Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
14400 | 1wo3 RC | 6329 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H ALA 1 1HT ALA 1 -3.562 4.639 3.555
2 2H ALA 1 2HT ALA 1 -2.041 4.550 2.766
3 3H ALA 1 3HT ALA 1 -2.148 5.185 4.357
4 HA ALA 1 HA ALA 1 -1.268 2.976 4.344
5 1HB ALA 1 1HB ALA 1 -2.333 3.510 6.342
6 2HB ALA 1 2HB ALA 1 -3.089 1.987 5.870
7 3HB ALA 1 3HB ALA 1 -3.933 3.512 5.600
8 H VAL 2 H VAL 2 -1.862 0.650 4.251
9 HA VAL 2 HA VAL 2 -2.673 -0.085 1.678
10 HB VAL 2 HB VAL 2 -1.240 -1.494 3.107
11 1HG1 VAL 2 1HG1 VAL 2 -2.511 -1.124 5.210
12 2HG1 VAL 2 2HG1 VAL 2 -2.140 -2.821 4.895
13 3HG1 VAL 2 3HG1 VAL 2 -3.765 -2.202 4.594
14 1HG2 VAL 2 1HG2 VAL 2 -2.083 -2.667 1.288
15 2HG2 VAL 2 2HG2 VAL 2 -3.734 -2.639 1.907
16 3HG2 VAL 2 3HG2 VAL 2 -2.529 -3.688 2.656
17 H SER 3 H SER 3 -4.464 0.092 4.705
18 HA SER 3 HA SER 3 -6.785 -1.255 3.906
19 1HB SER 3 2HB SER 3 -6.500 1.035 5.868
20 2HB SER 3 1HB SER 3 -7.901 -0.028 5.739
21 HG SER 3 HG SER 3 -6.242 -0.558 7.380
22 H ALA 4 H ALA 4 -5.689 2.020 3.351
23 HA ALA 4 HA ALA 4 -8.169 2.567 1.853
24 1HB ALA 4 1HB ALA 4 -7.676 4.057 3.807
25 2HB ALA 4 2HB ALA 4 -7.862 4.893 2.266
26 3HB ALA 4 3HB ALA 4 -6.252 4.623 2.935
27 H CYS 5 H CYS 5 -5.756 1.128 0.923
28 HA CYS 5 HA CYS 5 -4.129 2.706 -0.704
29 1HB CYS 5 2HB CYS 5 -3.431 0.484 -0.347
30 2HB CYS 5 1HB CYS 5 -4.981 -0.180 -0.845
31 H ALA 6 H ALA 6 -4.231 3.355 -2.826
32 HA ALA 6 HA ALA 6 -6.925 3.417 -3.985
33 1HB ALA 6 1HB ALA 6 -6.384 5.405 -5.007
34 2HB ALA 6 2HB ALA 6 -4.661 5.035 -5.060
35 3HB ALA 6 3HB ALA 6 -5.414 5.506 -3.537
36 H LEU 7 H LEU 7 -3.697 2.246 -4.529
37 HA LEU 7 HA LEU 7 -3.969 1.711 -7.311
38 1HB LEU 7 2HB LEU 7 -2.063 0.889 -5.161
39 2HB LEU 7 1HB LEU 7 -2.042 0.030 -6.689
40 HG LEU 7 HG LEU 7 -1.682 3.014 -6.418
41 1HD1 LEU 7 1HD1 LEU 7 0.564 1.293 -7.243
42 2HD1 LEU 7 2HD1 LEU 7 0.110 1.214 -5.542
43 3HD1 LEU 7 3HD1 LEU 7 0.553 2.760 -6.265
44 1HD2 LEU 7 1HD2 LEU 7 -0.903 2.867 -8.734
45 2HD2 LEU 7 2HD2 LEU 7 -2.574 2.326 -8.576
46 3HD2 LEU 7 3HD2 LEU 7 -1.277 1.143 -8.748
47 HA PRO 8 HA PRO 8 -6.209 -2.076 -7.406
48 1HB PRO 8 2HB PRO 8 -4.802 -3.598 -9.177
49 2HB PRO 8 1HB PRO 8 -5.819 -2.237 -9.661
50 1HG PRO 8 2HG PRO 8 -2.852 -2.343 -9.280
51 2HG PRO 8 1HG PRO 8 -3.787 -1.567 -10.572
52 1HD PRO 8 2HD PRO 8 -2.754 -0.170 -8.508
53 2HD PRO 8 1HD PRO 8 -4.295 0.273 -9.271
54 H LYS 9 H LYS 9 -5.178 -2.242 -5.088
55 HA LYS 9 HA LYS 9 -4.436 -3.621 -3.442
56 1HB LYS 9 2HB LYS 9 -4.319 -5.789 -5.537
57 2HB LYS 9 1HB LYS 9 -4.493 -5.989 -3.799
58 1HG LYS 9 2HG LYS 9 -6.711 -5.427 -3.815
59 2HG LYS 9 1HG LYS 9 -6.565 -4.443 -5.273
60 1HD LYS 9 2HD LYS 9 -7.783 -6.401 -5.866
61 2HD LYS 9 1HD LYS 9 -6.163 -6.572 -6.547
62 1HE LYS 9 2HE LYS 9 -6.921 -7.734 -3.880
63 2HE LYS 9 1HE LYS 9 -7.155 -8.612 -5.391
64 1HZ LYS 9 1HZ LYS 9 -4.698 -7.983 -3.970
65 2HZ LYS 9 2HZ LYS 9 -4.622 -7.879 -5.656
66 3HZ LYS 9 3HZ LYS 9 -5.087 -9.329 -4.919
67 H CYS 10 H CYS 10 -2.482 -3.524 -2.576
68 HA CYS 10 HA CYS 10 -0.150 -4.088 -4.291
69 1HB CYS 10 2HB CYS 10 -0.251 -2.138 -1.982
70 2HB CYS 10 1HB CYS 10 1.110 -2.421 -3.061
71 H ALA 11 H ALA 11 -1.033 -3.808 -0.847
72 HA ALA 11 HA ALA 11 1.001 -5.404 0.175
73 1HB ALA 11 1HB ALA 11 -0.256 -4.055 1.667
74 2HB ALA 11 2HB ALA 11 -0.553 -5.731 2.130
75 3HB ALA 11 3HB ALA 11 -1.768 -4.841 1.212
76 H ALA 12 H ALA 12 1.407 -7.336 -0.776
77 HA ALA 12 HA ALA 12 -0.794 -9.217 -1.185
78 1HB ALA 12 1HB ALA 12 1.946 -10.018 -1.915
79 2HB ALA 12 2HB ALA 12 1.288 -8.633 -2.787
80 3HB ALA 12 3HB ALA 12 0.437 -10.177 -2.813
81 H ALA 13 H ALA 13 0.468 -8.464 1.478
82 HA ALA 13 HA ALA 13 0.308 -10.992 2.691
83 1HB ALA 13 1HB ALA 13 2.359 -11.719 2.018
84 2HB ALA 13 2HB ALA 13 2.835 -10.851 3.478
85 3HB ALA 13 3HB ALA 13 3.022 -10.089 1.898
86 H ALA 14 H ALA 14 -0.664 -8.317 3.062
87 HA ALA 14 HA ALA 14 -1.092 -6.811 4.713
88 1HB ALA 14 1HB ALA 14 -0.401 -7.772 7.092
89 2HB ALA 14 2HB ALA 14 -0.288 -9.268 6.165
90 3HB ALA 14 3HB ALA 14 -1.805 -8.368 6.207
91 H ASN 15 H ASN 15 0.946 -5.895 3.442
92 HA ASN 15 HA ASN 15 2.796 -4.978 5.530
93 1HB ASN 15 2HB ASN 15 3.638 -6.803 3.711
94 2HB ASN 15 1HB ASN 15 3.973 -5.314 2.832
95 1HD2 ASN 15 1HD2 ASN 15 5.783 -7.310 3.991
96 2HD2 ASN 15 2HD2 ASN 15 6.819 -6.435 5.062
97 H VAL 16 H VAL 16 1.981 -3.048 5.729
98 HA VAL 16 HA VAL 16 0.979 -1.356 3.764
99 HB VAL 16 HB VAL 16 1.992 -1.074 6.537
100 1HG1 VAL 16 1HG1 VAL 16 2.972 0.917 5.803
101 2HG1 VAL 16 2HG1 VAL 16 1.380 1.434 6.362
102 3HG1 VAL 16 3HG1 VAL 16 1.686 1.233 4.637
103 1HG2 VAL 16 1HG2 VAL 16 -0.183 -0.797 7.060
104 2HG2 VAL 16 2HG2 VAL 16 -0.434 -1.559 5.490
105 3HG2 VAL 16 3HG2 VAL 16 -0.514 0.196 5.641
106 H ALA 17 H ALA 17 4.269 -1.686 5.049
107 HA ALA 17 HA ALA 17 5.469 0.506 3.855
108 1HB ALA 17 1HB ALA 17 7.515 -1.179 3.773
109 2HB ALA 17 2HB ALA 17 6.435 -2.146 4.778
110 3HB ALA 17 3HB ALA 17 6.906 -0.526 5.293
111 H ALA 18 H ALA 18 5.138 -2.788 2.545
112 HA ALA 18 HA ALA 18 6.371 -2.300 0.077
113 1HB ALA 18 1HB ALA 18 4.405 -4.336 1.043
114 2HB ALA 18 2HB ALA 18 6.086 -4.547 0.553
115 3HB ALA 18 3HB ALA 18 4.842 -4.263 -0.665
116 H HIS 19 H HIS 19 3.268 -1.411 1.287
117 HA HIS 19 HA HIS 19 2.186 -0.883 -1.353
118 1HB HIS 19 2HB HIS 19 0.424 -1.615 -0.100
119 2HB HIS 19 1HB HIS 19 1.104 -1.007 1.403
120 HD2 HIS 19 2HD HIS 19 0.038 1.268 2.314
121 HE1 HIS 19 1HE HIS 19 -1.955 2.398 -1.236
122 HE2 HIS 19 2HE HIS 19 -1.711 2.855 1.249
123 H MET 20 H MET 20 2.507 1.091 1.618
124 HA MET 20 HA MET 20 2.057 3.558 0.502
125 1HB MET 20 2HB MET 20 2.641 2.737 2.978
126 2HB MET 20 1HB MET 20 4.210 3.406 2.548
127 1HG MET 20 2HG MET 20 3.455 5.538 2.533
128 2HG MET 20 1HG MET 20 1.844 5.084 1.984
129 1HE MET 20 1HE MET 20 3.110 4.099 6.287
130 2HE MET 20 2HE MET 20 4.224 5.023 5.279
131 3HE MET 20 3HE MET 20 3.752 3.392 4.804
132 H THR 21 H THR 21 4.862 1.570 0.109
133 HA THR 21 HA THR 21 6.857 3.385 -0.447
134 HB THR 21 HB THR 21 7.184 0.948 -0.340
135 HG1 THR 21 1HG THR 21 8.667 0.845 -2.073
136 1HG2 THR 21 1HG2 THR 21 6.393 0.623 -3.176
137 2HG2 THR 21 2HG2 THR 21 5.130 0.574 -1.947
138 3HG2 THR 21 3HG2 THR 21 6.475 -0.565 -1.875
139 H HIS 22 H HIS 22 4.024 2.703 -2.325
140 HA HIS 22 HA HIS 22 5.034 4.512 -4.428
141 1HB HIS 22 2HB HIS 22 3.336 3.155 -5.904
142 2HB HIS 22 1HB HIS 22 4.958 2.533 -5.625
143 HD1 HIS 22 1HD HIS 22 4.946 0.138 -5.141
144 HD2 HIS 22 2HD HIS 22 1.501 1.976 -3.680
145 HE1 HIS 22 1HE HIS 22 3.604 -1.694 -4.071
146 HE2 HIS 22 2HE HIS 22 1.645 -0.515 -3.028
147 H CYS 23 H CYS 23 2.318 3.321 -2.593
148 HA CYS 23 HA CYS 23 0.454 5.195 -3.715
149 1HB CYS 23 2HB CYS 23 0.409 3.022 -1.676
150 2HB CYS 23 1HB CYS 23 -0.891 4.198 -1.681
151 H ALA 24 H ALA 24 -1.004 6.194 -1.755
152 HA ALA 24 HA ALA 24 -1.173 7.897 -0.257
153 1HB ALA 24 1HB ALA 24 0.421 7.911 1.631
154 2HB ALA 24 2HB ALA 24 1.383 6.692 0.794
155 3HB ALA 24 3HB ALA 24 -0.259 6.314 1.317
156 H LYS 25 H LYS 25 -0.629 9.067 -2.397
157 HA LYS 25 HA LYS 25 1.278 11.132 -1.751
158 1HB LYS 25 2HB LYS 25 2.597 9.303 -2.917
159 2HB LYS 25 1HB LYS 25 1.647 9.654 -4.355
160 1HG LYS 25 2HG LYS 25 2.494 12.128 -3.774
161 2HG LYS 25 1HG LYS 25 3.828 11.189 -3.100
162 1HD LYS 25 2HD LYS 25 4.572 11.417 -5.248
163 2HD LYS 25 1HD LYS 25 3.638 9.930 -5.419
164 1HE LYS 25 2HE LYS 25 2.449 12.646 -5.915
165 2HE LYS 25 1HE LYS 25 3.276 11.735 -7.179
166 1HZ LYS 25 1HZ LYS 25 1.625 9.875 -6.348
167 2HZ LYS 25 2HZ LYS 25 1.165 11.015 -7.509
168 3HZ LYS 25 3HZ LYS 25 0.703 11.218 -5.895
Start of MODEL 2
1 1H ALA 1 1HT ALA 1 -0.309 4.013 3.177
2 2H ALA 1 2HT ALA 1 -0.813 5.352 4.124
3 3H ALA 1 3HT ALA 1 -1.680 4.927 2.704
4 HA ALA 1 HA ALA 1 -1.382 3.182 5.049
5 1HB ALA 1 1HB ALA 1 -2.690 4.755 6.020
6 2HB ALA 1 2HB ALA 1 -3.954 3.903 5.133
7 3HB ALA 1 3HB ALA 1 -3.266 5.389 4.479
8 H VAL 2 H VAL 2 -1.534 1.187 4.261
9 HA VAL 2 HA VAL 2 -2.597 0.478 1.771
10 HB VAL 2 HB VAL 2 -1.026 -0.948 3.015
11 1HG1 VAL 2 1HG1 VAL 2 -1.496 -2.016 4.990
12 2HG1 VAL 2 2HG1 VAL 2 -3.238 -1.981 4.724
13 3HG1 VAL 2 3HG1 VAL 2 -2.390 -0.514 5.213
14 1HG2 VAL 2 1HG2 VAL 2 -2.834 -1.769 1.290
15 2HG2 VAL 2 2HG2 VAL 2 -3.456 -2.641 2.692
16 3HG2 VAL 2 3HG2 VAL 2 -1.804 -2.920 2.142
17 H SER 3 H SER 3 -4.100 0.835 4.902
18 HA SER 3 HA SER 3 -6.460 -0.607 4.456
19 1HB SER 3 2HB SER 3 -5.886 1.795 6.198
20 2HB SER 3 1HB SER 3 -7.432 0.946 6.209
21 HG SER 3 HG SER 3 -6.082 -0.992 6.633
22 H ALA 4 H ALA 4 -5.495 2.624 3.510
23 HA ALA 4 HA ALA 4 -8.110 2.990 2.202
24 1HB ALA 4 1HB ALA 4 -6.290 5.302 2.575
25 2HB ALA 4 2HB ALA 4 -7.092 4.654 4.005
26 3HB ALA 4 3HB ALA 4 -8.051 5.222 2.638
27 H CYS 5 H CYS 5 -5.779 1.496 1.173
28 HA CYS 5 HA CYS 5 -4.509 3.067 -0.834
29 1HB CYS 5 2HB CYS 5 -3.391 1.096 -0.053
30 2HB CYS 5 1HB CYS 5 -4.769 0.081 -0.451
31 H ALA 6 H ALA 6 -4.871 3.121 -3.049
32 HA ALA 6 HA ALA 6 -7.592 2.348 -3.863
33 1HB ALA 6 1HB ALA 6 -7.722 4.213 -5.197
34 2HB ALA 6 2HB ALA 6 -5.974 4.318 -5.409
35 3HB ALA 6 3HB ALA 6 -6.709 4.817 -3.885
36 H LEU 7 H LEU 7 -4.230 1.892 -4.488
37 HA LEU 7 HA LEU 7 -4.340 1.036 -7.164
38 1HB LEU 7 2HB LEU 7 -2.437 0.676 -4.902
39 2HB LEU 7 1HB LEU 7 -2.256 -0.364 -6.301
40 HG LEU 7 HG LEU 7 -2.297 2.646 -6.472
41 1HD1 LEU 7 1HD1 LEU 7 -0.113 2.766 -6.015
42 2HD1 LEU 7 2HD1 LEU 7 0.251 1.286 -6.903
43 3HD1 LEU 7 3HD1 LEU 7 -0.332 1.196 -5.241
44 1HD2 LEU 7 1HD2 LEU 7 -2.863 1.185 -8.488
45 2HD2 LEU 7 2HD2 LEU 7 -1.173 0.683 -8.445
46 3HD2 LEU 7 3HD2 LEU 7 -1.583 2.382 -8.688
47 HA PRO 8 HA PRO 8 -6.317 -2.910 -6.632
48 1HB PRO 8 2HB PRO 8 -5.964 -3.902 -9.098
49 2HB PRO 8 1HB PRO 8 -7.048 -2.539 -8.797
50 1HG PRO 8 2HG PRO 8 -4.252 -2.537 -9.866
51 2HG PRO 8 1HG PRO 8 -5.656 -1.595 -10.401
52 1HD PRO 8 2HD PRO 8 -3.685 -0.616 -8.761
53 2HD PRO 8 1HD PRO 8 -5.347 0.001 -8.790
54 H LYS 9 H LYS 9 -5.655 -4.802 -5.810
55 HA LYS 9 HA LYS 9 -4.307 -6.513 -5.150
56 1HB LYS 9 2HB LYS 9 -3.595 -6.098 -8.011
57 2HB LYS 9 1HB LYS 9 -2.545 -7.136 -7.056
58 1HG LYS 9 2HG LYS 9 -5.437 -7.659 -6.824
59 2HG LYS 9 1HG LYS 9 -4.699 -8.014 -8.388
60 1HD LYS 9 2HD LYS 9 -3.496 -9.746 -7.572
61 2HD LYS 9 1HD LYS 9 -3.204 -8.949 -6.025
62 1HE LYS 9 2HE LYS 9 -5.992 -9.742 -6.544
63 2HE LYS 9 1HE LYS 9 -4.847 -11.070 -6.357
64 1HZ LYS 9 1HZ LYS 9 -4.858 -8.873 -4.400
65 2HZ LYS 9 2HZ LYS 9 -4.384 -10.484 -4.198
66 3HZ LYS 9 3HZ LYS 9 -6.027 -10.091 -4.291
67 H CYS 10 H CYS 10 -3.515 -3.779 -4.533
68 HA CYS 10 HA CYS 10 -0.721 -3.449 -4.812
69 1HB CYS 10 2HB CYS 10 -2.691 -1.804 -4.051
70 2HB CYS 10 1HB CYS 10 -2.101 -2.268 -2.458
71 H ALA 11 H ALA 11 -2.697 -4.562 -2.066
72 HA ALA 11 HA ALA 11 -0.612 -5.086 -0.292
73 1HB ALA 11 1HB ALA 11 -2.176 -6.444 0.935
74 2HB ALA 11 2HB ALA 11 -3.217 -6.592 -0.481
75 3HB ALA 11 3HB ALA 11 -3.015 -5.026 0.306
76 H ALA 12 H ALA 12 1.048 -6.422 -0.497
77 HA ALA 12 HA ALA 12 0.852 -8.716 -2.293
78 1HB ALA 12 1HB ALA 12 3.360 -7.941 -0.865
79 2HB ALA 12 2HB ALA 12 2.784 -6.977 -2.225
80 3HB ALA 12 3HB ALA 12 3.155 -8.686 -2.451
81 H ALA 13 H ALA 13 1.113 -7.947 1.091
82 HA ALA 13 HA ALA 13 0.380 -10.560 1.885
83 1HB ALA 13 1HB ALA 13 2.406 -11.251 3.033
84 2HB ALA 13 2HB ALA 13 3.243 -9.807 2.462
85 3HB ALA 13 3HB ALA 13 2.719 -11.037 1.311
86 H ALA 14 H ALA 14 -0.439 -7.853 2.348
87 HA ALA 14 HA ALA 14 -1.218 -6.543 4.036
88 1HB ALA 14 1HB ALA 14 -0.443 -8.667 6.005
89 2HB ALA 14 2HB ALA 14 -1.804 -8.889 4.905
90 3HB ALA 14 3HB ALA 14 -1.808 -7.551 6.055
91 H ASN 15 H ASN 15 1.058 -5.607 3.286
92 HA ASN 15 HA ASN 15 2.466 -4.944 5.776
93 1HB ASN 15 2HB ASN 15 3.617 -6.646 4.011
94 2HB ASN 15 1HB ASN 15 4.152 -5.106 3.344
95 1HD2 ASN 15 1HD2 ASN 15 4.870 -3.541 5.197
96 2HD2 ASN 15 2HD2 ASN 15 5.993 -4.230 6.313
97 H VAL 16 H VAL 16 1.659 -2.996 5.973
98 HA VAL 16 HA VAL 16 0.978 -1.096 4.156
99 HB VAL 16 HB VAL 16 1.997 -1.047 6.940
100 1HG1 VAL 16 1HG1 VAL 16 3.150 0.889 6.205
101 2HG1 VAL 16 2HG1 VAL 16 1.674 1.475 6.970
102 3HG1 VAL 16 3HG1 VAL 16 1.790 1.416 5.211
103 1HG2 VAL 16 1HG2 VAL 16 -0.174 0.073 7.323
104 2HG2 VAL 16 2HG2 VAL 16 -0.334 -1.495 6.531
105 3HG2 VAL 16 3HG2 VAL 16 -0.492 -0.011 5.591
106 H ALA 17 H ALA 17 4.231 -1.667 5.478
107 HA ALA 17 HA ALA 17 5.561 0.474 4.318
108 1HB ALA 17 1HB ALA 17 6.379 -2.226 5.251
109 2HB ALA 17 2HB ALA 17 6.912 -0.632 5.788
110 3HB ALA 17 3HB ALA 17 7.525 -1.304 4.277
111 H ALA 18 H ALA 18 5.087 -2.799 2.999
112 HA ALA 18 HA ALA 18 6.388 -2.362 0.551
113 1HB ALA 18 1HB ALA 18 5.533 -4.559 1.650
114 2HB ALA 18 2HB ALA 18 5.568 -4.421 -0.109
115 3HB ALA 18 3HB ALA 18 4.048 -4.213 0.762
116 H HIS 19 H HIS 19 3.308 -1.346 1.717
117 HA HIS 19 HA HIS 19 2.272 -0.801 -0.936
118 1HB HIS 19 2HB HIS 19 0.468 -1.431 0.307
119 2HB HIS 19 1HB HIS 19 1.166 -0.843 1.811
120 HD2 HIS 19 2HD HIS 19 0.231 1.509 2.684
121 HE1 HIS 19 1HE HIS 19 -1.724 2.669 -0.878
122 HE2 HIS 19 2HE HIS 19 -1.158 3.344 1.494
123 H MET 20 H MET 20 2.689 1.196 2.006
124 HA MET 20 HA MET 20 2.349 3.667 0.852
125 1HB MET 20 2HB MET 20 2.908 2.851 3.340
126 2HB MET 20 1HB MET 20 4.496 3.460 2.895
127 1HG MET 20 2HG MET 20 3.348 5.603 2.223
128 2HG MET 20 1HG MET 20 1.902 4.966 3.005
129 1HE MET 20 1HE MET 20 1.961 6.544 6.008
130 2HE MET 20 2HE MET 20 1.501 6.650 4.309
131 3HE MET 20 3HE MET 20 2.737 7.727 4.957
132 H THR 21 H THR 21 5.056 1.542 0.488
133 HA THR 21 HA THR 21 7.128 3.264 -0.102
134 HB THR 21 HB THR 21 7.338 0.809 0.070
135 HG1 THR 21 1HG THR 21 9.082 1.682 -0.866
136 1HG2 THR 21 1HG2 THR 21 6.548 0.514 -2.781
137 2HG2 THR 21 2HG2 THR 21 5.308 0.451 -1.530
138 3HG2 THR 21 3HG2 THR 21 6.646 -0.697 -1.502
139 H HIS 22 H HIS 22 4.273 2.645 -1.969
140 HA HIS 22 HA HIS 22 5.360 4.352 -4.117
141 1HB HIS 22 2HB HIS 22 3.614 3.040 -5.565
142 2HB HIS 22 1HB HIS 22 5.198 2.341 -5.254
143 HD1 HIS 22 1HD HIS 22 5.028 -0.045 -4.757
144 HD2 HIS 22 2HD HIS 22 1.720 2.025 -3.289
145 HE1 HIS 22 1HE HIS 22 3.581 -1.774 -3.655
146 HE2 HIS 22 2HE HIS 22 1.713 -0.463 -2.607
147 H CYS 23 H CYS 23 2.606 3.351 -2.236
148 HA CYS 23 HA CYS 23 0.828 5.279 -3.417
149 1HB CYS 23 2HB CYS 23 0.676 3.151 -1.336
150 2HB CYS 23 1HB CYS 23 -0.563 4.390 -1.359
151 H ALA 24 H ALA 24 2.126 7.182 -2.916
152 HA ALA 24 HA ALA 24 1.453 8.234 -0.277
153 1HB ALA 24 1HB ALA 24 3.876 9.271 -0.351
154 2HB ALA 24 2HB ALA 24 4.214 7.828 -1.307
155 3HB ALA 24 3HB ALA 24 3.584 7.671 0.333
156 H LYS 25 H LYS 25 0.356 8.751 -2.857
157 HA LYS 25 HA LYS 25 1.336 11.461 -3.436
158 1HB LYS 25 2HB LYS 25 1.219 9.779 -5.307
159 2HB LYS 25 1HB LYS 25 -0.530 9.785 -5.118
160 1HG LYS 25 2HG LYS 25 -0.768 11.807 -6.096
161 2HG LYS 25 1HG LYS 25 0.764 12.416 -5.467
162 1HD LYS 25 2HD LYS 25 1.972 11.578 -7.217
163 2HD LYS 25 1HD LYS 25 0.854 10.240 -7.489
164 1HE LYS 25 2HE LYS 25 -0.186 12.966 -7.975
165 2HE LYS 25 1HE LYS 25 1.023 12.367 -9.110
166 1HZ LYS 25 1HZ LYS 25 -1.119 11.789 -9.928
167 2HZ LYS 25 2HZ LYS 25 -1.584 11.116 -8.448
168 3HZ LYS 25 3HZ LYS 25 -0.392 10.362 -9.381
Start of MODEL 3
1 1H ALA 1 1HT ALA 1 -1.650 5.160 2.935
2 2H ALA 1 2HT ALA 1 -2.016 5.639 4.542
3 3H ALA 1 3HT ALA 1 -3.249 5.001 3.533
4 HA ALA 1 HA ALA 1 -0.853 3.461 4.192
5 1HB ALA 1 1HB ALA 1 -1.892 4.240 6.296
6 2HB ALA 1 2HB ALA 1 -1.996 2.492 6.080
7 3HB ALA 1 3HB ALA 1 -3.411 3.504 5.786
8 H VAL 2 H VAL 2 -1.508 1.105 4.229
9 HA VAL 2 HA VAL 2 -2.609 0.384 1.763
10 HB VAL 2 HB VAL 2 -1.060 -1.058 3.014
11 1HG1 VAL 2 1HG1 VAL 2 -2.182 -0.593 5.243
12 2HG1 VAL 2 2HG1 VAL 2 -1.663 -2.252 4.952
13 3HG1 VAL 2 3HG1 VAL 2 -3.365 -1.819 4.787
14 1HG2 VAL 2 1HG2 VAL 2 -2.637 -1.942 1.258
15 2HG2 VAL 2 2HG2 VAL 2 -3.659 -2.513 2.576
16 3HG2 VAL 2 3HG2 VAL 2 -2.020 -3.140 2.398
17 H SER 3 H SER 3 -4.081 0.823 4.897
18 HA SER 3 HA SER 3 -6.479 -0.572 4.475
19 1HB SER 3 2HB SER 3 -5.563 1.573 6.320
20 2HB SER 3 1HB SER 3 -7.305 1.360 6.142
21 HG SER 3 HG SER 3 -6.845 -0.940 6.568
22 H ALA 4 H ALA 4 -5.435 2.625 3.505
23 HA ALA 4 HA ALA 4 -8.050 3.053 2.216
24 1HB ALA 4 1HB ALA 4 -7.945 4.902 3.519
25 2HB ALA 4 2HB ALA 4 -7.002 5.510 2.159
26 3HB ALA 4 3HB ALA 4 -6.182 4.887 3.590
27 H CYS 5 H CYS 5 -5.754 1.515 1.175
28 HA CYS 5 HA CYS 5 -4.465 3.073 -0.835
29 1HB CYS 5 2HB CYS 5 -3.364 1.095 -0.049
30 2HB CYS 5 1HB CYS 5 -4.750 0.090 -0.442
31 H ALA 6 H ALA 6 -4.835 3.126 -3.047
32 HA ALA 6 HA ALA 6 -7.563 2.371 -3.852
33 1HB ALA 6 1HB ALA 6 -7.276 4.109 -5.628
34 2HB ALA 6 2HB ALA 6 -5.748 4.550 -4.868
35 3HB ALA 6 3HB ALA 6 -7.259 4.736 -3.980
36 H LEU 7 H LEU 7 -4.205 1.888 -4.484
37 HA LEU 7 HA LEU 7 -4.329 1.028 -7.159
38 1HB LEU 7 2HB LEU 7 -2.421 0.663 -4.901
39 2HB LEU 7 1HB LEU 7 -2.250 -0.380 -6.299
40 HG LEU 7 HG LEU 7 -2.277 2.630 -6.476
41 1HD1 LEU 7 1HD1 LEU 7 0.264 1.256 -6.910
42 2HD1 LEU 7 2HD1 LEU 7 -0.316 1.174 -5.247
43 3HD1 LEU 7 3HD1 LEU 7 -0.090 2.739 -6.026
44 1HD2 LEU 7 1HD2 LEU 7 -2.855 1.165 -8.487
45 2HD2 LEU 7 2HD2 LEU 7 -1.166 0.657 -8.448
46 3HD2 LEU 7 3HD2 LEU 7 -1.570 2.357 -8.693
47 HA PRO 8 HA PRO 8 -6.328 -2.905 -6.608
48 1HB PRO 8 2HB PRO 8 -5.987 -3.907 -9.073
49 2HB PRO 8 1HB PRO 8 -7.065 -2.537 -8.772
50 1HG PRO 8 2HG PRO 8 -4.273 -2.550 -9.850
51 2HG PRO 8 1HG PRO 8 -5.674 -1.604 -10.383
52 1HD PRO 8 2HD PRO 8 -3.692 -0.629 -8.753
53 2HD PRO 8 1HD PRO 8 -5.353 -0.005 -8.777
54 H LYS 9 H LYS 9 -5.671 -4.799 -5.783
55 HA LYS 9 HA LYS 9 -4.330 -6.515 -5.125
56 1HB LYS 9 2HB LYS 9 -3.229 -6.095 -7.907
57 2HB LYS 9 1HB LYS 9 -2.798 -7.455 -6.878
58 1HG LYS 9 2HG LYS 9 -5.474 -7.658 -6.800
59 2HG LYS 9 1HG LYS 9 -5.267 -6.933 -8.396
60 1HD LYS 9 2HD LYS 9 -4.992 -9.068 -9.058
61 2HD LYS 9 1HD LYS 9 -3.348 -8.840 -8.457
62 1HE LYS 9 2HE LYS 9 -5.629 -9.923 -6.810
63 2HE LYS 9 1HE LYS 9 -4.449 -10.926 -7.653
64 1HZ LYS 9 1HZ LYS 9 -3.631 -8.868 -5.692
65 2HZ LYS 9 2HZ LYS 9 -2.732 -10.175 -6.278
66 3HZ LYS 9 3HZ LYS 9 -4.022 -10.446 -5.220
67 H CYS 10 H CYS 10 -3.523 -3.783 -4.517
68 HA CYS 10 HA CYS 10 -0.727 -3.468 -4.806
69 1HB CYS 10 2HB CYS 10 -2.685 -1.809 -4.049
70 2HB CYS 10 1HB CYS 10 -2.100 -2.271 -2.455
71 H ALA 11 H ALA 11 -2.705 -4.569 -2.057
72 HA ALA 11 HA ALA 11 -0.623 -5.091 -0.279
73 1HB ALA 11 1HB ALA 11 -2.189 -6.450 0.946
74 2HB ALA 11 2HB ALA 11 -3.228 -6.595 -0.471
75 3HB ALA 11 3HB ALA 11 -3.025 -5.031 0.317
76 H ALA 12 H ALA 12 1.056 -6.394 -0.541
77 HA ALA 12 HA ALA 12 0.859 -8.700 -2.314
78 1HB ALA 12 1HB ALA 12 3.394 -8.089 -0.915
79 2HB ALA 12 2HB ALA 12 2.813 -6.900 -2.080
80 3HB ALA 12 3HB ALA 12 3.106 -8.562 -2.590
81 H ALA 13 H ALA 13 1.115 -7.937 1.072
82 HA ALA 13 HA ALA 13 0.379 -10.550 1.861
83 1HB ALA 13 1HB ALA 13 2.604 -10.824 3.236
84 2HB ALA 13 2HB ALA 13 3.273 -9.858 1.921
85 3HB ALA 13 3HB ALA 13 2.487 -11.397 1.573
86 H ALA 14 H ALA 14 -0.435 -7.843 2.330
87 HA ALA 14 HA ALA 14 -1.210 -6.534 4.021
88 1HB ALA 14 1HB ALA 14 -0.477 -8.440 6.155
89 2HB ALA 14 2HB ALA 14 -1.566 -9.039 4.905
90 3HB ALA 14 3HB ALA 14 -2.003 -7.613 5.844
91 H ASN 15 H ASN 15 1.068 -5.603 3.273
92 HA ASN 15 HA ASN 15 2.477 -4.948 5.765
93 1HB ASN 15 2HB ASN 15 3.622 -6.648 3.990
94 2HB ASN 15 1HB ASN 15 4.168 -5.106 3.339
95 1HD2 ASN 15 1HD2 ASN 15 5.882 -4.183 4.227
96 2HD2 ASN 15 2HD2 ASN 15 6.611 -4.647 5.722
97 H VAL 16 H VAL 16 1.677 -2.999 5.965
98 HA VAL 16 HA VAL 16 1.001 -1.093 4.152
99 HB VAL 16 HB VAL 16 2.023 -1.052 6.935
100 1HG1 VAL 16 1HG1 VAL 16 1.803 1.422 5.222
101 2HG1 VAL 16 2HG1 VAL 16 3.183 0.882 6.176
102 3HG1 VAL 16 3HG1 VAL 16 1.728 1.464 6.983
103 1HG2 VAL 16 1HG2 VAL 16 -0.125 -0.185 7.439
104 2HG2 VAL 16 2HG2 VAL 16 -0.361 -1.464 6.248
105 3HG2 VAL 16 3HG2 VAL 16 -0.432 0.227 5.752
106 H ALA 17 H ALA 17 4.254 -1.668 5.475
107 HA ALA 17 HA ALA 17 5.588 0.467 4.311
108 1HB ALA 17 1HB ALA 17 7.032 -2.113 4.387
109 2HB ALA 17 2HB ALA 17 6.356 -1.535 5.909
110 3HB ALA 17 3HB ALA 17 7.499 -0.532 5.013
111 H ALA 18 H ALA 18 5.108 -2.807 2.999
112 HA ALA 18 HA ALA 18 6.410 -2.377 0.550
113 1HB ALA 18 1HB ALA 18 5.555 -4.570 1.652
114 2HB ALA 18 2HB ALA 18 5.587 -4.435 -0.106
115 3HB ALA 18 3HB ALA 18 4.069 -4.224 0.766
116 H HIS 19 H HIS 19 3.332 -1.354 1.714
117 HA HIS 19 HA HIS 19 2.296 -0.814 -0.941
118 1HB HIS 19 2HB HIS 19 0.492 -1.437 0.305
119 2HB HIS 19 1HB HIS 19 1.191 -0.848 1.808
120 HD2 HIS 19 2HD HIS 19 0.265 1.510 2.675
121 HE1 HIS 19 1HE HIS 19 -1.696 2.662 -0.885
122 HE2 HIS 19 2HE HIS 19 -1.125 3.344 1.484
123 H MET 20 H MET 20 2.718 1.192 1.997
124 HA MET 20 HA MET 20 2.380 3.659 0.836
125 1HB MET 20 2HB MET 20 2.919 2.866 3.325
126 2HB MET 20 1HB MET 20 4.526 3.427 2.885
127 1HG MET 20 2HG MET 20 3.184 5.546 2.073
128 2HG MET 20 1HG MET 20 2.013 4.959 3.252
129 1HE MET 20 1HE MET 20 3.061 5.182 6.412
130 2HE MET 20 2HE MET 20 1.826 5.508 5.196
131 3HE MET 20 3HE MET 20 2.719 6.842 5.927
132 H THR 21 H THR 21 5.084 1.530 0.475
133 HA THR 21 HA THR 21 7.157 3.249 -0.124
134 HB THR 21 HB THR 21 7.366 0.795 0.058
135 HG1 THR 21 1HG THR 21 8.329 1.983 -2.324
136 1HG2 THR 21 1HG2 THR 21 6.661 0.408 -2.783
137 2HG2 THR 21 2HG2 THR 21 5.333 0.509 -1.627
138 3HG2 THR 21 3HG2 THR 21 6.586 -0.716 -1.426
139 H HIS 22 H HIS 22 4.299 2.624 -1.984
140 HA HIS 22 HA HIS 22 5.385 4.321 -4.142
141 1HB HIS 22 2HB HIS 22 3.638 3.005 -5.584
142 2HB HIS 22 1HB HIS 22 5.220 2.303 -5.266
143 HD1 HIS 22 1HD HIS 22 5.039 -0.081 -4.764
144 HD2 HIS 22 2HD HIS 22 1.741 2.008 -3.299
145 HE1 HIS 22 1HE HIS 22 3.586 -1.801 -3.653
146 HE2 HIS 22 2HE HIS 22 1.724 -0.478 -2.607
147 H CYS 23 H CYS 23 2.633 3.333 -2.250
148 HA CYS 23 HA CYS 23 0.856 5.257 -3.437
149 1HB CYS 23 2HB CYS 23 0.703 3.137 -1.351
150 2HB CYS 23 1HB CYS 23 -0.532 4.379 -1.373
151 H ALA 24 H ALA 24 1.610 7.305 -3.001
152 HA ALA 24 HA ALA 24 1.298 8.200 -0.247
153 1HB ALA 24 1HB ALA 24 3.707 9.264 -1.597
154 2HB ALA 24 2HB ALA 24 3.796 7.613 -0.982
155 3HB ALA 24 3HB ALA 24 3.410 8.942 0.111
156 H LYS 25 H LYS 25 -0.304 8.571 -2.572
157 HA LYS 25 HA LYS 25 -0.102 11.492 -2.830
158 1HB LYS 25 2HB LYS 25 0.574 9.953 -4.895
159 2HB LYS 25 1HB LYS 25 -1.168 9.935 -5.134
160 1HG LYS 25 2HG LYS 25 -1.267 12.185 -5.599
161 2HG LYS 25 1HG LYS 25 0.230 12.538 -4.733
162 1HD LYS 25 2HD LYS 25 0.765 12.753 -7.016
163 2HD LYS 25 1HD LYS 25 1.410 11.183 -6.533
164 1HE LYS 25 2HE LYS 25 -1.360 11.207 -7.559
165 2HE LYS 25 1HE LYS 25 -0.091 11.562 -8.731
166 1HZ LYS 25 1HZ LYS 25 1.013 9.469 -7.777
167 2HZ LYS 25 2HZ LYS 25 -0.295 9.274 -8.830
168 3HZ LYS 25 3HZ LYS 25 -0.521 9.102 -7.162
Start of MODEL 4
1 1H ALA 1 1HT ALA 1 -2.881 5.067 3.124
2 2H ALA 1 2HT ALA 1 -1.194 4.928 2.841
3 3H ALA 1 3HT ALA 1 -1.767 5.671 4.278
4 HA ALA 1 HA ALA 1 -0.911 3.330 4.410
5 1HB ALA 1 1HB ALA 1 -2.297 4.630 6.098
6 2HB ALA 1 2HB ALA 1 -2.362 2.870 6.203
7 3HB ALA 1 3HB ALA 1 -3.693 3.759 5.462
8 H VAL 2 H VAL 2 -1.513 1.126 4.238
9 HA VAL 2 HA VAL 2 -2.611 0.383 1.775
10 HB VAL 2 HB VAL 2 -1.053 -1.043 3.033
11 1HG1 VAL 2 1HG1 VAL 2 -2.395 -0.541 5.234
12 2HG1 VAL 2 2HG1 VAL 2 -1.514 -2.055 5.036
13 3HG1 VAL 2 3HG1 VAL 2 -3.258 -2.010 4.784
14 1HG2 VAL 2 1HG2 VAL 2 -3.649 -2.504 2.597
15 2HG2 VAL 2 2HG2 VAL 2 -2.010 -3.138 2.443
16 3HG2 VAL 2 3HG2 VAL 2 -2.609 -1.952 1.283
17 H SER 3 H SER 3 -4.083 0.831 4.908
18 HA SER 3 HA SER 3 -6.474 -0.580 4.489
19 1HB SER 3 2HB SER 3 -5.555 1.552 6.343
20 2HB SER 3 1HB SER 3 -7.298 1.361 6.157
21 HG SER 3 HG SER 3 -6.866 -0.947 6.573
22 H ALA 4 H ALA 4 -5.431 2.604 3.493
23 HA ALA 4 HA ALA 4 -8.054 3.029 2.217
24 1HB ALA 4 1HB ALA 4 -7.946 5.270 2.635
25 2HB ALA 4 2HB ALA 4 -6.182 5.302 2.624
26 3HB ALA 4 3HB ALA 4 -7.045 4.669 4.026
27 H CYS 5 H CYS 5 -5.757 1.502 1.173
28 HA CYS 5 HA CYS 5 -4.466 3.067 -0.829
29 1HB CYS 5 2HB CYS 5 -3.367 1.085 -0.052
30 2HB CYS 5 1HB CYS 5 -4.754 0.084 -0.449
31 H ALA 6 H ALA 6 -4.828 3.124 -3.045
32 HA ALA 6 HA ALA 6 -7.558 2.382 -3.856
33 1HB ALA 6 1HB ALA 6 -7.648 4.235 -5.231
34 2HB ALA 6 2HB ALA 6 -5.894 4.350 -5.367
35 3HB ALA 6 3HB ALA 6 -6.696 4.838 -3.875
36 H LEU 7 H LEU 7 -4.202 1.891 -4.486
37 HA LEU 7 HA LEU 7 -4.328 1.033 -7.162
38 1HB LEU 7 2HB LEU 7 -2.421 0.661 -4.905
39 2HB LEU 7 1HB LEU 7 -2.251 -0.381 -6.305
40 HG LEU 7 HG LEU 7 -2.272 2.629 -6.479
41 1HD1 LEU 7 1HD1 LEU 7 -0.316 1.173 -5.245
42 2HD1 LEU 7 2HD1 LEU 7 -0.084 2.736 -6.030
43 3HD1 LEU 7 3HD1 LEU 7 0.266 1.247 -6.909
44 1HD2 LEU 7 1HD2 LEU 7 -2.850 1.168 -8.491
45 2HD2 LEU 7 2HD2 LEU 7 -1.164 0.655 -8.449
46 3HD2 LEU 7 3HD2 LEU 7 -1.562 2.355 -8.694
47 HA PRO 8 HA PRO 8 -6.329 -2.898 -6.621
48 1HB PRO 8 2HB PRO 8 -5.975 -3.904 -9.081
49 2HB PRO 8 1HB PRO 8 -7.050 -2.531 -8.790
50 1HG PRO 8 2HG PRO 8 -4.251 -2.555 -9.849
51 2HG PRO 8 1HG PRO 8 -5.646 -1.604 -10.392
52 1HD PRO 8 2HD PRO 8 -3.671 -0.635 -8.749
53 2HD PRO 8 1HD PRO 8 -5.328 -0.003 -8.788
54 H LYS 9 H LYS 9 -5.684 -4.791 -5.787
55 HA LYS 9 HA LYS 9 -4.348 -6.506 -5.111
56 1HB LYS 9 2HB LYS 9 -3.382 -6.100 -7.934
57 2HB LYS 9 1HB LYS 9 -2.726 -7.365 -6.903
58 1HG LYS 9 2HG LYS 9 -5.369 -7.826 -6.616
59 2HG LYS 9 1HG LYS 9 -5.327 -7.183 -8.259
60 1HD LYS 9 2HD LYS 9 -4.863 -9.310 -8.831
61 2HD LYS 9 1HD LYS 9 -3.225 -8.899 -8.316
62 1HE LYS 9 2HE LYS 9 -5.279 -10.000 -6.418
63 2HE LYS 9 1HE LYS 9 -4.233 -11.043 -7.381
64 1HZ LYS 9 1HZ LYS 9 -3.495 -10.415 -5.029
65 2HZ LYS 9 2HZ LYS 9 -3.092 -8.911 -5.691
66 3HZ LYS 9 3HZ LYS 9 -2.350 -10.316 -6.272
67 H CYS 10 H CYS 10 -3.530 -3.774 -4.522
68 HA CYS 10 HA CYS 10 -0.735 -3.466 -4.811
69 1HB CYS 10 2HB CYS 10 -2.687 -1.804 -4.049
70 2HB CYS 10 1HB CYS 10 -2.101 -2.270 -2.456
71 H ALA 11 H ALA 11 -2.706 -4.572 -2.060
72 HA ALA 11 HA ALA 11 -0.621 -5.095 -0.286
73 1HB ALA 11 1HB ALA 11 -2.183 -6.461 0.937
74 2HB ALA 11 2HB ALA 11 -3.225 -6.602 -0.479
75 3HB ALA 11 3HB ALA 11 -3.022 -5.040 0.314
76 H ALA 12 H ALA 12 1.052 -6.409 -0.526
77 HA ALA 12 HA ALA 12 0.858 -8.708 -2.312
78 1HB ALA 12 1HB ALA 12 3.169 -8.685 -2.451
79 2HB ALA 12 2HB ALA 12 3.358 -7.905 -0.880
80 3HB ALA 12 3HB ALA 12 2.783 -6.975 -2.262
81 H ALA 13 H ALA 13 1.120 -7.946 1.074
82 HA ALA 13 HA ALA 13 0.391 -10.561 1.863
83 1HB ALA 13 1HB ALA 13 2.487 -11.424 1.603
84 2HB ALA 13 2HB ALA 13 2.637 -10.794 3.244
85 3HB ALA 13 3HB ALA 13 3.281 -9.874 1.883
86 H ALA 14 H ALA 14 -0.431 -7.857 2.332
87 HA ALA 14 HA ALA 14 -1.208 -6.550 4.024
88 1HB ALA 14 1HB ALA 14 -0.459 -8.863 5.809
89 2HB ALA 14 2HB ALA 14 -1.975 -8.720 4.919
90 3HB ALA 14 3HB ALA 14 -1.584 -7.558 6.186
91 H ASN 15 H ASN 15 1.067 -5.611 3.274
92 HA ASN 15 HA ASN 15 2.475 -4.953 5.765
93 1HB ASN 15 2HB ASN 15 3.627 -6.650 3.997
94 2HB ASN 15 1HB ASN 15 4.159 -5.109 3.330
95 1HD2 ASN 15 1HD2 ASN 15 4.969 -3.552 5.087
96 2HD2 ASN 15 2HD2 ASN 15 6.060 -4.237 6.238
97 H VAL 16 H VAL 16 1.668 -3.006 5.967
98 HA VAL 16 HA VAL 16 0.987 -1.102 4.153
99 HB VAL 16 HB VAL 16 2.003 -1.059 6.938
100 1HG1 VAL 16 1HG1 VAL 16 1.751 1.425 5.240
101 2HG1 VAL 16 2HG1 VAL 16 3.158 0.879 6.152
102 3HG1 VAL 16 3HG1 VAL 16 1.721 1.446 7.004
103 1HG2 VAL 16 1HG2 VAL 16 -0.171 0.077 7.311
104 2HG2 VAL 16 2HG2 VAL 16 -0.322 -1.507 6.548
105 3HG2 VAL 16 3HG2 VAL 16 -0.489 -0.042 5.580
106 H ALA 17 H ALA 17 4.238 -1.667 5.481
107 HA ALA 17 HA ALA 17 5.566 0.475 4.321
108 1HB ALA 17 1HB ALA 17 7.026 -2.096 4.393
109 2HB ALA 17 2HB ALA 17 6.338 -1.534 5.916
110 3HB ALA 17 3HB ALA 17 7.476 -0.516 5.034
111 H ALA 18 H ALA 18 5.099 -2.800 3.006
112 HA ALA 18 HA ALA 18 6.405 -2.367 0.560
113 1HB ALA 18 1HB ALA 18 5.800 -4.592 1.456
114 2HB ALA 18 2HB ALA 18 5.291 -4.362 -0.216
115 3HB ALA 18 3HB ALA 18 4.109 -4.251 1.088
116 H HIS 19 H HIS 19 3.323 -1.349 1.717
117 HA HIS 19 HA HIS 19 2.291 -0.808 -0.938
118 1HB HIS 19 2HB HIS 19 0.485 -1.433 0.304
119 2HB HIS 19 1HB HIS 19 1.181 -0.844 1.809
120 HD2 HIS 19 2HD HIS 19 0.252 1.513 2.675
121 HE1 HIS 19 1HE HIS 19 -1.705 2.664 -0.888
122 HE2 HIS 19 2HE HIS 19 -1.137 3.346 1.481
123 H MET 20 H MET 20 2.700 1.197 2.001
124 HA MET 20 HA MET 20 2.365 3.665 0.841
125 1HB MET 20 2HB MET 20 2.750 3.013 3.314
126 2HB MET 20 1HB MET 20 4.456 3.244 2.958
127 1HG MET 20 2HG MET 20 4.006 5.329 3.668
128 2HG MET 20 1HG MET 20 3.518 5.541 1.989
129 1HE MET 20 1HE MET 20 1.790 5.688 5.816
130 2HE MET 20 2HE MET 20 1.396 7.224 5.046
131 3HE MET 20 3HE MET 20 3.049 6.611 4.998
132 H THR 21 H THR 21 5.074 1.539 0.487
133 HA THR 21 HA THR 21 7.145 3.263 -0.108
134 HB THR 21 HB THR 21 7.356 0.808 0.075
135 HG1 THR 21 1HG THR 21 8.326 2.001 -2.302
136 1HG2 THR 21 1HG2 THR 21 6.652 0.429 -2.769
137 2HG2 THR 21 2HG2 THR 21 5.330 0.510 -1.606
138 3HG2 THR 21 3HG2 THR 21 6.596 -0.705 -1.421
139 H HIS 22 H HIS 22 4.292 2.631 -1.976
140 HA HIS 22 HA HIS 22 5.382 4.328 -4.131
141 1HB HIS 22 2HB HIS 22 3.640 3.010 -5.577
142 2HB HIS 22 1HB HIS 22 5.221 2.308 -5.255
143 HD1 HIS 22 1HD HIS 22 5.040 -0.075 -4.752
144 HD2 HIS 22 2HD HIS 22 1.738 2.014 -3.296
145 HE1 HIS 22 1HE HIS 22 3.584 -1.794 -3.645
146 HE2 HIS 22 2HE HIS 22 1.720 -0.471 -2.603
147 H CYS 23 H CYS 23 2.627 3.340 -2.244
148 HA CYS 23 HA CYS 23 0.850 5.261 -3.439
149 1HB CYS 23 2HB CYS 23 0.695 3.142 -1.351
150 2HB CYS 23 1HB CYS 23 -0.542 4.383 -1.376
151 H ALA 24 H ALA 24 1.898 7.245 -2.988
152 HA ALA 24 HA ALA 24 1.292 8.289 -0.352
153 1HB ALA 24 1HB ALA 24 3.696 9.324 -0.349
154 2HB ALA 24 2HB ALA 24 4.080 7.919 -1.345
155 3HB ALA 24 3HB ALA 24 3.422 7.698 0.276
156 H LYS 25 H LYS 25 0.231 8.780 -2.945
157 HA LYS 25 HA LYS 25 0.961 11.614 -3.245
158 1HB LYS 25 2HB LYS 25 1.854 10.186 -5.114
159 2HB LYS 25 1HB LYS 25 0.190 9.802 -5.535
160 1HG LYS 25 2HG LYS 25 -0.166 12.315 -5.738
161 2HG LYS 25 1HG LYS 25 1.594 12.446 -5.701
162 1HD LYS 25 2HD LYS 25 1.407 12.222 -7.936
163 2HD LYS 25 1HD LYS 25 1.273 10.504 -7.558
164 1HE LYS 25 2HE LYS 25 -1.199 12.159 -7.525
165 2HE LYS 25 1HE LYS 25 -0.499 11.734 -9.086
166 1HZ LYS 25 1HZ LYS 25 -1.425 9.875 -6.969
167 2HZ LYS 25 2HZ LYS 25 -0.544 9.379 -8.325
168 3HZ LYS 25 3HZ LYS 25 -2.073 10.073 -8.520
Start of MODEL 5
1 1H ALA 1 1HT ALA 1 -2.954 5.136 3.213
2 2H ALA 1 2HT ALA 1 -1.304 4.943 2.780
3 3H ALA 1 3HT ALA 1 -1.723 5.698 4.264
4 HA ALA 1 HA ALA 1 -0.933 3.375 4.405
5 1HB ALA 1 1HB ALA 1 -3.392 4.529 5.575
6 2HB ALA 1 2HB ALA 1 -1.911 3.973 6.358
7 3HB ALA 1 3HB ALA 1 -3.121 2.804 5.828
8 H VAL 2 H VAL 2 -1.523 1.162 4.239
9 HA VAL 2 HA VAL 2 -2.603 0.412 1.769
10 HB VAL 2 HB VAL 2 -1.039 -1.003 3.034
11 1HG1 VAL 2 1HG1 VAL 2 -2.381 -0.513 5.231
12 2HG1 VAL 2 2HG1 VAL 2 -1.511 -2.034 5.030
13 3HG1 VAL 2 3HG1 VAL 2 -3.255 -1.974 4.775
14 1HG2 VAL 2 1HG2 VAL 2 -2.604 -1.914 1.277
15 2HG2 VAL 2 2HG2 VAL 2 -3.615 -2.499 2.599
16 3HG2 VAL 2 3HG2 VAL 2 -1.966 -3.097 2.419
17 H SER 3 H SER 3 -4.090 0.843 4.898
18 HA SER 3 HA SER 3 -6.469 -0.583 4.468
19 1HB SER 3 2HB SER 3 -5.575 1.555 6.326
20 2HB SER 3 1HB SER 3 -7.316 1.350 6.134
21 HG SER 3 HG SER 3 -5.578 -0.817 6.672
22 H ALA 4 H ALA 4 -5.454 2.621 3.498
23 HA ALA 4 HA ALA 4 -8.073 3.029 2.210
24 1HB ALA 4 1HB ALA 4 -7.937 4.850 3.582
25 2HB ALA 4 2HB ALA 4 -7.132 5.493 2.151
26 3HB ALA 4 3HB ALA 4 -6.176 4.909 3.513
27 H CYS 5 H CYS 5 -5.758 1.510 1.173
28 HA CYS 5 HA CYS 5 -4.483 3.075 -0.839
29 1HB CYS 5 2HB CYS 5 -3.371 1.103 -0.053
30 2HB CYS 5 1HB CYS 5 -4.751 0.091 -0.450
31 H ALA 6 H ALA 6 -4.860 3.142 -3.046
32 HA ALA 6 HA ALA 6 -7.582 2.371 -3.852
33 1HB ALA 6 1HB ALA 6 -7.408 4.122 -5.558
34 2HB ALA 6 2HB ALA 6 -5.781 4.504 -4.995
35 3HB ALA 6 3HB ALA 6 -7.166 4.767 -3.935
36 H LEU 7 H LEU 7 -4.224 1.896 -4.485
37 HA LEU 7 HA LEU 7 -4.346 1.030 -7.157
38 1HB LEU 7 2HB LEU 7 -2.438 0.672 -4.900
39 2HB LEU 7 1HB LEU 7 -2.264 -0.372 -6.297
40 HG LEU 7 HG LEU 7 -2.299 2.637 -6.478
41 1HD1 LEU 7 1HD1 LEU 7 0.248 1.273 -6.908
42 2HD1 LEU 7 2HD1 LEU 7 -0.334 1.188 -5.244
43 3HD1 LEU 7 3HD1 LEU 7 -0.114 2.755 -6.024
44 1HD2 LEU 7 1HD2 LEU 7 -1.586 2.360 -8.694
45 2HD2 LEU 7 2HD2 LEU 7 -2.870 1.169 -8.487
46 3HD2 LEU 7 3HD2 LEU 7 -1.181 0.661 -8.444
47 HA PRO 8 HA PRO 8 -6.340 -2.905 -6.601
48 1HB PRO 8 2HB PRO 8 -6.001 -3.908 -9.065
49 2HB PRO 8 1HB PRO 8 -7.079 -2.540 -8.764
50 1HG PRO 8 2HG PRO 8 -4.290 -2.549 -9.845
51 2HG PRO 8 1HG PRO 8 -5.693 -1.606 -10.378
52 1HD PRO 8 2HD PRO 8 -3.712 -0.624 -8.751
53 2HD PRO 8 1HD PRO 8 -5.375 -0.005 -8.773
54 H LYS 9 H LYS 9 -5.680 -4.796 -5.773
55 HA LYS 9 HA LYS 9 -4.334 -6.507 -5.111
56 1HB LYS 9 2HB LYS 9 -3.623 -6.109 -7.978
57 2HB LYS 9 1HB LYS 9 -2.598 -7.167 -7.017
58 1HG LYS 9 2HG LYS 9 -5.508 -7.619 -6.813
59 2HG LYS 9 1HG LYS 9 -4.747 -8.020 -8.354
60 1HD LYS 9 2HD LYS 9 -4.344 -9.996 -7.345
61 2HD LYS 9 1HD LYS 9 -2.983 -9.126 -6.633
62 1HE LYS 9 2HE LYS 9 -5.546 -8.856 -5.211
63 2HE LYS 9 1HE LYS 9 -4.847 -10.475 -5.207
64 1HZ LYS 9 1HZ LYS 9 -3.914 -8.050 -3.910
65 2HZ LYS 9 2HZ LYS 9 -2.710 -9.014 -4.604
66 3HZ LYS 9 3HZ LYS 9 -3.747 -9.666 -3.438
67 H CYS 10 H CYS 10 -3.525 -3.772 -4.520
68 HA CYS 10 HA CYS 10 -0.733 -3.452 -4.824
69 1HB CYS 10 2HB CYS 10 -2.683 -1.795 -4.056
70 2HB CYS 10 1HB CYS 10 -2.099 -2.262 -2.463
71 H ALA 11 H ALA 11 -2.683 -4.553 -2.055
72 HA ALA 11 HA ALA 11 -0.583 -5.075 -0.299
73 1HB ALA 11 1HB ALA 11 -3.186 -6.589 -0.464
74 2HB ALA 11 2HB ALA 11 -2.984 -5.019 0.315
75 3HB ALA 11 3HB ALA 11 -2.135 -6.431 0.943
76 H ALA 12 H ALA 12 1.071 -6.417 -0.499
77 HA ALA 12 HA ALA 12 0.877 -8.704 -2.304
78 1HB ALA 12 1HB ALA 12 3.391 -7.995 -0.870
79 2HB ALA 12 2HB ALA 12 2.820 -6.947 -2.168
80 3HB ALA 12 3HB ALA 12 3.163 -8.646 -2.494
81 H ALA 13 H ALA 13 1.127 -7.953 1.085
82 HA ALA 13 HA ALA 13 0.382 -10.565 1.864
83 1HB ALA 13 1HB ALA 13 2.590 -10.875 3.238
84 2HB ALA 13 2HB ALA 13 3.279 -9.873 1.961
85 3HB ALA 13 3HB ALA 13 2.498 -11.403 1.557
86 H ALA 14 H ALA 14 -0.425 -7.857 2.339
87 HA ALA 14 HA ALA 14 -1.207 -6.556 4.033
88 1HB ALA 14 1HB ALA 14 -0.437 -8.782 5.907
89 2HB ALA 14 2HB ALA 14 -1.888 -8.818 4.906
90 3HB ALA 14 3HB ALA 14 -1.690 -7.561 6.127
91 H ASN 15 H ASN 15 1.069 -5.619 3.283
92 HA ASN 15 HA ASN 15 2.476 -4.958 5.774
93 1HB ASN 15 2HB ASN 15 3.710 -6.696 4.293
94 2HB ASN 15 1HB ASN 15 4.011 -5.340 3.211
95 1HD2 ASN 15 1HD2 ASN 15 5.100 -7.030 5.874
96 2HD2 ASN 15 2HD2 ASN 15 6.275 -5.899 6.443
97 H VAL 16 H VAL 16 1.675 -3.010 5.969
98 HA VAL 16 HA VAL 16 0.996 -1.109 4.150
99 HB VAL 16 HB VAL 16 2.017 -1.059 6.935
100 1HG1 VAL 16 1HG1 VAL 16 3.144 0.888 6.387
101 2HG1 VAL 16 2HG1 VAL 16 1.559 1.517 6.839
102 3HG1 VAL 16 3HG1 VAL 16 1.983 1.335 5.137
103 1HG2 VAL 16 1HG2 VAL 16 -0.312 -1.502 6.539
104 2HG2 VAL 16 2HG2 VAL 16 -0.473 -0.031 5.580
105 3HG2 VAL 16 3HG2 VAL 16 -0.152 0.075 7.310
106 H ALA 17 H ALA 17 4.249 -1.683 5.473
107 HA ALA 17 HA ALA 17 5.585 0.453 4.311
108 1HB ALA 17 1HB ALA 17 6.986 -2.164 4.413
109 2HB ALA 17 2HB ALA 17 6.371 -1.496 5.925
110 3HB ALA 17 3HB ALA 17 7.518 -0.573 4.955
111 H ALA 18 H ALA 18 5.103 -2.818 2.992
112 HA ALA 18 HA ALA 18 6.403 -2.384 0.543
113 1HB ALA 18 1HB ALA 18 4.070 -4.219 0.621
114 2HB ALA 18 2HB ALA 18 5.423 -4.562 1.699
115 3HB ALA 18 3HB ALA 18 5.685 -4.467 -0.042
116 H HIS 19 H HIS 19 3.326 -1.361 1.711
117 HA HIS 19 HA HIS 19 2.290 -0.811 -0.942
118 1HB HIS 19 2HB HIS 19 0.485 -1.437 0.302
119 2HB HIS 19 1HB HIS 19 1.185 -0.853 1.807
120 HD2 HIS 19 2HD HIS 19 0.257 1.501 2.681
121 HE1 HIS 19 1HE HIS 19 -1.698 2.668 -0.879
122 HE2 HIS 19 2HE HIS 19 -1.129 3.340 1.494
123 H MET 20 H MET 20 2.711 1.183 2.003
124 HA MET 20 HA MET 20 2.376 3.656 0.852
125 1HB MET 20 2HB MET 20 2.907 2.858 3.337
126 2HB MET 20 1HB MET 20 4.520 3.405 2.903
127 1HG MET 20 2HG MET 20 3.241 5.547 2.105
128 2HG MET 20 1HG MET 20 2.011 4.966 3.226
129 1HE MET 20 1HE MET 20 2.939 7.401 5.595
130 2HE MET 20 2HE MET 20 2.233 7.221 3.989
131 3HE MET 20 3HE MET 20 3.794 8.020 4.182
132 H THR 21 H THR 21 5.081 1.525 0.486
133 HA THR 21 HA THR 21 7.155 3.244 -0.107
134 HB THR 21 HB THR 21 7.361 0.789 0.066
135 HG1 THR 21 1HG THR 21 9.104 1.665 -0.875
136 1HG2 THR 21 1HG2 THR 21 6.634 0.433 -2.779
137 2HG2 THR 21 2HG2 THR 21 5.326 0.495 -1.597
138 3HG2 THR 21 3HG2 THR 21 6.598 -0.716 -1.441
139 H HIS 22 H HIS 22 4.299 2.628 -1.973
140 HA HIS 22 HA HIS 22 5.388 4.335 -4.120
141 1HB HIS 22 2HB HIS 22 3.641 3.027 -5.570
142 2HB HIS 22 1HB HIS 22 5.222 2.323 -5.256
143 HD1 HIS 22 1HD HIS 22 5.040 -0.064 -4.766
144 HD2 HIS 22 2HD HIS 22 1.744 2.019 -3.289
145 HE1 HIS 22 1HE HIS 22 3.586 -1.789 -3.665
146 HE2 HIS 22 2HE HIS 22 1.727 -0.469 -2.610
147 H CYS 23 H CYS 23 2.634 3.341 -2.235
148 HA CYS 23 HA CYS 23 0.858 5.271 -3.416
149 1HB CYS 23 2HB CYS 23 0.704 3.142 -1.340
150 2HB CYS 23 1HB CYS 23 -0.533 4.384 -1.359
151 H ALA 24 H ALA 24 2.794 6.832 -2.660
152 HA ALA 24 HA ALA 24 2.041 7.923 -0.028
153 1HB ALA 24 1HB ALA 24 4.369 9.115 -0.387
154 2HB ALA 24 2HB ALA 24 4.652 7.726 -1.435
155 3HB ALA 24 3HB ALA 24 4.262 7.481 0.268
156 H LYS 25 H LYS 25 0.565 8.476 -2.399
157 HA LYS 25 HA LYS 25 1.375 11.092 -3.332
158 1HB LYS 25 2HB LYS 25 -0.783 9.153 -3.999
159 2HB LYS 25 1HB LYS 25 -1.073 10.848 -4.364
160 1HG LYS 25 2HG LYS 25 0.776 10.946 -5.833
161 2HG LYS 25 1HG LYS 25 1.385 9.385 -5.280
162 1HD LYS 25 2HD LYS 25 -0.033 8.222 -6.595
163 2HD LYS 25 1HD LYS 25 -1.357 9.363 -6.351
164 1HE LYS 25 2HE LYS 25 -0.572 10.804 -8.023
165 2HE LYS 25 1HE LYS 25 1.028 10.064 -8.031
166 1HZ LYS 25 1HZ LYS 25 -1.195 8.319 -8.712
167 2HZ LYS 25 2HZ LYS 25 0.354 8.411 -9.384
168 3HZ LYS 25 3HZ LYS 25 -0.833 9.527 -9.839
Start of MODEL 6
1 1H ALA 1 1HT ALA 1 -1.985 5.090 3.133
2 2H ALA 1 2HT ALA 1 -0.482 4.363 3.528
3 3H ALA 1 3HT ALA 1 -1.177 5.529 4.579
4 HA ALA 1 HA ALA 1 -1.367 3.168 5.257
5 1HB ALA 1 1HB ALA 1 -3.509 5.202 5.102
6 2HB ALA 1 2HB ALA 1 -2.749 4.456 6.509
7 3HB ALA 1 3HB ALA 1 -3.982 3.578 5.603
8 H VAL 2 H VAL 2 -1.551 1.216 4.402
9 HA VAL 2 HA VAL 2 -2.535 0.665 1.844
10 HB VAL 2 HB VAL 2 -0.974 -0.817 3.035
11 1HG1 VAL 2 1HG1 VAL 2 -3.318 -1.804 4.639
12 2HG1 VAL 2 2HG1 VAL 2 -2.184 -0.598 5.247
13 3HG1 VAL 2 3HG1 VAL 2 -1.612 -2.213 4.828
14 1HG2 VAL 2 1HG2 VAL 2 -1.766 -2.831 2.135
15 2HG2 VAL 2 2HG2 VAL 2 -2.526 -1.579 1.154
16 3HG2 VAL 2 3HG2 VAL 2 -3.451 -2.395 2.414
17 H SER 3 H SER 3 -4.144 0.804 4.934
18 HA SER 3 HA SER 3 -6.452 -0.664 4.350
19 1HB SER 3 2HB SER 3 -5.597 0.482 6.576
20 2HB SER 3 1HB SER 3 -6.648 1.794 6.041
21 HG SER 3 HG SER 3 -8.382 0.385 6.065
22 H ALA 4 H ALA 4 -5.510 2.588 3.492
23 HA ALA 4 HA ALA 4 -8.116 2.975 2.172
24 1HB ALA 4 1HB ALA 4 -6.188 4.897 3.405
25 2HB ALA 4 2HB ALA 4 -7.931 4.757 3.631
26 3HB ALA 4 3HB ALA 4 -7.288 5.437 2.136
27 H CYS 5 H CYS 5 -5.755 1.486 1.153
28 HA CYS 5 HA CYS 5 -4.490 3.060 -0.850
29 1HB CYS 5 2HB CYS 5 -3.375 1.085 -0.079
30 2HB CYS 5 1HB CYS 5 -4.755 0.074 -0.477
31 H ALA 6 H ALA 6 -4.842 3.114 -3.068
32 HA ALA 6 HA ALA 6 -7.567 2.365 -3.890
33 1HB ALA 6 1HB ALA 6 -7.651 4.212 -5.275
34 2HB ALA 6 2HB ALA 6 -5.896 4.339 -5.388
35 3HB ALA 6 3HB ALA 6 -6.722 4.821 -3.906
36 H LEU 7 H LEU 7 -4.205 1.891 -4.515
37 HA LEU 7 HA LEU 7 -4.320 1.027 -7.187
38 1HB LEU 7 2HB LEU 7 -2.419 0.664 -4.925
39 2HB LEU 7 1HB LEU 7 -2.243 -0.382 -6.320
40 HG LEU 7 HG LEU 7 -2.269 2.627 -6.502
41 1HD1 LEU 7 1HD1 LEU 7 0.272 1.250 -6.930
42 2HD1 LEU 7 2HD1 LEU 7 -0.311 1.172 -5.267
43 3HD1 LEU 7 3HD1 LEU 7 -0.082 2.736 -6.049
44 1HD2 LEU 7 1HD2 LEU 7 -2.846 1.169 -8.513
45 2HD2 LEU 7 2HD2 LEU 7 -1.163 0.646 -8.469
46 3HD2 LEU 7 3HD2 LEU 7 -1.551 2.349 -8.717
47 HA PRO 8 HA PRO 8 -6.317 -2.907 -6.648
48 1HB PRO 8 2HB PRO 8 -5.966 -3.908 -9.111
49 2HB PRO 8 1HB PRO 8 -7.044 -2.539 -8.814
50 1HG PRO 8 2HG PRO 8 -4.247 -2.552 -9.879
51 2HG PRO 8 1HG PRO 8 -5.646 -1.606 -10.419
52 1HD PRO 8 2HD PRO 8 -3.671 -0.632 -8.778
53 2HD PRO 8 1HD PRO 8 -5.331 -0.006 -8.812
54 H LYS 9 H LYS 9 -5.664 -4.800 -5.818
55 HA LYS 9 HA LYS 9 -4.325 -6.515 -5.153
56 1HB LYS 9 2HB LYS 9 -3.522 -6.099 -8.004
57 2HB LYS 9 1HB LYS 9 -2.605 -7.228 -7.015
58 1HG LYS 9 2HG LYS 9 -5.536 -7.524 -6.932
59 2HG LYS 9 1HG LYS 9 -4.752 -7.917 -8.464
60 1HD LYS 9 2HD LYS 9 -4.469 -9.942 -7.520
61 2HD LYS 9 1HD LYS 9 -3.104 -9.165 -6.716
62 1HE LYS 9 2HE LYS 9 -5.718 -8.832 -5.400
63 2HE LYS 9 1HE LYS 9 -5.083 -10.477 -5.424
64 1HZ LYS 9 1HZ LYS 9 -4.114 -8.138 -4.002
65 2HZ LYS 9 2HZ LYS 9 -2.920 -9.131 -4.671
66 3HZ LYS 9 3HZ LYS 9 -4.039 -9.774 -3.577
67 H CYS 10 H CYS 10 -3.519 -3.785 -4.544
68 HA CYS 10 HA CYS 10 -0.724 -3.467 -4.826
69 1HB CYS 10 2HB CYS 10 -2.685 -1.813 -4.065
70 2HB CYS 10 1HB CYS 10 -2.096 -2.276 -2.473
71 H ALA 11 H ALA 11 -2.702 -4.572 -2.079
72 HA ALA 11 HA ALA 11 -0.621 -5.098 -0.303
73 1HB ALA 11 1HB ALA 11 -2.185 -6.457 0.921
74 2HB ALA 11 2HB ALA 11 -3.225 -6.604 -0.496
75 3HB ALA 11 3HB ALA 11 -3.024 -5.038 0.292
76 H ALA 12 H ALA 12 1.038 -6.435 -0.500
77 HA ALA 12 HA ALA 12 0.844 -8.733 -2.293
78 1HB ALA 12 1HB ALA 12 3.399 -8.800 -1.553
79 2HB ALA 12 2HB ALA 12 3.064 -7.106 -1.196
80 3HB ALA 12 3HB ALA 12 2.811 -7.729 -2.826
81 H ALA 13 H ALA 13 1.114 -7.952 1.087
82 HA ALA 13 HA ALA 13 0.390 -10.563 1.891
83 1HB ALA 13 1HB ALA 13 2.373 -11.361 2.908
84 2HB ALA 13 2HB ALA 13 3.213 -9.835 2.632
85 3HB ALA 13 3HB ALA 13 2.815 -10.882 1.269
86 H ALA 14 H ALA 14 -0.437 -7.858 2.347
87 HA ALA 14 HA ALA 14 -1.213 -6.541 4.031
88 1HB ALA 14 1HB ALA 14 -1.940 -7.584 5.928
89 2HB ALA 14 2HB ALA 14 -0.453 -8.513 6.121
90 3HB ALA 14 3HB ALA 14 -1.644 -8.996 4.914
91 H ASN 15 H ASN 15 1.063 -5.606 3.279
92 HA ASN 15 HA ASN 15 2.471 -4.939 5.768
93 1HB ASN 15 2HB ASN 15 3.628 -6.648 4.030
94 2HB ASN 15 1HB ASN 15 4.142 -5.120 3.321
95 1HD2 ASN 15 1HD2 ASN 15 6.247 -5.127 3.845
96 2HD2 ASN 15 2HD2 ASN 15 6.855 -5.155 5.463
97 H VAL 16 H VAL 16 1.665 -2.990 5.962
98 HA VAL 16 HA VAL 16 0.982 -1.093 4.143
99 HB VAL 16 HB VAL 16 2.005 -1.040 6.925
100 1HG1 VAL 16 1HG1 VAL 16 1.920 1.371 5.140
101 2HG1 VAL 16 2HG1 VAL 16 3.139 0.905 6.327
102 3HG1 VAL 16 3HG1 VAL 16 1.576 1.523 6.863
103 1HG2 VAL 16 1HG2 VAL 16 -0.450 0.251 5.763
104 2HG2 VAL 16 2HG2 VAL 16 -0.146 -0.211 7.438
105 3HG2 VAL 16 3HG2 VAL 16 -0.384 -1.454 6.209
106 H ALA 17 H ALA 17 4.236 -1.652 5.469
107 HA ALA 17 HA ALA 17 5.564 0.483 4.299
108 1HB ALA 17 1HB ALA 17 6.876 -2.200 4.506
109 2HB ALA 17 2HB ALA 17 6.407 -1.317 5.960
110 3HB ALA 17 3HB ALA 17 7.548 -0.600 4.820
111 H ALA 18 H ALA 18 5.088 -2.794 2.994
112 HA ALA 18 HA ALA 18 6.391 -2.370 0.545
113 1HB ALA 18 1HB ALA 18 4.066 -4.235 0.972
114 2HB ALA 18 2HB ALA 18 5.703 -4.583 1.529
115 3HB ALA 18 3HB ALA 18 5.380 -4.388 -0.195
116 H HIS 19 H HIS 19 3.311 -1.347 1.704
117 HA HIS 19 HA HIS 19 2.278 -0.809 -0.952
118 1HB HIS 19 2HB HIS 19 0.472 -1.431 0.294
119 2HB HIS 19 1HB HIS 19 1.170 -0.837 1.796
120 HD2 HIS 19 2HD HIS 19 0.237 1.520 2.656
121 HE1 HIS 19 1HE HIS 19 -1.710 2.666 -0.914
122 HE2 HIS 19 2HE HIS 19 -1.431 3.170 1.558
123 H MET 20 H MET 20 2.695 1.200 1.983
124 HA MET 20 HA MET 20 2.360 3.665 0.817
125 1HB MET 20 2HB MET 20 2.910 2.863 3.310
126 2HB MET 20 1HB MET 20 4.503 3.458 2.865
127 1HG MET 20 2HG MET 20 3.716 5.640 2.531
128 2HG MET 20 1HG MET 20 2.033 5.116 2.500
129 1HE MET 20 1HE MET 20 1.565 7.188 5.292
130 2HE MET 20 2HE MET 20 2.307 7.354 3.701
131 3HE MET 20 3HE MET 20 3.278 7.584 5.155
132 H THR 21 H THR 21 5.065 1.535 0.466
133 HA THR 21 HA THR 21 7.140 3.253 -0.129
134 HB THR 21 HB THR 21 7.347 0.798 0.055
135 HG1 THR 21 1HG THR 21 8.313 1.962 -2.339
136 1HG2 THR 21 1HG2 THR 21 6.588 0.469 -2.795
137 2HG2 THR 21 2HG2 THR 21 5.318 0.458 -1.571
138 3HG2 THR 21 3HG2 THR 21 6.633 -0.715 -1.488
139 H HIS 22 H HIS 22 4.288 2.628 -1.997
140 HA HIS 22 HA HIS 22 5.381 4.323 -4.151
141 1HB HIS 22 2HB HIS 22 3.636 3.008 -5.596
142 2HB HIS 22 1HB HIS 22 5.217 2.307 -5.278
143 HD1 HIS 22 1HD HIS 22 5.040 -0.077 -4.772
144 HD2 HIS 22 2HD HIS 22 1.735 2.007 -3.317
145 HE1 HIS 22 1HE HIS 22 3.587 -1.798 -3.665
146 HE2 HIS 22 2HE HIS 22 1.721 -0.478 -2.624
147 H CYS 23 H CYS 23 2.622 3.336 -2.269
148 HA CYS 23 HA CYS 23 0.849 5.260 -3.462
149 1HB CYS 23 2HB CYS 23 0.691 3.144 -1.372
150 2HB CYS 23 1HB CYS 23 -0.546 4.384 -1.400
151 H ALA 24 H ALA 24 1.686 7.293 -3.025
152 HA ALA 24 HA ALA 24 1.113 8.343 -0.419
153 1HB ALA 24 1HB ALA 24 3.908 8.942 -1.140
154 2HB ALA 24 2HB ALA 24 3.590 7.305 -0.567
155 3HB ALA 24 3HB ALA 24 3.170 8.689 0.442
156 H LYS 25 H LYS 25 0.266 8.797 -3.139
157 HA LYS 25 HA LYS 25 1.291 11.506 -3.642
158 1HB LYS 25 2HB LYS 25 1.114 9.501 -5.415
159 2HB LYS 25 1HB LYS 25 -0.497 10.178 -5.606
160 1HG LYS 25 2HG LYS 25 0.366 12.280 -6.273
161 2HG LYS 25 1HG LYS 25 2.004 11.833 -5.794
162 1HD LYS 25 2HD LYS 25 2.233 11.391 -7.997
163 2HD LYS 25 1HD LYS 25 1.471 9.862 -7.553
164 1HE LYS 25 2HE LYS 25 0.147 12.303 -8.722
165 2HE LYS 25 1HE LYS 25 0.348 10.725 -9.482
166 1HZ LYS 25 1HZ LYS 25 -1.100 9.784 -7.765
167 2HZ LYS 25 2HZ LYS 25 -1.889 10.980 -8.662
168 3HZ LYS 25 3HZ LYS 25 -1.328 11.325 -7.104
Start of MODEL 7
1 1H ALA 1 1HT ALA 1 -1.795 4.929 2.884
2 2H ALA 1 2HT ALA 1 -1.902 5.372 4.539
3 3H ALA 1 3HT ALA 1 -3.281 4.761 3.720
4 HA ALA 1 HA ALA 1 -0.807 3.222 4.029
5 1HB ALA 1 1HB ALA 1 -1.257 3.361 6.243
6 2HB ALA 1 2HB ALA 1 -2.414 2.093 5.840
7 3HB ALA 1 3HB ALA 1 -2.954 3.766 5.988
8 H VAL 2 H VAL 2 -1.576 0.829 4.203
9 HA VAL 2 HA VAL 2 -2.733 0.118 1.761
10 HB VAL 2 HB VAL 2 -1.260 -1.382 3.035
11 1HG1 VAL 2 1HG1 VAL 2 -3.622 -1.725 4.880
12 2HG1 VAL 2 2HG1 VAL 2 -2.105 -0.915 5.276
13 3HG1 VAL 2 3HG1 VAL 2 -2.119 -2.647 4.941
14 1HG2 VAL 2 1HG2 VAL 2 -2.319 -3.411 2.446
15 2HG2 VAL 2 2HG2 VAL 2 -2.920 -2.203 1.310
16 3HG2 VAL 2 3HG2 VAL 2 -3.928 -2.720 2.661
17 H SER 3 H SER 3 -4.168 0.711 4.885
18 HA SER 3 HA SER 3 -6.647 -0.557 4.467
19 1HB SER 3 2HB SER 3 -5.961 0.120 6.695
20 2HB SER 3 1HB SER 3 -5.931 1.814 6.207
21 HG SER 3 HG SER 3 -8.266 0.219 6.066
22 H ALA 4 H ALA 4 -5.390 2.553 3.494
23 HA ALA 4 HA ALA 4 -7.978 3.162 2.219
24 1HB ALA 4 1HB ALA 4 -6.039 4.865 3.660
25 2HB ALA 4 2HB ALA 4 -7.796 4.982 3.552
26 3HB ALA 4 3HB ALA 4 -6.790 5.561 2.224
27 H CYS 5 H CYS 5 -5.762 1.526 1.167
28 HA CYS 5 HA CYS 5 -4.390 3.069 -0.809
29 1HB CYS 5 2HB CYS 5 -3.346 1.057 -0.039
30 2HB CYS 5 1HB CYS 5 -4.761 0.094 -0.434
31 H ALA 6 H ALA 6 -4.732 3.133 -3.031
32 HA ALA 6 HA ALA 6 -7.477 2.468 -3.863
33 1HB ALA 6 1HB ALA 6 -5.900 4.338 -5.509
34 2HB ALA 6 2HB ALA 6 -6.336 4.904 -3.897
35 3HB ALA 6 3HB ALA 6 -7.595 4.399 -5.024
36 H LEU 7 H LEU 7 -4.127 1.903 -4.474
37 HA LEU 7 HA LEU 7 -4.268 1.060 -7.159
38 1HB LEU 7 2HB LEU 7 -2.362 0.652 -4.905
39 2HB LEU 7 1HB LEU 7 -2.210 -0.382 -6.312
40 HG LEU 7 HG LEU 7 -2.187 2.630 -6.462
41 1HD1 LEU 7 1HD1 LEU 7 0.324 1.197 -6.912
42 2HD1 LEU 7 2HD1 LEU 7 -0.251 1.145 -5.246
43 3HD1 LEU 7 3HD1 LEU 7 0.010 2.698 -6.039
44 1HD2 LEU 7 1HD2 LEU 7 -2.794 1.175 -8.482
45 2HD2 LEU 7 2HD2 LEU 7 -1.103 0.674 -8.461
46 3HD2 LEU 7 3HD2 LEU 7 -1.517 2.374 -8.684
47 HA PRO 8 HA PRO 8 -6.316 -2.847 -6.621
48 1HB PRO 8 2HB PRO 8 -5.979 -3.854 -9.082
49 2HB PRO 8 1HB PRO 8 -7.034 -2.466 -8.789
50 1HG PRO 8 2HG PRO 8 -4.237 -2.530 -9.851
51 2HG PRO 8 1HG PRO 8 -5.617 -1.557 -10.391
52 1HD PRO 8 2HD PRO 8 -3.626 -0.622 -8.747
53 2HD PRO 8 1HD PRO 8 -5.273 0.037 -8.786
54 H LYS 9 H LYS 9 -5.700 -4.761 -5.804
55 HA LYS 9 HA LYS 9 -4.387 -6.495 -5.136
56 1HB LYS 9 2HB LYS 9 -3.325 -6.075 -7.928
57 2HB LYS 9 1HB LYS 9 -2.803 -7.402 -6.900
58 1HG LYS 9 2HG LYS 9 -5.717 -7.060 -7.266
59 2HG LYS 9 1HG LYS 9 -4.789 -7.623 -8.657
60 1HD LYS 9 2HD LYS 9 -5.478 -9.574 -7.528
61 2HD LYS 9 1HD LYS 9 -3.781 -9.354 -7.093
62 1HE LYS 9 2HE LYS 9 -5.741 -8.058 -5.314
63 2HE LYS 9 1HE LYS 9 -5.755 -9.821 -5.309
64 1HZ LYS 9 1HZ LYS 9 -4.143 -8.384 -3.780
65 2HZ LYS 9 2HZ LYS 9 -3.145 -8.546 -5.136
66 3HZ LYS 9 3HZ LYS 9 -3.731 -9.924 -4.350
67 H CYS 10 H CYS 10 -3.547 -3.770 -4.524
68 HA CYS 10 HA CYS 10 -0.744 -3.496 -4.784
69 1HB CYS 10 2HB CYS 10 -2.695 -1.816 -4.034
70 2HB CYS 10 1HB CYS 10 -2.106 -2.278 -2.442
71 H ALA 11 H ALA 11 -2.768 -4.594 -2.069
72 HA ALA 11 HA ALA 11 -0.723 -5.130 -0.256
73 1HB ALA 11 1HB ALA 11 -2.315 -6.512 0.922
74 2HB ALA 11 2HB ALA 11 -3.330 -6.625 -0.517
75 3HB ALA 11 3HB ALA 11 -3.131 -5.076 0.301
76 H ALA 12 H ALA 12 0.968 -6.419 -0.513
77 HA ALA 12 HA ALA 12 0.784 -8.739 -2.275
78 1HB ALA 12 1HB ALA 12 3.337 -8.122 -0.928
79 2HB ALA 12 2HB ALA 12 2.726 -6.900 -2.044
80 3HB ALA 12 3HB ALA 12 3.010 -8.546 -2.608
81 H ALA 13 H ALA 13 1.083 -7.929 1.099
82 HA ALA 13 HA ALA 13 0.378 -10.536 1.933
83 1HB ALA 13 1HB ALA 13 2.332 -11.449 2.726
84 2HB ALA 13 2HB ALA 13 3.144 -9.887 2.835
85 3HB ALA 13 3HB ALA 13 2.905 -10.647 1.262
86 H ALA 14 H ALA 14 -0.443 -7.827 2.383
87 HA ALA 14 HA ALA 14 -1.189 -6.496 4.071
88 1HB ALA 14 1HB ALA 14 -0.417 -8.436 6.177
89 2HB ALA 14 2HB ALA 14 -1.593 -8.960 4.972
90 3HB ALA 14 3HB ALA 14 -1.918 -7.536 5.959
91 H ASN 15 H ASN 15 1.081 -5.574 3.286
92 HA ASN 15 HA ASN 15 2.526 -4.907 5.754
93 1HB ASN 15 2HB ASN 15 3.678 -6.633 4.087
94 2HB ASN 15 1HB ASN 15 4.107 -5.155 3.231
95 1HD2 ASN 15 1HD2 ASN 15 6.293 -5.865 3.747
96 2HD2 ASN 15 2HD2 ASN 15 6.969 -5.438 5.279
97 H VAL 16 H VAL 16 1.721 -2.960 5.963
98 HA VAL 16 HA VAL 16 1.023 -1.060 4.147
99 HB VAL 16 HB VAL 16 2.051 -1.013 6.927
100 1HG1 VAL 16 1HG1 VAL 16 3.200 0.925 6.108
101 2HG1 VAL 16 2HG1 VAL 16 1.789 1.484 7.004
102 3HG1 VAL 16 3HG1 VAL 16 1.768 1.477 5.241
103 1HG2 VAL 16 1HG2 VAL 16 -0.103 -0.108 7.421
104 2HG2 VAL 16 2HG2 VAL 16 -0.323 -1.448 6.295
105 3HG2 VAL 16 3HG2 VAL 16 -0.419 0.215 5.717
106 H ALA 17 H ALA 17 4.279 -1.601 5.478
107 HA ALA 17 HA ALA 17 5.598 0.534 4.299
108 1HB ALA 17 1HB ALA 17 7.089 -2.011 4.370
109 2HB ALA 17 2HB ALA 17 6.371 -1.489 5.893
110 3HB ALA 17 3HB ALA 17 7.499 -0.434 5.044
111 H ALA 18 H ALA 18 5.144 -2.751 3.005
112 HA ALA 18 HA ALA 18 6.443 -2.328 0.555
113 1HB ALA 18 1HB ALA 18 5.581 -4.383 -0.119
114 2HB ALA 18 2HB ALA 18 4.114 -4.192 0.841
115 3HB ALA 18 3HB ALA 18 5.652 -4.527 1.637
116 H HIS 19 H HIS 19 3.360 -1.314 1.713
117 HA HIS 19 HA HIS 19 2.323 -0.794 -0.945
118 1HB HIS 19 2HB HIS 19 0.521 -1.423 0.301
119 2HB HIS 19 1HB HIS 19 1.216 -0.823 1.803
120 HD2 HIS 19 2HD HIS 19 0.283 1.536 2.656
121 HE1 HIS 19 1HE HIS 19 -1.702 2.652 -0.902
122 HE2 HIS 19 2HE HIS 19 -1.124 3.354 1.459
123 H MET 20 H MET 20 2.720 1.229 1.983
124 HA MET 20 HA MET 20 2.371 3.688 0.812
125 1HB MET 20 2HB MET 20 2.963 2.876 3.306
126 2HB MET 20 1HB MET 20 4.526 3.534 2.843
127 1HG MET 20 2HG MET 20 3.573 5.680 2.416
128 2HG MET 20 1HG MET 20 1.940 5.052 2.633
129 1HE MET 20 1HE MET 20 1.599 6.836 5.890
130 2HE MET 20 2HE MET 20 0.846 6.206 4.425
131 3HE MET 20 3HE MET 20 2.055 7.485 4.314
132 H THR 21 H THR 21 5.093 1.576 0.467
133 HA THR 21 HA THR 21 7.149 3.313 -0.149
134 HB THR 21 HB THR 21 7.386 0.864 0.066
135 HG1 THR 21 1HG THR 21 8.976 2.145 -1.047
136 1HG2 THR 21 1HG2 THR 21 5.358 0.534 -1.619
137 2HG2 THR 21 2HG2 THR 21 6.623 -0.675 -1.395
138 3HG2 THR 21 3HG2 THR 21 6.690 0.428 -2.769
139 H HIS 22 H HIS 22 4.297 2.637 -2.001
140 HA HIS 22 HA HIS 22 5.371 4.312 -4.181
141 1HB HIS 22 2HB HIS 22 3.639 2.967 -5.608
142 2HB HIS 22 1HB HIS 22 5.219 2.271 -5.272
143 HD1 HIS 22 1HD HIS 22 5.039 -0.105 -4.733
144 HD2 HIS 22 2HD HIS 22 1.730 2.003 -3.319
145 HE1 HIS 22 1HE HIS 22 3.581 -1.808 -3.605
146 HE2 HIS 22 2HE HIS 22 1.709 -0.472 -2.593
147 H CYS 23 H CYS 23 2.627 3.335 -2.273
148 HA CYS 23 HA CYS 23 0.839 5.234 -3.487
149 1HB CYS 23 2HB CYS 23 0.696 3.134 -1.382
150 2HB CYS 23 1HB CYS 23 -0.543 4.373 -1.407
151 H ALA 24 H ALA 24 -0.579 6.368 -1.571
152 HA ALA 24 HA ALA 24 -0.675 8.138 -0.144
153 1HB ALA 24 1HB ALA 24 0.329 7.846 1.867
154 2HB ALA 24 2HB ALA 24 1.902 7.488 1.156
155 3HB ALA 24 3HB ALA 24 0.651 6.246 1.199
156 H LYS 25 H LYS 25 -0.068 9.199 -2.321
157 HA LYS 25 HA LYS 25 2.554 10.477 -2.260
158 1HB LYS 25 2HB LYS 25 0.428 10.100 -4.308
159 2HB LYS 25 1HB LYS 25 1.455 11.520 -4.456
160 1HG LYS 25 2HG LYS 25 3.354 10.272 -4.846
161 2HG LYS 25 1HG LYS 25 2.691 8.829 -4.077
162 1HD LYS 25 2HD LYS 25 2.797 8.540 -6.491
163 2HD LYS 25 1HD LYS 25 1.120 8.567 -5.943
164 1HE LYS 25 2HE LYS 25 2.255 11.177 -6.701
165 2HE LYS 25 1HE LYS 25 2.065 10.020 -8.018
166 1HZ LYS 25 1HZ LYS 25 -0.289 9.732 -7.079
167 2HZ LYS 25 2HZ LYS 25 0.050 11.129 -7.969
168 3HZ LYS 25 3HZ LYS 25 -0.008 11.197 -6.280
Start of MODEL 8
1 1H ALA 1 1HT ALA 1 -1.042 4.746 2.927
2 2H ALA 1 2HT ALA 1 -1.567 5.479 4.388
3 3H ALA 1 3HT ALA 1 -2.715 4.972 3.218
4 HA ALA 1 HA ALA 1 -0.847 3.097 4.462
5 1HB ALA 1 1HB ALA 1 -1.812 3.709 6.417
6 2HB ALA 1 2HB ALA 1 -3.085 2.630 5.846
7 3HB ALA 1 3HB ALA 1 -3.244 4.374 5.631
8 H VAL 2 H VAL 2 -1.524 0.936 4.192
9 HA VAL 2 HA VAL 2 -2.645 0.323 1.707
10 HB VAL 2 HB VAL 2 -1.158 -1.210 2.924
11 1HG1 VAL 2 1HG1 VAL 2 -2.391 -0.735 5.147
12 2HG1 VAL 2 2HG1 VAL 2 -1.732 -2.346 4.862
13 3HG1 VAL 2 3HG1 VAL 2 -3.457 -2.047 4.646
14 1HG2 VAL 2 1HG2 VAL 2 -2.724 -2.001 1.136
15 2HG2 VAL 2 2HG2 VAL 2 -3.818 -2.529 2.415
16 3HG2 VAL 2 3HG2 VAL 2 -2.213 -3.247 2.274
17 H SER 3 H SER 3 -4.117 0.730 4.845
18 HA SER 3 HA SER 3 -6.558 -0.569 4.390
19 1HB SER 3 2HB SER 3 -5.833 0.192 6.617
20 2HB SER 3 1HB SER 3 -6.018 1.869 6.105
21 HG SER 3 HG SER 3 -8.261 1.369 5.736
22 H ALA 4 H ALA 4 -5.427 2.638 3.517
23 HA ALA 4 HA ALA 4 -8.015 3.158 2.207
24 1HB ALA 4 1HB ALA 4 -6.963 4.740 4.025
25 2HB ALA 4 2HB ALA 4 -7.792 5.401 2.617
26 3HB ALA 4 3HB ALA 4 -6.030 5.333 2.651
27 H CYS 5 H CYS 5 -5.761 1.551 1.157
28 HA CYS 5 HA CYS 5 -4.454 3.094 -0.861
29 1HB CYS 5 2HB CYS 5 -3.361 1.114 -0.057
30 2HB CYS 5 1HB CYS 5 -4.752 0.115 -0.450
31 H ALA 6 H ALA 6 -4.834 3.136 -3.070
32 HA ALA 6 HA ALA 6 -7.567 2.388 -3.860
33 1HB ALA 6 1HB ALA 6 -7.734 4.295 -5.057
34 2HB ALA 6 2HB ALA 6 -6.047 4.249 -5.567
35 3HB ALA 6 3HB ALA 6 -6.467 4.844 -3.961
36 H LEU 7 H LEU 7 -4.216 1.873 -4.496
37 HA LEU 7 HA LEU 7 -4.355 0.976 -7.159
38 1HB LEU 7 2HB LEU 7 -2.441 0.633 -4.904
39 2HB LEU 7 1HB LEU 7 -2.280 -0.430 -6.289
40 HG LEU 7 HG LEU 7 -2.304 2.575 -6.518
41 1HD1 LEU 7 1HD1 LEU 7 0.247 1.209 -6.907
42 2HD1 LEU 7 2HD1 LEU 7 -0.345 1.146 -5.247
43 3HD1 LEU 7 3HD1 LEU 7 -0.124 2.702 -6.045
44 1HD2 LEU 7 1HD2 LEU 7 -1.560 2.248 -8.723
45 2HD2 LEU 7 2HD2 LEU 7 -2.865 1.083 -8.503
46 3HD2 LEU 7 3HD2 LEU 7 -1.186 0.550 -8.435
47 HA PRO 8 HA PRO 8 -6.354 -2.946 -6.562
48 1HB PRO 8 2HB PRO 8 -5.990 -3.995 -9.001
49 2HB PRO 8 1HB PRO 8 -7.058 -2.610 -8.742
50 1HG PRO 8 2HG PRO 8 -4.253 -2.671 -9.781
51 2HG PRO 8 1HG PRO 8 -5.637 -1.723 -10.353
52 1HD PRO 8 2HD PRO 8 -3.668 -0.737 -8.711
53 2HD PRO 8 1HD PRO 8 -5.320 -0.093 -8.778
54 H LYS 9 H LYS 9 -5.716 -4.825 -5.690
55 HA LYS 9 HA LYS 9 -4.384 -6.524 -4.968
56 1HB LYS 9 2HB LYS 9 -3.611 -6.206 -7.837
57 2HB LYS 9 1HB LYS 9 -2.677 -7.299 -6.824
58 1HG LYS 9 2HG LYS 9 -5.149 -8.130 -6.209
59 2HG LYS 9 1HG LYS 9 -5.429 -7.548 -7.852
60 1HD LYS 9 2HD LYS 9 -4.217 -9.207 -8.781
61 2HD LYS 9 1HD LYS 9 -3.005 -9.176 -7.497
62 1HE LYS 9 2HE LYS 9 -5.763 -10.352 -7.191
63 2HE LYS 9 1HE LYS 9 -4.335 -11.289 -7.625
64 1HZ LYS 9 1HZ LYS 9 -4.155 -9.620 -5.239
65 2HZ LYS 9 2HZ LYS 9 -3.494 -11.147 -5.543
66 3HZ LYS 9 3HZ LYS 9 -5.128 -11.002 -5.136
67 H CYS 10 H CYS 10 -3.547 -3.785 -4.448
68 HA CYS 10 HA CYS 10 -0.756 -3.492 -4.760
69 1HB CYS 10 2HB CYS 10 -2.691 -1.809 -4.015
70 2HB CYS 10 1HB CYS 10 -2.107 -2.254 -2.416
71 H ALA 11 H ALA 11 -2.710 -4.566 -1.986
72 HA ALA 11 HA ALA 11 -0.620 -5.053 -0.210
73 1HB ALA 11 1HB ALA 11 -3.019 -5.005 0.395
74 2HB ALA 11 2HB ALA 11 -2.171 -6.415 1.033
75 3HB ALA 11 3HB ALA 11 -3.215 -6.579 -0.378
76 H ALA 12 H ALA 12 1.118 -6.233 -0.708
77 HA ALA 12 HA ALA 12 0.940 -8.566 -2.398
78 1HB ALA 12 1HB ALA 12 3.472 -8.651 -1.594
79 2HB ALA 12 2HB ALA 12 3.126 -6.969 -1.193
80 3HB ALA 12 3HB ALA 12 2.918 -7.541 -2.848
81 H ALA 13 H ALA 13 1.132 -7.869 1.008
82 HA ALA 13 HA ALA 13 0.372 -10.492 1.735
83 1HB ALA 13 1HB ALA 13 2.448 -11.064 3.024
84 2HB ALA 13 2HB ALA 13 3.263 -9.766 2.152
85 3HB ALA 13 3HB ALA 13 2.611 -11.146 1.270
86 H ALA 14 H ALA 14 -0.432 -7.789 2.247
87 HA ALA 14 HA ALA 14 -1.233 -6.517 3.954
88 1HB ALA 14 1HB ALA 14 -0.481 -8.559 5.987
89 2HB ALA 14 2HB ALA 14 -1.698 -8.970 4.779
90 3HB ALA 14 3HB ALA 14 -1.948 -7.589 5.848
91 H ASN 15 H ASN 15 1.048 -5.569 3.236
92 HA ASN 15 HA ASN 15 2.434 -4.941 5.746
93 1HB ASN 15 2HB ASN 15 3.611 -6.634 4.017
94 2HB ASN 15 1HB ASN 15 4.122 -5.107 3.304
95 1HD2 ASN 15 1HD2 ASN 15 5.960 -4.337 4.027
96 2HD2 ASN 15 2HD2 ASN 15 6.665 -4.654 5.571
97 H VAL 16 H VAL 16 1.637 -2.993 5.960
98 HA VAL 16 HA VAL 16 0.972 -1.069 4.162
99 HB VAL 16 HB VAL 16 1.982 -1.055 6.951
100 1HG1 VAL 16 1HG1 VAL 16 1.872 1.395 5.211
101 2HG1 VAL 16 2HG1 VAL 16 3.135 0.890 6.334
102 3HG1 VAL 16 3HG1 VAL 16 1.597 1.497 6.950
103 1HG2 VAL 16 1HG2 VAL 16 -0.164 -0.408 7.491
104 2HG2 VAL 16 2HG2 VAL 16 -0.435 -1.383 6.047
105 3HG2 VAL 16 3HG2 VAL 16 -0.436 0.377 5.936
106 H ALA 17 H ALA 17 4.218 -1.654 5.498
107 HA ALA 17 HA ALA 17 5.553 0.491 4.347
108 1HB ALA 17 1HB ALA 17 6.304 -1.556 5.932
109 2HB ALA 17 2HB ALA 17 7.440 -0.485 5.112
110 3HB ALA 17 3HB ALA 17 7.042 -2.053 4.411
111 H ALA 18 H ALA 18 5.083 -2.785 3.035
112 HA ALA 18 HA ALA 18 6.405 -2.359 0.596
113 1HB ALA 18 1HB ALA 18 5.501 -4.546 1.716
114 2HB ALA 18 2HB ALA 18 5.626 -4.428 -0.039
115 3HB ALA 18 3HB ALA 18 4.066 -4.203 0.752
116 H HIS 19 H HIS 19 3.318 -1.335 1.736
117 HA HIS 19 HA HIS 19 2.298 -0.802 -0.924
118 1HB HIS 19 2HB HIS 19 0.486 -1.418 0.315
119 2HB HIS 19 1HB HIS 19 1.179 -0.823 1.819
120 HD2 HIS 19 2HD HIS 19 0.258 1.543 2.671
121 HE1 HIS 19 1HE HIS 19 -1.694 2.678 -0.901
122 HE2 HIS 19 2HE HIS 19 -1.124 3.373 1.464
123 H MET 20 H MET 20 2.704 1.215 2.006
124 HA MET 20 HA MET 20 2.376 3.678 0.834
125 1HB MET 20 2HB MET 20 2.955 2.855 3.331
126 2HB MET 20 1HB MET 20 4.520 3.514 2.874
127 1HG MET 20 2HG MET 20 3.603 5.664 2.493
128 2HG MET 20 1HG MET 20 1.955 5.052 2.606
129 1HE MET 20 1HE MET 20 1.857 7.138 5.808
130 2HE MET 20 2HE MET 20 1.102 6.723 4.268
131 3HE MET 20 3HE MET 20 2.622 7.617 4.292
132 H THR 21 H THR 21 5.082 1.546 0.496
133 HA THR 21 HA THR 21 7.155 3.267 -0.103
134 HB THR 21 HB THR 21 7.365 0.812 0.101
135 HG1 THR 21 1HG THR 21 9.159 1.272 -0.860
136 1HG2 THR 21 1HG2 THR 21 6.684 0.410 -2.745
137 2HG2 THR 21 2HG2 THR 21 5.350 0.506 -1.595
138 3HG2 THR 21 3HG2 THR 21 6.609 -0.710 -1.385
139 H HIS 22 H HIS 22 4.308 2.621 -1.973
140 HA HIS 22 HA HIS 22 5.404 4.300 -4.140
141 1HB HIS 22 2HB HIS 22 3.668 2.974 -5.580
142 2HB HIS 22 1HB HIS 22 5.244 2.269 -5.245
143 HD1 HIS 22 1HD HIS 22 5.050 -0.111 -4.723
144 HD2 HIS 22 2HD HIS 22 1.750 2.005 -3.299
145 HE1 HIS 22 1HE HIS 22 3.581 -1.814 -3.608
146 HE2 HIS 22 2HE HIS 22 1.717 -0.473 -2.587
147 H CYS 23 H CYS 23 2.645 3.332 -2.250
148 HA CYS 23 HA CYS 23 0.875 5.248 -3.464
149 1HB CYS 23 2HB CYS 23 0.710 3.142 -1.365
150 2HB CYS 23 1HB CYS 23 -0.524 4.387 -1.398
151 H ALA 24 H ALA 24 0.969 7.335 -2.953
152 HA ALA 24 HA ALA 24 0.900 8.201 -0.223
153 1HB ALA 24 1HB ALA 24 3.306 9.073 -1.808
154 2HB ALA 24 2HB ALA 24 3.344 7.759 -0.632
155 3HB ALA 24 3HB ALA 24 2.947 9.396 -0.112
156 H LYS 25 H LYS 25 -0.698 8.462 -2.624
157 HA LYS 25 HA LYS 25 -0.742 11.397 -2.794
158 1HB LYS 25 2HB LYS 25 -0.958 9.415 -5.052
159 2HB LYS 25 1HB LYS 25 -1.572 11.057 -5.192
160 1HG LYS 25 2HG LYS 25 0.515 11.986 -5.222
161 2HG LYS 25 1HG LYS 25 1.236 10.666 -4.299
162 1HD LYS 25 2HD LYS 25 2.078 10.433 -6.487
163 2HD LYS 25 1HD LYS 25 0.814 9.210 -6.340
164 1HE LYS 25 2HE LYS 25 -0.055 11.845 -7.335
165 2HE LYS 25 1HE LYS 25 1.013 10.937 -8.404
166 1HZ LYS 25 1HZ LYS 25 -0.523 9.297 -8.699
167 2HZ LYS 25 2HZ LYS 25 -1.565 10.612 -8.484
168 3HZ LYS 25 3HZ LYS 25 -1.271 9.548 -7.203
Start of MODEL 9
1 1H ALA 1 1HT ALA 1 -2.558 5.123 3.352
2 2H ALA 1 2HT ALA 1 -0.893 4.711 3.297
3 3H ALA 1 3HT ALA 1 -1.523 5.569 4.644
4 HA ALA 1 HA ALA 1 -1.087 3.157 4.951
5 1HB ALA 1 1HB ALA 1 -2.321 3.983 6.668
6 2HB ALA 1 2HB ALA 1 -3.544 2.937 5.947
7 3HB ALA 1 3HB ALA 1 -3.550 4.666 5.604
8 H VAL 2 H VAL 2 -1.547 1.094 4.372
9 HA VAL 2 HA VAL 2 -2.557 0.549 1.826
10 HB VAL 2 HB VAL 2 -1.031 -0.966 3.021
11 1HG1 VAL 2 1HG1 VAL 2 -2.419 -0.663 5.209
12 2HG1 VAL 2 2HG1 VAL 2 -1.581 -2.183 4.897
13 3HG1 VAL 2 3HG1 VAL 2 -3.315 -2.055 4.603
14 1HG2 VAL 2 1HG2 VAL 2 -2.361 -1.799 1.138
15 2HG2 VAL 2 2HG2 VAL 2 -3.634 -2.287 2.256
16 3HG2 VAL 2 3HG2 VAL 2 -2.052 -3.064 2.327
17 H SER 3 H SER 3 -4.151 0.751 4.920
18 HA SER 3 HA SER 3 -6.501 -0.657 4.345
19 1HB SER 3 2HB SER 3 -5.695 1.418 6.311
20 2HB SER 3 1HB SER 3 -7.426 1.207 6.048
21 HG SER 3 HG SER 3 -6.953 -1.115 6.385
22 H ALA 4 H ALA 4 -5.473 2.571 3.496
23 HA ALA 4 HA ALA 4 -8.070 3.032 2.183
24 1HB ALA 4 1HB ALA 4 -7.025 4.637 4.010
25 2HB ALA 4 2HB ALA 4 -7.932 5.263 2.633
26 3HB ALA 4 3HB ALA 4 -6.167 5.274 2.606
27 H CYS 5 H CYS 5 -5.747 1.495 1.151
28 HA CYS 5 HA CYS 5 -4.456 3.062 -0.846
29 1HB CYS 5 2HB CYS 5 -3.359 1.077 -0.075
30 2HB CYS 5 1HB CYS 5 -4.748 0.078 -0.472
31 H ALA 6 H ALA 6 -4.806 3.114 -3.066
32 HA ALA 6 HA ALA 6 -7.540 2.390 -3.885
33 1HB ALA 6 1HB ALA 6 -7.327 4.714 -4.083
34 2HB ALA 6 2HB ALA 6 -7.095 4.110 -5.724
35 3HB ALA 6 3HB ALA 6 -5.702 4.598 -4.759
36 H LEU 7 H LEU 7 -4.182 1.885 -4.512
37 HA LEU 7 HA LEU 7 -4.310 1.015 -7.183
38 1HB LEU 7 2HB LEU 7 -2.405 0.647 -4.924
39 2HB LEU 7 1HB LEU 7 -2.240 -0.404 -6.318
40 HG LEU 7 HG LEU 7 -2.249 2.605 -6.508
41 1HD1 LEU 7 1HD1 LEU 7 0.284 1.211 -6.931
42 2HD1 LEU 7 2HD1 LEU 7 -0.298 1.148 -5.268
43 3HD1 LEU 7 3HD1 LEU 7 -0.061 2.706 -6.061
44 1HD2 LEU 7 1HD2 LEU 7 -2.835 1.144 -8.514
45 2HD2 LEU 7 2HD2 LEU 7 -1.155 0.610 -8.468
46 3HD2 LEU 7 3HD2 LEU 7 -1.533 2.314 -8.723
47 HA PRO 8 HA PRO 8 -6.332 -2.904 -6.625
48 1HB PRO 8 2HB PRO 8 -5.985 -3.919 -9.082
49 2HB PRO 8 1HB PRO 8 -7.057 -2.543 -8.794
50 1HG PRO 8 2HG PRO 8 -4.260 -2.577 -9.858
51 2HG PRO 8 1HG PRO 8 -5.653 -1.625 -10.402
52 1HD PRO 8 2HD PRO 8 -3.675 -0.652 -8.767
53 2HD PRO 8 1HD PRO 8 -5.332 -0.021 -8.802
54 H LYS 9 H LYS 9 -5.691 -4.796 -5.784
55 HA LYS 9 HA LYS 9 -4.363 -6.515 -5.108
56 1HB LYS 9 2HB LYS 9 -3.305 -6.121 -7.907
57 2HB LYS 9 1HB LYS 9 -2.801 -7.446 -6.867
58 1HG LYS 9 2HG LYS 9 -5.708 -7.104 -7.202
59 2HG LYS 9 1HG LYS 9 -4.810 -7.620 -8.632
60 1HD LYS 9 2HD LYS 9 -5.501 -9.595 -7.510
61 2HD LYS 9 1HD LYS 9 -3.774 -9.411 -7.194
62 1HE LYS 9 2HE LYS 9 -5.553 -8.129 -5.234
63 2HE LYS 9 1HE LYS 9 -5.643 -9.889 -5.288
64 1HZ LYS 9 1HZ LYS 9 -3.460 -8.166 -4.432
65 2HZ LYS 9 2HZ LYS 9 -3.016 -9.555 -5.289
66 3HZ LYS 9 3HZ LYS 9 -3.921 -9.693 -3.867
67 H CYS 10 H CYS 10 -3.537 -3.786 -4.520
68 HA CYS 10 HA CYS 10 -0.740 -3.489 -4.810
69 1HB CYS 10 2HB CYS 10 -2.685 -1.814 -4.062
70 2HB CYS 10 1HB CYS 10 -2.106 -2.272 -2.465
71 H ALA 11 H ALA 11 -2.726 -4.582 -2.064
72 HA ALA 11 HA ALA 11 -0.656 -5.093 -0.272
73 1HB ALA 11 1HB ALA 11 -2.224 -6.467 0.939
74 2HB ALA 11 2HB ALA 11 -3.250 -6.614 -0.487
75 3HB ALA 11 3HB ALA 11 -3.062 -5.050 0.307
76 H ALA 12 H ALA 12 1.048 -6.361 -0.567
77 HA ALA 12 HA ALA 12 0.877 -8.675 -2.326
78 1HB ALA 12 1HB ALA 12 3.386 -7.988 -0.889
79 2HB ALA 12 2HB ALA 12 2.805 -6.877 -2.131
80 3HB ALA 12 3HB ALA 12 3.145 -8.559 -2.541
81 H ALA 13 H ALA 13 1.111 -7.916 1.064
82 HA ALA 13 HA ALA 13 0.379 -10.530 1.847
83 1HB ALA 13 1HB ALA 13 2.307 -11.487 2.612
84 2HB ALA 13 2HB ALA 13 3.110 -9.937 2.858
85 3HB ALA 13 3HB ALA 13 2.944 -10.595 1.230
86 H ALA 14 H ALA 14 -0.438 -7.824 2.321
87 HA ALA 14 HA ALA 14 -1.219 -6.521 4.013
88 1HB ALA 14 1HB ALA 14 -0.485 -8.418 6.152
89 2HB ALA 14 2HB ALA 14 -1.557 -9.035 4.896
90 3HB ALA 14 3HB ALA 14 -2.017 -7.609 5.826
91 H ASN 15 H ASN 15 1.059 -5.583 3.268
92 HA ASN 15 HA ASN 15 2.462 -4.927 5.762
93 1HB ASN 15 2HB ASN 15 3.616 -6.629 3.999
94 2HB ASN 15 1HB ASN 15 4.155 -5.089 3.334
95 1HD2 ASN 15 1HD2 ASN 15 5.434 -7.383 4.886
96 2HD2 ASN 15 2HD2 ASN 15 6.336 -6.581 6.123
97 H VAL 16 H VAL 16 1.663 -2.977 5.960
98 HA VAL 16 HA VAL 16 0.987 -1.074 4.144
99 HB VAL 16 HB VAL 16 2.006 -1.029 6.929
100 1HG1 VAL 16 1HG1 VAL 16 3.144 0.914 6.336
101 2HG1 VAL 16 2HG1 VAL 16 1.583 1.534 6.870
102 3HG1 VAL 16 3HG1 VAL 16 1.929 1.385 5.148
103 1HG2 VAL 16 1HG2 VAL 16 -0.183 0.253 7.189
104 2HG2 VAL 16 2HG2 VAL 16 -0.290 -1.442 6.714
105 3HG2 VAL 16 3HG2 VAL 16 -0.496 -0.174 5.507
106 H ALA 17 H ALA 17 4.238 -1.637 5.478
107 HA ALA 17 HA ALA 17 5.570 0.497 4.309
108 1HB ALA 17 1HB ALA 17 7.014 -2.087 4.405
109 2HB ALA 17 2HB ALA 17 6.342 -1.488 5.922
110 3HB ALA 17 3HB ALA 17 7.485 -0.499 5.012
111 H ALA 18 H ALA 18 5.097 -2.783 3.009
112 HA ALA 18 HA ALA 18 6.406 -2.364 0.562
113 1HB ALA 18 1HB ALA 18 5.828 -4.587 1.438
114 2HB ALA 18 2HB ALA 18 5.252 -4.355 -0.213
115 3HB ALA 18 3HB ALA 18 4.123 -4.250 1.138
116 H HIS 19 H HIS 19 3.324 -1.339 1.712
117 HA HIS 19 HA HIS 19 2.296 -0.811 -0.947
118 1HB HIS 19 2HB HIS 19 0.487 -1.430 0.297
119 2HB HIS 19 1HB HIS 19 1.182 -0.832 1.798
120 HD2 HIS 19 2HD HIS 19 0.252 1.530 2.650
121 HE1 HIS 19 1HE HIS 19 -1.699 2.662 -0.922
122 HE2 HIS 19 2HE HIS 19 -1.418 3.176 1.547
123 H MET 20 H MET 20 2.707 1.208 1.981
124 HA MET 20 HA MET 20 2.372 3.670 0.809
125 1HB MET 20 2HB MET 20 2.944 2.857 3.305
126 2HB MET 20 1HB MET 20 4.517 3.498 2.850
127 1HG MET 20 2HG MET 20 3.647 5.657 2.491
128 2HG MET 20 1HG MET 20 1.984 5.074 2.539
129 1HE MET 20 1HE MET 20 1.893 7.264 5.587
130 2HE MET 20 2HE MET 20 1.925 7.265 3.824
131 3HE MET 20 3HE MET 20 3.394 7.621 4.733
132 H THR 21 H THR 21 5.079 1.540 0.467
133 HA THR 21 HA THR 21 7.152 3.260 -0.135
134 HB THR 21 HB THR 21 7.363 0.806 0.065
135 HG1 THR 21 1HG THR 21 8.330 1.956 -2.336
136 1HG2 THR 21 1HG2 THR 21 5.339 0.483 -1.600
137 2HG2 THR 21 2HG2 THR 21 6.620 -0.717 -1.437
138 3HG2 THR 21 3HG2 THR 21 6.647 0.425 -2.781
139 H HIS 22 H HIS 22 4.301 2.618 -2.001
140 HA HIS 22 HA HIS 22 5.394 4.301 -4.166
141 1HB HIS 22 2HB HIS 22 3.654 2.975 -5.606
142 2HB HIS 22 1HB HIS 22 5.233 2.273 -5.275
143 HD1 HIS 22 1HD HIS 22 5.046 -0.107 -4.759
144 HD2 HIS 22 2HD HIS 22 1.746 1.997 -3.321
145 HE1 HIS 22 1HE HIS 22 3.584 -1.816 -3.643
146 HE2 HIS 22 2HE HIS 22 1.722 -0.483 -2.613
147 H CYS 23 H CYS 23 2.637 3.327 -2.276
148 HA CYS 23 HA CYS 23 0.863 5.242 -3.482
149 1HB CYS 23 2HB CYS 23 0.703 3.135 -1.385
150 2HB CYS 23 1HB CYS 23 -0.533 4.377 -1.416
151 H ALA 24 H ALA 24 1.438 7.316 -3.049
152 HA ALA 24 HA ALA 24 1.046 8.287 -0.377
153 1HB ALA 24 1HB ALA 24 3.150 8.903 0.231
154 2HB ALA 24 2HB ALA 24 3.701 9.079 -1.435
155 3HB ALA 24 3HB ALA 24 3.549 7.473 -0.721
156 H LYS 25 H LYS 25 -0.206 8.712 -2.893
157 HA LYS 25 HA LYS 25 0.377 11.573 -3.286
158 1HB LYS 25 2HB LYS 25 0.865 9.806 -5.204
159 2HB LYS 25 1HB LYS 25 -0.862 9.982 -5.485
160 1HG LYS 25 2HG LYS 25 -0.575 12.386 -5.780
161 2HG LYS 25 1HG LYS 25 1.156 12.218 -5.483
162 1HD LYS 25 2HD LYS 25 1.197 12.145 -7.754
163 2HD LYS 25 1HD LYS 25 0.908 10.432 -7.445
164 1HE LYS 25 2HE LYS 25 -1.169 12.520 -8.096
165 2HE LYS 25 1HE LYS 25 -0.600 11.237 -9.163
166 1HZ LYS 25 1HZ LYS 25 -1.424 9.655 -7.396
167 2HZ LYS 25 2HZ LYS 25 -2.614 10.481 -8.271
168 3HZ LYS 25 3HZ LYS 25 -2.222 10.976 -6.702
Start of MODEL 10
1 1H ALA 1 1HT ALA 1 -2.782 4.815 3.425
2 2H ALA 1 2HT ALA 1 -1.105 4.617 3.119
3 3H ALA 1 3HT ALA 1 -1.635 5.291 4.605
4 HA ALA 1 HA ALA 1 -0.890 2.913 4.588
5 1HB ALA 1 1HB ALA 1 -2.414 4.270 6.256
6 2HB ALA 1 2HB ALA 1 -2.179 2.530 6.434
7 3HB ALA 1 3HB ALA 1 -3.647 3.150 5.675
8 H VAL 2 H VAL 2 -1.611 0.747 4.301
9 HA VAL 2 HA VAL 2 -2.692 0.192 1.785
10 HB VAL 2 HB VAL 2 -1.261 -1.388 3.008
11 1HG1 VAL 2 1HG1 VAL 2 -1.787 -2.378 4.981
12 2HG1 VAL 2 2HG1 VAL 2 -3.519 -2.385 4.644
13 3HG1 VAL 2 3HG1 VAL 2 -2.730 -0.901 5.180
14 1HG2 VAL 2 1HG2 VAL 2 -2.354 -3.399 2.319
15 2HG2 VAL 2 2HG2 VAL 2 -2.793 -2.129 1.177
16 3HG2 VAL 2 3HG2 VAL 2 -3.940 -2.634 2.417
17 H SER 3 H SER 3 -4.225 0.603 4.891
18 HA SER 3 HA SER 3 -6.685 -0.642 4.346
19 1HB SER 3 2HB SER 3 -5.637 0.451 6.556
20 2HB SER 3 1HB SER 3 -6.668 1.793 6.059
21 HG SER 3 HG SER 3 -7.618 -0.864 6.258
22 H ALA 4 H ALA 4 -5.415 2.503 3.509
23 HA ALA 4 HA ALA 4 -7.977 3.161 2.209
24 1HB ALA 4 1HB ALA 4 -6.972 4.667 4.077
25 2HB ALA 4 2HB ALA 4 -7.647 5.407 2.625
26 3HB ALA 4 3HB ALA 4 -5.900 5.228 2.793
27 H CYS 5 H CYS 5 -5.757 1.508 1.153
28 HA CYS 5 HA CYS 5 -4.374 3.060 -0.809
29 1HB CYS 5 2HB CYS 5 -3.338 1.039 -0.054
30 2HB CYS 5 1HB CYS 5 -4.759 0.085 -0.451
31 H ALA 6 H ALA 6 -4.703 3.127 -3.035
32 HA ALA 6 HA ALA 6 -7.453 2.493 -3.876
33 1HB ALA 6 1HB ALA 6 -7.339 4.752 -4.188
34 2HB ALA 6 2HB ALA 6 -6.738 4.211 -5.754
35 3HB ALA 6 3HB ALA 6 -5.605 4.733 -4.507
36 H LEU 7 H LEU 7 -4.104 1.908 -4.489
37 HA LEU 7 HA LEU 7 -4.253 1.064 -7.171
38 1HB LEU 7 2HB LEU 7 -2.346 0.648 -4.920
39 2HB LEU 7 1HB LEU 7 -2.201 -0.389 -6.326
40 HG LEU 7 HG LEU 7 -2.162 2.622 -6.478
41 1HD1 LEU 7 1HD1 LEU 7 -0.234 1.132 -5.261
42 2HD1 LEU 7 2HD1 LEU 7 0.037 2.679 -6.062
43 3HD1 LEU 7 3HD1 LEU 7 0.340 1.173 -6.928
44 1HD2 LEU 7 1HD2 LEU 7 -2.779 1.173 -8.497
45 2HD2 LEU 7 2HD2 LEU 7 -1.094 0.656 -8.475
46 3HD2 LEU 7 3HD2 LEU 7 -1.491 2.359 -8.702
47 HA PRO 8 HA PRO 8 -6.321 -2.833 -6.629
48 1HB PRO 8 2HB PRO 8 -5.992 -3.842 -9.091
49 2HB PRO 8 1HB PRO 8 -7.040 -2.449 -8.796
50 1HG PRO 8 2HG PRO 8 -4.245 -2.525 -9.862
51 2HG PRO 8 1HG PRO 8 -5.622 -1.547 -10.401
52 1HD PRO 8 2HD PRO 8 -3.625 -0.618 -8.760
53 2HD PRO 8 1HD PRO 8 -5.270 0.046 -8.797
54 H LYS 9 H LYS 9 -5.710 -4.747 -5.811
55 HA LYS 9 HA LYS 9 -4.406 -6.490 -5.147
56 1HB LYS 9 2HB LYS 9 -4.475 -6.642 -7.805
57 2HB LYS 9 1HB LYS 9 -2.753 -6.339 -7.621
58 1HG LYS 9 2HG LYS 9 -2.776 -8.617 -7.588
59 2HG LYS 9 1HG LYS 9 -2.926 -8.280 -5.862
60 1HD LYS 9 2HD LYS 9 -5.466 -8.410 -7.341
61 2HD LYS 9 1HD LYS 9 -4.571 -9.928 -7.250
62 1HE LYS 9 2HE LYS 9 -4.762 -8.413 -4.733
63 2HE LYS 9 1HE LYS 9 -6.284 -9.055 -5.348
64 1HZ LYS 9 1HZ LYS 9 -4.635 -10.455 -3.825
65 2HZ LYS 9 2HZ LYS 9 -4.021 -10.883 -5.342
66 3HZ LYS 9 3HZ LYS 9 -5.648 -11.171 -4.977
67 H CYS 10 H CYS 10 -3.557 -3.769 -4.532
68 HA CYS 10 HA CYS 10 -0.752 -3.508 -4.788
69 1HB CYS 10 2HB CYS 10 -2.697 -1.817 -4.048
70 2HB CYS 10 1HB CYS 10 -2.113 -2.276 -2.452
71 H ALA 11 H ALA 11 -2.793 -4.607 -2.089
72 HA ALA 11 HA ALA 11 -0.767 -5.137 -0.255
73 1HB ALA 11 1HB ALA 11 -2.364 -6.533 0.900
74 2HB ALA 11 2HB ALA 11 -3.363 -6.642 -0.549
75 3HB ALA 11 3HB ALA 11 -3.178 -5.096 0.280
76 H ALA 12 H ALA 12 0.936 -6.414 -0.500
77 HA ALA 12 HA ALA 12 0.777 -8.738 -2.261
78 1HB ALA 12 1HB ALA 12 3.281 -8.816 -1.814
79 2HB ALA 12 2HB ALA 12 3.073 -7.264 -1.003
80 3HB ALA 12 3HB ALA 12 2.674 -7.427 -2.713
81 H ALA 13 H ALA 13 1.069 -7.912 1.111
82 HA ALA 13 HA ALA 13 0.376 -10.518 1.958
83 1HB ALA 13 1HB ALA 13 2.640 -10.730 3.298
84 2HB ALA 13 2HB ALA 13 3.263 -9.807 1.930
85 3HB ALA 13 3HB ALA 13 2.478 -11.363 1.660
86 H ALA 14 H ALA 14 -0.453 -7.810 2.398
87 HA ALA 14 HA ALA 14 -1.198 -6.472 4.080
88 1HB ALA 14 1HB ALA 14 -0.980 -7.664 6.453
89 2HB ALA 14 2HB ALA 14 -0.754 -9.075 5.420
90 3HB ALA 14 3HB ALA 14 -2.220 -8.105 5.280
91 H ASN 15 H ASN 15 1.071 -5.550 3.295
92 HA ASN 15 HA ASN 15 2.516 -4.876 5.762
93 1HB ASN 15 2HB ASN 15 3.658 -6.602 4.063
94 2HB ASN 15 1HB ASN 15 4.120 -5.104 3.260
95 1HD2 ASN 15 1HD2 ASN 15 6.293 -5.461 3.716
96 2HD2 ASN 15 2HD2 ASN 15 6.943 -5.242 5.301
97 H VAL 16 H VAL 16 1.711 -2.928 5.963
98 HA VAL 16 HA VAL 16 1.014 -1.035 4.140
99 HB VAL 16 HB VAL 16 2.038 -0.978 6.922
100 1HG1 VAL 16 1HG1 VAL 16 3.188 0.958 6.147
101 2HG1 VAL 16 2HG1 VAL 16 1.735 1.533 6.966
102 3HG1 VAL 16 3HG1 VAL 16 1.796 1.492 5.203
103 1HG2 VAL 16 1HG2 VAL 16 -0.110 -0.501 7.464
104 2HG2 VAL 16 2HG2 VAL 16 -0.407 -1.250 5.896
105 3HG2 VAL 16 3HG2 VAL 16 -0.366 0.507 6.040
106 H ALA 17 H ALA 17 4.269 -1.568 5.479
107 HA ALA 17 HA ALA 17 5.588 0.563 4.294
108 1HB ALA 17 1HB ALA 17 7.088 -1.974 4.373
109 2HB ALA 17 2HB ALA 17 6.357 -1.462 5.895
110 3HB ALA 17 3HB ALA 17 7.485 -0.396 5.056
111 H ALA 18 H ALA 18 5.139 -2.727 3.013
112 HA ALA 18 HA ALA 18 6.443 -2.312 0.564
113 1HB ALA 18 1HB ALA 18 5.784 -4.417 0.035
114 2HB ALA 18 2HB ALA 18 4.135 -4.164 0.605
115 3HB ALA 18 3HB ALA 18 5.429 -4.476 1.761
116 H HIS 19 H HIS 19 3.358 -1.297 1.711
117 HA HIS 19 HA HIS 19 2.324 -0.788 -0.950
118 1HB HIS 19 2HB HIS 19 0.520 -1.414 0.294
119 2HB HIS 19 1HB HIS 19 1.212 -0.809 1.795
120 HD2 HIS 19 2HD HIS 19 0.276 1.556 2.638
121 HE1 HIS 19 1HE HIS 19 -1.707 2.653 -0.929
122 HE2 HIS 19 2HE HIS 19 -1.412 3.184 1.535
123 H MET 20 H MET 20 2.714 1.247 1.970
124 HA MET 20 HA MET 20 2.364 3.701 0.790
125 1HB MET 20 2HB MET 20 2.944 2.905 3.287
126 2HB MET 20 1HB MET 20 4.517 3.545 2.827
127 1HG MET 20 2HG MET 20 3.796 5.683 2.797
128 2HG MET 20 1HG MET 20 2.185 5.248 2.230
129 1HE MET 20 1HE MET 20 3.682 4.889 6.548
130 2HE MET 20 2HE MET 20 4.232 6.244 5.563
131 3HE MET 20 3HE MET 20 4.599 4.591 5.071
132 H THR 21 H THR 21 5.090 1.591 0.457
133 HA THR 21 HA THR 21 7.144 3.328 -0.163
134 HB THR 21 HB THR 21 7.385 0.880 0.063
135 HG1 THR 21 1HG THR 21 9.057 0.808 -1.290
136 1HG2 THR 21 1HG2 THR 21 6.666 0.456 -2.775
137 2HG2 THR 21 2HG2 THR 21 5.359 0.514 -1.592
138 3HG2 THR 21 3HG2 THR 21 6.655 -0.669 -1.417
139 H HIS 22 H HIS 22 4.297 2.639 -2.017
140 HA HIS 22 HA HIS 22 5.371 4.303 -4.204
141 1HB HIS 22 2HB HIS 22 3.644 2.949 -5.627
142 2HB HIS 22 1HB HIS 22 5.224 2.255 -5.283
143 HD1 HIS 22 1HD HIS 22 5.040 -0.119 -4.733
144 HD2 HIS 22 2HD HIS 22 1.730 1.998 -3.336
145 HE1 HIS 22 1HE HIS 22 3.578 -1.815 -3.599
146 HE2 HIS 22 2HE HIS 22 1.706 -0.472 -2.598
147 H CYS 23 H CYS 23 2.626 3.335 -2.293
148 HA CYS 23 HA CYS 23 0.838 5.226 -3.520
149 1HB CYS 23 2HB CYS 23 0.694 3.135 -1.407
150 2HB CYS 23 1HB CYS 23 -0.547 4.374 -1.437
151 H ALA 24 H ALA 24 2.126 7.145 -3.058
152 HA ALA 24 HA ALA 24 1.556 8.176 -0.369
153 1HB ALA 24 1HB ALA 24 3.853 9.428 -0.729
154 2HB ALA 24 2HB ALA 24 4.202 8.007 -1.715
155 3HB ALA 24 3HB ALA 24 3.783 7.818 -0.011
156 H LYS 25 H LYS 25 0.229 8.546 -2.937
157 HA LYS 25 HA LYS 25 0.796 11.387 -3.451
158 1HB LYS 25 2HB LYS 25 -0.233 9.164 -5.143
159 2HB LYS 25 1HB LYS 25 -0.835 10.783 -5.471
160 1HG LYS 25 2HG LYS 25 1.304 11.590 -6.004
161 2HG LYS 25 1HG LYS 25 2.099 10.183 -5.294
162 1HD LYS 25 2HD LYS 25 2.195 9.905 -7.650
163 2HD LYS 25 1HD LYS 25 0.962 8.790 -7.059
164 1HE LYS 25 2HE LYS 25 0.055 11.494 -7.848
165 2HE LYS 25 1HE LYS 25 0.579 10.422 -9.146
166 1HZ LYS 25 1HZ LYS 25 -1.244 9.311 -7.156
167 2HZ LYS 25 2HZ LYS 25 -1.157 9.027 -8.822
168 3HZ LYS 25 3HZ LYS 25 -1.889 10.437 -8.243
Start of MODEL 11
1 1H ALA 1 1HT ALA 1 -1.455 4.897 3.074
2 2H ALA 1 2HT ALA 1 -1.412 5.621 4.630
3 3H ALA 1 3HT ALA 1 -2.915 5.369 3.840
4 HA ALA 1 HA ALA 1 -1.060 3.334 4.870
5 1HB ALA 1 1HB ALA 1 -2.550 4.594 6.472
6 2HB ALA 1 2HB ALA 1 -2.736 2.841 6.462
7 3HB ALA 1 3HB ALA 1 -3.919 3.858 5.640
8 H VAL 2 H VAL 2 -1.534 1.197 4.398
9 HA VAL 2 HA VAL 2 -2.527 0.630 1.848
10 HB VAL 2 HB VAL 2 -0.970 -0.850 3.046
11 1HG1 VAL 2 1HG1 VAL 2 -2.175 -0.607 5.260
12 2HG1 VAL 2 2HG1 VAL 2 -1.607 -2.227 4.853
13 3HG1 VAL 2 3HG1 VAL 2 -3.312 -1.817 4.664
14 1HG2 VAL 2 1HG2 VAL 2 -1.988 -2.987 2.389
15 2HG2 VAL 2 2HG2 VAL 2 -2.221 -1.739 1.164
16 3HG2 VAL 2 3HG2 VAL 2 -3.551 -2.183 2.234
17 H SER 3 H SER 3 -4.128 0.797 4.942
18 HA SER 3 HA SER 3 -6.444 -0.664 4.371
19 1HB SER 3 2HB SER 3 -5.599 0.434 6.600
20 2HB SER 3 1HB SER 3 -6.569 1.807 6.065
21 HG SER 3 HG SER 3 -7.525 -0.853 6.340
22 H ALA 4 H ALA 4 -5.488 2.580 3.499
23 HA ALA 4 HA ALA 4 -8.094 2.973 2.181
24 1HB ALA 4 1HB ALA 4 -7.572 4.647 3.897
25 2HB ALA 4 2HB ALA 4 -7.675 5.363 2.290
26 3HB ALA 4 3HB ALA 4 -6.099 5.071 3.025
27 H CYS 5 H CYS 5 -5.741 1.481 1.160
28 HA CYS 5 HA CYS 5 -4.461 3.054 -0.832
29 1HB CYS 5 2HB CYS 5 -3.361 1.069 -0.073
30 2HB CYS 5 1HB CYS 5 -4.750 0.068 -0.470
31 H ALA 6 H ALA 6 -4.802 3.110 -3.056
32 HA ALA 6 HA ALA 6 -7.533 2.394 -3.885
33 1HB ALA 6 1HB ALA 6 -7.550 4.222 -5.339
34 2HB ALA 6 2HB ALA 6 -5.795 4.386 -5.301
35 3HB ALA 6 3HB ALA 6 -6.753 4.834 -3.890
36 H LEU 7 H LEU 7 -4.173 1.894 -4.509
37 HA LEU 7 HA LEU 7 -4.297 1.035 -7.183
38 1HB LEU 7 2HB LEU 7 -2.395 0.657 -4.924
39 2HB LEU 7 1HB LEU 7 -2.227 -0.386 -6.323
40 HG LEU 7 HG LEU 7 -2.233 2.624 -6.494
41 1HD1 LEU 7 1HD1 LEU 7 0.295 1.226 -6.933
42 2HD1 LEU 7 2HD1 LEU 7 -0.283 1.155 -5.269
43 3HD1 LEU 7 3HD1 LEU 7 -0.043 2.717 -6.054
44 1HD2 LEU 7 1HD2 LEU 7 -1.535 2.352 -8.712
45 2HD2 LEU 7 2HD2 LEU 7 -2.824 1.168 -8.508
46 3HD2 LEU 7 3HD2 LEU 7 -1.139 0.650 -8.473
47 HA PRO 8 HA PRO 8 -6.313 -2.890 -6.643
48 1HB PRO 8 2HB PRO 8 -5.971 -3.891 -9.106
49 2HB PRO 8 1HB PRO 8 -7.042 -2.515 -8.808
50 1HG PRO 8 2HG PRO 8 -4.247 -2.544 -9.879
51 2HG PRO 8 1HG PRO 8 -5.641 -1.588 -10.414
52 1HD PRO 8 2HD PRO 8 -3.658 -0.629 -8.776
53 2HD PRO 8 1HD PRO 8 -5.313 0.007 -8.807
54 H LYS 9 H LYS 9 -5.671 -4.790 -5.820
55 HA LYS 9 HA LYS 9 -4.341 -6.514 -5.160
56 1HB LYS 9 2HB LYS 9 -3.452 -6.084 -7.994
57 2HB LYS 9 1HB LYS 9 -2.662 -7.290 -6.989
58 1HG LYS 9 2HG LYS 9 -5.637 -7.269 -7.293
59 2HG LYS 9 1HG LYS 9 -4.603 -8.012 -8.515
60 1HD LYS 9 2HD LYS 9 -4.813 -9.847 -7.225
61 2HD LYS 9 1HD LYS 9 -3.559 -9.074 -6.252
62 1HE LYS 9 2HE LYS 9 -5.775 -7.905 -5.234
63 2HE LYS 9 1HE LYS 9 -6.421 -9.482 -5.686
64 1HZ LYS 9 1HZ LYS 9 -4.158 -8.923 -3.853
65 2HZ LYS 9 2HZ LYS 9 -4.525 -10.471 -4.428
66 3HZ LYS 9 3HZ LYS 9 -5.644 -9.638 -3.471
67 H CYS 10 H CYS 10 -3.524 -3.786 -4.544
68 HA CYS 10 HA CYS 10 -0.726 -3.482 -4.820
69 1HB CYS 10 2HB CYS 10 -2.686 -1.821 -4.059
70 2HB CYS 10 1HB CYS 10 -2.095 -2.285 -2.468
71 H ALA 11 H ALA 11 -2.718 -4.585 -2.082
72 HA ALA 11 HA ALA 11 -0.647 -5.118 -0.296
73 1HB ALA 11 1HB ALA 11 -3.052 -5.059 0.289
74 2HB ALA 11 2HB ALA 11 -2.222 -6.485 0.912
75 3HB ALA 11 3HB ALA 11 -3.254 -6.617 -0.512
76 H ALA 12 H ALA 12 1.019 -6.444 -0.510
77 HA ALA 12 HA ALA 12 0.825 -8.747 -2.296
78 1HB ALA 12 1HB ALA 12 3.228 -8.834 -2.202
79 2HB ALA 12 2HB ALA 12 3.259 -7.647 -0.899
80 3HB ALA 12 3HB ALA 12 2.726 -7.172 -2.511
81 H ALA 13 H ALA 13 1.107 -7.957 1.082
82 HA ALA 13 HA ALA 13 0.390 -10.568 1.896
83 1HB ALA 13 1HB ALA 13 3.101 -9.990 2.934
84 2HB ALA 13 2HB ALA 13 2.985 -10.559 1.268
85 3HB ALA 13 3HB ALA 13 2.325 -11.534 2.582
86 H ALA 14 H ALA 14 -0.436 -7.862 2.350
87 HA ALA 14 HA ALA 14 -1.201 -6.541 4.036
88 1HB ALA 14 1HB ALA 14 -0.463 -8.876 5.796
89 2HB ALA 14 2HB ALA 14 -1.999 -8.668 4.957
90 3HB ALA 14 3HB ALA 14 -1.530 -7.541 6.230
91 H ASN 15 H ASN 15 1.072 -5.609 3.274
92 HA ASN 15 HA ASN 15 2.492 -4.944 5.757
93 1HB ASN 15 2HB ASN 15 3.648 -6.657 4.041
94 2HB ASN 15 1HB ASN 15 4.132 -5.144 3.281
95 1HD2 ASN 15 1HD2 ASN 15 4.932 -3.482 4.971
96 2HD2 ASN 15 2HD2 ASN 15 6.081 -4.092 6.108
97 H VAL 16 H VAL 16 1.684 -2.997 5.958
98 HA VAL 16 HA VAL 16 0.994 -1.096 4.143
99 HB VAL 16 HB VAL 16 2.024 -1.048 6.924
100 1HG1 VAL 16 1HG1 VAL 16 3.170 0.892 6.230
101 2HG1 VAL 16 2HG1 VAL 16 1.663 1.488 6.928
102 3HG1 VAL 16 3HG1 VAL 16 1.849 1.400 5.176
103 1HG2 VAL 16 1HG2 VAL 16 -0.124 -0.213 7.440
104 2HG2 VAL 16 2HG2 VAL 16 -0.364 -1.464 6.221
105 3HG2 VAL 16 3HG2 VAL 16 -0.436 0.238 5.764
106 H ALA 17 H ALA 17 4.251 -1.645 5.468
107 HA ALA 17 HA ALA 17 5.574 0.489 4.292
108 1HB ALA 17 1HB ALA 17 7.058 -2.061 4.358
109 2HB ALA 17 2HB ALA 17 6.344 -1.538 5.884
110 3HB ALA 17 3HB ALA 17 7.474 -0.485 5.033
111 H ALA 18 H ALA 18 5.102 -2.791 2.994
112 HA ALA 18 HA ALA 18 6.403 -2.372 0.543
113 1HB ALA 18 1HB ALA 18 5.733 -4.585 1.518
114 2HB ALA 18 2HB ALA 18 5.371 -4.388 -0.197
115 3HB ALA 18 3HB ALA 18 4.083 -4.240 0.999
116 H HIS 19 H HIS 19 3.323 -1.347 1.702
117 HA HIS 19 HA HIS 19 2.288 -0.816 -0.954
118 1HB HIS 19 2HB HIS 19 0.483 -1.435 0.295
119 2HB HIS 19 1HB HIS 19 1.182 -0.838 1.795
120 HD2 HIS 19 2HD HIS 19 0.252 1.521 2.651
121 HE1 HIS 19 1HE HIS 19 -1.702 2.659 -0.919
122 HE2 HIS 19 2HE HIS 19 -1.418 3.170 1.551
123 H MET 20 H MET 20 2.702 1.200 1.976
124 HA MET 20 HA MET 20 2.368 3.663 0.806
125 1HB MET 20 2HB MET 20 2.883 2.894 3.298
126 2HB MET 20 1HB MET 20 4.505 3.419 2.868
127 1HG MET 20 2HG MET 20 3.588 5.619 2.237
128 2HG MET 20 1HG MET 20 1.998 5.081 2.776
129 1HE MET 20 1HE MET 20 1.587 5.313 6.066
130 2HE MET 20 2HE MET 20 1.108 5.794 4.438
131 3HE MET 20 3HE MET 20 1.844 6.972 5.524
132 H THR 21 H THR 21 5.074 1.534 0.461
133 HA THR 21 HA THR 21 7.148 3.252 -0.139
134 HB THR 21 HB THR 21 7.357 0.799 0.054
135 HG1 THR 21 1HG THR 21 8.970 2.061 -1.036
136 1HG2 THR 21 1HG2 THR 21 6.644 0.417 -2.791
137 2HG2 THR 21 2HG2 THR 21 5.329 0.489 -1.617
138 3HG2 THR 21 3HG2 THR 21 6.603 -0.720 -1.444
139 H HIS 22 H HIS 22 4.295 2.619 -2.004
140 HA HIS 22 HA HIS 22 5.387 4.307 -4.166
141 1HB HIS 22 2HB HIS 22 3.643 2.984 -5.607
142 2HB HIS 22 1HB HIS 22 5.225 2.284 -5.284
143 HD1 HIS 22 1HD HIS 22 5.045 -0.098 -4.768
144 HD2 HIS 22 2HD HIS 22 1.740 1.995 -3.325
145 HE1 HIS 22 1HE HIS 22 3.589 -1.814 -3.656
146 HE2 HIS 22 2HE HIS 22 1.723 -0.486 -2.622
147 H CYS 23 H CYS 23 2.629 3.326 -2.279
148 HA CYS 23 HA CYS 23 0.854 5.244 -3.480
149 1HB CYS 23 2HB CYS 23 0.698 3.135 -1.382
150 2HB CYS 23 1HB CYS 23 -0.539 4.377 -1.413
151 H ALA 24 H ALA 24 1.612 7.292 -3.056
152 HA ALA 24 HA ALA 24 1.181 8.265 -0.367
153 1HB ALA 24 1HB ALA 24 3.809 9.063 -1.493
154 2HB ALA 24 2HB ALA 24 3.676 7.465 -0.758
155 3HB ALA 24 3HB ALA 24 3.297 8.905 0.187
156 H LYS 25 H LYS 25 -0.497 9.007 -2.100
157 HA LYS 25 HA LYS 25 0.256 11.733 -2.833
158 1HB LYS 25 2HB LYS 25 0.316 9.884 -4.776
159 2HB LYS 25 1HB LYS 25 -1.397 10.277 -4.824
160 1HG LYS 25 2HG LYS 25 -1.041 12.345 -5.663
161 2HG LYS 25 1HG LYS 25 0.477 12.560 -4.788
162 1HD LYS 25 2HD LYS 25 1.104 12.413 -7.045
163 2HD LYS 25 1HD LYS 25 1.442 10.813 -6.382
164 1HE LYS 25 2HE LYS 25 -1.104 10.468 -7.198
165 2HE LYS 25 1HE LYS 25 -0.560 11.661 -8.376
166 1HZ LYS 25 1HZ LYS 25 1.394 10.146 -8.754
167 2HZ LYS 25 2HZ LYS 25 -0.097 9.562 -9.295
168 3HZ LYS 25 3HZ LYS 25 0.568 8.972 -7.857
Start of MODEL 12
1 1H ALA 1 1HT ALA 1 -1.882 5.741 4.606
2 2H ALA 1 2HT ALA 1 -3.262 5.232 3.722
3 3H ALA 1 3HT ALA 1 -1.714 5.224 2.981
4 HA ALA 1 HA ALA 1 -0.960 3.529 4.394
5 1HB ALA 1 1HB ALA 1 -1.850 3.716 6.466
6 2HB ALA 1 2HB ALA 1 -2.964 2.504 5.833
7 3HB ALA 1 3HB ALA 1 -3.434 4.203 5.865
8 H VAL 2 H VAL 2 -1.557 1.223 4.162
9 HA VAL 2 HA VAL 2 -2.501 0.663 1.588
10 HB VAL 2 HB VAL 2 -0.986 -0.830 2.835
11 1HG1 VAL 2 1HG1 VAL 2 -1.564 -2.025 4.704
12 2HG1 VAL 2 2HG1 VAL 2 -3.288 -1.986 4.330
13 3HG1 VAL 2 3HG1 VAL 2 -2.491 -0.548 4.968
14 1HG2 VAL 2 1HG2 VAL 2 -1.747 -2.075 1.114
15 2HG2 VAL 2 2HG2 VAL 2 -3.440 -1.741 1.480
16 3HG2 VAL 2 3HG2 VAL 2 -2.567 -2.972 2.393
17 H SER 3 H SER 3 -4.141 0.785 4.675
18 HA SER 3 HA SER 3 -6.481 -0.601 4.007
19 1HB SER 3 2HB SER 3 -5.715 1.400 6.069
20 2HB SER 3 1HB SER 3 -7.438 1.166 5.783
21 HG SER 3 HG SER 3 -6.651 -0.256 7.385
22 H ALA 4 H ALA 4 -5.439 2.657 3.308
23 HA ALA 4 HA ALA 4 -8.038 3.218 2.048
24 1HB ALA 4 1HB ALA 4 -7.745 4.990 3.458
25 2HB ALA 4 2HB ALA 4 -6.950 5.619 2.014
26 3HB ALA 4 3HB ALA 4 -5.986 4.946 3.328
27 H CYS 5 H CYS 5 -5.689 1.646 0.966
28 HA CYS 5 HA CYS 5 -4.560 3.236 -1.125
29 1HB CYS 5 2HB CYS 5 -3.332 1.331 -0.264
30 2HB CYS 5 1HB CYS 5 -4.636 0.240 -0.709
31 H ALA 6 H ALA 6 -5.209 3.496 -3.187
32 HA ALA 6 HA ALA 6 -7.868 2.524 -3.878
33 1HB ALA 6 1HB ALA 6 -7.439 4.073 -5.909
34 2HB ALA 6 2HB ALA 6 -6.081 4.669 -4.954
35 3HB ALA 6 3HB ALA 6 -7.724 4.792 -4.324
36 H LEU 7 H LEU 7 -4.554 1.922 -4.640
37 HA LEU 7 HA LEU 7 -4.944 0.775 -7.212
38 1HB LEU 7 2HB LEU 7 -2.737 0.672 -5.187
39 2HB LEU 7 1HB LEU 7 -2.678 -0.335 -6.619
40 HG LEU 7 HG LEU 7 -3.208 2.522 -7.117
41 1HD1 LEU 7 1HD1 LEU 7 -0.879 1.616 -5.576
42 2HD1 LEU 7 2HD1 LEU 7 -1.587 3.224 -5.732
43 3HD1 LEU 7 3HD1 LEU 7 -0.505 2.612 -6.984
44 1HD2 LEU 7 1HD2 LEU 7 -2.839 0.674 -8.819
45 2HD2 LEU 7 2HD2 LEU 7 -1.144 0.706 -8.332
46 3HD2 LEU 7 3HD2 LEU 7 -1.889 2.144 -9.030
47 HA PRO 8 HA PRO 8 -6.653 -3.100 -5.808
48 1HB PRO 8 2HB PRO 8 -6.797 -4.345 -8.186
49 2HB PRO 8 1HB PRO 8 -7.875 -3.007 -7.769
50 1HG PRO 8 2HG PRO 8 -5.398 -2.990 -9.448
51 2HG PRO 8 1HG PRO 8 -6.949 -2.182 -9.736
52 1HD PRO 8 2HD PRO 8 -4.752 -0.919 -8.707
53 2HD PRO 8 1HD PRO 8 -6.420 -0.415 -8.373
54 H LYS 9 H LYS 9 -5.776 -4.943 -5.050
55 HA LYS 9 HA LYS 9 -4.236 -6.545 -4.563
56 1HB LYS 9 2HB LYS 9 -3.773 -6.241 -7.528
57 2HB LYS 9 1HB LYS 9 -2.941 -7.450 -6.559
58 1HG LYS 9 2HG LYS 9 -5.877 -7.383 -6.302
59 2HG LYS 9 1HG LYS 9 -5.239 -7.906 -7.862
60 1HD LYS 9 2HD LYS 9 -4.262 -9.785 -6.987
61 2HD LYS 9 1HD LYS 9 -4.044 -9.058 -5.392
62 1HE LYS 9 2HE LYS 9 -6.836 -9.427 -6.255
63 2HE LYS 9 1HE LYS 9 -5.925 -10.911 -5.975
64 1HZ LYS 9 1HZ LYS 9 -7.193 -9.596 -4.055
65 2HZ LYS 9 2HZ LYS 9 -5.679 -8.853 -3.937
66 3HZ LYS 9 3HZ LYS 9 -5.812 -10.532 -3.772
67 H CYS 10 H CYS 10 -3.505 -3.712 -4.316
68 HA CYS 10 HA CYS 10 -0.839 -3.275 -5.114
69 1HB CYS 10 2HB CYS 10 -2.586 -1.587 -4.244
70 2HB CYS 10 1HB CYS 10 -2.057 -2.073 -2.637
71 H ALA 11 H ALA 11 -2.198 -4.379 -2.016
72 HA ALA 11 HA ALA 11 0.255 -4.703 -0.684
73 1HB ALA 11 1HB ALA 11 -0.956 -5.902 0.973
74 2HB ALA 11 2HB ALA 11 -2.241 -6.303 -0.165
75 3HB ALA 11 3HB ALA 11 -2.024 -4.636 0.368
76 H ALA 12 H ALA 12 1.481 -6.563 -0.235
77 HA ALA 12 HA ALA 12 1.249 -8.661 -2.289
78 1HB ALA 12 1HB ALA 12 3.755 -8.211 -0.733
79 2HB ALA 12 2HB ALA 12 3.341 -7.119 -2.055
80 3HB ALA 12 3HB ALA 12 3.542 -8.843 -2.366
81 H ALA 13 H ALA 13 1.335 -8.029 1.118
82 HA ALA 13 HA ALA 13 0.399 -10.627 1.751
83 1HB ALA 13 1HB ALA 13 2.210 -11.640 2.766
84 2HB ALA 13 2HB ALA 13 3.085 -10.120 2.956
85 3HB ALA 13 3HB ALA 13 2.957 -10.871 1.365
86 H ALA 14 H ALA 14 -0.357 -7.904 2.212
87 HA ALA 14 HA ALA 14 -1.295 -6.644 3.857
88 1HB ALA 14 1HB ALA 14 -0.643 -8.941 5.700
89 2HB ALA 14 2HB ALA 14 -2.089 -8.837 4.695
90 3HB ALA 14 3HB ALA 14 -1.820 -7.657 5.977
91 H ASN 15 H ASN 15 1.022 -5.698 3.253
92 HA ASN 15 HA ASN 15 2.247 -5.003 5.826
93 1HB ASN 15 2HB ASN 15 3.521 -6.733 4.156
94 2HB ASN 15 1HB ASN 15 4.131 -5.194 3.555
95 1HD2 ASN 15 1HD2 ASN 15 4.911 -3.682 5.294
96 2HD2 ASN 15 2HD2 ASN 15 5.837 -4.382 6.574
97 H VAL 16 H VAL 16 1.458 -3.046 5.935
98 HA VAL 16 HA VAL 16 0.892 -1.176 4.057
99 HB VAL 16 HB VAL 16 1.790 -1.077 6.881
100 1HG1 VAL 16 1HG1 VAL 16 2.994 0.833 6.165
101 2HG1 VAL 16 2HG1 VAL 16 1.486 1.450 6.839
102 3HG1 VAL 16 3HG1 VAL 16 1.692 1.346 5.091
103 1HG2 VAL 16 1HG2 VAL 16 -0.380 0.031 7.172
104 2HG2 VAL 16 2HG2 VAL 16 -0.530 -1.514 6.335
105 3HG2 VAL 16 3HG2 VAL 16 -0.623 -0.005 5.425
106 H ALA 17 H ALA 17 4.084 -1.868 5.433
107 HA ALA 17 HA ALA 17 5.510 0.269 4.367
108 1HB ALA 17 1HB ALA 17 6.439 -1.283 6.017
109 2HB ALA 17 2HB ALA 17 7.498 -1.122 4.616
110 3HB ALA 17 3HB ALA 17 6.485 -2.555 4.795
111 H ALA 18 H ALA 18 4.976 -2.961 2.965
112 HA ALA 18 HA ALA 18 6.343 -2.513 0.558
113 1HB ALA 18 1HB ALA 18 5.255 -4.681 1.647
114 2HB ALA 18 2HB ALA 18 5.589 -4.563 -0.081
115 3HB ALA 18 3HB ALA 18 3.957 -4.275 0.523
116 H HIS 19 H HIS 19 3.267 -1.423 1.668
117 HA HIS 19 HA HIS 19 2.322 -0.782 -0.998
118 1HB HIS 19 2HB HIS 19 0.465 -1.387 0.184
119 2HB HIS 19 1HB HIS 19 1.139 -0.853 1.719
120 HD2 HIS 19 2HD HIS 19 0.248 1.504 2.619
121 HE1 HIS 19 1HE HIS 19 -1.566 2.805 -0.967
122 HE2 HIS 19 2HE HIS 19 -1.052 3.408 1.435
123 H MET 20 H MET 20 2.717 1.127 2.005
124 HA MET 20 HA MET 20 2.489 3.636 0.907
125 1HB MET 20 2HB MET 20 2.790 2.896 3.372
126 2HB MET 20 1HB MET 20 4.510 3.098 3.064
127 1HG MET 20 2HG MET 20 4.135 5.185 3.776
128 2HG MET 20 1HG MET 20 3.579 5.442 2.122
129 1HE MET 20 1HE MET 20 1.467 7.038 5.323
130 2HE MET 20 2HE MET 20 2.014 7.724 3.793
131 3HE MET 20 3HE MET 20 3.158 6.887 4.844
132 H THR 21 H THR 21 5.138 1.433 0.570
133 HA THR 21 HA THR 21 7.281 3.099 0.081
134 HB THR 21 HB THR 21 7.406 0.635 0.197
135 HG1 THR 21 1HG THR 21 8.468 1.809 -2.154
136 1HG2 THR 21 1HG2 THR 21 5.412 0.388 -1.473
137 2HG2 THR 21 2HG2 THR 21 6.707 -0.809 -1.426
138 3HG2 THR 21 3HG2 THR 21 6.696 0.429 -2.681
139 H HIS 22 H HIS 22 4.465 2.612 -1.885
140 HA HIS 22 HA HIS 22 5.668 4.339 -3.956
141 1HB HIS 22 2HB HIS 22 3.929 3.120 -5.489
142 2HB HIS 22 1HB HIS 22 5.477 2.359 -5.144
143 HD1 HIS 22 1HD HIS 22 5.201 -0.034 -4.727
144 HD2 HIS 22 2HD HIS 22 1.934 2.119 -3.287
145 HE1 HIS 22 1HE HIS 22 3.660 -1.736 -3.713
146 HE2 HIS 22 2HE HIS 22 1.816 -0.384 -2.675
147 H CYS 23 H CYS 23 2.834 3.383 -2.175
148 HA CYS 23 HA CYS 23 1.151 5.396 -3.354
149 1HB CYS 23 2HB CYS 23 0.870 3.221 -1.335
150 2HB CYS 23 1HB CYS 23 -0.331 4.498 -1.369
151 H ALA 24 H ALA 24 1.571 7.453 -2.808
152 HA ALA 24 HA ALA 24 1.247 8.289 -0.089
153 1HB ALA 24 1HB ALA 24 3.471 7.843 0.327
154 2HB ALA 24 2HB ALA 24 3.538 9.530 -0.184
155 3HB ALA 24 3HB ALA 24 3.969 8.247 -1.316
156 H LYS 25 H LYS 25 0.070 8.772 -2.712
157 HA LYS 25 HA LYS 25 0.675 11.626 -3.080
158 1HB LYS 25 2HB LYS 25 0.750 9.867 -5.015
159 2HB LYS 25 1HB LYS 25 -1.000 10.036 -4.989
160 1HG LYS 25 2HG LYS 25 -0.948 12.163 -5.800
161 2HG LYS 25 1HG LYS 25 0.632 12.512 -5.098
162 1HD LYS 25 2HD LYS 25 1.350 12.293 -7.222
163 2HD LYS 25 1HD LYS 25 1.282 10.566 -6.865
164 1HE LYS 25 2HE LYS 25 -1.071 12.068 -7.976
165 2HE LYS 25 1HE LYS 25 0.165 11.362 -9.015
166 1HZ LYS 25 1HZ LYS 25 -0.306 9.207 -7.869
167 2HZ LYS 25 2HZ LYS 25 -1.575 9.792 -8.822
168 3HZ LYS 25 3HZ LYS 25 -1.642 9.945 -7.139
Start of MODEL 13
1 1H ALA 1 1HT ALA 1 -1.207 4.793 2.947
2 2H ALA 1 2HT ALA 1 -1.731 5.339 4.487
3 3H ALA 1 3HT ALA 1 -2.881 4.857 3.308
4 HA ALA 1 HA ALA 1 -0.831 3.019 4.291
5 1HB ALA 1 1HB ALA 1 -1.981 3.903 6.256
6 2HB ALA 1 2HB ALA 1 -2.418 2.219 5.963
7 3HB ALA 1 3HB ALA 1 -3.538 3.509 5.527
8 H VAL 2 H VAL 2 -1.562 0.799 4.028
9 HA VAL 2 HA VAL 2 -2.595 0.286 1.481
10 HB VAL 2 HB VAL 2 -1.167 -1.303 2.700
11 1HG1 VAL 2 1HG1 VAL 2 -2.460 -0.904 4.892
12 2HG1 VAL 2 2HG1 VAL 2 -1.841 -2.522 4.562
13 3HG1 VAL 2 3HG1 VAL 2 -3.548 -2.160 4.301
14 1HG2 VAL 2 1HG2 VAL 2 -3.829 -2.535 2.000
15 2HG2 VAL 2 2HG2 VAL 2 -2.250 -3.322 1.970
16 3HG2 VAL 2 3HG2 VAL 2 -2.617 -2.036 0.820
17 H SER 3 H SER 3 -4.176 0.614 4.574
18 HA SER 3 HA SER 3 -6.625 -0.626 3.920
19 1HB SER 3 2HB SER 3 -5.589 0.358 6.209
20 2HB SER 3 1HB SER 3 -6.685 1.675 5.790
21 HG SER 3 HG SER 3 -7.463 -1.050 5.880
22 H ALA 4 H ALA 4 -5.339 2.563 3.313
23 HA ALA 4 HA ALA 4 -7.906 3.371 2.121
24 1HB ALA 4 1HB ALA 4 -5.646 4.938 3.302
25 2HB ALA 4 2HB ALA 4 -7.367 5.004 3.679
26 3HB ALA 4 3HB ALA 4 -6.768 5.689 2.168
27 H CYS 5 H CYS 5 -5.647 1.678 0.965
28 HA CYS 5 HA CYS 5 -4.516 3.277 -1.131
29 1HB CYS 5 2HB CYS 5 -3.299 1.351 -0.284
30 2HB CYS 5 1HB CYS 5 -4.613 0.279 -0.742
31 H ALA 6 H ALA 6 -5.170 3.499 -3.207
32 HA ALA 6 HA ALA 6 -7.862 2.567 -3.839
33 1HB ALA 6 1HB ALA 6 -7.859 4.757 -4.419
34 2HB ALA 6 2HB ALA 6 -7.252 4.102 -5.939
35 3HB ALA 6 3HB ALA 6 -6.129 4.779 -4.760
36 H LEU 7 H LEU 7 -4.569 1.933 -4.655
37 HA LEU 7 HA LEU 7 -5.004 0.791 -7.220
38 1HB LEU 7 2HB LEU 7 -2.776 0.643 -5.217
39 2HB LEU 7 1HB LEU 7 -2.747 -0.349 -6.663
40 HG LEU 7 HG LEU 7 -3.253 2.508 -7.152
41 1HD1 LEU 7 1HD1 LEU 7 -0.566 2.636 -6.978
42 2HD1 LEU 7 2HD1 LEU 7 -0.927 1.606 -5.593
43 3HD1 LEU 7 3HD1 LEU 7 -1.664 3.203 -5.719
44 1HD2 LEU 7 1HD2 LEU 7 -1.903 2.133 -9.043
45 2HD2 LEU 7 2HD2 LEU 7 -2.847 0.656 -8.844
46 3HD2 LEU 7 3HD2 LEU 7 -1.160 0.701 -8.331
47 HA PRO 8 HA PRO 8 -6.716 -3.082 -5.836
48 1HB PRO 8 2HB PRO 8 -6.827 -4.342 -8.203
49 2HB PRO 8 1HB PRO 8 -7.896 -2.985 -7.823
50 1HG PRO 8 2HG PRO 8 -5.385 -3.021 -9.451
51 2HG PRO 8 1HG PRO 8 -6.917 -2.192 -9.777
52 1HD PRO 8 2HD PRO 8 -4.714 -0.962 -8.706
53 2HD PRO 8 1HD PRO 8 -6.380 -0.416 -8.434
54 H LYS 9 H LYS 9 -5.834 -4.882 -5.003
55 HA LYS 9 HA LYS 9 -4.308 -6.483 -4.470
56 1HB LYS 9 2HB LYS 9 -3.942 -6.281 -7.448
57 2HB LYS 9 1HB LYS 9 -2.981 -7.396 -6.487
58 1HG LYS 9 2HG LYS 9 -5.425 -8.047 -5.603
59 2HG LYS 9 1HG LYS 9 -5.832 -7.502 -7.232
60 1HD LYS 9 2HD LYS 9 -4.808 -9.259 -8.213
61 2HD LYS 9 1HD LYS 9 -3.489 -9.276 -7.040
62 1HE LYS 9 2HE LYS 9 -6.284 -10.269 -6.493
63 2HE LYS 9 1HE LYS 9 -4.931 -11.300 -6.963
64 1HZ LYS 9 1HZ LYS 9 -5.582 -10.803 -4.439
65 2HZ LYS 9 2HZ LYS 9 -4.475 -9.550 -4.688
66 3HZ LYS 9 3HZ LYS 9 -4.002 -11.155 -4.931
67 H CYS 10 H CYS 10 -3.548 -3.657 -4.300
68 HA CYS 10 HA CYS 10 -0.883 -3.262 -5.124
69 1HB CYS 10 2HB CYS 10 -2.585 -1.522 -4.311
70 2HB CYS 10 1HB CYS 10 -2.113 -1.994 -2.683
71 H ALA 11 H ALA 11 -2.253 -4.366 -2.039
72 HA ALA 11 HA ALA 11 0.173 -4.625 -0.652
73 1HB ALA 11 1HB ALA 11 -1.040 -5.914 0.953
74 2HB ALA 11 2HB ALA 11 -2.301 -6.290 -0.223
75 3HB ALA 11 3HB ALA 11 -2.108 -4.638 0.365
76 H ALA 12 H ALA 12 1.442 -6.454 -0.178
77 HA ALA 12 HA ALA 12 1.343 -8.533 -2.259
78 1HB ALA 12 1HB ALA 12 3.806 -8.850 -1.456
79 2HB ALA 12 2HB ALA 12 3.602 -7.215 -0.824
80 3HB ALA 12 3HB ALA 12 3.393 -7.527 -2.548
81 H ALA 13 H ALA 13 1.330 -7.937 1.159
82 HA ALA 13 HA ALA 13 0.422 -10.551 1.749
83 1HB ALA 13 1HB ALA 13 2.520 -10.883 3.358
84 2HB ALA 13 2HB ALA 13 3.314 -9.992 2.060
85 3HB ALA 13 3HB ALA 13 2.481 -11.507 1.710
86 H ALA 14 H ALA 14 -0.356 -7.840 2.246
87 HA ALA 14 HA ALA 14 -1.325 -6.621 3.905
88 1HB ALA 14 1HB ALA 14 -0.626 -8.784 5.866
89 2HB ALA 14 2HB ALA 14 -1.936 -8.972 4.699
90 3HB ALA 14 3HB ALA 14 -1.994 -7.671 5.889
91 H ASN 15 H ASN 15 0.980 -5.634 3.313
92 HA ASN 15 HA ASN 15 2.171 -4.917 5.893
93 1HB ASN 15 2HB ASN 15 3.511 -6.697 4.464
94 2HB ASN 15 1HB ASN 15 4.007 -5.272 3.555
95 1HD2 ASN 15 1HD2 ASN 15 5.776 -6.887 4.970
96 2HD2 ASN 15 2HD2 ASN 15 6.437 -5.971 6.277
97 H VAL 16 H VAL 16 1.402 -2.954 5.966
98 HA VAL 16 HA VAL 16 0.855 -1.113 4.053
99 HB VAL 16 HB VAL 16 1.729 -0.971 6.884
100 1HG1 VAL 16 1HG1 VAL 16 1.573 1.456 5.092
101 2HG1 VAL 16 2HG1 VAL 16 2.949 0.919 6.054
102 3HG1 VAL 16 3HG1 VAL 16 1.500 1.529 6.852
103 1HG2 VAL 16 1HG2 VAL 16 -0.436 -0.368 7.293
104 2HG2 VAL 16 2HG2 VAL 16 -0.653 -1.290 5.805
105 3HG2 VAL 16 3HG2 VAL 16 -0.613 0.473 5.753
106 H ALA 17 H ALA 17 4.031 -1.803 5.459
107 HA ALA 17 HA ALA 17 5.477 0.315 4.383
108 1HB ALA 17 1HB ALA 17 6.673 -2.423 4.576
109 2HB ALA 17 2HB ALA 17 6.200 -1.548 6.033
110 3HB ALA 17 3HB ALA 17 7.401 -0.858 4.939
111 H ALA 18 H ALA 18 4.937 -2.925 3.005
112 HA ALA 18 HA ALA 18 6.320 -2.507 0.604
113 1HB ALA 18 1HB ALA 18 5.584 -4.717 1.462
114 2HB ALA 18 2HB ALA 18 5.170 -4.448 -0.231
115 3HB ALA 18 3HB ALA 18 3.930 -4.299 1.015
116 H HIS 19 H HIS 19 3.246 -1.383 1.684
117 HA HIS 19 HA HIS 19 2.324 -0.756 -0.993
118 1HB HIS 19 2HB HIS 19 0.455 -1.337 0.180
119 2HB HIS 19 1HB HIS 19 1.123 -0.799 1.716
120 HD2 HIS 19 2HD HIS 19 0.246 1.573 2.594
121 HE1 HIS 19 1HE HIS 19 -1.544 2.859 -1.010
122 HE2 HIS 19 2HE HIS 19 -1.035 3.476 1.390
123 H MET 20 H MET 20 2.706 1.175 1.998
124 HA MET 20 HA MET 20 2.508 3.676 0.883
125 1HB MET 20 2HB MET 20 2.952 2.792 3.371
126 2HB MET 20 1HB MET 20 4.577 3.345 2.988
127 1HG MET 20 2HG MET 20 3.780 5.563 2.550
128 2HG MET 20 1HG MET 20 2.106 5.042 2.731
129 1HE MET 20 1HE MET 20 2.874 7.461 5.653
130 2HE MET 20 2HE MET 20 1.360 6.736 5.111
131 3HE MET 20 3HE MET 20 2.521 7.342 3.929
132 H THR 21 H THR 21 5.145 1.453 0.579
133 HA THR 21 HA THR 21 7.299 3.100 0.083
134 HB THR 21 HB THR 21 7.408 0.636 0.222
135 HG1 THR 21 1HG THR 21 9.174 0.642 -0.929
136 1HG2 THR 21 1HG2 THR 21 5.423 0.408 -1.478
137 2HG2 THR 21 2HG2 THR 21 6.686 -0.817 -1.370
138 3HG2 THR 21 3HG2 THR 21 6.735 0.388 -2.656
139 H HIS 22 H HIS 22 4.492 2.611 -1.895
140 HA HIS 22 HA HIS 22 5.717 4.311 -3.973
141 1HB HIS 22 2HB HIS 22 3.984 3.092 -5.509
142 2HB HIS 22 1HB HIS 22 5.520 2.317 -5.140
143 HD1 HIS 22 1HD HIS 22 5.203 -0.070 -4.724
144 HD2 HIS 22 2HD HIS 22 1.966 2.136 -3.299
145 HE1 HIS 22 1HE HIS 22 3.635 -1.746 -3.707
146 HE2 HIS 22 2HE HIS 22 1.811 -0.361 -2.675
147 H CYS 23 H CYS 23 2.871 3.398 -2.191
148 HA CYS 23 HA CYS 23 1.209 5.410 -3.403
149 1HB CYS 23 2HB CYS 23 0.899 3.254 -1.369
150 2HB CYS 23 1HB CYS 23 -0.292 4.540 -1.419
151 H ALA 24 H ALA 24 1.505 7.476 -2.851
152 HA ALA 24 HA ALA 24 1.364 8.250 -0.075
153 1HB ALA 24 1HB ALA 24 3.762 9.237 -1.582
154 2HB ALA 24 2HB ALA 24 3.822 7.757 -0.625
155 3HB ALA 24 3HB ALA 24 3.439 9.293 0.151
156 H LYS 25 H LYS 25 -0.212 8.624 -2.486
157 HA LYS 25 HA LYS 25 0.106 11.482 -3.037
158 1HB LYS 25 2HB LYS 25 -1.260 9.218 -4.414
159 2HB LYS 25 1HB LYS 25 -1.908 10.836 -4.644
160 1HG LYS 25 2HG LYS 25 -0.137 11.523 -5.874
161 2HG LYS 25 1HG LYS 25 1.010 10.508 -4.995
162 1HD LYS 25 2HD LYS 25 0.628 8.690 -6.323
163 2HD LYS 25 1HD LYS 25 -1.039 9.156 -6.668
164 1HE LYS 25 2HE LYS 25 1.059 10.955 -7.704
165 2HE LYS 25 1HE LYS 25 0.971 9.359 -8.447
166 1HZ LYS 25 1HZ LYS 25 -1.087 9.770 -9.307
167 2HZ LYS 25 2HZ LYS 25 -0.454 11.338 -9.345
168 3HZ LYS 25 3HZ LYS 25 -1.510 10.882 -8.104
Start of MODEL 14
1 1H ALA 1 1HT ALA 1 -1.101 4.921 2.970
2 2H ALA 1 2HT ALA 1 -1.763 5.667 4.366
3 3H ALA 1 3HT ALA 1 -2.795 5.150 3.096
4 HA ALA 1 HA ALA 1 -1.060 3.293 4.547
5 1HB ALA 1 1HB ALA 1 -2.575 4.614 6.091
6 2HB ALA 1 2HB ALA 1 -2.748 2.859 6.133
7 3HB ALA 1 3HB ALA 1 -3.927 3.842 5.263
8 H VAL 2 H VAL 2 -1.582 1.147 4.130
9 HA VAL 2 HA VAL 2 -2.532 0.546 1.567
10 HB VAL 2 HB VAL 2 -1.019 -0.933 2.828
11 1HG1 VAL 2 1HG1 VAL 2 -2.297 -0.629 5.005
12 2HG1 VAL 2 2HG1 VAL 2 -1.703 -2.252 4.651
13 3HG1 VAL 2 3HG1 VAL 2 -3.405 -1.860 4.401
14 1HG2 VAL 2 1HG2 VAL 2 -1.867 -2.977 2.003
15 2HG2 VAL 2 2HG2 VAL 2 -2.493 -1.727 0.928
16 3HG2 VAL 2 3HG2 VAL 2 -3.537 -2.435 2.161
17 H SER 3 H SER 3 -4.174 0.763 4.641
18 HA SER 3 HA SER 3 -6.522 -0.637 3.980
19 1HB SER 3 2HB SER 3 -7.550 0.605 5.857
20 2HB SER 3 1HB SER 3 -5.973 -0.056 6.291
21 HG SER 3 HG SER 3 -5.144 1.917 6.365
22 H ALA 4 H ALA 4 -5.459 2.624 3.314
23 HA ALA 4 HA ALA 4 -8.053 3.208 2.052
24 1HB ALA 4 1HB ALA 4 -6.012 4.901 3.384
25 2HB ALA 4 2HB ALA 4 -7.773 4.981 3.452
26 3HB ALA 4 3HB ALA 4 -6.916 5.604 2.042
27 H CYS 5 H CYS 5 -5.686 1.645 0.971
28 HA CYS 5 HA CYS 5 -4.551 3.246 -1.105
29 1HB CYS 5 2HB CYS 5 -3.332 1.332 -0.259
30 2HB CYS 5 1HB CYS 5 -4.639 0.249 -0.710
31 H ALA 6 H ALA 6 -5.182 3.517 -3.174
32 HA ALA 6 HA ALA 6 -7.848 2.577 -3.881
33 1HB ALA 6 1HB ALA 6 -7.978 4.329 -5.357
34 2HB ALA 6 2HB ALA 6 -6.242 4.344 -5.663
35 3HB ALA 6 3HB ALA 6 -6.876 4.997 -4.152
36 H LEU 7 H LEU 7 -4.535 1.952 -4.640
37 HA LEU 7 HA LEU 7 -4.932 0.805 -7.209
38 1HB LEU 7 2HB LEU 7 -2.725 0.692 -5.184
39 2HB LEU 7 1HB LEU 7 -2.674 -0.322 -6.613
40 HG LEU 7 HG LEU 7 -3.184 2.539 -7.119
41 1HD1 LEU 7 1HD1 LEU 7 -0.477 2.598 -6.992
42 2HD1 LEU 7 2HD1 LEU 7 -0.862 1.621 -5.576
43 3HD1 LEU 7 3HD1 LEU 7 -1.550 3.236 -5.747
44 1HD2 LEU 7 1HD2 LEU 7 -2.831 0.673 -8.812
45 2HD2 LEU 7 2HD2 LEU 7 -1.133 0.713 -8.336
46 3HD2 LEU 7 3HD2 LEU 7 -1.886 2.145 -9.038
47 HA PRO 8 HA PRO 8 -6.667 -3.058 -5.803
48 1HB PRO 8 2HB PRO 8 -6.822 -4.303 -8.180
49 2HB PRO 8 1HB PRO 8 -7.890 -2.958 -7.762
50 1HG PRO 8 2HG PRO 8 -5.413 -2.957 -9.442
51 2HG PRO 8 1HG PRO 8 -6.960 -2.140 -9.730
52 1HD PRO 8 2HD PRO 8 -4.755 -0.891 -8.702
53 2HD PRO 8 1HD PRO 8 -6.420 -0.377 -8.368
54 H LYS 9 H LYS 9 -5.805 -4.911 -5.047
55 HA LYS 9 HA LYS 9 -4.278 -6.526 -4.563
56 1HB LYS 9 2HB LYS 9 -3.380 -6.290 -7.432
57 2HB LYS 9 1HB LYS 9 -3.289 -7.701 -6.386
58 1HG LYS 9 2HG LYS 9 -5.921 -7.360 -6.345
59 2HG LYS 9 1HG LYS 9 -5.581 -6.603 -7.903
60 1HD LYS 9 2HD LYS 9 -5.781 -8.723 -8.659
61 2HD LYS 9 1HD LYS 9 -4.099 -8.836 -8.138
62 1HE LYS 9 2HE LYS 9 -6.567 -9.784 -6.708
63 2HE LYS 9 1HE LYS 9 -5.181 -10.732 -7.243
64 1HZ LYS 9 1HZ LYS 9 -5.199 -8.717 -5.062
65 2HZ LYS 9 2HZ LYS 9 -3.820 -9.529 -5.611
66 3HZ LYS 9 3HZ LYS 9 -5.076 -10.395 -4.880
67 H CYS 10 H CYS 10 -3.528 -3.697 -4.304
68 HA CYS 10 HA CYS 10 -0.857 -3.276 -5.093
69 1HB CYS 10 2HB CYS 10 -2.601 -1.581 -4.220
70 2HB CYS 10 1HB CYS 10 -2.066 -2.070 -2.617
71 H ALA 11 H ALA 11 -2.229 -4.360 -1.993
72 HA ALA 11 HA ALA 11 0.209 -4.705 -0.650
73 1HB ALA 11 1HB ALA 11 -2.079 -4.645 0.384
74 2HB ALA 11 2HB ALA 11 -1.017 -5.918 0.989
75 3HB ALA 11 3HB ALA 11 -2.293 -6.308 -0.164
76 H ALA 12 H ALA 12 1.464 -6.540 -0.241
77 HA ALA 12 HA ALA 12 1.219 -8.648 -2.281
78 1HB ALA 12 1HB ALA 12 3.542 -8.872 -2.306
79 2HB ALA 12 2HB ALA 12 3.732 -8.046 -0.760
80 3HB ALA 12 3HB ALA 12 3.283 -7.131 -2.199
81 H ALA 13 H ALA 13 1.351 -8.000 1.120
82 HA ALA 13 HA ALA 13 0.470 -10.614 1.775
83 1HB ALA 13 1HB ALA 13 2.542 -11.540 1.720
84 2HB ALA 13 2HB ALA 13 2.600 -10.881 3.354
85 3HB ALA 13 3HB ALA 13 3.357 -10.005 2.023
86 H ALA 14 H ALA 14 -0.343 -7.907 2.229
87 HA ALA 14 HA ALA 14 -1.277 -6.645 3.874
88 1HB ALA 14 1HB ALA 14 -1.169 -7.912 6.245
89 2HB ALA 14 2HB ALA 14 -0.938 -9.279 5.156
90 3HB ALA 14 3HB ALA 14 -2.372 -8.264 5.004
91 H ASN 15 H ASN 15 1.030 -5.678 3.279
92 HA ASN 15 HA ASN 15 2.246 -4.979 5.855
93 1HB ASN 15 2HB ASN 15 3.619 -6.738 4.592
94 2HB ASN 15 1HB ASN 15 3.945 -5.474 3.410
95 1HD2 ASN 15 1HD2 ASN 15 6.176 -5.890 4.038
96 2HD2 ASN 15 2HD2 ASN 15 6.820 -5.076 5.419
97 H VAL 16 H VAL 16 1.460 -3.022 5.958
98 HA VAL 16 HA VAL 16 0.892 -1.158 4.075
99 HB VAL 16 HB VAL 16 1.795 -1.049 6.897
100 1HG1 VAL 16 1HG1 VAL 16 3.001 0.856 6.084
101 2HG1 VAL 16 2HG1 VAL 16 1.554 1.452 6.897
102 3HG1 VAL 16 3HG1 VAL 16 1.617 1.398 5.135
103 1HG2 VAL 16 1HG2 VAL 16 -0.366 -0.192 7.297
104 2HG2 VAL 16 2HG2 VAL 16 -0.565 -1.460 6.087
105 3HG2 VAL 16 3HG2 VAL 16 -0.597 0.236 5.602
106 H ALA 17 H ALA 17 4.085 -1.849 5.444
107 HA ALA 17 HA ALA 17 5.509 0.285 4.369
108 1HB ALA 17 1HB ALA 17 6.256 -2.489 5.184
109 2HB ALA 17 2HB ALA 17 6.723 -0.944 5.897
110 3HB ALA 17 3HB ALA 17 7.444 -1.467 4.374
111 H ALA 18 H ALA 18 4.967 -2.948 2.981
112 HA ALA 18 HA ALA 18 6.333 -2.515 0.571
113 1HB ALA 18 1HB ALA 18 5.345 -4.693 1.625
114 2HB ALA 18 2HB ALA 18 5.482 -4.538 -0.127
115 3HB ALA 18 3HB ALA 18 3.927 -4.279 0.662
116 H HIS 19 H HIS 19 3.259 -1.415 1.681
117 HA HIS 19 HA HIS 19 2.313 -0.780 -0.987
118 1HB HIS 19 2HB HIS 19 0.458 -1.376 0.200
119 2HB HIS 19 1HB HIS 19 1.133 -0.838 1.732
120 HD2 HIS 19 2HD HIS 19 0.245 1.523 2.624
121 HE1 HIS 19 1HE HIS 19 -1.566 2.815 -0.968
122 HE2 HIS 19 2HE HIS 19 -1.052 3.425 1.434
123 H MET 20 H MET 20 2.714 1.138 2.010
124 HA MET 20 HA MET 20 2.492 3.644 0.904
125 1HB MET 20 2HB MET 20 2.981 2.731 3.389
126 2HB MET 20 1HB MET 20 4.577 3.351 2.990
127 1HG MET 20 2HG MET 20 2.085 4.992 2.677
128 2HG MET 20 1HG MET 20 3.002 4.927 4.181
129 1HE MET 20 1HE MET 20 2.752 7.664 3.565
130 2HE MET 20 2HE MET 20 2.304 7.434 1.874
131 3HE MET 20 3HE MET 20 3.703 8.425 2.290
132 H THR 21 H THR 21 5.137 1.435 0.575
133 HA THR 21 HA THR 21 7.282 3.095 0.078
134 HB THR 21 HB THR 21 7.402 0.630 0.202
135 HG1 THR 21 1HG THR 21 9.038 1.965 -0.882
136 1HG2 THR 21 1HG2 THR 21 6.683 0.427 -2.676
137 2HG2 THR 21 2HG2 THR 21 5.409 0.375 -1.458
138 3HG2 THR 21 3HG2 THR 21 6.709 -0.816 -1.426
139 H HIS 22 H HIS 22 4.466 2.607 -1.885
140 HA HIS 22 HA HIS 22 5.670 4.324 -3.962
141 1HB HIS 22 2HB HIS 22 3.929 3.105 -5.490
142 2HB HIS 22 1HB HIS 22 5.476 2.341 -5.143
143 HD1 HIS 22 1HD HIS 22 5.193 -0.049 -4.720
144 HD2 HIS 22 2HD HIS 22 1.933 2.116 -3.285
145 HE1 HIS 22 1HE HIS 22 3.648 -1.745 -3.701
146 HE2 HIS 22 2HE HIS 22 1.808 -0.385 -2.666
147 H CYS 23 H CYS 23 2.836 3.381 -2.176
148 HA CYS 23 HA CYS 23 1.157 5.393 -3.361
149 1HB CYS 23 2HB CYS 23 0.872 3.226 -1.336
150 2HB CYS 23 1HB CYS 23 -0.326 4.503 -1.375
151 H ALA 24 H ALA 24 1.859 7.419 -2.842
152 HA ALA 24 HA ALA 24 1.448 8.283 -0.115
153 1HB ALA 24 1HB ALA 24 3.887 7.481 -0.373
154 2HB ALA 24 2HB ALA 24 3.586 9.048 0.381
155 3HB ALA 24 3HB ALA 24 4.113 8.963 -1.301
156 H LYS 25 H LYS 25 0.189 8.795 -2.646
157 HA LYS 25 HA LYS 25 0.996 11.492 -3.380
158 1HB LYS 25 2HB LYS 25 -0.833 9.435 -4.511
159 2HB LYS 25 1HB LYS 25 -1.188 11.120 -4.867
160 1HG LYS 25 2HG LYS 25 0.715 11.403 -6.115
161 2HG LYS 25 1HG LYS 25 1.580 10.107 -5.287
162 1HD LYS 25 2HD LYS 25 0.745 8.502 -6.646
163 2HD LYS 25 1HD LYS 25 -0.825 9.295 -6.789
164 1HE LYS 25 2HE LYS 25 1.436 10.701 -8.050
165 2HE LYS 25 1HE LYS 25 0.995 9.159 -8.782
166 1HZ LYS 25 1HZ LYS 25 -1.184 10.995 -8.172
167 2HZ LYS 25 2HZ LYS 25 -0.981 9.956 -9.492
168 3HZ LYS 25 3HZ LYS 25 -0.159 11.434 -9.445
Start of MODEL 15
1 1H ALA 1 1HT ALA 1 -1.129 4.939 3.216
2 2H ALA 1 2HT ALA 1 -1.610 5.691 4.681
3 3H ALA 1 3HT ALA 1 -2.776 5.338 3.472
4 HA ALA 1 HA ALA 1 -1.165 3.319 4.873
5 1HB ALA 1 1HB ALA 1 -2.456 4.112 6.604
6 2HB ALA 1 2HB ALA 1 -3.515 2.878 5.922
7 3HB ALA 1 3HB ALA 1 -3.785 4.579 5.543
8 H VAL 2 H VAL 2 -1.555 1.253 4.223
9 HA VAL 2 HA VAL 2 -2.477 0.769 1.638
10 HB VAL 2 HB VAL 2 -0.958 -0.750 2.835
11 1HG1 VAL 2 1HG1 VAL 2 -2.479 -0.554 4.970
12 2HG1 VAL 2 2HG1 VAL 2 -1.522 -2.004 4.667
13 3HG1 VAL 2 3HG1 VAL 2 -3.244 -1.988 4.287
14 1HG2 VAL 2 1HG2 VAL 2 -3.505 -1.868 1.705
15 2HG2 VAL 2 2HG2 VAL 2 -2.174 -2.912 2.205
16 3HG2 VAL 2 3HG2 VAL 2 -1.926 -1.716 0.934
17 H SER 3 H SER 3 -4.175 0.807 4.686
18 HA SER 3 HA SER 3 -6.474 -0.619 3.961
19 1HB SER 3 2HB SER 3 -5.676 0.380 6.273
20 2HB SER 3 1HB SER 3 -6.689 1.740 5.788
21 HG SER 3 HG SER 3 -7.470 -0.967 6.102
22 H ALA 4 H ALA 4 -5.476 2.658 3.297
23 HA ALA 4 HA ALA 4 -8.070 3.195 2.016
24 1HB ALA 4 1HB ALA 4 -6.899 4.740 3.823
25 2HB ALA 4 2HB ALA 4 -7.840 5.410 2.491
26 3HB ALA 4 3HB ALA 4 -6.080 5.364 2.392
27 H CYS 5 H CYS 5 -5.683 1.647 0.955
28 HA CYS 5 HA CYS 5 -4.562 3.234 -1.137
29 1HB CYS 5 2HB CYS 5 -3.332 1.334 -0.275
30 2HB CYS 5 1HB CYS 5 -4.633 0.239 -0.718
31 H ALA 6 H ALA 6 -5.200 3.491 -3.205
32 HA ALA 6 HA ALA 6 -7.858 2.526 -3.904
33 1HB ALA 6 1HB ALA 6 -7.968 4.237 -5.461
34 2HB ALA 6 2HB ALA 6 -6.216 4.325 -5.640
35 3HB ALA 6 3HB ALA 6 -6.985 4.948 -4.181
36 H LEU 7 H LEU 7 -4.542 1.912 -4.658
37 HA LEU 7 HA LEU 7 -4.932 0.750 -7.222
38 1HB LEU 7 2HB LEU 7 -2.726 0.657 -5.193
39 2HB LEU 7 1HB LEU 7 -2.668 -0.361 -6.619
40 HG LEU 7 HG LEU 7 -3.193 2.493 -7.138
41 1HD1 LEU 7 1HD1 LEU 7 -1.572 3.202 -5.756
42 2HD1 LEU 7 2HD1 LEU 7 -0.492 2.582 -7.004
43 3HD1 LEU 7 3HD1 LEU 7 -0.865 1.595 -5.591
44 1HD2 LEU 7 1HD2 LEU 7 -1.873 2.100 -9.048
45 2HD2 LEU 7 2HD2 LEU 7 -2.826 0.633 -8.827
46 3HD2 LEU 7 3HD2 LEU 7 -1.132 0.665 -8.338
47 HA PRO 8 HA PRO 8 -6.650 -3.112 -5.791
48 1HB PRO 8 2HB PRO 8 -6.801 -4.370 -8.161
49 2HB PRO 8 1HB PRO 8 -7.877 -3.029 -7.749
50 1HG PRO 8 2HG PRO 8 -5.402 -3.023 -9.434
51 2HG PRO 8 1HG PRO 8 -6.955 -2.216 -9.723
52 1HD PRO 8 2HD PRO 8 -4.756 -0.949 -8.705
53 2HD PRO 8 1HD PRO 8 -6.422 -0.443 -8.369
54 H LYS 9 H LYS 9 -5.779 -4.956 -5.027
55 HA LYS 9 HA LYS 9 -4.242 -6.560 -4.535
56 1HB LYS 9 2HB LYS 9 -3.397 -6.322 -7.424
57 2HB LYS 9 1HB LYS 9 -3.209 -7.716 -6.368
58 1HG LYS 9 2HG LYS 9 -5.864 -7.459 -6.252
59 2HG LYS 9 1HG LYS 9 -5.579 -6.758 -7.847
60 1HD LYS 9 2HD LYS 9 -5.693 -8.901 -8.535
61 2HD LYS 9 1HD LYS 9 -4.018 -8.964 -7.982
62 1HE LYS 9 2HE LYS 9 -6.404 -9.666 -6.277
63 2HE LYS 9 1HE LYS 9 -5.436 -10.844 -7.163
64 1HZ LYS 9 1HZ LYS 9 -4.631 -9.158 -4.873
65 2HZ LYS 9 2HZ LYS 9 -3.481 -9.871 -5.888
66 3HZ LYS 9 3HZ LYS 9 -4.559 -10.843 -5.020
67 H CYS 10 H CYS 10 -3.507 -3.729 -4.291
68 HA CYS 10 HA CYS 10 -0.838 -3.300 -5.089
69 1HB CYS 10 2HB CYS 10 -2.585 -1.603 -4.236
70 2HB CYS 10 1HB CYS 10 -2.059 -2.079 -2.625
71 H ALA 11 H ALA 11 -2.219 -4.421 -2.011
72 HA ALA 11 HA ALA 11 0.240 -4.733 -0.667
73 1HB ALA 11 1HB ALA 11 -2.040 -4.633 0.385
74 2HB ALA 11 2HB ALA 11 -0.980 -5.899 1.005
75 3HB ALA 11 3HB ALA 11 -2.270 -6.306 -0.126
76 H ALA 12 H ALA 12 1.551 -6.509 -0.340
77 HA ALA 12 HA ALA 12 1.260 -8.649 -2.330
78 1HB ALA 12 1HB ALA 12 3.737 -9.045 -1.576
79 2HB ALA 12 2HB ALA 12 3.607 -7.385 -0.998
80 3HB ALA 12 3HB ALA 12 3.339 -7.749 -2.702
81 H ALA 13 H ALA 13 1.340 -8.014 1.075
82 HA ALA 13 HA ALA 13 0.394 -10.610 1.707
83 1HB ALA 13 1HB ALA 13 2.442 -11.587 1.679
84 2HB ALA 13 2HB ALA 13 2.495 -10.931 3.316
85 3HB ALA 13 3HB ALA 13 3.290 -10.073 1.995
86 H ALA 14 H ALA 14 -0.358 -7.885 2.160
87 HA ALA 14 HA ALA 14 -1.297 -6.617 3.799
88 1HB ALA 14 1HB ALA 14 -1.965 -7.626 5.822
89 2HB ALA 14 2HB ALA 14 -0.659 -8.809 5.754
90 3HB ALA 14 3HB ALA 14 -2.002 -8.913 4.616
91 H ASN 15 H ASN 15 1.027 -5.681 3.212
92 HA ASN 15 HA ASN 15 2.249 -5.008 5.795
93 1HB ASN 15 2HB ASN 15 3.554 -6.753 4.291
94 2HB ASN 15 1HB ASN 15 4.035 -5.305 3.412
95 1HD2 ASN 15 1HD2 ASN 15 6.189 -5.845 4.079
96 2HD2 ASN 15 2HD2 ASN 15 6.739 -5.400 5.655
97 H VAL 16 H VAL 16 1.452 -3.054 5.922
98 HA VAL 16 HA VAL 16 0.886 -1.161 4.069
99 HB VAL 16 HB VAL 16 1.794 -1.094 6.892
100 1HG1 VAL 16 1HG1 VAL 16 3.000 0.821 6.100
101 2HG1 VAL 16 2HG1 VAL 16 1.558 1.406 6.931
102 3HG1 VAL 16 3HG1 VAL 16 1.611 1.380 5.168
103 1HG2 VAL 16 1HG2 VAL 16 -0.625 0.005 5.464
104 2HG2 VAL 16 2HG2 VAL 16 -0.376 -0.002 7.209
105 3HG2 VAL 16 3HG2 VAL 16 -0.531 -1.526 6.335
106 H ALA 17 H ALA 17 4.081 -1.846 5.448
107 HA ALA 17 HA ALA 17 5.496 0.296 4.377
108 1HB ALA 17 1HB ALA 17 7.451 -0.886 4.871
109 2HB ALA 17 2HB ALA 17 6.684 -2.451 4.596
110 3HB ALA 17 3HB ALA 17 6.275 -1.506 6.029
111 H ALA 18 H ALA 18 4.962 -2.936 2.986
112 HA ALA 18 HA ALA 18 6.340 -2.499 0.582
113 1HB ALA 18 1HB ALA 18 5.424 -4.505 -0.166
114 2HB ALA 18 2HB ALA 18 3.937 -4.282 0.756
115 3HB ALA 18 3HB ALA 18 5.437 -4.694 1.587
116 H HIS 19 H HIS 19 3.261 -1.408 1.682
117 HA HIS 19 HA HIS 19 2.319 -0.781 -0.989
118 1HB HIS 19 2HB HIS 19 0.461 -1.377 0.195
119 2HB HIS 19 1HB HIS 19 1.133 -0.834 1.728
120 HD2 HIS 19 2HD HIS 19 0.240 1.530 2.612
121 HE1 HIS 19 1HE HIS 19 -1.564 2.809 -0.988
122 HE2 HIS 19 2HE HIS 19 -1.341 3.256 1.500
123 H MET 20 H MET 20 2.712 1.144 2.005
124 HA MET 20 HA MET 20 2.486 3.648 0.891
125 1HB MET 20 2HB MET 20 2.965 2.746 3.379
126 2HB MET 20 1HB MET 20 4.566 3.358 2.985
127 1HG MET 20 2HG MET 20 3.059 5.435 2.183
128 2HG MET 20 1HG MET 20 2.053 4.801 3.486
129 1HE MET 20 1HE MET 20 3.958 7.949 4.903
130 2HE MET 20 2HE MET 20 2.651 7.461 3.824
131 3HE MET 20 3HE MET 20 4.268 7.746 3.179
132 H THR 21 H THR 21 5.135 1.441 0.572
133 HA THR 21 HA THR 21 7.280 3.105 0.078
134 HB THR 21 HB THR 21 7.401 0.640 0.211
135 HG1 THR 21 1HG THR 21 8.484 1.841 -2.115
136 1HG2 THR 21 1HG2 THR 21 6.742 0.386 -2.667
137 2HG2 THR 21 2HG2 THR 21 5.417 0.417 -1.503
138 3HG2 THR 21 3HG2 THR 21 6.675 -0.813 -1.376
139 H HIS 22 H HIS 22 4.469 2.605 -1.891
140 HA HIS 22 HA HIS 22 5.677 4.317 -3.971
141 1HB HIS 22 2HB HIS 22 3.943 3.090 -5.501
142 2HB HIS 22 1HB HIS 22 5.489 2.328 -5.145
143 HD1 HIS 22 1HD HIS 22 5.207 -0.061 -4.716
144 HD2 HIS 22 2HD HIS 22 1.940 2.107 -3.296
145 HE1 HIS 22 1HE HIS 22 3.660 -1.754 -3.696
146 HE2 HIS 22 2HE HIS 22 1.816 -0.392 -2.670
147 H CYS 23 H CYS 23 2.839 3.376 -2.188
148 HA CYS 23 HA CYS 23 1.160 5.380 -3.386
149 1HB CYS 23 2HB CYS 23 0.873 3.219 -1.354
150 2HB CYS 23 1HB CYS 23 -0.327 4.497 -1.399
151 H ALA 24 H ALA 24 1.136 7.435 -2.760
152 HA ALA 24 HA ALA 24 0.984 8.257 -0.066
153 1HB ALA 24 1HB ALA 24 3.549 9.228 -1.214
154 2HB ALA 24 2HB ALA 24 3.503 7.609 -0.514
155 3HB ALA 24 3HB ALA 24 3.073 9.009 0.470
156 H LYS 25 H LYS 25 -0.388 8.720 -2.518
157 HA LYS 25 HA LYS 25 -0.097 11.641 -2.685
158 1HB LYS 25 2HB LYS 25 0.719 10.120 -4.720
159 2HB LYS 25 1HB LYS 25 -0.994 10.172 -5.114
160 1HG LYS 25 2HG LYS 25 -0.946 12.577 -5.217
161 2HG LYS 25 1HG LYS 25 0.734 12.598 -4.677
162 1HD LYS 25 2HD LYS 25 1.138 12.733 -6.901
163 2HD LYS 25 1HD LYS 25 0.966 10.980 -6.806
164 1HE LYS 25 2HE LYS 25 -1.510 12.556 -7.194
165 2HE LYS 25 1HE LYS 25 -0.390 12.484 -8.552
166 1HZ LYS 25 1HZ LYS 25 -1.465 10.109 -7.130
167 2HZ LYS 25 2HZ LYS 25 -0.496 10.100 -8.518
168 3HZ LYS 25 3HZ LYS 25 -2.072 10.711 -8.590
Start of MODEL 16
1 1H ALA 1 1HT ALA 1 -1.264 5.082 3.297
2 2H ALA 1 2HT ALA 1 -1.791 5.664 4.823
3 3H ALA 1 3HT ALA 1 -2.940 5.248 3.617
4 HA ALA 1 HA ALA 1 -1.032 3.330 4.749
5 1HB ALA 1 1HB ALA 1 -3.566 4.380 5.854
6 2HB ALA 1 2HB ALA 1 -2.157 3.712 6.678
7 3HB ALA 1 3HB ALA 1 -3.329 2.633 5.924
8 H VAL 2 H VAL 2 -1.510 1.194 4.181
9 HA VAL 2 HA VAL 2 -2.464 0.764 1.599
10 HB VAL 2 HB VAL 2 -0.950 -0.791 2.757
11 1HG1 VAL 2 1HG1 VAL 2 -2.259 -0.641 4.943
12 2HG1 VAL 2 2HG1 VAL 2 -1.617 -2.221 4.493
13 3HG1 VAL 2 3HG1 VAL 2 -3.326 -1.862 4.248
14 1HG2 VAL 2 1HG2 VAL 2 -3.515 -1.853 1.618
15 2HG2 VAL 2 2HG2 VAL 2 -2.204 -2.929 2.103
16 3HG2 VAL 2 3HG2 VAL 2 -1.932 -1.718 0.850
17 H SER 3 H SER 3 -4.135 0.783 4.661
18 HA SER 3 HA SER 3 -6.454 -0.616 3.951
19 1HB SER 3 2HB SER 3 -6.144 1.685 5.895
20 2HB SER 3 1HB SER 3 -7.530 0.597 5.819
21 HG SER 3 HG SER 3 -5.977 -1.129 6.212
22 H ALA 4 H ALA 4 -5.439 2.661 3.296
23 HA ALA 4 HA ALA 4 -8.035 3.216 2.029
24 1HB ALA 4 1HB ALA 4 -7.786 5.025 3.366
25 2HB ALA 4 2HB ALA 4 -6.849 5.613 1.993
26 3HB ALA 4 3HB ALA 4 -6.026 4.909 3.385
27 H CYS 5 H CYS 5 -5.674 1.651 0.947
28 HA CYS 5 HA CYS 5 -4.552 3.240 -1.147
29 1HB CYS 5 2HB CYS 5 -3.327 1.334 -0.286
30 2HB CYS 5 1HB CYS 5 -4.630 0.244 -0.734
31 H ALA 6 H ALA 6 -5.185 3.478 -3.222
32 HA ALA 6 HA ALA 6 -7.854 2.528 -3.906
33 1HB ALA 6 1HB ALA 6 -7.820 4.151 -5.671
34 2HB ALA 6 2HB ALA 6 -6.093 4.426 -5.446
35 3HB ALA 6 3HB ALA 6 -7.234 4.919 -4.196
36 H LEU 7 H LEU 7 -4.543 1.901 -4.670
37 HA LEU 7 HA LEU 7 -4.944 0.733 -7.229
38 1HB LEU 7 2HB LEU 7 -2.735 0.627 -5.205
39 2HB LEU 7 1HB LEU 7 -2.686 -0.389 -6.632
40 HG LEU 7 HG LEU 7 -3.198 2.465 -7.156
41 1HD1 LEU 7 1HD1 LEU 7 -0.878 1.568 -5.594
42 2HD1 LEU 7 2HD1 LEU 7 -1.586 3.173 -5.761
43 3HD1 LEU 7 3HD1 LEU 7 -0.499 2.556 -7.004
44 1HD2 LEU 7 1HD2 LEU 7 -2.820 0.597 -8.835
45 2HD2 LEU 7 2HD2 LEU 7 -1.128 0.634 -8.338
46 3HD2 LEU 7 3HD2 LEU 7 -1.869 2.065 -9.056
47 HA PRO 8 HA PRO 8 -6.669 -3.125 -5.806
48 1HB PRO 8 2HB PRO 8 -6.796 -4.395 -8.169
49 2HB PRO 8 1HB PRO 8 -7.869 -3.045 -7.781
50 1HG PRO 8 2HG PRO 8 -5.373 -3.067 -9.433
51 2HG PRO 8 1HG PRO 8 -6.916 -2.250 -9.746
52 1HD PRO 8 2HD PRO 8 -4.717 -0.995 -8.706
53 2HD PRO 8 1HD PRO 8 -6.385 -0.470 -8.404
54 H LYS 9 H LYS 9 -5.800 -4.951 -5.004
55 HA LYS 9 HA LYS 9 -4.272 -6.552 -4.481
56 1HB LYS 9 2HB LYS 9 -3.391 -6.374 -7.361
57 2HB LYS 9 1HB LYS 9 -3.262 -7.757 -6.283
58 1HG LYS 9 2HG LYS 9 -5.921 -7.390 -6.234
59 2HG LYS 9 1HG LYS 9 -5.557 -6.780 -7.849
60 1HD LYS 9 2HD LYS 9 -5.731 -8.947 -8.440
61 2HD LYS 9 1HD LYS 9 -4.082 -9.050 -7.821
62 1HE LYS 9 2HE LYS 9 -5.490 -9.393 -5.541
63 2HE LYS 9 1HE LYS 9 -6.598 -10.107 -6.712
64 1HZ LYS 9 1HZ LYS 9 -4.800 -11.572 -5.619
65 2HZ LYS 9 2HZ LYS 9 -3.749 -10.853 -6.731
66 3HZ LYS 9 3HZ LYS 9 -5.086 -11.732 -7.279
67 H CYS 10 H CYS 10 -3.523 -3.724 -4.274
68 HA CYS 10 HA CYS 10 -0.852 -3.315 -5.075
69 1HB CYS 10 2HB CYS 10 -2.586 -1.598 -4.246
70 2HB CYS 10 1HB CYS 10 -2.079 -2.065 -2.626
71 H ALA 11 H ALA 11 -2.251 -4.462 -2.020
72 HA ALA 11 HA ALA 11 0.209 -4.749 -0.657
73 1HB ALA 11 1HB ALA 11 -2.308 -6.310 -0.115
74 2HB ALA 11 2HB ALA 11 -2.069 -4.638 0.393
75 3HB ALA 11 3HB ALA 11 -1.017 -5.909 1.019
76 H ALA 12 H ALA 12 1.581 -6.461 -0.419
77 HA ALA 12 HA ALA 12 1.263 -8.633 -2.362
78 1HB ALA 12 1HB ALA 12 3.790 -8.288 -0.848
79 2HB ALA 12 2HB ALA 12 3.374 -7.059 -2.043
80 3HB ALA 12 3HB ALA 12 3.529 -8.747 -2.530
81 H ALA 13 H ALA 13 1.355 -7.987 1.039
82 HA ALA 13 HA ALA 13 0.436 -10.592 1.681
83 1HB ALA 13 1HB ALA 13 2.256 -11.556 2.755
84 2HB ALA 13 2HB ALA 13 3.127 -10.026 2.864
85 3HB ALA 13 3HB ALA 13 2.978 -10.848 1.309
86 H ALA 14 H ALA 14 -0.356 -7.876 2.120
87 HA ALA 14 HA ALA 14 -1.301 -6.601 3.750
88 1HB ALA 14 1HB ALA 14 -1.014 -9.239 5.037
89 2HB ALA 14 2HB ALA 14 -2.434 -8.209 4.858
90 3HB ALA 14 3HB ALA 14 -1.252 -7.868 6.122
91 H ASN 15 H ASN 15 1.025 -5.659 3.195
92 HA ASN 15 HA ASN 15 2.219 -5.000 5.793
93 1HB ASN 15 2HB ASN 15 3.540 -6.735 4.286
94 2HB ASN 15 1HB ASN 15 4.035 -5.278 3.431
95 1HD2 ASN 15 1HD2 ASN 15 5.919 -4.560 4.073
96 2HD2 ASN 15 2HD2 ASN 15 6.549 -4.625 5.680
97 H VAL 16 H VAL 16 1.426 -3.046 5.925
98 HA VAL 16 HA VAL 16 0.868 -1.143 4.084
99 HB VAL 16 HB VAL 16 1.779 -1.089 6.906
100 1HG1 VAL 16 1HG1 VAL 16 2.964 0.837 6.314
101 2HG1 VAL 16 2HG1 VAL 16 1.404 1.468 6.838
102 3HG1 VAL 16 3HG1 VAL 16 1.764 1.326 5.118
103 1HG2 VAL 16 1HG2 VAL 16 -0.378 -0.305 7.345
104 2HG2 VAL 16 2HG2 VAL 16 -0.593 -1.460 6.029
105 3HG2 VAL 16 3HG2 VAL 16 -0.604 0.272 5.693
106 H ALA 17 H ALA 17 4.062 -1.824 5.469
107 HA ALA 17 HA ALA 17 5.476 0.317 4.394
108 1HB ALA 17 1HB ALA 17 6.621 -2.450 4.679
109 2HB ALA 17 2HB ALA 17 6.286 -1.412 6.065
110 3HB ALA 17 3HB ALA 17 7.449 -0.900 4.841
111 H ALA 18 H ALA 18 4.937 -2.919 3.016
112 HA ALA 18 HA ALA 18 6.327 -2.498 0.614
113 1HB ALA 18 1HB ALA 18 5.377 -4.496 -0.144
114 2HB ALA 18 2HB ALA 18 3.921 -4.279 0.826
115 3HB ALA 18 3HB ALA 18 5.447 -4.690 1.608
116 H HIS 19 H HIS 19 3.246 -1.396 1.701
117 HA HIS 19 HA HIS 19 2.312 -0.780 -0.976
118 1HB HIS 19 2HB HIS 19 0.450 -1.366 0.208
119 2HB HIS 19 1HB HIS 19 1.120 -0.815 1.738
120 HD2 HIS 19 2HD HIS 19 0.228 1.554 2.608
121 HE1 HIS 19 1HE HIS 19 -1.560 2.820 -1.006
122 HE2 HIS 19 2HE HIS 19 -1.344 3.279 1.481
123 H MET 20 H MET 20 2.701 1.160 2.008
124 HA MET 20 HA MET 20 2.487 3.657 0.882
125 1HB MET 20 2HB MET 20 2.838 2.870 3.366
126 2HB MET 20 1HB MET 20 4.526 3.227 3.028
127 1HG MET 20 2HG MET 20 4.053 5.505 2.596
128 2HG MET 20 1HG MET 20 2.315 5.208 2.575
129 1HE MET 20 1HE MET 20 1.776 6.927 5.817
130 2HE MET 20 2HE MET 20 0.909 6.004 4.590
131 3HE MET 20 3HE MET 20 2.039 7.269 4.107
132 H THR 21 H THR 21 5.130 1.443 0.584
133 HA THR 21 HA THR 21 7.280 3.100 0.088
134 HB THR 21 HB THR 21 7.396 0.635 0.235
135 HG1 THR 21 1HG THR 21 9.228 0.948 -0.700
136 1HG2 THR 21 1HG2 THR 21 6.720 0.395 -2.648
137 2HG2 THR 21 2HG2 THR 21 5.418 0.381 -1.458
138 3HG2 THR 21 3HG2 THR 21 6.703 -0.824 -1.374
139 H HIS 22 H HIS 22 4.475 2.594 -1.888
140 HA HIS 22 HA HIS 22 5.694 4.292 -3.973
141 1HB HIS 22 2HB HIS 22 3.964 3.060 -5.504
142 2HB HIS 22 1HB HIS 22 5.504 2.295 -5.136
143 HD1 HIS 22 1HD HIS 22 5.210 -0.090 -4.700
144 HD2 HIS 22 2HD HIS 22 1.950 2.099 -3.297
145 HE1 HIS 22 1HE HIS 22 3.652 -1.773 -3.677
146 HE2 HIS 22 2HE HIS 22 1.813 -0.396 -2.660
147 H CYS 23 H CYS 23 2.849 3.370 -2.193
148 HA CYS 23 HA CYS 23 1.178 5.371 -3.409
149 1HB CYS 23 2HB CYS 23 0.880 3.224 -1.365
150 2HB CYS 23 1HB CYS 23 -0.317 4.502 -1.422
151 H ALA 24 H ALA 24 1.117 7.425 -2.782
152 HA ALA 24 HA ALA 24 1.047 8.223 -0.059
153 1HB ALA 24 1HB ALA 24 3.446 9.414 -1.304
154 2HB ALA 24 2HB ALA 24 3.582 7.735 -0.782
155 3HB ALA 24 3HB ALA 24 3.131 8.985 0.377
156 H LYS 25 H LYS 25 -0.502 8.616 -2.424
157 HA LYS 25 HA LYS 25 -0.404 11.549 -2.565
158 1HB LYS 25 2HB LYS 25 0.549 10.588 -4.644
159 2HB LYS 25 1HB LYS 25 -0.961 9.725 -4.912
160 1HG LYS 25 2HG LYS 25 -2.145 11.705 -5.332
161 2HG LYS 25 1HG LYS 25 -0.866 12.713 -4.652
162 1HD LYS 25 2HD LYS 25 0.425 12.581 -6.532
163 2HD LYS 25 1HD LYS 25 -0.185 10.985 -6.972
164 1HE LYS 25 2HE LYS 25 -2.109 13.238 -7.039
165 2HE LYS 25 1HE LYS 25 -0.864 13.209 -8.286
166 1HZ LYS 25 1HZ LYS 25 -1.586 10.811 -8.641
167 2HZ LYS 25 2HZ LYS 25 -2.634 12.021 -9.188
168 3HZ LYS 25 3HZ LYS 25 -2.966 11.205 -7.743
Start of MODEL 17
1 1H ALA 1 1HT ALA 1 -0.937 4.515 3.118
2 2H ALA 1 2HT ALA 1 -1.223 5.227 4.652
3 3H ALA 1 3HT ALA 1 -2.514 5.039 3.538
4 HA ALA 1 HA ALA 1 -0.983 2.850 4.769
5 1HB ALA 1 1HB ALA 1 -2.526 4.316 6.241
6 2HB ALA 1 2HB ALA 1 -2.686 2.561 6.313
7 3HB ALA 1 3HB ALA 1 -3.836 3.514 5.376
8 H VAL 2 H VAL 2 -1.531 0.825 4.082
9 HA VAL 2 HA VAL 2 -2.506 0.486 1.489
10 HB VAL 2 HB VAL 2 -1.073 -1.163 2.624
11 1HG1 VAL 2 1HG1 VAL 2 -1.647 -2.335 4.471
12 2HG1 VAL 2 2HG1 VAL 2 -3.351 -2.417 4.024
13 3HG1 VAL 2 3HG1 VAL 2 -2.699 -0.946 4.745
14 1HG2 VAL 2 1HG2 VAL 2 -3.707 -2.235 1.621
15 2HG2 VAL 2 2HG2 VAL 2 -2.240 -3.193 1.821
16 3HG2 VAL 2 3HG2 VAL 2 -2.277 -1.868 0.657
17 H SER 3 H SER 3 -4.164 0.550 4.557
18 HA SER 3 HA SER 3 -6.560 -0.705 3.811
19 1HB SER 3 2HB SER 3 -5.916 1.373 5.901
20 2HB SER 3 1HB SER 3 -7.543 0.724 5.697
21 HG SER 3 HG SER 3 -6.926 -1.107 6.558
22 H ALA 4 H ALA 4 -5.382 2.556 3.332
23 HA ALA 4 HA ALA 4 -7.941 3.310 2.100
24 1HB ALA 4 1HB ALA 4 -7.554 5.048 3.497
25 2HB ALA 4 2HB ALA 4 -6.602 5.625 2.130
26 3HB ALA 4 3HB ALA 4 -5.805 4.817 3.481
27 H CYS 5 H CYS 5 -5.644 1.658 0.945
28 HA CYS 5 HA CYS 5 -4.532 3.273 -1.143
29 1HB CYS 5 2HB CYS 5 -3.307 1.346 -0.308
30 2HB CYS 5 1HB CYS 5 -4.614 0.271 -0.775
31 H ALA 6 H ALA 6 -5.176 3.493 -3.225
32 HA ALA 6 HA ALA 6 -7.868 2.566 -3.864
33 1HB ALA 6 1HB ALA 6 -7.665 4.138 -5.791
34 2HB ALA 6 2HB ALA 6 -6.068 4.585 -5.191
35 3HB ALA 6 3HB ALA 6 -7.499 4.904 -4.211
36 H LEU 7 H LEU 7 -4.572 1.932 -4.680
37 HA LEU 7 HA LEU 7 -5.009 0.785 -7.241
38 1HB LEU 7 2HB LEU 7 -2.780 0.635 -5.240
39 2HB LEU 7 1HB LEU 7 -2.753 -0.354 -6.687
40 HG LEU 7 HG LEU 7 -3.259 2.499 -7.181
41 1HD1 LEU 7 1HD1 LEU 7 -0.581 2.655 -6.988
42 2HD1 LEU 7 2HD1 LEU 7 -0.930 1.606 -5.613
43 3HD1 LEU 7 3HD1 LEU 7 -1.688 3.195 -5.724
44 1HD2 LEU 7 1HD2 LEU 7 -1.891 2.125 -9.059
45 2HD2 LEU 7 2HD2 LEU 7 -2.832 0.647 -8.865
46 3HD2 LEU 7 3HD2 LEU 7 -1.150 0.696 -8.337
47 HA PRO 8 HA PRO 8 -6.721 -3.086 -5.855
48 1HB PRO 8 2HB PRO 8 -6.828 -4.352 -8.219
49 2HB PRO 8 1HB PRO 8 -7.896 -2.994 -7.845
50 1HG PRO 8 2HG PRO 8 -5.381 -3.034 -9.466
51 2HG PRO 8 1HG PRO 8 -6.913 -2.205 -9.797
52 1HD PRO 8 2HD PRO 8 -4.712 -0.972 -8.725
53 2HD PRO 8 1HD PRO 8 -6.378 -0.426 -8.458
54 H LYS 9 H LYS 9 -5.839 -4.883 -5.014
55 HA LYS 9 HA LYS 9 -4.315 -6.483 -4.473
56 1HB LYS 9 2HB LYS 9 -3.559 -6.320 -7.395
57 2HB LYS 9 1HB LYS 9 -3.222 -7.656 -6.303
58 1HG LYS 9 2HG LYS 9 -6.054 -6.885 -6.568
59 2HG LYS 9 1HG LYS 9 -5.301 -7.602 -7.994
60 1HD LYS 9 2HD LYS 9 -6.235 -9.395 -6.757
61 2HD LYS 9 1HD LYS 9 -4.492 -9.457 -6.484
62 1HE LYS 9 2HE LYS 9 -6.026 -7.835 -4.564
63 2HE LYS 9 1HE LYS 9 -6.344 -9.568 -4.518
64 1HZ LYS 9 1HZ LYS 9 -4.541 -8.852 -3.017
65 2HZ LYS 9 2HZ LYS 9 -3.637 -8.362 -4.359
66 3HZ LYS 9 3HZ LYS 9 -4.031 -9.994 -4.158
67 H CYS 10 H CYS 10 -3.555 -3.657 -4.308
68 HA CYS 10 HA CYS 10 -0.888 -3.266 -5.129
69 1HB CYS 10 2HB CYS 10 -2.587 -1.521 -4.331
70 2HB CYS 10 1HB CYS 10 -2.127 -1.988 -2.698
71 H ALA 11 H ALA 11 -2.270 -4.379 -2.056
72 HA ALA 11 HA ALA 11 0.152 -4.625 -0.654
73 1HB ALA 11 1HB ALA 11 -1.067 -5.920 0.944
74 2HB ALA 11 2HB ALA 11 -2.321 -6.296 -0.236
75 3HB ALA 11 3HB ALA 11 -2.133 -4.645 0.355
76 H ALA 12 H ALA 12 1.429 -6.447 -0.178
77 HA ALA 12 HA ALA 12 1.340 -8.530 -2.256
78 1HB ALA 12 1HB ALA 12 3.821 -8.792 -1.289
79 2HB ALA 12 2HB ALA 12 3.554 -7.086 -0.934
80 3HB ALA 12 3HB ALA 12 3.409 -7.674 -2.590
81 H ALA 13 H ALA 13 1.321 -7.926 1.162
82 HA ALA 13 HA ALA 13 0.421 -10.542 1.757
83 1HB ALA 13 1HB ALA 13 3.160 -9.964 2.851
84 2HB ALA 13 2HB ALA 13 2.901 -10.901 1.379
85 3HB ALA 13 3HB ALA 13 2.250 -11.475 2.915
86 H ALA 14 H ALA 14 -0.362 -7.830 2.249
87 HA ALA 14 HA ALA 14 -1.330 -6.609 3.907
88 1HB ALA 14 1HB ALA 14 -1.891 -7.650 5.980
89 2HB ALA 14 2HB ALA 14 -0.636 -8.871 5.772
90 3HB ALA 14 3HB ALA 14 -2.046 -8.866 4.712
91 H ASN 15 H ASN 15 0.976 -5.622 3.316
92 HA ASN 15 HA ASN 15 2.168 -4.905 5.896
93 1HB ASN 15 2HB ASN 15 3.613 -6.644 4.838
94 2HB ASN 15 1HB ASN 15 3.815 -5.584 3.446
95 1HD2 ASN 15 1HD2 ASN 15 5.785 -6.650 5.331
96 2HD2 ASN 15 2HD2 ASN 15 6.594 -5.276 5.994
97 H VAL 16 H VAL 16 1.397 -2.944 5.971
98 HA VAL 16 HA VAL 16 0.846 -1.101 4.061
99 HB VAL 16 HB VAL 16 1.729 -0.961 6.889
100 1HG1 VAL 16 1HG1 VAL 16 2.948 0.930 6.061
101 2HG1 VAL 16 2HG1 VAL 16 1.497 1.540 6.858
102 3HG1 VAL 16 3HG1 VAL 16 1.570 1.466 5.098
103 1HG2 VAL 16 1HG2 VAL 16 -0.494 0.555 6.681
104 2HG2 VAL 16 2HG2 VAL 16 -0.508 -1.193 6.913
105 3HG2 VAL 16 3HG2 VAL 16 -0.705 -0.516 5.297
106 H ALA 17 H ALA 17 4.026 -1.790 5.460
107 HA ALA 17 HA ALA 17 5.468 0.327 4.376
108 1HB ALA 17 1HB ALA 17 6.699 -2.389 4.551
109 2HB ALA 17 2HB ALA 17 6.178 -1.567 6.022
110 3HB ALA 17 3HB ALA 17 7.381 -0.818 4.971
111 H ALA 18 H ALA 18 4.915 -2.913 3.010
112 HA ALA 18 HA ALA 18 6.300 -2.508 0.606
113 1HB ALA 18 1HB ALA 18 5.195 -4.654 1.710
114 2HB ALA 18 2HB ALA 18 5.519 -4.555 -0.022
115 3HB ALA 18 3HB ALA 18 3.894 -4.247 0.591
116 H HIS 19 H HIS 19 3.227 -1.377 1.685
117 HA HIS 19 HA HIS 19 2.305 -0.755 -0.994
118 1HB HIS 19 2HB HIS 19 0.435 -1.331 0.185
119 2HB HIS 19 1HB HIS 19 1.104 -0.784 1.717
120 HD2 HIS 19 2HD HIS 19 0.221 1.586 2.586
121 HE1 HIS 19 1HE HIS 19 -1.550 2.866 -1.031
122 HE2 HIS 19 2HE HIS 19 -1.343 3.318 1.459
123 H MET 20 H MET 20 2.694 1.181 1.993
124 HA MET 20 HA MET 20 2.499 3.680 0.869
125 1HB MET 20 2HB MET 20 2.886 2.846 3.357
126 2HB MET 20 1HB MET 20 4.549 3.291 3.000
127 1HG MET 20 2HG MET 20 3.982 5.542 2.639
128 2HG MET 20 1HG MET 20 2.259 5.175 2.554
129 1HE MET 20 1HE MET 20 2.761 7.401 5.783
130 2HE MET 20 2HE MET 20 2.450 7.429 4.048
131 3HE MET 20 3HE MET 20 4.108 7.369 4.646
132 H THR 21 H THR 21 5.131 1.450 0.576
133 HA THR 21 HA THR 21 7.292 3.091 0.083
134 HB THR 21 HB THR 21 7.394 0.627 0.228
135 HG1 THR 21 1HG THR 21 9.050 1.938 -0.851
136 1HG2 THR 21 1HG2 THR 21 6.744 0.357 -2.649
137 2HG2 THR 21 2HG2 THR 21 5.412 0.416 -1.493
138 3HG2 THR 21 3HG2 THR 21 6.654 -0.828 -1.347
139 H HIS 22 H HIS 22 4.488 2.605 -1.899
140 HA HIS 22 HA HIS 22 5.722 4.297 -3.980
141 1HB HIS 22 2HB HIS 22 3.990 3.078 -5.517
142 2HB HIS 22 1HB HIS 22 5.523 2.301 -5.142
143 HD1 HIS 22 1HD HIS 22 5.202 -0.085 -4.719
144 HD2 HIS 22 2HD HIS 22 1.965 2.132 -3.309
145 HE1 HIS 22 1HE HIS 22 3.628 -1.754 -3.700
146 HE2 HIS 22 2HE HIS 22 1.804 -0.362 -2.677
147 H CYS 23 H CYS 23 2.871 3.394 -2.201
148 HA CYS 23 HA CYS 23 1.216 5.408 -3.420
149 1HB CYS 23 2HB CYS 23 0.895 3.258 -1.383
150 2HB CYS 23 1HB CYS 23 -0.293 4.545 -1.441
151 H ALA 24 H ALA 24 1.267 7.469 -2.817
152 HA ALA 24 HA ALA 24 1.063 8.315 -0.134
153 1HB ALA 24 1HB ALA 24 3.363 9.606 -0.306
154 2HB ALA 24 2HB ALA 24 3.790 8.220 -1.312
155 3HB ALA 24 3HB ALA 24 3.267 7.973 0.354
156 H LYS 25 H LYS 25 -0.231 8.802 -2.620
157 HA LYS 25 HA LYS 25 0.293 11.686 -2.940
158 1HB LYS 25 2HB LYS 25 0.662 9.947 -4.921
159 2HB LYS 25 1HB LYS 25 -1.072 10.161 -5.106
160 1HG LYS 25 2HG LYS 25 -0.813 12.509 -5.467
161 2HG LYS 25 1HG LYS 25 0.904 12.430 -5.065
162 1HD LYS 25 2HD LYS 25 1.155 12.314 -7.304
163 2HD LYS 25 1HD LYS 25 0.782 10.606 -7.055
164 1HE LYS 25 2HE LYS 25 -1.706 11.575 -7.257
165 2HE LYS 25 1HE LYS 25 -0.858 12.762 -8.247
166 1HZ LYS 25 1HZ LYS 25 -0.710 9.821 -8.634
167 2HZ LYS 25 2HZ LYS 25 -0.005 11.000 -9.621
168 3HZ LYS 25 3HZ LYS 25 -1.689 10.866 -9.536
Start of MODEL 18
1 1H ALA 1 1HT ALA 1 -0.301 4.115 3.111
2 2H ALA 1 2HT ALA 1 -0.985 5.291 4.159
3 3H ALA 1 3HT ALA 1 -1.841 4.780 2.761
4 HA ALA 1 HA ALA 1 -1.056 2.884 4.840
5 1HB ALA 1 1HB ALA 1 -2.225 4.411 6.155
6 2HB ALA 1 2HB ALA 1 -3.458 3.245 5.674
7 3HB ALA 1 3HB ALA 1 -3.356 4.805 4.860
8 H VAL 2 H VAL 2 -1.540 0.905 4.171
9 HA VAL 2 HA VAL 2 -2.654 0.344 1.670
10 HB VAL 2 HB VAL 2 -1.199 -1.229 2.877
11 1HG1 VAL 2 1HG1 VAL 2 -2.599 -0.747 5.073
12 2HG1 VAL 2 2HG1 VAL 2 -1.719 -2.258 4.841
13 3HG1 VAL 2 3HG1 VAL 2 -3.457 -2.194 4.545
14 1HG2 VAL 2 1HG2 VAL 2 -3.871 -2.512 2.342
15 2HG2 VAL 2 2HG2 VAL 2 -2.269 -3.233 2.175
16 3HG2 VAL 2 3HG2 VAL 2 -2.784 -1.960 1.068
17 H SER 3 H SER 3 -4.138 0.743 4.802
18 HA SER 3 HA SER 3 -6.597 -0.511 4.321
19 1HB SER 3 2HB SER 3 -5.788 1.757 6.136
20 2HB SER 3 1HB SER 3 -7.444 1.154 6.084
21 HG SER 3 HG SER 3 -6.622 -0.910 6.640
22 H ALA 4 H ALA 4 -5.386 2.651 3.429
23 HA ALA 4 HA ALA 4 -7.972 3.250 2.149
24 1HB ALA 4 1HB ALA 4 -7.502 4.944 3.731
25 2HB ALA 4 2HB ALA 4 -7.130 5.632 2.151
26 3HB ALA 4 3HB ALA 4 -5.826 5.078 3.201
27 H CYS 5 H CYS 5 -5.763 1.580 1.087
28 HA CYS 5 HA CYS 5 -4.473 3.106 -0.968
29 1HB CYS 5 2HB CYS 5 -3.358 1.148 -0.113
30 2HB CYS 5 1HB CYS 5 -4.730 0.127 -0.518
31 H ALA 6 H ALA 6 -4.928 3.188 -3.140
32 HA ALA 6 HA ALA 6 -7.650 2.372 -3.881
33 1HB ALA 6 1HB ALA 6 -6.069 4.222 -5.585
34 2HB ALA 6 2HB ALA 6 -6.668 4.821 -4.039
35 3HB ALA 6 3HB ALA 6 -7.799 4.200 -5.241
36 H LEU 7 H LEU 7 -4.316 1.810 -4.550
37 HA LEU 7 HA LEU 7 -4.515 0.841 -7.189
38 1HB LEU 7 2HB LEU 7 -2.548 0.548 -4.968
39 2HB LEU 7 1HB LEU 7 -2.416 -0.530 -6.344
40 HG LEU 7 HG LEU 7 -2.520 2.451 -6.702
41 1HD1 LEU 7 1HD1 LEU 7 -0.423 2.740 -6.024
42 2HD1 LEU 7 2HD1 LEU 7 0.132 1.316 -6.905
43 3HD1 LEU 7 3HD1 LEU 7 -0.527 1.146 -5.277
44 1HD2 LEU 7 1HD2 LEU 7 -2.888 0.821 -8.609
45 2HD2 LEU 7 2HD2 LEU 7 -1.200 0.355 -8.404
46 3HD2 LEU 7 3HD2 LEU 7 -1.610 2.016 -8.832
47 HA PRO 8 HA PRO 8 -6.511 -3.054 -6.412
48 1HB PRO 8 2HB PRO 8 -6.217 -4.177 -8.830
49 2HB PRO 8 1HB PRO 8 -7.286 -2.792 -8.577
50 1HG PRO 8 2HG PRO 8 -4.515 -2.866 -9.702
51 2HG PRO 8 1HG PRO 8 -5.923 -1.944 -10.258
52 1HD PRO 8 2HD PRO 8 -3.915 -0.890 -8.715
53 2HD PRO 8 1HD PRO 8 -5.576 -0.269 -8.737
54 H LYS 9 H LYS 9 -5.828 -4.881 -5.474
55 HA LYS 9 HA LYS 9 -4.469 -6.553 -4.740
56 1HB LYS 9 2HB LYS 9 -3.467 -6.356 -7.584
57 2HB LYS 9 1HB LYS 9 -3.038 -7.651 -6.475
58 1HG LYS 9 2HG LYS 9 -5.796 -7.603 -6.376
59 2HG LYS 9 1HG LYS 9 -5.430 -7.280 -8.073
60 1HD LYS 9 2HD LYS 9 -5.326 -9.528 -8.215
61 2HD LYS 9 1HD LYS 9 -3.701 -9.298 -7.566
62 1HE LYS 9 2HE LYS 9 -6.190 -9.908 -5.974
63 2HE LYS 9 1HE LYS 9 -4.888 -11.038 -6.342
64 1HZ LYS 9 1HZ LYS 9 -4.846 -8.705 -4.535
65 2HZ LYS 9 2HZ LYS 9 -3.409 -9.335 -5.167
66 3HZ LYS 9 3HZ LYS 9 -4.409 -10.307 -4.210
67 H CYS 10 H CYS 10 -3.601 -3.758 -4.442
68 HA CYS 10 HA CYS 10 -0.834 -3.488 -4.860
69 1HB CYS 10 2HB CYS 10 -2.661 -1.736 -4.173
70 2HB CYS 10 1HB CYS 10 -2.201 -2.184 -2.535
71 H ALA 11 H ALA 11 -2.673 -4.562 -2.018
72 HA ALA 11 HA ALA 11 -0.525 -4.931 -0.276
73 1HB ALA 11 1HB ALA 11 -1.998 -6.340 1.017
74 2HB ALA 11 2HB ALA 11 -3.071 -6.545 -0.367
75 3HB ALA 11 3HB ALA 11 -2.904 -4.962 0.392
76 H ALA 12 H ALA 12 1.246 -6.048 -0.809
77 HA ALA 12 HA ALA 12 1.174 -8.360 -2.501
78 1HB ALA 12 1HB ALA 12 3.663 -8.444 -1.574
79 2HB ALA 12 2HB ALA 12 3.276 -6.782 -1.130
80 3HB ALA 12 3HB ALA 12 3.159 -7.295 -2.813
81 H ALA 13 H ALA 13 1.208 -7.768 0.933
82 HA ALA 13 HA ALA 13 0.421 -10.410 1.547
83 1HB ALA 13 1HB ALA 13 2.485 -10.945 2.949
84 2HB ALA 13 2HB ALA 13 3.307 -9.714 1.991
85 3HB ALA 13 3HB ALA 13 2.623 -11.134 1.200
86 H ALA 14 H ALA 14 -0.398 -7.723 2.113
87 HA ALA 14 HA ALA 14 -1.272 -6.511 3.830
88 1HB ALA 14 1HB ALA 14 -0.594 -8.488 5.915
89 2HB ALA 14 2HB ALA 14 -1.616 -9.062 4.597
90 3HB ALA 14 3HB ALA 14 -2.122 -7.679 5.568
91 H ASN 15 H ASN 15 1.023 -5.527 3.204
92 HA ASN 15 HA ASN 15 2.312 -4.928 5.770
93 1HB ASN 15 2HB ASN 15 3.576 -6.631 4.160
94 2HB ASN 15 1HB ASN 15 4.065 -5.140 3.361
95 1HD2 ASN 15 1HD2 ASN 15 5.948 -4.423 4.007
96 2HD2 ASN 15 2HD2 ASN 15 6.615 -4.580 5.593
97 H VAL 16 H VAL 16 1.535 -2.974 5.966
98 HA VAL 16 HA VAL 16 0.928 -1.041 4.164
99 HB VAL 16 HB VAL 16 1.883 -1.039 6.971
100 1HG1 VAL 16 1HG1 VAL 16 3.070 0.895 6.344
101 2HG1 VAL 16 2HG1 VAL 16 1.546 1.503 6.993
102 3HG1 VAL 16 3HG1 VAL 16 1.794 1.428 5.248
103 1HG2 VAL 16 1HG2 VAL 16 -0.332 0.441 6.974
104 2HG2 VAL 16 2HG2 VAL 16 -0.366 -1.321 6.965
105 3HG2 VAL 16 3HG2 VAL 16 -0.589 -0.427 5.461
106 H ALA 17 H ALA 17 4.144 -1.676 5.543
107 HA ALA 17 HA ALA 17 5.517 0.470 4.427
108 1HB ALA 17 1HB ALA 17 6.739 -2.259 4.727
109 2HB ALA 17 2HB ALA 17 6.346 -1.251 6.120
110 3HB ALA 17 3HB ALA 17 7.503 -0.681 4.919
111 H ALA 18 H ALA 18 5.036 -2.797 3.103
112 HA ALA 18 HA ALA 18 6.407 -2.376 0.686
113 1HB ALA 18 1HB ALA 18 5.401 -4.389 -0.081
114 2HB ALA 18 2HB ALA 18 4.068 -4.236 1.065
115 3HB ALA 18 3HB ALA 18 5.696 -4.590 1.646
116 H HIS 19 H HIS 19 3.311 -1.336 1.780
117 HA HIS 19 HA HIS 19 2.335 -0.795 -0.897
118 1HB HIS 19 2HB HIS 19 0.500 -1.413 0.308
119 2HB HIS 19 1HB HIS 19 1.168 -0.826 1.826
120 HD2 HIS 19 2HD HIS 19 0.248 1.546 2.666
121 HE1 HIS 19 1HE HIS 19 -1.667 2.683 -0.923
122 HE2 HIS 19 2HE HIS 19 -1.122 3.376 1.448
123 H MET 20 H MET 20 2.698 1.208 2.049
124 HA MET 20 HA MET 20 2.393 3.677 0.884
125 1HB MET 20 2HB MET 20 2.929 2.847 3.385
126 2HB MET 20 1HB MET 20 4.507 3.491 2.955
127 1HG MET 20 2HG MET 20 3.069 5.549 2.160
128 2HG MET 20 1HG MET 20 1.917 4.893 3.321
129 1HE MET 20 1HE MET 20 3.903 3.828 5.837
130 2HE MET 20 2HE MET 20 2.280 4.495 5.663
131 3HE MET 20 3HE MET 20 3.459 5.304 6.697
132 H THR 21 H THR 21 5.101 1.540 0.583
133 HA THR 21 HA THR 21 7.179 3.269 0.009
134 HB THR 21 HB THR 21 7.407 0.822 0.242
135 HG1 THR 21 1HG THR 21 9.099 1.908 -0.743
136 1HG2 THR 21 1HG2 THR 21 6.713 0.416 -2.611
137 2HG2 THR 21 2HG2 THR 21 5.408 0.442 -1.424
138 3HG2 THR 21 3HG2 THR 21 6.719 -0.728 -1.269
139 H HIS 22 H HIS 22 4.366 2.595 -1.898
140 HA HIS 22 HA HIS 22 5.493 4.250 -4.066
141 1HB HIS 22 2HB HIS 22 3.794 2.915 -5.529
142 2HB HIS 22 1HB HIS 22 5.348 2.192 -5.134
143 HD1 HIS 22 1HD HIS 22 5.084 -0.183 -4.615
144 HD2 HIS 22 2HD HIS 22 1.808 2.014 -3.265
145 HE1 HIS 22 1HE HIS 22 3.557 -1.846 -3.518
146 HE2 HIS 22 2HE HIS 22 1.707 -0.457 -2.537
147 H CYS 23 H CYS 23 2.713 3.321 -2.191
148 HA CYS 23 HA CYS 23 0.966 5.231 -3.454
149 1HB CYS 23 2HB CYS 23 0.756 3.128 -1.358
150 2HB CYS 23 1HB CYS 23 -0.466 4.384 -1.399
151 H ALA 24 H ALA 24 1.499 7.309 -3.019
152 HA ALA 24 HA ALA 24 0.983 8.359 -0.435
153 1HB ALA 24 1HB ALA 24 3.120 9.078 0.263
154 2HB ALA 24 2HB ALA 24 3.858 8.627 -1.274
155 3HB ALA 24 3HB ALA 24 3.300 7.375 -0.164
156 H LYS 25 H LYS 25 -0.311 9.129 -2.508
157 HA LYS 25 HA LYS 25 0.752 11.784 -3.129
158 1HB LYS 25 2HB LYS 25 1.010 9.895 -5.000
159 2HB LYS 25 1HB LYS 25 -0.650 10.367 -5.336
160 1HG LYS 25 2HG LYS 25 0.159 12.734 -5.502
161 2HG LYS 25 1HG LYS 25 1.803 12.102 -5.412
162 1HD LYS 25 2HD LYS 25 1.357 12.345 -7.711
163 2HD LYS 25 1HD LYS 25 1.175 10.620 -7.382
164 1HE LYS 25 2HE LYS 25 -1.348 11.456 -6.945
165 2HE LYS 25 1HE LYS 25 -0.841 12.631 -8.158
166 1HZ LYS 25 1HZ LYS 25 -0.791 9.674 -8.426
167 2HZ LYS 25 2HZ LYS 25 -0.159 10.747 -9.571
168 3HZ LYS 25 3HZ LYS 25 -1.817 10.747 -9.238
Start of MODEL 19
1 1H ALA 1 1HT ALA 1 -2.135 4.918 2.582
2 2H ALA 1 2HT ALA 1 -2.358 5.381 4.220
3 3H ALA 1 3HT ALA 1 -3.642 4.646 3.351
4 HA ALA 1 HA ALA 1 -1.073 3.309 3.784
5 1HB ALA 1 1HB ALA 1 -2.133 4.036 5.950
6 2HB ALA 1 2HB ALA 1 -1.895 2.299 5.764
7 3HB ALA 1 3HB ALA 1 -3.498 2.999 5.538
8 H VAL 2 H VAL 2 -1.656 0.873 3.997
9 HA VAL 2 HA VAL 2 -2.705 0.015 1.556
10 HB VAL 2 HB VAL 2 -1.150 -1.334 2.904
11 1HG1 VAL 2 1HG1 VAL 2 -1.789 -2.478 4.872
12 2HG1 VAL 2 2HG1 VAL 2 -3.485 -2.040 4.664
13 3HG1 VAL 2 3HG1 VAL 2 -2.300 -0.804 5.089
14 1HG2 VAL 2 1HG2 VAL 2 -2.196 -3.514 2.513
15 2HG2 VAL 2 2HG2 VAL 2 -2.467 -2.416 1.160
16 3HG2 VAL 2 3HG2 VAL 2 -3.762 -2.728 2.317
17 H SER 3 H SER 3 -4.252 0.594 4.624
18 HA SER 3 HA SER 3 -6.633 -0.864 4.131
19 1HB SER 3 2HB SER 3 -5.634 0.266 6.336
20 2HB SER 3 1HB SER 3 -6.722 1.567 5.851
21 HG SER 3 HG SER 3 -7.448 -1.151 6.241
22 H ALA 4 H ALA 4 -5.548 2.351 3.297
23 HA ALA 4 HA ALA 4 -8.138 2.842 1.974
24 1HB ALA 4 1HB ALA 4 -8.009 4.534 3.545
25 2HB ALA 4 2HB ALA 4 -7.328 5.303 2.110
26 3HB ALA 4 3HB ALA 4 -6.260 4.699 3.377
27 H CYS 5 H CYS 5 -5.734 1.423 0.953
28 HA CYS 5 HA CYS 5 -4.389 3.100 -0.898
29 1HB CYS 5 2HB CYS 5 -3.321 1.068 -0.250
30 2HB CYS 5 1HB CYS 5 -4.714 0.104 -0.716
31 H ALA 6 H ALA 6 -4.801 3.571 -2.997
32 HA ALA 6 HA ALA 6 -7.487 2.987 -3.965
33 1HB ALA 6 1HB ALA 6 -7.280 4.818 -5.369
34 2HB ALA 6 2HB ALA 6 -5.520 4.711 -5.417
35 3HB ALA 6 3HB ALA 6 -6.328 5.305 -3.966
36 H LEU 7 H LEU 7 -4.169 2.175 -4.598
37 HA LEU 7 HA LEU 7 -4.497 1.197 -7.240
38 1HB LEU 7 2HB LEU 7 -2.432 0.880 -5.102
39 2HB LEU 7 1HB LEU 7 -2.377 -0.173 -6.503
40 HG LEU 7 HG LEU 7 -2.479 2.808 -6.829
41 1HD1 LEU 7 1HD1 LEU 7 0.177 1.752 -7.112
42 2HD1 LEU 7 2HD1 LEU 7 -0.429 1.460 -5.483
43 3HD1 LEU 7 3HD1 LEU 7 -0.395 3.100 -6.130
44 1HD2 LEU 7 1HD2 LEU 7 -2.890 1.243 -8.747
45 2HD2 LEU 7 2HD2 LEU 7 -1.231 0.677 -8.551
46 3HD2 LEU 7 3HD2 LEU 7 -1.545 2.361 -8.971
47 HA PRO 8 HA PRO 8 -6.429 -2.706 -6.515
48 1HB PRO 8 2HB PRO 8 -5.506 -4.145 -8.609
49 2HB PRO 8 1HB PRO 8 -6.675 -2.833 -8.802
50 1HG PRO 8 2HG PRO 8 -3.714 -2.811 -9.242
51 2HG PRO 8 1HG PRO 8 -4.997 -2.101 -10.238
52 1HD PRO 8 2HD PRO 8 -3.495 -0.644 -8.502
53 2HD PRO 8 1HD PRO 8 -5.178 -0.239 -8.897
54 H LYS 9 H LYS 9 -5.929 -4.151 -5.001
55 HA LYS 9 HA LYS 9 -4.829 -5.728 -3.789
56 1HB LYS 9 2HB LYS 9 -4.009 -6.167 -6.470
57 2HB LYS 9 1HB LYS 9 -2.583 -6.341 -5.458
58 1HG LYS 9 2HG LYS 9 -3.503 -8.112 -4.255
59 2HG LYS 9 1HG LYS 9 -5.146 -7.732 -4.777
60 1HD LYS 9 2HD LYS 9 -4.386 -8.293 -7.125
61 2HD LYS 9 1HD LYS 9 -2.913 -8.937 -6.398
62 1HE LYS 9 2HE LYS 9 -5.554 -9.848 -5.361
63 2HE LYS 9 1HE LYS 9 -4.976 -10.492 -6.898
64 1HZ LYS 9 1HZ LYS 9 -3.402 -10.558 -4.383
65 2HZ LYS 9 2HZ LYS 9 -3.031 -11.332 -5.840
66 3HZ LYS 9 3HZ LYS 9 -4.361 -11.841 -4.928
67 H CYS 10 H CYS 10 -2.036 -4.425 -5.558
68 HA CYS 10 HA CYS 10 -0.190 -3.285 -4.877
69 1HB CYS 10 2HB CYS 10 -2.310 -2.103 -3.471
70 2HB CYS 10 1HB CYS 10 -1.053 -2.372 -2.269
71 H ALA 11 H ALA 11 -1.465 -4.215 -1.689
72 HA ALA 11 HA ALA 11 1.086 -5.394 -0.999
73 1HB ALA 11 1HB ALA 11 0.348 -4.378 0.880
74 2HB ALA 11 2HB ALA 11 -0.444 -5.932 1.140
75 3HB ALA 11 3HB ALA 11 -1.352 -4.583 0.454
76 H ALA 12 H ALA 12 1.551 -7.522 -0.813
77 HA ALA 12 HA ALA 12 -0.605 -9.426 -1.458
78 1HB ALA 12 1HB ALA 12 2.245 -9.314 -2.352
79 2HB ALA 12 2HB ALA 12 0.781 -9.543 -3.307
80 3HB ALA 12 3HB ALA 12 1.388 -10.855 -2.297
81 H ALA 13 H ALA 13 0.460 -8.435 1.185
82 HA ALA 13 HA ALA 13 0.333 -10.874 2.578
83 1HB ALA 13 1HB ALA 13 2.736 -10.776 1.499
84 2HB ALA 13 2HB ALA 13 2.485 -11.409 3.126
85 3HB ALA 13 3HB ALA 13 3.070 -9.761 2.901
86 H ALA 14 H ALA 14 -0.768 -8.202 2.663
87 HA ALA 14 HA ALA 14 -1.280 -6.518 4.116
88 1HB ALA 14 1HB ALA 14 -1.380 -7.253 6.525
89 2HB ALA 14 2HB ALA 14 -0.701 -8.794 5.998
90 3HB ALA 14 3HB ALA 14 -2.265 -8.261 5.381
91 H ASN 15 H ASN 15 0.984 -5.762 3.201
92 HA ASN 15 HA ASN 15 2.585 -4.996 5.551
93 1HB ASN 15 2HB ASN 15 3.541 -6.738 3.710
94 2HB ASN 15 1HB ASN 15 4.019 -5.215 2.966
95 1HD2 ASN 15 1HD2 ASN 15 6.134 -5.112 3.322
96 2HD2 ASN 15 2HD2 ASN 15 6.892 -5.217 4.871
97 H VAL 16 H VAL 16 1.732 -3.059 5.768
98 HA VAL 16 HA VAL 16 0.986 -1.193 3.903
99 HB VAL 16 HB VAL 16 1.938 -1.114 6.712
100 1HG1 VAL 16 1HG1 VAL 16 3.065 0.846 5.973
101 2HG1 VAL 16 2HG1 VAL 16 1.574 1.393 6.740
102 3HG1 VAL 16 3HG1 VAL 16 1.695 1.346 4.981
103 1HG2 VAL 16 1HG2 VAL 16 -0.248 -0.251 7.143
104 2HG2 VAL 16 2HG2 VAL 16 -0.408 -1.604 6.023
105 3HG2 VAL 16 3HG2 VAL 16 -0.526 0.052 5.428
106 H ALA 17 H ALA 17 4.220 -1.758 5.253
107 HA ALA 17 HA ALA 17 5.553 0.425 4.176
108 1HB ALA 17 1HB ALA 17 7.513 -1.380 4.087
109 2HB ALA 17 2HB ALA 17 6.360 -2.281 5.071
110 3HB ALA 17 3HB ALA 17 6.921 -0.696 5.602
111 H ALA 18 H ALA 18 5.139 -2.814 2.754
112 HA ALA 18 HA ALA 18 6.456 -2.292 0.335
113 1HB ALA 18 1HB ALA 18 5.588 -4.525 1.360
114 2HB ALA 18 2HB ALA 18 5.666 -4.336 -0.392
115 3HB ALA 18 3HB ALA 18 4.125 -4.158 0.446
116 H HIS 19 H HIS 19 3.355 -1.331 1.492
117 HA HIS 19 HA HIS 19 2.352 -0.705 -1.156
118 1HB HIS 19 2HB HIS 19 0.535 -1.390 0.040
119 2HB HIS 19 1HB HIS 19 1.209 -0.852 1.573
120 HD2 HIS 19 2HD HIS 19 0.245 1.461 2.515
121 HE1 HIS 19 1HE HIS 19 -1.680 2.727 -1.026
122 HE2 HIS 19 2HE HIS 19 -1.148 3.324 1.375
123 H MET 20 H MET 20 2.696 1.199 1.859
124 HA MET 20 HA MET 20 2.354 3.702 0.786
125 1HB MET 20 2HB MET 20 2.881 2.810 3.252
126 2HB MET 20 1HB MET 20 4.476 3.434 2.851
127 1HG MET 20 2HG MET 20 3.203 5.573 2.159
128 2HG MET 20 1HG MET 20 1.890 4.901 3.125
129 1HE MET 20 1HE MET 20 3.919 3.885 6.170
130 2HE MET 20 2HE MET 20 2.445 3.694 5.221
131 3HE MET 20 3HE MET 20 2.545 4.956 6.449
132 H THR 21 H THR 21 5.090 1.619 0.390
133 HA THR 21 HA THR 21 7.153 3.374 -0.113
134 HB THR 21 HB THR 21 7.386 0.920 -0.033
135 HG1 THR 21 1HG THR 21 8.936 2.340 -1.138
136 1HG2 THR 21 1HG2 THR 21 6.674 0.663 -2.894
137 2HG2 THR 21 2HG2 THR 21 5.364 0.659 -1.713
138 3HG2 THR 21 3HG2 THR 21 6.654 -0.538 -1.603
139 H HIS 22 H HIS 22 4.326 2.807 -2.040
140 HA HIS 22 HA HIS 22 5.426 4.605 -4.106
141 1HB HIS 22 2HB HIS 22 3.703 3.332 -5.622
142 2HB HIS 22 1HB HIS 22 5.295 2.643 -5.325
143 HD1 HIS 22 1HD HIS 22 5.165 0.240 -4.905
144 HD2 HIS 22 2HD HIS 22 1.798 2.201 -3.419
145 HE1 HIS 22 1HE HIS 22 3.733 -1.552 -3.886
146 HE2 HIS 22 2HE HIS 22 1.823 -0.310 -2.825
147 H CYS 23 H CYS 23 2.652 3.501 -2.309
148 HA CYS 23 HA CYS 23 0.870 5.455 -3.436
149 1HB CYS 23 2HB CYS 23 0.717 3.254 -1.434
150 2HB CYS 23 1HB CYS 23 -0.536 4.479 -1.431
151 H ALA 24 H ALA 24 -0.578 6.481 -1.484
152 HA ALA 24 HA ALA 24 -0.705 8.166 0.040
153 1HB ALA 24 1HB ALA 24 -0.020 6.953 1.830
154 2HB ALA 24 2HB ALA 24 1.340 8.074 1.757
155 3HB ALA 24 3HB ALA 24 1.488 6.459 1.060
156 H LYS 25 H LYS 25 -0.097 9.344 -2.078
157 HA LYS 25 HA LYS 25 2.491 10.696 -1.865
158 1HB LYS 25 2HB LYS 25 1.881 9.770 -4.054
159 2HB LYS 25 1HB LYS 25 0.425 10.758 -4.073
160 1HG LYS 25 2HG LYS 25 1.733 12.773 -4.177
161 2HG LYS 25 1HG LYS 25 3.228 11.853 -3.993
162 1HD LYS 25 2HD LYS 25 3.074 12.296 -6.293
163 2HD LYS 25 1HD LYS 25 2.533 10.626 -6.120
164 1HE LYS 25 2HE LYS 25 0.173 11.788 -5.889
165 2HE LYS 25 1HE LYS 25 0.979 13.074 -6.788
166 1HZ LYS 25 1HZ LYS 25 0.665 10.245 -7.631
167 2HZ LYS 25 2HZ LYS 25 1.591 11.388 -8.465
168 3HZ LYS 25 3HZ LYS 25 -0.081 11.600 -8.320
Start of MODEL 20
1 1H ALA 1 1HT ALA 1 -1.196 4.751 2.818
2 2H ALA 1 2HT ALA 1 -1.941 5.535 4.151
3 3H ALA 1 3HT ALA 1 -2.900 4.941 2.857
4 HA ALA 1 HA ALA 1 -1.186 3.174 4.434
5 1HB ALA 1 1HB ALA 1 -2.408 3.865 6.214
6 2HB ALA 1 2HB ALA 1 -3.569 2.719 5.543
7 3HB ALA 1 3HB ALA 1 -3.742 4.443 5.215
8 H VAL 2 H VAL 2 -1.618 1.021 4.038
9 HA VAL 2 HA VAL 2 -2.568 0.332 1.495
10 HB VAL 2 HB VAL 2 -0.982 -1.055 2.780
11 1HG1 VAL 2 1HG1 VAL 2 -2.453 -0.758 4.922
12 2HG1 VAL 2 2HG1 VAL 2 -1.510 -2.229 4.684
13 3HG1 VAL 2 3HG1 VAL 2 -3.239 -2.226 4.338
14 1HG2 VAL 2 1HG2 VAL 2 -1.846 -2.241 1.003
15 2HG2 VAL 2 2HG2 VAL 2 -3.485 -2.230 1.652
16 3HG2 VAL 2 3HG2 VAL 2 -2.265 -3.288 2.358
17 H SER 3 H SER 3 -4.186 0.560 4.579
18 HA SER 3 HA SER 3 -6.476 -0.957 4.005
19 1HB SER 3 2HB SER 3 -5.611 0.237 6.225
20 2HB SER 3 1HB SER 3 -6.742 1.484 5.696
21 HG SER 3 HG SER 3 -8.392 0.146 6.001
22 H ALA 4 H ALA 4 -5.697 2.432 3.394
23 HA ALA 4 HA ALA 4 -8.242 2.720 1.948
24 1HB ALA 4 1HB ALA 4 -7.455 4.319 3.867
25 2HB ALA 4 2HB ALA 4 -8.252 4.964 2.433
26 3HB ALA 4 3HB ALA 4 -6.497 5.053 2.580
27 H CYS 5 H CYS 5 -5.742 1.419 0.964
28 HA CYS 5 HA CYS 5 -4.458 3.113 -0.896
29 1HB CYS 5 2HB CYS 5 -3.356 1.096 -0.260
30 2HB CYS 5 1HB CYS 5 -4.733 0.110 -0.728
31 H ALA 6 H ALA 6 -4.861 3.573 -3.002
32 HA ALA 6 HA ALA 6 -7.541 2.968 -3.976
33 1HB ALA 6 1HB ALA 6 -7.265 5.181 -4.374
34 2HB ALA 6 2HB ALA 6 -6.555 4.580 -5.871
35 3HB ALA 6 3HB ALA 6 -5.513 5.047 -4.527
36 H LEU 7 H LEU 7 -4.213 2.194 -4.611
37 HA LEU 7 HA LEU 7 -4.528 1.213 -7.251
38 1HB LEU 7 2HB LEU 7 -2.466 0.908 -5.111
39 2HB LEU 7 1HB LEU 7 -2.402 -0.146 -6.510
40 HG LEU 7 HG LEU 7 -2.526 2.833 -6.846
41 1HD1 LEU 7 1HD1 LEU 7 0.144 1.819 -7.110
42 2HD1 LEU 7 2HD1 LEU 7 -0.465 1.497 -5.487
43 3HD1 LEU 7 3HD1 LEU 7 -0.456 3.146 -6.115
44 1HD2 LEU 7 1HD2 LEU 7 -2.909 1.274 -8.763
45 2HD2 LEU 7 2HD2 LEU 7 -1.259 0.694 -8.546
46 3HD2 LEU 7 3HD2 LEU 7 -1.552 2.379 -8.975
47 HA PRO 8 HA PRO 8 -6.439 -2.703 -6.549
48 1HB PRO 8 2HB PRO 8 -5.478 -4.137 -8.631
49 2HB PRO 8 1HB PRO 8 -6.658 -2.838 -8.839
50 1HG PRO 8 2HG PRO 8 -3.692 -2.786 -9.247
51 2HG PRO 8 1HG PRO 8 -4.973 -2.090 -10.257
52 1HD PRO 8 2HD PRO 8 -3.505 -0.616 -8.510
53 2HD PRO 8 1HD PRO 8 -5.189 -0.231 -8.918
54 H LYS 9 H LYS 9 -5.948 -4.141 -5.031
55 HA LYS 9 HA LYS 9 -4.856 -5.696 -3.788
56 1HB LYS 9 2HB LYS 9 -4.530 -6.868 -5.909
57 2HB LYS 9 1HB LYS 9 -3.083 -5.921 -6.227
58 1HG LYS 9 2HG LYS 9 -1.829 -7.060 -4.681
59 2HG LYS 9 1HG LYS 9 -3.237 -7.529 -3.725
60 1HD LYS 9 2HD LYS 9 -2.666 -8.593 -6.486
61 2HD LYS 9 1HD LYS 9 -2.143 -9.395 -5.003
62 1HE LYS 9 2HE LYS 9 -4.988 -8.643 -5.110
63 2HE LYS 9 1HE LYS 9 -4.489 -9.888 -6.255
64 1HZ LYS 9 1HZ LYS 9 -4.128 -9.959 -3.308
65 2HZ LYS 9 2HZ LYS 9 -3.540 -11.129 -4.377
66 3HZ LYS 9 3HZ LYS 9 -5.208 -10.897 -4.211
67 H CYS 10 H CYS 10 -2.062 -4.394 -5.566
68 HA CYS 10 HA CYS 10 -0.215 -3.257 -4.887
69 1HB CYS 10 2HB CYS 10 -2.334 -2.089 -3.462
70 2HB CYS 10 1HB CYS 10 -1.064 -2.355 -2.272
71 H ALA 11 H ALA 11 -1.475 -4.199 -1.697
72 HA ALA 11 HA ALA 11 1.078 -5.355 -1.000
73 1HB ALA 11 1HB ALA 11 0.418 -5.153 1.146
74 2HB ALA 11 2HB ALA 11 -1.205 -5.759 0.816
75 3HB ALA 11 3HB ALA 11 -0.800 -4.079 0.458
76 H ALA 12 H ALA 12 1.553 -7.492 -0.696
77 HA ALA 12 HA ALA 12 -0.539 -9.430 -1.443
78 1HB ALA 12 1HB ALA 12 1.600 -10.770 -2.233
79 2HB ALA 12 2HB ALA 12 2.253 -9.142 -2.416
80 3HB ALA 12 3HB ALA 12 0.791 -9.609 -3.286
81 H ALA 13 H ALA 13 0.510 -8.449 1.212
82 HA ALA 13 HA ALA 13 0.440 -10.910 2.573
83 1HB ALA 13 1HB ALA 13 2.691 -11.189 1.669
84 2HB ALA 13 2HB ALA 13 2.723 -11.032 3.426
85 3HB ALA 13 3HB ALA 13 3.182 -9.665 2.409
86 H ALA 14 H ALA 14 -0.719 -8.263 2.695
87 HA ALA 14 HA ALA 14 -1.264 -6.611 4.172
88 1HB ALA 14 1HB ALA 14 -0.497 -8.344 6.459
89 2HB ALA 14 2HB ALA 14 -1.736 -8.930 5.350
90 3HB ALA 14 3HB ALA 14 -1.962 -7.398 6.195
91 H ASN 15 H ASN 15 0.982 -5.794 3.266
92 HA ASN 15 HA ASN 15 2.549 -4.997 5.625
93 1HB ASN 15 2HB ASN 15 3.566 -6.760 3.854
94 2HB ASN 15 1HB ASN 15 4.017 -5.256 3.057
95 1HD2 ASN 15 1HD2 ASN 15 4.892 -3.586 4.735
96 2HD2 ASN 15 2HD2 ASN 15 6.119 -4.203 5.783
97 H VAL 16 H VAL 16 1.700 -3.060 5.808
98 HA VAL 16 HA VAL 16 0.948 -1.230 3.910
99 HB VAL 16 HB VAL 16 1.892 -1.099 6.719
100 1HG1 VAL 16 1HG1 VAL 16 3.012 0.853 5.891
101 2HG1 VAL 16 2HG1 VAL 16 1.560 1.390 6.736
102 3HG1 VAL 16 3HG1 VAL 16 1.590 1.348 4.973
103 1HG2 VAL 16 1HG2 VAL 16 -0.318 -0.051 7.034
104 2HG2 VAL 16 2HG2 VAL 16 -0.417 -1.624 6.241
105 3HG2 VAL 16 3HG2 VAL 16 -0.590 -0.146 5.294
106 H ALA 17 H ALA 17 4.183 -1.788 5.250
107 HA ALA 17 HA ALA 17 5.517 0.392 4.169
108 1HB ALA 17 1HB ALA 17 6.970 -2.185 4.168
109 2HB ALA 17 2HB ALA 17 6.282 -1.660 5.704
110 3HB ALA 17 3HB ALA 17 7.426 -0.625 4.849
111 H ALA 18 H ALA 18 5.088 -2.846 2.748
112 HA ALA 18 HA ALA 18 6.398 -2.333 0.326
113 1HB ALA 18 1HB ALA 18 5.637 -4.574 1.272
114 2HB ALA 18 2HB ALA 18 5.459 -4.338 -0.468
115 3HB ALA 18 3HB ALA 18 4.055 -4.197 0.589
116 H HIS 19 H HIS 19 3.303 -1.355 1.490
117 HA HIS 19 HA HIS 19 2.303 -0.712 -1.156
118 1HB HIS 19 2HB HIS 19 0.484 -1.391 0.041
119 2HB HIS 19 1HB HIS 19 1.161 -0.859 1.575
120 HD2 HIS 19 2HD HIS 19 0.205 1.453 2.523
121 HE1 HIS 19 1HE HIS 19 -1.700 2.747 -1.018
122 HE2 HIS 19 2HE HIS 19 -1.172 3.331 1.386
123 H MET 20 H MET 20 2.653 1.178 1.865
124 HA MET 20 HA MET 20 2.333 3.688 0.802
125 1HB MET 20 2HB MET 20 2.887 2.755 3.266
126 2HB MET 20 1HB MET 20 4.452 3.443 2.859
127 1HG MET 20 2HG MET 20 2.927 5.494 2.141
128 2HG MET 20 1HG MET 20 1.857 4.777 3.344
129 1HE MET 20 1HE MET 20 2.262 6.857 5.614
130 2HE MET 20 2HE MET 20 2.145 7.238 3.896
131 3HE MET 20 3HE MET 20 3.453 7.919 4.863
132 H THR 21 H THR 21 5.056 1.587 0.405
133 HA THR 21 HA THR 21 7.133 3.331 -0.087
134 HB THR 21 HB THR 21 7.347 0.874 -0.017
135 HG1 THR 21 1HG THR 21 8.326 2.154 -2.347
136 1HG2 THR 21 1HG2 THR 21 6.641 0.637 -2.881
137 2HG2 THR 21 2HG2 THR 21 5.328 0.635 -1.702
138 3HG2 THR 21 3HG2 THR 21 6.611 -0.571 -1.596
139 H HIS 22 H HIS 22 4.305 2.793 -2.021
140 HA HIS 22 HA HIS 22 5.422 4.591 -4.078
141 1HB HIS 22 2HB HIS 22 3.692 3.337 -5.602
142 2HB HIS 22 1HB HIS 22 5.280 2.637 -5.308
143 HD1 HIS 22 1HD HIS 22 5.138 0.233 -4.893
144 HD2 HIS 22 2HD HIS 22 1.777 2.205 -3.409
145 HE1 HIS 22 1HE HIS 22 3.696 -1.554 -3.881
146 HE2 HIS 22 2HE HIS 22 1.789 -0.307 -2.823
147 H CYS 23 H CYS 23 2.635 3.497 -2.295
148 HA CYS 23 HA CYS 23 0.870 5.469 -3.415
149 1HB CYS 23 2HB CYS 23 0.698 3.263 -1.420
150 2HB CYS 23 1HB CYS 23 -0.547 4.496 -1.417
151 H ALA 24 H ALA 24 1.409 7.523 -2.872
152 HA ALA 24 HA ALA 24 1.032 8.330 -0.133
153 1HB ALA 24 1HB ALA 24 3.130 8.928 0.463
154 2HB ALA 24 2HB ALA 24 3.598 9.342 -1.186
155 3HB ALA 24 3HB ALA 24 3.572 7.654 -0.674
156 H LYS 25 H LYS 25 -0.214 8.813 -2.710
157 HA LYS 25 HA LYS 25 0.406 11.630 -3.217
158 1HB LYS 25 2HB LYS 25 -0.934 9.466 -4.758
159 2HB LYS 25 1HB LYS 25 -1.467 11.116 -5.047
160 1HG LYS 25 2HG LYS 25 0.552 11.758 -5.942
161 2HG LYS 25 1HG LYS 25 1.447 10.487 -5.106
162 1HD LYS 25 2HD LYS 25 1.332 9.971 -7.463
163 2HD LYS 25 1HD LYS 25 0.353 8.813 -6.561
164 1HE LYS 25 2HE LYS 25 -1.538 10.609 -7.075
165 2HE LYS 25 1HE LYS 25 -0.477 10.955 -8.440
166 1HZ LYS 25 1HZ LYS 25 -1.090 8.152 -7.923
167 2HZ LYS 25 2HZ LYS 25 -0.903 8.965 -9.393
168 3HZ LYS 25 3HZ LYS 25 -2.350 9.105 -8.529