NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | stage | position | program | type |
|
|
12629 |
1t9e   |
cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 H GLY 1 7.200 -1.937 1.886
2 1HA GLY 1 2HA GLY 1 6.347 -1.390 4.064
3 2HA GLY 1 1HA GLY 1 7.314 0.078 4.031
4 H ARG 2 H ARG 2 6.161 -0.089 1.034
5 HA ARG 2 HA ARG 2 4.319 2.023 1.348
6 1HB ARG 2 2HB ARG 2 5.736 1.178 -0.700
7 2HB ARG 2 1HB ARG 2 4.291 0.242 -1.051
8 1HG ARG 2 2HG ARG 2 2.982 2.195 -1.321
9 2HG ARG 2 1HG ARG 2 4.264 3.221 -0.666
10 1HD ARG 2 2HD ARG 2 4.204 1.756 -3.291
11 2HD ARG 2 1HD ARG 2 4.369 3.491 -3.008
12 HE ARG 2 HE ARG 2 6.509 2.093 -1.780
13 1HH1 ARG 2 1HH1 ARG 2 5.370 3.087 -4.946
14 2HH1 ARG 2 2HH1 ARG 2 6.951 3.079 -5.648
15 1HH2 ARG 2 1HH2 ARG 2 8.550 2.070 -2.667
16 2HH2 ARG 2 2HH2 ARG 2 8.786 2.494 -4.340
17 1HN ABA 3 H ABU 3 2.068 2.067 1.201
18 HA ABA 3 HA ABU 3 0.665 -0.499 1.140
19 1HB ABA 3 1HB ABU 3 -0.449 1.358 3.118
20 2HB ABA 3 2HB ABU 3 1.159 0.771 3.538
21 1HG ABA 3 1HG1 ABU 3 -1.396 -0.716 3.290
22 2HG ABA 3 2HG1 ABU 3 -0.137 -0.823 4.519
23 3HG ABA 3 3HG1 ABU 3 0.112 -1.557 2.936
24 H THR 4 H THR 4 -1.169 -0.419 -0.022
25 HA THR 4 HA THR 4 -1.798 2.005 -1.407
26 HB THR 4 HB THR 4 -3.587 0.703 -2.491
27 HG1 THR 4 1HG THR 4 -4.378 -0.910 -1.396
28 1HG2 THR 4 1HG2 THR 4 -1.640 -1.356 -2.790
29 2HG2 THR 4 2HG2 THR 4 -0.801 0.183 -2.602
30 3HG2 THR 4 3HG2 THR 4 -2.003 -0.016 -3.878
31 H LYS 5 H LYS 5 -3.613 3.281 -1.228
32 HA LYS 5 HA LYS 5 -4.867 3.338 1.363
33 1HB LYS 5 2HB LYS 5 -5.969 5.405 0.497
34 2HB LYS 5 1HB LYS 5 -4.213 5.453 0.420
35 1HG LYS 5 2HG LYS 5 -4.272 4.980 -1.955
36 2HG LYS 5 1HG LYS 5 -6.030 4.825 -1.901
37 1HD LYS 5 2HD LYS 5 -6.191 7.174 -1.175
38 2HD LYS 5 1HD LYS 5 -4.436 7.316 -1.299
39 1HE LYS 5 2HE LYS 5 -4.554 6.823 -3.684
40 2HE LYS 5 1HE LYS 5 -6.303 6.636 -3.569
41 1HZ LYS 5 1HZ LYS 5 -4.693 9.063 -3.574
42 2HZ LYS 5 2HZ LYS 5 -6.044 9.060 -2.559
43 3HZ LYS 5 3HZ LYS 5 -6.234 8.783 -4.216
44 H SER 6 H SER 6 -5.531 1.030 0.224
45 HA SER 6 HA SER 6 -8.378 1.372 -0.438
46 1HB SER 6 2HB SER 6 -8.155 -0.652 -1.900
47 2HB SER 6 1HB SER 6 -7.236 0.735 -2.483
48 HG SER 6 HG SER 6 -6.344 -1.685 -1.410
49 H ILE 7 H ILE 7 -9.382 -1.029 -0.261
50 HA ILE 7 HA ILE 7 -8.340 -2.331 2.149
51 HB ILE 7 HB ILE 7 -11.245 -1.560 1.759
52 1HG1 ILE 7 2HG1 ILE 7 -9.244 -0.623 3.832
53 2HG1 ILE 7 1HG1 ILE 7 -9.799 0.327 2.457
54 1HG2 ILE 7 1HG2 ILE 7 -11.086 -2.421 4.308
55 2HG2 ILE 7 2HG2 ILE 7 -9.889 -3.470 3.548
56 3HG2 ILE 7 3HG2 ILE 7 -11.547 -3.450 2.951
57 1HD1 ILE 7 1HD1 ILE 7 -10.913 0.189 5.021
58 2HD1 ILE 7 2HD1 ILE 7 -12.053 -0.616 3.943
59 3HD1 ILE 7 3HD1 ILE 7 -11.541 1.041 3.611
60 HA PRO 8 HA PRO 8 -7.948 -4.107 2.910
61 1HB PRO 8 2HB PRO 8 -6.320 -6.172 2.293
62 2HB PRO 8 1HB PRO 8 -7.929 -6.410 2.985
63 1HG PRO 8 2HG PRO 8 -7.040 -6.629 0.137
64 2HG PRO 8 1HG PRO 8 -8.136 -7.681 1.051
65 1HD PRO 8 2HD PRO 8 -8.999 -5.764 -0.685
66 2HD PRO 8 1HD PRO 8 -9.935 -6.292 0.727
67 HA PRO 9 HA PRO 9 -4.730 -1.698 1.031
68 1HB PRO 9 2HB PRO 9 -3.099 -1.440 3.191
69 2HB PRO 9 1HB PRO 9 -4.608 -0.539 3.008
70 1HG PRO 9 2HG PRO 9 -4.054 -3.005 4.605
71 2HG PRO 9 1HG PRO 9 -5.028 -1.587 5.035
72 1HD PRO 9 2HD PRO 9 -6.114 -3.925 4.176
73 2HD PRO 9 1HD PRO 9 -6.863 -2.345 3.875
74 H ILE 10 H ILE 10 -3.223 -2.433 -0.308
75 HA ILE 10 HA ILE 10 -1.894 -4.946 0.172
76 HB ILE 10 HB ILE 10 -1.500 -2.957 -2.074
77 1HG1 ILE 10 2HG1 ILE 10 -3.792 -3.792 -2.027
78 2HG1 ILE 10 1HG1 ILE 10 -2.923 -4.485 -3.392
79 1HG2 ILE 10 1HG2 ILE 10 -0.152 -4.460 -3.150
80 2HG2 ILE 10 2HG2 ILE 10 -0.856 -5.850 -2.325
81 3HG2 ILE 10 3HG2 ILE 10 0.279 -4.802 -1.475
82 1HD1 ILE 10 1HD1 ILE 10 -2.576 -6.289 -1.288
83 2HD1 ILE 10 2HD1 ILE 10 -3.598 -6.479 -2.713
84 3HD1 ILE 10 3HD1 ILE 10 -4.270 -5.797 -1.231
85 1HN ABA 11 H ABU 11 0.023 -5.191 1.123
86 HA ABA 11 HA ABU 11 1.598 -2.788 1.687
87 1HB ABA 11 1HB ABU 11 2.281 -5.394 2.949
88 2HB ABA 11 2HB ABU 11 0.766 -4.637 3.434
89 1HG ABA 11 1HG1 ABU 11 3.476 -3.341 3.568
90 2HG ABA 11 2HG1 ABU 11 2.609 -4.058 4.926
91 3HG ABA 11 3HG1 ABU 11 1.951 -2.639 4.110
92 H PHE 12 H PHE 12 3.442 -2.434 0.705
93 HA PHE 12 HA PHE 12 4.566 -4.502 -1.025
94 1HB PHE 12 2HB PHE 12 5.097 -1.528 -0.819
95 2HB PHE 12 1HB PHE 12 5.950 -2.605 -1.920
96 HD1 PHE 12 1HD PHE 12 5.223 -2.655 -4.082
97 HD2 PHE 12 2HD PHE 12 2.420 -1.751 -1.011
98 HE1 PHE 12 1HE PHE 12 3.481 -2.301 -5.783
99 HE2 PHE 12 2HE PHE 12 0.671 -1.401 -2.704
100 HZ PHE 12 HZ PHE 12 1.201 -1.674 -5.095
101 HA PRO 13 HA PRO 13 8.021 -5.554 1.492
102 1HB PRO 13 2HB PRO 13 9.797 -4.907 -0.803
103 2HB PRO 13 1HB PRO 13 9.650 -6.405 0.122
104 1HG PRO 13 2HG PRO 13 8.636 -6.226 -2.330
105 2HG PRO 13 1HG PRO 13 7.771 -7.100 -1.052
106 1HD PRO 13 2HD PRO 13 7.252 -4.376 -2.175
107 2HD PRO 13 1HD PRO 13 6.097 -5.628 -1.674
108 H ASP 14 H ASP 14 8.235 -2.531 -0.295
109 HA ASP 14 HA ASP 14 10.438 -1.515 1.258
110 1HB ASP 14 2HB ASP 14 10.233 0.485 -0.036
111 2HB ASP 14 1HB ASP 14 9.964 -0.863 -1.134
Start of MODEL 2
1 1H GLY 1 H GLY 1 7.145 -1.453 1.500
2 1HA GLY 1 2HA GLY 1 6.640 -0.945 3.994
3 2HA GLY 1 1HA GLY 1 7.571 0.506 3.645
4 H ARG 2 H ARG 2 6.340 0.277 0.812
5 HA ARG 2 HA ARG 2 4.376 2.243 1.143
6 1HB ARG 2 2HB ARG 2 5.627 0.934 -1.018
7 2HB ARG 2 1HB ARG 2 3.896 0.740 -1.261
8 1HG ARG 2 2HG ARG 2 4.598 2.717 -2.394
9 2HG ARG 2 1HG ARG 2 3.644 3.200 -0.989
10 1HD ARG 2 2HD ARG 2 5.605 4.610 -1.184
11 2HD ARG 2 1HD ARG 2 5.727 3.603 0.258
12 HE ARG 2 HE ARG 2 7.565 2.569 -0.638
13 1HH1 ARG 2 1HH1 ARG 2 5.954 4.374 -3.188
14 2HH1 ARG 2 2HH1 ARG 2 7.177 4.032 -4.364
15 1HH2 ARG 2 1HH2 ARG 2 9.140 2.117 -2.150
16 2HH2 ARG 2 2HH2 ARG 2 9.012 2.738 -3.774
17 1HN ABA 3 H ABU 3 2.118 2.202 0.951
18 HA ABA 3 HA ABU 3 0.763 -0.367 0.992
19 1HB ABA 3 1HB ABU 3 -0.069 1.521 3.141
20 2HB ABA 3 2HB ABU 3 1.414 0.608 3.403
21 1HG ABA 3 1HG1 ABU 3 -1.371 -0.426 3.039
22 2HG ABA 3 2HG1 ABU 3 -0.268 -0.666 4.395
23 3HG ABA 3 3HG1 ABU 3 0.045 -1.461 2.851
24 H THR 4 H THR 4 -1.086 -0.249 -0.129
25 HA THR 4 HA THR 4 -1.861 2.279 -1.261
26 HB THR 4 HB THR 4 -3.591 0.971 -2.458
27 HG1 THR 4 1HG THR 4 -4.187 -0.849 -1.580
28 1HG2 THR 4 1HG2 THR 4 -2.116 -0.156 -3.908
29 2HG2 THR 4 2HG2 THR 4 -0.973 -0.505 -2.610
30 3HG2 THR 4 3HG2 THR 4 -1.156 1.145 -3.204
31 H LYS 5 H LYS 5 -3.734 3.424 -0.888
32 HA LYS 5 HA LYS 5 -4.960 3.045 1.690
33 1HB LYS 5 2HB LYS 5 -6.121 5.151 1.232
34 2HB LYS 5 1HB LYS 5 -4.399 5.305 0.920
35 1HG LYS 5 2HG LYS 5 -4.770 5.167 -1.458
36 2HG LYS 5 1HG LYS 5 -6.490 4.858 -1.202
37 1HD LYS 5 2HD LYS 5 -6.556 7.095 0.005
38 2HD LYS 5 1HD LYS 5 -4.948 7.385 -0.662
39 1HE LYS 5 2HE LYS 5 -6.619 8.402 -2.083
40 2HE LYS 5 1HE LYS 5 -5.854 7.056 -2.929
41 1HZ LYS 5 1HZ LYS 5 -7.952 5.860 -1.743
42 2HZ LYS 5 2HZ LYS 5 -7.955 6.438 -3.334
43 3HZ LYS 5 3HZ LYS 5 -8.598 7.385 -2.089
44 H SER 6 H SER 6 -5.491 0.880 0.197
45 HA SER 6 HA SER 6 -8.313 1.171 -0.593
46 1HB SER 6 2HB SER 6 -7.917 -0.941 -1.906
47 2HB SER 6 1HB SER 6 -6.978 0.440 -2.471
48 HG SER 6 HG SER 6 -6.134 -1.872 -1.117
49 H ILE 7 H ILE 7 -9.277 -1.282 -0.446
50 HA ILE 7 HA ILE 7 -8.531 -2.446 2.133
51 HB ILE 7 HB ILE 7 -11.378 -1.712 1.398
52 1HG1 ILE 7 2HG1 ILE 7 -9.636 -0.677 3.648
53 2HG1 ILE 7 1HG1 ILE 7 -10.005 0.210 2.174
54 1HG2 ILE 7 1HG2 ILE 7 -11.441 -2.462 4.008
55 2HG2 ILE 7 2HG2 ILE 7 -10.228 -3.565 3.360
56 3HG2 ILE 7 3HG2 ILE 7 -11.843 -3.517 2.652
57 1HD1 ILE 7 1HD1 ILE 7 -12.162 -0.763 4.010
58 2HD1 ILE 7 2HD1 ILE 7 -12.245 0.491 2.772
59 3HD1 ILE 7 3HD1 ILE 7 -11.340 0.777 4.259
60 HA PRO 8 HA PRO 8 -7.980 -4.173 2.857
61 1HB PRO 8 2HB PRO 8 -6.312 -6.259 1.688
62 2HB PRO 8 1HB PRO 8 -7.254 -6.295 3.180
63 1HG PRO 8 2HG PRO 8 -7.908 -7.763 0.998
64 2HG PRO 8 1HG PRO 8 -9.115 -7.147 2.142
65 1HD PRO 8 2HD PRO 8 -8.317 -6.065 -0.539
66 2HD PRO 8 1HD PRO 8 -9.938 -6.236 0.171
67 HA PRO 9 HA PRO 9 -4.810 -1.646 1.060
68 1HB PRO 9 2HB PRO 9 -3.277 -1.944 3.532
69 2HB PRO 9 1HB PRO 9 -4.073 -0.510 2.882
70 1HG PRO 9 2HG PRO 9 -4.965 -1.797 5.087
71 2HG PRO 9 1HG PRO 9 -6.047 -0.951 3.967
72 1HD PRO 9 2HD PRO 9 -5.480 -3.881 4.206
73 2HD PRO 9 1HD PRO 9 -7.024 -3.051 3.917
74 H ILE 10 H ILE 10 -3.261 -2.249 -0.317
75 HA ILE 10 HA ILE 10 -1.907 -4.776 -0.001
76 HB ILE 10 HB ILE 10 -1.503 -2.635 -2.102
77 1HG1 ILE 10 2HG1 ILE 10 -3.154 -5.170 -2.223
78 2HG1 ILE 10 1HG1 ILE 10 -3.814 -3.549 -2.033
79 1HG2 ILE 10 1HG2 ILE 10 0.211 -4.625 -1.557
80 2HG2 ILE 10 2HG2 ILE 10 -0.064 -4.007 -3.186
81 3HG2 ILE 10 3HG2 ILE 10 -0.885 -5.472 -2.649
82 1HD1 ILE 10 1HD1 ILE 10 -2.263 -4.561 -4.405
83 2HD1 ILE 10 2HD1 ILE 10 -2.918 -2.933 -4.218
84 3HD1 ILE 10 3HD1 ILE 10 -4.007 -4.317 -4.323
85 1HN ABA 11 H ABU 11 -0.053 -5.039 1.049
86 HA ABA 11 HA ABU 11 1.535 -2.663 1.697
87 1HB ABA 11 1HB ABU 11 2.126 -5.305 2.939
88 2HB ABA 11 2HB ABU 11 0.626 -4.506 3.400
89 1HG ABA 11 1HG1 ABU 11 2.744 -2.606 3.488
90 2HG ABA 11 2HG1 ABU 11 3.215 -4.047 4.388
91 3HG ABA 11 3HG1 ABU 11 1.724 -3.201 4.798
92 H PHE 12 H PHE 12 3.380 -2.308 0.723
93 HA PHE 12 HA PHE 12 4.522 -4.349 -1.007
94 1HB PHE 12 2HB PHE 12 5.151 -1.412 -0.636
95 2HB PHE 12 1HB PHE 12 6.043 -2.467 -1.722
96 HD1 PHE 12 1HD PHE 12 5.504 -2.261 -3.924
97 HD2 PHE 12 2HD PHE 12 2.447 -1.688 -1.020
98 HE1 PHE 12 1HE PHE 12 3.891 -1.783 -5.719
99 HE2 PHE 12 2HE PHE 12 0.828 -1.214 -2.810
100 HZ PHE 12 HZ PHE 12 1.549 -1.261 -5.164
101 HA PRO 13 HA PRO 13 7.661 -5.741 1.743
102 1HB PRO 13 2HB PRO 13 9.537 -5.430 -0.545
103 2HB PRO 13 1HB PRO 13 9.208 -6.846 0.460
104 1HG PRO 13 2HG PRO 13 8.247 -6.695 -2.014
105 2HG PRO 13 1HG PRO 13 7.274 -7.387 -0.702
106 1HD PRO 13 2HD PRO 13 7.078 -4.702 -1.999
107 2HD PRO 13 1HD PRO 13 5.785 -5.774 -1.421
108 H ASP 14 H ASP 14 8.291 -2.858 -0.171
109 HA ASP 14 HA ASP 14 10.588 -2.070 1.352
110 1HB ASP 14 2HB ASP 14 10.729 -0.206 -0.040
111 2HB ASP 14 1HB ASP 14 9.984 -1.411 -1.082
Start of MODEL 3
1 1H GLY 1 H GLY 1 7.098 -1.615 1.622
2 1HA GLY 1 2HA GLY 1 6.506 -1.090 3.999
3 2HA GLY 1 1HA GLY 1 7.450 0.377 3.777
4 H ARG 2 H ARG 2 6.166 0.075 0.882
5 HA ARG 2 HA ARG 2 4.253 2.124 1.242
6 1HB ARG 2 2HB ARG 2 5.621 1.062 -0.886
7 2HB ARG 2 1HB ARG 2 3.981 0.511 -1.194
8 1HG ARG 2 2HG ARG 2 4.480 2.631 -2.310
9 2HG ARG 2 1HG ARG 2 3.167 2.787 -1.141
10 1HD ARG 2 2HD ARG 2 4.852 4.650 -1.112
11 2HD ARG 2 1HD ARG 2 4.583 3.855 0.438
12 HE ARG 2 HE ARG 2 6.732 2.565 -0.780
13 1HH1 ARG 2 1HH1 ARG 2 5.998 5.775 0.431
14 2HH1 ARG 2 2HH1 ARG 2 7.634 6.111 0.884
15 1HH2 ARG 2 1HH2 ARG 2 8.849 2.978 -0.184
16 2HH2 ARG 2 2HH2 ARG 2 9.277 4.509 0.530
17 1HN ABA 3 H ABU 3 1.993 2.075 1.035
18 HA ABA 3 HA ABU 3 0.666 -0.517 1.034
19 1HB ABA 3 1HB ABU 3 -0.288 1.358 3.127
20 2HB ABA 3 2HB ABU 3 1.241 0.548 3.449
21 1HG ABA 3 1HG1 ABU 3 -0.698 -1.334 2.488
22 2HG ABA 3 2HG1 ABU 3 -1.325 -0.441 3.875
23 3HG ABA 3 3HG1 ABU 3 0.200 -1.319 4.005
24 H THR 4 H THR 4 -1.233 -0.445 -0.044
25 HA THR 4 HA THR 4 -1.941 1.987 -1.368
26 HB THR 4 HB THR 4 -3.755 0.708 -2.401
27 HG1 THR 4 1HG THR 4 -4.561 -0.857 -1.238
28 1HG2 THR 4 1HG2 THR 4 -2.263 -1.265 -3.240
29 2HG2 THR 4 2HG2 THR 4 -1.004 -0.460 -2.301
30 3HG2 THR 4 3HG2 THR 4 -1.813 0.399 -3.613
31 H LYS 5 H LYS 5 -3.696 3.298 -1.062
32 HA LYS 5 HA LYS 5 -4.914 3.224 1.563
33 1HB LYS 5 2HB LYS 5 -4.054 5.342 0.451
34 2HB LYS 5 1HB LYS 5 -5.417 5.222 -0.650
35 1HG LYS 5 2HG LYS 5 -6.959 5.383 1.245
36 2HG LYS 5 1HG LYS 5 -5.585 5.523 2.341
37 1HD LYS 5 2HD LYS 5 -6.216 7.436 0.093
38 2HD LYS 5 1HD LYS 5 -6.600 7.708 1.794
39 1HE LYS 5 2HE LYS 5 -4.213 7.601 2.343
40 2HE LYS 5 1HE LYS 5 -3.837 7.340 0.642
41 1HZ LYS 5 1HZ LYS 5 -4.481 9.781 2.027
42 2HZ LYS 5 2HZ LYS 5 -5.334 9.584 0.579
43 3HZ LYS 5 3HZ LYS 5 -3.642 9.549 0.574
44 H SER 6 H SER 6 -5.654 1.043 0.288
45 HA SER 6 HA SER 6 -8.515 1.407 -0.111
46 1HB SER 6 2HB SER 6 -8.426 -0.026 -2.182
47 2HB SER 6 1HB SER 6 -7.687 1.564 -2.389
48 HG SER 6 HG SER 6 -6.505 -0.962 -2.309
49 H ILE 7 H ILE 7 -9.624 -0.299 0.770
50 HA ILE 7 HA ILE 7 -8.027 -2.382 2.019
51 HB ILE 7 HB ILE 7 -10.182 -3.045 3.108
52 1HG1 ILE 7 2HG1 ILE 7 -11.221 -0.504 1.826
53 2HG1 ILE 7 1HG1 ILE 7 -11.692 -2.134 1.358
54 1HG2 ILE 7 1HG2 ILE 7 -8.452 -0.979 3.679
55 2HG2 ILE 7 2HG2 ILE 7 -9.639 -1.676 4.780
56 3HG2 ILE 7 3HG2 ILE 7 -10.043 -0.238 3.843
57 1HD1 ILE 7 1HD1 ILE 7 -12.417 -0.567 3.774
58 2HD1 ILE 7 2HD1 ILE 7 -12.344 -2.326 3.891
59 3HD1 ILE 7 3HD1 ILE 7 -13.425 -1.562 2.724
60 HA PRO 8 HA PRO 8 -7.915 -4.386 2.696
61 1HB PRO 8 2HB PRO 8 -6.438 -6.415 1.216
62 2HB PRO 8 1HB PRO 8 -7.445 -6.604 2.653
63 1HG PRO 8 2HG PRO 8 -8.149 -7.582 0.222
64 2HG PRO 8 1HG PRO 8 -9.334 -7.055 1.430
65 1HD PRO 8 2HD PRO 8 -8.321 -5.607 -0.993
66 2HD PRO 8 1HD PRO 8 -9.978 -5.720 -0.356
67 HA PRO 9 HA PRO 9 -4.657 -1.701 1.257
68 1HB PRO 9 2HB PRO 9 -3.414 -2.369 3.863
69 2HB PRO 9 1HB PRO 9 -3.853 -0.793 3.194
70 1HG PRO 9 2HG PRO 9 -5.273 -1.890 5.169
71 2HG PRO 9 1HG PRO 9 -6.060 -0.969 3.873
72 1HD PRO 9 2HD PRO 9 -5.875 -3.935 4.249
73 2HD PRO 9 1HD PRO 9 -7.247 -2.952 3.696
74 H ILE 10 H ILE 10 -3.275 -2.459 -0.206
75 HA ILE 10 HA ILE 10 -1.884 -4.959 0.158
76 HB ILE 10 HB ILE 10 -1.581 -2.887 -2.028
77 1HG1 ILE 10 2HG1 ILE 10 -3.855 -3.777 -1.952
78 2HG1 ILE 10 1HG1 ILE 10 -3.007 -4.389 -3.367
79 1HG2 ILE 10 1HG2 ILE 10 -0.942 -5.555 -2.837
80 2HG2 ILE 10 2HG2 ILE 10 0.005 -5.130 -1.410
81 3HG2 ILE 10 3HG2 ILE 10 0.076 -4.114 -2.850
82 1HD1 ILE 10 1HD1 ILE 10 -4.234 -5.822 -1.192
83 2HD1 ILE 10 2HD1 ILE 10 -2.545 -6.288 -1.392
84 3HD1 ILE 10 3HD1 ILE 10 -3.661 -6.413 -2.752
85 1HN ABA 11 H ABU 11 -0.024 -5.155 1.201
86 HA ABA 11 HA ABU 11 1.563 -2.751 1.705
87 1HB ABA 11 1HB ABU 11 2.228 -5.330 3.030
88 2HB ABA 11 2HB ABU 11 0.714 -4.554 3.488
89 1HG ABA 11 1HG1 ABU 11 1.748 -2.958 4.652
90 2HG ABA 11 2HG1 ABU 11 3.008 -2.747 3.436
91 3HG ABA 11 3HG1 ABU 11 3.130 -4.053 4.616
92 H PHE 12 H PHE 12 3.408 -2.418 0.723
93 HA PHE 12 HA PHE 12 4.542 -4.525 -0.950
94 1HB PHE 12 2HB PHE 12 5.117 -1.555 -0.785
95 2HB PHE 12 1HB PHE 12 5.952 -2.665 -1.864
96 HD1 PHE 12 1HD PHE 12 2.449 -1.686 -0.989
97 HD2 PHE 12 2HD PHE 12 5.222 -2.779 -4.026
98 HE1 PHE 12 1HE PHE 12 0.711 -1.339 -2.694
99 HE2 PHE 12 2HE PHE 12 3.490 -2.434 -5.737
100 HZ PHE 12 HZ PHE 12 1.231 -1.713 -5.073
101 HA PRO 13 HA PRO 13 7.872 -5.587 1.724
102 1HB PRO 13 2HB PRO 13 9.696 -5.200 -0.590
103 2HB PRO 13 1HB PRO 13 9.464 -6.617 0.439
104 1HG PRO 13 2HG PRO 13 8.480 -6.566 -2.032
105 2HG PRO 13 1HG PRO 13 7.562 -7.300 -0.703
106 1HD PRO 13 2HD PRO 13 7.188 -4.645 -2.026
107 2HD PRO 13 1HD PRO 13 5.970 -5.797 -1.443
108 H ASP 14 H ASP 14 8.242 -2.712 -0.261
109 HA ASP 14 HA ASP 14 10.516 -1.698 1.154
110 1HB ASP 14 2HB ASP 14 10.355 0.212 -0.220
111 2HB ASP 14 1HB ASP 14 9.802 -1.114 -1.239
Start of MODEL 4
1 1H GLY 1 H GLY 1 7.128 -1.773 1.761
2 1HA GLY 1 2HA GLY 1 6.591 -1.128 4.101
3 2HA GLY 1 1HA GLY 1 7.497 0.346 3.792
4 H ARG 2 H ARG 2 6.295 0.348 1.003
5 HA ARG 2 HA ARG 2 4.257 2.205 1.459
6 1HB ARG 2 2HB ARG 2 5.600 1.097 -0.768
7 2HB ARG 2 1HB ARG 2 3.880 0.925 -1.080
8 1HG ARG 2 2HG ARG 2 4.884 3.016 -1.970
9 2HG ARG 2 1HG ARG 2 3.529 3.275 -0.870
10 1HD ARG 2 2HD ARG 2 5.566 4.775 -0.572
11 2HD ARG 2 1HD ARG 2 4.938 3.981 0.871
12 HE ARG 2 HE ARG 2 6.903 2.317 -0.206
13 1HH1 ARG 2 1HH1 ARG 2 6.728 5.540 1.181
14 2HH1 ARG 2 2HH1 ARG 2 8.303 5.449 1.894
15 1HH2 ARG 2 1HH2 ARG 2 8.928 2.180 0.737
16 2HH2 ARG 2 2HH2 ARG 2 9.570 3.516 1.643
17 1HN ABA 3 H ABU 3 2.014 2.123 1.202
18 HA ABA 3 HA ABU 3 0.736 -0.493 1.053
19 1HB ABA 3 1HB ABU 3 -0.421 1.219 3.146
20 2HB ABA 3 2HB ABU 3 1.195 0.629 3.522
21 1HG ABA 3 1HG1 ABU 3 -1.159 -0.708 3.956
22 2HG ABA 3 2HG1 ABU 3 0.456 -1.420 3.943
23 3HG ABA 3 3HG1 ABU 3 -0.535 -1.454 2.485
24 H THR 4 H THR 4 -1.084 -0.403 -0.138
25 HA THR 4 HA THR 4 -1.802 2.058 -1.382
26 HB THR 4 HB THR 4 -3.585 0.776 -2.493
27 HG1 THR 4 1HG THR 4 -4.336 -0.912 -1.489
28 1HG2 THR 4 1HG2 THR 4 -1.638 -1.243 -2.926
29 2HG2 THR 4 2HG2 THR 4 -0.788 0.276 -2.644
30 3HG2 THR 4 3HG2 THR 4 -1.996 0.167 -3.924
31 H LYS 5 H LYS 5 -3.655 3.284 -1.151
32 HA LYS 5 HA LYS 5 -4.867 3.219 1.469
33 1HB LYS 5 2HB LYS 5 -5.277 5.097 -0.865
34 2HB LYS 5 1HB LYS 5 -5.989 5.305 0.728
35 1HG LYS 5 2HG LYS 5 -3.738 5.471 1.696
36 2HG LYS 5 1HG LYS 5 -3.048 5.315 0.080
37 1HD LYS 5 2HD LYS 5 -3.132 7.653 0.757
38 2HD LYS 5 1HD LYS 5 -4.213 7.361 -0.607
39 1HE LYS 5 2HE LYS 5 -5.255 8.799 1.076
40 2HE LYS 5 1HE LYS 5 -6.121 7.274 0.901
41 1HZ LYS 5 1HZ LYS 5 -4.232 6.864 2.876
42 2HZ LYS 5 2HZ LYS 5 -5.905 7.012 3.075
43 3HZ LYS 5 3HZ LYS 5 -4.914 8.376 3.209
44 H SER 6 H SER 6 -5.514 0.953 0.185
45 HA SER 6 HA SER 6 -8.365 1.308 -0.462
46 1HB SER 6 2HB SER 6 -8.117 -0.715 -1.926
47 2HB SER 6 1HB SER 6 -7.193 0.678 -2.492
48 HG SER 6 HG SER 6 -6.299 -1.725 -1.347
49 H ILE 7 H ILE 7 -9.431 -1.031 -0.257
50 HA ILE 7 HA ILE 7 -8.402 -2.352 2.155
51 HB ILE 7 HB ILE 7 -11.276 -1.521 1.689
52 1HG1 ILE 7 2HG1 ILE 7 -9.795 0.255 2.572
53 2HG1 ILE 7 1HG1 ILE 7 -11.033 -0.220 3.727
54 1HG2 ILE 7 1HG2 ILE 7 -10.836 -3.852 2.697
55 2HG2 ILE 7 2HG2 ILE 7 -11.958 -2.772 3.523
56 3HG2 ILE 7 3HG2 ILE 7 -10.313 -2.966 4.129
57 1HD1 ILE 7 1HD1 ILE 7 -9.417 -0.445 5.223
58 2HD1 ILE 7 2HD1 ILE 7 -8.172 -0.242 3.991
59 3HD1 ILE 7 3HD1 ILE 7 -8.846 -1.840 4.308
60 HA PRO 8 HA PRO 8 -7.951 -4.098 2.890
61 1HB PRO 8 2HB PRO 8 -6.286 -6.141 2.289
62 2HB PRO 8 1HB PRO 8 -7.896 -6.403 2.974
63 1HG PRO 8 2HG PRO 8 -6.985 -6.617 0.132
64 2HG PRO 8 1HG PRO 8 -8.069 -7.684 1.044
65 1HD PRO 8 2HD PRO 8 -8.953 -5.786 -0.704
66 2HD PRO 8 1HD PRO 8 -9.890 -6.332 0.699
67 HA PRO 9 HA PRO 9 -4.711 -1.699 1.050
68 1HB PRO 9 2HB PRO 9 -3.160 -1.977 3.501
69 2HB PRO 9 1HB PRO 9 -3.979 -0.551 2.861
70 1HG PRO 9 2HG PRO 9 -4.809 -1.860 5.091
71 2HG PRO 9 1HG PRO 9 -5.909 -0.979 4.017
72 1HD PRO 9 2HD PRO 9 -5.386 -3.920 4.201
73 2HD PRO 9 1HD PRO 9 -6.922 -3.060 3.954
74 H ILE 10 H ILE 10 -3.203 -2.365 -0.330
75 HA ILE 10 HA ILE 10 -1.885 -4.907 0.024
76 HB ILE 10 HB ILE 10 -1.479 -2.809 -2.122
77 1HG1 ILE 10 2HG1 ILE 10 -3.146 -5.336 -2.192
78 2HG1 ILE 10 1HG1 ILE 10 -3.799 -3.713 -1.997
79 1HG2 ILE 10 1HG2 ILE 10 -0.900 -5.432 -3.024
80 2HG2 ILE 10 2HG2 ILE 10 -0.037 -5.184 -1.506
81 3HG2 ILE 10 3HG2 ILE 10 0.201 -4.065 -2.848
82 1HD1 ILE 10 1HD1 ILE 10 -2.409 -4.862 -4.398
83 2HD1 ILE 10 2HD1 ILE 10 -2.766 -3.145 -4.210
84 3HD1 ILE 10 3HD1 ILE 10 -4.082 -4.319 -4.262
85 1HN ABA 11 H ABU 11 -0.047 -5.161 1.104
86 HA ABA 11 HA ABU 11 1.544 -2.796 1.738
87 1HB ABA 11 1HB ABU 11 2.148 -5.488 2.887
88 2HB ABA 11 2HB ABU 11 0.696 -4.650 3.425
89 1HG ABA 11 1HG1 ABU 11 2.686 -2.727 3.558
90 2HG ABA 11 2HG1 ABU 11 3.450 -4.207 4.142
91 3HG ABA 11 3HG1 ABU 11 1.973 -3.616 4.906
92 H PHE 12 H PHE 12 3.362 -2.372 0.746
93 HA PHE 12 HA PHE 12 4.536 -4.350 -1.043
94 1HB PHE 12 2HB PHE 12 5.067 -1.399 -0.634
95 2HB PHE 12 1HB PHE 12 5.982 -2.405 -1.748
96 HD1 PHE 12 1HD PHE 12 5.401 -2.214 -3.940
97 HD2 PHE 12 2HD PHE 12 2.378 -1.731 -0.986
98 HE1 PHE 12 1HE PHE 12 3.751 -1.765 -5.708
99 HE2 PHE 12 2HE PHE 12 0.721 -1.284 -2.748
100 HZ PHE 12 HZ PHE 12 1.407 -1.299 -5.113
101 HA PRO 13 HA PRO 13 7.789 -5.617 1.651
102 1HB PRO 13 2HB PRO 13 9.633 -5.211 -0.646
103 2HB PRO 13 1HB PRO 13 9.355 -6.656 0.333
104 1HG PRO 13 2HG PRO 13 8.388 -6.486 -2.141
105 2HG PRO 13 1HG PRO 13 7.446 -7.248 -0.845
106 1HD PRO 13 2HD PRO 13 7.139 -4.540 -2.074
107 2HD PRO 13 1HD PRO 13 5.892 -5.683 -1.531
108 H ASP 14 H ASP 14 8.224 -2.735 -0.291
109 HA ASP 14 HA ASP 14 10.493 -1.758 1.155
110 1HB ASP 14 2HB ASP 14 10.235 0.261 -0.167
111 2HB ASP 14 1HB ASP 14 10.042 -1.149 -1.203
Start of MODEL 5
1 1H GLY 1 H GLY 1 6.984 -1.302 1.788
2 1HA GLY 1 2HA GLY 1 6.509 -0.577 4.293
3 2HA GLY 1 1HA GLY 1 7.415 0.822 3.739
4 H ARG 2 H ARG 2 6.237 0.419 0.985
5 HA ARG 2 HA ARG 2 4.142 2.275 1.217
6 1HB ARG 2 2HB ARG 2 5.465 0.845 -0.910
7 2HB ARG 2 1HB ARG 2 3.732 0.912 -1.200
8 1HG ARG 2 2HG ARG 2 4.769 2.789 -2.257
9 2HG ARG 2 1HG ARG 2 3.817 3.366 -0.888
10 1HD ARG 2 2HD ARG 2 5.920 4.524 -0.909
11 2HD ARG 2 1HD ARG 2 5.894 3.421 0.466
12 HE ARG 2 HE ARG 2 7.673 2.309 -0.435
13 1HH1 ARG 2 1HH1 ARG 2 6.190 4.218 -2.989
14 2HH1 ARG 2 2HH1 ARG 2 7.391 3.797 -4.161
15 1HH2 ARG 2 1HH2 ARG 2 9.222 1.765 -1.940
16 2HH2 ARG 2 2HH2 ARG 2 9.136 2.387 -3.564
17 1HN ABA 3 H ABU 3 1.916 2.098 0.919
18 HA ABA 3 HA ABU 3 0.682 -0.530 0.934
19 1HB ABA 3 1HB ABU 3 -0.414 1.252 3.021
20 2HB ABA 3 2HB ABU 3 1.189 0.611 3.366
21 1HG ABA 3 1HG1 ABU 3 -0.580 -0.777 4.309
22 2HG ABA 3 2HG1 ABU 3 0.369 -1.651 3.107
23 3HG ABA 3 3HG1 ABU 3 -1.232 -1.039 2.692
24 H THR 4 H THR 4 -1.239 -0.494 -0.136
25 HA THR 4 HA THR 4 -1.964 1.907 -1.492
26 HB THR 4 HB THR 4 -3.787 0.614 -2.487
27 HG1 THR 4 1HG THR 4 -4.603 -0.905 -1.267
28 1HG2 THR 4 1HG2 THR 4 -1.303 -1.092 -2.357
29 2HG2 THR 4 2HG2 THR 4 -1.435 0.383 -3.317
30 3HG2 THR 4 3HG2 THR 4 -2.476 -0.998 -3.672
31 H LYS 5 H LYS 5 -3.687 3.241 -1.200
32 HA LYS 5 HA LYS 5 -4.885 3.275 1.426
33 1HB LYS 5 2HB LYS 5 -5.913 5.406 0.660
34 2HB LYS 5 1HB LYS 5 -4.161 5.391 0.499
35 1HG LYS 5 2HG LYS 5 -4.256 5.217 -1.826
36 2HG LYS 5 1HG LYS 5 -5.941 4.694 -1.809
37 1HD LYS 5 2HD LYS 5 -4.924 7.440 -1.075
38 2HD LYS 5 1HD LYS 5 -5.747 7.005 -2.573
39 1HE LYS 5 2HE LYS 5 -6.891 6.933 0.217
40 2HE LYS 5 1HE LYS 5 -7.325 8.046 -1.079
41 1HZ LYS 5 1HZ LYS 5 -7.847 5.124 -0.960
42 2HZ LYS 5 2HZ LYS 5 -8.073 6.055 -2.357
43 3HZ LYS 5 3HZ LYS 5 -8.987 6.377 -0.971
44 H SER 6 H SER 6 -5.641 1.026 0.229
45 HA SER 6 HA SER 6 -8.520 1.360 -0.073
46 1HB SER 6 2HB SER 6 -8.454 -0.175 -2.100
47 2HB SER 6 1HB SER 6 -7.848 1.459 -2.380
48 HG SER 6 HG SER 6 -6.524 -0.954 -2.452
49 H ILE 7 H ILE 7 -9.588 -0.342 0.872
50 HA ILE 7 HA ILE 7 -7.936 -2.377 2.123
51 HB ILE 7 HB ILE 7 -10.048 -3.033 3.294
52 1HG1 ILE 7 2HG1 ILE 7 -11.158 -0.543 1.973
53 2HG1 ILE 7 1HG1 ILE 7 -11.621 -2.191 1.567
54 1HG2 ILE 7 1HG2 ILE 7 -9.826 -1.384 4.897
55 2HG2 ILE 7 2HG2 ILE 7 -9.601 -0.107 3.703
56 3HG2 ILE 7 3HG2 ILE 7 -8.302 -1.257 4.020
57 1HD1 ILE 7 1HD1 ILE 7 -12.858 -0.551 3.390
58 2HD1 ILE 7 2HD1 ILE 7 -11.895 -1.630 4.399
59 3HD1 ILE 7 3HD1 ILE 7 -13.060 -2.298 3.256
60 HA PRO 8 HA PRO 8 -7.790 -4.365 2.841
61 1HB PRO 8 2HB PRO 8 -6.338 -6.419 1.370
62 2HB PRO 8 1HB PRO 8 -7.305 -6.581 2.838
63 1HG PRO 8 2HG PRO 8 -8.068 -7.620 0.451
64 2HG PRO 8 1HG PRO 8 -9.223 -7.073 1.679
65 1HD PRO 8 2HD PRO 8 -8.289 -5.675 -0.803
66 2HD PRO 8 1HD PRO 8 -9.926 -5.785 -0.120
67 HA PRO 9 HA PRO 9 -4.596 -1.695 1.240
68 1HB PRO 9 2HB PRO 9 -3.276 -2.278 3.828
69 2HB PRO 9 1HB PRO 9 -3.749 -0.726 3.129
70 1HG PRO 9 2HG PRO 9 -5.101 -1.785 5.173
71 2HG PRO 9 1HG PRO 9 -5.933 -0.904 3.878
72 1HD PRO 9 2HD PRO 9 -5.709 -3.857 4.324
73 2HD PRO 9 1HD PRO 9 -7.107 -2.900 3.785
74 H ILE 10 H ILE 10 -3.243 -2.476 -0.236
75 HA ILE 10 HA ILE 10 -1.831 -4.960 0.148
76 HB ILE 10 HB ILE 10 -1.598 -2.931 -2.086
77 1HG1 ILE 10 2HG1 ILE 10 -3.857 -3.853 -1.938
78 2HG1 ILE 10 1HG1 ILE 10 -3.032 -4.480 -3.361
79 1HG2 ILE 10 1HG2 ILE 10 -0.005 -5.194 -1.462
80 2HG2 ILE 10 2HG2 ILE 10 0.095 -4.130 -2.866
81 3HG2 ILE 10 3HG2 ILE 10 -0.935 -5.561 -2.916
82 1HD1 ILE 10 1HD1 ILE 10 -4.437 -6.040 -1.786
83 2HD1 ILE 10 2HD1 ILE 10 -2.937 -6.077 -0.859
84 3HD1 ILE 10 3HD1 ILE 10 -2.947 -6.605 -2.542
85 1HN ABA 11 H ABU 11 0.009 -5.099 1.224
86 HA ABA 11 HA ABU 11 1.593 -2.694 1.671
87 1HB ABA 11 1HB ABU 11 2.341 -5.314 2.882
88 2HB ABA 11 2HB ABU 11 0.860 -4.542 3.440
89 1HG ABA 11 1HG1 ABU 11 2.162 -2.516 3.970
90 2HG ABA 11 2HG1 ABU 11 3.630 -3.380 3.516
91 3HG ABA 11 3HG1 ABU 11 2.670 -3.936 4.886
92 H PHE 12 H PHE 12 3.364 -2.277 0.585
93 HA PHE 12 HA PHE 12 4.447 -4.254 -1.243
94 1HB PHE 12 2HB PHE 12 5.087 -1.331 -0.786
95 2HB PHE 12 1HB PHE 12 5.934 -2.338 -1.952
96 HD1 PHE 12 1HD PHE 12 5.294 -2.037 -4.117
97 HD2 PHE 12 2HD PHE 12 2.368 -1.622 -1.056
98 HE1 PHE 12 1HE PHE 12 3.596 -1.504 -5.817
99 HE2 PHE 12 2HE PHE 12 0.664 -1.092 -2.749
100 HZ PHE 12 HZ PHE 12 1.277 -1.034 -5.132
101 HA PRO 13 HA PRO 13 7.713 -5.592 1.414
102 1HB PRO 13 2HB PRO 13 9.382 -5.916 -0.989
103 2HB PRO 13 1HB PRO 13 8.789 -7.137 0.139
104 1HG PRO 13 2HG PRO 13 7.809 -6.933 -2.347
105 2HG PRO 13 1HG PRO 13 6.780 -7.382 -0.974
106 1HD PRO 13 2HD PRO 13 7.057 -4.732 -2.348
107 2HD PRO 13 1HD PRO 13 5.588 -5.561 -1.788
108 H ASP 14 H ASP 14 7.648 -2.926 1.516
109 HA ASP 14 HA ASP 14 10.385 -2.214 1.901
110 1HB ASP 14 2HB ASP 14 10.697 -0.552 0.312
111 2HB ASP 14 1HB ASP 14 9.791 -1.739 -0.616
Start of MODEL 6
1 1H GLY 1 H GLY 1 7.101 -2.015 1.865
2 1HA GLY 1 2HA GLY 1 6.155 -1.731 4.042
3 2HA GLY 1 1HA GLY 1 7.102 -0.264 4.227
4 H ARG 2 H ARG 2 6.008 -0.112 1.184
5 HA ARG 2 HA ARG 2 4.155 1.954 1.699
6 1HB ARG 2 2HB ARG 2 5.601 1.350 -0.414
7 2HB ARG 2 1HB ARG 2 4.170 0.446 -0.882
8 1HG ARG 2 2HG ARG 2 2.846 2.401 -0.963
9 2HG ARG 2 1HG ARG 2 4.097 3.362 -0.165
10 1HD ARG 2 2HD ARG 2 4.122 2.204 -2.940
11 2HD ARG 2 1HD ARG 2 4.236 3.898 -2.463
12 HE ARG 2 HE ARG 2 6.384 2.419 -1.347
13 1HH1 ARG 2 1HH1 ARG 2 5.290 3.740 -4.408
14 2HH1 ARG 2 2HH1 ARG 2 6.887 3.852 -5.065
15 1HH2 ARG 2 1HH2 ARG 2 8.445 2.551 -2.178
16 2HH2 ARG 2 2HH2 ARG 2 8.708 3.169 -3.785
17 1HN ABA 3 H ABU 3 1.904 2.003 1.523
18 HA ABA 3 HA ABU 3 0.554 -0.593 1.282
19 1HB ABA 3 1HB ABU 3 -0.905 1.029 3.119
20 2HB ABA 3 2HB ABU 3 0.769 0.968 3.662
21 1HG ABA 3 1HG1 ABU 3 0.182 -0.933 4.655
22 2HG ABA 3 2HG1 ABU 3 0.265 -1.645 3.044
23 3HG ABA 3 3HG1 ABU 3 -1.283 -1.094 3.687
24 H THR 4 H THR 4 -1.241 -0.561 0.043
25 HA THR 4 HA THR 4 -1.794 1.769 -1.493
26 HB THR 4 HB THR 4 -3.622 0.472 -2.505
27 HG1 THR 4 1HG THR 4 -4.519 -0.960 -1.235
28 1HG2 THR 4 1HG2 THR 4 -0.859 -0.511 -2.300
29 2HG2 THR 4 2HG2 THR 4 -1.826 -0.129 -3.723
30 3HG2 THR 4 3HG2 THR 4 -2.026 -1.683 -2.913
31 H LYS 5 H LYS 5 -3.563 3.122 -1.461
32 HA LYS 5 HA LYS 5 -4.880 3.419 1.094
33 1HB LYS 5 2HB LYS 5 -5.241 5.045 -1.433
34 2HB LYS 5 1HB LYS 5 -5.792 5.484 0.176
35 1HG LYS 5 2HG LYS 5 -3.421 5.544 0.909
36 2HG LYS 5 1HG LYS 5 -2.945 5.263 -0.766
37 1HD LYS 5 2HD LYS 5 -4.593 7.602 0.202
38 2HD LYS 5 1HD LYS 5 -2.862 7.651 -0.122
39 1HE LYS 5 2HE LYS 5 -3.794 8.517 -2.068
40 2HE LYS 5 1HE LYS 5 -3.497 6.830 -2.481
41 1HZ LYS 5 1HZ LYS 5 -5.896 6.449 -1.804
42 2HZ LYS 5 2HZ LYS 5 -5.645 7.296 -3.247
43 3HZ LYS 5 3HZ LYS 5 -6.078 8.131 -1.842
44 H SER 6 H SER 6 -5.599 1.063 0.106
45 HA SER 6 HA SER 6 -8.450 1.375 -0.358
46 1HB SER 6 2HB SER 6 -8.334 -0.280 -2.275
47 2HB SER 6 1HB SER 6 -7.669 1.312 -2.642
48 HG SER 6 HG SER 6 -6.411 -1.137 -2.468
49 H ILE 7 H ILE 7 -9.545 -0.216 0.716
50 HA ILE 7 HA ILE 7 -7.943 -2.188 2.125
51 HB ILE 7 HB ILE 7 -10.083 -2.720 3.317
52 1HG1 ILE 7 2HG1 ILE 7 -11.115 -0.283 1.843
53 2HG1 ILE 7 1HG1 ILE 7 -11.612 -1.940 1.517
54 1HG2 ILE 7 1HG2 ILE 7 -9.995 -0.791 4.729
55 2HG2 ILE 7 2HG2 ILE 7 -9.313 0.189 3.432
56 3HG2 ILE 7 3HG2 ILE 7 -8.365 -1.116 4.141
57 1HD1 ILE 7 1HD1 ILE 7 -12.641 -2.124 3.658
58 2HD1 ILE 7 2HD1 ILE 7 -13.200 -0.629 2.909
59 3HD1 ILE 7 3HD1 ILE 7 -11.970 -0.577 4.172
60 HA PRO 8 HA PRO 8 -7.835 -4.102 2.983
61 1HB PRO 8 2HB PRO 8 -6.347 -6.249 2.291
62 2HB PRO 8 1HB PRO 8 -7.988 -6.402 2.928
63 1HG PRO 8 2HG PRO 8 -7.032 -6.548 0.100
64 2HG PRO 8 1HG PRO 8 -8.243 -7.545 0.927
65 1HD PRO 8 2HD PRO 8 -8.872 -5.470 -0.735
66 2HD PRO 8 1HD PRO 8 -9.910 -6.005 0.601
67 HA PRO 9 HA PRO 9 -4.563 -1.648 1.215
68 1HB PRO 9 2HB PRO 9 -2.977 -1.587 3.469
69 2HB PRO 9 1HB PRO 9 -4.356 -0.521 3.185
70 1HG PRO 9 2HG PRO 9 -4.192 -3.018 4.819
71 2HG PRO 9 1HG PRO 9 -5.043 -1.501 5.169
72 1HD PRO 9 2HD PRO 9 -6.338 -3.684 4.277
73 2HD PRO 9 1HD PRO 9 -6.831 -2.045 3.806
74 H ILE 10 H ILE 10 -3.201 -2.537 -0.182
75 HA ILE 10 HA ILE 10 -1.858 -5.031 0.354
76 HB ILE 10 HB ILE 10 -1.525 -3.138 -1.983
77 1HG1 ILE 10 2HG1 ILE 10 -3.213 -5.641 -1.758
78 2HG1 ILE 10 1HG1 ILE 10 -3.843 -3.998 -1.708
79 1HG2 ILE 10 1HG2 ILE 10 0.152 -5.146 -1.279
80 2HG2 ILE 10 2HG2 ILE 10 -0.112 -4.606 -2.938
81 3HG2 ILE 10 3HG2 ILE 10 -0.986 -6.007 -2.317
82 1HD1 ILE 10 1HD1 ILE 10 -4.084 -5.140 -3.902
83 2HD1 ILE 10 2HD1 ILE 10 -2.327 -5.139 -4.039
84 3HD1 ILE 10 3HD1 ILE 10 -3.207 -3.613 -3.971
85 1HN ABA 11 H ABU 11 0.107 -5.252 1.216
86 HA ABA 11 HA ABU 11 1.663 -2.829 1.707
87 1HB ABA 11 1HB ABU 11 2.462 -5.454 2.872
88 2HB ABA 11 2HB ABU 11 0.980 -4.713 3.465
89 1HG ABA 11 1HG1 ABU 11 3.724 -4.063 4.048
90 2HG ABA 11 2HG1 ABU 11 2.245 -3.565 4.869
91 3HG ABA 11 3HG1 ABU 11 2.831 -2.652 3.478
92 H PHE 12 H PHE 12 3.427 -2.391 0.638
93 HA PHE 12 HA PHE 12 4.525 -4.333 -1.234
94 1HB PHE 12 2HB PHE 12 5.005 -1.374 -0.818
95 2HB PHE 12 1HB PHE 12 5.916 -2.340 -1.971
96 HD1 PHE 12 1HD PHE 12 5.275 -2.041 -4.132
97 HD2 PHE 12 2HD PHE 12 2.299 -1.903 -1.092
98 HE1 PHE 12 1HE PHE 12 3.555 -1.632 -5.840
99 HE2 PHE 12 2HE PHE 12 0.573 -1.499 -2.797
100 HZ PHE 12 HZ PHE 12 1.199 -1.363 -5.175
101 HA PRO 13 HA PRO 13 8.095 -5.538 1.055
102 1HB PRO 13 2HB PRO 13 9.809 -4.528 -1.157
103 2HB PRO 13 1HB PRO 13 9.749 -6.132 -0.420
104 1HG PRO 13 2HG PRO 13 8.690 -5.709 -2.821
105 2HG PRO 13 1HG PRO 13 7.885 -6.770 -1.649
106 1HD PRO 13 2HD PRO 13 7.222 -3.962 -2.436
107 2HD PRO 13 1HD PRO 13 6.135 -5.317 -2.070
108 H ASP 14 H ASP 14 8.169 -2.310 -0.345
109 HA ASP 14 HA ASP 14 10.323 -1.405 1.349
110 1HB ASP 14 2HB ASP 14 10.081 0.713 0.272
111 2HB ASP 14 1HB ASP 14 9.872 -0.516 -0.970
Start of MODEL 7
1 1H GLY 1 H GLY 1 6.992 -1.513 1.420
2 1HA GLY 1 2HA GLY 1 6.540 -1.247 3.914
3 2HA GLY 1 1HA GLY 1 7.468 0.234 3.744
4 H ARG 2 H ARG 2 6.174 0.491 0.962
5 HA ARG 2 HA ARG 2 4.159 2.298 1.761
6 1HB ARG 2 2HB ARG 2 4.028 2.895 -0.433
7 2HB ARG 2 1HB ARG 2 5.561 2.038 -0.490
8 1HG ARG 2 2HG ARG 2 4.283 0.000 -1.199
9 2HG ARG 2 1HG ARG 2 2.863 1.034 -1.352
10 1HD ARG 2 2HD ARG 2 3.745 0.957 -3.510
11 2HD ARG 2 1HD ARG 2 4.326 2.492 -2.866
12 HE ARG 2 HE ARG 2 6.239 0.493 -2.338
13 1HH1 ARG 2 1HH1 ARG 2 4.916 2.331 -5.017
14 2HH1 ARG 2 2HH1 ARG 2 6.329 2.155 -6.002
15 1HH2 ARG 2 1HH2 ARG 2 8.074 0.226 -3.622
16 2HH2 ARG 2 2HH2 ARG 2 8.145 0.956 -5.204
17 1HN ABA 3 H ABU 3 1.926 2.217 1.596
18 HA ABA 3 HA ABU 3 0.729 -0.439 1.220
19 1HB ABA 3 1HB ABU 3 -0.296 1.451 3.323
20 2HB ABA 3 2HB ABU 3 1.045 0.368 3.682
21 1HG ABA 3 1HG1 ABU 3 -0.411 -1.535 2.990
22 2HG ABA 3 2HG1 ABU 3 -1.748 -0.388 2.886
23 3HG ABA 3 3HG1 ABU 3 -0.948 -0.670 4.432
24 H THR 4 H THR 4 -1.152 -0.454 0.071
25 HA THR 4 HA THR 4 -1.848 1.916 -1.354
26 HB THR 4 HB THR 4 -3.598 0.580 -2.415
27 HG1 THR 4 1HG THR 4 -4.465 -0.919 -1.206
28 1HG2 THR 4 1HG2 THR 4 -0.964 -0.852 -2.091
29 2HG2 THR 4 2HG2 THR 4 -1.401 0.317 -3.337
30 3HG2 THR 4 3HG2 THR 4 -2.172 -1.269 -3.305
31 H LYS 5 H LYS 5 -3.619 3.222 -1.153
32 HA LYS 5 HA LYS 5 -4.937 3.212 1.426
33 1HB LYS 5 2HB LYS 5 -5.065 5.153 -0.893
34 2HB LYS 5 1HB LYS 5 -5.946 5.361 0.614
35 1HG LYS 5 2HG LYS 5 -3.777 5.371 1.820
36 2HG LYS 5 1HG LYS 5 -2.957 5.311 0.258
37 1HD LYS 5 2HD LYS 5 -4.894 7.471 1.088
38 2HD LYS 5 1HD LYS 5 -3.140 7.603 1.221
39 1HE LYS 5 2HE LYS 5 -4.639 7.111 -1.349
40 2HE LYS 5 1HE LYS 5 -4.066 8.688 -0.808
41 1HZ LYS 5 1HZ LYS 5 -1.931 6.871 -0.700
42 2HZ LYS 5 2HZ LYS 5 -2.097 8.240 -1.680
43 3HZ LYS 5 3HZ LYS 5 -2.657 6.739 -2.224
44 H SER 6 H SER 6 -5.622 1.006 0.188
45 HA SER 6 HA SER 6 -8.466 1.354 -0.337
46 1HB SER 6 2HB SER 6 -8.273 -0.167 -2.348
47 2HB SER 6 1HB SER 6 -7.566 1.432 -2.584
48 HG SER 6 HG SER 6 -6.343 -1.054 -2.436
49 H ILE 7 H ILE 7 -9.611 -0.334 0.541
50 HA ILE 7 HA ILE 7 -8.063 -2.356 1.941
51 HB ILE 7 HB ILE 7 -10.264 -2.998 2.949
52 1HG1 ILE 7 2HG1 ILE 7 -11.257 -0.518 1.519
53 2HG1 ILE 7 1HG1 ILE 7 -11.695 -2.171 1.097
54 1HG2 ILE 7 1HG2 ILE 7 -9.107 -1.667 4.385
55 2HG2 ILE 7 2HG2 ILE 7 -10.491 -0.616 4.088
56 3HG2 ILE 7 3HG2 ILE 7 -8.976 -0.341 3.230
57 1HD1 ILE 7 1HD1 ILE 7 -12.228 -1.007 3.810
58 2HD1 ILE 7 2HD1 ILE 7 -12.919 -2.457 3.083
59 3HD1 ILE 7 3HD1 ILE 7 -13.363 -0.865 2.468
60 HA PRO 8 HA PRO 8 -7.971 -4.332 2.694
61 1HB PRO 8 2HB PRO 8 -6.410 -6.402 1.366
62 2HB PRO 8 1HB PRO 8 -7.488 -6.547 2.756
63 1HG PRO 8 2HG PRO 8 -8.062 -7.618 0.330
64 2HG PRO 8 1HG PRO 8 -9.309 -7.056 1.456
65 1HD PRO 8 2HD PRO 8 -8.185 -5.690 -0.961
66 2HD PRO 8 1HD PRO 8 -9.870 -5.792 -0.408
67 HA PRO 9 HA PRO 9 -4.652 -1.684 1.342
68 1HB PRO 9 2HB PRO 9 -3.213 -1.786 3.694
69 2HB PRO 9 1HB PRO 9 -4.585 -0.714 3.401
70 1HG PRO 9 2HG PRO 9 -4.495 -3.328 4.845
71 2HG PRO 9 1HG PRO 9 -5.392 -1.852 5.249
72 1HD PRO 9 2HD PRO 9 -6.593 -3.970 4.112
73 2HD PRO 9 1HD PRO 9 -7.072 -2.304 3.724
74 H ILE 10 H ILE 10 -3.269 -2.516 -0.078
75 HA ILE 10 HA ILE 10 -1.861 -4.981 0.409
76 HB ILE 10 HB ILE 10 -1.535 -3.020 -1.872
77 1HG1 ILE 10 2HG1 ILE 10 -3.195 -5.549 -1.734
78 2HG1 ILE 10 1HG1 ILE 10 -3.845 -3.915 -1.656
79 1HG2 ILE 10 1HG2 ILE 10 0.349 -4.613 -1.494
80 2HG2 ILE 10 2HG2 ILE 10 -0.452 -4.798 -3.054
81 3HG2 ILE 10 3HG2 ILE 10 -0.787 -5.938 -1.752
82 1HD1 ILE 10 1HD1 ILE 10 -4.160 -4.696 -3.864
83 2HD1 ILE 10 2HD1 ILE 10 -2.490 -5.249 -3.980
84 3HD1 ILE 10 3HD1 ILE 10 -2.845 -3.523 -3.922
85 1HN ABA 11 H ABU 11 0.046 -5.159 1.364
86 HA ABA 11 HA ABU 11 1.620 -2.732 1.832
87 1HB ABA 11 1HB ABU 11 2.843 -4.228 3.489
88 2HB ABA 11 2HB ABU 11 1.602 -5.439 3.173
89 1HG ABA 11 1HG1 ABU 11 0.261 -4.490 4.641
90 2HG ABA 11 2HG1 ABU 11 0.342 -2.956 3.777
91 3HG ABA 11 3HG1 ABU 11 1.535 -3.331 5.021
92 H PHE 12 H PHE 12 3.376 -2.375 0.666
93 HA PHE 12 HA PHE 12 4.433 -4.497 -1.019
94 1HB PHE 12 2HB PHE 12 4.944 -1.528 -0.860
95 2HB PHE 12 1HB PHE 12 5.929 -2.591 -1.857
96 HD1 PHE 12 1HD PHE 12 5.425 -2.394 -4.071
97 HD2 PHE 12 2HD PHE 12 2.251 -2.247 -1.238
98 HE1 PHE 12 1HE PHE 12 3.800 -2.187 -5.906
99 HE2 PHE 12 2HE PHE 12 0.621 -2.043 -3.068
100 HZ PHE 12 HZ PHE 12 1.395 -2.012 -5.407
101 HA PRO 13 HA PRO 13 7.888 -5.714 1.415
102 1HB PRO 13 2HB PRO 13 9.611 -5.107 -0.939
103 2HB PRO 13 1HB PRO 13 9.474 -6.596 0.002
104 1HG PRO 13 2HG PRO 13 8.373 -6.420 -2.411
105 2HG PRO 13 1HG PRO 13 7.541 -7.268 -1.094
106 1HD PRO 13 2HD PRO 13 7.013 -4.560 -2.240
107 2HD PRO 13 1HD PRO 13 5.866 -5.777 -1.646
108 H ASP 14 H ASP 14 8.232 -2.755 -0.458
109 HA ASP 14 HA ASP 14 10.466 -1.744 0.976
110 1HB ASP 14 2HB ASP 14 9.739 0.471 -0.077
111 2HB ASP 14 1HB ASP 14 10.185 -0.832 -1.170
Start of MODEL 8
1 1H GLY 1 H GLY 1 7.083 -1.429 1.447
2 1HA GLY 1 2HA GLY 1 6.747 -0.859 3.957
3 2HA GLY 1 1HA GLY 1 7.629 0.593 3.507
4 H ARG 2 H ARG 2 6.267 0.454 0.801
5 HA ARG 2 HA ARG 2 4.225 2.304 1.333
6 1HB ARG 2 2HB ARG 2 4.836 0.648 -1.106
7 2HB ARG 2 1HB ARG 2 3.554 1.851 -1.070
8 1HG ARG 2 2HG ARG 2 5.110 3.614 -0.716
9 2HG ARG 2 1HG ARG 2 6.429 2.472 -0.445
10 1HD ARG 2 2HD ARG 2 4.902 2.749 -3.030
11 2HD ARG 2 1HD ARG 2 6.459 3.510 -2.701
12 HE ARG 2 HE ARG 2 6.799 0.815 -2.171
13 1HH1 ARG 2 1HH1 ARG 2 5.926 2.776 -4.947
14 2HH1 ARG 2 2HH1 ARG 2 6.627 1.691 -6.098
15 1HH2 ARG 2 1HH2 ARG 2 7.725 -0.613 -3.663
16 2HH2 ARG 2 2HH2 ARG 2 7.656 -0.250 -5.367
17 1HN ABA 3 H ABU 3 1.966 2.172 1.052
18 HA ABA 3 HA ABU 3 0.733 -0.463 1.025
19 1HB ABA 3 1HB ABU 3 0.035 1.485 3.223
20 2HB ABA 3 2HB ABU 3 1.253 0.233 3.444
21 1HG ABA 3 1HG1 ABU 3 -0.666 -0.707 4.328
22 2HG ABA 3 2HG1 ABU 3 -0.587 -1.396 2.708
23 3HG ABA 3 3HG1 ABU 3 -1.692 -0.064 3.045
24 H THR 4 H THR 4 -1.169 -0.423 -0.058
25 HA THR 4 HA THR 4 -1.944 2.009 -1.338
26 HB THR 4 HB THR 4 -3.727 0.711 -2.389
27 HG1 THR 4 1HG THR 4 -4.517 -0.871 -1.241
28 1HG2 THR 4 1HG2 THR 4 -1.815 -1.370 -2.748
29 2HG2 THR 4 2HG2 THR 4 -0.950 0.157 -2.564
30 3HG2 THR 4 3HG2 THR 4 -2.181 -0.014 -3.815
31 H LYS 5 H LYS 5 -3.695 3.294 -0.991
32 HA LYS 5 HA LYS 5 -4.919 3.158 1.627
33 1HB LYS 5 2HB LYS 5 -5.244 5.184 -0.599
34 2HB LYS 5 1HB LYS 5 -5.925 5.336 1.014
35 1HG LYS 5 2HG LYS 5 -3.641 5.333 1.945
36 2HG LYS 5 1HG LYS 5 -2.999 5.276 0.304
37 1HD LYS 5 2HD LYS 5 -4.756 7.459 1.428
38 2HD LYS 5 1HD LYS 5 -3.008 7.560 1.213
39 1HE LYS 5 2HE LYS 5 -3.282 7.278 -1.197
40 2HE LYS 5 1HE LYS 5 -5.028 7.146 -0.990
41 1HZ LYS 5 1HZ LYS 5 -3.307 9.507 -0.817
42 2HZ LYS 5 2HZ LYS 5 -4.672 9.454 0.181
43 3HZ LYS 5 3HZ LYS 5 -4.848 9.341 -1.497
44 H SER 6 H SER 6 -5.644 0.997 0.285
45 HA SER 6 HA SER 6 -8.508 1.372 -0.112
46 1HB SER 6 2HB SER 6 -8.399 -0.067 -2.181
47 2HB SER 6 1HB SER 6 -7.666 1.526 -2.380
48 HG SER 6 HG SER 6 -6.479 -0.992 -2.314
49 H ILE 7 H ILE 7 -9.642 -0.340 0.721
50 HA ILE 7 HA ILE 7 -8.092 -2.432 2.020
51 HB ILE 7 HB ILE 7 -11.029 -1.716 2.185
52 1HG1 ILE 7 2HG1 ILE 7 -10.300 -1.335 4.644
53 2HG1 ILE 7 1HG1 ILE 7 -8.664 -1.305 3.999
54 1HG2 ILE 7 1HG2 ILE 7 -10.096 -3.511 4.250
55 2HG2 ILE 7 2HG2 ILE 7 -9.946 -4.228 2.645
56 3HG2 ILE 7 3HG2 ILE 7 -11.509 -3.632 3.203
57 1HD1 ILE 7 1HD1 ILE 7 -10.864 0.656 3.691
58 2HD1 ILE 7 2HD1 ILE 7 -9.712 0.477 2.368
59 3HD1 ILE 7 3HD1 ILE 7 -9.144 0.914 3.980
60 HA PRO 8 HA PRO 8 -7.926 -4.465 2.601
61 1HB PRO 8 2HB PRO 8 -6.436 -6.444 1.070
62 2HB PRO 8 1HB PRO 8 -7.451 -6.678 2.494
63 1HG PRO 8 2HG PRO 8 -8.138 -7.585 0.030
64 2HG PRO 8 1HG PRO 8 -9.331 -7.097 1.248
65 1HD PRO 8 2HD PRO 8 -8.306 -5.571 -1.122
66 2HD PRO 8 1HD PRO 8 -9.967 -5.713 -0.505
67 HA PRO 9 HA PRO 9 -4.666 -1.736 1.268
68 1HB PRO 9 2HB PRO 9 -3.457 -2.453 3.875
69 2HB PRO 9 1HB PRO 9 -3.904 -0.868 3.238
70 1HG PRO 9 2HG PRO 9 -5.339 -2.029 5.168
71 2HG PRO 9 1HG PRO 9 -6.118 -1.083 3.884
72 1HD PRO 9 2HD PRO 9 -5.901 -4.056 4.184
73 2HD PRO 9 1HD PRO 9 -7.281 -3.075 3.646
74 H ILE 10 H ILE 10 -3.260 -2.449 -0.190
75 HA ILE 10 HA ILE 10 -1.854 -4.945 0.131
76 HB ILE 10 HB ILE 10 -1.530 -2.821 -2.002
77 1HG1 ILE 10 2HG1 ILE 10 -3.135 -5.389 -2.060
78 2HG1 ILE 10 1HG1 ILE 10 -3.819 -3.777 -1.883
79 1HG2 ILE 10 1HG2 ILE 10 0.054 -5.063 -1.409
80 2HG2 ILE 10 2HG2 ILE 10 0.122 -4.043 -2.846
81 3HG2 ILE 10 3HG2 ILE 10 -0.890 -5.489 -2.838
82 1HD1 ILE 10 1HD1 ILE 10 -2.385 -3.462 -4.147
83 2HD1 ILE 10 2HD1 ILE 10 -4.085 -3.932 -4.099
84 3HD1 ILE 10 3HD1 ILE 10 -2.834 -5.163 -4.270
85 1HN ABA 11 H ABU 11 -0.039 -5.134 1.242
86 HA ABA 11 HA ABU 11 1.526 -2.740 1.830
87 1HB ABA 11 1HB ABU 11 2.721 -4.408 3.414
88 2HB ABA 11 2HB ABU 11 1.359 -5.473 3.076
89 1HG ABA 11 1HG1 ABU 11 -0.138 -4.136 4.184
90 2HG ABA 11 2HG1 ABU 11 0.846 -2.686 3.988
91 3HG ABA 11 3HG1 ABU 11 1.319 -3.924 5.153
92 H PHE 12 H PHE 12 3.347 -2.325 0.809
93 HA PHE 12 HA PHE 12 4.496 -4.327 -0.963
94 1HB PHE 12 2HB PHE 12 5.093 -1.389 -0.535
95 2HB PHE 12 1HB PHE 12 5.997 -2.410 -1.645
96 HD1 PHE 12 1HD PHE 12 2.384 -1.729 -0.920
97 HD2 PHE 12 2HD PHE 12 5.456 -2.123 -3.838
98 HE1 PHE 12 1HE PHE 12 0.753 -1.244 -2.696
99 HE2 PHE 12 2HE PHE 12 3.831 -1.638 -5.618
100 HZ PHE 12 HZ PHE 12 1.476 -1.197 -5.049
101 HA PRO 13 HA PRO 13 7.675 -5.688 1.784
102 1HB PRO 13 2HB PRO 13 9.520 -5.440 -0.535
103 2HB PRO 13 1HB PRO 13 9.182 -6.840 0.490
104 1HG PRO 13 2HG PRO 13 8.208 -6.699 -1.985
105 2HG PRO 13 1HG PRO 13 7.241 -7.378 -0.662
106 1HD PRO 13 2HD PRO 13 7.047 -4.698 -1.972
107 2HD PRO 13 1HD PRO 13 5.755 -5.764 -1.384
108 H ASP 14 H ASP 14 8.233 -2.923 -0.276
109 HA ASP 14 HA ASP 14 10.543 -1.961 1.083
110 1HB ASP 14 2HB ASP 14 10.009 0.173 -0.201
111 2HB ASP 14 1HB ASP 14 10.313 -1.269 -1.161
Start of MODEL 9
1 1H GLY 1 H GLY 1 7.192 -1.648 1.595
2 1HA GLY 1 2HA GLY 1 6.792 -0.877 3.960
3 2HA GLY 1 1HA GLY 1 7.765 0.518 3.522
4 H ARG 2 H ARG 2 6.400 0.287 0.761
5 HA ARG 2 HA ARG 2 4.462 2.290 1.229
6 1HB ARG 2 2HB ARG 2 5.678 1.020 -1.037
7 2HB ARG 2 1HB ARG 2 3.939 1.101 -1.283
8 1HG ARG 2 2HG ARG 2 5.341 3.050 -2.139
9 2HG ARG 2 1HG ARG 2 3.912 3.439 -1.179
10 1HD ARG 2 2HD ARG 2 6.015 4.739 -0.631
11 2HD ARG 2 1HD ARG 2 5.210 3.955 0.728
12 HE ARG 2 HE ARG 2 7.199 2.243 -0.348
13 1HH1 ARG 2 1HH1 ARG 2 6.876 5.170 1.568
14 2HH1 ARG 2 2HH1 ARG 2 8.334 4.892 2.457
15 1HH2 ARG 2 1HH2 ARG 2 9.072 1.863 0.815
16 2HH2 ARG 2 2HH2 ARG 2 9.599 2.989 2.028
17 1HN ABA 3 H ABU 3 2.192 2.235 0.953
18 HA ABA 3 HA ABU 3 0.884 -0.356 0.887
19 1HB ABA 3 1HB ABU 3 0.403 1.532 3.201
20 2HB ABA 3 2HB ABU 3 1.467 0.133 3.299
21 1HG ABA 3 1HG1 ABU 3 -0.249 -1.349 3.324
22 2HG ABA 3 2HG1 ABU 3 -1.309 -0.312 2.368
23 3HG ABA 3 3HG1 ABU 3 -1.044 0.032 4.078
24 H THR 4 H THR 4 -1.018 -0.238 -0.153
25 HA THR 4 HA THR 4 -1.862 2.334 -1.158
26 HB THR 4 HB THR 4 -3.577 1.046 -2.403
27 HG1 THR 4 1HG THR 4 -4.094 -0.850 -1.642
28 1HG2 THR 4 1HG2 THR 4 -2.004 0.815 -3.957
29 2HG2 THR 4 2HG2 THR 4 -1.427 -0.653 -3.167
30 3HG2 THR 4 3HG2 THR 4 -0.760 0.915 -2.712
31 H LYS 5 H LYS 5 -3.725 3.425 -0.631
32 HA LYS 5 HA LYS 5 -4.918 2.771 1.912
33 1HB LYS 5 2HB LYS 5 -6.195 4.897 1.557
34 2HB LYS 5 1HB LYS 5 -4.448 5.087 1.531
35 1HG LYS 5 2HG LYS 5 -4.473 5.193 -0.896
36 2HG LYS 5 1HG LYS 5 -6.218 4.930 -0.902
37 1HD LYS 5 2HD LYS 5 -5.695 7.295 -1.194
38 2HD LYS 5 1HD LYS 5 -6.538 7.021 0.330
39 1HE LYS 5 2HE LYS 5 -4.417 7.109 1.531
40 2HE LYS 5 1HE LYS 5 -3.554 7.340 0.012
41 1HZ LYS 5 1HZ LYS 5 -4.104 9.383 1.435
42 2HZ LYS 5 2HZ LYS 5 -5.679 9.215 0.836
43 3HZ LYS 5 3HZ LYS 5 -4.391 9.472 -0.230
44 H SER 6 H SER 6 -5.437 0.788 0.132
45 HA SER 6 HA SER 6 -8.223 1.167 -0.700
46 1HB SER 6 2HB SER 6 -7.816 -0.988 -1.966
47 2HB SER 6 1HB SER 6 -6.836 0.379 -2.496
48 HG SER 6 HG SER 6 -6.082 -1.927 -1.074
49 H ILE 7 H ILE 7 -9.190 -1.347 -0.667
50 HA ILE 7 HA ILE 7 -8.738 -2.453 2.002
51 HB ILE 7 HB ILE 7 -11.491 -1.758 0.939
52 1HG1 ILE 7 2HG1 ILE 7 -10.030 -0.661 3.354
53 2HG1 ILE 7 1HG1 ILE 7 -10.220 0.191 1.826
54 1HG2 ILE 7 1HG2 ILE 7 -10.622 -3.712 2.844
55 2HG2 ILE 7 2HG2 ILE 7 -12.253 -3.362 2.272
56 3HG2 ILE 7 3HG2 ILE 7 -11.598 -2.485 3.654
57 1HD1 ILE 7 1HD1 ILE 7 -11.882 0.372 3.996
58 2HD1 ILE 7 2HD1 ILE 7 -12.748 -0.729 2.925
59 3HD1 ILE 7 3HD1 ILE 7 -12.272 0.869 2.349
60 HA PRO 8 HA PRO 8 -8.123 -4.096 2.726
61 1HB PRO 8 2HB PRO 8 -6.324 -6.067 2.356
62 2HB PRO 8 1HB PRO 8 -7.974 -6.392 2.903
63 1HG PRO 8 2HG PRO 8 -6.800 -6.650 0.161
64 2HG PRO 8 1HG PRO 8 -7.899 -7.749 1.017
65 1HD PRO 8 2HD PRO 8 -8.728 -5.959 -0.870
66 2HD PRO 8 1HD PRO 8 -9.754 -6.520 0.463
67 HA PRO 9 HA PRO 9 -4.854 -1.579 1.103
68 1HB PRO 9 2HB PRO 9 -3.421 -1.944 3.633
69 2HB PRO 9 1HB PRO 9 -4.150 -0.482 2.966
70 1HG PRO 9 2HG PRO 9 -5.176 -1.756 5.112
71 2HG PRO 9 1HG PRO 9 -6.193 -0.898 3.940
72 1HD PRO 9 2HD PRO 9 -5.668 -3.836 4.202
73 2HD PRO 9 1HD PRO 9 -7.189 -2.989 3.847
74 H ILE 10 H ILE 10 -3.295 -2.211 -0.260
75 HA ILE 10 HA ILE 10 -1.964 -4.743 0.093
76 HB ILE 10 HB ILE 10 -1.519 -2.621 -2.017
77 1HG1 ILE 10 2HG1 ILE 10 -3.809 -3.460 -2.085
78 2HG1 ILE 10 1HG1 ILE 10 -2.900 -4.073 -3.462
79 1HG2 ILE 10 1HG2 ILE 10 -0.448 -5.383 -1.634
80 2HG2 ILE 10 2HG2 ILE 10 0.385 -3.914 -2.142
81 3HG2 ILE 10 3HG2 ILE 10 -0.685 -4.753 -3.266
82 1HD1 ILE 10 1HD1 ILE 10 -2.599 -6.000 -1.471
83 2HD1 ILE 10 2HD1 ILE 10 -3.606 -6.097 -2.916
84 3HD1 ILE 10 3HD1 ILE 10 -4.292 -5.508 -1.401
85 1HN ABA 11 H ABU 11 -0.126 -5.033 1.151
86 HA ABA 11 HA ABU 11 1.488 -2.688 1.836
87 1HB ABA 11 1HB ABU 11 2.564 -4.319 3.477
88 2HB ABA 11 2HB ABU 11 1.291 -5.451 3.035
89 1HG ABA 11 1HG1 ABU 11 -0.184 -3.281 3.633
90 2HG ABA 11 2HG1 ABU 11 1.184 -3.058 4.723
91 3HG ABA 11 3HG1 ABU 11 0.238 -4.545 4.787
92 H PHE 12 H PHE 12 3.329 -2.330 0.820
93 HA PHE 12 HA PHE 12 4.461 -4.410 -0.881
94 1HB PHE 12 2HB PHE 12 5.077 -1.458 -0.599
95 2HB PHE 12 1HB PHE 12 5.951 -2.541 -1.676
96 HD1 PHE 12 1HD PHE 12 2.389 -1.664 -0.922
97 HD2 PHE 12 2HD PHE 12 5.346 -2.472 -3.873
98 HE1 PHE 12 1HE PHE 12 0.734 -1.243 -2.691
99 HE2 PHE 12 2HE PHE 12 3.695 -2.052 -5.647
100 HZ PHE 12 HZ PHE 12 1.386 -1.436 -5.057
101 HA PRO 13 HA PRO 13 7.634 -5.619 1.933
102 1HB PRO 13 2HB PRO 13 9.747 -5.862 0.151
103 2HB PRO 13 1HB PRO 13 8.528 -7.101 0.459
104 1HG PRO 13 2HG PRO 13 8.686 -5.104 -1.757
105 2HG PRO 13 1HG PRO 13 8.178 -6.803 -1.810
106 1HD PRO 13 2HD PRO 13 6.386 -4.813 -1.855
107 2HD PRO 13 1HD PRO 13 6.062 -6.326 -0.981
108 H ASP 14 H ASP 14 8.236 -2.967 -0.279
109 HA ASP 14 HA ASP 14 10.583 -2.006 1.028
110 1HB ASP 14 2HB ASP 14 10.397 -0.081 -0.425
111 2HB ASP 14 1HB ASP 14 10.052 -1.535 -1.354
Start of MODEL 10
1 1H GLY 1 H GLY 1 7.100 -1.664 1.637
2 1HA GLY 1 2HA GLY 1 6.446 -1.228 3.995
3 2HA GLY 1 1HA GLY 1 7.396 0.247 3.873
4 H ARG 2 H ARG 2 6.127 0.024 0.934
5 HA ARG 2 HA ARG 2 4.251 2.101 1.333
6 1HB ARG 2 2HB ARG 2 5.602 1.118 -0.812
7 2HB ARG 2 1HB ARG 2 3.991 0.485 -1.123
8 1HG ARG 2 2HG ARG 2 4.360 2.623 -2.234
9 2HG ARG 2 1HG ARG 2 3.068 2.727 -1.037
10 1HD ARG 2 2HD ARG 2 4.695 4.653 -1.055
11 2HD ARG 2 1HD ARG 2 4.460 3.865 0.505
12 HE ARG 2 HE ARG 2 6.638 2.621 -0.707
13 1HH1 ARG 2 1HH1 ARG 2 5.826 5.837 0.445
14 2HH1 ARG 2 2HH1 ARG 2 7.455 6.226 0.877
15 1HH2 ARG 2 1HH2 ARG 2 8.745 3.104 -0.141
16 2HH2 ARG 2 2HH2 ARG 2 9.138 4.661 0.541
17 1HN ABA 3 H ABU 3 2.001 2.097 1.214
18 HA ABA 3 HA ABU 3 0.647 -0.496 1.212
19 1HB ABA 3 1HB ABU 3 -0.734 1.005 3.123
20 2HB ABA 3 2HB ABU 3 0.964 1.260 3.510
21 1HG ABA 3 1HG1 ABU 3 0.032 -0.614 4.745
22 2HG ABA 3 2HG1 ABU 3 1.309 -1.140 3.648
23 3HG ABA 3 3HG1 ABU 3 -0.383 -1.414 3.229
24 H THR 4 H THR 4 -1.202 -0.462 0.057
25 HA THR 4 HA THR 4 -1.871 1.930 -1.360
26 HB THR 4 HB THR 4 -3.650 0.630 -2.417
27 HG1 THR 4 1HG THR 4 -4.515 -0.884 -1.230
28 1HG2 THR 4 1HG2 THR 4 -1.737 0.214 -3.599
29 2HG2 THR 4 2HG2 THR 4 -2.107 -1.424 -3.060
30 3HG2 THR 4 3HG2 THR 4 -0.895 -0.468 -2.207
31 H LYS 5 H LYS 5 -3.637 3.241 -1.156
32 HA LYS 5 HA LYS 5 -4.920 3.272 1.437
33 1HB LYS 5 2HB LYS 5 -5.151 5.160 -0.918
34 2HB LYS 5 1HB LYS 5 -5.890 5.419 0.657
35 1HG LYS 5 2HG LYS 5 -3.677 5.486 1.689
36 2HG LYS 5 1HG LYS 5 -2.935 5.226 0.110
37 1HD LYS 5 2HD LYS 5 -3.902 7.323 -0.695
38 2HD LYS 5 1HD LYS 5 -4.663 7.579 0.878
39 1HE LYS 5 2HE LYS 5 -2.453 7.649 1.931
40 2HE LYS 5 1HE LYS 5 -1.695 7.394 0.360
41 1HZ LYS 5 1HZ LYS 5 -2.136 9.797 1.430
42 2HZ LYS 5 2HZ LYS 5 -3.538 9.625 0.500
43 3HZ LYS 5 3HZ LYS 5 -2.018 9.520 -0.234
44 H SER 6 H SER 6 -5.628 1.036 0.203
45 HA SER 6 HA SER 6 -8.485 1.389 -0.238
46 1HB SER 6 2HB SER 6 -8.368 -0.113 -2.259
47 2HB SER 6 1HB SER 6 -7.634 1.471 -2.509
48 HG SER 6 HG SER 6 -6.448 -1.045 -2.349
49 H ILE 7 H ILE 7 -9.594 -0.263 0.726
50 HA ILE 7 HA ILE 7 -8.002 -2.327 2.010
51 HB ILE 7 HB ILE 7 -10.009 -2.916 3.267
52 1HG1 ILE 7 2HG1 ILE 7 -11.641 -2.281 1.417
53 2HG1 ILE 7 1HG1 ILE 7 -12.111 -1.833 3.051
54 1HG2 ILE 7 1HG2 ILE 7 -8.860 -0.216 3.252
55 2HG2 ILE 7 2HG2 ILE 7 -8.976 -1.402 4.552
56 3HG2 ILE 7 3HG2 ILE 7 -10.367 -0.392 4.152
57 1HD1 ILE 7 1HD1 ILE 7 -10.677 0.329 1.865
58 2HD1 ILE 7 2HD1 ILE 7 -12.347 0.272 2.425
59 3HD1 ILE 7 3HD1 ILE 7 -11.955 -0.200 0.772
60 HA PRO 8 HA PRO 8 -7.932 -4.324 2.766
61 1HB PRO 8 2HB PRO 8 -6.489 -6.402 1.315
62 2HB PRO 8 1HB PRO 8 -7.472 -6.545 2.773
63 1HG PRO 8 2HG PRO 8 -8.232 -7.581 0.386
64 2HG PRO 8 1HG PRO 8 -9.390 -6.997 1.594
65 1HD PRO 8 2HD PRO 8 -8.391 -5.639 -0.884
66 2HD PRO 8 1HD PRO 8 -10.040 -5.708 -0.225
67 HA PRO 9 HA PRO 9 -4.659 -1.711 1.244
68 1HB PRO 9 2HB PRO 9 -3.113 -1.808 3.526
69 2HB PRO 9 1HB PRO 9 -4.491 -0.729 3.292
70 1HG PRO 9 2HG PRO 9 -4.348 -3.335 4.747
71 2HG PRO 9 1HG PRO 9 -5.216 -1.851 5.184
72 1HD PRO 9 2HD PRO 9 -6.479 -3.971 4.115
73 2HD PRO 9 1HD PRO 9 -6.972 -2.306 3.748
74 H ILE 10 H ILE 10 -3.248 -2.465 -0.179
75 HA ILE 10 HA ILE 10 -1.899 -4.986 0.195
76 HB ILE 10 HB ILE 10 -1.537 -2.915 -1.983
77 1HG1 ILE 10 2HG1 ILE 10 -3.827 -3.765 -1.940
78 2HG1 ILE 10 1HG1 ILE 10 -2.970 -4.395 -3.343
79 1HG2 ILE 10 1HG2 ILE 10 0.383 -4.391 -1.802
80 2HG2 ILE 10 2HG2 ILE 10 -0.530 -4.749 -3.268
81 3HG2 ILE 10 3HG2 ILE 10 -0.673 -5.803 -1.861
82 1HD1 ILE 10 1HD1 ILE 10 -4.212 -6.189 -2.488
83 2HD1 ILE 10 2HD1 ILE 10 -3.735 -5.836 -0.827
84 3HD1 ILE 10 3HD1 ILE 10 -2.553 -6.480 -1.964
85 1HN ABA 11 H ABU 11 -0.001 -5.241 1.160
86 HA ABA 11 HA ABU 11 1.569 -2.855 1.789
87 1HB ABA 11 1HB ABU 11 2.584 -4.126 3.553
88 2HB ABA 11 2HB ABU 11 1.931 -5.633 2.924
89 1HG ABA 11 1HG1 ABU 11 -0.206 -3.810 3.460
90 2HG ABA 11 2HG1 ABU 11 0.827 -3.974 4.882
91 3HG ABA 11 3HG1 ABU 11 0.107 -5.406 4.144
92 H PHE 12 H PHE 12 3.376 -2.435 0.759
93 HA PHE 12 HA PHE 12 4.520 -4.442 -1.023
94 1HB PHE 12 2HB PHE 12 5.016 -1.472 -0.722
95 2HB PHE 12 1HB PHE 12 5.917 -2.501 -1.829
96 HD1 PHE 12 1HD PHE 12 5.261 -2.440 -4.010
97 HD2 PHE 12 2HD PHE 12 2.334 -1.809 -0.985
98 HE1 PHE 12 1HE PHE 12 3.553 -2.073 -5.742
99 HE2 PHE 12 2HE PHE 12 0.622 -1.445 -2.712
100 HZ PHE 12 HZ PHE 12 1.230 -1.577 -5.094
101 HA PRO 13 HA PRO 13 7.923 -5.577 1.523
102 1HB PRO 13 2HB PRO 13 10.022 -5.372 -0.278
103 2HB PRO 13 1HB PRO 13 8.947 -6.761 -0.117
104 1HG PRO 13 2HG PRO 13 8.853 -4.506 -2.073
105 2HG PRO 13 1HG PRO 13 8.533 -6.231 -2.332
106 1HD PRO 13 2HD PRO 13 6.534 -4.465 -2.132
107 2HD PRO 13 1HD PRO 13 6.393 -6.093 -1.436
108 H ASP 14 H ASP 14 8.240 -2.595 -0.314
109 HA ASP 14 HA ASP 14 10.498 -1.627 1.162
110 1HB ASP 14 2HB ASP 14 10.315 0.356 -0.119
111 2HB ASP 14 1HB ASP 14 9.838 -0.943 -1.207
Start of MODEL 11
1 1H GLY 1 H GLY 1 7.102 -1.732 1.700
2 1HA GLY 1 2HA GLY 1 6.376 -1.284 4.024
3 2HA GLY 1 1HA GLY 1 7.340 0.185 3.938
4 H ARG 2 H ARG 2 6.153 -0.019 0.964
5 HA ARG 2 HA ARG 2 4.290 2.077 1.296
6 1HB ARG 2 2HB ARG 2 5.685 1.087 -0.796
7 2HB ARG 2 1HB ARG 2 4.101 0.406 -1.139
8 1HG ARG 2 2HG ARG 2 4.432 2.521 -2.292
9 2HG ARG 2 1HG ARG 2 3.124 2.635 -1.114
10 1HD ARG 2 2HD ARG 2 4.738 4.582 -1.181
11 2HD ARG 2 1HD ARG 2 4.462 3.856 0.401
12 HE ARG 2 HE ARG 2 6.680 2.579 -0.696
13 1HH1 ARG 2 1HH1 ARG 2 5.824 5.837 0.298
14 2HH1 ARG 2 2HH1 ARG 2 7.440 6.250 0.759
15 1HH2 ARG 2 1HH2 ARG 2 8.768 3.095 -0.093
16 2HH2 ARG 2 2HH2 ARG 2 9.136 4.679 0.536
17 1HN ABA 3 H ABU 3 2.039 2.097 1.147
18 HA ABA 3 HA ABU 3 0.654 -0.474 1.087
19 1HB ABA 3 1HB ABU 3 -0.440 1.358 3.102
20 2HB ABA 3 2HB ABU 3 1.170 0.763 3.497
21 1HG ABA 3 1HG1 ABU 3 0.226 -1.071 4.282
22 2HG ABA 3 2HG1 ABU 3 -0.271 -1.471 2.636
23 3HG ABA 3 3HG1 ABU 3 -1.357 -0.565 3.690
24 H THR 4 H THR 4 -1.204 -0.382 -0.043
25 HA THR 4 HA THR 4 -1.843 2.049 -1.408
26 HB THR 4 HB THR 4 -3.652 0.763 -2.473
27 HG1 THR 4 1HG THR 4 -4.440 -0.842 -1.360
28 1HG2 THR 4 1HG2 THR 4 -1.403 -1.164 -2.526
29 2HG2 THR 4 2HG2 THR 4 -1.029 0.511 -2.934
30 3HG2 THR 4 3HG2 THR 4 -2.249 -0.370 -3.855
31 H LYS 5 H LYS 5 -3.671 3.315 -1.231
32 HA LYS 5 HA LYS 5 -4.889 3.393 1.382
33 1HB LYS 5 2HB LYS 5 -4.136 5.450 0.161
34 2HB LYS 5 1HB LYS 5 -5.411 5.167 -1.015
35 1HG LYS 5 2HG LYS 5 -7.061 5.326 0.853
36 2HG LYS 5 1HG LYS 5 -5.732 5.813 1.905
37 1HD LYS 5 2HD LYS 5 -5.342 7.786 0.629
38 2HD LYS 5 1HD LYS 5 -6.435 7.247 -0.649
39 1HE LYS 5 2HE LYS 5 -7.217 7.947 2.180
40 2HE LYS 5 1HE LYS 5 -7.486 8.948 0.752
41 1HZ LYS 5 1HZ LYS 5 -9.229 7.708 0.110
42 2HZ LYS 5 2HZ LYS 5 -9.281 7.231 1.731
43 3HZ LYS 5 3HZ LYS 5 -8.522 6.244 0.584
44 H SER 6 H SER 6 -5.572 1.079 0.272
45 HA SER 6 HA SER 6 -8.435 1.404 -0.302
46 1HB SER 6 2HB SER 6 -8.248 -0.524 -1.895
47 2HB SER 6 1HB SER 6 -7.386 0.916 -2.439
48 HG SER 6 HG SER 6 -6.415 -1.560 -1.683
49 H ILE 7 H ILE 7 -9.423 -0.994 -0.168
50 HA ILE 7 HA ILE 7 -8.168 -2.416 2.054
51 HB ILE 7 HB ILE 7 -10.348 -2.771 3.159
52 1HG1 ILE 7 2HG1 ILE 7 -11.726 -2.201 1.093
53 2HG1 ILE 7 1HG1 ILE 7 -12.317 -1.578 2.627
54 1HG2 ILE 7 1HG2 ILE 7 -8.851 -1.111 4.039
55 2HG2 ILE 7 2HG2 ILE 7 -10.514 -0.553 4.205
56 3HG2 ILE 7 3HG2 ILE 7 -9.488 0.104 2.931
57 1HD1 ILE 7 1HD1 ILE 7 -11.481 0.622 2.092
58 2HD1 ILE 7 2HD1 ILE 7 -12.509 0.037 0.785
59 3HD1 ILE 7 3HD1 ILE 7 -10.754 0.016 0.605
60 HA PRO 8 HA PRO 8 -7.920 -4.243 2.893
61 1HB PRO 8 2HB PRO 8 -6.270 -6.277 2.182
62 2HB PRO 8 1HB PRO 8 -7.868 -6.544 2.889
63 1HG PRO 8 2HG PRO 8 -7.018 -6.662 0.023
64 2HG PRO 8 1HG PRO 8 -8.102 -7.746 0.915
65 1HD PRO 8 2HD PRO 8 -9.004 -5.789 -0.742
66 2HD PRO 8 1HD PRO 8 -9.905 -6.339 0.685
67 HA PRO 9 HA PRO 9 -4.726 -1.698 1.150
68 1HB PRO 9 2HB PRO 9 -3.247 -2.095 3.655
69 2HB PRO 9 1HB PRO 9 -3.946 -0.617 2.990
70 1HG PRO 9 2HG PRO 9 -4.977 -1.848 5.158
71 2HG PRO 9 1HG PRO 9 -5.986 -0.971 3.992
72 1HD PRO 9 2HD PRO 9 -5.544 -3.917 4.282
73 2HD PRO 9 1HD PRO 9 -7.041 -3.032 3.922
74 H ILE 10 H ILE 10 -3.256 -2.379 -0.267
75 HA ILE 10 HA ILE 10 -1.893 -4.898 0.081
76 HB ILE 10 HB ILE 10 -1.545 -2.808 -2.079
77 1HG1 ILE 10 2HG1 ILE 10 -3.830 -3.657 -2.054
78 2HG1 ILE 10 1HG1 ILE 10 -2.969 -4.296 -3.450
79 1HG2 ILE 10 1HG2 ILE 10 0.095 -4.049 -2.910
80 2HG2 ILE 10 2HG2 ILE 10 -0.934 -5.482 -2.899
81 3HG2 ILE 10 3HG2 ILE 10 0.013 -5.066 -1.472
82 1HD1 ILE 10 1HD1 ILE 10 -4.216 -6.084 -2.592
83 2HD1 ILE 10 2HD1 ILE 10 -3.749 -5.723 -0.931
84 3HD1 ILE 10 3HD1 ILE 10 -2.560 -6.374 -2.058
85 1HN ABA 11 H ABU 11 0.008 -5.146 1.057
86 HA ABA 11 HA ABU 11 1.587 -2.747 1.633
87 1HB ABA 11 1HB ABU 11 2.210 -5.362 2.919
88 2HB ABA 11 2HB ABU 11 0.725 -4.547 3.399
89 1HG ABA 11 1HG1 ABU 11 3.508 -3.420 3.557
90 2HG ABA 11 2HG1 ABU 11 2.513 -3.974 4.905
91 3HG ABA 11 3HG1 ABU 11 2.032 -2.553 3.979
92 H PHE 12 H PHE 12 3.440 -2.412 0.664
93 HA PHE 12 HA PHE 12 4.576 -4.501 -1.030
94 1HB PHE 12 2HB PHE 12 5.147 -1.534 -0.827
95 2HB PHE 12 1HB PHE 12 6.002 -2.628 -1.905
96 HD1 PHE 12 1HD PHE 12 2.475 -1.699 -1.068
97 HD2 PHE 12 2HD PHE 12 5.310 -2.696 -4.082
98 HE1 PHE 12 1HE PHE 12 0.759 -1.345 -2.792
99 HE2 PHE 12 2HE PHE 12 3.598 -2.342 -5.811
100 HZ PHE 12 HZ PHE 12 1.318 -1.665 -5.168
101 HA PRO 13 HA PRO 13 7.921 -5.615 1.603
102 1HB PRO 13 2HB PRO 13 9.755 -5.067 -0.674
103 2HB PRO 13 1HB PRO 13 9.563 -6.535 0.291
104 1HG PRO 13 2HG PRO 13 8.589 -6.409 -2.178
105 2HG PRO 13 1HG PRO 13 7.681 -7.219 -0.886
106 1HD PRO 13 2HD PRO 13 7.246 -4.525 -2.108
107 2HD PRO 13 1HD PRO 13 6.055 -5.729 -1.575
108 H ASP 14 H ASP 14 8.291 -2.646 -0.248
109 HA ASP 14 HA ASP 14 10.501 -1.657 1.282
110 1HB ASP 14 2HB ASP 14 10.343 0.313 -0.016
111 2HB ASP 14 1HB ASP 14 9.878 -0.987 -1.108
Start of MODEL 12
1 1H GLY 1 H GLY 1 6.991 -1.511 1.662
2 1HA GLY 1 2HA GLY 1 6.205 -1.685 4.107
3 2HA GLY 1 1HA GLY 1 7.112 -0.191 4.289
4 H ARG 2 H ARG 2 6.072 0.158 1.292
5 HA ARG 2 HA ARG 2 4.103 2.066 1.915
6 1HB ARG 2 2HB ARG 2 5.510 1.322 -0.363
7 2HB ARG 2 1HB ARG 2 3.834 0.991 -0.776
8 1HG ARG 2 2HG ARG 2 3.656 3.141 -1.297
9 2HG ARG 2 1HG ARG 2 3.744 3.481 0.433
10 1HD ARG 2 2HD ARG 2 5.978 3.491 -1.582
11 2HD ARG 2 1HD ARG 2 5.389 4.834 -0.604
12 HE ARG 2 HE ARG 2 7.292 2.817 0.158
13 1HH1 ARG 2 1HH1 ARG 2 4.930 5.103 1.414
14 2HH1 ARG 2 2HH1 ARG 2 5.605 5.098 3.007
15 1HH2 ARG 2 1HH2 ARG 2 8.159 2.802 2.199
16 2HH2 ARG 2 2HH2 ARG 2 7.465 3.775 3.466
17 1HN ABA 3 H ABU 3 1.842 2.077 1.447
18 HA ABA 3 HA ABU 3 0.569 -0.535 1.133
19 1HB ABA 3 1HB ABU 3 -0.990 0.892 3.023
20 2HB ABA 3 2HB ABU 3 0.673 0.941 3.598
21 1HG ABA 3 1HG1 ABU 3 -0.238 -0.961 4.579
22 2HG ABA 3 2HG1 ABU 3 0.700 -1.578 3.218
23 3HG ABA 3 3HG1 ABU 3 -1.055 -1.448 3.094
24 H THR 4 H THR 4 -1.162 -0.455 -0.179
25 HA THR 4 HA THR 4 -1.729 1.918 -1.613
26 HB THR 4 HB THR 4 -3.566 0.630 -2.658
27 HG1 THR 4 1HG THR 4 -4.395 -0.928 -1.504
28 1HG2 THR 4 1HG2 THR 4 -1.997 -0.181 -4.010
29 2HG2 THR 4 2HG2 THR 4 -1.645 -1.472 -2.859
30 3HG2 THR 4 3HG2 THR 4 -0.793 0.069 -2.744
31 H LYS 5 H LYS 5 -3.696 3.102 -1.719
32 HA LYS 5 HA LYS 5 -4.904 3.519 0.868
33 1HB LYS 5 2HB LYS 5 -5.373 4.910 -1.778
34 2HB LYS 5 1HB LYS 5 -6.063 5.408 -0.238
35 1HG LYS 5 2HG LYS 5 -3.136 5.355 -0.952
36 2HG LYS 5 1HG LYS 5 -4.156 6.785 -0.797
37 1HD LYS 5 2HD LYS 5 -3.502 4.844 1.421
38 2HD LYS 5 1HD LYS 5 -2.762 6.430 1.195
39 1HE LYS 5 2HE LYS 5 -4.925 7.501 1.508
40 2HE LYS 5 1HE LYS 5 -5.698 5.924 1.671
41 1HZ LYS 5 1HZ LYS 5 -5.306 6.913 3.825
42 2HZ LYS 5 2HZ LYS 5 -3.654 7.062 3.501
43 3HZ LYS 5 3HZ LYS 5 -4.351 5.526 3.651
44 H SER 6 H SER 6 -5.513 1.033 0.060
45 HA SER 6 HA SER 6 -8.390 1.219 -0.510
46 1HB SER 6 2HB SER 6 -8.184 -0.917 -1.792
47 2HB SER 6 1HB SER 6 -7.324 0.425 -2.546
48 HG SER 6 HG SER 6 -6.343 -1.893 -1.370
49 H ILE 7 H ILE 7 -9.379 -1.081 0.022
50 HA ILE 7 HA ILE 7 -8.105 -2.211 2.408
51 HB ILE 7 HB ILE 7 -11.009 -1.351 2.284
52 1HG1 ILE 7 2HG1 ILE 7 -8.772 -0.349 4.062
53 2HG1 ILE 7 1HG1 ILE 7 -9.398 0.509 2.658
54 1HG2 ILE 7 1HG2 ILE 7 -9.526 -2.605 4.589
55 2HG2 ILE 7 2HG2 ILE 7 -10.583 -3.491 3.489
56 3HG2 ILE 7 3HG2 ILE 7 -11.243 -2.210 4.505
57 1HD1 ILE 7 1HD1 ILE 7 -11.151 1.294 3.787
58 2HD1 ILE 7 2HD1 ILE 7 -10.237 0.846 5.227
59 3HD1 ILE 7 3HD1 ILE 7 -11.455 -0.252 4.579
60 HA PRO 8 HA PRO 8 -7.677 -3.978 3.276
61 1HB PRO 8 2HB PRO 8 -6.353 -6.241 1.990
62 2HB PRO 8 1HB PRO 8 -7.047 -6.131 3.608
63 1HG PRO 8 2HG PRO 8 -8.149 -7.643 1.655
64 2HG PRO 8 1HG PRO 8 -9.116 -6.856 2.916
65 1HD PRO 8 2HD PRO 8 -8.645 -6.005 0.080
66 2HD PRO 8 1HD PRO 8 -10.150 -5.986 1.027
67 HA PRO 9 HA PRO 9 -4.695 -1.763 0.842
68 1HB PRO 9 2HB PRO 9 -2.881 -1.265 2.795
69 2HB PRO 9 1HB PRO 9 -4.426 -0.414 2.685
70 1HG PRO 9 2HG PRO 9 -3.646 -2.708 4.437
71 2HG PRO 9 1HG PRO 9 -4.602 -1.270 4.836
72 1HD PRO 9 2HD PRO 9 -5.716 -3.693 4.307
73 2HD PRO 9 1HD PRO 9 -6.532 -2.157 3.961
74 H ILE 10 H ILE 10 -3.150 -2.467 -0.481
75 HA ILE 10 HA ILE 10 -1.819 -4.978 0.035
76 HB ILE 10 HB ILE 10 -1.645 -3.042 -2.286
77 1HG1 ILE 10 2HG1 ILE 10 -2.581 -5.127 -3.485
78 2HG1 ILE 10 1HG1 ILE 10 -2.953 -5.725 -1.874
79 1HG2 ILE 10 1HG2 ILE 10 -0.008 -4.251 -3.306
80 2HG2 ILE 10 2HG2 ILE 10 -0.443 -5.748 -2.484
81 3HG2 ILE 10 3HG2 ILE 10 0.463 -4.502 -1.626
82 1HD1 ILE 10 1HD1 ILE 10 -4.080 -3.329 -3.277
83 2HD1 ILE 10 2HD1 ILE 10 -4.250 -3.575 -1.539
84 3HD1 ILE 10 3HD1 ILE 10 -4.927 -4.749 -2.666
85 1HN ABA 11 H ABU 11 0.116 -5.198 0.955
86 HA ABA 11 HA ABU 11 1.615 -2.779 1.589
87 1HB ABA 11 1HB ABU 11 2.414 -5.477 2.596
88 2HB ABA 11 2HB ABU 11 0.951 -4.735 3.236
89 1HG ABA 11 1HG1 ABU 11 2.531 -2.676 3.591
90 2HG ABA 11 2HG1 ABU 11 3.785 -3.916 3.554
91 3HG ABA 11 3HG1 ABU 11 2.491 -4.006 4.748
92 H PHE 12 H PHE 12 3.431 -2.243 0.644
93 HA PHE 12 HA PHE 12 4.576 -3.966 -1.392
94 1HB PHE 12 2HB PHE 12 5.137 -1.117 -0.545
95 2HB PHE 12 1HB PHE 12 6.087 -1.953 -1.766
96 HD1 PHE 12 1HD PHE 12 2.425 -1.568 -1.069
97 HD2 PHE 12 2HD PHE 12 5.602 -1.264 -3.884
98 HE1 PHE 12 1HE PHE 12 0.821 -0.876 -2.799
99 HE2 PHE 12 2HE PHE 12 4.002 -0.570 -5.618
100 HZ PHE 12 HZ PHE 12 1.609 -0.375 -5.077
101 HA PRO 13 HA PRO 13 7.910 -5.723 0.879
102 1HB PRO 13 2HB PRO 13 9.746 -4.579 -1.172
103 2HB PRO 13 1HB PRO 13 9.593 -6.244 -0.599
104 1HG PRO 13 2HG PRO 13 8.607 -5.535 -2.964
105 2HG PRO 13 1HG PRO 13 7.729 -6.665 -1.917
106 1HD PRO 13 2HD PRO 13 7.200 -3.779 -2.460
107 2HD PRO 13 1HD PRO 13 6.054 -5.108 -2.197
108 H ASP 14 H ASP 14 8.346 -2.378 -0.182
109 HA ASP 14 HA ASP 14 10.473 -1.850 1.670
110 1HB ASP 14 2HB ASP 14 10.524 0.324 0.809
111 2HB ASP 14 1HB ASP 14 9.979 -0.634 -0.564
Start of MODEL 13
1 1H GLY 1 H GLY 1 6.986 -1.520 1.445
2 1HA GLY 1 2HA GLY 1 6.523 -1.237 3.936
3 2HA GLY 1 1HA GLY 1 7.446 0.244 3.759
4 H ARG 2 H ARG 2 6.172 0.489 0.973
5 HA ARG 2 HA ARG 2 4.146 2.291 1.746
6 1HB ARG 2 2HB ARG 2 4.026 2.871 -0.453
7 2HB ARG 2 1HB ARG 2 5.560 2.018 -0.495
8 1HG ARG 2 2HG ARG 2 4.294 -0.029 -1.196
9 2HG ARG 2 1HG ARG 2 2.870 0.999 -1.364
10 1HD ARG 2 2HD ARG 2 3.763 0.905 -3.516
11 2HD ARG 2 1HD ARG 2 4.329 2.451 -2.883
12 HE ARG 2 HE ARG 2 6.256 0.470 -2.327
13 1HH1 ARG 2 1HH1 ARG 2 4.933 2.276 -5.028
14 2HH1 ARG 2 2HH1 ARG 2 6.350 2.103 -6.004
15 1HH2 ARG 2 1HH2 ARG 2 8.098 0.204 -3.603
16 2HH2 ARG 2 2HH2 ARG 2 8.171 0.923 -5.189
17 1HN ABA 3 H ABU 3 1.909 2.207 1.548
18 HA ABA 3 HA ABU 3 0.714 -0.449 1.167
19 1HB ABA 3 1HB ABU 3 -0.366 1.380 3.279
20 2HB ABA 3 2HB ABU 3 1.047 0.396 3.645
21 1HG ABA 3 1HG1 ABU 3 -1.760 -0.375 3.333
22 2HG ABA 3 2HG1 ABU 3 -0.477 -1.097 4.305
23 3HG ABA 3 3HG1 ABU 3 -0.592 -1.464 2.584
24 H THR 4 H THR 4 -1.168 -0.439 0.020
25 HA THR 4 HA THR 4 -1.861 1.954 -1.368
26 HB THR 4 HB THR 4 -3.626 0.632 -2.434
27 HG1 THR 4 1HG THR 4 -4.460 -0.900 -1.245
28 1HG2 THR 4 1HG2 THR 4 -2.239 -0.959 -3.562
29 2HG2 THR 4 2HG2 THR 4 -1.117 -1.025 -2.202
30 3HG2 THR 4 3HG2 THR 4 -1.241 0.443 -3.174
31 H LYS 5 H LYS 5 -3.634 3.261 -1.158
32 HA LYS 5 HA LYS 5 -4.942 3.260 1.422
33 1HB LYS 5 2HB LYS 5 -4.079 5.349 0.275
34 2HB LYS 5 1HB LYS 5 -5.382 5.161 -0.891
35 1HG LYS 5 2HG LYS 5 -7.014 5.330 0.958
36 2HG LYS 5 1HG LYS 5 -5.675 5.625 2.070
37 1HD LYS 5 2HD LYS 5 -5.072 7.634 0.838
38 2HD LYS 5 1HD LYS 5 -6.361 7.326 -0.327
39 1HE LYS 5 2HE LYS 5 -8.016 7.527 1.479
40 2HE LYS 5 1HE LYS 5 -6.715 7.877 2.618
41 1HZ LYS 5 1HZ LYS 5 -6.414 9.953 1.780
42 2HZ LYS 5 2HZ LYS 5 -8.062 9.782 1.443
43 3HZ LYS 5 3HZ LYS 5 -6.921 9.539 0.219
44 H SER 6 H SER 6 -5.614 1.019 0.189
45 HA SER 6 HA SER 6 -8.467 1.340 -0.299
46 1HB SER 6 2HB SER 6 -8.307 -0.166 -2.312
47 2HB SER 6 1HB SER 6 -7.580 1.422 -2.556
48 HG SER 6 HG SER 6 -6.381 -1.085 -2.374
49 H ILE 7 H ILE 7 -9.590 -0.337 0.610
50 HA ILE 7 HA ILE 7 -8.019 -2.364 1.979
51 HB ILE 7 HB ILE 7 -10.198 -2.998 3.035
52 1HG1 ILE 7 2HG1 ILE 7 -11.219 -0.522 1.620
53 2HG1 ILE 7 1HG1 ILE 7 -11.670 -2.175 1.215
54 1HG2 ILE 7 1HG2 ILE 7 -9.521 -0.079 3.334
55 2HG2 ILE 7 2HG2 ILE 7 -8.563 -1.393 4.018
56 3HG2 ILE 7 3HG2 ILE 7 -10.229 -1.147 4.547
57 1HD1 ILE 7 1HD1 ILE 7 -12.093 -1.543 4.020
58 2HD1 ILE 7 2HD1 ILE 7 -13.189 -2.259 2.837
59 3HD1 ILE 7 3HD1 ILE 7 -13.009 -0.506 2.926
60 HA PRO 8 HA PRO 8 -7.924 -4.347 2.730
61 1HB PRO 8 2HB PRO 8 -6.393 -6.414 1.359
62 2HB PRO 8 1HB PRO 8 -7.436 -6.562 2.775
63 1HG PRO 8 2HG PRO 8 -8.072 -7.626 0.363
64 2HG PRO 8 1HG PRO 8 -9.291 -7.062 1.520
65 1HD PRO 8 2HD PRO 8 -8.219 -5.695 -0.924
66 2HD PRO 8 1HD PRO 8 -9.892 -5.794 -0.330
67 HA PRO 9 HA PRO 9 -4.641 -1.679 1.322
68 1HB PRO 9 2HB PRO 9 -3.459 -2.315 3.967
69 2HB PRO 9 1HB PRO 9 -3.867 -0.747 3.261
70 1HG PRO 9 2HG PRO 9 -5.348 -1.797 5.216
71 2HG PRO 9 1HG PRO 9 -6.095 -0.899 3.881
72 1HD PRO 9 2HD PRO 9 -5.937 -3.855 4.324
73 2HD PRO 9 1HD PRO 9 -7.288 -2.878 3.710
74 H ILE 10 H ILE 10 -3.263 -2.485 -0.121
75 HA ILE 10 HA ILE 10 -1.859 -4.964 0.317
76 HB ILE 10 HB ILE 10 -1.539 -2.964 -1.933
77 1HG1 ILE 10 2HG1 ILE 10 -3.206 -5.490 -1.830
78 2HG1 ILE 10 1HG1 ILE 10 -3.851 -3.856 -1.718
79 1HG2 ILE 10 1HG2 ILE 10 -0.983 -5.762 -2.502
80 2HG2 ILE 10 2HG2 ILE 10 0.078 -5.096 -1.262
81 3HG2 ILE 10 3HG2 ILE 10 -0.020 -4.324 -2.844
82 1HD1 ILE 10 1HD1 ILE 10 -2.256 -3.978 -4.046
83 2HD1 ILE 10 2HD1 ILE 10 -4.006 -3.792 -3.919
84 3HD1 ILE 10 3HD1 ILE 10 -3.295 -5.403 -4.031
85 1HN ABA 11 H ABU 11 0.019 -5.139 1.322
86 HA ABA 11 HA ABU 11 1.610 -2.725 1.785
87 1HB ABA 11 1HB ABU 11 2.697 -3.973 3.571
88 2HB ABA 11 2HB ABU 11 1.862 -5.446 3.090
89 1HG ABA 11 1HG1 ABU 11 0.264 -4.947 4.525
90 2HG ABA 11 2HG1 ABU 11 -0.136 -3.536 3.546
91 3HG ABA 11 3HG1 ABU 11 1.012 -3.390 4.876
92 H PHE 12 H PHE 12 3.388 -2.384 0.652
93 HA PHE 12 HA PHE 12 4.452 -4.517 -1.019
94 1HB PHE 12 2HB PHE 12 4.966 -1.548 -0.869
95 2HB PHE 12 1HB PHE 12 5.963 -2.618 -1.847
96 HD1 PHE 12 1HD PHE 12 5.489 -2.444 -4.068
97 HD2 PHE 12 2HD PHE 12 2.279 -2.253 -1.280
98 HE1 PHE 12 1HE PHE 12 3.890 -2.243 -5.928
99 HE2 PHE 12 2HE PHE 12 0.676 -2.054 -3.134
100 HZ PHE 12 HZ PHE 12 1.480 -2.049 -5.461
101 HA PRO 13 HA PRO 13 7.876 -5.709 1.468
102 1HB PRO 13 2HB PRO 13 9.962 -5.476 -0.363
103 2HB PRO 13 1HB PRO 13 8.916 -6.885 -0.169
104 1HG PRO 13 2HG PRO 13 8.759 -4.665 -2.158
105 2HG PRO 13 1HG PRO 13 8.435 -6.395 -2.375
106 1HD PRO 13 2HD PRO 13 6.439 -4.627 -2.168
107 2HD PRO 13 1HD PRO 13 6.314 -6.240 -1.434
108 H ASP 14 H ASP 14 8.228 -2.765 -0.415
109 HA ASP 14 HA ASP 14 10.462 -1.753 1.022
110 1HB ASP 14 2HB ASP 14 9.746 0.459 -0.046
111 2HB ASP 14 1HB ASP 14 10.196 -0.851 -1.130
Start of MODEL 14
1 1H GLY 1 H GLY 1 7.036 -1.315 1.821
2 1HA GLY 1 2HA GLY 1 6.625 -0.591 4.331
3 2HA GLY 1 1HA GLY 1 7.565 0.789 3.780
4 H ARG 2 H ARG 2 6.333 0.446 1.048
5 HA ARG 2 HA ARG 2 4.269 2.339 1.363
6 1HB ARG 2 2HB ARG 2 5.328 0.727 -0.907
7 2HB ARG 2 1HB ARG 2 3.784 1.543 -1.108
8 1HG ARG 2 2HG ARG 2 4.747 3.666 -0.815
9 2HG ARG 2 1HG ARG 2 6.242 2.986 -0.169
10 1HD ARG 2 2HD ARG 2 5.306 2.414 -2.965
11 2HD ARG 2 1HD ARG 2 6.278 3.834 -2.577
12 HE ARG 2 HE ARG 2 7.602 1.660 -1.474
13 1HH1 ARG 2 1HH1 ARG 2 6.632 2.677 -4.692
14 2HH1 ARG 2 2HH1 ARG 2 7.989 1.936 -5.464
15 1HH2 ARG 2 1HH2 ARG 2 9.368 0.717 -2.461
16 2HH2 ARG 2 2HH2 ARG 2 9.565 0.802 -4.185
17 1HN ABA 3 H ABU 3 2.043 2.181 0.974
18 HA ABA 3 HA ABU 3 0.814 -0.445 0.875
19 1HB ABA 3 1HB ABU 3 -0.111 1.382 3.066
20 2HB ABA 3 2HB ABU 3 1.297 0.362 3.341
21 1HG ABA 3 1HG1 ABU 3 -1.458 -0.580 2.597
22 2HG ABA 3 2HG1 ABU 3 -0.693 -0.703 4.182
23 3HG ABA 3 3HG1 ABU 3 -0.047 -1.616 2.817
24 H THR 4 H THR 4 -1.085 -0.380 -0.219
25 HA THR 4 HA THR 4 -1.839 2.090 -1.455
26 HB THR 4 HB THR 4 -3.629 0.774 -2.538
27 HG1 THR 4 1HG THR 4 -4.284 -0.963 -1.545
28 1HG2 THR 4 1HG2 THR 4 -1.397 -1.092 -2.857
29 2HG2 THR 4 2HG2 THR 4 -0.932 0.605 -2.978
30 3HG2 THR 4 3HG2 THR 4 -2.178 -0.046 -4.043
31 H LYS 5 H LYS 5 -3.692 3.293 -1.158
32 HA LYS 5 HA LYS 5 -4.878 3.160 1.465
33 1HB LYS 5 2HB LYS 5 -6.060 5.234 0.765
34 2HB LYS 5 1HB LYS 5 -4.314 5.343 0.605
35 1HG LYS 5 2HG LYS 5 -4.468 5.028 -1.781
36 2HG LYS 5 1HG LYS 5 -6.208 4.764 -1.664
37 1HD LYS 5 2HD LYS 5 -6.466 7.055 -0.781
38 2HD LYS 5 1HD LYS 5 -4.732 7.308 -0.991
39 1HE LYS 5 2HE LYS 5 -4.954 6.953 -3.388
40 2HE LYS 5 1HE LYS 5 -6.679 6.638 -3.195
41 1HZ LYS 5 1HZ LYS 5 -5.271 9.147 -3.289
42 2HZ LYS 5 2HZ LYS 5 -6.379 9.046 -2.014
43 3HZ LYS 5 3HZ LYS 5 -6.899 8.806 -3.606
44 H SER 6 H SER 6 -5.493 0.898 0.162
45 HA SER 6 HA SER 6 -8.347 1.200 -0.500
46 1HB SER 6 2HB SER 6 -8.062 -0.871 -1.885
47 2HB SER 6 1HB SER 6 -7.128 0.501 -2.480
48 HG SER 6 HG SER 6 -6.251 -1.843 -1.195
49 H ILE 7 H ILE 7 -9.414 -1.122 -0.223
50 HA ILE 7 HA ILE 7 -8.419 -2.371 2.240
51 HB ILE 7 HB ILE 7 -11.276 -1.508 1.735
52 1HG1 ILE 7 2HG1 ILE 7 -9.767 0.250 2.609
53 2HG1 ILE 7 1HG1 ILE 7 -11.024 -0.184 3.760
54 1HG2 ILE 7 1HG2 ILE 7 -11.001 -2.556 4.336
55 2HG2 ILE 7 2HG2 ILE 7 -10.298 -3.737 3.229
56 3HG2 ILE 7 3HG2 ILE 7 -11.961 -3.194 3.000
57 1HD1 ILE 7 1HD1 ILE 7 -8.213 -1.245 3.858
58 2HD1 ILE 7 2HD1 ILE 7 -9.473 -1.433 5.078
59 3HD1 ILE 7 3HD1 ILE 7 -8.780 0.158 4.762
60 HA PRO 8 HA PRO 8 -7.929 -4.091 2.985
61 1HB PRO 8 2HB PRO 8 -6.261 -6.132 2.400
62 2HB PRO 8 1HB PRO 8 -7.854 -6.391 3.119
63 1HG PRO 8 2HG PRO 8 -6.996 -6.659 0.265
64 2HG PRO 8 1HG PRO 8 -8.051 -7.717 1.220
65 1HD PRO 8 2HD PRO 8 -8.989 -5.865 -0.549
66 2HD PRO 8 1HD PRO 8 -9.892 -6.386 0.888
67 HA PRO 9 HA PRO 9 -4.734 -1.719 1.033
68 1HB PRO 9 2HB PRO 9 -3.136 -1.914 3.458
69 2HB PRO 9 1HB PRO 9 -3.999 -0.519 2.806
70 1HG PRO 9 2HG PRO 9 -4.749 -1.804 5.082
71 2HG PRO 9 1HG PRO 9 -5.890 -0.957 4.020
72 1HD PRO 9 2HD PRO 9 -5.314 -3.887 4.237
73 2HD PRO 9 1HD PRO 9 -6.869 -3.055 4.019
74 H ILE 10 H ILE 10 -3.236 -2.404 -0.358
75 HA ILE 10 HA ILE 10 -1.880 -4.918 0.059
76 HB ILE 10 HB ILE 10 -1.748 -2.903 -2.192
77 1HG1 ILE 10 2HG1 ILE 10 -2.644 -4.970 -3.456
78 2HG1 ILE 10 1HG1 ILE 10 -2.997 -5.625 -1.862
79 1HG2 ILE 10 1HG2 ILE 10 -0.305 -5.545 -2.023
80 2HG2 ILE 10 2HG2 ILE 10 0.449 -3.954 -1.909
81 3HG2 ILE 10 3HG2 ILE 10 -0.332 -4.455 -3.410
82 1HD1 ILE 10 1HD1 ILE 10 -4.013 -2.923 -2.606
83 2HD1 ILE 10 2HD1 ILE 10 -4.665 -4.096 -1.462
84 3HD1 ILE 10 3HD1 ILE 10 -4.830 -4.372 -3.196
85 1HN ABA 11 H ABU 11 -0.023 -5.123 1.097
86 HA ABA 11 HA ABU 11 1.541 -2.737 1.698
87 1HB ABA 11 1HB ABU 11 2.737 -4.218 3.300
88 2HB ABA 11 2HB ABU 11 1.723 -5.559 2.777
89 1HG ABA 11 1HG1 ABU 11 0.217 -3.212 3.628
90 2HG ABA 11 2HG1 ABU 11 1.213 -3.932 4.892
91 3HG ABA 11 3HG1 ABU 11 0.015 -4.913 4.049
92 H PHE 12 H PHE 12 3.366 -2.263 0.684
93 HA PHE 12 HA PHE 12 4.446 -4.154 -1.242
94 1HB PHE 12 2HB PHE 12 5.072 -1.254 -0.650
95 2HB PHE 12 1HB PHE 12 5.958 -2.208 -1.833
96 HD1 PHE 12 1HD PHE 12 2.349 -1.610 -1.020
97 HD2 PHE 12 2HD PHE 12 5.394 -1.758 -3.990
98 HE1 PHE 12 1HE PHE 12 0.693 -1.023 -2.741
99 HE2 PHE 12 2HE PHE 12 3.742 -1.170 -5.715
100 HZ PHE 12 HZ PHE 12 1.389 -0.802 -5.093
101 HA PRO 13 HA PRO 13 7.673 -5.598 1.415
102 1HB PRO 13 2HB PRO 13 9.507 -6.323 -0.459
103 2HB PRO 13 1HB PRO 13 8.042 -7.254 -0.127
104 1HG PRO 13 2HG PRO 13 8.576 -5.278 -2.312
105 2HG PRO 13 1HG PRO 13 7.768 -6.853 -2.402
106 1HD PRO 13 2HD PRO 13 6.391 -4.535 -2.328
107 2HD PRO 13 1HD PRO 13 5.778 -6.022 -1.576
108 H ASP 14 H ASP 14 7.663 -2.923 1.482
109 HA ASP 14 HA ASP 14 10.426 -2.268 1.831
110 1HB ASP 14 2HB ASP 14 10.667 -0.513 0.284
111 2HB ASP 14 1HB ASP 14 9.905 -1.792 -0.649
Start of MODEL 15
1 1H GLY 1 H GLY 1 7.054 -1.462 1.535
2 1HA GLY 1 2HA GLY 1 6.575 -1.225 4.097
3 2HA GLY 1 1HA GLY 1 7.495 0.251 3.873
4 H ARG 2 H ARG 2 6.258 0.527 1.096
5 HA ARG 2 HA ARG 2 4.197 2.294 1.829
6 1HB ARG 2 2HB ARG 2 5.182 1.195 -0.738
7 2HB ARG 2 1HB ARG 2 3.545 1.835 -0.741
8 1HG ARG 2 2HG ARG 2 4.853 3.642 -1.388
9 2HG ARG 2 1HG ARG 2 4.566 3.931 0.328
10 1HD ARG 2 2HD ARG 2 6.893 4.354 -0.250
11 2HD ARG 2 1HD ARG 2 6.759 2.983 0.852
12 HE ARG 2 HE ARG 2 7.565 1.600 -0.778
13 1HH1 ARG 2 1HH1 ARG 2 6.760 4.693 -2.235
14 2HH1 ARG 2 2HH1 ARG 2 7.363 4.254 -3.797
15 1HH2 ARG 2 1HH2 ARG 2 8.340 1.008 -2.817
16 2HH2 ARG 2 2HH2 ARG 2 8.272 2.149 -4.134
17 1HN ABA 3 H ABU 3 1.940 2.228 1.365
18 HA ABA 3 HA ABU 3 0.734 -0.410 1.067
19 1HB ABA 3 1HB ABU 3 -0.646 1.140 3.112
20 2HB ABA 3 2HB ABU 3 1.008 0.766 3.582
21 1HG ABA 3 1HG1 ABU 3 -1.220 -0.880 3.796
22 2HG ABA 3 2HG1 ABU 3 0.467 -1.320 4.058
23 3HG ABA 3 3HG1 ABU 3 -0.268 -1.554 2.472
24 H THR 4 H THR 4 -1.082 -0.350 -0.144
25 HA THR 4 HA THR 4 -1.778 2.084 -1.447
26 HB THR 4 HB THR 4 -3.546 0.765 -2.559
27 HG1 THR 4 1HG THR 4 -4.278 -0.925 -1.543
28 1HG2 THR 4 1HG2 THR 4 -0.772 0.406 -2.754
29 2HG2 THR 4 2HG2 THR 4 -1.989 0.041 -3.978
30 3HG2 THR 4 3HG2 THR 4 -1.473 -1.210 -2.848
31 H LYS 5 H LYS 5 -3.734 3.222 -1.370
32 HA LYS 5 HA LYS 5 -4.975 3.272 1.242
33 1HB LYS 5 2HB LYS 5 -5.141 5.056 -1.179
34 2HB LYS 5 1HB LYS 5 -6.272 5.227 0.155
35 1HG LYS 5 2HG LYS 5 -4.538 6.813 0.480
36 2HG LYS 5 1HG LYS 5 -4.311 5.536 1.675
37 1HD LYS 5 2HD LYS 5 -2.605 4.515 0.192
38 2HD LYS 5 1HD LYS 5 -2.790 5.881 -0.909
39 1HE LYS 5 2HE LYS 5 -1.905 6.039 1.972
40 2HE LYS 5 1HE LYS 5 -0.852 6.158 0.563
41 1HZ LYS 5 1HZ LYS 5 -1.991 8.162 -0.101
42 2HZ LYS 5 2HZ LYS 5 -1.428 8.333 1.483
43 3HZ LYS 5 3HZ LYS 5 -3.068 8.031 1.196
44 H SER 6 H SER 6 -5.532 0.935 0.151
45 HA SER 6 HA SER 6 -8.374 1.141 -0.585
46 1HB SER 6 2HB SER 6 -8.037 -0.915 -1.970
47 2HB SER 6 1HB SER 6 -7.132 0.473 -2.572
48 HG SER 6 HG SER 6 -6.208 -1.854 -1.292
49 H ILE 7 H ILE 7 -9.443 -1.113 -0.197
50 HA ILE 7 HA ILE 7 -8.322 -2.351 2.221
51 HB ILE 7 HB ILE 7 -11.241 -1.634 1.823
52 1HG1 ILE 7 2HG1 ILE 7 -10.695 -0.458 4.126
53 2HG1 ILE 7 1HG1 ILE 7 -9.054 -0.455 3.492
54 1HG2 ILE 7 1HG2 ILE 7 -10.074 -3.722 3.325
55 2HG2 ILE 7 2HG2 ILE 7 -11.762 -3.216 3.280
56 3HG2 ILE 7 3HG2 ILE 7 -10.663 -2.512 4.465
57 1HD1 ILE 7 1HD1 ILE 7 -11.442 0.748 2.112
58 2HD1 ILE 7 2HD1 ILE 7 -9.765 0.823 1.572
59 3HD1 ILE 7 3HD1 ILE 7 -10.251 1.640 3.057
60 HA PRO 8 HA PRO 8 -7.855 -4.120 3.031
61 1HB PRO 8 2HB PRO 8 -6.293 -6.265 1.821
62 2HB PRO 8 1HB PRO 8 -7.171 -6.256 3.351
63 1HG PRO 8 2HG PRO 8 -7.961 -7.730 1.219
64 2HG PRO 8 1HG PRO 8 -9.102 -7.060 2.400
65 1HD PRO 8 2HD PRO 8 -8.379 -6.042 -0.325
66 2HD PRO 8 1HD PRO 8 -9.975 -6.151 0.450
67 HA PRO 9 HA PRO 9 -4.702 -1.694 1.078
68 1HB PRO 9 2HB PRO 9 -3.114 -1.931 3.519
69 2HB PRO 9 1HB PRO 9 -3.916 -0.511 2.845
70 1HG PRO 9 2HG PRO 9 -4.761 -1.729 5.111
71 2HG PRO 9 1HG PRO 9 -5.863 -0.901 3.997
72 1HD PRO 9 2HD PRO 9 -5.317 -3.829 4.301
73 2HD PRO 9 1HD PRO 9 -6.860 -2.992 4.032
74 H ILE 10 H ILE 10 -3.203 -2.348 -0.317
75 HA ILE 10 HA ILE 10 -1.840 -4.866 0.042
76 HB ILE 10 HB ILE 10 -1.493 -2.788 -2.133
77 1HG1 ILE 10 2HG1 ILE 10 -3.139 -5.331 -2.126
78 2HG1 ILE 10 1HG1 ILE 10 -3.795 -3.702 -1.996
79 1HG2 ILE 10 1HG2 ILE 10 0.233 -4.018 -2.797
80 2HG2 ILE 10 2HG2 ILE 10 -0.876 -5.362 -3.069
81 3HG2 ILE 10 3HG2 ILE 10 -0.058 -5.195 -1.516
82 1HD1 ILE 10 1HD1 ILE 10 -2.585 -5.073 -4.350
83 2HD1 ILE 10 2HD1 ILE 10 -2.564 -3.313 -4.247
84 3HD1 ILE 10 3HD1 ILE 10 -4.099 -4.179 -4.223
85 1HN ABA 11 H ABU 11 0.014 -5.076 1.099
86 HA ABA 11 HA ABU 11 1.565 -2.687 1.721
87 1HB ABA 11 1HB ABU 11 2.239 -5.400 2.789
88 2HB ABA 11 2HB ABU 11 0.814 -4.566 3.401
89 1HG ABA 11 1HG1 ABU 11 3.414 -3.123 3.335
90 2HG ABA 11 2HG1 ABU 11 3.112 -4.318 4.597
91 3HG ABA 11 3HG1 ABU 11 2.041 -2.928 4.425
92 H PHE 12 H PHE 12 3.348 -2.188 0.698
93 HA PHE 12 HA PHE 12 4.490 -3.992 -1.253
94 1HB PHE 12 2HB PHE 12 5.147 -1.154 -0.431
95 2HB PHE 12 1HB PHE 12 6.083 -2.041 -1.625
96 HD1 PHE 12 1HD PHE 12 2.423 -1.552 -1.002
97 HD2 PHE 12 2HD PHE 12 5.667 -1.317 -3.746
98 HE1 PHE 12 1HE PHE 12 0.874 -0.820 -2.765
99 HE2 PHE 12 2HE PHE 12 4.123 -0.584 -5.515
100 HZ PHE 12 HZ PHE 12 1.722 -0.334 -5.026
101 HA PRO 13 HA PRO 13 7.610 -5.849 1.247
102 1HB PRO 13 2HB PRO 13 9.770 -5.614 -0.503
103 2HB PRO 13 1HB PRO 13 8.596 -6.933 -0.483
104 1HG PRO 13 2HG PRO 13 8.706 -4.516 -2.228
105 2HG PRO 13 1HG PRO 13 8.219 -6.174 -2.630
106 1HD PRO 13 2HD PRO 13 6.404 -4.238 -2.274
107 2HD PRO 13 1HD PRO 13 6.098 -5.900 -1.725
108 H ASP 14 H ASP 14 8.258 -2.750 -0.250
109 HA ASP 14 HA ASP 14 10.514 -2.154 1.413
110 1HB ASP 14 2HB ASP 14 10.256 0.163 0.430
111 2HB ASP 14 1HB ASP 14 10.539 -1.133 -0.723
Start of MODEL 16
1 1H GLY 1 H GLY 1 7.158 -1.899 1.842
2 1HA GLY 1 2HA GLY 1 6.278 -1.333 4.009
3 2HA GLY 1 1HA GLY 1 7.264 0.123 3.980
4 H ARG 2 H ARG 2 6.023 -0.226 0.949
5 HA ARG 2 HA ARG 2 4.251 1.972 1.256
6 1HB ARG 2 2HB ARG 2 5.596 1.000 -0.851
7 2HB ARG 2 1HB ARG 2 4.033 0.250 -1.156
8 1HG ARG 2 2HG ARG 2 2.986 2.240 -1.544
9 2HG ARG 2 1HG ARG 2 4.108 3.154 -0.537
10 1HD ARG 2 2HD ARG 2 4.608 2.055 -3.301
11 2HD ARG 2 1HD ARG 2 4.471 3.751 -2.838
12 HE ARG 2 HE ARG 2 6.612 2.206 -1.583
13 1HH1 ARG 2 1HH1 ARG 2 5.701 4.595 -4.003
14 2HH1 ARG 2 2HH1 ARG 2 7.335 5.057 -4.336
15 1HH2 ARG 2 1HH2 ARG 2 8.722 2.788 -2.017
16 2HH2 ARG 2 2HH2 ARG 2 9.075 4.018 -3.200
17 1HN ABA 3 H ABU 3 1.999 2.044 1.115
18 HA ABA 3 HA ABU 3 0.553 -0.494 1.188
19 1HB ABA 3 1HB ABU 3 -0.388 1.461 3.183
20 2HB ABA 3 2HB ABU 3 1.186 0.755 3.538
21 1HG ABA 3 1HG1 ABU 3 -1.037 -1.060 2.782
22 2HG ABA 3 2HG1 ABU 3 -1.025 -0.348 4.396
23 3HG ABA 3 3HG1 ABU 3 0.335 -1.333 3.856
24 H THR 4 H THR 4 -1.177 -0.409 -0.064
25 HA THR 4 HA THR 4 -1.914 1.973 -1.421
26 HB THR 4 HB THR 4 -3.734 0.647 -2.401
27 HG1 THR 4 1HG THR 4 -4.528 -0.904 -1.219
28 1HG2 THR 4 1HG2 THR 4 -2.405 -0.963 -3.563
29 2HG2 THR 4 2HG2 THR 4 -1.241 -1.040 -2.240
30 3HG2 THR 4 3HG2 THR 4 -1.370 0.423 -3.216
31 H LYS 5 H LYS 5 -3.733 3.256 -1.206
32 HA LYS 5 HA LYS 5 -4.938 3.261 1.437
33 1HB LYS 5 2HB LYS 5 -5.229 5.203 -0.870
34 2HB LYS 5 1HB LYS 5 -5.915 5.425 0.736
35 1HG LYS 5 2HG LYS 5 -2.984 5.274 0.054
36 2HG LYS 5 1HG LYS 5 -3.888 6.725 0.488
37 1HD LYS 5 2HD LYS 5 -4.282 5.884 2.706
38 2HD LYS 5 1HD LYS 5 -3.571 4.325 2.287
39 1HE LYS 5 2HE LYS 5 -2.113 6.965 2.333
40 2HE LYS 5 1HE LYS 5 -2.030 5.728 3.587
41 1HZ LYS 5 1HZ LYS 5 -0.837 5.757 0.919
42 2HZ LYS 5 2HZ LYS 5 -1.342 4.258 1.524
43 3HZ LYS 5 3HZ LYS 5 -0.206 5.178 2.379
44 H SER 6 H SER 6 -5.642 1.049 0.203
45 HA SER 6 HA SER 6 -8.504 1.379 -0.231
46 1HB SER 6 2HB SER 6 -8.413 -0.075 -2.252
47 2HB SER 6 1HB SER 6 -7.554 1.445 -2.500
48 HG SER 6 HG SER 6 -6.502 -1.141 -2.072
49 H ILE 7 H ILE 7 -9.601 -0.294 0.736
50 HA ILE 7 HA ILE 7 -7.981 -2.313 2.059
51 HB ILE 7 HB ILE 7 -10.148 -2.969 3.160
52 1HG1 ILE 7 2HG1 ILE 7 -11.166 -0.409 1.906
53 2HG1 ILE 7 1HG1 ILE 7 -11.625 -2.024 1.377
54 1HG2 ILE 7 1HG2 ILE 7 -9.117 -0.156 3.458
55 2HG2 ILE 7 2HG2 ILE 7 -8.596 -1.593 4.337
56 3HG2 ILE 7 3HG2 ILE 7 -10.209 -0.933 4.603
57 1HD1 ILE 7 1HD1 ILE 7 -13.062 -2.302 3.071
58 2HD1 ILE 7 2HD1 ILE 7 -13.007 -0.542 3.160
59 3HD1 ILE 7 3HD1 ILE 7 -12.003 -1.510 4.238
60 HA PRO 8 HA PRO 8 -7.870 -4.271 2.828
61 1HB PRO 8 2HB PRO 8 -6.388 -6.372 1.458
62 2HB PRO 8 1HB PRO 8 -7.403 -6.492 2.896
63 1HG PRO 8 2HG PRO 8 -8.092 -7.587 0.510
64 2HG PRO 8 1HG PRO 8 -9.285 -7.001 1.684
65 1HD PRO 8 2HD PRO 8 -8.253 -5.668 -0.796
66 2HD PRO 8 1HD PRO 8 -9.916 -5.757 -0.173
67 HA PRO 9 HA PRO 9 -4.614 -1.649 1.289
68 1HB PRO 9 2HB PRO 9 -3.314 -2.297 3.873
69 2HB PRO 9 1HB PRO 9 -3.745 -0.725 3.191
70 1HG PRO 9 2HG PRO 9 -5.129 -1.787 5.218
71 2HG PRO 9 1HG PRO 9 -5.926 -0.846 3.944
72 1HD PRO 9 2HD PRO 9 -5.837 -3.807 4.345
73 2HD PRO 9 1HD PRO 9 -7.173 -2.784 3.777
74 H ILE 10 H ILE 10 -3.272 -2.431 -0.192
75 HA ILE 10 HA ILE 10 -1.901 -4.943 0.157
76 HB ILE 10 HB ILE 10 -1.630 -2.891 -2.053
77 1HG1 ILE 10 2HG1 ILE 10 -3.915 -3.775 -1.894
78 2HG1 ILE 10 1HG1 ILE 10 -3.112 -4.360 -3.348
79 1HG2 ILE 10 1HG2 ILE 10 0.232 -4.636 -1.648
80 2HG2 ILE 10 2HG2 ILE 10 -0.399 -4.425 -3.281
81 3HG2 ILE 10 3HG2 ILE 10 -0.931 -5.790 -2.300
82 1HD1 ILE 10 1HD1 ILE 10 -4.348 -5.844 -1.263
83 2HD1 ILE 10 2HD1 ILE 10 -2.634 -6.258 -1.316
84 3HD1 ILE 10 3HD1 ILE 10 -3.628 -6.427 -2.763
85 1HN ABA 11 H ABU 11 0.003 -5.168 1.099
86 HA ABA 11 HA ABU 11 1.603 -2.770 1.602
87 1HB ABA 11 1HB ABU 11 2.264 -5.357 2.909
88 2HB ABA 11 2HB ABU 11 0.762 -4.572 3.386
89 1HG ABA 11 1HG1 ABU 11 3.570 -3.682 3.778
90 2HG ABA 11 2HG1 ABU 11 2.222 -3.709 4.915
91 3HG ABA 11 3HG1 ABU 11 2.289 -2.474 3.658
92 H PHE 12 H PHE 12 3.501 -2.469 0.703
93 HA PHE 12 HA PHE 12 4.601 -4.586 -0.997
94 1HB PHE 12 2HB PHE 12 5.165 -1.611 -0.908
95 2HB PHE 12 1HB PHE 12 5.968 -2.742 -1.989
96 HD1 PHE 12 1HD PHE 12 2.487 -1.754 -1.034
97 HD2 PHE 12 2HD PHE 12 5.182 -2.877 -4.129
98 HE1 PHE 12 1HE PHE 12 0.702 -1.436 -2.694
99 HE2 PHE 12 2HE PHE 12 3.401 -2.560 -5.797
100 HZ PHE 12 HZ PHE 12 1.158 -1.838 -5.080
101 HA PRO 13 HA PRO 13 8.009 -5.564 1.609
102 1HB PRO 13 2HB PRO 13 9.803 -4.974 -0.691
103 2HB PRO 13 1HB PRO 13 9.685 -6.431 0.300
104 1HG PRO 13 2HG PRO 13 8.681 -6.396 -2.156
105 2HG PRO 13 1HG PRO 13 7.819 -7.213 -0.838
106 1HD PRO 13 2HD PRO 13 7.263 -4.567 -2.116
107 2HD PRO 13 1HD PRO 13 6.127 -5.801 -1.534
108 H ASP 14 H ASP 14 8.252 -2.590 -0.258
109 HA ASP 14 HA ASP 14 10.435 -1.531 1.288
110 1HB ASP 14 2HB ASP 14 10.262 0.414 -0.060
111 2HB ASP 14 1HB ASP 14 9.920 -0.941 -1.129
Start of MODEL 17
1 1H GLY 1 H GLY 1 7.002 -1.579 1.502
2 1HA GLY 1 2HA GLY 1 6.506 -1.284 3.978
3 2HA GLY 1 1HA GLY 1 7.449 0.190 3.821
4 H ARG 2 H ARG 2 6.228 0.475 1.025
5 HA ARG 2 HA ARG 2 4.210 2.294 1.767
6 1HB ARG 2 2HB ARG 2 4.208 2.911 -0.412
7 2HB ARG 2 1HB ARG 2 5.667 1.935 -0.469
8 1HG ARG 2 2HG ARG 2 4.238 0.011 -1.199
9 2HG ARG 2 1HG ARG 2 2.899 1.150 -1.339
10 1HD ARG 2 2HD ARG 2 3.797 0.986 -3.502
11 2HD ARG 2 1HD ARG 2 4.415 2.507 -2.860
12 HE ARG 2 HE ARG 2 6.274 0.480 -2.289
13 1HH1 ARG 2 1HH1 ARG 2 4.989 2.240 -5.036
14 2HH1 ARG 2 2HH1 ARG 2 6.402 2.011 -6.008
15 1HH2 ARG 2 1HH2 ARG 2 8.113 0.145 -3.553
16 2HH2 ARG 2 2HH2 ARG 2 8.200 0.819 -5.159
17 1HN ABA 3 H ABU 3 1.984 2.233 1.588
18 HA ABA 3 HA ABU 3 0.756 -0.397 1.146
19 1HB ABA 3 1HB ABU 3 -0.503 1.305 3.210
20 2HB ABA 3 2HB ABU 3 1.059 0.625 3.649
21 1HG ABA 3 1HG1 ABU 3 -1.435 -0.609 3.798
22 2HG ABA 3 2HG1 ABU 3 0.147 -1.342 4.060
23 3HG ABA 3 3HG1 ABU 3 -0.593 -1.391 2.460
24 H THR 4 H THR 4 -1.099 -0.361 -0.017
25 HA THR 4 HA THR 4 -1.768 2.038 -1.400
26 HB THR 4 HB THR 4 -3.534 0.723 -2.478
27 HG1 THR 4 1HG THR 4 -4.370 -0.853 -1.365
28 1HG2 THR 4 1HG2 THR 4 -0.773 0.205 -2.580
29 2HG2 THR 4 2HG2 THR 4 -1.978 -0.130 -3.824
30 3HG2 THR 4 3HG2 THR 4 -1.571 -1.368 -2.635
31 H LYS 5 H LYS 5 -3.671 3.245 -1.301
32 HA LYS 5 HA LYS 5 -4.906 3.328 1.317
33 1HB LYS 5 2HB LYS 5 -5.145 5.130 -1.097
34 2HB LYS 5 1HB LYS 5 -6.029 5.386 0.401
35 1HG LYS 5 2HG LYS 5 -3.924 5.621 1.612
36 2HG LYS 5 1HG LYS 5 -3.031 5.350 0.115
37 1HD LYS 5 2HD LYS 5 -3.969 7.363 -0.850
38 2HD LYS 5 1HD LYS 5 -4.974 7.610 0.580
39 1HE LYS 5 2HE LYS 5 -3.004 9.056 0.614
40 2HE LYS 5 1HE LYS 5 -2.979 7.902 1.947
41 1HZ LYS 5 1HZ LYS 5 -1.513 6.499 0.494
42 2HZ LYS 5 2HZ LYS 5 -0.819 7.938 1.046
43 3HZ LYS 5 3HZ LYS 5 -1.380 7.828 -0.547
44 H SER 6 H SER 6 -5.563 1.032 0.240
45 HA SER 6 HA SER 6 -8.407 1.339 -0.421
46 1HB SER 6 2HB SER 6 -8.175 -0.599 -1.992
47 2HB SER 6 1HB SER 6 -7.292 0.833 -2.525
48 HG SER 6 HG SER 6 -6.343 -1.628 -1.638
49 H ILE 7 H ILE 7 -9.409 -1.042 -0.251
50 HA ILE 7 HA ILE 7 -8.175 -2.437 2.007
51 HB ILE 7 HB ILE 7 -10.450 -2.782 3.011
52 1HG1 ILE 7 2HG1 ILE 7 -11.216 -0.494 1.186
53 2HG1 ILE 7 1HG1 ILE 7 -11.758 -2.160 1.013
54 1HG2 ILE 7 1HG2 ILE 7 -9.006 -1.293 4.126
55 2HG2 ILE 7 2HG2 ILE 7 -10.554 -0.457 4.006
56 3HG2 ILE 7 3HG2 ILE 7 -9.236 -0.036 2.912
57 1HD1 ILE 7 1HD1 ILE 7 -12.356 -0.343 3.336
58 2HD1 ILE 7 2HD1 ILE 7 -12.898 -2.013 3.164
59 3HD1 ILE 7 3HD1 ILE 7 -13.468 -0.780 2.040
60 HA PRO 8 HA PRO 8 -7.964 -4.240 2.889
61 1HB PRO 8 2HB PRO 8 -6.385 -6.375 1.665
62 2HB PRO 8 1HB PRO 8 -7.318 -6.401 3.163
63 1HG PRO 8 2HG PRO 8 -8.063 -7.782 0.956
64 2HG PRO 8 1HG PRO 8 -9.232 -7.121 2.115
65 1HD PRO 8 2HD PRO 8 -8.388 -6.044 -0.551
66 2HD PRO 8 1HD PRO 8 -10.009 -6.120 0.170
67 HA PRO 9 HA PRO 9 -4.741 -1.734 1.148
68 1HB PRO 9 2HB PRO 9 -3.307 -2.064 3.687
69 2HB PRO 9 1HB PRO 9 -3.997 -0.605 2.973
70 1HG PRO 9 2HG PRO 9 -5.067 -1.781 5.150
71 2HG PRO 9 1HG PRO 9 -6.057 -0.944 3.941
72 1HD PRO 9 2HD PRO 9 -5.599 -3.880 4.315
73 2HD PRO 9 1HD PRO 9 -7.096 -3.014 3.911
74 H ILE 10 H ILE 10 -3.265 -2.456 -0.243
75 HA ILE 10 HA ILE 10 -1.853 -4.931 0.244
76 HB ILE 10 HB ILE 10 -1.695 -2.989 -2.075
77 1HG1 ILE 10 2HG1 ILE 10 -2.678 -5.114 -3.240
78 2HG1 ILE 10 1HG1 ILE 10 -3.147 -5.578 -1.609
79 1HG2 ILE 10 1HG2 ILE 10 0.288 -4.718 -1.338
80 2HG2 ILE 10 2HG2 ILE 10 0.014 -4.118 -2.973
81 3HG2 ILE 10 3HG2 ILE 10 -0.638 -5.683 -2.487
82 1HD1 ILE 10 1HD1 ILE 10 -4.826 -4.106 -1.552
83 2HD1 ILE 10 2HD1 ILE 10 -4.662 -4.112 -3.308
84 3HD1 ILE 10 3HD1 ILE 10 -3.888 -2.847 -2.354
85 1HN ABA 11 H ABU 11 0.047 -5.069 1.222
86 HA ABA 11 HA ABU 11 1.596 -2.612 1.619
87 1HB ABA 11 1HB ABU 11 2.222 -5.150 3.068
88 2HB ABA 11 2HB ABU 11 0.781 -4.251 3.531
89 1HG ABA 11 1HG1 ABU 11 2.583 -3.600 4.952
90 2HG ABA 11 2HG1 ABU 11 2.203 -2.254 3.878
91 3HG ABA 11 3HG1 ABU 11 3.617 -3.260 3.564
92 H PHE 12 H PHE 12 3.400 -2.323 0.533
93 HA PHE 12 HA PHE 12 4.482 -4.490 -1.068
94 1HB PHE 12 2HB PHE 12 5.073 -1.533 -0.917
95 2HB PHE 12 1HB PHE 12 6.033 -2.636 -1.893
96 HD1 PHE 12 1HD PHE 12 5.566 -2.486 -4.116
97 HD2 PHE 12 2HD PHE 12 2.366 -2.094 -1.336
98 HE1 PHE 12 1HE PHE 12 3.982 -2.224 -5.981
99 HE2 PHE 12 2HE PHE 12 0.778 -1.835 -3.196
100 HZ PHE 12 HZ PHE 12 1.584 -1.899 -5.522
101 HA PRO 13 HA PRO 13 7.819 -5.730 1.523
102 1HB PRO 13 2HB PRO 13 9.643 -5.205 -0.770
103 2HB PRO 13 1HB PRO 13 9.436 -6.673 0.191
104 1HG PRO 13 2HG PRO 13 8.438 -6.514 -2.269
105 2HG PRO 13 1HG PRO 13 7.538 -7.324 -0.974
106 1HD PRO 13 2HD PRO 13 7.109 -4.626 -2.183
107 2HD PRO 13 1HD PRO 13 5.915 -5.812 -1.615
108 H ASP 14 H ASP 14 8.258 -2.804 -0.370
109 HA ASP 14 HA ASP 14 10.474 -1.806 1.096
110 1HB ASP 14 2HB ASP 14 9.797 0.408 0.018
111 2HB ASP 14 1HB ASP 14 10.227 -0.909 -1.065
Start of MODEL 18
1 1H GLY 1 H GLY 1 7.065 -1.730 1.712
2 1HA GLY 1 2HA GLY 1 6.311 -1.485 4.066
3 2HA GLY 1 1HA GLY 1 7.261 -0.007 4.105
4 H ARG 2 H ARG 2 6.128 0.037 1.111
5 HA ARG 2 HA ARG 2 4.232 2.072 1.591
6 1HB ARG 2 2HB ARG 2 5.671 1.259 -0.563
7 2HB ARG 2 1HB ARG 2 4.079 0.647 -0.991
8 1HG ARG 2 2HG ARG 2 4.480 2.865 -1.919
9 2HG ARG 2 1HG ARG 2 3.138 2.873 -0.772
10 1HD ARG 2 2HD ARG 2 4.754 4.799 -0.573
11 2HD ARG 2 1HD ARG 2 4.460 3.892 0.909
12 HE ARG 2 HE ARG 2 6.690 2.750 -0.308
13 1HH1 ARG 2 1HH1 ARG 2 5.821 5.863 1.062
14 2HH1 ARG 2 2HH1 ARG 2 7.430 6.211 1.598
15 1HH2 ARG 2 1HH2 ARG 2 8.767 3.179 0.389
16 2HH2 ARG 2 2HH2 ARG 2 9.128 4.673 1.210
17 1HN ABA 3 H ABU 3 1.981 2.087 1.344
18 HA ABA 3 HA ABU 3 0.644 -0.504 1.122
19 1HB ABA 3 1HB ABU 3 -0.689 1.151 3.085
20 2HB ABA 3 2HB ABU 3 0.975 0.840 3.568
21 1HG ABA 3 1HG1 ABU 3 0.644 -1.464 3.649
22 2HG ABA 3 2HG1 ABU 3 -0.840 -1.375 2.700
23 3HG ABA 3 3HG1 ABU 3 -0.819 -0.782 4.360
24 H THR 4 H THR 4 -1.175 -0.427 -0.073
25 HA THR 4 HA THR 4 -1.779 1.988 -1.467
26 HB THR 4 HB THR 4 -3.572 0.694 -2.557
27 HG1 THR 4 1HG THR 4 -4.382 -0.911 -1.462
28 1HG2 THR 4 1HG2 THR 4 -0.760 -0.077 -2.483
29 2HG2 THR 4 2HG2 THR 4 -1.824 0.194 -3.864
30 3HG2 THR 4 3HG2 THR 4 -1.820 -1.370 -3.047
31 H LYS 5 H LYS 5 -3.655 3.225 -1.395
32 HA LYS 5 HA LYS 5 -4.912 3.396 1.193
33 1HB LYS 5 2HB LYS 5 -5.320 5.050 -1.308
34 2HB LYS 5 1HB LYS 5 -6.021 5.404 0.264
35 1HG LYS 5 2HG LYS 5 -3.738 5.644 1.184
36 2HG LYS 5 1HG LYS 5 -3.092 5.396 -0.438
37 1HD LYS 5 2HD LYS 5 -4.964 7.617 0.388
38 2HD LYS 5 1HD LYS 5 -3.223 7.779 0.146
39 1HE LYS 5 2HE LYS 5 -3.486 7.158 -2.200
40 2HE LYS 5 1HE LYS 5 -5.222 6.957 -1.961
41 1HZ LYS 5 1HZ LYS 5 -4.208 9.529 -1.141
42 2HZ LYS 5 2HZ LYS 5 -5.562 9.149 -2.082
43 3HZ LYS 5 3HZ LYS 5 -4.031 9.224 -2.796
44 H SER 6 H SER 6 -5.549 1.032 0.214
45 HA SER 6 HA SER 6 -8.399 1.287 -0.457
46 1HB SER 6 2HB SER 6 -8.165 -0.730 -1.910
47 2HB SER 6 1HB SER 6 -7.252 0.653 -2.515
48 HG SER 6 HG SER 6 -6.343 -1.746 -1.391
49 H ILE 7 H ILE 7 -9.474 -0.968 -0.088
50 HA ILE 7 HA ILE 7 -8.279 -2.282 2.254
51 HB ILE 7 HB ILE 7 -11.172 -1.439 1.969
52 1HG1 ILE 7 2HG1 ILE 7 -9.634 0.349 2.710
53 2HG1 ILE 7 1HG1 ILE 7 -10.782 -0.103 3.966
54 1HG2 ILE 7 1HG2 ILE 7 -10.091 -3.670 3.341
55 2HG2 ILE 7 2HG2 ILE 7 -11.753 -3.081 3.340
56 3HG2 ILE 7 3HG2 ILE 7 -10.610 -2.492 4.548
57 1HD1 ILE 7 1HD1 ILE 7 -9.054 -1.419 5.073
58 2HD1 ILE 7 2HD1 ILE 7 -8.559 0.261 4.876
59 3HD1 ILE 7 3HD1 ILE 7 -7.906 -0.981 3.807
60 HA PRO 8 HA PRO 8 -7.865 -4.055 3.044
61 1HB PRO 8 2HB PRO 8 -6.376 -6.238 1.814
62 2HB PRO 8 1HB PRO 8 -7.249 -6.215 3.347
63 1HG PRO 8 2HG PRO 8 -8.081 -7.651 1.202
64 2HG PRO 8 1HG PRO 8 -9.196 -6.973 2.402
65 1HD PRO 8 2HD PRO 8 -8.480 -5.938 -0.318
66 2HD PRO 8 1HD PRO 8 -10.069 -6.018 0.474
67 HA PRO 9 HA PRO 9 -4.703 -1.719 1.004
68 1HB PRO 9 2HB PRO 9 -2.990 -1.410 3.083
69 2HB PRO 9 1HB PRO 9 -4.517 -0.533 2.962
70 1HG PRO 9 2HG PRO 9 -3.849 -2.966 4.564
71 2HG PRO 9 1HG PRO 9 -4.828 -1.559 5.017
72 1HD PRO 9 2HD PRO 9 -5.901 -3.935 4.229
73 2HD PRO 9 1HD PRO 9 -6.705 -2.374 3.980
74 H ILE 10 H ILE 10 -3.193 -2.408 -0.351
75 HA ILE 10 HA ILE 10 -1.863 -4.936 0.066
76 HB ILE 10 HB ILE 10 -1.492 -2.899 -2.144
77 1HG1 ILE 10 2HG1 ILE 10 -3.781 -3.746 -2.095
78 2HG1 ILE 10 1HG1 ILE 10 -2.921 -4.407 -3.482
79 1HG2 ILE 10 1HG2 ILE 10 -0.065 -4.302 -3.192
80 2HG2 ILE 10 2HG2 ILE 10 -0.863 -5.751 -2.579
81 3HG2 ILE 10 3HG2 ILE 10 0.246 -4.851 -1.545
82 1HD1 ILE 10 1HD1 ILE 10 -4.261 -5.771 -1.361
83 2HD1 ILE 10 2HD1 ILE 10 -2.561 -6.240 -1.393
84 3HD1 ILE 10 3HD1 ILE 10 -3.552 -6.424 -2.839
85 1HN ABA 11 H ABU 11 0.050 -5.188 1.024
86 HA ABA 11 HA ABU 11 1.610 -2.790 1.632
87 1HB ABA 11 1HB ABU 11 2.288 -5.452 2.798
88 2HB ABA 11 2HB ABU 11 0.818 -4.653 3.346
89 1HG ABA 11 1HG1 ABU 11 2.508 -4.048 4.862
90 2HG ABA 11 2HG1 ABU 11 2.245 -2.635 3.838
91 3HG ABA 11 3HG1 ABU 11 3.644 -3.675 3.566
92 H PHE 12 H PHE 12 3.439 -2.373 0.656
93 HA PHE 12 HA PHE 12 4.581 -4.329 -1.178
94 1HB PHE 12 2HB PHE 12 5.124 -1.383 -0.741
95 2HB PHE 12 1HB PHE 12 6.018 -2.378 -1.884
96 HD1 PHE 12 1HD PHE 12 5.393 -2.178 -4.065
97 HD2 PHE 12 2HD PHE 12 2.432 -1.690 -1.047
98 HE1 PHE 12 1HE PHE 12 3.709 -1.705 -5.796
99 HE2 PHE 12 2HE PHE 12 0.744 -1.222 -2.773
100 HZ PHE 12 HZ PHE 12 1.381 -1.229 -5.151
101 HA PRO 13 HA PRO 13 7.958 -5.638 1.325
102 1HB PRO 13 2HB PRO 13 9.785 -4.862 -0.891
103 2HB PRO 13 1HB PRO 13 9.605 -6.416 -0.069
104 1HG PRO 13 2HG PRO 13 8.631 -6.060 -2.519
105 2HG PRO 13 1HG PRO 13 7.739 -7.009 -1.314
106 1HD PRO 13 2HD PRO 13 7.254 -4.218 -2.271
107 2HD PRO 13 1HD PRO 13 6.085 -5.486 -1.847
108 H ASP 14 H ASP 14 8.290 -2.510 -0.254
109 HA ASP 14 HA ASP 14 10.483 -1.638 1.377
110 1HB ASP 14 2HB ASP 14 10.328 0.431 0.242
111 2HB ASP 14 1HB ASP 14 9.896 -0.780 -0.959
Start of MODEL 19
1 1H GLY 1 H GLY 1 7.170 -1.713 1.728
2 1HA GLY 1 2HA GLY 1 6.687 -0.874 4.019
3 2HA GLY 1 1HA GLY 1 7.582 0.568 3.565
4 H ARG 2 H ARG 2 6.294 0.299 0.810
5 HA ARG 2 HA ARG 2 4.272 2.198 1.169
6 1HB ARG 2 2HB ARG 2 5.560 0.934 -0.996
7 2HB ARG 2 1HB ARG 2 3.836 0.703 -1.244
8 1HG ARG 2 2HG ARG 2 4.760 2.734 -2.328
9 2HG ARG 2 1HG ARG 2 3.442 3.058 -1.205
10 1HD ARG 2 2HD ARG 2 5.451 4.612 -1.093
11 2HD ARG 2 1HD ARG 2 4.901 3.914 0.430
12 HE ARG 2 HE ARG 2 6.855 2.209 -0.592
13 1HH1 ARG 2 1HH1 ARG 2 6.678 5.535 0.519
14 2HH1 ARG 2 2HH1 ARG 2 8.288 5.537 1.150
15 1HH2 ARG 2 1HH2 ARG 2 8.927 2.192 0.244
16 2HH2 ARG 2 2HH2 ARG 2 9.586 3.614 0.995
17 1HN ABA 3 H ABU 3 2.022 2.092 0.952
18 HA ABA 3 HA ABU 3 0.730 -0.511 1.028
19 1HB ABA 3 1HB ABU 3 0.037 1.510 3.154
20 2HB ABA 3 2HB ABU 3 1.299 0.311 3.422
21 1HG ABA 3 1HG1 ABU 3 -1.342 -0.019 3.989
22 2HG ABA 3 2HG1 ABU 3 -0.171 -1.320 3.778
23 3HG ABA 3 3HG1 ABU 3 -1.192 -0.825 2.429
24 H THR 4 H THR 4 -1.183 -0.462 -0.036
25 HA THR 4 HA THR 4 -1.906 1.950 -1.387
26 HB THR 4 HB THR 4 -3.741 0.657 -2.373
27 HG1 THR 4 1HG THR 4 -4.523 -0.866 -1.136
28 1HG2 THR 4 1HG2 THR 4 -1.631 -1.375 -2.518
29 2HG2 THR 4 2HG2 THR 4 -1.072 0.274 -2.797
30 3HG2 THR 4 3HG2 THR 4 -2.360 -0.402 -3.796
31 H LYS 5 H LYS 5 -3.609 3.301 -1.048
32 HA LYS 5 HA LYS 5 -4.772 3.300 1.588
33 1HB LYS 5 2HB LYS 5 -5.716 5.478 0.949
34 2HB LYS 5 1HB LYS 5 -3.988 5.410 0.644
35 1HG LYS 5 2HG LYS 5 -4.361 5.127 -1.714
36 2HG LYS 5 1HG LYS 5 -6.103 5.008 -1.460
37 1HD LYS 5 2HD LYS 5 -5.966 7.331 -0.446
38 2HD LYS 5 1HD LYS 5 -4.329 7.411 -1.101
39 1HE LYS 5 2HE LYS 5 -5.891 8.459 -2.629
40 2HE LYS 5 1HE LYS 5 -5.226 6.994 -3.350
41 1HZ LYS 5 1HZ LYS 5 -7.350 6.482 -3.744
42 2HZ LYS 5 2HZ LYS 5 -7.945 7.619 -2.644
43 3HZ LYS 5 3HZ LYS 5 -7.450 6.096 -2.099
44 H SER 6 H SER 6 -5.609 1.095 0.439
45 HA SER 6 HA SER 6 -8.463 1.584 -0.008
46 1HB SER 6 2HB SER 6 -8.413 -0.221 -1.780
47 2HB SER 6 1HB SER 6 -7.612 1.282 -2.240
48 HG SER 6 HG SER 6 -6.585 -1.207 -2.033
49 H ILE 7 H ILE 7 -9.424 -0.904 -0.199
50 HA ILE 7 HA ILE 7 -8.188 -2.496 1.918
51 HB ILE 7 HB ILE 7 -10.473 -2.974 2.862
52 1HG1 ILE 7 2HG1 ILE 7 -11.228 -0.478 1.328
53 2HG1 ILE 7 1HG1 ILE 7 -11.770 -2.108 0.945
54 1HG2 ILE 7 1HG2 ILE 7 -10.482 -0.348 3.729
55 2HG2 ILE 7 2HG2 ILE 7 -8.813 -0.628 3.231
56 3HG2 ILE 7 3HG2 ILE 7 -9.565 -1.683 4.429
57 1HD1 ILE 7 1HD1 ILE 7 -13.143 -2.219 2.812
58 2HD1 ILE 7 2HD1 ILE 7 -13.341 -0.560 2.252
59 3HD1 ILE 7 3HD1 ILE 7 -12.299 -0.906 3.632
60 HA PRO 8 HA PRO 8 -8.005 -4.348 2.635
61 1HB PRO 8 2HB PRO 8 -6.371 -6.382 1.903
62 2HB PRO 8 1HB PRO 8 -8.008 -6.649 2.512
63 1HG PRO 8 2HG PRO 8 -7.009 -6.651 -0.306
64 2HG PRO 8 1HG PRO 8 -8.172 -7.740 0.471
65 1HD PRO 8 2HD PRO 8 -8.904 -5.658 -1.135
66 2HD PRO 8 1HD PRO 8 -9.919 -6.281 0.179
67 HA PRO 9 HA PRO 9 -4.735 -1.754 1.105
68 1HB PRO 9 2HB PRO 9 -3.202 -1.719 3.371
69 2HB PRO 9 1HB PRO 9 -4.665 -0.749 3.161
70 1HG PRO 9 2HG PRO 9 -4.299 -3.341 4.605
71 2HG PRO 9 1HG PRO 9 -5.252 -1.920 5.073
72 1HD PRO 9 2HD PRO 9 -6.378 -4.132 4.004
73 2HD PRO 9 1HD PRO 9 -7.021 -2.503 3.714
74 H ILE 10 H ILE 10 -3.249 -2.469 -0.271
75 HA ILE 10 HA ILE 10 -1.892 -4.980 0.135
76 HB ILE 10 HB ILE 10 -1.490 -2.906 -2.031
77 1HG1 ILE 10 2HG1 ILE 10 -3.779 -3.766 -2.034
78 2HG1 ILE 10 1HG1 ILE 10 -2.891 -4.384 -3.423
79 1HG2 ILE 10 1HG2 ILE 10 0.330 -4.683 -1.518
80 2HG2 ILE 10 2HG2 ILE 10 -0.177 -4.418 -3.187
81 3HG2 ILE 10 3HG2 ILE 10 -0.796 -5.803 -2.287
82 1HD1 ILE 10 1HD1 ILE 10 -4.359 -6.042 -2.281
83 2HD1 ILE 10 2HD1 ILE 10 -3.292 -5.937 -0.881
84 3HD1 ILE 10 3HD1 ILE 10 -2.671 -6.529 -2.421
85 1HN ABA 11 H ABU 11 -0.049 -5.208 1.204
86 HA ABA 11 HA ABU 11 1.512 -2.817 1.828
87 1HB ABA 11 1HB ABU 11 2.668 -4.450 3.449
88 2HB ABA 11 2HB ABU 11 1.357 -5.560 3.067
89 1HG ABA 11 1HG1 ABU 11 0.970 -2.793 4.175
90 2HG ABA 11 2HG1 ABU 11 0.996 -4.272 5.137
91 3HG ABA 11 3HG1 ABU 11 -0.267 -4.026 3.930
92 H PHE 12 H PHE 12 3.346 -2.416 0.837
93 HA PHE 12 HA PHE 12 4.532 -4.460 -0.878
94 1HB PHE 12 2HB PHE 12 5.042 -1.487 -0.616
95 2HB PHE 12 1HB PHE 12 5.942 -2.541 -1.696
96 HD1 PHE 12 1HD PHE 12 5.311 -2.511 -3.886
97 HD2 PHE 12 2HD PHE 12 2.360 -1.783 -0.909
98 HE1 PHE 12 1HE PHE 12 3.632 -2.148 -5.645
99 HE2 PHE 12 2HE PHE 12 0.674 -1.424 -2.662
100 HZ PHE 12 HZ PHE 12 1.308 -1.605 -5.034
101 HA PRO 13 HA PRO 13 7.790 -5.543 1.894
102 1HB PRO 13 2HB PRO 13 9.611 -5.340 -0.446
103 2HB PRO 13 1HB PRO 13 9.325 -6.702 0.643
104 1HG PRO 13 2HG PRO 13 8.335 -6.706 -1.831
105 2HG PRO 13 1HG PRO 13 7.399 -7.358 -0.471
106 1HD PRO 13 2HD PRO 13 7.110 -4.744 -1.896
107 2HD PRO 13 1HD PRO 13 5.855 -5.830 -1.262
108 H ASP 14 H ASP 14 8.221 -2.829 -0.276
109 HA ASP 14 HA ASP 14 10.517 -1.758 1.053
110 1HB ASP 14 2HB ASP 14 10.238 0.159 -0.413
111 2HB ASP 14 1HB ASP 14 10.041 -1.327 -1.335
Start of MODEL 20
1 1H GLY 1 H GLY 1 7.203 -1.939 1.915
2 1HA GLY 1 2HA GLY 1 6.348 -1.283 4.073
3 2HA GLY 1 1HA GLY 1 7.342 0.163 3.977
4 H ARG 2 H ARG 2 6.237 -0.119 0.979
5 HA ARG 2 HA ARG 2 4.431 2.034 1.153
6 1HB ARG 2 2HB ARG 2 5.843 1.008 -0.833
7 2HB ARG 2 1HB ARG 2 4.354 0.131 -1.144
8 1HG ARG 2 2HG ARG 2 3.155 2.119 -1.552
9 2HG ARG 2 1HG ARG 2 4.456 3.121 -0.899
10 1HD ARG 2 2HD ARG 2 4.433 1.537 -3.458
11 2HD ARG 2 1HD ARG 2 4.617 3.281 -3.257
12 HE ARG 2 HE ARG 2 6.694 1.923 -1.889
13 1HH1 ARG 2 1HH1 ARG 2 5.668 2.731 -5.144
14 2HH1 ARG 2 2HH1 ARG 2 7.271 2.671 -5.792
15 1HH2 ARG 2 1HH2 ARG 2 8.764 1.838 -2.705
16 2HH2 ARG 2 2HH2 ARG 2 9.059 2.159 -4.392
17 1HN ABA 3 H ABU 3 2.193 2.116 1.099
18 HA ABA 3 HA ABU 3 0.718 -0.399 1.043
19 1HB ABA 3 1HB ABU 3 -0.142 1.467 3.174
20 2HB ABA 3 2HB ABU 3 1.369 0.615 3.467
21 1HG ABA 3 1HG1 ABU 3 -0.378 -1.341 2.554
22 2HG ABA 3 2HG1 ABU 3 -1.336 -0.337 3.643
23 3HG ABA 3 3HG1 ABU 3 0.159 -1.076 4.214
24 H THR 4 H THR 4 -1.058 -0.241 -0.122
25 HA THR 4 HA THR 4 -1.785 2.250 -1.328
26 HB THR 4 HB THR 4 -3.559 0.957 -2.456
27 HG1 THR 4 1HG THR 4 -4.248 -0.800 -1.519
28 1HG2 THR 4 1HG2 THR 4 -1.213 0.967 -3.305
29 2HG2 THR 4 2HG2 THR 4 -2.131 -0.469 -3.760
30 3HG2 THR 4 3HG2 THR 4 -0.949 -0.557 -2.455
31 H LYS 5 H LYS 5 -3.832 3.287 -1.191
32 HA LYS 5 HA LYS 5 -4.971 3.166 1.479
33 1HB LYS 5 2HB LYS 5 -5.108 5.154 -0.767
34 2HB LYS 5 1HB LYS 5 -6.298 5.204 0.526
35 1HG LYS 5 2HG LYS 5 -4.480 6.759 0.951
36 2HG LYS 5 1HG LYS 5 -4.515 5.485 2.170
37 1HD LYS 5 2HD LYS 5 -2.747 4.298 0.842
38 2HD LYS 5 1HD LYS 5 -2.632 5.738 -0.170
39 1HE LYS 5 2HE LYS 5 -1.952 7.070 1.709
40 2HE LYS 5 1HE LYS 5 -2.233 5.725 2.817
41 1HZ LYS 5 1HZ LYS 5 0.029 5.639 2.490
42 2HZ LYS 5 2HZ LYS 5 -0.063 6.092 0.863
43 3HZ LYS 5 3HZ LYS 5 -0.511 4.527 1.331
44 H SER 6 H SER 6 -5.549 0.925 0.231
45 HA SER 6 HA SER 6 -8.374 1.194 -0.546
46 1HB SER 6 2HB SER 6 -8.015 -0.910 -1.875
47 2HB SER 6 1HB SER 6 -7.103 0.475 -2.476
48 HG SER 6 HG SER 6 -6.202 -1.843 -1.181
49 H ILE 7 H ILE 7 -9.371 -1.199 -0.308
50 HA ILE 7 HA ILE 7 -8.467 -2.383 2.214
51 HB ILE 7 HB ILE 7 -11.349 -1.641 1.641
52 1HG1 ILE 7 2HG1 ILE 7 -9.468 -0.590 3.768
53 2HG1 ILE 7 1HG1 ILE 7 -9.939 0.286 2.317
54 1HG2 ILE 7 1HG2 ILE 7 -11.955 -3.148 3.154
55 2HG2 ILE 7 2HG2 ILE 7 -10.859 -2.442 4.341
56 3HG2 ILE 7 3HG2 ILE 7 -10.281 -3.696 3.245
57 1HD1 ILE 7 1HD1 ILE 7 -11.224 1.103 4.149
58 2HD1 ILE 7 2HD1 ILE 7 -11.711 -0.530 4.602
59 3HD1 ILE 7 3HD1 ILE 7 -12.295 0.179 3.097
60 HA PRO 8 HA PRO 8 -7.941 -4.099 2.950
61 1HB PRO 8 2HB PRO 8 -6.255 -6.126 2.364
62 2HB PRO 8 1HB PRO 8 -7.845 -6.398 3.085
63 1HG PRO 8 2HG PRO 8 -6.990 -6.660 0.230
64 2HG PRO 8 1HG PRO 8 -8.031 -7.726 1.189
65 1HD PRO 8 2HD PRO 8 -8.993 -5.890 -0.581
66 2HD PRO 8 1HD PRO 8 -9.885 -6.414 0.861
67 HA PRO 9 HA PRO 9 -4.808 -1.655 0.979
68 1HB PRO 9 2HB PRO 9 -3.110 -1.363 3.081
69 2HB PRO 9 1HB PRO 9 -4.646 -0.498 2.957
70 1HG PRO 9 2HG PRO 9 -3.976 -2.952 4.526
71 2HG PRO 9 1HG PRO 9 -4.966 -1.558 4.994
72 1HD PRO 9 2HD PRO 9 -6.028 -3.920 4.167
73 2HD PRO 9 1HD PRO 9 -6.826 -2.357 3.905
74 H ILE 10 H ILE 10 -3.241 -2.269 -0.358
75 HA ILE 10 HA ILE 10 -1.911 -4.802 -0.001
76 HB ILE 10 HB ILE 10 -1.483 -2.698 -2.132
77 1HG1 ILE 10 2HG1 ILE 10 -3.787 -3.512 -2.149
78 2HG1 ILE 10 1HG1 ILE 10 -2.913 -4.128 -3.546
79 1HG2 ILE 10 1HG2 ILE 10 -0.054 -4.088 -3.195
80 2HG2 ILE 10 2HG2 ILE 10 -0.894 -5.542 -2.656
81 3HG2 ILE 10 3HG2 ILE 10 0.206 -4.703 -1.563
82 1HD1 ILE 10 1HD1 ILE 10 -3.367 -5.702 -1.024
83 2HD1 ILE 10 2HD1 ILE 10 -2.725 -6.290 -2.557
84 3HD1 ILE 10 3HD1 ILE 10 -4.409 -5.778 -2.445
85 1HN ABA 11 H ABU 11 -0.009 -5.093 0.963
86 HA ABA 11 HA ABU 11 1.593 -2.718 1.597
87 1HB ABA 11 1HB ABU 11 2.140 -5.338 2.904
88 2HB ABA 11 2HB ABU 11 0.654 -4.504 3.345
89 1HG ABA 11 1HG1 ABU 11 2.494 -3.996 4.869
90 2HG ABA 11 2HG1 ABU 11 1.913 -2.558 4.030
91 3HG ABA 11 3HG1 ABU 11 3.415 -3.327 3.521
92 H PHE 12 H PHE 12 3.466 -2.428 0.654
93 HA PHE 12 HA PHE 12 4.592 -4.562 -0.994
94 1HB PHE 12 2HB PHE 12 5.204 -1.599 -0.852
95 2HB PHE 12 1HB PHE 12 6.032 -2.731 -1.914
96 HD1 PHE 12 1HD PHE 12 5.326 -2.829 -4.083
97 HD2 PHE 12 2HD PHE 12 2.529 -1.704 -1.080
98 HE1 PHE 12 1HE PHE 12 3.624 -2.447 -5.816
99 HE2 PHE 12 2HE PHE 12 0.820 -1.326 -2.808
100 HZ PHE 12 HZ PHE 12 1.366 -1.696 -5.179
101 HA PRO 13 HA PRO 13 7.926 -5.597 1.684
102 1HB PRO 13 2HB PRO 13 10.090 -5.459 -0.044
103 2HB PRO 13 1HB PRO 13 9.002 -6.840 0.122
104 1HG PRO 13 2HG PRO 13 8.992 -4.649 -1.910
105 2HG PRO 13 1HG PRO 13 8.675 -6.382 -2.123
106 1HD PRO 13 2HD PRO 13 6.676 -4.606 -2.056
107 2HD PRO 13 1HD PRO 13 6.504 -6.212 -1.315
108 H ASP 14 H ASP 14 8.257 -2.656 -0.203
109 HA ASP 14 HA ASP 14 10.473 -1.654 1.346
110 1HB ASP 14 2HB ASP 14 10.354 0.300 -0.024
111 2HB ASP 14 1HB ASP 14 10.056 -1.077 -1.077
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