Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
620641 | 2ndc RC | 26055 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 HT1 GLY 1 -0.889 -0.066 -0.390
2 H2 GLY 1 HT2 GLY 1 -2.056 0.106 -1.609
3 H3 GLY 1 HT3 GLY 1 -0.672 1.087 -1.614
4 HA2 GLY 1 HA1 GLY 1 0.739 -0.803 -2.033
5 HA3 GLY 1 HA2 GLY 1 -0.662 -1.865 -1.940
6 H GLY 2 HN GLY 2 1.398 -0.627 -4.064
7 HA2 GLY 2 HA2 LY 2 -0.583 -0.672 -6.225
8 HA3 GLY 2 HA1 GLY 2 0.408 0.769 -6.059
9 H LEU 3 HN LEU 3 1.433 0.544 -8.013
10 HA LEU 3 HA LEU 3 2.503 -1.932 -8.923
11 HB2 LEU 3 HB2 LEU 3 3.020 0.881 -9.872
12 HB3 LEU 3 HB1 LEU 3 3.514 -0.570 -10.720
13 HG LEU 3 HG LEU 3 0.660 0.256 -10.173
14 HD11 LEU 3 HD11 LEU 3 1.698 1.680 -11.831
15 HD12 LEU 3 HD12 LEU 3 0.550 0.588 -12.605
16 HD13 LEU 3 HD13 LEU 3 2.281 0.269 -12.712
17 HD21 LEU 3 HD21 LEU 3 0.054 -1.605 -11.618
18 HD22 LEU 3 HD22 LEU 3 0.948 -2.172 -10.207
19 HD23 LEU 3 HD23 LEU 3 1.753 -2.054 -11.772
20 H ARG 4 HN ARG 4 4.187 1.083 -7.974
21 HA ARG 4 HA ARG 4 6.712 -0.303 -8.016
22 HB2 ARG 4 HB2 ARG 4 7.727 1.839 -7.436
23 HB3 ARG 4 HB1 ARG 4 6.616 2.017 -8.782
24 HG2 ARG 4 HG2 ARG 4 5.837 2.656 -5.953
25 HG3 ARG 4 HG1 ARG 4 6.600 3.833 -7.022
26 HD2 ARG 4 HD2 ARG 4 3.961 2.434 -7.428
27 HD3 ARG 4 HD1 ARG 4 4.222 4.149 -7.109
28 HE ARG 4 HE ARG 4 5.588 3.328 -9.469
29 HH11 ARG 4 HH11 ARG 4 2.414 4.148 -8.255
30 HH12 ARG 4 HH12 ARG 4 1.804 4.643 -9.805
31 HH21 ARG 4 HH21 ARG 4 4.813 3.965 -11.497
32 HH22 ARG 4 HH22 ARG 4 3.184 4.566 -11.659
33 H SER 5 HN SER 5 4.367 0.514 -5.639
34 HA SER 5 HA SER 5 6.132 0.236 -3.389
35 HB2 SER 5 HB2 SER 5 3.844 0.207 -2.157
36 HB3 SER 5 HB1 SER 5 4.358 1.693 -2.962
37 HG SER 5 HG SER 5 2.417 1.488 -3.806
38 H LEU 6 HN LEU 6 4.487 -1.859 -5.451
39 HA LEU 6 HA LEU 6 3.539 -3.976 -4.040
40 HB2 LEU 6 HB2 LEU 6 3.693 -3.702 -6.536
41 HB3 LEU 6 HB1 LEU 6 5.354 -4.248 -6.431
42 HG LEU 6 HG LEU 6 4.484 -6.390 -5.422
43 HD11 LEU 6 HD11 LEU 6 2.319 -5.596 -4.685
44 HD12 LEU 6 HD12 LEU 6 2.121 -6.921 -5.834
45 HD13 LEU 6 HD13 LEU 6 1.849 -5.254 -6.352
46 HD21 LEU 6 HD21 LEU 6 3.814 -7.320 -7.575
47 HD22 LEU 6 HD22 LEU 6 5.189 -6.231 -7.752
48 HD23 LEU 6 HD23 LEU 6 3.574 -5.693 -8.214
49 H GLY 7 HN GLY 7 6.970 -3.326 -4.717
50 HA2 GLY 7 HA2 GLY 7 7.970 -5.708 -3.558
51 HA3 GLY 7 HA1 GLY 7 8.892 -4.240 -3.849
52 H ARG 8 HN ARG 8 7.525 -2.442 -2.207
53 HA ARG 8 HA ARG 8 8.610 -3.175 0.330
54 HB2 ARG 8 HB2 ARG 8 6.939 -0.793 -0.471
55 HB3 ARG 8 HB1 ARG 8 7.690 -0.996 1.107
56 HG2 ARG 8 HG2 ARG 8 9.892 -1.210 -0.151
57 HG3 ARG 8 HG1 ARG 8 9.015 -0.601 -1.554
58 HD2 ARG 8 HD2 ARG 8 9.354 0.787 1.099
59 HD3 ARG 8 HD1 ARG 8 10.157 1.207 -0.412
60 HE ARG 8 HE ARG 8 7.338 1.658 0.262
61 HH11 ARG 8 HH11 ARG 8 9.942 1.955 -2.062
62 HH12 ARG 8 HH12 ARG 8 9.182 3.250 -2.938
63 HH21 ARG 8 HH21 ARG 8 6.349 3.348 -0.852
64 HH22 ARG 8 HH22 ARG 8 7.121 4.055 -2.245
65 H LYS 9 HN LYS 9 5.488 -3.414 -1.133
66 HA LYS 9 HA LYS 9 3.895 -3.836 1.130
67 HB2 LYS 9 HB2 LYS 9 2.955 -3.737 -1.128
68 HB3 LYS 9 HB1 LYS 9 3.783 -5.229 -1.554
69 HG2 LYS 9 HG2 LYS 9 2.458 -6.256 0.409
70 HG3 LYS 9 HG1 LYS 9 1.436 -4.826 0.257
71 HD2 LYS 9 HD2 LYS 9 0.524 -6.689 -1.029
72 HD3 LYS 9 HD1 LYS 9 1.028 -5.378 -2.099
73 HE2 LYS 9 HE2 LYS 9 3.066 -6.545 -2.638
74 HE3 LYS 9 HE1 LYS 9 2.691 -7.809 -1.468
75 HZ1 LYS 9 HZ1 LYS 9 0.856 -8.514 -2.779
76 HZ2 LYS 9 HZ2 LYS 9 2.204 -8.405 -3.804
77 HZ3 LYS 9 HZ3 LYS 9 1.015 -7.199 -3.833
78 H ILE 10 HN ILE 10 6.013 -5.994 -0.689
79 HA ILE 10 HA ILE 10 5.597 -8.271 0.992
80 HB ILE 10 HB ILE 10 7.809 -7.638 -0.970
81 HG12 ILE 10 HG12 ILE 10 5.590 -7.797 -2.004
82 HG13 ILE 10 HG11 ILE 10 6.606 -9.150 -2.483
83 HG21 ILE 10 HG21 ILE 10 8.607 -9.263 0.614
84 HG22 ILE 10 HG22 ILE 10 8.281 -10.065 -0.921
85 HG23 ILE 10 HG23 ILE 10 7.148 -10.228 0.417
86 HD11 ILE 10 HD11 ILE 10 5.461 -10.571 -0.856
87 HD12 ILE 10 HD12 ILE 10 4.349 -9.884 -2.038
88 HD13 ILE 10 HD13 ILE 10 4.428 -9.213 -0.411
89 H LEU 11 HN LEU 11 7.874 -5.624 0.816
90 HA LEU 11 HA LEU 11 9.840 -6.551 2.568
91 HB2 LEU 11 HB2 LEU 11 9.968 -4.578 1.017
92 HB3 LEU 11 HB1 LEU 11 8.988 -3.686 2.158
93 HG LEU 11 HG LEU 11 11.585 -4.889 3.050
94 HD11 LEU 11 HD11 LEU 11 11.241 -2.261 1.612
95 HD12 LEU 11 HD12 LEU 11 12.116 -3.671 1.018
96 HD13 LEU 11 HD13 LEU 11 12.710 -2.798 2.430
97 HD21 LEU 11 HD21 LEU 11 10.090 -2.392 3.862
98 HD22 LEU 11 HD22 LEU 11 11.559 -3.021 4.610
99 HD23 LEU 11 HD23 LEU 11 10.054 -3.931 4.722
100 H ARG 12 HN ARG 12 6.855 -4.706 3.225
101 HA ARG 12 HA ARG 12 7.375 -4.418 6.002
102 HB2 ARG 12 HB2 ARG 12 5.122 -3.664 6.238
103 HB3 ARG 12 HB1 ARG 12 5.737 -3.028 4.722
104 HG2 ARG 12 HG2 ARG 12 4.510 -4.740 3.491
105 HG3 ARG 12 HG1 ARG 12 3.922 -5.419 5.010
106 HD2 ARG 12 HD2 ARG 12 2.867 -3.222 5.508
107 HD3 ARG 12 HD1 ARG 12 3.343 -2.676 3.903
108 HE ARG 12 HE ARG 12 1.944 -4.747 3.191
109 HH11 ARG 12 HH11 ARG 12 1.236 -2.545 5.831
110 HH12 ARG 12 HH12 ARG 12 -0.486 -2.783 5.717
111 HH21 ARG 12 HH21 ARG 12 -0.335 -5.039 3.048
112 HH22 ARG 12 HH22 ARG 12 -1.362 -4.185 4.164
113 H ALA 13 HN ALA 13 6.206 -7.006 4.085
114 HA ALA 13 HA ALA 13 5.442 -9.105 4.505
115 HB1 ALA 13 HB1 ALA 13 7.749 -9.277 5.267
116 HB2 ALA 13 HB2 ALA 13 6.692 -10.305 6.234
117 HB3 ALA 13 HB3 ALA 13 7.269 -8.772 6.887
118 H TRP 14 HN TRP 14 3.424 -7.697 5.033
119 HA TRP 14 HA TRP 14 2.401 -7.661 7.627
120 HB2 TRP 14 HB2 TRP 14 0.243 -7.271 6.604
121 HB3 TRP 14 HB1 TRP 14 1.474 -6.357 5.756
122 HD1 TRP 14 HD1 TRP 14 -1.528 -7.585 4.834
123 HE1 TRP 14 HE1 TRP 14 -1.659 -8.663 2.507
124 HE3 TRP 14 HE3 TRP 14 3.459 -8.504 4.040
125 HZ2 TRP 14 HZ2 TRP 14 0.092 -9.753 0.610
126 HZ3 TRP 14 HZ3 TRP 14 4.118 -9.579 1.937
127 HH2 TRP 14 HH2 TRP 14 2.470 -10.185 0.254
128 H LYS 15 HN LYS 15 1.773 -10.031 5.036
129 HA LYS 15 HA LYS 15 1.402 -12.054 7.131
130 HB2 LYS 15 HB2 LYS 15 -0.147 -13.226 5.662
131 HB3 LYS 15 HB1 LYS 15 -0.707 -11.586 5.954
132 HG2 LYS 15 HG2 LYS 15 -1.016 -11.558 3.735
133 HG3 LYS 15 HG1 LYS 15 0.719 -11.237 3.679
134 HD2 LYS 15 HD2 LYS 15 0.331 -13.008 2.157
135 HD3 LYS 15 HD1 LYS 15 1.046 -13.747 3.594
136 HE2 LYS 15 HE2 LYS 15 -1.294 -14.229 4.369
137 HE3 LYS 15 HE1 LYS 15 -1.845 -13.717 2.775
138 HZ1 LYS 15 HZ1 LYS 15 -1.646 -16.045 2.703
139 HZ2 LYS 15 HZ2 LYS 15 -0.117 -16.033 3.439
140 HZ3 LYS 15 HZ3 LYS 15 -0.304 -15.446 1.856
141 H LYS 16 HN LYS 16 3.112 -11.039 4.394
142 HA LYS 16 HA LYS 16 4.914 -11.791 3.285
143 HB2 LYS 16 HB2 LYS 16 5.718 -12.142 5.627
144 HB3 LYS 16 HB1 LYS 16 5.189 -13.814 5.510
145 HG2 LYS 16 HG2 LYS 16 7.570 -13.659 5.128
146 HG3 LYS 16 HG1 LYS 16 6.753 -14.164 3.648
147 HD2 LYS 16 HD2 LYS 16 6.860 -11.867 2.804
148 HD3 LYS 16 HD1 LYS 16 7.667 -11.357 4.288
149 HE2 LYS 16 HE2 LYS 16 8.736 -13.403 2.346
150 HE3 LYS 16 HE1 LYS 16 9.223 -11.710 2.395
151 HZ1 LYS 16 HZ1 LYS 16 10.800 -13.087 3.564
152 HZ2 LYS 16 HZ2 LYS 16 9.589 -13.693 4.577
153 HZ3 LYS 16 HZ3 LYS 16 10.023 -12.055 4.661
154 H TYR 17 HN TYR 17 3.454 -12.503 1.617
155 HA TYR 17 HA TYR 17 3.088 -13.916 -0.109
156 HB2 TYR 17 HB2 TYR 17 5.081 -15.590 1.392
157 HB3 TYR 17 HB1 TYR 17 4.370 -16.112 -0.130
158 HD1 TYR 17 HD1 TYR 17 5.136 -15.257 -2.192
159 HD2 TYR 17 HD2 TYR 17 6.491 -13.527 1.445
160 HE1 TYR 17 HE1 TYR 17 6.860 -14.023 -3.429
161 HE2 TYR 17 HE2 TYR 17 8.221 -12.290 0.219
162 HH TYR 17 HH TYR 17 9.420 -12.363 -1.845
163 H GLY 18 HN GLY 18 3.409 -16.320 2.492
164 HA2 GLY 18 HA2 GLY 18 0.683 -17.218 1.852
165 HA3 GLY 18 HA1 GLY 18 2.022 -18.347 1.691
Start of MODEL 2
1 H1 GLY 1 HT1 GLY 1 2.202 4.592 -1.944
2 H2 GLY 1 HT2 GLY 1 2.851 3.038 -1.769
3 H3 GLY 1 HT3 GLY 1 1.957 3.729 -0.506
4 HA2 GLY 1 HA1 GLY 1 0.653 2.077 -1.673
5 HA3 GLY 1 HA2 GLY 1 -0.040 3.685 -1.835
6 H GLY 2 HN GLY 2 0.776 0.935 -3.474
7 HA2 GLY 2 HA2 GLY 2 -0.104 1.199 -5.870
8 HA3 GLY 2 HA1 GLY 2 1.204 2.366 -6.015
9 H LEU 3 HN LEU 3 1.343 0.453 -7.808
10 HA LEU 3 HA LEU 3 2.669 -1.901 -6.895
11 HB2 LEU 3 HB2 LEU 3 3.103 -2.364 -9.274
12 HB3 LEU 3 HB1 LEU 3 1.422 -2.022 -8.930
13 HG LEU 3 HG LEU 3 2.029 0.393 -9.738
14 HD11 LEU 3 HD11 LEU 3 4.432 0.066 -9.905
15 HD12 LEU 3 HD12 LEU 3 3.744 0.400 -11.496
16 HD13 LEU 3 HD13 LEU 3 4.192 -1.248 -11.050
17 HD21 LEU 3 HD21 LEU 3 1.768 -1.951 -11.612
18 HD22 LEU 3 HD22 LEU 3 1.451 -0.268 -12.027
19 HD23 LEU 3 HD23 LEU 3 0.444 -1.083 -10.832
20 H ARG 4 HN ARG 4 3.767 1.285 -7.488
21 HA ARG 4 HA ARG 4 6.519 0.576 -7.878
22 HB2 ARG 4 HB2 ARG 4 6.999 2.858 -7.833
23 HB3 ARG 4 HB1 ARG 4 5.352 2.832 -8.437
24 HG2 ARG 4 HG2 ARG 4 6.090 3.335 -5.564
25 HG3 ARG 4 HG1 ARG 4 5.822 4.602 -6.756
26 HD2 ARG 4 HD2 ARG 4 3.783 2.534 -5.943
27 HD3 ARG 4 HD1 ARG 4 3.864 4.175 -5.305
28 HE ARG 4 HE ARG 4 3.294 3.503 -8.129
29 HH11 ARG 4 HH11 ARG 4 2.961 5.603 -5.339
30 HH12 ARG 4 HH12 ARG 4 1.799 6.647 -6.100
31 HH21 ARG 4 HH21 ARG 4 1.774 4.870 -9.127
32 HH22 ARG 4 HH22 ARG 4 1.151 6.244 -8.270
33 H SER 5 HN SER 5 4.382 0.790 -5.243
34 HA SER 5 HA SER 5 6.373 1.067 -3.184
35 HB2 SER 5 HB2 SER 5 3.436 0.384 -2.960
36 HB3 SER 5 HB1 SER 5 4.500 0.879 -1.642
37 HG SER 5 HG SER 5 4.855 2.833 -3.027
38 H LEU 6 HN LEU 6 5.210 -1.494 -5.060
39 HA LEU 6 HA LEU 6 4.473 -3.541 -3.480
40 HB2 LEU 6 HB2 LEU 6 6.225 -3.634 -5.914
41 HB3 LEU 6 HB1 LEU 6 5.623 -5.085 -5.136
42 HG LEU 6 HG LEU 6 3.959 -2.905 -6.399
43 HD11 LEU 6 HD11 LEU 6 5.081 -4.352 -8.005
44 HD12 LEU 6 HD12 LEU 6 3.343 -4.649 -7.992
45 HD13 LEU 6 HD13 LEU 6 4.439 -5.775 -7.188
46 HD21 LEU 6 HD21 LEU 6 2.821 -3.798 -4.452
47 HD22 LEU 6 HD22 LEU 6 3.109 -5.445 -5.013
48 HD23 LEU 6 HD23 LEU 6 2.049 -4.375 -5.930
49 H GLY 7 HN GLY 7 7.915 -2.807 -4.129
50 HA2 GLY 7 HA2 GLY 7 9.113 -4.892 -2.797
51 HA3 GLY 7 HA1 GLY 7 9.769 -3.263 -2.832
52 H ARG 8 HN ARG 8 7.922 -1.889 -1.323
53 HA ARG 8 HA ARG 8 8.505 -2.925 1.336
54 HB2 ARG 8 HB2 ARG 8 7.327 -0.253 0.542
55 HB3 ARG 8 HB1 ARG 8 7.944 -0.700 2.130
56 HG2 ARG 8 HG2 ARG 8 10.174 -0.925 1.245
57 HG3 ARG 8 HG1 ARG 8 9.591 -0.603 -0.384
58 HD2 ARG 8 HD2 ARG 8 8.811 1.641 0.477
59 HD3 ARG 8 HD1 ARG 8 9.726 1.294 1.947
60 HE ARG 8 HE ARG 8 11.144 1.077 -0.593
61 HH11 ARG 8 HH11 ARG 8 10.479 3.006 2.267
62 HH12 ARG 8 HH12 ARG 8 11.906 3.982 2.092
63 HH21 ARG 8 HH21 ARG 8 13.006 2.348 -0.825
64 HH22 ARG 8 HH22 ARG 8 13.345 3.617 0.321
65 H LYS 9 HN LYS 9 5.894 -2.638 -0.866
66 HA LYS 9 HA LYS 9 3.759 -2.716 1.021
67 HB2 LYS 9 HB2 LYS 9 3.524 -1.948 -1.338
68 HB3 LYS 9 HB1 LYS 9 3.735 -3.610 -1.868
69 HG2 LYS 9 HG2 LYS 9 1.717 -4.243 -0.605
70 HG3 LYS 9 HG1 LYS 9 1.492 -2.552 -0.157
71 HD2 LYS 9 HD2 LYS 9 1.298 -1.966 -2.541
72 HD3 LYS 9 HD1 LYS 9 1.475 -3.672 -2.963
73 HE2 LYS 9 HE2 LYS 9 -0.544 -4.179 -1.636
74 HE3 LYS 9 HE1 LYS 9 -0.736 -2.458 -1.305
75 HZ1 LYS 9 HZ1 LYS 9 -2.155 -3.127 -3.115
76 HZ2 LYS 9 HZ2 LYS 9 -0.838 -3.758 -3.977
77 HZ3 LYS 9 HZ3 LYS 9 -0.955 -2.088 -3.704
78 H ILE 10 HN ILE 10 5.799 -5.112 -0.469
79 HA ILE 10 HA ILE 10 4.248 -7.337 0.557
80 HB ILE 10 HB ILE 10 7.083 -7.336 -0.509
81 HG12 ILE 10 HG12 ILE 10 5.515 -6.503 -2.204
82 HG13 ILE 10 HG11 ILE 10 6.135 -8.093 -2.637
83 HG21 ILE 10 HG21 ILE 10 6.523 -9.299 0.847
84 HG22 ILE 10 HG22 ILE 10 6.750 -9.723 -0.849
85 HG23 ILE 10 HG23 ILE 10 5.123 -9.607 -0.180
86 HD11 ILE 10 HD11 ILE 10 3.768 -7.900 -3.127
87 HD12 ILE 10 HD12 ILE 10 3.437 -7.507 -1.438
88 HD13 ILE 10 HD13 ILE 10 4.051 -9.103 -1.871
89 H LEU 11 HN LEU 11 7.000 -5.397 1.439
90 HA LEU 11 HA LEU 11 8.197 -6.968 3.402
91 HB2 LEU 11 HB2 LEU 11 9.212 -4.990 2.410
92 HB3 LEU 11 HB1 LEU 11 8.010 -3.970 3.172
93 HG LEU 11 HG LEU 11 8.919 -4.756 5.399
94 HD11 LEU 11 HD11 LEU 11 11.157 -5.762 3.650
95 HD12 LEU 11 HD12 LEU 11 10.072 -6.750 4.628
96 HD13 LEU 11 HD13 LEU 11 11.197 -5.640 5.409
97 HD21 LEU 11 HD21 LEU 11 9.401 -2.554 4.522
98 HD22 LEU 11 HD22 LEU 11 10.717 -3.203 3.545
99 HD23 LEU 11 HD23 LEU 11 10.836 -3.217 5.305
100 H ARG 12 HN ARG 12 5.386 -4.893 3.593
101 HA ARG 12 HA ARG 12 5.280 -4.734 6.426
102 HB2 ARG 12 HB2 ARG 12 2.920 -3.992 6.053
103 HB3 ARG 12 HB1 ARG 12 4.119 -3.072 5.153
104 HG2 ARG 12 HG2 ARG 12 3.595 -4.330 3.138
105 HG3 ARG 12 HG1 ARG 12 2.420 -5.293 4.035
106 HD2 ARG 12 HD2 ARG 12 2.259 -2.301 3.790
107 HD3 ARG 12 HD1 ARG 12 1.484 -3.405 2.656
108 HE ARG 12 HE ARG 12 0.828 -3.860 5.440
109 HH11 ARG 12 HH11 ARG 12 -0.030 -2.174 2.494
110 HH12 ARG 12 HH12 ARG 12 -1.703 -1.988 2.922
111 HH21 ARG 12 HH21 ARG 12 -1.361 -3.626 6.017
112 HH22 ARG 12 HH22 ARG 12 -2.461 -2.804 4.948
113 H ALA 13 HN ALA 13 4.464 -7.193 4.201
114 HA ALA 13 HA ALA 13 3.423 -9.207 4.347
115 HB1 ALA 13 HB1 ALA 13 5.303 -9.583 5.855
116 HB2 ALA 13 HB2 ALA 13 3.879 -10.490 6.366
117 HB3 ALA 13 HB3 ALA 13 4.334 -9.012 7.216
118 H TRP 14 HN TRP 14 1.353 -8.248 3.961
119 HA TRP 14 HA TRP 14 -0.474 -7.548 5.977
120 HB2 TRP 14 HB2 TRP 14 -1.886 -8.765 3.813
121 HB3 TRP 14 HB1 TRP 14 -1.712 -7.052 4.183
122 HD1 TRP 14 HD1 TRP 14 -0.051 -5.641 2.713
123 HE1 TRP 14 HE1 TRP 14 1.277 -6.143 0.566
124 HE3 TRP 14 HE3 TRP 14 -0.618 -10.720 2.569
125 HZ2 TRP 14 HZ2 TRP 14 1.974 -8.385 -0.985
126 HZ3 TRP 14 HZ3 TRP 14 0.419 -11.971 0.721
127 HH2 TRP 14 HH2 TRP 14 1.689 -10.824 -1.020
128 H LYS 15 HN LYS 15 -0.573 -10.518 4.039
129 HA LYS 15 HA LYS 15 -1.293 -12.012 6.473
130 HB2 LYS 15 HB2 LYS 15 -2.530 -13.563 4.982
131 HB3 LYS 15 HB1 LYS 15 -3.190 -11.934 4.983
132 HG2 LYS 15 HG2 LYS 15 -3.116 -12.007 2.769
133 HG3 LYS 15 HG1 LYS 15 -1.356 -11.954 2.892
134 HD2 LYS 15 HD2 LYS 15 -2.001 -13.833 1.523
135 HD3 LYS 15 HD1 LYS 15 -1.332 -14.421 3.046
136 HE2 LYS 15 HE2 LYS 15 -3.663 -14.632 3.905
137 HE3 LYS 15 HE1 LYS 15 -4.245 -14.221 2.294
138 HZ1 LYS 15 HZ1 LYS 15 -2.521 -16.554 2.940
139 HZ2 LYS 15 HZ2 LYS 15 -3.177 -16.180 1.417
140 HZ3 LYS 15 HZ3 LYS 15 -4.195 -16.617 2.699
141 H LYS 16 HN LYS 16 1.109 -11.405 4.432
142 HA LYS 16 HA LYS 16 3.014 -12.406 3.712
143 HB2 LYS 16 HB2 LYS 16 3.187 -12.327 6.236
144 HB3 LYS 16 HB1 LYS 16 2.760 -14.033 6.235
145 HG2 LYS 16 HG2 LYS 16 5.184 -13.655 6.405
146 HG3 LYS 16 HG1 LYS 16 4.743 -14.572 4.963
147 HD2 LYS 16 HD2 LYS 16 4.872 -12.502 3.633
148 HD3 LYS 16 HD1 LYS 16 5.361 -11.618 5.077
149 HE2 LYS 16 HE2 LYS 16 6.881 -13.963 3.959
150 HE3 LYS 16 HE1 LYS 16 7.227 -12.289 3.533
151 HZ1 LYS 16 HZ1 LYS 16 7.643 -11.836 5.886
152 HZ2 LYS 16 HZ2 LYS 16 8.688 -13.021 5.278
153 HZ3 LYS 16 HZ3 LYS 16 7.377 -13.468 6.260
154 H TYR 17 HN TYR 17 1.350 -13.440 2.125
155 HA TYR 17 HA TYR 17 1.165 -15.076 0.589
156 HB2 TYR 17 HB2 TYR 17 3.289 -16.475 2.220
157 HB3 TYR 17 HB1 TYR 17 2.713 -17.014 0.646
158 HD1 TYR 17 HD1 TYR 17 3.027 -15.452 -1.337
159 HD2 TYR 17 HD2 TYR 17 4.992 -14.872 2.387
160 HE1 TYR 17 HE1 TYR 17 4.678 -14.005 -2.442
161 HE2 TYR 17 HE2 TYR 17 6.646 -13.420 1.294
162 HH TYR 17 HH TYR 17 7.570 -13.093 -0.987
163 H GLY 18 HN GLY 18 1.698 -17.006 3.555
164 HA2 GLY 18 HA2 GLY 18 -0.618 -18.620 2.767
165 HA3 GLY 18 HA1 GLY 18 0.604 -19.071 3.947
Start of MODEL 3
1 H1 GLY 1 HT1 GLY 1 0.748 2.296 -1.100
2 H2 GLY 1 HT2 GLY 1 0.321 0.681 -0.832
3 H3 GLY 1 HT3 GLY 1 -0.529 1.603 -1.971
4 HA2 GLY 1 HA1 GLY 1 1.416 1.766 -3.369
5 HA3 GLY 1 HA2 GLY 1 2.338 0.866 -2.173
6 H GLY 2 HN GLY 2 2.260 -0.026 -4.752
7 HA2 GLY 2 HA2 GLY 2 1.045 -2.619 -4.438
8 HA3 GLY 2 HA1 GLY 2 0.259 -1.630 -5.659
9 H LEU 3 HN LEU 3 1.413 -1.063 -7.554
10 HA LEU 3 HA LEU 3 2.919 -3.294 -8.501
11 HB2 LEU 3 HB2 LEU 3 2.450 -0.637 -9.863
12 HB3 LEU 3 HB1 LEU 3 2.992 -2.110 -10.634
13 HG LEU 3 HG LEU 3 0.733 -3.109 -9.910
14 HD11 LEU 3 HD11 LEU 3 -1.077 -1.481 -9.663
15 HD12 LEU 3 HD12 LEU 3 0.102 -0.169 -9.638
16 HD13 LEU 3 HD13 LEU 3 0.083 -1.363 -8.339
17 HD21 LEU 3 HD21 LEU 3 1.319 -2.606 -12.211
18 HD22 LEU 3 HD22 LEU 3 0.879 -0.914 -11.974
19 HD23 LEU 3 HD23 LEU 3 -0.360 -2.169 -11.896
20 H ARG 4 HN ARG 4 3.720 0.170 -8.445
21 HA ARG 4 HA ARG 4 6.506 -0.411 -8.908
22 HB2 ARG 4 HB2 ARG 4 6.788 2.012 -8.990
23 HB3 ARG 4 HB1 ARG 4 5.438 1.505 -9.994
24 HG2 ARG 4 HG2 ARG 4 4.054 2.057 -7.817
25 HG3 ARG 4 HG1 ARG 4 5.445 3.088 -7.479
26 HD2 ARG 4 HD2 ARG 4 3.558 3.192 -9.814
27 HD3 ARG 4 HD1 ARG 4 3.905 4.449 -8.629
28 HE ARG 4 HE ARG 4 6.167 3.638 -10.229
29 HH11 ARG 4 HH11 ARG 4 3.418 5.804 -10.008
30 HH12 ARG 4 HH12 ARG 4 4.132 7.013 -11.039
31 HH21 ARG 4 HH21 ARG 4 7.086 5.194 -11.605
32 HH22 ARG 4 HH22 ARG 4 6.214 6.659 -11.958
33 H SER 5 HN SER 5 4.467 0.069 -6.278
34 HA SER 5 HA SER 5 6.458 0.883 -4.377
35 HB2 SER 5 HB2 SER 5 3.800 -0.294 -3.641
36 HB3 SER 5 HB1 SER 5 4.723 0.972 -2.829
37 HG SER 5 HG SER 5 4.258 2.353 -4.593
38 H LEU 6 HN LEU 6 5.713 -2.012 -5.857
39 HA LEU 6 HA LEU 6 5.217 -3.951 -4.080
40 HB2 LEU 6 HB2 LEU 6 5.444 -4.309 -6.476
41 HB3 LEU 6 HB1 LEU 6 7.185 -4.152 -6.348
42 HG LEU 6 HG LEU 6 7.259 -6.193 -4.960
43 HD11 LEU 6 HD11 LEU 6 5.042 -6.058 -3.972
44 HD12 LEU 6 HD12 LEU 6 5.273 -7.605 -4.785
45 HD13 LEU 6 HD13 LEU 6 4.308 -6.343 -5.550
46 HD21 LEU 6 HD21 LEU 6 5.814 -6.555 -7.582
47 HD22 LEU 6 HD22 LEU 6 6.778 -7.774 -6.747
48 HD23 LEU 6 HD23 LEU 6 7.551 -6.325 -7.390
49 H GLY 7 HN GLY 7 8.573 -2.827 -4.725
50 HA2 GLY 7 HA2 GLY 7 9.904 -4.590 -3.037
51 HA3 GLY 7 HA1 GLY 7 10.437 -2.950 -3.375
52 H ARG 8 HN ARG 8 8.435 -1.489 -2.229
53 HA ARG 8 HA ARG 8 9.118 -1.619 0.550
54 HB2 ARG 8 HB2 ARG 8 7.282 0.159 -1.050
55 HB3 ARG 8 HB1 ARG 8 7.486 0.322 0.689
56 HG2 ARG 8 HG2 ARG 8 9.752 0.477 -1.280
57 HG3 ARG 8 HG1 ARG 8 8.865 1.881 -0.678
58 HD2 ARG 8 HD2 ARG 8 10.421 -0.099 0.988
59 HD3 ARG 8 HD1 ARG 8 10.911 1.552 0.598
60 HE ARG 8 HE ARG 8 8.355 1.267 1.945
61 HH11 ARG 8 HH11 ARG 8 11.806 1.783 2.329
62 HH12 ARG 8 HH12 ARG 8 11.630 2.649 3.831
63 HH21 ARG 8 HH21 ARG 8 8.126 2.364 3.908
64 HH22 ARG 8 HH22 ARG 8 9.529 2.974 4.738
65 H LYS 9 HN LYS 9 6.433 -2.637 -1.418
66 HA LYS 9 HA LYS 9 4.551 -2.902 0.706
67 HB2 LYS 9 HB2 LYS 9 3.964 -2.686 -1.721
68 HB3 LYS 9 HB1 LYS 9 4.542 -4.330 -1.957
69 HG2 LYS 9 HG2 LYS 9 2.834 -5.218 -0.560
70 HG3 LYS 9 HG1 LYS 9 2.343 -3.606 -0.035
71 HD2 LYS 9 HD2 LYS 9 1.683 -3.083 -2.356
72 HD3 LYS 9 HD1 LYS 9 2.117 -4.729 -2.826
73 HE2 LYS 9 HE2 LYS 9 0.431 -5.629 -1.331
74 HE3 LYS 9 HE1 LYS 9 0.036 -4.005 -0.768
75 HZ1 LYS 9 HZ1 LYS 9 -1.535 -4.852 -2.431
76 HZ2 LYS 9 HZ2 LYS 9 -0.281 -4.946 -3.569
77 HZ3 LYS 9 HZ3 LYS 9 -0.754 -3.443 -2.949
78 H ILE 10 HN ILE 10 6.807 -5.099 -0.903
79 HA ILE 10 HA ILE 10 6.090 -7.418 0.568
80 HB ILE 10 HB ILE 10 8.675 -6.727 -0.843
81 HG12 ILE 10 HG12 ILE 10 6.776 -6.832 -2.353
82 HG13 ILE 10 HG11 ILE 10 7.804 -8.243 -2.594
83 HG21 ILE 10 HG21 ILE 10 9.197 -9.105 -0.778
84 HG22 ILE 10 HG22 ILE 10 7.741 -9.407 0.169
85 HG23 ILE 10 HG23 ILE 10 9.054 -8.449 0.854
86 HD11 ILE 10 HD11 ILE 10 5.220 -8.168 -1.048
87 HD12 ILE 10 HD12 ILE 10 6.255 -9.583 -1.250
88 HD13 ILE 10 HD13 ILE 10 5.466 -8.860 -2.652
89 H LEU 11 HN LEU 11 8.277 -4.758 1.127
90 HA LEU 11 HA LEU 11 9.772 -5.775 3.255
91 HB2 LEU 11 HB2 LEU 11 10.187 -3.646 1.987
92 HB3 LEU 11 HB1 LEU 11 8.868 -2.917 2.877
93 HG LEU 11 HG LEU 11 11.184 -4.090 4.376
94 HD11 LEU 11 HD11 LEU 11 12.303 -1.910 4.270
95 HD12 LEU 11 HD12 LEU 11 11.101 -1.356 3.105
96 HD13 LEU 11 HD13 LEU 11 12.199 -2.670 2.682
97 HD21 LEU 11 HD21 LEU 11 10.607 -2.383 5.997
98 HD22 LEU 11 HD22 LEU 11 9.173 -3.325 5.589
99 HD23 LEU 11 HD23 LEU 11 9.395 -1.716 4.902
100 H ARG 12 HN ARG 12 6.571 -4.345 3.138
101 HA ARG 12 HA ARG 12 6.146 -4.138 5.923
102 HB2 ARG 12 HB2 ARG 12 4.670 -2.938 4.500
103 HB3 ARG 12 HB1 ARG 12 4.259 -4.382 3.585
104 HG2 ARG 12 HG2 ARG 12 3.154 -5.296 5.598
105 HG3 ARG 12 HG1 ARG 12 3.485 -3.776 6.428
106 HD2 ARG 12 HD2 ARG 12 2.031 -2.574 5.046
107 HD3 ARG 12 HD1 ARG 12 1.991 -3.851 3.828
108 HE ARG 12 HE ARG 12 0.971 -4.764 6.323
109 HH11 ARG 12 HH11 ARG 12 0.121 -2.777 3.575
110 HH12 ARG 12 HH12 ARG 12 -1.570 -3.176 3.643
111 HH21 ARG 12 HH21 ARG 12 -1.237 -5.296 6.430
112 HH22 ARG 12 HH22 ARG 12 -2.344 -4.614 5.272
113 H ALA 13 HN ALA 13 5.633 -6.742 3.611
114 HA ALA 13 HA ALA 13 5.054 -8.931 3.799
115 HB1 ALA 13 HB1 ALA 13 6.299 -8.650 6.535
116 HB2 ALA 13 HB2 ALA 13 7.167 -8.996 5.038
117 HB3 ALA 13 HB3 ALA 13 6.005 -10.161 5.675
118 H TRP 14 HN TRP 14 2.845 -7.861 3.873
119 HA TRP 14 HA TRP 14 1.387 -7.728 6.266
120 HB2 TRP 14 HB2 TRP 14 -0.578 -7.494 4.876
121 HB3 TRP 14 HB1 TRP 14 0.744 -6.592 4.147
122 HD1 TRP 14 HD1 TRP 14 -1.874 -9.034 3.302
123 HE1 TRP 14 HE1 TRP 14 -1.484 -10.050 0.973
124 HE3 TRP 14 HE3 TRP 14 2.935 -7.454 2.514
125 HZ2 TRP 14 HZ2 TRP 14 0.593 -10.173 -0.933
126 HZ3 TRP 14 HZ3 TRP 14 4.041 -8.076 0.409
127 HH2 TRP 14 HH2 TRP 14 2.893 -9.404 -1.279
128 H LYS 15 HN LYS 15 1.847 -10.343 3.944
129 HA LYS 15 HA LYS 15 0.533 -12.158 5.862
130 HB2 LYS 15 HB2 LYS 15 0.001 -13.636 3.968
131 HB3 LYS 15 HB1 LYS 15 -0.736 -12.051 3.776
132 HG2 LYS 15 HG2 LYS 15 0.632 -11.470 2.030
133 HG3 LYS 15 HG1 LYS 15 1.915 -12.575 2.523
134 HD2 LYS 15 HD2 LYS 15 0.817 -13.354 0.492
135 HD3 LYS 15 HD1 LYS 15 0.548 -14.475 1.826
136 HE2 LYS 15 HE2 LYS 15 -1.669 -13.446 2.190
137 HE3 LYS 15 HE1 LYS 15 -1.390 -12.415 0.785
138 HZ1 LYS 15 HZ1 LYS 15 -2.715 -14.376 0.236
139 HZ2 LYS 15 HZ2 LYS 15 -1.458 -15.388 0.747
140 HZ3 LYS 15 HZ3 LYS 15 -1.241 -14.377 -0.599
141 H LYS 16 HN LYS 16 3.400 -11.292 4.338
142 HA LYS 16 HA LYS 16 5.488 -12.161 4.191
143 HB2 LYS 16 HB2 LYS 16 4.930 -12.594 6.661
144 HB3 LYS 16 HB1 LYS 16 4.638 -14.261 6.186
145 HG2 LYS 16 HG2 LYS 16 6.877 -13.959 7.100
146 HG3 LYS 16 HG1 LYS 16 6.935 -14.461 5.408
147 HD2 LYS 16 HD2 LYS 16 7.366 -12.179 4.716
148 HD3 LYS 16 HD1 LYS 16 7.197 -11.617 6.380
149 HE2 LYS 16 HE2 LYS 16 9.287 -13.561 5.417
150 HE3 LYS 16 HE1 LYS 16 9.551 -11.833 5.652
151 HZ1 LYS 16 HZ1 LYS 16 9.026 -12.101 7.992
152 HZ2 LYS 16 HZ2 LYS 16 10.304 -13.129 7.557
153 HZ3 LYS 16 HZ3 LYS 16 8.746 -13.759 7.772
154 H TYR 17 HN TYR 17 3.338 -13.150 2.484
155 HA TYR 17 HA TYR 17 2.994 -14.614 0.809
156 HB2 TYR 17 HB2 TYR 17 5.808 -15.362 1.526
157 HB3 TYR 17 HB1 TYR 17 4.915 -16.291 0.326
158 HD1 TYR 17 HD1 TYR 17 4.089 -15.158 -1.728
159 HD2 TYR 17 HD2 TYR 17 6.738 -13.233 0.988
160 HE1 TYR 17 HE1 TYR 17 4.666 -13.521 -3.464
161 HE2 TYR 17 HE2 TYR 17 7.318 -11.583 -0.743
162 HH TYR 17 HH TYR 17 7.308 -11.383 -3.172
163 H GLY 18 HN GLY 18 1.340 -15.852 1.253
164 HA2 GLY 18 HA2 GLY 18 1.710 -18.505 2.246
165 HA3 GLY 18 HA1 GLY 18 0.892 -17.467 3.408
Start of MODEL 4
1 H1 GLY 1 HT1 GLY 1 -1.022 2.989 -1.781
2 H2 GLY 1 HT2 GLY 1 -0.301 2.349 -0.387
3 H3 GLY 1 HT3 GLY 1 -1.393 1.409 -1.283
4 HA2 GLY 1 HA1 GLY 1 1.302 2.305 -2.134
5 HA3 GLY 1 HA2 GLY 1 0.814 0.659 -1.752
6 H GLY 2 HN GLY 2 1.151 -0.294 -3.709
7 HA2 GLY 2 HA2 GLY 2 -0.716 -0.454 -5.631
8 HA3 GLY 2 HA1 GLY 2 0.195 0.962 -6.135
9 H LEU 3 HN LEU 3 1.245 0.273 -7.889
10 HA LEU 3 HA LEU 3 2.137 -2.415 -8.208
11 HB2 LEU 3 HB2 LEU 3 2.710 0.055 -9.840
12 HB3 LEU 3 HB1 LEU 3 3.113 -1.581 -10.327
13 HG LEU 3 HG LEU 3 0.315 -0.538 -9.863
14 HD11 LEU 3 HD11 LEU 3 1.376 0.393 -11.872
15 HD12 LEU 3 HD12 LEU 3 0.063 -0.712 -12.271
16 HD13 LEU 3 HD13 LEU 3 1.736 -1.242 -12.428
17 HD21 LEU 3 HD21 LEU 3 0.534 -2.913 -9.333
18 HD22 LEU 3 HD22 LEU 3 1.279 -3.198 -10.906
19 HD23 LEU 3 HD23 LEU 3 -0.401 -2.671 -10.809
20 H ARG 4 HN ARG 4 3.998 0.637 -8.110
21 HA ARG 4 HA ARG 4 6.477 -0.757 -7.902
22 HB2 ARG 4 HB2 ARG 4 7.510 1.448 -7.593
23 HB3 ARG 4 HB1 ARG 4 6.435 1.410 -8.978
24 HG2 ARG 4 HG2 ARG 4 5.521 2.463 -6.323
25 HG3 ARG 4 HG1 ARG 4 6.408 3.473 -7.464
26 HD2 ARG 4 HD2 ARG 4 3.739 2.136 -7.864
27 HD3 ARG 4 HD1 ARG 4 4.085 3.864 -7.825
28 HE ARG 4 HE ARG 4 4.987 2.050 -9.976
29 HH11 ARG 4 HH11 ARG 4 3.840 5.180 -8.889
30 HH12 ARG 4 HH12 ARG 4 3.822 5.861 -10.489
31 HH21 ARG 4 HH21 ARG 4 4.950 2.928 -12.054
32 HH22 ARG 4 HH22 ARG 4 4.475 4.588 -12.293
33 H SER 5 HN SER 5 4.143 0.247 -5.658
34 HA SER 5 HA SER 5 5.828 0.498 -3.377
35 HB2 SER 5 HB2 SER 5 2.867 -0.096 -3.447
36 HB3 SER 5 HB1 SER 5 3.780 0.622 -2.121
37 HG SER 5 HG SER 5 4.281 2.372 -3.634
38 H LEU 6 HN LEU 6 4.680 -2.129 -5.156
39 HA LEU 6 HA LEU 6 3.952 -4.146 -3.530
40 HB2 LEU 6 HB2 LEU 6 4.176 -4.366 -5.945
41 HB3 LEU 6 HB1 LEU 6 5.922 -4.333 -5.806
42 HG LEU 6 HG LEU 6 5.778 -6.455 -4.471
43 HD11 LEU 6 HD11 LEU 6 3.725 -7.777 -4.678
44 HD12 LEU 6 HD12 LEU 6 2.919 -6.391 -5.416
45 HD13 LEU 6 HD13 LEU 6 3.477 -6.302 -3.744
46 HD21 LEU 6 HD21 LEU 6 5.470 -7.872 -6.421
47 HD22 LEU 6 HD22 LEU 6 6.381 -6.421 -6.842
48 HD23 LEU 6 HD23 LEU 6 4.676 -6.548 -7.275
49 H GLY 7 HN GLY 7 7.377 -3.352 -4.185
50 HA2 GLY 7 HA2 GLY 7 8.521 -5.421 -2.710
51 HA3 GLY 7 HA1 GLY 7 9.301 -3.888 -3.053
52 H ARG 8 HN ARG 8 7.306 -2.321 -1.592
53 HA ARG 8 HA ARG 8 8.400 -2.762 1.077
54 HB2 ARG 8 HB2 ARG 8 6.737 -0.492 -0.038
55 HB3 ARG 8 HB1 ARG 8 7.413 -0.545 1.586
56 HG2 ARG 8 HG2 ARG 8 9.664 -0.583 0.658
57 HG3 ARG 8 HG1 ARG 8 8.995 -0.560 -0.975
58 HD2 ARG 8 HD2 ARG 8 9.739 1.660 -0.248
59 HD3 ARG 8 HD1 ARG 8 8.006 1.613 -0.570
60 HE ARG 8 HE ARG 8 7.963 1.223 2.026
61 HH11 ARG 8 HH11 ARG 8 10.017 3.399 0.211
62 HH12 ARG 8 HH12 ARG 8 10.147 4.558 1.504
63 HH21 ARG 8 HH21 ARG 8 8.104 2.723 3.710
64 HH22 ARG 8 HH22 ARG 8 9.042 4.179 3.501
65 H LYS 9 HN LYS 9 5.423 -3.012 -0.680
66 HA LYS 9 HA LYS 9 3.651 -3.186 1.532
67 HB2 LYS 9 HB2 LYS 9 2.975 -2.798 -0.860
68 HB3 LYS 9 HB1 LYS 9 3.337 -4.490 -1.178
69 HG2 LYS 9 HG2 LYS 9 1.656 -5.053 0.630
70 HG3 LYS 9 HG1 LYS 9 1.175 -3.355 0.572
71 HD2 LYS 9 HD2 LYS 9 -0.306 -4.593 -0.848
72 HD3 LYS 9 HD1 LYS 9 0.762 -3.637 -1.878
73 HE2 LYS 9 HE2 LYS 9 2.166 -5.600 -2.248
74 HE3 LYS 9 HE1 LYS 9 1.115 -6.559 -1.211
75 HZ1 LYS 9 HZ1 LYS 9 -0.709 -6.099 -2.780
76 HZ2 LYS 9 HZ2 LYS 9 0.566 -6.962 -3.487
77 HZ3 LYS 9 HZ3 LYS 9 0.389 -5.304 -3.804
78 H ILE 10 HN ILE 10 5.615 -5.521 -0.221
79 HA ILE 10 HA ILE 10 4.613 -7.841 1.090
80 HB ILE 10 HB ILE 10 7.329 -7.434 -0.179
81 HG12 ILE 10 HG12 ILE 10 5.562 -6.908 -1.776
82 HG13 ILE 10 HG11 ILE 10 6.335 -8.430 -2.204
83 HG21 ILE 10 HG21 ILE 10 5.784 -9.956 0.405
84 HG22 ILE 10 HG22 ILE 10 7.242 -9.404 1.229
85 HG23 ILE 10 HG23 ILE 10 7.313 -9.868 -0.470
86 HD11 ILE 10 HD11 ILE 10 3.926 -8.526 -2.497
87 HD12 ILE 10 HD12 ILE 10 3.695 -8.130 -0.794
88 HD13 ILE 10 HD13 ILE 10 4.461 -9.652 -1.247
89 H LEU 11 HN LEU 11 7.012 -5.444 1.845
90 HA LEU 11 HA LEU 11 8.624 -6.911 3.601
91 HB2 LEU 11 HB2 LEU 11 9.254 -4.753 2.574
92 HB3 LEU 11 HB1 LEU 11 8.095 -3.944 3.612
93 HG LEU 11 HG LEU 11 9.387 -4.706 5.592
94 HD11 LEU 11 HD11 LEU 11 11.385 -5.637 3.533
95 HD12 LEU 11 HD12 LEU 11 10.422 -6.678 4.583
96 HD13 LEU 11 HD13 LEU 11 11.630 -5.596 5.280
97 HD21 LEU 11 HD21 LEU 11 10.914 -3.112 3.537
98 HD22 LEU 11 HD22 LEU 11 11.270 -3.160 5.265
99 HD23 LEU 11 HD23 LEU 11 9.743 -2.485 4.698
100 H ARG 12 HN ARG 12 5.655 -5.073 4.181
101 HA ARG 12 HA ARG 12 5.874 -5.135 7.013
102 HB2 ARG 12 HB2 ARG 12 3.568 -4.368 7.083
103 HB3 ARG 12 HB1 ARG 12 4.456 -3.482 5.856
104 HG2 ARG 12 HG2 ARG 12 2.464 -3.900 4.798
105 HG3 ARG 12 HG1 ARG 12 3.463 -5.235 4.227
106 HD2 ARG 12 HD2 ARG 12 1.395 -6.193 4.805
107 HD3 ARG 12 HD1 ARG 12 2.492 -6.601 6.120
108 HE ARG 12 HE ARG 12 0.518 -4.412 6.288
109 HH11 ARG 12 HH11 ARG 12 2.240 -7.102 7.761
110 HH12 ARG 12 HH12 ARG 12 1.315 -7.037 9.232
111 HH21 ARG 12 HH21 ARG 12 -0.670 -4.326 8.214
112 HH22 ARG 12 HH22 ARG 12 -0.319 -5.447 9.499
113 H ALA 13 HN ALA 13 4.994 -7.469 4.708
114 HA ALA 13 HA ALA 13 4.240 -9.601 4.806
115 HB1 ALA 13 HB1 ALA 13 6.252 -9.818 6.195
116 HB2 ALA 13 HB2 ALA 13 4.986 -10.952 6.662
117 HB3 ALA 13 HB3 ALA 13 5.278 -9.509 7.633
118 H TRP 14 HN TRP 14 2.044 -9.009 4.593
119 HA TRP 14 HA TRP 14 0.313 -8.625 6.801
120 HB2 TRP 14 HB2 TRP 14 -1.150 -9.842 4.685
121 HB3 TRP 14 HB1 TRP 14 -1.098 -8.136 5.123
122 HD1 TRP 14 HD1 TRP 14 0.303 -6.518 3.594
123 HE1 TRP 14 HE1 TRP 14 1.464 -6.797 1.320
124 HE3 TRP 14 HE3 TRP 14 0.143 -11.615 3.210
125 HZ2 TRP 14 HZ2 TRP 14 2.201 -8.888 -0.414
126 HZ3 TRP 14 HZ3 TRP 14 1.097 -12.675 1.211
127 HH2 TRP 14 HH2 TRP 14 2.106 -11.341 -0.567
128 H LYS 15 HN LYS 15 0.252 -11.408 4.610
129 HA LYS 15 HA LYS 15 0.182 -13.163 6.963
130 HB2 LYS 15 HB2 LYS 15 -1.034 -14.781 5.352
131 HB3 LYS 15 HB1 LYS 15 -1.939 -13.461 6.072
132 HG2 LYS 15 HG2 LYS 15 -2.641 -13.042 4.006
133 HG3 LYS 15 HG1 LYS 15 -1.039 -12.356 3.729
134 HD2 LYS 15 HD2 LYS 15 -0.261 -14.329 2.708
135 HD3 LYS 15 HD1 LYS 15 -1.623 -15.275 3.318
136 HE2 LYS 15 HE2 LYS 15 -3.139 -13.900 1.911
137 HE3 LYS 15 HE1 LYS 15 -1.725 -13.096 1.233
138 HZ1 LYS 15 HZ1 LYS 15 -2.206 -16.023 1.077
139 HZ2 LYS 15 HZ2 LYS 15 -0.990 -15.142 0.290
140 HZ3 LYS 15 HZ3 LYS 15 -2.610 -14.924 -0.153
141 H LYS 16 HN LYS 16 2.165 -12.066 4.778
142 HA LYS 16 HA LYS 16 4.119 -12.723 3.830
143 HB2 LYS 16 HB2 LYS 16 4.476 -13.124 6.281
144 HB3 LYS 16 HB1 LYS 16 4.088 -14.815 6.005
145 HG2 LYS 16 HG2 LYS 16 6.475 -14.520 6.095
146 HG3 LYS 16 HG1 LYS 16 5.994 -14.983 4.463
147 HD2 LYS 16 HD2 LYS 16 6.221 -12.722 3.689
148 HD3 LYS 16 HD1 LYS 16 6.498 -12.140 5.332
149 HE2 LYS 16 HE2 LYS 16 8.292 -14.065 3.856
150 HE3 LYS 16 HE1 LYS 16 8.579 -12.331 3.996
151 HZ1 LYS 16 HZ1 LYS 16 8.383 -14.210 6.296
152 HZ2 LYS 16 HZ2 LYS 16 8.767 -12.559 6.373
153 HZ3 LYS 16 HZ3 LYS 16 9.837 -13.644 5.625
154 H TYR 17 HN TYR 17 2.540 -13.516 2.095
155 HA TYR 17 HA TYR 17 1.955 -14.998 0.492
156 HB2 TYR 17 HB2 TYR 17 4.782 -15.763 1.129
157 HB3 TYR 17 HB1 TYR 17 3.882 -16.592 -0.141
158 HD1 TYR 17 HD1 TYR 17 5.572 -13.525 0.830
159 HD2 TYR 17 HD2 TYR 17 3.104 -15.343 -2.121
160 HE1 TYR 17 HE1 TYR 17 6.080 -11.687 -0.715
161 HE2 TYR 17 HE2 TYR 17 3.609 -13.512 -3.677
162 HH TYR 17 HH TYR 17 6.108 -11.289 -3.175
163 H GLY 18 HN GLY 18 0.506 -15.746 2.413
164 HA2 GLY 18 HA2 GLY 18 0.883 -18.636 2.785
165 HA3 GLY 18 HA1 GLY 18 -0.202 -17.623 3.731
Start of MODEL 5
1 H1 GLY 1 HT1 GLY 1 1.904 2.529 -3.303
2 H2 GLY 1 HT2 GLY 1 0.408 2.132 -2.616
3 H3 GLY 1 HT3 GLY 1 0.832 3.755 -2.830
4 HA2 GLY 1 HA1 GLY 1 -0.722 3.162 -4.526
5 HA3 GLY 1 HA2 GLY 1 0.858 3.427 -5.247
6 H GLY 2 HN GLY 2 1.050 0.591 -3.554
7 HA2 GLY 2 HA2 GLY 2 0.597 -1.628 -4.017
8 HA3 GLY 2 HA1 GLY 2 -0.403 -1.113 -5.362
9 H LEU 3 HN LEU 3 0.829 -0.311 -7.312
10 HA LEU 3 HA LEU 3 2.171 -2.534 -8.297
11 HB2 LEU 3 HB2 LEU 3 2.094 0.286 -9.355
12 HB3 LEU 3 HB1 LEU 3 2.773 -1.062 -10.243
13 HG LEU 3 HG LEU 3 0.456 -2.152 -10.014
14 HD11 LEU 3 HD11 LEU 3 -0.290 0.704 -9.405
15 HD12 LEU 3 HD12 LEU 3 -0.445 -0.668 -8.307
16 HD13 LEU 3 HD13 LEU 3 -1.414 -0.604 -9.778
17 HD21 LEU 3 HD21 LEU 3 1.392 -1.246 -12.099
18 HD22 LEU 3 HD22 LEU 3 0.732 0.338 -11.689
19 HD23 LEU 3 HD23 LEU 3 -0.354 -1.018 -11.990
20 H ARG 4 HN ARG 4 3.679 0.682 -7.871
21 HA ARG 4 HA ARG 4 6.294 -0.523 -7.995
22 HB2 ARG 4 HB2 ARG 4 7.181 1.743 -7.767
23 HB3 ARG 4 HB1 ARG 4 5.985 1.638 -9.045
24 HG2 ARG 4 HG2 ARG 4 5.275 2.624 -6.302
25 HG3 ARG 4 HG1 ARG 4 5.950 3.691 -7.533
26 HD2 ARG 4 HD2 ARG 4 3.371 2.140 -7.649
27 HD3 ARG 4 HD1 ARG 4 3.573 3.891 -7.622
28 HE ARG 4 HE ARG 4 4.903 2.772 -9.864
29 HH11 ARG 4 HH11 ARG 4 1.718 3.636 -8.682
30 HH12 ARG 4 HH12 ARG 4 1.008 3.712 -10.267
31 HH21 ARG 4 HH21 ARG 4 4.000 2.918 -11.941
32 HH22 ARG 4 HH22 ARG 4 2.321 3.333 -12.135
33 H SER 5 HN SER 5 4.052 0.191 -5.593
34 HA SER 5 HA SER 5 5.865 0.661 -3.430
35 HB2 SER 5 HB2 SER 5 2.977 -0.201 -3.244
36 HB3 SER 5 HB1 SER 5 3.915 0.705 -2.055
37 HG SER 5 HG SER 5 4.101 2.369 -3.746
38 H LEU 6 HN LEU 6 4.839 -2.078 -5.101
39 HA LEU 6 HA LEU 6 4.266 -4.078 -3.409
40 HB2 LEU 6 HB2 LEU 6 4.525 -4.142 -5.918
41 HB3 LEU 6 HB1 LEU 6 6.234 -4.412 -5.663
42 HG LEU 6 HG LEU 6 4.209 -6.276 -4.458
43 HD11 LEU 6 HD11 LEU 6 4.433 -7.676 -6.473
44 HD12 LEU 6 HD12 LEU 6 5.316 -6.368 -7.262
45 HD13 LEU 6 HD13 LEU 6 3.627 -6.144 -6.804
46 HD21 LEU 6 HD21 LEU 6 6.044 -7.892 -4.699
47 HD22 LEU 6 HD22 LEU 6 6.518 -6.509 -3.713
48 HD23 LEU 6 HD23 LEU 6 7.061 -6.626 -5.386
49 H GLY 7 HN GLY 7 7.635 -3.066 -4.119
50 HA2 GLY 7 HA2 GLY 7 8.929 -5.037 -2.619
51 HA3 GLY 7 HA1 GLY 7 9.587 -3.448 -2.968
52 H ARG 8 HN ARG 8 7.618 -1.935 -1.581
53 HA ARG 8 HA ARG 8 8.590 -2.342 1.138
54 HB2 ARG 8 HB2 ARG 8 6.961 -0.080 -0.044
55 HB3 ARG 8 HB1 ARG 8 7.705 -0.095 1.553
56 HG2 ARG 8 HG2 ARG 8 9.903 -0.140 0.596
57 HG3 ARG 8 HG1 ARG 8 9.238 -0.332 -1.026
58 HD2 ARG 8 HD2 ARG 8 8.154 1.885 -0.787
59 HD3 ARG 8 HD1 ARG 8 8.960 2.071 0.772
60 HE ARG 8 HE ARG 8 10.895 1.458 -1.170
61 HH11 ARG 8 HH11 ARG 8 8.731 4.072 -0.308
62 HH12 ARG 8 HH12 ARG 8 9.767 5.315 -0.938
63 HH21 ARG 8 HH21 ARG 8 12.258 3.085 -2.025
64 HH22 ARG 8 HH22 ARG 8 11.765 4.753 -1.941
65 H LYS 9 HN LYS 9 5.799 -2.833 -0.735
66 HA LYS 9 HA LYS 9 3.770 -2.866 1.217
67 HB2 LYS 9 HB2 LYS 9 3.239 -2.872 -1.126
68 HB3 LYS 9 HB1 LYS 9 4.147 -4.350 -1.386
69 HG2 LYS 9 HG2 LYS 9 2.470 -5.513 0.086
70 HG3 LYS 9 HG1 LYS 9 1.511 -4.031 0.016
71 HD2 LYS 9 HD2 LYS 9 1.369 -4.185 -2.388
72 HD3 LYS 9 HD1 LYS 9 2.444 -5.585 -2.398
73 HE2 LYS 9 HE2 LYS 9 0.728 -6.786 -1.015
74 HE3 LYS 9 HE1 LYS 9 -0.348 -5.411 -1.274
75 HZ1 LYS 9 HZ1 LYS 9 0.835 -7.110 -3.408
76 HZ2 LYS 9 HZ2 LYS 9 -0.203 -5.790 -3.658
77 HZ3 LYS 9 HZ3 LYS 9 -0.771 -7.178 -2.871
78 H ILE 10 HN ILE 10 6.246 -5.163 0.331
79 HA ILE 10 HA ILE 10 5.087 -7.433 1.634
80 HB ILE 10 HB ILE 10 8.021 -7.077 1.019
81 HG12 ILE 10 HG12 ILE 10 6.854 -6.488 -1.013
82 HG13 ILE 10 HG11 ILE 10 7.539 -8.099 -1.197
83 HG21 ILE 10 HG21 ILE 10 6.248 -9.512 1.142
84 HG22 ILE 10 HG22 ILE 10 7.463 -9.036 2.329
85 HG23 ILE 10 HG23 ILE 10 7.957 -9.512 0.705
86 HD11 ILE 10 HD11 ILE 10 5.306 -7.957 -2.137
87 HD12 ILE 10 HD12 ILE 10 4.666 -7.469 -0.567
88 HD13 ILE 10 HD13 ILE 10 5.354 -9.079 -0.775
89 H LEU 11 HN LEU 11 6.815 -4.692 2.718
90 HA LEU 11 HA LEU 11 8.434 -5.774 4.734
91 HB2 LEU 11 HB2 LEU 11 8.222 -3.354 3.651
92 HB3 LEU 11 HB1 LEU 11 7.251 -3.061 5.078
93 HG LEU 11 HG LEU 11 9.602 -2.344 5.330
94 HD11 LEU 11 HD11 LEU 11 10.013 -3.374 7.506
95 HD12 LEU 11 HD12 LEU 11 8.790 -4.596 7.157
96 HD13 LEU 11 HD13 LEU 11 8.325 -2.901 7.314
97 HD21 LEU 11 HD21 LEU 11 11.357 -4.031 5.576
98 HD22 LEU 11 HD22 LEU 11 10.668 -4.026 3.952
99 HD23 LEU 11 HD23 LEU 11 10.209 -5.284 5.100
100 H ARG 12 HN ARG 12 5.066 -4.662 4.825
101 HA ARG 12 HA ARG 12 4.871 -4.859 7.668
102 HB2 ARG 12 HB2 ARG 12 2.453 -4.545 7.352
103 HB3 ARG 12 HB1 ARG 12 3.396 -3.350 6.475
104 HG2 ARG 12 HG2 ARG 12 2.980 -4.438 4.393
105 HG3 ARG 12 HG1 ARG 12 2.242 -5.822 5.204
106 HD2 ARG 12 HD2 ARG 12 1.187 -2.999 5.270
107 HD3 ARG 12 HD1 ARG 12 0.574 -4.286 4.231
108 HE ARG 12 HE ARG 12 0.518 -5.169 6.900
109 HH11 ARG 12 HH11 ARG 12 -1.083 -2.826 4.834
110 HH12 ARG 12 HH12 ARG 12 -2.584 -2.902 5.715
111 HH21 ARG 12 HH21 ARG 12 -1.431 -5.248 8.055
112 HH22 ARG 12 HH22 ARG 12 -2.777 -4.265 7.563
113 H ALA 13 HN ALA 13 4.620 -7.111 5.096
114 HA ALA 13 HA ALA 13 4.085 -9.329 4.975
115 HB1 ALA 13 HB1 ALA 13 4.933 -10.698 6.774
116 HB2 ALA 13 HB2 ALA 13 4.985 -9.304 7.854
117 HB3 ALA 13 HB3 ALA 13 6.053 -9.375 6.452
118 H TRP 14 HN TRP 14 1.815 -8.592 4.819
119 HA TRP 14 HA TRP 14 -0.074 -8.799 6.849
120 HB2 TRP 14 HB2 TRP 14 -1.068 -9.979 4.396
121 HB3 TRP 14 HB1 TRP 14 -1.499 -8.439 5.136
122 HD1 TRP 14 HD1 TRP 14 -0.651 -6.289 3.967
123 HE1 TRP 14 HE1 TRP 14 0.847 -5.803 1.933
124 HE3 TRP 14 HE3 TRP 14 1.109 -11.013 3.107
125 HZ2 TRP 14 HZ2 TRP 14 2.555 -7.236 0.197
126 HZ3 TRP 14 HZ3 TRP 14 2.678 -11.370 1.251
127 HH2 TRP 14 HH2 TRP 14 3.386 -9.520 -0.175
128 H LYS 15 HN LYS 15 0.662 -11.300 4.445
129 HA LYS 15 HA LYS 15 0.222 -13.355 6.510
130 HB2 LYS 15 HB2 LYS 15 -0.124 -14.889 4.518
131 HB3 LYS 15 HB1 LYS 15 -1.375 -13.680 4.783
132 HG2 LYS 15 HG2 LYS 15 -0.858 -12.524 2.899
133 HG3 LYS 15 HG1 LYS 15 0.851 -12.954 2.973
134 HD2 LYS 15 HD2 LYS 15 -0.327 -13.988 1.069
135 HD3 LYS 15 HD1 LYS 15 0.380 -15.166 2.175
136 HE2 LYS 15 HE2 LYS 15 -1.844 -15.443 3.238
137 HE3 LYS 15 HE1 LYS 15 -2.521 -14.335 2.046
138 HZ1 LYS 15 HZ1 LYS 15 -2.799 -16.751 1.539
139 HZ2 LYS 15 HZ2 LYS 15 -1.124 -16.849 1.320
140 HZ3 LYS 15 HZ3 LYS 15 -2.056 -15.855 0.307
141 H LYS 16 HN LYS 16 2.568 -11.759 4.852
142 HA LYS 16 HA LYS 16 4.770 -12.081 4.381
143 HB2 LYS 16 HB2 LYS 16 4.675 -12.788 6.814
144 HB3 LYS 16 HB1 LYS 16 4.583 -14.449 6.253
145 HG2 LYS 16 HG2 LYS 16 6.846 -13.845 6.927
146 HG3 LYS 16 HG1 LYS 16 6.768 -14.241 5.209
147 HD2 LYS 16 HD2 LYS 16 6.777 -11.898 4.627
148 HD3 LYS 16 HD1 LYS 16 6.718 -11.441 6.329
149 HE2 LYS 16 HE2 LYS 16 8.975 -11.223 5.439
150 HE3 LYS 16 HE1 LYS 16 8.905 -12.470 6.683
151 HZ1 LYS 16 HZ1 LYS 16 8.894 -14.159 4.992
152 HZ2 LYS 16 HZ2 LYS 16 10.211 -13.125 4.725
153 HZ3 LYS 16 HZ3 LYS 16 8.821 -12.995 3.761
154 H TYR 17 HN TYR 17 2.852 -13.242 2.660
155 HA TYR 17 HA TYR 17 2.556 -14.694 0.958
156 HB2 TYR 17 HB2 TYR 17 5.544 -14.766 1.243
157 HB3 TYR 17 HB1 TYR 17 4.727 -15.773 0.052
158 HD1 TYR 17 HD1 TYR 17 5.923 -12.468 0.835
159 HD2 TYR 17 HD2 TYR 17 3.305 -14.662 -1.704
160 HE1 TYR 17 HE1 TYR 17 5.853 -10.570 -0.728
161 HE2 TYR 17 HE2 TYR 17 3.229 -12.772 -3.269
162 HH TYR 17 HH TYR 17 5.377 -10.152 -3.105
163 H GLY 18 HN GLY 18 1.446 -15.880 2.768
164 HA2 GLY 18 HA2 GLY 18 2.664 -18.508 3.253
165 HA3 GLY 18 HA1 GLY 18 1.268 -17.850 4.101
Start of MODEL 6
1 H1 GLY 1 HT1 GLY 1 0.238 3.443 -0.883
2 H2 GLY 1 HT2 GLY 1 0.790 3.017 0.659
3 H3 GLY 1 HT3 GLY 1 -0.660 2.374 0.077
4 HA2 GLY 1 HA1 GLY 1 2.076 1.816 -0.906
5 HA3 GLY 1 HA2 GLY 1 1.000 0.692 -0.089
6 H GLY 2 HN GLY 2 2.027 1.933 -3.059
7 HA2 GLY 2 HA2 GLY 2 -0.231 0.607 -4.436
8 HA3 GLY 2 HA1 GLY 2 0.501 2.089 -5.030
9 H LEU 3 HN LEU 3 0.909 1.049 -7.024
10 HA LEU 3 HA LEU 3 2.282 -1.399 -7.274
11 HB2 LEU 3 HB2 LEU 3 2.005 0.878 -9.234
12 HB3 LEU 3 HB1 LEU 3 2.648 -0.703 -9.638
13 HG LEU 3 HG LEU 3 -0.162 -0.151 -8.678
14 HD11 LEU 3 HD11 LEU 3 -0.818 -0.743 -10.952
15 HD12 LEU 3 HD12 LEU 3 0.878 -0.905 -11.404
16 HD13 LEU 3 HD13 LEU 3 0.236 0.670 -10.940
17 HD21 LEU 3 HD21 LEU 3 0.604 -2.337 -7.960
18 HD22 LEU 3 HD22 LEU 3 1.159 -2.704 -9.593
19 HD23 LEU 3 HD23 LEU 3 -0.564 -2.507 -9.271
20 H ARG 4 HN ARG 4 3.472 1.952 -7.386
21 HA ARG 4 HA ARG 4 6.178 1.112 -7.836
22 HB2 ARG 4 HB2 ARG 4 6.763 3.500 -7.344
23 HB3 ARG 4 HB1 ARG 4 5.615 3.275 -8.653
24 HG2 ARG 4 HG2 ARG 4 4.550 3.788 -5.928
25 HG3 ARG 4 HG1 ARG 4 5.281 5.128 -6.812
26 HD2 ARG 4 HD2 ARG 4 2.973 3.402 -7.709
27 HD3 ARG 4 HD1 ARG 4 2.910 5.102 -7.235
28 HE ARG 4 HE ARG 4 4.257 4.081 -9.661
29 HH11 ARG 4 HH11 ARG 4 2.596 6.633 -7.912
30 HH12 ARG 4 HH12 ARG 4 2.622 7.729 -9.261
31 HH21 ARG 4 HH21 ARG 4 4.260 5.512 -11.418
32 HH22 ARG 4 HH22 ARG 4 3.569 7.100 -11.243
33 H SER 5 HN SER 5 4.178 1.425 -5.106
34 HA SER 5 HA SER 5 6.262 1.804 -3.175
35 HB2 SER 5 HB2 SER 5 3.513 0.712 -2.604
36 HB3 SER 5 HB1 SER 5 4.562 1.653 -1.543
37 HG SER 5 HG SER 5 4.278 3.422 -3.044
38 H LEU 6 HN LEU 6 5.032 -0.793 -4.968
39 HA LEU 6 HA LEU 6 4.908 -3.010 -3.459
40 HB2 LEU 6 HB2 LEU 6 4.620 -2.854 -5.922
41 HB3 LEU 6 HB1 LEU 6 6.361 -2.849 -6.100
42 HG LEU 6 HG LEU 6 5.016 -5.152 -4.722
43 HD11 LEU 6 HD11 LEU 6 4.815 -6.278 -6.879
44 HD12 LEU 6 HD12 LEU 6 5.318 -4.802 -7.704
45 HD13 LEU 6 HD13 LEU 6 3.794 -4.844 -6.814
46 HD21 LEU 6 HD21 LEU 6 6.917 -6.382 -5.609
47 HD22 LEU 6 HD22 LEU 6 7.472 -4.984 -4.690
48 HD23 LEU 6 HD23 LEU 6 7.482 -4.941 -6.453
49 H GLY 7 HN GLY 7 7.944 -1.511 -4.519
50 HA2 GLY 7 HA2 GLY 7 9.794 -3.384 -3.787
51 HA3 GLY 7 HA1 GLY 7 10.049 -1.655 -3.611
52 H ARG 8 HN ARG 8 8.591 -0.840 -1.580
53 HA ARG 8 HA ARG 8 9.708 -2.315 0.668
54 HB2 ARG 8 HB2 ARG 8 10.142 0.058 0.645
55 HB3 ARG 8 HB1 ARG 8 8.429 0.418 0.483
56 HG2 ARG 8 HG2 ARG 8 7.978 -0.129 2.698
57 HG3 ARG 8 HG1 ARG 8 9.462 -1.068 2.868
58 HD2 ARG 8 HD2 ARG 8 9.411 1.193 4.018
59 HD3 ARG 8 HD1 ARG 8 10.800 0.863 2.987
60 HE ARG 8 HE ARG 8 9.896 2.352 1.354
61 HH11 ARG 8 HH11 ARG 8 8.235 2.384 4.442
62 HH12 ARG 8 HH12 ARG 8 7.497 3.936 4.177
63 HH21 ARG 8 HH21 ARG 8 8.960 4.410 1.014
64 HH22 ARG 8 HH22 ARG 8 7.908 5.090 2.229
65 H LYS 9 HN LYS 9 6.699 -1.850 -0.903
66 HA LYS 9 HA LYS 9 4.907 -2.145 1.232
67 HB2 LYS 9 HB2 LYS 9 4.277 -1.400 -1.043
68 HB3 LYS 9 HB1 LYS 9 4.509 -3.041 -1.628
69 HG2 LYS 9 HG2 LYS 9 2.707 -3.833 -0.215
70 HG3 LYS 9 HG1 LYS 9 2.508 -2.219 0.470
71 HD2 LYS 9 HD2 LYS 9 1.903 -1.359 -1.746
72 HD3 LYS 9 HD1 LYS 9 2.099 -2.977 -2.426
73 HE2 LYS 9 HE2 LYS 9 0.310 -3.818 -1.020
74 HE3 LYS 9 HE1 LYS 9 0.144 -2.240 -0.250
75 HZ1 LYS 9 HZ1 LYS 9 -1.538 -2.643 -1.968
76 HZ2 LYS 9 HZ2 LYS 9 -0.320 -2.786 -3.134
77 HZ3 LYS 9 HZ3 LYS 9 -0.566 -1.307 -2.345
78 H ILE 10 HN ILE 10 6.876 -4.468 -0.408
79 HA ILE 10 HA ILE 10 5.393 -6.781 0.414
80 HB ILE 10 HB ILE 10 8.244 -6.551 -0.573
81 HG12 ILE 10 HG12 ILE 10 6.637 -5.779 -2.240
82 HG13 ILE 10 HG11 ILE 10 7.318 -7.329 -2.728
83 HG21 ILE 10 HG21 ILE 10 7.873 -8.610 0.693
84 HG22 ILE 10 HG22 ILE 10 8.106 -8.942 -1.022
85 HG23 ILE 10 HG23 ILE 10 6.486 -8.992 -0.329
86 HD11 ILE 10 HD11 ILE 10 4.931 -7.223 -3.164
87 HD12 ILE 10 HD12 ILE 10 4.626 -6.901 -1.455
88 HD13 ILE 10 HD13 ILE 10 5.301 -8.451 -1.956
89 H LEU 11 HN LEU 11 8.009 -4.872 1.746
90 HA LEU 11 HA LEU 11 9.178 -6.804 3.413
91 HB2 LEU 11 HB2 LEU 11 9.180 -3.812 3.417
92 HB3 LEU 11 HB1 LEU 11 9.906 -4.684 4.750
93 HG LEU 11 HG LEU 11 11.625 -4.061 3.205
94 HD11 LEU 11 HD11 LEU 11 11.002 -6.999 2.941
95 HD12 LEU 11 HD12 LEU 11 11.864 -6.235 4.276
96 HD13 LEU 11 HD13 LEU 11 12.571 -6.246 2.660
97 HD21 LEU 11 HD21 LEU 11 11.641 -4.826 0.882
98 HD22 LEU 11 HD22 LEU 11 10.268 -3.766 1.209
99 HD23 LEU 11 HD23 LEU 11 10.031 -5.511 1.099
100 H ARG 12 HN ARG 12 6.392 -4.757 3.907
101 HA ARG 12 HA ARG 12 6.304 -4.941 6.727
102 HB2 ARG 12 HB2 ARG 12 4.022 -4.142 6.561
103 HB3 ARG 12 HB1 ARG 12 5.048 -3.246 5.451
104 HG2 ARG 12 HG2 ARG 12 4.202 -4.462 3.577
105 HG3 ARG 12 HG1 ARG 12 3.325 -5.573 4.634
106 HD2 ARG 12 HD2 ARG 12 2.814 -2.619 4.343
107 HD3 ARG 12 HD1 ARG 12 1.833 -3.915 3.659
108 HE ARG 12 HE ARG 12 1.841 -4.501 6.298
109 HH11 ARG 12 HH11 ARG 12 1.130 -1.572 4.510
110 HH12 ARG 12 HH12 ARG 12 -0.044 -1.001 5.667
111 HH21 ARG 12 HH21 ARG 12 0.328 -3.746 7.826
112 HH22 ARG 12 HH22 ARG 12 -0.476 -2.229 7.564
113 H ALA 13 HN ALA 13 5.468 -7.145 4.239
114 HA ALA 13 HA ALA 13 4.457 -9.168 4.156
115 HB1 ALA 13 HB1 ALA 13 6.320 -9.747 5.618
116 HB2 ALA 13 HB2 ALA 13 4.881 -10.686 6.016
117 HB3 ALA 13 HB3 ALA 13 5.351 -9.323 7.032
118 H TRP 14 HN TRP 14 2.393 -8.169 3.865
119 HA TRP 14 HA TRP 14 0.574 -7.481 5.854
120 HB2 TRP 14 HB2 TRP 14 -0.784 -8.778 3.654
121 HB3 TRP 14 HB1 TRP 14 -0.759 -7.075 4.094
122 HD1 TRP 14 HD1 TRP 14 0.981 -5.498 2.821
123 HE1 TRP 14 HE1 TRP 14 2.315 -5.803 0.645
124 HE3 TRP 14 HE3 TRP 14 0.419 -10.544 2.220
125 HZ2 TRP 14 HZ2 TRP 14 3.021 -7.893 -1.102
126 HZ3 TRP 14 HZ3 TRP 14 1.461 -11.620 0.267
127 HH2 TRP 14 HH2 TRP 14 2.734 -10.319 -1.359
128 H LYS 15 HN LYS 15 0.211 -10.441 3.937
129 HA LYS 15 HA LYS 15 -0.151 -11.923 6.449
130 HB2 LYS 15 HB2 LYS 15 -1.539 -13.540 5.098
131 HB3 LYS 15 HB1 LYS 15 -2.264 -11.966 5.370
132 HG2 LYS 15 HG2 LYS 15 -2.757 -12.445 3.152
133 HG3 LYS 15 HG1 LYS 15 -1.366 -11.365 3.044
134 HD2 LYS 15 HD2 LYS 15 -1.109 -13.221 1.506
135 HD3 LYS 15 HD1 LYS 15 0.105 -13.317 2.782
136 HE2 LYS 15 HE2 LYS 15 -0.739 -15.515 2.440
137 HE3 LYS 15 HE1 LYS 15 -1.395 -14.932 3.967
138 HZ1 LYS 15 HZ1 LYS 15 -2.861 -14.850 1.389
139 HZ2 LYS 15 HZ2 LYS 15 -3.485 -14.516 2.928
140 HZ3 LYS 15 HZ3 LYS 15 -3.016 -16.096 2.530
141 H LYS 16 HN LYS 16 1.996 -11.257 4.243
142 HA LYS 16 HA LYS 16 3.943 -12.147 3.521
143 HB2 LYS 16 HB2 LYS 16 4.136 -12.549 5.971
144 HB3 LYS 16 HB1 LYS 16 3.496 -14.167 5.721
145 HG2 LYS 16 HG2 LYS 16 5.924 -14.175 5.945
146 HG3 LYS 16 HG1 LYS 16 5.422 -14.738 4.350
147 HD2 LYS 16 HD2 LYS 16 5.922 -12.552 3.404
148 HD3 LYS 16 HD1 LYS 16 6.372 -11.948 4.999
149 HE2 LYS 16 HE2 LYS 16 7.735 -14.206 3.541
150 HE3 LYS 16 HE1 LYS 16 8.326 -12.547 3.619
151 HZ1 LYS 16 HZ1 LYS 16 8.510 -12.756 6.014
152 HZ2 LYS 16 HZ2 LYS 16 9.422 -13.960 5.245
153 HZ3 LYS 16 HZ3 LYS 16 7.928 -14.350 5.951
154 H TYR 17 HN TYR 17 2.127 -12.804 1.797
155 HA TYR 17 HA TYR 17 1.864 -14.074 -0.042
156 HB2 TYR 17 HB2 TYR 17 4.174 -15.598 1.148
157 HB3 TYR 17 HB1 TYR 17 3.460 -16.002 -0.412
158 HD1 TYR 17 HD1 TYR 17 3.641 -14.427 -2.300
159 HD2 TYR 17 HD2 TYR 17 5.584 -13.662 1.407
160 HE1 TYR 17 HE1 TYR 17 5.049 -12.737 -3.394
161 HE2 TYR 17 HE2 TYR 17 6.998 -11.968 0.319
162 HH TYR 17 HH TYR 17 6.346 -10.751 -2.791
163 H GLY 18 HN GLY 18 2.462 -16.440 2.591
164 HA2 GLY 18 HA2 GLY 18 -0.186 -17.569 1.961
165 HA3 GLY 18 HA1 GLY 18 1.213 -18.626 2.091
Start of MODEL 7
1 H1 GLY 1 HT1 GLY 1 2.501 3.717 -2.857
2 H2 GLY 1 HT2 GLY 1 2.885 3.863 -1.215
3 H3 GLY 1 HT3 GLY 1 1.262 3.710 -1.700
4 HA2 GLY 1 HA1 GLY 1 3.383 1.645 -1.908
5 HA3 GLY 1 HA2 GLY 1 2.009 1.623 -0.813
6 H GLY 2 HN GLY 2 2.817 1.747 -4.282
7 HA2 GLY 2 HA2 GLY 2 0.637 -0.141 -4.772
8 HA3 GLY 2 HA1 GLY 2 0.581 1.398 -5.615
9 H LEU 3 HN LEU 3 1.716 1.642 -7.459
10 HA LEU 3 HA LEU 3 2.508 -0.757 -8.748
11 HB2 LEU 3 HB2 LEU 3 2.585 2.132 -9.564
12 HB3 LEU 3 HB1 LEU 3 3.198 0.863 -10.604
13 HG LEU 3 HG LEU 3 0.904 -0.183 -10.532
14 HD11 LEU 3 HD11 LEU 3 0.082 0.890 -8.496
15 HD12 LEU 3 HD12 LEU 3 -0.975 1.216 -9.871
16 HD13 LEU 3 HD13 LEU 3 0.139 2.458 -9.300
17 HD21 LEU 3 HD21 LEU 3 1.687 1.137 -12.424
18 HD22 LEU 3 HD22 LEU 3 1.119 2.610 -11.638
19 HD23 LEU 3 HD23 LEU 3 -0.039 1.381 -12.147
20 H ARG 4 HN ARG 4 4.424 2.211 -8.116
21 HA ARG 4 HA ARG 4 6.839 0.754 -8.745
22 HB2 ARG 4 HB2 ARG 4 8.020 2.898 -8.234
23 HB3 ARG 4 HB1 ARG 4 6.843 2.993 -9.530
24 HG2 ARG 4 HG2 ARG 4 5.993 3.759 -6.783
25 HG3 ARG 4 HG1 ARG 4 7.028 4.859 -7.697
26 HD2 ARG 4 HD2 ARG 4 4.315 3.807 -8.494
27 HD3 ARG 4 HD1 ARG 4 4.744 5.470 -8.095
28 HE ARG 4 HE ARG 4 6.262 4.446 -10.296
29 HH11 ARG 4 HH11 ARG 4 3.237 5.988 -9.387
30 HH12 ARG 4 HH12 ARG 4 2.928 6.587 -10.995
31 HH21 ARG 4 HH21 ARG 4 5.808 5.176 -12.403
32 HH22 ARG 4 HH22 ARG 4 4.354 6.079 -12.706
33 H SER 5 HN SER 5 5.030 1.499 -5.976
34 HA SER 5 HA SER 5 7.175 1.202 -4.083
35 HB2 SER 5 HB2 SER 5 4.251 0.930 -3.439
36 HB3 SER 5 HB1 SER 5 5.555 1.525 -2.414
37 HG SER 5 HG SER 5 5.524 3.441 -3.418
38 H LEU 6 HN LEU 6 5.378 -0.915 -5.965
39 HA LEU 6 HA LEU 6 4.378 -2.941 -4.521
40 HB2 LEU 6 HB2 LEU 6 4.567 -2.660 -7.048
41 HB3 LEU 6 HB1 LEU 6 6.115 -3.468 -6.920
42 HG LEU 6 HG LEU 6 3.576 -4.763 -5.941
43 HD11 LEU 6 HD11 LEU 6 3.255 -4.154 -8.285
44 HD12 LEU 6 HD12 LEU 6 3.438 -5.898 -8.099
45 HD13 LEU 6 HD13 LEU 6 4.784 -4.930 -8.699
46 HD21 LEU 6 HD21 LEU 6 4.832 -6.825 -6.286
47 HD22 LEU 6 HD22 LEU 6 5.703 -5.745 -5.196
48 HD23 LEU 6 HD23 LEU 6 6.211 -5.900 -6.877
49 H GLY 7 HN GLY 7 7.844 -2.784 -5.423
50 HA2 GLY 7 HA2 GLY 7 8.630 -5.178 -4.232
51 HA3 GLY 7 HA1 GLY 7 9.680 -3.792 -4.477
52 H ARG 8 HN ARG 8 8.685 -1.917 -2.828
53 HA ARG 8 HA ARG 8 9.591 -2.838 -0.276
54 HB2 ARG 8 HB2 ARG 8 10.060 -0.580 -1.214
55 HB3 ARG 8 HB1 ARG 8 8.359 -0.184 -1.031
56 HG2 ARG 8 HG2 ARG 8 8.514 -0.310 1.346
57 HG3 ARG 8 HG1 ARG 8 10.156 -0.954 1.255
58 HD2 ARG 8 HD2 ARG 8 9.259 1.788 0.369
59 HD3 ARG 8 HD1 ARG 8 10.204 1.415 1.812
60 HE ARG 8 HE ARG 8 11.722 0.363 -0.137
61 HH11 ARG 8 HH11 ARG 8 10.265 3.541 0.229
62 HH12 ARG 8 HH12 ARG 8 11.476 4.331 -0.742
63 HH21 ARG 8 HH21 ARG 8 13.279 1.396 -1.386
64 HH22 ARG 8 HH22 ARG 8 13.184 3.109 -1.670
65 H LYS 9 HN LYS 9 6.510 -2.431 -1.775
66 HA LYS 9 HA LYS 9 4.886 -2.157 0.515
67 HB2 LYS 9 HB2 LYS 9 4.078 -1.672 -1.741
68 HB3 LYS 9 HB1 LYS 9 4.242 -3.366 -2.181
69 HG2 LYS 9 HG2 LYS 9 2.518 -3.962 -0.553
70 HG3 LYS 9 HG1 LYS 9 2.365 -2.265 -0.095
71 HD2 LYS 9 HD2 LYS 9 1.597 -1.691 -2.313
72 HD3 LYS 9 HD1 LYS 9 1.869 -3.345 -2.870
73 HE2 LYS 9 HE2 LYS 9 0.181 -4.140 -1.273
74 HE3 LYS 9 HE1 LYS 9 -0.094 -2.480 -0.749
75 HZ1 LYS 9 HZ1 LYS 9 -1.043 -1.917 -2.797
76 HZ2 LYS 9 HZ2 LYS 9 -1.695 -3.445 -2.444
77 HZ3 LYS 9 HZ3 LYS 9 -0.441 -3.299 -3.573
78 H ILE 10 HN ILE 10 6.513 -4.873 -0.861
79 HA ILE 10 HA ILE 10 4.925 -6.900 0.402
80 HB ILE 10 HB ILE 10 7.746 -7.123 -0.665
81 HG12 ILE 10 HG12 ILE 10 6.197 -6.288 -2.392
82 HG13 ILE 10 HG11 ILE 10 6.743 -7.919 -2.756
83 HG21 ILE 10 HG21 ILE 10 7.085 -8.958 0.805
84 HG22 ILE 10 HG22 ILE 10 7.265 -9.504 -0.862
85 HG23 ILE 10 HG23 ILE 10 5.656 -9.244 -0.186
86 HD11 ILE 10 HD11 ILE 10 4.080 -7.131 -1.606
87 HD12 ILE 10 HD12 ILE 10 4.617 -8.791 -1.870
88 HD13 ILE 10 HD13 ILE 10 4.401 -7.702 -3.242
89 H LEU 11 HN LEU 11 7.623 -4.922 1.299
90 HA LEU 11 HA LEU 11 8.895 -6.590 3.163
91 HB2 LEU 11 HB2 LEU 11 8.893 -3.656 2.641
92 HB3 LEU 11 HB1 LEU 11 9.617 -4.242 4.124
93 HG LEU 11 HG LEU 11 11.191 -5.603 2.845
94 HD11 LEU 11 HD11 LEU 11 11.346 -5.418 0.430
95 HD12 LEU 11 HD12 LEU 11 9.912 -4.392 0.402
96 HD13 LEU 11 HD13 LEU 11 9.780 -6.077 0.905
97 HD21 LEU 11 HD21 LEU 11 11.084 -2.737 1.919
98 HD22 LEU 11 HD22 LEU 11 12.504 -3.783 1.887
99 HD23 LEU 11 HD23 LEU 11 11.790 -3.313 3.430
100 H ARG 12 HN ARG 12 6.059 -4.580 3.492
101 HA ARG 12 HA ARG 12 6.158 -4.335 6.316
102 HB2 ARG 12 HB2 ARG 12 3.828 -3.628 6.193
103 HB3 ARG 12 HB1 ARG 12 4.778 -2.840 4.941
104 HG2 ARG 12 HG2 ARG 12 3.768 -4.016 3.245
105 HG3 ARG 12 HG1 ARG 12 3.305 -5.350 4.302
106 HD2 ARG 12 HD2 ARG 12 2.126 -2.579 4.425
107 HD3 ARG 12 HD1 ARG 12 1.393 -3.943 3.580
108 HE ARG 12 HE ARG 12 1.958 -4.562 6.312
109 HH11 ARG 12 HH11 ARG 12 -0.342 -2.995 4.189
110 HH12 ARG 12 HH12 ARG 12 -1.648 -3.074 5.338
111 HH21 ARG 12 HH21 ARG 12 0.256 -4.733 7.793
112 HH22 ARG 12 HH22 ARG 12 -1.315 -4.091 7.393
113 H ALA 13 HN ALA 13 5.232 -6.893 4.216
114 HA ALA 13 HA ALA 13 4.262 -8.934 4.507
115 HB1 ALA 13 HB1 ALA 13 5.307 -8.598 7.319
116 HB2 ALA 13 HB2 ALA 13 6.210 -9.249 5.949
117 HB3 ALA 13 HB3 ALA 13 4.805 -10.114 6.573
118 H TRP 14 HN TRP 14 2.200 -7.905 4.174
119 HA TRP 14 HA TRP 14 0.463 -7.060 6.196
120 HB2 TRP 14 HB2 TRP 14 -0.995 -8.454 4.137
121 HB3 TRP 14 HB1 TRP 14 -0.886 -6.721 4.426
122 HD1 TRP 14 HD1 TRP 14 0.739 -5.319 2.884
123 HE1 TRP 14 HE1 TRP 14 2.021 -5.863 0.721
124 HE3 TRP 14 HE3 TRP 14 0.232 -10.409 2.904
125 HZ2 TRP 14 HZ2 TRP 14 2.710 -8.150 -0.787
126 HZ3 TRP 14 HZ3 TRP 14 1.225 -11.696 1.060
127 HH2 TRP 14 HH2 TRP 14 2.437 -10.589 -0.745
128 H LYS 15 HN LYS 15 0.440 -10.194 4.525
129 HA LYS 15 HA LYS 15 -0.304 -11.451 7.082
130 HB2 LYS 15 HB2 LYS 15 -1.320 -13.260 5.655
131 HB3 LYS 15 HB1 LYS 15 -2.140 -11.705 5.587
132 HG2 LYS 15 HG2 LYS 15 -1.799 -11.522 3.400
133 HG3 LYS 15 HG1 LYS 15 -0.092 -11.944 3.558
134 HD2 LYS 15 HD2 LYS 15 -1.239 -13.572 2.176
135 HD3 LYS 15 HD1 LYS 15 -0.696 -14.310 3.684
136 HE2 LYS 15 HE2 LYS 15 -3.025 -13.858 4.580
137 HE3 LYS 15 HE1 LYS 15 -3.488 -13.472 2.924
138 HZ1 LYS 15 HZ1 LYS 15 -4.000 -15.769 3.458
139 HZ2 LYS 15 HZ2 LYS 15 -2.381 -16.065 3.864
140 HZ3 LYS 15 HZ3 LYS 15 -2.801 -15.697 2.257
141 H LYS 16 HN LYS 16 1.898 -11.260 4.518
142 HA LYS 16 HA LYS 16 3.916 -12.162 4.094
143 HB2 LYS 16 HB2 LYS 16 4.258 -11.540 6.477
144 HB3 LYS 16 HB1 LYS 16 3.780 -13.167 6.937
145 HG2 LYS 16 HG2 LYS 16 6.178 -12.991 6.962
146 HG3 LYS 16 HG1 LYS 16 5.682 -14.067 5.655
147 HD2 LYS 16 HD2 LYS 16 5.889 -12.129 4.090
148 HD3 LYS 16 HD1 LYS 16 6.570 -11.195 5.425
149 HE2 LYS 16 HE2 LYS 16 7.691 -13.740 4.258
150 HE3 LYS 16 HE1 LYS 16 8.336 -12.117 4.025
151 HZ1 LYS 16 HZ1 LYS 16 8.129 -13.475 6.661
152 HZ2 LYS 16 HZ2 LYS 16 8.892 -11.996 6.339
153 HZ3 LYS 16 HZ3 LYS 16 9.530 -13.434 5.711
154 H TYR 17 HN TYR 17 2.218 -13.628 2.837
155 HA TYR 17 HA TYR 17 1.993 -15.619 1.771
156 HB2 TYR 17 HB2 TYR 17 4.723 -16.090 2.983
157 HB3 TYR 17 HB1 TYR 17 4.023 -17.022 1.660
158 HD1 TYR 17 HD1 TYR 17 3.881 -16.099 -0.573
159 HD2 TYR 17 HD2 TYR 17 5.462 -13.791 2.633
160 HE1 TYR 17 HE1 TYR 17 4.759 -14.467 -2.181
161 HE2 TYR 17 HE2 TYR 17 6.344 -12.156 1.033
162 HH TYR 17 HH TYR 17 7.008 -12.049 -1.319
163 H GLY 18 HN GLY 18 1.001 -15.496 4.535
164 HA2 GLY 18 HA2 GLY 18 1.073 -18.396 5.103
165 HA3 GLY 18 HA1 GLY 18 1.021 -17.187 6.381
Start of MODEL 8
1 H1 GLY 1 HT1 GLY 1 -0.235 5.039 -4.580
2 H2 GLY 1 HT2 GLY 1 -1.209 3.665 -4.766
3 H3 GLY 1 HT3 GLY 1 -0.603 4.467 -6.131
4 HA2 GLY 1 HA1 GLY 1 1.641 3.857 -5.563
5 HA3 GLY 1 HA2 GLY 1 1.052 3.084 -4.098
6 H GLY 2 HN GLY 2 1.533 0.977 -4.462
7 HA2 GLY 2 HA2 GLY 2 0.560 -1.082 -5.203
8 HA3 GLY 2 HA1 GLY 2 0.033 -0.270 -6.671
9 H LEU 3 HN LEU 3 1.463 -0.025 -8.386
10 HA LEU 3 HA LEU 3 3.351 -2.110 -8.680
11 HB2 LEU 3 HB2 LEU 3 2.916 0.359 -10.365
12 HB3 LEU 3 HB1 LEU 3 3.939 -0.985 -10.826
13 HG LEU 3 HG LEU 3 1.812 -2.424 -10.631
14 HD11 LEU 3 HD11 LEU 3 0.561 0.315 -10.826
15 HD12 LEU 3 HD12 LEU 3 0.413 -0.803 -9.469
16 HD13 LEU 3 HD13 LEU 3 -0.281 -1.220 -11.036
17 HD21 LEU 3 HD21 LEU 3 2.920 -1.875 -12.730
18 HD22 LEU 3 HD22 LEU 3 2.060 -0.336 -12.791
19 HD23 LEU 3 HD23 LEU 3 1.167 -1.852 -12.914
20 H ARG 4 HN ARG 4 3.714 1.385 -8.286
21 HA ARG 4 HA ARG 4 6.563 1.342 -8.260
22 HB2 ARG 4 HB2 ARG 4 5.189 3.320 -8.846
23 HB3 ARG 4 HB1 ARG 4 4.653 3.419 -7.176
24 HG2 ARG 4 HG2 ARG 4 6.887 3.908 -6.439
25 HG3 ARG 4 HG1 ARG 4 7.511 3.666 -8.075
26 HD2 ARG 4 HD2 ARG 4 5.570 5.784 -7.182
27 HD3 ARG 4 HD1 ARG 4 7.260 6.027 -7.624
28 HE ARG 4 HE ARG 4 6.093 4.830 -9.814
29 HH11 ARG 4 HH11 ARG 4 5.687 7.815 -8.027
30 HH12 ARG 4 HH12 ARG 4 4.995 8.667 -9.373
31 HH21 ARG 4 HH21 ARG 4 5.179 5.961 -11.582
32 HH22 ARG 4 HH22 ARG 4 4.669 7.612 -11.366
33 H SER 5 HN SER 5 4.095 0.841 -5.910
34 HA SER 5 HA SER 5 5.759 1.280 -3.610
35 HB2 SER 5 HB2 SER 5 3.057 -0.059 -3.795
36 HB3 SER 5 HB1 SER 5 3.835 0.546 -2.332
37 HG SER 5 HG SER 5 3.563 2.618 -3.028
38 H LEU 6 HN LEU 6 5.365 -1.255 -5.808
39 HA LEU 6 HA LEU 6 4.912 -3.550 -4.461
40 HB2 LEU 6 HB2 LEU 6 6.820 -3.056 -6.718
41 HB3 LEU 6 HB1 LEU 6 6.543 -4.666 -6.083
42 HG LEU 6 HG LEU 6 4.447 -2.870 -7.308
43 HD11 LEU 6 HD11 LEU 6 5.735 -5.403 -8.321
44 HD12 LEU 6 HD12 LEU 6 6.021 -3.777 -8.940
45 HD13 LEU 6 HD13 LEU 6 4.429 -4.515 -9.109
46 HD21 LEU 6 HD21 LEU 6 3.560 -4.292 -5.519
47 HD22 LEU 6 HD22 LEU 6 4.248 -5.708 -6.314
48 HD23 LEU 6 HD23 LEU 6 2.970 -4.787 -7.106
49 H GLY 7 HN GLY 7 8.219 -2.210 -4.808
50 HA2 GLY 7 HA2 GLY 7 9.526 -4.240 -3.386
51 HA3 GLY 7 HA1 GLY 7 10.121 -2.601 -3.580
52 H ARG 8 HN ARG 8 8.066 -1.248 -2.210
53 HA ARG 8 HA ARG 8 8.960 -1.791 0.500
54 HB2 ARG 8 HB2 ARG 8 7.411 0.482 -0.735
55 HB3 ARG 8 HB1 ARG 8 7.722 0.363 0.992
56 HG2 ARG 8 HG2 ARG 8 10.096 0.456 0.621
57 HG3 ARG 8 HG1 ARG 8 9.855 0.428 -1.126
58 HD2 ARG 8 HD2 ARG 8 8.751 2.578 0.662
59 HD3 ARG 8 HD1 ARG 8 10.323 2.689 -0.126
60 HE ARG 8 HE ARG 8 8.856 2.266 -2.244
61 HH11 ARG 8 HH11 ARG 8 8.008 4.222 0.544
62 HH12 ARG 8 HH12 ARG 8 7.081 5.357 -0.390
63 HH21 ARG 8 HH21 ARG 8 7.641 3.779 -3.457
64 HH22 ARG 8 HH22 ARG 8 6.846 5.090 -2.643
65 H LYS 9 HN LYS 9 6.142 -2.221 -1.444
66 HA LYS 9 HA LYS 9 4.176 -2.384 0.566
67 HB2 LYS 9 HB2 LYS 9 3.705 -2.306 -1.885
68 HB3 LYS 9 HB1 LYS 9 4.292 -3.959 -2.018
69 HG2 LYS 9 HG2 LYS 9 2.510 -4.648 -0.418
70 HG3 LYS 9 HG1 LYS 9 1.877 -3.004 -0.488
71 HD2 LYS 9 HD2 LYS 9 0.615 -4.395 -1.993
72 HD3 LYS 9 HD1 LYS 9 1.595 -3.276 -2.941
73 HE2 LYS 9 HE2 LYS 9 3.175 -4.979 -3.461
74 HE3 LYS 9 HE1 LYS 9 2.441 -6.094 -2.310
75 HZ1 LYS 9 HZ1 LYS 9 1.842 -6.564 -4.630
76 HZ2 LYS 9 HZ2 LYS 9 1.080 -5.051 -4.739
77 HZ3 LYS 9 HZ3 LYS 9 0.491 -6.228 -3.664
78 H ILE 10 HN ILE 10 6.658 -4.545 -0.513
79 HA ILE 10 HA ILE 10 5.619 -6.930 0.665
80 HB ILE 10 HB ILE 10 8.442 -6.277 -0.210
81 HG12 ILE 10 HG12 ILE 10 6.839 -6.084 -2.048
82 HG13 ILE 10 HG11 ILE 10 7.858 -7.499 -2.270
83 HG21 ILE 10 HG21 ILE 10 8.416 -8.173 1.311
84 HG22 ILE 10 HG22 ILE 10 8.768 -8.708 -0.331
85 HG23 ILE 10 HG23 ILE 10 7.159 -8.951 0.347
86 HD11 ILE 10 HD11 ILE 10 5.035 -7.505 -1.233
87 HD12 ILE 10 HD12 ILE 10 6.056 -8.928 -1.441
88 HD13 ILE 10 HD13 ILE 10 5.557 -7.984 -2.846
89 H LEU 11 HN LEU 11 7.271 -4.206 1.902
90 HA LEU 11 HA LEU 11 8.865 -5.492 3.866
91 HB2 LEU 11 HB2 LEU 11 7.929 -2.631 3.717
92 HB3 LEU 11 HB1 LEU 11 9.182 -3.231 4.786
93 HG LEU 11 HG LEU 11 9.301 -3.160 1.768
94 HD11 LEU 11 HD11 LEU 11 10.792 -1.584 3.861
95 HD12 LEU 11 HD12 LEU 11 9.540 -0.970 2.782
96 HD13 LEU 11 HD13 LEU 11 11.080 -1.519 2.120
97 HD21 LEU 11 HD21 LEU 11 11.309 -4.146 3.787
98 HD22 LEU 11 HD22 LEU 11 11.643 -3.883 2.075
99 HD23 LEU 11 HD23 LEU 11 10.471 -5.106 2.569
100 H ARG 12 HN ARG 12 5.524 -4.716 3.797
101 HA ARG 12 HA ARG 12 5.327 -4.570 6.681
102 HB2 ARG 12 HB2 ARG 12 2.886 -4.322 6.289
103 HB3 ARG 12 HB1 ARG 12 3.865 -3.105 5.486
104 HG2 ARG 12 HG2 ARG 12 3.617 -4.295 3.370
105 HG3 ARG 12 HG1 ARG 12 2.662 -5.536 4.181
106 HD2 ARG 12 HD2 ARG 12 1.930 -2.619 4.047
107 HD3 ARG 12 HD1 ARG 12 1.293 -3.863 2.975
108 HE ARG 12 HE ARG 12 0.778 -4.759 5.531
109 HH11 ARG 12 HH11 ARG 12 0.031 -1.828 3.750
110 HH12 ARG 12 HH12 ARG 12 -1.542 -1.647 4.466
111 HH21 ARG 12 HH21 ARG 12 -1.294 -4.504 6.475
112 HH22 ARG 12 HH22 ARG 12 -2.297 -3.163 6.009
113 H ALA 13 HN ALA 13 4.417 -6.828 4.116
114 HA ALA 13 HA ALA 13 3.658 -8.989 4.137
115 HB1 ALA 13 HB1 ALA 13 5.659 -9.171 6.389
116 HB2 ALA 13 HB2 ALA 13 6.044 -9.215 4.668
117 HB3 ALA 13 HB3 ALA 13 5.077 -10.502 5.391
118 H TRP 14 HN TRP 14 1.543 -8.391 4.849
119 HA TRP 14 HA TRP 14 0.654 -8.413 7.496
120 HB2 TRP 14 HB2 TRP 14 -1.459 -9.409 5.930
121 HB3 TRP 14 HB1 TRP 14 -1.164 -7.730 6.373
122 HD1 TRP 14 HD1 TRP 14 -0.305 -6.104 4.517
123 HE1 TRP 14 HE1 TRP 14 0.018 -6.313 1.973
124 HE3 TRP 14 HE3 TRP 14 -0.793 -11.170 4.044
125 HZ2 TRP 14 HZ2 TRP 14 0.086 -8.358 0.036
126 HZ3 TRP 14 HZ3 TRP 14 -0.579 -12.170 1.809
127 HH2 TRP 14 HH2 TRP 14 -0.152 -10.787 -0.156
128 H LYS 15 HN LYS 15 0.046 -10.999 5.141
129 HA LYS 15 HA LYS 15 -0.195 -12.964 7.272
130 HB2 LYS 15 HB2 LYS 15 -0.446 -13.273 4.275
131 HB3 LYS 15 HB1 LYS 15 -0.847 -14.495 5.471
132 HG2 LYS 15 HG2 LYS 15 -2.793 -13.478 6.065
133 HG3 LYS 15 HG1 LYS 15 -2.213 -11.866 5.634
134 HD2 LYS 15 HD2 LYS 15 -3.923 -12.671 4.062
135 HD3 LYS 15 HD1 LYS 15 -2.358 -12.408 3.279
136 HE2 LYS 15 HE2 LYS 15 -3.448 -14.497 2.542
137 HE3 LYS 15 HE1 LYS 15 -1.894 -14.781 3.323
138 HZ1 LYS 15 HZ1 LYS 15 -3.567 -16.367 4.057
139 HZ2 LYS 15 HZ2 LYS 15 -4.556 -15.106 4.604
140 HZ3 LYS 15 HZ3 LYS 15 -3.063 -15.394 5.349
141 H LYS 16 HN LYS 16 2.206 -11.667 5.381
142 HA LYS 16 HA LYS 16 4.345 -12.211 4.892
143 HB2 LYS 16 HB2 LYS 16 4.374 -13.231 7.192
144 HB3 LYS 16 HB1 LYS 16 3.928 -14.765 6.461
145 HG2 LYS 16 HG2 LYS 16 6.310 -14.671 6.910
146 HG3 LYS 16 HG1 LYS 16 6.002 -14.768 5.176
147 HD2 LYS 16 HD2 LYS 16 6.319 -12.320 5.019
148 HD3 LYS 16 HD1 LYS 16 6.709 -12.281 6.740
149 HE2 LYS 16 HE2 LYS 16 8.223 -13.752 4.585
150 HE3 LYS 16 HE1 LYS 16 8.741 -12.283 5.410
151 HZ1 LYS 16 HZ1 LYS 16 8.719 -13.560 7.507
152 HZ2 LYS 16 HZ2 LYS 16 9.838 -14.160 6.381
153 HZ3 LYS 16 HZ3 LYS 16 8.368 -14.969 6.624
154 H TYR 17 HN TYR 17 1.867 -13.142 3.506
155 HA TYR 17 HA TYR 17 1.490 -13.819 1.388
156 HB2 TYR 17 HB2 TYR 17 4.441 -14.467 1.233
157 HB3 TYR 17 HB1 TYR 17 3.343 -14.148 -0.112
158 HD1 TYR 17 HD1 TYR 17 2.194 -11.833 -0.142
159 HD2 TYR 17 HD2 TYR 17 5.647 -12.701 2.181
160 HE1 TYR 17 HE1 TYR 17 2.643 -9.428 0.082
161 HE2 TYR 17 HE2 TYR 17 6.112 -10.299 2.402
162 HH TYR 17 HH TYR 17 5.588 -8.218 1.401
163 H GLY 18 HN GLY 18 1.574 -15.636 3.756
164 HA2 GLY 18 HA2 GLY 18 1.307 -18.104 2.170
165 HA3 GLY 18 HA1 GLY 18 1.832 -18.109 3.851
Start of MODEL 9
1 H1 GLY 1 HT1 GLY 1 2.503 4.862 -3.372
2 H2 GLY 1 HT2 GLY 1 1.836 4.913 -1.812
3 H3 GLY 1 HT3 GLY 1 0.865 5.248 -3.163
4 HA2 GLY 1 HA1 GLY 1 2.105 2.635 -2.515
5 HA3 GLY 1 HA2 GLY 1 0.405 3.045 -2.335
6 H GLY 2 HN GLY 2 0.968 0.890 -3.839
7 HA2 GLY 2 HA2 GLY 2 -0.397 0.557 -5.886
8 HA3 GLY 2 HA1 GLY 2 0.496 1.905 -6.575
9 H LEU 3 HN LEU 3 1.059 0.533 -8.324
10 HA LEU 3 HA LEU 3 2.330 -1.957 -7.963
11 HB2 LEU 3 HB2 LEU 3 2.919 -1.742 -10.385
12 HB3 LEU 3 HB1 LEU 3 1.218 -1.583 -10.008
13 HG LEU 3 HG LEU 3 1.780 0.999 -10.052
14 HD11 LEU 3 HD11 LEU 3 3.432 1.518 -11.787
15 HD12 LEU 3 HD12 LEU 3 3.904 -0.180 -11.834
16 HD13 LEU 3 HD13 LEU 3 4.169 0.769 -10.371
17 HD21 LEU 3 HD21 LEU 3 1.131 1.034 -12.405
18 HD22 LEU 3 HD22 LEU 3 0.174 -0.131 -11.490
19 HD23 LEU 3 HD23 LEU 3 1.484 -0.689 -12.531
20 H ARG 4 HN ARG 4 3.638 1.298 -8.215
21 HA ARG 4 HA ARG 4 6.332 0.410 -8.611
22 HB2 ARG 4 HB2 ARG 4 6.990 2.694 -8.399
23 HB3 ARG 4 HB1 ARG 4 5.499 2.657 -9.319
24 HG2 ARG 4 HG2 ARG 4 5.645 3.298 -6.381
25 HG3 ARG 4 HG1 ARG 4 5.663 4.510 -7.660
26 HD2 ARG 4 HD2 ARG 4 3.446 2.568 -7.017
27 HD3 ARG 4 HD1 ARG 4 3.433 4.313 -6.774
28 HE ARG 4 HE ARG 4 3.904 3.768 -9.490
29 HH11 ARG 4 HH11 ARG 4 1.354 3.692 -7.097
30 HH12 ARG 4 HH12 ARG 4 0.075 3.748 -8.271
31 HH21 ARG 4 HH21 ARG 4 2.232 3.872 -11.045
32 HH22 ARG 4 HH22 ARG 4 0.568 3.849 -10.518
33 H SER 5 HN SER 5 4.279 0.785 -5.932
34 HA SER 5 HA SER 5 6.347 0.970 -3.943
35 HB2 SER 5 HB2 SER 5 3.403 0.385 -3.594
36 HB3 SER 5 HB1 SER 5 4.532 0.913 -2.344
37 HG SER 5 HG SER 5 4.848 2.836 -3.677
38 H LEU 6 HN LEU 6 5.065 -1.512 -5.792
39 HA LEU 6 HA LEU 6 4.254 -3.568 -4.280
40 HB2 LEU 6 HB2 LEU 6 4.806 -3.326 -6.847
41 HB3 LEU 6 HB1 LEU 6 6.257 -4.196 -6.403
42 HG LEU 6 HG LEU 6 4.475 -5.651 -7.309
43 HD11 LEU 6 HD11 LEU 6 5.108 -6.194 -4.416
44 HD12 LEU 6 HD12 LEU 6 6.154 -6.567 -5.785
45 HD13 LEU 6 HD13 LEU 6 4.596 -7.378 -5.617
46 HD21 LEU 6 HD21 LEU 6 2.503 -6.119 -5.939
47 HD22 LEU 6 HD22 LEU 6 2.547 -4.443 -6.480
48 HD23 LEU 6 HD23 LEU 6 2.984 -4.845 -4.821
49 H GLY 7 HN GLY 7 7.734 -3.129 -5.039
50 HA2 GLY 7 HA2 GLY 7 8.702 -5.248 -3.521
51 HA3 GLY 7 HA1 GLY 7 9.611 -3.793 -3.888
52 H ARG 8 HN ARG 8 8.375 -1.856 -2.516
53 HA ARG 8 HA ARG 8 9.203 -2.287 0.165
54 HB2 ARG 8 HB2 ARG 8 9.176 -0.078 -1.025
55 HB3 ARG 8 HB1 ARG 8 7.422 -0.085 -0.907
56 HG2 ARG 8 HG2 ARG 8 7.819 1.131 0.939
57 HG3 ARG 8 HG1 ARG 8 8.058 -0.453 1.680
58 HD2 ARG 8 HD2 ARG 8 10.188 1.390 0.598
59 HD3 ARG 8 HD1 ARG 8 9.879 1.009 2.290
60 HE ARG 8 HE ARG 8 10.494 -1.293 0.673
61 HH11 ARG 8 HH11 ARG 8 11.831 1.291 2.619
62 HH12 ARG 8 HH12 ARG 8 13.350 0.478 2.887
63 HH21 ARG 8 HH21 ARG 8 12.477 -2.373 1.033
64 HH22 ARG 8 HH22 ARG 8 13.700 -1.613 2.003
65 H LYS 9 HN LYS 9 6.147 -2.404 -1.490
66 HA LYS 9 HA LYS 9 4.394 -2.324 0.705
67 HB2 LYS 9 HB2 LYS 9 3.668 -1.906 -1.574
68 HB3 LYS 9 HB1 LYS 9 4.081 -3.545 -2.042
69 HG2 LYS 9 HG2 LYS 9 2.311 -4.435 -0.681
70 HG3 LYS 9 HG1 LYS 9 1.949 -2.830 -0.038
71 HD2 LYS 9 HD2 LYS 9 1.277 -2.061 -2.222
72 HD3 LYS 9 HD1 LYS 9 1.777 -3.585 -2.952
73 HE2 LYS 9 HE2 LYS 9 0.056 -4.770 -1.735
74 HE3 LYS 9 HE1 LYS 9 -0.404 -3.289 -0.893
75 HZ1 LYS 9 HZ1 LYS 9 -1.215 -2.349 -2.875
76 HZ2 LYS 9 HZ2 LYS 9 -1.823 -3.935 -2.851
77 HZ3 LYS 9 HZ3 LYS 9 -0.505 -3.543 -3.844
78 H ILE 10 HN ILE 10 6.027 -5.018 -0.894
79 HA ILE 10 HA ILE 10 4.642 -7.076 0.497
80 HB ILE 10 HB ILE 10 7.382 -7.179 -0.783
81 HG12 ILE 10 HG12 ILE 10 5.646 -6.524 -2.391
82 HG13 ILE 10 HG11 ILE 10 6.231 -8.150 -2.726
83 HG21 ILE 10 HG21 ILE 10 5.516 -9.413 0.011
84 HG22 ILE 10 HG22 ILE 10 7.057 -9.015 0.767
85 HG23 ILE 10 HG23 ILE 10 7.016 -9.607 -0.892
86 HD11 ILE 10 HD11 ILE 10 3.831 -8.028 -2.989
87 HD12 ILE 10 HD12 ILE 10 3.660 -7.441 -1.333
88 HD13 ILE 10 HD13 ILE 10 4.248 -9.078 -1.635
89 H LEU 11 HN LEU 11 7.449 -5.135 1.210
90 HA LEU 11 HA LEU 11 8.830 -6.804 2.944
91 HB2 LEU 11 HB2 LEU 11 9.755 -4.751 1.990
92 HB3 LEU 11 HB1 LEU 11 8.684 -3.793 2.997
93 HG LEU 11 HG LEU 11 9.811 -4.748 5.010
94 HD11 LEU 11 HD11 LEU 11 10.658 -6.797 3.973
95 HD12 LEU 11 HD12 LEU 11 11.944 -5.874 4.744
96 HD13 LEU 11 HD13 LEU 11 11.764 -5.838 2.991
97 HD21 LEU 11 HD21 LEU 11 11.831 -3.393 4.797
98 HD22 LEU 11 HD22 LEU 11 10.422 -2.558 4.142
99 HD23 LEU 11 HD23 LEU 11 11.591 -3.307 3.053
100 H ARG 12 HN ARG 12 6.096 -4.689 3.653
101 HA ARG 12 HA ARG 12 6.477 -4.670 6.462
102 HB2 ARG 12 HB2 ARG 12 4.135 -3.846 6.571
103 HB3 ARG 12 HB1 ARG 12 5.161 -2.931 5.479
104 HG2 ARG 12 HG2 ARG 12 4.191 -4.214 3.587
105 HG3 ARG 12 HG1 ARG 12 3.077 -4.971 4.729
106 HD2 ARG 12 HD2 ARG 12 2.085 -3.038 3.539
107 HD3 ARG 12 HD1 ARG 12 2.125 -2.824 5.290
108 HE ARG 12 HE ARG 12 4.451 -1.682 4.328
109 HH11 ARG 12 HH11 ARG 12 1.016 -1.171 3.814
110 HH12 ARG 12 HH12 ARG 12 1.197 0.533 3.552
111 HH21 ARG 12 HH21 ARG 12 4.659 0.557 4.027
112 HH22 ARG 12 HH22 ARG 12 3.251 1.513 3.678
113 H ALA 13 HN ALA 13 5.175 -7.003 4.325
114 HA ALA 13 HA ALA 13 4.340 -9.092 4.625
115 HB1 ALA 13 HB1 ALA 13 6.440 -9.388 5.804
116 HB2 ALA 13 HB2 ALA 13 5.160 -10.339 6.564
117 HB3 ALA 13 HB3 ALA 13 5.693 -8.828 7.300
118 H TRP 14 HN TRP 14 2.213 -7.973 4.639
119 HA TRP 14 HA TRP 14 0.738 -7.588 7.009
120 HB2 TRP 14 HB2 TRP 14 -0.954 -8.462 4.833
121 HB3 TRP 14 HB1 TRP 14 -0.827 -6.867 5.567
122 HD1 TRP 14 HD1 TRP 14 0.698 -5.064 4.339
123 HE1 TRP 14 HE1 TRP 14 1.735 -4.978 1.981
124 HE3 TRP 14 HE3 TRP 14 0.040 -9.942 2.981
125 HZ2 TRP 14 HZ2 TRP 14 2.193 -6.747 -0.172
126 HZ3 TRP 14 HZ3 TRP 14 0.798 -10.666 0.759
127 HH2 TRP 14 HH2 TRP 14 1.854 -9.101 -0.790
128 H LYS 15 HN LYS 15 0.415 -10.245 4.641
129 HA LYS 15 HA LYS 15 -0.155 -12.030 6.905
130 HB2 LYS 15 HB2 LYS 15 -1.352 -13.478 5.323
131 HB3 LYS 15 HB1 LYS 15 -2.047 -11.867 5.398
132 HG2 LYS 15 HG2 LYS 15 -1.959 -11.831 3.183
133 HG3 LYS 15 HG1 LYS 15 -0.203 -11.738 3.320
134 HD2 LYS 15 HD2 LYS 15 -0.969 -13.564 1.830
135 HD3 LYS 15 HD1 LYS 15 -0.023 -14.142 3.205
136 HE2 LYS 15 HE2 LYS 15 -2.077 -14.736 4.377
137 HE3 LYS 15 HE1 LYS 15 -3.035 -14.137 3.024
138 HZ1 LYS 15 HZ1 LYS 15 -1.022 -16.273 2.666
139 HZ2 LYS 15 HZ2 LYS 15 -2.335 -15.880 1.666
140 HZ3 LYS 15 HZ3 LYS 15 -2.602 -16.627 3.162
141 H LYS 16 HN LYS 16 2.106 -11.226 4.591
142 HA LYS 16 HA LYS 16 4.092 -12.116 3.935
143 HB2 LYS 16 HB2 LYS 16 4.419 -11.932 6.386
144 HB3 LYS 16 HB1 LYS 16 3.853 -13.585 6.569
145 HG2 LYS 16 HG2 LYS 16 6.225 -13.616 6.680
146 HG3 LYS 16 HG1 LYS 16 5.759 -14.316 5.130
147 HD2 LYS 16 HD2 LYS 16 6.153 -12.074 4.098
148 HD3 LYS 16 HD1 LYS 16 6.811 -11.540 5.645
149 HE2 LYS 16 HE2 LYS 16 7.869 -13.715 3.849
150 HE3 LYS 16 HE1 LYS 16 8.636 -12.175 4.230
151 HZ1 LYS 16 HZ1 LYS 16 9.696 -13.823 5.528
152 HZ2 LYS 16 HZ2 LYS 16 8.225 -14.492 6.037
153 HZ3 LYS 16 HZ3 LYS 16 8.699 -12.962 6.599
154 H TYR 17 HN TYR 17 2.524 -13.290 2.352
155 HA TYR 17 HA TYR 17 2.260 -15.063 0.971
156 HB2 TYR 17 HB2 TYR 17 4.429 -16.412 2.590
157 HB3 TYR 17 HB1 TYR 17 3.892 -16.860 0.975
158 HD1 TYR 17 HD1 TYR 17 4.264 -15.173 -0.918
159 HD2 TYR 17 HD2 TYR 17 6.132 -14.840 2.894
160 HE1 TYR 17 HE1 TYR 17 5.975 -13.692 -1.886
161 HE2 TYR 17 HE2 TYR 17 7.840 -13.363 1.933
162 HH TYR 17 HH TYR 17 8.840 -12.911 -0.265
163 H GLY 18 HN GLY 18 3.113 -16.832 3.926
164 HA2 GLY 18 HA2 GLY 18 0.375 -17.843 4.112
165 HA3 GLY 18 HA1 GLY 18 1.675 -19.010 3.895
Start of MODEL 10
1 H1 GLY 1 HT1 GLY 1 -0.832 1.317 -1.167
2 H2 GLY 1 HT2 GLY 1 0.578 2.060 -0.602
3 H3 GLY 1 HT3 GLY 1 -0.396 1.176 0.468
4 HA2 GLY 1 HA1 GLY 1 1.430 -0.210 -0.009
5 HA3 GLY 1 HA2 GLY 1 0.071 -0.838 -0.932
6 H GLY 2 HN GLY 2 -0.073 0.820 -3.053
7 HA2 GLY 2 HA2 GLY 2 0.968 1.834 -4.848
8 HA3 GLY 2 HA1 GLY 2 2.510 1.608 -4.046
9 H LEU 3 HN LEU 3 1.689 1.208 -6.851
10 HA LEU 3 HA LEU 3 1.820 -1.598 -7.378
11 HB2 LEU 3 HB2 LEU 3 2.238 0.820 -9.126
12 HB3 LEU 3 HB1 LEU 3 2.426 -0.814 -9.727
13 HG LEU 3 HG LEU 3 0.024 -1.223 -8.998
14 HD11 LEU 3 HD11 LEU 3 -0.185 0.699 -7.491
15 HD12 LEU 3 HD12 LEU 3 -1.413 0.714 -8.757
16 HD13 LEU 3 HD13 LEU 3 -0.019 1.787 -8.870
17 HD21 LEU 3 HD21 LEU 3 -0.894 -0.169 -11.005
18 HD22 LEU 3 HD22 LEU 3 0.662 -0.937 -11.322
19 HD23 LEU 3 HD23 LEU 3 0.564 0.815 -11.149
20 H ARG 4 HN ARG 4 4.200 1.011 -7.950
21 HA ARG 4 HA ARG 4 6.354 -0.902 -8.136
22 HB2 ARG 4 HB2 ARG 4 7.810 0.937 -8.545
23 HB3 ARG 4 HB1 ARG 4 6.318 1.280 -9.406
24 HG2 ARG 4 HG2 ARG 4 6.589 2.371 -6.664
25 HG3 ARG 4 HG1 ARG 4 7.574 3.097 -7.935
26 HD2 ARG 4 HD2 ARG 4 4.590 2.721 -8.117
27 HD3 ARG 4 HD1 ARG 4 5.363 4.204 -7.557
28 HE ARG 4 HE ARG 4 5.990 3.138 -10.227
29 HH11 ARG 4 HH11 ARG 4 4.647 5.660 -8.201
30 HH12 ARG 4 HH12 ARG 4 4.553 6.821 -9.497
31 HH21 ARG 4 HH21 ARG 4 5.886 4.641 -11.912
32 HH22 ARG 4 HH22 ARG 4 5.268 6.238 -11.614
33 H SER 5 HN SER 5 4.786 0.847 -5.727
34 HA SER 5 HA SER 5 6.831 0.944 -3.770
35 HB2 SER 5 HB2 SER 5 3.858 0.958 -3.268
36 HB3 SER 5 HB1 SER 5 5.129 1.706 -2.298
37 HG SER 5 HG SER 5 4.734 3.418 -3.452
38 H LEU 6 HN LEU 6 5.076 -1.576 -5.071
39 HA LEU 6 HA LEU 6 4.174 -3.309 -3.248
40 HB2 LEU 6 HB2 LEU 6 4.195 -3.845 -5.575
41 HB3 LEU 6 HB1 LEU 6 5.945 -3.879 -5.613
42 HG LEU 6 HG LEU 6 5.859 -5.883 -4.098
43 HD11 LEU 6 HD11 LEU 6 3.629 -5.544 -3.184
44 HD12 LEU 6 HD12 LEU 6 3.766 -7.121 -3.962
45 HD13 LEU 6 HD13 LEU 6 2.926 -5.803 -4.781
46 HD21 LEU 6 HD21 LEU 6 6.231 -6.085 -6.497
47 HD22 LEU 6 HD22 LEU 6 4.490 -6.122 -6.774
48 HD23 LEU 6 HD23 LEU 6 5.272 -7.433 -5.889
49 H GLY 7 HN GLY 7 7.665 -2.924 -3.944
50 HA2 GLY 7 HA2 GLY 7 8.611 -4.997 -2.328
51 HA3 GLY 7 HA1 GLY 7 9.514 -3.547 -2.735
52 H ARG 8 HN ARG 8 7.612 -1.752 -1.453
53 HA ARG 8 HA ARG 8 8.508 -2.128 1.293
54 HB2 ARG 8 HB2 ARG 8 7.271 0.188 -0.187
55 HB3 ARG 8 HB1 ARG 8 7.479 0.197 1.559
56 HG2 ARG 8 HG2 ARG 8 9.853 0.037 1.346
57 HG3 ARG 8 HG1 ARG 8 9.727 -0.211 -0.396
58 HD2 ARG 8 HD2 ARG 8 8.751 2.274 0.999
59 HD3 ARG 8 HD1 ARG 8 10.375 2.112 0.332
60 HE ARG 8 HE ARG 8 8.980 1.529 -1.811
61 HH11 ARG 8 HH11 ARG 8 8.318 4.032 0.559
62 HH12 ARG 8 HH12 ARG 8 7.589 5.099 -0.604
63 HH21 ARG 8 HH21 ARG 8 8.030 2.924 -3.322
64 HH22 ARG 8 HH22 ARG 8 7.416 4.471 -2.801
65 H LYS 9 HN LYS 9 5.617 -2.296 -0.629
66 HA LYS 9 HA LYS 9 3.708 -2.231 1.450
67 HB2 LYS 9 HB2 LYS 9 3.044 -2.058 -0.889
68 HB3 LYS 9 HB1 LYS 9 3.617 -3.692 -1.196
69 HG2 LYS 9 HG2 LYS 9 1.912 -4.626 0.200
70 HG3 LYS 9 HG1 LYS 9 1.403 -3.024 0.732
71 HD2 LYS 9 HD2 LYS 9 -0.110 -3.976 -0.963
72 HD3 LYS 9 HD1 LYS 9 0.656 -2.486 -1.513
73 HE2 LYS 9 HE2 LYS 9 2.252 -3.757 -2.818
74 HE3 LYS 9 HE1 LYS 9 1.578 -5.270 -2.217
75 HZ1 LYS 9 HZ1 LYS 9 0.845 -4.460 -4.503
76 HZ2 LYS 9 HZ2 LYS 9 -0.099 -3.317 -3.675
77 HZ3 LYS 9 HZ3 LYS 9 -0.367 -4.974 -3.432
78 H ILE 10 HN ILE 10 5.618 -4.850 0.029
79 HA ILE 10 HA ILE 10 4.502 -6.973 1.551
80 HB ILE 10 HB ILE 10 7.308 -6.799 0.429
81 HG12 ILE 10 HG12 ILE 10 5.599 -6.346 -1.304
82 HG13 ILE 10 HG11 ILE 10 6.468 -7.851 -1.587
83 HG21 ILE 10 HG21 ILE 10 7.196 -9.242 0.362
84 HG22 ILE 10 HG22 ILE 10 5.599 -9.189 1.107
85 HG23 ILE 10 HG23 ILE 10 7.009 -8.624 2.003
86 HD11 ILE 10 HD11 ILE 10 4.576 -9.106 -0.703
87 HD12 ILE 10 HD12 ILE 10 4.101 -8.084 -2.059
88 HD13 ILE 10 HD13 ILE 10 3.710 -7.597 -0.408
89 H LEU 11 HN LEU 11 6.913 -4.571 2.191
90 HA LEU 11 HA LEU 11 8.566 -5.880 3.996
91 HB2 LEU 11 HB2 LEU 11 8.698 -3.555 2.777
92 HB3 LEU 11 HB1 LEU 11 8.007 -2.959 4.270
93 HG LEU 11 HG LEU 11 10.494 -2.763 4.119
94 HD11 LEU 11 HD11 LEU 11 9.430 -4.500 6.335
95 HD12 LEU 11 HD12 LEU 11 9.422 -2.737 6.284
96 HD13 LEU 11 HD13 LEU 11 10.952 -3.611 6.373
97 HD21 LEU 11 HD21 LEU 11 11.838 -4.781 4.449
98 HD22 LEU 11 HD22 LEU 11 10.958 -4.819 2.920
99 HD23 LEU 11 HD23 LEU 11 10.385 -5.768 4.292
100 H ARG 12 HN ARG 12 5.583 -4.039 4.633
101 HA ARG 12 HA ARG 12 5.917 -4.056 7.461
102 HB2 ARG 12 HB2 ARG 12 3.602 -3.284 7.589
103 HB3 ARG 12 HB1 ARG 12 4.509 -2.379 6.387
104 HG2 ARG 12 HG2 ARG 12 3.425 -3.465 4.600
105 HG3 ARG 12 HG1 ARG 12 2.758 -4.707 5.663
106 HD2 ARG 12 HD2 ARG 12 2.073 -1.778 5.814
107 HD3 ARG 12 HD1 ARG 12 1.105 -2.986 4.970
108 HE ARG 12 HE ARG 12 1.037 -4.106 7.282
109 HH11 ARG 12 HH11 ARG 12 1.208 -0.633 6.820
110 HH12 ARG 12 HH12 ARG 12 0.261 -0.277 8.237
111 HH21 ARG 12 HH21 ARG 12 -0.178 -3.640 9.151
112 HH22 ARG 12 HH22 ARG 12 -0.489 -1.984 9.582
113 H ALA 13 HN ALA 13 4.817 -6.385 5.233
114 HA ALA 13 HA ALA 13 4.032 -8.493 5.425
115 HB1 ALA 13 HB1 ALA 13 6.035 -8.722 6.827
116 HB2 ALA 13 HB2 ALA 13 4.732 -9.798 7.334
117 HB3 ALA 13 HB3 ALA 13 5.068 -8.327 8.249
118 H TRP 14 HN TRP 14 1.844 -7.797 5.189
119 HA TRP 14 HA TRP 14 0.154 -7.546 7.491
120 HB2 TRP 14 HB2 TRP 14 -1.347 -8.398 5.206
121 HB3 TRP 14 HB1 TRP 14 -1.308 -6.806 5.959
122 HD1 TRP 14 HD1 TRP 14 -0.114 -4.897 4.660
123 HE1 TRP 14 HE1 TRP 14 1.115 -4.749 2.407
124 HE3 TRP 14 HE3 TRP 14 0.227 -9.880 3.587
125 HZ2 TRP 14 HZ2 TRP 14 2.091 -6.508 0.433
126 HZ3 TRP 14 HZ3 TRP 14 1.323 -10.564 1.500
127 HH2 TRP 14 HH2 TRP 14 2.236 -8.914 -0.045
128 H LYS 15 HN LYS 15 -0.077 -9.995 4.914
129 HA LYS 15 HA LYS 15 -0.224 -12.037 7.019
130 HB2 LYS 15 HB2 LYS 15 -1.333 -13.468 5.215
131 HB3 LYS 15 HB1 LYS 15 -2.283 -12.177 5.920
132 HG2 LYS 15 HG2 LYS 15 -2.741 -12.189 3.610
133 HG3 LYS 15 HG1 LYS 15 -1.713 -10.788 3.904
134 HD2 LYS 15 HD2 LYS 15 0.147 -11.809 2.914
135 HD3 LYS 15 HD1 LYS 15 -0.568 -13.419 3.027
136 HE2 LYS 15 HE2 LYS 15 -1.730 -11.225 1.326
137 HE3 LYS 15 HE1 LYS 15 -0.536 -12.375 0.724
138 HZ1 LYS 15 HZ1 LYS 15 -2.020 -14.178 1.160
139 HZ2 LYS 15 HZ2 LYS 15 -2.860 -13.020 0.244
140 HZ3 LYS 15 HZ3 LYS 15 -3.147 -13.155 1.911
141 H LYS 16 HN LYS 16 2.009 -10.717 5.410
142 HA LYS 16 HA LYS 16 4.111 -11.274 4.774
143 HB2 LYS 16 HB2 LYS 16 3.850 -12.444 7.019
144 HB3 LYS 16 HB1 LYS 16 3.598 -13.926 6.109
145 HG2 LYS 16 HG2 LYS 16 5.893 -13.752 6.869
146 HG3 LYS 16 HG1 LYS 16 5.813 -13.692 5.108
147 HD2 LYS 16 HD2 LYS 16 6.193 -11.355 5.077
148 HD3 LYS 16 HD1 LYS 16 5.923 -11.218 6.816
149 HE2 LYS 16 HE2 LYS 16 8.213 -12.680 5.503
150 HE3 LYS 16 HE1 LYS 16 8.307 -11.083 6.247
151 HZ1 LYS 16 HZ1 LYS 16 7.581 -12.143 8.353
152 HZ2 LYS 16 HZ2 LYS 16 9.092 -12.681 7.807
153 HZ3 LYS 16 HZ3 LYS 16 7.722 -13.659 7.603
154 H TYR 17 HN TYR 17 2.628 -11.453 2.682
155 HA TYR 17 HA TYR 17 2.194 -12.383 0.668
156 HB2 TYR 17 HB2 TYR 17 4.183 -13.280 -0.494
157 HB3 TYR 17 HB1 TYR 17 4.495 -11.771 0.345
158 HD1 TYR 17 HD1 TYR 17 6.131 -11.643 2.081
159 HD2 TYR 17 HD2 TYR 17 5.099 -15.414 0.395
160 HE1 TYR 17 HE1 TYR 17 8.084 -12.660 3.172
161 HE2 TYR 17 HE2 TYR 17 7.044 -16.441 1.486
162 HH TYR 17 HH TYR 17 8.816 -14.913 3.925
163 H GLY 18 HN GLY 18 1.388 -14.101 2.891
164 HA2 GLY 18 HA2 GLY 18 1.639 -16.740 1.612
165 HA3 GLY 18 HA1 GLY 18 1.253 -16.474 3.307