Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
578634 | 2mau RC | 19374 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 CYS 1 H CYS 1 6.561 2.634 3.671
2 HA CYS 1 HA CYS 1 8.093 1.544 2.168
3 HB2 CYS 1 2HB CYS 1 7.560 -1.024 1.895
4 HB3 CYS 1 3HB CYS 1 8.611 -0.457 3.189
5 H ALA 2 H ALA 2 7.503 0.213 0.099
6 HA ALA 2 HA ALA 2 4.784 1.025 -0.702
7 HB1 ALA 2 1HB ALA 2 7.245 0.771 -2.429
8 HB2 ALA 2 2HB ALA 2 5.642 1.274 -2.970
9 HB3 ALA 2 3HB ALA 2 6.549 2.280 -1.839
10 H GLN 3 H GLN 3 3.696 -0.316 -2.271
11 HA GLN 3 HA GLN 3 4.204 -3.138 -1.789
12 HB2 GLN 3 2HB GLN 3 1.898 -1.501 -2.585
13 HB3 GLN 3 3HB GLN 3 2.002 -3.050 -3.411
14 HG2 GLN 3 2HG GLN 3 0.794 -3.693 -1.612
15 HG3 GLN 3 3HG GLN 3 2.411 -3.917 -0.945
16 HE21 GLN 3 1HE2 GLN 3 -0.559 -2.648 -0.358
17 HE22 GLN 3 2HE2 GLN 3 -0.145 -1.487 0.852
18 H LYS 4 H LYS 4 4.476 -4.684 -3.419
19 HA LYS 4 HA LYS 4 6.198 -4.059 -5.488
20 HB2 LYS 4 2HB LYS 4 5.346 -6.306 -6.470
21 HB3 LYS 4 3HB LYS 4 6.166 -6.309 -4.914
22 HG2 LYS 4 2HG LYS 4 4.255 -7.743 -4.788
23 HG3 LYS 4 3HG LYS 4 3.955 -6.310 -3.799
24 HD2 LYS 4 2HD LYS 4 3.065 -5.979 -6.549
25 HD3 LYS 4 3HD LYS 4 2.279 -7.339 -5.742
26 HE2 LYS 4 2HE LYS 4 2.375 -4.474 -4.808
27 HE3 LYS 4 3HE LYS 4 0.965 -5.350 -5.402
28 HZ1 LYS 4 3HZ LYS 4 0.589 -5.759 -3.255
29 HZ2 LYS 4 1HZ LYS 4 2.166 -5.362 -2.785
30 HZ3 LYS 4 2HZ LYS 4 1.822 -6.910 -3.375
31 H GLY 5 H GLY 5 5.600 -4.787 -7.880
32 HA2 GLY 5 2HA GLY 5 4.625 -4.060 -9.830
33 HA3 GLY 5 3HA GLY 5 3.109 -4.360 -8.994
34 H GLU 6 H GLU 6 5.283 -2.017 -7.681
35 HA GLU 6 HA GLU 6 3.700 0.161 -8.863
36 HB2 GLU 6 2HB GLU 6 4.513 0.026 -5.956
37 HB3 GLU 6 3HB GLU 6 3.552 1.283 -6.723
38 HG2 GLU 6 2HG GLU 6 2.390 -1.337 -7.106
39 HG3 GLU 6 3HG GLU 6 2.610 -0.955 -5.399
40 H TYR 7 H TYR 7 4.753 2.300 -8.629
41 HA TYR 7 HA TYR 7 7.346 2.288 -9.639
42 HB2 TYR 7 2HB TYR 7 5.694 4.164 -9.826
43 HB3 TYR 7 3HB TYR 7 6.041 4.574 -8.150
44 HD1 TYR 7 HD2 TYR 7 8.174 5.572 -7.528
45 HD2 TYR 7 HD1 TYR 7 7.305 4.616 -11.582
46 HE1 TYR 7 HE2 TYR 7 10.063 6.969 -8.256
47 HE2 TYR 7 HE1 TYR 7 9.192 6.011 -12.321
48 HH TYR 7 HH TYR 7 10.531 7.883 -11.499
49 H CYS 8 H CYS 8 9.357 2.836 -8.751
50 HA CYS 8 HA CYS 8 9.601 3.057 -5.861
51 HB2 CYS 8 2HB CYS 8 9.634 0.646 -6.190
52 HB3 CYS 8 3HB CYS 8 10.872 0.805 -7.432
53 H SER 9 H SER 9 11.500 4.028 -5.189
54 HA SER 9 HA SER 9 13.707 4.475 -6.950
55 HB2 SER 9 2HB SER 9 13.500 6.847 -7.266
56 HB3 SER 9 3HB SER 9 11.986 6.113 -7.798
57 HG SER 9 HG SER 9 10.996 7.239 -6.340
58 H VAL 10 H VAL 10 15.152 6.316 -5.907
59 HA VAL 10 HA VAL 10 16.074 5.418 -3.479
60 HB VAL 10 HB VAL 10 17.134 7.701 -3.224
61 HG11 VAL 10 1HG1 VAL 10 18.262 5.862 -4.356
62 HG12 VAL 10 2HG1 VAL 10 17.464 6.290 -5.870
63 HG13 VAL 10 3HG1 VAL 10 18.627 7.398 -5.142
64 HG21 VAL 10 3HG2 VAL 10 16.419 9.441 -4.409
65 HG22 VAL 10 1HG2 VAL 10 16.588 8.546 -5.919
66 HG23 VAL 10 2HG2 VAL 10 15.092 8.437 -4.991
67 H TYR 11 H TYR 11 13.505 7.698 -4.123
68 HA TYR 11 HA TYR 11 13.267 8.422 -1.315
69 HB2 TYR 11 2HB TYR 11 11.432 9.230 -3.569
70 HB3 TYR 11 3HB TYR 11 11.636 10.021 -2.010
71 HD1 TYR 11 HD1 TYR 11 14.195 10.744 -1.551
72 HD2 TYR 11 HD2 TYR 11 12.408 10.260 -5.382
73 HE1 TYR 11 HE1 TYR 11 15.889 12.237 -2.524
74 HE2 TYR 11 HE2 TYR 11 14.098 11.750 -6.366
75 HH TYR 11 HH TYR 11 15.729 13.247 -5.898
76 H LEU 12 H LEU 12 11.579 6.533 -3.754
77 HA LEU 12 HA LEU 12 9.445 5.850 -1.900
78 HB2 LEU 12 2HB LEU 12 9.852 5.767 -4.767
79 HB3 LEU 12 3HB LEU 12 9.185 4.253 -4.158
80 HG LEU 12 HG LEU 12 7.651 6.261 -2.966
81 HD11 LEU 12 1HD1 LEU 12 8.832 7.556 -4.986
82 HD12 LEU 12 2HD1 LEU 12 7.178 7.882 -4.468
83 HD13 LEU 12 3HD1 LEU 12 7.478 6.838 -5.858
84 HD21 LEU 12 3HD2 LEU 12 5.904 5.137 -3.926
85 HD22 LEU 12 1HD2 LEU 12 7.171 3.917 -4.060
86 HD23 LEU 12 2HD2 LEU 12 6.748 4.906 -5.458
87 H GLN 13 H GLN 13 10.311 4.570 -0.320
88 HA GLN 13 HA GLN 13 12.096 2.408 -0.886
89 HB2 GLN 13 2HB GLN 13 11.077 3.746 1.440
90 HB3 GLN 13 3HB GLN 13 10.889 2.009 1.640
91 HG2 GLN 13 2HG GLN 13 13.445 3.470 1.017
92 HG3 GLN 13 3HG GLN 13 12.997 2.741 2.559
93 HE21 GLN 13 1HE2 GLN 13 12.116 0.335 2.027
94 HE22 GLN 13 2HE2 GLN 13 13.285 -0.621 1.188
95 H CYS 14 H CYS 14 11.677 0.165 -0.621
96 HA CYS 14 HA CYS 14 8.849 -0.573 -0.998
97 HB2 CYS 14 2HB CYS 14 10.706 -0.818 -2.924
98 HB3 CYS 14 3HB CYS 14 10.964 -2.348 -2.093
99 H CYS 15 H CYS 15 8.124 -2.484 -0.042
100 HA CYS 15 HA CYS 15 9.775 -3.393 2.201
101 HB2 CYS 15 2HB CYS 15 6.966 -2.880 1.838
102 HB3 CYS 15 3HB CYS 15 7.204 -4.544 2.362
103 H ASP 16 H ASP 16 10.927 -5.169 1.878
104 HA ASP 16 HA ASP 16 10.802 -6.914 -0.231
105 HB2 ASP 16 2HB ASP 16 11.781 -8.600 1.564
106 HB3 ASP 16 3HB ASP 16 12.715 -7.217 1.006
107 HA PRO 17 HA PRO 17 11.451 -9.328 -0.176
108 HB2 PRO 17 2HB PRO 17 10.421 -10.965 -2.080
109 HB3 PRO 17 3HB PRO 17 10.726 -11.494 -0.420
110 HG2 PRO 17 2HG PRO 17 8.156 -10.629 -1.692
111 HG3 PRO 17 3HG PRO 17 8.460 -11.988 -0.594
112 HD2 PRO 17 2HD PRO 17 7.386 -9.649 0.245
113 HD3 PRO 17 3HD PRO 17 8.430 -10.645 1.279
114 H TYR 18 H TYR 18 8.683 -7.719 -1.329
115 HA TYR 18 HA TYR 18 9.044 -7.357 -4.010
116 HB2 TYR 18 2HB TYR 18 8.389 -5.076 -2.147
117 HB3 TYR 18 3HB TYR 18 7.868 -5.287 -3.814
118 HD1 TYR 18 HD2 TYR 18 7.175 -8.279 -3.497
119 HD2 TYR 18 HD1 TYR 18 6.200 -4.827 -1.208
120 HE1 TYR 18 HE2 TYR 18 5.120 -9.383 -2.717
121 HE2 TYR 18 HE1 TYR 18 4.144 -5.921 -0.422
122 HH TYR 18 HH TYR 18 2.617 -8.050 -1.623
123 H HIS 19 H HIS 19 10.983 -7.122 -4.947
124 HA HIS 19 HA HIS 19 12.817 -5.082 -3.889
125 HB2 HIS 19 2HB HIS 19 14.570 -6.231 -5.179
126 HB3 HIS 19 3HB HIS 19 13.778 -7.324 -4.049
127 HD1 HIS 19 HD1 HIS 19 12.202 -9.145 -5.078
128 HD2 HIS 19 HD2 HIS 19 14.317 -6.895 -7.857
129 HE1 HIS 19 HE1 HIS 19 12.002 -10.398 -7.250
130 H CYS 20 H CYS 20 13.455 -3.377 -5.110
131 HA CYS 20 HA CYS 20 11.865 -2.684 -7.378
132 HB2 CYS 20 2HB CYS 20 14.365 -1.288 -6.415
133 HB3 CYS 20 3HB CYS 20 13.055 -0.600 -7.368
134 H THR 21 H THR 21 12.500 -2.403 -9.520
135 HA THR 21 HA THR 21 14.622 -4.188 -10.380
136 HB THR 21 HB THR 21 13.777 -3.508 -12.704
137 HG1 THR 21 HG1 THR 21 11.743 -2.514 -12.729
138 HG21 THR 21 3HG2 THR 21 12.804 -5.349 -10.795
139 HG22 THR 21 1HG2 THR 21 12.689 -5.445 -12.552
140 HG23 THR 21 2HG2 THR 21 11.401 -4.677 -11.623
141 H GLN 22 H GLN 22 13.733 -0.775 -10.873
142 HA GLN 22 HA GLN 22 16.550 -0.078 -11.021
143 HB2 GLN 22 2HB GLN 22 14.621 0.508 -13.273
144 HB3 GLN 22 3HB GLN 22 16.226 1.212 -13.124
145 HG2 GLN 22 2HG GLN 22 16.675 -0.500 -14.549
146 HG3 GLN 22 3HG GLN 22 16.960 -1.308 -13.009
147 HE21 GLN 22 1HE2 GLN 22 16.592 -3.250 -14.279
148 HE22 GLN 22 2HE2 GLN 22 14.972 -3.794 -14.532
149 HA PRO 23 HA PRO 23 13.782 2.961 -8.819
150 HB2 PRO 23 2HB PRO 23 15.236 3.008 -6.527
151 HB3 PRO 23 3HB PRO 23 13.947 1.835 -6.823
152 HG2 PRO 23 2HG PRO 23 16.910 1.506 -7.104
153 HG3 PRO 23 3HG PRO 23 15.721 0.391 -6.405
154 HD2 PRO 23 2HD PRO 23 16.704 0.090 -8.910
155 HD3 PRO 23 3HD PRO 23 15.053 -0.390 -8.468
156 H VAL 24 H VAL 24 16.987 2.743 -9.887
157 HA VAL 24 HA VAL 24 17.805 5.372 -8.991
158 HB VAL 24 HB VAL 24 19.499 3.636 -9.159
159 HG11 VAL 24 1HG1 VAL 24 18.170 2.945 -11.515
160 HG12 VAL 24 2HG1 VAL 24 19.761 3.510 -12.026
161 HG13 VAL 24 3HG1 VAL 24 19.625 2.200 -10.853
162 HG21 VAL 24 3HG2 VAL 24 19.914 6.128 -9.754
163 HG22 VAL 24 1HG2 VAL 24 21.171 4.939 -10.089
164 HG23 VAL 24 2HG2 VAL 24 20.138 5.521 -11.394
165 H ILE 25 H ILE 25 16.507 3.873 -11.868
166 HA ILE 25 HA ILE 25 16.522 6.509 -13.191
167 HB ILE 25 HB ILE 25 16.620 5.427 -15.339
168 HG12 ILE 25 2HG1 ILE 25 15.938 3.060 -13.759
169 HG13 ILE 25 3HG1 ILE 25 15.657 3.393 -15.464
170 HG21 ILE 25 1HG2 ILE 25 18.729 5.855 -14.066
171 HG22 ILE 25 2HG2 ILE 25 18.716 4.158 -13.590
172 HG23 ILE 25 3HG2 ILE 25 18.856 4.595 -15.293
173 HD11 ILE 25 3HD1 ILE 25 18.049 2.817 -15.882
174 HD12 ILE 25 1HD1 ILE 25 18.150 2.292 -14.201
175 HD13 ILE 25 2HD1 ILE 25 17.049 1.480 -15.315
176 H GLY 26 H GLY 26 14.534 5.005 -11.413
177 HA2 GLY 26 2HA GLY 26 12.218 5.269 -11.293
178 HA3 GLY 26 3HA GLY 26 12.205 5.716 -12.992
179 H GLY 27 H GLY 27 12.026 3.107 -10.703
180 HA2 GLY 27 2HA GLY 27 11.086 1.362 -12.883
181 HA3 GLY 27 3HA GLY 27 12.263 0.761 -11.724
182 H ILE 28 H ILE 28 10.671 -0.905 -11.283
183 HA ILE 28 HA ILE 28 8.776 -0.011 -9.232
184 HB ILE 28 HB ILE 28 7.136 -1.733 -10.073
185 HG12 ILE 28 2HG1 ILE 28 8.058 -1.559 -12.824
186 HG13 ILE 28 3HG1 ILE 28 9.231 -2.378 -11.799
187 HG21 ILE 28 1HG2 ILE 28 6.139 0.151 -10.703
188 HG22 ILE 28 2HG2 ILE 28 7.688 0.917 -11.051
189 HG23 ILE 28 3HG2 ILE 28 6.885 -0.051 -12.287
190 HD11 ILE 28 3HD1 ILE 28 6.670 -3.395 -11.161
191 HD12 ILE 28 1HD1 ILE 28 6.836 -3.392 -12.917
192 HD13 ILE 28 2HD1 ILE 28 8.029 -4.224 -11.919
193 H CYS 29 H CYS 29 7.804 -2.092 -8.143
194 HA CYS 29 HA CYS 29 10.097 -3.805 -7.483
195 HB2 CYS 29 2HB CYS 29 7.711 -2.857 -5.942
196 HB3 CYS 29 3HB CYS 29 8.496 -4.362 -5.473
197 H ALA 30 H ALA 30 9.721 -6.073 -7.075
198 HA ALA 30 HA ALA 30 7.378 -7.157 -8.494
199 HB1 ALA 30 1HB ALA 30 8.826 -7.800 -10.079
200 HB2 ALA 30 2HB ALA 30 10.227 -7.581 -9.029
201 HB3 ALA 30 3HB ALA 30 9.273 -9.061 -8.930
Start of MODEL 2
1 H1 CYS 1 H CYS 1 6.789 2.563 3.859
2 HA CYS 1 HA CYS 1 8.023 1.514 2.209
3 HB2 CYS 1 2HB CYS 1 7.518 -1.059 1.922
4 HB3 CYS 1 3HB CYS 1 8.555 -0.486 3.224
5 H ALA 2 H ALA 2 7.486 0.249 0.113
6 HA ALA 2 HA ALA 2 4.763 1.020 -0.706
7 HB1 ALA 2 1HB ALA 2 7.209 0.743 -2.447
8 HB2 ALA 2 2HB ALA 2 5.620 1.330 -2.943
9 HB3 ALA 2 3HB ALA 2 6.589 2.265 -1.804
10 H GLN 3 H GLN 3 3.685 -0.323 -2.273
11 HA GLN 3 HA GLN 3 4.206 -3.144 -1.799
12 HB2 GLN 3 2HB GLN 3 1.893 -1.515 -2.543
13 HB3 GLN 3 3HB GLN 3 2.005 -3.017 -3.450
14 HG2 GLN 3 2HG GLN 3 1.024 -4.015 -1.738
15 HG3 GLN 3 3HG GLN 3 2.511 -3.757 -0.826
16 HE21 GLN 3 1HE2 GLN 3 2.681 -1.736 0.377
17 HE22 GLN 3 2HE2 GLN 3 1.250 -1.049 1.059
18 H LYS 4 H LYS 4 4.474 -4.684 -3.441
19 HA LYS 4 HA LYS 4 6.205 -4.049 -5.501
20 HB2 LYS 4 2HB LYS 4 5.349 -6.287 -6.500
21 HB3 LYS 4 3HB LYS 4 6.164 -6.305 -4.942
22 HG2 LYS 4 2HG LYS 4 4.248 -7.732 -4.832
23 HG3 LYS 4 3HG LYS 4 3.949 -6.307 -3.834
24 HD2 LYS 4 2HD LYS 4 3.069 -5.954 -6.585
25 HD3 LYS 4 3HD LYS 4 2.277 -7.316 -5.789
26 HE2 LYS 4 2HE LYS 4 2.379 -4.456 -4.837
27 HE3 LYS 4 3HE LYS 4 0.968 -5.326 -5.438
28 HZ1 LYS 4 3HZ LYS 4 2.157 -5.350 -2.819
29 HZ2 LYS 4 1HZ LYS 4 1.826 -6.897 -3.417
30 HZ3 LYS 4 2HZ LYS 4 0.585 -5.754 -3.297
31 H GLY 5 H GLY 5 5.615 -4.754 -7.899
32 HA2 GLY 5 2HA GLY 5 4.651 -4.011 -9.847
33 HA3 GLY 5 3HA GLY 5 3.131 -4.316 -9.021
34 H GLU 6 H GLU 6 5.304 -1.986 -7.682
35 HA GLU 6 HA GLU 6 3.723 0.203 -8.846
36 HB2 GLU 6 2HB GLU 6 4.537 0.041 -5.941
37 HB3 GLU 6 3HB GLU 6 3.583 1.309 -6.697
38 HG2 GLU 6 2HG GLU 6 2.413 -1.306 -7.100
39 HG3 GLU 6 3HG GLU 6 2.626 -0.929 -5.391
40 H TYR 7 H TYR 7 4.776 2.328 -8.652
41 HA TYR 7 HA TYR 7 7.367 2.324 -9.646
42 HB2 TYR 7 2HB TYR 7 5.474 4.205 -9.462
43 HB3 TYR 7 3HB TYR 7 6.484 4.717 -8.114
44 HD1 TYR 7 HD2 TYR 7 8.821 5.418 -8.516
45 HD2 TYR 7 HD1 TYR 7 6.187 4.494 -11.727
46 HE1 TYR 7 HE2 TYR 7 10.334 6.565 -10.080
47 HE2 TYR 7 HE1 TYR 7 7.693 5.638 -13.300
48 HH TYR 7 HH TYR 7 9.432 7.300 -13.306
49 H CYS 8 H CYS 8 9.382 2.826 -8.766
50 HA CYS 8 HA CYS 8 9.635 3.038 -5.874
51 HB2 CYS 8 2HB CYS 8 9.669 0.633 -6.215
52 HB3 CYS 8 3HB CYS 8 10.891 0.798 -7.472
53 H SER 9 H SER 9 11.533 4.007 -5.198
54 HA SER 9 HA SER 9 13.740 4.466 -6.954
55 HB2 SER 9 2HB SER 9 13.528 6.827 -7.286
56 HB3 SER 9 3HB SER 9 12.000 6.103 -7.789
57 HG SER 9 HG SER 9 11.939 8.034 -6.354
58 H VAL 10 H VAL 10 15.190 6.292 -5.906
59 HA VAL 10 HA VAL 10 16.095 5.393 -3.471
60 HB VAL 10 HB VAL 10 17.296 7.523 -3.236
61 HG11 VAL 10 1HG1 VAL 10 17.233 6.040 -5.810
62 HG12 VAL 10 2HG1 VAL 10 18.207 7.509 -5.720
63 HG13 VAL 10 3HG1 VAL 10 18.520 6.173 -4.611
64 HG21 VAL 10 3HG2 VAL 10 16.014 9.291 -3.860
65 HG22 VAL 10 1HG2 VAL 10 16.873 9.054 -5.382
66 HG23 VAL 10 2HG2 VAL 10 15.244 8.409 -5.179
67 H TYR 11 H TYR 11 13.542 7.684 -4.132
68 HA TYR 11 HA TYR 11 13.299 8.422 -1.328
69 HB2 TYR 11 2HB TYR 11 11.471 9.224 -3.592
70 HB3 TYR 11 3HB TYR 11 11.674 10.021 -2.037
71 HD1 TYR 11 HD1 TYR 11 14.191 10.796 -1.564
72 HD2 TYR 11 HD2 TYR 11 12.497 10.184 -5.418
73 HE1 TYR 11 HE1 TYR 11 15.894 12.279 -2.541
74 HE2 TYR 11 HE2 TYR 11 14.196 11.663 -6.407
75 HH TYR 11 HH TYR 11 16.220 12.667 -6.009
76 H LEU 12 H LEU 12 11.613 6.521 -3.761
77 HA LEU 12 HA LEU 12 9.470 5.859 -1.910
78 HB2 LEU 12 2HB LEU 12 9.962 5.579 -4.797
79 HB3 LEU 12 3HB LEU 12 9.055 4.261 -4.059
80 HG LEU 12 HG LEU 12 7.992 6.822 -3.253
81 HD11 LEU 12 1HD1 LEU 12 7.856 6.279 -6.207
82 HD12 LEU 12 2HD1 LEU 12 8.986 7.428 -5.493
83 HD13 LEU 12 3HD1 LEU 12 7.249 7.680 -5.325
84 HD21 LEU 12 3HD2 LEU 12 6.552 4.899 -5.005
85 HD22 LEU 12 1HD2 LEU 12 5.990 5.771 -3.580
86 HD23 LEU 12 2HD2 LEU 12 7.041 4.366 -3.395
87 H GLN 13 H GLN 13 10.263 4.561 -0.323
88 HA GLN 13 HA GLN 13 12.072 2.405 -0.848
89 HB2 GLN 13 2HB GLN 13 11.526 3.824 1.366
90 HB3 GLN 13 3HB GLN 13 10.495 2.430 1.665
91 HG2 GLN 13 2HG GLN 13 12.876 1.296 0.882
92 HG3 GLN 13 3HG GLN 13 13.380 2.690 1.836
93 HE21 GLN 13 1HE2 GLN 13 12.267 -0.484 1.911
94 HE22 GLN 13 2HE2 GLN 13 11.966 -0.607 3.608
95 H CYS 14 H CYS 14 11.641 0.156 -0.523
96 HA CYS 14 HA CYS 14 8.822 -0.585 -0.960
97 HB2 CYS 14 2HB CYS 14 10.683 -0.813 -2.879
98 HB3 CYS 14 3HB CYS 14 10.954 -2.342 -2.052
99 H CYS 15 H CYS 15 8.103 -2.516 -0.031
100 HA CYS 15 HA CYS 15 9.745 -3.427 2.220
101 HB2 CYS 15 2HB CYS 15 6.935 -2.916 1.851
102 HB3 CYS 15 3HB CYS 15 7.175 -4.581 2.370
103 H ASP 16 H ASP 16 10.897 -5.203 1.893
104 HA ASP 16 HA ASP 16 10.778 -6.936 -0.227
105 HB2 ASP 16 2HB ASP 16 11.753 -8.631 1.563
106 HB3 ASP 16 3HB ASP 16 12.689 -7.245 1.012
107 HA PRO 17 HA PRO 17 11.429 -9.350 -0.178
108 HB2 PRO 17 2HB PRO 17 10.406 -10.982 -2.092
109 HB3 PRO 17 3HB PRO 17 10.707 -11.516 -0.435
110 HG2 PRO 17 2HG PRO 17 8.140 -10.648 -1.709
111 HG3 PRO 17 3HG PRO 17 8.442 -12.012 -0.615
112 HD2 PRO 17 2HD PRO 17 7.364 -9.676 0.230
113 HD3 PRO 17 3HD PRO 17 8.407 -10.676 1.263
114 H TYR 18 H TYR 18 8.661 -7.743 -1.336
115 HA TYR 18 HA TYR 18 9.035 -7.369 -4.015
116 HB2 TYR 18 2HB TYR 18 8.355 -5.103 -2.140
117 HB3 TYR 18 3HB TYR 18 7.852 -5.301 -3.815
118 HD1 TYR 18 HD1 TYR 18 7.170 -8.300 -3.533
119 HD2 TYR 18 HD2 TYR 18 6.153 -4.872 -1.228
120 HE1 TYR 18 HE1 TYR 18 5.111 -9.420 -2.786
121 HE2 TYR 18 HE2 TYR 18 4.093 -5.983 -0.472
122 HH TYR 18 HH TYR 18 2.824 -8.687 -1.928
123 H HIS 19 H HIS 19 10.984 -7.128 -4.932
124 HA HIS 19 HA HIS 19 12.796 -5.074 -3.859
125 HB2 HIS 19 2HB HIS 19 14.560 -6.216 -5.167
126 HB3 HIS 19 3HB HIS 19 13.797 -7.287 -3.996
127 HD1 HIS 19 HD1 HIS 19 12.615 -9.342 -4.885
128 HD2 HIS 19 HD2 HIS 19 13.885 -6.766 -7.888
129 HE1 HIS 19 HE1 HIS 19 12.298 -10.607 -7.036
130 H CYS 20 H CYS 20 13.430 -3.365 -5.074
131 HA CYS 20 HA CYS 20 11.860 -2.692 -7.365
132 HB2 CYS 20 2HB CYS 20 14.332 -1.255 -6.395
133 HB3 CYS 20 3HB CYS 20 12.993 -0.590 -7.326
134 H THR 21 H THR 21 12.528 -2.395 -9.496
135 HA THR 21 HA THR 21 14.678 -4.160 -10.326
136 HB THR 21 HB THR 21 13.861 -3.448 -12.664
137 HG1 THR 21 HG1 THR 21 12.532 -1.786 -12.475
138 HG21 THR 21 3HG2 THR 21 12.846 -5.426 -12.562
139 HG22 THR 21 1HG2 THR 21 11.513 -4.720 -11.649
140 HG23 THR 21 2HG2 THR 21 12.921 -5.358 -10.801
141 H GLN 22 H GLN 22 13.738 -0.788 -11.026
142 HA GLN 22 HA GLN 22 16.567 -0.059 -11.078
143 HB2 GLN 22 2HB GLN 22 14.631 0.536 -13.321
144 HB3 GLN 22 3HB GLN 22 16.237 1.235 -13.173
145 HG2 GLN 22 2HG GLN 22 15.577 -1.677 -13.547
146 HG3 GLN 22 3HG GLN 22 16.261 -0.586 -14.751
147 HE21 GLN 22 1HE2 GLN 22 18.121 0.746 -13.200
148 HE22 GLN 22 2HE2 GLN 22 19.357 -0.362 -12.723
149 HA PRO 23 HA PRO 23 13.802 2.956 -8.844
150 HB2 PRO 23 2HB PRO 23 15.285 3.014 -6.572
151 HB3 PRO 23 3HB PRO 23 14.005 1.828 -6.852
152 HG2 PRO 23 2HG PRO 23 16.967 1.531 -7.173
153 HG3 PRO 23 3HG PRO 23 15.800 0.402 -6.459
154 HD2 PRO 23 2HD PRO 23 16.752 0.113 -8.978
155 HD3 PRO 23 3HD PRO 23 15.112 -0.383 -8.515
156 H VAL 24 H VAL 24 16.993 2.772 -9.958
157 HA VAL 24 HA VAL 24 17.797 5.408 -9.067
158 HB VAL 24 HB VAL 24 19.506 3.687 -9.266
159 HG11 VAL 24 1HG1 VAL 24 19.726 3.579 -12.137
160 HG12 VAL 24 2HG1 VAL 24 19.625 2.261 -10.967
161 HG13 VAL 24 3HG1 VAL 24 18.150 2.991 -11.604
162 HG21 VAL 24 3HG2 VAL 24 20.093 5.589 -11.500
163 HG22 VAL 24 1HG2 VAL 24 19.888 6.185 -9.853
164 HG23 VAL 24 2HG2 VAL 24 21.154 5.012 -10.214
165 H ILE 25 H ILE 25 16.471 3.903 -11.928
166 HA ILE 25 HA ILE 25 16.439 6.541 -13.244
167 HB ILE 25 HB ILE 25 16.514 5.463 -15.397
168 HG12 ILE 25 2HG1 ILE 25 15.897 3.083 -13.806
169 HG13 ILE 25 3HG1 ILE 25 15.575 3.417 -15.505
170 HG21 ILE 25 1HG2 ILE 25 18.762 4.666 -15.389
171 HG22 ILE 25 2HG2 ILE 25 18.636 5.920 -14.157
172 HG23 ILE 25 3HG2 ILE 25 18.658 4.221 -13.685
173 HD11 ILE 25 3HD1 ILE 25 18.110 2.352 -14.295
174 HD12 ILE 25 1HD1 ILE 25 16.999 1.522 -15.384
175 HD13 ILE 25 2HD1 ILE 25 17.965 2.875 -15.973
176 H GLY 26 H GLY 26 14.492 5.030 -11.439
177 HA2 GLY 26 2HA GLY 26 12.177 5.259 -11.285
178 HA3 GLY 26 3HA GLY 26 12.134 5.716 -12.981
179 H GLY 27 H GLY 27 12.042 3.085 -10.706
180 HA2 GLY 27 2HA GLY 27 11.105 1.336 -12.887
181 HA3 GLY 27 3HA GLY 27 12.273 0.747 -11.713
182 H ILE 28 H ILE 28 10.700 -0.927 -11.267
183 HA ILE 28 HA ILE 28 8.767 -0.038 -9.250
184 HB ILE 28 HB ILE 28 7.137 -1.745 -10.091
185 HG12 ILE 28 2HG1 ILE 28 8.004 -1.735 -12.828
186 HG13 ILE 28 3HG1 ILE 28 9.292 -2.380 -11.816
187 HG21 ILE 28 1HG2 ILE 28 6.261 -0.322 -11.888
188 HG22 ILE 28 2HG2 ILE 28 6.807 0.625 -10.504
189 HG23 ILE 28 3HG2 ILE 28 7.804 0.529 -11.955
190 HD11 ILE 28 3HD1 ILE 28 6.460 -3.365 -11.679
191 HD12 ILE 28 1HD1 ILE 28 7.675 -4.056 -12.754
192 HD13 ILE 28 2HD1 ILE 28 7.909 -4.112 -11.006
193 H CYS 29 H CYS 29 7.818 -2.092 -8.128
194 HA CYS 29 HA CYS 29 10.113 -3.792 -7.443
195 HB2 CYS 29 2HB CYS 29 7.718 -2.829 -5.929
196 HB3 CYS 29 3HB CYS 29 8.488 -4.337 -5.443
197 H ALA 30 H ALA 30 9.758 -6.057 -7.031
198 HA ALA 30 HA ALA 30 7.353 -7.201 -8.253
199 HB1 ALA 30 1HB ALA 30 9.532 -8.843 -9.015
200 HB2 ALA 30 2HB ALA 30 8.428 -7.935 -10.048
201 HB3 ALA 30 3HB ALA 30 9.918 -7.184 -9.476
Start of MODEL 3
1 H1 CYS 1 H CYS 1 6.858 2.166 3.994
2 HA CYS 1 HA CYS 1 7.768 1.173 2.139
3 HB2 CYS 1 2HB CYS 1 7.521 -1.501 2.173
4 HB3 CYS 1 3HB CYS 1 8.819 -0.652 3.006
5 H ALA 2 H ALA 2 6.925 0.743 0.141
6 HA ALA 2 HA ALA 2 4.027 0.547 0.001
7 HB1 ALA 2 1HB ALA 2 5.193 2.252 -1.322
8 HB2 ALA 2 2HB ALA 2 6.038 0.980 -2.206
9 HB3 ALA 2 3HB ALA 2 4.287 1.135 -2.342
10 H GLN 3 H GLN 3 3.173 -0.790 -1.927
11 HA GLN 3 HA GLN 3 4.157 -3.509 -1.560
12 HB2 GLN 3 2HB GLN 3 1.594 -2.267 -2.307
13 HB3 GLN 3 3HB GLN 3 1.974 -3.747 -3.178
14 HG2 GLN 3 2HG GLN 3 2.290 -4.907 -1.038
15 HG3 GLN 3 3HG GLN 3 1.849 -3.427 -0.189
16 HE21 GLN 3 1HE2 GLN 3 0.442 -5.647 0.340
17 HE22 GLN 3 2HE2 GLN 3 -1.140 -5.551 -0.348
18 H LYS 4 H LYS 4 4.405 -4.950 -3.392
19 HA LYS 4 HA LYS 4 6.161 -4.046 -5.318
20 HB2 LYS 4 2HB LYS 4 5.374 -6.167 -6.599
21 HB3 LYS 4 3HB LYS 4 6.158 -6.352 -5.035
22 HG2 LYS 4 2HG LYS 4 4.279 -7.819 -5.117
23 HG3 LYS 4 3HG LYS 4 3.909 -6.510 -3.991
24 HD2 LYS 4 2HD LYS 4 3.101 -5.899 -6.717
25 HD3 LYS 4 3HD LYS 4 2.327 -7.357 -6.095
26 HE2 LYS 4 2HE LYS 4 2.287 -4.595 -4.895
27 HE3 LYS 4 3HE LYS 4 0.926 -5.500 -5.556
28 HZ1 LYS 4 3HZ LYS 4 1.827 -7.173 -3.667
29 HZ2 LYS 4 1HZ LYS 4 0.586 -6.048 -3.428
30 HZ3 LYS 4 2HZ LYS 4 2.165 -5.678 -2.952
31 H GLY 5 H GLY 5 5.640 -4.493 -7.801
32 HA2 GLY 5 2HA GLY 5 4.660 -3.638 -9.692
33 HA3 GLY 5 3HA GLY 5 3.131 -3.886 -8.862
34 H GLU 6 H GLU 6 5.348 -1.827 -7.270
35 HA GLU 6 HA GLU 6 3.805 0.514 -8.175
36 HB2 GLU 6 2HB GLU 6 3.874 1.412 -6.038
37 HB3 GLU 6 3HB GLU 6 3.691 -0.305 -5.711
38 HG2 GLU 6 2HG GLU 6 5.350 0.198 -4.242
39 HG3 GLU 6 3HG GLU 6 6.318 -0.238 -5.650
40 H TYR 7 H TYR 7 4.920 2.527 -8.370
41 HA TYR 7 HA TYR 7 7.437 2.306 -9.639
42 HB2 TYR 7 2HB TYR 7 5.513 4.115 -9.829
43 HB3 TYR 7 3HB TYR 7 6.477 4.940 -8.608
44 HD1 TYR 7 HD2 TYR 7 6.813 3.319 -11.953
45 HD2 TYR 7 HD1 TYR 7 8.214 6.320 -9.282
46 HE1 TYR 7 HE2 TYR 7 8.288 4.193 -13.717
47 HE2 TYR 7 HE1 TYR 7 9.691 7.204 -11.039
48 HH TYR 7 HH TYR 7 9.386 6.427 -14.257
49 H CYS 8 H CYS 8 9.300 1.939 -8.649
50 HA CYS 8 HA CYS 8 9.716 3.029 -5.949
51 HB2 CYS 8 2HB CYS 8 9.936 0.604 -6.092
52 HB3 CYS 8 3HB CYS 8 11.124 0.766 -7.382
53 H SER 9 H SER 9 11.522 4.239 -5.462
54 HA SER 9 HA SER 9 13.486 4.792 -7.534
55 HB2 SER 9 2HB SER 9 13.166 7.225 -7.414
56 HB3 SER 9 3HB SER 9 11.701 6.427 -7.989
57 HG SER 9 HG SER 9 11.140 7.927 -6.425
58 H VAL 10 H VAL 10 14.956 6.719 -6.549
59 HA VAL 10 HA VAL 10 16.330 5.594 -4.394
60 HB VAL 10 HB VAL 10 17.452 7.855 -4.216
61 HG11 VAL 10 1HG1 VAL 10 17.321 6.207 -6.698
62 HG12 VAL 10 2HG1 VAL 10 18.303 7.674 -6.685
63 HG13 VAL 10 3HG1 VAL 10 18.632 6.382 -5.530
64 HG21 VAL 10 3HG2 VAL 10 15.432 9.106 -5.042
65 HG22 VAL 10 1HG2 VAL 10 16.958 9.554 -5.804
66 HG23 VAL 10 2HG2 VAL 10 15.817 8.515 -6.658
67 H TYR 11 H TYR 11 13.539 7.585 -4.449
68 HA TYR 11 HA TYR 11 13.842 8.270 -1.612
69 HB2 TYR 11 2HB TYR 11 11.781 9.254 -3.594
70 HB3 TYR 11 3HB TYR 11 12.024 9.852 -1.957
71 HD1 TYR 11 HD2 TYR 11 14.473 10.728 -1.463
72 HD2 TYR 11 HD1 TYR 11 12.753 10.411 -5.342
73 HE1 TYR 11 HE2 TYR 11 16.078 12.391 -2.304
74 HE2 TYR 11 HE1 TYR 11 14.353 12.073 -6.194
75 HH TYR 11 HH TYR 11 16.221 14.023 -4.189
76 H LEU 12 H LEU 12 11.445 6.911 -3.865
77 HA LEU 12 HA LEU 12 9.895 5.861 -1.638
78 HB2 LEU 12 2HB LEU 12 9.479 5.899 -4.615
79 HB3 LEU 12 3HB LEU 12 8.422 5.005 -3.523
80 HG LEU 12 HG LEU 12 8.762 7.805 -2.763
81 HD11 LEU 12 1HD1 LEU 12 8.895 8.284 -5.073
82 HD12 LEU 12 2HD1 LEU 12 7.221 8.579 -4.605
83 HD13 LEU 12 3HD1 LEU 12 7.646 7.101 -5.466
84 HD21 LEU 12 3HD2 LEU 12 7.048 5.910 -2.095
85 HD22 LEU 12 1HD2 LEU 12 6.168 6.544 -3.487
86 HD23 LEU 12 2HD2 LEU 12 6.574 7.609 -2.140
87 H GLN 13 H GLN 13 9.964 3.820 -0.938
88 HA GLN 13 HA GLN 13 11.167 1.764 -2.652
89 HB2 GLN 13 2HB GLN 13 12.244 2.812 -0.156
90 HB3 GLN 13 3HB GLN 13 11.995 1.073 -0.095
91 HG2 GLN 13 2HG GLN 13 13.196 1.602 -2.574
92 HG3 GLN 13 3HG GLN 13 14.067 2.566 -1.383
93 HE21 GLN 13 1HE2 GLN 13 12.735 -0.698 -1.779
94 HE22 GLN 13 2HE2 GLN 13 14.067 -1.517 -1.045
95 H CYS 14 H CYS 14 10.727 -0.456 -1.857
96 HA CYS 14 HA CYS 14 8.105 -0.567 -0.514
97 HB2 CYS 14 2HB CYS 14 7.708 -2.650 -1.800
98 HB3 CYS 14 3HB CYS 14 7.933 -1.245 -2.839
99 H CYS 15 H CYS 15 7.741 -2.978 0.282
100 HA CYS 15 HA CYS 15 10.063 -3.614 1.974
101 HB2 CYS 15 2HB CYS 15 7.205 -3.406 2.490
102 HB3 CYS 15 3HB CYS 15 7.863 -4.946 3.034
103 H ASP 16 H ASP 16 10.860 -5.667 2.083
104 HA ASP 16 HA ASP 16 10.726 -7.342 -0.098
105 HB2 ASP 16 2HB ASP 16 11.220 -8.418 2.669
106 HB3 ASP 16 3HB ASP 16 11.962 -8.911 1.149
107 HA PRO 17 HA PRO 17 11.112 -9.754 -0.201
108 HB2 PRO 17 2HB PRO 17 9.984 -11.156 -2.234
109 HB3 PRO 17 3HB PRO 17 10.196 -11.821 -0.611
110 HG2 PRO 17 2HG PRO 17 7.752 -10.634 -1.866
111 HG3 PRO 17 3HG PRO 17 7.899 -12.087 -0.860
112 HD2 PRO 17 2HD PRO 17 7.027 -9.718 0.119
113 HD3 PRO 17 3HD PRO 17 7.947 -10.876 1.101
114 H TYR 18 H TYR 18 8.537 -7.818 -1.294
115 HA TYR 18 HA TYR 18 9.039 -7.318 -3.942
116 HB2 TYR 18 2HB TYR 18 8.447 -5.106 -1.980
117 HB3 TYR 18 3HB TYR 18 7.952 -5.224 -3.665
118 HD1 TYR 18 HD2 TYR 18 7.056 -8.153 -3.531
119 HD2 TYR 18 HD1 TYR 18 6.287 -4.802 -1.026
120 HE1 TYR 18 HE2 TYR 18 4.927 -9.169 -2.837
121 HE2 TYR 18 HE1 TYR 18 4.156 -5.808 -0.324
122 HH TYR 18 HH TYR 18 2.594 -7.423 -0.929
123 H HIS 19 H HIS 19 10.819 -6.771 -4.992
124 HA HIS 19 HA HIS 19 12.767 -5.013 -3.650
125 HB2 HIS 19 2HB HIS 19 14.543 -6.182 -4.921
126 HB3 HIS 19 3HB HIS 19 13.689 -7.256 -3.817
127 HD1 HIS 19 HD1 HIS 19 12.460 -9.231 -4.821
128 HD2 HIS 19 HD2 HIS 19 13.973 -6.626 -7.682
129 HE1 HIS 19 HE1 HIS 19 12.190 -10.418 -7.022
130 H CYS 20 H CYS 20 13.529 -3.294 -4.774
131 HA CYS 20 HA CYS 20 12.091 -2.461 -7.093
132 HB2 CYS 20 2HB CYS 20 14.584 -1.233 -5.900
133 HB3 CYS 20 3HB CYS 20 13.439 -0.449 -6.983
134 H THR 21 H THR 21 12.779 -2.244 -9.200
135 HA THR 21 HA THR 21 14.931 -4.028 -9.990
136 HB THR 21 HB THR 21 14.143 -3.401 -12.337
137 HG1 THR 21 HG1 THR 21 11.806 -2.623 -12.092
138 HG21 THR 21 3HG2 THR 21 13.100 -5.190 -10.419
139 HG22 THR 21 1HG2 THR 21 13.023 -5.319 -12.175
140 HG23 THR 21 2HG2 THR 21 11.723 -4.519 -11.292
141 H GLN 22 H GLN 22 13.986 -0.697 -10.870
142 HA GLN 22 HA GLN 22 16.799 0.082 -10.794
143 HB2 GLN 22 2HB GLN 22 15.009 0.510 -13.192
144 HB3 GLN 22 3HB GLN 22 16.605 1.220 -12.985
145 HG2 GLN 22 2HG GLN 22 17.674 -0.860 -13.166
146 HG3 GLN 22 3HG GLN 22 16.166 -1.745 -12.940
147 HE21 GLN 22 1HE2 GLN 22 18.115 -1.945 -15.085
148 HE22 GLN 22 2HE2 GLN 22 17.262 -1.603 -16.548
149 HA PRO 23 HA PRO 23 13.910 3.184 -8.901
150 HB2 PRO 23 2HB PRO 23 15.376 3.518 -6.640
151 HB3 PRO 23 3HB PRO 23 14.155 2.251 -6.817
152 HG2 PRO 23 2HG PRO 23 17.129 2.069 -7.104
153 HG3 PRO 23 3HG PRO 23 16.014 0.954 -6.294
154 HD2 PRO 23 2HD PRO 23 16.993 0.487 -8.775
155 HD3 PRO 23 3HD PRO 23 15.376 -0.044 -8.272
156 H VAL 24 H VAL 24 17.120 3.055 -9.977
157 HA VAL 24 HA VAL 24 17.811 5.781 -9.315
158 HB VAL 24 HB VAL 24 19.594 4.141 -9.416
159 HG11 VAL 24 1HG1 VAL 24 18.224 3.115 -11.582
160 HG12 VAL 24 2HG1 VAL 24 19.680 3.807 -12.302
161 HG13 VAL 24 3HG1 VAL 24 19.815 2.604 -11.018
162 HG21 VAL 24 3HG2 VAL 24 21.150 5.474 -10.460
163 HG22 VAL 24 1HG2 VAL 24 20.098 5.808 -11.836
164 HG23 VAL 24 2HG2 VAL 24 19.808 6.605 -10.290
165 H ILE 25 H ILE 25 16.580 4.006 -12.076
166 HA ILE 25 HA ILE 25 16.412 6.541 -13.572
167 HB ILE 25 HB ILE 25 16.391 5.230 -15.637
168 HG12 ILE 25 2HG1 ILE 25 16.148 3.013 -13.733
169 HG13 ILE 25 3HG1 ILE 25 15.656 3.107 -15.420
170 HG21 ILE 25 1HG2 ILE 25 18.707 4.677 -15.698
171 HG22 ILE 25 2HG2 ILE 25 18.521 6.044 -14.600
172 HG23 ILE 25 3HG2 ILE 25 18.751 4.420 -13.953
173 HD11 ILE 25 3HD1 ILE 25 18.056 2.766 -16.037
174 HD12 ILE 25 1HD1 ILE 25 18.374 2.436 -14.334
175 HD13 ILE 25 2HD1 ILE 25 17.280 1.395 -15.246
176 H GLY 26 H GLY 26 14.533 5.189 -11.606
177 HA2 GLY 26 2HA GLY 26 12.223 5.335 -11.412
178 HA3 GLY 26 3HA GLY 26 12.131 5.700 -13.129
179 H GLY 27 H GLY 27 12.319 3.141 -10.739
180 HA2 GLY 27 2HA GLY 27 11.386 1.258 -12.817
181 HA3 GLY 27 3HA GLY 27 12.497 0.780 -11.542
182 H ILE 28 H ILE 28 10.951 -0.882 -11.019
183 HA ILE 28 HA ILE 28 8.948 0.097 -9.135
184 HB ILE 28 HB ILE 28 7.313 -1.628 -9.996
185 HG12 ILE 28 2HG1 ILE 28 8.269 -1.517 -12.722
186 HG13 ILE 28 3HG1 ILE 28 9.470 -2.269 -11.678
187 HG21 ILE 28 1HG2 ILE 28 8.048 0.837 -11.535
188 HG22 ILE 28 2HG2 ILE 28 6.654 -0.142 -11.985
189 HG23 ILE 28 3HG2 ILE 28 6.733 0.597 -10.386
190 HD11 ILE 28 3HD1 ILE 28 6.917 -3.280 -12.625
191 HD12 ILE 28 1HD1 ILE 28 8.324 -4.145 -12.009
192 HD13 ILE 28 2HD1 ILE 28 7.140 -3.474 -10.886
193 H CYS 29 H CYS 29 7.912 -1.908 -8.000
194 HA CYS 29 HA CYS 29 10.141 -3.641 -7.205
195 HB2 CYS 29 2HB CYS 29 7.611 -2.784 -5.814
196 HB3 CYS 29 3HB CYS 29 8.575 -4.135 -5.228
197 H ALA 30 H ALA 30 9.840 -5.889 -6.930
198 HA ALA 30 HA ALA 30 7.585 -6.990 -8.478
199 HB1 ALA 30 1HB ALA 30 9.392 -7.533 -9.790
200 HB2 ALA 30 2HB ALA 30 10.475 -7.721 -8.411
201 HB3 ALA 30 3HB ALA 30 9.274 -8.963 -8.766
Start of MODEL 4
1 H1 CYS 1 H CYS 1 6.589 2.687 3.514
2 HA CYS 1 HA CYS 1 8.277 1.563 2.058
3 HB2 CYS 1 2HB CYS 1 7.629 -0.974 1.815
4 HB3 CYS 1 3HB CYS 1 8.705 -0.451 3.106
5 H ALA 2 H ALA 2 7.551 0.160 0.041
6 HA ALA 2 HA ALA 2 4.861 1.097 -0.722
7 HB1 ALA 2 1HB ALA 2 6.731 2.287 -1.851
8 HB2 ALA 2 2HB ALA 2 7.214 0.752 -2.572
9 HB3 ALA 2 3HB ALA 2 5.642 1.451 -2.959
10 H GLN 3 H GLN 3 3.756 -0.198 -2.350
11 HA GLN 3 HA GLN 3 4.169 -3.034 -1.860
12 HB2 GLN 3 2HB GLN 3 1.931 -1.336 -2.792
13 HB3 GLN 3 3HB GLN 3 1.997 -2.960 -3.464
14 HG2 GLN 3 2HG GLN 3 2.059 -3.871 -1.173
15 HG3 GLN 3 3HG GLN 3 1.891 -2.231 -0.546
16 HE21 GLN 3 1HE2 GLN 3 -0.029 -3.002 0.495
17 HE22 GLN 3 2HE2 GLN 3 -1.508 -3.116 -0.390
18 H LYS 4 H LYS 4 4.363 -4.593 -3.509
19 HA LYS 4 HA LYS 4 6.162 -4.029 -5.538
20 HB2 LYS 4 2HB LYS 4 5.966 -6.240 -6.160
21 HB3 LYS 4 3HB LYS 4 5.332 -6.301 -4.521
22 HG2 LYS 4 2HG LYS 4 3.402 -5.819 -6.718
23 HG3 LYS 4 3HG LYS 4 4.091 -7.437 -6.565
24 HD2 LYS 4 2HD LYS 4 2.274 -7.660 -5.195
25 HD3 LYS 4 3HD LYS 4 3.459 -7.080 -4.023
26 HE2 LYS 4 2HE LYS 4 2.435 -4.752 -5.055
27 HE3 LYS 4 3HE LYS 4 1.027 -5.811 -5.025
28 HZ1 LYS 4 3HZ LYS 4 2.669 -4.847 -2.784
29 HZ2 LYS 4 1HZ LYS 4 1.842 -6.315 -2.635
30 HZ3 LYS 4 2HZ LYS 4 0.985 -4.889 -2.937
31 H GLY 5 H GLY 5 5.616 -4.660 -7.945
32 HA2 GLY 5 2HA GLY 5 4.709 -3.879 -9.905
33 HA3 GLY 5 3HA GLY 5 3.164 -4.159 -9.117
34 H GLU 6 H GLU 6 5.356 -1.895 -7.700
35 HA GLU 6 HA GLU 6 3.842 0.341 -8.867
36 HB2 GLU 6 2HB GLU 6 4.627 0.138 -5.957
37 HB3 GLU 6 3HB GLU 6 3.699 1.427 -6.710
38 HG2 GLU 6 2HG GLU 6 2.481 -1.154 -7.152
39 HG3 GLU 6 3HG GLU 6 2.704 -0.822 -5.437
40 H TYR 7 H TYR 7 4.938 2.443 -8.631
41 HA TYR 7 HA TYR 7 7.531 2.402 -9.615
42 HB2 TYR 7 2HB TYR 7 6.008 4.331 -9.820
43 HB3 TYR 7 3HB TYR 7 6.181 4.646 -8.097
44 HD1 TYR 7 HD2 TYR 7 8.295 5.518 -7.199
45 HD2 TYR 7 HD1 TYR 7 7.741 4.935 -11.378
46 HE1 TYR 7 HE2 TYR 7 10.253 6.936 -7.651
47 HE2 TYR 7 HE1 TYR 7 9.698 6.349 -11.841
48 HH TYR 7 HH TYR 7 10.898 8.395 -10.293
49 H CYS 8 H CYS 8 9.554 2.872 -8.716
50 HA CYS 8 HA CYS 8 9.786 2.943 -5.808
51 HB2 CYS 8 2HB CYS 8 9.898 0.579 -6.228
52 HB3 CYS 8 3HB CYS 8 11.031 0.815 -7.555
53 H SER 9 H SER 9 11.598 3.986 -5.070
54 HA SER 9 HA SER 9 13.860 4.550 -6.711
55 HB2 SER 9 2HB SER 9 13.577 6.914 -7.031
56 HB3 SER 9 3HB SER 9 12.130 6.122 -7.655
57 HG SER 9 HG SER 9 11.926 8.048 -6.174
58 H VAL 10 H VAL 10 15.151 6.469 -5.585
59 HA VAL 10 HA VAL 10 15.971 5.591 -3.105
60 HB VAL 10 HB VAL 10 16.918 7.929 -2.799
61 HG11 VAL 10 1HG1 VAL 10 18.440 6.447 -3.680
62 HG12 VAL 10 2HG1 VAL 10 17.469 6.137 -5.120
63 HG13 VAL 10 3HG1 VAL 10 18.358 7.653 -4.964
64 HG21 VAL 10 3HG2 VAL 10 16.267 9.618 -4.098
65 HG22 VAL 10 1HG2 VAL 10 16.519 8.668 -5.563
66 HG23 VAL 10 2HG2 VAL 10 14.985 8.568 -4.699
67 H TYR 11 H TYR 11 13.380 7.800 -3.905
68 HA TYR 11 HA TYR 11 12.950 8.504 -1.115
69 HB2 TYR 11 2HB TYR 11 11.237 9.273 -3.478
70 HB3 TYR 11 3HB TYR 11 11.321 10.060 -1.906
71 HD1 TYR 11 HD1 TYR 11 13.878 10.786 -1.300
72 HD2 TYR 11 HD2 TYR 11 12.243 10.401 -5.209
73 HE1 TYR 11 HE1 TYR 11 15.589 12.328 -2.161
74 HE2 TYR 11 HE2 TYR 11 13.950 11.941 -6.081
75 HH TYR 11 HH TYR 11 15.491 13.537 -5.439
76 H LEU 12 H LEU 12 11.462 6.585 -3.662
77 HA LEU 12 HA LEU 12 9.243 5.833 -1.939
78 HB2 LEU 12 2HB LEU 12 9.815 5.786 -4.778
79 HB3 LEU 12 3HB LEU 12 9.154 4.251 -4.220
80 HG LEU 12 HG LEU 12 7.503 6.213 -3.104
81 HD11 LEU 12 1HD1 LEU 12 7.147 7.867 -4.577
82 HD12 LEU 12 2HD1 LEU 12 7.392 6.819 -5.974
83 HD13 LEU 12 3HD1 LEU 12 8.782 7.493 -5.123
84 HD21 LEU 12 3HD2 LEU 12 7.064 3.887 -4.121
85 HD22 LEU 12 1HD2 LEU 12 6.879 4.753 -5.645
86 HD23 LEU 12 2HD2 LEU 12 5.820 5.126 -4.285
87 H GLN 13 H GLN 13 10.202 4.631 -0.308
88 HA GLN 13 HA GLN 13 12.026 2.510 -0.781
89 HB2 GLN 13 2HB GLN 13 10.811 3.781 1.483
90 HB3 GLN 13 3HB GLN 13 10.663 2.038 1.653
91 HG2 GLN 13 2HG GLN 13 13.299 2.610 0.782
92 HG3 GLN 13 3HG GLN 13 12.919 3.682 2.129
93 HE21 GLN 13 1HE2 GLN 13 13.380 0.402 1.114
94 HE22 GLN 13 2HE2 GLN 13 13.438 -0.297 2.693
95 H CYS 14 H CYS 14 11.669 0.244 -0.520
96 HA CYS 14 HA CYS 14 8.904 -0.597 -1.098
97 HB2 CYS 14 2HB CYS 14 10.687 -0.709 -2.998
98 HB3 CYS 14 3HB CYS 14 11.283 -2.114 -2.122
99 H CYS 15 H CYS 15 8.136 -2.386 -0.056
100 HA CYS 15 HA CYS 15 9.763 -3.357 2.170
101 HB2 CYS 15 2HB CYS 15 6.961 -2.816 1.777
102 HB3 CYS 15 3HB CYS 15 7.181 -4.483 2.299
103 H ASP 16 H ASP 16 10.878 -5.162 1.886
104 HA ASP 16 HA ASP 16 10.737 -6.893 -0.253
105 HB2 ASP 16 2HB ASP 16 12.013 -6.883 2.367
106 HB3 ASP 16 3HB ASP 16 11.598 -8.510 1.834
107 HA PRO 17 HA PRO 17 11.413 -9.329 -0.125
108 HB2 PRO 17 2HB PRO 17 10.397 -11.021 -1.987
109 HB3 PRO 17 3HB PRO 17 10.694 -11.502 -0.313
110 HG2 PRO 17 2HG PRO 17 8.129 -10.680 -1.620
111 HG3 PRO 17 3HG PRO 17 8.430 -12.008 -0.484
112 HD2 PRO 17 2HD PRO 17 7.347 -9.648 0.286
113 HD3 PRO 17 3HD PRO 17 8.389 -10.613 1.351
114 H TYR 18 H TYR 18 8.660 -7.739 -1.321
115 HA TYR 18 HA TYR 18 9.013 -7.455 -4.012
116 HB2 TYR 18 2HB TYR 18 8.393 -5.110 -2.214
117 HB3 TYR 18 3HB TYR 18 7.856 -5.371 -3.870
118 HD1 TYR 18 HD2 TYR 18 7.135 -8.344 -3.452
119 HD2 TYR 18 HD1 TYR 18 6.219 -4.811 -1.264
120 HE1 TYR 18 HE2 TYR 18 5.077 -9.401 -2.618
121 HE2 TYR 18 HE1 TYR 18 4.159 -5.860 -0.422
122 HH TYR 18 HH TYR 18 3.436 -9.238 -1.030
123 H HIS 19 H HIS 19 10.945 -7.261 -4.969
124 HA HIS 19 HA HIS 19 12.822 -5.237 -3.964
125 HB2 HIS 19 2HB HIS 19 14.533 -6.418 -5.280
126 HB3 HIS 19 3HB HIS 19 13.741 -7.497 -4.136
127 HD1 HIS 19 HD1 HIS 19 12.605 -9.536 -5.071
128 HD2 HIS 19 HD2 HIS 19 13.731 -6.832 -8.018
129 HE1 HIS 19 HE1 HIS 19 12.221 -10.723 -7.256
130 H CYS 20 H CYS 20 13.501 -3.562 -5.215
131 HA CYS 20 HA CYS 20 11.876 -2.861 -7.470
132 HB2 CYS 20 2HB CYS 20 14.374 -1.450 -6.528
133 HB3 CYS 20 3HB CYS 20 13.040 -0.771 -7.455
134 H THR 21 H THR 21 12.494 -2.614 -9.613
135 HA THR 21 HA THR 21 14.514 -4.448 -10.517
136 HB THR 21 HB THR 21 13.831 -3.430 -12.816
137 HG1 THR 21 HG1 THR 21 12.324 -1.951 -12.745
138 HG21 THR 21 3HG2 THR 21 12.631 -5.303 -12.962
139 HG22 THR 21 1HG2 THR 21 11.400 -4.659 -11.878
140 HG23 THR 21 2HG2 THR 21 12.809 -5.493 -11.219
141 H GLN 22 H GLN 22 13.997 -0.939 -10.895
142 HA GLN 22 HA GLN 22 16.894 -0.567 -10.935
143 HB2 GLN 22 2HB GLN 22 15.006 0.196 -13.139
144 HB3 GLN 22 3HB GLN 22 16.471 1.126 -12.861
145 HG2 GLN 22 2HG GLN 22 17.720 -0.386 -13.889
146 HG3 GLN 22 3HG GLN 22 17.039 -1.697 -12.926
147 HE21 GLN 22 1HE2 GLN 22 14.468 -1.781 -13.641
148 HE22 GLN 22 2HE2 GLN 22 14.301 -2.124 -15.327
149 HA PRO 23 HA PRO 23 14.711 2.513 -8.274
150 HB2 PRO 23 2HB PRO 23 16.526 2.381 -6.259
151 HB3 PRO 23 3HB PRO 23 15.163 1.264 -6.399
152 HG2 PRO 23 2HG PRO 23 18.025 0.873 -7.189
153 HG3 PRO 23 3HG PRO 23 16.929 -0.250 -6.364
154 HD2 PRO 23 2HD PRO 23 17.471 -0.426 -9.011
155 HD3 PRO 23 3HD PRO 23 15.900 -0.887 -8.325
156 H VAL 24 H VAL 24 15.829 3.563 -10.379
157 HA VAL 24 HA VAL 24 17.301 5.795 -9.387
158 HB VAL 24 HB VAL 24 19.078 3.982 -9.668
159 HG11 VAL 24 1HG1 VAL 24 18.949 4.637 -12.585
160 HG12 VAL 24 2HG1 VAL 24 19.759 3.294 -11.774
161 HG13 VAL 24 3HG1 VAL 24 18.001 3.303 -11.926
162 HG21 VAL 24 3HG2 VAL 24 19.369 6.537 -9.637
163 HG22 VAL 24 1HG2 VAL 24 20.695 5.556 -10.263
164 HG23 VAL 24 2HG2 VAL 24 19.612 6.388 -11.378
165 H ILE 25 H ILE 25 16.167 3.923 -12.136
166 HA ILE 25 HA ILE 25 15.906 6.398 -13.702
167 HB ILE 25 HB ILE 25 15.652 4.984 -15.671
168 HG12 ILE 25 2HG1 ILE 25 15.515 2.853 -13.612
169 HG13 ILE 25 3HG1 ILE 25 14.685 2.979 -15.160
170 HG21 ILE 25 1HG2 ILE 25 17.923 5.642 -14.661
171 HG22 ILE 25 2HG2 ILE 25 18.052 3.942 -14.210
172 HG23 ILE 25 3HG2 ILE 25 17.894 4.395 -15.907
173 HD11 ILE 25 3HD1 ILE 25 16.112 1.163 -15.409
174 HD12 ILE 25 1HD1 ILE 25 16.962 2.487 -16.207
175 HD13 ILE 25 2HD1 ILE 25 17.444 1.978 -14.588
176 H GLY 26 H GLY 26 14.117 5.069 -11.529
177 HA2 GLY 26 2HA GLY 26 11.844 5.373 -11.134
178 HA3 GLY 26 3HA GLY 26 11.634 5.793 -12.828
179 H GLY 27 H GLY 27 12.739 2.905 -11.038
180 HA2 GLY 27 2HA GLY 27 11.232 1.236 -12.904
181 HA3 GLY 27 3HA GLY 27 12.408 0.676 -11.725
182 H ILE 28 H ILE 28 10.714 -0.959 -11.327
183 HA ILE 28 HA ILE 28 8.899 -0.001 -9.233
184 HB ILE 28 HB ILE 28 7.169 -1.634 -10.056
185 HG12 ILE 28 2HG1 ILE 28 8.064 -1.509 -12.819
186 HG13 ILE 28 3HG1 ILE 28 9.205 -2.386 -11.806
187 HG21 ILE 28 1HG2 ILE 28 6.981 0.057 -12.274
188 HG22 ILE 28 2HG2 ILE 28 6.250 0.287 -10.686
189 HG23 ILE 28 3HG2 ILE 28 7.830 0.987 -11.038
190 HD11 ILE 28 3HD1 ILE 28 7.916 -4.164 -12.044
191 HD12 ILE 28 1HD1 ILE 28 6.697 -3.343 -11.070
192 HD13 ILE 28 2HD1 ILE 28 6.654 -3.214 -12.829
193 H CYS 29 H CYS 29 7.877 -2.014 -8.105
194 HA CYS 29 HA CYS 29 10.102 -3.819 -7.478
195 HB2 CYS 29 2HB CYS 29 7.710 -2.856 -5.950
196 HB3 CYS 29 3HB CYS 29 8.495 -4.361 -5.484
197 H ALA 30 H ALA 30 9.622 -6.083 -7.037
198 HA ALA 30 HA ALA 30 7.199 -7.132 -8.288
199 HB1 ALA 30 1HB ALA 30 8.761 -7.092 -10.117
200 HB2 ALA 30 2HB ALA 30 9.983 -7.907 -9.141
201 HB3 ALA 30 3HB ALA 30 8.513 -8.762 -9.608
Start of MODEL 5
1 H1 CYS 1 H CYS 1 5.275 1.771 3.528
2 HA CYS 1 HA CYS 1 7.486 1.296 2.044
3 HB2 CYS 1 2HB CYS 1 7.123 -1.391 1.982
4 HB3 CYS 1 3HB CYS 1 8.356 -0.590 2.950
5 H ALA 2 H ALA 2 6.947 1.046 -0.067
6 HA ALA 2 HA ALA 2 4.167 1.071 -0.749
7 HB1 ALA 2 1HB ALA 2 5.171 1.023 -3.133
8 HB2 ALA 2 2HB ALA 2 5.433 2.443 -2.119
9 HB3 ALA 2 3HB ALA 2 6.714 1.245 -2.307
10 H GLN 3 H GLN 3 3.322 -0.345 -2.538
11 HA GLN 3 HA GLN 3 3.911 -3.124 -1.868
12 HB2 GLN 3 2HB GLN 3 1.580 -1.652 -2.924
13 HB3 GLN 3 3HB GLN 3 1.815 -3.262 -3.589
14 HG2 GLN 3 2HG GLN 3 1.853 -4.172 -1.302
15 HG3 GLN 3 3HG GLN 3 1.532 -2.555 -0.678
16 HE21 GLN 3 1HE2 GLN 3 -0.419 -1.494 -1.818
17 HE22 GLN 3 2HE2 GLN 3 -1.827 -2.488 -1.943
18 H LYS 4 H LYS 4 4.221 -4.729 -3.489
19 HA LYS 4 HA LYS 4 6.110 -4.131 -5.421
20 HB2 LYS 4 2HB LYS 4 6.043 -6.355 -5.992
21 HB3 LYS 4 3HB LYS 4 5.260 -6.418 -4.418
22 HG2 LYS 4 2HG LYS 4 3.508 -6.010 -6.765
23 HG3 LYS 4 3HG LYS 4 4.259 -7.598 -6.584
24 HD2 LYS 4 2HD LYS 4 2.342 -7.920 -5.372
25 HD3 LYS 4 3HD LYS 4 3.415 -7.333 -4.098
26 HE2 LYS 4 2HE LYS 4 2.371 -5.019 -5.174
27 HE3 LYS 4 3HE LYS 4 1.009 -6.136 -5.219
28 HZ1 LYS 4 3HZ LYS 4 2.493 -5.114 -2.897
29 HZ2 LYS 4 1HZ LYS 4 1.739 -6.624 -2.794
30 HZ3 LYS 4 2HZ LYS 4 0.822 -5.242 -3.130
31 H GLY 5 H GLY 5 5.741 -4.786 -7.845
32 HA2 GLY 5 2HA GLY 5 4.933 -4.038 -9.862
33 HA3 GLY 5 3HA GLY 5 3.357 -4.412 -9.181
34 H GLU 6 H GLU 6 5.321 -2.025 -7.629
35 HA GLU 6 HA GLU 6 3.700 0.109 -8.850
36 HB2 GLU 6 2HB GLU 6 3.030 -0.598 -6.473
37 HB3 GLU 6 3HB GLU 6 4.542 0.138 -5.960
38 HG2 GLU 6 2HG GLU 6 3.731 2.205 -6.140
39 HG3 GLU 6 3HG GLU 6 2.945 1.864 -7.680
40 H TYR 7 H TYR 7 4.663 2.306 -8.486
41 HA TYR 7 HA TYR 7 7.239 2.438 -9.538
42 HB2 TYR 7 2HB TYR 7 5.585 4.270 -9.675
43 HB3 TYR 7 3HB TYR 7 5.790 4.571 -7.953
44 HD1 TYR 7 HD1 TYR 7 7.783 4.383 -11.105
45 HD2 TYR 7 HD2 TYR 7 7.324 6.167 -7.270
46 HE1 TYR 7 HE1 TYR 7 9.642 5.916 -11.602
47 HE2 TYR 7 HE2 TYR 7 9.180 7.706 -7.757
48 HH TYR 7 HH TYR 7 10.260 8.669 -9.896
49 H CYS 8 H CYS 8 9.253 2.801 -8.678
50 HA CYS 8 HA CYS 8 9.580 3.095 -5.809
51 HB2 CYS 8 2HB CYS 8 9.521 0.745 -5.805
52 HB3 CYS 8 3HB CYS 8 10.400 0.631 -7.326
53 H SER 9 H SER 9 10.946 4.741 -5.671
54 HA SER 9 HA SER 9 13.157 4.905 -7.609
55 HB2 SER 9 2HB SER 9 13.111 7.258 -7.426
56 HB3 SER 9 3HB SER 9 11.412 6.791 -7.479
57 HG SER 9 HG SER 9 12.016 8.335 -5.798
58 H VAL 10 H VAL 10 15.089 6.168 -6.666
59 HA VAL 10 HA VAL 10 16.298 4.658 -4.683
60 HB VAL 10 HB VAL 10 17.895 6.613 -4.446
61 HG11 VAL 10 1HG1 VAL 10 17.784 4.682 -6.279
62 HG12 VAL 10 2HG1 VAL 10 17.621 6.077 -7.346
63 HG13 VAL 10 3HG1 VAL 10 19.028 5.932 -6.293
64 HG21 VAL 10 3HG2 VAL 10 17.685 8.472 -5.953
65 HG22 VAL 10 1HG2 VAL 10 16.233 7.779 -6.675
66 HG23 VAL 10 2HG2 VAL 10 16.202 8.350 -5.006
67 H TYR 11 H TYR 11 14.125 7.337 -4.392
68 HA TYR 11 HA TYR 11 14.764 7.772 -1.588
69 HB2 TYR 11 2HB TYR 11 12.596 9.042 -3.270
70 HB3 TYR 11 3HB TYR 11 13.141 9.578 -1.685
71 HD1 TYR 11 HD1 TYR 11 15.815 9.982 -1.609
72 HD2 TYR 11 HD2 TYR 11 13.362 10.246 -5.075
73 HE1 TYR 11 HE1 TYR 11 17.484 11.443 -2.672
74 HE2 TYR 11 HE2 TYR 11 15.025 11.706 -6.148
75 HH TYR 11 HH TYR 11 16.928 12.827 -5.893
76 H LEU 12 H LEU 12 11.876 6.887 -3.483
77 HA LEU 12 HA LEU 12 10.664 5.782 -1.059
78 HB2 LEU 12 2HB LEU 12 8.612 5.636 -2.425
79 HB3 LEU 12 3HB LEU 12 9.255 7.273 -2.295
80 HG LEU 12 HG LEU 12 10.366 6.288 -4.643
81 HD11 LEU 12 1HD1 LEU 12 8.343 4.557 -4.145
82 HD12 LEU 12 2HD1 LEU 12 8.914 4.989 -5.757
83 HD13 LEU 12 3HD1 LEU 12 7.503 5.799 -5.075
84 HD21 LEU 12 3HD2 LEU 12 8.773 7.868 -5.712
85 HD22 LEU 12 1HD2 LEU 12 9.631 8.551 -4.331
86 HD23 LEU 12 2HD2 LEU 12 7.954 8.032 -4.158
87 H GLN 13 H GLN 13 10.730 3.678 -0.664
88 HA GLN 13 HA GLN 13 11.113 1.833 -2.930
89 HB2 GLN 13 2HB GLN 13 12.430 0.393 -1.473
90 HB3 GLN 13 3HB GLN 13 13.139 2.001 -1.544
91 HG2 GLN 13 2HG GLN 13 12.608 2.487 0.627
92 HG3 GLN 13 3HG GLN 13 11.244 1.371 0.658
93 HE21 GLN 13 1HE2 GLN 13 12.262 -0.973 -0.080
94 HE22 GLN 13 2HE2 GLN 13 13.497 -1.493 1.010
95 H CYS 14 H CYS 14 10.741 -0.558 -1.764
96 HA CYS 14 HA CYS 14 8.025 -0.396 -0.631
97 HB2 CYS 14 2HB CYS 14 7.557 -2.542 -1.808
98 HB3 CYS 14 3HB CYS 14 7.879 -1.202 -2.903
99 H CYS 15 H CYS 15 7.519 -2.884 0.122
100 HA CYS 15 HA CYS 15 9.601 -3.433 2.123
101 HB2 CYS 15 2HB CYS 15 6.714 -3.292 2.232
102 HB3 CYS 15 3HB CYS 15 7.283 -4.855 2.808
103 H ASP 16 H ASP 16 10.615 -5.348 2.192
104 HA ASP 16 HA ASP 16 10.718 -7.074 0.054
105 HB2 ASP 16 2HB ASP 16 11.527 -8.766 1.916
106 HB3 ASP 16 3HB ASP 16 12.500 -7.363 1.480
107 HA PRO 17 HA PRO 17 11.359 -9.482 0.148
108 HB2 PRO 17 2HB PRO 17 10.519 -11.104 -1.860
109 HB3 PRO 17 3HB PRO 17 10.666 -11.647 -0.185
110 HG2 PRO 17 2HG PRO 17 8.227 -10.775 -1.686
111 HG3 PRO 17 3HG PRO 17 8.428 -12.143 -0.577
112 HD2 PRO 17 2HD PRO 17 7.274 -9.813 0.179
113 HD3 PRO 17 3HD PRO 17 8.218 -10.817 1.297
114 H TYR 18 H TYR 18 8.714 -7.860 -1.244
115 HA TYR 18 HA TYR 18 9.348 -7.476 -3.879
116 HB2 TYR 18 2HB TYR 18 8.456 -5.219 -2.087
117 HB3 TYR 18 3HB TYR 18 8.106 -5.444 -3.797
118 HD1 TYR 18 HD2 TYR 18 7.437 -8.440 -3.563
119 HD2 TYR 18 HD1 TYR 18 6.193 -5.027 -1.348
120 HE1 TYR 18 HE2 TYR 18 5.340 -9.586 -2.986
121 HE2 TYR 18 HE1 TYR 18 4.092 -6.165 -0.762
122 HH TYR 18 HH TYR 18 3.615 -9.422 -1.088
123 H HIS 19 H HIS 19 11.084 -6.762 -4.905
124 HA HIS 19 HA HIS 19 12.843 -4.836 -3.534
125 HB2 HIS 19 2HB HIS 19 14.763 -5.893 -4.641
126 HB3 HIS 19 3HB HIS 19 13.904 -7.046 -3.625
127 HD1 HIS 19 HD1 HIS 19 12.610 -8.951 -4.825
128 HD2 HIS 19 HD2 HIS 19 14.739 -6.453 -7.372
129 HE1 HIS 19 HE1 HIS 19 12.674 -10.144 -7.038
130 H CYS 20 H CYS 20 13.719 -3.184 -4.756
131 HA CYS 20 HA CYS 20 12.214 -2.306 -6.978
132 HB2 CYS 20 2HB CYS 20 13.805 -1.052 -5.213
133 HB3 CYS 20 3HB CYS 20 14.932 -1.184 -6.560
134 H THR 21 H THR 21 12.876 -1.985 -9.152
135 HA THR 21 HA THR 21 14.790 -4.017 -10.073
136 HB THR 21 HB THR 21 13.659 -3.602 -12.332
137 HG1 THR 21 HG1 THR 21 11.527 -2.718 -12.132
138 HG21 THR 21 3HG2 THR 21 12.720 -5.552 -11.812
139 HG22 THR 21 1HG2 THR 21 11.441 -4.698 -10.950
140 HG23 THR 21 2HG2 THR 21 12.900 -5.200 -10.094
141 H GLN 22 H GLN 22 14.206 -0.628 -9.926
142 HA GLN 22 HA GLN 22 16.789 0.079 -10.715
143 HB2 GLN 22 2HB GLN 22 16.223 1.222 -12.890
144 HB3 GLN 22 3HB GLN 22 16.263 -0.535 -12.952
145 HG2 GLN 22 2HG GLN 22 13.699 -0.312 -12.501
146 HG3 GLN 22 3HG GLN 22 13.939 1.317 -13.128
147 HE21 GLN 22 1HE2 GLN 22 12.817 1.047 -15.003
148 HE22 GLN 22 2HE2 GLN 22 13.327 -0.000 -16.279
149 HA PRO 23 HA PRO 23 14.234 3.265 -8.531
150 HB2 PRO 23 2HB PRO 23 16.056 3.706 -6.568
151 HB3 PRO 23 3HB PRO 23 14.842 2.425 -6.481
152 HG2 PRO 23 2HG PRO 23 17.727 2.252 -7.262
153 HG3 PRO 23 3HG PRO 23 16.780 1.165 -6.228
154 HD2 PRO 23 2HD PRO 23 17.333 0.598 -8.817
155 HD3 PRO 23 3HD PRO 23 15.832 0.077 -8.025
156 H VAL 24 H VAL 24 17.147 3.119 -10.207
157 HA VAL 24 HA VAL 24 17.961 5.856 -9.752
158 HB VAL 24 HB VAL 24 19.654 4.136 -10.195
159 HG11 VAL 24 1HG1 VAL 24 19.182 3.966 -13.067
160 HG12 VAL 24 2HG1 VAL 24 19.579 2.698 -11.906
161 HG13 VAL 24 3HG1 VAL 24 17.906 3.221 -12.104
162 HG21 VAL 24 3HG2 VAL 24 21.030 5.534 -11.356
163 HG22 VAL 24 1HG2 VAL 24 19.824 5.867 -12.600
164 HG23 VAL 24 2HG2 VAL 24 19.711 6.658 -11.028
165 H ILE 25 H ILE 25 16.147 4.041 -12.128
166 HA ILE 25 HA ILE 25 15.736 6.525 -13.661
167 HB ILE 25 HB ILE 25 15.150 5.100 -15.586
168 HG12 ILE 25 2HG1 ILE 25 15.406 3.004 -13.548
169 HG13 ILE 25 3HG1 ILE 25 14.493 3.006 -15.053
170 HG21 ILE 25 1HG2 ILE 25 17.858 4.357 -14.505
171 HG22 ILE 25 2HG2 ILE 25 17.376 4.519 -16.192
172 HG23 ILE 25 3HG2 ILE 25 17.472 5.947 -15.162
173 HD11 ILE 25 3HD1 ILE 25 16.656 2.600 -16.247
174 HD12 ILE 25 1HD1 ILE 25 17.400 2.360 -14.666
175 HD13 ILE 25 2HD1 ILE 25 16.108 1.286 -15.206
176 H GLY 26 H GLY 26 14.298 5.329 -11.257
177 HA2 GLY 26 2HA GLY 26 12.125 5.387 -10.502
178 HA3 GLY 26 3HA GLY 26 11.672 6.074 -12.054
179 H GLY 27 H GLY 27 12.810 2.940 -10.772
180 HA2 GLY 27 2HA GLY 27 11.158 1.556 -12.734
181 HA3 GLY 27 3HA GLY 27 12.317 0.816 -11.639
182 H ILE 28 H ILE 28 10.837 -0.786 -11.025
183 HA ILE 28 HA ILE 28 8.877 0.140 -9.055
184 HB ILE 28 HB ILE 28 7.241 -1.551 -9.834
185 HG12 ILE 28 2HG1 ILE 28 8.321 -1.753 -12.534
186 HG13 ILE 28 3HG1 ILE 28 9.373 -2.505 -11.338
187 HG21 ILE 28 1HG2 ILE 28 7.494 0.017 -12.270
188 HG22 ILE 28 2HG2 ILE 28 6.233 0.035 -11.037
189 HG23 ILE 28 3HG2 ILE 28 7.703 0.982 -10.808
190 HD11 ILE 28 3HD1 ILE 28 6.966 -3.475 -10.582
191 HD12 ILE 28 1HD1 ILE 28 6.741 -3.327 -12.325
192 HD13 ILE 28 2HD1 ILE 28 8.074 -4.290 -11.686
193 H CYS 29 H CYS 29 7.879 -2.045 -8.038
194 HA CYS 29 HA CYS 29 10.225 -3.593 -7.176
195 HB2 CYS 29 2HB CYS 29 7.646 -2.853 -5.820
196 HB3 CYS 29 3HB CYS 29 8.603 -4.215 -5.246
197 H ALA 30 H ALA 30 10.112 -5.848 -6.988
198 HA ALA 30 HA ALA 30 7.782 -7.158 -8.200
199 HB1 ALA 30 1HB ALA 30 8.912 -7.608 -10.057
200 HB2 ALA 30 2HB ALA 30 10.396 -6.932 -9.384
201 HB3 ALA 30 3HB ALA 30 9.985 -8.623 -9.094
Start of MODEL 6
1 H1 CYS 1 H CYS 1 6.989 2.744 3.536
2 HA CYS 1 HA CYS 1 8.266 1.591 1.971
3 HB2 CYS 1 2HB CYS 1 7.632 -0.975 1.748
4 HB3 CYS 1 3HB CYS 1 8.719 -0.406 3.011
5 H ALA 2 H ALA 2 7.650 0.118 -0.047
6 HA ALA 2 HA ALA 2 5.024 1.077 -0.976
7 HB1 ALA 2 1HB ALA 2 6.013 0.956 -3.265
8 HB2 ALA 2 2HB ALA 2 6.768 2.150 -2.207
9 HB3 ALA 2 3HB ALA 2 7.572 0.611 -2.514
10 H GLN 3 H GLN 3 3.853 -0.280 -2.461
11 HA GLN 3 HA GLN 3 4.137 -3.095 -1.787
12 HB2 GLN 3 2HB GLN 3 1.975 -1.357 -2.816
13 HB3 GLN 3 3HB GLN 3 1.962 -3.020 -3.388
14 HG2 GLN 3 2HG GLN 3 0.869 -3.530 -1.531
15 HG3 GLN 3 3HG GLN 3 2.384 -3.263 -0.669
16 HE21 GLN 3 1HE2 GLN 3 2.799 -0.922 -0.106
17 HE22 GLN 3 2HE2 GLN 3 1.453 -0.022 0.497
18 H LYS 4 H LYS 4 3.955 -4.754 -3.457
19 HA LYS 4 HA LYS 4 5.885 -4.494 -5.454
20 HB2 LYS 4 2HB LYS 4 5.500 -6.693 -5.875
21 HB3 LYS 4 3HB LYS 4 4.600 -6.588 -4.367
22 HG2 LYS 4 2HG LYS 4 3.058 -5.911 -6.769
23 HG3 LYS 4 3HG LYS 4 3.619 -7.583 -6.684
24 HD2 LYS 4 2HD LYS 4 1.504 -7.575 -5.642
25 HD3 LYS 4 3HD LYS 4 2.676 -7.622 -4.323
26 HE2 LYS 4 2HE LYS 4 2.186 -4.902 -4.941
27 HE3 LYS 4 3HE LYS 4 0.624 -5.710 -4.833
28 HZ1 LYS 4 3HZ LYS 4 2.228 -4.864 -2.741
29 HZ2 LYS 4 1HZ LYS 4 2.296 -6.554 -2.719
30 HZ3 LYS 4 2HZ LYS 4 0.801 -5.766 -2.640
31 H GLY 5 H GLY 5 5.464 -4.895 -7.835
32 HA2 GLY 5 2HA GLY 5 4.741 -3.940 -9.802
33 HA3 GLY 5 3HA GLY 5 3.148 -4.366 -9.195
34 H GLU 6 H GLU 6 5.256 -2.046 -7.627
35 HA GLU 6 HA GLU 6 3.525 0.132 -8.583
36 HB2 GLU 6 2HB GLU 6 2.902 0.741 -6.513
37 HB3 GLU 6 3HB GLU 6 3.415 -0.870 -6.032
38 HG2 GLU 6 2HG GLU 6 4.618 0.290 -4.528
39 HG3 GLU 6 3HG GLU 6 5.763 0.387 -5.863
40 H TYR 7 H TYR 7 4.492 2.278 -8.391
41 HA TYR 7 HA TYR 7 6.961 2.506 -9.561
42 HB2 TYR 7 2HB TYR 7 5.364 4.357 -9.436
43 HB3 TYR 7 3HB TYR 7 5.638 4.495 -7.704
44 HD1 TYR 7 HD2 TYR 7 7.750 4.361 -10.794
45 HD2 TYR 7 HD1 TYR 7 6.950 6.275 -7.079
46 HE1 TYR 7 HE2 TYR 7 9.589 5.939 -11.216
47 HE2 TYR 7 HE1 TYR 7 8.786 7.858 -7.492
48 HH TYR 7 HH TYR 7 9.964 8.745 -9.810
49 H CYS 8 H CYS 8 9.046 3.034 -8.839
50 HA CYS 8 HA CYS 8 9.623 2.919 -5.995
51 HB2 CYS 8 2HB CYS 8 9.683 0.574 -6.500
52 HB3 CYS 8 3HB CYS 8 10.636 0.855 -7.953
53 H SER 9 H SER 9 11.493 3.962 -5.439
54 HA SER 9 HA SER 9 13.549 4.584 -7.320
55 HB2 SER 9 2HB SER 9 13.228 6.931 -7.565
56 HB3 SER 9 3HB SER 9 11.669 6.191 -7.929
57 HG SER 9 HG SER 9 10.854 7.267 -6.332
58 H VAL 10 H VAL 10 15.054 6.341 -6.308
59 HA VAL 10 HA VAL 10 16.089 5.381 -3.942
60 HB VAL 10 HB VAL 10 17.217 7.639 -3.726
61 HG11 VAL 10 1HG1 VAL 10 17.528 6.595 -6.511
62 HG12 VAL 10 2HG1 VAL 10 18.764 7.124 -5.367
63 HG13 VAL 10 3HG1 VAL 10 17.946 5.580 -5.131
64 HG21 VAL 10 3HG2 VAL 10 16.475 8.443 -6.420
65 HG22 VAL 10 1HG2 VAL 10 15.115 8.488 -5.298
66 HG23 VAL 10 2HG2 VAL 10 16.581 9.401 -4.943
67 H TYR 11 H TYR 11 13.509 7.669 -4.428
68 HA TYR 11 HA TYR 11 13.465 8.445 -1.627
69 HB2 TYR 11 2HB TYR 11 11.406 9.181 -3.698
70 HB3 TYR 11 3HB TYR 11 11.833 10.046 -2.226
71 HD1 TYR 11 HD1 TYR 11 14.606 10.474 -2.251
72 HD2 TYR 11 HD2 TYR 11 11.972 10.362 -5.590
73 HE1 TYR 11 HE1 TYR 11 16.172 11.879 -3.525
74 HE2 TYR 11 HE2 TYR 11 13.530 11.766 -6.874
75 HH TYR 11 HH TYR 11 16.242 12.164 -6.673
76 H LEU 12 H LEU 12 11.571 6.533 -3.905
77 HA LEU 12 HA LEU 12 9.634 5.836 -1.849
78 HB2 LEU 12 2HB LEU 12 9.662 5.919 -4.697
79 HB3 LEU 12 3HB LEU 12 9.281 4.275 -4.189
80 HG LEU 12 HG LEU 12 7.225 5.415 -4.523
81 HD11 LEU 12 1HD1 LEU 12 6.227 4.741 -2.627
82 HD12 LEU 12 2HD1 LEU 12 7.278 5.715 -1.600
83 HD13 LEU 12 3HD1 LEU 12 7.840 4.160 -2.212
84 HD21 LEU 12 3HD2 LEU 12 7.590 7.498 -2.498
85 HD22 LEU 12 1HD2 LEU 12 6.834 7.579 -4.089
86 HD23 LEU 12 2HD2 LEU 12 8.588 7.700 -3.939
87 H GLN 13 H GLN 13 10.329 4.391 -0.402
88 HA GLN 13 HA GLN 13 12.194 2.308 -1.107
89 HB2 GLN 13 2HB GLN 13 11.807 3.633 1.181
90 HB3 GLN 13 3HB GLN 13 10.752 2.260 1.495
91 HG2 GLN 13 2HG GLN 13 12.989 1.916 2.399
92 HG3 GLN 13 3HG GLN 13 12.595 0.729 1.157
93 HE21 GLN 13 1HE2 GLN 13 13.814 0.613 -0.652
94 HE22 GLN 13 2HE2 GLN 13 15.204 1.595 -0.950
95 H CYS 14 H CYS 14 11.780 0.029 -0.700
96 HA CYS 14 HA CYS 14 8.961 -0.700 -1.157
97 HB2 CYS 14 2HB CYS 14 10.715 -0.981 -3.080
98 HB3 CYS 14 3HB CYS 14 11.222 -2.394 -2.159
99 H CYS 15 H CYS 15 8.176 -2.543 -0.144
100 HA CYS 15 HA CYS 15 9.786 -3.451 2.134
101 HB2 CYS 15 2HB CYS 15 6.999 -2.813 1.766
102 HB3 CYS 15 3HB CYS 15 7.167 -4.465 2.354
103 H ASP 16 H ASP 16 10.820 -5.310 1.894
104 HA ASP 16 HA ASP 16 10.618 -7.099 -0.173
105 HB2 ASP 16 2HB ASP 16 11.477 -8.794 1.667
106 HB3 ASP 16 3HB ASP 16 12.494 -7.471 1.105
107 HA PRO 17 HA PRO 17 11.111 -9.539 -0.067
108 HB2 PRO 17 2HB PRO 17 9.998 -11.147 -1.950
109 HB3 PRO 17 3HB PRO 17 10.256 -11.661 -0.279
110 HG2 PRO 17 2HG PRO 17 7.755 -10.664 -1.588
111 HG3 PRO 17 3HG PRO 17 7.965 -12.018 -0.463
112 HD2 PRO 17 2HD PRO 17 7.032 -9.602 0.324
113 HD3 PRO 17 3HD PRO 17 8.005 -10.640 1.384
114 H TYR 18 H TYR 18 8.438 -7.813 -1.295
115 HA TYR 18 HA TYR 18 8.894 -7.524 -3.980
116 HB2 TYR 18 2HB TYR 18 8.231 -5.189 -2.186
117 HB3 TYR 18 3HB TYR 18 7.756 -5.430 -3.864
118 HD1 TYR 18 HD1 TYR 18 6.963 -8.380 -3.535
119 HD2 TYR 18 HD2 TYR 18 6.042 -4.886 -1.288
120 HE1 TYR 18 HE1 TYR 18 4.861 -9.419 -2.793
121 HE2 TYR 18 HE2 TYR 18 3.938 -5.916 -0.538
122 HH TYR 18 HH TYR 18 2.969 -9.143 -1.662
123 H HIS 19 H HIS 19 10.862 -7.336 -4.861
124 HA HIS 19 HA HIS 19 12.767 -5.425 -3.717
125 HB2 HIS 19 2HB HIS 19 14.471 -6.557 -4.983
126 HB3 HIS 19 3HB HIS 19 13.498 -7.779 -4.167
127 HD1 HIS 19 HD1 HIS 19 12.410 -9.523 -5.607
128 HD2 HIS 19 HD2 HIS 19 13.934 -6.351 -7.817
129 HE1 HIS 19 HE1 HIS 19 12.210 -10.223 -8.014
130 H CYS 20 H CYS 20 13.791 -3.850 -5.001
131 HA CYS 20 HA CYS 20 12.098 -2.800 -7.105
132 HB2 CYS 20 2HB CYS 20 13.242 -1.445 -5.228
133 HB3 CYS 20 3HB CYS 20 14.703 -1.596 -6.199
134 H THR 21 H THR 21 12.892 -2.180 -9.191
135 HA THR 21 HA THR 21 14.885 -4.069 -10.207
136 HB THR 21 HB THR 21 14.011 -3.258 -12.474
137 HG1 THR 21 HG1 THR 21 12.367 -1.902 -12.488
138 HG21 THR 21 3HG2 THR 21 12.935 -5.204 -12.373
139 HG22 THR 21 1HG2 THR 21 11.624 -4.434 -11.480
140 HG23 THR 21 2HG2 THR 21 12.983 -5.147 -10.610
141 H GLN 22 H GLN 22 13.989 -0.649 -10.711
142 HA GLN 22 HA GLN 22 16.812 0.064 -10.737
143 HB2 GLN 22 2HB GLN 22 14.976 0.813 -13.016
144 HB3 GLN 22 3HB GLN 22 16.665 1.268 -12.843
145 HG2 GLN 22 2HG GLN 22 15.681 -1.562 -13.119
146 HG3 GLN 22 3HG GLN 22 16.277 -0.571 -14.450
147 HE21 GLN 22 1HE2 GLN 22 17.573 -2.791 -14.229
148 HE22 GLN 22 2HE2 GLN 22 19.107 -2.608 -13.454
149 HA PRO 23 HA PRO 23 14.144 3.090 -8.485
150 HB2 PRO 23 2HB PRO 23 15.854 3.373 -6.396
151 HB3 PRO 23 3HB PRO 23 14.643 2.089 -6.477
152 HG2 PRO 23 2HG PRO 23 17.567 1.979 -7.110
153 HG3 PRO 23 3HG PRO 23 16.569 0.813 -6.219
154 HD2 PRO 23 2HD PRO 23 17.267 0.454 -8.811
155 HD3 PRO 23 3HD PRO 23 15.726 -0.128 -8.147
156 H VAL 24 H VAL 24 17.205 3.065 -9.932
157 HA VAL 24 HA VAL 24 17.888 5.802 -9.266
158 HB VAL 24 HB VAL 24 19.704 4.210 -9.532
159 HG11 VAL 24 1HG1 VAL 24 18.203 3.168 -11.588
160 HG12 VAL 24 2HG1 VAL 24 19.550 3.939 -12.427
161 HG13 VAL 24 3HG1 VAL 24 19.861 2.721 -11.189
162 HG21 VAL 24 3HG2 VAL 24 19.983 5.927 -11.951
163 HG22 VAL 24 1HG2 VAL 24 19.765 6.697 -10.379
164 HG23 VAL 24 2HG2 VAL 24 21.132 5.616 -10.649
165 H ILE 25 H ILE 25 16.516 4.006 -11.951
166 HA ILE 25 HA ILE 25 16.173 6.539 -13.417
167 HB ILE 25 HB ILE 25 15.951 5.212 -15.462
168 HG12 ILE 25 2HG1 ILE 25 15.947 3.001 -13.519
169 HG13 ILE 25 3HG1 ILE 25 15.223 3.095 -15.120
170 HG21 ILE 25 1HG2 ILE 25 18.248 4.691 -15.751
171 HG22 ILE 25 2HG2 ILE 25 18.171 6.038 -14.617
172 HG23 ILE 25 3HG2 ILE 25 18.469 4.404 -14.026
173 HD11 ILE 25 3HD1 ILE 25 17.536 2.781 -16.055
174 HD12 ILE 25 1HD1 ILE 25 18.056 2.406 -14.413
175 HD13 ILE 25 2HD1 ILE 25 16.849 1.395 -15.208
176 H GLY 26 H GLY 26 14.476 5.305 -11.269
177 HA2 GLY 26 2HA GLY 26 12.217 5.288 -10.827
178 HA3 GLY 26 3HA GLY 26 11.951 5.873 -12.463
179 H GLY 27 H GLY 27 12.382 3.011 -10.470
180 HA2 GLY 27 2HA GLY 27 11.315 1.388 -12.696
181 HA3 GLY 27 3HA GLY 27 12.363 0.761 -11.432
182 H ILE 28 H ILE 28 10.833 -0.871 -10.962
183 HA ILE 28 HA ILE 28 8.709 0.059 -9.185
184 HB ILE 28 HB ILE 28 7.217 -1.783 -10.179
185 HG12 ILE 28 2HG1 ILE 28 8.397 -1.291 -12.821
186 HG13 ILE 28 3HG1 ILE 28 9.420 -2.249 -11.756
187 HG21 ILE 28 1HG2 ILE 28 6.066 -0.037 -10.920
188 HG22 ILE 28 2HG2 ILE 28 7.511 0.955 -10.724
189 HG23 ILE 28 3HG2 ILE 28 7.179 0.174 -12.271
190 HD11 ILE 28 3HD1 ILE 28 6.587 -2.866 -12.559
191 HD12 ILE 28 1HD1 ILE 28 8.047 -3.695 -13.098
192 HD13 ILE 28 2HD1 ILE 28 7.542 -3.804 -11.412
193 H CYS 29 H CYS 29 7.657 -1.953 -8.101
194 HA CYS 29 HA CYS 29 9.863 -3.604 -7.125
195 HB2 CYS 29 2HB CYS 29 7.093 -3.077 -6.037
196 HB3 CYS 29 3HB CYS 29 8.227 -4.209 -5.309
197 H ALA 30 H ALA 30 9.819 -5.837 -7.111
198 HA ALA 30 HA ALA 30 7.564 -7.181 -8.405
199 HB1 ALA 30 1HB ALA 30 9.624 -8.535 -9.534
200 HB2 ALA 30 2HB ALA 30 8.734 -7.232 -10.323
201 HB3 ALA 30 3HB ALA 30 10.265 -6.891 -9.518
Start of MODEL 7
1 H1 CYS 1 H CYS 1 5.894 0.950 4.493
2 HA CYS 1 HA CYS 1 8.081 0.888 2.637
3 HB2 CYS 1 2HB CYS 1 7.254 -1.598 2.038
4 HB3 CYS 1 3HB CYS 1 8.604 -1.274 3.119
5 H ALA 2 H ALA 2 7.369 0.511 0.428
6 HA ALA 2 HA ALA 2 4.627 1.438 0.051
7 HB1 ALA 2 1HB ALA 2 6.488 2.622 -1.065
8 HB2 ALA 2 2HB ALA 2 6.829 1.158 -1.989
9 HB3 ALA 2 3HB ALA 2 5.291 1.996 -2.199
10 H GLN 3 H GLN 3 3.631 0.556 -2.113
11 HA GLN 3 HA GLN 3 3.396 -2.316 -1.743
12 HB2 GLN 3 2HB GLN 3 1.786 -0.203 -3.091
13 HB3 GLN 3 3HB GLN 3 1.627 -1.855 -3.674
14 HG2 GLN 3 2HG GLN 3 -0.087 -1.455 -2.071
15 HG3 GLN 3 3HG GLN 3 1.086 -2.563 -1.361
16 HE21 GLN 3 1HE2 GLN 3 -0.672 0.226 -0.900
17 HE22 GLN 3 2HE2 GLN 3 0.180 0.860 0.463
18 H LYS 4 H LYS 4 4.351 -3.780 -2.988
19 HA LYS 4 HA LYS 4 6.232 -3.168 -4.940
20 HB2 LYS 4 2HB LYS 4 6.403 -5.487 -5.343
21 HB3 LYS 4 3HB LYS 4 5.942 -5.345 -3.652
22 HG2 LYS 4 2HG LYS 4 3.911 -5.781 -5.814
23 HG3 LYS 4 3HG LYS 4 4.771 -7.119 -5.051
24 HD2 LYS 4 2HD LYS 4 3.046 -7.064 -3.599
25 HD3 LYS 4 3HD LYS 4 3.957 -5.741 -2.869
26 HE2 LYS 4 2HE LYS 4 2.626 -4.334 -4.683
27 HE3 LYS 4 3HE LYS 4 1.493 -5.675 -4.528
28 HZ1 LYS 4 3HZ LYS 4 1.518 -5.272 -2.096
29 HZ2 LYS 4 1HZ LYS 4 0.878 -3.984 -2.988
30 HZ3 LYS 4 2HZ LYS 4 2.447 -3.884 -2.363
31 H GLY 5 H GLY 5 5.927 -4.532 -7.197
32 HA2 GLY 5 2HA GLY 5 5.083 -4.310 -9.323
33 HA3 GLY 5 3HA GLY 5 3.519 -4.519 -8.550
34 H GLU 6 H GLU 6 5.415 -1.813 -7.584
35 HA GLU 6 HA GLU 6 3.926 -0.041 -9.391
36 HB2 GLU 6 2HB GLU 6 4.254 0.503 -6.439
37 HB3 GLU 6 3HB GLU 6 3.330 1.447 -7.600
38 HG2 GLU 6 2HG GLU 6 2.299 -1.147 -7.743
39 HG3 GLU 6 3HG GLU 6 2.522 -0.809 -6.028
40 H TYR 7 H TYR 7 4.794 2.282 -9.162
41 HA TYR 7 HA TYR 7 7.422 2.378 -9.991
42 HB2 TYR 7 2HB TYR 7 5.678 4.191 -10.218
43 HB3 TYR 7 3HB TYR 7 6.022 4.635 -8.551
44 HD1 TYR 7 HD1 TYR 7 7.717 4.158 -11.840
45 HD2 TYR 7 HD2 TYR 7 7.683 6.197 -8.104
46 HE1 TYR 7 HE1 TYR 7 9.565 5.587 -12.609
47 HE2 TYR 7 HE2 TYR 7 9.530 7.632 -8.865
48 HH TYR 7 HH TYR 7 10.404 8.413 -11.226
49 H CYS 8 H CYS 8 9.380 2.908 -9.032
50 HA CYS 8 HA CYS 8 9.508 3.205 -6.140
51 HB2 CYS 8 2HB CYS 8 9.568 0.793 -6.388
52 HB3 CYS 8 3HB CYS 8 10.829 0.916 -7.610
53 H SER 9 H SER 9 11.329 4.263 -5.431
54 HA SER 9 HA SER 9 13.520 4.763 -7.272
55 HB2 SER 9 2HB SER 9 13.354 7.181 -7.153
56 HB3 SER 9 3HB SER 9 11.835 6.532 -7.773
57 HG SER 9 HG SER 9 11.271 7.979 -6.222
58 H VAL 10 H VAL 10 15.141 6.331 -6.131
59 HA VAL 10 HA VAL 10 16.157 5.086 -3.889
60 HB VAL 10 HB VAL 10 17.568 7.049 -3.551
61 HG11 VAL 10 1HG1 VAL 10 17.103 6.172 -6.386
62 HG12 VAL 10 2HG1 VAL 10 18.423 7.255 -5.941
63 HG13 VAL 10 3HG1 VAL 10 18.345 5.630 -5.257
64 HG21 VAL 10 3HG2 VAL 10 15.432 8.358 -5.125
65 HG22 VAL 10 1HG2 VAL 10 16.413 8.985 -3.799
66 HG23 VAL 10 2HG2 VAL 10 17.086 8.891 -5.427
67 H TYR 11 H TYR 11 13.696 7.533 -4.106
68 HA TYR 11 HA TYR 11 13.757 8.066 -1.247
69 HB2 TYR 11 2HB TYR 11 11.839 9.105 -3.342
70 HB3 TYR 11 3HB TYR 11 12.028 9.712 -1.701
71 HD1 TYR 11 HD2 TYR 11 14.344 10.667 -1.074
72 HD2 TYR 11 HD1 TYR 11 13.070 10.042 -5.085
73 HE1 TYR 11 HE2 TYR 11 16.044 12.263 -1.856
74 HE2 TYR 11 HE1 TYR 11 14.767 11.634 -5.879
75 HH TYR 11 HH TYR 11 16.080 13.498 -5.036
76 H LEU 12 H LEU 12 11.539 6.671 -3.645
77 HA LEU 12 HA LEU 12 9.752 5.760 -1.539
78 HB2 LEU 12 2HB LEU 12 9.632 6.043 -4.470
79 HB3 LEU 12 3HB LEU 12 8.741 4.679 -3.797
80 HG LEU 12 HG LEU 12 8.042 6.911 -2.238
81 HD11 LEU 12 1HD1 LEU 12 7.609 7.585 -5.124
82 HD12 LEU 12 2HD1 LEU 12 9.028 8.162 -4.252
83 HD13 LEU 12 3HD1 LEU 12 7.413 8.607 -3.700
84 HD21 LEU 12 3HD2 LEU 12 6.723 4.869 -2.997
85 HD22 LEU 12 1HD2 LEU 12 6.417 5.761 -4.487
86 HD23 LEU 12 2HD2 LEU 12 5.860 6.407 -2.944
87 H GLN 13 H GLN 13 10.205 3.936 -0.507
88 HA GLN 13 HA GLN 13 11.572 1.783 -1.974
89 HB2 GLN 13 2HB GLN 13 12.432 2.914 0.281
90 HB3 GLN 13 3HB GLN 13 11.351 1.723 0.993
91 HG2 GLN 13 2HG GLN 13 13.607 0.866 0.884
92 HG3 GLN 13 3HG GLN 13 12.544 -0.059 -0.174
93 HE21 GLN 13 1HE2 GLN 13 13.235 -0.416 -2.157
94 HE22 GLN 13 2HE2 GLN 13 14.468 0.471 -2.979
95 H CYS 14 H CYS 14 10.911 -0.410 -1.576
96 HA CYS 14 HA CYS 14 8.060 -0.612 -0.858
97 HB2 CYS 14 2HB CYS 14 8.056 -2.641 -2.345
98 HB3 CYS 14 3HB CYS 14 8.333 -1.118 -3.183
99 H CYS 15 H CYS 15 7.412 -2.816 -0.071
100 HA CYS 15 HA CYS 15 9.265 -3.629 2.018
101 HB2 CYS 15 2HB CYS 15 6.466 -3.417 1.831
102 HB3 CYS 15 3HB CYS 15 6.805 -5.139 1.972
103 H ASP 16 H ASP 16 10.326 -5.525 2.103
104 HA ASP 16 HA ASP 16 10.664 -7.067 -0.230
105 HB2 ASP 16 2HB ASP 16 11.718 -7.044 2.493
106 HB3 ASP 16 3HB ASP 16 11.559 -8.674 1.843
107 HA PRO 17 HA PRO 17 11.663 -9.443 0.015
108 HB2 PRO 17 2HB PRO 17 11.097 -11.243 -1.938
109 HB3 PRO 17 3HB PRO 17 11.249 -11.690 -0.235
110 HG2 PRO 17 2HG PRO 17 8.778 -11.190 -1.847
111 HG3 PRO 17 3HG PRO 17 9.103 -12.473 -0.668
112 HD2 PRO 17 2HD PRO 17 7.649 -10.272 -0.061
113 HD3 PRO 17 3HD PRO 17 8.669 -11.102 1.133
114 H TYR 18 H TYR 18 8.853 -8.337 -1.612
115 HA TYR 18 HA TYR 18 9.623 -7.953 -4.213
116 HB2 TYR 18 2HB TYR 18 8.204 -5.796 -2.661
117 HB3 TYR 18 3HB TYR 18 8.002 -6.235 -4.353
118 HD1 TYR 18 HD2 TYR 18 7.408 -8.938 -4.535
119 HD2 TYR 18 HD1 TYR 18 6.382 -6.304 -1.355
120 HE1 TYR 18 HE2 TYR 18 5.526 -10.404 -3.935
121 HE2 TYR 18 HE1 TYR 18 4.499 -7.763 -0.746
122 HH TYR 18 HH TYR 18 3.896 -10.207 -1.032
123 H HIS 19 H HIS 19 11.392 -7.092 -5.050
124 HA HIS 19 HA HIS 19 12.614 -4.778 -3.691
125 HB2 HIS 19 2HB HIS 19 14.774 -5.522 -4.643
126 HB3 HIS 19 3HB HIS 19 14.072 -6.720 -3.560
127 HD1 HIS 19 HD1 HIS 19 13.200 -8.921 -4.632
128 HD2 HIS 19 HD2 HIS 19 15.019 -6.311 -7.305
129 HE1 HIS 19 HE1 HIS 19 13.605 -10.269 -6.716
130 H CYS 20 H CYS 20 13.366 -3.070 -4.950
131 HA CYS 20 HA CYS 20 11.911 -2.580 -7.344
132 HB2 CYS 20 2HB CYS 20 14.295 -1.009 -6.362
133 HB3 CYS 20 3HB CYS 20 12.962 -0.439 -7.361
134 H THR 21 H THR 21 12.656 -2.353 -9.461
135 HA THR 21 HA THR 21 14.873 -4.094 -10.133
136 HB THR 21 HB THR 21 14.156 -3.480 -12.527
137 HG1 THR 21 HG1 THR 21 11.865 -2.759 -12.484
138 HG21 THR 21 3HG2 THR 21 13.085 -5.433 -12.437
139 HG22 THR 21 1HG2 THR 21 11.772 -4.725 -11.497
140 HG23 THR 21 2HG2 THR 21 13.201 -5.357 -10.679
141 H GLN 22 H GLN 22 13.941 -0.720 -10.795
142 HA GLN 22 HA GLN 22 16.741 0.047 -10.774
143 HB2 GLN 22 2HB GLN 22 14.968 0.402 -13.192
144 HB3 GLN 22 3HB GLN 22 16.469 1.288 -12.951
145 HG2 GLN 22 2HG GLN 22 16.287 -1.713 -13.033
146 HG3 GLN 22 3HG GLN 22 16.655 -0.704 -14.432
147 HE21 GLN 22 1HE2 GLN 22 18.716 -0.385 -14.842
148 HE22 GLN 22 2HE2 GLN 22 20.015 -0.528 -13.713
149 HA PRO 23 HA PRO 23 13.864 3.107 -8.823
150 HB2 PRO 23 2HB PRO 23 15.386 3.462 -6.604
151 HB3 PRO 23 3HB PRO 23 14.187 2.171 -6.749
152 HG2 PRO 23 2HG PRO 23 17.154 2.051 -7.122
153 HG3 PRO 23 3HG PRO 23 16.085 0.911 -6.285
154 HD2 PRO 23 2HD PRO 23 17.004 0.473 -8.795
155 HD3 PRO 23 3HD PRO 23 15.413 -0.094 -8.248
156 H VAL 24 H VAL 24 17.028 3.048 -10.014
157 HA VAL 24 HA VAL 24 17.680 5.792 -9.358
158 HB VAL 24 HB VAL 24 19.501 4.201 -9.492
159 HG11 VAL 24 1HG1 VAL 24 18.102 3.140 -11.635
160 HG12 VAL 24 2HG1 VAL 24 19.554 3.828 -12.364
161 HG13 VAL 24 3HG1 VAL 24 19.696 2.640 -11.069
162 HG21 VAL 24 3HG2 VAL 24 21.009 5.513 -10.689
163 HG22 VAL 24 1HG2 VAL 24 19.818 5.926 -11.922
164 HG23 VAL 24 2HG2 VAL 24 19.704 6.637 -10.313
165 H ILE 25 H ILE 25 16.429 3.978 -12.086
166 HA ILE 25 HA ILE 25 16.203 6.495 -13.604
167 HB ILE 25 HB ILE 25 16.166 5.207 -15.645
168 HG12 ILE 25 2HG1 ILE 25 15.781 2.969 -13.770
169 HG13 ILE 25 3HG1 ILE 25 15.239 3.150 -15.435
170 HG21 ILE 25 1HG2 ILE 25 18.448 4.167 -13.980
171 HG22 ILE 25 2HG2 ILE 25 18.430 4.498 -15.713
172 HG23 ILE 25 3HG2 ILE 25 18.347 5.830 -14.560
173 HD11 ILE 25 3HD1 ILE 25 17.919 2.220 -14.457
174 HD12 ILE 25 1HD1 ILE 25 16.725 1.322 -15.392
175 HD13 ILE 25 2HD1 ILE 25 17.603 2.659 -16.134
176 H GLY 26 H GLY 26 14.391 5.112 -11.554
177 HA2 GLY 26 2HA GLY 26 12.098 5.209 -11.251
178 HA3 GLY 26 3HA GLY 26 11.934 5.719 -12.925
179 H GLY 27 H GLY 27 12.288 2.942 -10.792
180 HA2 GLY 27 2HA GLY 27 11.213 1.255 -12.968
181 HA3 GLY 27 3HA GLY 27 12.370 0.666 -11.784
182 H ILE 28 H ILE 28 10.883 -1.020 -11.271
183 HA ILE 28 HA ILE 28 8.867 -0.151 -9.334
184 HB ILE 28 HB ILE 28 7.351 -2.001 -10.191
185 HG12 ILE 28 2HG1 ILE 28 8.382 -1.710 -12.913
186 HG13 ILE 28 3HG1 ILE 28 9.500 -2.548 -11.842
187 HG21 ILE 28 1HG2 ILE 28 6.194 -0.260 -10.934
188 HG22 ILE 28 2HG2 ILE 28 7.674 0.694 -11.006
189 HG23 ILE 28 3HG2 ILE 28 7.159 -0.239 -12.410
190 HD11 ILE 28 3HD1 ILE 28 7.641 -4.086 -11.229
191 HD12 ILE 28 1HD1 ILE 28 6.661 -3.310 -12.473
192 HD13 ILE 28 2HD1 ILE 28 8.135 -4.171 -12.920
193 H CYS 29 H CYS 29 8.074 -2.021 -7.997
194 HA CYS 29 HA CYS 29 10.354 -3.753 -7.365
195 HB2 CYS 29 2HB CYS 29 7.982 -2.803 -5.769
196 HB3 CYS 29 3HB CYS 29 8.984 -4.145 -5.222
197 H ALA 30 H ALA 30 9.998 -5.984 -6.830
198 HA ALA 30 HA ALA 30 7.479 -7.187 -7.642
199 HB1 ALA 30 1HB ALA 30 9.062 -8.838 -9.038
200 HB2 ALA 30 2HB ALA 30 8.264 -7.435 -9.750
201 HB3 ALA 30 3HB ALA 30 9.952 -7.330 -9.253
Start of MODEL 8
1 H1 CYS 1 H CYS 1 6.520 2.690 3.432
2 HA CYS 1 HA CYS 1 8.132 1.602 1.989
3 HB2 CYS 1 2HB CYS 1 7.634 -0.986 1.778
4 HB3 CYS 1 3HB CYS 1 8.681 -0.366 3.049
5 H ALA 2 H ALA 2 7.614 0.275 -0.073
6 HA ALA 2 HA ALA 2 4.914 1.054 -0.946
7 HB1 ALA 2 1HB ALA 2 7.412 0.620 -2.579
8 HB2 ALA 2 2HB ALA 2 5.834 1.077 -3.222
9 HB3 ALA 2 3HB ALA 2 6.701 2.175 -2.149
10 H GLN 3 H GLN 3 3.759 -0.346 -2.381
11 HA GLN 3 HA GLN 3 4.189 -3.152 -1.746
12 HB2 GLN 3 2HB GLN 3 1.920 -1.493 -2.628
13 HB3 GLN 3 3HB GLN 3 1.960 -3.114 -3.310
14 HG2 GLN 3 2HG GLN 3 2.104 -4.038 -1.030
15 HG3 GLN 3 3HG GLN 3 1.970 -2.402 -0.386
16 HE21 GLN 3 1HE2 GLN 3 0.120 -3.575 0.684
17 HE22 GLN 3 2HE2 GLN 3 -1.406 -3.519 -0.125
18 H LYS 4 H LYS 4 4.062 -4.805 -3.410
19 HA LYS 4 HA LYS 4 5.904 -4.455 -5.462
20 HB2 LYS 4 2HB LYS 4 5.525 -6.652 -5.986
21 HB3 LYS 4 3HB LYS 4 4.806 -6.612 -4.381
22 HG2 LYS 4 2HG LYS 4 3.014 -5.966 -6.636
23 HG3 LYS 4 3HG LYS 4 3.577 -7.635 -6.522
24 HD2 LYS 4 2HD LYS 4 1.679 -7.733 -5.230
25 HD3 LYS 4 3HD LYS 4 2.893 -7.365 -4.003
26 HE2 LYS 4 2HE LYS 4 2.122 -4.879 -4.941
27 HE3 LYS 4 3HE LYS 4 0.618 -5.799 -4.904
28 HZ1 LYS 4 3HZ LYS 4 2.374 -5.018 -2.693
29 HZ2 LYS 4 1HZ LYS 4 1.513 -6.469 -2.555
30 HZ3 LYS 4 2HZ LYS 4 0.684 -5.012 -2.781
31 H GLY 5 H GLY 5 5.355 -4.953 -7.847
32 HA2 GLY 5 2HA GLY 5 4.558 -4.003 -9.789
33 HA3 GLY 5 3HA GLY 5 2.991 -4.407 -9.103
34 H GLU 6 H GLU 6 5.202 -2.085 -7.679
35 HA GLU 6 HA GLU 6 3.477 0.106 -8.607
36 HB2 GLU 6 2HB GLU 6 2.867 0.733 -6.540
37 HB3 GLU 6 3HB GLU 6 3.364 -0.879 -6.047
38 HG2 GLU 6 2HG GLU 6 4.581 0.286 -4.556
39 HG3 GLU 6 3HG GLU 6 5.727 0.349 -5.895
40 H TYR 7 H TYR 7 4.477 2.226 -8.484
41 HA TYR 7 HA TYR 7 6.958 2.394 -9.636
42 HB2 TYR 7 2HB TYR 7 5.408 4.274 -9.588
43 HB3 TYR 7 3HB TYR 7 5.618 4.435 -7.849
44 HD1 TYR 7 HD1 TYR 7 7.590 4.497 -11.018
45 HD2 TYR 7 HD2 TYR 7 7.183 5.942 -7.036
46 HE1 TYR 7 HE1 TYR 7 9.462 6.047 -11.396
47 HE2 TYR 7 HE2 TYR 7 9.052 7.496 -7.404
48 HH TYR 7 HH TYR 7 10.598 8.216 -8.820
49 H CYS 8 H CYS 8 9.043 2.925 -8.908
50 HA CYS 8 HA CYS 8 9.598 2.867 -6.059
51 HB2 CYS 8 2HB CYS 8 9.641 0.514 -6.489
52 HB3 CYS 8 3HB CYS 8 10.581 0.738 -7.961
53 H SER 9 H SER 9 11.456 3.925 -5.517
54 HA SER 9 HA SER 9 13.549 4.464 -7.384
55 HB2 SER 9 2HB SER 9 13.250 6.798 -7.724
56 HB3 SER 9 3HB SER 9 11.688 6.062 -8.079
57 HG SER 9 HG SER 9 11.246 7.754 -6.760
58 H VAL 10 H VAL 10 15.055 6.236 -6.411
59 HA VAL 10 HA VAL 10 16.043 5.358 -3.996
60 HB VAL 10 HB VAL 10 17.181 7.617 -3.840
61 HG11 VAL 10 1HG1 VAL 10 17.593 5.454 -5.559
62 HG12 VAL 10 2HG1 VAL 10 17.839 6.894 -6.549
63 HG13 VAL 10 3HG1 VAL 10 18.772 6.670 -5.069
64 HG21 VAL 10 3HG2 VAL 10 15.319 8.816 -5.035
65 HG22 VAL 10 1HG2 VAL 10 16.945 9.184 -5.612
66 HG23 VAL 10 2HG2 VAL 10 15.910 8.090 -6.530
67 H TYR 11 H TYR 11 13.489 7.648 -4.604
68 HA TYR 11 HA TYR 11 13.403 8.519 -1.832
69 HB2 TYR 11 2HB TYR 11 11.377 9.197 -3.953
70 HB3 TYR 11 3HB TYR 11 11.803 10.115 -2.512
71 HD1 TYR 11 HD2 TYR 11 14.560 10.549 -2.520
72 HD2 TYR 11 HD1 TYR 11 11.991 10.256 -5.899
73 HE1 TYR 11 HE2 TYR 11 16.149 11.887 -3.838
74 HE2 TYR 11 HE1 TYR 11 13.572 11.591 -7.226
75 HH TYR 11 HH TYR 11 15.874 13.462 -6.006
76 H LEU 12 H LEU 12 11.546 6.529 -4.071
77 HA LEU 12 HA LEU 12 9.561 5.924 -2.033
78 HB2 LEU 12 2HB LEU 12 9.647 5.900 -4.876
79 HB3 LEU 12 3HB LEU 12 9.262 4.272 -4.321
80 HG LEU 12 HG LEU 12 7.206 5.383 -4.732
81 HD11 LEU 12 1HD1 LEU 12 6.138 4.907 -2.781
82 HD12 LEU 12 2HD1 LEU 12 7.329 5.749 -1.791
83 HD13 LEU 12 3HD1 LEU 12 7.696 4.151 -2.441
84 HD21 LEU 12 3HD2 LEU 12 8.539 7.698 -4.228
85 HD22 LEU 12 1HD2 LEU 12 7.536 7.550 -2.784
86 HD23 LEU 12 2HD2 LEU 12 6.786 7.559 -4.380
87 H GLN 13 H GLN 13 10.250 4.554 -0.506
88 HA GLN 13 HA GLN 13 12.132 2.456 -1.053
89 HB2 GLN 13 2HB GLN 13 11.753 3.795 1.151
90 HB3 GLN 13 3HB GLN 13 10.487 2.613 1.450
91 HG2 GLN 13 2HG GLN 13 12.471 1.896 2.559
92 HG3 GLN 13 3HG GLN 13 12.171 0.815 1.198
93 HE21 GLN 13 1HE2 GLN 13 14.110 0.164 0.563
94 HE22 GLN 13 2HE2 GLN 13 15.440 1.196 0.175
95 H CYS 14 H CYS 14 11.721 0.181 -0.601
96 HA CYS 14 HA CYS 14 8.932 -0.608 -1.127
97 HB2 CYS 14 2HB CYS 14 10.645 -0.794 -3.082
98 HB3 CYS 14 3HB CYS 14 11.248 -2.191 -2.196
99 H CYS 15 H CYS 15 8.198 -2.468 -0.126
100 HA CYS 15 HA CYS 15 9.858 -3.391 2.108
101 HB2 CYS 15 2HB CYS 15 7.044 -2.837 1.769
102 HB3 CYS 15 3HB CYS 15 7.277 -4.486 2.338
103 H ASP 16 H ASP 16 10.913 -5.236 1.868
104 HA ASP 16 HA ASP 16 10.737 -6.984 -0.255
105 HB2 ASP 16 2HB ASP 16 11.909 -7.079 2.452
106 HB3 ASP 16 3HB ASP 16 11.607 -8.649 1.712
107 HA PRO 17 HA PRO 17 11.345 -9.429 -0.118
108 HB2 PRO 17 2HB PRO 17 10.286 -11.102 -1.975
109 HB3 PRO 17 3HB PRO 17 10.571 -11.585 -0.298
110 HG2 PRO 17 2HG PRO 17 8.029 -10.702 -1.608
111 HG3 PRO 17 3HG PRO 17 8.295 -12.032 -0.467
112 HD2 PRO 17 2HD PRO 17 7.273 -9.643 0.293
113 HD3 PRO 17 3HD PRO 17 8.290 -10.630 1.363
114 H TYR 18 H TYR 18 8.611 -7.809 -1.345
115 HA TYR 18 HA TYR 18 9.052 -7.540 -4.040
116 HB2 TYR 18 2HB TYR 18 8.291 -5.200 -2.297
117 HB3 TYR 18 3HB TYR 18 7.800 -5.523 -3.956
118 HD1 TYR 18 HD2 TYR 18 7.107 -8.458 -3.589
119 HD2 TYR 18 HD1 TYR 18 6.160 -5.008 -1.286
120 HE1 TYR 18 HE2 TYR 18 5.071 -9.570 -2.770
121 HE2 TYR 18 HE1 TYR 18 4.122 -6.111 -0.460
122 HH TYR 18 HH TYR 18 3.568 -9.365 -0.699
123 H HIS 19 H HIS 19 11.023 -7.291 -4.904
124 HA HIS 19 HA HIS 19 12.835 -5.280 -3.784
125 HB2 HIS 19 2HB HIS 19 14.571 -6.335 -5.138
126 HB3 HIS 19 3HB HIS 19 13.740 -7.542 -4.161
127 HD1 HIS 19 HD1 HIS 19 12.311 -9.294 -5.401
128 HD2 HIS 19 HD2 HIS 19 14.209 -6.579 -7.907
129 HE1 HIS 19 HE1 HIS 19 12.097 -10.253 -7.716
130 H CYS 20 H CYS 20 13.837 -3.707 -5.118
131 HA CYS 20 HA CYS 20 12.075 -2.634 -7.122
132 HB2 CYS 20 2HB CYS 20 13.526 -1.358 -5.376
133 HB3 CYS 20 3HB CYS 20 14.821 -1.564 -6.551
134 H THR 21 H THR 21 12.847 -1.949 -9.260
135 HA THR 21 HA THR 21 14.746 -3.902 -10.389
136 HB THR 21 HB THR 21 13.497 -3.601 -12.548
137 HG1 THR 21 HG1 THR 21 11.982 -2.137 -12.600
138 HG21 THR 21 3HG2 THR 21 12.263 -4.815 -10.108
139 HG22 THR 21 1HG2 THR 21 12.984 -5.607 -11.508
140 HG23 THR 21 2HG2 THR 21 11.395 -4.854 -11.642
141 H GLN 22 H GLN 22 13.793 -0.570 -10.178
142 HA GLN 22 HA GLN 22 16.309 0.246 -11.346
143 HB2 GLN 22 2HB GLN 22 13.710 0.585 -12.736
144 HB3 GLN 22 3HB GLN 22 14.794 1.970 -12.743
145 HG2 GLN 22 2HG GLN 22 16.558 0.581 -13.715
146 HG3 GLN 22 3HG GLN 22 15.460 -0.798 -13.720
147 HE21 GLN 22 1HE2 GLN 22 16.368 -0.425 -16.059
148 HE22 GLN 22 2HE2 GLN 22 15.302 0.446 -17.102
149 HA PRO 23 HA PRO 23 14.563 2.843 -7.860
150 HB2 PRO 23 2HB PRO 23 16.669 2.493 -6.182
151 HB3 PRO 23 3HB PRO 23 15.282 1.397 -6.226
152 HG2 PRO 23 2HG PRO 23 17.977 1.096 -7.495
153 HG3 PRO 23 3HG PRO 23 17.006 -0.111 -6.632
154 HD2 PRO 23 2HD PRO 23 17.122 0.003 -9.336
155 HD3 PRO 23 3HD PRO 23 15.670 -0.530 -8.464
156 H VAL 24 H VAL 24 17.213 2.796 -9.950
157 HA VAL 24 HA VAL 24 18.257 5.364 -8.998
158 HB VAL 24 HB VAL 24 19.928 3.653 -9.477
159 HG11 VAL 24 1HG1 VAL 24 18.287 2.891 -11.522
160 HG12 VAL 24 2HG1 VAL 24 19.598 3.700 -12.383
161 HG13 VAL 24 3HG1 VAL 24 19.951 2.352 -11.300
162 HG21 VAL 24 3HG2 VAL 24 20.030 6.249 -10.235
163 HG22 VAL 24 1HG2 VAL 24 21.392 5.133 -10.336
164 HG23 VAL 24 2HG2 VAL 24 20.402 5.447 -11.761
165 H ILE 25 H ILE 25 16.673 3.858 -11.753
166 HA ILE 25 HA ILE 25 16.344 6.532 -12.949
167 HB ILE 25 HB ILE 25 16.074 5.395 -15.132
168 HG12 ILE 25 2HG1 ILE 25 16.274 3.031 -13.407
169 HG13 ILE 25 3HG1 ILE 25 15.548 3.203 -15.001
170 HG21 ILE 25 1HG2 ILE 25 18.253 6.322 -14.306
171 HG22 ILE 25 2HG2 ILE 25 18.699 4.679 -13.844
172 HG23 ILE 25 3HG2 ILE 25 18.396 5.067 -15.537
173 HD11 ILE 25 3HD1 ILE 25 18.429 2.691 -14.331
174 HD12 ILE 25 1HD1 ILE 25 17.309 1.643 -15.200
175 HD13 ILE 25 2HD1 ILE 25 17.874 3.140 -15.943
176 H GLY 26 H GLY 26 14.637 5.394 -10.935
177 HA2 GLY 26 2HA GLY 26 12.395 5.174 -10.495
178 HA3 GLY 26 3HA GLY 26 12.122 5.939 -12.054
179 H GLY 27 H GLY 27 12.029 3.024 -10.270
180 HA2 GLY 27 2HA GLY 27 11.140 1.605 -12.702
181 HA3 GLY 27 3HA GLY 27 12.176 0.825 -11.517
182 H ILE 28 H ILE 28 10.816 -0.785 -10.877
183 HA ILE 28 HA ILE 28 8.555 0.044 -9.233
184 HB ILE 28 HB ILE 28 7.199 -1.882 -10.229
185 HG12 ILE 28 2HG1 ILE 28 8.444 -1.478 -12.844
186 HG13 ILE 28 3HG1 ILE 28 9.508 -2.285 -11.698
187 HG21 ILE 28 1HG2 ILE 28 7.310 0.816 -10.794
188 HG22 ILE 28 2HG2 ILE 28 7.291 0.058 -12.385
189 HG23 ILE 28 3HG2 ILE 28 6.006 -0.288 -11.230
190 HD11 ILE 28 3HD1 ILE 28 7.714 -3.940 -11.283
191 HD12 ILE 28 1HD1 ILE 28 6.767 -3.170 -12.554
192 HD13 ILE 28 2HD1 ILE 28 8.310 -3.933 -12.942
193 H CYS 29 H CYS 29 7.573 -2.040 -8.179
194 HA CYS 29 HA CYS 29 9.849 -3.564 -7.125
195 HB2 CYS 29 2HB CYS 29 7.096 -3.010 -6.012
196 HB3 CYS 29 3HB CYS 29 8.221 -4.145 -5.275
197 H ALA 30 H ALA 30 9.940 -5.757 -7.207
198 HA ALA 30 HA ALA 30 7.661 -7.190 -8.386
199 HB1 ALA 30 1HB ALA 30 8.940 -7.104 -10.281
200 HB2 ALA 30 2HB ALA 30 10.460 -7.066 -9.389
201 HB3 ALA 30 3HB ALA 30 9.570 -8.580 -9.549
Start of MODEL 9
1 H1 CYS 1 H CYS 1 6.051 2.476 3.546
2 HA CYS 1 HA CYS 1 7.895 1.490 2.171
3 HB2 CYS 1 2HB CYS 1 7.372 -1.100 1.897
4 HB3 CYS 1 3HB CYS 1 8.438 -0.504 3.165
5 H ALA 2 H ALA 2 7.466 0.400 0.029
6 HA ALA 2 HA ALA 2 4.806 1.205 -0.891
7 HB1 ALA 2 1HB ALA 2 7.443 0.818 -2.252
8 HB2 ALA 2 2HB ALA 2 5.946 0.827 -3.184
9 HB3 ALA 2 3HB ALA 2 6.396 2.237 -2.224
10 H GLN 3 H GLN 3 3.682 -0.140 -2.468
11 HA GLN 3 HA GLN 3 3.799 -2.940 -1.695
12 HB2 GLN 3 2HB GLN 3 1.793 -1.150 -2.926
13 HB3 GLN 3 3HB GLN 3 1.751 -2.827 -3.456
14 HG2 GLN 3 2HG GLN 3 1.589 -3.530 -1.095
15 HG3 GLN 3 3HG GLN 3 1.521 -1.832 -0.626
16 HE21 GLN 3 1HE2 GLN 3 -0.455 -1.241 -0.139
17 HE22 GLN 3 2HE2 GLN 3 -1.903 -1.749 -0.933
18 H LYS 4 H LYS 4 3.719 -4.652 -3.295
19 HA LYS 4 HA LYS 4 5.776 -4.511 -5.172
20 HB2 LYS 4 2HB LYS 4 5.372 -6.717 -5.530
21 HB3 LYS 4 3HB LYS 4 4.387 -6.535 -4.085
22 HG2 LYS 4 2HG LYS 4 3.007 -5.935 -6.604
23 HG3 LYS 4 3HG LYS 4 3.523 -7.611 -6.409
24 HD2 LYS 4 2HD LYS 4 1.352 -7.515 -5.501
25 HD3 LYS 4 3HD LYS 4 2.439 -7.517 -4.110
26 HE2 LYS 4 2HE LYS 4 2.046 -4.822 -4.888
27 HE3 LYS 4 3HE LYS 4 0.462 -5.595 -4.841
28 HZ1 LYS 4 3HZ LYS 4 1.941 -4.672 -2.695
29 HZ2 LYS 4 1HZ LYS 4 1.989 -6.360 -2.587
30 HZ3 LYS 4 2HZ LYS 4 0.502 -5.557 -2.641
31 H GLY 5 H GLY 5 5.514 -4.988 -7.554
32 HA2 GLY 5 2HA GLY 5 4.951 -4.074 -9.594
33 HA3 GLY 5 3HA GLY 5 3.321 -4.512 -9.106
34 H GLU 6 H GLU 6 5.363 -2.087 -7.564
35 HA GLU 6 HA GLU 6 3.601 0.013 -8.629
36 HB2 GLU 6 2HB GLU 6 2.952 0.728 -6.595
37 HB3 GLU 6 3HB GLU 6 3.422 -0.878 -6.057
38 HG2 GLU 6 2HG GLU 6 4.622 0.283 -4.557
39 HG3 GLU 6 3HG GLU 6 5.790 0.360 -5.875
40 H TYR 7 H TYR 7 4.524 2.189 -8.490
41 HA TYR 7 HA TYR 7 7.005 2.421 -9.635
42 HB2 TYR 7 2HB TYR 7 5.085 4.181 -9.178
43 HB3 TYR 7 3HB TYR 7 6.105 4.607 -7.808
44 HD1 TYR 7 HD2 TYR 7 8.556 5.192 -8.303
45 HD2 TYR 7 HD1 TYR 7 5.543 5.038 -11.303
46 HE1 TYR 7 HE2 TYR 7 9.955 6.583 -9.771
47 HE2 TYR 7 HE1 TYR 7 6.935 6.428 -12.780
48 HH TYR 7 HH TYR 7 9.354 8.260 -11.838
49 H CYS 8 H CYS 8 9.071 3.002 -8.904
50 HA CYS 8 HA CYS 8 9.611 2.998 -6.050
51 HB2 CYS 8 2HB CYS 8 9.709 0.637 -6.479
52 HB3 CYS 8 3HB CYS 8 10.691 0.885 -7.920
53 H SER 9 H SER 9 11.469 4.076 -5.508
54 HA SER 9 HA SER 9 13.424 4.764 -7.526
55 HB2 SER 9 2HB SER 9 13.171 7.181 -7.282
56 HB3 SER 9 3HB SER 9 11.662 6.473 -7.858
57 HG SER 9 HG SER 9 12.285 7.552 -5.344
58 H VAL 10 H VAL 10 14.944 6.567 -6.402
59 HA VAL 10 HA VAL 10 16.289 5.268 -4.345
60 HB VAL 10 HB VAL 10 17.496 7.403 -3.985
61 HG11 VAL 10 1HG1 VAL 10 17.305 7.213 -6.931
62 HG12 VAL 10 2HG1 VAL 10 18.719 7.154 -5.878
63 HG13 VAL 10 3HG1 VAL 10 17.694 5.731 -6.060
64 HG21 VAL 10 3HG2 VAL 10 15.320 8.448 -5.764
65 HG22 VAL 10 1HG2 VAL 10 15.898 9.086 -4.225
66 HG23 VAL 10 2HG2 VAL 10 16.890 9.244 -5.674
67 H TYR 11 H TYR 11 13.832 7.794 -4.205
68 HA TYR 11 HA TYR 11 14.004 7.934 -1.307
69 HB2 TYR 11 2HB TYR 11 12.136 9.617 -1.593
70 HB3 TYR 11 3HB TYR 11 13.659 10.038 -2.370
71 HD1 TYR 11 HD2 TYR 11 10.225 8.824 -2.969
72 HD2 TYR 11 HD1 TYR 11 13.810 10.284 -4.736
73 HE1 TYR 11 HE2 TYR 11 9.047 9.110 -5.110
74 HE2 TYR 11 HE1 TYR 11 12.642 10.574 -6.881
75 HH TYR 11 HH TYR 11 9.176 9.880 -7.193
76 H LEU 12 H LEU 12 12.059 6.462 -3.773
77 HA LEU 12 HA LEU 12 9.954 5.743 -1.894
78 HB2 LEU 12 2HB LEU 12 9.988 6.253 -4.603
79 HB3 LEU 12 3HB LEU 12 9.855 4.497 -4.525
80 HG LEU 12 HG LEU 12 7.652 5.326 -4.689
81 HD11 LEU 12 1HD1 LEU 12 6.677 4.271 -2.915
82 HD12 LEU 12 2HD1 LEU 12 7.770 4.996 -1.736
83 HD13 LEU 12 3HD1 LEU 12 8.326 3.668 -2.755
84 HD21 LEU 12 3HD2 LEU 12 6.781 6.995 -3.023
85 HD22 LEU 12 1HD2 LEU 12 7.939 7.630 -4.190
86 HD23 LEU 12 2HD2 LEU 12 8.454 7.278 -2.540
87 H GLN 13 H GLN 13 10.644 4.205 -0.508
88 HA GLN 13 HA GLN 13 12.221 1.960 -1.464
89 HB2 GLN 13 2HB GLN 13 12.259 3.296 0.882
90 HB3 GLN 13 3HB GLN 13 11.191 1.967 1.311
91 HG2 GLN 13 2HG GLN 13 13.488 1.451 1.878
92 HG3 GLN 13 3HG GLN 13 12.893 0.366 0.622
93 HE21 GLN 13 1HE2 GLN 13 14.257 0.006 -0.961
94 HE22 GLN 13 2HE2 GLN 13 15.497 1.077 -1.508
95 H CYS 14 H CYS 14 11.592 -0.260 -0.977
96 HA CYS 14 HA CYS 14 8.669 -0.636 -1.006
97 HB2 CYS 14 2HB CYS 14 10.265 -1.125 -3.142
98 HB3 CYS 14 3HB CYS 14 10.329 -2.689 -2.337
99 H CYS 15 H CYS 15 7.852 -2.474 0.034
100 HA CYS 15 HA CYS 15 9.579 -3.483 2.153
101 HB2 CYS 15 2HB CYS 15 6.761 -2.949 1.862
102 HB3 CYS 15 3HB CYS 15 7.007 -4.608 2.398
103 H ASP 16 H ASP 16 10.607 -5.349 1.957
104 HA ASP 16 HA ASP 16 10.498 -7.069 -0.187
105 HB2 ASP 16 2HB ASP 16 11.626 -7.140 2.510
106 HB3 ASP 16 3HB ASP 16 11.218 -8.739 1.893
107 HA PRO 17 HA PRO 17 11.072 -9.519 -0.071
108 HB2 PRO 17 2HB PRO 17 10.071 -11.148 -1.999
109 HB3 PRO 17 3HB PRO 17 10.284 -11.663 -0.322
110 HG2 PRO 17 2HG PRO 17 7.805 -10.728 -1.716
111 HG3 PRO 17 3HG PRO 17 8.011 -12.081 -0.590
112 HD2 PRO 17 2HD PRO 17 6.985 -9.695 0.173
113 HD3 PRO 17 3HD PRO 17 7.947 -10.713 1.264
114 H TYR 18 H TYR 18 8.410 -7.842 -1.372
115 HA TYR 18 HA TYR 18 8.956 -7.531 -4.043
116 HB2 TYR 18 2HB TYR 18 8.161 -5.218 -2.278
117 HB3 TYR 18 3HB TYR 18 7.740 -5.487 -3.965
118 HD1 TYR 18 HD2 TYR 18 7.001 -8.433 -3.685
119 HD2 TYR 18 HD1 TYR 18 5.972 -5.004 -1.385
120 HE1 TYR 18 HE2 TYR 18 4.913 -9.532 -2.990
121 HE2 TYR 18 HE1 TYR 18 3.883 -6.094 -0.684
122 HH TYR 18 HH TYR 18 2.711 -8.942 -2.156
123 H HIS 19 H HIS 19 10.967 -7.304 -4.822
124 HA HIS 19 HA HIS 19 12.761 -5.336 -3.603
125 HB2 HIS 19 2HB HIS 19 14.512 -6.390 -5.008
126 HB3 HIS 19 3HB HIS 19 13.721 -7.541 -3.934
127 HD1 HIS 19 HD1 HIS 19 12.564 -9.512 -4.997
128 HD2 HIS 19 HD2 HIS 19 13.771 -6.663 -7.769
129 HE1 HIS 19 HE1 HIS 19 12.211 -10.574 -7.249
130 H CYS 20 H CYS 20 13.788 -3.723 -4.836
131 HA CYS 20 HA CYS 20 12.151 -2.701 -6.991
132 HB2 CYS 20 2HB CYS 20 13.197 -1.321 -5.094
133 HB3 CYS 20 3HB CYS 20 14.711 -1.475 -5.981
134 H THR 21 H THR 21 12.982 -2.074 -9.056
135 HA THR 21 HA THR 21 15.040 -3.922 -10.020
136 HB THR 21 HB THR 21 14.209 -3.202 -12.304
137 HG1 THR 21 HG1 THR 21 12.081 -2.224 -12.244
138 HG21 THR 21 3HG2 THR 21 12.665 -4.879 -12.311
139 HG22 THR 21 1HG2 THR 21 11.864 -4.299 -10.852
140 HG23 THR 21 2HG2 THR 21 13.381 -5.191 -10.730
141 H GLN 22 H GLN 22 14.060 -0.595 -10.863
142 HA GLN 22 HA GLN 22 16.869 0.220 -10.707
143 HB2 GLN 22 2HB GLN 22 15.066 0.718 -13.082
144 HB3 GLN 22 3HB GLN 22 16.649 1.448 -12.852
145 HG2 GLN 22 2HG GLN 22 16.748 -1.433 -12.615
146 HG3 GLN 22 3HG GLN 22 16.091 -0.916 -14.166
147 HE21 GLN 22 1HE2 GLN 22 17.996 -1.829 -15.106
148 HE22 GLN 22 2HE2 GLN 22 19.475 -0.938 -15.111
149 HA PRO 23 HA PRO 23 14.071 3.239 -8.619
150 HB2 PRO 23 2HB PRO 23 15.735 3.655 -6.516
151 HB3 PRO 23 3HB PRO 23 14.571 2.326 -6.571
152 HG2 PRO 23 2HG PRO 23 17.506 2.297 -7.154
153 HG3 PRO 23 3HG PRO 23 16.536 1.130 -6.238
154 HD2 PRO 23 2HD PRO 23 17.287 0.704 -8.805
155 HD3 PRO 23 3HD PRO 23 15.757 0.092 -8.144
156 H VAL 24 H VAL 24 17.146 3.271 -10.028
157 HA VAL 24 HA VAL 24 17.734 6.048 -9.441
158 HB VAL 24 HB VAL 24 19.605 4.518 -9.646
159 HG11 VAL 24 1HG1 VAL 24 19.797 2.957 -11.226
160 HG12 VAL 24 2HG1 VAL 24 18.144 3.366 -11.690
161 HG13 VAL 24 3HG1 VAL 24 19.507 4.120 -12.519
162 HG21 VAL 24 3HG2 VAL 24 19.815 6.162 -12.126
163 HG22 VAL 24 1HG2 VAL 24 19.603 6.967 -10.572
164 HG23 VAL 24 2HG2 VAL 24 20.993 5.914 -10.838
165 H ILE 25 H ILE 25 16.427 4.132 -12.075
166 HA ILE 25 HA ILE 25 16.023 6.608 -13.622
167 HB ILE 25 HB ILE 25 15.893 5.250 -15.631
168 HG12 ILE 25 2HG1 ILE 25 15.799 3.062 -13.661
169 HG13 ILE 25 3HG1 ILE 25 15.117 3.150 -15.282
170 HG21 ILE 25 1HG2 ILE 25 18.100 6.052 -14.721
171 HG22 ILE 25 2HG2 ILE 25 18.350 4.419 -14.107
172 HG23 ILE 25 3HG2 ILE 25 18.189 4.693 -15.841
173 HD11 ILE 25 3HD1 ILE 25 16.715 1.424 -15.314
174 HD12 ILE 25 1HD1 ILE 25 17.453 2.791 -16.149
175 HD13 ILE 25 2HD1 ILE 25 17.916 2.417 -14.489
176 H GLY 26 H GLY 26 14.355 5.350 -11.445
177 HA2 GLY 26 2HA GLY 26 12.090 5.310 -11.017
178 HA3 GLY 26 3HA GLY 26 11.819 5.810 -12.681
179 H GLY 27 H GLY 27 12.369 3.049 -10.568
180 HA2 GLY 27 2HA GLY 27 11.364 1.292 -12.718
181 HA3 GLY 27 3HA GLY 27 12.417 0.761 -11.413
182 H ILE 28 H ILE 28 10.890 -0.907 -10.956
183 HA ILE 28 HA ILE 28 8.758 0.023 -9.189
184 HB ILE 28 HB ILE 28 7.317 -1.897 -10.189
185 HG12 ILE 28 2HG1 ILE 28 8.491 -1.200 -12.809
186 HG13 ILE 28 3HG1 ILE 28 9.477 -2.252 -11.801
187 HG21 ILE 28 1HG2 ILE 28 6.976 0.034 -12.191
188 HG22 ILE 28 2HG2 ILE 28 6.117 -0.088 -10.657
189 HG23 ILE 28 3HG2 ILE 28 7.572 0.900 -10.775
190 HD11 ILE 28 3HD1 ILE 28 6.607 -2.922 -12.162
191 HD12 ILE 28 1HD1 ILE 28 7.725 -3.223 -13.491
192 HD13 ILE 28 2HD1 ILE 28 7.997 -3.981 -11.922
193 H CYS 29 H CYS 29 7.718 -1.992 -8.092
194 HA CYS 29 HA CYS 29 9.932 -3.577 -7.049
195 HB2 CYS 29 2HB CYS 29 7.072 -3.459 -6.073
196 HB3 CYS 29 3HB CYS 29 8.455 -4.136 -5.218
197 H ALA 30 H ALA 30 9.985 -5.812 -7.033
198 HA ALA 30 HA ALA 30 7.860 -7.262 -8.424
199 HB1 ALA 30 1HB ALA 30 9.992 -8.494 -9.524
200 HB2 ALA 30 2HB ALA 30 9.095 -7.193 -10.306
201 HB3 ALA 30 3HB ALA 30 10.589 -6.837 -9.441
Start of MODEL 10
1 H1 CYS 1 H CYS 1 7.962 2.296 4.129
2 HA CYS 1 HA CYS 1 8.506 1.549 2.023
3 HB2 CYS 1 2HB CYS 1 7.910 -1.010 1.873
4 HB3 CYS 1 3HB CYS 1 9.104 -0.437 3.034
5 H ALA 2 H ALA 2 7.639 0.143 0.086
6 HA ALA 2 HA ALA 2 4.832 0.918 -0.380
7 HB1 ALA 2 1HB ALA 2 7.117 0.915 -2.347
8 HB2 ALA 2 2HB ALA 2 5.429 1.225 -2.756
9 HB3 ALA 2 3HB ALA 2 6.294 2.328 -1.687
10 H GLN 3 H GLN 3 3.699 -0.400 -2.004
11 HA GLN 3 HA GLN 3 4.324 -3.212 -1.609
12 HB2 GLN 3 2HB GLN 3 1.929 -1.640 -2.201
13 HB3 GLN 3 3HB GLN 3 2.037 -3.119 -3.145
14 HG2 GLN 3 2HG GLN 3 1.112 -4.124 -1.395
15 HG3 GLN 3 3HG GLN 3 2.685 -3.964 -0.617
16 HE21 GLN 3 1HE2 GLN 3 -0.237 -3.853 0.274
17 HE22 GLN 3 2HE2 GLN 3 -0.301 -2.444 1.271
18 H LYS 4 H LYS 4 4.435 -4.728 -3.330
19 HA LYS 4 HA LYS 4 6.101 -4.055 -5.431
20 HB2 LYS 4 2HB LYS 4 5.142 -6.228 -6.483
21 HB3 LYS 4 3HB LYS 4 6.024 -6.328 -4.965
22 HG2 LYS 4 2HG LYS 4 4.077 -7.710 -4.823
23 HG3 LYS 4 3HG LYS 4 3.858 -6.318 -3.761
24 HD2 LYS 4 2HD LYS 4 2.872 -5.840 -6.457
25 HD3 LYS 4 3HD LYS 4 2.077 -7.209 -5.676
26 HE2 LYS 4 2HE LYS 4 2.291 -4.385 -4.643
27 HE3 LYS 4 3HE LYS 4 0.833 -5.212 -5.191
28 HZ1 LYS 4 3HZ LYS 4 0.573 -5.633 -3.019
29 HZ2 LYS 4 1HZ LYS 4 2.204 -5.375 -2.649
30 HZ3 LYS 4 2HZ LYS 4 1.704 -6.866 -3.273
31 H GLY 5 H GLY 5 5.384 -4.671 -7.830
32 HA2 GLY 5 2HA GLY 5 4.352 -3.850 -9.710
33 HA3 GLY 5 3HA GLY 5 2.862 -4.088 -8.809
34 H GLU 6 H GLU 6 5.206 -1.915 -7.513
35 HA GLU 6 HA GLU 6 3.676 0.380 -8.541
36 HB2 GLU 6 2HB GLU 6 4.700 0.076 -5.712
37 HB3 GLU 6 3HB GLU 6 3.817 1.452 -6.356
38 HG2 GLU 6 2HG GLU 6 2.427 -1.089 -6.698
39 HG3 GLU 6 3HG GLU 6 2.721 -0.656 -5.014
40 H TYR 7 H TYR 7 4.834 2.390 -8.604
41 HA TYR 7 HA TYR 7 7.434 2.164 -9.621
42 HB2 TYR 7 2HB TYR 7 5.779 4.027 -10.060
43 HB3 TYR 7 3HB TYR 7 6.215 4.685 -8.487
44 HD1 TYR 7 HD1 TYR 7 7.829 3.554 -11.663
45 HD2 TYR 7 HD2 TYR 7 7.897 6.268 -8.387
46 HE1 TYR 7 HE1 TYR 7 9.722 4.739 -12.692
47 HE2 TYR 7 HE2 TYR 7 9.790 7.461 -9.408
48 HH TYR 7 HH TYR 7 10.601 7.493 -12.302
49 H CYS 8 H CYS 8 9.340 1.979 -8.656
50 HA CYS 8 HA CYS 8 9.564 2.774 -5.827
51 HB2 CYS 8 2HB CYS 8 9.696 0.366 -6.011
52 HB3 CYS 8 3HB CYS 8 10.904 0.490 -7.285
53 H SER 9 H SER 9 11.361 3.904 -5.179
54 HA SER 9 HA SER 9 13.624 4.320 -6.875
55 HB2 SER 9 2HB SER 9 13.323 6.696 -7.301
56 HB3 SER 9 3HB SER 9 11.957 5.804 -7.968
57 HG SER 9 HG SER 9 10.729 6.976 -6.750
58 H VAL 10 H VAL 10 14.876 6.384 -5.913
59 HA VAL 10 HA VAL 10 15.764 5.696 -3.395
60 HB VAL 10 HB VAL 10 16.712 8.010 -3.258
61 HG11 VAL 10 1HG1 VAL 10 17.792 6.078 -4.456
62 HG12 VAL 10 2HG1 VAL 10 17.154 6.750 -5.957
63 HG13 VAL 10 3HG1 VAL 10 18.301 7.679 -4.992
64 HG21 VAL 10 3HG2 VAL 10 16.444 9.501 -5.170
65 HG22 VAL 10 1HG2 VAL 10 15.314 8.366 -5.908
66 HG23 VAL 10 2HG2 VAL 10 14.889 9.180 -4.402
67 H TYR 11 H TYR 11 13.058 7.702 -4.294
68 HA TYR 11 HA TYR 11 12.655 8.583 -1.543
69 HB2 TYR 11 2HB TYR 11 10.893 9.196 -3.913
70 HB3 TYR 11 3HB TYR 11 11.011 10.079 -2.395
71 HD1 TYR 11 HD2 TYR 11 13.437 11.031 -1.880
72 HD2 TYR 11 HD1 TYR 11 11.983 10.054 -5.758
73 HE1 TYR 11 HE2 TYR 11 15.107 12.535 -2.879
74 HE2 TYR 11 HE1 TYR 11 13.650 11.555 -6.768
75 HH TYR 11 HH TYR 11 15.662 12.644 -6.311
76 H LEU 12 H LEU 12 11.198 6.502 -3.974
77 HA LEU 12 HA LEU 12 8.998 5.800 -2.207
78 HB2 LEU 12 2HB LEU 12 9.644 5.453 -5.052
79 HB3 LEU 12 3HB LEU 12 8.788 4.100 -4.314
80 HG LEU 12 HG LEU 12 7.535 6.622 -3.653
81 HD11 LEU 12 1HD1 LEU 12 7.199 6.021 -6.530
82 HD12 LEU 12 2HD1 LEU 12 8.664 6.880 -6.055
83 HD13 LEU 12 3HD1 LEU 12 7.081 7.554 -5.666
84 HD21 LEU 12 3HD2 LEU 12 6.123 4.726 -5.370
85 HD22 LEU 12 1HD2 LEU 12 5.702 5.347 -3.774
86 HD23 LEU 12 2HD2 LEU 12 6.824 3.994 -3.926
87 H GLN 13 H GLN 13 10.033 4.734 -0.513
88 HA GLN 13 HA GLN 13 11.908 2.655 -0.833
89 HB2 GLN 13 2HB GLN 13 11.322 4.017 1.276
90 HB3 GLN 13 3HB GLN 13 10.020 2.856 1.501
91 HG2 GLN 13 2HG GLN 13 11.939 2.230 2.820
92 HG3 GLN 13 3HG GLN 13 11.657 1.038 1.552
93 HE21 GLN 13 1HE2 GLN 13 13.529 0.281 0.886
94 HE22 GLN 13 2HE2 GLN 13 14.942 1.214 0.545
95 H CYS 14 H CYS 14 11.654 0.390 -0.550
96 HA CYS 14 HA CYS 14 8.941 -0.616 -1.099
97 HB2 CYS 14 2HB CYS 14 10.640 -0.585 -3.070
98 HB3 CYS 14 3HB CYS 14 11.380 -1.948 -2.237
99 H CYS 15 H CYS 15 8.324 -2.448 -0.040
100 HA CYS 15 HA CYS 15 10.153 -3.399 2.045
101 HB2 CYS 15 2HB CYS 15 7.313 -2.871 1.930
102 HB3 CYS 15 3HB CYS 15 7.615 -4.523 2.458
103 H ASP 16 H ASP 16 11.154 -5.268 1.759
104 HA ASP 16 HA ASP 16 10.876 -6.952 -0.409
105 HB2 ASP 16 2HB ASP 16 12.259 -7.026 2.154
106 HB3 ASP 16 3HB ASP 16 11.771 -8.631 1.615
107 HA PRO 17 HA PRO 17 11.482 -9.412 -0.340
108 HB2 PRO 17 2HB PRO 17 10.341 -11.045 -2.184
109 HB3 PRO 17 3HB PRO 17 10.690 -11.560 -0.529
110 HG2 PRO 17 2HG PRO 17 8.102 -10.640 -1.722
111 HG3 PRO 17 3HG PRO 17 8.406 -11.993 -0.617
112 HD2 PRO 17 2HD PRO 17 7.428 -9.613 0.228
113 HD3 PRO 17 3HD PRO 17 8.481 -10.625 1.238
114 H TYR 18 H TYR 18 8.720 -7.742 -1.418
115 HA TYR 18 HA TYR 18 9.012 -7.426 -4.119
116 HB2 TYR 18 2HB TYR 18 8.439 -5.112 -2.269
117 HB3 TYR 18 3HB TYR 18 7.871 -5.337 -3.918
118 HD1 TYR 18 HD1 TYR 18 7.125 -8.301 -3.572
119 HD2 TYR 18 HD2 TYR 18 6.299 -4.832 -1.251
120 HE1 TYR 18 HE1 TYR 18 5.075 -9.364 -2.721
121 HE2 TYR 18 HE2 TYR 18 4.249 -5.886 -0.394
122 HH TYR 18 HH TYR 18 2.674 -8.134 -1.649
123 H HIS 19 H HIS 19 10.932 -7.234 -5.105
124 HA HIS 19 HA HIS 19 12.858 -5.264 -4.092
125 HB2 HIS 19 2HB HIS 19 14.488 -6.400 -5.567
126 HB3 HIS 19 3HB HIS 19 13.758 -7.504 -4.403
127 HD1 HIS 19 HD1 HIS 19 12.175 -9.329 -5.332
128 HD2 HIS 19 HD2 HIS 19 13.888 -6.916 -8.247
129 HE1 HIS 19 HE1 HIS 19 11.740 -10.500 -7.513
130 H CYS 20 H CYS 20 13.514 -3.537 -5.282
131 HA CYS 20 HA CYS 20 11.818 -2.694 -7.431
132 HB2 CYS 20 2HB CYS 20 14.382 -1.369 -6.553
133 HB3 CYS 20 3HB CYS 20 12.995 -0.625 -7.344
134 H THR 21 H THR 21 12.430 -2.221 -9.572
135 HA THR 21 HA THR 21 14.582 -3.943 -10.565
136 HB THR 21 HB THR 21 13.528 -3.532 -12.813
137 HG1 THR 21 HG1 THR 21 11.235 -2.762 -12.519
138 HG21 THR 21 3HG2 THR 21 12.455 -5.447 -12.439
139 HG22 THR 21 1HG2 THR 21 11.233 -4.619 -11.476
140 HG23 THR 21 2HG2 THR 21 12.706 -5.212 -10.710
141 H GLN 22 H GLN 22 13.667 -0.620 -10.249
142 HA GLN 22 HA GLN 22 16.266 0.212 -11.202
143 HB2 GLN 22 2HB GLN 22 13.720 0.963 -12.623
144 HB3 GLN 22 3HB GLN 22 15.157 1.974 -12.703
145 HG2 GLN 22 2HG GLN 22 15.546 0.748 -14.546
146 HG3 GLN 22 3HG GLN 22 16.250 -0.365 -13.374
147 HE21 GLN 22 1HE2 GLN 22 15.866 -2.168 -14.628
148 HE22 GLN 22 2HE2 GLN 22 14.282 -2.805 -14.883
149 HA PRO 23 HA PRO 23 14.781 2.648 -7.613
150 HB2 PRO 23 2HB PRO 23 17.235 2.842 -6.469
151 HB3 PRO 23 3HB PRO 23 16.176 1.445 -6.241
152 HG2 PRO 23 2HG PRO 23 18.502 1.777 -8.097
153 HG3 PRO 23 3HG PRO 23 18.068 0.387 -7.084
154 HD2 PRO 23 2HD PRO 23 17.535 0.479 -9.737
155 HD3 PRO 23 3HD PRO 23 16.489 -0.371 -8.582
156 H VAL 24 H VAL 24 17.910 3.172 -9.254
157 HA VAL 24 HA VAL 24 17.456 6.067 -9.100
158 HB VAL 24 HB VAL 24 19.631 5.122 -8.290
159 HG11 VAL 24 1HG1 VAL 24 19.749 3.399 -10.133
160 HG12 VAL 24 2HG1 VAL 24 20.268 4.704 -11.202
161 HG13 VAL 24 3HG1 VAL 24 21.244 4.270 -9.797
162 HG21 VAL 24 3HG2 VAL 24 20.689 6.769 -10.374
163 HG22 VAL 24 1HG2 VAL 24 19.125 7.404 -9.863
164 HG23 VAL 24 2HG2 VAL 24 20.409 7.167 -8.679
165 H ILE 25 H ILE 25 16.564 3.776 -11.125
166 HA ILE 25 HA ILE 25 17.067 5.422 -13.517
167 HB ILE 25 HB ILE 25 16.508 2.911 -14.508
168 HG12 ILE 25 2HG1 ILE 25 16.996 2.273 -11.983
169 HG13 ILE 25 3HG1 ILE 25 17.570 1.263 -13.304
170 HG21 ILE 25 1HG2 ILE 25 19.069 4.414 -14.082
171 HG22 ILE 25 2HG2 ILE 25 19.026 2.881 -14.950
172 HG23 ILE 25 3HG2 ILE 25 18.109 4.260 -15.553
173 HD11 ILE 25 3HD1 ILE 25 19.140 1.986 -11.322
174 HD12 ILE 25 1HD1 ILE 25 19.746 1.828 -12.970
175 HD13 ILE 25 2HD1 ILE 25 19.351 3.421 -12.324
176 H GLY 26 H GLY 26 14.792 4.869 -11.401
177 HA2 GLY 26 2HA GLY 26 12.505 5.086 -11.446
178 HA3 GLY 26 3HA GLY 26 12.653 5.499 -13.148
179 H GLY 27 H GLY 27 11.863 3.055 -10.864
180 HA2 GLY 27 2HA GLY 27 10.836 1.393 -13.029
181 HA3 GLY 27 3HA GLY 27 12.036 0.653 -11.981
182 H ILE 28 H ILE 28 10.450 -0.907 -11.375
183 HA ILE 28 HA ILE 28 8.680 0.086 -9.258
184 HB ILE 28 HB ILE 28 6.955 -1.597 -9.970
185 HG12 ILE 28 2HG1 ILE 28 7.698 -1.607 -12.759
186 HG13 ILE 28 3HG1 ILE 28 8.973 -2.337 -11.789
187 HG21 ILE 28 1HG2 ILE 28 6.569 -0.054 -12.213
188 HG22 ILE 28 2HG2 ILE 28 6.063 0.357 -10.576
189 HG23 ILE 28 3HG2 ILE 28 7.596 0.961 -11.202
190 HD11 ILE 28 3HD1 ILE 28 7.249 -3.915 -12.674
191 HD12 ILE 28 1HD1 ILE 28 7.496 -3.974 -10.929
192 HD13 ILE 28 2HD1 ILE 28 6.088 -3.144 -11.594
193 H CYS 29 H CYS 29 7.648 -2.045 -8.184
194 HA CYS 29 HA CYS 29 9.956 -3.738 -7.511
195 HB2 CYS 29 2HB CYS 29 7.563 -2.823 -5.946
196 HB3 CYS 29 3HB CYS 29 8.449 -4.264 -5.458
197 H ALA 30 H ALA 30 9.676 -5.989 -7.245
198 HA ALA 30 HA ALA 30 7.230 -7.097 -8.453
199 HB1 ALA 30 1HB ALA 30 9.984 -7.343 -9.365
200 HB2 ALA 30 2HB ALA 30 9.185 -8.901 -9.147
201 HB3 ALA 30 3HB ALA 30 8.474 -7.688 -10.210