NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
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18018 |
2dci   |
6954 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H GLY 1 1HN GLY 1 -9.864 -6.478 5.207
2 2H GLY 1 2HN GLY 1 -9.981 -7.982 4.570
3 3H GLY 1 3HN GLY 1 -11.177 -7.423 5.567
4 1HA GLY 1 1HA GLY 1 -11.849 -7.369 3.238
5 2HA GLY 1 2HA GLY 1 -11.813 -5.758 3.992
6 H LEU 2 H LEU 2 -11.560 -6.256 1.148
7 HA LEU 2 HA LEU 2 -9.041 -6.649 0.152
8 1HB LEU 2 1HB LEU 2 -9.879 -5.855 -1.929
9 2HB LEU 2 2HB LEU 2 -11.175 -6.675 -1.087
10 HG LEU 2 HG LEU 2 -11.650 -4.088 -0.267
11 1HD1 LEU 2 1HD1 LEU 2 -11.425 -2.572 -2.188
12 2HD1 LEU 2 2HD1 LEU 2 -9.826 -3.147 -1.708
13 3HD1 LEU 2 3HD1 LEU 2 -10.616 -3.839 -3.133
14 1HD2 LEU 2 1HD2 LEU 2 -13.417 -4.015 -1.988
15 2HD2 LEU 2 2HD2 LEU 2 -12.637 -5.351 -2.861
16 3HD2 LEU 2 3HD2 LEU 2 -13.318 -5.614 -1.241
17 H PHE 3 H PHE 3 -10.128 -3.670 1.625
18 HA PHE 3 HA PHE 3 -8.454 -1.723 0.558
19 1HB PHE 3 1HB PHE 3 -10.285 -1.764 2.416
20 2HB PHE 3 2HB PHE 3 -9.059 -2.190 3.512
21 HD1 PHE 3 1HD PHE 3 -7.962 -0.454 4.715
22 HD2 PHE 3 2HD PHE 3 -9.633 0.425 0.826
23 HE1 PHE 3 1HE PHE 3 -7.250 1.912 4.929
24 HE2 PHE 3 2HE PHE 3 -8.896 2.783 1.057
25 HZ PHE 3 HZ PHE 3 -7.689 3.521 3.098
26 H GLY 4 H GLY 4 -7.964 -4.043 3.016
27 1HA GLY 4 1HA GLY 4 -5.302 -3.438 3.922
28 2HA GLY 4 2HA GLY 4 -6.085 -5.014 4.092
29 H ALA 5 H ALA 5 -6.240 -4.859 0.872
30 HA ALA 5 HA ALA 5 -3.551 -6.058 0.448
31 1HB ALA 5 1HB ALA 5 -5.576 -7.270 -0.350
32 2HB ALA 5 2HB ALA 5 -5.944 -5.900 -1.429
33 3HB ALA 5 3HB ALA 5 -4.460 -6.838 -1.662
34 H ILE 6 H ILE 6 -5.204 -3.043 -0.031
35 HA ILE 6 HA ILE 6 -3.131 -2.100 -1.889
36 HB ILE 6 HB ILE 6 -4.941 -0.336 -2.490
37 1HG1 ILE 6 1HG1 ILE 6 -6.634 -2.767 -1.960
38 2HG1 ILE 6 2HG1 ILE 6 -6.518 -1.408 -0.848
39 1HG2 ILE 6 1HG2 ILE 6 -3.765 -1.853 -3.999
40 2HG2 ILE 6 2HG2 ILE 6 -4.873 -3.174 -3.551
41 3HG2 ILE 6 3HG2 ILE 6 -5.483 -1.737 -4.424
42 1HD1 ILE 6 1HD1 ILE 6 -7.611 -1.272 -3.685
43 2HD1 ILE 6 2HD1 ILE 6 -8.532 -1.124 -2.179
44 3HD1 ILE 6 3HD1 ILE 6 -7.363 0.134 -2.621
45 H ALA 7 H ALA 7 -5.431 -0.211 -0.120
46 HA ALA 7 HA ALA 7 -5.022 1.920 0.424
47 1HB ALA 7 1HB ALA 7 -5.715 0.604 2.384
48 2HB ALA 7 2HB ALA 7 -4.029 0.254 2.799
49 3HB ALA 7 3HB ALA 7 -4.651 1.918 2.904
50 H GLY 8 H GLY 8 -2.140 0.805 2.193
51 1HA GLY 8 1HA GLY 8 -0.430 2.911 1.730
52 2HA GLY 8 2HA GLY 8 0.084 1.249 1.984
53 H PHE 9 H PHE 9 -1.117 0.256 -0.685
54 HA PHE 9 HA PHE 9 1.123 0.933 -2.384
55 1HB PHE 9 1HB PHE 9 -1.468 -0.577 -2.772
56 2HB PHE 9 2HB PHE 9 -0.407 -0.227 -4.126
57 HD1 PHE 9 1HD PHE 9 1.994 -0.979 -4.118
58 HD2 PHE 9 2HD PHE 9 -0.883 -2.401 -1.232
59 HE1 PHE 9 1HE PHE 9 3.460 -2.909 -3.593
60 HE2 PHE 9 2HE PHE 9 0.578 -4.309 -0.708
61 HZ PHE 9 HZ PHE 9 2.757 -4.585 -1.893
62 H ILE 10 H ILE 10 -1.839 2.581 -1.791
63 HA ILE 10 HA ILE 10 -1.671 4.162 -4.323
64 HB ILE 10 HB ILE 10 -3.965 3.437 -2.429
65 1HG1 ILE 10 1HG1 ILE 10 -5.131 2.712 -4.469
66 2HG1 ILE 10 2HG1 ILE 10 -3.727 3.120 -5.461
67 1HG2 ILE 10 1HG2 ILE 10 -4.260 5.820 -2.890
68 2HG2 ILE 10 2HG2 ILE 10 -4.015 5.551 -4.630
69 3HG2 ILE 10 3HG2 ILE 10 -5.448 4.901 -3.802
70 1HD1 ILE 10 1HD1 ILE 10 -2.495 1.293 -4.636
71 2HD1 ILE 10 2HD1 ILE 10 -3.495 1.153 -3.170
72 3HD1 ILE 10 3HD1 ILE 10 -4.140 0.651 -4.755
73 H GLU 11 H GLU 11 -2.223 4.249 -0.844
74 HA GLU 11 HA GLU 11 -2.207 7.074 -0.482
75 1HB GLU 11 1HB GLU 11 -1.602 4.758 1.379
76 2HB GLU 11 2HB GLU 11 -1.797 6.422 1.943
77 1HG GLU 11 1HG GLU 11 -4.084 6.527 1.260
78 2HG GLU 11 2HG GLU 11 -3.979 5.046 0.321
79 H ASN 12 H ASN 12 0.431 4.918 -1.060
80 HA ASN 12 HA ASN 12 2.201 7.230 -1.157
81 1HB ASN 12 1HB ASN 12 2.522 6.261 1.184
82 2HB ASN 12 2HB ASN 12 3.162 4.802 0.437
83 1HD2 ASN 12 1HD2 ASN 12 4.550 6.741 2.230
84 2HD2 ASN 12 2HD2 ASN 12 5.885 7.391 1.261
85 H GLY 13 H GLY 13 2.186 3.672 -1.270
86 1HA GLY 13 1HA GLY 13 2.603 2.801 -3.741
87 2HA GLY 13 2HA GLY 13 4.101 3.717 -3.535
88 H ALA 14 H ALA 14 2.525 1.985 -0.867
89 HA ALA 14 HA ALA 14 3.328 0.655 0.697
90 1HB ALA 14 1HB ALA 14 2.822 -1.064 -0.908
91 2HB ALA 14 2HB ALA 14 4.461 -0.949 -1.605
92 3HB ALA 14 3HB ALA 14 4.230 -1.514 0.063
93 H GLU 15 H GLU 15 4.565 2.656 1.183
94 HA GLU 15 HA GLU 15 7.418 2.669 1.126
95 1HB GLU 15 1HB GLU 15 7.190 4.030 3.172
96 2HB GLU 15 2HB GLU 15 6.212 4.604 1.823
97 1HG GLU 15 1HG GLU 15 4.176 3.591 2.834
98 2HG GLU 15 2HG GLU 15 5.142 2.975 4.180
99 H GLY 16 H GLY 16 8.904 1.752 2.484
100 1HA GLY 16 1HA GLY 16 9.722 0.431 4.229
101 2HA GLY 16 2HA GLY 16 8.111 -0.281 4.484
102 H MET 17 H MET 17 7.567 -0.774 1.618
103 HA MET 17 HA MET 17 8.909 -3.253 1.251
104 1HB MET 17 1HB MET 17 6.509 -2.066 0.494
105 2HB MET 17 2HB MET 17 7.447 -1.930 -1.001
106 1HG MET 17 1HG MET 17 8.088 -4.334 -0.559
107 2HG MET 17 2HG MET 17 6.820 -4.373 0.660
108 1HE MET 17 1HE MET 17 7.712 -4.099 -3.112
109 2HE MET 17 2HE MET 17 6.133 -4.043 -3.927
110 3HE MET 17 3HE MET 17 6.708 -2.630 -3.019
111 H ILE 18 H ILE 18 9.182 0.004 0.082
112 HA ILE 18 HA ILE 18 11.337 -0.516 -1.874
113 HB ILE 18 HB ILE 18 10.271 2.065 -0.619
114 1HG1 ILE 18 1HG1 ILE 18 9.678 2.647 -2.972
115 2HG1 ILE 18 2HG1 ILE 18 10.112 1.009 -3.481
116 1HG2 ILE 18 1HG2 ILE 18 12.484 1.737 -2.693
117 2HG2 ILE 18 2HG2 ILE 18 11.723 3.280 -2.240
118 3HG2 ILE 18 3HG2 ILE 18 12.664 2.398 -1.051
119 1HD1 ILE 18 1HD1 ILE 18 7.913 1.744 -1.504
120 2HD1 ILE 18 2HD1 ILE 18 7.669 1.441 -3.232
121 3HD1 ILE 18 3HD1 ILE 18 8.212 0.121 -2.195
122 H ASP 19 H ASP 19 11.057 1.052 1.315
123 HA ASP 19 HA ASP 19 13.736 1.621 1.571
124 1HB ASP 19 1HB ASP 19 11.704 1.506 3.827
125 2HB ASP 19 2HB ASP 19 13.075 2.599 3.663
126 H GLY 20 H GLY 20 12.113 -1.307 2.542
127 1HA GLY 20 1HA GLY 20 13.597 -1.979 4.839
128 2HA GLY 20 2HA GLY 20 12.571 -3.046 3.881
Start of MODEL 2
1 1H GLY 1 1HN GLY 1 -10.946 -6.312 4.832
2 2H GLY 1 2HN GLY 1 -11.332 -7.534 3.810
3 3H GLY 1 3HN GLY 1 -12.388 -7.110 5.012
4 1HA GLY 1 1HA GLY 1 -13.127 -6.283 2.867
5 2HA GLY 1 2HA GLY 1 -12.750 -4.966 4.002
6 H LEU 2 H LEU 2 -12.705 -4.786 1.086
7 HA LEU 2 HA LEU 2 -10.341 -5.414 -0.143
8 1HB LEU 2 1HB LEU 2 -11.039 -3.998 -1.946
9 2HB LEU 2 2HB LEU 2 -12.421 -4.820 -1.253
10 HG LEU 2 HG LEU 2 -12.559 -2.482 0.166
11 1HD1 LEU 2 1HD1 LEU 2 -10.620 -1.435 -1.008
12 2HD1 LEU 2 2HD1 LEU 2 -11.450 -1.653 -2.557
13 3HD1 LEU 2 3HD1 LEU 2 -12.126 -0.574 -1.321
14 1HD2 LEU 2 1HD2 LEU 2 -14.393 -3.493 -1.123
15 2HD2 LEU 2 2HD2 LEU 2 -14.282 -1.757 -1.439
16 3HD2 LEU 2 3HD2 LEU 2 -13.668 -2.915 -2.638
17 H PHE 3 H PHE 3 -10.818 -2.565 1.900
18 HA PHE 3 HA PHE 3 -8.753 -0.884 1.070
19 1HB PHE 3 1HB PHE 3 -10.531 -0.705 2.937
20 2HB PHE 3 2HB PHE 3 -9.492 -1.604 3.947
21 HD1 PHE 3 1HD PHE 3 -9.316 1.456 1.713
22 HD2 PHE 3 2HD PHE 3 -7.955 -0.450 5.346
23 HE1 PHE 3 1HE PHE 3 -7.967 3.465 2.282
24 HE2 PHE 3 2HE PHE 3 -6.651 1.581 5.909
25 HZ PHE 3 HZ PHE 3 -6.639 3.528 4.360
26 H GLY 4 H GLY 4 -8.768 -3.479 3.297
27 1HA GLY 4 1HA GLY 4 -5.987 -3.582 4.061
28 2HA GLY 4 2HA GLY 4 -7.145 -4.896 4.283
29 H ALA 5 H ALA 5 -7.309 -4.442 1.020
30 HA ALA 5 HA ALA 5 -5.051 -6.311 0.440
31 1HB ALA 5 1HB ALA 5 -7.317 -7.032 -0.272
32 2HB ALA 5 2HB ALA 5 -7.450 -5.569 -1.281
33 3HB ALA 5 3HB ALA 5 -6.215 -6.788 -1.642
34 H ILE 6 H ILE 6 -6.074 -2.981 0.039
35 HA ILE 6 HA ILE 6 -3.784 -2.470 -1.712
36 HB ILE 6 HB ILE 6 -5.114 -0.340 -2.346
37 1HG1 ILE 6 1HG1 ILE 6 -7.336 -2.351 -2.023
38 2HG1 ILE 6 2HG1 ILE 6 -7.010 -1.170 -0.764
39 1HG2 ILE 6 1HG2 ILE 6 -5.637 -3.104 -3.467
40 2HG2 ILE 6 2HG2 ILE 6 -5.891 -1.557 -4.327
41 3HG2 ILE 6 3HG2 ILE 6 -4.254 -2.048 -3.844
42 1HD1 ILE 6 1HD1 ILE 6 -8.862 -0.433 -2.233
43 2HD1 ILE 6 2HD1 ILE 6 -7.498 0.690 -2.279
44 3HD1 ILE 6 3HD1 ILE 6 -7.771 -0.442 -3.628
45 H ALA 7 H ALA 7 -5.716 -0.101 -0.111
46 HA ALA 7 HA ALA 7 -5.026 1.845 0.626
47 1HB ALA 7 1HB ALA 7 -5.952 0.623 2.538
48 2HB ALA 7 2HB ALA 7 -4.371 -0.063 2.938
49 3HB ALA 7 3HB ALA 7 -4.654 1.688 3.110
50 H GLY 8 H GLY 8 -2.383 0.132 2.314
51 1HA GLY 8 1HA GLY 8 -0.352 2.038 1.966
52 2HA GLY 8 2HA GLY 8 -0.144 0.299 2.196
53 H PHE 9 H PHE 9 -1.509 -0.487 -0.342
54 HA PHE 9 HA PHE 9 0.627 -0.261 -2.203
55 1HB PHE 9 1HB PHE 9 -1.347 -1.954 -2.035
56 2HB PHE 9 2HB PHE 9 -2.310 -0.728 -2.855
57 HD1 PHE 9 1HD PHE 9 0.944 -2.614 -3.201
58 HD2 PHE 9 2HD PHE 9 -2.387 -0.767 -5.226
59 HE1 PHE 9 1HE PHE 9 1.798 -3.449 -5.371
60 HE2 PHE 9 2HE PHE 9 -1.538 -1.617 -7.393
61 HZ PHE 9 HZ PHE 9 0.555 -2.961 -7.473
62 H ILE 10 H ILE 10 -1.654 2.122 -1.377
63 HA ILE 10 HA ILE 10 -1.240 3.628 -3.906
64 HB ILE 10 HB ILE 10 -3.572 3.578 -1.920
65 1HG1 ILE 10 1HG1 ILE 10 -3.855 2.677 -4.805
66 2HG1 ILE 10 2HG1 ILE 10 -3.363 1.532 -3.558
67 1HG2 ILE 10 1HG2 ILE 10 -4.725 5.047 -3.576
68 2HG2 ILE 10 2HG2 ILE 10 -3.249 5.794 -2.971
69 3HG2 ILE 10 3HG2 ILE 10 -3.259 5.041 -4.584
70 1HD1 ILE 10 1HD1 ILE 10 -5.762 1.462 -3.808
71 2HD1 ILE 10 2HD1 ILE 10 -5.320 2.062 -2.190
72 3HD1 ILE 10 3HD1 ILE 10 -5.902 3.190 -3.431
73 H GLU 11 H GLU 11 -2.048 3.870 -0.473
74 HA GLU 11 HA GLU 11 -1.204 6.529 -0.019
75 1HB GLU 11 1HB GLU 11 -1.581 4.125 1.804
76 2HB GLU 11 2HB GLU 11 -1.306 5.760 2.409
77 1HG GLU 11 1HG GLU 11 -3.373 6.563 1.679
78 2HG GLU 11 2HG GLU 11 -3.549 5.348 0.423
79 H ASN 12 H ASN 12 0.778 3.720 -0.491
80 HA ASN 12 HA ASN 12 3.173 5.375 0.169
81 1HB ASN 12 1HB ASN 12 2.658 2.549 1.126
82 2HB ASN 12 2HB ASN 12 4.283 3.223 0.990
83 1HD2 ASN 12 1HD2 ASN 12 2.302 2.367 3.363
84 2HD2 ASN 12 2HD2 ASN 12 2.504 3.767 4.427
85 H GLY 13 H GLY 13 1.823 2.480 -1.471
86 1HA GLY 13 1HA GLY 13 2.021 2.041 -3.770
87 2HA GLY 13 2HA GLY 13 3.363 3.177 -3.891
88 H ALA 14 H ALA 14 5.232 2.477 -2.348
89 HA ALA 14 HA ALA 14 5.963 -0.330 -3.160
90 1HB ALA 14 1HB ALA 14 8.195 0.495 -3.654
91 2HB ALA 14 2HB ALA 14 6.986 1.384 -4.595
92 3HB ALA 14 3HB ALA 14 7.733 2.141 -3.168
93 H GLU 15 H GLU 15 4.905 -0.527 -0.886
94 HA GLU 15 HA GLU 15 6.261 0.485 1.365
95 1HB GLU 15 1HB GLU 15 4.414 -1.916 1.115
96 2HB GLU 15 2HB GLU 15 4.989 -1.215 2.653
97 1HG GLU 15 1HG GLU 15 4.141 1.009 1.889
98 2HG GLU 15 2HG GLU 15 3.354 0.219 0.512
99 H GLY 16 H GLY 16 7.794 -0.176 2.624
100 1HA GLY 16 1HA GLY 16 9.544 -1.351 3.541
101 2HA GLY 16 2HA GLY 16 9.114 -2.767 2.558
102 H MET 17 H MET 17 9.166 -0.842 0.064
103 HA MET 17 HA MET 17 11.953 -0.972 -0.542
104 1HB MET 17 1HB MET 17 9.480 -0.924 -1.940
105 2HB MET 17 2HB MET 17 10.210 0.649 -2.276
106 1HG MET 17 1HG MET 17 12.346 -0.644 -2.675
107 2HG MET 17 2HG MET 17 11.374 -2.110 -2.732
108 1HE MET 17 1HE MET 17 12.466 -2.648 -5.084
109 2HE MET 17 2HE MET 17 12.471 -1.517 -6.459
110 3HE MET 17 3HE MET 17 13.398 -1.137 -4.988
111 H ILE 18 H ILE 18 9.622 1.403 0.543
112 HA ILE 18 HA ILE 18 10.872 3.818 -0.145
113 HB ILE 18 HB ILE 18 9.324 3.192 2.405
114 1HG1 ILE 18 1HG1 ILE 18 7.829 2.477 0.816
115 2HG1 ILE 18 2HG1 ILE 18 7.307 4.105 1.175
116 1HG2 ILE 18 1HG2 ILE 18 8.646 5.598 2.341
117 2HG2 ILE 18 2HG2 ILE 18 10.389 5.412 2.520
118 3HG2 ILE 18 3HG2 ILE 18 9.712 5.847 0.940
119 1HD1 ILE 18 1HD1 ILE 18 8.904 3.223 -1.265
120 2HD1 ILE 18 2HD1 ILE 18 7.213 3.748 -1.213
121 3HD1 ILE 18 3HD1 ILE 18 8.518 4.915 -0.873
122 H ASP 19 H ASP 19 11.069 2.038 2.801
123 HA ASP 19 HA ASP 19 13.867 2.892 3.390
124 1HB ASP 19 1HB ASP 19 11.474 3.175 5.243
125 2HB ASP 19 2HB ASP 19 13.107 2.944 5.867
126 H GLY 20 H GLY 20 14.653 0.860 2.826
127 1HA GLY 20 1HA GLY 20 15.085 -1.087 4.550
128 2HA GLY 20 2HA GLY 20 13.461 -1.561 4.033
Start of MODEL 3
1 1H GLY 1 1HN GLY 1 -11.119 -7.045 4.059
2 2H GLY 1 2HN GLY 1 -11.583 -8.122 2.917
3 3H GLY 1 3HN GLY 1 -12.529 -7.894 4.258
4 1HA GLY 1 1HA GLY 1 -13.484 -6.805 2.335
5 2HA GLY 1 2HA GLY 1 -13.012 -5.648 3.601
6 H LEU 2 H LEU 2 -13.293 -4.746 1.011
7 HA LEU 2 HA LEU 2 -11.274 -5.002 -0.807
8 1HB LEU 2 1HB LEU 2 -12.141 -3.024 -1.854
9 2HB LEU 2 2HB LEU 2 -13.458 -3.951 -1.164
10 HG LEU 2 HG LEU 2 -13.010 -2.237 0.923
11 1HD1 LEU 2 1HD1 LEU 2 -12.627 0.037 0.070
12 2HD1 LEU 2 2HD1 LEU 2 -11.215 -0.966 -0.262
13 3HD1 LEU 2 3HD1 LEU 2 -12.351 -0.593 -1.566
14 1HD2 LEU 2 1HD2 LEU 2 -15.180 -2.625 -0.167
15 2HD2 LEU 2 2HD2 LEU 2 -14.896 -0.898 0.080
16 3HD2 LEU 2 3HD2 LEU 2 -14.691 -1.603 -1.537
17 H PHE 3 H PHE 3 -11.050 -3.096 2.128
18 HA PHE 3 HA PHE 3 -9.153 -1.170 1.529
19 1HB PHE 3 1HB PHE 3 -10.484 -1.795 3.664
20 2HB PHE 3 2HB PHE 3 -9.257 -2.916 4.036
21 HD1 PHE 3 1HD PHE 3 -9.687 0.738 3.198
22 HD2 PHE 3 2HD PHE 3 -7.319 -2.221 5.271
23 HE1 PHE 3 1HE PHE 3 -8.315 2.535 4.214
24 HE2 PHE 3 2HE PHE 3 -5.965 -0.414 6.287
25 HZ PHE 3 HZ PHE 3 -6.458 1.961 5.764
26 H GLY 4 H GLY 4 -8.731 -4.405 2.638
27 1HA GLY 4 1HA GLY 4 -5.878 -4.563 2.757
28 2HA GLY 4 2HA GLY 4 -6.931 -5.972 2.579
29 H ALA 5 H ALA 5 -7.963 -4.764 -0.093
30 HA ALA 5 HA ALA 5 -5.942 -5.994 -1.812
31 1HB ALA 5 1HB ALA 5 -7.433 -5.415 -3.642
32 2HB ALA 5 2HB ALA 5 -8.375 -6.152 -2.332
33 3HB ALA 5 3HB ALA 5 -8.415 -4.389 -2.590
34 H ILE 6 H ILE 6 -7.006 -2.679 -0.927
35 HA ILE 6 HA ILE 6 -4.873 -1.565 -2.610
36 HB ILE 6 HB ILE 6 -6.144 0.643 -2.087
37 1HG1 ILE 6 1HG1 ILE 6 -8.402 -1.350 -2.174
38 2HG1 ILE 6 2HG1 ILE 6 -7.778 -0.683 -0.664
39 1HG2 ILE 6 1HG2 ILE 6 -7.238 0.427 -4.230
40 2HG2 ILE 6 2HG2 ILE 6 -5.591 -0.214 -4.265
41 3HG2 ILE 6 3HG2 ILE 6 -6.973 -1.341 -4.198
42 1HD1 ILE 6 1HD1 ILE 6 -9.050 0.931 -2.919
43 2HD1 ILE 6 2HD1 ILE 6 -9.751 0.591 -1.331
44 3HD1 ILE 6 3HD1 ILE 6 -8.318 1.625 -1.452
45 H ALA 7 H ALA 7 -6.193 0.237 0.023
46 HA ALA 7 HA ALA 7 -5.015 1.686 1.266
47 1HB ALA 7 1HB ALA 7 -4.718 -1.005 2.689
48 2HB ALA 7 2HB ALA 7 -4.555 0.583 3.477
49 3HB ALA 7 3HB ALA 7 -6.103 0.095 2.755
50 H GLY 8 H GLY 8 -2.751 -0.966 1.988
51 1HA GLY 8 1HA GLY 8 -0.327 0.302 1.988
52 2HA GLY 8 2HA GLY 8 -0.569 -1.331 1.381
53 H PHE 9 H PHE 9 -2.207 -0.601 -0.923
54 HA PHE 9 HA PHE 9 -0.411 -0.039 -3.006
55 1HB PHE 9 1HB PHE 9 -2.726 -0.920 -3.220
56 2HB PHE 9 2HB PHE 9 -3.367 0.650 -2.757
57 HD1 PHE 9 1HD PHE 9 -3.837 2.276 -4.416
58 HD2 PHE 9 2HD PHE 9 -1.195 -1.007 -5.347
59 HE1 PHE 9 1HE PHE 9 -3.799 2.977 -6.791
60 HE2 PHE 9 2HE PHE 9 -1.164 -0.300 -7.724
61 HZ PHE 9 HZ PHE 9 -2.464 1.692 -8.450
62 H ILE 10 H ILE 10 -2.532 2.255 -1.244
63 HA ILE 10 HA ILE 10 -1.709 4.595 -2.738
64 HB ILE 10 HB ILE 10 -3.282 4.264 -0.123
65 1HG1 ILE 10 1HG1 ILE 10 -5.109 5.128 -1.990
66 2HG1 ILE 10 2HG1 ILE 10 -4.082 4.143 -3.019
67 1HG2 ILE 10 1HG2 ILE 10 -2.345 6.520 -0.306
68 2HG2 ILE 10 2HG2 ILE 10 -2.975 6.669 -1.964
69 3HG2 ILE 10 3HG2 ILE 10 -4.087 6.555 -0.572
70 1HD1 ILE 10 1HD1 ILE 10 -5.991 2.901 -2.063
71 2HD1 ILE 10 2HD1 ILE 10 -4.460 2.215 -1.473
72 3HD1 ILE 10 3HD1 ILE 10 -5.427 3.267 -0.421
73 H GLU 11 H GLU 11 -0.797 2.981 0.267
74 HA GLU 11 HA GLU 11 1.028 5.018 1.210
75 1HB GLU 11 1HB GLU 11 0.967 2.037 1.777
76 2HB GLU 11 2HB GLU 11 1.879 3.224 2.690
77 1HG GLU 11 1HG GLU 11 -0.050 4.218 3.627
78 2HG GLU 11 2HG GLU 11 -1.131 3.532 2.421
79 H ASN 12 H ASN 12 1.308 2.957 -1.491
80 HA ASN 12 HA ASN 12 2.759 2.971 -3.183
81 1HB ASN 12 1HB ASN 12 4.510 4.751 -1.472
82 2HB ASN 12 2HB ASN 12 5.053 4.036 -2.990
83 1HD2 ASN 12 1HD2 ASN 12 4.106 6.960 -1.944
84 2HD2 ASN 12 2HD2 ASN 12 3.104 7.431 -3.320
85 H GLY 13 H GLY 13 2.133 1.257 -1.085
86 1HA GLY 13 1HA GLY 13 2.459 -0.799 -0.535
87 2HA GLY 13 2HA GLY 13 4.101 -0.786 -1.239
88 H ALA 14 H ALA 14 3.846 1.883 0.680
89 HA ALA 14 HA ALA 14 4.419 2.511 2.802
90 1HB ALA 14 1HB ALA 14 5.632 1.168 4.391
91 2HB ALA 14 2HB ALA 14 4.141 0.326 3.925
92 3HB ALA 14 3HB ALA 14 5.712 -0.201 3.266
93 H GLU 15 H GLU 15 5.347 3.780 1.082
94 HA GLU 15 HA GLU 15 7.916 3.399 -0.016
95 1HB GLU 15 1HB GLU 15 8.045 5.895 -0.066
96 2HB GLU 15 2HB GLU 15 6.624 5.179 -0.814
97 1HG GLU 15 1HG GLU 15 5.279 5.746 1.234
98 2HG GLU 15 2HG GLU 15 6.709 6.509 1.932
99 H GLY 16 H GLY 16 10.017 3.667 0.684
100 1HA GLY 16 1HA GLY 16 11.725 4.227 2.100
101 2HA GLY 16 2HA GLY 16 10.590 4.388 3.473
102 H MET 17 H MET 17 9.114 1.940 2.949
103 HA MET 17 HA MET 17 10.885 -0.005 4.100
104 1HB MET 17 1HB MET 17 8.108 0.624 4.159
105 2HB MET 17 2HB MET 17 8.208 -0.863 3.204
106 1HG MET 17 1HG MET 17 9.761 -1.691 4.974
107 2HG MET 17 2HG MET 17 9.341 -0.307 5.967
108 1HE MET 17 1HE MET 17 6.867 -2.620 3.721
109 2HE MET 17 2HE MET 17 8.127 -3.673 4.407
110 3HE MET 17 3HE MET 17 6.444 -3.808 4.969
111 H ILE 18 H ILE 18 9.408 0.802 1.027
112 HA ILE 18 HA ILE 18 10.224 -1.599 -0.427
113 HB ILE 18 HB ILE 18 9.326 1.182 -1.248
114 1HG1 ILE 18 1HG1 ILE 18 7.748 -0.259 -2.668
115 2HG1 ILE 18 2HG1 ILE 18 8.411 -1.673 -1.847
116 1HG2 ILE 18 1HG2 ILE 18 11.139 0.830 -2.832
117 2HG2 ILE 18 2HG2 ILE 18 10.584 -0.830 -3.164
118 3HG2 ILE 18 3HG2 ILE 18 9.610 0.577 -3.652
119 1HD1 ILE 18 1HD1 ILE 18 7.535 -0.830 0.302
120 2HD1 ILE 18 2HD1 ILE 18 6.989 0.660 -0.511
121 3HD1 ILE 18 3HD1 ILE 18 6.265 -0.900 -0.928
122 H ASP 19 H ASP 19 11.617 1.694 -0.117
123 HA ASP 19 HA ASP 19 13.971 1.316 -1.456
124 1HB ASP 19 1HB ASP 19 13.555 3.107 0.970
125 2HB ASP 19 2HB ASP 19 14.661 3.364 -0.375
126 H GLY 20 H GLY 20 13.175 0.167 1.737
127 1HA GLY 20 1HA GLY 20 15.972 -0.726 2.247
128 2HA GLY 20 2HA GLY 20 14.676 -0.602 3.439
Start of MODEL 4
1 1H GLY 1 1HN GLY 1 -9.134 -7.095 4.837
2 2H GLY 1 2HN GLY 1 -9.417 -8.375 3.854
3 3H GLY 1 3HN GLY 1 -10.382 -8.132 5.175
4 1HA GLY 1 1HA GLY 1 -11.485 -7.469 3.123
5 2HA GLY 1 2HA GLY 1 -11.257 -6.121 4.260
6 H LEU 2 H LEU 2 -11.559 -5.891 1.364
7 HA LEU 2 HA LEU 2 -9.270 -5.962 -0.131
8 1HB LEU 2 1HB LEU 2 -10.441 -4.705 -1.782
9 2HB LEU 2 2HB LEU 2 -11.571 -5.762 -0.965
10 HG LEU 2 HG LEU 2 -11.935 -3.493 0.532
11 1HD1 LEU 2 1HD1 LEU 2 -11.321 -2.472 -2.284
12 2HD1 LEU 2 2HD1 LEU 2 -12.016 -1.528 -0.952
13 3HD1 LEU 2 3HD1 LEU 2 -10.356 -2.117 -0.843
14 1HD2 LEU 2 1HD2 LEU 2 -13.722 -4.782 -0.566
15 2HD2 LEU 2 2HD2 LEU 2 -13.933 -3.049 -0.845
16 3HD2 LEU 2 3HD2 LEU 2 -13.284 -4.079 -2.138
17 H PHE 3 H PHE 3 -10.067 -3.387 2.128
18 HA PHE 3 HA PHE 3 -8.552 -1.233 1.214
19 1HB PHE 3 1HB PHE 3 -10.062 -1.611 3.286
20 2HB PHE 3 2HB PHE 3 -8.711 -2.286 4.082
21 HD1 PHE 3 1HD PHE 3 -6.949 -0.897 5.038
22 HD2 PHE 3 2HD PHE 3 -9.966 0.859 2.497
23 HE1 PHE 3 1HE PHE 3 -6.179 1.366 5.680
24 HE2 PHE 3 2HE PHE 3 -9.180 3.121 3.141
25 HZ PHE 3 HZ PHE 3 -7.286 3.378 4.730
26 H GLY 4 H GLY 4 -7.695 -3.916 3.177
27 1HA GLY 4 1HA GLY 4 -4.876 -3.430 3.568
28 2HA GLY 4 2HA GLY 4 -5.691 -4.977 3.824
29 H ALA 5 H ALA 5 -6.453 -4.469 0.663
30 HA ALA 5 HA ALA 5 -3.983 -5.780 -0.350
31 1HB ALA 5 1HB ALA 5 -6.671 -5.358 -1.718
32 2HB ALA 5 2HB ALA 5 -5.303 -6.312 -2.315
33 3HB ALA 5 3HB ALA 5 -6.176 -6.841 -0.862
34 H ILE 6 H ILE 6 -5.587 -2.663 -0.261
35 HA ILE 6 HA ILE 6 -3.674 -1.648 -2.227
36 HB ILE 6 HB ILE 6 -5.389 0.285 -2.475
37 1HG1 ILE 6 1HG1 ILE 6 -7.209 -2.075 -2.041
38 2HG1 ILE 6 2HG1 ILE 6 -6.884 -0.907 -0.760
39 1HG2 ILE 6 1HG2 ILE 6 -5.585 -2.437 -3.783
40 2HG2 ILE 6 2HG2 ILE 6 -6.212 -0.906 -4.460
41 3HG2 ILE 6 3HG2 ILE 6 -4.466 -1.126 -4.220
42 1HD1 ILE 6 1HD1 ILE 6 -8.987 -0.318 -1.859
43 2HD1 ILE 6 2HD1 ILE 6 -7.771 0.932 -2.184
44 3HD1 ILE 6 3HD1 ILE 6 -8.188 -0.259 -3.440
45 H ALA 7 H ALA 7 -5.553 0.493 -0.354
46 HA ALA 7 HA ALA 7 -4.824 2.448 0.434
47 1HB ALA 7 1HB ALA 7 -4.507 2.205 2.896
48 2HB ALA 7 2HB ALA 7 -5.805 1.168 2.269
49 3HB ALA 7 3HB ALA 7 -4.231 0.459 2.677
50 H GLY 8 H GLY 8 -2.172 0.474 1.857
51 1HA GLY 8 1HA GLY 8 -0.161 2.480 1.751
52 2HA GLY 8 2HA GLY 8 0.090 0.735 1.824
53 H PHE 9 H PHE 9 -1.413 0.262 -0.761
54 HA PHE 9 HA PHE 9 0.602 0.521 -2.719
55 1HB PHE 9 1HB PHE 9 -1.511 -0.909 -2.722
56 2HB PHE 9 2HB PHE 9 -2.405 0.545 -3.163
57 HD1 PHE 9 1HD PHE 9 0.493 -1.598 -4.253
58 HD2 PHE 9 2HD PHE 9 -2.602 1.160 -5.451
59 HE1 PHE 9 1HE PHE 9 1.078 -1.970 -6.632
60 HE2 PHE 9 2HE PHE 9 -2.021 0.776 -7.828
61 HZ PHE 9 HZ PHE 9 -0.183 -0.792 -8.426
62 H ILE 10 H ILE 10 -1.798 2.862 -1.603
63 HA ILE 10 HA ILE 10 -1.263 4.692 -3.869
64 HB ILE 10 HB ILE 10 -3.391 4.712 -1.662
65 1HG1 ILE 10 1HG1 ILE 10 -4.734 4.591 -4.076
66 2HG1 ILE 10 2HG1 ILE 10 -3.320 3.620 -4.461
67 1HG2 ILE 10 1HG2 ILE 10 -2.787 6.984 -2.337
68 2HG2 ILE 10 2HG2 ILE 10 -2.980 6.542 -4.054
69 3HG2 ILE 10 3HG2 ILE 10 -4.387 6.555 -2.955
70 1HD1 ILE 10 1HD1 ILE 10 -3.832 2.196 -2.444
71 2HD1 ILE 10 2HD1 ILE 10 -5.261 3.202 -2.138
72 3HD1 ILE 10 3HD1 ILE 10 -5.157 2.241 -3.627
73 H GLU 11 H GLU 11 -1.356 4.618 -0.211
74 HA GLU 11 HA GLU 11 -0.230 7.149 0.113
75 1HB GLU 11 1HB GLU 11 -0.254 4.694 1.898
76 2HB GLU 11 2HB GLU 11 -0.006 6.343 2.466
77 1HG GLU 11 1HG GLU 11 -2.556 5.558 0.954
78 2HG GLU 11 2HG GLU 11 -2.359 5.231 2.633
79 H ASN 12 H ASN 12 1.389 4.356 -0.965
80 HA ASN 12 HA ASN 12 4.017 5.661 -0.725
81 1HB ASN 12 1HB ASN 12 3.189 3.588 1.167
82 2HB ASN 12 2HB ASN 12 4.475 2.957 0.159
83 1HD2 ASN 12 1HD2 ASN 12 3.784 6.207 1.594
84 2HD2 ASN 12 2HD2 ASN 12 5.369 6.327 2.382
85 H GLY 13 H GLY 13 2.113 2.864 -1.777
86 1HA GLY 13 1HA GLY 13 2.450 1.689 -3.888
87 2HA GLY 13 2HA GLY 13 4.148 2.152 -3.841
88 H ALA 14 H ALA 14 2.691 1.342 -0.824
89 HA ALA 14 HA ALA 14 2.603 -0.417 0.553
90 1HB ALA 14 1HB ALA 14 4.502 -2.001 -1.199
91 2HB ALA 14 2HB ALA 14 3.638 -2.565 0.237
92 3HB ALA 14 3HB ALA 14 2.726 -2.130 -1.225
93 H GLU 15 H GLU 15 3.477 0.417 2.322
94 HA GLU 15 HA GLU 15 5.933 1.775 2.424
95 1HB GLU 15 1HB GLU 15 4.306 0.509 4.691
96 2HB GLU 15 2HB GLU 15 5.582 1.704 4.871
97 1HG GLU 15 1HG GLU 15 3.576 2.874 5.137
98 2HG GLU 15 2HG GLU 15 4.214 3.342 3.571
99 H GLY 16 H GLY 16 7.933 1.229 3.035
100 1HA GLY 16 1HA GLY 16 9.739 0.073 3.900
101 2HA GLY 16 2HA GLY 16 8.665 -1.242 4.394
102 H MET 17 H MET 17 7.470 -1.379 1.660
103 HA MET 17 HA MET 17 9.199 -3.216 0.356
104 1HB MET 17 1HB MET 17 6.452 -2.542 0.406
105 2HB MET 17 2HB MET 17 6.982 -2.000 -1.189
106 1HG MET 17 1HG MET 17 8.161 -4.244 -1.336
107 2HG MET 17 2HG MET 17 7.226 -4.753 0.058
108 1HE MET 17 1HE MET 17 7.165 -3.739 -3.711
109 2HE MET 17 2HE MET 17 5.447 -3.880 -4.151
110 3HE MET 17 3HE MET 17 5.985 -2.541 -3.121
111 H ILE 18 H ILE 18 8.421 0.206 0.022
112 HA ILE 18 HA ILE 18 9.751 0.711 -2.476
113 HB ILE 18 HB ILE 18 9.402 2.594 -0.090
114 1HG1 ILE 18 1HG1 ILE 18 7.218 1.934 -0.459
115 2HG1 ILE 18 2HG1 ILE 18 7.365 3.438 -1.341
116 1HG2 ILE 18 1HG2 ILE 18 9.453 4.402 -1.787
117 2HG2 ILE 18 2HG2 ILE 18 10.961 3.489 -1.768
118 3HG2 ILE 18 3HG2 ILE 18 9.779 3.206 -3.058
119 1HD1 ILE 18 1HD1 ILE 18 7.745 2.093 -3.450
120 2HD1 ILE 18 2HD1 ILE 18 7.387 0.623 -2.512
121 3HD1 ILE 18 3HD1 ILE 18 6.149 1.865 -2.691
122 H ASP 19 H ASP 19 10.779 1.381 0.807
123 HA ASP 19 HA ASP 19 13.397 0.226 0.625
124 1HB ASP 19 1HB ASP 19 13.838 2.374 -0.590
125 2HB ASP 19 2HB ASP 19 13.195 3.274 0.786
126 H GLY 20 H GLY 20 14.511 0.620 2.776
127 1HA GLY 20 1HA GLY 20 14.078 1.778 5.002
128 2HA GLY 20 2HA GLY 20 12.545 0.890 5.023
Start of MODEL 5
1 1H GLY 1 1HN GLY 1 -11.698 -4.865 4.436
2 2H GLY 1 2HN GLY 1 -11.870 -6.478 4.209
3 3H GLY 1 3HN GLY 1 -13.200 -5.555 4.552
4 1HA GLY 1 1HA GLY 1 -13.098 -6.159 2.205
5 2HA GLY 1 2HA GLY 1 -13.029 -4.403 2.481
6 H LEU 2 H LEU 2 -11.998 -5.760 0.136
7 HA LEU 2 HA LEU 2 -9.378 -6.570 0.184
8 1HB LEU 2 1HB LEU 2 -9.410 -6.353 -2.195
9 2HB LEU 2 2HB LEU 2 -10.995 -6.854 -1.647
10 HG LEU 2 HG LEU 2 -11.390 -4.138 -1.721
11 1HD1 LEU 2 1HD1 LEU 2 -10.381 -3.210 -3.761
12 2HD1 LEU 2 2HD1 LEU 2 -9.106 -3.669 -2.630
13 3HD1 LEU 2 3HD1 LEU 2 -9.459 -4.705 -4.021
14 1HD2 LEU 2 1HD2 LEU 2 -12.480 -4.483 -3.907
15 2HD2 LEU 2 2HD2 LEU 2 -11.623 -6.026 -4.103
16 3HD2 LEU 2 3HD2 LEU 2 -12.821 -5.824 -2.806
17 H PHE 3 H PHE 3 -10.436 -3.250 0.369
18 HA PHE 3 HA PHE 3 -8.262 -1.761 -0.523
19 1HB PHE 3 1HB PHE 3 -10.580 -1.200 0.556
20 2HB PHE 3 2HB PHE 3 -9.824 -1.348 2.070
21 HD1 PHE 3 1HD PHE 3 -9.021 0.403 -1.206
22 HD2 PHE 3 2HD PHE 3 -9.186 0.679 3.105
23 HE1 PHE 3 1HE PHE 3 -8.202 2.744 -1.309
24 HE2 PHE 3 2HE PHE 3 -8.385 3.020 2.973
25 HZ PHE 3 HZ PHE 3 -7.878 4.047 0.773
26 H GLY 4 H GLY 4 -8.894 -3.307 2.468
27 1HA GLY 4 1HA GLY 4 -6.605 -2.543 4.029
28 2HA GLY 4 2HA GLY 4 -7.618 -3.956 4.350
29 H ALA 5 H ALA 5 -6.706 -4.804 1.368
30 HA ALA 5 HA ALA 5 -4.223 -6.181 2.263
31 1HB ALA 5 1HB ALA 5 -5.967 -7.481 1.051
32 2HB ALA 5 2HB ALA 5 -5.763 -6.407 -0.358
33 3HB ALA 5 3HB ALA 5 -4.421 -7.430 0.180
34 H ILE 6 H ILE 6 -5.219 -3.401 0.387
35 HA ILE 6 HA ILE 6 -2.525 -3.087 -0.724
36 HB ILE 6 HB ILE 6 -3.775 -1.663 -2.484
37 1HG1 ILE 6 1HG1 ILE 6 -5.797 -3.825 -1.936
38 2HG1 ILE 6 2HG1 ILE 6 -5.971 -2.193 -1.307
39 1HG2 ILE 6 1HG2 ILE 6 -3.726 -3.637 -3.943
40 2HG2 ILE 6 2HG2 ILE 6 -2.301 -3.566 -2.887
41 3HG2 ILE 6 3HG2 ILE 6 -3.628 -4.689 -2.501
42 1HD1 ILE 6 1HD1 ILE 6 -5.904 -2.941 -4.258
43 2HD1 ILE 6 2HD1 ILE 6 -7.300 -2.365 -3.332
44 3HD1 ILE 6 3HD1 ILE 6 -5.937 -1.275 -3.629
45 H ALA 7 H ALA 7 -5.111 -0.794 -0.673
46 HA ALA 7 HA ALA 7 -4.810 1.413 -0.759
47 1HB ALA 7 1HB ALA 7 -5.330 2.259 1.561
48 2HB ALA 7 2HB ALA 7 -6.237 0.794 1.164
49 3HB ALA 7 3HB ALA 7 -4.828 0.691 2.231
50 H GLY 8 H GLY 8 -2.692 0.998 2.119
51 1HA GLY 8 1HA GLY 8 -0.889 3.082 1.491
52 2HA GLY 8 2HA GLY 8 -0.537 1.680 2.507
53 H PHE 9 H PHE 9 -1.038 -0.248 0.133
54 HA PHE 9 HA PHE 9 1.553 -0.275 -0.989
55 1HB PHE 9 1HB PHE 9 -0.365 -2.080 -0.916
56 2HB PHE 9 2HB PHE 9 -0.906 -1.340 -2.414
57 HD1 PHE 9 1HD PHE 9 1.591 -3.481 -0.803
58 HD2 PHE 9 2HD PHE 9 0.594 -1.408 -4.453
59 HE1 PHE 9 1HE PHE 9 3.310 -4.788 -2.018
60 HE2 PHE 9 2HE PHE 9 2.299 -2.730 -5.668
61 HZ PHE 9 HZ PHE 9 3.671 -4.417 -4.455
62 H ILE 10 H ILE 10 -1.249 1.558 -1.876
63 HA ILE 10 HA ILE 10 0.026 2.539 -4.367
64 HB ILE 10 HB ILE 10 -2.892 2.436 -3.391
65 1HG1 ILE 10 1HG1 ILE 10 -2.770 1.366 -5.979
66 2HG1 ILE 10 2HG1 ILE 10 -1.230 0.841 -5.311
67 1HG2 ILE 10 1HG2 ILE 10 -2.550 4.584 -4.514
68 2HG2 ILE 10 2HG2 ILE 10 -1.764 3.769 -5.892
69 3HG2 ILE 10 3HG2 ILE 10 -3.492 3.502 -5.542
70 1HD1 ILE 10 1HD1 ILE 10 -2.908 -0.851 -4.876
71 2HD1 ILE 10 2HD1 ILE 10 -2.507 -0.071 -3.329
72 3HD1 ILE 10 3HD1 ILE 10 -4.012 0.351 -4.170
73 H GLU 11 H GLU 11 -1.945 3.649 -1.604
74 HA GLU 11 HA GLU 11 -1.475 6.406 -1.924
75 1HB GLU 11 1HB GLU 11 -2.166 4.781 0.548
76 2HB GLU 11 2HB GLU 11 -2.367 6.530 0.400
77 1HG GLU 11 1HG GLU 11 -4.017 6.258 -1.379
78 2HG GLU 11 2HG GLU 11 -3.809 4.507 -1.378
79 H ASN 12 H ASN 12 0.742 3.982 -0.738
80 HA ASN 12 HA ASN 12 2.531 6.154 0.221
81 1HB ASN 12 1HB ASN 12 1.170 4.777 2.070
82 2HB ASN 12 2HB ASN 12 2.424 3.577 1.784
83 1HD2 ASN 12 1HD2 ASN 12 4.754 4.809 1.610
84 2HD2 ASN 12 2HD2 ASN 12 5.042 5.834 3.043
85 H GLY 13 H GLY 13 2.167 4.047 -2.159
86 1HA GLY 13 1HA GLY 13 3.454 2.644 -3.410
87 2HA GLY 13 2HA GLY 13 4.844 3.525 -2.770
88 H ALA 14 H ALA 14 2.799 1.817 -0.533
89 HA ALA 14 HA ALA 14 3.074 0.220 0.950
90 1HB ALA 14 1HB ALA 14 3.406 -1.416 -0.820
91 2HB ALA 14 2HB ALA 14 5.133 -1.058 -0.858
92 3HB ALA 14 3HB ALA 14 4.416 -1.783 0.590
93 H GLU 15 H GLU 15 3.787 0.952 2.826
94 HA GLU 15 HA GLU 15 6.197 2.375 3.246
95 1HB GLU 15 1HB GLU 15 4.458 0.771 5.177
96 2HB GLU 15 2HB GLU 15 5.784 1.835 5.667
97 1HG GLU 15 1HG GLU 15 4.644 3.778 4.712
98 2HG GLU 15 2HG GLU 15 3.311 2.757 4.142
99 H GLY 16 H GLY 16 8.162 1.779 3.840
100 1HA GLY 16 1HA GLY 16 9.946 0.562 4.695
101 2HA GLY 16 2HA GLY 16 8.915 -0.883 4.806
102 H MET 17 H MET 17 7.907 -0.602 2.051
103 HA MET 17 HA MET 17 9.843 -2.052 0.590
104 1HB MET 17 1HB MET 17 7.069 -1.508 0.539
105 2HB MET 17 2HB MET 17 7.676 -0.710 -0.910
106 1HG MET 17 1HG MET 17 8.945 -2.876 -1.325
107 2HG MET 17 2HG MET 17 7.964 -3.618 -0.066
108 1HE MET 17 1HE MET 17 6.338 -5.258 -3.217
109 2HE MET 17 2HE MET 17 8.065 -4.933 -2.938
110 3HE MET 17 3HE MET 17 7.040 -5.529 -1.606
111 H ILE 18 H ILE 18 8.899 1.345 0.784
112 HA ILE 18 HA ILE 18 10.264 2.451 -1.423
113 HB ILE 18 HB ILE 18 9.966 3.625 1.380
114 1HG1 ILE 18 1HG1 ILE 18 7.769 3.060 0.899
115 2HG1 ILE 18 2HG1 ILE 18 7.870 4.736 0.393
116 1HG2 ILE 18 1HG2 ILE 18 10.295 5.011 -1.320
117 2HG2 ILE 18 2HG2 ILE 18 9.889 5.837 0.202
118 3HG2 ILE 18 3HG2 ILE 18 11.440 5.020 0.035
119 1HD1 ILE 18 1HD1 ILE 18 8.329 3.849 -1.980
120 2HD1 ILE 18 2HD1 ILE 18 7.859 2.252 -1.357
121 3HD1 ILE 18 3HD1 ILE 18 6.696 3.580 -1.314
122 H ASP 19 H ASP 19 11.388 1.373 1.566
123 HA ASP 19 HA ASP 19 14.224 2.249 1.124
124 1HB ASP 19 1HB ASP 19 12.998 2.850 3.250
125 2HB ASP 19 2HB ASP 19 12.999 1.135 3.670
126 H GLY 20 H GLY 20 12.432 -0.402 0.338
127 1HA GLY 20 1HA GLY 20 14.032 -2.580 1.385
128 2HA GLY 20 2HA GLY 20 12.718 -2.667 0.202
Start of MODEL 6
1 1H GLY 1 1HN GLY 1 -9.885 -6.842 5.203
2 2H GLY 1 2HN GLY 1 -9.753 -8.356 4.589
3 3H GLY 1 3HN GLY 1 -11.040 -7.977 5.557
4 1HA GLY 1 1HA GLY 1 -11.668 -8.065 3.216
5 2HA GLY 1 2HA GLY 1 -11.901 -6.457 3.941
6 H LEU 2 H LEU 2 -11.543 -6.913 1.121
7 HA LEU 2 HA LEU 2 -8.984 -6.932 0.143
8 1HB LEU 2 1HB LEU 2 -9.910 -6.277 -1.946
9 2HB LEU 2 2HB LEU 2 -11.086 -7.268 -1.112
10 HG LEU 2 HG LEU 2 -11.939 -4.780 -0.309
11 1HD1 LEU 2 1HD1 LEU 2 -10.893 -4.372 -3.153
12 2HD1 LEU 2 2HD1 LEU 2 -11.897 -3.240 -2.225
13 3HD1 LEU 2 3HD1 LEU 2 -10.242 -3.578 -1.712
14 1HD2 LEU 2 1HD2 LEU 2 -13.662 -4.952 -2.069
15 2HD2 LEU 2 2HD2 LEU 2 -12.681 -6.160 -2.925
16 3HD2 LEU 2 3HD2 LEU 2 -13.352 -6.524 -1.319
17 H PHE 3 H PHE 3 -10.515 -4.147 1.601
18 HA PHE 3 HA PHE 3 -9.150 -1.963 0.546
19 1HB PHE 3 1HB PHE 3 -10.966 -2.297 2.394
20 2HB PHE 3 2HB PHE 3 -9.691 -2.532 3.499
21 HD1 PHE 3 1HD PHE 3 -11.270 -0.032 1.237
22 HD2 PHE 3 2HD PHE 3 -8.295 -0.667 4.304
23 HE1 PHE 3 1HE PHE 3 -11.033 2.420 1.529
24 HE2 PHE 3 2HE PHE 3 -8.073 1.784 4.588
25 HZ PHE 3 HZ PHE 3 -9.434 3.329 3.202
26 H GLY 4 H GLY 4 -8.323 -4.170 3.052
27 1HA GLY 4 1HA GLY 4 -5.747 -3.147 3.859
28 2HA GLY 4 2HA GLY 4 -6.341 -4.779 4.184
29 H ALA 5 H ALA 5 -6.538 -4.822 0.915
30 HA ALA 5 HA ALA 5 -3.738 -5.754 0.548
31 1HB ALA 5 1HB ALA 5 -4.558 -6.750 -1.507
32 2HB ALA 5 2HB ALA 5 -5.608 -7.243 -0.162
33 3HB ALA 5 3HB ALA 5 -6.142 -5.986 -1.308
34 H ILE 6 H ILE 6 -5.762 -2.985 -0.084
35 HA ILE 6 HA ILE 6 -3.757 -1.930 -1.941
36 HB ILE 6 HB ILE 6 -5.701 -0.384 -2.689
37 1HG1 ILE 6 1HG1 ILE 6 -7.171 -2.939 -2.101
38 2HG1 ILE 6 2HG1 ILE 6 -7.220 -1.553 -1.009
39 1HG2 ILE 6 1HG2 ILE 6 -6.045 -1.945 -4.548
40 2HG2 ILE 6 2HG2 ILE 6 -4.337 -1.842 -4.078
41 3HG2 ILE 6 3HG2 ILE 6 -5.305 -3.250 -3.577
42 1HD1 ILE 6 1HD1 ILE 6 -9.207 -1.487 -2.413
43 2HD1 ILE 6 2HD1 ILE 6 -8.148 -0.133 -2.846
44 3HD1 ILE 6 3HD1 ILE 6 -8.225 -1.576 -3.885
45 H ALA 7 H ALA 7 -6.198 0.083 -0.655
46 HA ALA 7 HA ALA 7 -5.916 2.216 -0.110
47 1HB ALA 7 1HB ALA 7 -5.947 2.370 2.373
48 2HB ALA 7 2HB ALA 7 -6.914 1.008 1.772
49 3HB ALA 7 3HB ALA 7 -5.315 0.711 2.481
50 H GLY 8 H GLY 8 -3.243 1.029 1.959
51 1HA GLY 8 1HA GLY 8 -1.457 3.169 1.797
52 2HA GLY 8 2HA GLY 8 -1.011 1.475 1.977
53 H PHE 9 H PHE 9 -2.084 0.571 -0.585
54 HA PHE 9 HA PHE 9 0.061 1.037 -2.337
55 1HB PHE 9 1HB PHE 9 -1.696 -0.848 -2.286
56 2HB PHE 9 2HB PHE 9 -2.702 0.237 -3.248
57 HD1 PHE 9 1HD PHE 9 0.725 -1.296 -3.094
58 HD2 PHE 9 2HD PHE 9 -2.345 0.383 -5.611
59 HE1 PHE 9 1HE PHE 9 2.047 -1.895 -5.100
60 HE2 PHE 9 2HE PHE 9 -1.026 -0.220 -7.622
61 HZ PHE 9 HZ PHE 9 1.171 -1.369 -7.377
62 H ILE 10 H ILE 10 -2.760 2.998 -1.830
63 HA ILE 10 HA ILE 10 -2.242 4.556 -4.309
64 HB ILE 10 HB ILE 10 -4.740 4.260 -2.562
65 1HG1 ILE 10 1HG1 ILE 10 -5.445 3.468 -5.139
66 2HG1 ILE 10 2HG1 ILE 10 -3.797 2.862 -5.040
67 1HG2 ILE 10 1HG2 ILE 10 -4.613 6.511 -3.535
68 2HG2 ILE 10 2HG2 ILE 10 -4.323 5.816 -5.149
69 3HG2 ILE 10 3HG2 ILE 10 -5.883 5.566 -4.321
70 1HD1 ILE 10 1HD1 ILE 10 -6.097 2.287 -3.119
71 2HD1 ILE 10 2HD1 ILE 10 -5.375 1.174 -4.303
72 3HD1 ILE 10 3HD1 ILE 10 -4.442 1.699 -2.883
73 H GLU 11 H GLU 11 -2.700 4.689 -0.771
74 HA GLU 11 HA GLU 11 -2.262 7.506 -0.526
75 1HB GLU 11 1HB GLU 11 -1.789 5.211 1.403
76 2HB GLU 11 2HB GLU 11 -1.700 6.913 1.857
77 1HG GLU 11 1HG GLU 11 -4.032 7.276 1.347
78 2HG GLU 11 2HG GLU 11 -4.203 5.684 0.616
79 H ASN 12 H ASN 12 0.023 4.846 -1.074
80 HA ASN 12 HA ASN 12 2.062 6.881 -1.611
81 1HB ASN 12 1HB ASN 12 2.224 6.100 0.895
82 2HB ASN 12 2HB ASN 12 2.909 4.622 0.233
83 1HD2 ASN 12 1HD2 ASN 12 4.454 5.871 -2.000
84 2HD2 ASN 12 2HD2 ASN 12 5.725 6.779 -1.169
85 H GLY 13 H GLY 13 1.308 3.360 -1.420
86 1HA GLY 13 1HA GLY 13 1.635 2.067 -3.567
87 2HA GLY 13 2HA GLY 13 3.243 2.803 -3.615
88 H ALA 14 H ALA 14 4.679 2.421 -1.823
89 HA ALA 14 HA ALA 14 4.138 0.700 0.351
90 1HB ALA 14 1HB ALA 14 5.753 -0.615 -1.889
91 2HB ALA 14 2HB ALA 14 5.532 -1.243 -0.238
92 3HB ALA 14 3HB ALA 14 4.150 -1.135 -1.324
93 H GLU 15 H GLU 15 5.172 2.275 1.523
94 HA GLU 15 HA GLU 15 7.992 2.967 0.978
95 1HB GLU 15 1HB GLU 15 7.551 3.998 3.422
96 2HB GLU 15 2HB GLU 15 7.297 4.841 1.915
97 1HG GLU 15 1HG GLU 15 5.461 5.204 3.532
98 2HG GLU 15 2HG GLU 15 4.929 4.558 1.987
99 H GLY 16 H GLY 16 9.617 2.425 2.696
100 1HA GLY 16 1HA GLY 16 10.593 1.103 4.288
101 2HA GLY 16 2HA GLY 16 9.062 0.257 4.559
102 H MET 17 H MET 17 8.662 -0.221 1.697
103 HA MET 17 HA MET 17 9.834 -2.733 1.321
104 1HB MET 17 1HB MET 17 7.748 -1.190 0.278
105 2HB MET 17 2HB MET 17 8.864 -1.227 -1.074
106 1HG MET 17 1HG MET 17 9.067 -3.734 -0.567
107 2HG MET 17 2HG MET 17 7.636 -3.558 0.433
108 1HE MET 17 1HE MET 17 9.119 -3.562 -3.177
109 2HE MET 17 2HE MET 17 7.712 -3.178 -4.196
110 3HE MET 17 3HE MET 17 8.440 -1.914 -3.187
111 H ILE 18 H ILE 18 10.726 0.466 0.254
112 HA ILE 18 HA ILE 18 12.717 -0.234 -1.715
113 HB ILE 18 HB ILE 18 12.556 2.284 -0.002
114 1HG1 ILE 18 1HG1 ILE 18 11.396 3.176 -2.253
115 2HG1 ILE 18 2HG1 ILE 18 10.812 1.515 -2.333
116 1HG2 ILE 18 1HG2 ILE 18 13.682 3.363 -1.910
117 2HG2 ILE 18 2HG2 ILE 18 14.634 1.991 -1.342
118 3HG2 ILE 18 3HG2 ILE 18 13.655 1.831 -2.814
119 1HD1 ILE 18 1HD1 ILE 18 9.248 3.092 -1.213
120 2HD1 ILE 18 2HD1 ILE 18 9.771 1.844 -0.074
121 3HD1 ILE 18 3HD1 ILE 18 10.481 3.471 0.003
122 H ASP 19 H ASP 19 12.750 0.700 1.732
123 HA ASP 19 HA ASP 19 15.509 0.624 2.147
124 1HB ASP 19 1HB ASP 19 13.335 0.284 4.258
125 2HB ASP 19 2HB ASP 19 14.905 1.057 4.430
126 H GLY 20 H GLY 20 12.932 -1.718 2.979
127 1HA GLY 20 1HA GLY 20 12.937 -3.952 3.449
128 2HA GLY 20 2HA GLY 20 14.608 -4.070 2.863
Start of MODEL 7
1 1H GLY 1 1HN GLY 1 -10.248 -6.437 5.063
2 2H GLY 1 2HN GLY 1 -10.345 -7.936 4.410
3 3H GLY 1 3HN GLY 1 -11.537 -7.412 5.431
4 1HA GLY 1 1HA GLY 1 -12.237 -7.346 3.107
5 2HA GLY 1 2HA GLY 1 -12.234 -5.746 3.886
6 H LEU 2 H LEU 2 -11.972 -6.268 1.016
7 HA LEU 2 HA LEU 2 -9.425 -6.539 0.043
8 1HB LEU 2 1HB LEU 2 -10.284 -5.811 -2.057
9 2HB LEU 2 2HB LEU 2 -11.533 -6.706 -1.218
10 HG LEU 2 HG LEU 2 -12.200 -4.157 -0.434
11 1HD1 LEU 2 1HD1 LEU 2 -11.118 -3.845 -3.276
12 2HD1 LEU 2 2HD1 LEU 2 -12.039 -2.637 -2.359
13 3HD1 LEU 2 3HD1 LEU 2 -10.416 -3.093 -1.835
14 1HD2 LEU 2 1HD2 LEU 2 -13.041 -5.495 -3.042
15 2HD2 LEU 2 2HD2 LEU 2 -13.736 -5.797 -1.434
16 3HD2 LEU 2 3HD2 LEU 2 -13.929 -4.212 -2.193
17 H PHE 3 H PHE 3 -10.710 -3.592 1.441
18 HA PHE 3 HA PHE 3 -9.121 -1.582 0.351
19 1HB PHE 3 1HB PHE 3 -10.984 -1.640 2.166
20 2HB PHE 3 2HB PHE 3 -9.773 -2.005 3.307
21 HD1 PHE 3 1HD PHE 3 -10.635 0.578 0.701
22 HD2 PHE 3 2HD PHE 3 -8.505 -0.262 4.364
23 HE1 PHE 3 1HE PHE 3 -10.033 2.976 0.915
24 HE2 PHE 3 2HE PHE 3 -7.924 2.139 4.566
25 HZ PHE 3 HZ PHE 3 -8.663 3.753 2.834
26 H GLY 4 H GLY 4 -8.560 -3.746 2.959
27 1HA GLY 4 1HA GLY 4 -5.909 -2.953 3.771
28 2HA GLY 4 2HA GLY 4 -6.667 -4.501 4.158
29 H ALA 5 H ALA 5 -6.810 -4.681 0.896
30 HA ALA 5 HA ALA 5 -4.104 -5.894 0.630
31 1HB ALA 5 1HB ALA 5 -4.970 -6.898 -1.405
32 2HB ALA 5 2HB ALA 5 -6.080 -7.241 -0.063
33 3HB ALA 5 3HB ALA 5 -6.485 -5.991 -1.269
34 H ILE 6 H ILE 6 -5.879 -2.994 -0.206
35 HA ILE 6 HA ILE 6 -3.698 -2.158 -1.959
36 HB ILE 6 HB ILE 6 -5.487 -0.500 -2.864
37 1HG1 ILE 6 1HG1 ILE 6 -7.160 -2.934 -2.310
38 2HG1 ILE 6 2HG1 ILE 6 -7.179 -1.516 -1.260
39 1HG2 ILE 6 1HG2 ILE 6 -5.208 -3.400 -3.661
40 2HG2 ILE 6 2HG2 ILE 6 -5.808 -2.075 -4.706
41 3HG2 ILE 6 3HG2 ILE 6 -4.130 -2.058 -4.123
42 1HD1 ILE 6 1HD1 ILE 6 -9.066 -1.356 -2.795
43 2HD1 ILE 6 2HD1 ILE 6 -7.886 -0.094 -3.198
44 3HD1 ILE 6 3HD1 ILE 6 -8.003 -1.563 -4.197
45 H ALA 7 H ALA 7 -6.061 0.066 -0.914
46 HA ALA 7 HA ALA 7 -5.695 2.158 -0.318
47 1HB ALA 7 1HB ALA 7 -5.820 2.264 2.199
48 2HB ALA 7 2HB ALA 7 -6.879 1.031 1.493
49 3HB ALA 7 3HB ALA 7 -5.358 0.550 2.266
50 H GLY 8 H GLY 8 -3.258 0.851 1.954
51 1HA GLY 8 1HA GLY 8 -1.332 2.886 1.837
52 2HA GLY 8 2HA GLY 8 -1.013 1.185 2.158
53 H PHE 9 H PHE 9 -1.955 0.248 -0.510
54 HA PHE 9 HA PHE 9 0.403 0.510 -2.056
55 1HB PHE 9 1HB PHE 9 -1.450 -1.286 -2.085
56 2HB PHE 9 2HB PHE 9 -2.340 -0.185 -3.134
57 HD1 PHE 9 1HD PHE 9 -1.911 -0.226 -5.477
58 HD2 PHE 9 2HD PHE 9 1.013 -1.848 -2.759
59 HE1 PHE 9 1HE PHE 9 -0.559 -1.014 -7.401
60 HE2 PHE 9 2HE PHE 9 2.367 -2.631 -4.675
61 HZ PHE 9 HZ PHE 9 1.582 -2.229 -7.009
62 H ILE 10 H ILE 10 -2.262 2.695 -1.796
63 HA ILE 10 HA ILE 10 -1.489 4.150 -4.282
64 HB ILE 10 HB ILE 10 -4.161 3.887 -2.818
65 1HG1 ILE 10 1HG1 ILE 10 -4.511 3.131 -5.518
66 2HG1 ILE 10 2HG1 ILE 10 -2.947 2.439 -5.120
67 1HG2 ILE 10 1HG2 ILE 10 -3.931 6.143 -3.752
68 2HG2 ILE 10 2HG2 ILE 10 -3.456 5.463 -5.329
69 3HG2 ILE 10 3HG2 ILE 10 -5.102 5.207 -4.691
70 1HD1 ILE 10 1HD1 ILE 10 -5.575 2.024 -3.629
71 2HD1 ILE 10 2HD1 ILE 10 -4.709 0.843 -4.637
72 3HD1 ILE 10 3HD1 ILE 10 -4.014 1.378 -3.088
73 H GLU 11 H GLU 11 -2.487 4.384 -0.852
74 HA GLU 11 HA GLU 11 -2.020 7.182 -0.536
75 1HB GLU 11 1HB GLU 11 -2.099 4.819 1.357
76 2HB GLU 11 2HB GLU 11 -2.001 6.487 1.923
77 1HG GLU 11 1HG GLU 11 -4.169 7.015 1.284
78 2HG GLU 11 2HG GLU 11 -4.217 5.830 -0.010
79 H ASN 12 H ASN 12 0.232 4.461 -0.747
80 HA ASN 12 HA ASN 12 2.417 6.430 -0.605
81 1HB ASN 12 1HB ASN 12 2.512 5.298 1.594
82 2HB ASN 12 2HB ASN 12 2.478 3.714 0.809
83 1HD2 ASN 12 1HD2 ASN 12 4.595 6.075 1.964
84 2HD2 ASN 12 2HD2 ASN 12 5.975 5.820 0.913
85 H GLY 13 H GLY 13 1.679 2.956 -1.098
86 1HA GLY 13 1HA GLY 13 2.182 2.085 -3.471
87 2HA GLY 13 2HA GLY 13 3.746 2.884 -3.222
88 H ALA 14 H ALA 14 4.907 2.250 -1.078
89 HA ALA 14 HA ALA 14 4.403 -0.468 -0.147
90 1HB ALA 14 1HB ALA 14 6.262 -1.579 -1.278
91 2HB ALA 14 2HB ALA 14 5.174 -0.903 -2.484
92 3HB ALA 14 3HB ALA 14 6.704 -0.082 -2.118
93 H GLU 15 H GLU 15 5.374 2.373 0.898
94 HA GLU 15 HA GLU 15 7.943 2.440 1.628
95 1HB GLU 15 1HB GLU 15 7.340 3.645 3.695
96 2HB GLU 15 2HB GLU 15 6.659 4.244 2.204
97 1HG GLU 15 1HG GLU 15 4.450 3.218 2.781
98 2HG GLU 15 2HG GLU 15 5.138 2.569 4.264
99 H GLY 16 H GLY 16 9.412 1.482 2.706
100 1HA GLY 16 1HA GLY 16 10.244 0.181 4.557
101 2HA GLY 16 2HA GLY 16 8.791 -0.857 4.428
102 H MET 17 H MET 17 8.537 -1.170 1.666
103 HA MET 17 HA MET 17 10.476 -3.192 1.162
104 1HB MET 17 1HB MET 17 7.819 -2.510 0.418
105 2HB MET 17 2HB MET 17 8.744 -2.334 -1.062
106 1HG MET 17 1HG MET 17 9.755 -4.585 -0.456
107 2HG MET 17 2HG MET 17 8.515 -4.734 0.788
108 1HE MET 17 1HE MET 17 7.180 -7.330 -1.764
109 2HE MET 17 2HE MET 17 8.856 -7.023 -1.252
110 3HE MET 17 3HE MET 17 7.535 -6.979 -0.058
111 H ILE 18 H ILE 18 9.979 0.121 0.249
112 HA ILE 18 HA ILE 18 11.998 0.149 -1.922
113 HB ILE 18 HB ILE 18 10.864 2.489 -0.320
114 1HG1 ILE 18 1HG1 ILE 18 9.758 2.862 -2.772
115 2HG1 ILE 18 2HG1 ILE 18 9.779 1.096 -2.751
116 1HG2 ILE 18 1HG2 ILE 18 13.019 3.027 -1.397
117 2HG2 ILE 18 2HG2 ILE 18 12.401 2.440 -2.956
118 3HG2 ILE 18 3HG2 ILE 18 11.705 3.887 -2.188
119 1HD1 ILE 18 1HD1 ILE 18 8.537 1.201 -0.578
120 2HD1 ILE 18 2HD1 ILE 18 8.530 2.973 -0.680
121 3HD1 ILE 18 3HD1 ILE 18 7.659 2.018 -1.891
122 H ASP 19 H ASP 19 11.698 1.298 1.430
123 HA ASP 19 HA ASP 19 14.140 2.412 1.760
124 1HB ASP 19 1HB ASP 19 12.384 1.157 3.913
125 2HB ASP 19 2HB ASP 19 13.522 2.486 4.123
126 H GLY 20 H GLY 20 13.205 -0.943 2.547
127 1HA GLY 20 1HA GLY 20 14.433 -2.853 2.577
128 2HA GLY 20 2HA GLY 20 15.824 -1.935 1.996
Start of MODEL 8
1 1H GLY 1 1HN GLY 1 -10.097 -6.229 4.764
2 2H GLY 1 2HN GLY 1 -10.485 -7.535 3.855
3 3H GLY 1 3HN GLY 1 -11.466 -7.096 5.113
4 1HA GLY 1 1HA GLY 1 -12.408 -6.462 2.971
5 2HA GLY 1 2HA GLY 1 -12.074 -5.068 4.027
6 H LEU 2 H LEU 2 -12.240 -4.944 1.138
7 HA LEU 2 HA LEU 2 -9.933 -5.374 -0.273
8 1HB LEU 2 1HB LEU 2 -10.901 -4.077 -2.015
9 2HB LEU 2 2HB LEU 2 -12.185 -4.915 -1.171
10 HG LEU 2 HG LEU 2 -12.234 -2.535 0.197
11 1HD1 LEU 2 1HD1 LEU 2 -11.457 -1.777 -2.663
12 2HD1 LEU 2 2HD1 LEU 2 -12.023 -0.667 -1.399
13 3HD1 LEU 2 3HD1 LEU 2 -10.465 -1.478 -1.228
14 1HD2 LEU 2 1HD2 LEU 2 -14.172 -3.629 -0.858
15 2HD2 LEU 2 2HD2 LEU 2 -14.140 -1.902 -1.239
16 3HD2 LEU 2 3HD2 LEU 2 -13.626 -3.086 -2.460
17 H PHE 3 H PHE 3 -10.444 -2.659 1.887
18 HA PHE 3 HA PHE 3 -8.639 -0.740 0.969
19 1HB PHE 3 1HB PHE 3 -10.221 -0.882 3.022
20 2HB PHE 3 2HB PHE 3 -8.982 -1.711 3.847
21 HD1 PHE 3 1HD PHE 3 -7.275 -0.502 5.025
22 HD2 PHE 3 2HD PHE 3 -9.569 1.502 1.961
23 HE1 PHE 3 1HE PHE 3 -6.171 1.645 5.589
24 HE2 PHE 3 2HE PHE 3 -8.440 3.639 2.530
25 HZ PHE 3 HZ PHE 3 -6.731 3.707 4.327
26 H GLY 4 H GLY 4 -8.195 -3.494 2.962
27 1HA GLY 4 1HA GLY 4 -5.338 -3.408 3.403
28 2HA GLY 4 2HA GLY 4 -6.368 -4.821 3.652
29 H ALA 5 H ALA 5 -6.955 -4.153 0.465
30 HA ALA 5 HA ALA 5 -4.650 -5.775 -0.516
31 1HB ALA 5 1HB ALA 5 -7.278 -5.101 -1.896
32 2HB ALA 5 2HB ALA 5 -6.005 -6.180 -2.489
33 3HB ALA 5 3HB ALA 5 -6.925 -6.622 -1.036
34 H ILE 6 H ILE 6 -5.924 -2.515 -0.462
35 HA ILE 6 HA ILE 6 -3.848 -1.694 -2.340
36 HB ILE 6 HB ILE 6 -5.333 0.430 -2.582
37 1HG1 ILE 6 1HG1 ILE 6 -7.414 -1.724 -2.283
38 2HG1 ILE 6 2HG1 ILE 6 -7.007 -0.623 -0.967
39 1HG2 ILE 6 1HG2 ILE 6 -5.768 -2.208 -3.988
40 2HG2 ILE 6 2HG2 ILE 6 -6.188 -0.590 -4.631
41 3HG2 ILE 6 3HG2 ILE 6 -4.490 -1.015 -4.328
42 1HD1 ILE 6 1HD1 ILE 6 -8.130 0.208 -3.682
43 2HD1 ILE 6 2HD1 ILE 6 -8.987 0.230 -2.132
44 3HD1 ILE 6 3HD1 ILE 6 -7.622 1.331 -2.397
45 H ALA 7 H ALA 7 -5.541 0.618 -0.486
46 HA ALA 7 HA ALA 7 -4.627 2.413 0.447
47 1HB ALA 7 1HB ALA 7 -4.351 0.219 2.571
48 2HB ALA 7 2HB ALA 7 -4.422 1.963 2.915
49 3HB ALA 7 3HB ALA 7 -5.811 1.144 2.174
50 H GLY 8 H GLY 8 -2.296 0.171 2.002
51 1HA GLY 8 1HA GLY 8 -0.043 1.884 1.911
52 2HA GLY 8 2HA GLY 8 -0.052 0.133 2.063
53 H PHE 9 H PHE 9 -1.464 -0.104 -0.691
54 HA PHE 9 HA PHE 9 0.796 -0.074 -2.446
55 1HB PHE 9 1HB PHE 9 -1.415 -1.408 -2.561
56 2HB PHE 9 2HB PHE 9 -2.144 0.054 -3.206
57 HD1 PHE 9 1HD PHE 9 0.676 -2.369 -3.789
58 HD2 PHE 9 2HD PHE 9 -2.051 0.473 -5.552
59 HE1 PHE 9 1HE PHE 9 1.446 -3.027 -6.052
60 HE2 PHE 9 2HE PHE 9 -1.287 -0.200 -7.811
61 HZ PHE 9 HZ PHE 9 0.461 -1.952 -8.067
62 H ILE 10 H ILE 10 -1.225 2.499 -1.381
63 HA ILE 10 HA ILE 10 -0.384 4.295 -3.608
64 HB ILE 10 HB ILE 10 -2.919 4.208 -1.890
65 1HG1 ILE 10 1HG1 ILE 10 -3.640 4.226 -4.619
66 2HG1 ILE 10 2HG1 ILE 10 -2.233 3.177 -4.602
67 1HG2 ILE 10 1HG2 ILE 10 -3.703 6.098 -3.262
68 2HG2 ILE 10 2HG2 ILE 10 -2.285 6.535 -2.303
69 3HG2 ILE 10 3HG2 ILE 10 -2.102 6.197 -4.045
70 1HD1 ILE 10 1HD1 ILE 10 -4.219 1.843 -4.260
71 2HD1 ILE 10 2HD1 ILE 10 -3.346 1.883 -2.710
72 3HD1 ILE 10 3HD1 ILE 10 -4.777 2.903 -2.947
73 H GLU 11 H GLU 11 -1.166 4.041 -0.117
74 HA GLU 11 HA GLU 11 0.022 6.519 0.673
75 1HB GLU 11 1HB GLU 11 -0.786 3.978 2.134
76 2HB GLU 11 2HB GLU 11 -0.262 5.444 2.968
77 1HG GLU 11 1HG GLU 11 -2.169 6.654 2.387
78 2HG GLU 11 2HG GLU 11 -2.508 5.689 0.959
79 H ASN 12 H ASN 12 1.518 3.662 -0.380
80 HA ASN 12 HA ASN 12 4.117 4.817 0.338
81 1HB ASN 12 1HB ASN 12 3.129 2.333 1.589
82 2HB ASN 12 2HB ASN 12 4.579 2.046 0.648
83 1HD2 ASN 12 1HD2 ASN 12 3.621 4.944 2.625
84 2HD2 ASN 12 2HD2 ASN 12 5.026 4.800 3.691
85 H GLY 13 H GLY 13 2.441 2.094 -1.232
86 1HA GLY 13 1HA GLY 13 2.755 1.676 -3.691
87 2HA GLY 13 2HA GLY 13 4.433 2.139 -3.467
88 H ALA 14 H ALA 14 2.777 0.293 -0.970
89 HA ALA 14 HA ALA 14 2.853 -1.882 -0.298
90 1HB ALA 14 1HB ALA 14 4.361 -3.572 -1.053
91 2HB ALA 14 2HB ALA 14 3.622 -2.827 -2.479
92 3HB ALA 14 3HB ALA 14 5.298 -2.426 -2.022
93 H GLU 15 H GLU 15 3.287 -1.433 1.718
94 HA GLU 15 HA GLU 15 5.164 0.527 2.360
95 1HB GLU 15 1HB GLU 15 3.991 -1.303 4.499
96 2HB GLU 15 2HB GLU 15 4.370 0.406 4.599
97 1HG GLU 15 1HG GLU 15 2.065 0.417 4.600
98 2HG GLU 15 2HG GLU 15 2.403 0.723 2.902
99 H GLY 16 H GLY 16 7.076 0.647 3.190
100 1HA GLY 16 1HA GLY 16 9.033 0.148 4.324
101 2HA GLY 16 2HA GLY 16 8.403 -1.467 4.703
102 H MET 17 H MET 17 7.704 -1.975 1.901
103 HA MET 17 HA MET 17 9.971 -3.156 0.758
104 1HB MET 17 1HB MET 17 7.121 -3.092 0.517
105 2HB MET 17 2HB MET 17 7.728 -2.514 -1.027
106 1HG MET 17 1HG MET 17 9.207 -4.464 -1.127
107 2HG MET 17 2HG MET 17 8.612 -5.047 0.421
108 1HE MET 17 1HE MET 17 5.028 -6.284 -0.251
109 2HE MET 17 2HE MET 17 6.426 -6.329 0.846
110 3HE MET 17 3HE MET 17 5.594 -4.792 0.528
111 H ILE 18 H ILE 18 8.417 0.029 0.431
112 HA ILE 18 HA ILE 18 9.773 1.155 -1.748
113 HB ILE 18 HB ILE 18 9.181 2.450 0.949
114 1HG1 ILE 18 1HG1 ILE 18 7.133 1.476 0.482
115 2HG1 ILE 18 2HG1 ILE 18 6.963 3.122 -0.097
116 1HG2 ILE 18 1HG2 ILE 18 10.452 3.941 -0.507
117 2HG2 ILE 18 2HG2 ILE 18 9.320 3.662 -1.847
118 3HG2 ILE 18 3HG2 ILE 18 8.793 4.524 -0.383
119 1HD1 ILE 18 1HD1 ILE 18 7.477 0.644 -1.811
120 2HD1 ILE 18 2HD1 ILE 18 6.007 1.585 -1.683
121 3HD1 ILE 18 3HD1 ILE 18 7.456 2.313 -2.429
122 H ASP 19 H ASP 19 10.806 0.490 1.426
123 HA ASP 19 HA ASP 19 12.694 0.714 2.672
124 1HB ASP 19 1HB ASP 19 13.382 -0.789 0.652
125 2HB ASP 19 2HB ASP 19 14.396 0.570 0.180
126 H GLY 20 H GLY 20 15.229 2.009 1.663
127 1HA GLY 20 1HA GLY 20 15.919 4.374 1.346
128 2HA GLY 20 2HA GLY 20 14.434 4.851 2.180
Start of MODEL 9
1 1H GLY 1 1HN GLY 1 -11.751 -6.276 4.826
2 2H GLY 1 2HN GLY 1 -11.949 -7.660 3.972
3 3H GLY 1 3HN GLY 1 -13.141 -7.159 5.004
4 1HA GLY 1 1HA GLY 1 -13.716 -6.720 2.694
5 2HA GLY 1 2HA GLY 1 -13.588 -5.238 3.670
6 H LEU 2 H LEU 2 -13.281 -5.330 0.807
7 HA LEU 2 HA LEU 2 -10.825 -5.802 -0.231
8 1HB LEU 2 1HB LEU 2 -11.434 -4.463 -2.092
9 2HB LEU 2 2HB LEU 2 -12.837 -5.364 -1.561
10 HG LEU 2 HG LEU 2 -12.431 -2.467 -0.681
11 1HD1 LEU 2 1HD1 LEU 2 -13.732 -1.750 -2.657
12 2HD1 LEU 2 2HD1 LEU 2 -12.205 -2.497 -3.138
13 3HD1 LEU 2 3HD1 LEU 2 -13.719 -3.414 -3.280
14 1HD2 LEU 2 1HD2 LEU 2 -14.913 -4.196 -1.084
15 2HD2 LEU 2 2HD2 LEU 2 -14.268 -3.590 0.464
16 3HD2 LEU 2 3HD2 LEU 2 -14.935 -2.465 -0.705
17 H PHE 3 H PHE 3 -11.596 -2.884 1.611
18 HA PHE 3 HA PHE 3 -9.592 -1.115 0.887
19 1HB PHE 3 1HB PHE 3 -11.503 -1.093 2.652
20 2HB PHE 3 2HB PHE 3 -10.430 -1.853 3.729
21 HD1 PHE 3 1HD PHE 3 -8.560 -0.627 4.792
22 HD2 PHE 3 2HD PHE 3 -11.039 1.280 1.813
23 HE1 PHE 3 1HE PHE 3 -7.592 1.576 5.386
24 HE2 PHE 3 2HE PHE 3 -10.060 3.477 2.417
25 HZ PHE 3 HZ PHE 3 -8.334 3.626 4.202
26 H GLY 4 H GLY 4 -9.559 -3.724 3.127
27 1HA GLY 4 1HA GLY 4 -6.805 -3.631 4.015
28 2HA GLY 4 2HA GLY 4 -7.889 -5.014 4.195
29 H ALA 5 H ALA 5 -8.000 -4.657 0.924
30 HA ALA 5 HA ALA 5 -5.643 -6.405 0.445
31 1HB ALA 5 1HB ALA 5 -6.683 -6.888 -1.687
32 2HB ALA 5 2HB ALA 5 -7.879 -7.137 -0.397
33 3HB ALA 5 3HB ALA 5 -7.941 -5.674 -1.415
34 H ILE 6 H ILE 6 -6.676 -3.092 0.122
35 HA ILE 6 HA ILE 6 -4.356 -2.528 -1.570
36 HB ILE 6 HB ILE 6 -5.663 -0.344 -2.100
37 1HG1 ILE 6 1HG1 ILE 6 -7.904 -2.336 -1.862
38 2HG1 ILE 6 2HG1 ILE 6 -7.549 -1.157 -0.600
39 1HG2 ILE 6 1HG2 ILE 6 -4.762 -1.960 -3.663
40 2HG2 ILE 6 2HG2 ILE 6 -6.149 -3.039 -3.377
41 3HG2 ILE 6 3HG2 ILE 6 -6.387 -1.445 -4.158
42 1HD1 ILE 6 1HD1 ILE 6 -8.356 -0.473 -3.459
43 2HD1 ILE 6 2HD1 ILE 6 -9.366 -0.320 -2.011
44 3HD1 ILE 6 3HD1 ILE 6 -7.930 0.707 -2.196
45 H ALA 7 H ALA 7 -6.076 -0.011 -0.038
46 HA ALA 7 HA ALA 7 -5.185 1.795 0.860
47 1HB ALA 7 1HB ALA 7 -5.188 -0.206 3.171
48 2HB ALA 7 2HB ALA 7 -5.309 1.561 3.331
49 3HB ALA 7 3HB ALA 7 -6.594 0.655 2.518
50 H GLY 8 H GLY 8 -3.098 -0.458 2.714
51 1HA GLY 8 1HA GLY 8 -0.742 1.067 2.821
52 2HA GLY 8 2HA GLY 8 -0.832 -0.694 2.838
53 H PHE 9 H PHE 9 -2.000 -0.982 0.148
54 HA PHE 9 HA PHE 9 0.255 -1.035 -1.542
55 1HB PHE 9 1HB PHE 9 -1.994 -2.223 -1.766
56 2HB PHE 9 2HB PHE 9 -2.655 -0.701 -2.357
57 HD1 PHE 9 1HD PHE 9 0.307 -2.966 -3.044
58 HD2 PHE 9 2HD PHE 9 -2.793 -0.449 -4.690
59 HE1 PHE 9 1HE PHE 9 1.066 -3.520 -5.323
60 HE2 PHE 9 2HE PHE 9 -2.041 -1.031 -6.976
61 HZ PHE 9 HZ PHE 9 -0.111 -2.568 -7.302
62 H ILE 10 H ILE 10 -1.739 1.690 -0.685
63 HA ILE 10 HA ILE 10 -0.641 3.338 -2.896
64 HB ILE 10 HB ILE 10 -3.211 3.582 -1.255
65 1HG1 ILE 10 1HG1 ILE 10 -3.905 3.495 -3.977
66 2HG1 ILE 10 2HG1 ILE 10 -2.595 2.329 -3.893
67 1HG2 ILE 10 1HG2 ILE 10 -2.161 5.310 -3.531
68 2HG2 ILE 10 2HG2 ILE 10 -3.760 5.455 -2.753
69 3HG2 ILE 10 3HG2 ILE 10 -2.296 5.793 -1.819
70 1HD1 ILE 10 1HD1 ILE 10 -4.717 1.222 -3.518
71 2HD1 ILE 10 2HD1 ILE 10 -3.827 1.213 -1.976
72 3HD1 ILE 10 3HD1 ILE 10 -5.152 2.365 -2.230
73 H GLU 11 H GLU 11 -1.514 3.301 0.614
74 HA GLU 11 HA GLU 11 -0.207 5.724 1.297
75 1HB GLU 11 1HB GLU 11 -0.776 3.227 2.935
76 2HB GLU 11 2HB GLU 11 -0.282 4.776 3.618
77 1HG GLU 11 1HG GLU 11 -2.300 5.865 2.836
78 2HG GLU 11 2HG GLU 11 -2.810 4.434 1.941
79 H ASN 12 H ASN 12 1.187 2.614 0.538
80 HA ASN 12 HA ASN 12 3.903 3.745 1.018
81 1HB ASN 12 1HB ASN 12 2.804 1.062 1.898
82 2HB ASN 12 2HB ASN 12 4.461 1.156 1.351
83 1HD2 ASN 12 1HD2 ASN 12 3.201 4.033 3.101
84 2HD2 ASN 12 2HD2 ASN 12 4.147 3.633 4.536
85 H GLY 13 H GLY 13 2.023 3.713 -1.313
86 1HA GLY 13 1HA GLY 13 2.585 1.628 -3.124
87 2HA GLY 13 2HA GLY 13 1.794 3.160 -3.472
88 H ALA 14 H ALA 14 5.108 2.859 -2.335
89 HA ALA 14 HA ALA 14 6.267 2.882 -4.995
90 1HB ALA 14 1HB ALA 14 7.002 5.077 -3.008
91 2HB ALA 14 2HB ALA 14 7.824 4.719 -4.551
92 3HB ALA 14 3HB ALA 14 6.151 5.309 -4.555
93 H GLU 15 H GLU 15 6.167 0.729 -3.850
94 HA GLU 15 HA GLU 15 7.396 0.238 -1.405
95 1HB GLU 15 1HB GLU 15 6.870 -1.624 -3.761
96 2HB GLU 15 2HB GLU 15 7.337 -2.163 -2.140
97 1HG GLU 15 1HG GLU 15 5.316 -1.068 -1.188
98 2HG GLU 15 2HG GLU 15 4.815 -0.582 -2.813
99 H GLY 16 H GLY 16 9.339 -0.598 -0.765
100 1HA GLY 16 1HA GLY 16 11.491 -1.587 -1.066
101 2HA GLY 16 2HA GLY 16 11.589 -0.876 -2.687
102 H MET 17 H MET 17 10.627 1.765 -2.045
103 HA MET 17 HA MET 17 12.956 3.074 -1.242
104 1HB MET 17 1HB MET 17 10.551 3.715 -2.471
105 2HB MET 17 2HB MET 17 10.339 4.481 -0.898
106 1HG MET 17 1HG MET 17 12.775 5.290 -1.283
107 2HG MET 17 2HG MET 17 12.495 4.919 -2.977
108 1HE MET 17 1HE MET 17 10.541 6.057 -4.426
109 2HE MET 17 2HE MET 17 9.321 5.761 -3.163
110 3HE MET 17 3HE MET 17 9.517 7.392 -3.840
111 H ILE 18 H ILE 18 10.159 2.037 0.467
112 HA ILE 18 HA ILE 18 10.338 3.245 3.000
113 HB ILE 18 HB ILE 18 9.384 0.515 2.058
114 1HG1 ILE 18 1HG1 ILE 18 7.118 1.419 2.501
115 2HG1 ILE 18 2HG1 ILE 18 7.800 2.976 2.961
116 1HG2 ILE 18 1HG2 ILE 18 9.885 0.203 4.408
117 2HG2 ILE 18 2HG2 ILE 18 9.029 1.700 4.840
118 3HG2 ILE 18 3HG2 ILE 18 8.136 0.297 4.211
119 1HD1 ILE 18 1HD1 ILE 18 6.758 2.844 0.669
120 2HD1 ILE 18 2HD1 ILE 18 8.424 3.426 0.658
121 3HD1 ILE 18 3HD1 ILE 18 8.063 1.743 0.186
122 H ASP 19 H ASP 19 12.369 0.701 1.604
123 HA ASP 19 HA ASP 19 13.997 -0.621 2.341
124 1HB ASP 19 1HB ASP 19 15.164 1.474 2.234
125 2HB ASP 19 2HB ASP 19 14.687 1.893 3.881
126 H GLY 20 H GLY 20 14.029 0.826 5.546
127 1HA GLY 20 1HA GLY 20 13.876 -1.740 6.844
128 2HA GLY 20 2HA GLY 20 13.970 -0.152 7.617
Start of MODEL 10
1 1H GLY 1 1HN GLY 1 -8.048 -7.718 4.663
2 2H GLY 1 2HN GLY 1 -8.307 -8.992 3.665
3 3H GLY 1 3HN GLY 1 -9.093 -8.920 5.119
4 1HA GLY 1 1HA GLY 1 -10.552 -8.343 3.267
5 2HA GLY 1 2HA GLY 1 -10.344 -7.019 4.439
6 H LEU 2 H LEU 2 -11.062 -6.741 1.606
7 HA LEU 2 HA LEU 2 -9.023 -6.400 -0.163
8 1HB LEU 2 1HB LEU 2 -10.499 -5.175 -1.523
9 2HB LEU 2 2HB LEU 2 -11.417 -6.441 -0.735
10 HG LEU 2 HG LEU 2 -11.420 -3.527 0.204
11 1HD1 LEU 2 1HD1 LEU 2 -13.373 -4.943 -1.663
12 2HD1 LEU 2 2HD1 LEU 2 -13.555 -3.298 -1.013
13 3HD1 LEU 2 3HD1 LEU 2 -12.226 -3.664 -2.119
14 1HD2 LEU 2 1HD2 LEU 2 -13.299 -5.853 0.807
15 2HD2 LEU 2 2HD2 LEU 2 -12.257 -4.980 1.966
16 3HD2 LEU 2 3HD2 LEU 2 -13.617 -4.160 1.222
17 H PHE 3 H PHE 3 -10.036 -3.936 2.210
18 HA PHE 3 HA PHE 3 -8.795 -1.658 1.275
19 1HB PHE 3 1HB PHE 3 -10.200 -2.217 3.381
20 2HB PHE 3 2HB PHE 3 -8.758 -2.703 4.145
21 HD1 PHE 3 1HD PHE 3 -10.436 0.240 2.552
22 HD2 PHE 3 2HD PHE 3 -7.194 -1.082 5.082
23 HE1 PHE 3 1HE PHE 3 -9.940 2.593 3.162
24 HE2 PHE 3 2HE PHE 3 -6.715 1.273 5.686
25 HZ PHE 3 HZ PHE 3 -8.077 3.111 4.725
26 H GLY 4 H GLY 4 -7.546 -4.182 3.236
27 1HA GLY 4 1HA GLY 4 -4.814 -3.324 3.573
28 2HA GLY 4 2HA GLY 4 -5.405 -4.968 3.835
29 H ALA 5 H ALA 5 -6.294 -4.640 0.707
30 HA ALA 5 HA ALA 5 -3.679 -5.566 -0.363
31 1HB ALA 5 1HB ALA 5 -4.953 -6.254 -2.315
32 2HB ALA 5 2HB ALA 5 -5.711 -6.915 -0.851
33 3HB ALA 5 3HB ALA 5 -6.427 -5.507 -1.678
34 H ILE 6 H ILE 6 -5.699 -2.705 -0.235
35 HA ILE 6 HA ILE 6 -4.015 -1.418 -2.245
36 HB ILE 6 HB ILE 6 -6.041 0.213 -2.415
37 1HG1 ILE 6 1HG1 ILE 6 -7.428 -2.411 -1.972
38 2HG1 ILE 6 2HG1 ILE 6 -7.260 -1.211 -0.687
39 1HG2 ILE 6 1HG2 ILE 6 -5.804 -2.480 -3.770
40 2HG2 ILE 6 2HG2 ILE 6 -6.695 -1.063 -4.403
41 3HG2 ILE 6 3HG2 ILE 6 -4.932 -0.990 -4.204
42 1HD1 ILE 6 1HD1 ILE 6 -8.486 0.459 -2.065
43 2HD1 ILE 6 2HD1 ILE 6 -8.737 -0.783 -3.317
44 3HD1 ILE 6 3HD1 ILE 6 -9.463 -0.981 -1.712
45 H ALA 7 H ALA 7 -6.138 0.425 -0.319
46 HA ALA 7 HA ALA 7 -5.664 2.464 0.468
47 1HB ALA 7 1HB ALA 7 -6.433 1.011 2.289
48 2HB ALA 7 2HB ALA 7 -4.765 0.563 2.685
49 3HB ALA 7 3HB ALA 7 -5.318 2.237 2.920
50 H GLY 8 H GLY 8 -2.802 0.926 1.958
51 1HA GLY 8 1HA GLY 8 -0.966 3.025 1.800
52 2HA GLY 8 2HA GLY 8 -0.565 1.312 1.757
53 H PHE 9 H PHE 9 -2.016 0.784 -0.808
54 HA PHE 9 HA PHE 9 -0.012 1.370 -2.714
55 1HB PHE 9 1HB PHE 9 -1.809 -0.445 -2.717
56 2HB PHE 9 2HB PHE 9 -2.943 0.795 -3.249
57 HD1 PHE 9 1HD PHE 9 -3.107 1.330 -5.566
58 HD2 PHE 9 2HD PHE 9 0.369 -0.761 -4.106
59 HE1 PHE 9 1HE PHE 9 -2.304 1.040 -7.893
60 HE2 PHE 9 2HE PHE 9 1.176 -1.048 -6.429
61 HZ PHE 9 HZ PHE 9 -0.165 -0.156 -8.337
62 H ILE 10 H ILE 10 -2.753 3.284 -1.655
63 HA ILE 10 HA ILE 10 -2.504 5.147 -3.962
64 HB ILE 10 HB ILE 10 -4.729 4.714 -1.905
65 1HG1 ILE 10 1HG1 ILE 10 -5.810 4.286 -4.448
66 2HG1 ILE 10 2HG1 ILE 10 -4.199 3.605 -4.636
67 1HG2 ILE 10 1HG2 ILE 10 -4.597 6.576 -4.311
68 2HG2 ILE 10 2HG2 ILE 10 -6.044 6.263 -3.314
69 3HG2 ILE 10 3HG2 ILE 10 -4.637 7.064 -2.599
70 1HD1 ILE 10 1HD1 ILE 10 -4.628 2.207 -2.577
71 2HD1 ILE 10 2HD1 ILE 10 -6.263 2.893 -2.504
72 3HD1 ILE 10 3HD1 ILE 10 -5.776 1.909 -3.903
73 H GLU 11 H GLU 11 -2.476 4.872 -0.396
74 HA GLU 11 HA GLU 11 -1.903 7.635 0.111
75 1HB GLU 11 1HB GLU 11 -1.299 5.122 1.712
76 2HB GLU 11 2HB GLU 11 -1.135 6.765 2.336
77 1HG GLU 11 1HG GLU 11 -3.508 7.188 2.107
78 2HG GLU 11 2HG GLU 11 -3.773 5.669 1.258
79 H ASN 12 H ASN 12 0.160 5.012 -1.052
80 HA ASN 12 HA ASN 12 2.341 6.949 -1.398
81 1HB ASN 12 1HB ASN 12 2.953 5.892 0.743
82 2HB ASN 12 2HB ASN 12 2.710 4.284 0.053
83 1HD2 ASN 12 1HD2 ASN 12 5.044 6.752 0.509
84 2HD2 ASN 12 2HD2 ASN 12 6.179 6.303 -0.758
85 H GLY 13 H GLY 13 1.483 3.473 -1.647
86 1HA GLY 13 1HA GLY 13 1.490 2.570 -4.067
87 2HA GLY 13 2HA GLY 13 3.094 3.318 -4.131
88 H ALA 14 H ALA 14 4.554 2.714 -2.145
89 HA ALA 14 HA ALA 14 4.264 -0.123 -1.362
90 1HB ALA 14 1HB ALA 14 4.973 -0.214 -3.735
91 2HB ALA 14 2HB ALA 14 6.407 0.768 -3.339
92 3HB ALA 14 3HB ALA 14 6.216 -0.862 -2.655
93 H GLU 15 H GLU 15 5.404 2.898 -0.362
94 HA GLU 15 HA GLU 15 7.987 2.348 0.443
95 1HB GLU 15 1HB GLU 15 7.900 4.134 1.980
96 2HB GLU 15 2HB GLU 15 6.991 4.575 0.551
97 1HG GLU 15 1HG GLU 15 4.857 4.124 1.799
98 2HG GLU 15 2HG GLU 15 5.796 3.658 3.216
99 H GLY 16 H GLY 16 9.045 1.494 2.094
100 1HA GLY 16 1HA GLY 16 9.376 0.667 4.294
101 2HA GLY 16 2HA GLY 16 7.660 0.214 4.382
102 H MET 17 H MET 17 7.401 -0.978 1.791
103 HA MET 17 HA MET 17 8.155 -3.612 2.285
104 1HB MET 17 1HB MET 17 6.406 -2.226 0.621
105 2HB MET 17 2HB MET 17 7.612 -2.794 -0.534
106 1HG MET 17 1HG MET 17 7.428 -5.021 0.645
107 2HG MET 17 2HG MET 17 5.982 -4.423 1.449
108 1HE MET 17 1HE MET 17 4.591 -6.508 0.554
109 2HE MET 17 2HE MET 17 4.536 -6.993 -1.157
110 3HE MET 17 3HE MET 17 6.060 -7.116 -0.249
111 H ILE 18 H ILE 18 9.613 -1.072 0.493
112 HA ILE 18 HA ILE 18 11.688 -2.335 -0.977
113 HB ILE 18 HB ILE 18 11.507 0.355 0.428
114 1HG1 ILE 18 1HG1 ILE 18 11.481 1.223 -1.963
115 2HG1 ILE 18 2HG1 ILE 18 11.383 -0.440 -2.532
116 1HG2 ILE 18 1HG2 ILE 18 13.760 -0.550 -1.412
117 2HG2 ILE 18 2HG2 ILE 18 13.468 1.132 -0.912
118 3HG2 ILE 18 3HG2 ILE 18 13.904 -0.069 0.291
119 1HD1 ILE 18 1HD1 ILE 18 9.148 -0.663 -1.599
120 2HD1 ILE 18 2HD1 ILE 18 9.322 0.881 -0.718
121 3HD1 ILE 18 3HD1 ILE 18 9.221 0.858 -2.488
122 H ASP 19 H ASP 19 11.400 -1.853 2.501
123 HA ASP 19 HA ASP 19 12.762 -1.925 4.242
124 1HB ASP 19 1HB ASP 19 12.536 -4.309 3.847
125 2HB ASP 19 2HB ASP 19 14.015 -4.305 2.869
126 H GLY 20 H GLY 20 13.468 0.134 3.458
127 1HA GLY 20 1HA GLY 20 16.168 0.491 2.406
128 2HA GLY 20 2HA GLY 20 15.098 1.743 3.065
Start of MODEL 11
1 1H GLY 1 1HN GLY 1 -12.744 -5.210 4.367
2 2H GLY 1 2HN GLY 1 -12.991 -6.698 3.727
3 3H GLY 1 3HN GLY 1 -14.227 -5.932 4.520
4 1HA GLY 1 1HA GLY 1 -14.509 -5.845 2.111
5 2HA GLY 1 2HA GLY 1 -14.345 -4.239 2.856
6 H LEU 2 H LEU 2 -13.726 -4.890 0.087
7 HA LEU 2 HA LEU 2 -11.169 -5.673 -0.478
8 1HB LEU 2 1HB LEU 2 -11.534 -4.854 -2.681
9 2HB LEU 2 2HB LEU 2 -13.062 -5.433 -2.049
10 HG LEU 2 HG LEU 2 -13.280 -2.784 -1.369
11 1HD1 LEU 2 1HD1 LEU 2 -12.493 -1.381 -3.233
12 2HD1 LEU 2 2HD1 LEU 2 -11.111 -2.142 -2.444
13 3HD1 LEU 2 3HD1 LEU 2 -11.698 -2.778 -3.987
14 1HD2 LEU 2 1HD2 LEU 2 -13.939 -3.971 -4.102
15 2HD2 LEU 2 2HD2 LEU 2 -14.942 -4.084 -2.640
16 3HD2 LEU 2 3HD2 LEU 2 -14.663 -2.511 -3.397
17 H PHE 3 H PHE 3 -12.026 -2.508 0.735
18 HA PHE 3 HA PHE 3 -9.951 -0.857 -0.105
19 1HB PHE 3 1HB PHE 3 -12.028 -0.552 1.442
20 2HB PHE 3 2HB PHE 3 -11.062 -1.103 2.732
21 HD1 PHE 3 1HD PHE 3 -9.500 0.364 3.874
22 HD2 PHE 3 2HD PHE 3 -11.270 1.585 0.127
23 HE1 PHE 3 1HE PHE 3 -8.587 2.647 4.178
24 HE2 PHE 3 2HE PHE 3 -10.343 3.864 0.442
25 HZ PHE 3 HZ PHE 3 -9.000 4.395 2.467
26 H GLY 4 H GLY 4 -10.167 -3.060 2.524
27 1HA GLY 4 1HA GLY 4 -7.554 -2.770 3.706
28 2HA GLY 4 2HA GLY 4 -8.631 -4.148 3.954
29 H ALA 5 H ALA 5 -8.359 -4.326 0.702
30 HA ALA 5 HA ALA 5 -5.923 -6.031 0.783
31 1HB ALA 5 1HB ALA 5 -6.672 -6.857 -1.369
32 2HB ALA 5 2HB ALA 5 -8.015 -6.959 -0.211
33 3HB ALA 5 3HB ALA 5 -7.977 -5.663 -1.436
34 H ILE 6 H ILE 6 -6.964 -2.834 -0.208
35 HA ILE 6 HA ILE 6 -4.459 -2.487 -1.675
36 HB ILE 6 HB ILE 6 -5.717 -0.510 -2.782
37 1HG1 ILE 6 1HG1 ILE 6 -7.941 -2.519 -2.443
38 2HG1 ILE 6 2HG1 ILE 6 -7.780 -1.103 -1.404
39 1HG2 ILE 6 1HG2 ILE 6 -6.151 -2.027 -4.657
40 2HG2 ILE 6 2HG2 ILE 6 -4.592 -2.349 -3.874
41 3HG2 ILE 6 3HG2 ILE 6 -5.976 -3.421 -3.550
42 1HD1 ILE 6 1HD1 ILE 6 -8.228 -1.044 -4.419
43 2HD1 ILE 6 2HD1 ILE 6 -9.392 -0.591 -3.162
44 3HD1 ILE 6 3HD1 ILE 6 -7.935 0.389 -3.406
45 H ALA 7 H ALA 7 -6.406 0.198 -0.896
46 HA ALA 7 HA ALA 7 -5.623 2.192 -0.285
47 1HB ALA 7 1HB ALA 7 -6.111 2.460 2.141
48 2HB ALA 7 2HB ALA 7 -7.289 1.413 1.332
49 3HB ALA 7 3HB ALA 7 -6.024 0.697 2.349
50 H GLY 8 H GLY 8 -3.908 0.416 2.299
51 1HA GLY 8 1HA GLY 8 -1.558 1.905 2.518
52 2HA GLY 8 2HA GLY 8 -1.702 0.180 2.809
53 H PHE 9 H PHE 9 -2.443 -0.511 0.031
54 HA PHE 9 HA PHE 9 0.033 -0.880 -1.251
55 1HB PHE 9 1HB PHE 9 -2.154 -2.069 -1.673
56 2HB PHE 9 2HB PHE 9 -2.695 -0.647 -2.565
57 HD1 PHE 9 1HD PHE 9 -0.005 -3.263 -2.439
58 HD2 PHE 9 2HD PHE 9 -2.071 -0.350 -4.861
59 HE1 PHE 9 1HE PHE 9 1.184 -4.089 -4.448
60 HE2 PHE 9 2HE PHE 9 -0.884 -1.184 -6.869
61 HZ PHE 9 HZ PHE 9 0.746 -3.055 -6.671
62 H ILE 10 H ILE 10 -2.301 1.791 -1.523
63 HA ILE 10 HA ILE 10 -0.815 3.048 -3.742
64 HB ILE 10 HB ILE 10 -3.424 3.804 -2.315
65 1HG1 ILE 10 1HG1 ILE 10 -4.103 3.251 -4.941
66 2HG1 ILE 10 2HG1 ILE 10 -2.825 2.072 -4.694
67 1HG2 ILE 10 1HG2 ILE 10 -2.310 5.783 -3.251
68 2HG2 ILE 10 2HG2 ILE 10 -2.127 4.957 -4.817
69 3HG2 ILE 10 3HG2 ILE 10 -3.746 5.376 -4.194
70 1HD1 ILE 10 1HD1 ILE 10 -4.073 1.226 -2.682
71 2HD1 ILE 10 2HD1 ILE 10 -5.332 2.440 -2.985
72 3HD1 ILE 10 3HD1 ILE 10 -5.038 1.156 -4.175
73 H GLU 11 H GLU 11 -1.657 3.514 -0.297
74 HA GLU 11 HA GLU 11 -0.358 6.040 0.005
75 1HB GLU 11 1HB GLU 11 -0.915 3.819 1.995
76 2HB GLU 11 2HB GLU 11 -0.401 5.441 2.447
77 1HG GLU 11 1HG GLU 11 -2.427 6.440 1.694
78 2HG GLU 11 2HG GLU 11 -2.914 5.016 0.782
79 H ASN 12 H ASN 12 0.961 2.801 -0.215
80 HA ASN 12 HA ASN 12 3.596 3.921 -0.518
81 1HB ASN 12 1HB ASN 12 2.947 3.110 2.162
82 2HB ASN 12 2HB ASN 12 3.998 1.865 1.513
83 1HD2 ASN 12 1HD2 ASN 12 3.699 5.439 1.461
84 2HD2 ASN 12 2HD2 ASN 12 5.428 5.735 1.761
85 H GLY 13 H GLY 13 1.928 0.848 0.227
86 1HA GLY 13 1HA GLY 13 2.022 -1.240 -0.619
87 2HA GLY 13 2HA GLY 13 2.435 -0.494 -2.163
88 H ALA 14 H ALA 14 5.056 0.463 -0.806
89 HA ALA 14 HA ALA 14 6.580 -2.097 -0.928
90 1HB ALA 14 1HB ALA 14 7.138 0.509 -2.405
91 2HB ALA 14 2HB ALA 14 8.065 -1.005 -2.521
92 3HB ALA 14 3HB ALA 14 6.402 -0.941 -3.126
93 H GLU 15 H GLU 15 5.933 -0.658 1.519
94 HA GLU 15 HA GLU 15 7.940 1.096 2.412
95 1HB GLU 15 1HB GLU 15 6.678 -1.100 4.060
96 2HB GLU 15 2HB GLU 15 7.401 0.417 4.631
97 1HG GLU 15 1HG GLU 15 5.565 1.709 3.718
98 2HG GLU 15 2HG GLU 15 4.892 0.287 2.905
99 H GLY 16 H GLY 16 10.036 0.828 3.035
100 1HA GLY 16 1HA GLY 16 11.931 -0.300 3.792
101 2HA GLY 16 2HA GLY 16 11.292 -1.849 3.186
102 H MET 17 H MET 17 10.414 -0.807 0.563
103 HA MET 17 HA MET 17 12.874 -0.760 -0.893
104 1HB MET 17 1HB MET 17 10.236 -1.590 -1.325
105 2HB MET 17 2HB MET 17 10.261 -0.016 -2.146
106 1HG MET 17 1HG MET 17 12.445 -0.786 -3.119
107 2HG MET 17 2HG MET 17 12.078 -2.388 -2.478
108 1HE MET 17 1HE MET 17 9.721 -0.306 -5.922
109 2HE MET 17 2HE MET 17 9.533 0.226 -4.243
110 3HE MET 17 3HE MET 17 11.106 0.402 -5.056
111 H ILE 18 H ILE 18 10.376 1.428 0.233
112 HA ILE 18 HA ILE 18 11.251 3.861 -1.076
113 HB ILE 18 HB ILE 18 9.547 3.165 1.343
114 1HG1 ILE 18 1HG1 ILE 18 7.850 4.507 0.161
115 2HG1 ILE 18 2HG1 ILE 18 9.009 4.843 -1.144
116 1HG2 ILE 18 1HG2 ILE 18 10.728 5.127 2.171
117 2HG2 ILE 18 2HG2 ILE 18 10.433 5.997 0.646
118 3HG2 ILE 18 3HG2 ILE 18 9.091 5.581 1.738
119 1HD1 ILE 18 1HD1 ILE 18 7.797 2.171 -0.399
120 2HD1 ILE 18 2HD1 ILE 18 7.360 3.168 -1.787
121 3HD1 ILE 18 3HD1 ILE 18 8.965 2.424 -1.735
122 H ASP 19 H ASP 19 11.889 2.422 2.101
123 HA ASP 19 HA ASP 19 13.535 4.506 2.984
124 1HB ASP 19 1HB ASP 19 13.200 1.729 4.189
125 2HB ASP 19 2HB ASP 19 13.556 3.235 5.037
126 H GLY 20 H GLY 20 14.312 1.344 1.597
127 1HA GLY 20 1HA GLY 20 16.859 1.103 2.845
128 2HA GLY 20 2HA GLY 20 16.151 0.043 1.629
Start of MODEL 12
1 1H GLY 1 1HN GLY 1 -7.854 -7.359 5.117
2 2H GLY 1 2HN GLY 1 -7.931 -8.706 4.189
3 3H GLY 1 3HN GLY 1 -8.881 -8.589 5.539
4 1HA GLY 1 1HA GLY 1 -10.154 -8.216 3.510
5 2HA GLY 1 2HA GLY 1 -10.134 -6.801 4.588
6 H LEU 2 H LEU 2 -10.561 -6.743 1.696
7 HA LEU 2 HA LEU 2 -8.331 -6.477 0.134
8 1HB LEU 2 1HB LEU 2 -9.749 -5.535 -1.529
9 2HB LEU 2 2HB LEU 2 -10.657 -6.724 -0.621
10 HG LEU 2 HG LEU 2 -11.364 -4.473 0.777
11 1HD1 LEU 2 1HD1 LEU 2 -10.088 -2.925 -0.728
12 2HD1 LEU 2 2HD1 LEU 2 -11.023 -3.519 -2.108
13 3HD1 LEU 2 3HD1 LEU 2 -11.828 -2.635 -0.797
14 1HD2 LEU 2 1HD2 LEU 2 -12.666 -5.437 -1.805
15 2HD2 LEU 2 2HD2 LEU 2 -12.923 -6.117 -0.183
16 3HD2 LEU 2 3HD2 LEU 2 -13.449 -4.467 -0.540
17 H PHE 3 H PHE 3 -9.514 -3.992 2.324
18 HA PHE 3 HA PHE 3 -8.402 -1.648 1.290
19 1HB PHE 3 1HB PHE 3 -9.790 -2.182 3.413
20 2HB PHE 3 2HB PHE 3 -8.331 -2.592 4.197
21 HD1 PHE 3 1HD PHE 3 -6.798 -0.898 5.045
22 HD2 PHE 3 2HD PHE 3 -10.111 0.237 2.516
23 HE1 PHE 3 1HE PHE 3 -6.391 1.488 5.572
24 HE2 PHE 3 2HE PHE 3 -9.687 2.623 3.047
25 HZ PHE 3 HZ PHE 3 -7.830 3.250 4.577
26 H GLY 4 H GLY 4 -7.075 -4.067 3.340
27 1HA GLY 4 1HA GLY 4 -4.365 -3.096 3.609
28 2HA GLY 4 2HA GLY 4 -4.908 -4.734 3.988
29 H ALA 5 H ALA 5 -5.817 -4.546 0.820
30 HA ALA 5 HA ALA 5 -3.195 -5.518 -0.195
31 1HB ALA 5 1HB ALA 5 -4.438 -6.250 -2.144
32 2HB ALA 5 2HB ALA 5 -5.228 -6.872 -0.681
33 3HB ALA 5 3HB ALA 5 -5.920 -5.482 -1.556
34 H ILE 6 H ILE 6 -5.261 -2.659 -0.196
35 HA ILE 6 HA ILE 6 -3.495 -1.429 -2.166
36 HB ILE 6 HB ILE 6 -5.495 0.193 -2.492
37 1HG1 ILE 6 1HG1 ILE 6 -6.916 -2.414 -2.047
38 2HG1 ILE 6 2HG1 ILE 6 -6.812 -1.194 -0.772
39 1HG2 ILE 6 1HG2 ILE 6 -5.231 -2.553 -3.734
40 2HG2 ILE 6 2HG2 ILE 6 -6.086 -1.159 -4.454
41 3HG2 ILE 6 3HG2 ILE 6 -4.332 -1.086 -4.193
42 1HD1 ILE 6 1HD1 ILE 6 -8.145 -0.799 -3.488
43 2HD1 ILE 6 2HD1 ILE 6 -8.959 -0.969 -1.923
44 3HD1 ILE 6 3HD1 ILE 6 -7.955 0.459 -2.242
45 H ALA 7 H ALA 7 -5.719 0.465 -0.389
46 HA ALA 7 HA ALA 7 -5.298 2.540 0.322
47 1HB ALA 7 1HB ALA 7 -4.978 2.456 2.798
48 2HB ALA 7 2HB ALA 7 -6.118 1.228 2.206
49 3HB ALA 7 3HB ALA 7 -4.468 0.757 2.659
50 H GLY 8 H GLY 8 -2.438 1.111 1.957
51 1HA GLY 8 1HA GLY 8 -0.657 3.253 1.728
52 2HA GLY 8 2HA GLY 8 -0.204 1.553 1.766
53 H PHE 9 H PHE 9 -1.617 0.820 -0.707
54 HA PHE 9 HA PHE 9 0.300 1.343 -2.670
55 1HB PHE 9 1HB PHE 9 -1.588 -0.409 -2.618
56 2HB PHE 9 2HB PHE 9 -2.590 0.846 -3.371
57 HD1 PHE 9 1HD PHE 9 -2.233 1.452 -5.695
58 HD2 PHE 9 2HD PHE 9 0.622 -1.053 -3.662
59 HE1 PHE 9 1HE PHE 9 -1.014 1.114 -7.825
60 HE2 PHE 9 2HE PHE 9 1.853 -1.380 -5.775
61 HZ PHE 9 HZ PHE 9 1.027 -0.319 -7.884
62 H ILE 10 H ILE 10 -2.532 3.259 -1.795
63 HA ILE 10 HA ILE 10 -2.225 5.007 -4.156
64 HB ILE 10 HB ILE 10 -4.311 4.923 -1.900
65 1HG1 ILE 10 1HG1 ILE 10 -5.700 4.405 -4.221
66 2HG1 ILE 10 2HG1 ILE 10 -4.171 3.630 -4.616
67 1HG2 ILE 10 1HG2 ILE 10 -4.222 6.563 -4.465
68 2HG2 ILE 10 2HG2 ILE 10 -5.595 6.481 -3.326
69 3HG2 ILE 10 3HG2 ILE 10 -4.064 7.192 -2.805
70 1HD1 ILE 10 1HD1 ILE 10 -5.870 3.123 -2.126
71 2HD1 ILE 10 2HD1 ILE 10 -5.797 2.102 -3.576
72 3HD1 ILE 10 3HD1 ILE 10 -4.365 2.270 -2.532
73 H GLU 11 H GLU 11 -1.853 4.944 -0.621
74 HA GLU 11 HA GLU 11 -1.116 7.693 -0.353
75 1HB GLU 11 1HB GLU 11 -0.357 5.276 1.320
76 2HB GLU 11 2HB GLU 11 -0.106 6.951 1.806
77 1HG GLU 11 1HG GLU 11 -2.473 7.412 1.848
78 2HG GLU 11 2HG GLU 11 -2.875 5.878 1.091
79 H ASN 12 H ASN 12 0.732 4.913 -1.513
80 HA ASN 12 HA ASN 12 2.621 6.712 -2.703
81 1HB ASN 12 1HB ASN 12 4.660 6.064 -1.744
82 2HB ASN 12 2HB ASN 12 3.626 6.556 -0.393
83 1HD2 ASN 12 1HD2 ASN 12 6.095 4.553 -0.783
84 2HD2 ASN 12 2HD2 ASN 12 5.465 3.163 0.098
85 H GLY 13 H GLY 13 1.732 3.376 -1.919
86 1HA GLY 13 1HA GLY 13 1.825 1.940 -4.128
87 2HA GLY 13 2HA GLY 13 3.538 2.348 -4.042
88 H ALA 14 H ALA 14 2.652 2.205 -0.877
89 HA ALA 14 HA ALA 14 2.597 0.726 0.804
90 1HB ALA 14 1HB ALA 14 3.586 -1.516 -0.982
91 2HB ALA 14 2HB ALA 14 3.113 -1.609 0.711
92 3HB ALA 14 3HB ALA 14 1.882 -1.256 -0.527
93 H GLU 15 H GLU 15 4.078 1.672 1.905
94 HA GLU 15 HA GLU 15 6.944 1.742 1.224
95 1HB GLU 15 1HB GLU 15 6.899 2.638 3.736
96 2HB GLU 15 2HB GLU 15 6.619 3.647 2.340
97 1HG GLU 15 1HG GLU 15 5.073 4.091 4.241
98 2HG GLU 15 2HG GLU 15 4.284 3.778 2.705
99 H GLY 16 H GLY 16 8.371 0.975 2.956
100 1HA GLY 16 1HA GLY 16 9.201 -0.689 4.415
101 2HA GLY 16 2HA GLY 16 7.674 -1.594 4.271
102 H MET 17 H MET 17 7.413 -1.420 1.450
103 HA MET 17 HA MET 17 8.942 -3.566 0.460
104 1HB MET 17 1HB MET 17 6.651 -2.142 -0.266
105 2HB MET 17 2HB MET 17 7.803 -1.586 -1.479
106 1HG MET 17 1HG MET 17 8.373 -4.178 -1.558
107 2HG MET 17 2HG MET 17 6.746 -4.328 -0.905
108 1HE MET 17 1HE MET 17 4.575 -3.257 -2.205
109 2HE MET 17 2HE MET 17 5.405 -1.705 -2.490
110 3HE MET 17 3HE MET 17 4.655 -2.573 -3.844
111 H ILE 18 H ILE 18 9.292 -0.081 0.289
112 HA ILE 18 HA ILE 18 11.757 -0.208 -1.360
113 HB ILE 18 HB ILE 18 10.401 2.223 -0.102
114 1HG1 ILE 18 1HG1 ILE 18 9.718 2.580 -2.659
115 2HG1 ILE 18 2HG1 ILE 18 9.726 0.816 -2.684
116 1HG2 ILE 18 1HG2 ILE 18 11.647 3.491 -1.811
117 2HG2 ILE 18 2HG2 ILE 18 12.752 2.561 -0.802
118 3HG2 ILE 18 3HG2 ILE 18 12.353 1.981 -2.433
119 1HD1 ILE 18 1HD1 ILE 18 8.116 2.641 -0.825
120 2HD1 ILE 18 2HD1 ILE 18 7.486 1.761 -2.231
121 3HD1 ILE 18 3HD1 ILE 18 8.040 0.869 -0.808
122 H ASP 19 H ASP 19 10.593 0.818 1.825
123 HA ASP 19 HA ASP 19 12.995 1.906 2.690
124 1HB ASP 19 1HB ASP 19 10.597 1.180 4.409
125 2HB ASP 19 2HB ASP 19 11.718 2.525 4.623
126 H GLY 20 H GLY 20 12.106 -1.418 2.832
127 1HA GLY 20 1HA GLY 20 14.171 -1.938 4.918
128 2HA GLY 20 2HA GLY 20 12.610 -2.780 4.908
Start of MODEL 13
1 1H GLY 1 1HN GLY 1 -9.534 -6.404 5.180
2 2H GLY 1 2HN GLY 1 -10.114 -7.632 4.266
3 3H GLY 1 3HN GLY 1 -10.853 -7.261 5.701
4 1HA GLY 1 1HA GLY 1 -12.126 -6.452 3.805
5 2HA GLY 1 2HA GLY 1 -11.557 -5.142 4.866
6 H LEU 2 H LEU 2 -12.221 -4.681 2.144
7 HA LEU 2 HA LEU 2 -10.291 -5.092 0.240
8 1HB LEU 2 1HB LEU 2 -11.461 -3.519 -1.108
9 2HB LEU 2 2HB LEU 2 -12.623 -4.368 -0.113
10 HG LEU 2 HG LEU 2 -12.165 -2.177 1.488
11 1HD1 LEU 2 1HD1 LEU 2 -10.645 -1.080 -0.176
12 2HD1 LEU 2 2HD1 LEU 2 -11.946 -1.128 -1.375
13 3HD1 LEU 2 3HD1 LEU 2 -12.120 -0.148 0.094
14 1HD2 LEU 2 1HD2 LEU 2 -14.134 -2.311 -0.835
15 2HD2 LEU 2 2HD2 LEU 2 -14.372 -3.005 0.785
16 3HD2 LEU 2 3HD2 LEU 2 -14.266 -1.251 0.585
17 H PHE 3 H PHE 3 -10.105 -2.663 2.747
18 HA PHE 3 HA PHE 3 -8.323 -0.775 1.728
19 1HB PHE 3 1HB PHE 3 -9.483 -1.115 4.035
20 2HB PHE 3 2HB PHE 3 -8.195 -2.140 4.461
21 HD1 PHE 3 1HD PHE 3 -8.487 1.303 2.870
22 HD2 PHE 3 2HD PHE 3 -6.503 -1.190 5.794
23 HE1 PHE 3 1HE PHE 3 -7.006 3.195 3.508
24 HE2 PHE 3 2HE PHE 3 -5.070 0.726 6.437
25 HZ PHE 3 HZ PHE 3 -5.303 2.908 5.267
26 H GLY 4 H GLY 4 -7.808 -3.835 3.173
27 1HA GLY 4 1HA GLY 4 -4.933 -4.025 3.134
28 2HA GLY 4 2HA GLY 4 -6.033 -5.403 3.252
29 H ALA 5 H ALA 5 -7.105 -4.219 0.419
30 HA ALA 5 HA ALA 5 -5.149 -5.754 -1.213
31 1HB ALA 5 1HB ALA 5 -6.791 -5.570 -2.991
32 2HB ALA 5 2HB ALA 5 -7.587 -6.168 -1.522
33 3HB ALA 5 3HB ALA 5 -7.789 -4.470 -2.026
34 H ILE 6 H ILE 6 -5.943 -2.451 -0.370
35 HA ILE 6 HA ILE 6 -4.099 -1.428 -2.399
36 HB ILE 6 HB ILE 6 -5.432 0.780 -2.034
37 1HG1 ILE 6 1HG1 ILE 6 -7.601 -1.291 -1.753
38 2HG1 ILE 6 2HG1 ILE 6 -6.916 -0.446 -0.369
39 1HG2 ILE 6 1HG2 ILE 6 -6.675 0.188 -4.064
40 2HG2 ILE 6 2HG2 ILE 6 -4.997 -0.392 -4.124
41 3HG2 ILE 6 3HG2 ILE 6 -6.310 -1.541 -3.772
42 1HD1 ILE 6 1HD1 ILE 6 -7.619 1.742 -1.337
43 2HD1 ILE 6 2HD1 ILE 6 -8.396 0.875 -2.683
44 3HD1 ILE 6 3HD1 ILE 6 -8.993 0.662 -1.030
45 H ALA 7 H ALA 7 -5.389 0.380 0.233
46 HA ALA 7 HA ALA 7 -4.269 2.016 1.233
47 1HB ALA 7 1HB ALA 7 -5.029 0.380 2.902
48 2HB ALA 7 2HB ALA 7 -3.505 -0.510 2.796
49 3HB ALA 7 3HB ALA 7 -3.529 1.146 3.459
50 H GLY 8 H GLY 8 -1.680 -0.348 1.881
51 1HA GLY 8 1HA GLY 8 0.497 1.388 1.654
52 2HA GLY 8 2HA GLY 8 0.540 -0.362 1.420
53 H PHE 9 H PHE 9 -1.293 -0.228 -1.088
54 HA PHE 9 HA PHE 9 0.799 0.345 -2.992
55 1HB PHE 9 1HB PHE 9 -2.147 -0.327 -3.223
56 2HB PHE 9 2HB PHE 9 -1.150 0.010 -4.630
57 HD1 PHE 9 1HD PHE 9 1.118 -1.282 -4.837
58 HD2 PHE 9 2HD PHE 9 -2.192 -2.606 -2.407
59 HE1 PHE 9 1HE PHE 9 2.029 -3.586 -4.837
60 HE2 PHE 9 2HE PHE 9 -1.295 -4.892 -2.415
61 HZ PHE 9 HZ PHE 9 0.828 -5.404 -3.626
62 H ILE 10 H ILE 10 -1.283 2.447 -1.344
63 HA ILE 10 HA ILE 10 -1.003 4.607 -3.388
64 HB ILE 10 HB ILE 10 -3.183 3.973 -1.331
65 1HG1 ILE 10 1HG1 ILE 10 -4.728 4.311 -3.257
66 2HG1 ILE 10 2HG1 ILE 10 -3.349 4.467 -4.346
67 1HG2 ILE 10 1HG2 ILE 10 -2.733 6.385 -1.134
68 2HG2 ILE 10 2HG2 ILE 10 -2.800 6.568 -2.902
69 3HG2 ILE 10 3HG2 ILE 10 -4.256 6.139 -1.975
70 1HD1 ILE 10 1HD1 ILE 10 -4.627 2.194 -4.111
71 2HD1 ILE 10 2HD1 ILE 10 -2.864 2.173 -4.201
72 3HD1 ILE 10 3HD1 ILE 10 -3.668 1.997 -2.622
73 H GLU 11 H GLU 11 -1.343 3.937 0.074
74 HA GLU 11 HA GLU 11 -0.206 6.357 1.061
75 1HB GLU 11 1HB GLU 11 -0.685 3.612 2.290
76 2HB GLU 11 2HB GLU 11 -0.221 5.031 3.230
77 1HG GLU 11 1HG GLU 11 -2.258 6.142 2.870
78 2HG GLU 11 2HG GLU 11 -2.660 5.201 1.441
79 H ASN 12 H ASN 12 1.355 3.678 -0.348
80 HA ASN 12 HA ASN 12 3.981 4.813 0.390
81 1HB ASN 12 1HB ASN 12 2.960 2.247 1.424
82 2HB ASN 12 2HB ASN 12 4.392 2.018 0.441
83 1HD2 ASN 12 1HD2 ASN 12 3.550 4.780 2.650
84 2HD2 ASN 12 2HD2 ASN 12 4.951 4.484 3.694
85 H GLY 13 H GLY 13 1.924 3.524 -2.038
86 1HA GLY 13 1HA GLY 13 2.321 3.175 -4.275
87 2HA GLY 13 2HA GLY 13 4.049 3.468 -4.033
88 H ALA 14 H ALA 14 4.882 1.667 -2.266
89 HA ALA 14 HA ALA 14 3.688 -0.979 -2.572
90 1HB ALA 14 1HB ALA 14 6.532 -0.448 -3.554
91 2HB ALA 14 2HB ALA 14 5.816 -2.054 -3.290
92 3HB ALA 14 3HB ALA 14 5.154 -0.985 -4.542
93 H GLU 15 H GLU 15 3.356 -0.989 -0.330
94 HA GLU 15 HA GLU 15 5.177 0.207 1.478
95 1HB GLU 15 1HB GLU 15 3.776 -0.612 3.229
96 2HB GLU 15 2HB GLU 15 2.792 -0.074 1.895
97 1HG GLU 15 1HG GLU 15 1.722 -2.009 2.607
98 2HG GLU 15 2HG GLU 15 2.571 -2.507 1.150
99 H GLY 16 H GLY 16 6.685 -0.520 2.801
100 1HA GLY 16 1HA GLY 16 8.125 -1.920 3.960
101 2HA GLY 16 2HA GLY 16 7.479 -3.323 3.082
102 H MET 17 H MET 17 7.667 -2.180 0.512
103 HA MET 17 HA MET 17 10.218 -2.941 -0.373
104 1HB MET 17 1HB MET 17 7.671 -2.489 -1.441
105 2HB MET 17 2HB MET 17 8.587 -1.133 -2.096
106 1HG MET 17 1HG MET 17 10.370 -2.886 -2.626
107 2HG MET 17 2HG MET 17 9.140 -4.103 -2.334
108 1HE MET 17 1HE MET 17 8.963 -0.540 -4.244
109 2HE MET 17 2HE MET 17 10.495 -1.329 -4.688
110 3HE MET 17 3HE MET 17 9.206 -1.132 -5.899
111 H ILE 18 H ILE 18 8.806 0.128 0.413
112 HA ILE 18 HA ILE 18 10.705 1.948 -0.665
113 HB ILE 18 HB ILE 18 9.005 2.224 1.865
114 1HG1 ILE 18 1HG1 ILE 18 7.392 1.688 0.296
115 2HG1 ILE 18 2HG1 ILE 18 7.394 3.434 0.232
116 1HG2 ILE 18 1HG2 ILE 18 10.621 4.041 1.694
117 2HG2 ILE 18 2HG2 ILE 18 10.099 4.379 0.027
118 3HG2 ILE 18 3HG2 ILE 18 8.989 4.636 1.398
119 1HD1 ILE 18 1HD1 ILE 18 8.669 1.521 -1.775
120 2HD1 ILE 18 2HD1 ILE 18 7.326 2.617 -2.034
121 3HD1 ILE 18 3HD1 ILE 18 8.964 3.273 -1.775
122 H ASP 19 H ASP 19 10.684 0.110 2.151
123 HA ASP 19 HA ASP 19 11.909 -0.048 4.112
124 1HB ASP 19 1HB ASP 19 13.277 -1.330 2.584
125 2HB ASP 19 2HB ASP 19 14.187 0.111 2.119
126 H GLY 20 H GLY 20 14.717 1.884 3.260
127 1HA GLY 20 1HA GLY 20 13.568 4.453 3.897
128 2HA GLY 20 2HA GLY 20 14.525 3.775 5.228
Start of MODEL 14
1 1H GLY 1 1HN GLY 1 -10.196 -5.577 5.301
2 2H GLY 1 2HN GLY 1 -10.013 -7.192 5.092
3 3H GLY 1 3HN GLY 1 -11.439 -6.601 5.689
4 1HA GLY 1 1HA GLY 1 -11.645 -7.240 3.365
5 2HA GLY 1 2HA GLY 1 -11.923 -5.503 3.631
6 H LEU 2 H LEU 2 -11.133 -6.539 1.106
7 HA LEU 2 HA LEU 2 -8.467 -6.883 0.597
8 1HB LEU 2 1HB LEU 2 -9.001 -6.611 -1.712
9 2HB LEU 2 2HB LEU 2 -10.351 -7.378 -0.906
10 HG LEU 2 HG LEU 2 -11.174 -4.767 -0.749
11 1HD1 LEU 2 1HD1 LEU 2 -9.213 -3.882 -2.037
12 2HD1 LEU 2 2HD1 LEU 2 -9.649 -4.934 -3.392
13 3HD1 LEU 2 3HD1 LEU 2 -10.738 -3.628 -2.887
14 1HD2 LEU 2 1HD2 LEU 2 -12.496 -6.636 -1.641
15 2HD2 LEU 2 2HD2 LEU 2 -12.596 -5.227 -2.705
16 3HD2 LEU 2 3HD2 LEU 2 -11.559 -6.600 -3.151
17 H PHE 3 H PHE 3 -9.982 -3.783 1.163
18 HA PHE 3 HA PHE 3 -8.262 -1.953 -0.047
19 1HB PHE 3 1HB PHE 3 -10.394 -1.740 1.437
20 2HB PHE 3 2HB PHE 3 -9.376 -1.829 2.800
21 HD1 PHE 3 1HD PHE 3 -9.518 0.128 -0.447
22 HD2 PHE 3 2HD PHE 3 -8.665 0.196 3.791
23 HE1 PHE 3 1HE PHE 3 -8.953 2.545 -0.581
24 HE2 PHE 3 2HE PHE 3 -8.140 2.614 3.634
25 HZ PHE 3 HZ PHE 3 -8.254 3.777 1.445
26 H GLY 4 H GLY 4 -8.105 -3.560 2.979
27 1HA GLY 4 1HA GLY 4 -5.653 -2.480 4.047
28 2HA GLY 4 2HA GLY 4 -6.443 -3.958 4.612
29 H ALA 5 H ALA 5 -5.979 -4.739 1.455
30 HA ALA 5 HA ALA 5 -3.285 -5.912 1.934
31 1HB ALA 5 1HB ALA 5 -5.086 -7.344 0.983
32 2HB ALA 5 2HB ALA 5 -5.181 -6.256 -0.426
33 3HB ALA 5 3HB ALA 5 -3.695 -7.167 -0.108
34 H ILE 6 H ILE 6 -4.834 -3.254 0.229
35 HA ILE 6 HA ILE 6 -2.313 -2.533 -1.066
36 HB ILE 6 HB ILE 6 -3.910 -1.255 -2.685
37 1HG1 ILE 6 1HG1 ILE 6 -5.516 -3.725 -2.076
38 2HG1 ILE 6 2HG1 ILE 6 -5.892 -2.167 -1.344
39 1HG2 ILE 6 1HG2 ILE 6 -2.201 -2.884 -3.268
40 2HG2 ILE 6 2HG2 ILE 6 -3.295 -4.216 -2.818
41 3HG2 ILE 6 3HG2 ILE 6 -3.681 -3.161 -4.209
42 1HD1 ILE 6 1HD1 ILE 6 -5.945 -2.763 -4.334
43 2HD1 ILE 6 2HD1 ILE 6 -7.345 -2.511 -3.281
44 3HD1 ILE 6 3HD1 ILE 6 -6.232 -1.166 -3.600
45 H ALA 7 H ALA 7 -5.122 -0.551 -0.890
46 HA ALA 7 HA ALA 7 -5.091 1.663 -0.783
47 1HB ALA 7 1HB ALA 7 -6.379 0.773 1.121
48 2HB ALA 7 2HB ALA 7 -4.934 0.731 2.144
49 3HB ALA 7 3HB ALA 7 -5.603 2.291 1.610
50 H GLY 8 H GLY 8 -2.866 1.307 2.031
51 1HA GLY 8 1HA GLY 8 -1.333 3.628 1.533
52 2HA GLY 8 2HA GLY 8 -0.823 2.202 2.430
53 H PHE 9 H PHE 9 -1.091 0.355 0.021
54 HA PHE 9 HA PHE 9 1.427 0.770 -1.195
55 1HB PHE 9 1HB PHE 9 -0.325 -1.288 -1.085
56 2HB PHE 9 2HB PHE 9 -0.768 -0.682 -2.670
57 HD1 PHE 9 1HD PHE 9 1.883 -2.239 -0.610
58 HD2 PHE 9 2HD PHE 9 0.807 -0.891 -4.566
59 HE1 PHE 9 1HE PHE 9 3.827 -3.449 -1.551
60 HE2 PHE 9 2HE PHE 9 2.749 -2.113 -5.506
61 HZ PHE 9 HZ PHE 9 4.275 -3.383 -4.002
62 H ILE 10 H ILE 10 -1.438 2.483 -1.775
63 HA ILE 10 HA ILE 10 -0.415 3.646 -4.296
64 HB ILE 10 HB ILE 10 -3.267 3.008 -3.336
65 1HG1 ILE 10 1HG1 ILE 10 -2.947 1.961 -5.930
66 2HG1 ILE 10 2HG1 ILE 10 -1.366 1.674 -5.221
67 1HG2 ILE 10 1HG2 ILE 10 -3.284 5.176 -4.482
68 2HG2 ILE 10 2HG2 ILE 10 -2.382 4.485 -5.855
69 3HG2 ILE 10 3HG2 ILE 10 -4.043 3.943 -5.492
70 1HD1 ILE 10 1HD1 ILE 10 -4.078 0.791 -4.145
71 2HD1 ILE 10 2HD1 ILE 10 -2.791 -0.243 -4.806
72 3HD1 ILE 10 3HD1 ILE 10 -2.561 0.588 -3.251
73 H GLU 11 H GLU 11 -2.373 4.203 -1.356
74 HA GLU 11 HA GLU 11 -2.371 7.046 -1.508
75 1HB GLU 11 1HB GLU 11 -2.934 5.031 0.696
76 2HB GLU 11 2HB GLU 11 -3.194 6.766 0.897
77 1HG GLU 11 1HG GLU 11 -4.953 6.848 -0.643
78 2HG GLU 11 2HG GLU 11 -4.435 5.409 -1.506
79 H ASN 12 H ASN 12 0.133 4.863 -0.557
80 HA ASN 12 HA ASN 12 1.756 7.274 0.177
81 1HB ASN 12 1HB ASN 12 1.837 5.698 2.071
82 2HB ASN 12 2HB ASN 12 2.307 4.379 1.005
83 1HD2 ASN 12 1HD2 ASN 12 4.571 4.515 -0.144
84 2HD2 ASN 12 2HD2 ASN 12 5.705 5.519 0.727
85 H GLY 13 H GLY 13 1.627 4.067 -1.364
86 1HA GLY 13 1HA GLY 13 2.282 3.781 -3.741
87 2HA GLY 13 2HA GLY 13 3.552 4.986 -3.471
88 H ALA 14 H ALA 14 2.828 1.732 -3.407
89 HA ALA 14 HA ALA 14 3.707 -0.159 -2.480
90 1HB ALA 14 1HB ALA 14 5.923 -0.572 -3.412
91 2HB ALA 14 2HB ALA 14 4.891 0.278 -4.577
92 3HB ALA 14 3HB ALA 14 6.153 1.169 -3.689
93 H GLU 15 H GLU 15 3.251 0.772 -0.189
94 HA GLU 15 HA GLU 15 5.453 1.798 1.274
95 1HB GLU 15 1HB GLU 15 4.048 1.446 3.253
96 2HB GLU 15 2HB GLU 15 3.191 2.259 1.941
97 1HG GLU 15 1HG GLU 15 2.001 0.189 1.367
98 2HG GLU 15 2HG GLU 15 2.947 -0.721 2.555
99 H GLY 16 H GLY 16 6.721 0.903 2.828
100 1HA GLY 16 1HA GLY 16 7.738 -0.709 4.205
101 2HA GLY 16 2HA GLY 16 6.941 -2.005 3.282
102 H MET 17 H MET 17 7.387 -1.149 0.755
103 HA MET 17 HA MET 17 9.723 -2.388 -0.012
104 1HB MET 17 1HB MET 17 7.389 -1.479 -1.168
105 2HB MET 17 2HB MET 17 8.552 -0.346 -1.847
106 1HG MET 17 1HG MET 17 9.978 -2.435 -2.290
107 2HG MET 17 2HG MET 17 8.528 -3.376 -1.985
108 1HE MET 17 1HE MET 17 9.223 -0.593 -5.631
109 2HE MET 17 2HE MET 17 9.103 0.071 -3.990
110 3HE MET 17 3HE MET 17 10.442 -1.024 -4.410
111 H ILE 18 H ILE 18 9.079 0.917 0.579
112 HA ILE 18 HA ILE 18 11.230 2.398 -0.387
113 HB ILE 18 HB ILE 18 9.710 2.565 2.234
114 1HG1 ILE 18 1HG1 ILE 18 8.791 4.659 1.234
115 2HG1 ILE 18 2HG1 ILE 18 9.718 4.372 -0.240
116 1HG2 ILE 18 1HG2 ILE 18 11.803 4.557 1.271
117 2HG2 ILE 18 2HG2 ILE 18 10.631 4.860 2.575
118 3HG2 ILE 18 3HG2 ILE 18 11.847 3.605 2.771
119 1HD1 ILE 18 1HD1 ILE 18 8.361 2.458 -0.788
120 2HD1 ILE 18 2HD1 ILE 18 7.617 2.452 0.835
121 3HD1 ILE 18 3HD1 ILE 18 7.265 3.759 -0.317
122 H ASP 19 H ASP 19 11.360 0.039 2.326
123 HA ASP 19 HA ASP 19 14.319 0.432 2.340
124 1HB ASP 19 1HB ASP 19 13.347 1.565 4.314
125 2HB ASP 19 2HB ASP 19 12.580 0.051 4.804
126 H GLY 20 H GLY 20 15.470 -1.384 3.049
127 1HA GLY 20 1HA GLY 20 14.153 -4.061 2.654
128 2HA GLY 20 2HA GLY 20 15.825 -3.728 2.193
Start of MODEL 15
1 1H GLY 1 1HN GLY 1 -10.931 -6.401 4.988
2 2H GLY 1 2HN GLY 1 -10.908 -7.890 4.306
3 3H GLY 1 3HN GLY 1 -12.166 -7.464 5.293
4 1HA GLY 1 1HA GLY 1 -12.798 -7.398 2.955
5 2HA GLY 1 2HA GLY 1 -12.909 -5.810 3.751
6 H LEU 2 H LEU 2 -12.586 -6.157 0.916
7 HA LEU 2 HA LEU 2 -10.056 -6.398 -0.078
8 1HB LEU 2 1HB LEU 2 -10.912 -5.549 -2.134
9 2HB LEU 2 2HB LEU 2 -12.168 -6.469 -1.335
10 HG LEU 2 HG LEU 2 -12.780 -3.949 -0.408
11 1HD1 LEU 2 1HD1 LEU 2 -10.999 -2.850 -1.794
12 2HD1 LEU 2 2HD1 LEU 2 -11.747 -3.519 -3.253
13 3HD1 LEU 2 3HD1 LEU 2 -12.625 -2.340 -2.259
14 1HD2 LEU 2 1HD2 LEU 2 -13.684 -5.146 -3.064
15 2HD2 LEU 2 2HD2 LEU 2 -14.359 -5.519 -1.464
16 3HD2 LEU 2 3HD2 LEU 2 -14.540 -3.894 -2.140
17 H PHE 3 H PHE 3 -11.258 -3.496 1.478
18 HA PHE 3 HA PHE 3 -9.612 -1.473 0.487
19 1HB PHE 3 1HB PHE 3 -11.465 -1.604 2.316
20 2HB PHE 3 2HB PHE 3 -10.246 -2.046 3.418
21 HD1 PHE 3 1HD PHE 3 -8.780 -0.403 4.432
22 HD2 PHE 3 2HD PHE 3 -11.244 0.694 1.058
23 HE1 PHE 3 1HE PHE 3 -8.185 1.978 4.764
24 HE2 PHE 3 2HE PHE 3 -10.633 3.074 1.396
25 HZ PHE 3 HZ PHE 3 -9.101 3.717 3.246
26 H GLY 4 H GLY 4 -9.103 -3.840 2.914
27 1HA GLY 4 1HA GLY 4 -6.426 -3.215 3.789
28 2HA GLY 4 2HA GLY 4 -7.231 -4.772 4.011
29 H ALA 5 H ALA 5 -7.396 -4.610 0.753
30 HA ALA 5 HA ALA 5 -4.740 -5.881 0.338
31 1HB ALA 5 1HB ALA 5 -5.677 -6.688 -1.739
32 2HB ALA 5 2HB ALA 5 -6.810 -7.063 -0.421
33 3HB ALA 5 3HB ALA 5 -7.136 -5.706 -1.532
34 H ILE 6 H ILE 6 -6.355 -2.847 -0.136
35 HA ILE 6 HA ILE 6 -4.254 -1.976 -1.993
36 HB ILE 6 HB ILE 6 -5.975 -0.138 -2.606
37 1HG1 ILE 6 1HG1 ILE 6 -7.780 -2.488 -2.077
38 2HG1 ILE 6 2HG1 ILE 6 -7.605 -1.144 -0.948
39 1HG2 ILE 6 1HG2 ILE 6 -6.010 -2.979 -3.647
40 2HG2 ILE 6 2HG2 ILE 6 -6.579 -1.534 -4.531
41 3HG2 ILE 6 3HG2 ILE 6 -4.865 -1.695 -4.107
42 1HD1 ILE 6 1HD1 ILE 6 -8.388 0.448 -2.698
43 2HD1 ILE 6 2HD1 ILE 6 -8.667 -0.925 -3.796
44 3HD1 ILE 6 3HD1 ILE 6 -9.605 -0.781 -2.300
45 H ALA 7 H ALA 7 -6.371 0.257 -0.468
46 HA ALA 7 HA ALA 7 -5.752 2.316 0.115
47 1HB ALA 7 1HB ALA 7 -6.829 1.217 2.005
48 2HB ALA 7 2HB ALA 7 -5.272 0.612 2.604
49 3HB ALA 7 3HB ALA 7 -5.613 2.358 2.610
50 H GLY 8 H GLY 8 -3.182 0.676 2.002
51 1HA GLY 8 1HA GLY 8 -1.154 2.595 1.837
52 2HA GLY 8 2HA GLY 8 -0.913 0.859 1.989
53 H PHE 9 H PHE 9 -2.193 0.227 -0.635
54 HA PHE 9 HA PHE 9 -0.010 0.455 -2.417
55 1HB PHE 9 1HB PHE 9 -2.047 -1.141 -2.411
56 2HB PHE 9 2HB PHE 9 -2.903 0.148 -3.255
57 HD1 PHE 9 1HD PHE 9 0.220 -1.941 -3.385
58 HD2 PHE 9 2HD PHE 9 -2.636 0.390 -5.623
59 HE1 PHE 9 1HE PHE 9 1.294 -2.656 -5.496
60 HE2 PHE 9 2HE PHE 9 -1.562 -0.330 -7.739
61 HZ PHE 9 HZ PHE 9 0.401 -1.862 -7.685
62 H ILE 10 H ILE 10 -2.585 2.726 -1.729
63 HA ILE 10 HA ILE 10 -1.961 4.367 -4.131
64 HB ILE 10 HB ILE 10 -4.360 4.344 -2.232
65 1HG1 ILE 10 1HG1 ILE 10 -5.328 3.859 -4.794
66 2HG1 ILE 10 2HG1 ILE 10 -3.792 3.008 -4.858
67 1HG2 ILE 10 1HG2 ILE 10 -3.930 6.608 -3.057
68 2HG2 ILE 10 2HG2 ILE 10 -3.824 6.001 -4.728
69 3HG2 ILE 10 3HG2 ILE 10 -5.367 5.936 -3.835
70 1HD1 ILE 10 1HD1 ILE 10 -4.473 1.770 -2.762
71 2HD1 ILE 10 2HD1 ILE 10 -6.023 2.630 -2.808
72 3HD1 ILE 10 3HD1 ILE 10 -5.584 1.528 -4.130
73 H GLU 11 H GLU 11 -2.255 4.375 -0.548
74 HA GLU 11 HA GLU 11 -1.392 7.084 -0.204
75 1HB GLU 11 1HB GLU 11 -1.220 4.686 1.650
76 2HB GLU 11 2HB GLU 11 -0.946 6.355 2.144
77 1HG GLU 11 1HG GLU 11 -3.232 6.975 1.659
78 2HG GLU 11 2HG GLU 11 -3.577 5.422 0.906
79 H ASN 12 H ASN 12 0.441 4.187 -1.020
80 HA ASN 12 HA ASN 12 2.816 5.877 -1.325
81 1HB ASN 12 1HB ASN 12 3.147 4.953 0.945
82 2HB ASN 12 2HB ASN 12 2.845 3.318 0.349
83 1HD2 ASN 12 1HD2 ASN 12 5.177 6.025 0.319
84 2HD2 ASN 12 2HD2 ASN 12 6.479 5.074 -0.385
85 H GLY 13 H GLY 13 1.623 2.491 -1.414
86 1HA GLY 13 1HA GLY 13 1.699 1.397 -3.738
87 2HA GLY 13 2HA GLY 13 3.374 1.977 -3.759
88 H ALA 14 H ALA 14 4.657 1.419 -1.650
89 HA ALA 14 HA ALA 14 3.922 -0.880 -0.131
90 1HB ALA 14 1HB ALA 14 5.992 -1.346 -2.328
91 2HB ALA 14 2HB ALA 14 5.644 -2.441 -0.968
92 3HB ALA 14 3HB ALA 14 4.403 -2.136 -2.199
93 H GLU 15 H GLU 15 4.516 0.704 1.477
94 HA GLU 15 HA GLU 15 7.095 1.965 1.323
95 1HB GLU 15 1HB GLU 15 6.480 3.070 3.395
96 2HB GLU 15 2HB GLU 15 5.203 3.147 2.211
97 1HG GLU 15 1HG GLU 15 4.134 2.793 4.269
98 2HG GLU 15 2HG GLU 15 3.995 1.285 3.378
99 H GLY 16 H GLY 16 8.600 1.965 3.143
100 1HA GLY 16 1HA GLY 16 9.809 1.121 4.919
101 2HA GLY 16 2HA GLY 16 8.867 -0.385 4.861
102 H MET 17 H MET 17 9.061 -0.813 2.121
103 HA MET 17 HA MET 17 11.327 -2.430 1.871
104 1HB MET 17 1HB MET 17 8.897 -2.067 0.566
105 2HB MET 17 2HB MET 17 10.014 -1.411 -0.625
106 1HG MET 17 1HG MET 17 11.416 -3.531 -0.048
107 2HG MET 17 2HG MET 17 9.916 -4.173 0.601
108 1HE MET 17 1HE MET 17 7.887 -2.720 -1.630
109 2HE MET 17 2HE MET 17 7.630 -4.143 -2.662
110 3HE MET 17 3HE MET 17 7.659 -4.325 -0.891
111 H ILE 18 H ILE 18 10.682 0.814 0.862
112 HA ILE 18 HA ILE 18 12.845 1.432 -0.827
113 HB ILE 18 HB ILE 18 11.471 3.201 1.252
114 1HG1 ILE 18 1HG1 ILE 18 10.428 4.155 -0.958
115 2HG1 ILE 18 2HG1 ILE 18 10.895 2.626 -1.690
116 1HG2 ILE 18 1HG2 ILE 18 13.615 4.206 0.615
117 2HG2 ILE 18 2HG2 ILE 18 13.230 3.991 -1.106
118 3HG2 ILE 18 3HG2 ILE 18 12.289 5.114 -0.095
119 1HD1 ILE 18 1HD1 ILE 18 8.507 2.795 -0.897
120 2HD1 ILE 18 2HD1 ILE 18 9.360 1.430 -0.185
121 3HD1 ILE 18 3HD1 ILE 18 9.103 2.915 0.769
122 H ASP 19 H ASP 19 12.839 1.128 2.773
123 HA ASP 19 HA ASP 19 15.607 2.091 2.942
124 1HB ASP 19 1HB ASP 19 13.930 2.706 4.655
125 2HB ASP 19 2HB ASP 19 13.780 1.005 5.111
126 H GLY 20 H GLY 20 16.017 0.360 1.305
127 1HA GLY 20 1HA GLY 20 17.914 -1.394 2.061
128 2HA GLY 20 2HA GLY 20 16.470 -2.364 2.380
Start of MODEL 16
1 1H GLY 1 1HN GLY 1 -7.753 -7.471 5.284
2 2H GLY 1 2HN GLY 1 -8.122 -8.689 4.253
3 3H GLY 1 3HN GLY 1 -8.808 -8.656 5.759
4 1HA GLY 1 1HA GLY 1 -10.372 -7.952 4.051
5 2HA GLY 1 2HA GLY 1 -10.022 -6.673 5.238
6 H LEU 2 H LEU 2 -10.961 -6.202 2.536
7 HA LEU 2 HA LEU 2 -9.047 -5.953 0.590
8 1HB LEU 2 1HB LEU 2 -10.649 -4.721 -0.654
9 2HB LEU 2 2HB LEU 2 -11.500 -5.904 0.315
10 HG LEU 2 HG LEU 2 -11.623 -3.743 2.017
11 1HD1 LEU 2 1HD1 LEU 2 -10.519 -2.193 0.381
12 2HD1 LEU 2 2HD1 LEU 2 -11.790 -2.555 -0.797
13 3HD1 LEU 2 3HD1 LEU 2 -12.187 -1.725 0.720
14 1HD2 LEU 2 1HD2 LEU 2 -13.544 -4.320 -0.282
15 2HD2 LEU 2 2HD2 LEU 2 -13.532 -5.127 1.302
16 3HD2 LEU 2 3HD2 LEU 2 -13.926 -3.406 1.193
17 H PHE 3 H PHE 3 -9.481 -3.672 3.232
18 HA PHE 3 HA PHE 3 -8.283 -1.347 2.229
19 1HB PHE 3 1HB PHE 3 -9.296 -1.969 4.531
20 2HB PHE 3 2HB PHE 3 -7.786 -2.646 4.951
21 HD1 PHE 3 1HD PHE 3 -5.883 -1.248 5.600
22 HD2 PHE 3 2HD PHE 3 -9.450 0.552 3.957
23 HE1 PHE 3 1HE PHE 3 -5.026 1.004 6.184
24 HE2 PHE 3 2HE PHE 3 -8.577 2.797 4.548
25 HZ PHE 3 HZ PHE 3 -6.360 3.024 5.652
26 H GLY 4 H GLY 4 -6.919 -4.126 3.743
27 1HA GLY 4 1HA GLY 4 -4.098 -3.539 3.423
28 2HA GLY 4 2HA GLY 4 -4.779 -5.118 3.826
29 H ALA 5 H ALA 5 -6.323 -4.394 0.962
30 HA ALA 5 HA ALA 5 -4.216 -5.676 -0.703
31 1HB ALA 5 1HB ALA 5 -6.497 -6.693 -0.676
32 2HB ALA 5 2HB ALA 5 -7.147 -5.171 -1.343
33 3HB ALA 5 3HB ALA 5 -5.987 -6.122 -2.281
34 H ILE 6 H ILE 6 -5.623 -2.581 -0.018
35 HA ILE 6 HA ILE 6 -4.069 -1.424 -2.218
36 HB ILE 6 HB ILE 6 -5.618 0.621 -1.881
37 1HG1 ILE 6 1HG1 ILE 6 -7.518 -1.665 -1.342
38 2HG1 ILE 6 2HG1 ILE 6 -6.853 -0.691 -0.042
39 1HG2 ILE 6 1HG2 ILE 6 -5.225 -0.610 -3.928
40 2HG2 ILE 6 2HG2 ILE 6 -6.350 -1.890 -3.404
41 3HG2 ILE 6 3HG2 ILE 6 -6.956 -0.242 -3.753
42 1HD1 ILE 6 1HD1 ILE 6 -9.107 0.093 -0.614
43 2HD1 ILE 6 2HD1 ILE 6 -7.901 1.346 -0.959
44 3HD1 ILE 6 3HD1 ILE 6 -8.605 0.390 -2.288
45 H ALA 7 H ALA 7 -5.423 0.242 0.476
46 HA ALA 7 HA ALA 7 -4.541 2.103 1.328
47 1HB ALA 7 1HB ALA 7 -3.267 -0.231 2.849
48 2HB ALA 7 2HB ALA 7 -3.468 1.407 3.510
49 3HB ALA 7 3HB ALA 7 -4.889 0.445 3.088
50 H GLY 8 H GLY 8 -1.522 0.251 1.765
51 1HA GLY 8 1HA GLY 8 0.307 2.306 1.311
52 2HA GLY 8 2HA GLY 8 0.602 0.590 1.030
53 H PHE 9 H PHE 9 -1.384 0.270 -1.234
54 HA PHE 9 HA PHE 9 0.311 1.189 -3.369
55 1HB PHE 9 1HB PHE 9 -2.550 0.184 -3.384
56 2HB PHE 9 2HB PHE 9 -1.541 0.370 -4.809
57 HD1 PHE 9 1HD PHE 9 -2.912 -2.165 -4.069
58 HD2 PHE 9 2HD PHE 9 1.055 -0.761 -3.075
59 HE1 PHE 9 1HE PHE 9 -2.144 -4.490 -3.774
60 HE2 PHE 9 2HE PHE 9 1.792 -3.068 -2.747
61 HZ PHE 9 HZ PHE 9 0.216 -4.958 -3.102
62 H ILE 10 H ILE 10 -2.009 2.903 -1.575
63 HA ILE 10 HA ILE 10 -2.337 4.977 -3.694
64 HB ILE 10 HB ILE 10 -3.818 4.372 -1.098
65 1HG1 ILE 10 1HG1 ILE 10 -5.207 4.347 -3.776
66 2HG1 ILE 10 2HG1 ILE 10 -4.302 2.924 -3.255
67 1HG2 ILE 10 1HG2 ILE 10 -4.330 6.586 -3.146
68 2HG2 ILE 10 2HG2 ILE 10 -5.399 6.213 -1.778
69 3HG2 ILE 10 3HG2 ILE 10 -3.773 6.812 -1.475
70 1HD1 ILE 10 1HD1 ILE 10 -5.526 2.840 -1.132
71 2HD1 ILE 10 2HD1 ILE 10 -6.486 4.253 -1.607
72 3HD1 ILE 10 3HD1 ILE 10 -6.620 2.740 -2.533
73 H GLU 11 H GLU 11 -1.850 4.489 -0.210
74 HA GLU 11 HA GLU 11 -0.944 7.092 0.388
75 1HB GLU 11 1HB GLU 11 -0.480 4.442 1.809
76 2HB GLU 11 2HB GLU 11 -0.136 6.023 2.522
77 1HG GLU 11 1HG GLU 11 -2.481 6.689 2.342
78 2HG GLU 11 2HG GLU 11 -2.899 5.182 1.530
79 H ASN 12 H ASN 12 0.820 4.728 -1.306
80 HA ASN 12 HA ASN 12 3.111 6.511 -1.415
81 1HB ASN 12 1HB ASN 12 3.267 4.341 0.499
82 2HB ASN 12 2HB ASN 12 4.357 3.963 -0.825
83 1HD2 ASN 12 1HD2 ASN 12 3.366 6.961 0.951
84 2HD2 ASN 12 2HD2 ASN 12 5.037 7.478 1.259
85 H GLY 13 H GLY 13 1.630 3.455 -2.428
86 1HA GLY 13 1HA GLY 13 1.494 2.601 -4.613
87 2HA GLY 13 2HA GLY 13 2.717 3.756 -5.161
88 H ALA 14 H ALA 14 4.814 3.540 -3.932
89 HA ALA 14 HA ALA 14 5.896 0.797 -4.192
90 1HB ALA 14 1HB ALA 14 7.255 3.452 -3.538
91 2HB ALA 14 2HB ALA 14 8.072 1.911 -3.871
92 3HB ALA 14 3HB ALA 14 7.137 2.707 -5.152
93 H GLU 15 H GLU 15 4.158 0.474 -2.307
94 HA GLU 15 HA GLU 15 5.084 1.280 0.330
95 1HB GLU 15 1HB GLU 15 3.127 0.219 1.175
96 2HB GLU 15 2HB GLU 15 2.722 1.081 -0.286
97 1HG GLU 15 1HG GLU 15 1.516 -0.906 -0.491
98 2HG GLU 15 2HG GLU 15 2.896 -1.140 -1.553
99 H GLY 16 H GLY 16 5.557 -0.156 2.040
100 1HA GLY 16 1HA GLY 16 6.423 -1.998 3.146
101 2HA GLY 16 2HA GLY 16 6.581 -2.860 1.600
102 H MET 17 H MET 17 7.761 -0.899 0.152
103 HA MET 17 HA MET 17 10.460 -1.403 0.272
104 1HB MET 17 1HB MET 17 8.600 -0.258 -1.453
105 2HB MET 17 2HB MET 17 9.590 1.127 -1.033
106 1HG MET 17 1HG MET 17 11.588 -0.379 -1.489
107 2HG MET 17 2HG MET 17 10.472 -1.560 -2.158
108 1HE MET 17 1HE MET 17 11.786 -1.780 -4.336
109 2HE MET 17 2HE MET 17 12.280 -0.424 -5.371
110 3HE MET 17 3HE MET 17 13.000 -0.622 -3.760
111 H ILE 18 H ILE 18 8.649 1.172 1.637
112 HA ILE 18 HA ILE 18 10.440 3.053 2.606
113 HB ILE 18 HB ILE 18 8.056 1.795 4.034
114 1HG1 ILE 18 1HG1 ILE 18 7.142 4.221 3.277
115 2HG1 ILE 18 2HG1 ILE 18 8.320 4.011 1.992
116 1HG2 ILE 18 1HG2 ILE 18 9.424 2.976 5.683
117 2HG2 ILE 18 2HG2 ILE 18 9.493 4.410 4.637
118 3HG2 ILE 18 3HG2 ILE 18 7.955 3.883 5.363
119 1HD1 ILE 18 1HD1 ILE 18 6.005 3.263 1.420
120 2HD1 ILE 18 2HD1 ILE 18 7.161 1.937 1.284
121 3HD1 ILE 18 3HD1 ILE 18 6.086 2.042 2.699
122 H ASP 19 H ASP 19 10.065 -0.329 3.845
123 HA ASP 19 HA ASP 19 12.542 0.167 5.421
124 1HB ASP 19 1HB ASP 19 10.674 -0.214 6.973
125 2HB ASP 19 2HB ASP 19 10.310 -1.746 6.163
126 H GLY 20 H GLY 20 13.944 -1.573 5.498
127 1HA GLY 20 1HA GLY 20 15.465 -2.928 4.452
128 2HA GLY 20 2HA GLY 20 14.072 -3.869 3.928
Start of MODEL 17
1 1H GLY 1 1HN GLY 1 -10.227 -5.746 5.668
2 2H GLY 1 2HN GLY 1 -10.076 -7.322 5.249
3 3H GLY 1 3HN GLY 1 -11.395 -6.831 6.120
4 1HA GLY 1 1HA GLY 1 -11.975 -7.203 3.812
5 2HA GLY 1 2HA GLY 1 -12.173 -5.500 4.289
6 H LEU 2 H LEU 2 -11.883 -6.069 1.603
7 HA LEU 2 HA LEU 2 -9.411 -6.526 0.537
8 1HB LEU 2 1HB LEU 2 -10.308 -5.812 -1.545
9 2HB LEU 2 2HB LEU 2 -11.591 -6.565 -0.624
10 HG LEU 2 HG LEU 2 -11.999 -3.941 0.094
11 1HD1 LEU 2 1HD1 LEU 2 -11.796 -2.507 -1.899
12 2HD1 LEU 2 2HD1 LEU 2 -10.195 -3.078 -1.424
13 3HD1 LEU 2 3HD1 LEU 2 -11.018 -3.821 -2.802
14 1HD2 LEU 2 1HD2 LEU 2 -13.800 -3.901 -1.592
15 2HD2 LEU 2 2HD2 LEU 2 -13.062 -5.283 -2.431
16 3HD2 LEU 2 3HD2 LEU 2 -13.712 -5.473 -0.787
17 H PHE 3 H PHE 3 -10.402 -3.458 1.910
18 HA PHE 3 HA PHE 3 -8.712 -1.610 0.695
19 1HB PHE 3 1HB PHE 3 -10.490 -1.506 2.604
20 2HB PHE 3 2HB PHE 3 -9.241 -1.909 3.684
21 HD1 PHE 3 1HD PHE 3 -9.663 0.546 0.813
22 HD2 PHE 3 2HD PHE 3 -8.239 -0.101 4.843
23 HE1 PHE 3 1HE PHE 3 -8.836 2.882 0.911
24 HE2 PHE 3 2HE PHE 3 -7.447 2.248 4.925
25 HZ PHE 3 HZ PHE 3 -7.717 3.725 2.953
26 H GLY 4 H GLY 4 -8.213 -3.818 3.251
27 1HA GLY 4 1HA GLY 4 -5.487 -3.271 4.015
28 2HA GLY 4 2HA GLY 4 -6.332 -4.791 4.319
29 H ALA 5 H ALA 5 -6.596 -4.754 1.074
30 HA ALA 5 HA ALA 5 -3.967 -6.079 0.609
31 1HB ALA 5 1HB ALA 5 -4.991 -6.966 -1.401
32 2HB ALA 5 2HB ALA 5 -6.052 -7.297 -0.013
33 3HB ALA 5 3HB ALA 5 -6.445 -5.986 -1.156
34 H ILE 6 H ILE 6 -5.587 -3.064 0.044
35 HA ILE 6 HA ILE 6 -3.542 -2.269 -1.899
36 HB ILE 6 HB ILE 6 -5.277 -0.443 -2.508
37 1HG1 ILE 6 1HG1 ILE 6 -7.072 -2.774 -1.866
38 2HG1 ILE 6 2HG1 ILE 6 -6.863 -1.402 -0.785
39 1HG2 ILE 6 1HG2 ILE 6 -5.944 -1.873 -4.379
40 2HG2 ILE 6 2HG2 ILE 6 -4.218 -2.040 -4.000
41 3HG2 ILE 6 3HG2 ILE 6 -5.361 -3.305 -3.478
42 1HD1 ILE 6 1HD1 ILE 6 -8.896 -1.054 -2.067
43 2HD1 ILE 6 2HD1 ILE 6 -7.686 0.147 -2.554
44 3HD1 ILE 6 3HD1 ILE 6 -8.021 -1.259 -3.595
45 H ALA 7 H ALA 7 -5.707 -0.152 -0.238
46 HA ALA 7 HA ALA 7 -5.213 1.945 0.301
47 1HB ALA 7 1HB ALA 7 -4.333 0.252 2.705
48 2HB ALA 7 2HB ALA 7 -4.824 1.961 2.795
49 3HB ALA 7 3HB ALA 7 -5.990 0.725 2.291
50 H GLY 8 H GLY 8 -2.345 0.583 1.985
51 1HA GLY 8 1HA GLY 8 -0.525 2.671 1.573
52 2HA GLY 8 2HA GLY 8 -0.126 0.963 1.747
53 H PHE 9 H PHE 9 -1.511 0.090 -0.755
54 HA PHE 9 HA PHE 9 0.516 0.566 -2.685
55 1HB PHE 9 1HB PHE 9 -1.377 -1.275 -2.436
56 2HB PHE 9 2HB PHE 9 -2.348 -0.155 -3.374
57 HD1 PHE 9 1HD PHE 9 -2.108 -0.072 -5.768
58 HD2 PHE 9 2HD PHE 9 0.849 -2.109 -3.381
59 HE1 PHE 9 1HE PHE 9 -1.090 -1.013 -7.825
60 HE2 PHE 9 2HE PHE 9 1.869 -3.040 -5.437
61 HZ PHE 9 HZ PHE 9 0.897 -2.503 -7.666
62 H ILE 10 H ILE 10 -1.968 2.680 -1.730
63 HA ILE 10 HA ILE 10 -1.687 4.366 -4.162
64 HB ILE 10 HB ILE 10 -4.085 3.784 -2.340
65 1HG1 ILE 10 1HG1 ILE 10 -4.868 3.465 -5.038
66 2HG1 ILE 10 2HG1 ILE 10 -3.244 2.801 -5.025
67 1HG2 ILE 10 1HG2 ILE 10 -5.362 5.335 -3.773
68 2HG2 ILE 10 2HG2 ILE 10 -4.079 6.164 -2.885
69 3HG2 ILE 10 3HG2 ILE 10 -3.855 5.792 -4.616
70 1HD1 ILE 10 1HD1 ILE 10 -3.944 1.393 -3.023
71 2HD1 ILE 10 2HD1 ILE 10 -5.592 2.005 -3.254
72 3HD1 ILE 10 3HD1 ILE 10 -4.824 1.034 -4.529
73 H GLU 11 H GLU 11 -2.362 4.286 -0.648
74 HA GLU 11 HA GLU 11 -1.818 7.054 -0.171
75 1HB GLU 11 1HB GLU 11 -2.083 4.585 1.588
76 2HB GLU 11 2HB GLU 11 -1.916 6.219 2.238
77 1HG GLU 11 1HG GLU 11 -3.999 6.932 1.419
78 2HG GLU 11 2HG GLU 11 -4.098 5.670 0.200
79 H ASN 12 H ASN 12 0.333 4.443 -0.759
80 HA ASN 12 HA ASN 12 2.573 6.296 -0.219
81 1HB ASN 12 1HB ASN 12 2.098 3.829 1.323
82 2HB ASN 12 2HB ASN 12 3.611 3.748 0.443
83 1HD2 ASN 12 1HD2 ASN 12 1.916 6.553 2.033
84 2HD2 ASN 12 2HD2 ASN 12 3.295 6.899 3.093
85 H GLY 13 H GLY 13 1.210 3.624 -2.045
86 1HA GLY 13 1HA GLY 13 1.586 3.274 -4.348
87 2HA GLY 13 2HA GLY 13 3.077 4.218 -4.265
88 H ALA 14 H ALA 14 4.660 3.263 -2.534
89 HA ALA 14 HA ALA 14 4.801 0.303 -2.617
90 1HB ALA 14 1HB ALA 14 6.929 2.088 -3.876
91 2HB ALA 14 2HB ALA 14 7.023 0.325 -3.664
92 3HB ALA 14 3HB ALA 14 5.808 1.020 -4.754
93 H GLU 15 H GLU 15 4.300 1.140 -0.302
94 HA GLU 15 HA GLU 15 6.639 1.840 1.289
95 1HB GLU 15 1HB GLU 15 5.279 1.148 3.191
96 2HB GLU 15 2HB GLU 15 4.464 2.324 2.167
97 1HG GLU 15 1HG GLU 15 3.161 0.435 1.101
98 2HG GLU 15 2HG GLU 15 3.924 -0.679 2.242
99 H GLY 16 H GLY 16 7.768 0.219 2.739
100 1HA GLY 16 1HA GLY 16 8.496 -1.855 3.324
101 2HA GLY 16 2HA GLY 16 7.576 -2.612 2.004
102 H MET 17 H MET 17 8.471 -0.675 -0.013
103 HA MET 17 HA MET 17 10.845 -1.797 -0.968
104 1HB MET 17 1HB MET 17 8.668 -0.406 -1.904
105 2HB MET 17 2HB MET 17 9.831 0.914 -1.822
106 1HG MET 17 1HG MET 17 11.431 -0.584 -2.996
107 2HG MET 17 2HG MET 17 10.132 -1.742 -3.252
108 1HE MET 17 1HE MET 17 10.293 2.453 -5.271
109 2HE MET 17 2HE MET 17 9.759 2.283 -3.589
110 3HE MET 17 3HE MET 17 11.436 1.876 -4.036
111 H ILE 18 H ILE 18 10.051 1.080 0.840
112 HA ILE 18 HA ILE 18 12.674 2.383 0.639
113 HB ILE 18 HB ILE 18 10.460 2.851 2.687
114 1HG1 ILE 18 1HG1 ILE 18 10.182 4.989 1.024
115 2HG1 ILE 18 2HG1 ILE 18 10.652 3.771 -0.163
116 1HG2 ILE 18 1HG2 ILE 18 12.644 3.832 3.316
117 2HG2 ILE 18 2HG2 ILE 18 12.735 4.657 1.746
118 3HG2 ILE 18 3HG2 ILE 18 11.479 5.095 2.928
119 1HD1 ILE 18 1HD1 ILE 18 8.754 2.340 0.715
120 2HD1 ILE 18 2HD1 ILE 18 8.330 3.655 1.826
121 3HD1 ILE 18 3HD1 ILE 18 8.210 3.904 0.074
122 H ASP 19 H ASP 19 10.867 0.459 2.972
123 HA ASP 19 HA ASP 19 12.448 0.669 5.180
124 1HB ASP 19 1HB ASP 19 10.470 -1.528 4.475
125 2HB ASP 19 2HB ASP 19 10.910 -0.978 6.091
126 H GLY 20 H GLY 20 13.861 -0.603 2.722
127 1HA GLY 20 1HA GLY 20 14.820 -3.233 3.553
128 2HA GLY 20 2HA GLY 20 15.421 -2.235 2.220
Start of MODEL 18
1 1H GLY 1 1HN GLY 1 -8.826 -6.407 5.615
2 2H GLY 1 2HN GLY 1 -8.892 -7.910 4.968
3 3H GLY 1 3HN GLY 1 -10.047 -7.439 6.057
4 1HA GLY 1 1HA GLY 1 -10.892 -7.408 3.786
5 2HA GLY 1 2HA GLY 1 -10.895 -5.801 4.549
6 H LEU 2 H LEU 2 -10.853 -6.199 1.708
7 HA LEU 2 HA LEU 2 -8.420 -6.474 0.484
8 1HB LEU 2 1HB LEU 2 -9.453 -5.633 -1.491
9 2HB LEU 2 2HB LEU 2 -10.640 -6.536 -0.576
10 HG LEU 2 HG LEU 2 -11.183 -4.025 0.375
11 1HD1 LEU 2 1HD1 LEU 2 -11.149 -2.405 -1.481
12 2HD1 LEU 2 2HD1 LEU 2 -9.498 -2.900 -1.100
13 3HD1 LEU 2 3HD1 LEU 2 -10.310 -3.574 -2.520
14 1HD2 LEU 2 1HD2 LEU 2 -13.043 -3.949 -1.240
15 2HD2 LEU 2 2HD2 LEU 2 -12.250 -5.194 -2.229
16 3HD2 LEU 2 3HD2 LEU 2 -12.826 -5.579 -0.591
17 H PHE 3 H PHE 3 -9.500 -3.560 2.106
18 HA PHE 3 HA PHE 3 -7.957 -1.551 0.952
19 1HB PHE 3 1HB PHE 3 -9.652 -1.604 2.917
20 2HB PHE 3 2HB PHE 3 -8.370 -2.066 3.939
21 HD1 PHE 3 1HD PHE 3 -7.274 -0.374 5.168
22 HD2 PHE 3 2HD PHE 3 -8.990 0.619 1.324
23 HE1 PHE 3 1HE PHE 3 -6.541 1.980 5.433
24 HE2 PHE 3 2HE PHE 3 -8.204 2.961 1.600
25 HZ PHE 3 HZ PHE 3 -6.985 3.638 3.632
26 H GLY 4 H GLY 4 -7.228 -3.792 3.442
27 1HA GLY 4 1HA GLY 4 -4.518 -3.072 4.076
28 2HA GLY 4 2HA GLY 4 -5.250 -4.640 4.437
29 H ALA 5 H ALA 5 -5.657 -4.722 1.229
30 HA ALA 5 HA ALA 5 -3.017 -5.978 0.706
31 1HB ALA 5 1HB ALA 5 -5.097 -7.171 0.038
32 2HB ALA 5 2HB ALA 5 -5.497 -5.824 -1.059
33 3HB ALA 5 3HB ALA 5 -4.043 -6.796 -1.341
34 H ILE 6 H ILE 6 -4.756 -2.991 0.054
35 HA ILE 6 HA ILE 6 -2.625 -2.103 -1.754
36 HB ILE 6 HB ILE 6 -4.422 -0.426 -2.572
37 1HG1 ILE 6 1HG1 ILE 6 -6.101 -2.871 -1.999
38 2HG1 ILE 6 2HG1 ILE 6 -6.079 -1.501 -0.901
39 1HG2 ILE 6 1HG2 ILE 6 -3.163 -2.013 -3.921
40 2HG2 ILE 6 2HG2 ILE 6 -4.253 -3.330 -3.428
41 3HG2 ILE 6 3HG2 ILE 6 -4.865 -1.980 -4.424
42 1HD1 ILE 6 1HD1 ILE 6 -8.031 -1.328 -2.364
43 2HD1 ILE 6 2HD1 ILE 6 -6.907 0.001 -2.694
44 3HD1 ILE 6 3HD1 ILE 6 -7.001 -1.387 -3.804
45 H ALA 7 H ALA 7 -5.096 -0.163 -0.287
46 HA ALA 7 HA ALA 7 -4.832 1.994 0.167
47 1HB ALA 7 1HB ALA 7 -4.547 2.193 2.652
48 2HB ALA 7 2HB ALA 7 -5.549 0.802 2.199
49 3HB ALA 7 3HB ALA 7 -3.872 0.544 2.699
50 H GLY 8 H GLY 8 -1.991 1.138 2.137
51 1HA GLY 8 1HA GLY 8 -0.365 3.315 1.604
52 2HA GLY 8 2HA GLY 8 0.189 1.691 2.009
53 H PHE 9 H PHE 9 -0.894 0.476 -0.585
54 HA PHE 9 HA PHE 9 1.308 1.013 -2.277
55 1HB PHE 9 1HB PHE 9 -1.367 -0.341 -2.598
56 2HB PHE 9 2HB PHE 9 -0.556 0.137 -4.065
57 HD1 PHE 9 1HD PHE 9 1.267 -1.044 -4.984
58 HD2 PHE 9 2HD PHE 9 -0.121 -1.979 -1.004
59 HE1 PHE 9 1HE PHE 9 2.715 -3.055 -4.947
60 HE2 PHE 9 2HE PHE 9 1.312 -3.991 -0.984
61 HZ PHE 9 HZ PHE 9 2.748 -4.530 -2.943
62 H ILE 10 H ILE 10 -1.731 2.633 -1.987
63 HA ILE 10 HA ILE 10 -1.359 4.268 -4.434
64 HB ILE 10 HB ILE 10 -3.725 3.749 -2.539
65 1HG1 ILE 10 1HG1 ILE 10 -3.732 2.870 -5.434
66 2HG1 ILE 10 2HG1 ILE 10 -2.969 1.852 -4.216
67 1HG2 ILE 10 1HG2 ILE 10 -3.667 5.343 -5.151
68 2HG2 ILE 10 2HG2 ILE 10 -5.131 4.948 -4.225
69 3HG2 ILE 10 3HG2 ILE 10 -3.915 6.004 -3.521
70 1HD1 ILE 10 1HD1 ILE 10 -5.029 1.880 -2.845
71 2HD1 ILE 10 2HD1 ILE 10 -5.850 2.802 -4.119
72 3HD1 ILE 10 3HD1 ILE 10 -5.262 1.158 -4.451
73 H GLU 11 H GLU 11 -2.351 4.423 -1.064
74 HA GLU 11 HA GLU 11 -2.231 7.243 -0.724
75 1HB GLU 11 1HB GLU 11 -2.308 4.876 1.178
76 2HB GLU 11 2HB GLU 11 -2.462 6.549 1.718
77 1HG GLU 11 1HG GLU 11 -4.521 6.886 0.599
78 2HG GLU 11 2HG GLU 11 -4.301 5.504 -0.463
79 H ASN 12 H ASN 12 0.405 5.056 -0.970
80 HA ASN 12 HA ASN 12 2.121 7.307 -0.107
81 1HB ASN 12 1HB ASN 12 1.917 4.845 1.464
82 2HB ASN 12 2HB ASN 12 3.538 5.021 0.806
83 1HD2 ASN 12 1HD2 ASN 12 1.145 7.484 2.013
84 2HD2 ASN 12 2HD2 ASN 12 2.265 8.106 3.238
85 H GLY 13 H GLY 13 2.271 3.949 -1.366
86 1HA GLY 13 1HA GLY 13 2.961 3.979 -3.881
87 2HA GLY 13 2HA GLY 13 4.383 4.850 -3.285
88 H ALA 14 H ALA 14 2.742 1.832 -3.418
89 HA ALA 14 HA ALA 14 3.161 -0.308 -2.958
90 1HB ALA 14 1HB ALA 14 5.160 0.022 -4.335
91 2HB ALA 14 2HB ALA 14 6.101 0.411 -2.875
92 3HB ALA 14 3HB ALA 14 5.391 -1.203 -3.077
93 H GLU 15 H GLU 15 5.113 1.663 -0.699
94 HA GLU 15 HA GLU 15 5.949 1.455 1.283
95 1HB GLU 15 1HB GLU 15 3.247 0.257 1.620
96 2HB GLU 15 2HB GLU 15 4.407 0.368 2.973
97 1HG GLU 15 1HG GLU 15 4.394 2.807 2.778
98 2HG GLU 15 2HG GLU 15 3.263 2.689 1.413
99 H GLY 16 H GLY 16 7.288 0.300 2.440
100 1HA GLY 16 1HA GLY 16 8.200 -1.425 3.674
101 2HA GLY 16 2HA GLY 16 7.116 -2.603 2.906
102 H MET 17 H MET 17 7.491 -1.780 0.302
103 HA MET 17 HA MET 17 9.627 -3.243 -0.727
104 1HB MET 17 1HB MET 17 7.232 -1.998 -1.575
105 2HB MET 17 2HB MET 17 8.475 -1.063 -2.397
106 1HG MET 17 1HG MET 17 9.486 -3.235 -3.095
107 2HG MET 17 2HG MET 17 8.111 -4.082 -2.409
108 1HE MET 17 1HE MET 17 8.068 -0.671 -4.592
109 2HE MET 17 2HE MET 17 9.364 -1.699 -5.254
110 3HE MET 17 3HE MET 17 7.887 -1.398 -6.199
111 H ILE 18 H ILE 18 9.272 0.197 0.020
112 HA ILE 18 HA ILE 18 11.964 0.878 -1.020
113 HB ILE 18 HB ILE 18 9.965 2.650 0.451
114 1HG1 ILE 18 1HG1 ILE 18 8.628 1.881 -1.335
115 2HG1 ILE 18 2HG1 ILE 18 9.161 3.503 -1.730
116 1HG2 ILE 18 1HG2 ILE 18 12.226 3.316 -1.481
117 2HG2 ILE 18 2HG2 ILE 18 11.109 4.489 -0.744
118 3HG2 ILE 18 3HG2 ILE 18 12.221 3.568 0.275
119 1HD1 ILE 18 1HD1 ILE 18 9.242 2.067 -3.693
120 2HD1 ILE 18 2HD1 ILE 18 10.898 2.549 -3.250
121 3HD1 ILE 18 3HD1 ILE 18 10.306 0.914 -2.874
122 H ASP 19 H ASP 19 10.008 0.898 1.850
123 HA ASP 19 HA ASP 19 11.794 2.082 3.592
124 1HB ASP 19 1HB ASP 19 9.410 0.388 4.416
125 2HB ASP 19 2HB ASP 19 10.043 1.826 5.212
126 H GLY 20 H GLY 20 11.703 -1.276 2.793
127 1HA GLY 20 1HA GLY 20 13.043 -3.024 3.650
128 2HA GLY 20 2HA GLY 20 13.535 -1.996 5.007
Start of MODEL 19
1 1H GLY 1 1HN GLY 1 -10.667 -5.924 5.462
2 2H GLY 1 2HN GLY 1 -10.646 -7.516 5.074
3 3H GLY 1 3HN GLY 1 -11.947 -6.889 5.880
4 1HA GLY 1 1HA GLY 1 -12.428 -7.256 3.530
5 2HA GLY 1 2HA GLY 1 -12.552 -5.547 4.012
6 H LEU 2 H LEU 2 -12.015 -6.517 1.314
7 HA LEU 2 HA LEU 2 -9.386 -6.840 0.613
8 1HB LEU 2 1HB LEU 2 -10.076 -6.516 -1.640
9 2HB LEU 2 2HB LEU 2 -11.377 -7.293 -0.766
10 HG LEU 2 HG LEU 2 -12.161 -4.676 -0.492
11 1HD1 LEU 2 1HD1 LEU 2 -10.821 -4.804 -3.237
12 2HD1 LEU 2 2HD1 LEU 2 -11.858 -3.497 -2.634
13 3HD1 LEU 2 3HD1 LEU 2 -10.281 -3.787 -1.895
14 1HD2 LEU 2 1HD2 LEU 2 -13.561 -6.516 -1.336
15 2HD2 LEU 2 2HD2 LEU 2 -13.718 -5.083 -2.361
16 3HD2 LEU 2 3HD2 LEU 2 -12.725 -6.453 -2.903
17 H PHE 3 H PHE 3 -10.860 -3.754 1.382
18 HA PHE 3 HA PHE 3 -9.200 -1.898 0.122
19 1HB PHE 3 1HB PHE 3 -11.227 -1.692 1.731
20 2HB PHE 3 2HB PHE 3 -10.137 -1.850 3.033
21 HD1 PHE 3 1HD PHE 3 -8.835 0.022 3.840
22 HD2 PHE 3 2HD PHE 3 -10.876 0.295 0.042
23 HE1 PHE 3 1HE PHE 3 -8.322 2.445 3.729
24 HE2 PHE 3 2HE PHE 3 -10.348 2.717 -0.056
25 HZ PHE 3 HZ PHE 3 -9.070 3.793 1.788
26 H GLY 4 H GLY 4 -8.875 -3.556 3.117
27 1HA GLY 4 1HA GLY 4 -6.284 -2.602 3.971
28 2HA GLY 4 2HA GLY 4 -7.104 -4.033 4.602
29 H ALA 5 H ALA 5 -6.966 -4.822 1.401
30 HA ALA 5 HA ALA 5 -4.290 -6.101 1.637
31 1HB ALA 5 1HB ALA 5 -6.209 -7.529 0.964
32 2HB ALA 5 2HB ALA 5 -6.453 -6.495 -0.470
33 3HB ALA 5 3HB ALA 5 -4.955 -7.418 -0.286
34 H ILE 6 H ILE 6 -5.905 -3.372 0.102
35 HA ILE 6 HA ILE 6 -3.465 -2.838 -1.407
36 HB ILE 6 HB ILE 6 -5.046 -1.353 -2.854
37 1HG1 ILE 6 1HG1 ILE 6 -6.851 -3.669 -2.153
38 2HG1 ILE 6 2HG1 ILE 6 -6.995 -2.094 -1.375
39 1HG2 ILE 6 1HG2 ILE 6 -3.536 -3.090 -3.584
40 2HG2 ILE 6 2HG2 ILE 6 -4.689 -4.346 -3.074
41 3HG2 ILE 6 3HG2 ILE 6 -5.097 -3.237 -4.421
42 1HD1 ILE 6 1HD1 ILE 6 -7.337 -2.625 -4.360
43 2HD1 ILE 6 2HD1 ILE 6 -8.624 -2.255 -3.198
44 3HD1 ILE 6 3HD1 ILE 6 -7.407 -1.023 -3.586
45 H ALA 7 H ALA 7 -5.888 -0.470 -1.156
46 HA ALA 7 HA ALA 7 -5.515 1.714 -0.870
47 1HB ALA 7 1HB ALA 7 -6.220 2.261 1.449
48 2HB ALA 7 2HB ALA 7 -7.119 0.885 0.792
49 3HB ALA 7 3HB ALA 7 -5.817 0.607 1.964
50 H GLY 8 H GLY 8 -3.657 0.685 2.016
51 1HA GLY 8 1HA GLY 8 -1.669 2.684 1.997
52 2HA GLY 8 2HA GLY 8 -1.500 1.058 2.660
53 H PHE 9 H PHE 9 -1.883 -0.339 0.026
54 HA PHE 9 HA PHE 9 0.732 -0.393 -1.017
55 1HB PHE 9 1HB PHE 9 -1.123 -2.084 -1.261
56 2HB PHE 9 2HB PHE 9 -1.908 -1.006 -2.409
57 HD1 PHE 9 1HD PHE 9 1.353 -2.781 -1.797
58 HD2 PHE 9 2HD PHE 9 -1.421 -1.236 -4.717
59 HE1 PHE 9 1HE PHE 9 2.737 -3.723 -3.595
60 HE2 PHE 9 2HE PHE 9 -0.045 -2.212 -6.534
61 HZ PHE 9 HZ PHE 9 2.042 -3.460 -5.988
62 H ILE 10 H ILE 10 -1.816 1.924 -1.613
63 HA ILE 10 HA ILE 10 -0.451 3.027 -4.011
64 HB ILE 10 HB ILE 10 -3.366 3.146 -3.087
65 1HG1 ILE 10 1HG1 ILE 10 -3.302 1.975 -5.641
66 2HG1 ILE 10 2HG1 ILE 10 -1.897 1.262 -4.867
67 1HG2 ILE 10 1HG2 ILE 10 -2.049 4.217 -5.620
68 2HG2 ILE 10 2HG2 ILE 10 -3.798 4.213 -5.273
69 3HG2 ILE 10 3HG2 ILE 10 -2.709 5.196 -4.286
70 1HD1 ILE 10 1HD1 ILE 10 -4.776 1.249 -3.853
71 2HD1 ILE 10 2HD1 ILE 10 -3.854 -0.129 -4.490
72 3HD1 ILE 10 3HD1 ILE 10 -3.406 0.603 -2.931
73 H GLU 11 H GLU 11 -2.243 3.882 -0.994
74 HA GLU 11 HA GLU 11 -1.560 6.651 -0.982
75 1HB GLU 11 1HB GLU 11 -2.246 4.720 1.269
76 2HB GLU 11 2HB GLU 11 -2.181 6.477 1.442
77 1HG GLU 11 1HG GLU 11 -3.991 6.772 -0.167
78 2HG GLU 11 2HG GLU 11 -4.042 5.043 -0.511
79 H ASN 12 H ASN 12 0.326 3.811 -0.216
80 HA ASN 12 HA ASN 12 2.658 5.527 0.261
81 1HB ASN 12 1HB ASN 12 1.891 4.505 2.458
82 2HB ASN 12 2HB ASN 12 2.200 2.914 1.765
83 1HD2 ASN 12 1HD2 ASN 12 4.480 2.658 0.825
84 2HD2 ASN 12 2HD2 ASN 12 5.819 3.364 1.764
85 H GLY 13 H GLY 13 1.829 4.886 -2.185
86 1HA GLY 13 1HA GLY 13 2.861 2.463 -3.273
87 2HA GLY 13 2HA GLY 13 2.504 3.966 -4.138
88 H ALA 14 H ALA 14 4.759 3.155 -1.565
89 HA ALA 14 HA ALA 14 7.237 3.694 -3.039
90 1HB ALA 14 1HB ALA 14 6.544 5.915 -2.163
91 2HB ALA 14 2HB ALA 14 6.380 5.222 -0.529
92 3HB ALA 14 3HB ALA 14 7.976 5.309 -1.307
93 H GLU 15 H GLU 15 5.942 1.289 -2.069
94 HA GLU 15 HA GLU 15 7.038 0.465 0.465
95 1HB GLU 15 1HB GLU 15 6.159 -1.201 -1.932
96 2HB GLU 15 2HB GLU 15 6.454 -1.790 -0.284
97 1HG GLU 15 1HG GLU 15 4.646 -0.217 0.529
98 2HG GLU 15 2HG GLU 15 4.272 0.152 -1.160
99 H GLY 16 H GLY 16 8.938 -0.850 0.808
100 1HA GLY 16 1HA GLY 16 10.969 -1.859 0.253
101 2HA GLY 16 2HA GLY 16 10.873 -1.192 -1.383
102 H MET 17 H MET 17 10.166 1.507 -0.546
103 HA MET 17 HA MET 17 12.706 2.660 -0.027
104 1HB MET 17 1HB MET 17 10.262 3.365 -1.212
105 2HB MET 17 2HB MET 17 10.212 4.276 0.305
106 1HG MET 17 1HG MET 17 12.573 4.938 -0.218
107 2HG MET 17 2HG MET 17 12.326 4.331 -1.856
108 1HE MET 17 1HE MET 17 12.272 8.278 -2.253
109 2HE MET 17 2HE MET 17 13.220 7.357 -1.062
110 3HE MET 17 3HE MET 17 13.075 6.766 -2.736
111 H ILE 18 H ILE 18 9.864 1.872 1.825
112 HA ILE 18 HA ILE 18 10.466 3.465 4.194
113 HB ILE 18 HB ILE 18 8.690 0.989 3.958
114 1HG1 ILE 18 1HG1 ILE 18 7.813 2.352 2.289
115 2HG1 ILE 18 2HG1 ILE 18 6.768 2.558 3.680
116 1HG2 ILE 18 1HG2 ILE 18 7.450 1.996 5.866
117 2HG2 ILE 18 2HG2 ILE 18 9.128 1.639 6.286
118 3HG2 ILE 18 3HG2 ILE 18 8.645 3.309 5.942
119 1HD1 ILE 18 1HD1 ILE 18 8.913 4.509 2.736
120 2HD1 ILE 18 2HD1 ILE 18 7.162 4.699 2.598
121 3HD1 ILE 18 3HD1 ILE 18 7.929 4.711 4.205
122 H ASP 19 H ASP 19 10.423 0.035 3.538
123 HA ASP 19 HA ASP 19 13.156 -0.398 4.148
124 1HB ASP 19 1HB ASP 19 12.405 -0.776 6.449
125 2HB ASP 19 2HB ASP 19 11.056 -1.773 5.886
126 H GLY 20 H GLY 20 13.666 -2.555 3.369
127 1HA GLY 20 1HA GLY 20 11.658 -3.942 1.665
128 2HA GLY 20 2HA GLY 20 13.191 -3.448 0.937
Start of MODEL 20
1 1H GLY 1 1HN GLY 1 -11.085 -5.650 5.168
2 2H GLY 1 2HN GLY 1 -10.809 -7.254 4.982
3 3H GLY 1 3HN GLY 1 -12.284 -6.734 5.524
4 1HA GLY 1 1HA GLY 1 -12.381 -7.404 3.204
5 2HA GLY 1 2HA GLY 1 -12.751 -5.680 3.437
6 H LEU 2 H LEU 2 -11.838 -6.689 0.954
7 HA LEU 2 HA LEU 2 -9.155 -6.953 0.525
8 1HB LEU 2 1HB LEU 2 -9.626 -6.691 -1.803
9 2HB LEU 2 2HB LEU 2 -10.963 -7.513 -1.031
10 HG LEU 2 HG LEU 2 -11.901 -4.941 -0.899
11 1HD1 LEU 2 1HD1 LEU 2 -11.459 -3.786 -3.026
12 2HD1 LEU 2 2HD1 LEU 2 -9.947 -3.975 -2.136
13 3HD1 LEU 2 3HD1 LEU 2 -10.302 -5.045 -3.501
14 1HD2 LEU 2 1HD2 LEU 2 -13.116 -6.869 -1.825
15 2HD2 LEU 2 2HD2 LEU 2 -13.251 -5.466 -2.893
16 3HD2 LEU 2 3HD2 LEU 2 -12.142 -6.790 -3.309
17 H PHE 3 H PHE 3 -10.768 -3.878 1.007
18 HA PHE 3 HA PHE 3 -9.042 -2.023 -0.157
19 1HB PHE 3 1HB PHE 3 -11.232 -1.842 1.237
20 2HB PHE 3 2HB PHE 3 -10.270 -1.892 2.641
21 HD1 PHE 3 1HD PHE 3 -10.689 0.073 -0.543
22 HD2 PHE 3 2HD PHE 3 -9.268 0.097 3.536
23 HE1 PHE 3 1HE PHE 3 -10.256 2.511 -0.696
24 HE2 PHE 3 2HE PHE 3 -8.851 2.533 3.368
25 HZ PHE 3 HZ PHE 3 -9.331 3.741 1.257
26 H GLY 4 H GLY 4 -8.967 -3.584 2.901
27 1HA GLY 4 1HA GLY 4 -6.581 -2.440 4.042
28 2HA GLY 4 2HA GLY 4 -7.360 -3.927 4.594
29 H ALA 5 H ALA 5 -6.782 -4.786 1.491
30 HA ALA 5 HA ALA 5 -4.084 -5.884 2.080
31 1HB ALA 5 1HB ALA 5 -4.415 -7.205 0.063
32 2HB ALA 5 2HB ALA 5 -5.831 -7.378 1.119
33 3HB ALA 5 3HB ALA 5 -5.907 -6.333 -0.322
34 H ILE 6 H ILE 6 -5.628 -3.285 0.287
35 HA ILE 6 HA ILE 6 -3.100 -2.624 -1.028
36 HB ILE 6 HB ILE 6 -4.677 -1.394 -2.687
37 1HG1 ILE 6 1HG1 ILE 6 -6.317 -3.814 -2.002
38 2HG1 ILE 6 2HG1 ILE 6 -6.673 -2.224 -1.328
39 1HG2 ILE 6 1HG2 ILE 6 -2.984 -3.055 -3.213
40 2HG2 ILE 6 2HG2 ILE 6 -4.090 -4.361 -2.717
41 3HG2 ILE 6 3HG2 ILE 6 -4.463 -3.352 -4.146
42 1HD1 ILE 6 1HD1 ILE 6 -6.720 -2.927 -4.295
43 2HD1 ILE 6 2HD1 ILE 6 -8.120 -2.605 -3.259
44 3HD1 ILE 6 3HD1 ILE 6 -6.976 -1.298 -3.622
45 H ALA 7 H ALA 7 -5.823 -0.552 -1.011
46 HA ALA 7 HA ALA 7 -5.758 1.656 -0.954
47 1HB ALA 7 1HB ALA 7 -6.434 2.375 1.334
48 2HB ALA 7 2HB ALA 7 -7.169 0.831 0.871
49 3HB ALA 7 3HB ALA 7 -5.798 0.851 1.997
50 H GLY 8 H GLY 8 -3.675 1.273 1.945
51 1HA GLY 8 1HA GLY 8 -1.962 3.457 1.650
52 2HA GLY 8 2HA GLY 8 -1.513 1.901 2.349
53 H PHE 9 H PHE 9 -1.824 0.252 0.011
54 HA PHE 9 HA PHE 9 0.673 0.532 -1.216
55 1HB PHE 9 1HB PHE 9 -1.082 -1.445 -1.087
56 2HB PHE 9 2HB PHE 9 -1.629 -0.807 -2.633
57 HD1 PHE 9 1HD PHE 9 -0.456 -1.435 -4.629
58 HD2 PHE 9 2HD PHE 9 1.454 -1.922 -0.792
59 HE1 PHE 9 1HE PHE 9 1.474 -2.540 -5.726
60 HE2 PHE 9 2HE PHE 9 3.391 -3.005 -1.891
61 HZ PHE 9 HZ PHE 9 3.409 -3.314 -4.362
62 H ILE 10 H ILE 10 -2.155 2.345 -1.924
63 HA ILE 10 HA ILE 10 -1.068 3.277 -4.530
64 HB ILE 10 HB ILE 10 -3.938 3.013 -3.491
65 1HG1 ILE 10 1HG1 ILE 10 -3.796 1.688 -5.961
66 2HG1 ILE 10 2HG1 ILE 10 -2.233 1.305 -5.254
67 1HG2 ILE 10 1HG2 ILE 10 -2.940 4.131 -6.140
68 2HG2 ILE 10 2HG2 ILE 10 -4.645 3.804 -5.723
69 3HG2 ILE 10 3HG2 ILE 10 -3.746 5.042 -4.838
70 1HD1 ILE 10 1HD1 ILE 10 -3.878 -0.382 -4.647
71 2HD1 ILE 10 2HD1 ILE 10 -3.450 0.527 -3.178
72 3HD1 ILE 10 3HD1 ILE 10 -4.982 0.858 -4.007
73 H GLU 11 H GLU 11 -2.702 4.145 -1.462
74 HA GLU 11 HA GLU 11 -2.516 6.971 -1.819
75 1HB GLU 11 1HB GLU 11 -2.712 5.224 0.659
76 2HB GLU 11 2HB GLU 11 -2.906 6.980 0.668
77 1HG GLU 11 1HG GLU 11 -4.855 6.854 -0.780
78 2HG GLU 11 2HG GLU 11 -4.663 5.121 -1.007
79 H ASN 12 H ASN 12 -0.033 4.588 -0.937
80 HA ASN 12 HA ASN 12 1.913 6.827 -0.835
81 1HB ASN 12 1HB ASN 12 1.419 6.272 1.485
82 2HB ASN 12 2HB ASN 12 1.655 4.549 1.175
83 1HD2 ASN 12 1HD2 ASN 12 3.726 3.705 1.216
84 2HD2 ASN 12 2HD2 ASN 12 5.152 4.703 1.602
85 H GLY 13 H GLY 13 1.587 3.222 -0.800
86 1HA GLY 13 1HA GLY 13 2.309 1.632 -2.247
87 2HA GLY 13 2HA GLY 13 2.726 2.888 -3.412
88 H ALA 14 H ALA 14 4.633 4.109 -1.348
89 HA ALA 14 HA ALA 14 6.972 2.552 -1.982
90 1HB ALA 14 1HB ALA 14 6.969 5.011 -1.857
91 2HB ALA 14 2HB ALA 14 6.647 4.931 -0.111
92 3HB ALA 14 3HB ALA 14 8.172 4.299 -0.770
93 H GLU 15 H GLU 15 4.673 1.874 0.488
94 HA GLU 15 HA GLU 15 6.420 1.300 2.634
95 1HB GLU 15 1HB GLU 15 4.647 -0.410 3.304
96 2HB GLU 15 2HB GLU 15 4.187 1.276 3.253
97 1HG GLU 15 1HG GLU 15 3.616 -0.328 0.758
98 2HG GLU 15 2HG GLU 15 2.657 -0.674 2.204
99 H GLY 16 H GLY 16 7.733 -0.287 3.125
100 1HA GLY 16 1HA GLY 16 8.853 -2.306 3.097
101 2HA GLY 16 2HA GLY 16 7.834 -2.868 1.761
102 H MET 17 H MET 17 8.410 -0.281 0.226
103 HA MET 17 HA MET 17 10.739 -1.050 -1.186
104 1HB MET 17 1HB MET 17 8.435 0.514 -1.602
105 2HB MET 17 2HB MET 17 9.714 1.726 -1.496
106 1HG MET 17 1HG MET 17 11.042 0.283 -2.999
107 2HG MET 17 2HG MET 17 9.617 -0.696 -3.325
108 1HE MET 17 1HE MET 17 7.325 1.551 -5.442
109 2HE MET 17 2HE MET 17 7.736 -0.102 -4.935
110 3HE MET 17 3HE MET 17 7.195 1.087 -3.730
111 H ILE 18 H ILE 18 9.989 1.204 1.350
112 HA ILE 18 HA ILE 18 11.744 3.235 1.288
113 HB ILE 18 HB ILE 18 10.986 1.569 3.727
114 1HG1 ILE 18 1HG1 ILE 18 8.942 2.081 2.783
115 2HG1 ILE 18 2HG1 ILE 18 9.151 3.241 4.080
116 1HG2 ILE 18 1HG2 ILE 18 11.203 3.698 5.046
117 2HG2 ILE 18 2HG2 ILE 18 12.739 3.148 4.389
118 3HG2 ILE 18 3HG2 ILE 18 11.888 4.490 3.609
119 1HD1 ILE 18 1HD1 ILE 18 9.599 3.749 1.117
120 2HD1 ILE 18 2HD1 ILE 18 8.272 4.356 2.124
121 3HD1 ILE 18 3HD1 ILE 18 9.945 4.924 2.404
122 H ASP 19 H ASP 19 12.397 0.286 2.918
123 HA ASP 19 HA ASP 19 15.360 0.574 2.654
124 1HB ASP 19 1HB ASP 19 14.630 1.652 4.789
125 2HB ASP 19 2HB ASP 19 13.955 0.108 5.314
126 H GLY 20 H GLY 20 16.448 -1.445 3.609
127 1HA GLY 20 1HA GLY 20 16.666 -3.812 3.546
128 2HA GLY 20 2HA GLY 20 15.019 -3.970 2.920
Start of MODEL 21
1 1H GLY 1 1HN GLY 1 -10.227 -5.746 5.668
2 2H GLY 1 2HN GLY 1 -10.076 -7.322 5.249
3 3H GLY 1 3HN GLY 1 -11.395 -6.831 6.120
4 1HA GLY 1 1HA GLY 1 -11.975 -7.203 3.812
5 2HA GLY 1 2HA GLY 1 -12.173 -5.500 4.289
6 H LEU 2 H LEU 2 -11.883 -6.069 1.603
7 HA LEU 2 HA LEU 2 -9.411 -6.526 0.537
8 1HB LEU 2 1HB LEU 2 -10.308 -5.812 -1.545
9 2HB LEU 2 2HB LEU 2 -11.591 -6.565 -0.624
10 HG LEU 2 HG LEU 2 -11.999 -3.941 0.094
11 1HD1 LEU 2 1HD1 LEU 2 -11.796 -2.507 -1.899
12 2HD1 LEU 2 2HD1 LEU 2 -10.195 -3.078 -1.424
13 3HD1 LEU 2 3HD1 LEU 2 -11.018 -3.821 -2.802
14 1HD2 LEU 2 1HD2 LEU 2 -13.800 -3.901 -1.592
15 2HD2 LEU 2 2HD2 LEU 2 -13.062 -5.283 -2.431
16 3HD2 LEU 2 3HD2 LEU 2 -13.712 -5.473 -0.787
17 H PHE 3 H PHE 3 -10.402 -3.458 1.910
18 HA PHE 3 HA PHE 3 -8.712 -1.610 0.695
19 1HB PHE 3 1HB PHE 3 -10.490 -1.506 2.604
20 2HB PHE 3 2HB PHE 3 -9.241 -1.909 3.684
21 HD1 PHE 3 1HD PHE 3 -9.663 0.546 0.813
22 HD2 PHE 3 2HD PHE 3 -8.239 -0.101 4.843
23 HE1 PHE 3 1HE PHE 3 -8.836 2.882 0.911
24 HE2 PHE 3 2HE PHE 3 -7.447 2.248 4.925
25 HZ PHE 3 HZ PHE 3 -7.717 3.725 2.953
26 H GLY 4 H GLY 4 -8.213 -3.818 3.251
27 1HA GLY 4 1HA GLY 4 -5.487 -3.271 4.015
28 2HA GLY 4 2HA GLY 4 -6.332 -4.791 4.319
29 H ALA 5 H ALA 5 -6.596 -4.754 1.074
30 HA ALA 5 HA ALA 5 -3.967 -6.079 0.609
31 1HB ALA 5 1HB ALA 5 -4.991 -6.966 -1.401
32 2HB ALA 5 2HB ALA 5 -6.052 -7.297 -0.013
33 3HB ALA 5 3HB ALA 5 -6.445 -5.986 -1.156
34 H ILE 6 H ILE 6 -5.587 -3.064 0.044
35 HA ILE 6 HA ILE 6 -3.542 -2.269 -1.899
36 HB ILE 6 HB ILE 6 -5.277 -0.443 -2.508
37 1HG1 ILE 6 1HG1 ILE 6 -7.072 -2.774 -1.866
38 2HG1 ILE 6 2HG1 ILE 6 -6.863 -1.402 -0.785
39 1HG2 ILE 6 1HG2 ILE 6 -5.944 -1.873 -4.379
40 2HG2 ILE 6 2HG2 ILE 6 -4.218 -2.040 -4.000
41 3HG2 ILE 6 3HG2 ILE 6 -5.361 -3.305 -3.478
42 1HD1 ILE 6 1HD1 ILE 6 -8.896 -1.054 -2.067
43 2HD1 ILE 6 2HD1 ILE 6 -7.686 0.147 -2.554
44 3HD1 ILE 6 3HD1 ILE 6 -8.021 -1.259 -3.595
45 H ALA 7 H ALA 7 -5.707 -0.152 -0.238
46 HA ALA 7 HA ALA 7 -5.213 1.945 0.301
47 1HB ALA 7 1HB ALA 7 -4.333 0.252 2.705
48 2HB ALA 7 2HB ALA 7 -4.824 1.961 2.795
49 3HB ALA 7 3HB ALA 7 -5.990 0.725 2.291
50 H GLY 8 H GLY 8 -2.345 0.583 1.985
51 1HA GLY 8 1HA GLY 8 -0.525 2.671 1.573
52 2HA GLY 8 2HA GLY 8 -0.126 0.963 1.747
53 H PHE 9 H PHE 9 -1.511 0.090 -0.755
54 HA PHE 9 HA PHE 9 0.516 0.566 -2.685
55 1HB PHE 9 1HB PHE 9 -1.377 -1.275 -2.436
56 2HB PHE 9 2HB PHE 9 -2.348 -0.155 -3.374
57 HD1 PHE 9 1HD PHE 9 -2.108 -0.072 -5.768
58 HD2 PHE 9 2HD PHE 9 0.849 -2.109 -3.381
59 HE1 PHE 9 1HE PHE 9 -1.090 -1.013 -7.825
60 HE2 PHE 9 2HE PHE 9 1.869 -3.040 -5.437
61 HZ PHE 9 HZ PHE 9 0.897 -2.503 -7.666
62 H ILE 10 H ILE 10 -1.968 2.680 -1.730
63 HA ILE 10 HA ILE 10 -1.687 4.366 -4.162
64 HB ILE 10 HB ILE 10 -4.085 3.784 -2.340
65 1HG1 ILE 10 1HG1 ILE 10 -4.868 3.465 -5.038
66 2HG1 ILE 10 2HG1 ILE 10 -3.244 2.801 -5.025
67 1HG2 ILE 10 1HG2 ILE 10 -5.362 5.335 -3.773
68 2HG2 ILE 10 2HG2 ILE 10 -4.079 6.164 -2.885
69 3HG2 ILE 10 3HG2 ILE 10 -3.855 5.792 -4.616
70 1HD1 ILE 10 1HD1 ILE 10 -3.944 1.393 -3.023
71 2HD1 ILE 10 2HD1 ILE 10 -5.592 2.005 -3.254
72 3HD1 ILE 10 3HD1 ILE 10 -4.824 1.034 -4.529
73 H GLU 11 H GLU 11 -2.362 4.286 -0.648
74 HA GLU 11 HA GLU 11 -1.818 7.054 -0.171
75 1HB GLU 11 1HB GLU 11 -2.083 4.585 1.588
76 2HB GLU 11 2HB GLU 11 -1.916 6.219 2.238
77 1HG GLU 11 1HG GLU 11 -3.999 6.932 1.419
78 2HG GLU 11 2HG GLU 11 -4.098 5.670 0.200
79 H ASN 12 H ASN 12 0.333 4.443 -0.759
80 HA ASN 12 HA ASN 12 2.573 6.296 -0.219
81 1HB ASN 12 1HB ASN 12 2.098 3.829 1.323
82 2HB ASN 12 2HB ASN 12 3.611 3.748 0.443
83 1HD2 ASN 12 1HD2 ASN 12 1.916 6.553 2.033
84 2HD2 ASN 12 2HD2 ASN 12 3.295 6.899 3.093
85 H GLY 13 H GLY 13 1.210 3.624 -2.045
86 1HA GLY 13 1HA GLY 13 1.586 3.274 -4.348
87 2HA GLY 13 2HA GLY 13 3.077 4.218 -4.265
88 H ALA 14 H ALA 14 4.660 3.263 -2.534
89 HA ALA 14 HA ALA 14 4.801 0.303 -2.617
90 1HB ALA 14 1HB ALA 14 6.929 2.088 -3.876
91 2HB ALA 14 2HB ALA 14 7.023 0.325 -3.664
92 3HB ALA 14 3HB ALA 14 5.808 1.020 -4.754
93 H GLU 15 H GLU 15 4.300 1.140 -0.302
94 HA GLU 15 HA GLU 15 6.639 1.840 1.289
95 1HB GLU 15 1HB GLU 15 5.279 1.148 3.191
96 2HB GLU 15 2HB GLU 15 4.464 2.324 2.167
97 1HG GLU 15 1HG GLU 15 3.161 0.435 1.101
98 2HG GLU 15 2HG GLU 15 3.924 -0.679 2.242
99 H GLY 16 H GLY 16 7.768 0.219 2.739
100 1HA GLY 16 1HA GLY 16 8.496 -1.855 3.324
101 2HA GLY 16 2HA GLY 16 7.576 -2.612 2.004
102 H MET 17 H MET 17 8.471 -0.675 -0.013
103 HA MET 17 HA MET 17 10.845 -1.797 -0.968
104 1HB MET 17 1HB MET 17 8.668 -0.406 -1.904
105 2HB MET 17 2HB MET 17 9.831 0.914 -1.822
106 1HG MET 17 1HG MET 17 11.431 -0.584 -2.996
107 2HG MET 17 2HG MET 17 10.132 -1.742 -3.252
108 1HE MET 17 1HE MET 17 10.293 2.453 -5.271
109 2HE MET 17 2HE MET 17 9.759 2.283 -3.589
110 3HE MET 17 3HE MET 17 11.436 1.876 -4.036
111 H ILE 18 H ILE 18 10.051 1.080 0.840
112 HA ILE 18 HA ILE 18 12.674 2.383 0.639
113 HB ILE 18 HB ILE 18 10.460 2.851 2.687
114 1HG1 ILE 18 1HG1 ILE 18 10.182 4.989 1.024
115 2HG1 ILE 18 2HG1 ILE 18 10.652 3.771 -0.163
116 1HG2 ILE 18 1HG2 ILE 18 12.644 3.832 3.316
117 2HG2 ILE 18 2HG2 ILE 18 12.735 4.657 1.746
118 3HG2 ILE 18 3HG2 ILE 18 11.479 5.095 2.928
119 1HD1 ILE 18 1HD1 ILE 18 8.754 2.340 0.715
120 2HD1 ILE 18 2HD1 ILE 18 8.330 3.655 1.826
121 3HD1 ILE 18 3HD1 ILE 18 8.210 3.904 0.074
122 H ASP 19 H ASP 19 10.867 0.459 2.972
123 HA ASP 19 HA ASP 19 12.448 0.669 5.180
124 1HB ASP 19 1HB ASP 19 10.470 -1.528 4.475
125 2HB ASP 19 2HB ASP 19 10.910 -0.978 6.091
126 H GLY 20 H GLY 20 13.861 -0.603 2.722
127 1HA GLY 20 1HA GLY 20 14.820 -3.233 3.553
128 2HA GLY 20 2HA GLY 20 15.421 -2.235 2.220
Start of MODEL 22
1 1H GLY 1 1HN GLY 1 -8.931 -7.538 5.007
2 2H GLY 1 2HN GLY 1 -9.048 -8.873 4.062
3 3H GLY 1 3HN GLY 1 -10.079 -8.686 5.343
4 1HA GLY 1 1HA GLY 1 -11.175 -8.207 3.238
5 2HA GLY 1 2HA GLY 1 -11.115 -6.800 4.325
6 H LEU 2 H LEU 2 -11.329 -6.743 1.398
7 HA LEU 2 HA LEU 2 -8.982 -6.620 -0.002
8 1HB LEU 2 1HB LEU 2 -10.220 -5.594 -1.756
9 2HB LEU 2 2HB LEU 2 -11.266 -6.717 -0.914
10 HG LEU 2 HG LEU 2 -11.905 -4.417 0.441
11 1HD1 LEU 2 1HD1 LEU 2 -12.142 -2.558 -1.164
12 2HD1 LEU 2 2HD1 LEU 2 -10.435 -2.966 -0.974
13 3HD1 LEU 2 3HD1 LEU 2 -11.310 -3.502 -2.416
14 1HD2 LEU 2 1HD2 LEU 2 -13.509 -5.955 -0.624
15 2HD2 LEU 2 2HD2 LEU 2 -13.897 -4.272 -1.006
16 3HD2 LEU 2 3HD2 LEU 2 -13.102 -5.294 -2.223
17 H PHE 3 H PHE 3 -10.140 -4.079 2.125
18 HA PHE 3 HA PHE 3 -8.861 -1.790 1.187
19 1HB PHE 3 1HB PHE 3 -10.372 -2.327 3.237
20 2HB PHE 3 2HB PHE 3 -8.960 -2.778 4.076
21 HD1 PHE 3 1HD PHE 3 -7.559 -1.133 5.151
22 HD2 PHE 3 2HD PHE 3 -10.489 0.123 2.235
23 HE1 PHE 3 1HE PHE 3 -7.137 1.236 5.737
24 HE2 PHE 3 2HE PHE 3 -10.046 2.491 2.824
25 HZ PHE 3 HZ PHE 3 -8.374 3.051 4.575
26 H GLY 4 H GLY 4 -7.751 -4.342 3.196
27 1HA GLY 4 1HA GLY 4 -5.028 -3.520 3.690
28 2HA GLY 4 2HA GLY 4 -5.641 -5.166 3.880
29 H ALA 5 H ALA 5 -6.376 -4.767 0.727
30 HA ALA 5 HA ALA 5 -3.722 -5.693 -0.238
31 1HB ALA 5 1HB ALA 5 -5.744 -7.030 -0.817
32 2HB ALA 5 2HB ALA 5 -6.407 -5.614 -1.674
33 3HB ALA 5 3HB ALA 5 -4.912 -6.373 -2.241
34 H ILE 6 H ILE 6 -5.727 -2.827 -0.154
35 HA ILE 6 HA ILE 6 -3.971 -1.542 -2.115
36 HB ILE 6 HB ILE 6 -5.932 0.132 -2.331
37 1HG1 ILE 6 1HG1 ILE 6 -7.415 -2.449 -1.909
38 2HG1 ILE 6 2HG1 ILE 6 -7.245 -1.245 -0.631
39 1HG2 ILE 6 1HG2 ILE 6 -6.607 -1.119 -4.327
40 2HG2 ILE 6 2HG2 ILE 6 -4.847 -1.119 -4.103
41 3HG2 ILE 6 3HG2 ILE 6 -5.788 -2.571 -3.680
42 1HD1 ILE 6 1HD1 ILE 6 -8.650 -0.798 -3.301
43 2HD1 ILE 6 2HD1 ILE 6 -9.411 -0.920 -1.707
44 3HD1 ILE 6 3HD1 ILE 6 -8.364 0.461 -2.077
45 H ALA 7 H ALA 7 -6.122 0.289 -0.200
46 HA ALA 7 HA ALA 7 -5.679 2.300 0.623
47 1HB ALA 7 1HB ALA 7 -4.790 0.383 2.824
48 2HB ALA 7 2HB ALA 7 -5.316 2.066 3.079
49 3HB ALA 7 3HB ALA 7 -6.451 0.865 2.432
50 H GLY 8 H GLY 8 -2.764 0.697 1.979
51 1HA GLY 8 1HA GLY 8 -1.003 2.923 1.949
52 2HA GLY 8 2HA GLY 8 -0.546 1.223 1.898
53 H PHE 9 H PHE 9 -2.028 0.700 -0.658
54 HA PHE 9 HA PHE 9 -0.094 1.348 -2.609
55 1HB PHE 9 1HB PHE 9 -1.919 -0.454 -2.608
56 2HB PHE 9 2HB PHE 9 -3.043 0.818 -3.093
57 HD1 PHE 9 1HD PHE 9 -3.300 1.295 -5.398
58 HD2 PHE 9 2HD PHE 9 0.295 -0.669 -4.045
59 HE1 PHE 9 1HE PHE 9 -2.543 1.056 -7.746
60 HE2 PHE 9 2HE PHE 9 1.053 -0.899 -6.387
61 HZ PHE 9 HZ PHE 9 -0.369 -0.048 -8.253
62 H ILE 10 H ILE 10 -2.783 3.269 -1.388
63 HA ILE 10 HA ILE 10 -2.601 5.164 -3.669
64 HB ILE 10 HB ILE 10 -4.735 4.760 -1.521
65 1HG1 ILE 10 1HG1 ILE 10 -5.958 4.378 -4.000
66 2HG1 ILE 10 2HG1 ILE 10 -4.383 3.647 -4.281
67 1HG2 ILE 10 1HG2 ILE 10 -4.668 6.615 -3.933
68 2HG2 ILE 10 2HG2 ILE 10 -6.065 6.355 -2.854
69 3HG2 ILE 10 3HG2 ILE 10 -4.595 7.106 -2.222
70 1HD1 ILE 10 1HD1 ILE 10 -4.737 2.211 -2.263
71 2HD1 ILE 10 2HD1 ILE 10 -6.314 2.989 -2.007
72 3HD1 ILE 10 3HD1 ILE 10 -6.032 2.029 -3.474
73 H GLU 11 H GLU 11 -2.530 4.890 -0.043
74 HA GLU 11 HA GLU 11 -1.867 7.577 0.462
75 1HB GLU 11 1HB GLU 11 -1.073 5.040 1.924
76 2HB GLU 11 2HB GLU 11 -1.056 6.648 2.628
77 1HG GLU 11 1HG GLU 11 -3.671 5.589 1.475
78 2HG GLU 11 2HG GLU 11 -3.080 4.956 2.977
79 H ASN 12 H ASN 12 0.146 4.969 -0.847
80 HA ASN 12 HA ASN 12 2.278 6.929 -1.306
81 1HB ASN 12 1HB ASN 12 3.039 5.853 0.776
82 2HB ASN 12 2HB ASN 12 2.794 4.249 0.071
83 1HD2 ASN 12 1HD2 ASN 12 5.122 6.678 0.510
84 2HD2 ASN 12 2HD2 ASN 12 6.169 6.351 -0.864
85 H GLY 13 H GLY 13 1.481 3.432 -1.544
86 1HA GLY 13 1HA GLY 13 1.303 2.558 -3.960
87 2HA GLY 13 2HA GLY 13 2.846 3.386 -4.186
88 H ALA 14 H ALA 14 4.567 2.816 -2.422
89 HA ALA 14 HA ALA 14 4.519 -0.050 -1.704
90 1HB ALA 14 1HB ALA 14 6.283 -0.676 -3.278
91 2HB ALA 14 2HB ALA 14 4.892 -0.035 -4.162
92 3HB ALA 14 3HB ALA 14 6.337 0.980 -3.923
93 H GLU 15 H GLU 15 5.504 2.905 -0.595
94 HA GLU 15 HA GLU 15 8.228 2.517 -0.091
95 1HB GLU 15 1HB GLU 15 8.111 4.136 1.642
96 2HB GLU 15 2HB GLU 15 7.099 4.639 0.307
97 1HG GLU 15 1HG GLU 15 5.070 3.925 1.581
98 2HG GLU 15 2HG GLU 15 6.094 3.351 2.898
99 H GLY 16 H GLY 16 9.437 1.844 1.658
100 1HA GLY 16 1HA GLY 16 9.933 0.863 3.734
101 2HA GLY 16 2HA GLY 16 8.291 0.190 3.817
102 H MET 17 H MET 17 8.127 -0.798 1.176
103 HA MET 17 HA MET 17 9.066 -3.393 1.390
104 1HB MET 17 1HB MET 17 7.249 -1.981 -0.111
105 2HB MET 17 2HB MET 17 8.525 -2.177 -1.309
106 1HG MET 17 1HG MET 17 8.581 -4.589 -0.587
107 2HG MET 17 2HG MET 17 7.079 -4.317 0.284
108 1HE MET 17 1HE MET 17 8.856 -4.547 -3.150
109 2HE MET 17 2HE MET 17 7.550 -4.322 -4.337
110 3HE MET 17 3HE MET 17 8.141 -2.936 -3.401
111 H ILE 18 H ILE 18 10.371 -0.605 -0.143
112 HA ILE 18 HA ILE 18 12.450 -1.670 -1.751
113 HB ILE 18 HB ILE 18 12.170 1.001 -0.312
114 1HG1 ILE 18 1HG1 ILE 18 11.865 1.872 -2.660
115 2HG1 ILE 18 2HG1 ILE 18 11.850 0.215 -3.254
116 1HG2 ILE 18 1HG2 ILE 18 13.961 1.892 -1.798
117 2HG2 ILE 18 2HG2 ILE 18 14.571 0.708 -0.652
118 3HG2 ILE 18 3HG2 ILE 18 14.307 0.235 -2.344
119 1HD1 ILE 18 1HD1 ILE 18 9.724 -0.201 -2.187
120 2HD1 ILE 18 2HD1 ILE 18 9.850 1.297 -1.225
121 3HD1 ILE 18 3HD1 ILE 18 9.603 1.369 -2.980
122 H ASP 19 H ASP 19 12.406 -1.133 1.803
123 HA ASP 19 HA ASP 19 14.933 -2.491 2.184
124 1HB ASP 19 1HB ASP 19 15.994 -0.506 1.389
125 2HB ASP 19 2HB ASP 19 14.853 0.544 2.231
126 H GLY 20 H GLY 20 13.371 0.288 3.828
127 1HA GLY 20 1HA GLY 20 12.247 0.402 5.872
128 2HA GLY 20 2HA GLY 20 12.384 -1.356 6.066
Start of MODEL 23
1 1H GLY 1 1HN GLY 1 -9.432 -7.515 5.025
2 2H GLY 1 2HN GLY 1 -10.048 -8.617 3.982
3 3H GLY 1 3HN GLY 1 -10.734 -8.435 5.476
4 1HA GLY 1 1HA GLY 1 -12.063 -7.391 3.734
5 2HA GLY 1 2HA GLY 1 -11.472 -6.236 4.953
6 H LEU 2 H LEU 2 -12.199 -5.646 2.163
7 HA LEU 2 HA LEU 2 -10.196 -5.771 0.317
8 1HB LEU 2 1HB LEU 2 -11.434 -4.172 -0.966
9 2HB LEU 2 2HB LEU 2 -12.535 -5.232 -0.115
10 HG LEU 2 HG LEU 2 -12.467 -3.187 1.690
11 1HD1 LEU 2 1HD1 LEU 2 -12.529 -1.020 0.521
12 2HD1 LEU 2 2HD1 LEU 2 -10.937 -1.753 0.320
13 3HD1 LEU 2 3HD1 LEU 2 -12.101 -1.805 -1.012
14 1HD2 LEU 2 1HD2 LEU 2 -14.496 -4.144 0.677
15 2HD2 LEU 2 2HD2 LEU 2 -14.563 -2.377 0.679
16 3HD2 LEU 2 3HD2 LEU 2 -14.187 -3.244 -0.825
17 H PHE 3 H PHE 3 -10.345 -3.386 2.906
18 HA PHE 3 HA PHE 3 -8.750 -1.312 1.967
19 1HB PHE 3 1HB PHE 3 -9.999 -1.754 4.195
20 2HB PHE 3 2HB PHE 3 -8.628 -2.614 4.730
21 HD1 PHE 3 1HD PHE 3 -9.709 0.771 3.524
22 HD2 PHE 3 2HD PHE 3 -6.667 -1.488 5.597
23 HE1 PHE 3 1HE PHE 3 -8.600 2.880 4.216
24 HE2 PHE 3 2HE PHE 3 -5.578 0.628 6.289
25 HZ PHE 3 HZ PHE 3 -6.534 2.810 5.596
26 H GLY 4 H GLY 4 -7.921 -4.240 3.538
27 1HA GLY 4 1HA GLY 4 -5.055 -4.008 3.669
28 2HA GLY 4 2HA GLY 4 -5.960 -5.515 3.848
29 H ALA 5 H ALA 5 -6.974 -4.638 0.862
30 HA ALA 5 HA ALA 5 -4.723 -6.005 -0.533
31 1HB ALA 5 1HB ALA 5 -7.453 -5.147 -1.581
32 2HB ALA 5 2HB ALA 5 -6.245 -6.125 -2.430
33 3HB ALA 5 3HB ALA 5 -7.043 -6.776 -0.984
34 H ILE 6 H ILE 6 -6.087 -2.806 -0.010
35 HA ILE 6 HA ILE 6 -4.315 -1.673 -2.043
36 HB ILE 6 HB ILE 6 -6.049 0.268 -2.001
37 1HG1 ILE 6 1HG1 ILE 6 -7.825 -2.120 -1.599
38 2HG1 ILE 6 2HG1 ILE 6 -7.393 -1.041 -0.272
39 1HG2 ILE 6 1HG2 ILE 6 -5.269 -0.991 -3.923
40 2HG2 ILE 6 2HG2 ILE 6 -6.361 -2.335 -3.507
41 3HG2 ILE 6 3HG2 ILE 6 -7.026 -0.750 -4.002
42 1HD1 ILE 6 1HD1 ILE 6 -9.576 -0.378 -1.155
43 2HD1 ILE 6 2HD1 ILE 6 -8.386 0.890 -1.507
44 3HD1 ILE 6 3HD1 ILE 6 -8.913 -0.226 -2.790
45 H ALA 7 H ALA 7 -6.030 0.323 0.106
46 HA ALA 7 HA ALA 7 -5.282 2.185 1.037
47 1HB ALA 7 1HB ALA 7 -4.707 1.671 3.419
48 2HB ALA 7 2HB ALA 7 -6.014 0.648 2.800
49 3HB ALA 7 3HB ALA 7 -4.378 -0.016 2.964
50 H GLY 8 H GLY 8 -2.434 0.260 2.074
51 1HA GLY 8 1HA GLY 8 -0.486 2.289 1.853
52 2HA GLY 8 2HA GLY 8 -0.201 0.550 1.745
53 H PHE 9 H PHE 9 -1.905 0.163 -0.700
54 HA PHE 9 HA PHE 9 -0.074 0.708 -2.753
55 1HB PHE 9 1HB PHE 9 -2.043 -0.905 -2.698
56 2HB PHE 9 2HB PHE 9 -3.093 0.473 -3.019
57 HD1 PHE 9 1HD PHE 9 0.000 -1.216 -4.341
58 HD2 PHE 9 2HD PHE 9 -3.539 1.067 -5.265
59 HE1 PHE 9 1HE PHE 9 0.503 -1.415 -6.761
60 HE2 PHE 9 2HE PHE 9 -3.041 0.864 -7.685
61 HZ PHE 9 HZ PHE 9 -1.024 -0.385 -8.445
62 H ILE 10 H ILE 10 -2.396 2.861 -1.305
63 HA ILE 10 HA ILE 10 -2.156 4.864 -3.504
64 HB ILE 10 HB ILE 10 -4.318 4.374 -1.390
65 1HG1 ILE 10 1HG1 ILE 10 -5.489 4.389 -3.964
66 2HG1 ILE 10 2HG1 ILE 10 -3.973 3.538 -4.231
67 1HG2 ILE 10 1HG2 ILE 10 -4.083 6.780 -1.768
68 2HG2 ILE 10 2HG2 ILE 10 -4.147 6.532 -3.531
69 3HG2 ILE 10 3HG2 ILE 10 -5.570 6.184 -2.513
70 1HD1 ILE 10 1HD1 ILE 10 -4.559 2.040 -2.284
71 2HD1 ILE 10 2HD1 ILE 10 -6.116 2.881 -2.165
72 3HD1 ILE 10 3HD1 ILE 10 -5.717 1.960 -3.634
73 H GLU 11 H GLU 11 -2.185 4.374 0.055
74 HA GLU 11 HA GLU 11 -1.341 7.039 0.703
75 1HB GLU 11 1HB GLU 11 -1.220 4.413 2.239
76 2HB GLU 11 2HB GLU 11 -0.891 5.999 2.947
77 1HG GLU 11 1HG GLU 11 -3.161 6.762 2.455
78 2HG GLU 11 2HG GLU 11 -3.546 5.251 1.633
79 H ASN 12 H ASN 12 0.427 4.351 -0.584
80 HA ASN 12 HA ASN 12 2.931 5.905 -0.292
81 1HB ASN 12 1HB ASN 12 2.870 4.152 1.498
82 2HB ASN 12 2HB ASN 12 2.715 2.912 0.256
83 1HD2 ASN 12 1HD2 ASN 12 4.925 5.293 1.699
84 2HD2 ASN 12 2HD2 ASN 12 6.340 4.707 0.832
85 H GLY 13 H GLY 13 1.714 2.816 -1.730
86 1HA GLY 13 1HA GLY 13 1.705 2.058 -3.879
87 2HA GLY 13 2HA GLY 13 1.944 3.717 -4.417
88 H ALA 14 H ALA 14 4.604 2.894 -2.426
89 HA ALA 14 HA ALA 14 6.198 1.690 -4.622
90 1HB ALA 14 1HB ALA 14 6.595 4.134 -4.624
91 2HB ALA 14 2HB ALA 14 7.001 4.067 -2.890
92 3HB ALA 14 3HB ALA 14 8.029 3.239 -4.080
93 H GLU 15 H GLU 15 4.896 0.369 -2.536
94 HA GLU 15 HA GLU 15 6.249 0.407 -0.081
95 1HB GLU 15 1HB GLU 15 4.353 -1.634 -1.317
96 2HB GLU 15 2HB GLU 15 4.764 -1.578 0.403
97 1HG GLU 15 1HG GLU 15 3.638 0.479 0.749
98 2HG GLU 15 2HG GLU 15 3.586 0.876 -0.965
99 H GLY 16 H GLY 16 7.563 -1.048 0.963
100 1HA GLY 16 1HA GLY 16 8.862 -2.976 1.329
101 2HA GLY 16 2HA GLY 16 8.755 -3.385 -0.394
102 H MET 17 H MET 17 9.338 -0.805 -1.427
103 HA MET 17 HA MET 17 12.095 -0.765 -1.697
104 1HB MET 17 1HB MET 17 9.865 0.385 -2.885
105 2HB MET 17 2HB MET 17 10.599 1.786 -2.101
106 1HG MET 17 1HG MET 17 12.774 0.951 -3.090
107 2HG MET 17 2HG MET 17 11.831 -0.146 -4.093
108 1HE MET 17 1HE MET 17 13.891 1.847 -5.373
109 2HE MET 17 2HE MET 17 12.844 0.772 -6.331
110 3HE MET 17 3HE MET 17 12.955 2.499 -6.738
111 H ILE 18 H ILE 18 9.984 0.862 0.486
112 HA ILE 18 HA ILE 18 11.504 2.823 1.747
113 HB ILE 18 HB ILE 18 9.466 0.871 2.900
114 1HG1 ILE 18 1HG1 ILE 18 7.907 2.780 2.853
115 2HG1 ILE 18 2HG1 ILE 18 9.136 3.810 2.115
116 1HG2 ILE 18 1HG2 ILE 18 10.573 3.392 4.201
117 2HG2 ILE 18 2HG2 ILE 18 9.136 2.501 4.763
118 3HG2 ILE 18 3HG2 ILE 18 10.710 1.730 4.806
119 1HD1 ILE 18 1HD1 ILE 18 8.965 2.633 0.039
120 2HD1 ILE 18 2HD1 ILE 18 8.092 1.274 0.805
121 3HD1 ILE 18 3HD1 ILE 18 7.317 2.853 0.611
122 H ASP 19 H ASP 19 11.889 -0.710 2.100
123 HA ASP 19 HA ASP 19 13.162 -2.002 3.421
124 1HB ASP 19 1HB ASP 19 14.960 -0.828 2.161
125 2HB ASP 19 2HB ASP 19 15.130 0.316 3.491
126 H GLY 20 H GLY 20 14.877 -0.752 5.684
127 1HA GLY 20 1HA GLY 20 13.116 0.554 7.518
128 2HA GLY 20 2HA GLY 20 13.180 -1.175 7.870
Start of MODEL 24
1 1H GLY 1 1HN GLY 1 -8.202 -7.306 5.293
2 2H GLY 1 2HN GLY 1 -8.179 -8.719 4.466
3 3H GLY 1 3HN GLY 1 -9.198 -8.547 5.758
4 1HA GLY 1 1HA GLY 1 -10.382 -8.381 3.650
5 2HA GLY 1 2HA GLY 1 -10.479 -6.895 4.623
6 H LEU 2 H LEU 2 -10.804 -6.984 1.752
7 HA LEU 2 HA LEU 2 -8.550 -6.725 0.218
8 1HB LEU 2 1HB LEU 2 -9.967 -5.889 -1.503
9 2HB LEU 2 2HB LEU 2 -10.866 -7.057 -0.559
10 HG LEU 2 HG LEU 2 -11.623 -4.756 0.736
11 1HD1 LEU 2 1HD1 LEU 2 -10.356 -3.269 -0.845
12 2HD1 LEU 2 2HD1 LEU 2 -11.302 -3.928 -2.188
13 3HD1 LEU 2 3HD1 LEU 2 -12.099 -2.996 -0.906
14 1HD2 LEU 2 1HD2 LEU 2 -13.147 -6.471 -0.153
15 2HD2 LEU 2 2HD2 LEU 2 -13.700 -4.850 -0.593
16 3HD2 LEU 2 3HD2 LEU 2 -12.890 -5.866 -1.804
17 H PHE 3 H PHE 3 -9.811 -4.208 2.309
18 HA PHE 3 HA PHE 3 -8.766 -1.859 1.227
19 1HB PHE 3 1HB PHE 3 -10.127 -2.404 3.369
20 2HB PHE 3 2HB PHE 3 -8.653 -2.748 4.151
21 HD1 PHE 3 1HD PHE 3 -10.546 -0.005 2.451
22 HD2 PHE 3 2HD PHE 3 -7.174 -0.993 4.963
23 HE1 PHE 3 1HE PHE 3 -10.206 2.399 2.959
24 HE2 PHE 3 2HE PHE 3 -6.851 1.411 5.465
25 HZ PHE 3 HZ PHE 3 -8.359 3.108 4.465
26 H GLY 4 H GLY 4 -7.361 -4.212 3.304
27 1HA GLY 4 1HA GLY 4 -4.681 -3.159 3.560
28 2HA GLY 4 2HA GLY 4 -5.167 -4.814 3.939
29 H ALA 5 H ALA 5 -6.099 -4.694 0.785
30 HA ALA 5 HA ALA 5 -3.455 -5.578 -0.242
31 1HB ALA 5 1HB ALA 5 -6.194 -5.666 -1.572
32 2HB ALA 5 2HB ALA 5 -4.693 -6.400 -2.157
33 3HB ALA 5 3HB ALA 5 -5.448 -7.011 -0.670
34 H ILE 6 H ILE 6 -5.583 -2.785 -0.239
35 HA ILE 6 HA ILE 6 -3.902 -1.521 -2.266
36 HB ILE 6 HB ILE 6 -5.967 0.045 -2.538
37 1HG1 ILE 6 1HG1 ILE 6 -7.288 -2.603 -2.012
38 2HG1 ILE 6 2HG1 ILE 6 -7.186 -1.337 -0.785
39 1HG2 ILE 6 1HG2 ILE 6 -4.786 -1.197 -4.255
40 2HG2 ILE 6 2HG2 ILE 6 -5.621 -2.694 -3.778
41 3HG2 ILE 6 3HG2 ILE 6 -6.540 -1.333 -4.490
42 1HD1 ILE 6 1HD1 ILE 6 -8.421 0.229 -2.283
43 2HD1 ILE 6 2HD1 ILE 6 -8.613 -1.088 -3.467
44 3HD1 ILE 6 3HD1 ILE 6 -9.370 -1.212 -1.870
45 H ALA 7 H ALA 7 -6.115 0.327 -0.439
46 HA ALA 7 HA ALA 7 -5.688 2.418 0.254
47 1HB ALA 7 1HB ALA 7 -5.392 2.308 2.725
48 2HB ALA 7 2HB ALA 7 -6.498 1.064 2.118
49 3HB ALA 7 3HB ALA 7 -4.841 0.624 2.576
50 H GLY 8 H GLY 8 -2.840 1.003 1.896
51 1HA GLY 8 1HA GLY 8 -1.046 3.129 1.677
52 2HA GLY 8 2HA GLY 8 -0.606 1.428 1.739
53 H PHE 9 H PHE 9 -1.985 0.763 -0.856
54 HA PHE 9 HA PHE 9 0.081 1.297 -2.721
55 1HB PHE 9 1HB PHE 9 -1.655 -0.564 -2.711
56 2HB PHE 9 2HB PHE 9 -2.825 0.618 -3.294
57 HD1 PHE 9 1HD PHE 9 -3.006 1.040 -5.626
58 HD2 PHE 9 2HD PHE 9 0.568 -0.806 -4.070
59 HE1 PHE 9 1HE PHE 9 -2.168 0.708 -7.936
60 HE2 PHE 9 2HE PHE 9 1.408 -1.128 -6.375
61 HZ PHE 9 HZ PHE 9 0.033 -0.387 -8.322
62 H ILE 10 H ILE 10 -2.674 3.233 -1.788
63 HA ILE 10 HA ILE 10 -2.402 5.004 -4.167
64 HB ILE 10 HB ILE 10 -4.705 4.547 -2.210
65 1HG1 ILE 10 1HG1 ILE 10 -5.640 3.990 -4.786
66 2HG1 ILE 10 2HG1 ILE 10 -3.998 3.372 -4.872
67 1HG2 ILE 10 1HG2 ILE 10 -4.677 6.874 -2.977
68 2HG2 ILE 10 2HG2 ILE 10 -4.536 6.335 -4.669
69 3HG2 ILE 10 3HG2 ILE 10 -6.012 5.992 -3.728
70 1HD1 ILE 10 1HD1 ILE 10 -6.153 2.643 -2.840
71 2HD1 ILE 10 2HD1 ILE 10 -5.506 1.624 -4.147
72 3HD1 ILE 10 3HD1 ILE 10 -4.485 2.051 -2.755
73 H GLU 11 H GLU 11 -2.532 4.844 -0.590
74 HA GLU 11 HA GLU 11 -2.014 7.637 -0.163
75 1HB GLU 11 1HB GLU 11 -1.438 5.207 1.565
76 2HB GLU 11 2HB GLU 11 -1.334 6.878 2.119
77 1HG GLU 11 1HG GLU 11 -3.703 7.240 1.777
78 2HG GLU 11 2HG GLU 11 -3.903 5.684 0.979
79 H ASN 12 H ASN 12 0.130 4.991 -1.153
80 HA ASN 12 HA ASN 12 2.261 6.981 -1.524
81 1HB ASN 12 1HB ASN 12 2.870 5.977 0.647
82 2HB ASN 12 2HB ASN 12 2.685 4.352 -0.018
83 1HD2 ASN 12 1HD2 ASN 12 4.948 6.879 0.436
84 2HD2 ASN 12 2HD2 ASN 12 6.108 6.459 -0.818
85 H GLY 13 H GLY 13 1.526 3.474 -1.701
86 1HA GLY 13 1HA GLY 13 1.547 2.525 -4.106
87 2HA GLY 13 2HA GLY 13 3.124 3.323 -4.195
88 H ALA 14 H ALA 14 4.567 2.816 -2.133
89 HA ALA 14 HA ALA 14 4.408 -0.056 -1.408
90 1HB ALA 14 1HB ALA 14 6.485 -0.602 -2.633
91 2HB ALA 14 2HB ALA 14 5.206 -0.068 -3.733
92 3HB ALA 14 3HB ALA 14 6.522 1.045 -3.306
93 H GLU 15 H GLU 15 5.479 3.051 -0.399
94 HA GLU 15 HA GLU 15 8.017 2.540 0.559
95 1HB GLU 15 1HB GLU 15 7.847 4.342 2.040
96 2HB GLU 15 2HB GLU 15 6.982 4.750 0.571
97 1HG GLU 15 1HG GLU 15 4.811 4.279 1.745
98 2HG GLU 15 2HG GLU 15 5.699 3.859 3.209
99 H GLY 16 H GLY 16 9.035 1.803 2.393
100 1HA GLY 16 1HA GLY 16 9.171 0.862 4.490
101 2HA GLY 16 2HA GLY 16 7.487 0.270 4.380
102 H MET 17 H MET 17 7.734 -0.759 1.608
103 HA MET 17 HA MET 17 8.928 -3.279 2.165
104 1HB MET 17 1HB MET 17 6.992 -2.220 0.418
105 2HB MET 17 2HB MET 17 8.351 -2.545 -0.665
106 1HG MET 17 1HG MET 17 8.530 -4.753 0.572
107 2HG MET 17 2HG MET 17 6.925 -4.436 1.225
108 1HE MET 17 1HE MET 17 6.168 -6.812 0.283
109 2HE MET 17 2HE MET 17 6.351 -7.307 -1.415
110 3HE MET 17 3HE MET 17 7.792 -7.060 -0.402
111 H ILE 18 H ILE 18 9.831 -0.342 0.514
112 HA ILE 18 HA ILE 18 12.142 -1.451 -0.932
113 HB ILE 18 HB ILE 18 11.532 1.458 -0.236
114 1HG1 ILE 18 1HG1 ILE 18 11.005 1.281 -2.931
115 2HG1 ILE 18 2HG1 ILE 18 10.429 -0.299 -2.395
116 1HG2 ILE 18 1HG2 ILE 18 13.890 1.114 -0.868
117 2HG2 ILE 18 2HG2 ILE 18 13.387 0.274 -2.351
118 3HG2 ILE 18 3HG2 ILE 18 13.038 2.004 -2.125
119 1HD1 ILE 18 1HD1 ILE 18 8.623 1.340 -2.338
120 2HD1 ILE 18 2HD1 ILE 18 9.043 0.926 -0.663
121 3HD1 ILE 18 3HD1 ILE 18 9.599 2.457 -1.367
122 H ASP 19 H ASP 19 11.585 0.520 1.929
123 HA ASP 19 HA ASP 19 14.100 1.011 2.853
124 1HB ASP 19 1HB ASP 19 11.530 0.773 4.461
125 2HB ASP 19 2HB ASP 19 12.909 1.818 4.807
126 H GLY 20 H GLY 20 13.232 -2.042 2.579
127 1HA GLY 20 1HA GLY 20 15.021 -3.002 4.633
128 2HA GLY 20 2HA GLY 20 13.351 -3.478 4.969
Start of MODEL 25
1 1H GLY 1 1HN GLY 1 -9.864 -6.896 4.635
2 2H GLY 1 2HN GLY 1 -10.051 -8.237 3.713
3 3H GLY 1 3HN GLY 1 -11.146 -7.909 4.909
4 1HA GLY 1 1HA GLY 1 -12.033 -7.380 2.719
5 2HA GLY 1 2HA GLY 1 -11.903 -5.955 3.777
6 H LEU 2 H LEU 2 -11.927 -5.887 0.871
7 HA LEU 2 HA LEU 2 -9.581 -6.080 -0.456
8 1HB LEU 2 1HB LEU 2 -10.509 -4.736 -2.158
9 2HB LEU 2 2HB LEU 2 -11.785 -5.737 -1.496
10 HG LEU 2 HG LEU 2 -11.398 -2.794 -0.745
11 1HD1 LEU 2 1HD1 LEU 2 -13.179 -2.295 -2.374
12 2HD1 LEU 2 2HD1 LEU 2 -11.778 -3.013 -3.176
13 3HD1 LEU 2 3HD1 LEU 2 -13.223 -4.002 -2.870
14 1HD2 LEU 2 1HD2 LEU 2 -13.763 -4.685 -0.392
15 2HD2 LEU 2 2HD2 LEU 2 -12.812 -3.892 0.895
16 3HD2 LEU 2 3HD2 LEU 2 -13.833 -2.931 -0.159
17 H PHE 3 H PHE 3 -10.485 -3.254 1.504
18 HA PHE 3 HA PHE 3 -8.719 -1.314 0.676
19 1HB PHE 3 1HB PHE 3 -10.543 -1.485 2.522
20 2HB PHE 3 2HB PHE 3 -9.343 -2.087 3.563
21 HD1 PHE 3 1HD PHE 3 -10.169 0.890 1.424
22 HD2 PHE 3 2HD PHE 3 -7.832 -0.601 4.737
23 HE1 PHE 3 1HE PHE 3 -9.443 3.199 1.964
24 HE2 PHE 3 2HE PHE 3 -7.123 1.712 5.269
25 HZ PHE 3 HZ PHE 3 -7.919 3.613 3.884
26 H GLY 4 H GLY 4 -8.290 -3.877 2.894
27 1HA GLY 4 1HA GLY 4 -5.602 -3.437 3.818
28 2HA GLY 4 2HA GLY 4 -6.454 -4.984 3.894
29 H ALA 5 H ALA 5 -6.629 -4.646 0.691
30 HA ALA 5 HA ALA 5 -3.996 -5.922 0.174
31 1HB ALA 5 1HB ALA 5 -6.353 -5.445 -1.699
32 2HB ALA 5 2HB ALA 5 -4.912 -6.421 -2.025
33 3HB ALA 5 3HB ALA 5 -6.062 -6.945 -0.776
34 H ILE 6 H ILE 6 -5.525 -2.784 -0.080
35 HA ILE 6 HA ILE 6 -3.420 -1.861 -1.903
36 HB ILE 6 HB ILE 6 -5.140 -0.020 -2.461
37 1HG1 ILE 6 1HG1 ILE 6 -6.945 -2.388 -2.004
38 2HG1 ILE 6 2HG1 ILE 6 -6.775 -1.084 -0.831
39 1HG2 ILE 6 1HG2 ILE 6 -4.037 -1.529 -4.013
40 2HG2 ILE 6 2HG2 ILE 6 -5.192 -2.820 -3.599
41 3HG2 ILE 6 3HG2 ILE 6 -5.750 -1.338 -4.428
42 1HD1 ILE 6 1HD1 ILE 6 -7.839 -0.763 -3.666
43 2HD1 ILE 6 2HD1 ILE 6 -8.779 -0.694 -2.165
44 3HD1 ILE 6 3HD1 ILE 6 -7.577 0.565 -2.509
45 H ALA 7 H ALA 7 -5.584 0.244 -0.257
46 HA ALA 7 HA ALA 7 -5.036 2.309 0.379
47 1HB ALA 7 1HB ALA 7 -4.849 2.278 2.866
48 2HB ALA 7 2HB ALA 7 -6.007 1.077 2.260
49 3HB ALA 7 3HB ALA 7 -4.401 0.557 2.803
50 H GLY 8 H GLY 8 -2.374 0.747 2.187
51 1HA GLY 8 1HA GLY 8 -0.394 2.682 2.037
52 2HA GLY 8 2HA GLY 8 -0.115 0.950 2.074
53 H PHE 9 H PHE 9 -1.447 0.408 -0.514
54 HA PHE 9 HA PHE 9 0.626 0.768 -2.400
55 1HB PHE 9 1HB PHE 9 -1.355 -0.857 -2.416
56 2HB PHE 9 2HB PHE 9 -2.315 0.476 -3.065
57 HD1 PHE 9 1HD PHE 9 0.718 -1.641 -3.632
58 HD2 PHE 9 2HD PHE 9 -2.056 1.161 -5.381
59 HE1 PHE 9 1HE PHE 9 1.715 -2.048 -5.862
60 HE2 PHE 9 2HE PHE 9 -1.062 0.746 -7.614
61 HZ PHE 9 HZ PHE 9 0.820 -0.864 -7.864
62 H ILE 10 H ILE 10 -2.262 2.771 -1.740
63 HA ILE 10 HA ILE 10 -1.703 4.549 -4.020
64 HB ILE 10 HB ILE 10 -3.869 4.601 -1.846
65 1HG1 ILE 10 1HG1 ILE 10 -5.168 4.163 -4.266
66 2HG1 ILE 10 2HG1 ILE 10 -3.691 3.242 -4.514
67 1HG2 ILE 10 1HG2 ILE 10 -5.013 6.225 -3.321
68 2HG2 ILE 10 2HG2 ILE 10 -3.468 6.850 -2.737
69 3HG2 ILE 10 3HG2 ILE 10 -3.592 6.234 -4.402
70 1HD1 ILE 10 1HD1 ILE 10 -5.622 2.982 -2.160
71 2HD1 ILE 10 2HD1 ILE 10 -5.491 1.886 -3.551
72 3HD1 ILE 10 3HD1 ILE 10 -4.147 2.017 -2.386
73 H GLU 11 H GLU 11 -1.465 4.434 -0.475
74 HA GLU 11 HA GLU 11 -0.690 7.126 -0.051
75 1HB GLU 11 1HB GLU 11 0.113 4.603 1.420
76 2HB GLU 11 2HB GLU 11 0.397 6.228 2.033
77 1HG GLU 11 1HG GLU 11 -1.894 6.681 2.364
78 2HG GLU 11 2HG GLU 11 -2.425 5.402 1.284
79 H ASN 12 H ASN 12 1.180 4.417 -1.310
80 HA ASN 12 HA ASN 12 2.850 6.208 -2.672
81 1HB ASN 12 1HB ASN 12 4.059 6.256 -0.391
82 2HB ASN 12 2HB ASN 12 4.472 4.566 -0.689
83 1HD2 ASN 12 1HD2 ASN 12 6.778 5.333 -0.567
84 2HD2 ASN 12 2HD2 ASN 12 7.440 6.065 -2.037
85 H GLY 13 H GLY 13 2.700 2.899 -1.320
86 1HA GLY 13 1HA GLY 13 2.509 1.410 -3.653
87 2HA GLY 13 2HA GLY 13 4.231 1.777 -3.528
88 H ALA 14 H ALA 14 2.077 1.191 -0.772
89 HA ALA 14 HA ALA 14 2.041 -0.230 0.929
90 1HB ALA 14 1HB ALA 14 1.737 -2.076 -0.663
91 2HB ALA 14 2HB ALA 14 3.504 -2.267 -0.778
92 3HB ALA 14 3HB ALA 14 2.689 -2.552 0.764
93 H GLU 15 H GLU 15 3.294 1.334 2.078
94 HA GLU 15 HA GLU 15 6.005 1.517 1.711
95 1HB GLU 15 1HB GLU 15 3.950 2.627 3.573
96 2HB GLU 15 2HB GLU 15 5.617 2.761 4.136
97 1HG GLU 15 1HG GLU 15 4.628 3.630 1.393
98 2HG GLU 15 2HG GLU 15 4.880 4.695 2.761
99 H GLY 16 H GLY 16 7.650 1.559 3.195
100 1HA GLY 16 1HA GLY 16 9.074 0.645 4.849
101 2HA GLY 16 2HA GLY 16 7.914 -0.667 5.152
102 H MET 17 H MET 17 7.418 -1.301 2.364
103 HA MET 17 HA MET 17 9.379 -3.162 1.708
104 1HB MET 17 1HB MET 17 6.754 -2.667 1.226
105 2HB MET 17 2HB MET 17 7.416 -1.931 -0.238
106 1HG MET 17 1HG MET 17 8.654 -3.979 -0.633
107 2HG MET 17 2HG MET 17 7.939 -4.726 0.796
108 1HE MET 17 1HE MET 17 7.081 -3.182 -2.773
109 2HE MET 17 2HE MET 17 5.366 -3.629 -2.941
110 3HE MET 17 3HE MET 17 5.847 -2.423 -1.737
111 H ILE 18 H ILE 18 8.713 0.084 0.749
112 HA ILE 18 HA ILE 18 10.462 0.466 -1.473
113 HB ILE 18 HB ILE 18 9.270 2.297 0.632
114 1HG1 ILE 18 1HG1 ILE 18 7.960 3.216 -1.252
115 2HG1 ILE 18 2HG1 ILE 18 8.774 2.145 -2.388
116 1HG2 ILE 18 1HG2 ILE 18 10.967 3.239 -1.711
117 2HG2 ILE 18 2HG2 ILE 18 9.930 4.280 -0.703
118 3HG2 ILE 18 3HG2 ILE 18 11.310 3.469 0.018
119 1HD1 ILE 18 1HD1 ILE 18 6.424 1.504 -1.702
120 2HD1 ILE 18 2HD1 ILE 18 7.629 0.223 -1.493
121 3HD1 ILE 18 3HD1 ILE 18 7.062 1.153 -0.085
122 H ASP 19 H ASP 19 11.157 0.377 2.013
123 HA ASP 19 HA ASP 19 13.573 1.939 1.818
124 1HB ASP 19 1HB ASP 19 12.166 1.775 3.870
125 2HB ASP 19 2HB ASP 19 12.659 0.085 4.049
126 H GLY 20 H GLY 20 15.699 1.207 2.432
127 1HA GLY 20 1HA GLY 20 16.760 -1.242 2.721
128 2HA GLY 20 2HA GLY 20 16.572 -1.183 0.955
Start of MODEL 26
1 1H GLY 1 1HN GLY 1 -8.909 -6.324 5.439
2 2H GLY 1 2HN GLY 1 -9.140 -7.749 4.666
3 3H GLY 1 3HN GLY 1 -10.107 -7.349 5.947
4 1HA GLY 1 1HA GLY 1 -11.255 -7.056 3.835
5 2HA GLY 1 2HA GLY 1 -11.073 -5.536 4.741
6 H LEU 2 H LEU 2 -11.435 -5.671 1.884
7 HA LEU 2 HA LEU 2 -9.183 -5.902 0.338
8 1HB LEU 2 1HB LEU 2 -10.429 -4.897 -1.418
9 2HB LEU 2 2HB LEU 2 -11.528 -5.829 -0.424
10 HG LEU 2 HG LEU 2 -11.826 -3.368 0.761
11 1HD1 LEU 2 1HD1 LEU 2 -10.318 -2.210 -0.871
12 2HD1 LEU 2 2HD1 LEU 2 -11.352 -2.761 -2.197
13 3HD1 LEU 2 3HD1 LEU 2 -11.983 -1.633 -0.981
14 1HD2 LEU 2 1HD2 LEU 2 -13.892 -3.129 -0.565
15 2HD2 LEU 2 2HD2 LEU 2 -13.297 -4.334 -1.728
16 3HD2 LEU 2 3HD2 LEU 2 -13.651 -4.805 -0.051
17 H PHE 3 H PHE 3 -9.941 -3.108 2.324
18 HA PHE 3 HA PHE 3 -8.470 -1.053 1.138
19 1HB PHE 3 1HB PHE 3 -9.899 -1.210 3.295
20 2HB PHE 3 2HB PHE 3 -8.521 -1.806 4.102
21 HD1 PHE 3 1HD PHE 3 -9.655 1.143 2.052
22 HD2 PHE 3 2HD PHE 3 -6.887 -0.310 5.034
23 HE1 PHE 3 1HE PHE 3 -8.788 3.444 2.386
24 HE2 PHE 3 2HE PHE 3 -6.045 1.998 5.364
25 HZ PHE 3 HZ PHE 3 -6.975 3.870 4.028
26 H GLY 4 H GLY 4 -7.532 -3.517 3.341
27 1HA GLY 4 1HA GLY 4 -4.694 -3.000 3.533
28 2HA GLY 4 2HA GLY 4 -5.489 -4.505 4.005
29 H ALA 5 H ALA 5 -6.403 -4.330 0.841
30 HA ALA 5 HA ALA 5 -3.989 -5.770 -0.140
31 1HB ALA 5 1HB ALA 5 -6.720 -5.436 -1.447
32 2HB ALA 5 2HB ALA 5 -5.384 -6.459 -1.999
33 3HB ALA 5 3HB ALA 5 -6.210 -6.841 -0.476
34 H ILE 6 H ILE 6 -5.598 -2.643 -0.318
35 HA ILE 6 HA ILE 6 -3.657 -1.794 -2.319
36 HB ILE 6 HB ILE 6 -5.382 0.122 -2.721
37 1HG1 ILE 6 1HG1 ILE 6 -7.195 -2.217 -2.163
38 2HG1 ILE 6 2HG1 ILE 6 -6.895 -0.956 -0.967
39 1HG2 ILE 6 1HG2 ILE 6 -6.128 -1.182 -4.646
40 2HG2 ILE 6 2HG2 ILE 6 -4.388 -1.368 -4.337
41 3HG2 ILE 6 3HG2 ILE 6 -5.507 -2.670 -3.862
42 1HD1 ILE 6 1HD1 ILE 6 -8.158 -0.517 -3.708
43 2HD1 ILE 6 2HD1 ILE 6 -8.984 -0.462 -2.141
44 3HD1 ILE 6 3HD1 ILE 6 -7.770 0.769 -2.540
45 H ALA 7 H ALA 7 -5.567 0.499 -0.673
46 HA ALA 7 HA ALA 7 -4.841 2.469 0.077
47 1HB ALA 7 1HB ALA 7 -4.370 0.496 2.375
48 2HB ALA 7 2HB ALA 7 -4.576 2.248 2.584
49 3HB ALA 7 3HB ALA 7 -5.900 1.271 1.923
50 H GLY 8 H GLY 8 -2.316 0.646 1.838
51 1HA GLY 8 1HA GLY 8 -0.203 2.480 1.609
52 2HA GLY 8 2HA GLY 8 -0.069 0.734 1.804
53 H PHE 9 H PHE 9 -1.409 0.124 -0.846
54 HA PHE 9 HA PHE 9 0.798 0.226 -2.626
55 1HB PHE 9 1HB PHE 9 -1.229 -1.304 -2.670
56 2HB PHE 9 2HB PHE 9 -2.172 0.055 -3.264
57 HD1 PHE 9 1HD PHE 9 -2.375 0.383 -5.595
58 HD2 PHE 9 2HD PHE 9 0.940 -1.911 -4.064
59 HE1 PHE 9 1HE PHE 9 -1.689 -0.174 -7.909
60 HE2 PHE 9 2HE PHE 9 1.626 -2.459 -6.384
61 HZ PHE 9 HZ PHE 9 0.309 -1.597 -8.312
62 H ILE 10 H ILE 10 -1.554 2.655 -1.854
63 HA ILE 10 HA ILE 10 -0.854 4.317 -4.227
64 HB ILE 10 HB ILE 10 -3.342 4.220 -2.435
65 1HG1 ILE 10 1HG1 ILE 10 -4.101 3.866 -5.135
66 2HG1 ILE 10 2HG1 ILE 10 -2.622 2.927 -5.020
67 1HG2 ILE 10 1HG2 ILE 10 -4.292 5.877 -3.996
68 2HG2 ILE 10 2HG2 ILE 10 -2.891 6.525 -3.136
69 3HG2 ILE 10 3HG2 ILE 10 -2.719 5.998 -4.829
70 1HD1 ILE 10 1HD1 ILE 10 -3.608 1.773 -2.988
71 2HD1 ILE 10 2HD1 ILE 10 -5.106 2.679 -3.270
72 3HD1 ILE 10 3HD1 ILE 10 -4.529 1.523 -4.491
73 H GLU 11 H GLU 11 -1.494 4.320 -0.700
74 HA GLU 11 HA GLU 11 -0.583 6.999 -0.240
75 1HB GLU 11 1HB GLU 11 -1.161 4.607 1.550
76 2HB GLU 11 2HB GLU 11 -0.774 6.216 2.172
77 1HG GLU 11 1HG GLU 11 -2.737 7.195 1.204
78 2HG GLU 11 2HG GLU 11 -3.070 5.779 0.213
79 H ASN 12 H ASN 12 1.214 4.172 -0.897
80 HA ASN 12 HA ASN 12 3.687 5.642 -0.240
81 1HB ASN 12 1HB ASN 12 2.758 3.311 1.301
82 2HB ASN 12 2HB ASN 12 4.253 2.938 0.472
83 1HD2 ASN 12 1HD2 ASN 12 3.015 5.996 2.021
84 2HD2 ASN 12 2HD2 ASN 12 4.415 6.127 3.098
85 H GLY 13 H GLY 13 2.242 2.715 -1.657
86 1HA GLY 13 1HA GLY 13 2.833 2.200 -4.067
87 2HA GLY 13 2HA GLY 13 4.502 2.519 -3.605
88 H ALA 14 H ALA 14 2.949 1.117 -0.982
89 HA ALA 14 HA ALA 14 2.634 -0.940 -0.123
90 1HB ALA 14 1HB ALA 14 2.584 -2.162 -2.284
91 2HB ALA 14 2HB ALA 14 4.365 -2.169 -2.266
92 3HB ALA 14 3HB ALA 14 3.478 -3.019 -1.002
93 H GLU 15 H GLU 15 3.608 -0.231 1.590
94 HA GLU 15 HA GLU 15 6.173 0.519 2.126
95 1HB GLU 15 1HB GLU 15 4.358 -0.985 4.052
96 2HB GLU 15 2HB GLU 15 5.697 0.095 4.449
97 1HG GLU 15 1HG GLU 15 3.892 1.459 4.833
98 2HG GLU 15 2HG GLU 15 4.349 1.930 3.203
99 H GLY 16 H GLY 16 7.975 -0.387 3.067
100 1HA GLY 16 1HA GLY 16 9.421 -2.141 3.715
101 2HA GLY 16 2HA GLY 16 8.531 -3.269 2.645
102 H MET 17 H MET 17 8.124 -1.719 0.398
103 HA MET 17 HA MET 17 10.648 -1.887 -0.894
104 1HB MET 17 1HB MET 17 7.904 -1.964 -1.595
105 2HB MET 17 2HB MET 17 8.455 -0.437 -2.262
106 1HG MET 17 1HG MET 17 10.500 -1.759 -3.065
107 2HG MET 17 2HG MET 17 9.552 -3.206 -2.781
108 1HE MET 17 1HE MET 17 9.839 -4.030 -5.272
109 2HE MET 17 2HE MET 17 9.607 -2.982 -6.686
110 3HE MET 17 3HE MET 17 10.902 -2.631 -5.517
111 H ILE 18 H ILE 18 8.704 0.616 0.481
112 HA ILE 18 HA ILE 18 10.164 2.871 -0.752
113 HB ILE 18 HB ILE 18 8.033 2.793 1.445
114 1HG1 ILE 18 1HG1 ILE 18 6.606 3.961 -0.186
115 2HG1 ILE 18 2HG1 ILE 18 7.845 3.799 -1.437
116 1HG2 ILE 18 1HG2 ILE 18 7.897 5.263 1.177
117 2HG2 ILE 18 2HG2 ILE 18 9.456 4.767 1.818
118 3HG2 ILE 18 3HG2 ILE 18 9.316 5.218 0.104
119 1HD1 ILE 18 1HD1 ILE 18 7.473 1.409 -1.524
120 2HD1 ILE 18 2HD1 ILE 18 6.480 1.469 -0.038
121 3HD1 ILE 18 3HD1 ILE 18 5.903 2.189 -1.550
122 H ASP 19 H ASP 19 9.601 1.844 2.625
123 HA ASP 19 HA ASP 19 11.642 3.481 3.729
124 1HB ASP 19 1HB ASP 19 10.802 2.310 5.836
125 2HB ASP 19 2HB ASP 19 9.585 3.162 4.886
126 H GLY 20 H GLY 20 11.576 0.028 2.814
127 1HA GLY 20 1HA GLY 20 14.264 -0.321 4.079
128 2HA GLY 20 2HA GLY 20 13.035 -1.574 3.905
Start of MODEL 27
1 1H GLY 1 1HN GLY 1 -12.371 -5.918 4.581
2 2H GLY 1 2HN GLY 1 -12.851 -7.123 3.583
3 3H GLY 1 3HN GLY 1 -13.867 -6.606 4.783
4 1HA GLY 1 1HA GLY 1 -14.547 -5.759 2.619
5 2HA GLY 1 2HA GLY 1 -14.097 -4.466 3.756
6 H LEU 2 H LEU 2 -14.026 -4.285 0.837
7 HA LEU 2 HA LEU 2 -11.683 -5.040 -0.368
8 1HB LEU 2 1HB LEU 2 -12.310 -3.660 -2.195
9 2HB LEU 2 2HB LEU 2 -13.762 -4.310 -1.466
10 HG LEU 2 HG LEU 2 -13.650 -1.920 -0.134
11 1HD1 LEU 2 1HD1 LEU 2 -11.617 -1.114 -1.356
12 2HD1 LEU 2 2HD1 LEU 2 -12.472 -1.319 -2.892
13 3HD1 LEU 2 3HD1 LEU 2 -13.032 -0.121 -1.709
14 1HD2 LEU 2 1HD2 LEU 2 -15.585 -2.778 -1.391
15 2HD2 LEU 2 2HD2 LEU 2 -15.293 -1.076 -1.772
16 3HD2 LEU 2 3HD2 LEU 2 -14.804 -2.336 -2.925
17 H PHE 3 H PHE 3 -12.034 -2.217 1.698
18 HA PHE 3 HA PHE 3 -9.909 -0.584 0.928
19 1HB PHE 3 1HB PHE 3 -11.682 -0.431 2.807
20 2HB PHE 3 2HB PHE 3 -10.665 -1.398 3.777
21 HD1 PHE 3 1HD PHE 3 -10.814 1.884 1.978
22 HD2 PHE 3 2HD PHE 3 -8.715 -0.492 4.911
23 HE1 PHE 3 1HE PHE 3 -9.489 3.871 2.656
24 HE2 PHE 3 2HE PHE 3 -7.406 1.503 5.581
25 HZ PHE 3 HZ PHE 3 -7.779 3.678 4.450
26 H GLY 4 H GLY 4 -10.012 -3.272 3.064
27 1HA GLY 4 1HA GLY 4 -7.219 -3.507 3.758
28 2HA GLY 4 2HA GLY 4 -8.431 -4.772 3.976
29 H ALA 5 H ALA 5 -8.702 -4.278 0.730
30 HA ALA 5 HA ALA 5 -6.578 -6.247 0.047
31 1HB ALA 5 1HB ALA 5 -8.912 -6.753 -0.652
32 2HB ALA 5 2HB ALA 5 -8.931 -5.251 -1.612
33 3HB ALA 5 3HB ALA 5 -7.805 -6.554 -2.027
34 H ILE 6 H ILE 6 -7.325 -2.824 -0.176
35 HA ILE 6 HA ILE 6 -5.002 -2.467 -1.913
36 HB ILE 6 HB ILE 6 -6.098 -0.161 -2.406
37 1HG1 ILE 6 1HG1 ILE 6 -8.518 -1.928 -2.163
38 2HG1 ILE 6 2HG1 ILE 6 -8.041 -0.834 -0.866
39 1HG2 ILE 6 1HG2 ILE 6 -5.384 -1.843 -3.991
40 2HG2 ILE 6 2HG2 ILE 6 -6.857 -2.794 -3.680
41 3HG2 ILE 6 3HG2 ILE 6 -6.968 -1.184 -4.454
42 1HD1 ILE 6 1HD1 ILE 6 -8.226 1.112 -2.411
43 2HD1 ILE 6 2HD1 ILE 6 -8.803 0.019 -3.693
44 3HD1 ILE 6 3HD1 ILE 6 -9.764 0.249 -2.221
45 H ALA 7 H ALA 7 -6.432 0.202 -0.363
46 HA ALA 7 HA ALA 7 -5.344 1.911 0.541
47 1HB ALA 7 1HB ALA 7 -5.480 1.646 3.025
48 2HB ALA 7 2HB ALA 7 -6.871 0.932 2.198
49 3HB ALA 7 3HB ALA 7 -5.584 -0.116 2.822
50 H GLY 8 H GLY 8 -3.510 -0.560 2.380
51 1HA GLY 8 1HA GLY 8 -1.010 0.774 2.445
52 2HA GLY 8 2HA GLY 8 -1.266 -0.968 2.574
53 H PHE 9 H PHE 9 -2.519 -1.157 -0.176
54 HA PHE 9 HA PHE 9 -0.262 -1.542 -1.837
55 1HB PHE 9 1HB PHE 9 -2.650 -2.431 -2.049
56 2HB PHE 9 2HB PHE 9 -3.108 -0.850 -2.672
57 HD1 PHE 9 1HD PHE 9 -2.719 -0.277 -4.975
58 HD2 PHE 9 2HD PHE 9 -0.934 -3.829 -3.302
59 HE1 PHE 9 1HE PHE 9 -2.054 -1.014 -7.246
60 HE2 PHE 9 2HE PHE 9 -0.269 -4.562 -5.575
61 HZ PHE 9 HZ PHE 9 -0.836 -3.162 -7.554
62 H ILE 10 H ILE 10 -1.943 1.400 -1.030
63 HA ILE 10 HA ILE 10 -0.652 2.910 -3.241
64 HB ILE 10 HB ILE 10 -3.171 3.458 -1.579
65 1HG1 ILE 10 1HG1 ILE 10 -3.874 3.464 -4.296
66 2HG1 ILE 10 2HG1 ILE 10 -2.710 2.150 -4.218
67 1HG2 ILE 10 1HG2 ILE 10 -3.486 5.395 -3.072
68 2HG2 ILE 10 2HG2 ILE 10 -2.001 5.549 -2.124
69 3HG2 ILE 10 3HG2 ILE 10 -1.910 5.067 -3.837
70 1HD1 ILE 10 1HD1 ILE 10 -4.944 1.290 -3.830
71 2HD1 ILE 10 2HD1 ILE 10 -4.059 1.191 -2.289
72 3HD1 ILE 10 3HD1 ILE 10 -5.243 2.486 -2.552
73 H GLU 11 H GLU 11 -1.644 3.108 0.219
74 HA GLU 11 HA GLU 11 -0.019 5.318 0.929
75 1HB GLU 11 1HB GLU 11 -1.145 3.012 2.565
76 2HB GLU 11 2HB GLU 11 -0.455 4.481 3.260
77 1HG GLU 11 1HG GLU 11 -2.171 5.867 2.232
78 2HG GLU 11 2HG GLU 11 -2.848 4.490 1.361
79 H ASN 12 H ASN 12 0.907 2.031 0.280
80 HA ASN 12 HA ASN 12 3.690 2.745 0.859
81 1HB ASN 12 1HB ASN 12 2.128 0.873 2.462
82 2HB ASN 12 2HB ASN 12 3.369 -0.008 1.619
83 1HD2 ASN 12 1HD2 ASN 12 3.284 3.366 3.023
84 2HD2 ASN 12 2HD2 ASN 12 4.696 3.077 4.052
85 H GLY 13 H GLY 13 2.131 2.742 -1.576
86 1HA GLY 13 1HA GLY 13 2.548 0.427 -3.156
87 2HA GLY 13 2HA GLY 13 2.310 2.066 -3.749
88 H ALA 14 H ALA 14 5.036 2.046 -1.786
89 HA ALA 14 HA ALA 14 6.974 1.092 -3.767
90 1HB ALA 14 1HB ALA 14 7.064 3.909 -2.591
91 2HB ALA 14 2HB ALA 14 8.327 3.155 -3.585
92 3HB ALA 14 3HB ALA 14 6.737 3.497 -4.293
93 H GLU 15 H GLU 15 5.967 -0.041 -1.277
94 HA GLU 15 HA GLU 15 7.457 0.651 0.952
95 1HB GLU 15 1HB GLU 15 6.755 -1.428 1.929
96 2HB GLU 15 2HB GLU 15 5.475 -0.595 1.099
97 1HG GLU 15 1HG GLU 15 5.132 -2.870 0.611
98 2HG GLU 15 2HG GLU 15 5.741 -2.154 -0.872
99 H GLY 16 H GLY 16 9.138 -0.158 2.032
100 1HA GLY 16 1HA GLY 16 11.065 -1.260 2.604
101 2HA GLY 16 2HA GLY 16 11.021 -2.156 1.069
102 H MET 17 H MET 17 10.614 0.049 -0.565
103 HA MET 17 HA MET 17 13.200 0.755 -1.365
104 1HB MET 17 1HB MET 17 10.570 0.755 -2.343
105 2HB MET 17 2HB MET 17 10.940 2.469 -2.255
106 1HG MET 17 1HG MET 17 13.120 1.870 -3.400
107 2HG MET 17 2HG MET 17 12.436 0.287 -3.740
108 1HE MET 17 1HE MET 17 10.315 -0.138 -5.317
109 2HE MET 17 2HE MET 17 9.354 0.976 -4.318
110 3HE MET 17 3HE MET 17 9.382 1.168 -6.083
111 H ILE 18 H ILE 18 10.819 2.391 0.636
112 HA ILE 18 HA ILE 18 11.833 5.032 0.547
113 HB ILE 18 HB ILE 18 10.482 3.650 2.883
114 1HG1 ILE 18 1HG1 ILE 18 8.417 5.016 1.637
115 2HG1 ILE 18 2HG1 ILE 18 9.312 4.394 0.253
116 1HG2 ILE 18 1HG2 ILE 18 9.601 5.906 3.421
117 2HG2 ILE 18 2HG2 ILE 18 11.357 5.899 3.428
118 3HG2 ILE 18 3HG2 ILE 18 10.494 6.588 2.033
119 1HD1 ILE 18 1HD1 ILE 18 8.259 2.817 2.656
120 2HD1 ILE 18 2HD1 ILE 18 7.545 2.867 1.035
121 3HD1 ILE 18 3HD1 ILE 18 9.142 2.112 1.285
122 H ASP 19 H ASP 19 12.690 2.283 2.663
123 HA ASP 19 HA ASP 19 14.658 4.022 4.107
124 1HB ASP 19 1HB ASP 19 12.672 1.955 5.110
125 2HB ASP 19 2HB ASP 19 13.964 2.626 6.104
126 H GLY 20 H GLY 20 14.199 0.830 2.609
127 1HA GLY 20 1HA GLY 20 15.618 -0.906 2.297
128 2HA GLY 20 2HA GLY 20 16.943 0.015 3.025
Start of MODEL 28
1 1H GLY 1 1HN GLY 1 -9.728 -6.103 5.364
2 2H GLY 1 2HN GLY 1 -10.016 -7.556 4.664
3 3H GLY 1 3HN GLY 1 -11.087 -6.958 5.775
4 1HA GLY 1 1HA GLY 1 -11.912 -6.723 3.505
5 2HA GLY 1 2HA GLY 1 -11.692 -5.164 4.334
6 H LEU 2 H LEU 2 -11.651 -5.595 1.433
7 HA LEU 2 HA LEU 2 -9.208 -6.108 0.309
8 1HB LEU 2 1HB LEU 2 -10.076 -5.199 -1.716
9 2HB LEU 2 2HB LEU 2 -11.369 -5.994 -0.846
10 HG LEU 2 HG LEU 2 -11.762 -3.443 0.058
11 1HD1 LEU 2 1HD1 LEU 2 -11.506 -1.844 -1.796
12 2HD1 LEU 2 2HD1 LEU 2 -9.920 -2.465 -1.338
13 3HD1 LEU 2 3HD1 LEU 2 -10.716 -3.082 -2.792
14 1HD2 LEU 2 1HD2 LEU 2 -12.787 -4.550 -2.588
15 2HD2 LEU 2 2HD2 LEU 2 -13.470 -4.871 -0.978
16 3HD2 LEU 2 3HD2 LEU 2 -13.526 -3.236 -1.648
17 H PHE 3 H PHE 3 -10.105 -3.065 1.821
18 HA PHE 3 HA PHE 3 -8.309 -1.245 0.707
19 1HB PHE 3 1HB PHE 3 -10.145 -1.076 2.542
20 2HB PHE 3 2HB PHE 3 -8.977 -1.591 3.670
21 HD1 PHE 3 1HD PHE 3 -7.882 0.085 4.923
22 HD2 PHE 3 2HD PHE 3 -9.160 0.998 0.894
23 HE1 PHE 3 1HE PHE 3 -6.985 2.386 5.147
24 HE2 PHE 3 2HE PHE 3 -8.210 3.285 1.132
25 HZ PHE 3 HZ PHE 3 -7.127 3.971 3.237
26 H GLY 4 H GLY 4 -7.973 -3.445 3.315
27 1HA GLY 4 1HA GLY 4 -5.242 -2.948 4.092
28 2HA GLY 4 2HA GLY 4 -6.167 -4.392 4.516
29 H ALA 5 H ALA 5 -6.333 -4.561 1.242
30 HA ALA 5 HA ALA 5 -3.817 -6.136 0.993
31 1HB ALA 5 1HB ALA 5 -4.754 -6.922 -1.107
32 2HB ALA 5 2HB ALA 5 -5.950 -7.135 0.187
33 3HB ALA 5 3HB ALA 5 -6.117 -5.797 -0.979
34 H ILE 6 H ILE 6 -5.198 -3.028 0.093
35 HA ILE 6 HA ILE 6 -2.837 -2.383 -1.515
36 HB ILE 6 HB ILE 6 -4.439 -0.630 -2.588
37 1HG1 ILE 6 1HG1 ILE 6 -6.317 -2.932 -2.084
38 2HG1 ILE 6 2HG1 ILE 6 -6.307 -1.503 -1.061
39 1HG2 ILE 6 1HG2 ILE 6 -4.778 -2.245 -4.411
40 2HG2 ILE 6 2HG2 ILE 6 -3.143 -2.352 -3.729
41 3HG2 ILE 6 3HG2 ILE 6 -4.357 -3.579 -3.297
42 1HD1 ILE 6 1HD1 ILE 6 -6.935 -1.522 -4.046
43 2HD1 ILE 6 2HD1 ILE 6 -8.086 -1.276 -2.721
44 3HD1 ILE 6 3HD1 ILE 6 -6.828 -0.064 -3.030
45 H ALA 7 H ALA 7 -5.258 -0.177 -0.449
46 HA ALA 7 HA ALA 7 -4.846 1.975 -0.035
47 1HB ALA 7 1HB ALA 7 -4.316 0.551 2.640
48 2HB ALA 7 2HB ALA 7 -4.825 2.250 2.463
49 3HB ALA 7 3HB ALA 7 -5.897 0.933 1.947
50 H GLY 8 H GLY 8 -2.320 0.931 2.271
51 1HA GLY 8 1HA GLY 8 -0.529 3.031 1.820
52 2HA GLY 8 2HA GLY 8 -0.123 1.426 2.417
53 H PHE 9 H PHE 9 -0.936 0.001 -0.190
54 HA PHE 9 HA PHE 9 1.526 0.340 -1.589
55 1HB PHE 9 1HB PHE 9 -1.120 -1.004 -2.236
56 2HB PHE 9 2HB PHE 9 0.153 -0.913 -3.430
57 HD1 PHE 9 1HD PHE 9 1.116 -2.967 -3.747
58 HD2 PHE 9 2HD PHE 9 0.276 -1.721 0.311
59 HE1 PHE 9 1HE PHE 9 2.198 -5.010 -2.877
60 HE2 PHE 9 2HE PHE 9 1.359 -3.730 1.155
61 HZ PHE 9 HZ PHE 9 2.330 -5.407 -0.421
62 H ILE 10 H ILE 10 -1.242 2.295 -1.625
63 HA ILE 10 HA ILE 10 -0.466 3.683 -4.133
64 HB ILE 10 HB ILE 10 -3.175 3.222 -2.738
65 1HG1 ILE 10 1HG1 ILE 10 -3.943 2.578 -5.032
66 2HG1 ILE 10 2HG1 ILE 10 -2.280 2.672 -5.612
67 1HG2 ILE 10 1HG2 ILE 10 -4.196 4.761 -4.428
68 2HG2 ILE 10 2HG2 ILE 10 -3.110 5.614 -3.343
69 3HG2 ILE 10 3HG2 ILE 10 -2.568 5.210 -4.988
70 1HD1 ILE 10 1HD1 ILE 10 -1.670 0.727 -4.427
71 2HD1 ILE 10 2HD1 ILE 10 -2.995 0.910 -3.253
72 3HD1 ILE 10 3HD1 ILE 10 -3.329 0.371 -4.917
73 H GLU 11 H GLU 11 -1.904 4.071 -0.938
74 HA GLU 11 HA GLU 11 -1.574 6.886 -0.737
75 1HB GLU 11 1HB GLU 11 -2.125 4.689 1.295
76 2HB GLU 11 2HB GLU 11 -2.216 6.411 1.678
77 1HG GLU 11 1HG GLU 11 -4.058 6.787 0.241
78 2HG GLU 11 2HG GLU 11 -3.808 5.297 -0.657
79 H ASN 12 H ASN 12 0.778 4.447 -0.438
80 HA ASN 12 HA ASN 12 2.688 6.506 0.560
81 1HB ASN 12 1HB ASN 12 2.770 3.569 1.361
82 2HB ASN 12 2HB ASN 12 4.112 4.688 1.527
83 1HD2 ASN 12 1HD2 ASN 12 2.079 3.160 3.470
84 2HD2 ASN 12 2HD2 ASN 12 1.732 4.465 4.617
85 H GLY 13 H GLY 13 2.247 3.368 -1.141
86 1HA GLY 13 1HA GLY 13 2.584 3.504 -3.595
87 2HA GLY 13 2HA GLY 13 4.066 4.407 -3.299
88 H ALA 14 H ALA 14 2.672 1.318 -3.588
89 HA ALA 14 HA ALA 14 3.327 -0.781 -3.706
90 1HB ALA 14 1HB ALA 14 5.563 -1.299 -4.506
91 2HB ALA 14 2HB ALA 14 4.915 0.129 -5.339
92 3HB ALA 14 3HB ALA 14 6.134 0.319 -4.054
93 H GLU 15 H GLU 15 5.230 0.951 -1.310
94 HA GLU 15 HA GLU 15 6.168 0.542 0.600
95 1HB GLU 15 1HB GLU 15 3.762 -1.256 0.710
96 2HB GLU 15 2HB GLU 15 4.769 -0.852 2.131
97 1HG GLU 15 1HG GLU 15 4.353 1.546 1.758
98 2HG GLU 15 2HG GLU 15 3.315 1.167 0.382
99 H GLY 16 H GLY 16 7.174 -0.899 2.166
100 1HA GLY 16 1HA GLY 16 8.442 -2.647 2.878
101 2HA GLY 16 2HA GLY 16 8.255 -3.482 1.307
102 H MET 17 H MET 17 8.707 -1.467 -0.344
103 HA MET 17 HA MET 17 11.500 -1.327 -0.753
104 1HB MET 17 1HB MET 17 9.122 -1.186 -2.229
105 2HB MET 17 2HB MET 17 9.600 0.503 -2.197
106 1HG MET 17 1HG MET 17 11.902 -0.295 -2.811
107 2HG MET 17 2HG MET 17 11.216 -1.879 -3.140
108 1HE MET 17 1HE MET 17 10.406 1.951 -5.650
109 2HE MET 17 2HE MET 17 9.685 1.779 -4.040
110 3HE MET 17 3HE MET 17 11.455 1.860 -4.216
111 H ILE 18 H ILE 18 9.094 0.846 0.503
112 HA ILE 18 HA ILE 18 10.811 3.237 0.646
113 HB ILE 18 HB ILE 18 7.987 2.509 1.544
114 1HG1 ILE 18 1HG1 ILE 18 7.350 4.403 0.085
115 2HG1 ILE 18 2HG1 ILE 18 9.053 4.702 -0.280
116 1HG2 ILE 18 1HG2 ILE 18 9.457 5.099 2.194
117 2HG2 ILE 18 2HG2 ILE 18 7.704 4.845 2.354
118 3HG2 ILE 18 3HG2 ILE 18 8.813 3.917 3.357
119 1HD1 ILE 18 1HD1 ILE 18 7.637 2.130 -1.034
120 2HD1 ILE 18 2HD1 ILE 18 7.733 3.565 -2.084
121 3HD1 ILE 18 3HD1 ILE 18 9.215 2.738 -1.615
122 H ASP 19 H ASP 19 9.382 0.804 2.841
123 HA ASP 19 HA ASP 19 10.400 1.706 5.233
124 1HB ASP 19 1HB ASP 19 9.742 -1.173 4.493
125 2HB ASP 19 2HB ASP 19 9.611 -0.416 6.077
126 H GLY 20 H GLY 20 11.958 -0.421 2.808
127 1HA GLY 20 1HA GLY 20 14.573 0.084 3.706
128 2HA GLY 20 2HA GLY 20 14.032 -1.453 4.418
Start of MODEL 29
1 1H GLY 1 1HN GLY 1 -10.745 -5.673 4.904
2 2H GLY 1 2HN GLY 1 -10.702 -7.270 4.545
3 3H GLY 1 3HN GLY 1 -12.075 -6.616 5.198
4 1HA GLY 1 1HA GLY 1 -12.323 -7.013 2.824
5 2HA GLY 1 2HA GLY 1 -12.448 -5.291 3.252
6 H LEU 2 H LEU 2 -11.688 -6.286 0.641
7 HA LEU 2 HA LEU 2 -9.028 -6.747 0.190
8 1HB LEU 2 1HB LEU 2 -9.489 -6.389 -2.120
9 2HB LEU 2 2HB LEU 2 -10.897 -7.109 -1.370
10 HG LEU 2 HG LEU 2 -11.573 -4.450 -1.155
11 1HD1 LEU 2 1HD1 LEU 2 -10.027 -4.664 -3.783
12 2HD1 LEU 2 2HD1 LEU 2 -11.039 -3.302 -3.265
13 3HD1 LEU 2 3HD1 LEU 2 -9.544 -3.670 -2.401
14 1HD2 LEU 2 1HD2 LEU 2 -12.997 -4.796 -3.138
15 2HD2 LEU 2 2HD2 LEU 2 -12.036 -6.218 -3.594
16 3HD2 LEU 2 3HD2 LEU 2 -12.993 -6.225 -2.097
17 H PHE 3 H PHE 3 -10.394 -3.586 0.824
18 HA PHE 3 HA PHE 3 -8.525 -1.828 -0.272
19 1HB PHE 3 1HB PHE 3 -10.670 -1.526 1.173
20 2HB PHE 3 2HB PHE 3 -9.697 -1.742 2.550
21 HD1 PHE 3 1HD PHE 3 -9.110 0.236 3.683
22 HD2 PHE 3 2HD PHE 3 -9.370 0.321 -0.633
23 HE1 PHE 3 1HE PHE 3 -8.395 2.607 3.674
24 HE2 PHE 3 2HE PHE 3 -8.611 2.685 -0.613
25 HZ PHE 3 HZ PHE 3 -8.117 3.819 1.522
26 H GLY 4 H GLY 4 -8.546 -3.579 2.662
27 1HA GLY 4 1HA GLY 4 -6.061 -2.759 3.867
28 2HA GLY 4 2HA GLY 4 -6.925 -4.250 4.259
29 H ALA 5 H ALA 5 -6.483 -4.800 1.087
30 HA ALA 5 HA ALA 5 -3.810 -6.065 1.446
31 1HB ALA 5 1HB ALA 5 -4.347 -7.304 -0.575
32 2HB ALA 5 2HB ALA 5 -5.680 -7.459 0.587
33 3HB ALA 5 3HB ALA 5 -5.830 -6.367 -0.813
34 H ILE 6 H ILE 6 -5.289 -3.266 -0.021
35 HA ILE 6 HA ILE 6 -2.809 -2.661 -1.455
36 HB ILE 6 HB ILE 6 -4.352 -1.088 -2.827
37 1HG1 ILE 6 1HG1 ILE 6 -6.190 -3.416 -2.304
38 2HG1 ILE 6 2HG1 ILE 6 -6.335 -1.896 -1.429
39 1HG2 ILE 6 1HG2 ILE 6 -4.447 -2.856 -4.520
40 2HG2 ILE 6 2HG2 ILE 6 -2.887 -2.842 -3.670
41 3HG2 ILE 6 3HG2 ILE 6 -4.104 -4.076 -3.258
42 1HD1 ILE 6 1HD1 ILE 6 -6.692 -0.672 -3.571
43 2HD1 ILE 6 2HD1 ILE 6 -6.663 -2.225 -4.441
44 3HD1 ILE 6 3HD1 ILE 6 -7.943 -1.890 -3.261
45 H ALA 7 H ALA 7 -5.380 -0.431 -0.891
46 HA ALA 7 HA ALA 7 -5.078 1.737 -0.587
47 1HB ALA 7 1HB ALA 7 -5.482 2.205 1.840
48 2HB ALA 7 2HB ALA 7 -6.392 0.786 1.294
49 3HB ALA 7 3HB ALA 7 -4.921 0.565 2.251
50 H GLY 8 H GLY 8 -2.820 0.863 2.083
51 1HA GLY 8 1HA GLY 8 -1.062 3.056 1.685
52 2HA GLY 8 2HA GLY 8 -0.667 1.542 2.501
53 H PHE 9 H PHE 9 -1.287 -0.017 -0.159
54 HA PHE 9 HA PHE 9 1.284 0.192 -1.339
55 1HB PHE 9 1HB PHE 9 -0.619 -1.664 -1.443
56 2HB PHE 9 2HB PHE 9 -1.181 -0.768 -2.840
57 HD1 PHE 9 1HD PHE 9 1.357 -3.038 -1.486
58 HD2 PHE 9 2HD PHE 9 0.259 -0.653 -4.911
59 HE1 PHE 9 1HE PHE 9 3.004 -4.264 -2.869
60 HE2 PHE 9 2HE PHE 9 1.902 -1.889 -6.292
61 HZ PHE 9 HZ PHE 9 3.288 -3.691 -5.275
62 H ILE 10 H ILE 10 -1.440 2.211 -1.682
63 HA ILE 10 HA ILE 10 -0.339 3.580 -4.064
64 HB ILE 10 HB ILE 10 -3.223 3.183 -3.061
65 1HG1 ILE 10 1HG1 ILE 10 -3.088 2.390 -5.761
66 2HG1 ILE 10 2HG1 ILE 10 -1.557 1.814 -5.120
67 1HG2 ILE 10 1HG2 ILE 10 -3.921 4.443 -5.076
68 2HG2 ILE 10 2HG2 ILE 10 -2.987 5.448 -3.967
69 3HG2 ILE 10 3HG2 ILE 10 -2.214 4.807 -5.440
70 1HD1 ILE 10 1HD1 ILE 10 -2.864 0.701 -3.248
71 2HD1 ILE 10 2HD1 ILE 10 -4.354 1.208 -4.063
72 3HD1 ILE 10 3HD1 ILE 10 -3.241 0.082 -4.872
73 H GLU 11 H GLU 11 -2.368 4.097 -1.172
74 HA GLU 11 HA GLU 11 -1.945 6.885 -0.926
75 1HB GLU 11 1HB GLU 11 -2.833 4.706 1.001
76 2HB GLU 11 2HB GLU 11 -2.919 6.425 1.384
77 1HG GLU 11 1HG GLU 11 -4.649 6.849 -0.083
78 2HG GLU 11 2HG GLU 11 -4.202 5.573 -1.202
79 H ASN 12 H ASN 12 0.257 4.257 -0.197
80 HA ASN 12 HA ASN 12 2.064 6.266 1.023
81 1HB ASN 12 1HB ASN 12 1.426 3.522 2.176
82 2HB ASN 12 2HB ASN 12 2.957 4.309 2.455
83 1HD2 ASN 12 1HD2 ASN 12 3.041 6.370 3.546
84 2HD2 ASN 12 2HD2 ASN 12 1.690 6.830 4.612
85 H GLY 13 H GLY 13 1.491 4.825 -1.711
86 1HA GLY 13 1HA GLY 13 2.646 3.832 -3.402
87 2HA GLY 13 2HA GLY 13 4.014 4.737 -2.746
88 H ALA 14 H ALA 14 2.599 2.160 -0.804
89 HA ALA 14 HA ALA 14 3.475 0.321 0.115
90 1HB ALA 14 1HB ALA 14 3.226 -0.586 -2.205
91 2HB ALA 14 2HB ALA 14 4.924 -0.187 -2.505
92 3HB ALA 14 3HB ALA 14 4.505 -1.372 -1.257
93 H GLU 15 H GLU 15 5.026 2.962 0.303
94 HA GLU 15 HA GLU 15 7.781 2.441 0.352
95 1HB GLU 15 1HB GLU 15 7.992 4.428 1.613
96 2HB GLU 15 2HB GLU 15 6.651 4.659 0.495
97 1HG GLU 15 1HG GLU 15 5.130 3.944 2.501
98 2HG GLU 15 2HG GLU 15 6.549 4.187 3.503
99 H GLY 16 H GLY 16 9.235 1.948 2.012
100 1HA GLY 16 1HA GLY 16 9.929 1.105 4.052
101 2HA GLY 16 2HA GLY 16 8.284 0.495 4.397
102 H MET 17 H MET 17 7.778 -0.649 1.774
103 HA MET 17 HA MET 17 9.126 -3.152 2.057
104 1HB MET 17 1HB MET 17 6.696 -2.183 1.007
105 2HB MET 17 2HB MET 17 7.612 -2.605 -0.443
106 1HG MET 17 1HG MET 17 8.225 -4.716 0.809
107 2HG MET 17 2HG MET 17 6.930 -4.338 1.941
108 1HE MET 17 1HE MET 17 6.007 -6.809 1.436
109 2HE MET 17 2HE MET 17 5.568 -7.389 -0.188
110 3HE MET 17 3HE MET 17 7.273 -7.076 0.213
111 H ILE 18 H ILE 18 9.400 -0.320 0.094
112 HA ILE 18 HA ILE 18 11.257 -1.557 -1.857
113 HB ILE 18 HB ILE 18 10.370 1.352 -1.565
114 1HG1 ILE 18 1HG1 ILE 18 9.413 0.951 -3.869
115 2HG1 ILE 18 2HG1 ILE 18 9.710 -0.777 -3.662
116 1HG2 ILE 18 1HG2 ILE 18 12.669 1.286 -2.481
117 2HG2 ILE 18 2HG2 ILE 18 12.179 0.059 -3.666
118 3HG2 ILE 18 3HG2 ILE 18 11.532 1.712 -3.746
119 1HD1 ILE 18 1HD1 ILE 18 8.032 -0.850 -1.884
120 2HD1 ILE 18 2HD1 ILE 18 7.913 0.933 -1.890
121 3HD1 ILE 18 3HD1 ILE 18 7.353 -0.014 -3.280
122 H ASP 19 H ASP 19 11.543 1.317 0.281
123 HA ASP 19 HA ASP 19 14.343 1.476 0.243
124 1HB ASP 19 1HB ASP 19 13.857 3.145 2.107
125 2HB ASP 19 2HB ASP 19 13.028 3.411 0.576
126 H GLY 20 H GLY 20 12.256 -0.529 2.284
127 1HA GLY 20 1HA GLY 20 14.153 -0.864 4.411
128 2HA GLY 20 2HA GLY 20 12.745 -1.867 4.066
Start of MODEL 30
1 1H GLY 1 1HN GLY 1 -8.707 -7.460 4.811
2 2H GLY 1 2HN GLY 1 -8.996 -8.645 3.720
3 3H GLY 1 3HN GLY 1 -9.776 -8.672 5.179
4 1HA GLY 1 1HA GLY 1 -11.238 -7.925 3.400
5 2HA GLY 1 2HA GLY 1 -10.979 -6.684 4.648
6 H LEU 2 H LEU 2 -11.754 -6.121 1.916
7 HA LEU 2 HA LEU 2 -9.748 -5.819 0.085
8 1HB LEU 2 1HB LEU 2 -11.262 -4.513 -1.194
9 2HB LEU 2 2HB LEU 2 -12.177 -5.722 -0.320
10 HG LEU 2 HG LEU 2 -12.396 -3.640 1.453
11 1HD1 LEU 2 1HD1 LEU 2 -12.836 -1.551 0.223
12 2HD1 LEU 2 2HD1 LEU 2 -11.154 -2.028 -0.017
13 3HD1 LEU 2 3HD1 LEU 2 -12.338 -2.312 -1.301
14 1HD2 LEU 2 1HD2 LEU 2 -14.268 -4.948 0.535
15 2HD2 LEU 2 2HD2 LEU 2 -14.624 -3.216 0.484
16 3HD2 LEU 2 3HD2 LEU 2 -14.150 -4.065 -1.004
17 H PHE 3 H PHE 3 -10.313 -3.603 2.764
18 HA PHE 3 HA PHE 3 -9.077 -1.252 1.901
19 1HB PHE 3 1HB PHE 3 -10.234 -1.989 4.111
20 2HB PHE 3 2HB PHE 3 -8.730 -2.619 4.610
21 HD1 PHE 3 1HD PHE 3 -10.567 0.506 3.821
22 HD2 PHE 3 2HD PHE 3 -6.822 -1.137 5.213
23 HE1 PHE 3 1HE PHE 3 -9.853 2.755 4.584
24 HE2 PHE 3 2HE PHE 3 -6.125 1.117 5.971
25 HZ PHE 3 HZ PHE 3 -7.630 3.063 5.654
26 H GLY 4 H GLY 4 -7.787 -4.085 3.382
27 1HA GLY 4 1HA GLY 4 -4.962 -3.443 3.311
28 2HA GLY 4 2HA GLY 4 -5.645 -5.046 3.595
29 H ALA 5 H ALA 5 -6.992 -4.289 0.651
30 HA ALA 5 HA ALA 5 -4.727 -5.439 -0.890
31 1HB ALA 5 1HB ALA 5 -7.591 -4.885 -1.762
32 2HB ALA 5 2HB ALA 5 -6.344 -5.762 -2.660
33 3HB ALA 5 3HB ALA 5 -6.991 -6.451 -1.157
34 H ILE 6 H ILE 6 -6.276 -2.369 -0.173
35 HA ILE 6 HA ILE 6 -4.658 -1.113 -2.251
36 HB ILE 6 HB ILE 6 -6.362 0.836 -1.945
37 1HG1 ILE 6 1HG1 ILE 6 -8.133 -1.566 -1.598
38 2HG1 ILE 6 2HG1 ILE 6 -7.601 -0.581 -0.234
39 1HG2 ILE 6 1HG2 ILE 6 -5.697 -0.281 -3.990
40 2HG2 ILE 6 2HG2 ILE 6 -6.761 -1.656 -3.610
41 3HG2 ILE 6 3HG2 ILE 6 -7.455 -0.042 -3.954
42 1HD1 ILE 6 1HD1 ILE 6 -9.839 0.136 -0.932
43 2HD1 ILE 6 2HD1 ILE 6 -8.662 1.428 -1.237
44 3HD1 ILE 6 3HD1 ILE 6 -9.262 0.430 -2.583
45 H ALA 7 H ALA 7 -6.162 0.780 0.162
46 HA ALA 7 HA ALA 7 -5.206 2.609 1.067
47 1HB ALA 7 1HB ALA 7 -4.430 0.277 2.892
48 2HB ALA 7 2HB ALA 7 -4.555 1.971 3.411
49 3HB ALA 7 3HB ALA 7 -5.994 1.112 2.837
50 H GLY 8 H GLY 8 -2.495 0.459 1.987
51 1HA GLY 8 1HA GLY 8 -0.357 2.240 1.710
52 2HA GLY 8 2HA GLY 8 -0.284 0.493 1.499
53 H PHE 9 H PHE 9 -2.087 0.414 -0.878
54 HA PHE 9 HA PHE 9 -0.248 0.854 -2.991
55 1HB PHE 9 1HB PHE 9 -2.356 -0.631 -2.861
56 2HB PHE 9 2HB PHE 9 -3.271 0.828 -3.232
57 HD1 PHE 9 1HD PHE 9 -0.294 -1.137 -4.484
58 HD2 PHE 9 2HD PHE 9 -3.677 1.340 -5.507
59 HE1 PHE 9 1HE PHE 9 0.181 -1.481 -6.888
60 HE2 PHE 9 2HE PHE 9 -3.198 0.991 -7.914
61 HZ PHE 9 HZ PHE 9 -1.274 -0.425 -8.613
62 H ILE 10 H ILE 10 -2.276 3.128 -1.341
63 HA ILE 10 HA ILE 10 -1.988 5.158 -3.496
64 HB ILE 10 HB ILE 10 -4.067 4.812 -1.270
65 1HG1 ILE 10 1HG1 ILE 10 -5.413 4.919 -3.732
66 2HG1 ILE 10 2HG1 ILE 10 -3.978 3.990 -4.142
67 1HG2 ILE 10 1HG2 ILE 10 -3.848 6.936 -3.442
68 2HG2 ILE 10 2HG2 ILE 10 -5.219 6.726 -2.319
69 3HG2 ILE 10 3HG2 ILE 10 -3.632 7.193 -1.691
70 1HD1 ILE 10 1HD1 ILE 10 -5.775 2.514 -3.445
71 2HD1 ILE 10 2HD1 ILE 10 -4.505 2.459 -2.200
72 3HD1 ILE 10 3HD1 ILE 10 -5.981 3.402 -1.919
73 H GLU 11 H GLU 11 -1.821 4.531 0.039
74 HA GLU 11 HA GLU 11 -0.677 7.087 0.673
75 1HB GLU 11 1HB GLU 11 -0.836 4.433 2.154
76 2HB GLU 11 2HB GLU 11 -0.236 5.932 2.882
77 1HG GLU 11 1HG GLU 11 -2.371 7.046 2.546
78 2HG GLU 11 2HG GLU 11 -3.013 5.683 1.633
79 H ASN 12 H ASN 12 0.743 4.306 -0.767
80 HA ASN 12 HA ASN 12 3.403 5.594 -0.679
81 1HB ASN 12 1HB ASN 12 2.686 3.366 1.067
82 2HB ASN 12 2HB ASN 12 3.846 2.808 -0.121
83 1HD2 ASN 12 1HD2 ASN 12 3.420 5.933 1.664
84 2HD2 ASN 12 2HD2 ASN 12 5.072 5.922 2.311
85 H GLY 13 H GLY 13 1.285 3.119 -2.070
86 1HA GLY 13 1HA GLY 13 1.280 2.410 -4.333
87 2HA GLY 13 2HA GLY 13 2.892 3.088 -4.563
88 H ALA 14 H ALA 14 4.526 2.089 -2.873
89 HA ALA 14 HA ALA 14 4.232 -0.876 -2.712
90 1HB ALA 14 1HB ALA 14 5.182 -0.415 -4.922
91 2HB ALA 14 2HB ALA 14 6.439 0.619 -4.197
92 3HB ALA 14 3HB ALA 14 6.420 -1.121 -3.867
93 H GLU 15 H GLU 15 3.985 0.072 -0.399
94 HA GLU 15 HA GLU 15 6.313 1.162 0.880
95 1HB GLU 15 1HB GLU 15 5.074 0.709 2.981
96 2HB GLU 15 2HB GLU 15 4.106 1.570 1.803
97 1HG GLU 15 1HG GLU 15 2.927 -0.516 1.183
98 2HG GLU 15 2HG GLU 15 3.908 -1.418 2.347
99 H GLY 16 H GLY 16 7.556 0.247 2.502
100 1HA GLY 16 1HA GLY 16 8.631 -1.321 3.824
101 2HA GLY 16 2HA GLY 16 7.741 -2.630 3.016
102 H MET 17 H MET 17 8.202 -1.791 0.409
103 HA MET 17 HA MET 17 10.465 -3.156 -0.396
104 1HB MET 17 1HB MET 17 8.077 -2.071 -1.429
105 2HB MET 17 2HB MET 17 9.322 -1.168 -2.275
106 1HG MET 17 1HG MET 17 10.421 -3.279 -2.832
107 2HG MET 17 2HG MET 17 9.179 -4.207 -2.009
108 1HE MET 17 1HE MET 17 6.892 -4.881 -2.948
109 2HE MET 17 2HE MET 17 6.454 -3.179 -2.678
110 3HE MET 17 3HE MET 17 6.050 -3.966 -4.220
111 H ILE 18 H ILE 18 9.947 0.242 0.225
112 HA ILE 18 HA ILE 18 12.299 1.380 -0.891
113 HB ILE 18 HB ILE 18 10.789 2.159 1.650
114 1HG1 ILE 18 1HG1 ILE 18 9.915 4.049 0.251
115 2HG1 ILE 18 2HG1 ILE 18 10.626 3.308 -1.182
116 1HG2 ILE 18 1HG2 ILE 18 12.867 3.734 0.068
117 2HG2 ILE 18 2HG2 ILE 18 11.849 4.406 1.365
118 3HG2 ILE 18 3HG2 ILE 18 13.023 3.155 1.734
119 1HD1 ILE 18 1HD1 ILE 18 8.136 2.994 -0.826
120 2HD1 ILE 18 2HD1 ILE 18 9.043 1.507 -1.087
121 3HD1 ILE 18 3HD1 ILE 18 8.524 1.958 0.563
122 H ASP 19 H ASP 19 11.854 -0.503 2.075
123 HA ASP 19 HA ASP 19 13.058 -1.135 3.779
124 1HB ASP 19 1HB ASP 19 14.192 -2.372 1.953
125 2HB ASP 19 2HB ASP 19 15.437 -1.119 1.905
126 H GLY 20 H GLY 20 14.953 -0.717 5.255
127 1HA GLY 20 1HA GLY 20 16.163 0.645 6.647
128 2HA GLY 20 2HA GLY 20 16.325 1.791 5.312
Start of MODEL 31
1 1H GLY 1 1HN GLY 1 -10.626 -7.018 4.628
2 2H GLY 1 2HN GLY 1 -11.169 -8.106 3.529
3 3H GLY 1 3HN GLY 1 -12.019 -7.866 4.928
4 1HA GLY 1 1HA GLY 1 -13.079 -6.786 3.036
5 2HA GLY 1 2HA GLY 1 -12.571 -5.640 4.299
6 H LEU 2 H LEU 2 -12.946 -5.061 1.443
7 HA LEU 2 HA LEU 2 -10.738 -5.301 -0.155
8 1HB LEU 2 1HB LEU 2 -11.780 -3.729 -1.609
9 2HB LEU 2 2HB LEU 2 -13.027 -4.680 -0.831
10 HG LEU 2 HG LEU 2 -12.897 -2.526 0.901
11 1HD1 LEU 2 1HD1 LEU 2 -11.260 -1.302 -0.548
12 2HD1 LEU 2 2HD1 LEU 2 -12.413 -1.377 -1.890
13 3HD1 LEU 2 3HD1 LEU 2 -12.806 -0.456 -0.425
14 1HD2 LEU 2 1HD2 LEU 2 -14.933 -1.700 -0.215
15 2HD2 LEU 2 2HD2 LEU 2 -14.575 -2.706 -1.636
16 3HD2 LEU 2 3HD2 LEU 2 -14.949 -3.463 -0.072
17 H PHE 3 H PHE 3 -11.026 -2.967 2.441
18 HA PHE 3 HA PHE 3 -9.260 -0.931 1.719
19 1HB PHE 3 1HB PHE 3 -10.726 -1.461 3.819
20 2HB PHE 3 2HB PHE 3 -9.406 -2.358 4.414
21 HD1 PHE 3 1HD PHE 3 -10.518 1.067 3.468
22 HD2 PHE 3 2HD PHE 3 -7.374 -1.268 5.289
23 HE1 PHE 3 1HE PHE 3 -9.473 3.140 4.343
24 HE2 PHE 3 2HE PHE 3 -6.345 0.809 6.162
25 HZ PHE 3 HZ PHE 3 -7.384 3.013 5.687
26 H GLY 4 H GLY 4 -8.744 -4.020 3.146
27 1HA GLY 4 1HA GLY 4 -5.872 -4.001 3.455
28 2HA GLY 4 2HA GLY 4 -6.889 -5.446 3.461
29 H ALA 5 H ALA 5 -7.681 -4.252 0.504
30 HA ALA 5 HA ALA 5 -5.472 -5.671 -0.890
31 1HB ALA 5 1HB ALA 5 -7.835 -6.260 -1.439
32 2HB ALA 5 2HB ALA 5 -8.098 -4.582 -1.981
33 3HB ALA 5 3HB ALA 5 -6.931 -5.611 -2.825
34 H ILE 6 H ILE 6 -6.516 -2.450 -0.077
35 HA ILE 6 HA ILE 6 -4.642 -1.328 -2.024
36 HB ILE 6 HB ILE 6 -6.055 0.822 -1.675
37 1HG1 ILE 6 1HG1 ILE 6 -8.164 -1.309 -1.497
38 2HG1 ILE 6 2HG1 ILE 6 -7.550 -0.458 -0.076
39 1HG2 ILE 6 1HG2 ILE 6 -5.521 -0.288 -3.769
40 2HG2 ILE 6 2HG2 ILE 6 -6.796 -1.496 -3.471
41 3HG2 ILE 6 3HG2 ILE 6 -7.220 0.219 -3.747
42 1HD1 ILE 6 1HD1 ILE 6 -9.632 0.598 -0.789
43 2HD1 ILE 6 2HD1 ILE 6 -8.280 1.717 -1.044
44 3HD1 ILE 6 3HD1 ILE 6 -8.992 0.844 -2.423
45 H ALA 7 H ALA 7 -5.967 0.609 0.470
46 HA ALA 7 HA ALA 7 -4.870 2.236 1.502
47 1HB ALA 7 1HB ALA 7 -5.812 0.700 3.166
48 2HB ALA 7 2HB ALA 7 -4.300 -0.226 3.221
49 3HB ALA 7 3HB ALA 7 -4.338 1.452 3.807
50 H GLY 8 H GLY 8 -2.377 -0.245 2.234
51 1HA GLY 8 1HA GLY 8 -0.044 1.281 2.140
52 2HA GLY 8 2HA GLY 8 -0.199 -0.412 1.697
53 H PHE 9 H PHE 9 -1.984 -0.049 -0.552
54 HA PHE 9 HA PHE 9 -0.199 0.454 -2.667
55 1HB PHE 9 1HB PHE 9 -2.469 -0.808 -2.614
56 2HB PHE 9 2HB PHE 9 -3.193 0.775 -2.926
57 HD1 PHE 9 1HD PHE 9 -0.466 -1.517 -4.157
58 HD2 PHE 9 2HD PHE 9 -3.275 1.595 -5.161
59 HE1 PHE 9 1HE PHE 9 0.244 -1.647 -6.517
60 HE2 PHE 9 2HE PHE 9 -2.574 1.459 -7.535
61 HZ PHE 9 HZ PHE 9 -0.826 -0.176 -8.231
62 H ILE 10 H ILE 10 -1.985 2.755 -0.781
63 HA ILE 10 HA ILE 10 -1.514 4.913 -2.773
64 HB ILE 10 HB ILE 10 -3.529 4.650 -0.484
65 1HG1 ILE 10 1HG1 ILE 10 -4.993 5.094 -2.808
66 2HG1 ILE 10 2HG1 ILE 10 -3.680 4.103 -3.432
67 1HG2 ILE 10 1HG2 ILE 10 -2.806 6.976 -0.765
68 2HG2 ILE 10 2HG2 ILE 10 -3.117 6.876 -2.518
69 3HG2 ILE 10 3HG2 ILE 10 -4.463 6.767 -1.349
70 1HD1 ILE 10 1HD1 ILE 10 -4.216 2.395 -1.655
71 2HD1 ILE 10 2HD1 ILE 10 -5.547 3.432 -1.111
72 3HD1 ILE 10 3HD1 ILE 10 -5.578 2.739 -2.749
73 H GLU 11 H GLU 11 -1.171 3.869 0.633
74 HA GLU 11 HA GLU 11 0.284 6.180 1.471
75 1HB GLU 11 1HB GLU 11 0.226 3.334 2.521
76 2HB GLU 11 2HB GLU 11 1.014 4.679 3.353
77 1HG GLU 11 1HG GLU 11 -1.069 5.872 3.613
78 2HG GLU 11 2HG GLU 11 -1.938 4.753 2.571
79 H ASN 12 H ASN 12 1.314 3.414 -0.444
80 HA ASN 12 HA ASN 12 3.585 5.052 -1.176
81 1HB ASN 12 1HB ASN 12 4.353 3.484 0.827
82 2HB ASN 12 2HB ASN 12 4.466 2.261 -0.445
83 1HD2 ASN 12 1HD2 ASN 12 6.621 2.232 -1.482
84 2HD2 ASN 12 2HD2 ASN 12 7.553 3.717 -1.577
85 H GLY 13 H GLY 13 1.582 2.201 -1.827
86 1HA GLY 13 1HA GLY 13 1.079 1.403 -4.027
87 2HA GLY 13 2HA GLY 13 2.455 2.283 -4.666
88 H ALA 14 H ALA 14 4.563 1.513 -3.313
89 HA ALA 14 HA ALA 14 4.676 -1.464 -3.201
90 1HB ALA 14 1HB ALA 14 6.725 0.408 -4.465
91 2HB ALA 14 2HB ALA 14 6.947 -1.331 -4.183
92 3HB ALA 14 3HB ALA 14 5.701 -0.770 -5.318
93 H GLU 15 H GLU 15 4.451 -1.390 -0.960
94 HA GLU 15 HA GLU 15 6.195 0.227 0.720
95 1HB GLU 15 1HB GLU 15 4.486 -2.194 1.375
96 2HB GLU 15 2HB GLU 15 5.293 -1.143 2.552
97 1HG GLU 15 1HG GLU 15 3.958 0.786 1.808
98 2HG GLU 15 2HG GLU 15 3.143 -0.211 0.594
99 H GLY 16 H GLY 16 7.731 -0.749 2.221
100 1HA GLY 16 1HA GLY 16 9.406 -2.190 2.952
101 2HA GLY 16 2HA GLY 16 9.051 -3.302 1.616
102 H MET 17 H MET 17 9.013 -1.355 -0.411
103 HA MET 17 HA MET 17 11.555 -1.252 -1.460
104 1HB MET 17 1HB MET 17 8.940 -0.734 -2.229
105 2HB MET 17 2HB MET 17 9.622 0.890 -2.243
106 1HG MET 17 1HG MET 17 11.559 -0.141 -3.521
107 2HG MET 17 2HG MET 17 10.566 -1.580 -3.733
108 1HE MET 17 1HE MET 17 11.840 -0.156 -6.183
109 2HE MET 17 2HE MET 17 10.722 -1.530 -6.359
110 3HE MET 17 3HE MET 17 10.481 -0.056 -7.327
111 H ILE 18 H ILE 18 9.888 0.994 0.549
112 HA ILE 18 HA ILE 18 11.383 3.344 0.547
113 HB ILE 18 HB ILE 18 10.112 1.899 2.922
114 1HG1 ILE 18 1HG1 ILE 18 8.304 3.774 2.475
115 2HG1 ILE 18 2HG1 ILE 18 8.915 3.727 0.823
116 1HG2 ILE 18 1HG2 ILE 18 11.623 3.684 3.696
117 2HG2 ILE 18 2HG2 ILE 18 10.854 4.838 2.591
118 3HG2 ILE 18 3HG2 ILE 18 9.953 4.140 3.964
119 1HD1 ILE 18 1HD1 ILE 18 7.926 1.299 2.405
120 2HD1 ILE 18 2HD1 ILE 18 6.892 2.299 1.383
121 3HD1 ILE 18 3HD1 ILE 18 8.212 1.385 0.645
122 H ASP 19 H ASP 19 12.227 0.215 2.062
123 HA ASP 19 HA ASP 19 13.931 -0.504 3.318
124 1HB ASP 19 1HB ASP 19 15.190 0.144 1.233
125 2HB ASP 19 2HB ASP 19 15.652 1.646 2.034
126 H GLY 20 H GLY 20 16.050 0.993 4.665
127 1HA GLY 20 1HA GLY 20 14.574 2.952 6.373
128 2HA GLY 20 2HA GLY 20 15.971 2.008 6.916
Start of MODEL 32
1 1H GLY 1 1HN GLY 1 -9.873 -6.781 5.165
2 2H GLY 1 2HN GLY 1 -10.085 -8.126 4.254
3 3H GLY 1 3HN GLY 1 -11.139 -7.801 5.487
4 1HA GLY 1 1HA GLY 1 -12.114 -7.286 3.337
5 2HA GLY 1 2HA GLY 1 -11.939 -5.848 4.370
6 H LEU 2 H LEU 2 -12.132 -5.616 1.567
7 HA LEU 2 HA LEU 2 -9.894 -5.907 0.036
8 1HB LEU 2 1HB LEU 2 -10.969 -4.537 -1.586
9 2HB LEU 2 2HB LEU 2 -12.192 -5.447 -0.728
10 HG LEU 2 HG LEU 2 -12.213 -3.140 0.766
11 1HD1 LEU 2 1HD1 LEU 2 -12.118 -1.190 -0.730
12 2HD1 LEU 2 2HD1 LEU 2 -10.543 -1.987 -0.709
13 3HD1 LEU 2 3HD1 LEU 2 -11.625 -2.219 -2.088
14 1HD2 LEU 2 1HD2 LEU 2 -14.186 -4.224 -0.228
15 2HD2 LEU 2 2HD2 LEU 2 -14.210 -2.479 -0.523
16 3HD2 LEU 2 3HD2 LEU 2 -13.746 -3.590 -1.830
17 H PHE 3 H PHE 3 -10.339 -3.313 2.355
18 HA PHE 3 HA PHE 3 -8.644 -1.300 1.449
19 1HB PHE 3 1HB PHE 3 -10.144 -1.663 3.561
20 2HB PHE 3 2HB PHE 3 -8.799 -2.413 4.283
21 HD1 PHE 3 1HD PHE 3 -7.134 -1.097 5.419
22 HD2 PHE 3 2HD PHE 3 -9.770 0.802 2.573
23 HE1 PHE 3 1HE PHE 3 -6.224 1.121 6.045
24 HE2 PHE 3 2HE PHE 3 -8.842 3.014 3.202
25 HZ PHE 3 HZ PHE 3 -7.068 3.175 4.937
26 H GLY 4 H GLY 4 -8.039 -4.188 3.198
27 1HA GLY 4 1HA GLY 4 -5.193 -4.022 3.633
28 2HA GLY 4 2HA GLY 4 -6.140 -5.514 3.677
29 H ALA 5 H ALA 5 -6.859 -4.633 0.627
30 HA ALA 5 HA ALA 5 -4.475 -5.957 -0.563
31 1HB ALA 5 1HB ALA 5 -5.835 -6.152 -2.563
32 2HB ALA 5 2HB ALA 5 -6.750 -6.781 -1.175
33 3HB ALA 5 3HB ALA 5 -7.122 -5.169 -1.850
34 H ILE 6 H ILE 6 -5.805 -2.777 -0.066
35 HA ILE 6 HA ILE 6 -3.989 -1.672 -2.084
36 HB ILE 6 HB ILE 6 -5.570 0.364 -1.968
37 1HG1 ILE 6 1HG1 ILE 6 -7.513 -1.905 -1.590
38 2HG1 ILE 6 2HG1 ILE 6 -6.997 -0.871 -0.261
39 1HG2 ILE 6 1HG2 ILE 6 -4.931 -0.899 -3.937
40 2HG2 ILE 6 2HG2 ILE 6 -6.118 -2.164 -3.531
41 3HG2 ILE 6 3HG2 ILE 6 -6.662 -0.519 -3.971
42 1HD1 ILE 6 1HD1 ILE 6 -9.131 -0.042 -1.071
43 2HD1 ILE 6 2HD1 ILE 6 -7.867 1.136 -1.466
44 3HD1 ILE 6 3HD1 ILE 6 -8.514 0.061 -2.729
45 H ALA 7 H ALA 7 -5.608 0.217 0.290
46 HA ALA 7 HA ALA 7 -4.791 2.058 1.206
47 1HB ALA 7 1HB ALA 7 -5.525 0.492 2.941
48 2HB ALA 7 2HB ALA 7 -3.890 -0.179 3.083
49 3HB ALA 7 3HB ALA 7 -4.206 1.504 3.561
50 H GLY 8 H GLY 8 -1.984 -0.006 2.056
51 1HA GLY 8 1HA GLY 8 0.103 1.850 1.931
52 2HA GLY 8 2HA GLY 8 0.229 0.139 1.542
53 H PHE 9 H PHE 9 -1.611 0.189 -0.736
54 HA PHE 9 HA PHE 9 0.087 0.875 -2.865
55 1HB PHE 9 1HB PHE 9 -2.034 -0.648 -2.728
56 2HB PHE 9 2HB PHE 9 -2.915 0.821 -3.155
57 HD1 PHE 9 1HD PHE 9 -2.894 1.603 -5.446
58 HD2 PHE 9 2HD PHE 9 -0.085 -1.414 -4.185
59 HE1 PHE 9 1HE PHE 9 -2.172 1.288 -7.799
60 HE2 PHE 9 2HE PHE 9 0.639 -1.727 -6.528
61 HZ PHE 9 HZ PHE 9 -0.412 -0.384 -8.352
62 H ILE 10 H ILE 10 -2.119 2.925 -1.076
63 HA ILE 10 HA ILE 10 -1.922 5.089 -3.103
64 HB ILE 10 HB ILE 10 -3.818 4.671 -0.737
65 1HG1 ILE 10 1HG1 ILE 10 -5.409 4.829 -3.006
66 2HG1 ILE 10 2HG1 ILE 10 -4.011 3.977 -3.649
67 1HG2 ILE 10 1HG2 ILE 10 -3.407 7.058 -1.136
68 2HG2 ILE 10 2HG2 ILE 10 -3.764 6.845 -2.868
69 3HG2 ILE 10 3HG2 ILE 10 -5.041 6.619 -1.643
70 1HD1 ILE 10 1HD1 ILE 10 -5.725 2.438 -2.822
71 2HD1 ILE 10 2HD1 ILE 10 -4.266 2.285 -1.812
72 3HD1 ILE 10 3HD1 ILE 10 -5.675 3.185 -1.212
73 H GLU 11 H GLU 11 -1.362 4.215 0.328
74 HA GLU 11 HA GLU 11 -0.272 6.729 1.109
75 1HB GLU 11 1HB GLU 11 0.272 3.919 2.122
76 2HB GLU 11 2HB GLU 11 0.792 5.387 2.945
77 1HG GLU 11 1HG GLU 11 -1.468 6.081 3.378
78 2HG GLU 11 2HG GLU 11 -2.144 4.854 2.314
79 H ASN 12 H ASN 12 1.142 4.112 -0.795
80 HA ASN 12 HA ASN 12 3.411 5.865 -1.396
81 1HB ASN 12 1HB ASN 12 4.040 4.491 0.713
82 2HB ASN 12 2HB ASN 12 4.096 3.088 -0.364
83 1HD2 ASN 12 1HD2 ASN 12 6.355 2.714 -1.161
84 2HD2 ASN 12 2HD2 ASN 12 7.341 4.118 -1.467
85 H GLY 13 H GLY 13 1.707 2.789 -1.962
86 1HA GLY 13 1HA GLY 13 1.404 1.941 -4.252
87 2HA GLY 13 2HA GLY 13 3.030 2.510 -4.633
88 H ALA 14 H ALA 14 4.714 1.734 -2.898
89 HA ALA 14 HA ALA 14 4.140 -0.875 -1.682
90 1HB ALA 14 1HB ALA 14 6.483 -0.460 -3.595
91 2HB ALA 14 2HB ALA 14 6.190 -1.888 -2.577
92 3HB ALA 14 3HB ALA 14 5.063 -1.493 -3.887
93 H GLU 15 H GLU 15 4.392 -0.071 0.353
94 HA GLU 15 HA GLU 15 6.625 1.681 1.109
95 1HB GLU 15 1HB GLU 15 5.684 1.607 3.325
96 2HB GLU 15 2HB GLU 15 4.395 1.873 2.175
97 1HG GLU 15 1HG GLU 15 3.468 0.366 3.690
98 2HG GLU 15 2HG GLU 15 3.863 -0.630 2.299
99 H GLY 16 H GLY 16 8.283 0.982 2.605
100 1HA GLY 16 1HA GLY 16 9.603 -0.465 3.811
101 2HA GLY 16 2HA GLY 16 8.592 -1.807 3.269
102 H MET 17 H MET 17 8.642 -1.210 0.600
103 HA MET 17 HA MET 17 10.833 -2.625 -0.449
104 1HB MET 17 1HB MET 17 8.231 -1.805 -1.204
105 2HB MET 17 2HB MET 17 9.256 -0.891 -2.286
106 1HG MET 17 1HG MET 17 10.514 -3.114 -2.636
107 2HG MET 17 2HG MET 17 9.144 -3.892 -1.863
108 1HE MET 17 1HE MET 17 9.101 -1.843 -6.023
109 2HE MET 17 2HE MET 17 9.275 -0.871 -4.549
110 3HE MET 17 3HE MET 17 10.529 -2.056 -4.985
111 H ILE 18 H ILE 18 10.115 0.814 -0.118
112 HA ILE 18 HA ILE 18 12.241 1.758 -1.856
113 HB ILE 18 HB ILE 18 10.844 3.257 0.390
114 1HG1 ILE 18 1HG1 ILE 18 8.971 2.454 -0.654
115 2HG1 ILE 18 2HG1 ILE 18 9.192 4.088 -1.255
116 1HG2 ILE 18 1HG2 ILE 18 11.249 5.241 -1.030
117 2HG2 ILE 18 2HG2 ILE 18 12.764 4.400 -0.679
118 3HG2 ILE 18 3HG2 ILE 18 12.001 4.214 -2.269
119 1HD1 ILE 18 1HD1 ILE 18 10.133 3.143 -3.376
120 2HD1 ILE 18 2HD1 ILE 18 9.789 1.507 -2.762
121 3HD1 ILE 18 3HD1 ILE 18 8.460 2.632 -3.044
122 H ASP 19 H ASP 19 11.637 1.817 1.631
123 HA ASP 19 HA ASP 19 13.994 0.487 2.381
124 1HB ASP 19 1HB ASP 19 14.986 2.779 2.235
125 2HB ASP 19 2HB ASP 19 13.714 3.392 3.298
126 H GLY 20 H GLY 20 13.797 0.214 4.822
127 1HA GLY 20 1HA GLY 20 12.528 0.200 6.824
128 2HA GLY 20 2HA GLY 20 11.052 0.561 5.931
Start of MODEL 33
1 1H GLY 1 1HN GLY 1 -12.052 -5.518 4.343
2 2H GLY 1 2HN GLY 1 -12.286 -6.966 3.613
3 3H GLY 1 3HN GLY 1 -13.500 -6.303 4.521
4 1HA GLY 1 1HA GLY 1 -13.922 -6.063 2.148
5 2HA GLY 1 2HA GLY 1 -13.761 -4.503 2.986
6 H LEU 2 H LEU 2 -13.277 -4.999 0.144
7 HA LEU 2 HA LEU 2 -10.727 -5.667 -0.581
8 1HB LEU 2 1HB LEU 2 -11.239 -4.771 -2.730
9 2HB LEU 2 2HB LEU 2 -12.694 -5.458 -2.042
10 HG LEU 2 HG LEU 2 -13.011 -2.849 -1.245
11 1HD1 LEU 2 1HD1 LEU 2 -11.608 -2.674 -3.954
12 2HD1 LEU 2 2HD1 LEU 2 -12.413 -1.345 -3.097
13 3HD1 LEU 2 3HD1 LEU 2 -10.947 -2.066 -2.429
14 1HD2 LEU 2 1HD2 LEU 2 -13.796 -3.997 -3.954
15 2HD2 LEU 2 2HD2 LEU 2 -14.691 -4.184 -2.429
16 3HD2 LEU 2 3HD2 LEU 2 -14.536 -2.585 -3.168
17 H PHE 3 H PHE 3 -11.638 -2.555 0.772
18 HA PHE 3 HA PHE 3 -9.627 -0.836 -0.107
19 1HB PHE 3 1HB PHE 3 -11.690 -0.626 1.490
20 2HB PHE 3 2HB PHE 3 -10.660 -1.131 2.749
21 HD1 PHE 3 1HD PHE 3 -8.891 0.342 3.667
22 HD2 PHE 3 2HD PHE 3 -11.313 1.600 0.318
23 HE1 PHE 3 1HE PHE 3 -8.083 2.667 3.948
24 HE2 PHE 3 2HE PHE 3 -10.492 3.923 0.610
25 HZ PHE 3 HZ PHE 3 -8.878 4.458 2.425
26 H GLY 4 H GLY 4 -9.737 -3.098 2.486
27 1HA GLY 4 1HA GLY 4 -7.100 -2.762 3.608
28 2HA GLY 4 2HA GLY 4 -8.156 -4.153 3.876
29 H ALA 5 H ALA 5 -7.959 -4.306 0.606
30 HA ALA 5 HA ALA 5 -5.531 -6.015 0.634
31 1HB ALA 5 1HB ALA 5 -7.626 -6.897 -0.382
32 2HB ALA 5 2HB ALA 5 -7.595 -5.562 -1.562
33 3HB ALA 5 3HB ALA 5 -6.295 -6.765 -1.549
34 H ILE 6 H ILE 6 -6.535 -2.785 -0.262
35 HA ILE 6 HA ILE 6 -4.046 -2.396 -1.749
36 HB ILE 6 HB ILE 6 -5.371 -0.410 -2.794
37 1HG1 ILE 6 1HG1 ILE 6 -7.535 -2.473 -2.469
38 2HG1 ILE 6 2HG1 ILE 6 -7.385 -1.074 -1.403
39 1HG2 ILE 6 1HG2 ILE 6 -5.568 -3.314 -3.625
40 2HG2 ILE 6 2HG2 ILE 6 -5.793 -1.903 -4.701
41 3HG2 ILE 6 3HG2 ILE 6 -4.214 -2.205 -3.950
42 1HD1 ILE 6 1HD1 ILE 6 -7.883 -0.961 -4.408
43 2HD1 ILE 6 2HD1 ILE 6 -9.045 -0.585 -3.124
44 3HD1 ILE 6 3HD1 ILE 6 -7.627 0.455 -3.360
45 H ALA 7 H ALA 7 -5.992 0.261 -0.862
46 HA ALA 7 HA ALA 7 -5.183 2.249 -0.267
47 1HB ALA 7 1HB ALA 7 -5.411 0.734 2.380
48 2HB ALA 7 2HB ALA 7 -5.554 2.495 2.173
49 3HB ALA 7 3HB ALA 7 -6.750 1.416 1.437
50 H GLY 8 H GLY 8 -3.286 0.508 2.239
51 1HA GLY 8 1HA GLY 8 -0.986 2.096 2.233
52 2HA GLY 8 2HA GLY 8 -1.040 0.385 2.639
53 H PHE 9 H PHE 9 -1.924 -0.462 -0.105
54 HA PHE 9 HA PHE 9 0.578 -0.771 -1.412
55 1HB PHE 9 1HB PHE 9 -1.719 -2.068 -1.547
56 2HB PHE 9 2HB PHE 9 -2.079 -0.933 -2.837
57 HD1 PHE 9 1HD PHE 9 -0.939 -1.119 -5.005
58 HD2 PHE 9 2HD PHE 9 0.188 -3.652 -1.704
59 HE1 PHE 9 1HE PHE 9 0.414 -2.519 -6.539
60 HE2 PHE 9 2HE PHE 9 1.553 -5.042 -3.237
61 HZ PHE 9 HZ PHE 9 1.671 -4.481 -5.660
62 H ILE 10 H ILE 10 -1.538 1.959 -1.395
63 HA ILE 10 HA ILE 10 -0.253 3.138 -3.804
64 HB ILE 10 HB ILE 10 -3.044 3.495 -2.605
65 1HG1 ILE 10 1HG1 ILE 10 -3.340 2.793 -5.307
66 2HG1 ILE 10 2HG1 ILE 10 -1.958 1.817 -4.831
67 1HG2 ILE 10 1HG2 ILE 10 -3.497 4.960 -4.553
68 2HG2 ILE 10 2HG2 ILE 10 -2.241 5.636 -3.510
69 3HG2 ILE 10 3HG2 ILE 10 -1.786 4.839 -5.036
70 1HD1 ILE 10 1HD1 ILE 10 -4.013 0.582 -4.467
71 2HD1 ILE 10 2HD1 ILE 10 -3.335 0.977 -2.870
72 3HD1 ILE 10 3HD1 ILE 10 -4.701 1.912 -3.504
73 H GLU 11 H GLU 11 -1.487 3.688 -0.472
74 HA GLU 11 HA GLU 11 -0.455 6.332 -0.221
75 1HB GLU 11 1HB GLU 11 -1.022 4.198 1.866
76 2HB GLU 11 2HB GLU 11 -0.681 5.888 2.237
77 1HG GLU 11 1HG GLU 11 -2.662 6.645 1.066
78 2HG GLU 11 2HG GLU 11 -3.002 5.032 0.448
79 H ASN 12 H ASN 12 1.204 3.232 -0.128
80 HA ASN 12 HA ASN 12 3.728 4.751 -0.119
81 1HB ASN 12 1HB ASN 12 3.065 2.632 1.938
82 2HB ASN 12 2HB ASN 12 4.715 2.792 1.340
83 1HD2 ASN 12 1HD2 ASN 12 3.199 3.531 4.009
84 2HD2 ASN 12 2HD2 ASN 12 3.799 5.180 4.303
85 H GLY 13 H GLY 13 2.226 1.471 -0.404
86 1HA GLY 13 1HA GLY 13 2.512 0.177 -2.435
87 2HA GLY 13 2HA GLY 13 4.072 0.929 -2.705
88 H ALA 14 H ALA 14 3.582 0.064 0.541
89 HA ALA 14 HA ALA 14 3.994 -1.727 1.875
90 1HB ALA 14 1HB ALA 14 5.482 -3.174 -0.331
91 2HB ALA 14 2HB ALA 14 5.026 -3.787 1.262
92 3HB ALA 14 3HB ALA 14 3.762 -3.423 0.063
93 H GLU 15 H GLU 15 5.149 -0.639 3.219
94 HA GLU 15 HA GLU 15 7.405 0.924 2.654
95 1HB GLU 15 1HB GLU 15 6.337 -0.138 5.318
96 2HB GLU 15 2HB GLU 15 7.469 1.190 5.102
97 1HG GLU 15 1HG GLU 15 5.493 2.330 5.392
98 2HG GLU 15 2HG GLU 15 5.657 2.318 3.644
99 H GLY 16 H GLY 16 9.601 0.763 3.342
100 1HA GLY 16 1HA GLY 16 11.501 -0.258 4.124
101 2HA GLY 16 2HA GLY 16 10.695 -1.848 4.156
102 H MET 17 H MET 17 9.498 -1.561 1.478
103 HA MET 17 HA MET 17 11.710 -2.239 -0.229
104 1HB MET 17 1HB MET 17 8.905 -2.740 -0.059
105 2HB MET 17 2HB MET 17 9.081 -1.697 -1.463
106 1HG MET 17 1HG MET 17 11.100 -3.305 -1.985
107 2HG MET 17 2HG MET 17 10.274 -4.407 -0.893
108 1HE MET 17 1HE MET 17 6.781 -4.798 -2.825
109 2HE MET 17 2HE MET 17 7.616 -5.000 -1.266
110 3HE MET 17 3HE MET 17 7.131 -3.376 -1.822
111 H ILE 18 H ILE 18 9.669 0.533 0.429
112 HA ILE 18 HA ILE 18 10.249 2.001 -2.016
113 HB ILE 18 HB ILE 18 9.202 3.069 0.642
114 1HG1 ILE 18 1HG1 ILE 18 7.753 1.263 0.306
115 2HG1 ILE 18 2HG1 ILE 18 6.886 2.695 -0.199
116 1HG2 ILE 18 1HG2 ILE 18 9.740 4.811 -0.992
117 2HG2 ILE 18 2HG2 ILE 18 8.744 4.013 -2.222
118 3HG2 ILE 18 3HG2 ILE 18 7.990 4.709 -0.771
119 1HD1 ILE 18 1HD1 ILE 18 6.479 0.853 -1.739
120 2HD1 ILE 18 2HD1 ILE 18 7.380 2.133 -2.586
121 3HD1 ILE 18 3HD1 ILE 18 8.207 0.653 -2.047
122 H ASP 19 H ASP 19 11.213 2.028 1.285
123 HA ASP 19 HA ASP 19 12.796 4.297 1.476
124 1HB ASP 19 1HB ASP 19 12.987 1.731 3.116
125 2HB ASP 19 2HB ASP 19 13.448 3.349 3.643
126 H GLY 20 H GLY 20 15.153 4.291 2.219
127 1HA GLY 20 1HA GLY 20 16.905 3.148 0.218
128 2HA GLY 20 2HA GLY 20 17.367 4.133 1.610
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