 -1.830
203 2HZ LYS 24 2HZ LYS 24 14.968 -7.695 -2.613
204 3HZ LYS 24 3HZ LYS 24 15.589 -6.258 -1.951
205 H ALA 25 H ALA 25 15.459 -0.344 -3.935
206 HA ALA 25 HA ALA 25 18.156 0.941 -3.868
207 1HB ALA 25 1HB ALA 25 16.487 -0.176 -6.013
208 2HB ALA 25 2HB ALA 25 17.122 1.428 -6.382
209 3HB ALA 25 3HB ALA 25 18.226 0.113 -5.978