NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | cing | in_recoord | in_dress | stage | position | program | type |
|
|
1458 |
1alg   |
cing | recoord | dress | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H GLN 1 H GLN 1 80.960 36.026 13.534
2 HA GLN 1 HA GLN 1 82.796 37.032 14.851
3 1HB GLN 1 2HB GLN 1 80.076 36.869 15.941
4 2HB GLN 1 1HB GLN 1 81.295 37.180 17.177
5 1HG GLN 1 2HG GLN 1 80.829 39.347 16.458
6 2HG GLN 1 1HG GLN 1 82.197 38.935 15.426
7 1HE2 GLN 1 2HE2 GLN 1 78.530 39.517 13.766
8 2HE2 GLN 1 1HE2 GLN 1 78.747 39.597 15.451
9 H GLY 2 H GLY 2 84.024 36.930 16.903
10 1HA GLY 2 2HA GLY 2 83.949 34.353 18.362
11 2HA GLY 2 1HA GLY 2 85.437 34.721 17.489
12 H LEU 3 H LEU 3 86.607 36.694 18.106
13 HA LEU 3 HA LEU 3 85.828 37.988 20.642
14 1HB LEU 3 2HB LEU 3 87.211 35.817 21.079
15 2HB LEU 3 1HB LEU 3 88.579 36.764 20.493
16 HG LEU 3 HG LEU 3 87.803 38.566 22.183
17 1HD1 LEU 3 2HD1 LEU 3 85.592 37.323 22.556
18 2HD1 LEU 3 1HD1 LEU 3 86.523 36.163 23.503
19 3HD1 LEU 3 3HD1 LEU 3 86.442 37.851 24.008
20 1HD2 LEU 3 1HD2 LEU 3 88.894 35.902 23.149
21 2HD2 LEU 3 3HD2 LEU 3 89.844 37.223 22.468
22 3HD2 LEU 3 2HD2 LEU 3 89.030 37.431 24.018
23 H GLY 4 H GLY 4 85.804 39.349 18.371
24 1HA GLY 4 2HA GLY 4 88.424 40.539 17.760
25 2HA GLY 4 1HA GLY 4 86.891 40.957 16.996
26 H CYS 5 H CYS 5 86.573 43.102 17.354
27 HA CYS 5 HA CYS 5 87.460 44.373 19.856
28 1HB CYS 5 2HB CYS 5 87.647 45.470 17.587
29 2HB CYS 5 1HB CYS 5 85.889 45.606 17.577
30 HG CYS 5 HG CYS 5 87.674 47.002 19.740
31 H ASP 6 H ASP 6 84.342 43.766 18.201
32 HA ASP 6 HA ASP 6 82.785 44.887 20.390
33 1HB ASP 6 2HB ASP 6 82.101 44.652 17.899
34 2HB ASP 6 1HB ASP 6 81.707 42.983 18.312
35 H GLU 7 H GLU 7 83.666 41.587 19.353
36 HA GLU 7 HA GLU 7 82.062 40.202 21.281
37 1HB GLU 7 2HB GLU 7 84.658 39.390 19.940
38 2HB GLU 7 1HB GLU 7 83.641 38.299 20.881
39 1HG GLU 7 2HG GLU 7 82.617 37.869 18.898
40 2HG GLU 7 1HG GLU 7 81.811 39.415 19.160
41 H MET 8 H MET 8 85.502 41.241 21.406
42 HA MET 8 HA MET 8 85.979 40.257 24.058
43 1HB MET 8 2HB MET 8 87.967 41.591 24.052
44 2HB MET 8 1HB MET 8 87.740 41.064 22.387
45 1HG MET 8 2HG MET 8 86.701 43.228 21.836
46 2HG MET 8 1HG MET 8 86.908 43.759 23.504
47 1HE MET 8 1HE MET 8 87.639 45.596 21.859
48 2HE MET 8 3HE MET 8 88.741 45.899 23.209
49 3HE MET 8 2HE MET 8 89.343 45.919 21.553
50 H LEU 9 H LEU 9 84.719 43.340 22.826
51 HA LEU 9 HA LEU 9 84.577 44.752 25.297
52 1HB LEU 9 2HB LEU 9 84.253 46.049 23.359
53 2HB LEU 9 1HB LEU 9 83.107 44.903 22.671
54 HG LEU 9 HG LEU 9 81.572 45.503 24.642
55 1HD1 LEU 9 2HD1 LEU 9 83.582 47.768 24.792
56 2HD1 LEU 9 1HD1 LEU 9 82.001 47.790 25.573
57 3HD1 LEU 9 3HD1 LEU 9 83.211 46.605 26.065
58 1HD2 LEU 9 3HD2 LEU 9 81.257 46.277 22.294
59 2HD2 LEU 9 2HD2 LEU 9 80.717 47.474 23.472
60 3HD2 LEU 9 1HD2 LEU 9 82.262 47.682 22.648
61 H GLN 10 H GLN 10 82.272 42.559 23.677
62 HA GLN 10 HA GLN 10 80.178 42.804 25.633
63 1HB GLN 10 2HB GLN 10 80.857 40.521 23.750
64 2HB GLN 10 1HB GLN 10 79.370 40.627 24.691
65 1HG GLN 10 2HG GLN 10 80.292 42.448 22.461
66 2HG GLN 10 1HG GLN 10 78.822 41.483 22.532
67 1HE2 GLN 10 2HE2 GLN 10 78.863 45.195 24.150
68 2HE2 GLN 10 1HE2 GLN 10 80.223 44.556 23.356
69 H GLY 11 H GLY 11 83.112 40.834 25.459
70 1HA GLY 11 2HA GLY 11 82.439 39.004 27.578
71 2HA GLY 11 1HA GLY 11 84.073 39.364 27.018
72 H PHE 12 H PHE 12 83.786 42.269 27.514
73 HA PHE 12 HA PHE 12 84.467 42.243 30.372
74 1HB PHE 12 2HB PHE 12 84.143 44.733 28.688
75 2HB PHE 12 1HB PHE 12 85.197 44.480 30.077
76 HD1 PHE 12 HD2 PHE 12 86.346 41.788 29.338
77 HD2 PHE 12 HD1 PHE 12 85.696 45.332 26.996
78 HE1 PHE 12 HE2 PHE 12 88.164 41.106 27.799
79 HE2 PHE 12 HE1 PHE 12 87.515 44.647 25.457
80 HZ PHE 12 HZ PHE 12 88.742 42.531 25.857
81 H ALA 13 H ALA 13 81.847 43.417 28.297
82 HA ALA 13 HA ALA 13 80.363 44.837 30.293
83 1HB ALA 13 2HB ALA 13 79.482 43.402 27.770
84 2HB ALA 13 1HB ALA 13 78.418 44.424 28.737
85 3HB ALA 13 3HB ALA 13 79.831 45.122 27.945
86 H VAL 14 H VAL 14 80.276 41.430 29.224
87 HA VAL 14 HA VAL 14 78.159 40.693 31.081
88 HB VAL 14 HB VAL 14 78.604 39.433 28.974
89 1HG1 VAL 14 1HG1 VAL 14 81.108 39.593 29.123
90 2HG1 VAL 14 3HG1 VAL 14 81.062 38.405 30.423
91 3HG1 VAL 14 2HG1 VAL 14 80.526 37.961 28.804
92 1HG2 VAL 14 2HG2 VAL 14 77.476 38.402 30.988
93 2HG2 VAL 14 1HG2 VAL 14 78.259 37.238 29.919
94 3HG2 VAL 14 3HG2 VAL 14 79.037 37.710 31.430
95 H ALA 15 H ALA 15 81.712 40.567 31.127
96 HA ALA 15 HA ALA 15 81.971 39.039 33.546
97 1HB ALA 15 1HB ALA 15 83.769 39.727 31.770
98 2HB ALA 15 3HB ALA 15 83.944 41.168 32.770
99 3HB ALA 15 2HB ALA 15 84.244 39.573 33.460
100 H VAL 16 H VAL 16 82.101 42.572 32.972
101 HA VAL 16 HA VAL 16 82.311 43.259 35.740
102 HB VAL 16 HB VAL 16 82.813 44.780 33.768
103 1HG1 VAL 16 3HG1 VAL 16 80.617 44.278 32.609
104 2HG1 VAL 16 2HG1 VAL 16 79.826 45.281 33.825
105 3HG1 VAL 16 1HG1 VAL 16 81.012 45.992 32.731
106 1HG2 VAL 16 1HG2 VAL 16 82.561 45.532 36.171
107 2HG2 VAL 16 3HG2 VAL 16 82.216 46.781 34.975
108 3HG2 VAL 16 2HG2 VAL 16 80.891 45.955 35.795
109 H LYS 17 H LYS 17 79.537 42.601 33.664
110 HA LYS 17 HA LYS 17 77.538 43.566 35.530
111 1HB LYS 17 2HB LYS 17 77.028 43.341 33.145
112 2HB LYS 17 1HB LYS 17 77.338 41.608 33.220
113 1HG LYS 17 2HG LYS 17 74.938 41.954 33.321
114 2HG LYS 17 1HG LYS 17 75.485 41.410 34.907
115 1HD LYS 17 2HD LYS 17 75.748 44.109 35.190
116 2HD LYS 17 1HD LYS 17 74.373 44.031 34.089
117 1HE LYS 17 2HE LYS 17 73.245 43.845 36.094
118 2HE LYS 17 1HE LYS 17 73.584 42.139 35.803
119 1HZ LYS 17 1HZ LYS 17 75.615 42.383 37.140
120 2HZ LYS 17 3HZ LYS 17 75.195 43.993 37.476
121 3HZ LYS 17 2HZ LYS 17 74.211 42.727 38.036
122 H MET 18 H MET 18 79.004 40.386 34.859
123 HA MET 18 HA MET 18 77.338 38.997 36.813
124 1HB MET 18 2HB MET 18 79.807 38.239 35.240
125 2HB MET 18 1HB MET 18 79.109 37.162 36.449
126 1HG MET 18 2HG MET 18 77.454 38.353 34.217
127 2HG MET 18 1HG MET 18 78.316 36.826 34.033
128 1HE MET 18 3HE MET 18 77.630 34.652 34.858
129 2HE MET 18 2HE MET 18 75.906 34.374 35.098
130 3HE MET 18 1HE MET 18 76.461 35.233 33.663
131 H GLY 19 H GLY 19 80.789 39.978 36.719
132 1HA GLY 19 2HA GLY 19 82.023 40.859 38.577
133 2HA GLY 19 1HA GLY 19 80.733 40.331 39.658
134 H ALA 20 H ALA 20 83.148 38.898 37.424
135 HA ALA 20 HA ALA 20 83.811 36.922 39.551
136 1HB ALA 20 2HB ALA 20 82.538 36.356 36.955
137 2HB ALA 20 1HB ALA 20 83.970 35.379 37.279
138 3HB ALA 20 3HB ALA 20 82.617 35.363 38.410
139 H THR 21 H THR 21 84.697 37.659 36.139
140 HA THR 21 HA THR 21 87.473 38.201 37.029
141 HB THR 21 HB THR 21 87.295 35.745 36.500
142 HG1 THR 21 HG1 THR 21 89.300 36.301 36.162
143 1HG2 THR 21 1HG2 THR 21 85.881 36.744 34.238
144 2HG2 THR 21 3HG2 THR 21 87.344 35.959 33.646
145 3HG2 THR 21 2HG2 THR 21 86.212 35.064 34.658
146 H LYS 22 H LYS 22 88.563 38.244 34.357
147 HA LYS 22 HA LYS 22 87.687 40.865 33.517
148 1HB LYS 22 2HB LYS 22 89.325 40.622 31.712
149 2HB LYS 22 1HB LYS 22 90.020 40.066 33.233
150 1HG LYS 22 2HG LYS 22 89.414 37.720 32.599
151 2HG LYS 22 1HG LYS 22 88.863 38.323 31.036
152 1HD LYS 22 2HD LYS 22 91.068 39.081 30.456
153 2HD LYS 22 1HD LYS 22 91.661 38.793 32.092
154 1HE LYS 22 2HE LYS 22 90.445 36.447 30.748
155 2HE LYS 22 1HE LYS 22 91.964 37.017 30.055
156 1HZ LYS 22 2HZ LYS 22 92.949 36.929 32.276
157 2HZ LYS 22 1HZ LYS 22 91.492 36.321 32.906
158 3HZ LYS 22 3HZ LYS 22 92.379 35.405 31.788
159 H ALA 23 H ALA 23 86.900 37.609 32.455
160 HA ALA 23 HA ALA 23 84.821 38.754 30.669
161 1HB ALA 23 3HB ALA 23 86.775 38.247 29.233
162 2HB ALA 23 2HB ALA 23 86.766 36.584 29.821
163 3HB ALA 23 1HB ALA 23 85.413 37.188 28.864
164 H ASP 24 H ASP 24 82.917 37.829 31.242
165 HA ASP 24 HA ASP 24 82.916 34.961 32.086
166 1HB ASP 24 2HB ASP 24 81.406 37.226 33.434
167 2HB ASP 24 1HB ASP 24 81.237 35.516 33.829
Start of MODEL 2
1 H GLN 1 H GLN 1 77.155 34.756 18.823
2 HA GLN 1 HA GLN 1 79.253 36.677 17.889
3 1HB GLN 1 2HB GLN 1 77.694 36.631 20.484
4 2HB GLN 1 1HB GLN 1 79.213 37.511 20.316
5 1HG GLN 1 2HG GLN 1 77.973 38.448 18.128
6 2HG GLN 1 1HG GLN 1 76.547 38.078 19.098
7 1HE2 GLN 1 2HE2 GLN 1 78.969 41.184 20.174
8 2HE2 GLN 1 1HE2 GLN 1 79.426 40.136 18.913
9 H GLY 2 H GLY 2 81.216 35.710 17.973
10 1HA GLY 2 2HA GLY 2 81.687 33.611 20.060
11 2HA GLY 2 1HA GLY 2 82.459 33.601 18.474
12 H LEU 3 H LEU 3 83.958 35.415 17.999
13 HA LEU 3 HA LEU 3 84.950 36.977 20.288
14 1HB LEU 3 2HB LEU 3 86.130 34.477 19.668
15 2HB LEU 3 1HB LEU 3 87.243 35.708 19.071
16 HG LEU 3 HG LEU 3 86.060 36.170 21.766
17 1HD1 LEU 3 1HD1 LEU 3 86.637 33.740 21.765
18 2HD1 LEU 3 3HD1 LEU 3 88.284 34.162 21.295
19 3HD1 LEU 3 2HD1 LEU 3 87.653 34.680 22.858
20 1HD2 LEU 3 1HD2 LEU 3 87.674 37.724 20.672
21 2HD2 LEU 3 3HD2 LEU 3 88.306 37.065 22.181
22 3HD2 LEU 3 2HD2 LEU 3 88.868 36.426 20.637
23 H GLY 4 H GLY 4 85.510 38.957 19.512
24 1HA GLY 4 2HA GLY 4 87.052 39.425 17.154
25 2HA GLY 4 1HA GLY 4 85.347 39.666 16.770
26 H CYS 5 H CYS 5 85.062 41.850 16.708
27 HA CYS 5 HA CYS 5 86.473 43.617 18.593
28 1HB CYS 5 2HB CYS 5 86.073 44.194 16.162
29 2HB CYS 5 1HB CYS 5 84.361 44.360 16.551
30 HG CYS 5 HG CYS 5 86.469 46.097 18.071
31 H ASP 6 H ASP 6 83.074 42.736 17.883
32 HA ASP 6 HA ASP 6 82.097 44.269 20.181
33 1HB ASP 6 2HB ASP 6 80.842 43.797 17.962
34 2HB ASP 6 1HB ASP 6 80.497 42.214 18.659
35 H GLU 7 H GLU 7 82.683 40.836 19.419
36 HA GLU 7 HA GLU 7 81.475 39.762 21.785
37 1HB GLU 7 2HB GLU 7 83.767 38.670 20.125
38 2HB GLU 7 1HB GLU 7 82.855 37.752 21.322
39 1HG GLU 7 2HG GLU 7 81.409 37.228 19.673
40 2HG GLU 7 1HG GLU 7 80.896 38.913 19.693
41 H MET 8 H MET 8 84.847 40.783 21.107
42 HA MET 8 HA MET 8 85.875 40.069 23.693
43 1HB MET 8 2HB MET 8 87.788 41.416 23.150
44 2HB MET 8 1HB MET 8 87.258 40.680 21.640
45 1HG MET 8 2HG MET 8 86.070 42.753 21.039
46 2HG MET 8 1HG MET 8 86.579 43.492 22.557
47 1HE MET 8 3HE MET 8 86.872 45.027 20.460
48 2HE MET 8 2HE MET 8 88.193 45.623 21.463
49 3HE MET 8 1HE MET 8 88.469 45.306 19.752
50 H LEU 9 H LEU 9 84.344 43.013 22.426
51 HA LEU 9 HA LEU 9 84.670 44.671 24.724
52 1HB LEU 9 2HB LEU 9 83.953 45.795 22.795
53 2HB LEU 9 1HB LEU 9 82.749 44.568 22.410
54 HG LEU 9 HG LEU 9 81.531 45.305 24.540
55 1HD1 LEU 9 3HD1 LEU 9 83.463 47.620 24.208
56 2HD1 LEU 9 2HD1 LEU 9 82.041 47.643 25.251
57 3HD1 LEU 9 1HD1 LEU 9 83.365 46.529 25.590
58 1HD2 LEU 9 3HD2 LEU 9 80.859 45.905 22.203
59 2HD2 LEU 9 2HD2 LEU 9 80.434 47.145 23.383
60 3HD2 LEU 9 1HD2 LEU 9 81.837 47.367 22.337
61 H GLN 10 H GLN 10 82.118 42.352 23.806
62 HA GLN 10 HA GLN 10 80.417 42.803 26.068
63 1HB GLN 10 2HB GLN 10 80.814 40.315 24.375
64 2HB GLN 10 1HB GLN 10 79.514 40.524 25.546
65 1HG GLN 10 2HG GLN 10 79.989 42.108 23.011
66 2HG GLN 10 1HG GLN 10 78.596 41.106 23.407
67 1HE2 GLN 10 2HE2 GLN 10 78.696 44.964 24.627
68 2HE2 GLN 10 1HE2 GLN 10 79.938 44.296 23.677
69 H GLY 11 H GLY 11 83.329 40.840 25.625
70 1HA GLY 11 2HA GLY 11 83.066 39.290 28.043
71 2HA GLY 11 1HA GLY 11 84.569 39.559 27.158
72 H PHE 12 H PHE 12 84.295 42.520 27.336
73 HA PHE 12 HA PHE 12 85.486 42.845 30.007
74 1HB PHE 12 2HB PHE 12 84.835 45.114 28.120
75 2HB PHE 12 1HB PHE 12 86.135 45.011 29.305
76 HD1 PHE 12 HD2 PHE 12 87.170 42.249 28.680
77 HD2 PHE 12 HD1 PHE 12 86.016 45.488 26.103
78 HE1 PHE 12 HE2 PHE 12 88.675 41.380 26.913
79 HE2 PHE 12 HE1 PHE 12 87.522 44.617 24.337
80 HZ PHE 12 HZ PHE 12 88.844 42.561 24.741
81 H ALA 13 H ALA 13 82.538 43.772 28.283
82 HA ALA 13 HA ALA 13 81.407 45.435 30.334
83 1HB ALA 13 2HB ALA 13 80.143 43.803 28.113
84 2HB ALA 13 1HB ALA 13 79.241 44.923 29.137
85 3HB ALA 13 3HB ALA 13 80.521 45.526 28.084
86 H VAL 14 H VAL 14 80.940 41.970 29.542
87 HA VAL 14 HA VAL 14 79.140 41.420 31.708
88 HB VAL 14 HB VAL 14 79.473 39.932 29.718
89 1HG1 VAL 14 2HG1 VAL 14 82.027 40.154 29.833
90 2HG1 VAL 14 1HG1 VAL 14 81.966 38.955 31.124
91 3HG1 VAL 14 3HG1 VAL 14 81.394 38.542 29.509
92 1HG2 VAL 14 2HG2 VAL 14 78.414 39.104 31.810
93 2HG2 VAL 14 1HG2 VAL 14 79.294 37.830 30.967
94 3HG2 VAL 14 3HG2 VAL 14 80.000 38.594 32.390
95 H ALA 15 H ALA 15 82.682 41.365 31.474
96 HA ALA 15 HA ALA 15 83.153 40.151 34.043
97 1HB ALA 15 1HB ALA 15 84.851 40.325 32.208
98 2HB ALA 15 3HB ALA 15 84.954 42.057 32.526
99 3HB ALA 15 2HB ALA 15 85.444 40.902 33.766
100 H VAL 16 H VAL 16 83.181 43.570 32.979
101 HA VAL 16 HA VAL 16 83.653 44.573 35.641
102 HB VAL 16 HB VAL 16 84.167 45.807 33.492
103 1HG1 VAL 16 1HG1 VAL 16 81.962 45.336 32.407
104 2HG1 VAL 16 3HG1 VAL 16 81.198 46.425 33.566
105 3HG1 VAL 16 2HG1 VAL 16 82.375 47.050 32.411
106 1HG2 VAL 16 1HG2 VAL 16 82.445 47.224 35.551
107 2HG2 VAL 16 3HG2 VAL 16 84.183 46.946 35.669
108 3HG2 VAL 16 2HG2 VAL 16 83.544 48.020 34.424
109 H LYS 17 H LYS 17 80.726 43.878 33.789
110 HA LYS 17 HA LYS 17 78.918 45.229 35.614
111 1HB LYS 17 2HB LYS 17 78.454 44.591 33.184
112 2HB LYS 17 1HB LYS 17 78.220 42.942 33.762
113 1HG LYS 17 2HG LYS 17 76.766 45.031 35.280
114 2HG LYS 17 1HG LYS 17 76.219 44.787 33.621
115 1HD LYS 17 2HD LYS 17 75.404 42.698 34.054
116 2HD LYS 17 1HD LYS 17 76.717 42.307 35.164
117 1HE LYS 17 2HE LYS 17 74.993 44.439 36.186
118 2HE LYS 17 1HE LYS 17 74.110 42.941 35.894
119 1HZ LYS 17 3HZ LYS 17 76.625 43.171 37.466
120 2HZ LYS 17 2HZ LYS 17 75.065 43.020 38.126
121 3HZ LYS 17 1HZ LYS 17 75.731 41.750 37.215
122 H MET 18 H MET 18 80.024 41.853 35.248
123 HA MET 18 HA MET 18 78.375 40.937 37.495
124 1HB MET 18 2HB MET 18 80.482 39.630 35.766
125 2HB MET 18 1HB MET 18 79.774 38.807 37.156
126 1HG MET 18 2HG MET 18 77.951 40.079 35.141
127 2HG MET 18 1HG MET 18 78.694 38.526 34.762
128 1HE MET 18 1HE MET 18 78.971 36.778 36.814
129 2HE MET 18 3HE MET 18 77.419 36.056 37.258
130 3HE MET 18 2HE MET 18 77.830 36.294 35.562
131 H GLY 19 H GLY 19 81.761 41.833 36.955
132 1HA GLY 19 2HA GLY 19 83.143 42.739 38.733
133 2HA GLY 19 1HA GLY 19 82.157 41.866 39.906
134 H ALA 20 H ALA 20 83.697 40.672 36.915
135 HA ALA 20 HA ALA 20 85.725 39.170 38.406
136 1HB ALA 20 3HB ALA 20 83.712 37.743 38.679
137 2HB ALA 20 2HB ALA 20 83.526 37.687 36.927
138 3HB ALA 20 1HB ALA 20 84.938 36.952 37.688
139 H THR 21 H THR 21 87.383 39.830 37.092
140 HA THR 21 HA THR 21 87.073 40.107 34.204
141 HB THR 21 HB THR 21 89.608 40.147 35.874
142 HG1 THR 21 HG1 THR 21 89.277 42.343 35.952
143 1HG2 THR 21 3HG2 THR 21 88.968 41.160 33.090
144 2HG2 THR 21 2HG2 THR 21 90.469 41.488 33.954
145 3HG2 THR 21 1HG2 THR 21 90.059 39.835 33.497
146 H LYS 22 H LYS 22 88.612 37.733 36.378
147 HA LYS 22 HA LYS 22 89.731 36.146 34.225
148 1HB LYS 22 2HB LYS 22 90.409 36.189 36.736
149 2HB LYS 22 1HB LYS 22 89.072 35.059 36.959
150 1HG LYS 22 2HG LYS 22 90.968 34.482 34.732
151 2HG LYS 22 1HG LYS 22 91.563 34.231 36.373
152 1HD LYS 22 2HD LYS 22 90.238 32.418 36.704
153 2HD LYS 22 1HD LYS 22 88.850 33.179 35.928
154 1HE LYS 22 2HE LYS 22 90.869 32.662 33.943
155 2HE LYS 22 1HE LYS 22 90.557 31.182 34.849
156 1HZ LYS 22 1HZ LYS 22 88.481 32.896 33.583
157 2HZ LYS 22 3HZ LYS 22 89.052 31.421 32.964
158 3HZ LYS 22 2HZ LYS 22 88.199 31.450 34.433
159 H ALA 23 H ALA 23 86.835 35.811 36.272
160 HA ALA 23 HA ALA 23 85.903 33.445 34.837
161 1HB ALA 23 3HB ALA 23 84.746 35.223 36.975
162 2HB ALA 23 2HB ALA 23 83.724 34.043 36.154
163 3HB ALA 23 1HB ALA 23 85.141 33.506 37.056
164 H ASP 24 H ASP 24 84.002 36.449 35.298
165 HA ASP 24 HA ASP 24 82.683 36.111 32.739
166 1HB ASP 24 2HB ASP 24 82.729 38.391 34.738
167 2HB ASP 24 1HB ASP 24 81.736 38.398 33.282
Start of MODEL 3
1 H GLN 1 H GLN 1 79.280 42.059 11.033
2 HA GLN 1 HA GLN 1 78.965 41.483 13.498
3 1HB GLN 1 2HB GLN 1 78.487 39.006 12.359
4 2HB GLN 1 1HB GLN 1 80.083 38.798 13.079
5 1HG GLN 1 2HG GLN 1 77.690 39.935 14.557
6 2HG GLN 1 1HG GLN 1 78.199 38.249 14.650
7 1HE2 GLN 1 2HE2 GLN 1 81.139 38.999 16.595
8 2HE2 GLN 1 1HE2 GLN 1 80.514 37.892 15.465
9 H GLY 2 H GLY 2 80.747 42.123 14.640
10 1HA GLY 2 2HA GLY 2 83.363 42.138 13.274
11 2HA GLY 2 1HA GLY 2 82.978 42.957 14.788
12 H LEU 3 H LEU 3 83.459 39.698 13.417
13 HA LEU 3 HA LEU 3 83.592 38.224 15.814
14 1HB LEU 3 2HB LEU 3 84.993 36.608 14.559
15 2HB LEU 3 1HB LEU 3 83.608 37.145 13.611
16 HG LEU 3 HG LEU 3 85.664 39.001 13.065
17 1HD1 LEU 3 3HD1 LEU 3 87.247 37.340 14.022
18 2HD1 LEU 3 2HD1 LEU 3 86.655 36.140 12.873
19 3HD1 LEU 3 1HD1 LEU 3 87.501 37.575 12.293
20 1HD2 LEU 3 1HD2 LEU 3 83.914 38.201 11.512
21 2HD2 LEU 3 3HD2 LEU 3 85.518 38.024 10.802
22 3HD2 LEU 3 2HD2 LEU 3 84.686 36.616 11.461
23 H GLY 4 H GLY 4 85.216 37.818 17.325
24 1HA GLY 4 2HA GLY 4 87.429 37.934 18.248
25 2HA GLY 4 1HA GLY 4 87.887 39.038 16.951
26 H CYS 5 H CYS 5 86.486 41.160 17.028
27 HA CYS 5 HA CYS 5 87.078 42.465 19.543
28 1HB CYS 5 2HB CYS 5 87.172 43.598 17.331
29 2HB CYS 5 1HB CYS 5 85.420 43.452 17.206
30 HG CYS 5 HG CYS 5 86.810 45.136 19.454
31 H ASP 6 H ASP 6 84.020 41.524 17.926
32 HA ASP 6 HA ASP 6 82.338 42.518 20.063
33 1HB ASP 6 2HB ASP 6 81.930 40.756 17.666
34 2HB ASP 6 1HB ASP 6 80.679 40.820 18.907
35 H GLU 7 H GLU 7 83.743 39.337 19.296
36 HA GLU 7 HA GLU 7 82.372 37.876 21.353
37 1HB GLU 7 2HB GLU 7 84.872 37.421 19.745
38 2HB GLU 7 1HB GLU 7 84.511 36.361 21.108
39 1HG GLU 7 2HG GLU 7 83.344 35.207 19.503
40 2HG GLU 7 1HG GLU 7 82.088 36.372 19.921
41 H MET 8 H MET 8 85.649 39.353 21.301
42 HA MET 8 HA MET 8 86.268 38.714 24.032
43 1HB MET 8 2HB MET 8 88.105 40.236 23.822
44 2HB MET 8 1HB MET 8 87.905 39.497 22.236
45 1HG MET 8 2HG MET 8 86.634 41.465 21.472
46 2HG MET 8 1HG MET 8 86.812 42.205 23.062
47 1HE MET 8 2HE MET 8 87.526 44.144 21.451
48 2HE MET 8 1HE MET 8 88.327 44.226 23.018
49 3HE MET 8 3HE MET 8 89.237 44.556 21.537
50 H LEU 9 H LEU 9 84.562 41.417 22.528
51 HA LEU 9 HA LEU 9 84.438 43.176 24.756
52 1HB LEU 9 2HB LEU 9 83.780 44.066 22.677
53 2HB LEU 9 1HB LEU 9 82.715 42.706 22.331
54 HG LEU 9 HG LEU 9 81.312 43.472 24.319
55 1HD1 LEU 9 2HD1 LEU 9 83.062 44.921 25.325
56 2HD1 LEU 9 1HD1 LEU 9 82.963 45.986 23.923
57 3HD1 LEU 9 3HD1 LEU 9 81.577 45.815 25.000
58 1HD2 LEU 9 3HD2 LEU 9 80.789 43.881 21.881
59 2HD2 LEU 9 2HD2 LEU 9 80.111 45.083 22.979
60 3HD2 LEU 9 1HD2 LEU 9 81.560 45.459 22.045
61 H GLN 10 H GLN 10 82.351 40.446 23.807
62 HA GLN 10 HA GLN 10 80.379 40.816 25.861
63 1HB GLN 10 2HB GLN 10 81.245 38.295 24.412
64 2HB GLN 10 1HB GLN 10 79.804 38.427 25.419
65 1HG GLN 10 2HG GLN 10 80.388 39.871 22.824
66 2HG GLN 10 1HG GLN 10 79.071 38.752 23.161
67 1HE2 GLN 10 2HE2 GLN 10 78.662 42.678 24.099
68 2HE2 GLN 10 1HE2 GLN 10 80.083 42.086 23.378
69 H GLY 11 H GLY 11 83.551 39.258 25.852
70 1HA GLY 11 2HA GLY 11 83.253 37.769 28.290
71 2HA GLY 11 1HA GLY 11 84.790 38.283 27.595
72 H PHE 12 H PHE 12 83.871 41.159 27.631
73 HA PHE 12 HA PHE 12 84.744 41.762 30.368
74 1HB PHE 12 2HB PHE 12 83.724 43.779 28.357
75 2HB PHE 12 1HB PHE 12 84.885 44.029 29.660
76 HD1 PHE 12 HD2 PHE 12 86.614 41.592 29.265
77 HD2 PHE 12 HD1 PHE 12 84.979 44.384 26.439
78 HE1 PHE 12 HE2 PHE 12 88.453 41.073 27.688
79 HE2 PHE 12 HE1 PHE 12 86.819 43.864 24.862
80 HZ PHE 12 HZ PHE 12 88.551 42.204 25.485
81 H ALA 13 H ALA 13 81.779 41.913 28.453
82 HA ALA 13 HA ALA 13 80.173 43.275 30.435
83 1HB ALA 13 2HB ALA 13 79.446 41.490 28.093
84 2HB ALA 13 1HB ALA 13 78.261 42.365 29.064
85 3HB ALA 13 3HB ALA 13 79.456 43.254 28.119
86 H VAL 14 H VAL 14 80.522 39.825 29.525
87 HA VAL 14 HA VAL 14 78.741 38.790 31.516
88 HB VAL 14 HB VAL 14 79.850 36.628 31.124
89 1HG1 VAL 14 1HG1 VAL 14 78.590 38.223 29.196
90 2HG1 VAL 14 3HG1 VAL 14 79.982 37.528 28.367
91 3HG1 VAL 14 2HG1 VAL 14 78.800 36.473 29.140
92 1HG2 VAL 14 1HG2 VAL 14 81.939 38.372 29.809
93 2HG2 VAL 14 3HG2 VAL 14 82.166 37.170 31.078
94 3HG2 VAL 14 2HG2 VAL 14 81.789 36.656 29.434
95 H ALA 15 H ALA 15 82.199 39.560 31.595
96 HA ALA 15 HA ALA 15 82.650 38.438 34.228
97 1HB ALA 15 1HB ALA 15 84.337 39.033 32.300
98 2HB ALA 15 3HB ALA 15 84.354 40.618 33.076
99 3HB ALA 15 2HB ALA 15 84.838 39.186 33.986
100 H VAL 16 H VAL 16 82.271 41.795 33.025
101 HA VAL 16 HA VAL 16 82.421 43.003 35.609
102 HB VAL 16 HB VAL 16 82.611 44.178 33.348
103 1HG1 VAL 16 2HG1 VAL 16 80.473 43.225 32.439
104 2HG1 VAL 16 1HG1 VAL 16 79.589 44.242 33.575
105 3HG1 VAL 16 3HG1 VAL 16 80.573 44.980 32.311
106 1HG2 VAL 16 2HG2 VAL 16 82.491 45.385 35.506
107 2HG2 VAL 16 1HG2 VAL 16 81.666 46.275 34.226
108 3HG2 VAL 16 3HG2 VAL 16 80.730 45.365 35.412
109 H LYS 17 H LYS 17 79.716 41.597 33.825
110 HA LYS 17 HA LYS 17 77.651 42.578 35.607
111 1HB LYS 17 2HB LYS 17 77.302 41.726 33.241
112 2HB LYS 17 1HB LYS 17 77.545 40.097 33.871
113 1HG LYS 17 2HG LYS 17 75.608 41.742 35.389
114 2HG LYS 17 1HG LYS 17 75.111 41.334 33.746
115 1HD LYS 17 2HD LYS 17 74.914 39.105 34.214
116 2HD LYS 17 1HD LYS 17 76.294 39.109 35.311
117 1HE LYS 17 2HE LYS 17 74.053 40.702 36.319
118 2HE LYS 17 1HE LYS 17 73.626 39.008 36.074
119 1HZ LYS 17 1HZ LYS 17 76.005 39.962 37.585
120 2HZ LYS 17 3HZ LYS 17 74.553 39.436 38.290
121 3HZ LYS 17 2HZ LYS 17 75.507 38.346 37.402
122 H MET 18 H MET 18 79.630 39.625 35.468
123 HA MET 18 HA MET 18 78.230 38.341 37.683
124 1HB MET 18 2HB MET 18 80.493 37.713 35.897
125 2HB MET 18 1HB MET 18 80.669 37.082 37.535
126 1HG MET 18 2HG MET 18 78.142 36.716 35.912
127 2HG MET 18 1HG MET 18 79.465 35.551 35.887
128 1HE MET 18 2HE MET 18 80.431 34.451 37.595
129 2HE MET 18 1HE MET 18 80.483 35.364 39.101
130 3HE MET 18 3HE MET 18 79.626 33.818 39.028
131 H GLY 19 H GLY 19 81.455 39.883 37.333
132 1HA GLY 19 2HA GLY 19 81.295 41.039 39.994
133 2HA GLY 19 1HA GLY 19 82.398 39.664 39.943
134 H ALA 20 H ALA 20 84.350 39.852 38.764
135 HA ALA 20 HA ALA 20 85.295 42.605 38.395
136 1HB ALA 20 3HB ALA 20 86.574 40.462 39.311
137 2HB ALA 20 2HB ALA 20 86.938 40.234 37.600
138 3HB ALA 20 1HB ALA 20 87.433 41.716 38.417
139 H THR 21 H THR 21 85.425 43.662 36.481
140 HA THR 21 HA THR 21 84.235 42.659 34.088
141 HB THR 21 HB THR 21 84.379 45.054 34.500
142 HG1 THR 21 HG1 THR 21 84.325 44.713 32.365
143 1HG2 THR 21 3HG2 THR 21 87.221 44.406 34.903
144 2HG2 THR 21 2HG2 THR 21 86.948 45.855 33.937
145 3HG2 THR 21 1HG2 THR 21 86.263 45.734 35.557
146 H LYS 22 H LYS 22 87.492 42.309 35.306
147 HA LYS 22 HA LYS 22 88.292 41.119 32.678
148 1HB LYS 22 2HB LYS 22 89.729 42.886 34.592
149 2HB LYS 22 1HB LYS 22 90.678 41.589 33.864
150 1HG LYS 22 2HG LYS 22 90.944 43.252 32.265
151 2HG LYS 22 1HG LYS 22 89.521 42.423 31.634
152 1HD LYS 22 2HD LYS 22 88.268 44.144 33.254
153 2HD LYS 22 1HD LYS 22 89.729 45.088 32.966
154 1HE LYS 22 2HE LYS 22 88.519 45.792 31.145
155 2HE LYS 22 1HE LYS 22 89.223 44.339 30.436
156 1HZ LYS 22 3HZ LYS 22 87.220 43.118 31.159
157 2HZ LYS 22 2HZ LYS 22 86.537 44.583 31.693
158 3HZ LYS 22 1HZ LYS 22 86.876 44.348 30.042
159 H ALA 23 H ALA 23 86.894 39.726 34.868
160 HA ALA 23 HA ALA 23 88.561 37.379 35.010
161 1HB ALA 23 3HB ALA 23 88.450 39.190 37.410
162 2HB ALA 23 2HB ALA 23 88.585 37.446 37.633
163 3HB ALA 23 1HB ALA 23 89.828 38.319 36.737
164 H ASP 24 H ASP 24 86.528 38.181 37.777
165 HA ASP 24 HA ASP 24 84.700 36.006 37.061
166 1HB ASP 24 2HB ASP 24 85.372 36.353 39.410
167 2HB ASP 24 1HB ASP 24 84.650 37.961 39.387
Start of MODEL 4
1 H GLN 1 H GLN 1 78.184 44.424 10.718
2 HA GLN 1 HA GLN 1 78.685 44.287 13.661
3 1HB GLN 1 2HB GLN 1 77.262 42.361 12.556
4 2HB GLN 1 1HB GLN 1 78.829 41.808 11.966
5 1HG GLN 1 2HG GLN 1 78.886 42.546 14.805
6 2HG GLN 1 1HG GLN 1 77.755 41.238 14.462
7 1HE2 GLN 1 2HE2 GLN 1 81.707 40.468 14.421
8 2HE2 GLN 1 1HE2 GLN 1 81.078 41.962 14.938
9 H GLY 2 H GLY 2 80.838 44.240 14.208
10 1HA GLY 2 2HA GLY 2 82.817 43.964 11.972
11 2HA GLY 2 1HA GLY 2 83.028 45.100 13.306
12 H LEU 3 H LEU 3 83.798 42.010 12.210
13 HA LEU 3 HA LEU 3 83.868 40.437 14.566
14 1HB LEU 3 2HB LEU 3 85.631 39.125 13.439
15 2HB LEU 3 1HB LEU 3 84.318 39.508 12.328
16 HG LEU 3 HG LEU 3 86.102 41.675 12.125
17 1HD1 LEU 3 2HD1 LEU 3 87.783 40.242 13.280
18 2HD1 LEU 3 1HD1 LEU 3 87.583 39.030 12.014
19 3HD1 LEU 3 3HD1 LEU 3 88.247 40.616 11.620
20 1HD2 LEU 3 1HD2 LEU 3 84.749 40.654 10.318
21 2HD2 LEU 3 3HD2 LEU 3 86.443 40.795 9.848
22 3HD2 LEU 3 2HD2 LEU 3 85.794 39.233 10.347
23 H GLY 4 H GLY 4 85.490 40.104 16.151
24 1HA GLY 4 2HA GLY 4 87.583 40.564 17.254
25 2HA GLY 4 1HA GLY 4 87.815 41.946 16.182
26 H CYS 5 H CYS 5 85.871 43.598 16.446
27 HA CYS 5 HA CYS 5 86.035 44.625 19.141
28 1HB CYS 5 2HB CYS 5 85.834 46.059 17.128
29 2HB CYS 5 1HB CYS 5 84.201 45.444 16.872
30 HG CYS 5 HG CYS 5 83.411 46.649 19.009
31 H ASP 6 H ASP 6 83.371 43.128 17.266
32 HA ASP 6 HA ASP 6 81.447 43.311 19.415
33 1HB ASP 6 2HB ASP 6 81.605 41.702 16.867
34 2HB ASP 6 1HB ASP 6 80.303 41.437 18.025
35 H GLU 7 H GLU 7 83.636 40.725 18.302
36 HA GLU 7 HA GLU 7 82.738 38.735 20.162
37 1HB GLU 7 2HB GLU 7 85.285 39.115 18.587
38 2HB GLU 7 1HB GLU 7 85.096 37.767 19.710
39 1HG GLU 7 2HG GLU 7 84.205 36.722 17.880
40 2HG GLU 7 1HG GLU 7 82.746 37.586 18.361
41 H MET 8 H MET 8 85.544 40.986 20.319
42 HA MET 8 HA MET 8 86.418 40.158 22.914
43 1HB MET 8 2HB MET 8 87.759 42.139 22.951
44 2HB MET 8 1HB MET 8 87.694 41.630 21.266
45 1HG MET 8 2HG MET 8 85.864 43.259 20.866
46 2HG MET 8 1HG MET 8 85.994 43.795 22.540
47 1HE MET 8 1HE MET 8 86.077 46.078 21.140
48 2HE MET 8 3HE MET 8 86.888 46.111 22.712
49 3HE MET 8 2HE MET 8 87.634 46.884 21.316
50 H LEU 9 H LEU 9 84.003 42.534 21.882
51 HA LEU 9 HA LEU 9 83.498 43.767 24.394
52 1HB LEU 9 2HB LEU 9 82.538 44.830 22.534
53 2HB LEU 9 1HB LEU 9 81.905 43.321 21.881
54 HG LEU 9 HG LEU 9 80.362 43.222 23.893
55 1HD1 LEU 9 2HD1 LEU 9 81.565 45.966 24.256
56 2HD1 LEU 9 1HD1 LEU 9 79.960 45.580 24.875
57 3HD1 LEU 9 3HD1 LEU 9 81.366 44.689 25.456
58 1HD2 LEU 9 2HD2 LEU 9 79.643 43.986 21.638
59 2HD2 LEU 9 1HD2 LEU 9 78.775 44.821 22.925
60 3HD2 LEU 9 3HD2 LEU 9 80.088 45.635 22.076
61 H GLN 10 H GLN 10 82.156 40.818 22.909
62 HA GLN 10 HA GLN 10 80.224 40.244 24.939
63 1HB GLN 10 2HB GLN 10 81.749 38.370 23.103
64 2HB GLN 10 1HB GLN 10 80.362 37.896 24.083
65 1HG GLN 10 2HG GLN 10 80.416 39.908 21.820
66 2HG GLN 10 1HG GLN 10 79.528 38.388 21.878
67 1HE2 GLN 10 2HE2 GLN 10 77.928 41.718 23.563
68 2HE2 GLN 10 1HE2 GLN 10 79.450 41.758 22.807
69 H GLY 11 H GLY 11 83.708 39.664 24.762
70 1HA GLY 11 2HA GLY 11 83.858 37.797 26.956
71 2HA GLY 11 1HA GLY 11 85.201 38.763 26.341
72 H PHE 12 H PHE 12 83.738 41.315 26.750
73 HA PHE 12 HA PHE 12 84.403 41.689 29.590
74 1HB PHE 12 2HB PHE 12 83.076 43.772 27.853
75 2HB PHE 12 1HB PHE 12 84.198 44.009 29.191
76 HD1 PHE 12 HD2 PHE 12 86.346 42.062 28.498
77 HD2 PHE 12 HD1 PHE 12 84.140 44.787 26.016
78 HE1 PHE 12 HE2 PHE 12 88.223 42.110 26.880
79 HE2 PHE 12 HE1 PHE 12 86.018 44.834 24.399
80 HZ PHE 12 HZ PHE 12 88.056 43.491 24.830
81 H ALA 13 H ALA 13 81.531 41.658 27.518
82 HA ALA 13 HA ALA 13 79.607 42.417 29.502
83 1HB ALA 13 2HB ALA 13 79.381 40.744 26.984
84 2HB ALA 13 1HB ALA 13 77.989 41.235 27.951
85 3HB ALA 13 3HB ALA 13 78.993 42.456 27.167
86 H VAL 14 H VAL 14 80.827 39.223 28.455
87 HA VAL 14 HA VAL 14 79.147 37.724 30.274
88 HB VAL 14 HB VAL 14 80.197 36.752 28.218
89 1HG1 VAL 14 2HG1 VAL 14 82.429 37.904 28.604
90 2HG1 VAL 14 1HG1 VAL 14 82.751 36.692 29.844
91 3HG1 VAL 14 3HG1 VAL 14 82.531 36.200 28.165
92 1HG2 VAL 14 3HG2 VAL 14 79.408 35.356 30.162
93 2HG2 VAL 14 2HG2 VAL 14 80.682 34.597 29.208
94 3HG2 VAL 14 1HG2 VAL 14 81.068 35.344 30.758
95 H ALA 15 H ALA 15 82.442 39.051 30.487
96 HA ALA 15 HA ALA 15 83.109 37.787 32.994
97 1HB ALA 15 1HB ALA 15 84.762 38.815 31.392
98 2HB ALA 15 3HB ALA 15 84.189 40.400 31.909
99 3HB ALA 15 2HB ALA 15 84.972 39.325 33.068
100 H VAL 16 H VAL 16 81.933 41.069 32.195
101 HA VAL 16 HA VAL 16 81.758 41.933 34.922
102 HB VAL 16 HB VAL 16 81.793 43.418 32.859
103 1HG1 VAL 16 3HG1 VAL 16 79.962 42.128 31.685
104 2HG1 VAL 16 2HG1 VAL 16 78.820 42.832 32.829
105 3HG1 VAL 16 1HG1 VAL 16 79.715 43.873 31.723
106 1HG2 VAL 16 3HG2 VAL 16 79.591 43.862 34.900
107 2HG2 VAL 16 2HG2 VAL 16 81.290 44.288 35.108
108 3HG2 VAL 16 1HG2 VAL 16 80.316 45.113 33.891
109 H LYS 17 H LYS 17 79.528 40.178 32.836
110 HA LYS 17 HA LYS 17 77.254 40.489 34.652
111 1HB LYS 17 2HB LYS 17 77.050 40.165 32.160
112 2HB LYS 17 1HB LYS 17 77.595 38.504 32.389
113 1HG LYS 17 2HG LYS 17 75.390 39.348 34.173
114 2HG LYS 17 1HG LYS 17 74.973 39.269 32.461
115 1HD LYS 17 2HD LYS 17 75.210 36.995 32.367
116 2HD LYS 17 1HD LYS 17 76.555 36.986 33.508
117 1HE LYS 17 2HE LYS 17 74.041 37.848 34.740
118 2HE LYS 17 1HE LYS 17 73.949 36.215 34.079
119 1HZ LYS 17 1HZ LYS 17 76.060 37.210 35.924
120 2HZ LYS 17 3HZ LYS 17 74.753 36.222 36.368
121 3HZ LYS 17 2HZ LYS 17 75.939 35.630 35.305
122 H MET 18 H MET 18 79.657 37.942 33.957
123 HA MET 18 HA MET 18 78.451 35.917 35.592
124 1HB MET 18 2HB MET 18 81.211 36.376 34.494
125 2HB MET 18 1HB MET 18 80.943 35.089 35.670
126 1HG MET 18 2HG MET 18 79.292 35.402 33.150
127 2HG MET 18 1HG MET 18 80.720 34.372 33.251
128 1HE MET 18 1HE MET 18 81.065 32.468 34.359
129 2HE MET 18 3HE MET 18 80.658 32.818 36.045
130 3HE MET 18 2HE MET 18 79.932 31.436 35.228
131 H GLY 19 H GLY 19 81.473 37.703 36.376
132 1HA GLY 19 2HA GLY 19 80.995 38.960 38.707
133 2HA GLY 19 1HA GLY 19 80.907 37.286 39.253
134 H ALA 20 H ALA 20 83.071 39.216 37.146
135 HA ALA 20 HA ALA 20 85.385 38.191 38.731
136 1HB ALA 20 1HB ALA 20 85.040 38.222 35.728
137 2HB ALA 20 3HB ALA 20 86.632 38.147 36.484
138 3HB ALA 20 2HB ALA 20 85.462 36.857 36.762
139 H THR 21 H THR 21 87.262 39.620 38.664
140 HA THR 21 HA THR 21 86.593 42.409 38.797
141 HB THR 21 HB THR 21 88.465 41.388 40.075
142 HG1 THR 21 HG1 THR 21 89.633 43.184 39.965
143 1HG2 THR 21 2HG2 THR 21 89.265 39.902 38.227
144 2HG2 THR 21 1HG2 THR 21 89.912 41.325 37.412
145 3HG2 THR 21 3HG2 THR 21 90.559 40.835 38.977
146 H LYS 22 H LYS 22 88.123 40.446 36.252
147 HA LYS 22 HA LYS 22 87.572 42.641 34.330
148 1HB LYS 22 2HB LYS 22 90.260 41.537 35.031
149 2HB LYS 22 1HB LYS 22 89.943 41.911 33.338
150 1HG LYS 22 2HG LYS 22 90.497 44.042 33.861
151 2HG LYS 22 1HG LYS 22 88.927 44.126 34.662
152 1HD LYS 22 2HD LYS 22 90.218 43.031 36.679
153 2HD LYS 22 1HD LYS 22 91.644 43.674 35.864
154 1HE LYS 22 2HE LYS 22 91.122 45.517 37.140
155 2HE LYS 22 1HE LYS 22 90.096 45.864 35.747
156 1HZ LYS 22 1HZ LYS 22 89.235 44.427 38.207
157 2HZ LYS 22 3HZ LYS 22 88.874 46.045 37.833
158 3HZ LYS 22 2HZ LYS 22 88.250 44.791 36.868
159 H ALA 23 H ALA 23 88.980 39.363 34.572
160 HA ALA 23 HA ALA 23 87.313 38.586 32.208
161 1HB ALA 23 3HB ALA 23 89.759 38.580 31.745
162 2HB ALA 23 2HB ALA 23 89.987 37.431 33.064
163 3HB ALA 23 1HB ALA 23 89.061 36.964 31.638
164 H ASP 24 H ASP 24 85.860 36.977 32.588
165 HA ASP 24 HA ASP 24 86.006 35.544 35.198
166 1HB ASP 24 2HB ASP 24 83.923 36.877 34.395
167 2HB ASP 24 1HB ASP 24 83.648 35.511 33.315
Start of MODEL 5
1 H GLN 1 H GLN 1 81.077 42.337 14.607
2 HA GLN 1 HA GLN 1 83.008 40.598 13.132
3 1HB GLN 1 2HB GLN 1 83.506 42.637 14.922
4 2HB GLN 1 1HB GLN 1 83.592 41.211 15.955
5 1HG GLN 1 2HG GLN 1 84.973 41.014 13.327
6 2HG GLN 1 1HG GLN 1 85.699 42.098 14.514
7 1HE2 GLN 1 2HE2 GLN 1 85.612 38.066 15.296
8 2HE2 GLN 1 1HE2 GLN 1 84.571 38.706 14.112
9 H GLY 2 H GLY 2 81.265 40.726 16.267
10 1HA GLY 2 2HA GLY 2 80.032 38.981 17.302
11 2HA GLY 2 1HA GLY 2 80.508 37.901 15.992
12 H LEU 3 H LEU 3 82.404 36.682 16.206
13 HA LEU 3 HA LEU 3 83.358 36.296 18.936
14 1HB LEU 3 2HB LEU 3 84.840 34.552 17.873
15 2HB LEU 3 1HB LEU 3 83.122 34.329 17.557
16 HG LEU 3 HG LEU 3 84.240 36.038 15.523
17 1HD1 LEU 3 2HD1 LEU 3 86.380 34.937 16.088
18 2HD1 LEU 3 1HD1 LEU 3 85.618 33.359 15.885
19 3HD1 LEU 3 3HD1 LEU 3 85.805 34.434 14.499
20 1HD2 LEU 3 2HD2 LEU 3 82.191 34.624 15.369
21 2HD2 LEU 3 1HD2 LEU 3 83.321 34.305 14.053
22 3HD2 LEU 3 3HD2 LEU 3 83.209 33.185 15.410
23 H GLY 4 H GLY 4 84.533 38.104 19.601
24 1HA GLY 4 2HA GLY 4 87.142 38.460 19.549
25 2HA GLY 4 1HA GLY 4 86.810 38.994 17.903
26 H CYS 5 H CYS 5 86.014 41.037 17.573
27 HA CYS 5 HA CYS 5 86.357 43.028 19.580
28 1HB CYS 5 2HB CYS 5 86.410 43.373 17.084
29 2HB CYS 5 1HB CYS 5 84.650 43.260 17.091
30 HG CYS 5 HG CYS 5 84.512 45.446 18.444
31 H ASP 6 H ASP 6 83.384 41.418 18.417
32 HA ASP 6 HA ASP 6 81.678 43.026 20.169
33 1HB ASP 6 2HB ASP 6 81.190 40.618 18.408
34 2HB ASP 6 1HB ASP 6 79.933 41.283 19.450
35 H GLU 7 H GLU 7 82.930 39.675 20.192
36 HA GLU 7 HA GLU 7 81.564 38.861 22.577
37 1HB GLU 7 2HB GLU 7 83.006 37.527 20.749
38 2HB GLU 7 1HB GLU 7 84.254 37.718 21.980
39 1HG GLU 7 2HG GLU 7 81.512 36.765 22.767
40 2HG GLU 7 1HG GLU 7 82.670 35.630 22.075
41 H MET 8 H MET 8 84.849 40.234 22.090
42 HA MET 8 HA MET 8 85.692 40.097 24.799
43 1HB MET 8 2HB MET 8 87.332 41.777 24.250
44 2HB MET 8 1HB MET 8 87.140 40.751 22.832
45 1HG MET 8 2HG MET 8 85.551 42.431 21.887
46 2HG MET 8 1HG MET 8 85.883 43.476 23.268
47 1HE MET 8 3HE MET 8 86.219 44.930 20.898
48 2HE MET 8 2HE MET 8 86.964 45.516 22.383
49 3HE MET 8 1HE MET 8 87.877 45.547 20.876
50 H LEU 9 H LEU 9 83.780 42.580 23.109
51 HA LEU 9 HA LEU 9 83.577 44.449 25.251
52 1HB LEU 9 2HB LEU 9 82.893 45.193 23.108
53 2HB LEU 9 1HB LEU 9 81.858 43.789 22.858
54 HG LEU 9 HG LEU 9 80.524 44.676 24.900
55 1HD1 LEU 9 2HD1 LEU 9 82.283 46.357 25.517
56 2HD1 LEU 9 1HD1 LEU 9 81.908 47.229 24.031
57 3HD1 LEU 9 3HD1 LEU 9 80.685 47.068 25.291
58 1HD2 LEU 9 3HD2 LEU 9 79.803 44.699 22.489
59 2HD2 LEU 9 2HD2 LEU 9 79.146 46.031 23.439
60 3HD2 LEU 9 1HD2 LEU 9 80.504 46.311 22.349
61 H GLN 10 H GLN 10 81.554 41.651 24.351
62 HA GLN 10 HA GLN 10 79.611 41.967 26.443
63 1HB GLN 10 2HB GLN 10 80.520 39.435 25.029
64 2HB GLN 10 1HB GLN 10 79.052 39.596 25.993
65 1HG GLN 10 2HG GLN 10 79.700 41.083 23.430
66 2HG GLN 10 1HG GLN 10 78.477 39.832 23.637
67 1HE2 GLN 10 2HE2 GLN 10 77.654 43.659 24.741
68 2HE2 GLN 10 1HE2 GLN 10 79.188 43.233 24.145
69 H GLY 11 H GLY 11 82.826 40.512 26.347
70 1HA GLY 11 2HA GLY 11 82.622 39.047 28.825
71 2HA GLY 11 1HA GLY 11 84.124 39.521 28.033
72 H PHE 12 H PHE 12 83.402 42.399 28.023
73 HA PHE 12 HA PHE 12 84.366 43.047 30.708
74 1HB PHE 12 2HB PHE 12 83.341 45.054 28.689
75 2HB PHE 12 1HB PHE 12 84.561 45.289 29.938
76 HD1 PHE 12 HD2 PHE 12 86.180 42.779 29.536
77 HD2 PHE 12 HD1 PHE 12 84.542 45.571 26.712
78 HE1 PHE 12 HE2 PHE 12 87.936 42.157 27.902
79 HE2 PHE 12 HE1 PHE 12 86.299 44.947 25.078
80 HZ PHE 12 HZ PHE 12 87.989 43.235 25.673
81 H ALA 13 H ALA 13 81.324 43.303 28.915
82 HA ALA 13 HA ALA 13 79.853 44.799 30.876
83 1HB ALA 13 2HB ALA 13 78.963 42.823 28.753
84 2HB ALA 13 1HB ALA 13 77.848 43.795 29.713
85 3HB ALA 13 3HB ALA 13 78.989 44.582 28.622
86 H VAL 14 H VAL 14 80.197 41.285 30.306
87 HA VAL 14 HA VAL 14 78.562 40.567 32.606
88 HB VAL 14 HB VAL 14 78.857 39.068 30.628
89 1HG1 VAL 14 2HG1 VAL 14 81.336 39.625 30.384
90 2HG1 VAL 14 1HG1 VAL 14 81.625 38.522 31.728
91 3HG1 VAL 14 3HG1 VAL 14 80.919 37.920 30.228
92 1HG2 VAL 14 3HG2 VAL 14 78.234 38.212 32.917
93 2HG2 VAL 14 2HG2 VAL 14 79.039 37.017 31.901
94 3HG2 VAL 14 1HG2 VAL 14 79.937 37.835 33.180
95 H ALA 15 H ALA 15 82.031 40.986 32.003
96 HA ALA 15 HA ALA 15 82.912 39.883 34.513
97 1HB ALA 15 3HB ALA 15 84.261 41.887 32.690
98 2HB ALA 15 2HB ALA 15 85.045 41.017 34.007
99 3HB ALA 15 1HB ALA 15 84.435 40.134 32.608
100 H VAL 16 H VAL 16 82.321 43.248 33.445
101 HA VAL 16 HA VAL 16 83.075 44.441 35.925
102 HB VAL 16 HB VAL 16 82.725 45.653 33.720
103 1HG1 VAL 16 1HG1 VAL 16 80.470 44.612 33.286
104 2HG1 VAL 16 3HG1 VAL 16 79.816 45.627 34.570
105 3HG1 VAL 16 2HG1 VAL 16 80.496 46.366 33.121
106 1HG2 VAL 16 3HG2 VAL 16 83.003 46.829 35.892
107 2HG2 VAL 16 2HG2 VAL 16 81.936 47.710 34.798
108 3HG2 VAL 16 1HG2 VAL 16 81.256 46.773 36.128
109 H LYS 17 H LYS 17 80.073 42.958 34.847
110 HA LYS 17 HA LYS 17 78.549 43.870 37.179
111 1HB LYS 17 2HB LYS 17 77.488 43.431 34.960
112 2HB LYS 17 1HB LYS 17 77.879 41.721 35.145
113 1HG LYS 17 2HG LYS 17 76.511 42.861 37.485
114 2HG LYS 17 1HG LYS 17 75.543 42.918 36.012
115 1HD LYS 17 2HD LYS 17 75.341 40.647 35.897
116 2HD LYS 17 1HD LYS 17 76.986 40.372 36.470
117 1HE LYS 17 2HE LYS 17 75.180 41.547 38.487
118 2HE LYS 17 1HE LYS 17 74.730 39.923 37.966
119 1HZ LYS 17 1HZ LYS 17 77.033 39.224 38.408
120 2HZ LYS 17 3HZ LYS 17 77.382 40.774 39.008
121 3HZ LYS 17 2HZ LYS 17 76.249 39.788 39.805
122 H MET 18 H MET 18 80.215 40.888 36.155
123 HA MET 18 HA MET 18 79.372 39.467 38.595
124 1HB MET 18 2HB MET 18 81.039 38.733 36.190
125 2HB MET 18 1HB MET 18 80.975 37.689 37.609
126 1HG MET 18 2HG MET 18 78.408 38.683 36.415
127 2HG MET 18 1HG MET 18 79.253 37.344 35.639
128 1HE MET 18 1HE MET 18 80.320 35.503 36.958
129 2HE MET 18 3HE MET 18 79.321 34.514 38.032
130 3HE MET 18 2HE MET 18 78.790 34.846 36.385
131 H GLY 19 H GLY 19 82.630 40.026 37.161
132 1HA GLY 19 2HA GLY 19 83.989 41.465 38.976
133 2HA GLY 19 1HA GLY 19 83.781 39.973 39.891
134 H ALA 20 H ALA 20 84.940 41.094 36.692
135 HA ALA 20 HA ALA 20 87.440 39.643 36.965
136 1HB ALA 20 2HB ALA 20 85.646 37.871 36.343
137 2HB ALA 20 1HB ALA 20 85.660 38.624 34.749
138 3HB ALA 20 3HB ALA 20 87.133 37.901 35.396
139 H THR 21 H THR 21 88.005 39.403 34.154
140 HA THR 21 HA THR 21 87.981 42.294 33.388
141 HB THR 21 HB THR 21 89.960 41.653 31.941
142 HG1 THR 21 HG1 THR 21 90.952 39.645 32.582
143 1HG2 THR 21 2HG2 THR 21 90.111 42.652 34.264
144 2HG2 THR 21 1HG2 THR 21 90.349 41.014 34.873
145 3HG2 THR 21 3HG2 THR 21 91.523 41.721 33.764
146 H LYS 22 H LYS 22 88.419 39.286 31.492
147 HA LYS 22 HA LYS 22 86.307 40.292 29.625
148 1HB LYS 22 2HB LYS 22 88.793 39.955 28.866
149 2HB LYS 22 1HB LYS 22 88.367 38.244 28.846
150 1HG LYS 22 2HG LYS 22 86.399 40.031 27.547
151 2HG LYS 22 1HG LYS 22 87.964 39.938 26.740
152 1HD LYS 22 2HD LYS 22 87.629 37.794 26.074
153 2HD LYS 22 1HD LYS 22 86.932 37.326 27.625
154 1HE LYS 22 2HE LYS 22 85.092 39.111 26.394
155 2HE LYS 22 1HE LYS 22 85.573 37.939 25.168
156 1HZ LYS 22 2HZ LYS 22 84.607 37.269 27.900
157 2HZ LYS 22 1HZ LYS 22 83.681 37.165 26.472
158 3HZ LYS 22 3HZ LYS 22 85.029 36.156 26.684
159 H ALA 23 H ALA 23 87.380 37.570 31.553
160 HA ALA 23 HA ALA 23 84.806 36.200 30.956
161 1HB ALA 23 1HB ALA 23 86.712 35.189 29.611
162 2HB ALA 23 3HB ALA 23 87.446 34.725 31.146
163 3HB ALA 23 2HB ALA 23 85.878 34.063 30.683
164 H ASP 24 H ASP 24 83.807 35.561 32.816
165 HA ASP 24 HA ASP 24 85.246 35.916 35.376
166 1HB ASP 24 2HB ASP 24 82.339 35.231 34.827
167 2HB ASP 24 1HB ASP 24 83.020 35.645 36.399
Start of MODEL 6
1 H GLN 1 H GLN 1 75.891 41.664 14.175
2 HA GLN 1 HA GLN 1 77.510 40.225 15.204
3 1HB GLN 1 2HB GLN 1 76.214 38.216 13.351
4 2HB GLN 1 1HB GLN 1 77.690 37.846 14.243
5 1HG GLN 1 2HG GLN 1 76.062 38.949 16.193
6 2HG GLN 1 1HG GLN 1 74.924 38.029 15.209
7 1HE2 GLN 1 2HE2 GLN 1 77.871 36.019 17.247
8 2HE2 GLN 1 1HE2 GLN 1 78.048 37.686 16.958
9 H GLY 2 H GLY 2 79.421 41.093 14.567
10 1HA GLY 2 2HA GLY 2 80.220 40.848 11.692
11 2HA GLY 2 1HA GLY 2 80.807 42.101 12.787
12 H LEU 3 H LEU 3 81.232 38.826 11.714
13 HA LEU 3 HA LEU 3 82.887 37.779 13.765
14 1HB LEU 3 2HB LEU 3 82.698 37.274 10.801
15 2HB LEU 3 1HB LEU 3 83.936 36.469 11.765
16 HG LEU 3 HG LEU 3 81.098 36.435 12.735
17 1HD1 LEU 3 3HD1 LEU 3 82.258 34.698 10.540
18 2HD1 LEU 3 2HD1 LEU 3 80.802 34.288 11.446
19 3HD1 LEU 3 1HD1 LEU 3 80.835 35.734 10.438
20 1HD2 LEU 3 1HD2 LEU 3 83.467 34.544 12.875
21 2HD2 LEU 3 3HD2 LEU 3 82.826 35.532 14.188
22 3HD2 LEU 3 2HD2 LEU 3 81.878 34.189 13.552
23 H GLY 4 H GLY 4 84.587 38.946 14.579
24 1HA GLY 4 2HA GLY 4 87.084 39.202 13.755
25 2HA GLY 4 1HA GLY 4 86.364 40.421 12.704
26 H CYS 5 H CYS 5 85.830 42.416 13.561
27 HA CYS 5 HA CYS 5 86.959 43.057 16.193
28 1HB CYS 5 2HB CYS 5 87.229 44.541 14.196
29 2HB CYS 5 1HB CYS 5 85.494 44.856 14.243
30 HG CYS 5 HG CYS 5 85.780 46.099 16.482
31 H ASP 6 H ASP 6 83.717 42.956 14.710
32 HA ASP 6 HA ASP 6 82.359 44.029 17.032
33 1HB ASP 6 2HB ASP 6 81.355 44.104 14.776
34 2HB ASP 6 1HB ASP 6 81.281 42.343 14.750
35 H GLU 7 H GLU 7 82.800 40.697 15.780
36 HA GLU 7 HA GLU 7 81.383 39.412 17.907
37 1HB GLU 7 2HB GLU 7 82.877 38.623 15.592
38 2HB GLU 7 1HB GLU 7 83.447 37.681 16.970
39 1HG GLU 7 2HG GLU 7 81.610 36.448 16.090
40 2HG GLU 7 1HG GLU 7 80.976 37.269 17.515
41 H MET 8 H MET 8 84.895 40.077 17.499
42 HA MET 8 HA MET 8 85.693 38.843 19.960
43 1HB MET 8 2HB MET 8 87.788 39.950 19.691
44 2HB MET 8 1HB MET 8 87.220 39.624 18.056
45 1HG MET 8 2HG MET 8 86.386 41.929 17.871
46 2HG MET 8 1HG MET 8 86.909 42.263 19.521
47 1HE MET 8 1HE MET 8 87.890 44.315 18.007
48 2HE MET 8 3HE MET 8 88.710 43.949 19.532
49 3HE MET 8 2HE MET 8 89.650 44.316 18.088
50 H LEU 9 H LEU 9 84.598 42.136 19.196
51 HA LEU 9 HA LEU 9 85.053 43.322 21.746
52 1HB LEU 9 2HB LEU 9 84.550 44.822 20.008
53 2HB LEU 9 1HB LEU 9 83.182 43.863 19.450
54 HG LEU 9 HG LEU 9 82.052 44.423 21.667
55 1HD1 LEU 9 2HD1 LEU 9 84.349 46.401 21.741
56 2HD1 LEU 9 1HD1 LEU 9 82.910 46.511 22.756
57 3HD1 LEU 9 3HD1 LEU 9 84.006 45.140 22.926
58 1HD2 LEU 9 3HD2 LEU 9 82.743 46.650 19.728
59 2HD2 LEU 9 2HD2 LEU 9 81.403 45.512 19.579
60 3HD2 LEU 9 1HD2 LEU 9 81.409 46.702 20.881
61 H GLN 10 H GLN 10 82.265 41.530 20.431
62 HA GLN 10 HA GLN 10 80.548 41.841 22.699
63 1HB GLN 10 2HB GLN 10 80.705 39.610 20.648
64 2HB GLN 10 1HB GLN 10 79.395 39.798 21.812
65 1HG GLN 10 2HG GLN 10 80.157 41.676 19.566
66 2HG GLN 10 1HG GLN 10 78.634 40.819 19.782
67 1HE2 GLN 10 2HE2 GLN 10 79.221 44.380 21.638
68 2HE2 GLN 10 1HE2 GLN 10 80.422 43.692 20.653
69 H GLY 11 H GLY 11 83.223 39.622 22.038
70 1HA GLY 11 2HA GLY 11 82.661 37.772 24.180
71 2HA GLY 11 1HA GLY 11 84.227 37.981 23.393
72 H PHE 12 H PHE 12 84.335 40.875 24.002
73 HA PHE 12 HA PHE 12 85.400 40.665 26.736
74 1HB PHE 12 2HB PHE 12 85.144 43.245 25.187
75 2HB PHE 12 1HB PHE 12 86.365 42.793 26.375
76 HD1 PHE 12 HD2 PHE 12 87.096 40.059 25.393
77 HD2 PHE 12 HD1 PHE 12 86.410 43.721 23.253
78 HE1 PHE 12 HE2 PHE 12 88.550 39.257 23.552
79 HE2 PHE 12 HE1 PHE 12 87.865 42.918 21.414
80 HZ PHE 12 HZ PHE 12 88.928 40.684 21.562
81 H ALA 13 H ALA 13 82.702 42.220 25.054
82 HA ALA 13 HA ALA 13 81.669 43.707 27.283
83 1HB ALA 13 2HB ALA 13 80.346 42.591 24.792
84 2HB ALA 13 1HB ALA 13 79.530 43.662 25.933
85 3HB ALA 13 3HB ALA 13 80.937 44.236 25.037
86 H VAL 14 H VAL 14 80.855 40.471 25.978
87 HA VAL 14 HA VAL 14 78.871 39.870 27.976
88 HB VAL 14 HB VAL 14 79.124 38.676 25.770
89 1HG1 VAL 14 2HG1 VAL 14 81.646 38.454 25.995
90 2HG1 VAL 14 1HG1 VAL 14 81.350 37.163 27.158
91 3HG1 VAL 14 3HG1 VAL 14 80.808 36.989 25.490
92 1HG2 VAL 14 2HG2 VAL 14 77.810 37.748 27.685
93 2HG2 VAL 14 1HG2 VAL 14 78.493 36.494 26.651
94 3HG2 VAL 14 3HG2 VAL 14 79.248 36.867 28.201
95 H ALA 15 H ALA 15 82.383 39.360 27.824
96 HA ALA 15 HA ALA 15 82.552 37.726 30.198
97 1HB ALA 15 1HB ALA 15 84.335 37.876 28.447
98 2HB ALA 15 3HB ALA 15 84.684 39.514 29.000
99 3HB ALA 15 2HB ALA 15 84.942 38.145 30.081
100 H VAL 16 H VAL 16 83.148 41.215 29.628
101 HA VAL 16 HA VAL 16 83.689 41.810 32.378
102 HB VAL 16 HB VAL 16 84.267 43.276 30.388
103 1HG1 VAL 16 3HG1 VAL 16 82.003 43.179 29.340
104 2HG1 VAL 16 2HG1 VAL 16 81.376 44.144 30.675
105 3HG1 VAL 16 1HG1 VAL 16 82.575 44.828 29.578
106 1HG2 VAL 16 1HG2 VAL 16 84.421 44.056 32.737
107 2HG2 VAL 16 3HG2 VAL 16 83.958 45.363 31.647
108 3HG2 VAL 16 2HG2 VAL 16 82.740 44.586 32.659
109 H LYS 17 H LYS 17 80.690 41.674 30.512
110 HA LYS 17 HA LYS 17 79.031 42.869 32.574
111 1HB LYS 17 2HB LYS 17 78.532 42.586 30.040
112 2HB LYS 17 1HB LYS 17 78.036 40.949 30.470
113 1HG LYS 17 2HG LYS 17 76.954 43.154 32.155
114 2HG LYS 17 1HG LYS 17 76.328 43.039 30.510
115 1HD LYS 17 2HD LYS 17 75.188 41.123 30.949
116 2HD LYS 17 1HD LYS 17 76.508 40.447 31.903
117 1HE LYS 17 2HE LYS 17 75.358 42.715 33.279
118 2HE LYS 17 1HE LYS 17 74.096 41.552 32.872
119 1HZ LYS 17 2HZ LYS 17 76.658 40.860 34.217
120 2HZ LYS 17 1HZ LYS 17 75.179 41.099 35.023
121 3HZ LYS 17 3HZ LYS 17 75.346 39.816 33.926
122 H MET 18 H MET 18 79.865 39.526 31.654
123 HA MET 18 HA MET 18 78.135 38.294 33.630
124 1HB MET 18 2HB MET 18 80.413 37.329 31.907
125 2HB MET 18 1HB MET 18 79.750 36.293 33.171
126 1HG MET 18 2HG MET 18 77.509 36.490 32.190
127 2HG MET 18 1HG MET 18 78.132 37.580 30.951
128 1HE MET 18 1HE MET 18 76.865 36.091 29.450
129 2HE MET 18 3HE MET 18 77.396 34.520 28.834
130 3HE MET 18 2HE MET 18 76.551 34.625 30.376
131 H GLY 19 H GLY 19 81.678 38.849 33.494
132 1HA GLY 19 2HA GLY 19 82.791 39.730 35.536
133 2HA GLY 19 1HA GLY 19 81.695 38.728 36.486
134 H ALA 20 H ALA 20 84.014 38.256 33.784
135 HA ALA 20 HA ALA 20 84.627 35.537 34.610
136 1HB ALA 20 3HB ALA 20 84.880 36.763 32.255
137 2HB ALA 20 2HB ALA 20 86.497 37.100 32.870
138 3HB ALA 20 1HB ALA 20 85.946 35.433 32.707
139 H THR 21 H THR 21 86.537 38.576 34.633
140 HA THR 21 HA THR 21 88.066 37.457 36.954
141 HB THR 21 HB THR 21 90.051 38.690 36.146
142 HG1 THR 21 HG1 THR 21 88.847 39.105 33.662
143 1HG2 THR 21 2HG2 THR 21 89.682 36.333 35.462
144 2HG2 THR 21 1HG2 THR 21 88.851 36.901 34.014
145 3HG2 THR 21 3HG2 THR 21 90.566 37.246 34.240
146 H LYS 22 H LYS 22 87.354 40.560 35.297
147 HA LYS 22 HA LYS 22 86.099 41.796 37.523
148 1HB LYS 22 2HB LYS 22 88.002 43.463 38.031
149 2HB LYS 22 1HB LYS 22 88.134 41.856 38.737
150 1HG LYS 22 2HG LYS 22 89.442 41.341 36.476
151 2HG LYS 22 1HG LYS 22 89.709 43.084 36.506
152 1HD LYS 22 2HD LYS 22 91.494 42.515 37.814
153 2HD LYS 22 1HD LYS 22 90.278 42.477 39.090
154 1HE LYS 22 2HE LYS 22 90.647 40.002 37.457
155 2HE LYS 22 1HE LYS 22 91.896 40.396 38.637
156 1HZ LYS 22 1HZ LYS 22 90.032 40.668 40.281
157 2HZ LYS 22 3HZ LYS 22 89.003 39.962 39.129
158 3HZ LYS 22 2HZ LYS 22 90.314 39.078 39.753
159 H ALA 23 H ALA 23 88.378 42.527 34.882
160 HA ALA 23 HA ALA 23 86.351 44.409 33.763
161 1HB ALA 23 2HB ALA 23 88.112 45.732 34.903
162 2HB ALA 23 1HB ALA 23 89.342 44.919 33.936
163 3HB ALA 23 3HB ALA 23 88.163 45.974 33.156
164 H ASP 24 H ASP 24 85.993 42.300 32.550
165 HA ASP 24 HA ASP 24 88.070 41.620 30.559
166 1HB ASP 24 2HB ASP 24 85.289 40.447 30.854
167 2HB ASP 24 1HB ASP 24 86.659 39.741 29.999
Start of MODEL 7
1 H GLN 1 H GLN 1 78.858 39.211 24.317
2 HA GLN 1 HA GLN 1 77.819 37.366 22.634
3 1HB GLN 1 2HB GLN 1 77.327 40.355 22.427
4 2HB GLN 1 1HB GLN 1 76.310 39.131 21.668
5 1HG GLN 1 2HG GLN 1 75.141 39.114 23.608
6 2HG GLN 1 1HG GLN 1 76.510 38.236 24.288
7 1HE2 GLN 1 2HE2 GLN 1 76.192 42.269 25.064
8 2HE2 GLN 1 1HE2 GLN 1 75.455 41.637 23.668
9 H GLY 2 H GLY 2 79.309 36.506 21.141
10 1HA GLY 2 2HA GLY 2 80.186 36.283 18.962
11 2HA GLY 2 1HA GLY 2 79.429 37.821 18.550
12 H LEU 3 H LEU 3 81.505 38.241 17.398
13 HA LEU 3 HA LEU 3 83.307 39.804 19.080
14 1HB LEU 3 2HB LEU 3 83.995 37.173 18.920
15 2HB LEU 3 1HB LEU 3 84.836 37.811 17.507
16 HG LEU 3 HG LEU 3 85.535 39.721 19.234
17 1HD1 LEU 3 2HD1 LEU 3 84.181 38.726 21.072
18 2HD1 LEU 3 1HD1 LEU 3 85.172 37.269 20.985
19 3HD1 LEU 3 3HD1 LEU 3 85.897 38.801 21.474
20 1HD2 LEU 3 2HD2 LEU 3 87.077 38.250 17.982
21 2HD2 LEU 3 1HD2 LEU 3 87.608 38.445 19.653
22 3HD2 LEU 3 3HD2 LEU 3 86.797 36.961 19.153
23 H GLY 4 H GLY 4 84.420 41.335 17.878
24 1HA GLY 4 2HA GLY 4 85.227 41.391 15.243
25 2HA GLY 4 1HA GLY 4 83.509 41.789 15.142
26 H CYS 5 H CYS 5 83.082 43.936 15.230
27 HA CYS 5 HA CYS 5 85.151 45.799 16.204
28 1HB CYS 5 2HB CYS 5 83.942 46.356 14.140
29 2HB CYS 5 1HB CYS 5 82.405 46.296 15.002
30 HG CYS 5 HG CYS 5 82.934 48.490 16.151
31 H ASP 6 H ASP 6 81.614 45.839 16.765
32 HA ASP 6 HA ASP 6 82.086 46.776 19.527
33 1HB ASP 6 2HB ASP 6 79.622 46.458 17.803
34 2HB ASP 6 1HB ASP 6 79.511 46.834 19.522
35 H GLU 7 H GLU 7 81.311 43.840 17.842
36 HA GLU 7 HA GLU 7 79.967 42.424 19.944
37 1HB GLU 7 2HB GLU 7 81.738 41.168 17.837
38 2HB GLU 7 1HB GLU 7 80.348 40.449 18.647
39 1HG GLU 7 2HG GLU 7 79.163 41.119 16.834
40 2HG GLU 7 1HG GLU 7 79.269 42.737 17.529
41 H MET 8 H MET 8 83.423 42.827 19.151
42 HA MET 8 HA MET 8 84.457 40.871 20.943
43 1HB MET 8 2HB MET 8 86.565 42.071 20.826
44 2HB MET 8 1HB MET 8 85.820 42.104 19.231
45 1HG MET 8 2HG MET 8 84.922 44.374 19.738
46 2HG MET 8 1HG MET 8 85.776 44.340 21.279
47 1HE MET 8 1HE MET 8 86.368 46.484 20.509
48 2HE MET 8 3HE MET 8 87.974 46.811 19.842
49 3HE MET 8 2HE MET 8 86.572 46.738 18.778
50 H LEU 9 H LEU 9 83.605 44.291 21.486
51 HA LEU 9 HA LEU 9 84.427 44.457 24.213
52 1HB LEU 9 2HB LEU 9 83.926 46.505 23.141
53 2HB LEU 9 1HB LEU 9 82.390 45.906 22.521
54 HG LEU 9 HG LEU 9 81.690 45.711 25.004
55 1HD1 LEU 9 2HD1 LEU 9 84.006 46.036 25.884
56 2HD1 LEU 9 1HD1 LEU 9 83.977 47.686 25.262
57 3HD1 LEU 9 3HD1 LEU 9 82.860 47.206 26.539
58 1HD2 LEU 9 3HD2 LEU 9 81.046 47.487 23.226
59 2HD2 LEU 9 2HD2 LEU 9 80.774 47.885 24.922
60 3HD2 LEU 9 1HD2 LEU 9 82.177 48.539 24.077
61 H GLN 10 H GLN 10 81.368 43.455 22.695
62 HA GLN 10 HA GLN 10 79.924 42.995 25.140
63 1HB GLN 10 2HB GLN 10 79.568 41.711 22.410
64 2HB GLN 10 1HB GLN 10 78.395 41.655 23.725
65 1HG GLN 10 2HG GLN 10 79.363 44.137 22.272
66 2HG GLN 10 1HG GLN 10 77.754 43.424 22.177
67 1HE2 GLN 10 2HE2 GLN 10 78.690 45.862 25.286
68 2HE2 GLN 10 1HE2 GLN 10 79.832 45.498 24.081
69 H GLY 11 H GLY 11 82.200 41.047 23.260
70 1HA GLY 11 2HA GLY 11 81.649 38.523 24.536
71 2HA GLY 11 1HA GLY 11 83.139 38.935 23.687
72 H PHE 12 H PHE 12 83.661 41.298 25.386
73 HA PHE 12 HA PHE 12 84.978 39.906 27.609
74 1HB PHE 12 2HB PHE 12 84.835 42.909 27.300
75 2HB PHE 12 1HB PHE 12 86.115 41.941 28.026
76 HD1 PHE 12 HD2 PHE 12 86.392 39.813 25.904
77 HD2 PHE 12 HD1 PHE 12 86.003 44.081 25.603
78 HE1 PHE 12 HE2 PHE 12 87.559 39.766 23.719
79 HE2 PHE 12 HE1 PHE 12 87.172 44.032 23.417
80 HZ PHE 12 HZ PHE 12 87.942 41.874 22.474
81 H ALA 13 H ALA 13 82.290 42.160 27.131
82 HA ALA 13 HA ALA 13 81.676 42.632 29.892
83 1HB ALA 13 2HB ALA 13 79.919 42.658 27.417
84 2HB ALA 13 1HB ALA 13 79.411 43.252 28.999
85 3HB ALA 13 3HB ALA 13 80.736 44.043 28.144
86 H VAL 14 H VAL 14 80.497 40.189 27.561
87 HA VAL 14 HA VAL 14 78.728 38.911 29.473
88 HB VAL 14 HB VAL 14 78.454 38.750 26.984
89 1HG1 VAL 14 3HG1 VAL 14 80.947 38.414 26.576
90 2HG1 VAL 14 2HG1 VAL 14 80.721 36.748 27.103
91 3HG1 VAL 14 1HG1 VAL 14 79.879 37.342 25.673
92 1HG2 VAL 14 1HG2 VAL 14 78.808 36.120 28.454
93 2HG2 VAL 14 3HG2 VAL 14 77.360 37.126 28.471
94 3HG2 VAL 14 2HG2 VAL 14 77.872 36.342 26.976
95 H ALA 15 H ALA 15 82.078 38.355 28.413
96 HA ALA 15 HA ALA 15 82.445 35.879 29.847
97 1HB ALA 15 1HB ALA 15 83.927 36.669 27.995
98 2HB ALA 15 3HB ALA 15 84.540 37.927 29.068
99 3HB ALA 15 2HB ALA 15 84.823 36.228 29.449
100 H VAL 16 H VAL 16 83.344 39.258 30.624
101 HA VAL 16 HA VAL 16 84.459 38.693 33.174
102 HB VAL 16 HB VAL 16 84.642 40.872 31.872
103 1HG1 VAL 16 1HG1 VAL 16 82.184 41.131 31.496
104 2HG1 VAL 16 3HG1 VAL 16 81.986 41.438 33.221
105 3HG1 VAL 16 2HG1 VAL 16 82.922 42.554 32.227
106 1HG2 VAL 16 1HG2 VAL 16 83.896 40.895 34.810
107 2HG2 VAL 16 3HG2 VAL 16 85.512 40.733 34.123
108 3HG2 VAL 16 2HG2 VAL 16 84.642 42.260 33.978
109 H LYS 17 H LYS 17 81.115 39.230 32.172
110 HA LYS 17 HA LYS 17 80.091 39.328 34.910
111 1HB LYS 17 2HB LYS 17 79.030 40.434 32.871
112 2HB LYS 17 1HB LYS 17 78.507 38.822 32.383
113 1HG LYS 17 2HG LYS 17 77.928 39.527 35.200
114 2HG LYS 17 1HG LYS 17 77.043 40.466 33.997
115 1HD LYS 17 2HD LYS 17 75.867 38.643 33.234
116 2HD LYS 17 1HD LYS 17 77.190 37.522 33.555
117 1HE LYS 17 2HE LYS 17 76.042 38.777 35.969
118 2HE LYS 17 1HE LYS 17 74.932 37.721 35.094
119 1HZ LYS 17 2HZ LYS 17 77.699 36.913 35.804
120 2HZ LYS 17 1HZ LYS 17 76.362 36.613 36.812
121 3HZ LYS 17 3HZ LYS 17 76.426 35.922 35.265
122 H MET 18 H MET 18 80.332 36.868 32.344
123 HA MET 18 HA MET 18 78.741 34.863 33.634
124 1HB MET 18 2HB MET 18 80.831 34.859 31.482
125 2HB MET 18 1HB MET 18 80.331 33.319 32.181
126 1HG MET 18 2HG MET 18 78.029 33.707 31.583
127 2HG MET 18 1HG MET 18 78.378 35.368 31.105
128 1HE MET 18 2HE MET 18 78.078 31.789 30.200
129 2HE MET 18 1HE MET 18 79.189 31.480 28.868
130 3HE MET 18 3HE MET 18 79.812 31.735 30.503
131 H GLY 19 H GLY 19 82.323 35.136 33.469
132 1HA GLY 19 2HA GLY 19 82.710 34.490 36.241
133 2HA GLY 19 1HA GLY 19 82.921 33.035 35.265
134 H ALA 20 H ALA 20 84.173 36.259 35.906
135 HA ALA 20 HA ALA 20 86.890 35.563 35.435
136 1HB ALA 20 1HB ALA 20 85.376 36.586 33.059
137 2HB ALA 20 3HB ALA 20 87.036 37.133 33.289
138 3HB ALA 20 2HB ALA 20 86.690 35.412 33.126
139 H THR 21 H THR 21 88.031 37.077 36.556
140 HA THR 21 HA THR 21 86.748 39.486 37.542
141 HB THR 21 HB THR 21 89.085 40.003 38.414
142 HG1 THR 21 HG1 THR 21 90.625 38.410 38.136
143 1HG2 THR 21 2HG2 THR 21 87.333 38.678 39.655
144 2HG2 THR 21 1HG2 THR 21 88.097 37.212 39.043
145 3HG2 THR 21 3HG2 THR 21 88.993 38.293 40.109
146 H LYS 22 H LYS 22 89.725 39.136 35.566
147 HA LYS 22 HA LYS 22 88.791 41.416 33.904
148 1HB LYS 22 2HB LYS 22 90.494 41.989 35.861
149 2HB LYS 22 1HB LYS 22 91.673 41.374 34.702
150 1HG LYS 22 2HG LYS 22 91.365 43.820 34.461
151 2HG LYS 22 1HG LYS 22 90.859 42.962 33.006
152 1HD LYS 22 2HD LYS 22 88.684 43.240 34.947
153 2HD LYS 22 1HD LYS 22 89.323 44.799 34.427
154 1HE LYS 22 2HE LYS 22 88.279 44.602 32.443
155 2HE LYS 22 1HE LYS 22 89.105 43.076 32.134
156 1HZ LYS 22 2HZ LYS 22 86.950 42.889 34.052
157 2HZ LYS 22 1HZ LYS 22 86.449 43.338 32.492
158 3HZ LYS 22 3HZ LYS 22 87.311 41.896 32.720
159 H ALA 23 H ALA 23 89.418 38.336 33.703
160 HA ALA 23 HA ALA 23 91.397 38.385 31.498
161 1HB ALA 23 1HB ALA 23 91.486 36.567 33.211
162 2HB ALA 23 3HB ALA 23 89.879 36.046 32.707
163 3HB ALA 23 2HB ALA 23 91.233 35.939 31.582
164 H ASP 24 H ASP 24 89.637 39.846 30.438
165 HA ASP 24 HA ASP 24 88.141 38.171 28.528
166 1HB ASP 24 2HB ASP 24 86.017 39.500 28.972
167 2HB ASP 24 1HB ASP 24 86.465 38.390 30.264
Start of MODEL 8
1 H GLN 1 H GLN 1 83.501 31.700 26.539
2 HA GLN 1 HA GLN 1 82.515 33.802 26.168
3 1HB GLN 1 2HB GLN 1 84.647 34.371 28.156
4 2HB GLN 1 1HB GLN 1 84.082 35.755 27.220
5 1HG GLN 1 2HG GLN 1 82.074 33.877 28.431
6 2HG GLN 1 1HG GLN 1 82.839 35.100 29.445
7 1HE2 GLN 1 2HE2 GLN 1 81.256 37.848 27.749
8 2HE2 GLN 1 1HE2 GLN 1 82.634 37.420 28.652
9 H GLY 2 H GLY 2 82.672 34.206 24.004
10 1HA GLY 2 2HA GLY 2 85.290 34.723 22.747
11 2HA GLY 2 1HA GLY 2 83.746 34.577 21.907
12 H LEU 3 H LEU 3 85.791 36.761 23.772
13 HA LEU 3 HA LEU 3 84.012 39.052 23.539
14 1HB LEU 3 2HB LEU 3 86.831 38.594 24.460
15 2HB LEU 3 1HB LEU 3 86.324 40.241 24.089
16 HG LEU 3 HG LEU 3 84.257 39.692 25.582
17 1HD1 LEU 3 1HD1 LEU 3 86.236 37.539 26.372
18 2HD1 LEU 3 3HD1 LEU 3 84.910 38.060 27.411
19 3HD1 LEU 3 2HD1 LEU 3 84.566 37.321 25.847
20 1HD2 LEU 3 3HD2 LEU 3 86.075 41.289 26.155
21 2HD2 LEU 3 2HD2 LEU 3 85.498 40.418 27.575
22 3HD2 LEU 3 1HD2 LEU 3 87.020 39.954 26.814
23 H GLY 4 H GLY 4 83.531 39.344 21.327
24 1HA GLY 4 2HA GLY 4 85.795 39.743 19.440
25 2HA GLY 4 1HA GLY 4 84.100 39.568 18.984
26 H CYS 5 H CYS 5 83.144 41.428 18.349
27 HA CYS 5 HA CYS 5 84.434 44.011 18.937
28 1HB CYS 5 2HB CYS 5 83.580 43.565 16.667
29 2HB CYS 5 1HB CYS 5 81.954 43.351 17.314
30 HG CYS 5 HG CYS 5 81.771 45.845 17.753
31 H ASP 6 H ASP 6 81.030 42.888 19.153
32 HA ASP 6 HA ASP 6 80.408 44.915 21.163
33 1HB ASP 6 2HB ASP 6 78.781 42.559 20.153
34 2HB ASP 6 1HB ASP 6 78.165 43.863 21.167
35 H GLU 7 H GLU 7 80.883 41.375 21.161
36 HA GLU 7 HA GLU 7 80.212 40.976 23.922
37 1HB GLU 7 2HB GLU 7 80.845 39.323 21.812
38 2HB GLU 7 1HB GLU 7 82.267 39.169 22.844
39 1HG GLU 7 2HG GLU 7 79.470 38.961 23.967
40 2HG GLU 7 1HG GLU 7 80.309 37.558 23.308
41 H MET 8 H MET 8 83.092 42.257 22.401
42 HA MET 8 HA MET 8 85.040 41.669 24.369
43 1HB MET 8 2HB MET 8 86.099 42.741 22.652
44 2HB MET 8 1HB MET 8 84.673 43.687 22.237
45 1HG MET 8 2HG MET 8 85.203 45.393 23.717
46 2HG MET 8 1HG MET 8 86.137 44.331 24.770
47 1HE MET 8 3HE MET 8 85.952 46.456 21.616
48 2HE MET 8 2HE MET 8 87.415 46.070 20.714
49 3HE MET 8 1HE MET 8 86.146 44.860 20.878
50 H LEU 9 H LEU 9 82.951 44.578 24.129
51 HA LEU 9 HA LEU 9 83.634 45.591 26.734
52 1HB LEU 9 2HB LEU 9 82.728 47.186 25.256
53 2HB LEU 9 1HB LEU 9 81.429 46.110 24.745
54 HG LEU 9 HG LEU 9 80.570 46.263 27.158
55 1HD1 LEU 9 1HD1 LEU 9 82.498 48.603 27.123
56 2HD1 LEU 9 3HD1 LEU 9 81.256 48.343 28.348
57 3HD1 LEU 9 2HD1 LEU 9 82.584 47.194 28.181
58 1HD2 LEU 9 1HD2 LEU 9 80.616 48.715 25.374
59 2HD2 LEU 9 3HD2 LEU 9 79.454 47.390 25.303
60 3HD2 LEU 9 2HD2 LEU 9 79.482 48.464 26.701
61 H GLN 10 H GLN 10 80.988 43.542 25.528
62 HA GLN 10 HA GLN 10 79.482 43.406 27.952
63 1HB GLN 10 2HB GLN 10 79.738 41.381 25.709
64 2HB GLN 10 1HB GLN 10 78.505 41.337 26.969
65 1HG GLN 10 2HG GLN 10 78.913 43.547 24.931
66 2HG GLN 10 1HG GLN 10 77.580 42.395 24.969
67 1HE2 GLN 10 2HE2 GLN 10 77.518 45.641 27.431
68 2HE2 GLN 10 1HE2 GLN 10 78.873 45.319 26.456
69 H GLY 11 H GLY 11 82.340 41.620 26.861
70 1HA GLY 11 2HA GLY 11 82.225 39.501 28.783
71 2HA GLY 11 1HA GLY 11 83.693 40.069 27.989
72 H PHE 12 H PHE 12 83.443 42.816 28.956
73 HA PHE 12 HA PHE 12 84.652 42.460 31.599
74 1HB PHE 12 2HB PHE 12 83.825 45.127 30.448
75 2HB PHE 12 1HB PHE 12 85.188 44.761 31.504
76 HD1 PHE 12 HD2 PHE 12 86.338 42.377 30.108
77 HD2 PHE 12 HD1 PHE 12 84.838 46.086 28.548
78 HE1 PHE 12 HE2 PHE 12 87.783 42.121 28.113
79 HE2 PHE 12 HE1 PHE 12 86.284 45.829 26.551
80 HZ PHE 12 HZ PHE 12 87.750 43.843 26.333
81 H ALA 13 H ALA 13 81.614 43.683 30.267
82 HA ALA 13 HA ALA 13 80.490 44.642 32.731
83 1HB ALA 13 2HB ALA 13 79.201 43.671 30.164
84 2HB ALA 13 1HB ALA 13 78.317 44.452 31.476
85 3HB ALA 13 3HB ALA 13 79.563 45.342 30.600
86 H VAL 14 H VAL 14 80.224 41.507 31.022
87 HA VAL 14 HA VAL 14 78.476 40.344 33.030
88 HB VAL 14 HB VAL 14 78.572 39.564 30.651
89 1HG1 VAL 14 2HG1 VAL 14 81.146 39.697 30.609
90 2HG1 VAL 14 1HG1 VAL 14 81.118 38.130 31.416
91 3HG1 VAL 14 3HG1 VAL 14 80.402 38.310 29.815
92 1HG2 VAL 14 3HG2 VAL 14 77.639 38.122 32.424
93 2HG2 VAL 14 2HG2 VAL 14 78.453 37.158 31.191
94 3HG2 VAL 14 1HG2 VAL 14 79.246 37.465 32.736
95 H ALA 15 H ALA 15 81.988 40.260 32.432
96 HA ALA 15 HA ALA 15 82.572 38.318 34.486
97 1HB ALA 15 1HB ALA 15 84.135 38.879 32.631
98 2HB ALA 15 3HB ALA 15 84.373 40.472 33.349
99 3HB ALA 15 2HB ALA 15 84.892 39.028 34.217
100 H VAL 16 H VAL 16 82.744 41.897 34.434
101 HA VAL 16 HA VAL 16 83.609 42.150 37.142
102 HB VAL 16 HB VAL 16 83.596 43.944 35.294
103 1HG1 VAL 16 1HG1 VAL 16 81.104 43.664 34.878
104 2HG1 VAL 16 3HG1 VAL 16 80.835 44.488 36.414
105 3HG1 VAL 16 2HG1 VAL 16 81.646 45.328 35.093
106 1HG2 VAL 16 2HG2 VAL 16 82.597 44.643 38.073
107 2HG2 VAL 16 1HG2 VAL 16 84.281 44.387 37.619
108 3HG2 VAL 16 3HG2 VAL 16 83.390 45.759 36.962
109 H LYS 17 H LYS 17 80.478 41.457 35.799
110 HA LYS 17 HA LYS 17 79.043 42.203 38.265
111 1HB LYS 17 2HB LYS 17 78.318 42.004 35.596
112 2HB LYS 17 1HB LYS 17 77.584 40.574 36.319
113 1HG LYS 17 2HG LYS 17 75.990 41.829 37.292
114 2HG LYS 17 1HG LYS 17 77.210 42.836 38.071
115 1HD LYS 17 2HD LYS 17 76.456 43.196 35.165
116 2HD LYS 17 1HD LYS 17 75.599 44.027 36.463
117 1HE LYS 17 2HE LYS 17 77.223 45.580 36.547
118 2HE LYS 17 1HE LYS 17 78.404 44.328 36.931
119 1HZ LYS 17 3HZ LYS 17 77.515 45.056 34.190
120 2HZ LYS 17 2HZ LYS 17 78.976 45.544 34.906
121 3HZ LYS 17 1HZ LYS 17 78.693 43.898 34.583
122 H MET 18 H MET 18 79.816 39.187 36.476
123 HA MET 18 HA MET 18 78.754 37.558 38.699
124 1HB MET 18 2HB MET 18 79.944 36.896 35.998
125 2HB MET 18 1HB MET 18 79.571 35.650 37.190
126 1HG MET 18 2HG MET 18 77.240 37.015 37.236
127 2HG MET 18 1HG MET 18 77.731 37.334 35.572
128 1HE MET 18 1HE MET 18 75.429 35.548 37.296
129 2HE MET 18 3HE MET 18 75.147 35.931 35.592
130 3HE MET 18 2HE MET 18 75.057 34.262 36.150
131 H GLY 19 H GLY 19 81.909 37.888 37.023
132 1HA GLY 19 2HA GLY 19 83.507 37.992 39.349
133 2HA GLY 19 1HA GLY 19 83.373 36.290 38.905
134 H ALA 20 H ALA 20 85.309 38.916 38.512
135 HA ALA 20 HA ALA 20 85.957 38.873 35.718
136 1HB ALA 20 3HB ALA 20 86.629 40.717 37.217
137 2HB ALA 20 2HB ALA 20 87.709 39.623 38.081
138 3HB ALA 20 1HB ALA 20 88.031 40.030 36.395
139 H THR 21 H THR 21 86.434 36.900 34.815
140 HA THR 21 HA THR 21 88.410 35.143 36.198
141 HB THR 21 HB THR 21 87.638 33.431 34.489
142 HG1 THR 21 HG1 THR 21 85.690 33.948 33.422
143 1HG2 THR 21 3HG2 THR 21 86.742 33.611 36.832
144 2HG2 THR 21 2HG2 THR 21 85.426 34.598 36.197
145 3HG2 THR 21 1HG2 THR 21 85.598 32.920 35.682
146 H LYS 22 H LYS 22 87.642 36.010 32.795
147 HA LYS 22 HA LYS 22 90.515 36.604 32.346
148 1HB LYS 22 2HB LYS 22 90.608 35.129 30.367
149 2HB LYS 22 1HB LYS 22 90.271 34.203 31.828
150 1HG LYS 22 2HG LYS 22 88.374 33.423 30.901
151 2HG LYS 22 1HG LYS 22 87.769 35.072 30.745
152 1HD LYS 22 2HD LYS 22 89.409 35.120 28.657
153 2HD LYS 22 1HD LYS 22 89.182 33.373 28.724
154 1HE LYS 22 2HE LYS 22 86.898 33.515 28.275
155 2HE LYS 22 1HE LYS 22 86.781 35.171 28.873
156 1HZ LYS 22 2HZ LYS 22 88.288 34.412 26.430
157 2HZ LYS 22 1HZ LYS 22 86.672 34.941 26.405
158 3HZ LYS 22 3HZ LYS 22 87.897 35.979 26.958
159 H ALA 23 H ALA 23 88.029 38.234 32.382
160 HA ALA 23 HA ALA 23 88.463 39.632 29.849
161 1HB ALA 23 2HB ALA 23 85.959 38.050 30.369
162 2HB ALA 23 1HB ALA 23 85.870 39.539 29.428
163 3HB ALA 23 3HB ALA 23 86.886 38.207 28.876
164 H ASP 24 H ASP 24 89.037 41.335 31.329
165 HA ASP 24 HA ASP 24 86.716 42.899 32.246
166 1HB ASP 24 2HB ASP 24 88.107 41.249 34.082
167 2HB ASP 24 1HB ASP 24 88.635 42.900 34.406
Start of MODEL 9
1 H GLN 1 H GLN 1 86.981 31.860 15.394
2 HA GLN 1 HA GLN 1 86.787 33.149 17.437
3 1HB GLN 1 2HB GLN 1 89.115 33.321 16.012
4 2HB GLN 1 1HB GLN 1 88.707 35.027 16.192
5 1HG GLN 1 2HG GLN 1 88.684 33.101 18.527
6 2HG GLN 1 1HG GLN 1 90.120 34.016 18.069
7 1HE2 GLN 1 2HE2 GLN 1 88.788 37.154 19.178
8 2HE2 GLN 1 1HE2 GLN 1 89.930 36.441 18.139
9 H GLY 2 H GLY 2 85.075 34.429 17.968
10 1HA GLY 2 2HA GLY 2 84.653 36.950 16.405
11 2HA GLY 2 1HA GLY 2 83.351 36.058 17.191
12 H LEU 3 H LEU 3 86.551 37.328 18.205
13 HA LEU 3 HA LEU 3 85.189 38.840 20.368
14 1HB LEU 3 2HB LEU 3 86.025 36.513 21.148
15 2HB LEU 3 1HB LEU 3 87.642 37.197 20.992
16 HG LEU 3 HG LEU 3 86.525 39.189 22.384
17 1HD1 LEU 3 1HD1 LEU 3 84.890 36.722 23.011
18 2HD1 LEU 3 3HD1 LEU 3 85.048 38.063 24.145
19 3HD1 LEU 3 2HD1 LEU 3 84.306 38.326 22.568
20 1HD2 LEU 3 3HD2 LEU 3 87.471 36.558 23.569
21 2HD2 LEU 3 2HD2 LEU 3 88.504 37.895 23.064
22 3HD2 LEU 3 1HD2 LEU 3 87.408 38.096 24.430
23 H GLY 4 H GLY 4 85.762 40.735 19.196
24 1HA GLY 4 2HA GLY 4 88.661 41.272 18.803
25 2HA GLY 4 1HA GLY 4 87.342 42.212 18.103
26 H CYS 5 H CYS 5 87.472 44.230 18.962
27 HA CYS 5 HA CYS 5 88.374 44.642 21.733
28 1HB CYS 5 2HB CYS 5 88.976 46.141 19.749
29 2HB CYS 5 1HB CYS 5 87.321 46.744 19.830
30 HG CYS 5 HG CYS 5 89.338 47.021 22.212
31 H ASP 6 H ASP 6 85.362 45.034 19.858
32 HA ASP 6 HA ASP 6 83.883 46.049 22.164
33 1HB ASP 6 2HB ASP 6 83.405 46.506 19.662
34 2HB ASP 6 1HB ASP 6 82.633 44.920 19.661
35 H GLU 7 H GLU 7 84.072 42.920 20.436
36 HA GLU 7 HA GLU 7 82.042 41.604 21.969
37 1HB GLU 7 2HB GLU 7 84.470 40.464 20.557
38 2HB GLU 7 1HB GLU 7 83.145 39.495 21.198
39 1HG GLU 7 2HG GLU 7 82.181 39.769 19.165
40 2HG GLU 7 1HG GLU 7 81.819 41.409 19.704
41 H MET 8 H MET 8 85.600 41.764 22.433
42 HA MET 8 HA MET 8 85.644 40.129 24.789
43 1HB MET 8 2HB MET 8 87.850 41.002 25.190
44 2HB MET 8 1HB MET 8 87.674 40.866 23.443
45 1HG MET 8 2HG MET 8 87.131 43.267 23.305
46 2HG MET 8 1HG MET 8 87.292 43.407 25.055
47 1HE MET 8 1HE MET 8 88.610 45.375 24.015
48 2HE MET 8 3HE MET 8 89.425 44.960 25.530
49 3HE MET 8 2HE MET 8 90.370 45.318 24.087
50 H LEU 9 H LEU 9 85.176 43.617 24.293
51 HA LEU 9 HA LEU 9 85.076 44.395 27.040
52 1HB LEU 9 2HB LEU 9 85.287 46.154 25.487
53 2HB LEU 9 1HB LEU 9 84.000 45.527 24.462
54 HG LEU 9 HG LEU 9 82.419 46.002 26.428
55 1HD1 LEU 9 3HD1 LEU 9 84.853 47.598 27.281
56 2HD1 LEU 9 2HD1 LEU 9 83.237 47.806 27.956
57 3HD1 LEU 9 1HD1 LEU 9 84.095 46.281 28.177
58 1HD2 LEU 9 1HD2 LEU 9 82.536 47.373 24.366
59 2HD2 LEU 9 3HD2 LEU 9 82.210 48.368 25.785
60 3HD2 LEU 9 2HD2 LEU 9 83.829 48.331 25.088
61 H GLN 10 H GLN 10 82.510 43.385 24.757
62 HA GLN 10 HA GLN 10 80.320 43.646 26.580
63 1HB GLN 10 2HB GLN 10 80.691 41.778 24.216
64 2HB GLN 10 1HB GLN 10 79.164 42.009 25.065
65 1HG GLN 10 2HG GLN 10 80.713 44.030 23.435
66 2HG GLN 10 1HG GLN 10 79.062 43.472 23.187
67 1HE2 GLN 10 2HE2 GLN 10 79.784 46.545 25.730
68 2HE2 GLN 10 1HE2 GLN 10 81.045 45.783 24.883
69 H GLY 11 H GLY 11 82.715 41.084 26.097
70 1HA GLY 11 2HA GLY 11 81.377 39.049 27.630
71 2HA GLY 11 1HA GLY 11 83.110 39.105 27.299
72 H PHE 12 H PHE 12 83.371 41.824 28.500
73 HA PHE 12 HA PHE 12 83.656 40.959 31.297
74 1HB PHE 12 2HB PHE 12 84.159 43.758 30.266
75 2HB PHE 12 1HB PHE 12 84.907 42.951 31.642
76 HD1 PHE 12 HD2 PHE 12 85.490 40.273 30.370
77 HD2 PHE 12 HD1 PHE 12 86.052 44.281 28.928
78 HE1 PHE 12 HE2 PHE 12 87.306 39.483 28.882
79 HE2 PHE 12 HE1 PHE 12 87.870 43.489 27.440
80 HZ PHE 12 HZ PHE 12 88.489 41.089 27.413
81 H ALA 13 H ALA 13 81.665 43.180 29.394
82 HA ALA 13 HA ALA 13 80.300 44.461 31.563
83 1HB ALA 13 2HB ALA 13 79.438 43.854 28.718
84 2HB ALA 13 1HB ALA 13 78.511 44.868 29.825
85 3HB ALA 13 3HB ALA 13 80.127 45.362 29.319
86 H VAL 14 H VAL 14 79.594 41.496 29.711
87 HA VAL 14 HA VAL 14 77.179 40.897 31.234
88 HB VAL 14 HB VAL 14 77.511 40.111 28.890
89 1HG1 VAL 14 1HG1 VAL 14 79.990 39.607 29.255
90 2HG1 VAL 14 3HG1 VAL 14 79.474 38.117 30.044
91 3HG1 VAL 14 2HG1 VAL 14 79.086 38.398 28.347
92 1HG2 VAL 14 2HG2 VAL 14 76.001 38.929 30.535
93 2HG2 VAL 14 1HG2 VAL 14 76.595 37.903 29.229
94 3HG2 VAL 14 3HG2 VAL 14 77.318 37.794 30.834
95 H ALA 15 H ALA 15 80.589 39.909 31.350
96 HA ALA 15 HA ALA 15 80.265 37.845 33.332
97 1HB ALA 15 1HB ALA 15 82.291 38.133 31.879
98 2HB ALA 15 3HB ALA 15 82.709 39.563 32.823
99 3HB ALA 15 2HB ALA 15 82.675 37.978 33.594
100 H VAL 16 H VAL 16 81.296 41.269 33.603
101 HA VAL 16 HA VAL 16 81.519 41.282 36.440
102 HB VAL 16 HB VAL 16 82.339 43.078 34.818
103 1HG1 VAL 16 2HG1 VAL 16 80.080 43.317 33.697
104 2HG1 VAL 16 1HG1 VAL 16 79.526 44.148 35.150
105 3HG1 VAL 16 3HG1 VAL 16 80.830 44.837 34.183
106 1HG2 VAL 16 2HG2 VAL 16 82.246 43.268 37.347
107 2HG2 VAL 16 1HG2 VAL 16 82.196 44.806 36.486
108 3HG2 VAL 16 3HG2 VAL 16 80.715 44.120 37.152
109 H LYS 17 H LYS 17 78.735 41.683 34.313
110 HA LYS 17 HA LYS 17 76.874 42.628 36.287
111 1HB LYS 17 2HB LYS 17 76.417 42.737 33.863
112 2HB LYS 17 1HB LYS 17 76.390 40.976 33.785
113 1HG LYS 17 2HG LYS 17 74.100 41.731 33.907
114 2HG LYS 17 1HG LYS 17 74.504 41.011 35.465
115 1HD LYS 17 2HD LYS 17 75.257 43.628 35.848
116 2HD LYS 17 1HD LYS 17 73.849 43.808 34.803
117 1HE LYS 17 2HE LYS 17 72.823 43.745 36.886
118 2HE LYS 17 1HE LYS 17 72.787 42.035 36.456
119 1HZ LYS 17 1HZ LYS 17 74.881 43.350 38.107
120 2HZ LYS 17 3HZ LYS 17 73.622 42.384 38.705
121 3HZ LYS 17 2HZ LYS 17 74.818 41.697 37.711
122 H MET 18 H MET 18 77.984 39.401 35.340
123 HA MET 18 HA MET 18 76.072 38.053 37.125
124 1HB MET 18 2HB MET 18 78.413 37.015 35.494
125 2HB MET 18 1HB MET 18 77.321 35.994 36.429
126 1HG MET 18 2HG MET 18 75.443 36.599 35.072
127 2HG MET 18 1HG MET 18 76.339 37.909 34.301
128 1HE MET 18 2HE MET 18 75.296 34.460 34.518
129 2HE MET 18 1HE MET 18 76.239 33.493 33.386
130 3HE MET 18 3HE MET 18 76.914 33.924 34.964
131 H GLY 19 H GLY 19 79.621 38.579 37.001
132 1HA GLY 19 2HA GLY 19 79.793 38.794 39.887
133 2HA GLY 19 1HA GLY 19 80.403 37.239 39.324
134 H ALA 20 H ALA 20 82.362 37.170 38.177
135 HA ALA 20 HA ALA 20 84.186 39.389 38.637
136 1HB ALA 20 1HB ALA 20 84.470 36.740 37.200
137 2HB ALA 20 3HB ALA 20 85.794 37.895 37.351
138 3HB ALA 20 2HB ALA 20 85.085 37.172 38.795
139 H THR 21 H THR 21 84.787 40.977 37.230
140 HA THR 21 HA THR 21 83.344 41.344 34.745
141 HB THR 21 HB THR 21 84.139 43.235 36.174
142 HG1 THR 21 HG1 THR 21 84.478 44.481 34.449
143 1HG2 THR 21 2HG2 THR 21 86.386 42.139 36.654
144 2HG2 THR 21 1HG2 THR 21 86.878 42.639 35.036
145 3HG2 THR 21 3HG2 THR 21 86.452 43.852 36.242
146 H LYS 22 H LYS 22 86.560 40.110 35.561
147 HA LYS 22 HA LYS 22 87.655 40.184 32.908
148 1HB LYS 22 2HB LYS 22 88.607 39.492 35.408
149 2HB LYS 22 1HB LYS 22 88.553 37.938 34.576
150 1HG LYS 22 2HG LYS 22 89.718 40.327 33.172
151 2HG LYS 22 1HG LYS 22 90.691 39.452 34.355
152 1HD LYS 22 2HD LYS 22 91.190 37.975 32.728
153 2HD LYS 22 1HD LYS 22 89.508 37.450 32.784
154 1HE LYS 22 2HE LYS 22 89.398 39.787 31.284
155 2HE LYS 22 1HE LYS 22 90.894 39.025 30.743
156 1HZ LYS 22 1HZ LYS 22 89.590 36.937 30.475
157 2HZ LYS 22 3HZ LYS 22 88.176 37.827 30.785
158 3HZ LYS 22 2HZ LYS 22 89.126 38.186 29.420
159 H ALA 23 H ALA 23 85.931 37.635 34.693
160 HA ALA 23 HA ALA 23 84.780 36.542 32.270
161 1HB ALA 23 2HB ALA 23 87.102 35.108 33.576
162 2HB ALA 23 1HB ALA 23 85.903 34.253 32.604
163 3HB ALA 23 3HB ALA 23 86.893 35.516 31.873
164 H ASP 24 H ASP 24 82.831 35.780 32.923
165 HA ASP 24 HA ASP 24 82.596 34.241 35.435
166 1HB ASP 24 2HB ASP 24 82.264 36.800 35.843
167 2HB ASP 24 1HB ASP 24 80.719 36.563 35.028
Start of MODEL 10
1 H GLN 1 H GLN 1 76.687 37.793 15.403
2 HA GLN 1 HA GLN 1 78.331 37.949 17.894
3 1HB GLN 1 2HB GLN 1 77.466 35.576 16.883
4 2HB GLN 1 1HB GLN 1 78.969 35.769 15.982
5 1HG GLN 1 2HG GLN 1 80.153 35.156 17.795
6 2HG GLN 1 1HG GLN 1 79.460 36.491 18.713
7 1HE2 GLN 1 2HE2 GLN 1 78.083 32.715 19.313
8 2HE2 GLN 1 1HE2 GLN 1 79.282 33.033 18.150
9 H GLY 2 H GLY 2 80.359 38.827 17.593
10 1HA GLY 2 2HA GLY 2 81.400 39.106 14.813
11 2HA GLY 2 1HA GLY 2 81.233 40.555 15.805
12 H LEU 3 H LEU 3 83.027 37.576 15.365
13 HA LEU 3 HA LEU 3 84.630 37.650 17.720
14 1HB LEU 3 2HB LEU 3 84.425 35.846 15.804
15 2HB LEU 3 1HB LEU 3 85.783 36.728 15.105
16 HG LEU 3 HG LEU 3 86.717 36.535 17.599
17 1HD1 LEU 3 2HD1 LEU 3 84.584 35.369 18.318
18 2HD1 LEU 3 1HD1 LEU 3 85.072 34.008 17.308
19 3HD1 LEU 3 3HD1 LEU 3 86.066 34.487 18.683
20 1HD2 LEU 3 3HD2 LEU 3 87.803 35.667 15.550
21 2HD2 LEU 3 2HD2 LEU 3 87.933 34.514 16.878
22 3HD2 LEU 3 1HD2 LEU 3 86.750 34.253 15.596
23 H GLY 4 H GLY 4 85.714 39.481 18.312
24 1HA GLY 4 2HA GLY 4 88.031 40.492 17.592
25 2HA GLY 4 1HA GLY 4 87.097 41.085 16.218
26 H CYS 5 H CYS 5 85.534 42.724 16.565
27 HA CYS 5 HA CYS 5 86.076 44.421 18.906
28 1HB CYS 5 2HB CYS 5 85.869 45.362 16.607
29 2HB CYS 5 1HB CYS 5 84.177 44.865 16.586
30 HG CYS 5 HG CYS 5 83.634 46.605 18.393
31 H ASP 6 H ASP 6 83.296 42.629 17.556
32 HA ASP 6 HA ASP 6 81.458 43.506 19.622
33 1HB ASP 6 2HB ASP 6 81.286 41.107 17.771
34 2HB ASP 6 1HB ASP 6 79.957 41.779 18.713
35 H GLU 7 H GLU 7 83.293 40.473 19.084
36 HA GLU 7 HA GLU 7 82.335 39.152 21.437
37 1HB GLU 7 2HB GLU 7 84.300 38.656 19.366
38 2HB GLU 7 1HB GLU 7 84.936 38.193 20.945
39 1HG GLU 7 2HG GLU 7 83.795 36.256 20.246
40 2HG GLU 7 1HG GLU 7 82.624 37.053 21.294
41 H MET 8 H MET 8 85.279 41.138 20.890
42 HA MET 8 HA MET 8 86.321 40.824 23.542
43 1HB MET 8 2HB MET 8 87.781 42.641 23.052
44 2HB MET 8 1HB MET 8 87.522 41.835 21.508
45 1HG MET 8 2HG MET 8 85.840 43.504 20.889
46 2HG MET 8 1HG MET 8 86.012 44.289 22.458
47 1HE MET 8 1HE MET 8 86.134 46.205 20.489
48 2HE MET 8 3HE MET 8 86.877 46.625 22.039
49 3HE MET 8 2HE MET 8 87.692 47.028 20.530
50 H LEU 9 H LEU 9 84.019 43.141 22.140
51 HA LEU 9 HA LEU 9 83.712 44.837 24.408
52 1HB LEU 9 2HB LEU 9 82.786 45.620 22.382
53 2HB LEU 9 1HB LEU 9 81.963 44.095 22.065
54 HG LEU 9 HG LEU 9 80.578 44.578 24.165
55 1HD1 LEU 9 1HD1 LEU 9 82.075 46.329 25.074
56 2HD1 LEU 9 3HD1 LEU 9 81.716 47.348 23.681
57 3HD1 LEU 9 2HD1 LEU 9 80.441 46.943 24.829
58 1HD2 LEU 9 1HD2 LEU 9 79.741 44.834 21.840
59 2HD2 LEU 9 3HD2 LEU 9 79.045 46.039 22.924
60 3HD2 LEU 9 2HD2 LEU 9 80.345 46.491 21.822
61 H GLN 10 H GLN 10 82.069 41.817 23.462
62 HA GLN 10 HA GLN 10 80.213 41.754 25.652
63 1HB GLN 10 2HB GLN 10 81.414 39.480 24.037
64 2HB GLN 10 1HB GLN 10 80.050 39.313 25.141
65 1HG GLN 10 2HG GLN 10 80.169 40.942 22.592
66 2HG GLN 10 1HG GLN 10 79.122 39.570 22.940
67 1HE2 GLN 10 2HE2 GLN 10 78.036 43.291 24.152
68 2HE2 GLN 10 1HE2 GLN 10 79.501 43.027 23.332
69 H GLY 11 H GLY 11 83.597 40.758 25.337
70 1HA GLY 11 2HA GLY 11 83.747 39.225 27.768
71 2HA GLY 11 1HA GLY 11 85.120 39.967 26.943
72 H PHE 12 H PHE 12 83.959 42.680 27.059
73 HA PHE 12 HA PHE 12 84.819 43.367 29.787
74 1HB PHE 12 2HB PHE 12 83.605 45.326 27.837
75 2HB PHE 12 1HB PHE 12 84.826 45.619 29.073
76 HD1 PHE 12 HD2 PHE 12 86.690 43.327 28.531
77 HD2 PHE 12 HD1 PHE 12 84.681 46.018 25.851
78 HE1 PHE 12 HE2 PHE 12 88.457 42.957 26.834
79 HE2 PHE 12 HE1 PHE 12 86.450 45.647 24.154
80 HZ PHE 12 HZ PHE 12 88.332 44.112 24.645
81 H ALA 13 H ALA 13 81.842 43.292 27.884
82 HA ALA 13 HA ALA 13 80.123 44.536 29.821
83 1HB ALA 13 2HB ALA 13 79.537 42.540 27.612
84 2HB ALA 13 1HB ALA 13 78.301 43.416 28.516
85 3HB ALA 13 3HB ALA 13 79.435 44.297 27.492
86 H VAL 14 H VAL 14 80.859 41.098 29.121
87 HA VAL 14 HA VAL 14 79.174 40.025 31.185
88 HB VAL 14 HB VAL 14 80.071 38.682 29.283
89 1HG1 VAL 14 3HG1 VAL 14 82.402 39.736 29.478
90 2HG1 VAL 14 2HG1 VAL 14 82.683 38.613 30.807
91 3HG1 VAL 14 1HG1 VAL 14 82.351 37.998 29.189
92 1HG2 VAL 14 1HG2 VAL 14 79.473 37.828 31.755
93 2HG2 VAL 14 3HG2 VAL 14 80.047 36.726 30.503
94 3HG2 VAL 14 2HG2 VAL 14 81.169 37.343 31.715
95 H ALA 15 H ALA 15 82.571 41.078 31.175
96 HA ALA 15 HA ALA 15 83.235 40.096 33.790
97 1HB ALA 15 1HB ALA 15 84.818 40.966 31.953
98 2HB ALA 15 3HB ALA 15 84.421 42.578 32.549
99 3HB ALA 15 2HB ALA 15 85.200 41.410 33.617
100 H VAL 16 H VAL 16 82.197 43.342 32.693
101 HA VAL 16 HA VAL 16 82.092 44.397 35.377
102 HB VAL 16 HB VAL 16 82.351 45.786 33.287
103 1HG1 VAL 16 2HG1 VAL 16 80.573 44.613 31.979
104 2HG1 VAL 16 1HG1 VAL 16 79.362 45.333 33.038
105 3HG1 VAL 16 3HG1 VAL 16 80.358 46.362 32.009
106 1HG2 VAL 16 3HG2 VAL 16 81.701 46.760 35.483
107 2HG2 VAL 16 2HG2 VAL 16 80.994 47.643 34.130
108 3HG2 VAL 16 1HG2 VAL 16 80.004 46.522 35.065
109 H LYS 17 H LYS 17 79.731 42.808 33.284
110 HA LYS 17 HA LYS 17 77.422 43.441 34.920
111 1HB LYS 17 2HB LYS 17 77.408 42.710 32.477
112 2HB LYS 17 1HB LYS 17 77.719 41.074 33.058
113 1HG LYS 17 2HG LYS 17 75.510 42.479 34.434
114 2HG LYS 17 1HG LYS 17 75.217 42.131 32.730
115 1HD LYS 17 2HD LYS 17 75.174 39.865 33.058
116 2HD LYS 17 1HD LYS 17 76.405 39.919 34.319
117 1HE LYS 17 2HE LYS 17 73.889 41.255 35.063
118 2HE LYS 17 1HE LYS 17 73.715 39.525 34.765
119 1HZ LYS 17 3HZ LYS 17 75.775 40.724 36.545
120 2HZ LYS 17 2HZ LYS 17 74.302 40.065 37.085
121 3HZ LYS 17 1HZ LYS 17 75.454 39.070 36.330
122 H MET 18 H MET 18 79.651 40.658 34.743
123 HA MET 18 HA MET 18 78.210 39.187 36.828
124 1HB MET 18 2HB MET 18 80.722 38.761 35.241
125 2HB MET 18 1HB MET 18 80.478 37.830 36.718
126 1HG MET 18 2HG MET 18 78.272 38.012 34.681
127 2HG MET 18 1HG MET 18 79.592 36.865 34.452
128 1HE MET 18 1HE MET 18 80.007 34.828 35.646
129 2HE MET 18 3HE MET 18 80.482 35.765 37.069
130 3HE MET 18 2HE MET 18 79.399 34.386 37.240
131 H GLY 19 H GLY 19 81.191 41.128 36.629
132 1HA GLY 19 2HA GLY 19 81.953 42.497 38.487
133 2HA GLY 19 1HA GLY 19 81.123 41.404 39.595
134 H ALA 20 H ALA 20 83.441 40.767 36.941
135 HA ALA 20 HA ALA 20 85.447 39.812 38.894
136 1HB ALA 20 3HB ALA 20 84.006 37.841 38.456
137 2HB ALA 20 2HB ALA 20 84.314 38.012 36.729
138 3HB ALA 20 1HB ALA 20 85.635 37.606 37.825
139 H THR 21 H THR 21 87.350 40.647 38.210
140 HA THR 21 HA THR 21 87.660 41.599 35.448
141 HB THR 21 HB THR 21 89.965 42.282 36.297
142 HG1 THR 21 HG1 THR 21 90.336 42.062 38.470
143 1HG2 THR 21 1HG2 THR 21 87.682 43.597 36.430
144 2HG2 THR 21 3HG2 THR 21 87.872 43.340 38.164
145 3HG2 THR 21 2HG2 THR 21 89.109 44.214 37.261
146 H LYS 22 H LYS 22 89.587 39.388 37.529
147 HA LYS 22 HA LYS 22 90.832 38.202 35.136
148 1HB LYS 22 2HB LYS 22 91.877 38.656 37.539
149 2HB LYS 22 1HB LYS 22 91.199 37.066 37.888
150 1HG LYS 22 2HG LYS 22 92.478 36.925 35.335
151 2HG LYS 22 1HG LYS 22 93.601 37.691 36.459
152 1HD LYS 22 2HD LYS 22 94.084 35.633 37.242
153 2HD LYS 22 1HD LYS 22 92.458 35.590 37.924
154 1HE LYS 22 2HE LYS 22 92.406 35.002 35.078
155 2HE LYS 22 1HE LYS 22 93.482 33.897 35.933
156 1HZ LYS 22 3HZ LYS 22 90.684 34.503 36.738
157 2HZ LYS 22 2HZ LYS 22 91.169 33.118 35.877
158 3HZ LYS 22 1HZ LYS 22 91.720 33.370 37.464
159 H ALA 23 H ALA 23 88.415 37.628 34.577
160 HA ALA 23 HA ALA 23 88.116 34.799 34.655
161 1HB ALA 23 3HB ALA 23 86.747 36.319 36.837
162 2HB ALA 23 2HB ALA 23 85.859 34.999 36.076
163 3HB ALA 23 1HB ALA 23 87.410 34.685 36.854
164 H ASP 24 H ASP 24 85.406 37.078 35.124
165 HA ASP 24 HA ASP 24 84.229 36.278 32.581
166 1HB ASP 24 2HB ASP 24 83.481 38.375 34.638
167 2HB ASP 24 1HB ASP 24 82.539 38.081 33.176
No H/Q in entry = 167
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