Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
592413 | 2mso RC | 25128 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 SER 1 H SER 1 -6.020 4.614 2.100
2 HA SER 1 HA SER 1 -7.433 2.647 3.660
3 HB3 SER 1 2HB SER 1 -5.876 1.929 1.206
4 HG SER 1 HG SER 1 -8.052 0.909 0.875
5 H CYS 2 H CYS 2 -4.148 2.768 2.268
6 HA CYS 2 HA CYS 2 -3.181 1.299 4.621
7 HB3 CYS 2 2HB CYS 2 -1.775 -0.116 3.212
8 H ASN 3 H ASN 3 -1.875 2.710 5.590
9 HA ASN 3 HA ASN 3 0.071 4.168 3.924
10 HB3 ASN 3 2HB ASN 3 0.022 5.781 6.008
11 HD21 ASN 3 1HD2 ASN 3 0.147 7.457 4.696
12 HD22 ASN 3 2HD2 ASN 3 -1.056 7.940 3.553
13 H ASN 4 H ASN 4 1.098 1.922 4.437
14 HA ASN 4 HA ASN 4 2.909 2.354 6.695
15 HB3 ASN 4 2HB ASN 4 1.546 0.811 7.761
16 HD21 ASN 4 1HD2 ASN 4 2.042 -1.829 5.763
17 HD22 ASN 4 2HD2 ASN 4 0.438 -1.988 5.141
18 H SER 5 H SER 5 4.935 1.259 6.504
19 HA SER 5 HA SER 5 5.877 1.135 3.811
20 HB3 SER 5 2HB SER 5 7.294 1.964 5.645
21 HG SER 5 HG SER 5 7.912 0.684 7.276
22 H CYS 6 H CYS 6 6.823 -0.659 2.744
23 HA CYS 6 HA CYS 6 6.779 -3.296 3.733
24 HB3 CYS 6 2HB CYS 6 4.393 -3.208 3.624
25 H GLN 7 H GLN 7 7.171 -4.915 1.969
26 HA GLN 7 HA GLN 7 8.468 -3.642 -0.349
27 HB3 GLN 7 2HB GLN 7 10.035 -5.715 -0.188
28 HG3 GLN 7 2HG GLN 7 11.506 -4.603 1.484
29 HE21 GLN 7 1HE2 GLN 7 10.664 -1.596 0.818
30 HE22 GLN 7 2HE2 GLN 7 11.349 -1.397 -0.754
31 H SER 8 H SER 8 7.018 -6.624 0.908
32 HA SER 8 HA SER 8 5.965 -7.157 -1.776
33 HB3 SER 8 2HB SER 8 7.919 -8.580 -1.606
34 HG SER 8 HG SER 8 8.373 -8.933 0.459
35 H HIS 9 H HIS 9 4.236 -6.054 -0.315
36 HA HIS 9 HA HIS 9 2.267 -6.187 0.823
37 HB3 HIS 9 2HB HIS 9 1.035 -8.417 0.487
38 HD1 HIS 9 1HD HIS 9 2.765 -7.727 -2.758
39 HD2 HIS 9 2HD HIS 9 -0.662 -6.557 -0.721
40 HE1 HIS 9 1HE HIS 9 1.375 -6.478 -4.441
41 H SER 10 H SER 10 4.733 -6.867 2.259
42 HA SER 10 HA SER 10 4.157 -9.019 4.052
43 HB3 SER 10 2HB SER 10 6.450 -8.580 3.802
44 HG SER 10 HG SER 10 6.194 -5.889 4.577
45 H ASP 11 H ASP 11 3.800 -5.514 4.147
46 HA ASP 11 HA ASP 11 2.450 -5.763 6.752
47 HB3 ASP 11 2HB ASP 11 2.911 -3.386 7.077
48 H CYS 12 H CYS 12 2.075 -4.871 3.437
49 HA CYS 12 HA CYS 12 -0.224 -3.256 3.638
50 HB3 CYS 12 2HB CYS 12 -0.505 -3.628 1.277
51 H ALA 13 H ALA 13 -2.411 -3.862 2.885
52 HA ALA 13 HA ALA 13 -3.219 -6.613 3.040
53 HB1 ALA 13 1HB ALA 13 -3.101 -6.389 5.366
54 HB2 ALA 13 2HB ALA 13 -3.767 -4.755 5.332
55 HB3 ALA 13 3HB ALA 13 -4.806 -6.137 4.986
56 H SER 14 H SER 14 -5.638 -6.812 2.879
57 HA SER 14 HA SER 14 -7.559 -6.376 1.741
58 HB3 SER 14 2HB SER 14 -8.190 -3.830 1.715
59 HG SER 14 HG SER 14 -7.905 -5.434 4.028
60 H HIS 15 H HIS 15 -5.524 -6.873 0.084
61 HA HIS 15 HA HIS 15 -4.701 -6.587 -2.023
62 HB3 HIS 15 2HB HIS 15 -6.319 -5.761 -3.693
63 HD1 HIS 15 1HD HIS 15 -5.791 -8.447 -1.750
64 HD2 HIS 15 2HD HIS 15 -9.302 -7.020 -3.453
65 HE1 HIS 15 1HE HIS 15 -7.332 -10.431 -1.877
66 H CYS 16 H CYS 16 -3.441 -4.884 -0.475
67 HA CYS 16 HA CYS 16 -3.586 -2.257 -1.792
68 HB3 CYS 16 2HB CYS 16 -1.982 -1.756 0.290
69 H ILE 17 H ILE 17 -2.126 -1.935 -3.322
70 HA ILE 17 HA ILE 17 0.035 -3.598 -3.888
71 HB ILE 17 HB ILE 17 -0.192 -0.678 -4.622
72 HG13 ILE 17 2HG1 ILE 17 -1.261 -1.504 -6.699
73 HG21 ILE 17 1HG2 ILE 17 1.009 -1.854 -6.716
74 HG22 ILE 17 2HG2 ILE 17 1.889 -1.138 -5.367
75 HG23 ILE 17 3HG2 ILE 17 1.608 -2.878 -5.410
76 HD11 ILE 17 3HD1 ILE 17 -1.995 -4.082 -5.497
77 HD12 ILE 17 1HD1 ILE 17 -1.719 -3.646 -7.183
78 HD13 ILE 17 2HD1 ILE 17 -0.349 -3.962 -6.118
79 H CYS 18 H CYS 18 2.256 -3.423 -3.568
80 HA CYS 18 HA CYS 18 3.110 -1.504 -1.503
81 HB3 CYS 18 2HB CYS 18 4.768 -3.537 -0.973
82 H THR 19 H THR 19 4.961 -0.436 -1.894
83 HA THR 19 HA THR 19 6.833 -1.437 -3.893
84 HB THR 19 HB THR 19 6.895 0.673 -5.127
85 HG1 THR 19 1HG THR 19 5.277 2.247 -4.701
86 HG21 THR 19 3HG2 THR 19 4.678 0.514 -6.235
87 HG22 THR 19 1HG2 THR 19 4.142 -0.553 -4.939
88 HG23 THR 19 2HG2 THR 19 5.452 -1.055 -6.008
89 H PHE 20 H PHE 20 8.573 0.540 -4.143
90 HA PHE 20 HA PHE 20 10.017 0.542 -1.762
91 HB3 PHE 20 2HB PHE 20 11.166 0.919 -3.827
92 HD1 PHE 20 1HD PHE 20 10.082 4.409 -3.369
93 HD2 PHE 20 2HD PHE 20 10.038 0.994 -5.908
94 HE1 PHE 20 1HE PHE 20 9.196 5.789 -5.203
95 HE2 PHE 20 2HE PHE 20 9.152 2.369 -7.747
96 HZ PHE 20 HZ PHE 20 8.731 4.770 -7.396
97 H ARG 21 H ARG 21 7.477 2.616 -2.841
98 HA ARG 21 HA ARG 21 8.054 4.610 -0.782
99 HB3 ARG 21 2HB ARG 21 5.849 5.590 -1.872
100 HG3 ARG 21 2HG ARG 21 7.392 6.356 -3.888
101 HD3 ARG 21 2HD ARG 21 6.616 7.516 -1.650
102 HE ARG 21 HE ARG 21 9.116 6.521 -0.831
103 HH11 ARG 21 1HH1 ARG 21 7.246 9.457 -0.812
104 HH12 ARG 21 2HH1 ARG 21 7.988 10.074 0.626
105 HH21 ARG 21 1HH2 ARG 21 10.100 7.323 1.064
106 HH22 ARG 21 2HH2 ARG 21 9.613 8.861 1.692
107 H GLY 22 H GLY 22 7.110 1.823 -0.229
108 HA2 GLY 22 2HA GLY 22 5.864 1.005 1.560
109 HA3 GLY 22 3HA GLY 22 5.070 2.568 1.688
110 H CYS 23 H CYS 23 3.105 1.334 1.990
111 HA CYS 23 HA CYS 23 2.100 -0.186 -0.260
112 HB3 CYS 23 2HB CYS 23 0.116 -0.539 1.140
113 H GLY 24 H GLY 24 -0.109 0.297 -1.120
114 HA2 GLY 24 2HA GLY 24 -0.590 3.205 -1.273
115 HA3 GLY 24 3HA GLY 24 -0.548 2.215 -2.724
116 H ALA 25 H ALA 25 -2.738 3.815 -1.967
117 HA ALA 25 HA ALA 25 -4.745 1.774 -1.262
118 HB1 ALA 25 1HB ALA 25 -6.180 3.722 -0.591
119 HB2 ALA 25 2HB ALA 25 -4.756 3.456 0.416
120 HB3 ALA 25 3HB ALA 25 -4.757 4.746 -0.786
121 H VAL 26 H VAL 26 -7.004 2.493 -2.152
122 HA VAL 26 HA VAL 26 -6.636 3.106 -5.010
123 HB VAL 26 HB VAL 26 -8.750 1.877 -5.389
124 HG11 VAL 26 1HG1 VAL 26 -7.774 -0.230 -5.398
125 HG12 VAL 26 2HG1 VAL 26 -6.378 0.848 -5.369
126 HG13 VAL 26 3HG1 VAL 26 -6.910 0.053 -3.887
127 HG21 VAL 26 3HG2 VAL 26 -8.887 2.017 -2.531
128 HG22 VAL 26 1HG2 VAL 26 -10.112 1.480 -3.680
129 HG23 VAL 26 2HG2 VAL 26 -8.935 0.331 -3.046
130 H ASN 27 H ASN 27 -8.042 4.521 -6.040
131 HA ASN 27 HA ASN 27 -9.328 6.386 -6.247
132 HB3 ASN 27 2HB ASN 27 -11.417 6.450 -4.880
133 HD21 ASN 27 1HD2 ASN 27 -12.755 4.006 -4.667
134 HD22 ASN 27 2HD2 ASN 27 -12.817 3.279 -6.233
135 H GLY 28 H GLY 28 -7.008 6.365 -4.382
136 HA2 GLY 28 2HA GLY 28 -5.979 7.820 -2.935
137 HA3 GLY 28 3HA GLY 28 -7.179 8.996 -3.450
138 H LEU 29 H LEU 29 -7.583 5.945 -1.678
139 HA LEU 29 HA LEU 29 -9.104 7.395 0.350
140 HB3 LEU 29 2HB LEU 29 -9.176 4.734 1.041
141 HG LEU 29 HG LEU 29 -11.204 6.054 0.921
142 HD11 LEU 29 1HD1 LEU 29 -11.295 7.413 -0.871
143 HD12 LEU 29 2HD1 LEU 29 -12.140 6.051 -1.605
144 HD13 LEU 29 3HD1 LEU 29 -10.419 6.286 -1.907
145 HD21 LEU 29 3HD2 LEU 29 -11.669 3.766 0.965
146 HD22 LEU 29 1HD2 LEU 29 -11.110 3.526 -0.690
147 HD23 LEU 29 2HD2 LEU 29 -12.629 4.371 -0.387
148 HA PRO 30 HA PRO 30 -6.074 7.177 3.515
149 HB3 PRO 30 2HB PRO 30 -7.607 8.151 4.921
150 HG3 PRO 30 2HG PRO 30 -9.859 7.579 4.823
151 HD3 PRO 30 2HD PRO 30 -9.458 7.995 2.592
Start of MODEL 2
1 H1 SER 1 H SER 1 -7.017 4.137 2.867
2 HA SER 1 HA SER 1 -7.185 2.593 5.169
3 HB3 SER 1 2HB SER 1 -6.951 1.838 2.259
4 HG SER 1 HG SER 1 -7.252 -0.254 2.802
5 H CYS 2 H CYS 2 -4.872 1.846 2.573
6 HA CYS 2 HA CYS 2 -3.037 0.771 4.572
7 HB3 CYS 2 2HB CYS 2 -1.811 -0.129 2.604
8 H ASN 3 H ASN 3 -1.789 2.288 5.479
9 HA ASN 3 HA ASN 3 -0.454 4.220 3.697
10 HB3 ASN 3 2HB ASN 3 -0.401 5.802 5.496
11 HD21 ASN 3 1HD2 ASN 3 -1.860 7.004 4.465
12 HD22 ASN 3 2HD2 ASN 3 -3.570 6.775 4.544
13 H ASN 4 H ASN 4 -0.083 1.798 6.146
14 HA ASN 4 HA ASN 4 2.459 2.303 7.112
15 HB3 ASN 4 2HB ASN 4 1.015 0.520 7.985
16 HD21 ASN 4 1HD2 ASN 4 1.355 -2.141 7.648
17 HD22 ASN 4 2HD2 ASN 4 0.580 -2.665 6.196
18 H SER 5 H SER 5 4.489 1.136 6.593
19 HA SER 5 HA SER 5 4.993 1.313 3.729
20 HB3 SER 5 2HB SER 5 7.425 0.925 4.575
21 HG SER 5 HG SER 5 6.464 3.284 5.668
22 H CYS 6 H CYS 6 6.435 -0.327 2.721
23 HA CYS 6 HA CYS 6 6.781 -2.903 3.787
24 HB3 CYS 6 2HB CYS 6 4.440 -3.254 3.690
25 H GLN 7 H GLN 7 7.075 -4.548 1.838
26 HA GLN 7 HA GLN 7 8.309 -3.138 -0.423
27 HB3 GLN 7 2HB GLN 7 10.144 -3.651 1.032
28 HG3 GLN 7 2HG GLN 7 9.401 -6.556 0.989
29 HE21 GLN 7 1HE2 GLN 7 11.065 -7.748 1.545
30 HE22 GLN 7 2HE2 GLN 7 12.439 -7.227 2.454
31 H SER 8 H SER 8 7.323 -6.303 0.858
32 HA SER 8 HA SER 8 6.284 -6.965 -1.807
33 HB3 SER 8 2HB SER 8 7.080 -9.316 -1.479
34 HG SER 8 HG SER 8 8.383 -8.089 -2.765
35 H HIS 9 H HIS 9 4.479 -6.041 -0.262
36 HA HIS 9 HA HIS 9 2.550 -6.407 0.891
37 HB3 HIS 9 2HB HIS 9 1.575 -8.768 0.552
38 HD1 HIS 9 1HD HIS 9 -0.362 -7.626 -0.533
39 HD2 HIS 9 2HD HIS 9 3.127 -7.281 -2.763
40 HE1 HIS 9 1HE HIS 9 -1.054 -6.563 -2.705
41 H SER 10 H SER 10 5.024 -6.726 2.339
42 HA SER 10 HA SER 10 4.725 -8.980 4.104
43 HB3 SER 10 2HB SER 10 6.964 -8.310 3.783
44 HG SER 10 HG SER 10 7.608 -6.267 3.670
45 H ASP 11 H ASP 11 3.930 -5.565 4.146
46 HA ASP 11 HA ASP 11 2.674 -5.936 6.787
47 HB3 ASP 11 2HB ASP 11 2.946 -3.531 7.145
48 H CYS 12 H CYS 12 2.225 -5.046 3.485
49 HA CYS 12 HA CYS 12 -0.190 -3.607 3.712
50 HB3 CYS 12 2HB CYS 12 -0.440 -3.954 1.346
51 H ALA 13 H ALA 13 -2.308 -4.406 2.842
52 HA ALA 13 HA ALA 13 -2.903 -7.197 2.977
53 HB1 ALA 13 1HB ALA 13 -2.831 -7.070 5.296
54 HB2 ALA 13 2HB ALA 13 -3.537 -5.454 5.328
55 HB3 ALA 13 3HB ALA 13 -4.543 -6.847 4.934
56 H SER 14 H SER 14 -5.308 -7.576 2.828
57 HA SER 14 HA SER 14 -7.259 -7.266 1.698
58 HB3 SER 14 2HB SER 14 -8.246 -4.940 1.815
59 HG SER 14 HG SER 14 -8.900 -5.645 3.669
60 H HIS 15 H HIS 15 -5.205 -7.570 0.022
61 HA HIS 15 HA HIS 15 -4.417 -7.173 -2.079
62 HB3 HIS 15 2HB HIS 15 -6.168 -6.203 -3.669
63 HD1 HIS 15 1HD HIS 15 -5.821 -9.000 -1.299
64 HD2 HIS 15 2HD HIS 15 -8.010 -8.135 -4.722
65 HE1 HIS 15 1HE HIS 15 -6.725 -11.207 -2.094
66 H CYS 16 H CYS 16 -3.232 -5.446 -0.534
67 HA CYS 16 HA CYS 16 -3.575 -2.797 -1.775
68 HB3 CYS 16 2HB CYS 16 -2.003 -2.245 0.327
69 H ILE 17 H ILE 17 -2.165 -2.436 -3.348
70 HA ILE 17 HA ILE 17 0.124 -3.911 -3.892
71 HB ILE 17 HB ILE 17 -0.962 -2.455 -5.546
72 HG13 ILE 17 2HG1 ILE 17 1.959 -1.899 -4.996
73 HG21 ILE 17 1HG2 ILE 17 0.360 -0.116 -4.200
74 HG22 ILE 17 2HG2 ILE 17 -0.824 -0.105 -5.506
75 HG23 ILE 17 3HG2 ILE 17 -1.312 -0.576 -3.879
76 HD11 ILE 17 3HD1 ILE 17 0.662 -3.778 -6.956
77 HD12 ILE 17 1HD1 ILE 17 2.393 -3.515 -6.740
78 HD13 ILE 17 2HD1 ILE 17 1.443 -4.247 -5.447
79 H CYS 18 H CYS 18 2.262 -3.724 -3.399
80 HA CYS 18 HA CYS 18 2.979 -1.686 -1.394
81 HB3 CYS 18 2HB CYS 18 4.801 -3.579 -0.887
82 H THR 19 H THR 19 4.089 -0.176 -2.477
83 HA THR 19 HA THR 19 6.156 -1.056 -4.380
84 HB THR 19 HB THR 19 5.547 1.810 -4.345
85 HG1 THR 19 1HG THR 19 3.451 1.633 -4.484
86 HG21 THR 19 3HG2 THR 19 5.041 0.483 -6.831
87 HG22 THR 19 1HG2 THR 19 6.526 -0.151 -6.123
88 HG23 THR 19 2HG2 THR 19 6.355 1.581 -6.408
89 H PHE 20 H PHE 20 7.874 0.912 -4.535
90 HA PHE 20 HA PHE 20 9.484 0.688 -2.272
91 HB3 PHE 20 2HB PHE 20 10.537 1.255 -4.320
92 HD1 PHE 20 1HD PHE 20 9.246 4.644 -3.618
93 HD2 PHE 20 2HD PHE 20 9.399 1.404 -6.373
94 HE1 PHE 20 1HE PHE 20 8.219 6.067 -5.343
95 HE2 PHE 20 2HE PHE 20 8.374 2.821 -8.103
96 HZ PHE 20 HZ PHE 20 7.782 5.156 -7.588
97 H ARG 21 H ARG 21 6.879 2.840 -2.957
98 HA ARG 21 HA ARG 21 7.619 4.650 -0.788
99 HB3 ARG 21 2HB ARG 21 5.256 5.617 -1.632
100 HG3 ARG 21 2HG ARG 21 7.712 6.054 -3.303
101 HD3 ARG 21 2HD ARG 21 5.389 7.121 -3.771
102 HE ARG 21 HE ARG 21 5.745 8.137 -1.205
103 HH11 ARG 21 1HH1 ARG 21 5.062 9.310 -4.410
104 HH12 ARG 21 2HH1 ARG 21 4.159 10.681 -3.858
105 HH21 ARG 21 1HH2 ARG 21 4.557 9.938 -0.463
106 HH22 ARG 21 2HH2 ARG 21 3.873 11.037 -1.612
107 H GLY 22 H GLY 22 6.678 1.791 -0.473
108 HA2 GLY 22 2HA GLY 22 5.616 0.811 1.363
109 HA3 GLY 22 3HA GLY 22 4.837 2.349 1.704
110 H CYS 23 H CYS 23 2.932 0.998 2.070
111 HA CYS 23 HA CYS 23 1.728 -0.311 -0.199
112 HB3 CYS 23 2HB CYS 23 -0.082 -0.857 1.299
113 H GLY 24 H GLY 24 -0.701 0.227 -0.588
114 HA2 GLY 24 2HA GLY 24 -1.381 3.028 -0.367
115 HA3 GLY 24 3HA GLY 24 -0.980 2.516 -2.000
116 H ALA 25 H ALA 25 -3.523 3.483 -0.845
117 HA ALA 25 HA ALA 25 -5.212 1.107 -1.231
118 HB1 ALA 25 1HB ALA 25 -5.302 2.924 0.778
119 HB2 ALA 25 2HB ALA 25 -6.499 3.590 -0.335
120 HB3 ALA 25 3HB ALA 25 -6.671 1.939 0.261
121 H VAL 26 H VAL 26 -7.303 1.507 -2.377
122 HA VAL 26 HA VAL 26 -6.909 2.308 -4.990
123 HB VAL 26 HB VAL 26 -9.376 2.365 -5.212
124 HG11 VAL 26 1HG1 VAL 26 -9.012 -0.021 -3.542
125 HG12 VAL 26 2HG1 VAL 26 -9.464 0.119 -5.243
126 HG13 VAL 26 3HG1 VAL 26 -7.768 0.220 -4.769
127 HG21 VAL 26 3HG2 VAL 26 -10.108 3.343 -3.195
128 HG22 VAL 26 1HG2 VAL 26 -10.673 1.673 -3.139
129 HG23 VAL 26 2HG2 VAL 26 -9.250 2.154 -2.214
130 H ASN 27 H ASN 27 -6.884 4.195 -6.040
131 HA ASN 27 HA ASN 27 -6.928 6.433 -6.444
132 HB3 ASN 27 2HB ASN 27 -9.194 6.575 -4.455
133 HD21 ASN 27 1HD2 ASN 27 -8.171 7.554 -7.713
134 HD22 ASN 27 2HD2 ASN 27 -8.678 9.199 -7.560
135 H GLY 28 H GLY 28 -5.364 5.335 -4.166
136 HA2 GLY 28 2HA GLY 28 -4.069 6.098 -2.429
137 HA3 GLY 28 3HA GLY 28 -4.198 7.661 -3.221
138 H LEU 29 H LEU 29 -6.170 5.497 -1.186
139 HA LEU 29 HA LEU 29 -7.102 7.890 0.259
140 HB3 LEU 29 2HB LEU 29 -8.837 5.807 0.875
141 HG LEU 29 HG LEU 29 -9.245 8.330 0.076
142 HD11 LEU 29 1HD1 LEU 29 -10.671 7.979 -2.079
143 HD12 LEU 29 2HD1 LEU 29 -9.585 6.615 -2.340
144 HD13 LEU 29 3HD1 LEU 29 -8.933 8.247 -2.200
145 HD21 LEU 29 3HD2 LEU 29 -10.771 6.768 1.308
146 HD22 LEU 29 1HD2 LEU 29 -11.333 6.187 -0.259
147 HD23 LEU 29 2HD2 LEU 29 -11.578 7.873 0.195
148 HA PRO 30 HA PRO 30 -5.443 6.366 4.024
149 HB3 PRO 30 2HB PRO 30 -6.324 8.222 5.055
150 HG3 PRO 30 2HG PRO 30 -8.409 9.054 4.449
151 HD3 PRO 30 2HD PRO 30 -7.436 8.867 2.368
Start of MODEL 3
1 H1 SER 1 H SER 1 -7.430 3.745 2.712
2 HA SER 1 HA SER 1 -7.641 2.032 4.880
3 HB3 SER 1 2HB SER 1 -6.997 1.219 2.035
4 HG SER 1 HG SER 1 -8.560 -0.143 3.961
5 H CYS 2 H CYS 2 -5.132 1.672 2.376
6 HA CYS 2 HA CYS 2 -3.340 0.601 4.443
7 HB3 CYS 2 2HB CYS 2 -2.163 -0.537 2.694
8 H ASN 3 H ASN 3 -1.986 2.058 5.251
9 HA ASN 3 HA ASN 3 -0.511 3.781 3.400
10 HB3 ASN 3 2HB ASN 3 -2.138 5.319 4.138
11 HD21 ASN 3 1HD2 ASN 3 -3.609 6.124 5.588
12 HD22 ASN 3 2HD2 ASN 3 -3.987 5.337 7.079
13 H ASN 4 H ASN 4 0.699 1.633 4.227
14 HA ASN 4 HA ASN 4 2.498 2.563 6.358
15 HB3 ASN 4 2HB ASN 4 1.383 0.907 7.536
16 HD21 ASN 4 1HD2 ASN 4 2.348 -1.577 5.380
17 HD22 ASN 4 2HD2 ASN 4 0.766 -2.094 4.914
18 H SER 5 H SER 5 4.621 1.387 6.318
19 HA SER 5 HA SER 5 5.635 1.409 3.621
20 HB3 SER 5 2HB SER 5 7.833 0.882 4.816
21 HG SER 5 HG SER 5 7.562 2.994 4.423
22 H CYS 6 H CYS 6 6.605 -0.297 2.521
23 HA CYS 6 HA CYS 6 6.887 -2.909 3.569
24 HB3 CYS 6 2HB CYS 6 4.495 -3.042 3.523
25 H GLN 7 H GLN 7 6.844 -4.514 1.467
26 HA GLN 7 HA GLN 7 8.114 -3.158 -0.789
27 HB3 GLN 7 2HB GLN 7 10.012 -3.690 0.564
28 HG3 GLN 7 2HG GLN 7 9.195 -6.575 0.645
29 HE21 GLN 7 1HE2 GLN 7 10.682 -7.860 1.538
30 HE22 GLN 7 2HE2 GLN 7 12.183 -7.324 2.206
31 H SER 8 H SER 8 7.144 -6.301 0.563
32 HA SER 8 HA SER 8 5.971 -6.964 -2.048
33 HB3 SER 8 2HB SER 8 6.704 -9.371 -1.590
34 HG SER 8 HG SER 8 8.628 -9.010 -2.598
35 H HIS 9 H HIS 9 4.222 -5.998 -0.500
36 HA HIS 9 HA HIS 9 2.336 -6.299 0.744
37 HB3 HIS 9 2HB HIS 9 2.405 -9.209 0.007
38 HD1 HIS 9 1HD HIS 9 0.530 -9.588 1.744
39 HD2 HIS 9 2HD HIS 9 -0.368 -6.721 -1.125
40 HE1 HIS 9 1HE HIS 9 -1.938 -9.164 1.967
41 H SER 10 H SER 10 4.905 -6.708 2.070
42 HA SER 10 HA SER 10 4.634 -8.902 3.888
43 HB3 SER 10 2HB SER 10 6.520 -7.698 5.108
44 HG SER 10 HG SER 10 7.065 -9.253 3.602
45 H ASP 11 H ASP 11 3.922 -5.454 3.979
46 HA ASP 11 HA ASP 11 2.661 -5.843 6.614
47 HB3 ASP 11 2HB ASP 11 2.901 -3.234 6.658
48 H CYS 12 H CYS 12 2.236 -4.860 3.338
49 HA CYS 12 HA CYS 12 -0.048 -3.273 3.511
50 HB3 CYS 12 2HB CYS 12 -0.450 -3.848 1.191
51 H ALA 13 H ALA 13 -2.277 -3.864 2.914
52 HA ALA 13 HA ALA 13 -3.049 -6.603 3.587
53 HB1 ALA 13 1HB ALA 13 -4.038 -4.154 5.034
54 HB2 ALA 13 2HB ALA 13 -4.837 -5.726 5.107
55 HB3 ALA 13 3HB ALA 13 -3.192 -5.543 5.715
56 H SER 14 H SER 14 -5.511 -6.846 3.295
57 HA SER 14 HA SER 14 -7.214 -6.931 1.784
58 HB3 SER 14 2HB SER 14 -8.077 -4.680 1.042
59 HG SER 14 HG SER 14 -8.819 -5.409 2.999
60 H HIS 15 H HIS 15 -4.529 -7.318 0.760
61 HA HIS 15 HA HIS 15 -3.478 -7.641 -1.231
62 HB3 HIS 15 2HB HIS 15 -4.818 -7.826 -3.232
63 HD1 HIS 15 1HD HIS 15 -4.423 -9.613 -0.566
64 HD2 HIS 15 2HD HIS 15 -7.931 -9.012 -2.709
65 HE1 HIS 15 1HE HIS 15 -5.882 -11.590 -0.033
66 H CYS 16 H CYS 16 -3.373 -5.062 0.015
67 HA CYS 16 HA CYS 16 -3.581 -3.058 -2.039
68 HB3 CYS 16 2HB CYS 16 -2.199 -1.755 -0.207
69 H ILE 17 H ILE 17 -2.091 -2.514 -3.489
70 HA ILE 17 HA ILE 17 0.210 -3.964 -3.979
71 HB ILE 17 HB ILE 17 0.876 -2.247 -5.521
72 HG13 ILE 17 2HG1 ILE 17 -0.738 -0.528 -3.721
73 HG21 ILE 17 1HG2 ILE 17 -1.472 -3.577 -5.647
74 HG22 ILE 17 2HG2 ILE 17 -2.033 -1.913 -5.809
75 HG23 ILE 17 3HG2 ILE 17 -0.846 -2.556 -6.942
76 HD11 ILE 17 3HD1 ILE 17 1.013 0.877 -3.788
77 HD12 ILE 17 1HD1 ILE 17 1.876 -0.572 -4.301
78 HD13 ILE 17 2HD1 ILE 17 1.318 0.594 -5.501
79 H CYS 18 H CYS 18 2.433 -3.527 -3.707
80 HA CYS 18 HA CYS 18 3.095 -1.577 -1.607
81 HB3 CYS 18 2HB CYS 18 4.898 -3.470 -1.042
82 H THR 19 H THR 19 4.263 -0.098 -2.659
83 HA THR 19 HA THR 19 6.311 -1.015 -4.563
84 HB THR 19 HB THR 19 5.811 1.862 -4.518
85 HG1 THR 19 1HG THR 19 3.700 0.170 -5.409
86 HG21 THR 19 3HG2 THR 19 6.711 -0.097 -6.298
87 HG22 THR 19 1HG2 THR 19 6.494 1.622 -6.628
88 HG23 THR 19 2HG2 THR 19 5.191 0.486 -6.977
89 H PHE 20 H PHE 20 8.068 0.936 -4.693
90 HA PHE 20 HA PHE 20 9.674 0.637 -2.430
91 HB3 PHE 20 2HB PHE 20 10.579 1.219 -4.629
92 HD1 PHE 20 2HD PHE 20 8.973 1.837 -6.348
93 HD2 PHE 20 1HD PHE 20 10.341 4.664 -3.474
94 HE1 PHE 20 2HE PHE 20 8.098 3.669 -7.738
95 HE2 PHE 20 1HE PHE 20 9.468 6.500 -4.860
96 HZ PHE 20 HZ PHE 20 8.344 6.004 -6.994
97 H ARG 21 H ARG 21 7.126 2.861 -3.100
98 HA ARG 21 HA ARG 21 7.907 4.614 -0.894
99 HB3 ARG 21 2HB ARG 21 5.681 5.774 -1.733
100 HG3 ARG 21 2HG ARG 21 7.172 6.647 -3.781
101 HD3 ARG 21 2HD ARG 21 8.370 8.074 -1.967
102 HE ARG 21 HE ARG 21 5.678 8.183 -2.858
103 HH11 ARG 21 1HH1 ARG 21 7.874 9.541 -0.522
104 HH12 ARG 21 2HH1 ARG 21 7.018 11.041 -0.395
105 HH21 ARG 21 1HH2 ARG 21 4.541 10.154 -2.699
106 HH22 ARG 21 2HH2 ARG 21 5.122 11.389 -1.633
107 H GLY 22 H GLY 22 6.897 1.816 -0.577
108 HA2 GLY 22 2HA GLY 22 5.743 0.875 1.224
109 HA3 GLY 22 3HA GLY 22 4.966 2.425 1.505
110 H CYS 23 H CYS 23 3.000 1.201 1.792
111 HA CYS 23 HA CYS 23 1.889 -0.082 -0.571
112 HB3 CYS 23 2HB CYS 23 0.108 -0.820 0.850
113 H GLY 24 H GLY 24 -0.670 0.436 -0.693
114 HA2 GLY 24 2HA GLY 24 -1.418 3.157 -0.320
115 HA3 GLY 24 3HA GLY 24 -0.918 2.873 -1.981
116 H ALA 25 H ALA 25 -3.560 3.560 -0.810
117 HA ALA 25 HA ALA 25 -5.115 1.178 -1.527
118 HB1 ALA 25 1HB ALA 25 -6.625 3.485 -0.581
119 HB2 ALA 25 2HB ALA 25 -6.632 1.813 -0.015
120 HB3 ALA 25 3HB ALA 25 -5.401 2.936 0.564
121 H VAL 26 H VAL 26 -7.079 1.506 -2.836
122 HA VAL 26 HA VAL 26 -6.552 2.585 -5.324
123 HB VAL 26 HB VAL 26 -8.991 2.446 -5.757
124 HG11 VAL 26 1HG1 VAL 26 -7.381 0.468 -5.773
125 HG12 VAL 26 2HG1 VAL 26 -8.108 0.013 -4.230
126 HG13 VAL 26 3HG1 VAL 26 -9.104 0.103 -5.684
127 HG21 VAL 26 3HG2 VAL 26 -9.974 3.139 -3.731
128 HG22 VAL 26 1HG2 VAL 26 -10.367 1.426 -3.877
129 HG23 VAL 26 2HG2 VAL 26 -9.077 1.946 -2.792
130 H ASN 27 H ASN 27 -6.686 4.550 -6.226
131 HA ASN 27 HA ASN 27 -6.922 6.802 -6.438
132 HB3 ASN 27 2HB ASN 27 -9.299 6.527 -4.594
133 HD21 ASN 27 1HD2 ASN 27 -8.360 7.915 -7.724
134 HD22 ASN 27 2HD2 ASN 27 -8.970 9.498 -7.396
135 H GLY 28 H GLY 28 -5.416 5.625 -4.137
136 HA2 GLY 28 2HA GLY 28 -4.308 6.337 -2.255
137 HA3 GLY 28 3HA GLY 28 -4.492 7.942 -2.945
138 H LEU 29 H LEU 29 -6.302 5.502 -1.095
139 HA LEU 29 HA LEU 29 -7.531 7.715 0.413
140 HB3 LEU 29 2HB LEU 29 -9.189 5.505 0.723
141 HG LEU 29 HG LEU 29 -9.697 8.056 0.145
142 HD11 LEU 29 1HD1 LEU 29 -9.932 6.589 -2.470
143 HD12 LEU 29 2HD1 LEU 29 -9.044 8.074 -2.128
144 HD13 LEU 29 3HD1 LEU 29 -10.807 8.079 -2.117
145 HD21 LEU 29 3HD2 LEU 29 -11.671 5.962 -0.700
146 HD22 LEU 29 1HD2 LEU 29 -11.961 7.492 0.128
147 HD23 LEU 29 2HD2 LEU 29 -11.197 6.155 0.988
148 HA PRO 30 HA PRO 30 -6.048 5.945 4.144
149 HB3 PRO 30 2HB PRO 30 -7.094 7.658 5.262
150 HG3 PRO 30 2HG PRO 30 -9.174 8.442 4.582
151 HD3 PRO 30 2HD PRO 30 -8.056 8.486 2.568
Start of MODEL 4
1 H1 SER 1 H SER 1 -7.510 3.185 2.656
2 HA SER 1 HA SER 1 -7.282 0.843 4.119
3 HB3 SER 1 2HB SER 1 -6.858 1.123 1.134
4 HG SER 1 HG SER 1 -8.238 -1.027 2.114
5 H CYS 2 H CYS 2 -4.867 2.483 2.127
6 HA CYS 2 HA CYS 2 -2.834 0.644 3.209
7 HB3 CYS 2 2HB CYS 2 -1.588 0.825 1.190
8 H ASN 3 H ASN 3 -2.014 1.753 4.897
9 HA ASN 3 HA ASN 3 -0.629 4.247 4.299
10 HB3 ASN 3 2HB ASN 3 -2.414 4.044 6.726
11 HD21 ASN 3 1HD2 ASN 3 -3.196 6.789 6.198
12 HD22 ASN 3 2HD2 ASN 3 -1.852 7.772 6.660
13 H ASN 4 H ASN 4 0.896 2.243 4.472
14 HA ASN 4 HA ASN 4 2.234 2.482 7.020
15 HB3 ASN 4 2HB ASN 4 0.487 0.567 7.158
16 HD21 ASN 4 1HD2 ASN 4 -0.340 -0.699 5.629
17 HD22 ASN 4 2HD2 ASN 4 0.539 -1.896 4.746
18 H SER 5 H SER 5 4.222 0.856 6.957
19 HA SER 5 HA SER 5 5.520 1.346 4.376
20 HB3 SER 5 2HB SER 5 7.638 0.936 5.631
21 HG SER 5 HG SER 5 7.488 2.853 6.872
22 H CYS 6 H CYS 6 6.388 -0.257 3.145
23 HA CYS 6 HA CYS 6 6.705 -2.940 4.101
24 HB3 CYS 6 2HB CYS 6 4.309 -3.011 3.778
25 H GLN 7 H GLN 7 7.182 -4.435 2.128
26 HA GLN 7 HA GLN 7 8.565 -2.922 0.027
27 HB3 GLN 7 2HB GLN 7 10.529 -4.318 0.210
28 HG3 GLN 7 2HG GLN 7 9.746 -3.350 2.950
29 HE21 GLN 7 1HE2 GLN 7 11.103 -3.924 4.473
30 HE22 GLN 7 2HE2 GLN 7 12.757 -4.371 4.257
31 H SER 8 H SER 8 7.430 -6.102 1.110
32 HA SER 8 HA SER 8 6.608 -6.671 -1.645
33 HB3 SER 8 2HB SER 8 8.010 -8.723 0.079
34 HG SER 8 HG SER 8 8.216 -9.621 -2.167
35 H HIS 9 H HIS 9 4.679 -5.866 -0.231
36 HA HIS 9 HA HIS 9 2.679 -6.316 0.759
37 HB3 HIS 9 2HB HIS 9 1.876 -8.763 0.364
38 HD1 HIS 9 1HD HIS 9 2.072 -9.126 -2.822
39 HD2 HIS 9 2HD HIS 9 1.190 -5.636 -0.749
40 HE1 HIS 9 1HE HIS 9 0.796 -7.686 -4.443
41 H SER 10 H SER 10 5.050 -6.544 2.388
42 HA SER 10 HA SER 10 4.722 -8.815 4.120
43 HB3 SER 10 2HB SER 10 6.546 -7.918 5.381
44 HG SER 10 HG SER 10 7.800 -8.325 3.760
45 H ASP 11 H ASP 11 4.192 -5.311 4.455
46 HA ASP 11 HA ASP 11 2.627 -5.806 6.881
47 HB3 ASP 11 2HB ASP 11 2.689 -3.292 7.088
48 H CYS 12 H CYS 12 2.331 -4.743 3.578
49 HA CYS 12 HA CYS 12 -0.102 -3.429 3.607
50 HB3 CYS 12 2HB CYS 12 -0.321 -4.052 1.265
51 H ALA 13 H ALA 13 -2.229 -4.029 3.560
52 HA ALA 13 HA ALA 13 -2.928 -6.857 3.548
53 HB1 ALA 13 1HB ALA 13 -3.150 -5.085 5.923
54 HB2 ALA 13 2HB ALA 13 -4.444 -6.246 5.626
55 HB3 ALA 13 3HB ALA 13 -2.784 -6.807 5.824
56 H SER 14 H SER 14 -5.336 -7.156 3.554
57 HA SER 14 HA SER 14 -7.349 -6.788 2.563
58 HB3 SER 14 2HB SER 14 -8.257 -4.432 2.742
59 HG SER 14 HG SER 14 -7.109 -5.559 5.083
60 H HIS 15 H HIS 15 -5.553 -7.215 0.709
61 HA HIS 15 HA HIS 15 -4.917 -6.859 -1.451
62 HB3 HIS 15 2HB HIS 15 -7.420 -5.211 -1.747
63 HD1 HIS 15 1HD HIS 15 -5.869 -8.264 -3.420
64 HD2 HIS 15 2HD HIS 15 -7.309 -4.476 -4.341
65 HE1 HIS 15 1HE HIS 15 -5.700 -8.070 -5.921
66 H CYS 16 H CYS 16 -3.455 -5.266 0.011
67 HA CYS 16 HA CYS 16 -3.660 -2.576 -1.164
68 HB3 CYS 16 2HB CYS 16 -1.801 -2.284 0.785
69 H ILE 17 H ILE 17 -2.343 -2.204 -2.808
70 HA ILE 17 HA ILE 17 -0.209 -3.918 -3.528
71 HB ILE 17 HB ILE 17 -1.403 -2.621 -5.209
72 HG13 ILE 17 2HG1 ILE 17 1.521 -1.878 -4.961
73 HG21 ILE 17 1HG2 ILE 17 -1.758 -0.415 -5.110
74 HG22 ILE 17 2HG2 ILE 17 -1.238 -0.546 -3.431
75 HG23 ILE 17 3HG2 ILE 17 -0.083 -0.073 -4.677
76 HD11 ILE 17 3HD1 ILE 17 0.262 -4.363 -5.527
77 HD12 ILE 17 1HD1 ILE 17 1.057 -3.779 -6.988
78 HD13 ILE 17 2HD1 ILE 17 1.981 -3.968 -5.496
79 H CYS 18 H CYS 18 1.835 -3.961 -2.874
80 HA CYS 18 HA CYS 18 2.844 -1.694 -1.296
81 HB3 CYS 18 2HB CYS 18 4.626 -3.597 -0.730
82 H THR 19 H THR 19 4.588 -0.576 -1.939
83 HA THR 19 HA THR 19 6.289 -1.665 -4.060
84 HB THR 19 HB THR 19 6.231 0.421 -5.331
85 HG1 THR 19 1HG THR 19 4.726 2.039 -4.757
86 HG21 THR 19 3HG2 THR 19 3.576 -0.900 -4.812
87 HG22 THR 19 1HG2 THR 19 4.707 -1.202 -6.131
88 HG23 THR 19 2HG2 THR 19 3.802 0.311 -6.074
89 H PHE 20 H PHE 20 7.998 0.309 -4.523
90 HA PHE 20 HA PHE 20 9.710 0.322 -2.336
91 HB3 PHE 20 2HB PHE 20 10.651 0.741 -4.469
92 HD1 PHE 20 1HD PHE 20 9.165 4.097 -3.938
93 HD2 PHE 20 2HD PHE 20 9.556 0.739 -6.524
94 HE1 PHE 20 1HE PHE 20 8.022 5.344 -5.724
95 HE2 PHE 20 2HE PHE 20 8.414 1.982 -8.314
96 HZ PHE 20 HZ PHE 20 7.646 4.287 -7.916
97 H ARG 21 H ARG 21 7.060 2.413 -3.102
98 HA ARG 21 HA ARG 21 7.845 4.323 -1.024
99 HB3 ARG 21 2HB ARG 21 7.170 5.385 -3.052
100 HG3 ARG 21 2HG ARG 21 4.911 3.456 -3.002
101 HD3 ARG 21 2HD ARG 21 3.754 5.583 -2.956
102 HE ARG 21 HE ARG 21 5.814 6.494 -4.744
103 HH11 ARG 21 1HH1 ARG 21 2.550 6.993 -3.639
104 HH12 ARG 21 2HH1 ARG 21 2.511 8.663 -4.098
105 HH21 ARG 21 1HH2 ARG 21 5.774 8.692 -5.354
106 HH22 ARG 21 2HH2 ARG 21 4.345 9.629 -5.075
107 H GLY 22 H GLY 22 6.894 1.576 -0.467
108 HA2 GLY 22 2HA GLY 22 5.694 0.688 1.304
109 HA3 GLY 22 3HA GLY 22 5.002 2.278 1.590
110 H CYS 23 H CYS 23 2.988 1.159 1.956
111 HA CYS 23 HA CYS 23 1.739 -0.087 -0.361
112 HB3 CYS 23 2HB CYS 23 -0.001 -0.775 1.121
113 H GLY 24 H GLY 24 0.106 0.778 -1.545
114 HA2 GLY 24 2HA GLY 24 -0.851 3.459 -0.754
115 HA3 GLY 24 3HA GLY 24 -0.343 3.118 -2.402
116 H ALA 25 H ALA 25 -2.964 3.949 -1.168
117 HA ALA 25 HA ALA 25 -4.624 1.714 -2.127
118 HB1 ALA 25 1HB ALA 25 -6.361 3.419 -0.877
119 HB2 ALA 25 2HB ALA 25 -5.614 2.001 -0.141
120 HB3 ALA 25 3HB ALA 25 -4.897 3.595 0.091
121 H VAL 26 H VAL 26 -6.513 2.223 -3.392
122 HA VAL 26 HA VAL 26 -6.034 3.852 -5.581
123 HB VAL 26 HB VAL 26 -8.439 3.635 -6.105
124 HG11 VAL 26 1HG1 VAL 26 -6.656 1.392 -5.461
125 HG12 VAL 26 2HG1 VAL 26 -8.360 0.966 -5.636
126 HG13 VAL 26 3HG1 VAL 26 -7.510 1.772 -6.955
127 HG21 VAL 26 3HG2 VAL 26 -9.616 3.795 -4.124
128 HG22 VAL 26 1HG2 VAL 26 -9.687 2.062 -4.445
129 HG23 VAL 26 2HG2 VAL 26 -8.534 2.695 -3.270
130 H ASN 27 H ASN 27 -6.167 5.969 -5.945
131 HA ASN 27 HA ASN 27 -6.565 8.190 -5.660
132 HB3 ASN 27 2HB ASN 27 -8.762 8.859 -4.806
133 HD21 ASN 27 1HD2 ASN 27 -7.907 8.614 -7.254
134 HD22 ASN 27 2HD2 ASN 27 -8.995 7.712 -8.247
135 H GLY 28 H GLY 28 -5.228 6.472 -3.517
136 HA2 GLY 28 2HA GLY 28 -4.197 6.843 -1.501
137 HA3 GLY 28 3HA GLY 28 -4.522 8.549 -1.770
138 H LEU 29 H LEU 29 -6.146 5.558 -0.732
139 HA LEU 29 HA LEU 29 -7.760 7.192 1.112
140 HB3 LEU 29 2HB LEU 29 -9.105 4.884 1.076
141 HG LEU 29 HG LEU 29 -9.466 7.360 -0.363
142 HD11 LEU 29 1HD1 LEU 29 -11.248 5.936 -1.838
143 HD12 LEU 29 2HD1 LEU 29 -9.842 4.873 -1.865
144 HD13 LEU 29 3HD1 LEU 29 -9.700 6.536 -2.432
145 HD21 LEU 29 3HD2 LEU 29 -11.927 6.378 0.005
146 HD22 LEU 29 1HD2 LEU 29 -10.987 7.124 1.298
147 HD23 LEU 29 2HD2 LEU 29 -11.043 5.367 1.151
148 HA PRO 30 HA PRO 30 -6.009 5.170 4.591
149 HB3 PRO 30 2HB PRO 30 -7.349 6.497 5.905
150 HG3 PRO 30 2HG PRO 30 -9.524 7.014 5.264
151 HD3 PRO 30 2HD PRO 30 -8.400 7.547 3.322
Start of MODEL 5
1 H1 SER 1 H SER 1 -7.373 4.323 2.878
2 HA SER 1 HA SER 1 -7.651 2.459 4.879
3 HB3 SER 1 2HB SER 1 -6.926 1.467 2.156
4 HG SER 1 HG SER 1 -9.351 0.836 3.220
5 H CYS 2 H CYS 2 -5.029 2.445 2.456
6 HA CYS 2 HA CYS 2 -3.389 0.929 4.371
7 HB3 CYS 2 2HB CYS 2 -2.035 0.304 2.346
8 H ASN 3 H ASN 3 -1.905 2.073 5.405
9 HA ASN 3 HA ASN 3 -0.336 4.051 3.942
10 HB3 ASN 3 2HB ASN 3 -0.762 5.849 5.362
11 HD21 ASN 3 1HD2 ASN 3 -3.462 4.825 6.946
12 HD22 ASN 3 2HD2 ASN 3 -4.656 5.231 5.763
13 H ASN 4 H ASN 4 0.677 1.680 4.513
14 HA ASN 4 HA ASN 4 2.498 2.226 6.753
15 HB3 ASN 4 2HB ASN 4 1.246 0.575 7.775
16 HD21 ASN 4 1HD2 ASN 4 1.919 -1.772 5.370
17 HD22 ASN 4 2HD2 ASN 4 0.289 -2.063 4.880
18 H SER 5 H SER 5 4.599 1.338 6.542
19 HA SER 5 HA SER 5 5.551 1.281 3.851
20 HB3 SER 5 2HB SER 5 7.766 0.940 4.865
21 HG SER 5 HG SER 5 7.826 2.894 5.762
22 H CYS 6 H CYS 6 6.682 -0.434 2.813
23 HA CYS 6 HA CYS 6 6.804 -3.066 3.838
24 HB3 CYS 6 2HB CYS 6 4.432 -3.164 3.595
25 H GLN 7 H GLN 7 7.044 -4.667 1.830
26 HA GLN 7 HA GLN 7 8.483 -3.309 -0.333
27 HB3 GLN 7 2HB GLN 7 10.197 -5.253 -0.101
28 HG3 GLN 7 2HG GLN 7 11.464 -4.016 1.709
29 HE21 GLN 7 1HE2 GLN 7 12.879 -2.431 1.003
30 HE22 GLN 7 2HE2 GLN 7 12.833 -1.797 -0.603
31 H SER 8 H SER 8 7.243 -6.397 0.902
32 HA SER 8 HA SER 8 6.281 -7.013 -1.797
33 HB3 SER 8 2HB SER 8 7.181 -9.197 -1.830
34 HG SER 8 HG SER 8 9.454 -8.404 -0.682
35 H HIS 9 H HIS 9 4.406 -6.133 -0.426
36 HA HIS 9 HA HIS 9 2.450 -6.469 0.698
37 HB3 HIS 9 2HB HIS 9 2.576 -9.388 0.064
38 HD1 HIS 9 1HD HIS 9 0.271 -7.068 -1.684
39 HD2 HIS 9 2HD HIS 9 0.256 -9.484 1.696
40 HE1 HIS 9 1HE HIS 9 -2.139 -7.233 -0.986
41 H SER 10 H SER 10 4.927 -6.798 2.202
42 HA SER 10 HA SER 10 4.575 -8.982 4.025
43 HB3 SER 10 2HB SER 10 6.346 -7.688 5.357
44 HG SER 10 HG SER 10 7.224 -9.226 4.136
45 H ASP 11 H ASP 11 3.830 -5.538 4.035
46 HA ASP 11 HA ASP 11 2.394 -5.916 6.581
47 HB3 ASP 11 2HB ASP 11 2.601 -3.291 6.580
48 H CYS 12 H CYS 12 2.171 -4.997 3.272
49 HA CYS 12 HA CYS 12 -0.190 -3.467 3.339
50 HB3 CYS 12 2HB CYS 12 -0.336 -3.868 0.968
51 H ALA 13 H ALA 13 -2.314 -4.148 2.479
52 HA ALA 13 HA ALA 13 -3.046 -6.916 2.591
53 HB1 ALA 13 1HB ALA 13 -3.041 -6.733 4.918
54 HB2 ALA 13 2HB ALA 13 -3.718 -5.105 4.884
55 HB3 ALA 13 3HB ALA 13 -4.731 -6.489 4.477
56 H SER 14 H SER 14 -5.447 -7.189 2.325
57 HA SER 14 HA SER 14 -7.328 -6.800 1.106
58 HB3 SER 14 2HB SER 14 -8.151 -4.364 1.142
59 HG SER 14 HG SER 14 -7.860 -4.788 3.756
60 H HIS 15 H HIS 15 -5.161 -7.153 -0.450
61 HA HIS 15 HA HIS 15 -4.264 -6.787 -2.513
62 HB3 HIS 15 2HB HIS 15 -5.812 -6.153 -4.254
63 HD1 HIS 15 1HD HIS 15 -5.354 -8.819 -2.623
64 HD2 HIS 15 2HD HIS 15 -9.033 -7.098 -3.496
65 HE1 HIS 15 1HE HIS 15 -7.020 -10.699 -2.510
66 H CYS 16 H CYS 16 -3.128 -5.079 -0.909
67 HA CYS 16 HA CYS 16 -3.353 -2.426 -2.165
68 HB3 CYS 16 2HB CYS 16 -1.859 -1.911 0.004
69 H ILE 17 H ILE 17 -1.858 -2.059 -3.655
70 HA ILE 17 HA ILE 17 0.411 -3.592 -4.125
71 HB ILE 17 HB ILE 17 -0.003 -0.693 -4.865
72 HG13 ILE 17 2HG1 ILE 17 -0.862 -1.559 -6.987
73 HG21 ILE 17 1HG2 ILE 17 2.069 -2.693 -5.526
74 HG22 ILE 17 2HG2 ILE 17 1.480 -1.695 -6.855
75 HG23 ILE 17 3HG2 ILE 17 2.178 -0.935 -5.424
76 HD11 ILE 17 3HD1 ILE 17 -1.465 -3.912 -7.240
77 HD12 ILE 17 1HD1 ILE 17 0.281 -3.689 -7.128
78 HD13 ILE 17 2HD1 ILE 17 -0.623 -4.285 -5.735
79 H CYS 18 H CYS 18 2.506 -3.511 -3.487
80 HA CYS 18 HA CYS 18 3.188 -1.522 -1.421
81 HB3 CYS 18 2HB CYS 18 4.960 -3.461 -0.905
82 H THR 19 H THR 19 5.020 -0.356 -1.638
83 HA THR 19 HA THR 19 7.016 -1.121 -3.617
84 HB THR 19 HB THR 19 6.972 1.329 -4.461
85 HG1 THR 19 1HG THR 19 4.214 1.183 -3.930
86 HG21 THR 19 3HG2 THR 19 4.631 -0.340 -5.337
87 HG22 THR 19 1HG2 THR 19 6.291 -0.824 -5.683
88 HG23 THR 19 2HG2 THR 19 5.669 0.703 -6.311
89 H PHE 20 H PHE 20 8.751 0.776 -3.658
90 HA PHE 20 HA PHE 20 9.995 0.798 -1.174
91 HB3 PHE 20 2HB PHE 20 11.081 1.234 -3.401
92 HD1 PHE 20 2HD PHE 20 9.365 2.031 -5.066
93 HD2 PHE 20 1HD PHE 20 11.318 4.642 -2.331
94 HE1 PHE 20 2HE PHE 20 8.752 3.956 -6.471
95 HE2 PHE 20 1HE PHE 20 10.707 6.572 -3.730
96 HZ PHE 20 HZ PHE 20 9.422 6.230 -5.802
97 H ARG 21 H ARG 21 7.561 2.891 -2.465
98 HA ARG 21 HA ARG 21 7.950 4.851 -0.332
99 HB3 ARG 21 2HB ARG 21 7.588 5.788 -2.521
100 HG3 ARG 21 2HG ARG 21 5.832 3.657 -2.941
101 HD3 ARG 21 2HD ARG 21 4.043 5.041 -1.971
102 HE ARG 21 HE ARG 21 4.288 7.277 -2.439
103 HH11 ARG 21 1HH1 ARG 21 4.414 5.442 -5.395
104 HH12 ARG 21 2HH1 ARG 21 4.340 6.839 -6.418
105 HH21 ARG 21 1HH2 ARG 21 4.191 9.123 -3.775
106 HH22 ARG 21 2HH2 ARG 21 4.214 8.932 -5.495
107 H GLY 22 H GLY 22 7.014 2.139 0.239
108 HA2 GLY 22 2HA GLY 22 5.552 1.272 1.808
109 HA3 GLY 22 3HA GLY 22 4.787 2.851 1.910
110 H CYS 23 H CYS 23 3.018 1.004 2.070
111 HA CYS 23 HA CYS 23 2.123 -0.114 -0.394
112 HB3 CYS 23 2HB CYS 23 0.167 -0.822 0.840
113 H GLY 24 H GLY 24 -0.491 0.339 -0.681
114 HA2 GLY 24 2HA GLY 24 -1.108 3.159 -0.629
115 HA3 GLY 24 3HA GLY 24 -0.768 2.539 -2.237
116 H ALA 25 H ALA 25 -3.257 3.617 -1.014
117 HA ALA 25 HA ALA 25 -4.994 1.257 -1.287
118 HB1 ALA 25 1HB ALA 25 -4.956 3.214 0.669
119 HB2 ALA 25 2HB ALA 25 -6.321 3.658 -0.354
120 HB3 ALA 25 3HB ALA 25 -6.249 2.052 0.371
121 H VAL 26 H VAL 26 -7.081 1.611 -2.384
122 HA VAL 26 HA VAL 26 -6.770 2.538 -4.985
123 HB VAL 26 HB VAL 26 -9.248 2.424 -5.158
124 HG11 VAL 26 1HG1 VAL 26 -9.182 0.177 -5.318
125 HG12 VAL 26 2HG1 VAL 26 -7.472 0.398 -4.942
126 HG13 VAL 26 3HG1 VAL 26 -8.610 -0.029 -3.664
127 HG21 VAL 26 3HG2 VAL 26 -9.925 3.220 -3.011
128 HG22 VAL 26 1HG2 VAL 26 -10.475 1.552 -3.158
129 HG23 VAL 26 2HG2 VAL 26 -9.048 1.927 -2.192
130 H ASN 27 H ASN 27 -6.945 4.464 -5.951
131 HA ASN 27 HA ASN 27 -7.226 6.698 -6.266
132 HB3 ASN 27 2HB ASN 27 -9.207 7.737 -5.414
133 HD21 ASN 27 1HD2 ASN 27 -10.810 5.096 -4.358
134 HD22 ASN 27 2HD2 ASN 27 -11.373 4.467 -5.865
135 H GLY 28 H GLY 28 -5.578 5.515 -3.952
136 HA2 GLY 28 2HA GLY 28 -4.164 6.332 -2.340
137 HA3 GLY 28 3HA GLY 28 -4.410 7.906 -3.082
138 H LEU 29 H LEU 29 -6.230 5.611 -1.045
139 HA LEU 29 HA LEU 29 -7.134 7.919 0.548
140 HB3 LEU 29 2HB LEU 29 -8.925 6.086 1.237
141 HG LEU 29 HG LEU 29 -8.968 8.053 -0.941
142 HD11 LEU 29 1HD1 LEU 29 -10.912 5.750 -0.925
143 HD12 LEU 29 2HD1 LEU 29 -9.766 6.152 -2.202
144 HD13 LEU 29 3HD1 LEU 29 -11.106 7.241 -1.847
145 HD21 LEU 29 3HD2 LEU 29 -11.272 8.381 0.165
146 HD22 LEU 29 1HD2 LEU 29 -9.828 8.783 1.093
147 HD23 LEU 29 2HD2 LEU 29 -10.673 7.266 1.394
148 HA PRO 30 HA PRO 30 -5.196 6.266 4.122
149 HB3 PRO 30 2HB PRO 30 -5.902 8.147 5.236
150 HG3 PRO 30 2HG PRO 30 -7.983 9.089 4.801
151 HD3 PRO 30 2HD PRO 30 -7.183 8.884 2.649
Start of MODEL 6
1 H1 SER 1 H SER 1 -7.146 3.662 2.944
2 HA SER 1 HA SER 1 -7.106 2.020 5.182
3 HB3 SER 1 2HB SER 1 -7.160 1.426 2.231
4 HG SER 1 HG SER 1 -7.643 -0.553 4.170
5 H CYS 2 H CYS 2 -4.910 1.728 2.384
6 HA CYS 2 HA CYS 2 -2.935 0.477 4.161
7 HB3 CYS 2 2HB CYS 2 -1.918 -0.443 2.162
8 H ASN 3 H ASN 3 -2.091 2.368 5.075
9 HA ASN 3 HA ASN 3 -0.468 3.985 3.223
10 HB3 ASN 3 2HB ASN 3 -0.775 5.801 5.075
11 HD21 ASN 3 1HD2 ASN 3 -2.043 7.548 4.468
12 HD22 ASN 3 2HD2 ASN 3 -2.978 7.546 3.016
13 H ASN 4 H ASN 4 0.614 1.738 4.268
14 HA ASN 4 HA ASN 4 2.438 2.783 6.331
15 HB3 ASN 4 2HB ASN 4 1.253 1.172 7.530
16 HD21 ASN 4 1HD2 ASN 4 2.419 -1.272 5.363
17 HD22 ASN 4 2HD2 ASN 4 0.873 -1.901 4.915
18 H SER 5 H SER 5 4.436 1.153 6.416
19 HA SER 5 HA SER 5 5.550 1.227 3.721
20 HB3 SER 5 2HB SER 5 7.710 0.997 4.777
21 HG SER 5 HG SER 5 7.565 2.760 6.311
22 H CYS 6 H CYS 6 6.728 -0.562 2.840
23 HA CYS 6 HA CYS 6 6.705 -3.148 3.980
24 HB3 CYS 6 2HB CYS 6 4.372 -3.253 3.603
25 H GLN 7 H GLN 7 6.901 -4.823 1.953
26 HA GLN 7 HA GLN 7 8.543 -3.610 -0.138
27 HB3 GLN 7 2HB GLN 7 9.589 -6.040 1.271
28 HG3 GLN 7 2HG GLN 7 11.172 -3.803 0.071
29 HE21 GLN 7 1HE2 GLN 7 12.822 -5.476 -1.366
30 HE22 GLN 7 2HE2 GLN 7 13.735 -6.455 -0.274
31 H SER 8 H SER 8 7.248 -6.656 1.161
32 HA SER 8 HA SER 8 6.472 -7.389 -1.580
33 HB3 SER 8 2HB SER 8 7.073 -9.714 -1.156
34 HG SER 8 HG SER 8 9.266 -8.107 -0.362
35 H HIS 9 H HIS 9 4.566 -6.212 -0.375
36 HA HIS 9 HA HIS 9 2.481 -6.324 0.540
37 HB3 HIS 9 2HB HIS 9 2.367 -9.252 -0.052
38 HD1 HIS 9 1HD HIS 9 0.194 -8.830 1.504
39 HD2 HIS 9 2HD HIS 9 0.204 -6.986 -2.219
40 HE1 HIS 9 1HE HIS 9 -2.200 -8.204 1.057
41 H SER 10 H SER 10 4.751 -6.883 2.291
42 HA SER 10 HA SER 10 4.009 -8.987 4.083
43 HB3 SER 10 2HB SER 10 5.863 -8.312 5.404
44 HG SER 10 HG SER 10 6.578 -9.069 3.413
45 H ASP 11 H ASP 11 3.992 -5.433 4.383
46 HA ASP 11 HA ASP 11 2.259 -5.623 6.714
47 HB3 ASP 11 2HB ASP 11 2.600 -3.224 6.934
48 H CYS 12 H CYS 12 2.033 -5.081 3.335
49 HA CYS 12 HA CYS 12 -0.329 -3.524 3.269
50 HB3 CYS 12 2HB CYS 12 -0.431 -4.058 0.935
51 H ALA 13 H ALA 13 -2.408 -4.348 2.309
52 HA ALA 13 HA ALA 13 -3.139 -7.073 2.577
53 HB1 ALA 13 1HB ALA 13 -3.766 -5.244 4.871
54 HB2 ALA 13 2HB ALA 13 -4.766 -6.651 4.508
55 HB3 ALA 13 3HB ALA 13 -3.060 -6.860 4.903
56 H SER 14 H SER 14 -5.551 -7.357 2.398
57 HA SER 14 HA SER 14 -7.474 -6.990 1.239
58 HB3 SER 14 2HB SER 14 -8.371 -4.628 1.301
59 HG SER 14 HG SER 14 -7.547 -5.085 3.894
60 H HIS 15 H HIS 15 -5.473 -7.441 -0.428
61 HA HIS 15 HA HIS 15 -4.650 -7.126 -2.530
62 HB3 HIS 15 2HB HIS 15 -6.261 -6.303 -4.191
63 HD1 HIS 15 1HD HIS 15 -5.796 -8.977 -2.206
64 HD2 HIS 15 2HD HIS 15 -9.264 -7.507 -3.960
65 HE1 HIS 15 1HE HIS 15 -7.372 -10.933 -2.320
66 H CYS 16 H CYS 16 -3.334 -5.479 -1.020
67 HA CYS 16 HA CYS 16 -3.434 -2.858 -2.363
68 HB3 CYS 16 2HB CYS 16 -2.057 -2.216 -0.194
69 H ILE 17 H ILE 17 -1.685 -2.218 -3.460
70 HA ILE 17 HA ILE 17 0.460 -4.014 -3.924
71 HB ILE 17 HB ILE 17 1.284 -2.479 -5.469
72 HG13 ILE 17 2HG1 ILE 17 0.709 -0.048 -5.414
73 HG21 ILE 17 1HG2 ILE 17 -0.496 -2.294 -6.826
74 HG22 ILE 17 2HG2 ILE 17 -1.353 -3.110 -5.520
75 HG23 ILE 17 3HG2 ILE 17 -1.419 -1.353 -5.653
76 HD11 ILE 17 3HD1 ILE 17 -1.342 -0.210 -4.044
77 HD12 ILE 17 1HD1 ILE 17 -0.337 -0.607 -2.650
78 HD13 ILE 17 2HD1 ILE 17 -0.176 0.964 -3.435
79 H CYS 18 H CYS 18 2.801 -3.045 -3.864
80 HA CYS 18 HA CYS 18 3.345 -1.483 -1.481
81 HB3 CYS 18 2HB CYS 18 5.081 -3.439 -0.915
82 H THR 19 H THR 19 4.898 -0.101 -1.985
83 HA THR 19 HA THR 19 7.035 -0.958 -3.814
84 HB THR 19 HB THR 19 7.024 1.212 -4.926
85 HG1 THR 19 1HG THR 19 4.841 1.729 -3.177
86 HG21 THR 19 3HG2 THR 19 4.644 1.047 -5.936
87 HG22 THR 19 1HG2 THR 19 4.480 -0.375 -4.907
88 HG23 THR 19 2HG2 THR 19 5.746 -0.315 -6.132
89 H PHE 20 H PHE 20 8.651 1.147 -3.861
90 HA PHE 20 HA PHE 20 10.000 1.072 -1.425
91 HB3 PHE 20 2HB PHE 20 11.245 1.673 -3.351
92 HD1 PHE 20 1HD PHE 20 9.661 4.978 -2.893
93 HD2 PHE 20 2HD PHE 20 10.348 1.704 -5.524
94 HE1 PHE 20 1HE PHE 20 8.752 6.295 -4.763
95 HE2 PHE 20 2HE PHE 20 9.441 3.014 -7.398
96 HZ PHE 20 HZ PHE 20 8.641 5.313 -7.019
97 H ARG 21 H ARG 21 7.364 3.044 -2.462
98 HA ARG 21 HA ARG 21 7.720 4.894 -0.221
99 HB3 ARG 21 2HB ARG 21 5.486 5.788 -1.422
100 HG3 ARG 21 2HG ARG 21 8.085 6.351 -2.790
101 HD3 ARG 21 2HD ARG 21 5.677 7.979 -2.000
102 HE ARG 21 HE ARG 21 8.258 8.980 -2.321
103 HH11 ARG 21 1HH1 ARG 21 5.068 9.484 -3.621
104 HH12 ARG 21 2HH1 ARG 21 5.337 11.158 -3.981
105 HH21 ARG 21 1HH2 ARG 21 8.625 11.182 -2.789
106 HH22 ARG 21 2HH2 ARG 21 7.361 12.122 -3.507
107 H GLY 22 H GLY 22 6.834 2.002 -0.066
108 HA2 GLY 22 2HA GLY 22 5.531 0.969 1.573
109 HA3 GLY 22 3HA GLY 22 4.666 2.482 1.805
110 H CYS 23 H CYS 23 2.831 0.909 1.881
111 HA CYS 23 HA CYS 23 2.007 -0.278 -0.612
112 HB3 CYS 23 2HB CYS 23 0.113 -1.105 0.594
113 H GLY 24 H GLY 24 -0.672 0.154 -0.762
114 HA2 GLY 24 2HA GLY 24 -1.333 2.945 -0.661
115 HA3 GLY 24 3HA GLY 24 -0.957 2.407 -2.291
116 H ALA 25 H ALA 25 -3.488 3.295 -0.828
117 HA ALA 25 HA ALA 25 -5.158 0.924 -1.229
118 HB1 ALA 25 1HB ALA 25 -6.559 3.319 -0.384
119 HB2 ALA 25 2HB ALA 25 -6.473 1.730 0.379
120 HB3 ALA 25 3HB ALA 25 -5.209 2.924 0.681
121 H VAL 26 H VAL 26 -7.262 1.239 -2.346
122 HA VAL 26 HA VAL 26 -6.900 2.130 -4.971
123 HB VAL 26 HB VAL 26 -9.315 1.818 -5.263
124 HG11 VAL 26 1HG1 VAL 26 -7.534 -0.097 -4.908
125 HG12 VAL 26 2HG1 VAL 26 -8.532 -0.442 -3.493
126 HG13 VAL 26 3HG1 VAL 26 -9.247 -0.462 -5.105
127 HG21 VAL 26 3HG2 VAL 26 -10.471 0.880 -3.095
128 HG22 VAL 26 1HG2 VAL 26 -9.271 1.888 -2.286
129 HG23 VAL 26 2HG2 VAL 26 -10.416 2.613 -3.414
130 H ASN 27 H ASN 27 -7.182 4.032 -5.967
131 HA ASN 27 HA ASN 27 -7.574 6.246 -6.303
132 HB3 ASN 27 2HB ASN 27 -9.689 6.124 -4.162
133 HD21 ASN 27 1HD2 ASN 27 -11.735 6.969 -5.724
134 HD22 ASN 27 2HD2 ASN 27 -11.418 8.563 -6.312
135 H GLY 28 H GLY 28 -5.766 5.276 -4.124
136 HA2 GLY 28 2HA GLY 28 -4.485 6.147 -2.427
137 HA3 GLY 28 3HA GLY 28 -4.802 7.694 -3.199
138 H LEU 29 H LEU 29 -6.251 5.347 -0.959
139 HA LEU 29 HA LEU 29 -7.323 7.623 0.568
140 HB3 LEU 29 2HB LEU 29 -9.033 5.502 1.088
141 HG LEU 29 HG LEU 29 -9.631 7.956 0.669
142 HD11 LEU 29 1HD1 LEU 29 -8.809 8.340 -1.500
143 HD12 LEU 29 2HD1 LEU 29 -10.562 8.280 -1.669
144 HD13 LEU 29 3HD1 LEU 29 -9.583 6.891 -2.140
145 HD21 LEU 29 3HD2 LEU 29 -11.884 7.409 0.359
146 HD22 LEU 29 1HD2 LEU 29 -11.185 5.967 1.095
147 HD23 LEU 29 2HD2 LEU 29 -11.500 6.005 -0.639
148 HA PRO 30 HA PRO 30 -5.543 5.843 4.161
149 HB3 PRO 30 2HB PRO 30 -6.402 7.612 5.350
150 HG3 PRO 30 2HG PRO 30 -8.509 8.471 4.867
151 HD3 PRO 30 2HD PRO 30 -7.597 8.443 2.749
Start of MODEL 7
1 H1 SER 1 H SER 1 -6.817 3.860 2.356
2 HA SER 1 HA SER 1 -7.569 2.225 4.484
3 HB3 SER 1 2HB SER 1 -6.849 1.099 1.787
4 HG SER 1 HG SER 1 -8.408 -0.316 2.264
5 H CYS 2 H CYS 2 -4.686 2.048 2.411
6 HA CYS 2 HA CYS 2 -3.373 0.474 4.520
7 HB3 CYS 2 2HB CYS 2 -2.172 -0.769 2.694
8 H ASN 3 H ASN 3 -1.489 1.287 5.170
9 HA ASN 3 HA ASN 3 0.300 2.654 3.396
10 HB3 ASN 3 2HB ASN 3 -0.932 4.273 5.634
11 HD21 ASN 3 1HD2 ASN 3 1.331 4.675 6.173
12 HD22 ASN 3 2HD2 ASN 3 2.199 5.865 5.271
13 H ASN 4 H ASN 4 1.863 1.228 4.062
14 HA ASN 4 HA ASN 4 2.890 1.668 6.771
15 HB3 ASN 4 2HB ASN 4 3.251 -0.696 7.143
16 HD21 ASN 4 1HD2 ASN 4 0.643 -1.740 5.419
17 HD22 ASN 4 2HD2 ASN 4 -0.606 -1.405 6.565
18 H SER 5 H SER 5 5.043 0.020 6.754
19 HA SER 5 HA SER 5 6.719 1.279 4.728
20 HB3 SER 5 2HB SER 5 7.853 -0.533 6.812
21 HG SER 5 HG SER 5 9.112 1.689 6.802
22 H CYS 6 H CYS 6 4.856 -1.251 4.564
23 HA CYS 6 HA CYS 6 6.326 -3.521 4.037
24 HB3 CYS 6 2HB CYS 6 3.879 -3.494 4.056
25 H GLN 7 H GLN 7 7.650 -4.205 2.459
26 HA GLN 7 HA GLN 7 8.151 -2.359 0.225
27 HB3 GLN 7 2HB GLN 7 10.319 -3.841 0.103
28 HG3 GLN 7 2HG GLN 7 11.392 -2.448 1.927
29 HE21 GLN 7 1HE2 GLN 7 12.417 -2.187 -0.121
30 HE22 GLN 7 2HE2 GLN 7 12.037 -0.831 -1.121
31 H SER 8 H SER 8 7.279 -5.611 1.073
32 HA SER 8 HA SER 8 6.737 -6.169 -1.746
33 HB3 SER 8 2HB SER 8 8.265 -8.061 0.059
34 HG SER 8 HG SER 8 8.023 -9.514 -1.476
35 H HIS 9 H HIS 9 4.693 -5.510 -0.361
36 HA HIS 9 HA HIS 9 2.661 -6.119 0.462
37 HB3 HIS 9 2HB HIS 9 3.225 -8.936 -0.427
38 HD1 HIS 9 1HD HIS 9 0.560 -6.490 -1.516
39 HD2 HIS 9 2HD HIS 9 0.955 -9.972 0.715
40 HE1 HIS 9 1HE HIS 9 -1.789 -7.231 -1.004
41 H SER 10 H SER 10 4.859 -6.208 2.265
42 HA SER 10 HA SER 10 4.643 -8.587 3.868
43 HB3 SER 10 2HB SER 10 6.074 -5.956 4.224
44 HG SER 10 HG SER 10 5.946 -8.147 6.025
45 H ASP 11 H ASP 11 4.234 -5.212 4.908
46 HA ASP 11 HA ASP 11 2.399 -5.978 6.969
47 HB3 ASP 11 2HB ASP 11 2.156 -3.315 6.966
48 H CYS 12 H CYS 12 2.123 -4.973 3.686
49 HA CYS 12 HA CYS 12 -0.435 -3.840 3.681
50 HB3 CYS 12 2HB CYS 12 -0.473 -4.297 1.308
51 H ALA 13 H ALA 13 -2.410 -4.835 2.733
52 HA ALA 13 HA ALA 13 -2.816 -7.625 2.710
53 HB1 ALA 13 1HB ALA 13 -2.606 -7.722 5.029
54 HB2 ALA 13 2HB ALA 13 -3.466 -6.200 5.266
55 HB3 ALA 13 3HB ALA 13 -4.349 -7.642 4.768
56 H SER 14 H SER 14 -5.151 -8.189 2.543
57 HA SER 14 HA SER 14 -7.207 -7.901 1.613
58 HB3 SER 14 2HB SER 14 -7.091 -4.978 2.322
59 HG SER 14 HG SER 14 -9.278 -6.576 2.880
60 H HIS 15 H HIS 15 -5.302 -7.982 -0.213
61 HA HIS 15 HA HIS 15 -4.667 -7.382 -2.319
62 HB3 HIS 15 2HB HIS 15 -6.570 -6.279 -3.671
63 HD1 HIS 15 1HD HIS 15 -6.434 -9.305 -1.418
64 HD2 HIS 15 2HD HIS 15 -7.815 -8.209 -5.180
65 HE1 HIS 15 1HE HIS 15 -7.127 -11.451 -2.531
66 H CYS 16 H CYS 16 -3.557 -5.706 -0.549
67 HA CYS 16 HA CYS 16 -3.953 -3.010 -1.665
68 HB3 CYS 16 2HB CYS 16 -2.510 -2.445 0.481
69 H ILE 17 H ILE 17 -2.525 -2.561 -3.203
70 HA ILE 17 HA ILE 17 -0.144 -3.924 -3.695
71 HB ILE 17 HB ILE 17 -0.826 -1.088 -4.483
72 HG13 ILE 17 2HG1 ILE 17 -1.612 -2.083 -6.586
73 HG21 ILE 17 1HG2 ILE 17 0.728 -2.075 -6.473
74 HG22 ILE 17 2HG2 ILE 17 1.326 -1.097 -5.134
75 HG23 ILE 17 3HG2 ILE 17 1.447 -2.855 -5.064
76 HD11 ILE 17 3HD1 ILE 17 -2.013 -4.477 -6.774
77 HD12 ILE 17 1HD1 ILE 17 -0.291 -4.117 -6.657
78 HD13 ILE 17 2HD1 ILE 17 -1.158 -4.741 -5.254
79 H CYS 18 H CYS 18 1.963 -3.613 -3.140
80 HA CYS 18 HA CYS 18 2.530 -1.474 -1.194
81 HB3 CYS 18 2HB CYS 18 4.331 -3.306 -0.449
82 H THR 19 H THR 19 3.744 -0.036 -2.243
83 HA THR 19 HA THR 19 5.872 -1.017 -4.024
84 HB THR 19 HB THR 19 5.368 1.854 -4.128
85 HG1 THR 19 1HG THR 19 3.279 0.140 -5.028
86 HG21 THR 19 3HG2 THR 19 6.316 -0.186 -5.788
87 HG22 THR 19 1HG2 THR 19 6.111 1.515 -6.204
88 HG23 THR 19 2HG2 THR 19 4.817 0.363 -6.538
89 H PHE 20 H PHE 20 7.590 0.999 -4.166
90 HA PHE 20 HA PHE 20 9.149 0.777 -1.867
91 HB3 PHE 20 2HB PHE 20 10.244 1.359 -3.889
92 HD1 PHE 20 1HD PHE 20 8.895 4.730 -3.196
93 HD2 PHE 20 2HD PHE 20 9.174 1.516 -5.973
94 HE1 PHE 20 1HE PHE 20 7.898 6.154 -4.937
95 HE2 PHE 20 2HE PHE 20 8.179 2.935 -7.719
96 HZ PHE 20 HZ PHE 20 7.538 5.257 -7.202
97 H ARG 21 H ARG 21 6.548 2.918 -2.610
98 HA ARG 21 HA ARG 21 7.222 4.722 -0.413
99 HB3 ARG 21 2HB ARG 21 4.870 5.671 -1.315
100 HG3 ARG 21 2HG ARG 21 7.361 6.153 -2.918
101 HD3 ARG 21 2HD ARG 21 5.057 7.909 -2.081
102 HE ARG 21 HE ARG 21 7.628 8.652 -3.091
103 HH11 ARG 21 1HH1 ARG 21 4.238 9.444 -3.130
104 HH12 ARG 21 2HH1 ARG 21 4.499 11.114 -3.514
105 HH21 ARG 21 1HH2 ARG 21 7.985 10.848 -3.596
106 HH22 ARG 21 2HH2 ARG 21 6.630 11.910 -3.779
107 H GLY 22 H GLY 22 6.278 1.850 -0.151
108 HA2 GLY 22 2HA GLY 22 5.184 0.863 1.668
109 HA3 GLY 22 3HA GLY 22 4.373 2.391 1.980
110 H CYS 23 H CYS 23 2.499 0.954 2.295
111 HA CYS 23 HA CYS 23 1.378 -0.311 -0.046
112 HB3 CYS 23 2HB CYS 23 -0.407 -1.021 1.394
113 H GLY 24 H GLY 24 -1.015 0.157 -0.526
114 HA2 GLY 24 2HA GLY 24 -1.851 2.900 -0.138
115 HA3 GLY 24 3HA GLY 24 -1.360 2.524 -1.783
116 H ALA 25 H ALA 25 -3.899 3.381 -1.332
117 HA ALA 25 HA ALA 25 -5.479 0.926 -1.739
118 HB1 ALA 25 1HB ALA 25 -6.764 3.385 -0.646
119 HB2 ALA 25 2HB ALA 25 -7.221 1.692 -0.452
120 HB3 ALA 25 3HB ALA 25 -5.840 2.339 0.435
121 H VAL 26 H VAL 26 -7.766 1.754 -2.696
122 HA VAL 26 HA VAL 26 -7.303 2.427 -5.346
123 HB VAL 26 HB VAL 26 -9.735 2.920 -5.491
124 HG11 VAL 26 1HG1 VAL 26 -8.603 0.448 -4.327
125 HG12 VAL 26 2HG1 VAL 26 -10.361 0.598 -4.328
126 HG13 VAL 26 3HG1 VAL 26 -9.465 0.697 -5.845
127 HG21 VAL 26 3HG2 VAL 26 -9.566 2.623 -2.501
128 HG22 VAL 26 1HG2 VAL 26 -10.187 3.990 -3.426
129 HG23 VAL 26 2HG2 VAL 26 -11.075 2.467 -3.400
130 H ASN 27 H ASN 27 -6.894 4.269 -6.378
131 HA ASN 27 HA ASN 27 -6.568 6.478 -6.810
132 HB3 ASN 27 2HB ASN 27 -8.795 6.988 -4.832
133 HD21 ASN 27 1HD2 ASN 27 -8.894 9.080 -4.504
134 HD22 ASN 27 2HD2 ASN 27 -8.597 10.314 -5.676
135 H GLY 28 H GLY 28 -5.208 5.151 -4.530
136 HA2 GLY 28 2HA GLY 28 -3.759 5.704 -2.837
137 HA3 GLY 28 3HA GLY 28 -3.700 7.292 -3.587
138 H LEU 29 H LEU 29 -5.748 5.316 -1.452
139 HA LEU 29 HA LEU 29 -6.313 7.763 0.088
140 HB3 LEU 29 2HB LEU 29 -8.421 6.021 0.578
141 HG LEU 29 HG LEU 29 -8.381 8.604 0.038
142 HD11 LEU 29 1HD1 LEU 29 -9.008 7.305 -2.597
143 HD12 LEU 29 2HD1 LEU 29 -7.836 8.576 -2.251
144 HD13 LEU 29 3HD1 LEU 29 -9.563 8.926 -2.182
145 HD21 LEU 29 3HD2 LEU 29 -10.687 8.577 0.184
146 HD22 LEU 29 1HD2 LEU 29 -10.258 7.003 0.856
147 HD23 LEU 29 2HD2 LEU 29 -10.838 7.123 -0.805
148 HA PRO 30 HA PRO 30 -4.985 5.674 3.711
149 HB3 PRO 30 2HB PRO 30 -5.491 7.584 4.885
150 HG3 PRO 30 2HG PRO 30 -7.376 8.844 4.368
151 HD3 PRO 30 2HD PRO 30 -6.456 8.628 2.267
Start of MODEL 8
1 H1 SER 1 H SER 1 -6.985 3.742 2.553
2 HA SER 1 HA SER 1 -7.471 2.081 4.691
3 HB3 SER 1 2HB SER 1 -6.717 1.442 1.839
4 HG SER 1 HG SER 1 -6.496 -0.546 2.451
5 H CYS 2 H CYS 2 -4.440 2.877 3.221
6 HA CYS 2 HA CYS 2 -3.084 1.113 5.142
7 HB3 CYS 2 2HB CYS 2 -1.284 0.827 3.361
8 H ASN 3 H ASN 3 -1.574 2.095 6.335
9 HA ASN 3 HA ASN 3 -0.414 4.613 5.368
10 HB3 ASN 3 2HB ASN 3 -2.254 5.197 6.885
11 HD21 ASN 3 1HD2 ASN 3 -0.705 5.314 9.675
12 HD22 ASN 3 2HD2 ASN 3 -1.406 3.969 10.501
13 H ASN 4 H ASN 4 0.537 1.805 5.635
14 HA ASN 4 HA ASN 4 2.713 2.215 7.575
15 HB3 ASN 4 2HB ASN 4 1.745 0.215 8.220
16 HD21 ASN 4 1HD2 ASN 4 2.434 -1.329 5.233
17 HD22 ASN 4 2HD2 ASN 4 0.805 -1.711 4.801
18 H SER 5 H SER 5 4.688 0.708 6.799
19 HA SER 5 HA SER 5 5.253 1.436 3.999
20 HB3 SER 5 2HB SER 5 7.382 2.220 4.536
21 HG SER 5 HG SER 5 7.015 3.354 6.706
22 H CYS 6 H CYS 6 5.565 -0.298 2.789
23 HA CYS 6 HA CYS 6 7.025 -2.581 3.914
24 HB3 CYS 6 2HB CYS 6 4.836 -3.402 4.079
25 H GLN 7 H GLN 7 7.800 -4.086 2.196
26 HA GLN 7 HA GLN 7 8.676 -2.524 -0.128
27 HB3 GLN 7 2HB GLN 7 10.484 -4.154 -0.336
28 HG3 GLN 7 2HG GLN 7 10.579 -2.256 1.416
29 HE21 GLN 7 1HE2 GLN 7 10.997 -5.495 2.811
30 HE22 GLN 7 2HE2 GLN 7 10.367 -5.091 4.368
31 H SER 8 H SER 8 7.754 -5.888 0.625
32 HA SER 8 HA SER 8 6.302 -5.983 -1.923
33 HB3 SER 8 2HB SER 8 8.358 -7.982 -0.969
34 HG SER 8 HG SER 8 7.487 -8.794 -3.242
35 H HIS 9 H HIS 9 4.437 -5.745 -0.571
36 HA HIS 9 HA HIS 9 2.675 -6.472 0.680
37 HB3 HIS 9 2HB HIS 9 3.337 -9.307 0.014
38 HD1 HIS 9 1HD HIS 9 0.551 -6.963 -1.063
39 HD2 HIS 9 2HD HIS 9 1.153 -10.372 1.235
40 HE1 HIS 9 1HE HIS 9 -1.744 -7.721 -0.370
41 H SER 10 H SER 10 5.263 -6.284 2.011
42 HA SER 10 HA SER 10 5.557 -8.488 3.797
43 HB3 SER 10 2HB SER 10 6.954 -6.728 5.102
44 HG SER 10 HG SER 10 8.133 -6.805 2.669
45 H ASP 11 H ASP 11 3.965 -5.343 3.978
46 HA ASP 11 HA ASP 11 2.461 -6.302 6.299
47 HB3 ASP 11 2HB ASP 11 2.708 -3.789 7.107
48 H CYS 12 H CYS 12 1.926 -5.857 3.410
49 HA CYS 12 HA CYS 12 0.036 -3.634 3.442
50 HB3 CYS 12 2HB CYS 12 -0.129 -3.919 1.074
51 H ALA 13 H ALA 13 -2.178 -3.882 2.950
52 HA ALA 13 HA ALA 13 -3.382 -6.463 2.680
53 HB1 ALA 13 1HB ALA 13 -3.185 -5.220 5.354
54 HB2 ALA 13 2HB ALA 13 -4.746 -5.912 4.914
55 HB3 ALA 13 3HB ALA 13 -3.299 -6.919 4.896
56 H SER 14 H SER 14 -5.870 -6.228 2.993
57 HA SER 14 HA SER 14 -7.773 -5.326 2.125
58 HB3 SER 14 2HB SER 14 -8.193 -2.929 2.747
59 HG SER 14 HG SER 14 -8.248 -4.885 4.256
60 H HIS 15 H HIS 15 -6.076 -5.777 0.140
61 HA HIS 15 HA HIS 15 -5.567 -5.244 -2.012
62 HB3 HIS 15 2HB HIS 15 -7.425 -2.890 -1.848
63 HD1 HIS 15 1HD HIS 15 -5.094 -3.983 -3.953
64 HD2 HIS 15 2HD HIS 15 -9.228 -3.967 -4.367
65 HE1 HIS 15 1HE HIS 15 -5.521 -4.056 -6.430
66 H CYS 16 H CYS 16 -3.508 -4.567 -0.834
67 HA CYS 16 HA CYS 16 -2.875 -1.825 -1.655
68 HB3 CYS 16 2HB CYS 16 -1.334 -1.883 0.496
69 H ILE 17 H ILE 17 -1.018 -1.663 -2.753
70 HA ILE 17 HA ILE 17 0.731 -4.031 -2.825
71 HB ILE 17 HB ILE 17 -0.396 -3.404 -4.969
72 HG13 ILE 17 2HG1 ILE 17 2.625 -3.209 -4.901
73 HG21 ILE 17 1HG2 ILE 17 -0.229 -1.373 -5.916
74 HG22 ILE 17 2HG2 ILE 17 0.173 -0.845 -4.283
75 HG23 ILE 17 3HG2 ILE 17 1.460 -1.178 -5.444
76 HD11 ILE 17 3HD1 ILE 17 0.927 -5.379 -4.287
77 HD12 ILE 17 1HD1 ILE 17 1.667 -5.703 -5.855
78 HD13 ILE 17 2HD1 ILE 17 2.683 -5.367 -4.453
79 H CYS 18 H CYS 18 2.924 -3.814 -2.590
80 HA CYS 18 HA CYS 18 3.865 -1.157 -1.733
81 HB3 CYS 18 2HB CYS 18 5.339 -2.195 -0.204
82 H THR 19 H THR 19 5.224 -0.197 -3.076
83 HA THR 19 HA THR 19 7.021 -1.869 -4.706
84 HB THR 19 HB THR 19 5.555 0.628 -5.574
85 HG1 THR 19 1HG THR 19 5.467 -2.105 -6.361
86 HG21 THR 19 3HG2 THR 19 7.755 -0.925 -6.935
87 HG22 THR 19 1HG2 THR 19 7.773 0.775 -6.466
88 HG23 THR 19 2HG2 THR 19 6.711 0.229 -7.764
89 H PHE 20 H PHE 20 6.704 1.649 -4.419
90 HA PHE 20 HA PHE 20 9.421 1.724 -3.281
91 HB3 PHE 20 2HB PHE 20 9.234 2.457 -5.701
92 HD1 PHE 20 2HD PHE 20 6.836 2.759 -6.381
93 HD2 PHE 20 1HD PHE 20 9.036 5.761 -4.314
94 HE1 PHE 20 2HE PHE 20 5.197 4.449 -7.096
95 HE2 PHE 20 1HE PHE 20 7.399 7.455 -5.027
96 HZ PHE 20 HZ PHE 20 5.477 6.800 -6.421
97 H ARG 21 H ARG 21 6.226 3.169 -3.400
98 HA ARG 21 HA ARG 21 6.902 4.951 -1.178
99 HB3 ARG 21 2HB ARG 21 5.740 5.994 -3.033
100 HG3 ARG 21 2HG ARG 21 4.336 3.642 -3.300
101 HD3 ARG 21 2HD ARG 21 2.111 5.479 -3.001
102 HE ARG 21 HE ARG 21 2.057 2.993 -1.576
103 HH11 ARG 21 1HH1 ARG 21 1.848 4.469 -4.722
104 HH12 ARG 21 2HH1 ARG 21 0.929 3.174 -5.413
105 HH21 ARG 21 1HH2 ARG 21 0.846 1.281 -2.475
106 HH22 ARG 21 2HH2 ARG 21 0.358 1.361 -4.134
107 H GLY 22 H GLY 22 6.652 2.051 -0.846
108 HA2 GLY 22 2HA GLY 22 5.846 0.649 0.791
109 HA3 GLY 22 3HA GLY 22 5.071 2.048 1.518
110 H CYS 23 H CYS 23 3.325 0.548 2.000
111 HA CYS 23 HA CYS 23 1.784 -0.525 -0.186
112 HB3 CYS 23 2HB CYS 23 0.347 -1.445 1.485
113 H GLY 24 H GLY 24 -0.021 0.299 -1.100
114 HA2 GLY 24 2HA GLY 24 -1.241 2.682 0.114
115 HA3 GLY 24 3HA GLY 24 -0.682 2.765 -1.551
116 H ALA 25 H ALA 25 -3.362 3.178 -0.646
117 HA ALA 25 HA ALA 25 -4.791 0.787 -1.539
118 HB1 ALA 25 1HB ALA 25 -6.455 3.064 -0.865
119 HB2 ALA 25 2HB ALA 25 -6.446 1.433 -0.195
120 HB3 ALA 25 3HB ALA 25 -5.333 2.650 0.431
121 H VAL 26 H VAL 26 -6.875 1.405 -2.859
122 HA VAL 26 HA VAL 26 -6.011 2.258 -5.399
123 HB VAL 26 HB VAL 26 -8.423 2.226 -6.015
124 HG11 VAL 26 1HG1 VAL 26 -8.633 -0.112 -5.924
125 HG12 VAL 26 2HG1 VAL 26 -6.893 0.188 -5.901
126 HG13 VAL 26 3HG1 VAL 26 -7.740 -0.218 -4.409
127 HG21 VAL 26 3HG2 VAL 26 -8.741 2.503 -3.195
128 HG22 VAL 26 1HG2 VAL 26 -9.975 2.523 -4.455
129 HG23 VAL 26 2HG2 VAL 26 -9.503 0.997 -3.706
130 H ASN 27 H ASN 27 -6.103 4.174 -6.441
131 HA ASN 27 HA ASN 27 -6.234 6.424 -6.753
132 HB3 ASN 27 2HB ASN 27 -8.314 7.541 -5.820
133 HD21 ASN 27 1HD2 ASN 27 -10.100 4.852 -6.259
134 HD22 ASN 27 2HD2 ASN 27 -10.259 4.875 -7.979
135 H GLY 28 H GLY 28 -4.877 5.257 -4.323
136 HA2 GLY 28 2HA GLY 28 -3.751 6.020 -2.472
137 HA3 GLY 28 3HA GLY 28 -3.867 7.604 -3.226
138 H LEU 29 H LEU 29 -5.672 5.306 -1.217
139 HA LEU 29 HA LEU 29 -6.879 7.614 0.156
140 HB3 LEU 29 2HB LEU 29 -8.630 5.471 0.498
141 HG LEU 29 HG LEU 29 -8.940 8.080 -0.251
142 HD11 LEU 29 1HD1 LEU 29 -8.572 7.771 -2.564
143 HD12 LEU 29 2HD1 LEU 29 -10.319 7.903 -2.359
144 HD13 LEU 29 3HD1 LEU 29 -9.578 6.323 -2.607
145 HD21 LEU 29 3HD2 LEU 29 -10.454 6.221 0.891
146 HD22 LEU 29 1HD2 LEU 29 -11.234 6.251 -0.691
147 HD23 LEU 29 2HD2 LEU 29 -11.126 7.729 0.267
148 HA PRO 30 HA PRO 30 -5.511 5.891 3.953
149 HB3 PRO 30 2HB PRO 30 -6.460 7.700 5.003
150 HG3 PRO 30 2HG PRO 30 -8.487 8.581 4.280
151 HD3 PRO 30 2HD PRO 30 -7.356 8.489 2.274
Start of MODEL 9
1 H1 SER 1 H SER 1 -6.540 3.852 2.714
2 HA SER 1 HA SER 1 -7.145 2.439 5.145
3 HB3 SER 1 2HB SER 1 -6.577 1.128 2.494
4 HG SER 1 HG SER 1 -8.628 0.054 3.489
5 H CYS 2 H CYS 2 -4.699 1.796 2.629
6 HA CYS 2 HA CYS 2 -2.966 0.668 4.715
7 HB3 CYS 2 2HB CYS 2 -1.860 -0.571 2.987
8 H ASN 3 H ASN 3 -1.696 2.226 5.526
9 HA ASN 3 HA ASN 3 -0.046 3.746 3.633
10 HB3 ASN 3 2HB ASN 3 -1.059 5.036 6.152
11 HD21 ASN 3 1HD2 ASN 3 -0.157 6.942 6.411
12 HD22 ASN 3 2HD2 ASN 3 0.642 7.865 5.189
13 H ASN 4 H ASN 4 1.285 1.798 4.352
14 HA ASN 4 HA ASN 4 2.930 2.636 6.630
15 HB3 ASN 4 2HB ASN 4 1.354 0.788 7.312
16 HD21 ASN 4 1HD2 ASN 4 0.164 -0.642 6.270
17 HD22 ASN 4 2HD2 ASN 4 0.762 -1.924 5.277
18 H SER 5 H SER 5 4.870 0.793 6.620
19 HA SER 5 HA SER 5 6.077 1.152 3.973
20 HB3 SER 5 2HB SER 5 7.517 2.072 5.574
21 HG SER 5 HG SER 5 8.072 0.583 7.458
22 H CYS 6 H CYS 6 6.149 -0.516 2.638
23 HA CYS 6 HA CYS 6 6.629 -3.197 3.689
24 HB3 CYS 6 2HB CYS 6 4.231 -3.167 3.576
25 H GLN 7 H GLN 7 7.027 -4.770 1.857
26 HA GLN 7 HA GLN 7 8.250 -3.412 -0.448
27 HB3 GLN 7 2HB GLN 7 10.083 -5.097 -0.358
28 HG3 GLN 7 2HG GLN 7 9.840 -3.523 2.195
29 HE21 GLN 7 1HE2 GLN 7 11.962 -2.786 2.940
30 HE22 GLN 7 2HE2 GLN 7 13.312 -3.851 2.774
31 H SER 8 H SER 8 6.947 -6.428 0.858
32 HA SER 8 HA SER 8 5.945 -7.081 -1.814
33 HB3 SER 8 2HB SER 8 7.283 -9.162 -0.075
34 HG SER 8 HG SER 8 6.091 -10.228 -1.506
35 H HIS 9 H HIS 9 4.179 -6.066 -0.303
36 HA HIS 9 HA HIS 9 2.233 -6.321 0.850
37 HB3 HIS 9 2HB HIS 9 2.175 -9.233 0.180
38 HD1 HIS 9 1HD HIS 9 -0.085 -7.031 -1.654
39 HD2 HIS 9 2HD HIS 9 -0.053 -8.945 2.034
40 HE1 HIS 9 1HE HIS 9 -2.470 -6.993 -0.856
41 H SER 10 H SER 10 4.759 -6.849 2.252
42 HA SER 10 HA SER 10 4.325 -9.023 4.061
43 HB3 SER 10 2HB SER 10 6.191 -7.699 5.361
44 HG SER 10 HG SER 10 7.327 -9.179 4.421
45 H ASP 11 H ASP 11 3.670 -5.580 4.071
46 HA ASP 11 HA ASP 11 2.401 -5.874 6.715
47 HB3 ASP 11 2HB ASP 11 2.647 -3.220 6.550
48 H CYS 12 H CYS 12 2.005 -4.948 3.408
49 HA CYS 12 HA CYS 12 -0.399 -3.469 3.680
50 HB3 CYS 12 2HB CYS 12 -0.585 -3.630 1.297
51 H ALA 13 H ALA 13 -2.496 -4.204 2.705
52 HA ALA 13 HA ALA 13 -3.098 -6.995 2.638
53 HB1 ALA 13 1HB ALA 13 -3.085 -7.043 4.956
54 HB2 ALA 13 2HB ALA 13 -3.762 -5.419 5.095
55 HB3 ALA 13 3HB ALA 13 -4.786 -6.761 4.582
56 H SER 14 H SER 14 -5.461 -7.377 2.337
57 HA SER 14 HA SER 14 -7.417 -6.967 1.250
58 HB3 SER 14 2HB SER 14 -7.112 -4.030 1.829
59 HG SER 14 HG SER 14 -9.449 -4.633 2.404
60 H HIS 15 H HIS 15 -5.363 -7.266 -0.412
61 HA HIS 15 HA HIS 15 -4.535 -6.814 -2.488
62 HB3 HIS 15 2HB HIS 15 -6.260 -5.666 -4.033
63 HD1 HIS 15 1HD HIS 15 -6.105 -8.648 -1.807
64 HD2 HIS 15 2HD HIS 15 -7.857 -7.537 -5.406
65 HE1 HIS 15 1HE HIS 15 -6.923 -10.788 -2.846
66 H CYS 16 H CYS 16 -3.485 -5.104 -0.693
67 HA CYS 16 HA CYS 16 -3.673 -2.431 -1.898
68 HB3 CYS 16 2HB CYS 16 -2.151 -1.987 0.258
69 H ILE 17 H ILE 17 -2.215 -2.034 -3.418
70 HA ILE 17 HA ILE 17 0.029 -3.528 -4.019
71 HB ILE 17 HB ILE 17 -0.301 -0.569 -4.524
72 HG13 ILE 17 2HG1 ILE 17 -1.238 -1.276 -6.705
73 HG21 ILE 17 1HG2 ILE 17 1.579 -2.647 -5.528
74 HG22 ILE 17 2HG2 ILE 17 1.065 -1.365 -6.623
75 HG23 ILE 17 3HG2 ILE 17 1.878 -0.960 -5.112
76 HD11 ILE 17 3HD1 ILE 17 -2.093 -3.900 -5.985
77 HD12 ILE 17 1HD1 ILE 17 -1.236 -3.362 -7.428
78 HD13 ILE 17 2HD1 ILE 17 -0.331 -3.830 -5.988
79 H CYS 18 H CYS 18 2.226 -3.335 -3.603
80 HA CYS 18 HA CYS 18 2.985 -1.527 -1.408
81 HB3 CYS 18 2HB CYS 18 4.630 -3.577 -0.906
82 H THR 19 H THR 19 4.641 -0.263 -1.905
83 HA THR 19 HA THR 19 6.688 -1.231 -3.768
84 HB THR 19 HB THR 19 6.725 0.918 -4.960
85 HG1 THR 19 1HG THR 19 4.585 1.485 -3.194
86 HG21 THR 19 3HG2 THR 19 4.172 -0.664 -4.938
87 HG22 THR 19 1HG2 THR 19 5.490 -0.707 -6.108
88 HG23 THR 19 2HG2 THR 19 4.405 0.683 -6.051
89 H PHE 20 H PHE 20 8.375 0.792 -3.932
90 HA PHE 20 HA PHE 20 9.698 0.835 -1.473
91 HB3 PHE 20 2HB PHE 20 10.721 1.246 -3.739
92 HD1 PHE 20 2HD PHE 20 8.921 2.019 -5.345
93 HD2 PHE 20 1HD PHE 20 11.000 4.663 -2.738
94 HE1 PHE 20 2HE PHE 20 8.257 3.923 -6.755
95 HE2 PHE 20 1HE PHE 20 10.340 6.572 -4.143
96 HZ PHE 20 HZ PHE 20 8.966 6.204 -6.153
97 H ARG 21 H ARG 21 7.145 2.799 -2.674
98 HA ARG 21 HA ARG 21 7.599 4.879 -0.674
99 HB3 ARG 21 2HB ARG 21 5.328 5.664 -1.854
100 HG3 ARG 21 2HG ARG 21 7.582 6.070 -3.679
101 HD3 ARG 21 2HD ARG 21 6.330 8.177 -1.989
102 HE ARG 21 HE ARG 21 7.741 8.152 -4.430
103 HH11 ARG 21 1HH1 ARG 21 5.045 9.702 -2.867
104 HH12 ARG 21 2HH1 ARG 21 5.188 11.166 -3.781
105 HH21 ARG 21 1HH2 ARG 21 7.940 10.074 -5.642
106 HH22 ARG 21 2HH2 ARG 21 6.834 11.376 -5.361
107 H GLY 22 H GLY 22 6.716 2.041 -0.110
108 HA2 GLY 22 2HA GLY 22 5.454 1.151 1.617
109 HA3 GLY 22 3HA GLY 22 4.739 2.736 1.865
110 H CYS 23 H CYS 23 2.918 1.023 2.194
111 HA CYS 23 HA CYS 23 1.721 -0.141 -0.091
112 HB3 CYS 23 2HB CYS 23 -0.196 -0.555 1.341
113 H GLY 24 H GLY 24 -0.825 0.487 -0.318
114 HA2 GLY 24 2HA GLY 24 -1.541 3.203 -0.241
115 HA3 GLY 24 3HA GLY 24 -0.848 2.860 -1.820
116 H ALA 25 H ALA 25 -3.677 3.299 -0.442
117 HA ALA 25 HA ALA 25 -5.136 0.995 -1.365
118 HB1 ALA 25 1HB ALA 25 -6.964 1.898 -0.336
119 HB2 ALA 25 2HB ALA 25 -5.681 2.705 0.568
120 HB3 ALA 25 3HB ALA 25 -6.511 3.555 -0.736
121 H VAL 26 H VAL 26 -7.288 1.732 -2.652
122 HA VAL 26 HA VAL 26 -6.283 2.602 -5.235
123 HB VAL 26 HB VAL 26 -8.430 1.897 -6.128
124 HG11 VAL 26 1HG1 VAL 26 -6.648 0.190 -4.639
125 HG12 VAL 26 2HG1 VAL 26 -8.278 -0.486 -4.686
126 HG13 VAL 26 3HG1 VAL 26 -7.440 -0.093 -6.188
127 HG21 VAL 26 3HG2 VAL 26 -10.109 2.401 -4.662
128 HG22 VAL 26 1HG2 VAL 26 -9.930 0.681 -4.321
129 HG23 VAL 26 2HG2 VAL 26 -9.189 1.872 -3.253
130 H ASN 27 H ASN 27 -6.934 4.402 -6.349
131 HA ASN 27 HA ASN 27 -7.678 6.524 -6.684
132 HB3 ASN 27 2HB ASN 27 -9.892 6.059 -4.710
133 HD21 ASN 27 1HD2 ASN 27 -9.235 6.867 -8.106
134 HD22 ASN 27 2HD2 ASN 27 -10.202 8.297 -8.128
135 H GLY 28 H GLY 28 -5.815 5.923 -4.498
136 HA2 GLY 28 2HA GLY 28 -4.799 6.985 -2.732
137 HA3 GLY 28 3HA GLY 28 -5.490 8.452 -3.409
138 H LEU 29 H LEU 29 -6.166 5.731 -1.251
139 HA LEU 29 HA LEU 29 -7.844 7.533 0.349
140 HB3 LEU 29 2HB LEU 29 -8.501 4.708 -0.465
141 HG LEU 29 HG LEU 29 -9.188 5.630 1.987
142 HD11 LEU 29 1HD1 LEU 29 -11.292 6.605 2.037
143 HD12 LEU 29 2HD1 LEU 29 -11.644 6.171 0.364
144 HD13 LEU 29 3HD1 LEU 29 -10.491 7.457 0.718
145 HD21 LEU 29 3HD2 LEU 29 -11.323 4.085 1.446
146 HD22 LEU 29 1HD2 LEU 29 -9.703 3.449 1.733
147 HD23 LEU 29 2HD2 LEU 29 -10.284 3.666 0.082
148 HA PRO 30 HA PRO 30 -5.290 6.103 3.649
149 HB3 PRO 30 2HB PRO 30 -5.907 8.024 4.747
150 HG3 PRO 30 2HG PRO 30 -8.031 8.932 4.476
151 HD3 PRO 30 2HD PRO 30 -7.439 8.643 2.268
Start of MODEL 10
1 H1 SER 1 H SER 1 -6.956 3.744 2.754
2 HA SER 1 HA SER 1 -7.301 2.481 5.318
3 HB3 SER 1 2HB SER 1 -7.288 1.275 2.539
4 HG SER 1 HG SER 1 -8.788 -0.137 4.073
5 H CYS 2 H CYS 2 -4.859 2.560 2.797
6 HA CYS 2 HA CYS 2 -3.096 0.974 4.545
7 HB3 CYS 2 2HB CYS 2 -1.996 0.104 2.508
8 H ASN 3 H ASN 3 -2.160 2.788 5.482
9 HA ASN 3 HA ASN 3 -0.603 4.501 3.658
10 HB3 ASN 3 2HB ASN 3 -2.426 5.577 5.099
11 HD21 ASN 3 1HD2 ASN 3 -0.695 7.105 7.148
12 HD22 ASN 3 2HD2 ASN 3 -0.940 6.208 8.605
13 H ASN 4 H ASN 4 0.104 1.867 4.850
14 HA ASN 4 HA ASN 4 2.353 2.658 6.567
15 HB3 ASN 4 2HB ASN 4 0.889 0.948 7.520
16 HD21 ASN 4 1HD2 ASN 4 1.041 -1.687 7.437
17 HD22 ASN 4 2HD2 ASN 4 0.356 -2.320 5.983
18 H SER 5 H SER 5 4.423 1.563 6.217
19 HA SER 5 HA SER 5 5.088 1.548 3.400
20 HB3 SER 5 2HB SER 5 7.446 1.133 4.357
21 HG SER 5 HG SER 5 7.090 3.425 5.479
22 H CYS 6 H CYS 6 6.384 -0.168 2.434
23 HA CYS 6 HA CYS 6 6.618 -2.733 3.594
24 HB3 CYS 6 2HB CYS 6 4.270 -2.982 3.403
25 H GLN 7 H GLN 7 7.006 -4.431 1.757
26 HA GLN 7 HA GLN 7 8.389 -3.119 -0.485
27 HB3 GLN 7 2HB GLN 7 9.992 -5.222 -0.159
28 HG3 GLN 7 2HG GLN 7 10.229 -2.760 1.557
29 HE21 GLN 7 1HE2 GLN 7 11.149 -4.559 2.991
30 HE22 GLN 7 2HE2 GLN 7 12.836 -4.878 2.802
31 H SER 8 H SER 8 7.203 -6.237 0.755
32 HA SER 8 HA SER 8 6.174 -6.828 -1.926
33 HB3 SER 8 2HB SER 8 7.111 -8.978 -2.021
34 HG SER 8 HG SER 8 8.749 -7.427 -2.293
35 H HIS 9 H HIS 9 4.356 -5.936 -0.432
36 HA HIS 9 HA HIS 9 2.408 -6.298 0.688
37 HB3 HIS 9 2HB HIS 9 2.524 -9.216 0.069
38 HD1 HIS 9 1HD HIS 9 0.474 -9.172 1.756
39 HD2 HIS 9 2HD HIS 9 -0.042 -7.003 -1.750
40 HE1 HIS 9 1HE HIS 9 -1.997 -8.738 1.592
41 H SER 10 H SER 10 4.979 -6.702 2.096
42 HA SER 10 HA SER 10 4.573 -8.845 3.964
43 HB3 SER 10 2HB SER 10 6.463 -6.502 4.247
44 HG SER 10 HG SER 10 7.655 -8.047 5.437
45 H ASP 11 H ASP 11 3.905 -5.412 3.857
46 HA ASP 11 HA ASP 11 2.709 -5.601 6.544
47 HB3 ASP 11 2HB ASP 11 3.239 -3.350 6.955
48 H CYS 12 H CYS 12 2.215 -4.833 3.211
49 HA CYS 12 HA CYS 12 -0.157 -3.322 3.431
50 HB3 CYS 12 2HB CYS 12 -0.467 -3.757 1.085
51 H ALA 13 H ALA 13 -2.330 -4.037 2.792
52 HA ALA 13 HA ALA 13 -3.010 -6.816 2.963
53 HB1 ALA 13 1HB ALA 13 -4.482 -6.498 4.994
54 HB2 ALA 13 2HB ALA 13 -2.745 -6.555 5.297
55 HB3 ALA 13 3HB ALA 13 -3.589 -5.007 5.296
56 H SER 14 H SER 14 -5.379 -7.154 2.819
57 HA SER 14 HA SER 14 -7.394 -6.771 1.837
58 HB3 SER 14 2HB SER 14 -6.908 -3.828 2.327
59 HG SER 14 HG SER 14 -8.927 -3.689 1.800
60 H HIS 15 H HIS 15 -5.449 -7.211 0.071
61 HA HIS 15 HA HIS 15 -4.747 -6.902 -2.076
62 HB3 HIS 15 2HB HIS 15 -6.570 -5.794 -3.565
63 HD1 HIS 15 1HD HIS 15 -6.032 -8.729 -1.401
64 HD2 HIS 15 2HD HIS 15 -8.426 -7.699 -4.637
65 HE1 HIS 15 1HE HIS 15 -6.938 -10.902 -2.286
66 H CYS 16 H CYS 16 -3.561 -5.103 -0.472
67 HA CYS 16 HA CYS 16 -3.781 -2.519 -1.858
68 HB3 CYS 16 2HB CYS 16 -2.209 -1.890 0.192
69 H ILE 17 H ILE 17 -2.378 -2.290 -3.464
70 HA ILE 17 HA ILE 17 -0.156 -3.853 -3.983
71 HB ILE 17 HB ILE 17 -1.193 -2.363 -5.647
72 HG13 ILE 17 2HG1 ILE 17 1.754 -1.829 -5.206
73 HG21 ILE 17 1HG2 ILE 17 0.312 -0.072 -4.433
74 HG22 ILE 17 2HG2 ILE 17 -0.981 -0.041 -5.632
75 HG23 ILE 17 3HG2 ILE 17 -1.345 -0.440 -3.953
76 HD11 ILE 17 3HD1 ILE 17 0.351 -4.235 -5.973
77 HD12 ILE 17 1HD1 ILE 17 1.472 -3.695 -7.223
78 HD13 ILE 17 2HD1 ILE 17 2.053 -3.991 -5.584
79 H CYS 18 H CYS 18 2.055 -3.616 -3.670
80 HA CYS 18 HA CYS 18 2.870 -1.612 -1.672
81 HB3 CYS 18 2HB CYS 18 4.586 -3.582 -1.094
82 H THR 19 H THR 19 4.668 -0.489 -2.128
83 HA THR 19 HA THR 19 6.561 -1.504 -4.103
84 HB THR 19 HB THR 19 6.560 0.596 -5.380
85 HG1 THR 19 1HG THR 19 5.376 2.260 -4.773
86 HG21 THR 19 3HG2 THR 19 3.777 -0.562 -5.244
87 HG22 THR 19 1HG2 THR 19 5.132 -1.336 -6.065
88 HG23 THR 19 2HG2 THR 19 4.538 0.228 -6.625
89 H PHE 20 H PHE 20 8.259 0.488 -4.420
90 HA PHE 20 HA PHE 20 9.704 0.609 -2.042
91 HB3 PHE 20 2HB PHE 20 10.757 0.927 -4.218
92 HD1 PHE 20 2HD PHE 20 9.312 1.148 -6.147
93 HD2 PHE 20 1HD PHE 20 10.157 4.479 -3.635
94 HE1 PHE 20 2HE PHE 20 8.444 2.667 -7.876
95 HE2 PHE 20 1HE PHE 20 9.289 6.004 -5.361
96 HZ PHE 20 HZ PHE 20 8.432 5.098 -7.485
97 H ARG 21 H ARG 21 7.127 2.595 -3.200
98 HA ARG 21 HA ARG 21 7.667 4.675 -1.219
99 HB3 ARG 21 2HB ARG 21 5.450 5.577 -2.347
100 HG3 ARG 21 2HG ARG 21 7.032 6.222 -4.416
101 HD3 ARG 21 2HD ARG 21 6.087 7.535 -2.320
102 HE ARG 21 HE ARG 21 8.704 6.843 -1.412
103 HH11 ARG 21 1HH1 ARG 21 6.311 9.372 -1.429
104 HH12 ARG 21 2HH1 ARG 21 6.878 10.097 0.039
105 HH21 ARG 21 1HH2 ARG 21 9.459 7.788 0.521
106 HH22 ARG 21 2HH2 ARG 21 8.668 9.196 1.147
107 H GLY 22 H GLY 22 6.773 1.898 -0.559
108 HA2 GLY 22 2HA GLY 22 5.517 1.079 1.211
109 HA3 GLY 22 3HA GLY 22 4.770 2.662 1.370
110 H CYS 23 H CYS 23 2.845 1.273 1.753
111 HA CYS 23 HA CYS 23 1.722 -0.029 -0.583
112 HB3 CYS 23 2HB CYS 23 -0.049 -0.747 0.863
113 H GLY 24 H GLY 24 -0.814 0.454 -0.769
114 HA2 GLY 24 2HA GLY 24 -1.645 3.149 -0.415
115 HA3 GLY 24 3HA GLY 24 -1.078 2.895 -2.059
116 H ALA 25 H ALA 25 -3.773 3.516 -1.028
117 HA ALA 25 HA ALA 25 -5.236 1.093 -1.814
118 HB1 ALA 25 1HB ALA 25 -6.552 3.537 -0.700
119 HB2 ALA 25 2HB ALA 25 -7.060 1.850 -0.608
120 HB3 ALA 25 3HB ALA 25 -5.703 2.417 0.366
121 H VAL 26 H VAL 26 -7.498 1.855 -2.846
122 HA VAL 26 HA VAL 26 -6.885 2.715 -5.454
123 HB VAL 26 HB VAL 26 -9.326 2.804 -5.814
124 HG11 VAL 26 1HG1 VAL 26 -9.699 0.492 -5.626
125 HG12 VAL 26 2HG1 VAL 26 -7.950 0.660 -5.782
126 HG13 VAL 26 3HG1 VAL 26 -8.669 0.357 -4.200
127 HG21 VAL 26 3HG2 VAL 26 -9.388 2.453 -2.830
128 HG22 VAL 26 1HG2 VAL 26 -10.184 3.685 -3.810
129 HG23 VAL 26 2HG2 VAL 26 -10.753 2.017 -3.856
130 H ASN 27 H ASN 27 -6.759 4.671 -6.350
131 HA ASN 27 HA ASN 27 -6.707 6.936 -6.565
132 HB3 ASN 27 2HB ASN 27 -8.756 8.147 -5.669
133 HD21 ASN 27 1HD2 ASN 27 -9.949 5.000 -6.497
134 HD22 ASN 27 2HD2 ASN 27 -10.303 5.345 -8.153
135 H GLY 28 H GLY 28 -5.429 5.661 -4.209
136 HA2 GLY 28 2HA GLY 28 -4.212 6.363 -2.392
137 HA3 GLY 28 3HA GLY 28 -4.555 8.008 -2.907
138 H LEU 29 H LEU 29 -6.561 5.331 -1.671
139 HA LEU 29 HA LEU 29 -7.933 7.221 0.075
140 HB3 LEU 29 2HB LEU 29 -8.459 4.336 -0.612
141 HG LEU 29 HG LEU 29 -9.357 5.385 1.719
142 HD11 LEU 29 1HD1 LEU 29 -11.902 5.609 0.421
143 HD12 LEU 29 2HD1 LEU 29 -10.781 6.795 -0.244
144 HD13 LEU 29 3HD1 LEU 29 -11.089 6.750 1.491
145 HD21 LEU 29 3HD2 LEU 29 -11.002 3.558 -0.020
146 HD22 LEU 29 1HD2 LEU 29 -10.928 3.600 1.742
147 HD23 LEU 29 2HD2 LEU 29 -9.532 3.051 0.814
148 HA PRO 30 HA PRO 30 -5.618 6.064 3.646
149 HB3 PRO 30 2HB PRO 30 -6.364 8.031 4.571
150 HG3 PRO 30 2HG PRO 30 -8.480 8.862 4.079
151 HD3 PRO 30 2HD PRO 30 -7.707 8.456 1.945
Start of MODEL 11
1 H1 SER 1 H SER 1 -7.413 3.898 3.158
2 HA SER 1 HA SER 1 -7.208 2.368 5.491
3 HB3 SER 1 2HB SER 1 -7.492 1.304 2.671
4 HG SER 1 HG SER 1 -8.188 0.316 5.232
5 H CYS 2 H CYS 2 -5.270 2.259 2.512
6 HA CYS 2 HA CYS 2 -3.271 0.654 3.962
7 HB3 CYS 2 2HB CYS 2 -2.542 -0.223 1.849
8 H ASN 3 H ASN 3 -1.894 2.104 4.832
9 HA ASN 3 HA ASN 3 -0.312 3.705 2.997
10 HB3 ASN 3 2HB ASN 3 -1.606 4.997 5.406
11 HD21 ASN 3 1HD2 ASN 3 -1.348 7.275 5.447
12 HD22 ASN 3 2HD2 ASN 3 0.022 8.020 4.703
13 H ASN 4 H ASN 4 0.859 1.667 3.916
14 HA ASN 4 HA ASN 4 2.500 2.603 6.162
15 HB3 ASN 4 2HB ASN 4 1.242 1.022 7.310
16 HD21 ASN 4 1HD2 ASN 4 2.327 -1.616 5.444
17 HD22 ASN 4 2HD2 ASN 4 0.789 -2.113 4.832
18 H SER 5 H SER 5 4.425 0.851 6.351
19 HA SER 5 HA SER 5 5.732 0.977 3.752
20 HB3 SER 5 2HB SER 5 7.742 0.185 5.143
21 HG SER 5 HG SER 5 8.086 2.245 5.134
22 H CYS 6 H CYS 6 6.479 -0.768 2.611
23 HA CYS 6 HA CYS 6 6.523 -3.424 3.599
24 HB3 CYS 6 2HB CYS 6 4.143 -3.386 3.496
25 H GLN 7 H GLN 7 7.081 -4.998 1.911
26 HA GLN 7 HA GLN 7 8.372 -3.679 -0.386
27 HB3 GLN 7 2HB GLN 7 9.281 -6.341 0.624
28 HG3 GLN 7 2HG GLN 7 10.899 -4.008 -0.355
29 HE21 GLN 7 1HE2 GLN 7 12.160 -4.902 1.545
30 HE22 GLN 7 2HE2 GLN 7 13.251 -6.196 1.203
31 H SER 8 H SER 8 6.843 -6.706 0.677
32 HA SER 8 HA SER 8 5.774 -7.031 -2.034
33 HB3 SER 8 2HB SER 8 6.453 -9.268 -2.243
34 HG SER 8 HG SER 8 8.462 -8.746 -2.482
35 H HIS 9 H HIS 9 3.845 -6.205 -1.012
36 HA HIS 9 HA HIS 9 1.914 -6.332 0.235
37 HB3 HIS 9 2HB HIS 9 1.433 -7.709 -1.739
38 HD1 HIS 9 1HD HIS 9 3.394 -9.149 -2.671
39 HD2 HIS 9 2HD HIS 9 1.344 -10.872 0.504
40 HE1 HIS 9 1HE HIS 9 4.107 -11.560 -2.641
41 H SER 10 H SER 10 4.101 -6.689 1.910
42 HA SER 10 HA SER 10 3.707 -9.025 3.548
43 HB3 SER 10 2HB SER 10 5.418 -6.556 3.914
44 HG SER 10 HG SER 10 6.166 -8.683 5.379
45 H ASP 11 H ASP 11 3.512 -5.535 4.270
46 HA ASP 11 HA ASP 11 1.662 -6.134 6.455
47 HB3 ASP 11 2HB ASP 11 2.009 -3.503 6.712
48 H CYS 12 H CYS 12 1.722 -4.860 3.266
49 HA CYS 12 HA CYS 12 -0.410 -3.108 3.217
50 HB3 CYS 12 2HB CYS 12 -0.656 -3.669 0.859
51 H ALA 13 H ALA 13 -2.507 -3.284 3.634
52 HA ALA 13 HA ALA 13 -3.655 -5.942 4.023
53 HB1 ALA 13 1HB ALA 13 -3.948 -4.352 5.828
54 HB2 ALA 13 2HB ALA 13 -4.728 -3.213 4.729
55 HB3 ALA 13 3HB ALA 13 -5.510 -4.748 5.109
56 H SER 14 H SER 14 -5.911 -6.306 3.283
57 HA SER 14 HA SER 14 -7.346 -6.623 1.541
58 HB3 SER 14 2HB SER 14 -7.963 -4.419 0.324
59 HG SER 14 HG SER 14 -8.368 -3.914 2.979
60 H HIS 15 H HIS 15 -4.555 -7.088 1.013
61 HA HIS 15 HA HIS 15 -3.127 -7.516 -0.708
62 HB3 HIS 15 2HB HIS 15 -4.348 -7.741 -3.006
63 HD1 HIS 15 1HD HIS 15 -2.790 -9.529 -0.962
64 HD2 HIS 15 2HD HIS 15 -6.724 -10.122 -2.161
65 HE1 HIS 15 1HE HIS 15 -3.256 -11.966 -0.559
66 H CYS 16 H CYS 16 -3.744 -4.700 0.029
67 HA CYS 16 HA CYS 16 -3.804 -3.052 -2.242
68 HB3 CYS 16 2HB CYS 16 -2.549 -1.440 -0.569
69 H ILE 17 H ILE 17 -2.185 -2.024 -3.410
70 HA ILE 17 HA ILE 17 0.044 -3.478 -4.130
71 HB ILE 17 HB ILE 17 0.865 -1.526 -5.268
72 HG13 ILE 17 2HG1 ILE 17 -0.704 -0.113 -3.185
73 HG21 ILE 17 1HG2 ILE 17 -2.035 -1.004 -5.501
74 HG22 ILE 17 2HG2 ILE 17 -0.840 -1.352 -6.749
75 HG23 ILE 17 3HG2 ILE 17 -1.500 -2.662 -5.771
76 HD11 ILE 17 3HD1 ILE 17 1.441 1.268 -4.621
77 HD12 ILE 17 1HD1 ILE 17 1.147 1.106 -2.890
78 HD13 ILE 17 2HD1 ILE 17 1.934 -0.200 -3.777
79 H CYS 18 H CYS 18 2.354 -2.854 -3.911
80 HA CYS 18 HA CYS 18 3.082 -1.466 -1.468
81 HB3 CYS 18 2HB CYS 18 4.606 -3.617 -1.019
82 H THR 19 H THR 19 4.630 -0.133 -2.108
83 HA THR 19 HA THR 19 6.775 -1.179 -3.823
84 HB THR 19 HB THR 19 6.865 0.930 -5.070
85 HG1 THR 19 1HG THR 19 5.715 2.599 -4.453
86 HG21 THR 19 3HG2 THR 19 4.674 0.689 -6.296
87 HG22 THR 19 1HG2 THR 19 4.211 -0.502 -5.080
88 HG23 THR 19 2HG2 THR 19 5.605 -0.798 -6.121
89 H PHE 20 H PHE 20 8.508 0.777 -3.963
90 HA PHE 20 HA PHE 20 9.718 0.890 -1.452
91 HB3 PHE 20 2HB PHE 20 10.833 1.207 -3.699
92 HD1 PHE 20 2HD PHE 20 9.077 2.014 -5.359
93 HD2 PHE 20 1HD PHE 20 11.230 4.625 -2.777
94 HE1 PHE 20 2HE PHE 20 8.529 3.911 -6.826
95 HE2 PHE 20 1HE PHE 20 10.685 6.527 -4.240
96 HZ PHE 20 HZ PHE 20 9.332 6.172 -6.267
97 H ARG 21 H ARG 21 7.278 2.876 -2.852
98 HA ARG 21 HA ARG 21 7.677 5.002 -0.889
99 HB3 ARG 21 2HB ARG 21 5.463 5.760 -2.240
100 HG3 ARG 21 2HG ARG 21 7.902 6.183 -3.824
101 HD3 ARG 21 2HD ARG 21 5.722 7.481 -3.933
102 HE ARG 21 HE ARG 21 6.166 7.940 -1.231
103 HH11 ARG 21 1HH1 ARG 21 5.515 9.793 -4.105
104 HH12 ARG 21 2HH1 ARG 21 4.697 11.064 -3.259
105 HH21 ARG 21 1HH2 ARG 21 5.091 9.608 -0.105
106 HH22 ARG 21 2HH2 ARG 21 4.457 10.958 -0.983
107 H GLY 22 H GLY 22 6.669 2.195 -0.322
108 HA2 GLY 22 2HA GLY 22 5.316 1.440 1.418
109 HA3 GLY 22 3HA GLY 22 4.559 3.025 1.481
110 H CYS 23 H CYS 23 2.855 1.070 1.780
111 HA CYS 23 HA CYS 23 1.845 -0.069 -0.624
112 HB3 CYS 23 2HB CYS 23 -0.026 -0.810 0.723
113 H GLY 24 H GLY 24 -0.840 0.336 -0.648
114 HA2 GLY 24 2HA GLY 24 -1.569 3.097 -0.560
115 HA3 GLY 24 3HA GLY 24 -1.196 2.586 -2.200
116 H ALA 25 H ALA 25 -3.741 3.440 -0.892
117 HA ALA 25 HA ALA 25 -5.339 1.002 -1.282
118 HB1 ALA 25 1HB ALA 25 -6.924 3.155 -0.307
119 HB2 ALA 25 2HB ALA 25 -6.495 1.645 0.497
120 HB3 ALA 25 3HB ALA 25 -5.452 3.057 0.660
121 H VAL 26 H VAL 26 -7.617 1.534 -2.173
122 HA VAL 26 HA VAL 26 -7.410 2.274 -4.830
123 HB VAL 26 HB VAL 26 -9.895 2.504 -4.805
124 HG11 VAL 26 1HG1 VAL 26 -9.545 0.053 -3.255
125 HG12 VAL 26 2HG1 VAL 26 -10.073 0.275 -4.924
126 HG13 VAL 26 3HG1 VAL 26 -8.351 0.258 -4.536
127 HG21 VAL 26 3HG2 VAL 26 -9.463 2.194 -1.845
128 HG22 VAL 26 1HG2 VAL 26 -10.349 3.460 -2.698
129 HG23 VAL 26 2HG2 VAL 26 -11.002 1.823 -2.623
130 H ASN 27 H ASN 27 -7.139 4.160 -5.812
131 HA ASN 27 HA ASN 27 -7.051 6.394 -6.225
132 HB3 ASN 27 2HB ASN 27 -8.953 7.756 -5.506
133 HD21 ASN 27 1HD2 ASN 27 -9.238 7.396 -7.716
134 HD22 ASN 27 2HD2 ASN 27 -10.309 6.176 -8.306
135 H GLY 28 H GLY 28 -5.576 5.256 -3.945
136 HA2 GLY 28 2HA GLY 28 -4.285 5.961 -2.180
137 HA3 GLY 28 3HA GLY 28 -4.377 7.542 -2.941
138 H LEU 29 H LEU 29 -6.328 5.361 -0.911
139 HA LEU 29 HA LEU 29 -7.257 7.740 0.559
140 HB3 LEU 29 2HB LEU 29 -9.068 5.730 1.116
141 HG LEU 29 HG LEU 29 -9.539 8.171 0.481
142 HD11 LEU 29 1HD1 LEU 29 -8.739 8.491 -1.646
143 HD12 LEU 29 2HD1 LEU 29 -10.442 8.167 -1.971
144 HD13 LEU 29 3HD1 LEU 29 -9.243 6.892 -2.196
145 HD21 LEU 29 3HD2 LEU 29 -11.827 7.636 -0.148
146 HD22 LEU 29 1HD2 LEU 29 -11.258 6.538 1.110
147 HD23 LEU 29 2HD2 LEU 29 -11.345 5.992 -0.565
148 HA PRO 30 HA PRO 30 -5.679 6.070 4.296
149 HB3 PRO 30 2HB PRO 30 -6.525 7.915 5.370
150 HG3 PRO 30 2HG PRO 30 -8.582 8.817 4.767
151 HD3 PRO 30 2HD PRO 30 -7.592 8.665 2.691
Start of MODEL 12
1 H1 SER 1 H SER 1 -6.724 3.488 2.445
2 HA SER 1 HA SER 1 -7.757 2.030 4.704
3 HB3 SER 1 2HB SER 1 -6.866 1.036 1.985
4 HG SER 1 HG SER 1 -8.545 -0.616 2.737
5 H CYS 2 H CYS 2 -4.696 2.277 2.980
6 HA CYS 2 HA CYS 2 -3.424 0.787 5.174
7 HB3 CYS 2 2HB CYS 2 -1.885 -0.254 3.554
8 H ASN 3 H ASN 3 -2.015 2.044 6.182
9 HA ASN 3 HA ASN 3 -0.448 3.967 4.601
10 HB3 ASN 3 2HB ASN 3 -2.006 5.373 5.671
11 HD21 ASN 3 1HD2 ASN 3 -3.205 6.083 7.496
12 HD22 ASN 3 2HD2 ASN 3 -3.648 4.970 8.741
13 H ASN 4 H ASN 4 0.774 1.726 4.921
14 HA ASN 4 HA ASN 4 2.708 2.225 7.063
15 HB3 ASN 4 2HB ASN 4 1.574 0.528 8.154
16 HD21 ASN 4 1HD2 ASN 4 2.086 -1.970 5.984
17 HD22 ASN 4 2HD2 ASN 4 0.449 -2.225 5.492
18 H SER 5 H SER 5 4.777 1.157 6.711
19 HA SER 5 HA SER 5 5.498 1.214 3.917
20 HB3 SER 5 2HB SER 5 7.793 1.027 4.702
21 HG SER 5 HG SER 5 7.706 3.009 5.372
22 H CYS 6 H CYS 6 6.554 -0.476 2.788
23 HA CYS 6 HA CYS 6 6.815 -3.101 3.853
24 HB3 CYS 6 2HB CYS 6 4.446 -3.260 3.711
25 H GLN 7 H GLN 7 7.154 -4.721 1.959
26 HA GLN 7 HA GLN 7 8.468 -3.347 -0.286
27 HB3 GLN 7 2HB GLN 7 10.196 -5.239 -0.151
28 HG3 GLN 7 2HG GLN 7 10.067 -3.110 1.963
29 HE21 GLN 7 1HE2 GLN 7 11.566 -3.056 3.489
30 HE22 GLN 7 2HE2 GLN 7 12.934 -4.106 3.596
31 H SER 8 H SER 8 7.031 -6.328 0.943
32 HA SER 8 HA SER 8 6.002 -6.901 -1.717
33 HB3 SER 8 2HB SER 8 7.748 -8.840 -0.183
34 HG SER 8 HG SER 8 7.182 -9.892 -2.454
35 H HIS 9 H HIS 9 4.214 -6.103 -0.205
36 HA HIS 9 HA HIS 9 2.333 -6.501 1.020
37 HB3 HIS 9 2HB HIS 9 1.389 -8.867 0.715
38 HD1 HIS 9 1HD HIS 9 0.572 -6.093 -0.224
39 HD2 HIS 9 2HD HIS 9 1.761 -9.126 -2.802
40 HE1 HIS 9 1HE HIS 9 -0.435 -5.512 -2.454
41 H SER 10 H SER 10 4.902 -6.811 2.363
42 HA SER 10 HA SER 10 4.643 -9.029 4.180
43 HB3 SER 10 2HB SER 10 6.461 -6.648 4.539
44 HG SER 10 HG SER 10 6.601 -8.058 6.224
45 H ASP 11 H ASP 11 3.980 -5.578 4.225
46 HA ASP 11 HA ASP 11 2.799 -5.890 6.907
47 HB3 ASP 11 2HB ASP 11 3.174 -3.492 7.236
48 H CYS 12 H CYS 12 2.269 -4.990 3.619
49 HA CYS 12 HA CYS 12 -0.093 -3.472 3.944
50 HB3 CYS 12 2HB CYS 12 -0.415 -3.755 1.582
51 H ALA 13 H ALA 13 -2.254 -4.202 3.104
52 HA ALA 13 HA ALA 13 -2.928 -6.971 3.194
53 HB1 ALA 13 1HB ALA 13 -2.853 -7.027 5.479
54 HB2 ALA 13 2HB ALA 13 -3.280 -5.323 5.647
55 HB3 ALA 13 3HB ALA 13 -4.522 -6.506 5.239
56 H SER 14 H SER 14 -5.294 -7.313 3.010
57 HA SER 14 HA SER 14 -7.300 -6.893 2.023
58 HB3 SER 14 2HB SER 14 -6.964 -3.948 2.495
59 HG SER 14 HG SER 14 -9.164 -4.132 2.945
60 H HIS 15 H HIS 15 -5.329 -7.239 0.263
61 HA HIS 15 HA HIS 15 -4.604 -6.827 -1.859
62 HB3 HIS 15 2HB HIS 15 -6.369 -5.793 -3.373
63 HD1 HIS 15 1HD HIS 15 -5.214 -8.612 -2.919
64 HD2 HIS 15 2HD HIS 15 -9.218 -7.615 -2.422
65 HE1 HIS 15 1HE HIS 15 -6.481 -10.768 -3.180
66 H CYS 16 H CYS 16 -3.435 -5.101 -0.177
67 HA CYS 16 HA CYS 16 -3.676 -2.451 -1.427
68 HB3 CYS 16 2HB CYS 16 -2.080 -1.948 0.657
69 H ILE 17 H ILE 17 -2.277 -2.117 -3.017
70 HA ILE 17 HA ILE 17 -0.060 -3.634 -3.651
71 HB ILE 17 HB ILE 17 -1.139 -1.964 -5.155
72 HG13 ILE 17 2HG1 ILE 17 1.858 -1.732 -4.799
73 HG21 ILE 17 1HG2 ILE 17 -1.010 0.277 -4.863
74 HG22 ILE 17 2HG2 ILE 17 -0.848 -0.193 -3.171
75 HG23 ILE 17 3HG2 ILE 17 0.587 0.199 -4.120
76 HD11 ILE 17 3HD1 ILE 17 0.179 -3.602 -6.446
77 HD12 ILE 17 1HD1 ILE 17 1.908 -3.354 -6.695
78 HD13 ILE 17 2HD1 ILE 17 1.322 -4.014 -5.167
79 H CYS 18 H CYS 18 2.139 -3.471 -3.293
80 HA CYS 18 HA CYS 18 2.967 -1.630 -1.146
81 HB3 CYS 18 2HB CYS 18 4.697 -3.637 -0.767
82 H THR 19 H THR 19 3.905 -0.116 -2.474
83 HA THR 19 HA THR 19 6.067 -1.036 -4.243
84 HB THR 19 HB THR 19 5.930 1.188 -5.308
85 HG1 THR 19 1HG THR 19 4.186 2.556 -4.716
86 HG21 THR 19 3HG2 THR 19 4.477 -0.844 -5.955
87 HG22 THR 19 1HG2 THR 19 4.036 0.737 -6.599
88 HG23 THR 19 2HG2 THR 19 3.148 0.063 -5.233
89 H PHE 20 H PHE 20 7.691 1.021 -4.492
90 HA PHE 20 HA PHE 20 9.234 1.008 -2.149
91 HB3 PHE 20 2HB PHE 20 10.069 1.423 -4.489
92 HD1 PHE 20 2HD PHE 20 8.172 2.214 -5.956
93 HD2 PHE 20 1HD PHE 20 10.430 4.836 -3.477
94 HE1 PHE 20 2HE PHE 20 7.409 4.132 -7.296
95 HE2 PHE 20 1HE PHE 20 9.670 6.758 -4.812
96 HZ PHE 20 HZ PHE 20 8.159 6.407 -6.726
97 H ARG 21 H ARG 21 6.544 2.905 -3.041
98 HA ARG 21 HA ARG 21 7.196 5.037 -1.153
99 HB3 ARG 21 2HB ARG 21 5.177 6.140 -2.018
100 HG3 ARG 21 2HG ARG 21 6.525 5.163 -4.487
101 HD3 ARG 21 2HD ARG 21 6.388 7.461 -5.136
102 HE ARG 21 HE ARG 21 3.762 7.341 -3.984
103 HH11 ARG 21 1HH1 ARG 21 5.889 5.988 -6.386
104 HH12 ARG 21 2HH1 ARG 21 4.600 5.439 -7.406
105 HH21 ARG 21 1HH2 ARG 21 2.057 6.624 -5.319
106 HH22 ARG 21 2HH2 ARG 21 2.421 5.802 -6.798
107 H GLY 22 H GLY 22 6.500 2.207 -0.404
108 HA2 GLY 22 2HA GLY 22 5.459 1.277 1.434
109 HA3 GLY 22 3HA GLY 22 4.816 2.867 1.815
110 H CYS 23 H CYS 23 3.181 0.836 2.300
111 HA CYS 23 HA CYS 23 1.586 -0.079 0.178
112 HB3 CYS 23 2HB CYS 23 -0.011 -0.740 1.865
113 H GLY 24 H GLY 24 -0.213 0.707 -0.816
114 HA2 GLY 24 2HA GLY 24 -1.442 3.166 0.161
115 HA3 GLY 24 3HA GLY 24 -0.666 3.250 -1.413
116 H ALA 25 H ALA 25 -3.444 3.684 -0.843
117 HA ALA 25 HA ALA 25 -4.692 1.354 -2.137
118 HB1 ALA 25 1HB ALA 25 -6.571 1.724 -0.953
119 HB2 ALA 25 2HB ALA 25 -5.482 2.599 0.124
120 HB3 ALA 25 3HB ALA 25 -6.431 3.478 -1.076
121 H VAL 26 H VAL 26 -6.561 1.943 -3.614
122 HA VAL 26 HA VAL 26 -5.648 3.328 -5.833
123 HB VAL 26 HB VAL 26 -8.057 3.379 -6.566
124 HG11 VAL 26 1HG1 VAL 26 -7.367 0.649 -5.553
125 HG12 VAL 26 2HG1 VAL 26 -8.069 1.122 -7.102
126 HG13 VAL 26 3HG1 VAL 26 -6.363 1.431 -6.775
127 HG21 VAL 26 3HG2 VAL 26 -9.038 3.598 -4.316
128 HG22 VAL 26 1HG2 VAL 26 -9.707 2.232 -5.208
129 HG23 VAL 26 2HG2 VAL 26 -8.509 1.958 -3.943
130 H ASN 27 H ASN 27 -5.665 5.400 -6.484
131 HA ASN 27 HA ASN 27 -5.855 7.665 -6.413
132 HB3 ASN 27 2HB ASN 27 -8.395 7.452 -4.842
133 HD21 ASN 27 1HD2 ASN 27 -9.411 8.236 -7.682
134 HD22 ASN 27 2HD2 ASN 27 -9.123 9.940 -7.721
135 H GLY 28 H GLY 28 -4.589 6.200 -4.174
136 HA2 GLY 28 2HA GLY 28 -3.638 6.670 -2.138
137 HA3 GLY 28 3HA GLY 28 -3.930 8.358 -2.534
138 H LEU 29 H LEU 29 -6.081 5.616 -1.787
139 HA LEU 29 HA LEU 29 -7.584 7.350 0.015
140 HB3 LEU 29 2HB LEU 29 -8.117 4.587 -1.059
141 HG LEU 29 HG LEU 29 -9.226 5.397 1.275
142 HD11 LEU 29 1HD1 LEU 29 -10.391 7.082 -0.640
143 HD12 LEU 29 2HD1 LEU 29 -10.884 6.848 1.037
144 HD13 LEU 29 3HD1 LEU 29 -11.612 5.874 -0.239
145 HD21 LEU 29 3HD2 LEU 29 -9.396 3.182 0.247
146 HD22 LEU 29 1HD2 LEU 29 -10.588 3.803 -0.894
147 HD23 LEU 29 2HD2 LEU 29 -10.962 3.748 0.828
148 HA PRO 30 HA PRO 30 -5.692 5.697 3.638
149 HB3 PRO 30 2HB PRO 30 -6.474 7.572 4.710
150 HG3 PRO 30 2HG PRO 30 -8.502 8.538 4.110
151 HD3 PRO 30 2HD PRO 30 -7.521 8.350 2.032
Start of MODEL 13
1 H1 SER 1 H SER 1 -6.902 3.601 2.582
2 HA SER 1 HA SER 1 -7.564 2.193 4.999
3 HB3 SER 1 2HB SER 1 -7.828 1.643 2.068
4 HG SER 1 HG SER 1 -8.859 -0.418 3.164
5 H CYS 2 H CYS 2 -5.002 2.092 2.604
6 HA CYS 2 HA CYS 2 -3.547 0.212 4.331
7 HB3 CYS 2 2HB CYS 2 -2.753 -1.049 2.453
8 H ASN 3 H ASN 3 -2.656 2.312 5.055
9 HA ASN 3 HA ASN 3 -0.549 3.261 3.225
10 HB3 ASN 3 2HB ASN 3 -1.949 4.808 5.417
11 HD21 ASN 3 1HD2 ASN 3 -1.402 7.014 5.524
12 HD22 ASN 3 2HD2 ASN 3 0.141 7.581 4.994
13 H ASN 4 H ASN 4 1.008 1.798 3.933
14 HA ASN 4 HA ASN 4 2.284 2.521 6.432
15 HB3 ASN 4 2HB ASN 4 0.617 0.659 6.932
16 HD21 ASN 4 1HD2 ASN 4 -0.352 -0.807 5.711
17 HD22 ASN 4 2HD2 ASN 4 0.432 -2.116 4.899
18 H SER 5 H SER 5 4.262 0.817 6.675
19 HA SER 5 HA SER 5 5.736 1.128 4.176
20 HB3 SER 5 2HB SER 5 6.802 1.964 6.207
21 HG SER 5 HG SER 5 7.349 -0.463 7.316
22 H CYS 6 H CYS 6 5.979 -0.499 2.809
23 HA CYS 6 HA CYS 6 6.383 -3.202 3.767
24 HB3 CYS 6 2HB CYS 6 3.995 -3.244 3.665
25 H GLN 7 H GLN 7 6.532 -4.704 1.706
26 HA GLN 7 HA GLN 7 7.812 -3.256 -0.497
27 HB3 GLN 7 2HB GLN 7 9.082 -5.731 0.640
28 HG3 GLN 7 2HG GLN 7 9.994 -3.511 -1.148
29 HE21 GLN 7 1HE2 GLN 7 11.614 -2.571 0.055
30 HE22 GLN 7 2HE2 GLN 7 13.065 -3.404 0.483
31 H SER 8 H SER 8 6.751 -6.432 0.696
32 HA SER 8 HA SER 8 5.686 -6.984 -1.989
33 HB3 SER 8 2HB SER 8 6.367 -9.354 -1.742
34 HG SER 8 HG SER 8 7.815 -7.537 -2.576
35 H HIS 9 H HIS 9 3.942 -5.963 -0.392
36 HA HIS 9 HA HIS 9 1.973 -6.238 0.718
37 HB3 HIS 9 2HB HIS 9 0.869 -8.542 0.315
38 HD1 HIS 9 1HD HIS 9 2.635 -6.660 -2.497
39 HD2 HIS 9 2HD HIS 9 -1.182 -7.620 -1.164
40 HE1 HIS 9 1HE HIS 9 1.061 -5.638 -4.171
41 H SER 10 H SER 10 4.525 -6.936 2.068
42 HA SER 10 HA SER 10 4.053 -9.152 3.791
43 HB3 SER 10 2HB SER 10 5.981 -8.300 5.067
44 HG SER 10 HG SER 10 6.573 -9.405 3.246
45 H ASP 11 H ASP 11 3.574 -5.663 4.083
46 HA ASP 11 HA ASP 11 2.176 -6.124 6.634
47 HB3 ASP 11 2HB ASP 11 2.497 -3.533 6.796
48 H CYS 12 H CYS 12 1.888 -4.955 3.393
49 HA CYS 12 HA CYS 12 -0.335 -3.308 3.545
50 HB3 CYS 12 2HB CYS 12 -0.730 -3.848 1.207
51 H ALA 13 H ALA 13 -2.485 -3.601 3.767
52 HA ALA 13 HA ALA 13 -3.401 -6.336 4.331
53 HB1 ALA 13 1HB ALA 13 -5.298 -5.223 5.492
54 HB2 ALA 13 2HB ALA 13 -3.720 -4.846 6.184
55 HB3 ALA 13 3HB ALA 13 -4.536 -3.668 5.156
56 H SER 14 H SER 14 -5.681 -6.823 3.725
57 HA SER 14 HA SER 14 -7.190 -7.217 2.064
58 HB3 SER 14 2HB SER 14 -7.066 -4.339 1.249
59 HG SER 14 HG SER 14 -9.383 -4.693 1.464
60 H HIS 15 H HIS 15 -4.426 -7.538 1.367
61 HA HIS 15 HA HIS 15 -3.075 -7.870 -0.436
62 HB3 HIS 15 2HB HIS 15 -4.420 -8.134 -2.663
63 HD1 HIS 15 1HD HIS 15 -2.597 -9.879 -0.893
64 HD2 HIS 15 2HD HIS 15 -6.627 -10.636 -1.566
65 HE1 HIS 15 1HE HIS 15 -2.901 -12.338 -0.464
66 H CYS 16 H CYS 16 -3.771 -5.100 0.370
67 HA CYS 16 HA CYS 16 -4.030 -3.457 -1.908
68 HB3 CYS 16 2HB CYS 16 -2.883 -1.747 -0.277
69 H ILE 17 H ILE 17 -2.502 -2.309 -3.094
70 HA ILE 17 HA ILE 17 -0.196 -3.612 -3.863
71 HB ILE 17 HB ILE 17 0.475 -1.608 -5.006
72 HG13 ILE 17 2HG1 ILE 17 -1.141 -0.306 -2.886
73 HG21 ILE 17 1HG2 ILE 17 -2.098 -2.749 -5.196
74 HG22 ILE 17 2HG2 ILE 17 -2.281 -1.014 -5.447
75 HG23 ILE 17 3HG2 ILE 17 -1.171 -1.938 -6.457
76 HD11 ILE 17 3HD1 ILE 17 0.929 1.148 -4.396
77 HD12 ILE 17 1HD1 ILE 17 0.606 1.097 -2.664
78 HD13 ILE 17 2HD1 ILE 17 1.471 -0.230 -3.439
79 H CYS 18 H CYS 18 2.069 -2.904 -3.658
80 HA CYS 18 HA CYS 18 2.770 -1.427 -1.262
81 HB3 CYS 18 2HB CYS 18 4.369 -3.511 -0.757
82 H THR 19 H THR 19 4.293 -0.079 -1.925
83 HA THR 19 HA THR 19 6.442 -1.102 -3.647
84 HB THR 19 HB THR 19 6.461 0.967 -4.949
85 HG1 THR 19 1HG THR 19 4.314 1.629 -3.226
86 HG21 THR 19 3HG2 THR 19 4.255 0.667 -6.126
87 HG22 THR 19 1HG2 THR 19 3.823 -0.489 -4.868
88 HG23 THR 19 2HG2 THR 19 5.201 -0.807 -5.922
89 H PHE 20 H PHE 20 8.078 0.968 -3.861
90 HA PHE 20 HA PHE 20 9.385 1.123 -1.412
91 HB3 PHE 20 2HB PHE 20 10.604 1.545 -3.434
92 HD1 PHE 20 1HD PHE 20 9.311 4.972 -3.075
93 HD2 PHE 20 2HD PHE 20 9.544 1.522 -5.557
94 HE1 PHE 20 1HE PHE 20 8.429 6.277 -4.965
95 HE2 PHE 20 2HE PHE 20 8.663 2.822 -7.452
96 HZ PHE 20 HZ PHE 20 8.104 5.202 -7.157
97 H ARG 21 H ARG 21 6.785 3.021 -2.676
98 HA ARG 21 HA ARG 21 7.108 5.062 -0.610
99 HB3 ARG 21 2HB ARG 21 4.936 5.914 -1.846
100 HG3 ARG 21 2HG ARG 21 6.589 6.672 -3.807
101 HD3 ARG 21 2HD ARG 21 7.078 7.744 -1.056
102 HE ARG 21 HE ARG 21 7.957 9.307 -2.484
103 HH11 ARG 21 1HH1 ARG 21 4.845 8.288 -3.664
104 HH12 ARG 21 2HH1 ARG 21 4.768 9.505 -4.896
105 HH21 ARG 21 1HH2 ARG 21 7.867 10.914 -4.100
106 HH22 ARG 21 2HH2 ARG 21 6.488 10.997 -5.143
107 H GLY 22 H GLY 22 6.304 2.236 -0.072
108 HA2 GLY 22 2HA GLY 22 4.992 1.354 1.635
109 HA3 GLY 22 3HA GLY 22 4.104 2.869 1.700
110 H CYS 23 H CYS 23 2.279 1.317 1.939
111 HA CYS 23 HA CYS 23 1.471 -0.028 -0.513
112 HB3 CYS 23 2HB CYS 23 -0.266 -1.040 0.786
113 H GLY 24 H GLY 24 -1.073 0.167 -0.858
114 HA2 GLY 24 2HA GLY 24 -2.135 2.814 -0.455
115 HA3 GLY 24 3HA GLY 24 -1.622 2.520 -2.110
116 H ALA 25 H ALA 25 -4.307 2.877 -0.673
117 HA ALA 25 HA ALA 25 -5.655 0.374 -1.212
118 HB1 ALA 25 1HB ALA 25 -6.720 3.059 -0.345
119 HB2 ALA 25 2HB ALA 25 -7.683 1.587 -0.494
120 HB3 ALA 25 3HB ALA 25 -6.379 1.671 0.690
121 H VAL 26 H VAL 26 -6.655 3.632 -2.205
122 HA VAL 26 HA VAL 26 -6.666 2.831 -5.006
123 HB VAL 26 HB VAL 26 -9.059 3.753 -5.193
124 HG11 VAL 26 1HG1 VAL 26 -9.953 1.597 -5.083
125 HG12 VAL 26 2HG1 VAL 26 -8.234 1.332 -5.380
126 HG13 VAL 26 3HG1 VAL 26 -8.892 1.126 -3.757
127 HG21 VAL 26 3HG2 VAL 26 -9.009 3.055 -2.259
128 HG22 VAL 26 1HG2 VAL 26 -9.247 4.660 -2.951
129 HG23 VAL 26 2HG2 VAL 26 -10.458 3.403 -3.200
130 H ASN 27 H ASN 27 -5.637 4.439 -5.984
131 HA ASN 27 HA ASN 27 -4.940 6.517 -6.589
132 HB3 ASN 27 2HB ASN 27 -6.751 8.364 -6.198
133 HD21 ASN 27 1HD2 ASN 27 -7.289 8.972 -8.161
134 HD22 ASN 27 2HD2 ASN 27 -7.546 7.929 -9.515
135 H GLY 28 H GLY 28 -4.605 5.520 -3.754
136 HA2 GLY 28 2HA GLY 28 -3.235 6.410 -2.077
137 HA3 GLY 28 3HA GLY 28 -3.544 8.021 -2.710
138 H LEU 29 H LEU 29 -5.688 5.433 -1.528
139 HA LEU 29 HA LEU 29 -6.994 7.426 0.186
140 HB3 LEU 29 2HB LEU 29 -7.918 4.748 -0.837
141 HG LEU 29 HG LEU 29 -8.850 5.721 1.512
142 HD11 LEU 29 1HD1 LEU 29 -10.876 6.908 1.206
143 HD12 LEU 29 2HD1 LEU 29 -10.800 6.728 -0.546
144 HD13 LEU 29 3HD1 LEU 29 -9.644 7.770 0.284
145 HD21 LEU 29 3HD2 LEU 29 -10.528 4.334 -0.575
146 HD22 LEU 29 1HD2 LEU 29 -10.751 4.282 1.174
147 HD23 LEU 29 2HD2 LEU 29 -9.326 3.539 0.444
148 HA PRO 30 HA PRO 30 -5.248 5.572 3.785
149 HB3 PRO 30 2HB PRO 30 -5.747 7.546 4.851
150 HG3 PRO 30 2HG PRO 30 -7.643 8.768 4.286
151 HD3 PRO 30 2HD PRO 30 -6.748 8.429 2.189
Start of MODEL 14
1 H1 SER 1 H SER 1 -7.106 3.786 2.924
2 HA SER 1 HA SER 1 -7.338 2.227 5.264
3 HB3 SER 1 2HB SER 1 -6.948 1.084 2.500
4 HG SER 1 HG SER 1 -7.790 -0.620 3.392
5 H CYS 2 H CYS 2 -5.072 1.686 2.563
6 HA CYS 2 HA CYS 2 -3.203 0.468 4.466
7 HB3 CYS 2 2HB CYS 2 -2.186 -0.626 2.597
8 H ASN 3 H ASN 3 -2.178 2.226 5.360
9 HA ASN 3 HA ASN 3 -0.496 3.779 3.511
10 HB3 ASN 3 2HB ASN 3 -0.808 5.770 4.852
11 HD21 ASN 3 1HD2 ASN 3 -1.786 6.678 3.160
12 HD22 ASN 3 2HD2 ASN 3 -3.453 6.480 2.755
13 H ASN 4 H ASN 4 0.759 1.720 4.300
14 HA ASN 4 HA ASN 4 2.437 2.602 6.546
15 HB3 ASN 4 2HB ASN 4 1.330 0.889 7.635
16 HD21 ASN 4 1HD2 ASN 4 2.341 -1.590 5.540
17 HD22 ASN 4 2HD2 ASN 4 0.781 -2.066 4.969
18 H SER 5 H SER 5 4.452 0.955 6.567
19 HA SER 5 HA SER 5 5.637 1.258 3.914
20 HB3 SER 5 2HB SER 5 7.755 1.140 4.970
21 HG SER 5 HG SER 5 6.924 3.073 5.560
22 H CYS 6 H CYS 6 6.421 -0.408 2.703
23 HA CYS 6 HA CYS 6 6.695 -3.070 3.705
24 HB3 CYS 6 2HB CYS 6 4.312 -3.166 3.549
25 H GLN 7 H GLN 7 6.834 -4.618 1.629
26 HA GLN 7 HA GLN 7 8.178 -3.206 -0.555
27 HB3 GLN 7 2HB GLN 7 9.447 -5.660 0.615
28 HG3 GLN 7 2HG GLN 7 10.147 -4.675 -1.616
29 HE21 GLN 7 1HE2 GLN 7 10.639 -2.921 -2.717
30 HE22 GLN 7 2HE2 GLN 7 11.195 -1.426 -2.053
31 H SER 8 H SER 8 7.147 -6.383 0.668
32 HA SER 8 HA SER 8 6.110 -6.981 -2.018
33 HB3 SER 8 2HB SER 8 8.214 -8.209 -1.741
34 HG SER 8 HG SER 8 8.553 -8.650 0.320
35 H HIS 9 H HIS 9 4.273 -6.023 -0.584
36 HA HIS 9 HA HIS 9 2.314 -6.316 0.544
37 HB3 HIS 9 2HB HIS 9 2.460 -9.198 -0.327
38 HD1 HIS 9 1HD HIS 9 -0.115 -6.509 -0.989
39 HD2 HIS 9 2HD HIS 9 0.308 -10.056 1.133
40 HE1 HIS 9 1HE HIS 9 -2.412 -7.049 -0.119
41 H SER 10 H SER 10 4.791 -6.791 2.015
42 HA SER 10 HA SER 10 4.383 -9.015 3.770
43 HB3 SER 10 2HB SER 10 6.203 -7.882 5.125
44 HG SER 10 HG SER 10 7.696 -8.599 3.745
45 H ASP 11 H ASP 11 3.751 -5.547 3.924
46 HA ASP 11 HA ASP 11 2.330 -5.972 6.470
47 HB3 ASP 11 2HB ASP 11 2.644 -3.577 6.897
48 H CYS 12 H CYS 12 2.038 -5.000 3.178
49 HA CYS 12 HA CYS 12 -0.285 -3.445 3.276
50 HB3 CYS 12 2HB CYS 12 -0.542 -3.946 0.925
51 H ALA 13 H ALA 13 -2.471 -3.946 2.990
52 HA ALA 13 HA ALA 13 -3.226 -6.767 3.304
53 HB1 ALA 13 1HB ALA 13 -4.132 -4.469 5.019
54 HB2 ALA 13 2HB ALA 13 -5.015 -5.993 4.917
55 HB3 ALA 13 3HB ALA 13 -3.359 -5.972 5.524
56 H SER 14 H SER 14 -5.590 -7.108 2.894
57 HA SER 14 HA SER 14 -7.334 -7.035 1.433
58 HB3 SER 14 2HB SER 14 -8.266 -4.732 0.967
59 HG SER 14 HG SER 14 -9.168 -5.304 2.783
60 H HIS 15 H HIS 15 -4.813 -7.419 0.274
61 HA HIS 15 HA HIS 15 -3.730 -7.412 -1.729
62 HB3 HIS 15 2HB HIS 15 -5.119 -7.320 -3.729
63 HD1 HIS 15 1HD HIS 15 -4.486 -9.511 -1.484
64 HD2 HIS 15 2HD HIS 15 -8.182 -8.706 -3.202
65 HE1 HIS 15 1HE HIS 15 -5.833 -11.615 -1.197
66 H CYS 16 H CYS 16 -3.267 -5.142 -0.305
67 HA CYS 16 HA CYS 16 -3.618 -2.872 -2.104
68 HB3 CYS 16 2HB CYS 16 -2.251 -1.791 -0.088
69 H ILE 17 H ILE 17 -2.051 -2.055 -3.355
70 HA ILE 17 HA ILE 17 0.221 -3.463 -4.039
71 HB ILE 17 HB ILE 17 0.994 -1.511 -5.208
72 HG13 ILE 17 2HG1 ILE 17 -0.628 -0.104 -3.161
73 HG21 ILE 17 1HG2 ILE 17 -1.411 -2.696 -5.626
74 HG22 ILE 17 2HG2 ILE 17 -1.876 -0.998 -5.531
75 HG23 ILE 17 3HG2 ILE 17 -0.673 -1.518 -6.712
76 HD11 ILE 17 3HD1 ILE 17 1.531 1.246 -4.642
77 HD12 ILE 17 1HD1 ILE 17 1.164 1.234 -2.917
78 HD13 ILE 17 2HD1 ILE 17 2.000 -0.135 -3.651
79 H CYS 18 H CYS 18 2.497 -2.910 -3.759
80 HA CYS 18 HA CYS 18 3.165 -1.433 -1.332
81 HB3 CYS 18 2HB CYS 18 4.778 -3.522 -0.901
82 H THR 19 H THR 19 4.819 -0.139 -1.747
83 HA THR 19 HA THR 19 6.887 -1.020 -3.638
84 HB THR 19 HB THR 19 7.001 1.222 -4.630
85 HG1 THR 19 1HG THR 19 4.655 1.747 -3.091
86 HG21 THR 19 3HG2 THR 19 5.121 -0.720 -5.160
87 HG22 THR 19 1HG2 THR 19 5.495 0.659 -6.193
88 HG23 THR 19 2HG2 THR 19 4.153 0.749 -5.052
89 H PHE 20 H PHE 20 8.632 0.965 -3.598
90 HA PHE 20 HA PHE 20 9.909 0.738 -1.113
91 HB3 PHE 20 2HB PHE 20 11.260 1.175 -3.020
92 HD1 PHE 20 1HD PHE 20 9.597 4.479 -2.542
93 HD2 PHE 20 2HD PHE 20 10.893 1.476 -5.265
94 HE1 PHE 20 1HE PHE 20 8.895 5.892 -4.430
95 HE2 PHE 20 2HE PHE 20 10.194 2.885 -7.157
96 HZ PHE 20 HZ PHE 20 9.194 5.096 -6.742
97 H ARG 21 H ARG 21 7.427 2.833 -2.167
98 HA ARG 21 HA ARG 21 7.930 4.711 0.034
99 HB3 ARG 21 2HB ARG 21 7.615 5.896 -1.986
100 HG3 ARG 21 2HG ARG 21 5.142 4.251 -2.479
101 HD3 ARG 21 2HD ARG 21 4.697 6.441 -3.265
102 HE ARG 21 HE ARG 21 7.162 6.702 -4.797
103 HH11 ARG 21 1HH1 ARG 21 5.261 7.651 -2.040
104 HH12 ARG 21 2HH1 ARG 21 6.159 9.105 -1.756
105 HH21 ARG 21 1HH2 ARG 21 8.353 8.614 -4.434
106 HH22 ARG 21 2HH2 ARG 21 7.917 9.652 -3.119
107 H GLY 22 H GLY 22 6.857 1.977 0.353
108 HA2 GLY 22 2HA GLY 22 5.381 1.116 1.936
109 HA3 GLY 22 3HA GLY 22 4.606 2.691 2.030
110 H CYS 23 H CYS 23 2.709 1.138 2.094
111 HA CYS 23 HA CYS 23 1.944 0.036 -0.480
112 HB3 CYS 23 2HB CYS 23 0.060 -0.912 0.663
113 H GLY 24 H GLY 24 -0.742 0.416 -0.601
114 HA2 GLY 24 2HA GLY 24 -1.497 3.155 -0.263
115 HA3 GLY 24 3HA GLY 24 -1.066 2.798 -1.929
116 H ALA 25 H ALA 25 -3.635 3.625 -1.015
117 HA ALA 25 HA ALA 25 -5.233 1.187 -1.425
118 HB1 ALA 25 1HB ALA 25 -6.762 1.956 0.023
119 HB2 ALA 25 2HB ALA 25 -5.467 3.019 0.573
120 HB3 ALA 25 3HB ALA 25 -6.657 3.606 -0.588
121 H VAL 26 H VAL 26 -7.489 1.874 -2.442
122 HA VAL 26 HA VAL 26 -7.099 2.375 -5.121
123 HB VAL 26 HB VAL 26 -9.566 3.040 -5.146
124 HG11 VAL 26 1HG1 VAL 26 -10.107 0.850 -5.291
125 HG12 VAL 26 2HG1 VAL 26 -8.361 0.636 -5.148
126 HG13 VAL 26 3HG1 VAL 26 -9.392 0.458 -3.727
127 HG21 VAL 26 3HG2 VAL 26 -9.387 2.226 -2.247
128 HG22 VAL 26 1HG2 VAL 26 -9.594 3.883 -2.816
129 HG23 VAL 26 2HG2 VAL 26 -10.843 2.679 -3.135
130 H ASN 27 H ASN 27 -6.611 4.122 -6.270
131 HA ASN 27 HA ASN 27 -5.977 6.290 -6.679
132 HB3 ASN 27 2HB ASN 27 -8.389 6.223 -7.275
133 HD21 ASN 27 1HD2 ASN 27 -9.775 5.047 -5.969
134 HD22 ASN 27 2HD2 ASN 27 -10.642 5.766 -4.659
135 H GLY 28 H GLY 28 -5.103 5.432 -4.132
136 HA2 GLY 28 2HA GLY 28 -4.173 6.308 -2.226
137 HA3 GLY 28 3HA GLY 28 -4.406 7.889 -2.957
138 H LEU 29 H LEU 29 -5.559 5.613 -0.654
139 HA LEU 29 HA LEU 29 -7.331 7.634 0.453
140 HB3 LEU 29 2HB LEU 29 -8.789 5.246 0.682
141 HG LEU 29 HG LEU 29 -9.409 7.843 -0.006
142 HD11 LEU 29 1HD1 LEU 29 -9.585 6.077 -2.391
143 HD12 LEU 29 2HD1 LEU 29 -9.215 7.798 -2.281
144 HD13 LEU 29 3HD1 LEU 29 -10.879 7.241 -2.106
145 HD21 LEU 29 3HD2 LEU 29 -11.388 5.631 -0.361
146 HD22 LEU 29 1HD2 LEU 29 -11.587 7.203 0.413
147 HD23 LEU 29 2HD2 LEU 29 -10.672 5.933 1.223
148 HA PRO 30 HA PRO 30 -5.902 6.080 4.301
149 HB3 PRO 30 2HB PRO 30 -7.024 7.822 5.295
150 HG3 PRO 30 2HG PRO 30 -9.091 8.529 4.497
151 HD3 PRO 30 2HD PRO 30 -7.892 8.503 2.529
Start of MODEL 15
1 H1 SER 1 H SER 1 -6.988 4.086 2.593
2 HA SER 1 HA SER 1 -7.423 2.762 5.054
3 HB3 SER 1 2HB SER 1 -7.273 1.467 2.326
4 HG SER 1 HG SER 1 -9.071 0.271 3.432
5 H CYS 2 H CYS 2 -4.808 2.698 2.723
6 HA CYS 2 HA CYS 2 -3.309 0.935 4.545
7 HB3 CYS 2 2HB CYS 2 -2.080 0.272 2.328
8 H ASN 3 H ASN 3 -2.082 2.441 5.562
9 HA ASN 3 HA ASN 3 -0.264 4.012 3.864
10 HB3 ASN 3 2HB ASN 3 -1.761 5.649 4.679
11 HD21 ASN 3 1HD2 ASN 3 -3.663 4.713 5.477
12 HD22 ASN 3 2HD2 ASN 3 -3.952 4.565 7.174
13 H ASN 4 H ASN 4 0.972 1.950 4.338
14 HA ASN 4 HA ASN 4 2.632 2.414 6.705
15 HB3 ASN 4 2HB ASN 4 1.405 0.672 7.607
16 HD21 ASN 4 1HD2 ASN 4 2.309 -1.162 4.757
17 HD22 ASN 4 2HD2 ASN 4 0.707 -1.652 4.334
18 H SER 5 H SER 5 4.635 0.919 6.586
19 HA SER 5 HA SER 5 5.737 1.224 3.899
20 HB3 SER 5 2HB SER 5 6.909 2.126 5.965
21 HG SER 5 HG SER 5 7.975 -0.400 6.398
22 H CYS 6 H CYS 6 6.557 -0.436 2.692
23 HA CYS 6 HA CYS 6 6.824 -3.098 3.737
24 HB3 CYS 6 2HB CYS 6 4.473 -3.240 3.453
25 H GLN 7 H GLN 7 7.300 -4.667 1.855
26 HA GLN 7 HA GLN 7 8.639 -3.280 -0.356
27 HB3 GLN 7 2HB GLN 7 10.615 -4.713 -0.105
28 HG3 GLN 7 2HG GLN 7 11.277 -3.951 2.312
29 HE21 GLN 7 1HE2 GLN 7 12.913 -3.675 0.663
30 HE22 GLN 7 2HE2 GLN 7 13.097 -2.134 -0.098
31 H SER 8 H SER 8 7.507 -6.355 0.977
32 HA SER 8 HA SER 8 6.860 -7.209 -1.761
33 HB3 SER 8 2HB SER 8 7.443 -9.550 -1.084
34 HG SER 8 HG SER 8 8.966 -7.961 -2.101
35 H HIS 9 H HIS 9 4.877 -6.057 -0.649
36 HA HIS 9 HA HIS 9 2.768 -6.215 0.206
37 HB3 HIS 9 2HB HIS 9 1.718 -8.557 -0.147
38 HD1 HIS 9 1HD HIS 9 -0.005 -7.818 -1.742
39 HD2 HIS 9 2HD HIS 9 3.816 -6.862 -3.062
40 HE1 HIS 9 1HE HIS 9 -0.323 -6.720 -3.982
41 H SER 10 H SER 10 4.817 -6.441 2.122
42 HA SER 10 HA SER 10 4.196 -8.610 3.911
43 HB3 SER 10 2HB SER 10 5.761 -7.386 5.464
44 HG SER 10 HG SER 10 6.679 -8.891 4.105
45 H ASP 11 H ASP 11 4.193 -5.103 4.530
46 HA ASP 11 HA ASP 11 2.330 -5.327 6.663
47 HB3 ASP 11 2HB ASP 11 2.250 -2.790 6.441
48 H CYS 12 H CYS 12 2.030 -4.881 3.241
49 HA CYS 12 HA CYS 12 -0.423 -3.643 2.990
50 HB3 CYS 12 2HB CYS 12 -0.598 -5.364 0.949
51 H ALA 13 H ALA 13 -2.543 -4.267 3.068
52 HA ALA 13 HA ALA 13 -3.218 -7.043 3.615
53 HB1 ALA 13 1HB ALA 13 -2.920 -6.454 5.844
54 HB2 ALA 13 2HB ALA 13 -3.573 -4.833 5.604
55 HB3 ALA 13 3HB ALA 13 -4.652 -6.227 5.594
56 H SER 14 H SER 14 -5.653 -7.298 3.794
57 HA SER 14 HA SER 14 -7.652 -7.169 2.707
58 HB3 SER 14 2HB SER 14 -8.606 -4.804 2.573
59 HG SER 14 HG SER 14 -9.166 -5.098 4.578
60 H HIS 15 H HIS 15 -5.415 -7.424 1.012
61 HA HIS 15 HA HIS 15 -4.883 -7.371 -1.199
62 HB3 HIS 15 2HB HIS 15 -7.467 -6.023 -1.874
63 HD1 HIS 15 1HD HIS 15 -4.659 -6.742 -3.442
64 HD2 HIS 15 2HD HIS 15 -8.374 -8.571 -3.782
65 HE1 HIS 15 1HE HIS 15 -4.665 -7.838 -5.706
66 H CYS 16 H CYS 16 -3.488 -5.572 -0.154
67 HA CYS 16 HA CYS 16 -4.029 -3.028 -1.542
68 HB3 CYS 16 2HB CYS 16 -2.240 -2.249 0.270
69 H ILE 17 H ILE 17 -2.395 -2.057 -2.710
70 HA ILE 17 HA ILE 17 -0.326 -3.836 -3.657
71 HB ILE 17 HB ILE 17 -1.395 -1.193 -4.508
72 HG13 ILE 17 2HG1 ILE 17 -0.537 -3.614 -6.103
73 HG21 ILE 17 1HG2 ILE 17 0.865 -0.572 -4.497
74 HG22 ILE 17 2HG2 ILE 17 1.394 -2.161 -5.048
75 HG23 ILE 17 3HG2 ILE 17 0.552 -1.079 -6.157
76 HD11 ILE 17 3HD1 ILE 17 -2.266 -4.345 -4.585
77 HD12 ILE 17 1HD1 ILE 17 -3.271 -2.966 -5.029
78 HD13 ILE 17 2HD1 ILE 17 -2.908 -4.213 -6.222
79 H CYS 18 H CYS 18 1.834 -3.683 -3.313
80 HA CYS 18 HA CYS 18 2.742 -1.574 -1.464
81 HB3 CYS 18 2HB CYS 18 4.565 -3.481 -1.015
82 H THR 19 H THR 19 4.519 -0.429 -1.997
83 HA THR 19 HA THR 19 6.260 -1.360 -4.144
84 HB THR 19 HB THR 19 6.127 0.756 -5.372
85 HG1 THR 19 1HG THR 19 4.413 2.217 -4.818
86 HG21 THR 19 3HG2 THR 19 3.846 0.478 -6.309
87 HG22 THR 19 1HG2 THR 19 3.463 -0.611 -4.977
88 HG23 THR 19 2HG2 THR 19 4.713 -1.049 -6.142
89 H PHE 20 H PHE 20 7.892 0.679 -4.542
90 HA PHE 20 HA PHE 20 9.523 0.761 -2.285
91 HB3 PHE 20 2HB PHE 20 10.219 1.200 -4.668
92 HD1 PHE 20 2HD PHE 20 8.185 1.949 -5.992
93 HD2 PHE 20 1HD PHE 20 10.590 4.613 -3.704
94 HE1 PHE 20 2HE PHE 20 7.303 3.849 -7.283
95 HE2 PHE 20 1HE PHE 20 9.711 6.517 -4.991
96 HZ PHE 20 HZ PHE 20 8.064 6.137 -6.783
97 H ARG 21 H ARG 21 6.828 2.727 -3.174
98 HA ARG 21 HA ARG 21 7.489 4.756 -1.177
99 HB3 ARG 21 2HB ARG 21 5.185 5.662 -2.103
100 HG3 ARG 21 2HG ARG 21 6.673 6.292 -4.303
101 HD3 ARG 21 2HD ARG 21 5.614 7.697 -2.390
102 HE ARG 21 HE ARG 21 8.119 7.059 -1.172
103 HH11 ARG 21 1HH1 ARG 21 5.710 9.547 -1.529
104 HH12 ARG 21 2HH1 ARG 21 6.097 10.318 -0.026
105 HH21 ARG 21 1HH2 ARG 21 8.638 8.065 0.807
106 HH22 ARG 21 2HH2 ARG 21 7.763 9.475 1.301
107 H GLY 22 H GLY 22 6.695 1.951 -0.529
108 HA2 GLY 22 2HA GLY 22 5.626 1.137 1.380
109 HA3 GLY 22 3HA GLY 22 4.735 2.647 1.497
110 H CYS 23 H CYS 23 2.904 1.236 1.970
111 HA CYS 23 HA CYS 23 1.830 -0.177 -0.362
112 HB3 CYS 23 2HB CYS 23 0.062 -0.866 1.435
113 H GLY 24 H GLY 24 -0.025 0.425 -1.379
114 HA2 GLY 24 2HA GLY 24 -1.227 2.966 -0.474
115 HA3 GLY 24 3HA GLY 24 -1.118 2.464 -2.155
116 H ALA 25 H ALA 25 -3.518 3.230 -1.501
117 HA ALA 25 HA ALA 25 -5.022 0.725 -1.139
118 HB1 ALA 25 1HB ALA 25 -5.021 2.813 0.669
119 HB2 ALA 25 2HB ALA 25 -6.491 3.072 -0.268
120 HB3 ALA 25 3HB ALA 25 -6.229 1.533 0.551
121 H VAL 26 H VAL 26 -7.525 1.485 -1.674
122 HA VAL 26 HA VAL 26 -7.656 1.632 -4.442
123 HB VAL 26 HB VAL 26 -10.068 2.303 -4.095
124 HG11 VAL 26 1HG1 VAL 26 -9.337 -0.035 -4.261
125 HG12 VAL 26 2HG1 VAL 26 -9.083 -0.072 -2.514
126 HG13 VAL 26 3HG1 VAL 26 -10.707 0.149 -3.168
127 HG21 VAL 26 3HG2 VAL 26 -9.097 3.086 -1.583
128 HG22 VAL 26 1HG2 VAL 26 -10.769 3.097 -2.143
129 HG23 VAL 26 2HG2 VAL 26 -10.135 1.689 -1.290
130 H ASN 27 H ASN 27 -7.135 3.235 -5.763
131 HA ASN 27 HA ASN 27 -6.798 5.311 -6.628
132 HB3 ASN 27 2HB ASN 27 -8.502 7.087 -5.718
133 HD21 ASN 27 1HD2 ASN 27 -8.269 7.047 -8.033
134 HD22 ASN 27 2HD2 ASN 27 -9.403 6.162 -8.989
135 H GLY 28 H GLY 28 -5.358 4.498 -4.196
136 HA2 GLY 28 2HA GLY 28 -3.843 5.404 -2.729
137 HA3 GLY 28 3HA GLY 28 -3.954 6.871 -3.691
138 H LEU 29 H LEU 29 -6.232 5.141 -1.562
139 HA LEU 29 HA LEU 29 -6.727 7.700 -0.196
140 HB3 LEU 29 2HB LEU 29 -8.753 6.022 0.579
141 HG LEU 29 HG LEU 29 -9.212 8.284 -0.163
142 HD11 LEU 29 1HD1 LEU 29 -8.083 8.920 -1.993
143 HD12 LEU 29 2HD1 LEU 29 -9.476 8.278 -2.862
144 HD13 LEU 29 3HD1 LEU 29 -8.033 7.286 -2.658
145 HD21 LEU 29 3HD2 LEU 29 -11.175 7.721 -1.735
146 HD22 LEU 29 1HD2 LEU 29 -11.161 7.017 -0.118
147 HD23 LEU 29 2HD2 LEU 29 -10.680 6.044 -1.507
148 HA PRO 30 HA PRO 30 -5.248 6.172 3.641
149 HB3 PRO 30 2HB PRO 30 -5.848 8.187 4.569
150 HG3 PRO 30 2HG PRO 30 -7.804 9.267 3.928
151 HD3 PRO 30 2HD PRO 30 -6.895 8.831 1.856
Start of MODEL 16
1 H1 SER 1 H SER 1 -6.415 4.310 2.140
2 HA SER 1 HA SER 1 -7.521 2.687 4.209
3 HB3 SER 1 2HB SER 1 -6.517 1.621 1.579
4 HG SER 1 HG SER 1 -8.517 0.415 1.845
5 H CYS 2 H CYS 2 -4.507 2.463 2.320
6 HA CYS 2 HA CYS 2 -3.292 1.050 4.596
7 HB3 CYS 2 2HB CYS 2 -2.167 -0.485 3.127
8 H ASN 3 H ASN 3 -2.050 2.689 5.353
9 HA ASN 3 HA ASN 3 -0.096 3.846 3.475
10 HB3 ASN 3 2HB ASN 3 -0.087 5.862 4.963
11 HD21 ASN 3 1HD2 ASN 3 -0.677 5.381 2.393
12 HD22 ASN 3 2HD2 ASN 3 -2.152 6.161 1.946
13 H ASN 4 H ASN 4 1.158 1.912 4.122
14 HA ASN 4 HA ASN 4 2.772 2.536 6.483
15 HB3 ASN 4 2HB ASN 4 1.493 0.886 7.490
16 HD21 ASN 4 1HD2 ASN 4 2.364 -1.724 5.583
17 HD22 ASN 4 2HD2 ASN 4 0.827 -2.044 4.864
18 H SER 5 H SER 5 4.674 0.785 6.504
19 HA SER 5 HA SER 5 5.917 1.032 3.873
20 HB3 SER 5 2HB SER 5 8.012 0.403 5.105
21 HG SER 5 HG SER 5 7.871 2.380 6.517
22 H CYS 6 H CYS 6 6.746 -0.686 2.719
23 HA CYS 6 HA CYS 6 6.871 -3.346 3.656
24 HB3 CYS 6 2HB CYS 6 4.490 -3.384 3.636
25 H GLN 7 H GLN 7 6.967 -4.910 1.654
26 HA GLN 7 HA GLN 7 8.212 -3.528 -0.618
27 HB3 GLN 7 2HB GLN 7 9.412 -6.054 0.470
28 HG3 GLN 7 2HG GLN 7 10.534 -3.753 -1.109
29 HE21 GLN 7 1HE2 GLN 7 12.415 -3.333 -0.100
30 HE22 GLN 7 2HE2 GLN 7 13.652 -4.505 0.189
31 H SER 8 H SER 8 6.905 -6.563 0.655
32 HA SER 8 HA SER 8 5.777 -7.109 -1.994
33 HB3 SER 8 2HB SER 8 6.621 -9.262 -2.157
34 HG SER 8 HG SER 8 8.393 -7.807 -2.208
35 H HIS 9 H HIS 9 4.106 -6.052 -0.390
36 HA HIS 9 HA HIS 9 2.186 -6.258 0.816
37 HB3 HIS 9 2HB HIS 9 1.995 -9.143 0.055
38 HD1 HIS 9 1HD HIS 9 0.079 -8.961 1.917
39 HD2 HIS 9 2HD HIS 9 -0.488 -6.683 -1.512
40 HE1 HIS 9 1HE HIS 9 -2.353 -8.328 1.926
41 H SER 10 H SER 10 4.691 -6.865 2.159
42 HA SER 10 HA SER 10 4.192 -9.082 3.928
43 HB3 SER 10 2HB SER 10 6.274 -6.894 4.145
44 HG SER 10 HG SER 10 7.152 -8.107 5.668
45 H ASP 11 H ASP 11 3.739 -5.621 3.966
46 HA ASP 11 HA ASP 11 2.638 -5.827 6.693
47 HB3 ASP 11 2HB ASP 11 3.275 -3.587 7.119
48 H CYS 12 H CYS 12 2.057 -4.947 3.408
49 HA CYS 12 HA CYS 12 -0.140 -3.249 3.667
50 HB3 CYS 12 2HB CYS 12 -0.701 -3.859 1.392
51 H ALA 13 H ALA 13 -2.425 -3.811 3.102
52 HA ALA 13 HA ALA 13 -3.277 -6.477 3.907
53 HB1 ALA 13 1HB ALA 13 -4.943 -5.460 5.519
54 HB2 ALA 13 2HB ALA 13 -3.258 -5.471 6.041
55 HB3 ALA 13 3HB ALA 13 -3.983 -3.984 5.430
56 H SER 14 H SER 14 -5.771 -6.586 3.801
57 HA SER 14 HA SER 14 -7.582 -6.588 2.416
58 HB3 SER 14 2HB SER 14 -7.560 -4.218 3.510
59 HG SER 14 HG SER 14 -6.752 -2.687 2.337
60 H HIS 15 H HIS 15 -4.999 -7.133 1.211
61 HA HIS 15 HA HIS 15 -4.119 -7.542 -0.846
62 HB3 HIS 15 2HB HIS 15 -6.720 -6.595 -2.041
63 HD1 HIS 15 1HD HIS 15 -4.709 -9.795 -2.377
64 HD2 HIS 15 2HD HIS 15 -5.971 -6.559 -4.657
65 HE1 HIS 15 1HE HIS 15 -4.034 -10.332 -4.738
66 H CYS 16 H CYS 16 -3.766 -4.966 0.365
67 HA CYS 16 HA CYS 16 -3.995 -2.956 -1.674
68 HB3 CYS 16 2HB CYS 16 -2.355 -1.772 0.033
69 H ILE 17 H ILE 17 -2.330 -1.992 -2.852
70 HA ILE 17 HA ILE 17 -0.237 -3.771 -3.656
71 HB ILE 17 HB ILE 17 -1.352 -2.256 -5.253
72 HG13 ILE 17 2HG1 ILE 17 0.515 -2.037 -6.559
73 HG21 ILE 17 1HG2 ILE 17 0.005 -0.119 -3.627
74 HG22 ILE 17 2HG2 ILE 17 -0.624 0.149 -5.251
75 HG23 ILE 17 3HG2 ILE 17 -1.719 -0.307 -3.946
76 HD11 ILE 17 3HD1 ILE 17 1.818 -0.796 -4.179
77 HD12 ILE 17 1HD1 ILE 17 2.794 -1.425 -5.508
78 HD13 ILE 17 2HD1 ILE 17 1.609 -0.153 -5.808
79 H CYS 18 H CYS 18 1.983 -3.527 -3.425
80 HA CYS 18 HA CYS 18 2.849 -1.576 -1.393
81 HB3 CYS 18 2HB CYS 18 4.652 -3.517 -1.014
82 H THR 19 H THR 19 4.721 -0.486 -1.770
83 HA THR 19 HA THR 19 6.411 -1.275 -4.017
84 HB THR 19 HB THR 19 6.403 1.299 -4.613
85 HG1 THR 19 1HG THR 19 4.927 2.035 -3.128
86 HG21 THR 19 3HG2 THR 19 4.942 -1.009 -5.576
87 HG22 THR 19 1HG2 THR 19 5.740 0.274 -6.485
88 HG23 THR 19 2HG2 THR 19 4.083 0.492 -5.921
89 H PHE 20 H PHE 20 8.269 0.475 -4.187
90 HA PHE 20 HA PHE 20 9.802 0.282 -1.875
91 HB3 PHE 20 2HB PHE 20 10.779 0.672 -4.085
92 HD1 PHE 20 2HD PHE 20 9.205 1.241 -5.861
93 HD2 PHE 20 1HD PHE 20 10.708 4.194 -3.190
94 HE1 PHE 20 2HE PHE 20 8.444 3.010 -7.394
95 HE2 PHE 20 1HE PHE 20 9.948 5.968 -4.717
96 HZ PHE 20 HZ PHE 20 8.816 5.377 -6.823
97 H ARG 21 H ARG 21 7.405 2.602 -2.773
98 HA ARG 21 HA ARG 21 8.211 4.428 -0.633
99 HB3 ARG 21 2HB ARG 21 6.106 5.680 -1.648
100 HG3 ARG 21 2HG ARG 21 7.746 6.370 -3.640
101 HD3 ARG 21 2HD ARG 21 8.790 7.967 -2.094
102 HE ARG 21 HE ARG 21 6.072 7.801 -2.477
103 HH11 ARG 21 1HH1 ARG 21 8.201 9.023 -0.008
104 HH12 ARG 21 2HH1 ARG 21 7.106 10.264 0.505
105 HH21 ARG 21 1HH2 ARG 21 4.622 9.431 -1.811
106 HH22 ARG 21 2HH2 ARG 21 5.071 10.495 -0.520
107 H GLY 22 H GLY 22 6.984 1.725 -0.229
108 HA2 GLY 22 2HA GLY 22 5.682 0.958 1.550
109 HA3 GLY 22 3HA GLY 22 5.023 2.576 1.735
110 H CYS 23 H CYS 23 3.131 0.927 2.033
111 HA CYS 23 HA CYS 23 1.973 -0.081 -0.395
112 HB3 CYS 23 2HB CYS 23 0.131 -0.801 0.993
113 H GLY 24 H GLY 24 -0.418 0.484 -0.830
114 HA2 GLY 24 2HA GLY 24 -1.087 3.269 -0.319
115 HA3 GLY 24 3HA GLY 24 -0.741 2.867 -1.994
116 H ALA 25 H ALA 25 -3.156 3.871 -1.534
117 HA ALA 25 HA ALA 25 -4.933 1.523 -1.673
118 HB1 ALA 25 1HB ALA 25 -6.513 2.485 -0.342
119 HB2 ALA 25 2HB ALA 25 -5.067 3.208 0.365
120 HB3 ALA 25 3HB ALA 25 -6.044 4.127 -0.780
121 H VAL 26 H VAL 26 -7.113 2.226 -2.731
122 HA VAL 26 HA VAL 26 -6.412 3.472 -5.280
123 HB VAL 26 HB VAL 26 -8.435 2.491 -6.168
124 HG11 VAL 26 1HG1 VAL 26 -6.760 0.624 -4.506
125 HG12 VAL 26 2HG1 VAL 26 -7.959 0.063 -5.673
126 HG13 VAL 26 3HG1 VAL 26 -6.579 1.020 -6.214
127 HG21 VAL 26 3HG2 VAL 26 -9.585 0.843 -4.400
128 HG22 VAL 26 1HG2 VAL 26 -9.066 2.121 -3.301
129 HG23 VAL 26 2HG2 VAL 26 -10.128 2.502 -4.657
130 H ASN 27 H ASN 27 -7.914 4.962 -6.304
131 HA ASN 27 HA ASN 27 -9.029 6.947 -6.329
132 HB3 ASN 27 2HB ASN 27 -10.743 6.424 -4.022
133 HD21 ASN 27 1HD2 ASN 27 -12.908 5.497 -5.563
134 HD22 ASN 27 2HD2 ASN 27 -13.363 6.756 -6.656
135 H GLY 28 H GLY 28 -6.679 6.634 -4.543
136 HA2 GLY 28 2HA GLY 28 -5.534 7.861 -2.976
137 HA3 GLY 28 3HA GLY 28 -6.609 9.178 -3.422
138 H LEU 29 H LEU 29 -7.079 6.082 -1.718
139 HA LEU 29 HA LEU 29 -8.605 7.524 0.324
140 HB3 LEU 29 2HB LEU 29 -8.986 5.004 1.035
141 HG LEU 29 HG LEU 29 -10.440 6.691 -0.831
142 HD11 LEU 29 1HD1 LEU 29 -10.652 5.167 -2.471
143 HD12 LEU 29 2HD1 LEU 29 -11.820 4.435 -1.371
144 HD13 LEU 29 3HD1 LEU 29 -10.167 3.825 -1.434
145 HD21 LEU 29 3HD2 LEU 29 -11.023 4.827 1.431
146 HD22 LEU 29 1HD2 LEU 29 -12.334 5.405 0.402
147 HD23 LEU 29 2HD2 LEU 29 -11.338 6.557 1.291
148 HA PRO 30 HA PRO 30 -5.590 7.107 3.483
149 HB3 PRO 30 2HB PRO 30 -7.087 8.106 4.912
150 HG3 PRO 30 2HG PRO 30 -9.359 7.625 4.796
151 HD3 PRO 30 2HD PRO 30 -8.936 8.082 2.578
Start of MODEL 17
1 H1 SER 1 H SER 1 -6.944 3.865 2.858
2 HA SER 1 HA SER 1 -7.238 2.104 4.995
3 HB3 SER 1 2HB SER 1 -6.772 1.616 2.052
4 HG SER 1 HG SER 1 -7.843 -0.511 3.031
5 H CYS 2 H CYS 2 -4.709 1.763 2.510
6 HA CYS 2 HA CYS 2 -2.949 0.640 4.580
7 HB3 CYS 2 2HB CYS 2 -1.775 -0.500 2.820
8 H ASN 3 H ASN 3 -1.624 2.118 5.409
9 HA ASN 3 HA ASN 3 -0.146 3.850 3.552
10 HB3 ASN 3 2HB ASN 3 -0.443 5.777 4.890
11 HD21 ASN 3 1HD2 ASN 3 -3.201 4.195 6.245
12 HD22 ASN 3 2HD2 ASN 3 -4.367 4.818 5.132
13 H ASN 4 H ASN 4 0.635 1.368 4.754
14 HA ASN 4 HA ASN 4 2.698 2.267 6.654
15 HB3 ASN 4 2HB ASN 4 1.568 0.622 7.818
16 HD21 ASN 4 1HD2 ASN 4 2.285 -1.528 5.146
17 HD22 ASN 4 2HD2 ASN 4 0.659 -2.052 4.885
18 H SER 5 H SER 5 4.823 1.343 6.457
19 HA SER 5 HA SER 5 5.728 1.270 3.751
20 HB3 SER 5 2HB SER 5 7.960 0.688 4.895
21 HG SER 5 HG SER 5 7.973 2.775 4.603
22 H CYS 6 H CYS 6 6.663 -0.433 2.612
23 HA CYS 6 HA CYS 6 6.857 -3.073 3.683
24 HB3 CYS 6 2HB CYS 6 4.503 -3.203 3.454
25 H GLN 7 H GLN 7 7.149 -4.685 1.731
26 HA GLN 7 HA GLN 7 8.579 -3.336 -0.449
27 HB3 GLN 7 2HB GLN 7 10.308 -3.965 1.089
28 HG3 GLN 7 2HG GLN 7 9.445 -6.831 0.968
29 HE21 GLN 7 1HE2 GLN 7 9.972 -6.976 3.812
30 HE22 GLN 7 2HE2 GLN 7 11.689 -6.931 3.997
31 H SER 8 H SER 8 7.345 -6.443 0.756
32 HA SER 8 HA SER 8 6.402 -7.029 -1.962
33 HB3 SER 8 2HB SER 8 7.648 -9.122 -0.172
34 HG SER 8 HG SER 8 7.563 -9.434 -2.904
35 H HIS 9 H HIS 9 4.635 -5.976 -0.380
36 HA HIS 9 HA HIS 9 2.583 -6.252 0.562
37 HB3 HIS 9 2HB HIS 9 2.722 -9.191 -0.057
38 HD1 HIS 9 1HD HIS 9 0.267 -6.729 -1.443
39 HD2 HIS 9 2HD HIS 9 0.476 -9.606 1.546
40 HE1 HIS 9 1HE HIS 9 -2.099 -7.049 -0.653
41 H SER 10 H SER 10 5.020 -6.623 2.136
42 HA SER 10 HA SER 10 4.582 -8.729 4.014
43 HB3 SER 10 2HB SER 10 6.452 -6.410 3.799
44 HG SER 10 HG SER 10 7.204 -6.797 5.883
45 H ASP 11 H ASP 11 4.122 -5.205 4.124
46 HA ASP 11 HA ASP 11 2.561 -5.521 6.588
47 HB3 ASP 11 2HB ASP 11 2.758 -3.051 6.768
48 H CYS 12 H CYS 12 2.248 -4.908 3.233
49 HA CYS 12 HA CYS 12 -0.167 -3.432 3.251
50 HB3 CYS 12 2HB CYS 12 -0.297 -3.914 0.906
51 H ALA 13 H ALA 13 -2.292 -4.161 2.697
52 HA ALA 13 HA ALA 13 -2.923 -6.964 2.769
53 HB1 ALA 13 1HB ALA 13 -2.674 -6.708 5.120
54 HB2 ALA 13 2HB ALA 13 -3.614 -5.215 5.119
55 HB3 ALA 13 3HB ALA 13 -4.405 -6.755 4.783
56 H SER 14 H SER 14 -5.307 -7.326 2.635
57 HA SER 14 HA SER 14 -7.315 -6.956 1.635
58 HB3 SER 14 2HB SER 14 -6.858 -4.008 2.110
59 HG SER 14 HG SER 14 -9.234 -4.335 2.550
60 H HIS 15 H HIS 15 -5.347 -7.383 -0.113
61 HA HIS 15 HA HIS 15 -4.634 -7.075 -2.257
62 HB3 HIS 15 2HB HIS 15 -6.343 -6.351 -3.856
63 HD1 HIS 15 1HD HIS 15 -5.717 -8.960 -1.842
64 HD2 HIS 15 2HD HIS 15 -9.310 -7.611 -3.433
65 HE1 HIS 15 1HE HIS 15 -7.250 -10.953 -1.824
66 H CYS 16 H CYS 16 -3.478 -5.261 -0.643
67 HA CYS 16 HA CYS 16 -3.727 -2.669 -2.001
68 HB3 CYS 16 2HB CYS 16 -2.069 -2.106 0.025
69 H ILE 17 H ILE 17 -2.085 -1.812 -3.158
70 HA ILE 17 HA ILE 17 0.054 -3.540 -3.961
71 HB ILE 17 HB ILE 17 -1.026 -1.984 -5.541
72 HG13 ILE 17 2HG1 ILE 17 0.882 -1.697 -6.771
73 HG21 ILE 17 1HG2 ILE 17 -1.462 -0.089 -4.175
74 HG22 ILE 17 2HG2 ILE 17 0.249 0.110 -3.794
75 HG23 ILE 17 3HG2 ILE 17 -0.334 0.429 -5.428
76 HD11 ILE 17 3HD1 ILE 17 2.090 -0.527 -4.305
77 HD12 ILE 17 1HD1 ILE 17 3.115 -1.091 -5.625
78 HD13 ILE 17 2HD1 ILE 17 1.921 0.175 -5.914
79 H CYS 18 H CYS 18 2.242 -3.331 -3.588
80 HA CYS 18 HA CYS 18 3.014 -1.427 -1.474
81 HB3 CYS 18 2HB CYS 18 4.827 -3.360 -1.100
82 H THR 19 H THR 19 4.812 -0.235 -1.794
83 HA THR 19 HA THR 19 6.681 -0.955 -3.912
84 HB THR 19 HB THR 19 6.542 1.595 -4.593
85 HG1 THR 19 1HG THR 19 4.272 2.215 -4.560
86 HG21 THR 19 3HG2 THR 19 5.374 -0.839 -5.593
87 HG22 THR 19 1HG2 THR 19 6.055 0.521 -6.486
88 HG23 THR 19 2HG2 THR 19 4.359 0.543 -6.002
89 H PHE 20 H PHE 20 8.421 0.920 -4.019
90 HA PHE 20 HA PHE 20 9.862 0.879 -1.669
91 HB3 PHE 20 2HB PHE 20 10.697 1.508 -3.972
92 HD1 PHE 20 2HD PHE 20 8.633 2.441 -5.222
93 HD2 PHE 20 1HD PHE 20 11.199 4.793 -2.775
94 HE1 PHE 20 2HE PHE 20 7.861 4.473 -6.372
95 HE2 PHE 20 1HE PHE 20 10.431 6.830 -3.921
96 HZ PHE 20 HZ PHE 20 8.760 6.672 -5.722
97 H ARG 21 H ARG 21 7.346 3.075 -2.665
98 HA ARG 21 HA ARG 21 7.831 4.811 -0.363
99 HB3 ARG 21 2HB ARG 21 7.422 6.010 -2.386
100 HG3 ARG 21 2HG ARG 21 5.205 4.078 -2.767
101 HD3 ARG 21 2HD ARG 21 4.098 6.294 -2.633
102 HE ARG 21 HE ARG 21 6.240 7.301 -4.005
103 HH11 ARG 21 1HH1 ARG 21 2.796 7.214 -4.500
104 HH12 ARG 21 2HH1 ARG 21 2.752 8.712 -5.371
105 HH21 ARG 21 1HH2 ARG 21 6.196 9.273 -5.150
106 HH22 ARG 21 2HH2 ARG 21 4.687 9.881 -5.741
107 H GLY 22 H GLY 22 7.041 2.245 0.321
108 HA2 GLY 22 2HA GLY 22 5.571 1.215 1.757
109 HA3 GLY 22 3HA GLY 22 4.797 2.779 1.969
110 H CYS 23 H CYS 23 2.974 1.066 2.083
111 HA CYS 23 HA CYS 23 2.039 0.072 -0.451
112 HB3 CYS 23 2HB CYS 23 0.206 -0.859 0.773
113 H GLY 24 H GLY 24 -0.423 0.500 -0.904
114 HA2 GLY 24 2HA GLY 24 -1.262 3.220 -0.367
115 HA3 GLY 24 3HA GLY 24 -0.795 2.916 -2.033
116 H ALA 25 H ALA 25 -3.413 3.626 -0.850
117 HA ALA 25 HA ALA 25 -4.977 1.230 -1.505
118 HB1 ALA 25 1HB ALA 25 -5.222 2.968 0.594
119 HB2 ALA 25 2HB ALA 25 -6.455 3.549 -0.525
120 HB3 ALA 25 3HB ALA 25 -6.480 1.873 0.021
121 H VAL 26 H VAL 26 -7.047 1.634 -2.700
122 HA VAL 26 HA VAL 26 -6.577 2.635 -5.238
123 HB VAL 26 HB VAL 26 -9.018 2.563 -5.584
124 HG11 VAL 26 1HG1 VAL 26 -8.609 0.121 -4.001
125 HG12 VAL 26 2HG1 VAL 26 -9.010 0.317 -5.709
126 HG13 VAL 26 3HG1 VAL 26 -7.338 0.479 -5.168
127 HG21 VAL 26 3HG2 VAL 26 -10.260 3.156 -3.814
128 HG22 VAL 26 1HG2 VAL 26 -10.085 1.473 -3.315
129 HG23 VAL 26 2HG2 VAL 26 -9.004 2.705 -2.662
130 H ASN 27 H ASN 27 -6.582 4.597 -6.131
131 HA ASN 27 HA ASN 27 -6.735 6.852 -6.378
132 HB3 ASN 27 2HB ASN 27 -8.776 7.945 -5.621
133 HD21 ASN 27 1HD2 ASN 27 -10.931 5.770 -5.346
134 HD22 ASN 27 2HD2 ASN 27 -11.128 5.206 -6.967
135 H GLY 28 H GLY 28 -5.300 5.609 -4.034
136 HA2 GLY 28 2HA GLY 28 -4.095 6.319 -2.214
137 HA3 GLY 28 3HA GLY 28 -4.268 7.931 -2.892
138 H LEU 29 H LEU 29 -6.011 5.514 -0.959
139 HA LEU 29 HA LEU 29 -7.216 7.743 0.545
140 HB3 LEU 29 2HB LEU 29 -8.842 5.534 0.964
141 HG LEU 29 HG LEU 29 -9.346 8.081 0.236
142 HD11 LEU 29 1HD1 LEU 29 -10.219 6.465 -2.145
143 HD12 LEU 29 2HD1 LEU 29 -8.774 7.474 -2.139
144 HD13 LEU 29 3HD1 LEU 29 -10.360 8.205 -1.899
145 HD21 LEU 29 3HD2 LEU 29 -11.538 7.567 0.634
146 HD22 LEU 29 1HD2 LEU 29 -10.762 6.130 1.300
147 HD23 LEU 29 2HD2 LEU 29 -11.477 6.078 -0.311
148 HA PRO 30 HA PRO 30 -5.585 6.068 4.258
149 HB3 PRO 30 2HB PRO 30 -6.614 7.790 5.377
150 HG3 PRO 30 2HG PRO 30 -8.728 8.534 4.753
151 HD3 PRO 30 2HD PRO 30 -7.679 8.550 2.701
Start of MODEL 18
1 H1 SER 1 H SER 1 -6.624 3.901 2.835
2 HA SER 1 HA SER 1 -7.031 2.541 5.342
3 HB3 SER 1 2HB SER 1 -6.663 1.243 2.641
4 HG SER 1 HG SER 1 -8.555 0.358 4.438
5 H CYS 2 H CYS 2 -4.739 1.954 2.668
6 HA CYS 2 HA CYS 2 -2.873 0.791 4.606
7 HB3 CYS 2 2HB CYS 2 -1.749 -0.204 2.699
8 H ASN 3 H ASN 3 -2.006 2.657 5.515
9 HA ASN 3 HA ASN 3 -0.327 4.254 3.694
10 HB3 ASN 3 2HB ASN 3 -1.338 5.373 6.286
11 HD21 ASN 3 1HD2 ASN 3 -1.053 7.543 6.422
12 HD22 ASN 3 2HD2 ASN 3 -0.214 8.478 5.236
13 H ASN 4 H ASN 4 1.066 2.283 4.351
14 HA ASN 4 HA ASN 4 2.816 3.184 6.504
15 HB3 ASN 4 2HB ASN 4 1.546 1.624 7.739
16 HD21 ASN 4 1HD2 ASN 4 2.767 -1.143 6.322
17 HD22 ASN 4 2HD2 ASN 4 1.306 -1.748 5.624
18 H SER 5 H SER 5 4.762 1.472 6.565
19 HA SER 5 HA SER 5 5.753 1.407 3.813
20 HB3 SER 5 2HB SER 5 7.165 2.565 5.425
21 HG SER 5 HG SER 5 7.951 0.362 6.824
22 H CYS 6 H CYS 6 6.580 -0.432 2.851
23 HA CYS 6 HA CYS 6 6.643 -2.946 4.269
24 HB3 CYS 6 2HB CYS 6 4.340 -3.058 3.811
25 H GLN 7 H GLN 7 6.868 -4.753 2.357
26 HA GLN 7 HA GLN 7 8.909 -3.694 0.516
27 HB3 GLN 7 2HB GLN 7 10.310 -4.947 1.778
28 HG3 GLN 7 2HG GLN 7 9.443 -7.149 2.883
29 HE21 GLN 7 1HE2 GLN 7 7.784 -6.426 5.012
30 HE22 GLN 7 2HE2 GLN 7 8.568 -5.182 5.920
31 H SER 8 H SER 8 6.977 -6.654 1.014
32 HA SER 8 HA SER 8 5.960 -6.432 -1.708
33 HB3 SER 8 2HB SER 8 7.686 -7.814 -2.347
34 HG SER 8 HG SER 8 8.051 -9.659 -0.559
35 H HIS 9 H HIS 9 4.071 -5.949 -0.350
36 HA HIS 9 HA HIS 9 2.061 -6.497 0.562
37 HB3 HIS 9 2HB HIS 9 1.343 -8.963 0.094
38 HD1 HIS 9 1HD HIS 9 -0.685 -8.231 -1.111
39 HD2 HIS 9 2HD HIS 9 2.777 -6.807 -2.912
40 HE1 HIS 9 1HE HIS 9 -1.450 -7.032 -3.185
41 H SER 10 H SER 10 4.559 -6.853 2.113
42 HA SER 10 HA SER 10 4.111 -9.117 3.836
43 HB3 SER 10 2HB SER 10 6.044 -8.343 5.063
44 HG SER 10 HG SER 10 6.340 -9.186 2.859
45 H ASP 11 H ASP 11 4.141 -5.593 4.402
46 HA ASP 11 HA ASP 11 2.581 -5.965 6.831
47 HB3 ASP 11 2HB ASP 11 3.022 -3.641 7.282
48 H CYS 12 H CYS 12 2.176 -4.907 3.551
49 HA CYS 12 HA CYS 12 -0.192 -3.415 3.834
50 HB3 CYS 12 2HB CYS 12 -0.464 -3.685 1.454
51 H ALA 13 H ALA 13 -2.303 -4.173 2.756
52 HA ALA 13 HA ALA 13 -2.986 -6.934 2.906
53 HB1 ALA 13 1HB ALA 13 -4.757 -6.346 4.791
54 HB2 ALA 13 2HB ALA 13 -3.137 -6.930 5.178
55 HB3 ALA 13 3HB ALA 13 -3.497 -5.205 5.264
56 H SER 14 H SER 14 -5.334 -7.285 2.550
57 HA SER 14 HA SER 14 -7.250 -6.911 1.381
58 HB3 SER 14 2HB SER 14 -6.897 -3.953 1.822
59 HG SER 14 HG SER 14 -9.129 -5.704 1.745
60 H HIS 15 H HIS 15 -5.124 -7.318 -0.187
61 HA HIS 15 HA HIS 15 -4.223 -6.992 -2.256
62 HB3 HIS 15 2HB HIS 15 -5.827 -6.140 -3.981
63 HD1 HIS 15 1HD HIS 15 -4.982 -8.857 -3.760
64 HD2 HIS 15 2HD HIS 15 -8.756 -7.763 -2.413
65 HE1 HIS 15 1HE HIS 15 -6.320 -10.986 -3.707
66 H CYS 16 H CYS 16 -3.247 -5.167 -0.533
67 HA CYS 16 HA CYS 16 -3.410 -2.569 -1.891
68 HB3 CYS 16 2HB CYS 16 -1.918 -2.010 0.260
69 H ILE 17 H ILE 17 -1.931 -2.238 -3.405
70 HA ILE 17 HA ILE 17 0.356 -3.763 -3.836
71 HB ILE 17 HB ILE 17 -0.683 -2.295 -5.539
72 HG13 ILE 17 2HG1 ILE 17 2.251 -1.766 -5.017
73 HG21 ILE 17 1HG2 ILE 17 0.799 0.037 -4.418
74 HG22 ILE 17 2HG2 ILE 17 -0.594 0.002 -5.496
75 HG23 ILE 17 3HG2 ILE 17 -0.798 -0.362 -3.783
76 HD11 ILE 17 3HD1 ILE 17 0.921 -3.936 -6.622
77 HD12 ILE 17 1HD1 ILE 17 2.651 -3.594 -6.601
78 HD13 ILE 17 2HD1 ILE 17 1.842 -4.141 -5.131
79 H CYS 18 H CYS 18 2.538 -3.452 -3.418
80 HA CYS 18 HA CYS 18 3.186 -1.410 -1.396
81 HB3 CYS 18 2HB CYS 18 4.952 -3.311 -0.740
82 H THR 19 H THR 19 4.344 0.032 -2.528
83 HA THR 19 HA THR 19 6.500 -0.972 -4.265
84 HB THR 19 HB THR 19 5.913 1.875 -4.513
85 HG1 THR 19 1HG THR 19 3.829 1.767 -4.854
86 HG21 THR 19 3HG2 THR 19 5.524 0.870 -6.953
87 HG22 THR 19 1HG2 THR 19 6.395 -0.488 -6.245
88 HG23 THR 19 2HG2 THR 19 7.135 1.113 -6.281
89 H PHE 20 H PHE 20 8.116 1.157 -4.490
90 HA PHE 20 HA PHE 20 9.722 1.058 -2.227
91 HB3 PHE 20 2HB PHE 20 10.705 1.731 -4.290
92 HD1 PHE 20 1HD PHE 20 9.123 4.970 -3.428
93 HD2 PHE 20 2HD PHE 20 9.637 1.923 -6.355
94 HE1 PHE 20 1HE PHE 20 7.992 6.384 -5.094
95 HE2 PHE 20 2HE PHE 20 8.508 3.333 -8.026
96 HZ PHE 20 HZ PHE 20 7.682 5.567 -7.396
97 H ARG 21 H ARG 21 6.988 3.062 -2.930
98 HA ARG 21 HA ARG 21 7.560 4.805 -0.646
99 HB3 ARG 21 2HB ARG 21 6.912 6.018 -2.595
100 HG3 ARG 21 2HG ARG 21 4.790 3.958 -2.851
101 HD3 ARG 21 2HD ARG 21 3.708 6.259 -2.602
102 HE ARG 21 HE ARG 21 5.456 6.891 -4.757
103 HH11 ARG 21 1HH1 ARG 21 2.256 7.454 -3.508
104 HH12 ARG 21 2HH1 ARG 21 2.085 8.996 -4.279
105 HH21 ARG 21 1HH2 ARG 21 5.243 8.920 -5.777
106 HH22 ARG 21 2HH2 ARG 21 3.784 9.828 -5.570
107 H GLY 22 H GLY 22 7.035 2.235 0.117
108 HA2 GLY 22 2HA GLY 22 5.730 1.035 1.574
109 HA3 GLY 22 3HA GLY 22 4.924 2.552 1.943
110 H CYS 23 H CYS 23 3.061 1.054 2.174
111 HA CYS 23 HA CYS 23 1.955 -0.230 -0.106
112 HB3 CYS 23 2HB CYS 23 -0.024 -0.559 1.265
113 H GLY 24 H GLY 24 -0.585 0.421 -0.436
114 HA2 GLY 24 2HA GLY 24 -1.140 3.206 -0.569
115 HA3 GLY 24 3HA GLY 24 -0.584 2.615 -2.128
116 H ALA 25 H ALA 25 -3.264 3.530 -0.827
117 HA ALA 25 HA ALA 25 -4.894 1.216 -1.609
118 HB1 ALA 25 1HB ALA 25 -5.086 2.781 0.599
119 HB2 ALA 25 2HB ALA 25 -6.260 3.550 -0.471
120 HB3 ALA 25 3HB ALA 25 -6.415 1.837 -0.078
121 H VAL 26 H VAL 26 -7.068 1.898 -2.634
122 HA VAL 26 HA VAL 26 -6.575 2.940 -5.174
123 HB VAL 26 HB VAL 26 -9.080 3.121 -5.364
124 HG11 VAL 26 1HG1 VAL 26 -9.311 0.860 -5.689
125 HG12 VAL 26 2HG1 VAL 26 -7.552 1.003 -5.634
126 HG13 VAL 26 3HG1 VAL 26 -8.437 0.448 -4.213
127 HG21 VAL 26 3HG2 VAL 26 -9.650 1.626 -2.969
128 HG22 VAL 26 1HG2 VAL 26 -8.935 3.189 -2.574
129 HG23 VAL 26 2HG2 VAL 26 -10.391 3.111 -3.566
130 H ASN 27 H ASN 27 -6.305 4.948 -5.877
131 HA ASN 27 HA ASN 27 -6.298 7.218 -5.999
132 HB3 ASN 27 2HB ASN 27 -8.313 8.402 -5.334
133 HD21 ASN 27 1HD2 ASN 27 -7.889 7.754 -7.677
134 HD22 ASN 27 2HD2 ASN 27 -9.078 6.730 -8.400
135 H GLY 28 H GLY 28 -4.910 5.885 -3.811
136 HA2 GLY 28 2HA GLY 28 -3.679 6.486 -1.968
137 HA3 GLY 28 3HA GLY 28 -4.101 8.150 -2.345
138 H LEU 29 H LEU 29 -6.640 5.868 -1.794
139 HA LEU 29 HA LEU 29 -7.827 7.378 0.241
140 HB3 LEU 29 2HB LEU 29 -8.177 4.485 -0.519
141 HG LEU 29 HG LEU 29 -9.161 5.424 1.823
142 HD11 LEU 29 1HD1 LEU 29 -11.493 5.991 1.532
143 HD12 LEU 29 2HD1 LEU 29 -11.330 5.883 -0.221
144 HD13 LEU 29 3HD1 LEU 29 -10.482 7.149 0.668
145 HD21 LEU 29 3HD2 LEU 29 -11.119 3.692 1.088
146 HD22 LEU 29 1HD2 LEU 29 -9.519 3.213 1.650
147 HD23 LEU 29 2HD2 LEU 29 -9.856 3.298 -0.079
148 HA PRO 30 HA PRO 30 -5.485 6.269 3.810
149 HB3 PRO 30 2HB PRO 30 -6.354 8.165 4.775
150 HG3 PRO 30 2HG PRO 30 -8.510 8.883 4.279
151 HD3 PRO 30 2HD PRO 30 -7.694 8.576 2.145
Start of MODEL 19
1 H1 SER 1 H SER 1 -6.335 4.399 1.767
2 HA SER 1 HA SER 1 -7.533 2.743 3.708
3 HB3 SER 1 2HB SER 1 -6.211 1.722 1.197
4 HG SER 1 HG SER 1 -8.539 0.683 1.467
5 H CYS 2 H CYS 2 -4.268 2.759 2.311
6 HA CYS 2 HA CYS 2 -3.337 1.276 4.670
7 HB3 CYS 2 2HB CYS 2 -1.893 -0.121 3.295
8 H ASN 3 H ASN 3 -1.804 2.384 5.670
9 HA ASN 3 HA ASN 3 0.081 3.970 4.069
10 HB3 ASN 3 2HB ASN 3 -0.905 4.991 6.716
11 HD21 ASN 3 1HD2 ASN 3 -0.034 6.890 7.209
12 HD22 ASN 3 2HD2 ASN 3 0.949 7.842 6.154
13 H ASN 4 H ASN 4 1.056 1.701 4.628
14 HA ASN 4 HA ASN 4 2.719 2.085 7.021
15 HB3 ASN 4 2HB ASN 4 1.371 0.381 7.822
16 HD21 ASN 4 1HD2 ASN 4 2.305 -1.136 4.763
17 HD22 ASN 4 2HD2 ASN 4 0.714 -1.658 4.336
18 H SER 5 H SER 5 4.627 0.431 6.920
19 HA SER 5 HA SER 5 5.869 0.806 4.303
20 HB3 SER 5 2HB SER 5 7.229 1.597 6.093
21 HG SER 5 HG SER 5 7.177 -0.935 7.336
22 H CYS 6 H CYS 6 6.760 -0.855 3.099
23 HA CYS 6 HA CYS 6 6.768 -3.571 3.981
24 HB3 CYS 6 2HB CYS 6 4.430 -3.568 3.605
25 H GLN 7 H GLN 7 7.453 -5.064 2.228
26 HA GLN 7 HA GLN 7 8.904 -3.645 0.095
27 HB3 GLN 7 2HB GLN 7 10.706 -5.363 0.349
28 HG3 GLN 7 2HG GLN 7 10.135 -3.662 2.762
29 HE21 GLN 7 1HE2 GLN 7 13.205 -3.941 1.253
30 HE22 GLN 7 2HE2 GLN 7 14.001 -4.796 2.525
31 H SER 8 H SER 8 7.477 -6.706 1.154
32 HA SER 8 HA SER 8 6.934 -7.332 -1.669
33 HB3 SER 8 2HB SER 8 7.728 -9.371 0.423
34 HG SER 8 HG SER 8 6.732 -10.529 -1.063
35 H HIS 9 H HIS 9 5.004 -6.070 -0.495
36 HA HIS 9 HA HIS 9 2.834 -6.120 0.188
37 HB3 HIS 9 2HB HIS 9 2.677 -9.020 -0.552
38 HD1 HIS 9 1HD HIS 9 0.339 -9.213 0.415
39 HD2 HIS 9 2HD HIS 9 0.765 -6.021 -2.209
40 HE1 HIS 9 1HE HIS 9 -1.994 -8.373 -0.006
41 H SER 10 H SER 10 4.741 -6.615 2.195
42 HA SER 10 HA SER 10 3.874 -8.834 3.809
43 HB3 SER 10 2HB SER 10 5.602 -8.273 5.268
44 HG SER 10 HG SER 10 7.328 -7.451 3.909
45 H ASP 11 H ASP 11 3.935 -5.328 4.473
46 HA ASP 11 HA ASP 11 1.929 -5.587 6.512
47 HB3 ASP 11 2HB ASP 11 2.055 -3.027 6.455
48 H CYS 12 H CYS 12 1.969 -4.901 3.125
49 HA CYS 12 HA CYS 12 -0.336 -3.432 2.751
50 HB3 CYS 12 2HB CYS 12 -0.478 -5.012 0.597
51 H ALA 13 H ALA 13 -2.500 -3.864 2.614
52 HA ALA 13 HA ALA 13 -3.484 -6.578 2.856
53 HB1 ALA 13 1HB ALA 13 -3.284 -6.322 5.143
54 HB2 ALA 13 2HB ALA 13 -3.658 -4.599 5.089
55 HB3 ALA 13 3HB ALA 13 -4.941 -5.788 4.857
56 H SER 14 H SER 14 -5.974 -6.521 3.011
57 HA SER 14 HA SER 14 -7.901 -6.048 1.891
58 HB3 SER 14 2HB SER 14 -8.471 -3.533 1.869
59 HG SER 14 HG SER 14 -7.923 -3.957 4.471
60 H HIS 15 H HIS 15 -5.647 -6.487 0.242
61 HA HIS 15 HA HIS 15 -5.038 -6.364 -1.948
62 HB3 HIS 15 2HB HIS 15 -7.428 -4.672 -2.576
63 HD1 HIS 15 1HD HIS 15 -5.875 -8.001 -3.604
64 HD2 HIS 15 2HD HIS 15 -7.332 -4.479 -5.259
65 HE1 HIS 15 1HE HIS 15 -5.621 -8.272 -6.091
66 H CYS 16 H CYS 16 -3.583 -4.732 -0.574
67 HA CYS 16 HA CYS 16 -3.699 -2.110 -1.913
68 HB3 CYS 16 2HB CYS 16 -2.019 -1.576 0.062
69 H ILE 17 H ILE 17 -1.949 -1.357 -3.016
70 HA ILE 17 HA ILE 17 0.017 -3.297 -3.822
71 HB ILE 17 HB ILE 17 -0.944 -1.697 -5.436
72 HG13 ILE 17 2HG1 ILE 17 2.038 -1.395 -5.018
73 HG21 ILE 17 1HG2 ILE 17 -0.968 0.191 -3.721
74 HG22 ILE 17 2HG2 ILE 17 0.724 0.441 -4.151
75 HG23 ILE 17 3HG2 ILE 17 -0.532 0.609 -5.377
76 HD11 ILE 17 3HD1 ILE 17 2.137 -3.572 -5.440
77 HD12 ILE 17 1HD1 ILE 17 0.434 -3.648 -5.891
78 HD13 ILE 17 2HD1 ILE 17 1.641 -3.160 -7.083
79 H CYS 18 H CYS 18 2.223 -3.240 -3.479
80 HA CYS 18 HA CYS 18 3.159 -1.348 -1.421
81 HB3 CYS 18 2HB CYS 18 4.798 -3.416 -0.978
82 H THR 19 H THR 19 4.974 -0.254 -1.862
83 HA THR 19 HA THR 19 6.771 -1.228 -3.959
84 HB THR 19 HB THR 19 6.913 1.101 -4.901
85 HG1 THR 19 1HG THR 19 5.594 1.833 -2.884
86 HG21 THR 19 3HG2 THR 19 4.206 -0.221 -5.121
87 HG22 THR 19 1HG2 THR 19 5.648 -0.707 -6.011
88 HG23 THR 19 2HG2 THR 19 4.931 0.880 -6.291
89 H PHE 20 H PHE 20 8.630 0.603 -4.128
90 HA PHE 20 HA PHE 20 10.132 0.387 -1.800
91 HB3 PHE 20 2HB PHE 20 11.295 0.820 -3.816
92 HD1 PHE 20 1HD PHE 20 9.970 4.242 -3.252
93 HD2 PHE 20 2HD PHE 20 10.438 0.998 -5.968
94 HE1 PHE 20 1HE PHE 20 9.088 5.643 -5.072
95 HE2 PHE 20 2HE PHE 20 9.558 2.394 -7.792
96 HZ PHE 20 HZ PHE 20 8.883 4.721 -7.346
97 H ARG 21 H ARG 21 7.714 2.696 -2.685
98 HA ARG 21 HA ARG 21 8.460 4.492 -0.502
99 HB3 ARG 21 2HB ARG 21 7.928 5.628 -2.535
100 HG3 ARG 21 2HG ARG 21 5.565 3.822 -2.619
101 HD3 ARG 21 2HD ARG 21 4.627 6.102 -2.591
102 HE ARG 21 HE ARG 21 6.758 6.750 -4.329
103 HH11 ARG 21 1HH1 ARG 21 3.374 7.384 -3.806
104 HH12 ARG 21 2HH1 ARG 21 3.422 8.954 -4.537
105 HH21 ARG 21 1HH2 ARG 21 6.833 8.815 -5.295
106 HH22 ARG 21 2HH2 ARG 21 5.389 9.766 -5.386
107 H GLY 22 H GLY 22 7.446 1.824 0.055
108 HA2 GLY 22 2HA GLY 22 6.109 0.946 1.724
109 HA3 GLY 22 3HA GLY 22 5.450 2.554 1.985
110 H CYS 23 H CYS 23 3.580 0.861 2.260
111 HA CYS 23 HA CYS 23 2.359 0.044 -0.229
112 HB3 CYS 23 2HB CYS 23 0.457 -0.624 1.372
113 H GLY 24 H GLY 24 0.651 0.974 -1.252
114 HA2 GLY 24 2HA GLY 24 -0.241 3.574 -0.173
115 HA3 GLY 24 3HA GLY 24 -0.143 3.188 -1.884
116 H ALA 25 H ALA 25 -2.426 4.173 -1.451
117 HA ALA 25 HA ALA 25 -4.283 1.944 -0.921
118 HB1 ALA 25 1HB ALA 25 -4.373 3.884 0.679
119 HB2 ALA 25 2HB ALA 25 -4.953 4.867 -0.666
120 HB3 ALA 25 3HB ALA 25 -5.897 3.483 -0.113
121 H VAL 26 H VAL 26 -6.578 2.820 -1.958
122 HA VAL 26 HA VAL 26 -6.069 3.687 -4.708
123 HB VAL 26 HB VAL 26 -7.682 1.872 -5.489
124 HG11 VAL 26 1HG1 VAL 26 -4.871 1.361 -4.582
125 HG12 VAL 26 2HG1 VAL 26 -5.801 0.114 -5.416
126 HG13 VAL 26 3HG1 VAL 26 -5.479 1.656 -6.212
127 HG21 VAL 26 3HG2 VAL 26 -6.841 0.049 -3.390
128 HG22 VAL 26 1HG2 VAL 26 -7.869 1.348 -2.784
129 HG23 VAL 26 2HG2 VAL 26 -8.439 0.308 -4.088
130 H ASN 27 H ASN 27 -8.108 4.182 -5.881
131 HA ASN 27 HA ASN 27 -10.091 5.280 -6.060
132 HB3 ASN 27 2HB ASN 27 -10.766 4.065 -3.373
133 HD21 ASN 27 1HD2 ASN 27 -13.062 3.625 -3.188
134 HD22 ASN 27 2HD2 ASN 27 -14.188 4.709 -3.926
135 H GLY 28 H GLY 28 -7.722 6.232 -4.286
136 HA2 GLY 28 2HA GLY 28 -7.200 8.229 -3.273
137 HA3 GLY 28 3HA GLY 28 -8.795 8.802 -3.737
138 H LEU 29 H LEU 29 -7.831 6.125 -1.608
139 HA LEU 29 HA LEU 29 -9.290 7.471 0.571
140 HB3 LEU 29 2HB LEU 29 -9.538 5.002 1.389
141 HG LEU 29 HG LEU 29 -11.665 4.721 0.444
142 HD11 LEU 29 1HD1 LEU 29 -12.706 6.847 0.695
143 HD12 LEU 29 2HD1 LEU 29 -11.211 7.693 0.298
144 HD13 LEU 29 3HD1 LEU 29 -11.339 6.794 1.809
145 HD21 LEU 29 3HD2 LEU 29 -11.658 6.661 -1.686
146 HD22 LEU 29 1HD2 LEU 29 -12.099 4.954 -1.722
147 HD23 LEU 29 2HD2 LEU 29 -10.418 5.434 -1.951
148 HA PRO 30 HA PRO 30 -5.753 7.156 3.147
149 HB3 PRO 30 2HB PRO 30 -7.002 8.108 4.824
150 HG3 PRO 30 2HG PRO 30 -9.241 7.552 5.117
151 HD3 PRO 30 2HD PRO 30 -9.238 8.016 2.858
Start of MODEL 20
1 H1 SER 1 H SER 1 -6.351 4.451 2.812
2 HA SER 1 HA SER 1 -6.693 3.147 5.219
3 HB3 SER 1 2HB SER 1 -6.689 2.059 2.400
4 HG SER 1 HG SER 1 -7.247 0.797 4.855
5 H CYS 2 H CYS 2 -4.664 1.761 2.646
6 HA CYS 2 HA CYS 2 -3.028 0.465 4.682
7 HB3 CYS 2 2HB CYS 2 -2.119 -0.858 2.861
8 H ASN 3 H ASN 3 -1.553 1.839 5.505
9 HA ASN 3 HA ASN 3 0.375 3.003 3.628
10 HB3 ASN 3 2HB ASN 3 -0.905 4.915 4.108
11 HD21 ASN 3 1HD2 ASN 3 -2.937 4.699 4.893
12 HD22 ASN 3 2HD2 ASN 3 -3.327 4.710 6.575
13 H ASN 4 H ASN 4 1.944 1.520 4.149
14 HA ASN 4 HA ASN 4 3.129 1.836 6.805
15 HB3 ASN 4 2HB ASN 4 3.368 -0.513 7.173
16 HD21 ASN 4 1HD2 ASN 4 0.883 -1.795 5.630
17 HD22 ASN 4 2HD2 ASN 4 -0.422 -1.338 6.666
18 H SER 5 H SER 5 5.207 0.096 6.619
19 HA SER 5 HA SER 5 6.780 1.298 4.466
20 HB3 SER 5 2HB SER 5 8.700 0.179 5.808
21 HG SER 5 HG SER 5 8.755 1.952 7.171
22 H CYS 6 H CYS 6 4.878 -1.202 4.518
23 HA CYS 6 HA CYS 6 6.279 -3.519 4.004
24 HB3 CYS 6 2HB CYS 6 3.821 -3.394 4.161
25 H GLN 7 H GLN 7 7.395 -4.364 2.322
26 HA GLN 7 HA GLN 7 7.894 -2.573 0.044
27 HB3 GLN 7 2HB GLN 7 9.925 -4.200 -0.222
28 HG3 GLN 7 2HG GLN 7 9.691 -2.104 1.908
29 HE21 GLN 7 1HE2 GLN 7 11.861 -1.122 2.399
30 HE22 GLN 7 2HE2 GLN 7 13.149 -2.216 2.754
31 H SER 8 H SER 8 6.990 -5.830 0.960
32 HA SER 8 HA SER 8 6.016 -6.289 -1.751
33 HB3 SER 8 2HB SER 8 6.998 -8.711 -1.474
34 HG SER 8 HG SER 8 7.634 -7.132 -3.069
35 H HIS 9 H HIS 9 3.985 -5.985 -0.667
36 HA HIS 9 HA HIS 9 2.169 -6.600 0.603
37 HB3 HIS 9 2HB HIS 9 2.000 -8.015 -1.406
38 HD1 HIS 9 1HD HIS 9 4.216 -8.976 -2.375
39 HD2 HIS 9 2HD HIS 9 2.645 -11.139 0.804
40 HE1 HIS 9 1HE HIS 9 5.450 -11.167 -2.378
41 H SER 10 H SER 10 4.479 -6.502 2.192
42 HA SER 10 HA SER 10 4.624 -8.893 3.796
43 HB3 SER 10 2HB SER 10 6.002 -7.238 5.297
44 HG SER 10 HG SER 10 6.980 -8.828 4.013
45 H ASP 11 H ASP 11 3.591 -5.537 4.417
46 HA ASP 11 HA ASP 11 2.017 -6.522 6.698
47 HB3 ASP 11 2HB ASP 11 1.905 -3.871 7.035
48 H CYS 12 H CYS 12 1.808 -5.064 3.578
49 HA CYS 12 HA CYS 12 -0.671 -3.803 3.700
50 HB3 CYS 12 2HB CYS 12 -0.754 -4.042 1.288
51 H ALA 13 H ALA 13 -2.747 -4.518 2.855
52 HA ALA 13 HA ALA 13 -3.286 -7.335 2.644
53 HB1 ALA 13 1HB ALA 13 -4.071 -5.811 5.102
54 HB2 ALA 13 2HB ALA 13 -5.010 -7.197 4.546
55 HB3 ALA 13 3HB ALA 13 -3.310 -7.396 4.973
56 H SER 14 H SER 14 -5.633 -7.750 2.274
57 HA SER 14 HA SER 14 -7.569 -7.351 1.148
58 HB3 SER 14 2HB SER 14 -7.273 -4.433 1.858
59 HG SER 14 HG SER 14 -9.699 -5.573 2.173
60 H HIS 15 H HIS 15 -5.435 -7.567 -0.451
61 HA HIS 15 HA HIS 15 -4.557 -7.059 -2.492
62 HB3 HIS 15 2HB HIS 15 -6.219 -6.076 -4.128
63 HD1 HIS 15 1HD HIS 15 -5.097 -8.799 -3.969
64 HD2 HIS 15 2HD HIS 15 -9.072 -8.027 -3.037
65 HE1 HIS 15 1HE HIS 15 -6.291 -10.996 -4.243
66 H CYS 16 H CYS 16 -3.658 -5.325 -0.623
67 HA CYS 16 HA CYS 16 -3.908 -2.644 -1.792
68 HB3 CYS 16 2HB CYS 16 -2.434 -2.188 0.393
69 H ILE 17 H ILE 17 -2.451 -2.174 -3.294
70 HA ILE 17 HA ILE 17 -0.114 -3.573 -3.835
71 HB ILE 17 HB ILE 17 -0.678 -0.671 -4.453
72 HG13 ILE 17 2HG1 ILE 17 -1.437 -1.541 -6.645
73 HG21 ILE 17 1HG2 ILE 17 0.861 -1.705 -6.486
74 HG22 ILE 17 2HG2 ILE 17 1.434 -0.673 -5.177
75 HG23 ILE 17 3HG2 ILE 17 1.568 -2.426 -5.040
76 HD11 ILE 17 3HD1 ILE 17 -0.175 -3.819 -6.190
77 HD12 ILE 17 1HD1 ILE 17 -1.752 -4.269 -5.544
78 HD13 ILE 17 2HD1 ILE 17 -1.607 -3.726 -7.216
79 H CYS 18 H CYS 18 1.975 -3.429 -3.195
80 HA CYS 18 HA CYS 18 2.625 -1.405 -1.152
81 HB3 CYS 18 2HB CYS 18 4.308 -3.357 -0.454
82 H THR 19 H THR 19 3.824 0.019 -2.280
83 HA THR 19 HA THR 19 6.041 -1.028 -3.910
84 HB THR 19 HB THR 19 5.507 1.820 -4.220
85 HG1 THR 19 1HG THR 19 3.399 1.654 -4.310
86 HG21 THR 19 3HG2 THR 19 6.698 -0.137 -5.673
87 HG22 THR 19 1HG2 THR 19 6.147 1.397 -6.345
88 HG23 THR 19 2HG2 THR 19 5.130 -0.037 -6.473
89 H PHE 20 H PHE 20 7.692 1.076 -4.091
90 HA PHE 20 HA PHE 20 9.155 0.999 -1.710
91 HB3 PHE 20 2HB PHE 20 10.324 1.503 -3.716
92 HD1 PHE 20 1HD PHE 20 8.900 4.879 -3.243
93 HD2 PHE 20 2HD PHE 20 9.328 1.537 -5.845
94 HE1 PHE 20 1HE PHE 20 7.954 6.200 -5.091
95 HE2 PHE 20 2HE PHE 20 8.385 2.853 -7.696
96 HZ PHE 20 HZ PHE 20 7.697 5.188 -7.322
97 H ARG 21 H ARG 21 6.504 2.973 -2.648
98 HA ARG 21 HA ARG 21 7.040 4.953 -0.569
99 HB3 ARG 21 2HB ARG 21 4.656 5.707 -1.583
100 HG3 ARG 21 2HG ARG 21 7.148 6.245 -3.162
101 HD3 ARG 21 2HD ARG 21 4.637 7.768 -2.522
102 HE ARG 21 HE ARG 21 7.159 8.946 -2.887
103 HH11 ARG 21 1HH1 ARG 21 3.901 9.157 -4.094
104 HH12 ARG 21 2HH1 ARG 21 4.021 10.837 -4.501
105 HH21 ARG 21 1HH2 ARG 21 7.330 11.158 -3.418
106 HH22 ARG 21 2HH2 ARG 21 5.973 11.974 -4.116
107 H GLY 22 H GLY 22 6.231 2.060 -0.128
108 HA2 GLY 22 2HA GLY 22 5.133 1.110 1.695
109 HA3 GLY 22 3HA GLY 22 4.300 2.635 1.957
110 H CYS 23 H CYS 23 2.559 0.929 2.341
111 HA CYS 23 HA CYS 23 1.427 -0.456 0.153
112 HB3 CYS 23 2HB CYS 23 -0.562 -0.693 1.615
113 H GLY 24 H GLY 24 -1.010 -0.002 -0.391
114 HA2 GLY 24 2HA GLY 24 -1.623 2.830 -0.627
115 HA3 GLY 24 3HA GLY 24 -1.286 2.001 -2.140
116 H ALA 25 H ALA 25 -3.756 3.274 -1.251
117 HA ALA 25 HA ALA 25 -5.529 0.917 -1.264
118 HB1 ALA 25 1HB ALA 25 -6.961 1.899 0.198
119 HB2 ALA 25 2HB ALA 25 -5.475 2.693 0.718
120 HB3 ALA 25 3HB ALA 25 -6.592 3.531 -0.360
121 H VAL 26 H VAL 26 -7.766 1.515 -2.186
122 HA VAL 26 HA VAL 26 -7.557 2.040 -4.886
123 HB VAL 26 HB VAL 26 -10.045 2.574 -4.772
124 HG11 VAL 26 1HG1 VAL 26 -10.309 0.387 -5.074
125 HG12 VAL 26 2HG1 VAL 26 -8.637 0.174 -4.550
126 HG13 VAL 26 3HG1 VAL 26 -9.952 0.052 -3.380
127 HG21 VAL 26 3HG2 VAL 26 -9.905 1.628 -1.938
128 HG22 VAL 26 1HG2 VAL 26 -9.741 3.344 -2.310
129 HG23 VAL 26 2HG2 VAL 26 -11.206 2.477 -2.771
130 H ASN 27 H ASN 27 -7.512 3.810 -6.145
131 HA ASN 27 HA ASN 27 -7.271 5.989 -6.754
132 HB3 ASN 27 2HB ASN 27 -8.873 7.575 -5.363
133 HD21 ASN 27 1HD2 ASN 27 -10.344 8.327 -6.730
134 HD22 ASN 27 2HD2 ASN 27 -10.972 7.473 -8.094
135 H GLY 28 H GLY 28 -5.611 4.875 -4.543
136 HA2 GLY 28 2HA GLY 28 -4.033 5.592 -3.037
137 HA3 GLY 28 3HA GLY 28 -4.036 7.078 -3.976
138 H LEU 29 H LEU 29 -5.483 5.423 -1.231
139 HA LEU 29 HA LEU 29 -6.013 8.040 -0.025
140 HB3 LEU 29 2HB LEU 29 -8.064 6.412 0.910
141 HG LEU 29 HG LEU 29 -8.085 8.909 0.097
142 HD11 LEU 29 1HD1 LEU 29 -8.691 7.340 -2.352
143 HD12 LEU 29 2HD1 LEU 29 -7.851 8.880 -2.172
144 HD13 LEU 29 3HD1 LEU 29 -9.609 8.815 -2.053
145 HD21 LEU 29 3HD2 LEU 29 -10.490 8.874 0.170
146 HD22 LEU 29 1HD2 LEU 29 -9.864 7.709 1.338
147 HD23 LEU 29 2HD2 LEU 29 -10.515 7.149 -0.202
148 HA PRO 30 HA PRO 30 -4.286 6.367 3.645
149 HB3 PRO 30 2HB PRO 30 -4.635 8.413 4.631
150 HG3 PRO 30 2HG PRO 30 -6.556 9.646 4.188
151 HD3 PRO 30 2HD PRO 30 -5.891 9.161 2.036