Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
578707 | 2mmj RC | 19856 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H1 GLY 1 -4.798 -16.672 2.607
2 H2 GLY 1 H2 GLY 1 -4.799 -18.305 2.605
3 H3 GLY 1 H3 GLY 1 -3.768 -17.489 3.283
4 HA2 GLY 1 HA2 GLY 1 -2.451 -17.517 1.404
5 HA3 GLY 1 HA3 GLY 1 -3.772 -18.370 0.618
6 H LEU 2 H LEU 2 -5.624 -16.101 1.130
7 HA LEU 2 HA LEU 2 -5.045 -14.650 -1.280
8 HB2 LEU 2 HB2 LEU 2 -7.265 -14.509 0.741
9 HB3 LEU 2 HB3 LEU 2 -7.160 -13.402 -0.627
10 HG LEU 2 HG LEU 2 -7.365 -16.401 -0.877
11 HD11 LEU 2 HD11 LEU 2 -9.553 -16.246 -0.573
12 HD12 LEU 2 HD12 LEU 2 -9.663 -15.007 -1.823
13 HD13 LEU 2 HD13 LEU 2 -9.362 -14.544 -0.148
14 HD21 LEU 2 HD21 LEU 2 -6.432 -15.695 -2.861
15 HD22 LEU 2 HD22 LEU 2 -7.233 -14.125 -2.805
16 HD23 LEU 2 HD23 LEU 2 -8.154 -15.571 -3.222
17 H PHE 3 H PHE 3 -5.897 -13.429 1.960
18 HA PHE 3 HA PHE 3 -4.937 -10.849 1.584
19 HB2 PHE 3 HB2 PHE 3 -6.041 -12.350 3.716
20 HB3 PHE 3 HB3 PHE 3 -4.561 -11.614 4.323
21 HD1 PHE 3 HD2 PHE 3 -7.914 -10.989 3.009
22 HD2 PHE 3 HD1 PHE 3 -4.353 -9.220 4.526
23 HE1 PHE 3 HE2 PHE 3 -9.104 -8.856 3.303
24 HE2 PHE 3 HE1 PHE 3 -5.536 -7.084 4.823
25 HZ PHE 3 HZ PHE 3 -7.915 -6.899 4.210
26 H GLY 4 H GLY 4 -3.240 -13.783 2.370
27 HA2 GLY 4 HA2 GLY 4 -0.910 -12.858 3.521
28 HA3 GLY 4 HA3 GLY 4 -0.990 -14.243 2.443
29 H VAL 5 H VAL 5 -1.930 -12.597 0.187
30 HA VAL 5 HA VAL 5 0.691 -11.555 -0.595
31 HB VAL 5 HB VAL 5 -1.738 -12.159 -2.287
32 HG11 VAL 5 HG11 VAL 5 1.004 -11.143 -2.968
33 HG12 VAL 5 HG12 VAL 5 0.003 -11.989 -4.149
34 HG13 VAL 5 HG13 VAL 5 -0.564 -10.481 -3.429
35 HG21 VAL 5 HG21 VAL 5 0.381 -13.809 -3.019
36 HG22 VAL 5 HG22 VAL 5 0.393 -13.814 -1.256
37 HG23 VAL 5 HG23 VAL 5 -1.068 -14.277 -2.129
38 H LEU 6 H LEU 6 -2.524 -10.529 0.136
39 HA LEU 6 HA LEU 6 -2.745 -8.146 -1.249
40 HB2 LEU 6 HB2 LEU 6 -3.816 -9.203 1.296
41 HB3 LEU 6 HB3 LEU 6 -3.920 -7.460 1.059
42 HG LEU 6 HG LEU 6 -5.041 -9.494 -0.865
43 HD11 LEU 6 HD11 LEU 6 -7.179 -8.252 0.271
44 HD12 LEU 6 HD12 LEU 6 -6.092 -8.423 1.649
45 HD13 LEU 6 HD13 LEU 6 -6.576 -9.846 0.726
46 HD21 LEU 6 HD21 LEU 6 -4.405 -6.980 -1.438
47 HD22 LEU 6 HD22 LEU 6 -5.973 -6.683 -0.686
48 HD23 LEU 6 HD23 LEU 6 -5.854 -7.753 -2.083
49 H ALA 7 H ALA 7 -0.738 -8.938 1.471
50 HA ALA 7 HA ALA 7 -0.195 -6.383 2.470
51 HB1 ALA 7 HB1 ALA 7 0.764 -7.804 3.905
52 HB2 ALA 7 HB2 ALA 7 1.004 -9.038 2.667
53 HB3 ALA 7 HB3 ALA 7 2.164 -7.720 2.834
54 H LYS 8 H LYS 8 0.909 -7.993 -0.400
55 HA LYS 8 HA LYS 8 3.239 -6.516 -0.918
56 HB2 LYS 8 HB2 LYS 8 1.965 -8.586 -2.144
57 HB3 LYS 8 HB3 LYS 8 1.615 -7.274 -3.262
58 HG2 LYS 8 HG2 LYS 8 4.414 -7.476 -2.374
59 HG3 LYS 8 HG3 LYS 8 3.823 -8.803 -3.377
60 HD2 LYS 8 HD2 LYS 8 3.589 -7.488 -5.215
61 HD3 LYS 8 HD3 LYS 8 3.158 -6.060 -4.270
62 HE2 LYS 8 HE2 LYS 8 5.424 -5.628 -3.729
63 HE3 LYS 8 HE3 LYS 8 5.940 -7.206 -4.322
64 HZ1 LYS 8 HZ1 LYS 8 4.972 -6.322 -6.547
65 HZ2 LYS 8 HZ2 LYS 8 6.518 -5.846 -6.054
66 HZ3 LYS 8 HZ3 LYS 8 5.204 -4.802 -5.842
67 H VAL 9 H VAL 9 -0.045 -5.599 -0.984
68 HA VAL 9 HA VAL 9 0.703 -3.016 -2.160
69 HB VAL 9 HB VAL 9 -1.940 -4.305 -2.804
70 HG11 VAL 9 HG11 VAL 9 -1.766 -2.658 -4.727
71 HG12 VAL 9 HG12 VAL 9 -2.007 -1.968 -3.120
72 HG13 VAL 9 HG13 VAL 9 -0.406 -1.944 -3.860
73 HG21 VAL 9 HG21 VAL 9 -0.798 -4.618 -5.117
74 HG22 VAL 9 HG22 VAL 9 0.698 -4.602 -4.182
75 HG23 VAL 9 HG23 VAL 9 -0.536 -5.818 -3.851
76 H ALA 10 H ALA 10 0.621 -3.325 0.502
77 HA ALA 10 HA ALA 10 -1.500 -1.549 1.266
78 HB1 ALA 10 HB1 ALA 10 -2.553 -2.935 2.921
79 HB2 ALA 10 HB2 ALA 10 -2.618 -3.764 1.365
80 HB3 ALA 10 HB3 ALA 10 -1.441 -4.261 2.580
81 HB2 I4G 11 HB2 I4G 11 -0.289 -0.014 0.889
82 HB3 I4G 11 HB3 I4G 11 0.597 1.155 1.607
83 HG I4G 11 HG I4G 11 -1.989 0.335 2.814
84 HD13 I4G 11 HD13 I4G 11 -0.464 3.001 2.836
85 HD11 I4G 11 HD11 I4G 11 -2.002 2.696 3.664
86 HD12 I4G 11 HD12 I4G 11 -0.540 1.844 4.172
87 HD23 I4G 11 HD23 I4G 11 -2.493 0.860 0.435
88 HD22 I4G 11 HD22 I4G 11 -1.684 2.427 0.597
89 HD21 I4G 11 HD21 I4G 11 -3.167 2.093 1.510
90 HA2 I4G 11 HA2 I4G 11 1.902 -0.784 4.066
91 HA3 I4G 11 HA3 I4G 11 1.081 0.620 4.211
92 H HIS 12 H HIS 12 2.432 -0.541 1.309
93 HA HIS 12 HA HIS 12 4.500 1.548 1.426
94 HB2 HIS 12 HB2 HIS 12 5.874 0.234 0.102
95 HB3 HIS 12 HB3 HIS 12 5.025 -0.990 1.040
96 HD1 HIS 12 HD1 HIS 12 6.176 -0.671 -2.173
97 HD2 HIS 12 HD2 HIS 12 2.402 -1.527 -0.661
98 HE1 HIS 12 HE1 HIS 12 4.954 -1.836 -4.036
99 H VAL 13 H VAL 13 1.611 0.603 -0.127
100 HA VAL 13 HA VAL 13 1.846 1.660 -2.675
101 HB VAL 13 HB VAL 13 -0.559 1.634 -0.851
102 HG11 VAL 13 HG11 VAL 13 -1.115 3.263 -2.424
103 HG12 VAL 13 HG12 VAL 13 -0.275 2.424 -3.730
104 HG13 VAL 13 HG13 VAL 13 -1.793 1.782 -3.100
105 HG21 VAL 13 HG21 VAL 13 -1.219 -0.298 -2.256
106 HG22 VAL 13 HG22 VAL 13 0.344 -0.203 -3.067
107 HG23 VAL 13 HG23 VAL 13 0.266 -0.576 -1.345
108 H VAL 14 H VAL 14 0.617 3.331 0.228
109 HA VAL 14 HA VAL 14 0.215 5.836 -0.865
110 HB VAL 14 HB VAL 14 1.167 5.161 1.921
111 HG11 VAL 14 HG11 VAL 14 1.639 7.461 1.576
112 HG12 VAL 14 HG12 VAL 14 0.095 7.724 0.763
113 HG13 VAL 14 HG13 VAL 14 0.135 7.384 2.494
114 HG21 VAL 14 HG21 VAL 14 -1.103 4.314 0.877
115 HG22 VAL 14 HG22 VAL 14 -1.020 4.897 2.539
116 HG23 VAL 14 HG23 VAL 14 -1.623 5.955 1.263
117 H GLY 15 H GLY 15 3.205 4.394 0.338
118 HA2 GLY 15 HA2 GLY 15 4.808 6.704 0.266
119 HA3 GLY 15 HA3 GLY 15 5.396 5.052 0.154
120 H ALA 16 H ALA 16 3.635 4.676 -2.279
121 HA ALA 16 HA ALA 16 5.572 5.750 -4.185
122 HB1 ALA 16 HB1 ALA 16 5.153 3.958 -5.492
123 HB2 ALA 16 HB2 ALA 16 4.557 3.270 -3.981
124 HB3 ALA 16 HB3 ALA 16 3.425 3.967 -5.139
125 H ILE 17 H ILE 17 2.032 5.471 -3.863
126 HA ILE 17 HA ILE 17 1.323 7.052 -6.036
127 HB ILE 17 HB ILE 17 -0.139 6.763 -3.408
128 HG12 ILE 17 HG12 ILE 17 -0.386 5.246 -6.014
129 HG13 ILE 17 HG13 ILE 17 0.275 4.617 -4.509
130 HG21 ILE 17 HG21 ILE 17 -1.129 7.703 -6.096
131 HG22 ILE 17 HG22 ILE 17 -2.136 7.407 -4.680
132 HG23 ILE 17 HG23 ILE 17 -0.931 8.694 -4.652
133 HD11 ILE 17 HD11 ILE 17 -2.571 5.420 -5.046
134 HD12 ILE 17 HD12 ILE 17 -1.946 3.792 -4.778
135 HD13 ILE 17 HD13 ILE 17 -1.946 4.964 -3.461
136 H ALA 18 H ALA 18 2.241 7.972 -2.769
137 HA ALA 18 HA ALA 18 1.523 10.720 -3.031
138 HB1 ALA 18 HB1 ALA 18 2.571 11.045 -0.929
139 HB2 ALA 18 HB2 ALA 18 1.791 9.463 -0.866
140 HB3 ALA 18 HB3 ALA 18 3.535 9.578 -1.107
141 H GLU 19 H GLU 19 4.101 8.861 -4.222
142 HA GLU 19 HA GLU 19 6.133 10.857 -4.226
143 HB2 GLU 19 HB2 GLU 19 6.277 8.251 -4.558
144 HB3 GLU 19 HB3 GLU 19 6.054 8.659 -6.254
145 HG2 GLU 19 HG2 GLU 19 8.055 10.360 -5.139
146 HG3 GLU 19 HG3 GLU 19 8.432 8.682 -4.753
147 H HIS 20 H HIS 20 3.925 9.639 -6.739
148 HA HIS 20 HA HIS 20 4.752 11.634 -8.634
149 HB2 HIS 20 HB2 HIS 20 3.367 10.567 -10.158
150 HB3 HIS 20 HB3 HIS 20 3.775 9.247 -9.065
151 HD1 HIS 20 HD1 HIS 20 0.938 11.486 -10.056
152 HD2 HIS 20 HD2 HIS 20 1.649 8.224 -7.584
153 HE1 HIS 20 HE1 HIS 20 -1.333 10.672 -9.348
154 H PHE 21 H PHE 21 2.367 11.390 -6.154
155 HA PHE 21 HA PHE 21 0.866 13.673 -7.188
156 HB2 PHE 21 HB2 PHE 21 0.030 11.424 -5.889
157 HB3 PHE 21 HB3 PHE 21 0.126 12.572 -4.557
158 HD1 PHE 21 HD1 PHE 21 -1.007 12.711 -8.114
159 HD2 PHE 21 HD2 PHE 21 -1.894 13.500 -4.026
160 HE1 PHE 21 HE1 PHE 21 -3.186 13.646 -8.771
161 HE2 PHE 21 HE2 PHE 21 -4.075 14.435 -4.676
162 HZ PHE 21 HZ PHE 21 -4.724 14.508 -7.051
163 HN1 NH2 22 HN1 NH2 22 3.814 13.764 -6.130
164 HN2 NH2 22 HN2 NH2 22 3.795 15.001 -4.836
Start of MODEL 2
1 H1 GLY 1 H1 GLY 1 -4.859 -18.939 2.034
2 H2 GLY 1 H2 GLY 1 -4.952 -18.306 0.531
3 H3 GLY 1 H3 GLY 1 -3.810 -19.120 1.005
4 HA2 GLY 1 HA2 GLY 1 -4.185 -16.931 2.795
5 HA3 GLY 1 HA3 GLY 1 -2.708 -17.318 1.924
6 H LEU 2 H LEU 2 -5.969 -16.018 1.312
7 HA LEU 2 HA LEU 2 -5.249 -14.667 -1.064
8 HB2 LEU 2 HB2 LEU 2 -7.588 -15.230 0.225
9 HB3 LEU 2 HB3 LEU 2 -7.440 -13.493 0.490
10 HG LEU 2 HG LEU 2 -8.810 -13.952 -1.458
11 HD11 LEU 2 HD11 LEU 2 -7.624 -12.582 -3.085
12 HD12 LEU 2 HD12 LEU 2 -6.111 -12.844 -2.220
13 HD13 LEU 2 HD13 LEU 2 -7.419 -11.942 -1.455
14 HD21 LEU 2 HD21 LEU 2 -8.374 -15.633 -2.836
15 HD22 LEU 2 HD22 LEU 2 -6.904 -15.989 -1.926
16 HD23 LEU 2 HD23 LEU 2 -6.847 -14.884 -3.301
17 H PHE 3 H PHE 3 -6.052 -13.282 2.128
18 HA PHE 3 HA PHE 3 -5.100 -10.707 1.543
19 HB2 PHE 3 HB2 PHE 3 -6.342 -11.984 3.718
20 HB3 PHE 3 HB3 PHE 3 -4.841 -11.316 4.352
21 HD1 PHE 3 HD1 PHE 3 -4.425 -8.900 4.268
22 HD2 PHE 3 HD2 PHE 3 -8.137 -10.577 3.031
23 HE1 PHE 3 HE1 PHE 3 -5.470 -6.677 4.400
24 HE2 PHE 3 HE2 PHE 3 -9.187 -8.355 3.160
25 HZ PHE 3 HZ PHE 3 -7.853 -6.401 3.845
26 H GLY 4 H GLY 4 -3.482 -13.594 2.620
27 HA2 GLY 4 HA2 GLY 4 -1.176 -12.608 3.773
28 HA3 GLY 4 HA3 GLY 4 -1.245 -14.080 2.816
29 H VAL 5 H VAL 5 -2.104 -12.561 0.413
30 HA VAL 5 HA VAL 5 0.571 -11.680 -0.387
31 HB VAL 5 HB VAL 5 -1.854 -12.300 -2.081
32 HG11 VAL 5 HG11 VAL 5 0.949 -11.475 -2.790
33 HG12 VAL 5 HG12 VAL 5 -0.110 -12.311 -3.928
34 HG13 VAL 5 HG13 VAL 5 -0.571 -10.734 -3.286
35 HG21 VAL 5 HG21 VAL 5 -1.082 -14.331 -1.158
36 HG22 VAL 5 HG22 VAL 5 -0.402 -14.257 -2.784
37 HG23 VAL 5 HG23 VAL 5 0.609 -13.883 -1.388
38 H LEU 6 H LEU 6 -2.632 -10.488 0.168
39 HA LEU 6 HA LEU 6 -2.662 -8.175 -1.368
40 HB2 LEU 6 HB2 LEU 6 -3.947 -9.032 1.165
41 HB3 LEU 6 HB3 LEU 6 -4.001 -7.316 0.766
42 HG LEU 6 HG LEU 6 -5.042 -9.530 -1.000
43 HD11 LEU 6 HD11 LEU 6 -7.015 -9.421 0.028
44 HD12 LEU 6 HD12 LEU 6 -6.966 -7.661 0.119
45 HD13 LEU 6 HD13 LEU 6 -6.157 -8.630 1.351
46 HD21 LEU 6 HD21 LEU 6 -6.217 -7.093 -1.650
47 HD22 LEU 6 HD22 LEU 6 -4.998 -7.966 -2.579
48 HD23 LEU 6 HD23 LEU 6 -4.507 -6.725 -1.425
49 H ALA 7 H ALA 7 -0.852 -8.924 1.484
50 HA ALA 7 HA ALA 7 -0.296 -6.336 2.419
51 HB1 ALA 7 HB1 ALA 7 0.276 -8.792 3.323
52 HB2 ALA 7 HB2 ALA 7 1.847 -8.358 2.645
53 HB3 ALA 7 HB3 ALA 7 1.108 -7.340 3.881
54 H LYS 8 H LYS 8 0.959 -8.142 -0.270
55 HA LYS 8 HA LYS 8 3.378 -6.790 -0.683
56 HB2 LYS 8 HB2 LYS 8 2.116 -8.863 -1.901
57 HB3 LYS 8 HB3 LYS 8 1.883 -7.597 -3.099
58 HG2 LYS 8 HG2 LYS 8 4.610 -7.914 -1.999
59 HG3 LYS 8 HG3 LYS 8 4.017 -9.186 -3.070
60 HD2 LYS 8 HD2 LYS 8 3.282 -7.002 -4.469
61 HD3 LYS 8 HD3 LYS 8 4.720 -6.380 -3.655
62 HE2 LYS 8 HE2 LYS 8 5.856 -8.539 -4.464
63 HE3 LYS 8 HE3 LYS 8 4.480 -8.691 -5.556
64 HZ1 LYS 8 HZ1 LYS 8 5.016 -6.532 -6.484
65 HZ2 LYS 8 HZ2 LYS 8 6.345 -7.571 -6.613
66 HZ3 LYS 8 HZ3 LYS 8 6.325 -6.366 -5.426
67 H VAL 9 H VAL 9 0.143 -5.755 -1.075
68 HA VAL 9 HA VAL 9 1.098 -3.258 -2.289
69 HB VAL 9 HB VAL 9 -1.542 -4.460 -3.087
70 HG11 VAL 9 HG11 VAL 9 -1.148 -2.927 -5.061
71 HG12 VAL 9 HG12 VAL 9 -1.448 -2.136 -3.513
72 HG13 VAL 9 HG13 VAL 9 0.195 -2.244 -4.145
73 HG21 VAL 9 HG21 VAL 9 -0.182 -6.090 -3.970
74 HG22 VAL 9 HG22 VAL 9 -0.197 -4.918 -5.288
75 HG23 VAL 9 HG23 VAL 9 1.179 -4.990 -4.187
76 H ALA 10 H ALA 10 0.776 -3.469 0.378
77 HA ALA 10 HA ALA 10 -1.332 -1.575 0.881
78 HB1 ALA 10 HB1 ALA 10 -2.664 -3.548 1.073
79 HB2 ALA 10 HB2 ALA 10 -1.462 -4.324 2.105
80 HB3 ALA 10 HB3 ALA 10 -2.369 -2.934 2.700
81 HB2 I4G 11 HB2 I4G 11 -0.156 -0.108 0.541
82 HB3 I4G 11 HB3 I4G 11 0.852 1.026 1.145
83 HG I4G 11 HG I4G 11 -0.782 2.050 2.490
84 HD13 I4G 11 HD13 I4G 11 -2.243 1.079 -0.031
85 HD11 I4G 11 HD11 I4G 11 -2.775 2.413 1.009
86 HD12 I4G 11 HD12 I4G 11 -1.269 2.549 0.096
87 HD23 I4G 11 HD23 I4G 11 -1.550 -0.077 3.526
88 HD22 I4G 11 HD22 I4G 11 -2.451 -0.482 2.056
89 HD21 I4G 11 HD21 I4G 11 -2.928 0.918 3.035
90 HA2 I4G 11 HA2 I4G 11 1.899 -0.741 3.858
91 HA3 I4G 11 HA3 I4G 11 1.087 0.676 3.899
92 H HIS 12 H HIS 12 2.662 -0.661 1.178
93 HA HIS 12 HA HIS 12 4.757 1.387 1.349
94 HB2 HIS 12 HB2 HIS 12 6.120 0.022 0.039
95 HB3 HIS 12 HB3 HIS 12 5.237 -1.144 1.021
96 HD1 HIS 12 HD1 HIS 12 6.396 -0.937 -2.214
97 HD2 HIS 12 HD2 HIS 12 2.628 -1.732 -0.656
98 HE1 HIS 12 HE1 HIS 12 5.160 -2.158 -4.032
99 H VAL 13 H VAL 13 1.955 0.463 -0.419
100 HA VAL 13 HA VAL 13 2.402 1.605 -2.911
101 HB VAL 13 HB VAL 13 -0.166 1.441 -1.331
102 HG11 VAL 13 HG11 VAL 13 -1.180 1.611 -3.683
103 HG12 VAL 13 HG12 VAL 13 -0.612 3.096 -2.917
104 HG13 VAL 13 HG13 VAL 13 0.371 2.307 -4.152
105 HG21 VAL 13 HG21 VAL 13 1.233 -0.636 -2.146
106 HG22 VAL 13 HG22 VAL 13 -0.525 -0.613 -2.279
107 HG23 VAL 13 HG23 VAL 13 0.470 -0.259 -3.691
108 H VAL 14 H VAL 14 0.894 3.119 -0.057
109 HA VAL 14 HA VAL 14 0.444 5.642 -1.066
110 HB VAL 14 HB VAL 14 1.335 4.929 1.731
111 HG11 VAL 14 HG11 VAL 14 1.658 7.251 1.525
112 HG12 VAL 14 HG12 VAL 14 0.183 7.454 0.577
113 HG13 VAL 14 HG13 VAL 14 0.082 7.068 2.295
114 HG21 VAL 14 HG21 VAL 14 -1.379 5.542 1.703
115 HG22 VAL 14 HG22 VAL 14 -1.131 4.534 0.276
116 HG23 VAL 14 HG23 VAL 14 -0.657 3.942 1.868
117 H GLY 15 H GLY 15 3.454 4.259 0.129
118 HA2 GLY 15 HA2 GLY 15 4.985 6.592 0.304
119 HA3 GLY 15 HA3 GLY 15 5.625 4.986 -0.013
120 H ALA 16 H ALA 16 4.051 4.697 -2.485
121 HA ALA 16 HA ALA 16 5.841 6.229 -4.214
122 HB1 ALA 16 HB1 ALA 16 4.267 4.498 -5.768
123 HB2 ALA 16 HB2 ALA 16 5.960 4.305 -5.312
124 HB3 ALA 16 HB3 ALA 16 4.691 3.607 -4.306
125 H ILE 17 H ILE 17 2.380 5.537 -3.823
126 HA ILE 17 HA ILE 17 1.403 7.069 -5.927
127 HB ILE 17 HB ILE 17 0.104 6.620 -3.237
128 HG12 ILE 17 HG12 ILE 17 0.684 4.513 -4.307
129 HG13 ILE 17 HG13 ILE 17 -1.057 4.759 -4.390
130 HG21 ILE 17 HG21 ILE 17 -0.936 7.647 -5.856
131 HG22 ILE 17 HG22 ILE 17 -2.000 6.883 -4.678
132 HG23 ILE 17 HG23 ILE 17 -1.111 8.342 -4.244
133 HD11 ILE 17 HD11 ILE 17 0.959 5.043 -6.593
134 HD12 ILE 17 HD12 ILE 17 -0.396 3.918 -6.484
135 HD13 ILE 17 HD13 ILE 17 -0.695 5.640 -6.721
136 H ALA 18 H ALA 18 2.333 8.024 -2.666
137 HA ALA 18 HA ALA 18 1.367 10.704 -2.895
138 HB1 ALA 18 HB1 ALA 18 3.300 9.441 -0.959
139 HB2 ALA 18 HB2 ALA 18 2.692 11.091 -0.829
140 HB3 ALA 18 HB3 ALA 18 1.577 9.729 -0.713
141 H GLU 19 H GLU 19 4.010 9.104 -4.215
142 HA GLU 19 HA GLU 19 5.891 11.268 -4.159
143 HB2 GLU 19 HB2 GLU 19 6.276 8.685 -4.483
144 HB3 GLU 19 HB3 GLU 19 6.025 9.068 -6.180
145 HG2 GLU 19 HG2 GLU 19 8.292 9.254 -6.034
146 HG3 GLU 19 HG3 GLU 19 7.810 10.920 -5.719
147 H HIS 20 H HIS 20 3.804 9.847 -6.666
148 HA HIS 20 HA HIS 20 4.451 11.895 -8.573
149 HB2 HIS 20 HB2 HIS 20 3.197 10.687 -10.092
150 HB3 HIS 20 HB3 HIS 20 3.660 9.417 -8.962
151 HD1 HIS 20 HD1 HIS 20 0.724 11.295 -10.243
152 HD2 HIS 20 HD2 HIS 20 1.556 8.449 -7.333
153 HE1 HIS 20 HE1 HIS 20 -1.511 10.393 -9.527
154 H PHE 21 H PHE 21 2.096 11.457 -6.090
155 HA PHE 21 HA PHE 21 0.692 13.880 -7.007
156 HB2 PHE 21 HB2 PHE 21 -0.411 11.377 -6.567
157 HB3 PHE 21 HB3 PHE 21 -0.777 12.250 -5.082
158 HD1 PHE 21 HD2 PHE 21 -0.910 12.720 -8.779
159 HD2 PHE 21 HD1 PHE 21 -2.699 13.503 -4.997
160 HE1 PHE 21 HE2 PHE 21 -2.793 13.833 -9.904
161 HE2 PHE 21 HE1 PHE 21 -4.586 14.616 -6.117
162 HZ PHE 21 HZ PHE 21 -4.633 14.784 -8.573
163 HN1 NH2 22 HN1 NH2 22 3.234 13.853 -5.435
164 HN2 NH2 22 HN2 NH2 22 2.868 14.546 -3.826
Start of MODEL 3
1 H1 GLY 1 H1 GLY 1 -1.588 -16.495 1.564
2 H2 GLY 1 H2 GLY 1 -1.934 -17.457 2.838
3 H3 GLY 1 H3 GLY 1 -1.620 -17.972 1.487
4 HA2 GLY 1 HA2 GLY 1 -3.871 -18.034 1.026
5 HA3 GLY 1 HA3 GLY 1 -4.127 -17.110 2.499
6 H LEU 2 H LEU 2 -5.857 -16.262 0.956
7 HA LEU 2 HA LEU 2 -5.304 -14.656 -1.234
8 HB2 LEU 2 HB2 LEU 2 -7.556 -15.385 -0.445
9 HB3 LEU 2 HB3 LEU 2 -7.456 -14.159 0.817
10 HG LEU 2 HG LEU 2 -7.012 -12.701 -1.467
11 HD11 LEU 2 HD11 LEU 2 -8.727 -13.334 -3.054
12 HD12 LEU 2 HD12 LEU 2 -9.153 -14.735 -2.073
13 HD13 LEU 2 HD13 LEU 2 -7.574 -14.652 -2.852
14 HD21 LEU 2 HD21 LEU 2 -9.490 -12.104 -1.156
15 HD22 LEU 2 HD22 LEU 2 -8.395 -11.839 0.202
16 HD23 LEU 2 HD23 LEU 2 -9.454 -13.250 0.186
17 H PHE 3 H PHE 3 -6.064 -13.399 2.018
18 HA PHE 3 HA PHE 3 -5.135 -10.804 1.517
19 HB2 PHE 3 HB2 PHE 3 -6.319 -12.182 3.672
20 HB3 PHE 3 HB3 PHE 3 -4.828 -11.485 4.298
21 HD1 PHE 3 HD2 PHE 3 -8.076 -10.739 2.754
22 HD2 PHE 3 HD1 PHE 3 -4.575 -9.131 4.563
23 HE1 PHE 3 HE2 PHE 3 -9.189 -8.553 2.956
24 HE2 PHE 3 HE1 PHE 3 -5.682 -6.943 4.769
25 HZ PHE 3 HZ PHE 3 -7.992 -6.652 3.964
26 H GLY 4 H GLY 4 -3.473 -13.707 2.484
27 HA2 GLY 4 HA2 GLY 4 -1.161 -12.733 3.635
28 HA3 GLY 4 HA3 GLY 4 -1.228 -14.175 2.633
29 H VAL 5 H VAL 5 -2.131 -12.598 0.287
30 HA VAL 5 HA VAL 5 0.522 -11.657 -0.516
31 HB VAL 5 HB VAL 5 -1.913 -12.262 -2.200
32 HG11 VAL 5 HG11 VAL 5 -0.595 -10.595 -3.300
33 HG12 VAL 5 HG12 VAL 5 0.895 -11.477 -2.964
34 HG13 VAL 5 HG13 VAL 5 -0.289 -12.142 -4.091
35 HG21 VAL 5 HG21 VAL 5 -0.799 -14.273 -2.851
36 HG22 VAL 5 HG22 VAL 5 0.656 -13.820 -1.964
37 HG23 VAL 5 HG23 VAL 5 -0.821 -14.218 -1.088
38 H LEU 6 H LEU 6 -2.687 -10.525 0.117
39 HA LEU 6 HA LEU 6 -2.777 -8.173 -1.352
40 HB2 LEU 6 HB2 LEU 6 -4.013 -9.138 1.158
41 HB3 LEU 6 HB3 LEU 6 -4.069 -7.401 0.859
42 HG LEU 6 HG LEU 6 -5.117 -9.472 -1.065
43 HD11 LEU 6 HD11 LEU 6 -7.324 -8.283 -0.144
44 HD12 LEU 6 HD12 LEU 6 -6.333 -8.207 1.313
45 HD13 LEU 6 HD13 LEU 6 -6.668 -9.764 0.554
46 HD21 LEU 6 HD21 LEU 6 -6.215 -6.786 -1.147
47 HD22 LEU 6 HD22 LEU 6 -5.566 -7.784 -2.448
48 HD23 LEU 6 HD23 LEU 6 -4.479 -6.814 -1.453
49 H ALA 7 H ALA 7 -0.907 -8.968 1.449
50 HA ALA 7 HA ALA 7 -0.365 -6.401 2.440
51 HB1 ALA 7 HB1 ALA 7 0.755 -7.576 3.950
52 HB2 ALA 7 HB2 ALA 7 0.465 -9.031 2.995
53 HB3 ALA 7 HB3 ALA 7 1.929 -8.082 2.734
54 H LYS 8 H LYS 8 0.861 -8.116 -0.321
55 HA LYS 8 HA LYS 8 3.251 -6.712 -0.744
56 HB2 LYS 8 HB2 LYS 8 2.000 -8.778 -1.988
57 HB3 LYS 8 HB3 LYS 8 1.731 -7.488 -3.153
58 HG2 LYS 8 HG2 LYS 8 4.316 -7.092 -2.774
59 HG3 LYS 8 HG3 LYS 8 4.258 -8.796 -2.313
60 HD2 LYS 8 HD2 LYS 8 3.166 -9.310 -4.465
61 HD3 LYS 8 HD3 LYS 8 3.311 -7.611 -4.923
62 HE2 LYS 8 HE2 LYS 8 5.731 -9.161 -4.094
63 HE3 LYS 8 HE3 LYS 8 5.094 -9.325 -5.729
64 HZ1 LYS 8 HZ1 LYS 8 6.116 -7.454 -6.269
65 HZ2 LYS 8 HZ2 LYS 8 6.709 -7.286 -4.695
66 HZ3 LYS 8 HZ3 LYS 8 5.220 -6.601 -5.114
67 H VAL 9 H VAL 9 -0.005 -5.722 -1.041
68 HA VAL 9 HA VAL 9 0.881 -3.190 -2.238
69 HB VAL 9 HB VAL 9 -1.775 -4.405 -2.956
70 HG11 VAL 9 HG11 VAL 9 -1.718 -2.076 -3.352
71 HG12 VAL 9 HG12 VAL 9 -0.097 -2.158 -4.044
72 HG13 VAL 9 HG13 VAL 9 -1.467 -2.841 -4.920
73 HG21 VAL 9 HG21 VAL 9 0.907 -4.975 -4.079
74 HG22 VAL 9 HG22 VAL 9 -0.523 -6.003 -3.983
75 HG23 VAL 9 HG23 VAL 9 -0.419 -4.752 -5.221
76 H ALA 10 H ALA 10 0.655 -3.462 0.439
77 HA ALA 10 HA ALA 10 -1.444 -1.589 1.052
78 HB1 ALA 10 HB1 ALA 10 -1.521 -4.371 2.202
79 HB2 ALA 10 HB2 ALA 10 -2.395 -3.002 2.890
80 HB3 ALA 10 HB3 ALA 10 -2.769 -3.557 1.258
81 HB2 I4G 11 HB2 I4G 11 -0.304 -0.105 0.713
82 HB3 I4G 11 HB3 I4G 11 0.727 1.018 1.297
83 HG I4G 11 HG I4G 11 -0.854 1.981 2.767
84 HD13 I4G 11 HD13 I4G 11 -2.371 1.172 0.222
85 HD11 I4G 11 HD11 I4G 11 -2.867 2.453 1.344
86 HD12 I4G 11 HD12 I4G 11 -1.375 2.620 0.413
87 HD23 I4G 11 HD23 I4G 11 -1.634 -0.191 3.695
88 HD22 I4G 11 HD22 I4G 11 -2.566 -0.501 2.221
89 HD21 I4G 11 HD21 I4G 11 -3.006 0.848 3.285
90 HA2 I4G 11 HA2 I4G 11 1.878 -0.795 3.940
91 HA3 I4G 11 HA3 I4G 11 1.060 0.615 4.035
92 H HIS 12 H HIS 12 2.544 -0.652 1.234
93 HA HIS 12 HA HIS 12 4.626 1.415 1.374
94 HB2 HIS 12 HB2 HIS 12 5.974 0.080 0.027
95 HB3 HIS 12 HB3 HIS 12 5.117 -1.114 0.996
96 HD1 HIS 12 HD1 HIS 12 6.217 -0.815 -2.256
97 HD2 HIS 12 HD2 HIS 12 2.490 -1.698 -0.646
98 HE1 HIS 12 HE1 HIS 12 4.962 -2.009 -4.079
99 H VAL 13 H VAL 13 1.780 0.483 -0.311
100 HA VAL 13 HA VAL 13 2.136 1.647 -2.808
101 HB VAL 13 HB VAL 13 -0.383 1.471 -1.150
102 HG11 VAL 13 HG11 VAL 13 -1.314 2.797 -2.678
103 HG12 VAL 13 HG12 VAL 13 0.129 2.757 -3.694
104 HG13 VAL 13 HG13 VAL 13 -1.084 1.483 -3.832
105 HG21 VAL 13 HG21 VAL 13 -0.859 -0.520 -2.376
106 HG22 VAL 13 HG22 VAL 13 0.521 -0.264 -3.444
107 HG23 VAL 13 HG23 VAL 13 0.782 -0.666 -1.746
108 H VAL 14 H VAL 14 0.878 3.124 0.174
109 HA VAL 14 HA VAL 14 0.267 5.643 -0.760
110 HB VAL 14 HB VAL 14 1.490 4.941 1.912
111 HG11 VAL 14 HG11 VAL 14 1.705 7.212 1.939
112 HG12 VAL 14 HG12 VAL 14 0.382 7.463 0.798
113 HG13 VAL 14 HG13 VAL 14 0.033 7.073 2.482
114 HG21 VAL 14 HG21 VAL 14 -1.162 4.579 0.751
115 HG22 VAL 14 HG22 VAL 14 -0.440 3.840 2.181
116 HG23 VAL 14 HG23 VAL 14 -1.182 5.435 2.293
117 H GLY 15 H GLY 15 3.407 4.513 0.488
118 HA2 GLY 15 HA2 GLY 15 4.825 6.893 0.227
119 HA3 GLY 15 HA3 GLY 15 5.538 5.289 0.133
120 H ALA 16 H ALA 16 3.730 4.718 -2.229
121 HA ALA 16 HA ALA 16 5.544 5.814 -4.226
122 HB1 ALA 16 HB1 ALA 16 3.515 4.132 -5.350
123 HB2 ALA 16 HB2 ALA 16 5.257 3.862 -5.242
124 HB3 ALA 16 HB3 ALA 16 4.203 3.364 -3.918
125 H ILE 17 H ILE 17 2.015 5.516 -3.791
126 HA ILE 17 HA ILE 17 1.236 7.088 -5.946
127 HB ILE 17 HB ILE 17 -0.156 6.796 -3.281
128 HG12 ILE 17 HG12 ILE 17 -0.454 5.259 -5.871
129 HG13 ILE 17 HG13 ILE 17 0.258 4.647 -4.382
130 HG21 ILE 17 HG21 ILE 17 -2.190 7.409 -4.506
131 HG22 ILE 17 HG22 ILE 17 -0.999 8.709 -4.517
132 HG23 ILE 17 HG23 ILE 17 -1.222 7.706 -5.950
133 HD11 ILE 17 HD11 ILE 17 -1.911 4.908 -3.264
134 HD12 ILE 17 HD12 ILE 17 -2.611 5.452 -4.789
135 HD13 ILE 17 HD13 ILE 17 -1.984 3.809 -4.642
136 H ALA 18 H ALA 18 2.233 8.018 -2.706
137 HA ALA 18 HA ALA 18 1.493 10.766 -2.970
138 HB1 ALA 18 HB1 ALA 18 1.610 9.961 -0.767
139 HB2 ALA 18 HB2 ALA 18 3.216 9.274 -1.015
140 HB3 ALA 18 HB3 ALA 18 3.008 11.023 -0.943
141 H GLU 19 H GLU 19 4.046 8.908 -4.193
142 HA GLU 19 HA GLU 19 6.084 10.905 -4.209
143 HB2 GLU 19 HB2 GLU 19 6.225 8.294 -4.524
144 HB3 GLU 19 HB3 GLU 19 6.008 8.696 -6.222
145 HG2 GLU 19 HG2 GLU 19 8.356 8.469 -5.677
146 HG3 GLU 19 HG3 GLU 19 7.979 10.126 -6.145
147 H HIS 20 H HIS 20 3.848 9.673 -6.686
148 HA HIS 20 HA HIS 20 4.669 11.645 -8.610
149 HB2 HIS 20 HB2 HIS 20 3.277 10.562 -10.114
150 HB3 HIS 20 HB3 HIS 20 3.674 9.254 -9.002
151 HD1 HIS 20 HD1 HIS 20 0.856 11.473 -10.063
152 HD2 HIS 20 HD2 HIS 20 1.542 8.304 -7.465
153 HE1 HIS 20 HE1 HIS 20 -1.422 10.698 -9.331
154 H PHE 21 H PHE 21 2.305 11.432 -6.108
155 HA PHE 21 HA PHE 21 0.868 13.769 -7.138
156 HB2 PHE 21 HB2 PHE 21 -0.098 11.484 -6.004
157 HB3 PHE 21 HB3 PHE 21 -0.041 12.557 -4.610
158 HD1 PHE 21 HD2 PHE 21 -0.979 12.920 -8.207
159 HD2 PHE 21 HD1 PHE 21 -2.061 13.511 -4.134
160 HE1 PHE 21 HE2 PHE 21 -3.094 13.952 -8.923
161 HE2 PHE 21 HE1 PHE 21 -4.179 14.544 -4.843
162 HZ PHE 21 HZ PHE 21 -4.698 14.767 -7.240
163 HN1 NH2 22 HN1 NH2 22 3.755 13.731 -5.934
164 HN2 NH2 22 HN2 NH2 22 3.700 14.896 -4.576
Start of MODEL 4
1 H1 GLY 1 H1 GLY 1 -1.904 -17.136 2.748
2 H2 GLY 1 H2 GLY 1 -1.773 -18.100 1.437
3 H3 GLY 1 H3 GLY 1 -1.560 -16.636 1.399
4 HA2 GLY 1 HA2 GLY 1 -3.971 -18.003 1.037
5 HA3 GLY 1 HA3 GLY 1 -4.128 -17.038 2.498
6 H LEU 2 H LEU 2 -5.896 -16.199 0.960
7 HA LEU 2 HA LEU 2 -5.321 -14.620 -1.258
8 HB2 LEU 2 HB2 LEU 2 -7.580 -15.370 -0.082
9 HB3 LEU 2 HB3 LEU 2 -7.473 -13.747 0.593
10 HG LEU 2 HG LEU 2 -7.230 -14.089 -2.359
11 HD11 LEU 2 HD11 LEU 2 -9.449 -15.061 -0.887
12 HD12 LEU 2 HD12 LEU 2 -9.263 -14.920 -2.635
13 HD13 LEU 2 HD13 LEU 2 -9.945 -13.582 -1.710
14 HD21 LEU 2 HD21 LEU 2 -8.834 -11.980 -1.036
15 HD22 LEU 2 HD22 LEU 2 -7.762 -11.883 -2.432
16 HD23 LEU 2 HD23 LEU 2 -7.087 -11.929 -0.802
17 H PHE 3 H PHE 3 -6.007 -13.426 2.038
18 HA PHE 3 HA PHE 3 -5.120 -10.802 1.525
19 HB2 PHE 3 HB2 PHE 3 -6.529 -11.896 3.518
20 HB3 PHE 3 HB3 PHE 3 -4.951 -11.869 4.297
21 HD1 PHE 3 HD1 PHE 3 -3.713 -9.644 4.387
22 HD2 PHE 3 HD2 PHE 3 -7.848 -9.983 3.440
23 HE1 PHE 3 HE1 PHE 3 -4.035 -7.273 4.960
24 HE2 PHE 3 HE2 PHE 3 -8.177 -7.613 4.009
25 HZ PHE 3 HZ PHE 3 -6.269 -6.254 4.771
26 H GLY 4 H GLY 4 -3.457 -13.706 2.492
27 HA2 GLY 4 HA2 GLY 4 -1.146 -12.730 3.643
28 HA3 GLY 4 HA3 GLY 4 -1.213 -14.172 2.642
29 H VAL 5 H VAL 5 -2.115 -12.598 0.295
30 HA VAL 5 HA VAL 5 0.538 -11.656 -0.507
31 HB VAL 5 HB VAL 5 -1.895 -12.264 -2.193
32 HG11 VAL 5 HG11 VAL 5 0.152 -12.295 -3.924
33 HG12 VAL 5 HG12 VAL 5 -0.820 -10.859 -3.604
34 HG13 VAL 5 HG13 VAL 5 0.736 -11.067 -2.802
35 HG21 VAL 5 HG21 VAL 5 0.646 -13.819 -1.723
36 HG22 VAL 5 HG22 VAL 5 -0.980 -14.276 -1.215
37 HG23 VAL 5 HG23 VAL 5 -0.573 -14.221 -2.931
38 H LEU 6 H LEU 6 -2.670 -10.525 0.125
39 HA LEU 6 HA LEU 6 -2.761 -8.175 -1.347
40 HB2 LEU 6 HB2 LEU 6 -4.008 -9.151 1.149
41 HB3 LEU 6 HB3 LEU 6 -4.048 -7.410 0.879
42 HG LEU 6 HG LEU 6 -5.108 -9.438 -1.084
43 HD11 LEU 6 HD11 LEU 6 -6.586 -9.734 0.647
44 HD12 LEU 6 HD12 LEU 6 -7.332 -8.380 -0.203
45 HD13 LEU 6 HD13 LEU 6 -6.378 -8.090 1.252
46 HD21 LEU 6 HD21 LEU 6 -5.203 -7.691 -2.450
47 HD22 LEU 6 HD22 LEU 6 -4.623 -6.609 -1.183
48 HD23 LEU 6 HD23 LEU 6 -6.350 -6.939 -1.340
49 H ALA 7 H ALA 7 -0.892 -8.968 1.456
50 HA ALA 7 HA ALA 7 -0.355 -6.399 2.446
51 HB1 ALA 7 HB1 ALA 7 1.742 -8.516 2.533
52 HB2 ALA 7 HB2 ALA 7 1.225 -7.387 3.787
53 HB3 ALA 7 HB3 ALA 7 0.218 -8.777 3.383
54 H LYS 8 H LYS 8 0.879 -8.117 -0.311
55 HA LYS 8 HA LYS 8 3.267 -6.709 -0.733
56 HB2 LYS 8 HB2 LYS 8 2.022 -8.778 -1.976
57 HB3 LYS 8 HB3 LYS 8 1.751 -7.489 -3.142
58 HG2 LYS 8 HG2 LYS 8 4.111 -7.097 -3.341
59 HG3 LYS 8 HG3 LYS 8 4.449 -8.251 -2.048
60 HD2 LYS 8 HD2 LYS 8 3.560 -10.062 -3.412
61 HD3 LYS 8 HD3 LYS 8 3.161 -8.917 -4.695
62 HE2 LYS 8 HE2 LYS 8 5.420 -8.509 -5.182
63 HE3 LYS 8 HE3 LYS 8 5.963 -9.213 -3.660
64 HZ1 LYS 8 HZ1 LYS 8 4.674 -11.270 -4.841
65 HZ2 LYS 8 HZ2 LYS 8 6.347 -11.022 -4.884
66 HZ3 LYS 8 HZ3 LYS 8 5.380 -10.496 -6.170
67 H VAL 9 H VAL 9 0.011 -5.723 -1.035
68 HA VAL 9 HA VAL 9 0.896 -3.190 -2.231
69 HB VAL 9 HB VAL 9 -1.758 -4.409 -2.955
70 HG11 VAL 9 HG11 VAL 9 -0.079 -2.160 -4.039
71 HG12 VAL 9 HG12 VAL 9 -1.447 -2.845 -4.919
72 HG13 VAL 9 HG13 VAL 9 -1.701 -2.080 -3.349
73 HG21 VAL 9 HG21 VAL 9 -0.492 -6.006 -3.969
74 HG22 VAL 9 HG22 VAL 9 -0.406 -4.763 -5.217
75 HG23 VAL 9 HG23 VAL 9 0.928 -4.967 -4.083
76 H ALA 10 H ALA 10 0.664 -3.461 0.445
77 HA ALA 10 HA ALA 10 -1.438 -1.591 1.053
78 HB1 ALA 10 HB1 ALA 10 -2.588 -2.897 2.705
79 HB2 ALA 10 HB2 ALA 10 -2.599 -3.785 1.180
80 HB3 ALA 10 HB3 ALA 10 -1.485 -4.253 2.465
81 HB2 I4G 11 HB2 I4G 11 -0.300 -0.106 0.718
82 HB3 I4G 11 HB3 I4G 11 0.728 1.019 1.305
83 HG I4G 11 HG I4G 11 -0.859 1.976 2.774
84 HD13 I4G 11 HD13 I4G 11 -2.366 1.173 0.221
85 HD11 I4G 11 HD11 I4G 11 -2.867 2.452 1.344
86 HD12 I4G 11 HD12 I4G 11 -1.371 2.622 0.419
87 HD23 I4G 11 HD23 I4G 11 -1.642 -0.198 3.693
88 HD22 I4G 11 HD22 I4G 11 -2.567 -0.504 2.215
89 HD21 I4G 11 HD21 I4G 11 -3.012 0.841 3.280
90 HA2 I4G 11 HA2 I4G 11 1.874 -0.794 3.950
91 HA3 I4G 11 HA3 I4G 11 1.055 0.616 4.044
92 H HIS 12 H HIS 12 2.546 -0.649 1.244
93 HA HIS 12 HA HIS 12 4.625 1.420 1.390
94 HB2 HIS 12 HB2 HIS 12 5.979 0.087 0.048
95 HB3 HIS 12 HB3 HIS 12 5.120 -1.108 1.015
96 HD1 HIS 12 HD1 HIS 12 6.231 -0.813 -2.232
97 HD2 HIS 12 HD2 HIS 12 2.498 -1.694 -0.636
98 HE1 HIS 12 HE1 HIS 12 4.983 -2.008 -4.059
99 H VAL 13 H VAL 13 1.784 0.485 -0.301
100 HA VAL 13 HA VAL 13 2.147 1.649 -2.798
101 HB VAL 13 HB VAL 13 -0.377 1.468 -1.148
102 HG11 VAL 13 HG11 VAL 13 0.146 2.719 -3.719
103 HG12 VAL 13 HG12 VAL 13 -1.104 1.478 -3.808
104 HG13 VAL 13 HG13 VAL 13 -1.273 2.823 -2.680
105 HG21 VAL 13 HG21 VAL 13 -0.832 -0.541 -2.303
106 HG22 VAL 13 HG22 VAL 13 0.468 -0.262 -3.459
107 HG23 VAL 13 HG23 VAL 13 0.849 -0.656 -1.783
108 H VAL 14 H VAL 14 0.889 3.122 0.184
109 HA VAL 14 HA VAL 14 0.267 5.640 -0.748
110 HB VAL 14 HB VAL 14 1.500 4.942 1.920
111 HG11 VAL 14 HG11 VAL 14 0.437 7.463 0.791
112 HG12 VAL 14 HG12 VAL 14 -0.006 7.079 2.455
113 HG13 VAL 14 HG13 VAL 14 1.694 7.202 2.000
114 HG21 VAL 14 HG21 VAL 14 -1.168 5.424 2.316
115 HG22 VAL 14 HG22 VAL 14 -1.159 4.579 0.768
116 HG23 VAL 14 HG23 VAL 14 -0.425 3.831 2.186
117 H GLY 15 H GLY 15 3.414 4.523 0.498
118 HA2 GLY 15 HA2 GLY 15 4.823 6.907 0.228
119 HA3 GLY 15 HA3 GLY 15 5.541 5.305 0.139
120 H ALA 16 H ALA 16 3.734 4.718 -2.220
121 HA ALA 16 HA ALA 16 5.544 5.809 -4.222
122 HB1 ALA 16 HB1 ALA 16 3.553 3.578 -4.191
123 HB2 ALA 16 HB2 ALA 16 4.143 4.225 -5.722
124 HB3 ALA 16 HB3 ALA 16 5.277 3.536 -4.561
125 H ILE 17 H ILE 17 2.017 5.514 -3.781
126 HA ILE 17 HA ILE 17 1.234 7.079 -5.942
127 HB ILE 17 HB ILE 17 -0.154 6.798 -3.272
128 HG12 ILE 17 HG12 ILE 17 -0.457 5.249 -5.854
129 HG13 ILE 17 HG13 ILE 17 0.258 4.644 -4.364
130 HG21 ILE 17 HG21 ILE 17 -0.999 8.705 -4.517
131 HG22 ILE 17 HG22 ILE 17 -1.222 7.696 -5.945
132 HG23 ILE 17 HG23 ILE 17 -2.190 7.406 -4.501
133 HD11 ILE 17 HD11 ILE 17 -1.988 3.808 -4.619
134 HD12 ILE 17 HD12 ILE 17 -1.910 4.910 -3.244
135 HD13 ILE 17 HD13 ILE 17 -2.611 5.451 -4.769
136 H ALA 18 H ALA 18 2.237 8.021 -2.707
137 HA ALA 18 HA ALA 18 1.496 10.767 -2.979
138 HB1 ALA 18 HB1 ALA 18 1.926 9.358 -0.831
139 HB2 ALA 18 HB2 ALA 18 3.602 9.854 -1.069
140 HB3 ALA 18 HB3 ALA 18 2.344 11.071 -0.857
141 H GLU 19 H GLU 19 4.049 8.905 -4.200
142 HA GLU 19 HA GLU 19 6.084 10.905 -4.233
143 HB2 GLU 19 HB2 GLU 19 6.225 8.292 -4.540
144 HB3 GLU 19 HB3 GLU 19 6.000 8.688 -6.238
145 HG2 GLU 19 HG2 GLU 19 7.954 10.412 -5.660
146 HG3 GLU 19 HG3 GLU 19 8.313 9.163 -4.469
147 H HIS 20 H HIS 20 3.841 9.661 -6.699
148 HA HIS 20 HA HIS 20 4.650 11.630 -8.632
149 HB2 HIS 20 HB2 HIS 20 3.265 10.535 -10.129
150 HB3 HIS 20 HB3 HIS 20 3.661 9.233 -9.012
151 HD1 HIS 20 HD1 HIS 20 0.842 11.433 -10.097
152 HD2 HIS 20 HD2 HIS 20 1.530 8.299 -7.457
153 HE1 HIS 20 HE1 HIS 20 -1.436 10.663 -9.360
154 H PHE 21 H PHE 21 2.297 11.415 -6.120
155 HA PHE 21 HA PHE 21 0.873 13.768 -7.147
156 HB2 PHE 21 HB2 PHE 21 -0.117 11.459 -6.060
157 HB3 PHE 21 HB3 PHE 21 -0.108 12.531 -4.665
158 HD1 PHE 21 HD2 PHE 21 -1.016 12.726 -8.283
159 HD2 PHE 21 HD1 PHE 21 -2.060 13.648 -4.261
160 HE1 PHE 21 HE2 PHE 21 -3.110 13.752 -9.065
161 HE2 PHE 21 HE1 PHE 21 -4.157 14.675 -5.037
162 HZ PHE 21 HZ PHE 21 -4.683 14.730 -7.441
163 HN1 NH2 22 HN1 NH2 22 3.733 13.701 -5.896
164 HN2 NH2 22 HN2 NH2 22 3.658 14.833 -4.513
Start of MODEL 5
1 H1 GLY 1 H1 GLY 1 -3.638 -17.874 3.324
2 H2 GLY 1 H2 GLY 1 -4.221 -16.389 2.972
3 H3 GLY 1 H3 GLY 1 -4.990 -17.637 2.773
4 HA2 GLY 1 HA2 GLY 1 -2.418 -17.468 1.392
5 HA3 GLY 1 HA3 GLY 1 -3.857 -18.292 0.810
6 H LEU 2 H LEU 2 -5.676 -16.125 1.201
7 HA LEU 2 HA LEU 2 -5.183 -14.694 -1.227
8 HB2 LEU 2 HB2 LEU 2 -7.395 -15.183 0.537
9 HB3 LEU 2 HB3 LEU 2 -7.294 -13.464 0.160
10 HG LEU 2 HG LEU 2 -7.093 -14.428 -2.317
11 HD11 LEU 2 HD11 LEU 2 -7.903 -16.694 -0.725
12 HD12 LEU 2 HD12 LEU 2 -7.461 -16.614 -2.430
13 HD13 LEU 2 HD13 LEU 2 -9.122 -16.290 -1.935
14 HD21 LEU 2 HD21 LEU 2 -9.843 -14.411 -1.191
15 HD22 LEU 2 HD22 LEU 2 -9.205 -13.625 -2.635
16 HD23 LEU 2 HD23 LEU 2 -8.870 -12.947 -1.041
17 H PHE 3 H PHE 3 -6.007 -13.391 1.988
18 HA PHE 3 HA PHE 3 -5.058 -10.814 1.497
19 HB2 PHE 3 HB2 PHE 3 -6.198 -12.224 3.681
20 HB3 PHE 3 HB3 PHE 3 -4.743 -11.428 4.275
21 HD1 PHE 3 HD2 PHE 3 -7.997 -10.876 2.629
22 HD2 PHE 3 HD1 PHE 3 -4.663 -9.088 4.579
23 HE1 PHE 3 HE2 PHE 3 -9.228 -8.751 2.779
24 HE2 PHE 3 HE1 PHE 3 -5.889 -6.961 4.734
25 HZ PHE 3 HZ PHE 3 -8.175 -6.790 3.831
26 H GLY 4 H GLY 4 -3.385 -13.708 2.465
27 HA2 GLY 4 HA2 GLY 4 -1.079 -12.724 3.619
28 HA3 GLY 4 HA3 GLY 4 -1.139 -14.167 2.617
29 H VAL 5 H VAL 5 -2.048 -12.591 0.271
30 HA VAL 5 HA VAL 5 0.602 -11.641 -0.530
31 HB VAL 5 HB VAL 5 -1.831 -12.254 -2.215
32 HG11 VAL 5 HG11 VAL 5 0.172 -12.269 -3.971
33 HG12 VAL 5 HG12 VAL 5 -0.746 -10.809 -3.595
34 HG13 VAL 5 HG13 VAL 5 0.822 -11.087 -2.835
35 HG21 VAL 5 HG21 VAL 5 0.691 -13.805 -1.663
36 HG22 VAL 5 HG22 VAL 5 -0.969 -14.284 -1.308
37 HG23 VAL 5 HG23 VAL 5 -0.419 -14.180 -2.980
38 H LEU 6 H LEU 6 -2.612 -10.520 0.099
39 HA LEU 6 HA LEU 6 -2.705 -8.167 -1.368
40 HB2 LEU 6 HB2 LEU 6 -3.953 -9.148 1.128
41 HB3 LEU 6 HB3 LEU 6 -4.003 -7.409 0.850
42 HG LEU 6 HG LEU 6 -5.018 -9.415 -1.152
43 HD11 LEU 6 HD11 LEU 6 -6.237 -8.423 1.331
44 HD12 LEU 6 HD12 LEU 6 -6.599 -9.863 0.380
45 HD13 LEU 6 HD13 LEU 6 -7.248 -8.299 -0.109
46 HD21 LEU 6 HD21 LEU 6 -4.851 -7.491 -2.344
47 HD22 LEU 6 HD22 LEU 6 -4.954 -6.462 -0.914
48 HD23 LEU 6 HD23 LEU 6 -6.414 -7.189 -1.586
49 H ALA 7 H ALA 7 -0.840 -8.962 1.436
50 HA ALA 7 HA ALA 7 -0.313 -6.394 2.434
51 HB1 ALA 7 HB1 ALA 7 0.214 -8.593 3.543
52 HB2 ALA 7 HB2 ALA 7 1.624 -8.697 2.487
53 HB3 ALA 7 HB3 ALA 7 1.481 -7.370 3.639
54 H LYS 8 H LYS 8 0.932 -8.101 -0.324
55 HA LYS 8 HA LYS 8 3.317 -6.685 -0.735
56 HB2 LYS 8 HB2 LYS 8 2.082 -8.758 -1.986
57 HB3 LYS 8 HB3 LYS 8 1.815 -7.468 -3.151
58 HG2 LYS 8 HG2 LYS 8 4.151 -7.095 -3.396
59 HG3 LYS 8 HG3 LYS 8 4.522 -8.157 -2.036
60 HD2 LYS 8 HD2 LYS 8 3.017 -9.245 -4.373
61 HD3 LYS 8 HD3 LYS 8 4.762 -9.016 -4.500
62 HE2 LYS 8 HE2 LYS 8 3.446 -10.539 -2.260
63 HE3 LYS 8 HE3 LYS 8 4.011 -11.300 -3.745
64 HZ1 LYS 8 HZ1 LYS 8 5.834 -11.556 -2.432
65 HZ2 LYS 8 HZ2 LYS 8 5.558 -10.141 -1.548
66 HZ3 LYS 8 HZ3 LYS 8 6.207 -10.049 -3.108
67 H VAL 9 H VAL 9 0.059 -5.709 -1.042
68 HA VAL 9 HA VAL 9 0.937 -3.174 -2.237
69 HB VAL 9 HB VAL 9 -1.711 -4.403 -2.965
70 HG11 VAL 9 HG11 VAL 9 -0.039 -2.148 -4.048
71 HG12 VAL 9 HG12 VAL 9 -1.405 -2.836 -4.928
72 HG13 VAL 9 HG13 VAL 9 -1.660 -2.072 -3.359
73 HG21 VAL 9 HG21 VAL 9 -0.407 -4.789 -5.218
74 HG22 VAL 9 HG22 VAL 9 0.980 -4.905 -4.135
75 HG23 VAL 9 HG23 VAL 9 -0.387 -6.001 -3.937
76 H ALA 10 H ALA 10 0.704 -3.445 0.439
77 HA ALA 10 HA ALA 10 -1.406 -1.582 1.044
78 HB1 ALA 10 HB1 ALA 10 -2.308 -4.049 1.179
79 HB2 ALA 10 HB2 ALA 10 -1.494 -4.024 2.744
80 HB3 ALA 10 HB3 ALA 10 -2.759 -2.848 2.390
81 HB2 I4G 11 HB2 I4G 11 -0.272 -0.094 0.710
82 HB3 I4G 11 HB3 I4G 11 0.750 1.035 1.301
83 HG I4G 11 HG I4G 11 -0.844 1.989 2.763
84 HD13 I4G 11 HD13 I4G 11 -2.347 1.171 0.212
85 HD11 I4G 11 HD11 I4G 11 -2.853 2.450 1.333
86 HD12 I4G 11 HD12 I4G 11 -1.359 2.626 0.407
87 HD23 I4G 11 HD23 I4G 11 -1.614 -0.188 3.688
88 HD22 I4G 11 HD22 I4G 11 -2.539 -0.502 2.210
89 HD21 I4G 11 HD21 I4G 11 -2.990 0.843 3.272
90 HA2 I4G 11 HA2 I4G 11 1.899 -0.774 3.946
91 HA3 I4G 11 HA3 I4G 11 1.075 0.633 4.038
92 H HIS 12 H HIS 12 2.573 -0.626 1.241
93 HA HIS 12 HA HIS 12 4.646 1.449 1.389
94 HB2 HIS 12 HB2 HIS 12 6.007 0.120 0.050
95 HB3 HIS 12 HB3 HIS 12 5.150 -1.078 1.016
96 HD1 HIS 12 HD1 HIS 12 6.267 -0.783 -2.228
97 HD2 HIS 12 HD2 HIS 12 2.531 -1.670 -0.639
98 HE1 HIS 12 HE1 HIS 12 5.027 -1.984 -4.057
99 H VAL 13 H VAL 13 1.809 0.505 -0.305
100 HA VAL 13 HA VAL 13 2.173 1.667 -2.802
101 HB VAL 13 HB VAL 13 -0.353 1.481 -1.157
102 HG11 VAL 13 HG11 VAL 13 -1.039 1.480 -3.844
103 HG12 VAL 13 HG12 VAL 13 -1.281 2.798 -2.697
104 HG13 VAL 13 HG13 VAL 13 0.167 2.759 -3.704
105 HG21 VAL 13 HG21 VAL 13 0.456 -0.248 -3.476
106 HG22 VAL 13 HG22 VAL 13 0.918 -0.633 -1.818
107 HG23 VAL 13 HG23 VAL 13 -0.787 -0.546 -2.261
108 H VAL 14 H VAL 14 0.897 3.138 0.174
109 HA VAL 14 HA VAL 14 0.273 5.653 -0.763
110 HB VAL 14 HB VAL 14 1.494 4.960 1.912
111 HG11 VAL 14 HG11 VAL 14 0.103 7.071 2.541
112 HG12 VAL 14 HG12 VAL 14 1.710 7.257 1.836
113 HG13 VAL 14 HG13 VAL 14 0.275 7.464 0.830
114 HG21 VAL 14 HG21 VAL 14 -0.429 3.846 2.174
115 HG22 VAL 14 HG22 VAL 14 -1.181 5.437 2.291
116 HG23 VAL 14 HG23 VAL 14 -1.156 4.585 0.748
117 H GLY 15 H GLY 15 3.417 4.543 0.494
118 HA2 GLY 15 HA2 GLY 15 4.820 6.931 0.234
119 HA3 GLY 15 HA3 GLY 15 5.543 5.332 0.144
120 H ALA 16 H ALA 16 3.743 4.749 -2.222
121 HA ALA 16 HA ALA 16 5.557 5.851 -4.217
122 HB1 ALA 16 HB1 ALA 16 5.098 3.448 -4.236
123 HB2 ALA 16 HB2 ALA 16 3.386 3.777 -4.509
124 HB3 ALA 16 HB3 ALA 16 4.575 4.219 -5.735
125 H ILE 17 H ILE 17 2.029 5.538 -3.781
126 HA ILE 17 HA ILE 17 1.240 7.096 -5.943
127 HB ILE 17 HB ILE 17 -0.146 6.811 -3.275
128 HG12 ILE 17 HG12 ILE 17 -0.443 5.260 -5.857
129 HG13 ILE 17 HG13 ILE 17 0.275 4.659 -4.367
130 HG21 ILE 17 HG21 ILE 17 -0.999 8.715 -4.518
131 HG22 ILE 17 HG22 ILE 17 -1.217 7.706 -5.947
132 HG23 ILE 17 HG23 ILE 17 -2.185 7.410 -4.504
133 HD11 ILE 17 HD11 ILE 17 -1.895 4.921 -3.247
134 HD12 ILE 17 HD12 ILE 17 -2.598 5.447 -4.776
135 HD13 ILE 17 HD13 ILE 17 -1.963 3.810 -4.614
136 H ALA 18 H ALA 18 2.238 8.048 -2.709
137 HA ALA 18 HA ALA 18 1.483 10.789 -2.981
138 HB1 ALA 18 HB1 ALA 18 3.055 11.045 -0.974
139 HB2 ALA 18 HB2 ALA 18 1.620 10.039 -0.774
140 HB3 ALA 18 HB3 ALA 18 3.195 9.288 -1.029
141 H GLU 19 H GLU 19 4.048 8.940 -4.205
142 HA GLU 19 HA GLU 19 6.067 10.953 -4.249
143 HB2 GLU 19 HB2 GLU 19 6.227 8.343 -4.553
144 HB3 GLU 19 HB3 GLU 19 5.989 8.732 -6.250
145 HG2 GLU 19 HG2 GLU 19 7.988 10.452 -5.142
146 HG3 GLU 19 HG3 GLU 19 8.380 8.771 -4.788
147 H HIS 20 H HIS 20 3.829 9.691 -6.711
148 HA HIS 20 HA HIS 20 4.617 11.669 -8.642
149 HB2 HIS 20 HB2 HIS 20 3.248 10.559 -10.140
150 HB3 HIS 20 HB3 HIS 20 3.650 9.261 -9.019
151 HD1 HIS 20 HD1 HIS 20 0.818 11.421 -10.140
152 HD2 HIS 20 HD2 HIS 20 1.519 8.335 -7.449
153 HE1 HIS 20 HE1 HIS 20 -1.456 10.641 -9.404
154 H PHE 21 H PHE 21 2.270 11.430 -6.128
155 HA PHE 21 HA PHE 21 0.859 13.801 -7.139
156 HB2 PHE 21 HB2 PHE 21 -0.178 11.460 -6.175
157 HB3 PHE 21 HB3 PHE 21 -0.211 12.478 -4.739
158 HD1 PHE 21 HD1 PHE 21 -0.997 12.815 -8.375
159 HD2 PHE 21 HD2 PHE 21 -2.169 13.592 -4.358
160 HE1 PHE 21 HE1 PHE 21 -3.059 13.885 -9.187
161 HE2 PHE 21 HE2 PHE 21 -4.234 14.662 -5.164
162 HZ PHE 21 HZ PHE 21 -4.681 14.809 -7.581
163 HN1 NH2 22 HN1 NH2 22 3.673 13.678 -5.796
164 HN2 NH2 22 HN2 NH2 22 3.554 14.759 -4.374
Start of MODEL 6
1 H1 GLY 1 H1 GLY 1 -2.563 -17.899 3.046
2 H2 GLY 1 H2 GLY 1 -2.030 -16.583 2.237
3 H3 GLY 1 H3 GLY 1 -2.931 -16.513 3.409
4 HA2 GLY 1 HA2 GLY 1 -3.816 -18.043 1.063
5 HA3 GLY 1 HA3 GLY 1 -4.866 -17.276 2.244
6 H LEU 2 H LEU 2 -6.079 -16.119 0.780
7 HA LEU 2 HA LEU 2 -5.118 -14.648 -1.382
8 HB2 LEU 2 HB2 LEU 2 -7.246 -13.336 -1.137
9 HB3 LEU 2 HB3 LEU 2 -7.431 -15.083 -1.270
10 HG LEU 2 HG LEU 2 -7.376 -14.715 1.442
11 HD11 LEU 2 HD11 LEU 2 -9.365 -12.693 0.811
12 HD12 LEU 2 HD12 LEU 2 -7.719 -12.162 0.467
13 HD13 LEU 2 HD13 LEU 2 -8.143 -12.725 2.083
14 HD21 LEU 2 HD21 LEU 2 -9.701 -14.810 -0.472
15 HD22 LEU 2 HD22 LEU 2 -9.854 -15.006 1.274
16 HD23 LEU 2 HD23 LEU 2 -8.914 -16.167 0.336
17 H PHE 3 H PHE 3 -5.866 -13.548 1.920
18 HA PHE 3 HA PHE 3 -5.020 -10.880 1.505
19 HB2 PHE 3 HB2 PHE 3 -6.224 -12.332 3.580
20 HB3 PHE 3 HB3 PHE 3 -4.713 -11.733 4.253
21 HD1 PHE 3 HD1 PHE 3 -4.280 -9.321 4.380
22 HD2 PHE 3 HD2 PHE 3 -8.019 -10.859 3.049
23 HE1 PHE 3 HE1 PHE 3 -5.309 -7.113 4.728
24 HE2 PHE 3 HE2 PHE 3 -9.053 -8.653 3.394
25 HZ PHE 3 HZ PHE 3 -7.697 -6.776 4.233
26 H GLY 4 H GLY 4 -3.340 -13.817 2.329
27 HA2 GLY 4 HA2 GLY 4 -1.032 -12.891 3.522
28 HA3 GLY 4 HA3 GLY 4 -1.092 -14.278 2.446
29 H VAL 5 H VAL 5 -1.982 -12.647 0.164
30 HA VAL 5 HA VAL 5 0.653 -11.599 -0.563
31 HB VAL 5 HB VAL 5 -1.737 -12.222 -2.306
32 HG11 VAL 5 HG11 VAL 5 -0.616 -10.619 -3.526
33 HG12 VAL 5 HG12 VAL 5 0.962 -11.080 -2.884
34 HG13 VAL 5 HG13 VAL 5 0.166 -12.096 -4.085
35 HG21 VAL 5 HG21 VAL 5 0.000 -13.998 -3.123
36 HG22 VAL 5 HG22 VAL 5 0.699 -13.761 -1.521
37 HG23 VAL 5 HG23 VAL 5 -0.971 -14.304 -1.682
38 H LEU 6 H LEU 6 -2.577 -10.579 0.099
39 HA LEU 6 HA LEU 6 -2.784 -8.208 -1.306
40 HB2 LEU 6 HB2 LEU 6 -3.890 -9.249 1.231
41 HB3 LEU 6 HB3 LEU 6 -3.996 -7.508 0.980
42 HG LEU 6 HG LEU 6 -5.111 -9.593 -0.893
43 HD11 LEU 6 HD11 LEU 6 -7.177 -8.086 0.194
44 HD12 LEU 6 HD12 LEU 6 -6.138 -8.479 1.563
45 HD13 LEU 6 HD13 LEU 6 -6.787 -9.769 0.552
46 HD21 LEU 6 HD21 LEU 6 -4.809 -7.777 -2.253
47 HD22 LEU 6 HD22 LEU 6 -4.956 -6.621 -0.929
48 HD23 LEU 6 HD23 LEU 6 -6.396 -7.404 -1.581
49 H ALA 7 H ALA 7 -0.820 -8.969 1.455
50 HA ALA 7 HA ALA 7 -0.300 -6.406 2.440
51 HB1 ALA 7 HB1 ALA 7 0.846 -9.057 2.718
52 HB2 ALA 7 HB2 ALA 7 2.069 -7.787 2.794
53 HB3 ALA 7 HB3 ALA 7 0.697 -7.758 3.903
54 H LYS 8 H LYS 8 0.852 -8.031 -0.403
55 HA LYS 8 HA LYS 8 3.187 -6.569 -0.905
56 HB2 LYS 8 HB2 LYS 8 1.919 -8.622 -2.146
57 HB3 LYS 8 HB3 LYS 8 1.550 -7.306 -3.253
58 HG2 LYS 8 HG2 LYS 8 4.205 -6.921 -2.859
59 HG3 LYS 8 HG3 LYS 8 4.086 -8.678 -2.727
60 HD2 LYS 8 HD2 LYS 8 2.640 -7.386 -4.970
61 HD3 LYS 8 HD3 LYS 8 4.402 -7.428 -5.063
62 HE2 LYS 8 HE2 LYS 8 2.869 -9.904 -4.379
63 HE3 LYS 8 HE3 LYS 8 3.008 -9.385 -6.058
64 HZ1 LYS 8 HZ1 LYS 8 5.327 -9.608 -6.000
65 HZ2 LYS 8 HZ2 LYS 8 4.743 -10.994 -5.227
66 HZ3 LYS 8 HZ3 LYS 8 5.375 -9.720 -4.312
67 H VAL 9 H VAL 9 -0.105 -5.638 -1.040
68 HA VAL 9 HA VAL 9 0.682 -3.068 -2.236
69 HB VAL 9 HB VAL 9 -2.027 -4.280 -2.727
70 HG11 VAL 9 HG11 VAL 9 -2.022 -1.957 -3.117
71 HG12 VAL 9 HG12 VAL 9 -0.452 -2.013 -3.919
72 HG13 VAL 9 HG13 VAL 9 -1.872 -2.700 -4.709
73 HG21 VAL 9 HG21 VAL 9 -1.117 -4.825 -5.027
74 HG22 VAL 9 HG22 VAL 9 0.493 -4.618 -4.338
75 HG23 VAL 9 HG23 VAL 9 -0.579 -5.870 -3.711
76 H ALA 10 H ALA 10 0.676 -3.418 0.461
77 HA ALA 10 HA ALA 10 -1.349 -1.537 1.278
78 HB1 ALA 10 HB1 ALA 10 -2.582 -3.629 1.495
79 HB2 ALA 10 HB2 ALA 10 -1.308 -4.281 2.528
80 HB3 ALA 10 HB3 ALA 10 -2.272 -2.909 3.076
81 HB2 I4G 11 HB2 I4G 11 -0.163 -0.059 0.829
82 HB3 I4G 11 HB3 I4G 11 0.871 1.070 1.400
83 HG I4G 11 HG I4G 11 -1.712 1.552 1.478
84 HD13 I4G 11 HD13 I4G 11 -1.219 -0.085 4.030
85 HD11 I4G 11 HD11 I4G 11 -2.675 0.867 3.692
86 HD12 I4G 11 HD12 I4G 11 -2.291 -0.543 2.700
87 HD23 I4G 11 HD23 I4G 11 0.025 3.098 2.362
88 HD22 I4G 11 HD22 I4G 11 0.143 2.137 3.845
89 HD21 I4G 11 HD21 I4G 11 -1.355 3.004 3.464
90 HA2 I4G 11 HA2 I4G 11 2.225 -0.819 3.873
91 HA3 I4G 11 HA3 I4G 11 1.426 0.592 4.071
92 H HIS 12 H HIS 12 2.662 -0.622 1.128
93 HA HIS 12 HA HIS 12 4.745 1.449 1.127
94 HB2 HIS 12 HB2 HIS 12 6.004 0.127 -0.300
95 HB3 HIS 12 HB3 HIS 12 5.188 -1.092 0.676
96 HD1 HIS 12 HD1 HIS 12 6.113 -0.686 -2.622
97 HD2 HIS 12 HD2 HIS 12 2.479 -1.619 -0.839
98 HE1 HIS 12 HE1 HIS 12 4.756 -1.817 -4.413
99 H VAL 13 H VAL 13 1.766 0.545 -0.308
100 HA VAL 13 HA VAL 13 1.902 1.698 -2.828
101 HB VAL 13 HB VAL 13 -0.446 1.565 -0.934
102 HG11 VAL 13 HG11 VAL 13 -0.277 2.378 -3.822
103 HG12 VAL 13 HG12 VAL 13 -1.770 1.768 -3.102
104 HG13 VAL 13 HG13 VAL 13 -1.025 3.240 -2.477
105 HG21 VAL 13 HG21 VAL 13 0.558 -0.598 -1.602
106 HG22 VAL 13 HG22 VAL 13 -1.094 -0.392 -2.188
107 HG23 VAL 13 HG23 VAL 13 0.267 -0.178 -3.291
108 H VAL 14 H VAL 14 0.429 3.244 0.033
109 HA VAL 14 HA VAL 14 0.152 5.786 -0.994
110 HB VAL 14 HB VAL 14 0.788 5.006 1.855
111 HG11 VAL 14 HG11 VAL 14 -0.070 7.617 0.644
112 HG12 VAL 14 HG12 VAL 14 -0.392 7.223 2.334
113 HG13 VAL 14 HG13 VAL 14 1.270 7.297 1.745
114 HG21 VAL 14 HG21 VAL 14 -1.302 4.098 0.669
115 HG22 VAL 14 HG22 VAL 14 -1.514 4.883 2.234
116 HG23 VAL 14 HG23 VAL 14 -1.899 5.756 0.751
117 H GLY 15 H GLY 15 3.029 4.214 0.211
118 HA2 GLY 15 HA2 GLY 15 4.632 6.513 0.575
119 HA3 GLY 15 HA3 GLY 15 5.224 4.880 0.306
120 H ALA 16 H ALA 16 3.855 4.607 -2.262
121 HA ALA 16 HA ALA 16 5.797 6.088 -3.867
122 HB1 ALA 16 HB1 ALA 16 5.247 3.510 -3.973
123 HB2 ALA 16 HB2 ALA 16 3.981 4.064 -5.070
124 HB3 ALA 16 HB3 ALA 16 5.671 4.420 -5.424
125 H ILE 17 H ILE 17 2.309 5.535 -3.628
126 HA ILE 17 HA ILE 17 1.477 6.984 -5.851
127 HB ILE 17 HB ILE 17 0.070 6.710 -3.192
128 HG12 ILE 17 HG12 ILE 17 0.641 4.561 -4.289
129 HG13 ILE 17 HG13 ILE 17 -1.096 4.837 -4.219
130 HG21 ILE 17 HG21 ILE 17 -1.872 6.919 -5.097
131 HG22 ILE 17 HG22 ILE 17 -1.316 8.236 -4.065
132 HG23 ILE 17 HG23 ILE 17 -0.655 8.049 -5.689
133 HD11 ILE 17 HD11 ILE 17 -0.024 5.875 -6.668
134 HD12 ILE 17 HD12 ILE 17 0.436 4.186 -6.453
135 HD13 ILE 17 HD13 ILE 17 -1.265 4.649 -6.413
136 H ALA 18 H ALA 18 2.359 8.079 -2.626
137 HA ALA 18 HA ALA 18 1.494 10.774 -3.005
138 HB1 ALA 18 HB1 ALA 18 1.828 9.577 -0.791
139 HB2 ALA 18 HB2 ALA 18 3.553 9.869 -1.015
140 HB3 ALA 18 HB3 ALA 18 2.438 11.229 -0.899
141 H GLU 19 H GLU 19 4.096 9.022 -4.209
142 HA GLU 19 HA GLU 19 6.049 11.122 -4.241
143 HB2 GLU 19 HB2 GLU 19 6.353 8.518 -4.429
144 HB3 GLU 19 HB3 GLU 19 6.121 8.815 -6.146
145 HG2 GLU 19 HG2 GLU 19 8.004 10.698 -5.135
146 HG3 GLU 19 HG3 GLU 19 8.479 9.077 -4.627
147 H HIS 20 H HIS 20 3.961 9.637 -6.713
148 HA HIS 20 HA HIS 20 4.690 11.568 -8.706
149 HB2 HIS 20 HB2 HIS 20 3.404 10.332 -10.177
150 HB3 HIS 20 HB3 HIS 20 3.817 9.105 -8.982
151 HD1 HIS 20 HD1 HIS 20 0.954 11.023 -10.370
152 HD2 HIS 20 HD2 HIS 20 1.670 8.280 -7.334
153 HE1 HIS 20 HE1 HIS 20 -1.316 10.230 -9.633
154 H PHE 21 H PHE 21 2.290 11.336 -6.235
155 HA PHE 21 HA PHE 21 0.970 13.746 -7.299
156 HB2 PHE 21 HB2 PHE 21 -0.218 11.328 -6.731
157 HB3 PHE 21 HB3 PHE 21 -0.514 12.250 -5.261
158 HD1 PHE 21 HD1 PHE 21 -0.902 14.954 -6.247
159 HD2 PHE 21 HD2 PHE 21 -2.219 11.248 -7.875
160 HE1 PHE 21 HE1 PHE 21 -2.777 16.106 -7.345
161 HE2 PHE 21 HE2 PHE 21 -4.095 12.395 -8.978
162 HZ PHE 21 HZ PHE 21 -4.377 14.827 -8.715
163 HN1 NH2 22 HN1 NH2 22 3.504 13.845 -5.788
164 HN2 NH2 22 HN2 NH2 22 3.171 14.622 -4.210
Start of MODEL 7
1 H1 GLY 1 H1 GLY 1 -3.655 -16.469 3.084
2 H2 GLY 1 H2 GLY 1 -5.105 -17.161 2.786
3 H3 GLY 1 H3 GLY 1 -3.939 -17.903 3.313
4 HA2 GLY 1 HA2 GLY 1 -2.672 -17.719 1.231
5 HA3 GLY 1 HA3 GLY 1 -4.288 -18.307 0.868
6 H LEU 2 H LEU 2 -5.790 -16.016 1.122
7 HA LEU 2 HA LEU 2 -5.091 -14.653 -1.318
8 HB2 LEU 2 HB2 LEU 2 -7.445 -15.327 -0.225
9 HB3 LEU 2 HB3 LEU 2 -7.321 -13.668 0.356
10 HG LEU 2 HG LEU 2 -6.907 -14.181 -2.548
11 HD11 LEU 2 HD11 LEU 2 -8.969 -15.458 -1.701
12 HD12 LEU 2 HD12 LEU 2 -9.169 -14.357 -3.063
13 HD13 LEU 2 HD13 LEU 2 -9.675 -13.862 -1.448
14 HD21 LEU 2 HD21 LEU 2 -6.662 -11.953 -2.157
15 HD22 LEU 2 HD22 LEU 2 -7.741 -11.962 -0.762
16 HD23 LEU 2 HD23 LEU 2 -8.409 -11.998 -2.394
17 H PHE 3 H PHE 3 -5.913 -13.485 1.954
18 HA PHE 3 HA PHE 3 -5.000 -10.866 1.554
19 HB2 PHE 3 HB2 PHE 3 -6.132 -12.366 3.678
20 HB3 PHE 3 HB3 PHE 3 -4.671 -11.606 4.301
21 HD1 PHE 3 HD2 PHE 3 -8.004 -11.030 2.909
22 HD2 PHE 3 HD1 PHE 3 -4.499 -9.214 4.502
23 HE1 PHE 3 HE2 PHE 3 -9.223 -8.908 3.163
24 HE2 PHE 3 HE1 PHE 3 -5.714 -7.088 4.759
25 HZ PHE 3 HZ PHE 3 -8.077 -6.934 4.088
26 H GLY 4 H GLY 4 -3.318 -13.798 2.384
27 HA2 GLY 4 HA2 GLY 4 -1.008 -12.868 3.572
28 HA3 GLY 4 HA3 GLY 4 -1.070 -14.259 2.499
29 H VAL 5 H VAL 5 -1.964 -12.633 0.214
30 HA VAL 5 HA VAL 5 0.668 -11.589 -0.522
31 HB VAL 5 HB VAL 5 -1.725 -12.215 -2.258
32 HG11 VAL 5 HG11 VAL 5 -0.684 -10.754 -3.629
33 HG12 VAL 5 HG12 VAL 5 0.862 -10.899 -2.790
34 HG13 VAL 5 HG13 VAL 5 0.367 -12.132 -3.950
35 HG21 VAL 5 HG21 VAL 5 0.862 -13.706 -1.824
36 HG22 VAL 5 HG22 VAL 5 -0.746 -14.223 -1.318
37 HG23 VAL 5 HG23 VAL 5 -0.355 -14.114 -3.033
38 H LEU 6 H LEU 6 -2.560 -10.566 0.143
39 HA LEU 6 HA LEU 6 -2.768 -8.197 -1.268
40 HB2 LEU 6 HB2 LEU 6 -3.871 -9.232 1.274
41 HB3 LEU 6 HB3 LEU 6 -3.977 -7.491 1.019
42 HG LEU 6 HG LEU 6 -5.065 -9.547 -0.903
43 HD11 LEU 6 HD11 LEU 6 -7.238 -8.354 0.165
44 HD12 LEU 6 HD12 LEU 6 -6.175 -8.406 1.571
45 HD13 LEU 6 HD13 LEU 6 -6.583 -9.895 0.719
46 HD21 LEU 6 HD21 LEU 6 -4.711 -7.558 -2.080
47 HD22 LEU 6 HD22 LEU 6 -5.194 -6.553 -0.713
48 HD23 LEU 6 HD23 LEU 6 -6.405 -7.480 -1.599
49 H ALA 7 H ALA 7 -0.801 -8.954 1.493
50 HA ALA 7 HA ALA 7 -0.279 -6.388 2.472
51 HB1 ALA 7 HB1 ALA 7 1.965 -8.307 2.484
52 HB2 ALA 7 HB2 ALA 7 1.250 -7.383 3.806
53 HB3 ALA 7 HB3 ALA 7 0.462 -8.851 3.230
54 H LYS 8 H LYS 8 0.868 -8.020 -0.369
55 HA LYS 8 HA LYS 8 3.204 -6.561 -0.876
56 HB2 LYS 8 HB2 LYS 8 1.935 -8.617 -2.110
57 HB3 LYS 8 HB3 LYS 8 1.566 -7.303 -3.221
58 HG2 LYS 8 HG2 LYS 8 4.238 -6.945 -2.787
59 HG3 LYS 8 HG3 LYS 8 4.080 -8.703 -2.731
60 HD2 LYS 8 HD2 LYS 8 3.072 -8.744 -4.904
61 HD3 LYS 8 HD3 LYS 8 2.967 -6.983 -4.944
62 HE2 LYS 8 HE2 LYS 8 5.620 -7.334 -4.517
63 HE3 LYS 8 HE3 LYS 8 5.248 -8.762 -5.481
64 HZ1 LYS 8 HZ1 LYS 8 4.440 -7.422 -7.233
65 HZ2 LYS 8 HZ2 LYS 8 5.918 -6.744 -6.768
66 HZ3 LYS 8 HZ3 LYS 8 4.467 -6.019 -6.288
67 H VAL 9 H VAL 9 -0.086 -5.629 -1.009
68 HA VAL 9 HA VAL 9 0.700 -3.062 -2.214
69 HB VAL 9 HB VAL 9 -2.010 -4.275 -2.698
70 HG11 VAL 9 HG11 VAL 9 -0.435 -2.011 -3.895
71 HG12 VAL 9 HG12 VAL 9 -1.855 -2.700 -4.686
72 HG13 VAL 9 HG13 VAL 9 -2.006 -1.953 -3.095
73 HG21 VAL 9 HG21 VAL 9 -0.407 -5.837 -3.622
74 HG22 VAL 9 HG22 VAL 9 -1.197 -4.953 -4.928
75 HG23 VAL 9 HG23 VAL 9 0.443 -4.525 -4.439
76 H ALA 10 H ALA 10 0.698 -3.402 0.482
77 HA ALA 10 HA ALA 10 -1.327 -1.519 1.297
78 HB1 ALA 10 HB1 ALA 10 -2.110 -2.961 3.197
79 HB2 ALA 10 HB2 ALA 10 -2.643 -3.476 1.596
80 HB3 ALA 10 HB3 ALA 10 -1.319 -4.320 2.400
81 HB2 I4G 11 HB2 I4G 11 -0.146 -0.041 0.838
82 HB3 I4G 11 HB3 I4G 11 0.887 1.092 1.401
83 HG I4G 11 HG I4G 11 -1.695 1.568 1.485
84 HD13 I4G 11 HD13 I4G 11 -1.192 -0.056 4.042
85 HD11 I4G 11 HD11 I4G 11 -2.652 0.892 3.704
86 HD12 I4G 11 HD12 I4G 11 -2.268 -0.522 2.718
87 HD23 I4G 11 HD23 I4G 11 0.040 3.122 2.357
88 HD22 I4G 11 HD22 I4G 11 0.165 2.168 3.843
89 HD21 I4G 11 HD21 I4G 11 -1.336 3.032 3.463
90 HA2 I4G 11 HA2 I4G 11 2.253 -0.782 3.879
91 HA3 I4G 11 HA3 I4G 11 1.450 0.627 4.072
92 H HIS 12 H HIS 12 2.684 -0.597 1.131
93 HA HIS 12 HA HIS 12 4.762 1.478 1.117
94 HB2 HIS 12 HB2 HIS 12 6.011 0.157 -0.321
95 HB3 HIS 12 HB3 HIS 12 5.209 -1.060 0.668
96 HD1 HIS 12 HD1 HIS 12 6.102 -0.669 -2.640
97 HD2 HIS 12 HD2 HIS 12 2.485 -1.599 -0.818
98 HE1 HIS 12 HE1 HIS 12 4.731 -1.811 -4.412
99 H VAL 13 H VAL 13 1.779 0.566 -0.307
100 HA VAL 13 HA VAL 13 1.901 1.718 -2.828
101 HB VAL 13 HB VAL 13 -0.435 1.581 -0.918
102 HG11 VAL 13 HG11 VAL 13 -0.972 3.289 -2.472
103 HG12 VAL 13 HG12 VAL 13 -0.321 2.359 -3.824
104 HG13 VAL 13 HG13 VAL 13 -1.801 1.834 -3.022
105 HG21 VAL 13 HG21 VAL 13 -0.658 -0.545 -1.536
106 HG22 VAL 13 HG22 VAL 13 -0.539 -0.124 -3.245
107 HG23 VAL 13 HG23 VAL 13 0.924 -0.419 -2.306
108 H VAL 14 H VAL 14 0.440 3.271 0.035
109 HA VAL 14 HA VAL 14 0.162 5.811 -0.994
110 HB VAL 14 HB VAL 14 0.806 5.036 1.853
111 HG11 VAL 14 HG11 VAL 14 -0.459 7.277 2.250
112 HG12 VAL 14 HG12 VAL 14 1.261 7.300 1.855
113 HG13 VAL 14 HG13 VAL 14 0.064 7.648 0.608
114 HG21 VAL 14 HG21 VAL 14 -1.257 4.060 0.817
115 HG22 VAL 14 HG22 VAL 14 -1.548 5.067 2.235
116 HG23 VAL 14 HG23 VAL 14 -1.861 5.706 0.621
117 H GLY 15 H GLY 15 3.042 4.238 0.203
118 HA2 GLY 15 HA2 GLY 15 4.648 6.537 0.557
119 HA3 GLY 15 HA3 GLY 15 5.237 4.903 0.290
120 H ALA 16 H ALA 16 3.860 4.626 -2.274
121 HA ALA 16 HA ALA 16 5.798 6.104 -3.887
122 HB1 ALA 16 HB1 ALA 16 5.945 3.937 -4.574
123 HB2 ALA 16 HB2 ALA 16 4.245 3.600 -4.248
124 HB3 ALA 16 HB3 ALA 16 4.704 4.505 -5.689
125 H ILE 17 H ILE 17 2.311 5.551 -3.636
126 HA ILE 17 HA ILE 17 1.470 6.997 -5.859
127 HB ILE 17 HB ILE 17 0.073 6.728 -3.194
128 HG12 ILE 17 HG12 ILE 17 0.640 4.577 -4.289
129 HG13 ILE 17 HG13 ILE 17 -1.096 4.853 -4.213
130 HG21 ILE 17 HG21 ILE 17 -1.963 7.007 -4.797
131 HG22 ILE 17 HG22 ILE 17 -1.099 8.428 -4.214
132 HG23 ILE 17 HG23 ILE 17 -0.790 7.813 -5.837
133 HD11 ILE 17 HD11 ILE 17 -1.113 5.515 -6.543
134 HD12 ILE 17 HD12 ILE 17 0.637 5.311 -6.629
135 HD13 ILE 17 HD13 ILE 17 -0.403 3.912 -6.354
136 H ALA 18 H ALA 18 2.357 8.098 -2.636
137 HA ALA 18 HA ALA 18 1.491 10.792 -3.019
138 HB1 ALA 18 HB1 ALA 18 1.747 9.723 -0.795
139 HB2 ALA 18 HB2 ALA 18 3.496 9.753 -1.022
140 HB3 ALA 18 HB3 ALA 18 2.593 11.264 -0.936
141 H GLU 19 H GLU 19 4.093 9.037 -4.226
142 HA GLU 19 HA GLU 19 6.045 11.137 -4.268
143 HB2 GLU 19 HB2 GLU 19 6.349 8.534 -4.453
144 HB3 GLU 19 HB3 GLU 19 6.109 8.828 -6.170
145 HG2 GLU 19 HG2 GLU 19 8.023 10.667 -5.014
146 HG3 GLU 19 HG3 GLU 19 8.491 8.985 -4.777
147 H HIS 20 H HIS 20 3.949 9.650 -6.731
148 HA HIS 20 HA HIS 20 4.672 11.579 -8.728
149 HB2 HIS 20 HB2 HIS 20 3.385 10.340 -10.194
150 HB3 HIS 20 HB3 HIS 20 3.800 9.115 -9.000
151 HD1 HIS 20 HD1 HIS 20 0.933 11.028 -10.384
152 HD2 HIS 20 HD2 HIS 20 1.658 8.288 -7.346
153 HE1 HIS 20 HE1 HIS 20 -1.334 10.232 -9.641
154 H PHE 21 H PHE 21 2.280 11.347 -6.251
155 HA PHE 21 HA PHE 21 0.953 13.754 -7.312
156 HB2 PHE 21 HB2 PHE 21 -0.230 11.334 -6.741
157 HB3 PHE 21 HB3 PHE 21 -0.527 12.259 -5.273
158 HD1 PHE 21 HD2 PHE 21 -0.919 14.960 -6.267
159 HD2 PHE 21 HD1 PHE 21 -2.231 11.247 -7.882
160 HE1 PHE 21 HE2 PHE 21 -2.795 16.107 -7.369
161 HE2 PHE 21 HE1 PHE 21 -4.110 12.388 -8.987
162 HZ PHE 21 HZ PHE 21 -4.396 14.821 -8.730
163 HN1 NH2 22 HN1 NH2 22 3.488 13.862 -5.808
164 HN2 NH2 22 HN2 NH2 22 3.158 14.636 -4.228
Start of MODEL 8
1 H1 GLY 1 H1 GLY 1 -2.685 -16.638 2.848
2 H2 GLY 1 H2 GLY 1 -4.305 -16.785 2.995
3 H3 GLY 1 H3 GLY 1 -3.357 -17.890 3.253
4 HA2 GLY 1 HA2 GLY 1 -2.653 -17.984 0.869
5 HA3 GLY 1 HA3 GLY 1 -4.385 -18.228 1.046
6 H LEU 2 H LEU 2 -5.711 -16.173 0.996
7 HA LEU 2 HA LEU 2 -5.028 -14.735 -1.393
8 HB2 LEU 2 HB2 LEU 2 -7.360 -15.493 -0.444
9 HB3 LEU 2 HB3 LEU 2 -7.291 -13.933 0.372
10 HG LEU 2 HG LEU 2 -6.722 -13.223 -2.195
11 HD11 LEU 2 HD11 LEU 2 -8.599 -15.574 -2.275
12 HD12 LEU 2 HD12 LEU 2 -7.088 -15.364 -3.159
13 HD13 LEU 2 HD13 LEU 2 -8.489 -14.369 -3.558
14 HD21 LEU 2 HD21 LEU 2 -8.660 -12.045 -2.057
15 HD22 LEU 2 HD22 LEU 2 -8.530 -12.536 -0.368
16 HD23 LEU 2 HD23 LEU 2 -9.589 -13.423 -1.467
17 H PHE 3 H PHE 3 -5.919 -13.596 1.871
18 HA PHE 3 HA PHE 3 -5.043 -10.966 1.504
19 HB2 PHE 3 HB2 PHE 3 -6.148 -12.514 3.616
20 HB3 PHE 3 HB3 PHE 3 -4.719 -11.703 4.248
21 HD1 PHE 3 HD2 PHE 3 -8.071 -11.254 2.866
22 HD2 PHE 3 HD1 PHE 3 -4.625 -9.297 4.420
23 HE1 PHE 3 HE2 PHE 3 -9.366 -9.177 3.111
24 HE2 PHE 3 HE1 PHE 3 -5.916 -7.217 4.669
25 HZ PHE 3 HZ PHE 3 -8.289 -7.155 4.014
26 H GLY 4 H GLY 4 -3.309 -13.870 2.324
27 HA2 GLY 4 HA2 GLY 4 -1.028 -12.903 3.538
28 HA3 GLY 4 HA3 GLY 4 -1.054 -14.286 2.453
29 H VAL 5 H VAL 5 -1.970 -12.643 0.181
30 HA VAL 5 HA VAL 5 0.650 -11.553 -0.532
31 HB VAL 5 HB VAL 5 -1.729 -12.190 -2.284
32 HG11 VAL 5 HG11 VAL 5 0.431 -12.059 -3.932
33 HG12 VAL 5 HG12 VAL 5 -0.722 -10.746 -3.680
34 HG13 VAL 5 HG13 VAL 5 0.794 -10.776 -2.778
35 HG21 VAL 5 HG21 VAL 5 0.751 -13.694 -1.552
36 HG22 VAL 5 HG22 VAL 5 -0.917 -14.261 -1.639
37 HG23 VAL 5 HG23 VAL 5 -0.013 -13.949 -3.121
38 H LEU 6 H LEU 6 -2.600 -10.586 0.125
39 HA LEU 6 HA LEU 6 -2.817 -8.194 -1.251
40 HB2 LEU 6 HB2 LEU 6 -3.935 -9.258 1.283
41 HB3 LEU 6 HB3 LEU 6 -4.104 -7.531 0.980
42 HG LEU 6 HG LEU 6 -5.092 -9.703 -0.866
43 HD11 LEU 6 HD11 LEU 6 -6.747 -9.952 0.603
44 HD12 LEU 6 HD12 LEU 6 -7.267 -8.333 0.139
45 HD13 LEU 6 HD13 LEU 6 -6.228 -8.556 1.546
46 HD21 LEU 6 HD21 LEU 6 -4.753 -7.815 -2.184
47 HD22 LEU 6 HD22 LEU 6 -5.225 -6.708 -0.893
48 HD23 LEU 6 HD23 LEU 6 -6.447 -7.684 -1.711
49 H ALA 7 H ALA 7 -0.878 -8.982 1.516
50 HA ALA 7 HA ALA 7 -0.414 -6.428 2.560
51 HB1 ALA 7 HB1 ALA 7 1.801 -7.477 3.314
52 HB2 ALA 7 HB2 ALA 7 0.301 -8.209 3.885
53 HB3 ALA 7 HB3 ALA 7 1.200 -8.955 2.564
54 H LYS 8 H LYS 8 0.817 -7.995 -0.284
55 HA LYS 8 HA LYS 8 3.134 -6.479 -0.717
56 HB2 LYS 8 HB2 LYS 8 1.933 -8.549 -2.005
57 HB3 LYS 8 HB3 LYS 8 1.583 -7.230 -3.114
58 HG2 LYS 8 HG2 LYS 8 4.199 -6.788 -2.680
59 HG3 LYS 8 HG3 LYS 8 4.140 -8.540 -2.468
60 HD2 LYS 8 HD2 LYS 8 4.500 -8.394 -4.733
61 HD3 LYS 8 HD3 LYS 8 2.736 -8.445 -4.685
62 HE2 LYS 8 HE2 LYS 8 3.741 -5.741 -4.425
63 HE3 LYS 8 HE3 LYS 8 4.322 -6.511 -5.902
64 HZ1 LYS 8 HZ1 LYS 8 1.777 -7.208 -6.000
65 HZ2 LYS 8 HZ2 LYS 8 2.351 -5.763 -6.666
66 HZ3 LYS 8 HZ3 LYS 8 1.613 -5.758 -5.143
67 H VAL 9 H VAL 9 -0.166 -5.614 -0.897
68 HA VAL 9 HA VAL 9 0.578 -3.047 -2.134
69 HB VAL 9 HB VAL 9 -2.144 -4.272 -2.497
70 HG11 VAL 9 HG11 VAL 9 -2.055 -2.741 -4.526
71 HG12 VAL 9 HG12 VAL 9 -2.158 -1.960 -2.946
72 HG13 VAL 9 HG13 VAL 9 -0.613 -2.035 -3.796
73 HG21 VAL 9 HG21 VAL 9 -1.027 -4.617 -4.919
74 HG22 VAL 9 HG22 VAL 9 0.374 -4.918 -3.892
75 HG23 VAL 9 HG23 VAL 9 -1.091 -5.879 -3.688
76 H ALA 10 H ALA 10 0.655 -3.386 0.581
77 HA ALA 10 HA ALA 10 -1.336 -1.477 1.434
78 HB1 ALA 10 HB1 ALA 10 -2.776 -2.954 2.268
79 HB2 ALA 10 HB2 ALA 10 -1.662 -4.296 1.999
80 HB3 ALA 10 HB3 ALA 10 -1.553 -3.342 3.478
81 HB2 I4G 11 HB2 I4G 11 -0.166 -0.010 0.914
82 HB3 I4G 11 HB3 I4G 11 0.888 1.128 1.425
83 HG I4G 11 HG I4G 11 -1.688 1.618 1.587
84 HD13 I4G 11 HD13 I4G 11 -1.108 0.027 4.149
85 HD11 I4G 11 HD11 I4G 11 -2.574 0.977 3.846
86 HD12 I4G 11 HD12 I4G 11 -2.229 -0.453 2.867
87 HD23 I4G 11 HD23 I4G 11 0.082 3.175 2.381
88 HD22 I4G 11 HD22 I4G 11 0.251 2.242 3.876
89 HD21 I4G 11 HD21 I4G 11 -1.259 3.106 3.532
90 HA2 I4G 11 HA2 I4G 11 2.334 -0.714 3.879
91 HA3 I4G 11 HA3 I4G 11 1.534 0.694 4.092
92 H HIS 12 H HIS 12 2.689 -0.565 1.130
93 HA HIS 12 HA HIS 12 4.746 1.528 1.021
94 HB2 HIS 12 HB2 HIS 12 5.967 0.191 -0.419
95 HB3 HIS 12 HB3 HIS 12 5.180 -1.024 0.585
96 HD1 HIS 12 HD1 HIS 12 6.007 -0.609 -2.747
97 HD2 HIS 12 HD2 HIS 12 2.445 -1.590 -0.848
98 HE1 HIS 12 HE1 HIS 12 4.609 -1.759 -4.493
99 H VAL 13 H VAL 13 1.727 0.576 -0.299
100 HA VAL 13 HA VAL 13 1.766 1.700 -2.836
101 HB VAL 13 HB VAL 13 -0.522 1.580 -0.867
102 HG11 VAL 13 HG11 VAL 13 -0.475 2.252 -3.802
103 HG12 VAL 13 HG12 VAL 13 -1.934 1.747 -2.948
104 HG13 VAL 13 HG13 VAL 13 -1.101 3.228 -2.474
105 HG21 VAL 13 HG21 VAL 13 0.206 -0.226 -3.172
106 HG22 VAL 13 HG22 VAL 13 0.439 -0.597 -1.464
107 HG23 VAL 13 HG23 VAL 13 -1.191 -0.404 -2.110
108 H VAL 14 H VAL 14 0.397 3.264 0.067
109 HA VAL 14 HA VAL 14 0.065 5.794 -0.994
110 HB VAL 14 HB VAL 14 0.752 5.053 1.852
111 HG11 VAL 14 HG11 VAL 14 0.111 7.643 0.562
112 HG12 VAL 14 HG12 VAL 14 -0.630 7.312 2.129
113 HG13 VAL 14 HG13 VAL 14 1.126 7.293 1.961
114 HG21 VAL 14 HG21 VAL 14 -1.518 4.849 2.265
115 HG22 VAL 14 HG22 VAL 14 -1.967 5.787 0.841
116 HG23 VAL 14 HG23 VAL 14 -1.365 4.140 0.657
117 H GLY 15 H GLY 15 2.967 4.260 0.211
118 HA2 GLY 15 HA2 GLY 15 4.544 6.606 0.462
119 HA3 GLY 15 HA3 GLY 15 5.152 4.964 0.318
120 H ALA 16 H ALA 16 3.659 4.631 -2.256
121 HA ALA 16 HA ALA 16 5.695 5.872 -3.946
122 HB1 ALA 16 HB1 ALA 16 4.436 3.352 -3.931
123 HB2 ALA 16 HB2 ALA 16 3.937 4.166 -5.413
124 HB3 ALA 16 HB3 ALA 16 5.651 3.954 -5.058
125 H ILE 17 H ILE 17 2.160 5.495 -3.815
126 HA ILE 17 HA ILE 17 1.501 7.032 -6.035
127 HB ILE 17 HB ILE 17 -0.046 6.751 -3.456
128 HG12 ILE 17 HG12 ILE 17 -0.176 5.200 -6.051
129 HG13 ILE 17 HG13 ILE 17 0.439 4.600 -4.516
130 HG21 ILE 17 HG21 ILE 17 -0.828 8.655 -4.747
131 HG22 ILE 17 HG22 ILE 17 -0.956 7.647 -6.188
132 HG23 ILE 17 HG23 ILE 17 -2.008 7.347 -4.806
133 HD11 ILE 17 HD11 ILE 17 -1.813 4.894 -3.549
134 HD12 ILE 17 HD12 ILE 17 -2.399 5.366 -5.144
135 HD13 ILE 17 HD13 ILE 17 -1.765 3.741 -4.882
136 H ALA 18 H ALA 18 2.285 8.015 -2.751
137 HA ALA 18 HA ALA 18 1.518 10.739 -3.056
138 HB1 ALA 18 HB1 ALA 18 3.210 9.269 -1.064
139 HB2 ALA 18 HB2 ALA 18 3.040 11.023 -1.011
140 HB3 ALA 18 HB3 ALA 18 1.617 9.994 -0.845
141 H GLU 19 H GLU 19 4.163 8.937 -4.193
142 HA GLU 19 HA GLU 19 6.139 10.987 -4.196
143 HB2 GLU 19 HB2 GLU 19 6.369 8.390 -4.493
144 HB3 GLU 19 HB3 GLU 19 6.131 8.758 -6.195
145 HG2 GLU 19 HG2 GLU 19 8.138 9.817 -6.397
146 HG3 GLU 19 HG3 GLU 19 8.171 10.315 -4.706
147 H HIS 20 H HIS 20 4.038 9.665 -6.750
148 HA HIS 20 HA HIS 20 4.819 11.681 -8.637
149 HB2 HIS 20 HB2 HIS 20 3.517 10.547 -10.180
150 HB3 HIS 20 HB3 HIS 20 3.923 9.254 -9.056
151 HD1 HIS 20 HD1 HIS 20 1.066 11.357 -10.228
152 HD2 HIS 20 HD2 HIS 20 1.776 8.252 -7.562
153 HE1 HIS 20 HE1 HIS 20 -1.207 10.510 -9.562
154 H PHE 21 H PHE 21 2.397 11.371 -6.200
155 HA PHE 21 HA PHE 21 0.943 13.694 -7.251
156 HB2 PHE 21 HB2 PHE 21 -0.056 11.353 -6.303
157 HB3 PHE 21 HB3 PHE 21 -0.081 12.330 -4.839
158 HD1 PHE 21 HD2 PHE 21 -0.831 14.941 -5.631
159 HD2 PHE 21 HD1 PHE 21 -2.148 11.218 -7.220
160 HE1 PHE 21 HE2 PHE 21 -2.921 16.003 -6.376
161 HE2 PHE 21 HE1 PHE 21 -4.240 12.275 -7.968
162 HZ PHE 21 HZ PHE 21 -4.630 14.669 -7.546
163 HN1 NH2 22 HN1 NH2 22 3.630 14.173 -6.232
164 HN2 NH2 22 HN2 NH2 22 3.502 15.103 -4.707
Start of MODEL 9
1 H1 GLY 1 H1 GLY 1 -3.358 -17.276 3.269
2 H2 GLY 1 H2 GLY 1 -4.758 -16.705 2.650
3 H3 GLY 1 H3 GLY 1 -4.519 -18.135 2.946
4 HA2 GLY 1 HA2 GLY 1 -2.427 -17.663 1.265
5 HA3 GLY 1 HA3 GLY 1 -3.938 -18.385 0.729
6 H LEU 2 H LEU 2 -5.659 -16.222 0.997
7 HA LEU 2 HA LEU 2 -5.005 -14.752 -1.371
8 HB2 LEU 2 HB2 LEU 2 -7.331 -15.356 0.114
9 HB3 LEU 2 HB3 LEU 2 -7.207 -13.600 0.040
10 HG LEU 2 HG LEU 2 -7.050 -15.310 -2.427
11 HD11 LEU 2 HD11 LEU 2 -9.588 -13.955 -1.844
12 HD12 LEU 2 HD12 LEU 2 -9.233 -15.350 -0.827
13 HD13 LEU 2 HD13 LEU 2 -9.279 -15.527 -2.581
14 HD21 LEU 2 HD21 LEU 2 -6.271 -13.119 -2.820
15 HD22 LEU 2 HD22 LEU 2 -7.565 -12.402 -1.859
16 HD23 LEU 2 HD23 LEU 2 -7.931 -13.151 -3.414
17 H PHE 3 H PHE 3 -5.904 -13.600 1.886
18 HA PHE 3 HA PHE 3 -5.021 -10.976 1.520
19 HB2 PHE 3 HB2 PHE 3 -6.158 -12.493 3.612
20 HB3 PHE 3 HB3 PHE 3 -4.696 -11.762 4.267
21 HD1 PHE 3 HD2 PHE 3 -8.016 -11.126 2.872
22 HD2 PHE 3 HD1 PHE 3 -4.498 -9.371 4.505
23 HE1 PHE 3 HE2 PHE 3 -9.215 -8.998 3.159
24 HE2 PHE 3 HE1 PHE 3 -5.693 -7.240 4.797
25 HZ PHE 3 HZ PHE 3 -8.054 -7.051 4.123
26 H GLY 4 H GLY 4 -3.282 -13.877 2.342
27 HA2 GLY 4 HA2 GLY 4 -0.999 -12.906 3.549
28 HA3 GLY 4 HA3 GLY 4 -1.025 -14.291 2.468
29 H VAL 5 H VAL 5 -1.949 -12.652 0.195
30 HA VAL 5 HA VAL 5 0.670 -11.560 -0.526
31 HB VAL 5 HB VAL 5 -1.712 -12.201 -2.272
32 HG11 VAL 5 HG11 VAL 5 1.079 -11.314 -2.992
33 HG12 VAL 5 HG12 VAL 5 -0.128 -11.893 -4.142
34 HG13 VAL 5 HG13 VAL 5 -0.412 -10.406 -3.236
35 HG21 VAL 5 HG21 VAL 5 -0.998 -14.304 -1.968
36 HG22 VAL 5 HG22 VAL 5 0.334 -13.848 -3.031
37 HG23 VAL 5 HG23 VAL 5 0.540 -13.782 -1.281
38 H LEU 6 H LEU 6 -2.580 -10.595 0.136
39 HA LEU 6 HA LEU 6 -2.802 -8.206 -1.244
40 HB2 LEU 6 HB2 LEU 6 -3.929 -9.292 1.269
41 HB3 LEU 6 HB3 LEU 6 -4.068 -7.553 1.020
42 HG LEU 6 HG LEU 6 -5.114 -9.668 -0.863
43 HD11 LEU 6 HD11 LEU 6 -6.573 -9.847 0.894
44 HD12 LEU 6 HD12 LEU 6 -7.321 -8.535 -0.017
45 HD13 LEU 6 HD13 LEU 6 -6.341 -8.174 1.403
46 HD21 LEU 6 HD21 LEU 6 -5.168 -6.667 -0.877
47 HD22 LEU 6 HD22 LEU 6 -6.379 -7.621 -1.735
48 HD23 LEU 6 HD23 LEU 6 -4.673 -7.771 -2.159
49 H ALA 7 H ALA 7 -0.857 -8.988 1.521
50 HA ALA 7 HA ALA 7 -0.394 -6.432 2.560
51 HB1 ALA 7 HB1 ALA 7 1.095 -9.011 2.620
52 HB2 ALA 7 HB2 ALA 7 1.890 -7.548 3.203
53 HB3 ALA 7 HB3 ALA 7 0.383 -8.089 3.943
54 H LYS 8 H LYS 8 0.832 -8.002 -0.284
55 HA LYS 8 HA LYS 8 3.148 -6.484 -0.722
56 HB2 LYS 8 HB2 LYS 8 1.949 -8.558 -2.004
57 HB3 LYS 8 HB3 LYS 8 1.593 -7.242 -3.115
58 HG2 LYS 8 HG2 LYS 8 4.380 -7.521 -2.134
59 HG3 LYS 8 HG3 LYS 8 3.789 -8.688 -3.320
60 HD2 LYS 8 HD2 LYS 8 3.159 -5.883 -3.928
61 HD3 LYS 8 HD3 LYS 8 4.882 -6.273 -3.933
62 HE2 LYS 8 HE2 LYS 8 4.516 -8.045 -5.532
63 HE3 LYS 8 HE3 LYS 8 2.772 -7.799 -5.455
64 HZ1 LYS 8 HZ1 LYS 8 4.384 -5.483 -6.170
65 HZ2 LYS 8 HZ2 LYS 8 2.879 -5.978 -6.761
66 HZ3 LYS 8 HZ3 LYS 8 4.293 -6.717 -7.323
67 H VAL 9 H VAL 9 -0.153 -5.622 -0.897
68 HA VAL 9 HA VAL 9 0.586 -3.055 -2.136
69 HB VAL 9 HB VAL 9 -2.133 -4.286 -2.504
70 HG11 VAL 9 HG11 VAL 9 -2.157 -1.978 -2.954
71 HG12 VAL 9 HG12 VAL 9 -0.606 -2.043 -3.795
72 HG13 VAL 9 HG13 VAL 9 -2.042 -2.755 -4.532
73 HG21 VAL 9 HG21 VAL 9 -0.980 -5.904 -3.629
74 HG22 VAL 9 HG22 VAL 9 -1.102 -4.695 -4.907
75 HG23 VAL 9 HG23 VAL 9 0.387 -4.847 -3.976
76 H ALA 10 H ALA 10 0.661 -3.390 0.578
77 HA ALA 10 HA ALA 10 -1.336 -1.488 1.427
78 HB1 ALA 10 HB1 ALA 10 -2.452 -3.712 1.681
79 HB2 ALA 10 HB2 ALA 10 -1.216 -4.129 2.870
80 HB3 ALA 10 HB3 ALA 10 -2.314 -2.782 3.174
81 HB2 I4G 11 HB2 I4G 11 -0.172 -0.015 0.909
82 HB3 I4G 11 HB3 I4G 11 0.879 1.126 1.421
83 HG I4G 11 HG I4G 11 -1.699 1.607 1.581
84 HD13 I4G 11 HD13 I4G 11 -1.116 0.017 4.143
85 HD11 I4G 11 HD11 I4G 11 -2.586 0.962 3.838
86 HD12 I4G 11 HD12 I4G 11 -2.234 -0.466 2.860
87 HD23 I4G 11 HD23 I4G 11 0.065 3.171 2.376
88 HD22 I4G 11 HD22 I4G 11 0.235 2.238 3.872
89 HD21 I4G 11 HD21 I4G 11 -1.277 3.096 3.526
90 HA2 I4G 11 HA2 I4G 11 2.328 -0.713 3.877
91 HA3 I4G 11 HA3 I4G 11 1.524 0.693 4.088
92 H HIS 12 H HIS 12 2.684 -0.563 1.127
93 HA HIS 12 HA HIS 12 4.736 1.536 1.021
94 HB2 HIS 12 HB2 HIS 12 5.964 0.202 -0.417
95 HB3 HIS 12 HB3 HIS 12 5.180 -1.014 0.589
96 HD1 HIS 12 HD1 HIS 12 6.010 -0.606 -2.742
97 HD2 HIS 12 HD2 HIS 12 2.448 -1.590 -0.845
98 HE1 HIS 12 HE1 HIS 12 4.618 -1.764 -4.487
99 H VAL 13 H VAL 13 1.721 0.574 -0.302
100 HA VAL 13 HA VAL 13 1.759 1.690 -2.841
101 HB VAL 13 HB VAL 13 -0.528 1.578 -0.871
102 HG11 VAL 13 HG11 VAL 13 -0.398 2.419 -3.736
103 HG12 VAL 13 HG12 VAL 13 -1.851 1.634 -3.112
104 HG13 VAL 13 HG13 VAL 13 -1.284 3.142 -2.394
105 HG21 VAL 13 HG21 VAL 13 0.363 -0.609 -1.413
106 HG22 VAL 13 HG22 VAL 13 -1.206 -0.395 -2.187
107 HG23 VAL 13 HG23 VAL 13 0.273 -0.248 -3.137
108 H VAL 14 H VAL 14 0.397 3.264 0.060
109 HA VAL 14 HA VAL 14 0.060 5.790 -1.009
110 HB VAL 14 HB VAL 14 0.754 5.058 1.838
111 HG11 VAL 14 HG11 VAL 14 0.135 7.645 0.539
112 HG12 VAL 14 HG12 VAL 14 -0.637 7.324 2.094
113 HG13 VAL 14 HG13 VAL 14 1.122 7.293 1.959
114 HG21 VAL 14 HG21 VAL 14 -1.319 4.056 0.819
115 HG22 VAL 14 HG22 VAL 14 -1.583 5.039 2.259
116 HG23 VAL 14 HG23 VAL 14 -1.943 5.698 0.663
117 H GLY 15 H GLY 15 2.967 4.256 0.173
118 HA2 GLY 15 HA2 GLY 15 4.547 6.602 0.425
119 HA3 GLY 15 HA3 GLY 15 5.154 4.960 0.272
120 H ALA 16 H ALA 16 3.637 4.641 -2.295
121 HA ALA 16 HA ALA 16 5.667 5.880 -3.994
122 HB1 ALA 16 HB1 ALA 16 5.624 3.937 -5.058
123 HB2 ALA 16 HB2 ALA 16 4.333 3.375 -3.996
124 HB3 ALA 16 HB3 ALA 16 3.938 4.211 -5.499
125 H ILE 17 H ILE 17 2.132 5.507 -3.856
126 HA ILE 17 HA ILE 17 1.471 7.066 -6.059
127 HB ILE 17 HB ILE 17 -0.079 6.782 -3.482
128 HG12 ILE 17 HG12 ILE 17 -0.218 5.215 -6.069
129 HG13 ILE 17 HG13 ILE 17 0.435 4.627 -4.543
130 HG21 ILE 17 HG21 ILE 17 -1.577 8.169 -4.346
131 HG22 ILE 17 HG22 ILE 17 -0.556 8.404 -5.763
132 HG23 ILE 17 HG23 ILE 17 -1.754 7.110 -5.745
133 HD11 ILE 17 HD11 ILE 17 -1.823 4.950 -3.543
134 HD12 ILE 17 HD12 ILE 17 -2.423 5.321 -5.159
135 HD13 ILE 17 HD13 ILE 17 -1.748 3.730 -4.812
136 H ALA 18 H ALA 18 2.233 8.020 -2.758
137 HA ALA 18 HA ALA 18 1.483 10.750 -3.053
138 HB1 ALA 18 HB1 ALA 18 1.576 9.832 -0.854
139 HB2 ALA 18 HB2 ALA 18 3.263 9.359 -1.060
140 HB3 ALA 18 HB3 ALA 18 2.830 11.067 -0.968
141 H GLU 19 H GLU 19 4.127 8.944 -4.177
142 HA GLU 19 HA GLU 19 6.117 10.982 -4.136
143 HB2 GLU 19 HB2 GLU 19 6.330 8.384 -4.456
144 HB3 GLU 19 HB3 GLU 19 6.128 8.776 -6.158
145 HG2 GLU 19 HG2 GLU 19 8.091 10.474 -4.872
146 HG3 GLU 19 HG3 GLU 19 8.493 8.763 -4.740
147 H HIS 20 H HIS 20 4.025 9.700 -6.717
148 HA HIS 20 HA HIS 20 4.845 11.717 -8.587
149 HB2 HIS 20 HB2 HIS 20 3.527 10.615 -10.146
150 HB3 HIS 20 HB3 HIS 20 3.935 9.307 -9.039
151 HD1 HIS 20 HD1 HIS 20 1.076 11.476 -10.117
152 HD2 HIS 20 HD2 HIS 20 1.793 8.241 -7.609
153 HE1 HIS 20 HE1 HIS 20 -1.195 10.612 -9.468
154 H PHE 21 H PHE 21 2.400 11.420 -6.172
155 HA PHE 21 HA PHE 21 0.882 13.672 -7.249
156 HB2 PHE 21 HB2 PHE 21 0.046 11.401 -5.994
157 HB3 PHE 21 HB3 PHE 21 0.080 12.536 -4.649
158 HD1 PHE 21 HD1 PHE 21 -0.934 12.720 -8.239
159 HD2 PHE 21 HD2 PHE 21 -1.984 13.395 -4.171
160 HE1 PHE 21 HE1 PHE 21 -3.109 13.623 -8.953
161 HE2 PHE 21 HE2 PHE 21 -4.160 14.298 -4.878
162 HZ PHE 21 HZ PHE 21 -4.725 14.411 -7.272
163 HN1 NH2 22 HN1 NH2 22 3.775 13.895 -6.164
164 HN2 NH2 22 HN2 NH2 22 3.693 15.097 -4.840
Start of MODEL 10
1 H1 GLY 1 H1 GLY 1 -4.675 -18.309 -0.043
2 H2 GLY 1 H2 GLY 1 -3.347 -19.189 0.319
3 H3 GLY 1 H3 GLY 1 -4.503 -19.043 1.229
4 HA2 GLY 1 HA2 GLY 1 -3.691 -17.111 2.178
5 HA3 GLY 1 HA3 GLY 1 -2.257 -17.455 1.221
6 H LEU 2 H LEU 2 -5.492 -16.005 0.938
7 HA LEU 2 HA LEU 2 -4.818 -14.499 -1.391
8 HB2 LEU 2 HB2 LEU 2 -7.141 -15.254 -0.381
9 HB3 LEU 2 HB3 LEU 2 -7.045 -13.679 0.404
10 HG LEU 2 HG LEU 2 -8.374 -13.569 -1.631
11 HD11 LEU 2 HD11 LEU 2 -6.845 -11.683 -0.871
12 HD12 LEU 2 HD12 LEU 2 -7.408 -11.634 -2.541
13 HD13 LEU 2 HD13 LEU 2 -5.770 -12.178 -2.180
14 HD21 LEU 2 HD21 LEU 2 -6.347 -15.267 -2.653
15 HD22 LEU 2 HD22 LEU 2 -6.357 -13.791 -3.620
16 HD23 LEU 2 HD23 LEU 2 -7.836 -14.736 -3.437
17 H PHE 3 H PHE 3 -5.639 -13.410 1.909
18 HA PHE 3 HA PHE 3 -4.795 -10.774 1.589
19 HB2 PHE 3 HB2 PHE 3 -5.802 -12.374 3.689
20 HB3 PHE 3 HB3 PHE 3 -4.320 -11.636 4.289
21 HD1 PHE 3 HD2 PHE 3 -7.723 -11.028 3.110
22 HD2 PHE 3 HD1 PHE 3 -4.143 -9.242 4.565
23 HE1 PHE 3 HE2 PHE 3 -8.941 -8.932 3.524
24 HE2 PHE 3 HE1 PHE 3 -5.357 -7.142 4.980
25 HZ PHE 3 HZ PHE 3 -7.759 -6.984 4.460
26 H GLY 4 H GLY 4 -2.981 -13.673 2.217
27 HA2 GLY 4 HA2 GLY 4 -0.651 -12.714 3.343
28 HA3 GLY 4 HA3 GLY 4 -0.715 -14.058 2.213
29 H VAL 5 H VAL 5 -1.760 -12.380 0.040
30 HA VAL 5 HA VAL 5 0.798 -11.200 -0.756
31 HB VAL 5 HB VAL 5 -1.637 -11.855 -2.421
32 HG11 VAL 5 HG11 VAL 5 -0.486 -10.034 -3.443
33 HG12 VAL 5 HG12 VAL 5 1.081 -10.803 -3.183
34 HG13 VAL 5 HG13 VAL 5 -0.062 -11.496 -4.334
35 HG21 VAL 5 HG21 VAL 5 -0.551 -13.859 -1.612
36 HG22 VAL 5 HG22 VAL 5 -0.217 -13.659 -3.332
37 HG23 VAL 5 HG23 VAL 5 1.020 -13.257 -2.140
38 H LEU 6 H LEU 6 -2.429 -10.335 0.096
39 HA LEU 6 HA LEU 6 -2.796 -7.926 -1.212
40 HB2 LEU 6 HB2 LEU 6 -3.735 -9.091 1.342
41 HB3 LEU 6 HB3 LEU 6 -3.935 -7.352 1.138
42 HG LEU 6 HG LEU 6 -5.031 -9.441 -0.743
43 HD11 LEU 6 HD11 LEU 6 -6.029 -8.363 1.774
44 HD12 LEU 6 HD12 LEU 6 -6.556 -9.770 0.852
45 HD13 LEU 6 HD13 LEU 6 -7.154 -8.166 0.430
46 HD21 LEU 6 HD21 LEU 6 -6.442 -7.388 -1.401
47 HD22 LEU 6 HD22 LEU 6 -4.786 -7.500 -1.999
48 HD23 LEU 6 HD23 LEU 6 -5.162 -6.450 -0.632
49 H ALA 7 H ALA 7 -0.673 -8.706 1.421
50 HA ALA 7 HA ALA 7 -0.209 -6.155 2.473
51 HB1 ALA 7 HB1 ALA 7 2.002 -8.154 2.280
52 HB2 ALA 7 HB2 ALA 7 1.567 -7.082 3.613
53 HB3 ALA 7 HB3 ALA 7 0.584 -8.506 3.270
54 H LYS 8 H LYS 8 0.854 -7.636 -0.475
55 HA LYS 8 HA LYS 8 3.106 -6.022 -1.002
56 HB2 LYS 8 HB2 LYS 8 1.927 -8.167 -2.225
57 HB3 LYS 8 HB3 LYS 8 1.540 -6.866 -3.343
58 HG2 LYS 8 HG2 LYS 8 4.334 -6.985 -2.411
59 HG3 LYS 8 HG3 LYS 8 3.799 -8.303 -3.456
60 HD2 LYS 8 HD2 LYS 8 3.002 -5.616 -4.342
61 HD3 LYS 8 HD3 LYS 8 4.742 -5.915 -4.345
62 HE2 LYS 8 HE2 LYS 8 4.038 -6.574 -6.475
63 HE3 LYS 8 HE3 LYS 8 4.179 -8.085 -5.578
64 HZ1 LYS 8 HZ1 LYS 8 1.574 -6.890 -5.392
65 HZ2 LYS 8 HZ2 LYS 8 2.008 -8.478 -5.778
66 HZ3 LYS 8 HZ3 LYS 8 2.004 -7.288 -6.979
67 H VAL 9 H VAL 9 -0.201 -5.291 -0.939
68 HA VAL 9 HA VAL 9 0.339 -2.679 -2.153
69 HB VAL 9 HB VAL 9 -0.748 -4.076 -3.883
70 HG11 VAL 9 HG11 VAL 9 -2.398 -4.843 -1.685
71 HG12 VAL 9 HG12 VAL 9 -3.408 -4.128 -2.943
72 HG13 VAL 9 HG13 VAL 9 -2.359 -5.495 -3.323
73 HG21 VAL 9 HG21 VAL 9 -2.817 -2.095 -3.082
74 HG22 VAL 9 HG22 VAL 9 -1.179 -1.520 -3.392
75 HG23 VAL 9 HG23 VAL 9 -2.067 -2.372 -4.654
76 H ALA 10 H ALA 10 0.339 -2.972 0.502
77 HA ALA 10 HA ALA 10 -1.731 -1.248 1.356
78 HB1 ALA 10 HB1 ALA 10 -2.479 -3.942 1.338
79 HB2 ALA 10 HB2 ALA 10 -2.154 -3.548 3.025
80 HB3 ALA 10 HB3 ALA 10 -3.322 -2.599 2.108
81 HB2 I4G 11 HB2 I4G 11 -0.425 0.250 1.216
82 HB3 I4G 11 HB3 I4G 11 0.446 1.289 2.127
83 HG I4G 11 HG I4G 11 -2.193 0.439 3.153
84 HD13 I4G 11 HD13 I4G 11 -0.678 3.106 3.307
85 HD11 I4G 11 HD11 I4G 11 -2.234 2.768 4.088
86 HD12 I4G 11 HD12 I4G 11 -0.782 1.902 4.599
87 HD23 I4G 11 HD23 I4G 11 -2.643 1.048 0.784
88 HD22 I4G 11 HD22 I4G 11 -1.844 2.611 1.021
89 HD21 I4G 11 HD21 I4G 11 -3.346 2.240 1.886
90 HA2 I4G 11 HA2 I4G 11 1.561 -0.993 4.369
91 HA3 I4G 11 HA3 I4G 11 0.797 0.423 4.652
92 H HIS 12 H HIS 12 2.249 -0.496 1.704
93 HA HIS 12 HA HIS 12 4.254 1.633 2.071
94 HB2 HIS 12 HB2 HIS 12 5.507 0.238 0.250
95 HB3 HIS 12 HB3 HIS 12 5.563 -0.279 1.933
96 HD1 HIS 12 HD1 HIS 12 5.607 -2.755 1.825
97 HD2 HIS 12 HD2 HIS 12 2.772 -1.135 -0.744
98 HE1 HIS 12 HE1 HIS 12 4.373 -4.722 0.859
99 H VAL 13 H VAL 13 1.535 0.692 0.376
100 HA VAL 13 HA VAL 13 2.027 1.536 -2.240
101 HB VAL 13 HB VAL 13 -0.575 1.786 -0.724
102 HG11 VAL 13 HG11 VAL 13 -0.801 1.145 -3.517
103 HG12 VAL 13 HG12 VAL 13 -1.499 2.493 -2.617
104 HG13 VAL 13 HG13 VAL 13 0.122 2.632 -3.300
105 HG21 VAL 13 HG21 VAL 13 0.506 -0.517 -2.347
106 HG22 VAL 13 HG22 VAL 13 0.315 -0.483 -0.594
107 HG23 VAL 13 HG23 VAL 13 -1.106 -0.424 -1.637
108 H VAL 14 H VAL 14 0.753 3.374 0.528
109 HA VAL 14 HA VAL 14 0.299 5.806 -0.686
110 HB VAL 14 HB VAL 14 1.401 5.349 2.090
111 HG11 VAL 14 HG11 VAL 14 -0.174 7.598 2.165
112 HG12 VAL 14 HG12 VAL 14 1.590 7.576 2.126
113 HG13 VAL 14 HG13 VAL 14 0.675 7.765 0.629
114 HG21 VAL 14 HG21 VAL 14 -1.454 5.687 1.178
115 HG22 VAL 14 HG22 VAL 14 -0.705 4.147 1.600
116 HG23 VAL 14 HG23 VAL 14 -0.899 5.398 2.827
117 H GLY 15 H GLY 15 3.345 4.565 0.655
118 HA2 GLY 15 HA2 GLY 15 4.912 6.845 0.315
119 HA3 GLY 15 HA3 GLY 15 5.521 5.196 0.296
120 H ALA 16 H ALA 16 3.711 4.620 -2.051
121 HA ALA 16 HA ALA 16 5.576 5.583 -4.081
122 HB1 ALA 16 HB1 ALA 16 4.556 3.119 -3.676
123 HB2 ALA 16 HB2 ALA 16 3.418 3.742 -4.872
124 HB3 ALA 16 HB3 ALA 16 5.143 3.697 -5.236
125 H ILE 17 H ILE 17 2.056 5.367 -3.576
126 HA ILE 17 HA ILE 17 1.249 6.759 -5.844
127 HB ILE 17 HB ILE 17 -0.084 6.736 -3.135
128 HG12 ILE 17 HG12 ILE 17 -0.472 4.962 -5.555
129 HG13 ILE 17 HG13 ILE 17 0.286 4.485 -4.040
130 HG21 ILE 17 HG21 ILE 17 -1.211 7.381 -5.856
131 HG22 ILE 17 HG22 ILE 17 -2.133 7.269 -4.358
132 HG23 ILE 17 HG23 ILE 17 -0.920 8.533 -4.554
133 HD11 ILE 17 HD11 ILE 17 -2.584 5.324 -4.382
134 HD12 ILE 17 HD12 ILE 17 -1.998 3.671 -4.194
135 HD13 ILE 17 HD13 ILE 17 -1.821 4.825 -2.872
136 H ALA 18 H ALA 18 2.348 7.946 -2.725
137 HA ALA 18 HA ALA 18 1.650 10.676 -3.219
138 HB1 ALA 18 HB1 ALA 18 2.863 11.171 -1.195
139 HB2 ALA 18 HB2 ALA 18 1.880 9.727 -0.948
140 HB3 ALA 18 HB3 ALA 18 3.617 9.576 -1.216
141 H GLU 19 H GLU 19 4.111 8.668 -4.355
142 HA GLU 19 HA GLU 19 6.197 10.617 -4.566
143 HB2 GLU 19 HB2 GLU 19 6.297 7.988 -4.626
144 HB3 GLU 19 HB3 GLU 19 6.052 8.221 -6.351
145 HG2 GLU 19 HG2 GLU 19 8.044 9.607 -6.466
146 HG3 GLU 19 HG3 GLU 19 8.283 9.426 -4.729
147 H HIS 20 H HIS 20 3.912 9.182 -6.886
148 HA HIS 20 HA HIS 20 4.729 10.945 -9.001
149 HB2 HIS 20 HB2 HIS 20 3.322 9.730 -10.374
150 HB3 HIS 20 HB3 HIS 20 3.677 8.539 -9.127
151 HD1 HIS 20 HD1 HIS 20 0.923 10.592 -10.545
152 HD2 HIS 20 HD2 HIS 20 1.522 7.950 -7.394
153 HE1 HIS 20 HE1 HIS 20 -1.377 10.001 -9.716
154 H PHE 21 H PHE 21 2.399 11.013 -6.458
155 HA PHE 21 HA PHE 21 1.207 13.446 -7.618
156 HB2 PHE 21 HB2 PHE 21 -0.134 11.170 -6.918
157 HB3 PHE 21 HB3 PHE 21 -0.276 12.126 -5.446
158 HD1 PHE 21 HD1 PHE 21 -0.513 14.842 -6.451
159 HD2 PHE 21 HD2 PHE 21 -2.202 11.230 -7.939
160 HE1 PHE 21 HE1 PHE 21 -2.357 16.123 -7.459
161 HE2 PHE 21 HE2 PHE 21 -4.047 12.505 -8.950
162 HZ PHE 21 HZ PHE 21 -4.126 14.955 -8.711
163 HN1 NH2 22 HN1 NH2 22 3.802 13.389 -6.158
164 HN2 NH2 22 HN2 NH2 22 3.577 14.300 -4.633
Start of MODEL 11
1 H1 GLY 1 H1 GLY 1 -2.801 -18.150 -0.291
2 H2 GLY 1 H2 GLY 1 -1.624 -18.098 0.841
3 H3 GLY 1 H3 GLY 1 -2.742 -19.066 0.869
4 HA2 GLY 1 HA2 GLY 1 -4.322 -17.560 1.720
5 HA3 GLY 1 HA3 GLY 1 -2.826 -16.866 2.330
6 H LEU 2 H LEU 2 -5.605 -16.163 0.731
7 HA LEU 2 HA LEU 2 -4.907 -14.503 -1.375
8 HB2 LEU 2 HB2 LEU 2 -7.212 -15.203 -0.709
9 HB3 LEU 2 HB3 LEU 2 -7.145 -14.003 0.580
10 HG LEU 2 HG LEU 2 -6.653 -12.369 -1.433
11 HD11 LEU 2 HD11 LEU 2 -7.595 -12.965 -3.485
12 HD12 LEU 2 HD12 LEU 2 -8.417 -14.369 -2.807
13 HD13 LEU 2 HD13 LEU 2 -6.665 -14.385 -3.008
14 HD21 LEU 2 HD21 LEU 2 -8.671 -12.638 0.220
15 HD22 LEU 2 HD22 LEU 2 -9.487 -13.269 -1.211
16 HD23 LEU 2 HD23 LEU 2 -8.818 -11.637 -1.223
17 H PHE 3 H PHE 3 -5.780 -13.345 1.887
18 HA PHE 3 HA PHE 3 -4.879 -10.742 1.571
19 HB2 PHE 3 HB2 PHE 3 -5.966 -12.269 3.648
20 HB3 PHE 3 HB3 PHE 3 -4.430 -11.681 4.277
21 HD1 PHE 3 HD1 PHE 3 -3.989 -9.229 4.330
22 HD2 PHE 3 HD2 PHE 3 -7.817 -10.836 3.391
23 HE1 PHE 3 HE1 PHE 3 -5.018 -7.044 4.801
24 HE2 PHE 3 HE2 PHE 3 -8.851 -8.654 3.859
25 HZ PHE 3 HZ PHE 3 -7.452 -6.754 4.564
26 H GLY 4 H GLY 4 -3.092 -13.655 2.216
27 HA2 GLY 4 HA2 GLY 4 -0.756 -12.713 3.342
28 HA3 GLY 4 HA3 GLY 4 -0.831 -14.061 2.217
29 H VAL 5 H VAL 5 -1.855 -12.386 0.033
30 HA VAL 5 HA VAL 5 0.714 -11.231 -0.763
31 HB VAL 5 HB VAL 5 -1.723 -11.873 -2.429
32 HG11 VAL 5 HG11 VAL 5 -0.107 -11.554 -4.334
33 HG12 VAL 5 HG12 VAL 5 -0.574 -10.081 -3.481
34 HG13 VAL 5 HG13 VAL 5 0.998 -10.821 -3.172
35 HG21 VAL 5 HG21 VAL 5 0.856 -13.327 -1.928
36 HG22 VAL 5 HG22 VAL 5 -0.796 -13.927 -1.772
37 HG23 VAL 5 HG23 VAL 5 -0.115 -13.620 -3.370
38 H LEU 6 H LEU 6 -2.507 -10.334 0.079
39 HA LEU 6 HA LEU 6 -2.849 -7.927 -1.242
40 HB2 LEU 6 HB2 LEU 6 -3.799 -9.063 1.325
41 HB3 LEU 6 HB3 LEU 6 -3.997 -7.328 1.092
42 HG LEU 6 HG LEU 6 -5.111 -9.479 -0.708
43 HD11 LEU 6 HD11 LEU 6 -6.560 -9.649 1.017
44 HD12 LEU 6 HD12 LEU 6 -7.254 -8.208 0.274
45 HD13 LEU 6 HD13 LEU 6 -6.165 -8.051 1.652
46 HD21 LEU 6 HD21 LEU 6 -4.616 -6.715 -1.159
47 HD22 LEU 6 HD22 LEU 6 -6.358 -6.958 -1.046
48 HD23 LEU 6 HD23 LEU 6 -5.413 -7.881 -2.215
49 H ALA 7 H ALA 7 -0.737 -8.716 1.398
50 HA ALA 7 HA ALA 7 -0.254 -6.163 2.440
51 HB1 ALA 7 HB1 ALA 7 2.079 -7.932 2.357
52 HB2 ALA 7 HB2 ALA 7 1.258 -7.193 3.734
53 HB3 ALA 7 HB3 ALA 7 0.622 -8.674 3.018
54 H LYS 8 H LYS 8 0.805 -7.671 -0.496
55 HA LYS 8 HA LYS 8 3.076 -6.084 -1.024
56 HB2 LYS 8 HB2 LYS 8 1.879 -8.222 -2.240
57 HB3 LYS 8 HB3 LYS 8 1.505 -6.923 -3.365
58 HG2 LYS 8 HG2 LYS 8 4.059 -6.392 -3.115
59 HG3 LYS 8 HG3 LYS 8 4.140 -8.081 -2.608
60 HD2 LYS 8 HD2 LYS 8 2.541 -8.162 -4.856
61 HD3 LYS 8 HD3 LYS 8 3.750 -6.941 -5.259
62 HE2 LYS 8 HE2 LYS 8 5.493 -8.604 -4.492
63 HE3 LYS 8 HE3 LYS 8 4.203 -9.804 -4.446
64 HZ1 LYS 8 HZ1 LYS 8 4.388 -8.296 -6.910
65 HZ2 LYS 8 HZ2 LYS 8 4.154 -9.954 -6.668
66 HZ3 LYS 8 HZ3 LYS 8 5.713 -9.301 -6.595
67 H VAL 9 H VAL 9 -0.227 -5.321 -0.982
68 HA VAL 9 HA VAL 9 0.348 -2.715 -2.195
69 HB VAL 9 HB VAL 9 -0.732 -4.107 -3.935
70 HG11 VAL 9 HG11 VAL 9 -2.727 -5.178 -3.681
71 HG12 VAL 9 HG12 VAL 9 -2.144 -5.275 -2.019
72 HG13 VAL 9 HG13 VAL 9 -3.314 -4.036 -2.472
73 HG21 VAL 9 HG21 VAL 9 -2.032 -2.395 -4.724
74 HG22 VAL 9 HG22 VAL 9 -2.790 -2.101 -3.159
75 HG23 VAL 9 HG23 VAL 9 -1.142 -1.547 -3.459
76 H ALA 10 H ALA 10 0.313 -3.011 0.461
77 HA ALA 10 HA ALA 10 -1.753 -1.268 1.289
78 HB1 ALA 10 HB1 ALA 10 -2.093 -3.762 2.814
79 HB2 ALA 10 HB2 ALA 10 -3.289 -2.577 2.288
80 HB3 ALA 10 HB3 ALA 10 -2.699 -3.793 1.157
81 HB2 I4G 11 HB2 I4G 11 -0.436 0.219 1.157
82 HB3 I4G 11 HB3 I4G 11 0.435 1.255 2.071
83 HG I4G 11 HG I4G 11 -2.207 0.436 3.101
84 HD13 I4G 11 HD13 I4G 11 -0.693 3.107 3.185
85 HD11 I4G 11 HD11 I4G 11 -2.247 2.788 3.977
86 HD12 I4G 11 HD12 I4G 11 -0.793 1.936 4.506
87 HD23 I4G 11 HD23 I4G 11 -2.662 0.986 0.718
88 HD22 I4G 11 HD22 I4G 11 -1.862 2.554 0.914
89 HD21 I4G 11 HD21 I4G 11 -3.363 2.205 1.791
90 HA2 I4G 11 HA2 I4G 11 1.513 -1.027 4.330
91 HA3 I4G 11 HA3 I4G 11 0.752 0.392 4.605
92 H HIS 12 H HIS 12 2.235 -0.541 1.676
93 HA HIS 12 HA HIS 12 4.245 1.581 2.060
94 HB2 HIS 12 HB2 HIS 12 5.507 0.181 0.250
95 HB3 HIS 12 HB3 HIS 12 5.541 -0.340 1.931
96 HD1 HIS 12 HD1 HIS 12 5.585 -2.818 1.800
97 HD2 HIS 12 HD2 HIS 12 2.758 -1.170 -0.761
98 HE1 HIS 12 HE1 HIS 12 4.345 -4.773 0.820
99 H VAL 13 H VAL 13 1.539 0.647 0.334
100 HA VAL 13 HA VAL 13 2.053 1.492 -2.274
101 HB VAL 13 HB VAL 13 -0.555 1.763 -0.773
102 HG11 VAL 13 HG11 VAL 13 0.251 2.248 -3.542
103 HG12 VAL 13 HG12 VAL 13 -1.152 1.188 -3.377
104 HG13 VAL 13 HG13 VAL 13 -1.174 2.799 -2.661
105 HG21 VAL 13 HG21 VAL 13 0.522 -0.544 -2.393
106 HG22 VAL 13 HG22 VAL 13 0.304 -0.514 -0.642
107 HG23 VAL 13 HG23 VAL 13 -1.101 -0.438 -1.707
108 H VAL 14 H VAL 14 0.711 3.348 0.454
109 HA VAL 14 HA VAL 14 0.334 5.781 -0.782
110 HB VAL 14 HB VAL 14 1.321 5.321 2.037
111 HG11 VAL 14 HG11 VAL 14 1.483 7.539 2.144
112 HG12 VAL 14 HG12 VAL 14 0.756 7.737 0.548
113 HG13 VAL 14 HG13 VAL 14 -0.271 7.593 1.974
114 HG21 VAL 14 HG21 VAL 14 -0.774 4.138 1.465
115 HG22 VAL 14 HG22 VAL 14 -1.003 5.390 2.686
116 HG23 VAL 14 HG23 VAL 14 -1.494 5.685 1.018
117 H GLY 15 H GLY 15 3.319 4.423 0.535
118 HA2 GLY 15 HA2 GLY 15 4.947 6.683 0.361
119 HA3 GLY 15 HA3 GLY 15 5.515 5.024 0.248
120 H ALA 16 H ALA 16 3.806 4.545 -2.141
121 HA ALA 16 HA ALA 16 5.663 5.679 -4.090
122 HB1 ALA 16 HB1 ALA 16 5.206 3.895 -5.450
123 HB2 ALA 16 HB2 ALA 16 4.917 3.169 -3.868
124 HB3 ALA 16 HB3 ALA 16 3.557 3.718 -4.849
125 H ILE 17 H ILE 17 2.162 5.368 -3.563
126 HA ILE 17 HA ILE 17 1.287 6.765 -5.805
127 HB ILE 17 HB ILE 17 -0.006 6.716 -3.076
128 HG12 ILE 17 HG12 ILE 17 0.386 4.461 -3.898
129 HG13 ILE 17 HG13 ILE 17 -1.330 4.839 -4.005
130 HG21 ILE 17 HG21 ILE 17 -1.079 7.403 -5.803
131 HG22 ILE 17 HG22 ILE 17 -2.099 7.068 -4.405
132 HG23 ILE 17 HG23 ILE 17 -0.997 8.444 -4.382
133 HD11 ILE 17 HD11 ILE 17 0.671 4.749 -6.243
134 HD12 ILE 17 HD12 ILE 17 -0.720 3.694 -5.986
135 HD13 ILE 17 HD13 ILE 17 -0.963 5.387 -6.415
136 H ALA 18 H ALA 18 2.418 7.939 -2.692
137 HA ALA 18 HA ALA 18 1.668 10.663 -3.160
138 HB1 ALA 18 HB1 ALA 18 2.720 11.161 -1.110
139 HB2 ALA 18 HB2 ALA 18 1.996 9.565 -0.901
140 HB3 ALA 18 HB3 ALA 18 3.730 9.716 -1.189
141 H GLU 19 H GLU 19 4.124 8.708 -4.357
142 HA GLU 19 HA GLU 19 6.190 10.689 -4.548
143 HB2 GLU 19 HB2 GLU 19 6.334 8.060 -4.618
144 HB3 GLU 19 HB3 GLU 19 6.084 8.298 -6.341
145 HG2 GLU 19 HG2 GLU 19 8.037 9.900 -6.271
146 HG3 GLU 19 HG3 GLU 19 8.351 9.294 -4.645
147 H HIS 20 H HIS 20 3.912 9.228 -6.858
148 HA HIS 20 HA HIS 20 4.696 11.002 -8.978
149 HB2 HIS 20 HB2 HIS 20 3.292 9.773 -10.340
150 HB3 HIS 20 HB3 HIS 20 3.666 8.585 -9.096
151 HD1 HIS 20 HD1 HIS 20 0.882 10.588 -10.512
152 HD2 HIS 20 HD2 HIS 20 1.530 7.998 -7.329
153 HE1 HIS 20 HE1 HIS 20 -1.406 9.983 -9.663
154 H PHE 21 H PHE 21 2.385 11.047 -6.417
155 HA PHE 21 HA PHE 21 1.193 13.492 -7.550
156 HB2 PHE 21 HB2 PHE 21 -0.134 11.161 -6.851
157 HB3 PHE 21 HB3 PHE 21 -0.383 12.207 -5.457
158 HD1 PHE 21 HD2 PHE 21 -0.507 12.384 -9.182
159 HD2 PHE 21 HD1 PHE 21 -2.216 13.581 -5.473
160 HE1 PHE 21 HE2 PHE 21 -2.298 13.559 -10.392
161 HE2 PHE 21 HE1 PHE 21 -4.012 14.758 -6.677
162 HZ PHE 21 HZ PHE 21 -4.053 14.748 -9.139
163 HN1 NH2 22 HN1 NH2 22 3.756 13.378 -6.025
164 HN2 NH2 22 HN2 NH2 22 3.495 14.249 -4.482
Start of MODEL 12
1 H1 GLY 1 H1 GLY 1 -3.564 -17.620 3.209
2 H2 GLY 1 H2 GLY 1 -4.482 -16.384 2.664
3 H3 GLY 1 H3 GLY 1 -4.838 -17.808 2.482
4 HA2 GLY 1 HA2 GLY 1 -2.223 -17.279 1.420
5 HA3 GLY 1 HA3 GLY 1 -3.546 -18.081 0.586
6 H LEU 2 H LEU 2 -5.500 -16.157 0.612
7 HA LEU 2 HA LEU 2 -4.773 -14.535 -1.554
8 HB2 LEU 2 HB2 LEU 2 -7.108 -15.289 -0.527
9 HB3 LEU 2 HB3 LEU 2 -7.013 -13.685 0.195
10 HG LEU 2 HG LEU 2 -6.598 -12.890 -2.241
11 HD11 LEU 2 HD11 LEU 2 -7.644 -14.268 -3.938
12 HD12 LEU 2 HD12 LEU 2 -7.981 -15.521 -2.744
13 HD13 LEU 2 HD13 LEU 2 -6.315 -15.142 -3.178
14 HD21 LEU 2 HD21 LEU 2 -8.940 -12.532 -2.535
15 HD22 LEU 2 HD22 LEU 2 -8.599 -12.454 -0.806
16 HD23 LEU 2 HD23 LEU 2 -9.337 -13.900 -1.496
17 H PHE 3 H PHE 3 -5.614 -13.475 1.750
18 HA PHE 3 HA PHE 3 -4.778 -10.833 1.459
19 HB2 PHE 3 HB2 PHE 3 -5.772 -12.468 3.547
20 HB3 PHE 3 HB3 PHE 3 -4.304 -11.707 4.152
21 HD1 PHE 3 HD1 PHE 3 -4.154 -9.287 4.364
22 HD2 PHE 3 HD2 PHE 3 -7.732 -11.179 3.043
23 HE1 PHE 3 HE1 PHE 3 -5.404 -7.211 4.788
24 HE2 PHE 3 HE2 PHE 3 -8.987 -9.104 3.464
25 HZ PHE 3 HZ PHE 3 -7.824 -7.117 4.336
26 H GLY 4 H GLY 4 -2.954 -13.733 2.060
27 HA2 GLY 4 HA2 GLY 4 -0.631 -12.778 3.202
28 HA3 GLY 4 HA3 GLY 4 -0.688 -14.111 2.057
29 H VAL 5 H VAL 5 -1.735 -12.411 -0.099
30 HA VAL 5 HA VAL 5 0.821 -11.216 -0.878
31 HB VAL 5 HB VAL 5 -1.610 -11.859 -2.554
32 HG11 VAL 5 HG11 VAL 5 0.335 -11.590 -4.350
33 HG12 VAL 5 HG12 VAL 5 -0.663 -10.230 -3.828
34 HG13 VAL 5 HG13 VAL 5 0.942 -10.468 -3.134
35 HG21 VAL 5 HG21 VAL 5 -0.801 -13.914 -2.813
36 HG22 VAL 5 HG22 VAL 5 0.804 -13.297 -3.202
37 HG23 VAL 5 HG23 VAL 5 0.345 -13.561 -1.520
38 H LEU 6 H LEU 6 -2.410 -10.369 -0.023
39 HA LEU 6 HA LEU 6 -2.780 -7.945 -1.304
40 HB2 LEU 6 HB2 LEU 6 -3.726 -9.149 1.228
41 HB3 LEU 6 HB3 LEU 6 -3.921 -7.406 1.058
42 HG LEU 6 HG LEU 6 -5.037 -9.483 -0.827
43 HD11 LEU 6 HD11 LEU 6 -7.195 -8.334 0.194
44 HD12 LEU 6 HD12 LEU 6 -6.119 -8.115 1.572
45 HD13 LEU 6 HD13 LEU 6 -6.433 -9.734 0.949
46 HD21 LEU 6 HD21 LEU 6 -6.399 -7.361 -1.488
47 HD22 LEU 6 HD22 LEU 6 -4.785 -7.613 -2.153
48 HD23 LEU 6 HD23 LEU 6 -5.020 -6.496 -0.808
49 H ALA 7 H ALA 7 -0.662 -8.752 1.326
50 HA ALA 7 HA ALA 7 -0.207 -6.210 2.406
51 HB1 ALA 7 HB1 ALA 7 1.626 -7.131 3.500
52 HB2 ALA 7 HB2 ALA 7 0.572 -8.523 3.236
53 HB3 ALA 7 HB3 ALA 7 1.966 -8.260 2.188
54 H LYS 8 H LYS 8 0.869 -7.658 -0.553
55 HA LYS 8 HA LYS 8 3.119 -6.032 -1.055
56 HB2 LYS 8 HB2 LYS 8 1.951 -8.170 -2.303
57 HB3 LYS 8 HB3 LYS 8 1.567 -6.859 -3.411
58 HG2 LYS 8 HG2 LYS 8 4.352 -6.936 -2.481
59 HG3 LYS 8 HG3 LYS 8 3.847 -8.297 -3.484
60 HD2 LYS 8 HD2 LYS 8 3.045 -5.612 -4.420
61 HD3 LYS 8 HD3 LYS 8 4.771 -5.978 -4.483
62 HE2 LYS 8 HE2 LYS 8 4.442 -7.139 -6.346
63 HE3 LYS 8 HE3 LYS 8 3.389 -8.243 -5.461
64 HZ1 LYS 8 HZ1 LYS 8 2.670 -5.918 -7.111
65 HZ2 LYS 8 HZ2 LYS 8 1.638 -6.397 -5.859
66 HZ3 LYS 8 HZ3 LYS 8 2.010 -7.474 -7.109
67 H VAL 9 H VAL 9 -0.190 -5.312 -0.997
68 HA VAL 9 HA VAL 9 0.345 -2.688 -2.186
69 HB VAL 9 HB VAL 9 -0.731 -4.072 -3.932
70 HG11 VAL 9 HG11 VAL 9 -2.387 -4.865 -1.746
71 HG12 VAL 9 HG12 VAL 9 -3.395 -4.148 -3.005
72 HG13 VAL 9 HG13 VAL 9 -2.336 -5.506 -3.389
73 HG21 VAL 9 HG21 VAL 9 -2.815 -2.110 -3.119
74 HG22 VAL 9 HG22 VAL 9 -1.179 -1.522 -3.414
75 HG23 VAL 9 HG23 VAL 9 -2.056 -2.366 -4.691
76 H ALA 10 H ALA 10 0.338 -2.998 0.465
77 HA ALA 10 HA ALA 10 -1.740 -1.289 1.328
78 HB1 ALA 10 HB1 ALA 10 -3.025 -3.410 1.157
79 HB2 ALA 10 HB2 ALA 10 -1.961 -4.105 2.380
80 HB3 ALA 10 HB3 ALA 10 -2.990 -2.730 2.784
81 HB2 I4G 11 HB2 I4G 11 -0.439 0.214 1.208
82 HB3 I4G 11 HB3 I4G 11 0.420 1.249 2.135
83 HG I4G 11 HG I4G 11 -2.222 0.371 3.132
84 HD13 I4G 11 HD13 I4G 11 -0.718 3.042 3.338
85 HD11 I4G 11 HD11 I4G 11 -2.279 2.685 4.103
86 HD12 I4G 11 HD12 I4G 11 -0.827 1.817 4.610
87 HD23 I4G 11 HD23 I4G 11 -2.657 1.016 0.770
88 HD22 I4G 11 HD22 I4G 11 -1.865 2.578 1.036
89 HD21 I4G 11 HD21 I4G 11 -3.373 2.187 1.884
90 HA2 I4G 11 HA2 I4G 11 1.534 -1.052 4.358
91 HA3 I4G 11 HA3 I4G 11 0.768 0.361 4.646
92 H HIS 12 H HIS 12 2.229 -0.528 1.694
93 HA HIS 12 HA HIS 12 4.229 1.601 2.086
94 HB2 HIS 12 HB2 HIS 12 5.495 0.223 0.264
95 HB3 HIS 12 HB3 HIS 12 5.542 -0.308 1.943
96 HD1 HIS 12 HD1 HIS 12 5.600 -2.784 1.805
97 HD2 HIS 12 HD2 HIS 12 2.761 -1.147 -0.750
98 HE1 HIS 12 HE1 HIS 12 4.374 -4.745 0.817
99 H VAL 13 H VAL 13 1.517 0.670 0.377
100 HA VAL 13 HA VAL 13 2.022 1.535 -2.231
101 HB VAL 13 HB VAL 13 -0.592 1.760 -0.733
102 HG11 VAL 13 HG11 VAL 13 0.091 2.668 -3.265
103 HG12 VAL 13 HG12 VAL 13 -0.730 1.133 -3.554
104 HG13 VAL 13 HG13 VAL 13 -1.538 2.409 -2.641
105 HG21 VAL 13 HG21 VAL 13 0.522 -0.533 -2.345
106 HG22 VAL 13 HG22 VAL 13 0.301 -0.503 -0.596
107 HG23 VAL 13 HG23 VAL 13 -1.102 -0.449 -1.664
108 H VAL 14 H VAL 14 0.739 3.340 0.553
109 HA VAL 14 HA VAL 14 0.261 5.779 -0.636
110 HB VAL 14 HB VAL 14 1.384 5.303 2.129
111 HG11 VAL 14 HG11 VAL 14 1.674 7.608 1.553
112 HG12 VAL 14 HG12 VAL 14 0.030 7.708 0.918
113 HG13 VAL 14 HG13 VAL 14 0.297 7.486 2.648
114 HG21 VAL 14 HG21 VAL 14 -0.718 4.098 1.641
115 HG22 VAL 14 HG22 VAL 14 -0.914 5.336 2.881
116 HG23 VAL 14 HG23 VAL 14 -1.479 5.636 1.237
117 H GLY 15 H GLY 15 3.321 4.580 0.720
118 HA2 GLY 15 HA2 GLY 15 4.864 6.871 0.360
119 HA3 GLY 15 HA3 GLY 15 5.492 5.230 0.354
120 H ALA 16 H ALA 16 3.681 4.626 -1.992
121 HA ALA 16 HA ALA 16 5.548 5.572 -4.026
122 HB1 ALA 16 HB1 ALA 16 3.442 3.790 -4.946
123 HB2 ALA 16 HB2 ALA 16 5.195 3.627 -5.060
124 HB3 ALA 16 HB3 ALA 16 4.357 3.127 -3.590
125 H ILE 17 H ILE 17 2.028 5.388 -3.515
126 HA ILE 17 HA ILE 17 1.227 6.767 -5.793
127 HB ILE 17 HB ILE 17 -0.100 6.785 -3.080
128 HG12 ILE 17 HG12 ILE 17 -0.559 4.994 -5.477
129 HG13 ILE 17 HG13 ILE 17 0.281 4.520 -4.004
130 HG21 ILE 17 HG21 ILE 17 -0.725 8.187 -5.474
131 HG22 ILE 17 HG22 ILE 17 -1.957 6.955 -5.210
132 HG23 ILE 17 HG23 ILE 17 -1.619 8.146 -3.954
133 HD11 ILE 17 HD11 ILE 17 -2.031 3.715 -4.080
134 HD12 ILE 17 HD12 ILE 17 -1.746 4.806 -2.723
135 HD13 ILE 17 HD13 ILE 17 -2.597 5.384 -4.155
136 H ALA 18 H ALA 18 2.338 7.972 -2.684
137 HA ALA 18 HA ALA 18 1.666 10.704 -3.204
138 HB1 ALA 18 HB1 ALA 18 2.884 11.206 -1.185
139 HB2 ALA 18 HB2 ALA 18 1.890 9.773 -0.924
140 HB3 ALA 18 HB3 ALA 18 3.625 9.605 -1.192
141 H GLU 19 H GLU 19 4.107 8.666 -4.323
142 HA GLU 19 HA GLU 19 6.210 10.593 -4.555
143 HB2 GLU 19 HB2 GLU 19 6.289 7.963 -4.588
144 HB3 GLU 19 HB3 GLU 19 6.042 8.182 -6.315
145 HG2 GLU 19 HG2 GLU 19 8.056 9.439 -6.520
146 HG3 GLU 19 HG3 GLU 19 8.258 9.500 -4.770
147 H HIS 20 H HIS 20 3.909 9.156 -6.857
148 HA HIS 20 HA HIS 20 4.738 10.896 -8.991
149 HB2 HIS 20 HB2 HIS 20 3.327 9.675 -10.352
150 HB3 HIS 20 HB3 HIS 20 3.672 8.493 -9.092
151 HD1 HIS 20 HD1 HIS 20 0.934 10.539 -10.545
152 HD2 HIS 20 HD2 HIS 20 1.510 7.948 -7.349
153 HE1 HIS 20 HE1 HIS 20 -1.371 9.975 -9.713
154 H PHE 21 H PHE 21 2.410 11.000 -6.447
155 HA PHE 21 HA PHE 21 1.252 13.444 -7.617
156 HB2 PHE 21 HB2 PHE 21 -0.111 11.156 -6.911
157 HB3 PHE 21 HB3 PHE 21 -0.314 12.177 -5.491
158 HD1 PHE 21 HD2 PHE 21 -0.387 12.617 -9.201
159 HD2 PHE 21 HD1 PHE 21 -2.244 13.400 -5.451
160 HE1 PHE 21 HE2 PHE 21 -2.180 13.849 -10.349
161 HE2 PHE 21 HE1 PHE 21 -4.040 14.632 -6.594
162 HZ PHE 21 HZ PHE 21 -4.009 14.860 -9.046
163 HN1 NH2 22 HN1 NH2 22 3.812 13.399 -6.139
164 HN2 NH2 22 HN2 NH2 22 3.569 14.278 -4.598
Start of MODEL 13
1 H1 GLY 1 H1 GLY 1 -1.381 -17.325 1.838
2 H2 GLY 1 H2 GLY 1 -1.959 -18.681 1.135
3 H3 GLY 1 H3 GLY 1 -1.538 -17.484 0.376
4 HA2 GLY 1 HA2 GLY 1 -4.094 -17.955 1.026
5 HA3 GLY 1 HA3 GLY 1 -3.579 -16.955 2.374
6 H LEU 2 H LEU 2 -5.622 -16.085 0.820
7 HA LEU 2 HA LEU 2 -4.906 -14.502 -1.390
8 HB2 LEU 2 HB2 LEU 2 -7.233 -15.238 -0.435
9 HB3 LEU 2 HB3 LEU 2 -7.134 -13.704 0.428
10 HG LEU 2 HG LEU 2 -6.564 -13.018 -2.192
11 HD11 LEU 2 HD11 LEU 2 -8.876 -14.950 -2.196
12 HD12 LEU 2 HD12 LEU 2 -7.284 -15.294 -2.870
13 HD13 LEU 2 HD13 LEU 2 -8.273 -14.004 -3.557
14 HD21 LEU 2 HD21 LEU 2 -7.952 -11.821 -0.514
15 HD22 LEU 2 HD22 LEU 2 -9.260 -12.957 -0.842
16 HD23 LEU 2 HD23 LEU 2 -8.681 -11.887 -2.119
17 H PHE 3 H PHE 3 -5.742 -13.379 1.894
18 HA PHE 3 HA PHE 3 -4.875 -10.756 1.571
19 HB2 PHE 3 HB2 PHE 3 -6.174 -11.973 3.528
20 HB3 PHE 3 HB3 PHE 3 -4.564 -12.076 4.232
21 HD1 PHE 3 HD1 PHE 3 -3.235 -9.891 4.434
22 HD2 PHE 3 HD2 PHE 3 -7.436 -10.045 3.767
23 HE1 PHE 3 HE1 PHE 3 -3.447 -7.583 5.261
24 HE2 PHE 3 HE2 PHE 3 -7.654 -7.737 4.592
25 HZ PHE 3 HZ PHE 3 -5.658 -6.503 5.339
26 H GLY 4 H GLY 4 -3.073 -13.663 2.201
27 HA2 GLY 4 HA2 GLY 4 -0.737 -12.713 3.321
28 HA3 GLY 4 HA3 GLY 4 -0.809 -14.059 2.194
29 H VAL 5 H VAL 5 -1.848 -12.384 0.018
30 HA VAL 5 HA VAL 5 0.713 -11.216 -0.784
31 HB VAL 5 HB VAL 5 -1.727 -11.866 -2.445
32 HG11 VAL 5 HG11 VAL 5 -0.801 -10.325 -3.806
33 HG12 VAL 5 HG12 VAL 5 0.780 -10.429 -3.028
34 HG13 VAL 5 HG13 VAL 5 0.296 -11.644 -4.211
35 HG21 VAL 5 HG21 VAL 5 -0.581 -13.850 -1.572
36 HG22 VAL 5 HG22 VAL 5 -0.395 -13.709 -3.320
37 HG23 VAL 5 HG23 VAL 5 0.939 -13.269 -2.254
38 H LEU 6 H LEU 6 -2.509 -10.335 0.071
39 HA LEU 6 HA LEU 6 -2.868 -7.928 -1.244
40 HB2 LEU 6 HB2 LEU 6 -3.807 -9.083 1.314
41 HB3 LEU 6 HB3 LEU 6 -3.996 -7.343 1.111
42 HG LEU 6 HG LEU 6 -5.116 -9.435 -0.753
43 HD11 LEU 6 HD11 LEU 6 -6.565 -9.727 0.944
44 HD12 LEU 6 HD12 LEU 6 -7.256 -8.220 0.344
45 HD13 LEU 6 HD13 LEU 6 -6.144 -8.195 1.711
46 HD21 LEU 6 HD21 LEU 6 -5.479 -7.765 -2.165
47 HD22 LEU 6 HD22 LEU 6 -4.665 -6.649 -1.067
48 HD23 LEU 6 HD23 LEU 6 -6.405 -6.913 -0.928
49 H ALA 7 H ALA 7 -0.743 -8.709 1.388
50 HA ALA 7 HA ALA 7 -0.264 -6.157 2.429
51 HB1 ALA 7 HB1 ALA 7 0.655 -7.758 3.763
52 HB2 ALA 7 HB2 ALA 7 1.219 -8.727 2.401
53 HB3 ALA 7 HB3 ALA 7 2.096 -7.271 2.870
54 H LYS 8 H LYS 8 0.786 -7.652 -0.515
55 HA LYS 8 HA LYS 8 3.043 -6.050 -1.056
56 HB2 LYS 8 HB2 LYS 8 1.847 -8.191 -2.270
57 HB3 LYS 8 HB3 LYS 8 1.460 -6.890 -3.389
58 HG2 LYS 8 HG2 LYS 8 4.261 -7.052 -2.462
59 HG3 LYS 8 HG3 LYS 8 3.700 -8.328 -3.543
60 HD2 LYS 8 HD2 LYS 8 2.734 -5.963 -4.660
61 HD3 LYS 8 HD3 LYS 8 4.374 -5.580 -4.130
62 HE2 LYS 8 HE2 LYS 8 4.865 -7.932 -5.272
63 HE3 LYS 8 HE3 LYS 8 3.433 -7.488 -6.200
64 HZ1 LYS 8 HZ1 LYS 8 6.055 -6.157 -6.087
65 HZ2 LYS 8 HZ2 LYS 8 4.679 -5.257 -6.485
66 HZ3 LYS 8 HZ3 LYS 8 5.128 -6.581 -7.437
67 H VAL 9 H VAL 9 -0.262 -5.302 -0.987
68 HA VAL 9 HA VAL 9 0.290 -2.693 -2.203
69 HB VAL 9 HB VAL 9 -0.811 -4.090 -3.927
70 HG11 VAL 9 HG11 VAL 9 -2.437 -5.490 -3.365
71 HG12 VAL 9 HG12 VAL 9 -2.459 -4.842 -1.724
72 HG13 VAL 9 HG13 VAL 9 -3.470 -4.115 -2.975
73 HG21 VAL 9 HG21 VAL 9 -2.121 -2.381 -4.700
74 HG22 VAL 9 HG22 VAL 9 -2.863 -2.089 -3.127
75 HG23 VAL 9 HG23 VAL 9 -1.221 -1.531 -3.445
76 H ALA 10 H ALA 10 0.292 -2.994 0.455
77 HA ALA 10 HA ALA 10 -1.766 -1.254 1.311
78 HB1 ALA 10 HB1 ALA 10 -2.458 -3.185 3.095
79 HB2 ALA 10 HB2 ALA 10 -3.377 -2.780 1.644
80 HB3 ALA 10 HB3 ALA 10 -2.242 -4.130 1.622
81 HB2 I4G 11 HB2 I4G 11 -0.454 0.234 1.162
82 HB3 I4G 11 HB3 I4G 11 0.429 1.271 2.063
83 HG I4G 11 HG I4G 11 -2.217 0.442 3.093
84 HD13 I4G 11 HD13 I4G 11 -0.667 3.088 3.276
85 HD11 I4G 11 HD11 I4G 11 -2.229 2.762 4.051
86 HD12 I4G 11 HD12 I4G 11 -0.789 1.872 4.554
87 HD23 I4G 11 HD23 I4G 11 -2.658 1.082 0.730
88 HD22 I4G 11 HD22 I4G 11 -1.837 2.631 0.983
89 HD21 I4G 11 HD21 I4G 11 -3.346 2.272 1.843
90 HA2 I4G 11 HA2 I4G 11 1.541 -1.008 4.307
91 HA3 I4G 11 HA3 I4G 11 0.782 0.409 4.594
92 H HIS 12 H HIS 12 2.227 -0.520 1.644
93 HA HIS 12 HA HIS 12 4.236 1.607 2.003
94 HB2 HIS 12 HB2 HIS 12 5.470 0.208 0.168
95 HB3 HIS 12 HB3 HIS 12 5.540 -0.304 1.851
96 HD1 HIS 12 HD1 HIS 12 5.559 -2.780 1.770
97 HD2 HIS 12 HD2 HIS 12 2.741 -1.162 -0.818
98 HE1 HIS 12 HE1 HIS 12 4.316 -4.746 0.815
99 H VAL 13 H VAL 13 1.509 0.667 0.311
100 HA VAL 13 HA VAL 13 1.987 1.518 -2.301
101 HB VAL 13 HB VAL 13 -0.602 1.779 -0.766
102 HG11 VAL 13 HG11 VAL 13 -0.834 1.155 -3.569
103 HG12 VAL 13 HG12 VAL 13 -1.548 2.483 -2.651
104 HG13 VAL 13 HG13 VAL 13 0.071 2.649 -3.332
105 HG21 VAL 13 HG21 VAL 13 -1.153 -0.421 -1.693
106 HG22 VAL 13 HG22 VAL 13 0.457 -0.524 -2.405
107 HG23 VAL 13 HG23 VAL 13 0.269 -0.495 -0.651
108 H VAL 14 H VAL 14 0.764 3.361 0.484
109 HA VAL 14 HA VAL 14 0.303 5.797 -0.720
110 HB VAL 14 HB VAL 14 1.454 5.332 2.035
111 HG11 VAL 14 HG11 VAL 14 1.745 7.584 1.823
112 HG12 VAL 14 HG12 VAL 14 0.450 7.752 0.635
113 HG13 VAL 14 HG13 VAL 14 0.061 7.561 2.345
114 HG21 VAL 14 HG21 VAL 14 -1.417 5.690 1.184
115 HG22 VAL 14 HG22 VAL 14 -0.670 4.141 1.576
116 HG23 VAL 14 HG23 VAL 14 -0.828 5.383 2.818
117 H GLY 15 H GLY 15 3.365 4.524 0.544
118 HA2 GLY 15 HA2 GLY 15 4.942 6.798 0.187
119 HA3 GLY 15 HA3 GLY 15 5.538 5.146 0.149
120 H ALA 16 H ALA 16 3.699 4.567 -2.161
121 HA ALA 16 HA ALA 16 5.526 5.514 -4.225
122 HB1 ALA 16 HB1 ALA 16 5.256 3.423 -4.926
123 HB2 ALA 16 HB2 ALA 16 3.899 3.165 -3.829
124 HB3 ALA 16 HB3 ALA 16 3.625 3.872 -5.421
125 H ILE 17 H ILE 17 1.999 5.322 -3.731
126 HA ILE 17 HA ILE 17 1.231 6.806 -5.955
127 HB ILE 17 HB ILE 17 -0.149 6.692 -3.271
128 HG12 ILE 17 HG12 ILE 17 -0.531 4.993 -5.746
129 HG13 ILE 17 HG13 ILE 17 0.269 4.471 -4.268
130 HG21 ILE 17 HG21 ILE 17 -0.738 8.182 -5.621
131 HG22 ILE 17 HG22 ILE 17 -1.965 6.930 -5.427
132 HG23 ILE 17 HG23 ILE 17 -1.660 8.075 -4.121
133 HD11 ILE 17 HD11 ILE 17 -1.992 3.624 -4.369
134 HD12 ILE 17 HD12 ILE 17 -1.826 4.773 -3.042
135 HD13 ILE 17 HD13 ILE 17 -2.620 5.262 -4.538
136 H ALA 18 H ALA 18 2.292 7.861 -2.777
137 HA ALA 18 HA ALA 18 1.627 10.620 -3.214
138 HB1 ALA 18 HB1 ALA 18 3.588 9.707 -1.150
139 HB2 ALA 18 HB2 ALA 18 2.410 11.018 -1.074
140 HB3 ALA 18 HB3 ALA 18 1.871 9.342 -0.971
141 H GLU 19 H GLU 19 4.089 8.616 -4.309
142 HA GLU 19 HA GLU 19 6.214 10.551 -4.330
143 HB2 GLU 19 HB2 GLU 19 6.305 7.918 -4.400
144 HB3 GLU 19 HB3 GLU 19 6.190 8.170 -6.136
145 HG2 GLU 19 HG2 GLU 19 8.378 8.464 -6.180
146 HG3 GLU 19 HG3 GLU 19 8.154 9.949 -5.257
147 H HIS 20 H HIS 20 4.043 9.160 -6.777
148 HA HIS 20 HA HIS 20 5.013 10.920 -8.838
149 HB2 HIS 20 HB2 HIS 20 3.711 9.705 -10.300
150 HB3 HIS 20 HB3 HIS 20 3.941 8.516 -9.023
151 HD1 HIS 20 HD1 HIS 20 1.354 10.419 -10.808
152 HD2 HIS 20 HD2 HIS 20 1.639 8.172 -7.326
153 HE1 HIS 20 HE1 HIS 20 -1.017 9.928 -10.129
154 H PHE 21 H PHE 21 2.631 11.063 -6.384
155 HA PHE 21 HA PHE 21 1.245 13.282 -7.715
156 HB2 PHE 21 HB2 PHE 21 -0.184 11.488 -6.835
157 HB3 PHE 21 HB3 PHE 21 0.490 11.732 -5.227
158 HD1 PHE 21 HD2 PHE 21 -1.717 13.106 -7.806
159 HD2 PHE 21 HD1 PHE 21 -0.175 13.599 -3.870
160 HE1 PHE 21 HE2 PHE 21 -3.457 14.781 -7.339
161 HE2 PHE 21 HE1 PHE 21 -1.913 15.275 -3.395
162 HZ PHE 21 HZ PHE 21 -3.556 15.868 -5.132
163 HN1 NH2 22 HN1 NH2 22 1.891 12.529 -4.147
164 HN2 NH2 22 HN2 NH2 22 2.596 14.121 -3.731
Start of MODEL 14
1 H1 GLY 1 H1 GLY 1 -3.531 -16.145 2.895
2 H2 GLY 1 H2 GLY 1 -4.037 -17.539 3.579
3 H3 GLY 1 H3 GLY 1 -2.768 -17.410 2.829
4 HA2 GLY 1 HA2 GLY 1 -4.036 -18.342 1.102
5 HA3 GLY 1 HA3 GLY 1 -5.475 -17.611 1.796
6 H LEU 2 H LEU 2 -6.232 -15.743 0.964
7 HA LEU 2 HA LEU 2 -4.899 -14.726 -1.411
8 HB2 LEU 2 HB2 LEU 2 -7.574 -14.049 -0.198
9 HB3 LEU 2 HB3 LEU 2 -6.969 -13.431 -1.733
10 HG LEU 2 HG LEU 2 -8.456 -15.123 -2.334
11 HD11 LEU 2 HD11 LEU 2 -7.147 -16.633 -3.517
12 HD12 LEU 2 HD12 LEU 2 -5.919 -16.713 -2.254
13 HD13 LEU 2 HD13 LEU 2 -6.056 -15.272 -3.260
14 HD21 LEU 2 HD21 LEU 2 -8.190 -16.055 0.184
15 HD22 LEU 2 HD22 LEU 2 -7.303 -17.292 -0.708
16 HD23 LEU 2 HD23 LEU 2 -8.985 -16.943 -1.115
17 H PHE 3 H PHE 3 -5.476 -13.826 1.880
18 HA PHE 3 HA PHE 3 -4.892 -11.031 1.497
19 HB2 PHE 3 HB2 PHE 3 -5.890 -12.696 3.623
20 HB3 PHE 3 HB3 PHE 3 -4.566 -11.699 4.218
21 HD1 PHE 3 HD2 PHE 3 -7.752 -11.489 2.312
22 HD2 PHE 3 HD1 PHE 3 -4.962 -9.508 4.844
23 HE1 PHE 3 HE2 PHE 3 -9.287 -9.575 2.500
24 HE2 PHE 3 HE1 PHE 3 -6.492 -7.591 5.036
25 HZ PHE 3 HZ PHE 3 -8.658 -7.622 3.862
26 H GLY 4 H GLY 4 -3.129 -13.929 2.307
27 HA2 GLY 4 HA2 GLY 4 -0.861 -12.937 3.525
28 HA3 GLY 4 HA3 GLY 4 -0.870 -14.322 2.443
29 H VAL 5 H VAL 5 -1.798 -12.691 0.167
30 HA VAL 5 HA VAL 5 0.815 -11.576 -0.542
31 HB VAL 5 HB VAL 5 -1.554 -12.238 -2.298
32 HG11 VAL 5 HG11 VAL 5 1.101 -10.998 -2.844
33 HG12 VAL 5 HG12 VAL 5 0.385 -12.059 -4.056
34 HG13 VAL 5 HG13 VAL 5 -0.480 -10.618 -3.523
35 HG21 VAL 5 HG21 VAL 5 0.467 -13.882 -3.067
36 HG22 VAL 5 HG22 VAL 5 0.746 -13.786 -1.327
37 HG23 VAL 5 HG23 VAL 5 -0.815 -14.333 -1.943
38 H LEU 6 H LEU 6 -2.446 -10.639 0.107
39 HA LEU 6 HA LEU 6 -2.686 -8.254 -1.274
40 HB2 LEU 6 HB2 LEU 6 -3.817 -9.365 1.220
41 HB3 LEU 6 HB3 LEU 6 -3.950 -7.621 1.007
42 HG LEU 6 HG LEU 6 -5.009 -9.703 -0.905
43 HD11 LEU 6 HD11 LEU 6 -6.062 -8.733 1.542
44 HD12 LEU 6 HD12 LEU 6 -6.819 -9.806 0.366
45 HD13 LEU 6 HD13 LEU 6 -7.026 -8.060 0.228
46 HD21 LEU 6 HD21 LEU 6 -4.933 -6.713 -0.933
47 HD22 LEU 6 HD22 LEU 6 -6.257 -7.578 -1.714
48 HD23 LEU 6 HD23 LEU 6 -4.594 -7.855 -2.234
49 H ALA 7 H ALA 7 -0.742 -9.016 1.499
50 HA ALA 7 HA ALA 7 -0.304 -6.455 2.536
51 HB1 ALA 7 HB1 ALA 7 0.363 -8.492 3.701
52 HB2 ALA 7 HB2 ALA 7 1.597 -8.796 2.478
53 HB3 ALA 7 HB3 ALA 7 1.725 -7.386 3.527
54 H LYS 8 H LYS 8 0.943 -8.014 -0.305
55 HA LYS 8 HA LYS 8 3.246 -6.477 -0.739
56 HB2 LYS 8 HB2 LYS 8 2.064 -8.560 -2.024
57 HB3 LYS 8 HB3 LYS 8 1.700 -7.245 -3.135
58 HG2 LYS 8 HG2 LYS 8 4.427 -7.026 -2.384
59 HG3 LYS 8 HG3 LYS 8 4.112 -8.700 -2.843
60 HD2 LYS 8 HD2 LYS 8 3.379 -8.084 -4.991
61 HD3 LYS 8 HD3 LYS 8 3.196 -6.389 -4.533
62 HE2 LYS 8 HE2 LYS 8 5.905 -7.439 -4.177
63 HE3 LYS 8 HE3 LYS 8 5.345 -7.455 -5.848
64 HZ1 LYS 8 HZ1 LYS 8 4.607 -5.003 -4.827
65 HZ2 LYS 8 HZ2 LYS 8 5.852 -5.314 -5.929
66 HZ3 LYS 8 HZ3 LYS 8 6.185 -5.256 -4.271
67 H VAL 9 H VAL 9 -0.063 -5.643 -0.921
68 HA VAL 9 HA VAL 9 0.657 -3.067 -2.153
69 HB VAL 9 HB VAL 9 -2.048 -4.325 -2.537
70 HG11 VAL 9 HG11 VAL 9 -1.964 -2.787 -4.560
71 HG12 VAL 9 HG12 VAL 9 -2.089 -2.012 -2.979
72 HG13 VAL 9 HG13 VAL 9 -0.538 -2.064 -3.817
73 HG21 VAL 9 HG21 VAL 9 -0.747 -5.931 -3.589
74 HG22 VAL 9 HG22 VAL 9 -1.108 -4.809 -4.901
75 HG23 VAL 9 HG23 VAL 9 0.465 -4.758 -4.105
76 H ALA 10 H ALA 10 0.723 -3.404 0.560
77 HA ALA 10 HA ALA 10 -1.298 -1.525 1.404
78 HB1 ALA 10 HB1 ALA 10 -1.173 -3.970 3.098
79 HB2 ALA 10 HB2 ALA 10 -2.477 -2.798 2.898
80 HB3 ALA 10 HB3 ALA 10 -2.167 -3.995 1.640
81 HB2 I4G 11 HB2 I4G 11 -0.145 -0.041 0.894
82 HB3 I4G 11 HB3 I4G 11 0.891 1.110 1.413
83 HG I4G 11 HG I4G 11 -1.692 1.566 1.560
84 HD13 I4G 11 HD13 I4G 11 -1.106 -0.022 4.122
85 HD11 I4G 11 HD11 I4G 11 -2.583 0.909 3.812
86 HD12 I4G 11 HD12 I4G 11 -2.213 -0.514 2.833
87 HD23 I4G 11 HD23 I4G 11 0.053 3.146 2.367
88 HD22 I4G 11 HD22 I4G 11 0.224 2.211 3.861
89 HD21 I4G 11 HD21 I4G 11 -1.294 3.056 3.510
90 HA2 I4G 11 HA2 I4G 11 2.345 -0.717 3.872
91 HA3 I4G 11 HA3 I4G 11 1.526 0.681 4.081
92 H HIS 12 H HIS 12 2.713 -0.559 1.124
93 HA HIS 12 HA HIS 12 4.747 1.558 1.031
94 HB2 HIS 12 HB2 HIS 12 5.991 0.239 -0.406
95 HB3 HIS 12 HB3 HIS 12 5.217 -0.985 0.595
96 HD1 HIS 12 HD1 HIS 12 6.052 -0.564 -2.733
97 HD2 HIS 12 HD2 HIS 12 2.493 -1.585 -0.847
98 HE1 HIS 12 HE1 HIS 12 4.675 -1.733 -4.483
99 H VAL 13 H VAL 13 1.747 0.572 -0.308
100 HA VAL 13 HA VAL 13 1.786 1.697 -2.843
101 HB VAL 13 HB VAL 13 -0.509 1.551 -0.885
102 HG11 VAL 13 HG11 VAL 13 -1.471 2.985 -2.335
103 HG12 VAL 13 HG12 VAL 13 -0.325 2.618 -3.625
104 HG13 VAL 13 HG13 VAL 13 -1.680 1.533 -3.313
105 HG21 VAL 13 HG21 VAL 13 0.494 -0.610 -1.498
106 HG22 VAL 13 HG22 VAL 13 -1.150 -0.442 -2.114
107 HG23 VAL 13 HG23 VAL 13 0.224 -0.239 -3.200
108 H VAL 14 H VAL 14 0.388 3.247 0.054
109 HA VAL 14 HA VAL 14 0.033 5.774 -1.008
110 HB VAL 14 HB VAL 14 0.716 5.040 1.841
111 HG11 VAL 14 HG11 VAL 14 -0.698 7.284 2.104
112 HG12 VAL 14 HG12 VAL 14 1.061 7.281 1.962
113 HG13 VAL 14 HG13 VAL 14 0.061 7.622 0.548
114 HG21 VAL 14 HG21 VAL 14 -1.341 4.021 0.792
115 HG22 VAL 14 HG22 VAL 14 -1.618 4.977 2.249
116 HG23 VAL 14 HG23 VAL 14 -1.983 5.659 0.663
117 H GLY 15 H GLY 15 2.947 4.267 0.201
118 HA2 GLY 15 HA2 GLY 15 4.499 6.630 0.465
119 HA3 GLY 15 HA3 GLY 15 5.125 4.994 0.318
120 H ALA 16 H ALA 16 3.642 4.653 -2.262
121 HA ALA 16 HA ALA 16 5.670 5.922 -3.942
122 HB1 ALA 16 HB1 ALA 16 4.157 3.441 -4.038
123 HB2 ALA 16 HB2 ALA 16 4.174 4.290 -5.583
124 HB3 ALA 16 HB3 ALA 16 5.694 3.862 -4.796
125 H ILE 17 H ILE 17 2.139 5.502 -3.826
126 HA ILE 17 HA ILE 17 1.471 7.041 -6.042
127 HB ILE 17 HB ILE 17 -0.088 6.727 -3.475
128 HG12 ILE 17 HG12 ILE 17 -0.180 5.184 -6.076
129 HG13 ILE 17 HG13 ILE 17 0.437 4.587 -4.540
130 HG21 ILE 17 HG21 ILE 17 -0.887 8.623 -4.764
131 HG22 ILE 17 HG22 ILE 17 -0.992 7.619 -6.208
132 HG23 ILE 17 HG23 ILE 17 -2.050 7.300 -4.834
133 HD11 ILE 17 HD11 ILE 17 -2.407 5.274 -5.223
134 HD12 ILE 17 HD12 ILE 17 -1.735 3.683 -4.862
135 HD13 ILE 17 HD13 ILE 17 -1.847 4.903 -3.592
136 H ALA 18 H ALA 18 2.223 8.015 -2.749
137 HA ALA 18 HA ALA 18 1.428 10.734 -3.055
138 HB1 ALA 18 HB1 ALA 18 2.285 11.090 -0.912
139 HB2 ALA 18 HB2 ALA 18 1.743 9.412 -0.883
140 HB3 ALA 18 HB3 ALA 18 3.458 9.780 -1.063
141 H GLU 19 H GLU 19 4.091 8.964 -4.175
142 HA GLU 19 HA GLU 19 6.057 11.027 -4.123
143 HB2 GLU 19 HB2 GLU 19 6.308 8.431 -4.429
144 HB3 GLU 19 HB3 GLU 19 6.111 8.812 -6.134
145 HG2 GLU 19 HG2 GLU 19 7.985 10.615 -5.480
146 HG3 GLU 19 HG3 GLU 19 8.366 9.347 -4.317
147 H HIS 20 H HIS 20 3.997 9.705 -6.709
148 HA HIS 20 HA HIS 20 4.803 11.717 -8.588
149 HB2 HIS 20 HB2 HIS 20 3.496 10.595 -10.142
150 HB3 HIS 20 HB3 HIS 20 3.912 9.298 -9.027
151 HD1 HIS 20 HD1 HIS 20 1.037 11.432 -10.127
152 HD2 HIS 20 HD2 HIS 20 1.778 8.227 -7.589
153 HE1 HIS 20 HE1 HIS 20 -1.227 10.554 -9.474
154 H PHE 21 H PHE 21 2.346 11.413 -6.182
155 HA PHE 21 HA PHE 21 0.822 13.654 -7.275
156 HB2 PHE 21 HB2 PHE 21 0.006 11.374 -6.000
157 HB3 PHE 21 HB3 PHE 21 -0.011 12.542 -4.683
158 HD1 PHE 21 HD2 PHE 21 -0.939 12.643 -8.300
159 HD2 PHE 21 HD1 PHE 21 -2.107 13.351 -4.267
160 HE1 PHE 21 HE2 PHE 21 -3.113 13.489 -9.082
161 HE2 PHE 21 HE1 PHE 21 -4.284 14.197 -5.044
162 HZ PHE 21 HZ PHE 21 -4.789 14.268 -7.453
163 HN1 NH2 22 HN1 NH2 22 3.734 13.662 -5.939
164 HN2 NH2 22 HN2 NH2 22 3.623 14.946 -4.696
Start of MODEL 15
1 H1 GLY 1 H1 GLY 1 -4.007 -16.190 2.825
2 H2 GLY 1 H2 GLY 1 -4.294 -17.790 2.983
3 H3 GLY 1 H3 GLY 1 -2.984 -17.163 3.265
4 HA2 GLY 1 HA2 GLY 1 -2.309 -17.573 1.109
5 HA3 GLY 1 HA3 GLY 1 -3.952 -18.112 0.794
6 H LEU 2 H LEU 2 -5.543 -16.091 0.816
7 HA LEU 2 HA LEU 2 -4.827 -14.553 -1.457
8 HB2 LEU 2 HB2 LEU 2 -7.121 -15.149 -1.074
9 HB3 LEU 2 HB3 LEU 2 -7.121 -14.320 0.482
10 HG LEU 2 HG LEU 2 -6.448 -12.504 -1.662
11 HD11 LEU 2 HD11 LEU 2 -8.968 -12.581 -2.425
12 HD12 LEU 2 HD12 LEU 2 -8.798 -14.290 -2.022
13 HD13 LEU 2 HD13 LEU 2 -7.736 -13.557 -3.225
14 HD21 LEU 2 HD21 LEU 2 -7.309 -12.092 0.716
15 HD22 LEU 2 HD22 LEU 2 -8.902 -12.476 0.064
16 HD23 LEU 2 HD23 LEU 2 -7.986 -11.115 -0.586
17 H PHE 3 H PHE 3 -5.726 -13.409 1.803
18 HA PHE 3 HA PHE 3 -4.838 -10.797 1.494
19 HB2 PHE 3 HB2 PHE 3 -6.048 -12.208 3.502
20 HB3 PHE 3 HB3 PHE 3 -4.459 -11.901 4.193
21 HD1 PHE 3 HD1 PHE 3 -3.650 -9.538 4.380
22 HD2 PHE 3 HD2 PHE 3 -7.667 -10.513 3.362
23 HE1 PHE 3 HE1 PHE 3 -4.353 -7.259 4.986
24 HE2 PHE 3 HE2 PHE 3 -8.376 -8.236 3.965
25 HZ PHE 3 HZ PHE 3 -6.718 -6.606 4.779
26 H GLY 4 H GLY 4 -3.049 -13.704 2.151
27 HA2 GLY 4 HA2 GLY 4 -0.726 -12.755 3.302
28 HA3 GLY 4 HA3 GLY 4 -0.786 -14.103 2.176
29 H VAL 5 H VAL 5 -1.793 -12.431 -0.017
30 HA VAL 5 HA VAL 5 0.780 -11.267 -0.786
31 HB VAL 5 HB VAL 5 -1.637 -11.919 -2.479
32 HG11 VAL 5 HG11 VAL 5 -0.580 -10.203 -3.632
33 HG12 VAL 5 HG12 VAL 5 1.029 -10.715 -3.120
34 HG13 VAL 5 HG13 VAL 5 0.147 -11.651 -4.326
35 HG21 VAL 5 HG21 VAL 5 -0.359 -13.852 -1.488
36 HG22 VAL 5 HG22 VAL 5 -0.445 -13.823 -3.249
37 HG23 VAL 5 HG23 VAL 5 1.031 -13.313 -2.430
38 H LEU 6 H LEU 6 -2.453 -10.383 0.024
39 HA LEU 6 HA LEU 6 -2.795 -7.980 -1.302
40 HB2 LEU 6 HB2 LEU 6 -3.766 -9.127 1.248
41 HB3 LEU 6 HB3 LEU 6 -3.954 -7.388 1.036
42 HG LEU 6 HG LEU 6 -5.063 -9.506 -0.806
43 HD11 LEU 6 HD11 LEU 6 -6.520 -9.709 0.908
44 HD12 LEU 6 HD12 LEU 6 -7.209 -8.254 0.189
45 HD13 LEU 6 HD13 LEU 6 -6.129 -8.125 1.576
46 HD21 LEU 6 HD21 LEU 6 -4.947 -6.538 -0.903
47 HD22 LEU 6 HD22 LEU 6 -6.416 -7.334 -1.467
48 HD23 LEU 6 HD23 LEU 6 -4.862 -7.719 -2.210
49 H ALA 7 H ALA 7 -0.704 -8.754 1.359
50 HA ALA 7 HA ALA 7 -0.239 -6.198 2.401
51 HB1 ALA 7 HB1 ALA 7 0.966 -8.817 2.604
52 HB2 ALA 7 HB2 ALA 7 2.184 -7.541 2.618
53 HB3 ALA 7 HB3 ALA 7 0.874 -7.522 3.798
54 H LYS 8 H LYS 8 0.853 -7.703 -0.526
55 HA LYS 8 HA LYS 8 3.117 -6.105 -1.043
56 HB2 LYS 8 HB2 LYS 8 1.935 -8.244 -2.268
57 HB3 LYS 8 HB3 LYS 8 1.555 -6.945 -3.391
58 HG2 LYS 8 HG2 LYS 8 4.177 -6.469 -2.954
59 HG3 LYS 8 HG3 LYS 8 4.126 -8.224 -2.774
60 HD2 LYS 8 HD2 LYS 8 4.541 -7.879 -5.055
61 HD3 LYS 8 HD3 LYS 8 2.814 -8.230 -4.970
62 HE2 LYS 8 HE2 LYS 8 2.327 -5.832 -5.051
63 HE3 LYS 8 HE3 LYS 8 4.053 -5.482 -5.130
64 HZ1 LYS 8 HZ1 LYS 8 4.190 -6.167 -7.277
65 HZ2 LYS 8 HZ2 LYS 8 2.584 -5.639 -7.284
66 HZ3 LYS 8 HZ3 LYS 8 2.931 -7.288 -7.139
67 H VAL 9 H VAL 9 -0.192 -5.356 -1.023
68 HA VAL 9 HA VAL 9 0.383 -2.748 -2.233
69 HB VAL 9 HB VAL 9 -0.706 -4.152 -3.963
70 HG11 VAL 9 HG11 VAL 9 -2.375 -4.886 -1.777
71 HG12 VAL 9 HG12 VAL 9 -3.376 -4.140 -3.024
72 HG13 VAL 9 HG13 VAL 9 -2.361 -5.527 -3.420
73 HG21 VAL 9 HG21 VAL 9 -1.999 -2.437 -4.761
74 HG22 VAL 9 HG22 VAL 9 -2.746 -2.122 -3.195
75 HG23 VAL 9 HG23 VAL 9 -1.095 -1.585 -3.508
76 H ALA 10 H ALA 10 0.348 -3.071 0.433
77 HA ALA 10 HA ALA 10 -1.714 -1.316 1.263
78 HB1 ALA 10 HB1 ALA 10 -2.169 -3.580 2.955
79 HB2 ALA 10 HB2 ALA 10 -3.320 -2.669 1.978
80 HB3 ALA 10 HB3 ALA 10 -2.446 -4.028 1.272
81 HB2 I4G 11 HB2 I4G 11 -0.483 0.163 1.148
82 HB3 I4G 11 HB3 I4G 11 0.488 1.183 1.975
83 HG I4G 11 HG I4G 11 -2.091 1.693 1.846
84 HD13 I4G 11 HD13 I4G 11 -1.866 -0.273 4.195
85 HD11 I4G 11 HD11 I4G 11 -3.279 0.738 3.840
86 HD12 I4G 11 HD12 I4G 11 -2.797 -0.536 2.714
87 HD23 I4G 11 HD23 I4G 11 -0.451 3.082 3.100
88 HD22 I4G 11 HD22 I4G 11 -0.490 1.933 4.447
89 HD21 I4G 11 HD21 I4G 11 -1.939 2.866 4.033
90 HA2 I4G 11 HA2 I4G 11 1.564 -1.058 4.288
91 HA3 I4G 11 HA3 I4G 11 0.796 0.355 4.571
92 H HIS 12 H HIS 12 2.266 -0.561 1.630
93 HA HIS 12 HA HIS 12 4.265 1.572 2.007
94 HB2 HIS 12 HB2 HIS 12 5.508 0.176 0.169
95 HB3 HIS 12 HB3 HIS 12 5.586 -0.324 1.856
96 HD1 HIS 12 HD1 HIS 12 5.583 -2.797 1.834
97 HD2 HIS 12 HD2 HIS 12 2.826 -1.223 -0.846
98 HE1 HIS 12 HE1 HIS 12 4.360 -4.779 0.887
99 H VAL 13 H VAL 13 1.554 0.625 0.294
100 HA VAL 13 HA VAL 13 2.044 1.482 -2.313
101 HB VAL 13 HB VAL 13 -0.552 1.732 -0.791
102 HG11 VAL 13 HG11 VAL 13 0.137 2.607 -3.357
103 HG12 VAL 13 HG12 VAL 13 -0.791 1.124 -3.591
104 HG13 VAL 13 HG13 VAL 13 -1.481 2.463 -2.672
105 HG21 VAL 13 HG21 VAL 13 0.521 -0.556 -2.438
106 HG22 VAL 13 HG22 VAL 13 0.322 -0.541 -0.685
107 HG23 VAL 13 HG23 VAL 13 -1.094 -0.465 -1.734
108 H VAL 14 H VAL 14 0.712 3.324 0.430
109 HA VAL 14 HA VAL 14 0.325 5.760 -0.805
110 HB VAL 14 HB VAL 14 1.289 5.285 2.019
111 HG11 VAL 14 HG11 VAL 14 0.174 7.715 0.649
112 HG12 VAL 14 HG12 VAL 14 0.096 7.505 2.399
113 HG13 VAL 14 HG13 VAL 14 1.660 7.564 1.586
114 HG21 VAL 14 HG21 VAL 14 -0.956 5.168 2.678
115 HG22 VAL 14 HG22 VAL 14 -1.535 5.813 1.143
116 HG23 VAL 14 HG23 VAL 14 -0.876 4.178 1.221
117 H GLY 15 H GLY 15 3.308 4.369 0.457
118 HA2 GLY 15 HA2 GLY 15 4.931 6.652 0.322
119 HA3 GLY 15 HA3 GLY 15 5.503 4.994 0.211
120 H ALA 16 H ALA 16 3.762 4.553 -2.189
121 HA ALA 16 HA ALA 16 5.649 5.656 -4.129
122 HB1 ALA 16 HB1 ALA 16 3.664 3.892 -5.256
123 HB2 ALA 16 HB2 ALA 16 5.420 3.726 -5.208
124 HB3 ALA 16 HB3 ALA 16 4.443 3.161 -3.852
125 H ILE 17 H ILE 17 2.131 5.355 -3.669
126 HA ILE 17 HA ILE 17 1.311 6.814 -5.890
127 HB ILE 17 HB ILE 17 -0.029 6.666 -3.188
128 HG12 ILE 17 HG12 ILE 17 -0.381 4.991 -5.683
129 HG13 ILE 17 HG13 ILE 17 0.367 4.460 -4.180
130 HG21 ILE 17 HG21 ILE 17 -0.894 8.511 -4.513
131 HG22 ILE 17 HG22 ILE 17 -1.143 7.430 -5.883
132 HG23 ILE 17 HG23 ILE 17 -2.085 7.216 -4.408
133 HD11 ILE 17 HD11 ILE 17 -2.510 5.265 -4.540
134 HD12 ILE 17 HD12 ILE 17 -1.896 3.621 -4.368
135 HD13 ILE 17 HD13 ILE 17 -1.766 4.755 -3.025
136 H ALA 18 H ALA 18 2.377 7.906 -2.723
137 HA ALA 18 HA ALA 18 1.635 10.638 -3.112
138 HB1 ALA 18 HB1 ALA 18 3.728 9.675 -1.187
139 HB2 ALA 18 HB2 ALA 18 2.658 11.070 -1.046
140 HB3 ALA 18 HB3 ALA 18 2.004 9.439 -0.894
141 H GLU 19 H GLU 19 4.134 8.721 -4.327
142 HA GLU 19 HA GLU 19 6.178 10.714 -4.482
143 HB2 GLU 19 HB2 GLU 19 6.330 8.093 -4.644
144 HB3 GLU 19 HB3 GLU 19 6.059 8.387 -6.357
145 HG2 GLU 19 HG2 GLU 19 8.385 8.270 -6.085
146 HG3 GLU 19 HG3 GLU 19 8.011 9.983 -6.265
147 H HIS 20 H HIS 20 3.914 9.325 -6.850
148 HA HIS 20 HA HIS 20 4.680 11.195 -8.892
149 HB2 HIS 20 HB2 HIS 20 3.297 10.004 -10.309
150 HB3 HIS 20 HB3 HIS 20 3.684 8.772 -9.113
151 HD1 HIS 20 HD1 HIS 20 0.879 10.816 -10.439
152 HD2 HIS 20 HD2 HIS 20 1.548 8.064 -7.400
153 HE1 HIS 20 HE1 HIS 20 -1.404 10.141 -9.630
154 H PHE 21 H PHE 21 2.363 11.104 -6.340
155 HA PHE 21 HA PHE 21 1.113 13.557 -7.390
156 HB2 PHE 21 HB2 PHE 21 -0.175 11.218 -6.787
157 HB3 PHE 21 HB3 PHE 21 -0.345 12.118 -5.282
158 HD1 PHE 21 HD2 PHE 21 -0.636 14.863 -6.201
159 HD2 PHE 21 HD1 PHE 21 -2.243 11.264 -7.807
160 HE1 PHE 21 HE2 PHE 21 -2.505 16.135 -7.172
161 HE2 PHE 21 HE1 PHE 21 -4.114 12.531 -8.782
162 HZ PHE 21 HZ PHE 21 -4.248 14.969 -8.464
163 HN1 NH2 22 HN1 NH2 22 3.704 13.540 -5.960
164 HN2 NH2 22 HN2 NH2 22 3.461 14.358 -4.385
Start of MODEL 16
1 H1 GLY 1 H1 GLY 1 -5.280 -17.828 0.960
2 H2 GLY 1 H2 GLY 1 -4.163 -19.013 1.080
3 H3 GLY 1 H3 GLY 1 -4.907 -18.471 2.239
4 HA2 GLY 1 HA2 GLY 1 -3.358 -16.814 2.606
5 HA3 GLY 1 HA3 GLY 1 -2.466 -17.575 1.297
6 H LEU 2 H LEU 2 -5.615 -15.991 1.074
7 HA LEU 2 HA LEU 2 -4.888 -14.507 -1.211
8 HB2 LEU 2 HB2 LEU 2 -7.222 -15.199 -0.228
9 HB3 LEU 2 HB3 LEU 2 -7.116 -13.630 0.566
10 HG LEU 2 HG LEU 2 -8.430 -13.517 -1.490
11 HD11 LEU 2 HD11 LEU 2 -5.789 -12.096 -1.787
12 HD12 LEU 2 HD12 LEU 2 -7.103 -11.574 -0.732
13 HD13 LEU 2 HD13 LEU 2 -7.337 -11.614 -2.480
14 HD21 LEU 2 HD21 LEU 2 -7.515 -13.957 -3.637
15 HD22 LEU 2 HD22 LEU 2 -7.177 -15.371 -2.636
16 HD23 LEU 2 HD23 LEU 2 -5.900 -14.201 -2.971
17 H PHE 3 H PHE 3 -5.735 -13.267 2.028
18 HA PHE 3 HA PHE 3 -4.836 -10.664 1.611
19 HB2 PHE 3 HB2 PHE 3 -5.978 -12.090 3.720
20 HB3 PHE 3 HB3 PHE 3 -4.439 -11.520 4.356
21 HD1 PHE 3 HD1 PHE 3 -3.969 -9.121 4.505
22 HD2 PHE 3 HD2 PHE 3 -7.757 -10.579 3.225
23 HE1 PHE 3 HE1 PHE 3 -4.951 -6.899 4.891
24 HE2 PHE 3 HE2 PHE 3 -8.745 -8.358 3.608
25 HZ PHE 3 HZ PHE 3 -7.342 -6.515 4.441
26 H GLY 4 H GLY 4 -3.084 -13.565 2.392
27 HA2 GLY 4 HA2 GLY 4 -0.756 -12.598 3.514
28 HA3 GLY 4 HA3 GLY 4 -0.826 -13.989 2.444
29 H VAL 5 H VAL 5 -1.801 -12.400 0.178
30 HA VAL 5 HA VAL 5 0.788 -11.293 -0.622
31 HB VAL 5 HB VAL 5 -1.624 -11.993 -2.302
32 HG11 VAL 5 HG11 VAL 5 1.072 -10.875 -2.988
33 HG12 VAL 5 HG12 VAL 5 0.137 -11.805 -4.160
34 HG13 VAL 5 HG13 VAL 5 -0.522 -10.312 -3.490
35 HG21 VAL 5 HG21 VAL 5 -0.858 -14.073 -1.868
36 HG22 VAL 5 HG22 VAL 5 0.326 -13.667 -3.111
37 HG23 VAL 5 HG23 VAL 5 0.745 -13.502 -1.405
38 H LEU 6 H LEU 6 -2.438 -10.344 0.134
39 HA LEU 6 HA LEU 6 -2.750 -7.996 -1.294
40 HB2 LEU 6 HB2 LEU 6 -3.741 -9.020 1.303
41 HB3 LEU 6 HB3 LEU 6 -3.918 -7.292 1.004
42 HG LEU 6 HG LEU 6 -5.006 -9.462 -0.788
43 HD11 LEU 6 HD11 LEU 6 -7.118 -8.075 0.328
44 HD12 LEU 6 HD12 LEU 6 -6.012 -8.319 1.680
45 HD13 LEU 6 HD13 LEU 6 -6.592 -9.703 0.755
46 HD21 LEU 6 HD21 LEU 6 -5.332 -6.466 -0.759
47 HD22 LEU 6 HD22 LEU 6 -6.325 -7.564 -1.719
48 HD23 LEU 6 HD23 LEU 6 -4.590 -7.452 -2.020
49 H ALA 7 H ALA 7 -0.676 -8.679 1.405
50 HA ALA 7 HA ALA 7 -0.191 -6.098 2.357
51 HB1 ALA 7 HB1 ALA 7 0.549 -8.245 3.415
52 HB2 ALA 7 HB2 ALA 7 1.847 -8.309 2.222
53 HB3 ALA 7 HB3 ALA 7 1.775 -6.976 3.374
54 H LYS 8 H LYS 8 0.951 -7.730 -0.498
55 HA LYS 8 HA LYS 8 3.193 -6.156 -1.088
56 HB2 LYS 8 HB2 LYS 8 2.016 -8.309 -2.247
57 HB3 LYS 8 HB3 LYS 8 1.553 -7.046 -3.379
58 HG2 LYS 8 HG2 LYS 8 3.957 -6.417 -3.553
59 HG3 LYS 8 HG3 LYS 8 4.343 -7.828 -2.565
60 HD2 LYS 8 HD2 LYS 8 4.000 -9.264 -4.266
61 HD3 LYS 8 HD3 LYS 8 2.597 -8.374 -4.864
62 HE2 LYS 8 HE2 LYS 8 3.833 -7.128 -6.290
63 HE3 LYS 8 HE3 LYS 8 5.208 -7.041 -5.191
64 HZ1 LYS 8 HZ1 LYS 8 6.174 -8.521 -6.512
65 HZ2 LYS 8 HZ2 LYS 8 4.745 -8.824 -7.366
66 HZ3 LYS 8 HZ3 LYS 8 5.072 -9.671 -5.939
67 H VAL 9 H VAL 9 -0.147 -5.415 -1.172
68 HA VAL 9 HA VAL 9 0.472 -2.820 -2.407
69 HB VAL 9 HB VAL 9 -0.679 -4.317 -4.054
70 HG11 VAL 9 HG11 VAL 9 -2.501 -5.469 -3.516
71 HG12 VAL 9 HG12 VAL 9 -2.320 -4.894 -1.857
72 HG13 VAL 9 HG13 VAL 9 -3.329 -4.001 -2.996
73 HG21 VAL 9 HG21 VAL 9 -0.870 -1.716 -3.811
74 HG22 VAL 9 HG22 VAL 9 -1.884 -2.582 -4.965
75 HG23 VAL 9 HG23 VAL 9 -2.548 -2.085 -3.409
76 H ALA 10 H ALA 10 0.342 -3.370 0.341
77 HA ALA 10 HA ALA 10 -1.666 -1.470 1.129
78 HB1 ALA 10 HB1 ALA 10 -1.899 -4.341 2.007
79 HB2 ALA 10 HB2 ALA 10 -2.693 -2.999 2.833
80 HB3 ALA 10 HB3 ALA 10 -3.100 -3.368 1.157
81 HB2 I4G 11 HB2 I4G 11 -0.397 -0.023 0.906
82 HB3 I4G 11 HB3 I4G 11 0.634 1.006 1.644
83 HG I4G 11 HG I4G 11 -1.910 1.626 1.558
84 HD13 I4G 11 HD13 I4G 11 -1.739 -0.260 3.976
85 HD11 I4G 11 HD11 I4G 11 -3.108 0.804 3.604
86 HD12 I4G 11 HD12 I4G 11 -2.706 -0.532 2.521
87 HD23 I4G 11 HD23 I4G 11 -0.186 2.981 2.733
88 HD22 I4G 11 HD22 I4G 11 -0.255 1.886 4.123
89 HD21 I4G 11 HD21 I4G 11 -1.666 2.871 3.695
90 HA2 I4G 11 HA2 I4G 11 1.734 -1.133 4.018
91 HA3 I4G 11 HA3 I4G 11 0.928 0.251 4.340
92 H HIS 12 H HIS 12 2.471 -0.716 1.429
93 HA HIS 12 HA HIS 12 4.408 1.476 1.755
94 HB2 HIS 12 HB2 HIS 12 5.961 0.264 0.543
95 HB3 HIS 12 HB3 HIS 12 5.093 -1.030 1.363
96 HD1 HIS 12 HD1 HIS 12 6.551 -0.637 -1.684
97 HD2 HIS 12 HD2 HIS 12 2.638 -1.551 -0.625
98 HE1 HIS 12 HE1 HIS 12 5.559 -1.777 -3.695
99 H VAL 13 H VAL 13 1.676 0.468 0.009
100 HA VAL 13 HA VAL 13 2.015 1.500 -2.524
101 HB VAL 13 HB VAL 13 -0.488 1.624 -0.835
102 HG11 VAL 13 HG11 VAL 13 -0.665 3.127 -2.719
103 HG12 VAL 13 HG12 VAL 13 -0.114 1.862 -3.820
104 HG13 VAL 13 HG13 VAL 13 -1.670 1.706 -3.001
105 HG21 VAL 13 HG21 VAL 13 0.463 -0.451 -2.808
106 HG22 VAL 13 HG22 VAL 13 0.394 -0.639 -1.057
107 HG23 VAL 13 HG23 VAL 13 -1.095 -0.453 -1.983
108 H VAL 14 H VAL 14 0.610 3.244 0.256
109 HA VAL 14 HA VAL 14 0.321 5.728 -0.898
110 HB VAL 14 HB VAL 14 1.114 5.126 1.954
111 HG11 VAL 14 HG11 VAL 14 -0.150 7.371 2.281
112 HG12 VAL 14 HG12 VAL 14 1.537 7.392 1.763
113 HG13 VAL 14 HG13 VAL 14 0.248 7.638 0.584
114 HG21 VAL 14 HG21 VAL 14 -1.030 4.118 0.953
115 HG22 VAL 14 HG22 VAL 14 -1.157 4.999 2.476
116 HG23 VAL 14 HG23 VAL 14 -1.643 5.772 0.969
117 H GLY 15 H GLY 15 3.231 4.174 0.258
118 HA2 GLY 15 HA2 GLY 15 4.897 6.439 0.425
119 HA3 GLY 15 HA3 GLY 15 5.440 4.788 0.169
120 H ALA 16 H ALA 16 3.897 4.481 -2.302
121 HA ALA 16 HA ALA 16 5.770 5.864 -4.068
122 HB1 ALA 16 HB1 ALA 16 5.106 3.295 -4.058
123 HB2 ALA 16 HB2 ALA 16 3.836 3.884 -5.132
124 HB3 ALA 16 HB3 ALA 16 5.531 4.148 -5.541
125 H ILE 17 H ILE 17 2.283 5.371 -3.651
126 HA ILE 17 HA ILE 17 1.379 6.829 -5.840
127 HB ILE 17 HB ILE 17 0.066 6.607 -3.129
128 HG12 ILE 17 HG12 ILE 17 0.539 4.411 -4.064
129 HG13 ILE 17 HG13 ILE 17 -1.188 4.737 -4.165
130 HG21 ILE 17 HG21 ILE 17 -0.858 7.625 -5.776
131 HG22 ILE 17 HG22 ILE 17 -2.009 6.829 -4.703
132 HG23 ILE 17 HG23 ILE 17 -1.146 8.268 -4.160
133 HD11 ILE 17 HD11 ILE 17 -0.964 4.022 -6.268
134 HD12 ILE 17 HD12 ILE 17 -0.333 5.640 -6.575
135 HD13 ILE 17 HD13 ILE 17 0.777 4.301 -6.284
136 H ALA 18 H ALA 18 2.394 7.914 -2.650
137 HA ALA 18 HA ALA 18 1.557 10.623 -3.016
138 HB1 ALA 18 HB1 ALA 18 1.835 9.561 -0.795
139 HB2 ALA 18 HB2 ALA 18 3.579 9.547 -1.057
140 HB3 ALA 18 HB3 ALA 18 2.715 11.080 -0.957
141 H GLU 19 H GLU 19 4.099 8.823 -4.275
142 HA GLU 19 HA GLU 19 6.085 10.890 -4.361
143 HB2 GLU 19 HB2 GLU 19 6.338 8.277 -4.545
144 HB3 GLU 19 HB3 GLU 19 6.081 8.578 -6.258
145 HG2 GLU 19 HG2 GLU 19 8.035 10.395 -5.167
146 HG3 GLU 19 HG3 GLU 19 8.480 8.715 -4.868
147 H HIS 20 H HIS 20 3.901 9.436 -6.765
148 HA HIS 20 HA HIS 20 4.621 11.341 -8.790
149 HB2 HIS 20 HB2 HIS 20 3.282 10.119 -10.223
150 HB3 HIS 20 HB3 HIS 20 3.696 8.892 -9.029
151 HD1 HIS 20 HD1 HIS 20 0.841 10.846 -10.375
152 HD2 HIS 20 HD2 HIS 20 1.571 8.126 -7.321
153 HE1 HIS 20 HE1 HIS 20 -1.427 10.102 -9.580
154 H PHE 21 H PHE 21 2.284 11.166 -6.257
155 HA PHE 21 HA PHE 21 0.993 13.606 -7.291
156 HB2 PHE 21 HB2 PHE 21 -0.232 11.194 -6.702
157 HB3 PHE 21 HB3 PHE 21 -0.528 12.161 -5.262
158 HD1 PHE 21 HD2 PHE 21 -0.655 12.508 -8.975
159 HD2 PHE 21 HD1 PHE 21 -2.420 13.453 -5.219
160 HE1 PHE 21 HE2 PHE 21 -2.495 13.659 -10.132
161 HE2 PHE 21 HE1 PHE 21 -4.264 14.605 -6.371
162 HZ PHE 21 HZ PHE 21 -4.302 14.711 -8.831
163 HN1 NH2 22 HN1 NH2 22 3.551 13.555 -5.763
164 HN2 NH2 22 HN2 NH2 22 3.246 14.346 -4.186
Start of MODEL 17
1 H1 GLY 1 H1 GLY 1 -3.716 -16.803 3.313
2 H2 GLY 1 H2 GLY 1 -2.262 -17.477 3.000
3 H3 GLY 1 H3 GLY 1 -2.563 -16.046 2.776
4 HA2 GLY 1 HA2 GLY 1 -2.693 -17.875 0.819
5 HA3 GLY 1 HA3 GLY 1 -4.358 -17.851 1.380
6 H LEU 2 H LEU 2 -5.590 -15.929 1.137
7 HA LEU 2 HA LEU 2 -4.965 -14.499 -1.263
8 HB2 LEU 2 HB2 LEU 2 -7.266 -15.209 -0.448
9 HB3 LEU 2 HB3 LEU 2 -7.171 -13.855 0.675
10 HG LEU 2 HG LEU 2 -6.768 -13.309 -2.224
11 HD11 LEU 2 HD11 LEU 2 -8.699 -14.735 -2.297
12 HD12 LEU 2 HD12 LEU 2 -9.219 -13.062 -2.497
13 HD13 LEU 2 HD13 LEU 2 -9.439 -13.873 -0.948
14 HD21 LEU 2 HD21 LEU 2 -6.967 -11.213 -1.523
15 HD22 LEU 2 HD22 LEU 2 -7.044 -11.814 0.134
16 HD23 LEU 2 HD23 LEU 2 -8.530 -11.561 -0.783
17 H PHE 3 H PHE 3 -5.833 -13.245 1.961
18 HA PHE 3 HA PHE 3 -4.901 -10.661 1.565
19 HB2 PHE 3 HB2 PHE 3 -6.118 -12.015 3.631
20 HB3 PHE 3 HB3 PHE 3 -4.539 -11.630 4.307
21 HD1 PHE 3 HD1 PHE 3 -3.819 -9.281 4.508
22 HD2 PHE 3 HD2 PHE 3 -7.749 -10.332 3.254
23 HE1 PHE 3 HE1 PHE 3 -4.582 -6.991 4.990
24 HE2 PHE 3 HE2 PHE 3 -8.517 -8.045 3.732
25 HZ PHE 3 HZ PHE 3 -6.933 -6.371 4.600
26 H GLY 4 H GLY 4 -3.161 -13.572 2.340
27 HA2 GLY 4 HA2 GLY 4 -0.831 -12.618 3.468
28 HA3 GLY 4 HA3 GLY 4 -0.906 -14.006 2.393
29 H VAL 5 H VAL 5 -1.872 -12.407 0.131
30 HA VAL 5 HA VAL 5 0.723 -11.309 -0.664
31 HB VAL 5 HB VAL 5 -1.692 -11.993 -2.347
32 HG11 VAL 5 HG11 VAL 5 0.210 -11.849 -4.153
33 HG12 VAL 5 HG12 VAL 5 -0.653 -10.400 -3.632
34 HG13 VAL 5 HG13 VAL 5 0.946 -10.760 -2.979
35 HG21 VAL 5 HG21 VAL 5 0.029 -13.750 -3.195
36 HG22 VAL 5 HG22 VAL 5 0.813 -13.468 -1.639
37 HG23 VAL 5 HG23 VAL 5 -0.852 -14.049 -1.696
38 H LEU 6 H LEU 6 -2.500 -10.347 0.091
39 HA LEU 6 HA LEU 6 -2.801 -7.994 -1.330
40 HB2 LEU 6 HB2 LEU 6 -3.799 -9.022 1.262
41 HB3 LEU 6 HB3 LEU 6 -3.967 -7.292 0.970
42 HG LEU 6 HG LEU 6 -5.061 -9.447 -0.836
43 HD11 LEU 6 HD11 LEU 6 -6.139 -8.142 1.579
44 HD12 LEU 6 HD12 LEU 6 -6.518 -9.709 0.866
45 HD13 LEU 6 HD13 LEU 6 -7.228 -8.241 0.196
46 HD21 LEU 6 HD21 LEU 6 -6.403 -7.003 -1.145
47 HD22 LEU 6 HD22 LEU 6 -5.321 -7.793 -2.292
48 HD23 LEU 6 HD23 LEU 6 -4.681 -6.619 -1.141
49 H ALA 7 H ALA 7 -0.732 -8.693 1.369
50 HA ALA 7 HA ALA 7 -0.236 -6.117 2.328
51 HB1 ALA 7 HB1 ALA 7 1.673 -7.005 3.390
52 HB2 ALA 7 HB2 ALA 7 0.501 -8.323 3.333
53 HB3 ALA 7 HB3 ALA 7 1.842 -8.285 2.187
54 H LYS 8 H LYS 8 0.902 -7.747 -0.531
55 HA LYS 8 HA LYS 8 3.150 -6.179 -1.115
56 HB2 LYS 8 HB2 LYS 8 1.967 -8.325 -2.279
57 HB3 LYS 8 HB3 LYS 8 1.509 -7.058 -3.410
58 HG2 LYS 8 HG2 LYS 8 4.079 -6.467 -3.229
59 HG3 LYS 8 HG3 LYS 8 4.186 -8.172 -2.783
60 HD2 LYS 8 HD2 LYS 8 2.982 -8.765 -4.848
61 HD3 LYS 8 HD3 LYS 8 2.936 -7.058 -5.296
62 HE2 LYS 8 HE2 LYS 8 4.748 -8.231 -6.440
63 HE3 LYS 8 HE3 LYS 8 5.372 -6.995 -5.350
64 HZ1 LYS 8 HZ1 LYS 8 6.205 -8.549 -3.916
65 HZ2 LYS 8 HZ2 LYS 8 6.404 -9.368 -5.382
66 HZ3 LYS 8 HZ3 LYS 8 5.103 -9.750 -4.371
67 H VAL 9 H VAL 9 -0.188 -5.427 -1.199
68 HA VAL 9 HA VAL 9 0.440 -2.831 -2.426
69 HB VAL 9 HB VAL 9 -0.712 -4.320 -4.081
70 HG11 VAL 9 HG11 VAL 9 -2.538 -5.468 -3.549
71 HG12 VAL 9 HG12 VAL 9 -2.359 -4.899 -1.888
72 HG13 VAL 9 HG13 VAL 9 -3.363 -3.999 -3.025
73 HG21 VAL 9 HG21 VAL 9 -1.910 -2.581 -4.988
74 HG22 VAL 9 HG22 VAL 9 -2.577 -2.084 -3.432
75 HG23 VAL 9 HG23 VAL 9 -0.898 -1.717 -3.828
76 H ALA 10 H ALA 10 0.303 -3.388 0.320
77 HA ALA 10 HA ALA 10 -1.701 -1.485 1.109
78 HB1 ALA 10 HB1 ALA 10 -1.973 -4.375 1.875
79 HB2 ALA 10 HB2 ALA 10 -2.662 -3.078 2.854
80 HB3 ALA 10 HB3 ALA 10 -3.186 -3.296 1.183
81 HB2 I4G 11 HB2 I4G 11 -0.425 -0.041 0.893
82 HB3 I4G 11 HB3 I4G 11 0.608 0.983 1.637
83 HG I4G 11 HG I4G 11 -1.934 1.611 1.547
84 HD13 I4G 11 HD13 I4G 11 -1.775 -0.282 3.960
85 HD11 I4G 11 HD11 I4G 11 -3.140 0.787 3.588
86 HD12 I4G 11 HD12 I4G 11 -2.740 -0.548 2.502
87 HD23 I4G 11 HD23 I4G 11 -0.209 2.957 2.730
88 HD22 I4G 11 HD22 I4G 11 -0.285 1.859 4.116
89 HD21 I4G 11 HD21 I4G 11 -1.692 2.850 3.689
90 HA2 I4G 11 HA2 I4G 11 1.695 -1.167 4.006
91 HA3 I4G 11 HA3 I4G 11 0.892 0.217 4.331
92 H HIS 12 H HIS 12 2.439 -0.746 1.420
93 HA HIS 12 HA HIS 12 4.382 1.438 1.756
94 HB2 HIS 12 HB2 HIS 12 5.933 0.224 0.546
95 HB3 HIS 12 HB3 HIS 12 5.059 -1.070 1.360
96 HD1 HIS 12 HD1 HIS 12 6.526 -0.675 -1.682
97 HD2 HIS 12 HD2 HIS 12 2.607 -1.576 -0.637
98 HE1 HIS 12 HE1 HIS 12 5.535 -1.805 -3.698
99 H VAL 13 H VAL 13 1.652 0.445 0.002
100 HA VAL 13 HA VAL 13 1.999 1.482 -2.527
101 HB VAL 13 HB VAL 13 -0.505 1.612 -0.843
102 HG11 VAL 13 HG11 VAL 13 -1.088 2.990 -2.563
103 HG12 VAL 13 HG12 VAL 13 0.058 2.257 -3.687
104 HG13 VAL 13 HG13 VAL 13 -1.457 1.435 -3.310
105 HG21 VAL 13 HG21 VAL 13 -1.118 -0.454 -2.042
106 HG22 VAL 13 HG22 VAL 13 0.475 -0.467 -2.799
107 HG23 VAL 13 HG23 VAL 13 0.329 -0.654 -1.052
108 H VAL 14 H VAL 14 0.596 3.224 0.255
109 HA VAL 14 HA VAL 14 0.319 5.713 -0.895
110 HB VAL 14 HB VAL 14 1.106 5.101 1.957
111 HG11 VAL 14 HG11 VAL 14 1.468 7.336 1.970
112 HG12 VAL 14 HG12 VAL 14 0.457 7.619 0.551
113 HG13 VAL 14 HG13 VAL 14 -0.288 7.382 2.132
114 HG21 VAL 14 HG21 VAL 14 -1.026 4.082 0.996
115 HG22 VAL 14 HG22 VAL 14 -1.183 5.028 2.476
116 HG23 VAL 14 HG23 VAL 14 -1.644 5.733 0.926
117 H GLY 15 H GLY 15 3.220 4.145 0.263
118 HA2 GLY 15 HA2 GLY 15 4.896 6.402 0.436
119 HA3 GLY 15 HA3 GLY 15 5.432 4.750 0.177
120 H ALA 16 H ALA 16 3.892 4.456 -2.298
121 HA ALA 16 HA ALA 16 5.772 5.838 -4.056
122 HB1 ALA 16 HB1 ALA 16 4.245 3.330 -4.181
123 HB2 ALA 16 HB2 ALA 16 4.381 4.206 -5.705
124 HB3 ALA 16 HB3 ALA 16 5.835 3.727 -4.831
125 H ILE 17 H ILE 17 2.283 5.354 -3.646
126 HA ILE 17 HA ILE 17 1.387 6.821 -5.832
127 HB ILE 17 HB ILE 17 0.068 6.596 -3.124
128 HG12 ILE 17 HG12 ILE 17 0.538 4.401 -4.064
129 HG13 ILE 17 HG13 ILE 17 -1.188 4.731 -4.168
130 HG21 ILE 17 HG21 ILE 17 -2.023 6.972 -4.432
131 HG22 ILE 17 HG22 ILE 17 -0.948 8.367 -4.369
132 HG23 ILE 17 HG23 ILE 17 -1.019 7.374 -5.824
133 HD11 ILE 17 HD11 ILE 17 -0.980 4.045 -6.277
134 HD12 ILE 17 HD12 ILE 17 -0.295 5.642 -6.574
135 HD13 ILE 17 HD13 ILE 17 0.769 4.268 -6.278
136 H ALA 18 H ALA 18 2.404 7.893 -2.638
137 HA ALA 18 HA ALA 18 1.574 10.605 -2.995
138 HB1 ALA 18 HB1 ALA 18 3.556 9.462 -1.031
139 HB2 ALA 18 HB2 ALA 18 2.793 11.049 -0.943
140 HB3 ALA 18 HB3 ALA 18 1.816 9.591 -0.773
141 H GLU 19 H GLU 19 4.112 8.802 -4.257
142 HA GLU 19 HA GLU 19 6.105 10.863 -4.332
143 HB2 GLU 19 HB2 GLU 19 6.349 8.252 -4.525
144 HB3 GLU 19 HB3 GLU 19 6.096 8.557 -6.238
145 HG2 GLU 19 HG2 GLU 19 8.112 9.535 -6.507
146 HG3 GLU 19 HG3 GLU 19 8.110 10.240 -4.891
147 H HIS 20 H HIS 20 3.919 9.426 -6.744
148 HA HIS 20 HA HIS 20 4.647 11.335 -8.761
149 HB2 HIS 20 HB2 HIS 20 3.307 10.121 -10.200
150 HB3 HIS 20 HB3 HIS 20 3.716 8.889 -9.011
151 HD1 HIS 20 HD1 HIS 20 0.869 10.855 -10.355
152 HD2 HIS 20 HD2 HIS 20 1.586 8.125 -7.307
153 HE1 HIS 20 HE1 HIS 20 -1.402 10.116 -9.566
154 H PHE 21 H PHE 21 2.312 11.163 -6.229
155 HA PHE 21 HA PHE 21 1.027 13.607 -7.259
156 HB2 PHE 21 HB2 PHE 21 -0.207 11.201 -6.681
157 HB3 PHE 21 HB3 PHE 21 -0.491 12.155 -5.229
158 HD1 PHE 21 HD1 PHE 21 -0.635 12.543 -8.938
159 HD2 PHE 21 HD2 PHE 21 -2.381 13.448 -5.163
160 HE1 PHE 21 HE1 PHE 21 -2.476 13.713 -10.075
161 HE2 PHE 21 HE2 PHE 21 -4.227 14.619 -6.293
162 HZ PHE 21 HZ PHE 21 -4.276 14.753 -8.752
163 HN1 NH2 22 HN1 NH2 22 3.584 13.566 -5.745
164 HN2 NH2 22 HN2 NH2 22 3.284 14.349 -4.163
Start of MODEL 18
1 H1 GLY 1 H1 GLY 1 -4.157 -19.085 1.148
2 H2 GLY 1 H2 GLY 1 -3.731 -18.308 -0.224
3 H3 GLY 1 H3 GLY 1 -2.764 -19.007 0.653
4 HA2 GLY 1 HA2 GLY 1 -4.092 -17.183 2.324
5 HA3 GLY 1 HA3 GLY 1 -2.393 -17.105 1.883
6 H LEU 2 H LEU 2 -5.599 -15.960 1.182
7 HA LEU 2 HA LEU 2 -4.961 -14.472 -1.147
8 HB2 LEU 2 HB2 LEU 2 -7.181 -14.124 0.860
9 HB3 LEU 2 HB3 LEU 2 -7.083 -13.284 -0.685
10 HG LEU 2 HG LEU 2 -7.013 -16.244 -0.770
11 HD11 LEU 2 HD11 LEU 2 -9.657 -15.943 -0.819
12 HD12 LEU 2 HD12 LEU 2 -9.266 -14.677 0.345
13 HD13 LEU 2 HD13 LEU 2 -8.775 -16.343 0.656
14 HD21 LEU 2 HD21 LEU 2 -8.805 -15.436 -2.597
15 HD22 LEU 2 HD22 LEU 2 -7.066 -15.478 -2.896
16 HD23 LEU 2 HD23 LEU 2 -7.849 -13.962 -2.447
17 H PHE 3 H PHE 3 -5.832 -13.194 2.067
18 HA PHE 3 HA PHE 3 -4.890 -10.620 1.662
19 HB2 PHE 3 HB2 PHE 3 -5.966 -12.099 3.814
20 HB3 PHE 3 HB3 PHE 3 -4.474 -11.376 4.404
21 HD1 PHE 3 HD1 PHE 3 -4.210 -8.946 4.464
22 HD2 PHE 3 HD2 PHE 3 -7.868 -10.761 3.265
23 HE1 PHE 3 HE1 PHE 3 -5.372 -6.800 4.772
24 HE2 PHE 3 HE2 PHE 3 -9.036 -8.617 3.571
25 HZ PHE 3 HZ PHE 3 -7.788 -6.633 4.324
26 H GLY 4 H GLY 4 -3.153 -13.530 2.444
27 HA2 GLY 4 HA2 GLY 4 -0.817 -12.574 3.562
28 HA3 GLY 4 HA3 GLY 4 -0.897 -13.966 2.492
29 H VAL 5 H VAL 5 -1.865 -12.377 0.225
30 HA VAL 5 HA VAL 5 0.727 -11.283 -0.580
31 HB VAL 5 HB VAL 5 -1.690 -11.976 -2.256
32 HG11 VAL 5 HG11 VAL 5 0.939 -10.733 -2.892
33 HG12 VAL 5 HG12 VAL 5 0.222 -11.843 -4.061
34 HG13 VAL 5 HG13 VAL 5 -0.659 -10.400 -3.559
35 HG21 VAL 5 HG21 VAL 5 0.825 -13.443 -1.564
36 HG22 VAL 5 HG22 VAL 5 -0.840 -14.024 -1.575
37 HG23 VAL 5 HG23 VAL 5 0.005 -13.745 -3.097
38 H LEU 6 H LEU 6 -2.492 -10.318 0.179
39 HA LEU 6 HA LEU 6 -2.798 -7.972 -1.254
40 HB2 LEU 6 HB2 LEU 6 -3.786 -8.982 1.350
41 HB3 LEU 6 HB3 LEU 6 -3.960 -7.255 1.041
42 HG LEU 6 HG LEU 6 -5.051 -9.428 -0.745
43 HD11 LEU 6 HD11 LEU 6 -7.153 -8.030 0.406
44 HD12 LEU 6 HD12 LEU 6 -6.042 -8.333 1.740
45 HD13 LEU 6 HD13 LEU 6 -6.651 -9.679 0.777
46 HD21 LEU 6 HD21 LEU 6 -4.752 -7.509 -2.051
47 HD22 LEU 6 HD22 LEU 6 -5.232 -6.431 -0.740
48 HD23 LEU 6 HD23 LEU 6 -6.439 -7.437 -1.541
49 H ALA 7 H ALA 7 -0.721 -8.656 1.442
50 HA ALA 7 HA ALA 7 -0.223 -6.076 2.386
51 HB1 ALA 7 HB1 ALA 7 1.192 -8.671 2.485
52 HB2 ALA 7 HB2 ALA 7 2.150 -7.229 2.824
53 HB3 ALA 7 HB3 ALA 7 0.718 -7.583 3.791
54 H LYS 8 H LYS 8 0.907 -7.721 -0.467
55 HA LYS 8 HA LYS 8 3.154 -6.158 -1.066
56 HB2 LYS 8 HB2 LYS 8 1.966 -8.310 -2.215
57 HB3 LYS 8 HB3 LYS 8 1.505 -7.048 -3.352
58 HG2 LYS 8 HG2 LYS 8 4.213 -6.620 -2.875
59 HG3 LYS 8 HG3 LYS 8 4.040 -8.373 -2.999
60 HD2 LYS 8 HD2 LYS 8 2.535 -7.671 -5.083
61 HD3 LYS 8 HD3 LYS 8 3.598 -6.263 -5.040
62 HE2 LYS 8 HE2 LYS 8 4.891 -7.585 -6.347
63 HE3 LYS 8 HE3 LYS 8 5.430 -8.196 -4.784
64 HZ1 LYS 8 HZ1 LYS 8 4.237 -10.121 -5.020
65 HZ2 LYS 8 HZ2 LYS 8 4.670 -9.831 -6.630
66 HZ3 LYS 8 HZ3 LYS 8 3.114 -9.445 -6.090
67 H VAL 9 H VAL 9 -0.184 -5.403 -1.146
68 HA VAL 9 HA VAL 9 0.442 -2.815 -2.389
69 HB VAL 9 HB VAL 9 -0.718 -4.314 -4.030
70 HG11 VAL 9 HG11 VAL 9 -2.544 -5.454 -3.485
71 HG12 VAL 9 HG12 VAL 9 -2.357 -4.876 -1.827
72 HG13 VAL 9 HG13 VAL 9 -3.364 -3.982 -2.966
73 HG21 VAL 9 HG21 VAL 9 -2.577 -2.072 -3.388
74 HG22 VAL 9 HG22 VAL 9 -0.900 -1.709 -3.793
75 HG23 VAL 9 HG23 VAL 9 -1.915 -2.576 -4.944
76 H ALA 10 H ALA 10 0.314 -3.359 0.361
77 HA ALA 10 HA ALA 10 -1.685 -1.448 1.147
78 HB1 ALA 10 HB1 ALA 10 -2.372 -3.301 2.991
79 HB2 ALA 10 HB2 ALA 10 -3.277 -2.997 1.508
80 HB3 ALA 10 HB3 ALA 10 -2.118 -4.325 1.577
81 HB2 I4G 11 HB2 I4G 11 -0.409 -0.007 0.918
82 HB3 I4G 11 HB3 I4G 11 0.628 1.019 1.651
83 HG I4G 11 HG I4G 11 -1.913 1.650 1.568
84 HD13 I4G 11 HD13 I4G 11 -1.747 -0.229 3.991
85 HD11 I4G 11 HD11 I4G 11 -3.112 0.840 3.618
86 HD12 I4G 11 HD12 I4G 11 -2.719 -0.501 2.538
87 HD23 I4G 11 HD23 I4G 11 -0.181 3.001 2.737
88 HD22 I4G 11 HD22 I4G 11 -0.254 1.910 4.130
89 HD21 I4G 11 HD21 I4G 11 -1.660 2.901 3.702
90 HA2 I4G 11 HA2 I4G 11 1.723 -1.117 4.029
91 HA3 I4G 11 HA3 I4G 11 0.922 0.270 4.349
92 H HIS 12 H HIS 12 2.458 -0.711 1.438
93 HA HIS 12 HA HIS 12 4.404 1.474 1.755
94 HB2 HIS 12 HB2 HIS 12 5.950 0.254 0.543
95 HB3 HIS 12 HB3 HIS 12 5.078 -1.036 1.368
96 HD1 HIS 12 HD1 HIS 12 6.531 -0.653 -1.683
97 HD2 HIS 12 HD2 HIS 12 2.617 -1.552 -0.615
98 HE1 HIS 12 HE1 HIS 12 5.530 -1.794 -3.689
99 H VAL 13 H VAL 13 1.665 0.474 0.017
100 HA VAL 13 HA VAL 13 2.004 1.499 -2.519
101 HB VAL 13 HB VAL 13 -0.495 1.636 -0.827
102 HG11 VAL 13 HG11 VAL 13 -1.443 1.439 -3.300
103 HG12 VAL 13 HG12 VAL 13 -1.096 2.999 -2.551
104 HG13 VAL 13 HG13 VAL 13 0.063 2.279 -3.669
105 HG21 VAL 13 HG21 VAL 13 0.407 -0.442 -2.819
106 HG22 VAL 13 HG22 VAL 13 0.415 -0.630 -1.066
107 HG23 VAL 13 HG23 VAL 13 -1.114 -0.446 -1.926
108 H VAL 14 H VAL 14 0.609 3.254 0.259
109 HA VAL 14 HA VAL 14 0.327 5.737 -0.900
110 HB VAL 14 HB VAL 14 1.122 5.137 1.953
111 HG11 VAL 14 HG11 VAL 14 1.416 7.354 2.078
112 HG12 VAL 14 HG12 VAL 14 0.611 7.644 0.535
113 HG13 VAL 14 HG13 VAL 14 -0.343 7.442 2.005
114 HG21 VAL 14 HG21 VAL 14 -1.633 5.789 0.962
115 HG22 VAL 14 HG22 VAL 14 -1.027 4.133 0.962
116 HG23 VAL 14 HG23 VAL 14 -1.152 5.026 2.477
117 H GLY 15 H GLY 15 3.232 4.174 0.256
118 HA2 GLY 15 HA2 GLY 15 4.907 6.433 0.415
119 HA3 GLY 15 HA3 GLY 15 5.444 4.780 0.163
120 H ALA 16 H ALA 16 3.897 4.473 -2.306
121 HA ALA 16 HA ALA 16 5.775 5.845 -4.076
122 HB1 ALA 16 HB1 ALA 16 5.105 4.244 -5.763
123 HB2 ALA 16 HB2 ALA 16 5.522 3.402 -4.270
124 HB3 ALA 16 HB3 ALA 16 3.829 3.629 -4.710
125 H ILE 17 H ILE 17 2.285 5.365 -3.655
126 HA ILE 17 HA ILE 17 1.384 6.822 -5.846
127 HB ILE 17 HB ILE 17 0.074 6.613 -3.133
128 HG12 ILE 17 HG12 ILE 17 0.538 4.413 -4.064
129 HG13 ILE 17 HG13 ILE 17 -1.188 4.745 -4.161
130 HG21 ILE 17 HG21 ILE 17 -1.237 8.198 -4.078
131 HG22 ILE 17 HG22 ILE 17 -0.777 7.756 -5.721
132 HG23 ILE 17 HG23 ILE 17 -1.969 6.792 -4.850
133 HD11 ILE 17 HD11 ILE 17 -0.250 5.650 -6.576
134 HD12 ILE 17 HD12 ILE 17 0.734 4.218 -6.270
135 HD13 ILE 17 HD13 ILE 17 -1.025 4.094 -6.278
136 H ALA 18 H ALA 18 2.406 7.912 -2.659
137 HA ALA 18 HA ALA 18 1.580 10.623 -3.030
138 HB1 ALA 18 HB1 ALA 18 1.791 9.707 -0.801
139 HB2 ALA 18 HB2 ALA 18 3.512 9.416 -1.055
140 HB3 ALA 18 HB3 ALA 18 2.896 11.067 -0.998
141 H GLU 19 H GLU 19 4.114 8.809 -4.288
142 HA GLU 19 HA GLU 19 6.108 10.868 -4.381
143 HB2 GLU 19 HB2 GLU 19 6.350 8.255 -4.559
144 HB3 GLU 19 HB3 GLU 19 6.091 8.551 -6.273
145 HG2 GLU 19 HG2 GLU 19 8.135 10.178 -4.864
146 HG3 GLU 19 HG3 GLU 19 8.504 8.491 -5.218
147 H HIS 20 H HIS 20 3.915 9.418 -6.780
148 HA HIS 20 HA HIS 20 4.640 11.315 -8.810
149 HB2 HIS 20 HB2 HIS 20 3.295 10.095 -10.238
150 HB3 HIS 20 HB3 HIS 20 3.707 8.869 -9.043
151 HD1 HIS 20 HD1 HIS 20 0.857 10.829 -10.392
152 HD2 HIS 20 HD2 HIS 20 1.580 8.116 -7.330
153 HE1 HIS 20 HE1 HIS 20 -1.411 10.096 -9.593
154 H PHE 21 H PHE 21 2.307 11.156 -6.273
155 HA PHE 21 HA PHE 21 1.025 13.599 -7.311
156 HB2 PHE 21 HB2 PHE 21 -0.209 11.191 -6.717
157 HB3 PHE 21 HB3 PHE 21 -0.504 12.164 -5.280
158 HD1 PHE 21 HD2 PHE 21 -0.803 14.847 -6.377
159 HD2 PHE 21 HD1 PHE 21 -2.213 11.115 -7.860
160 HE1 PHE 21 HE2 PHE 21 -2.639 16.005 -7.536
161 HE2 PHE 21 HE1 PHE 21 -4.050 12.267 -9.022
162 HZ PHE 21 HZ PHE 21 -4.266 14.715 -8.861
163 HN1 NH2 22 HN1 NH2 22 3.584 13.529 -5.778
164 HN2 NH2 22 HN2 NH2 22 3.282 14.326 -4.204
Start of MODEL 19
1 H1 GLY 1 H1 GLY 1 -3.118 -17.637 3.180
2 H2 GLY 1 H2 GLY 1 -1.892 -16.956 2.343
3 H3 GLY 1 H3 GLY 1 -3.068 -16.201 2.827
4 HA2 GLY 1 HA2 GLY 1 -2.943 -18.119 0.617
5 HA3 GLY 1 HA3 GLY 1 -4.504 -17.847 1.375
6 H LEU 2 H LEU 2 -5.606 -15.935 1.007
7 HA LEU 2 HA LEU 2 -4.866 -14.555 -1.413
8 HB2 LEU 2 HB2 LEU 2 -7.246 -15.196 -0.227
9 HB3 LEU 2 HB3 LEU 2 -7.105 -13.476 0.135
10 HG LEU 2 HG LEU 2 -6.709 -13.176 -2.382
11 HD11 LEU 2 HD11 LEU 2 -8.291 -15.617 -2.835
12 HD12 LEU 2 HD12 LEU 2 -6.590 -15.866 -2.443
13 HD13 LEU 2 HD13 LEU 2 -7.039 -14.870 -3.827
14 HD21 LEU 2 HD21 LEU 2 -8.886 -12.901 -0.868
15 HD22 LEU 2 HD22 LEU 2 -9.465 -14.169 -1.949
16 HD23 LEU 2 HD23 LEU 2 -8.901 -12.635 -2.612
17 H PHE 3 H PHE 3 -5.753 -13.405 1.849
18 HA PHE 3 HA PHE 3 -4.875 -10.783 1.516
19 HB2 PHE 3 HB2 PHE 3 -5.955 -12.332 3.605
20 HB3 PHE 3 HB3 PHE 3 -4.456 -11.653 4.233
21 HD1 PHE 3 HD1 PHE 3 -4.179 -9.252 4.469
22 HD2 PHE 3 HD2 PHE 3 -7.823 -10.927 3.044
23 HE1 PHE 3 HE1 PHE 3 -5.317 -7.108 4.868
24 HE2 PHE 3 HE2 PHE 3 -8.967 -8.785 3.440
25 HZ PHE 3 HZ PHE 3 -7.714 -6.871 4.353
26 H GLY 4 H GLY 4 -3.098 -13.693 2.202
27 HA2 GLY 4 HA2 GLY 4 -0.779 -12.744 3.357
28 HA3 GLY 4 HA3 GLY 4 -0.837 -14.099 2.239
29 H VAL 5 H VAL 5 -1.829 -12.437 0.031
30 HA VAL 5 HA VAL 5 0.752 -11.286 -0.734
31 HB VAL 5 HB VAL 5 -1.660 -11.940 -2.433
32 HG11 VAL 5 HG11 VAL 5 0.474 -11.744 -4.122
33 HG12 VAL 5 HG12 VAL 5 -0.721 -10.475 -3.847
34 HG13 VAL 5 HG13 VAL 5 0.806 -10.456 -2.966
35 HG21 VAL 5 HG21 VAL 5 0.968 -13.365 -2.045
36 HG22 VAL 5 HG22 VAL 5 -0.637 -13.955 -1.616
37 HG23 VAL 5 HG23 VAL 5 -0.196 -13.750 -3.311
38 H LEU 6 H LEU 6 -2.481 -10.386 0.054
39 HA LEU 6 HA LEU 6 -2.808 -7.989 -1.286
40 HB2 LEU 6 HB2 LEU 6 -3.796 -9.119 1.264
41 HB3 LEU 6 HB3 LEU 6 -3.974 -7.379 1.045
42 HG LEU 6 HG LEU 6 -5.077 -9.488 -0.812
43 HD11 LEU 6 HD11 LEU 6 -7.240 -8.297 0.184
44 HD12 LEU 6 HD12 LEU 6 -6.169 -8.119 1.574
45 HD13 LEU 6 HD13 LEU 6 -6.513 -9.722 0.925
46 HD21 LEU 6 HD21 LEU 6 -6.427 -7.157 -1.269
47 HD22 LEU 6 HD22 LEU 6 -5.095 -7.772 -2.249
48 HD23 LEU 6 HD23 LEU 6 -4.783 -6.584 -0.984
49 H ALA 7 H ALA 7 -0.732 -8.755 1.391
50 HA ALA 7 HA ALA 7 -0.262 -6.196 2.419
51 HB1 ALA 7 HB1 ALA 7 1.302 -7.186 3.705
52 HB2 ALA 7 HB2 ALA 7 0.578 -8.668 3.081
53 HB3 ALA 7 HB3 ALA 7 2.046 -8.026 2.344
54 H LYS 8 H LYS 8 0.838 -7.722 -0.493
55 HA LYS 8 HA LYS 8 3.111 -6.136 -1.007
56 HB2 LYS 8 HB2 LYS 8 1.926 -8.277 -2.227
57 HB3 LYS 8 HB3 LYS 8 1.557 -6.983 -3.359
58 HG2 LYS 8 HG2 LYS 8 4.321 -6.909 -2.496
59 HG3 LYS 8 HG3 LYS 8 3.892 -8.454 -3.233
60 HD2 LYS 8 HD2 LYS 8 3.121 -7.357 -5.224
61 HD3 LYS 8 HD3 LYS 8 3.315 -5.769 -4.479
62 HE2 LYS 8 HE2 LYS 8 5.784 -7.205 -4.315
63 HE3 LYS 8 HE3 LYS 8 5.202 -7.237 -5.979
64 HZ1 LYS 8 HZ1 LYS 8 5.293 -4.723 -4.428
65 HZ2 LYS 8 HZ2 LYS 8 5.223 -4.926 -6.106
66 HZ3 LYS 8 HZ3 LYS 8 6.649 -5.287 -5.270
67 H VAL 9 H VAL 9 -0.195 -5.373 -1.009
68 HA VAL 9 HA VAL 9 0.394 -2.774 -2.233
69 HB VAL 9 HB VAL 9 -0.691 -4.183 -3.959
70 HG11 VAL 9 HG11 VAL 9 -2.348 -5.554 -3.414
71 HG12 VAL 9 HG12 VAL 9 -2.377 -4.899 -1.775
72 HG13 VAL 9 HG13 VAL 9 -3.365 -4.163 -3.038
73 HG21 VAL 9 HG21 VAL 9 -1.077 -1.615 -3.514
74 HG22 VAL 9 HG22 VAL 9 -1.972 -2.468 -4.773
75 HG23 VAL 9 HG23 VAL 9 -2.730 -2.147 -3.212
76 H ALA 10 H ALA 10 0.347 -3.078 0.435
77 HA ALA 10 HA ALA 10 -1.712 -1.311 1.245
78 HB1 ALA 10 HB1 ALA 10 -3.251 -2.608 2.254
79 HB2 ALA 10 HB2 ALA 10 -2.662 -3.836 1.133
80 HB3 ALA 10 HB3 ALA 10 -2.058 -3.792 2.789
81 HB2 I4G 11 HB2 I4G 11 -0.476 0.163 1.129
82 HB3 I4G 11 HB3 I4G 11 0.494 1.184 1.957
83 HG I4G 11 HG I4G 11 -2.080 1.701 1.812
84 HD13 I4G 11 HD13 I4G 11 -1.876 -0.255 4.171
85 HD11 I4G 11 HD11 I4G 11 -3.283 0.761 3.803
86 HD12 I4G 11 HD12 I4G 11 -2.801 -0.521 2.686
87 HD23 I4G 11 HD23 I4G 11 -0.444 3.091 3.068
88 HD22 I4G 11 HD22 I4G 11 -0.493 1.948 4.420
89 HD21 I4G 11 HD21 I4G 11 -1.936 2.884 3.993
90 HA2 I4G 11 HA2 I4G 11 1.550 -1.050 4.287
91 HA3 I4G 11 HA3 I4G 11 0.786 0.369 4.556
92 H HIS 12 H HIS 12 2.268 -0.571 1.628
93 HA HIS 12 HA HIS 12 4.274 1.555 2.002
94 HB2 HIS 12 HB2 HIS 12 5.522 0.143 0.180
95 HB3 HIS 12 HB3 HIS 12 5.586 -0.348 1.870
96 HD1 HIS 12 HD1 HIS 12 5.575 -2.821 1.860
97 HD2 HIS 12 HD2 HIS 12 2.836 -1.249 -0.839
98 HE1 HIS 12 HE1 HIS 12 4.349 -4.803 0.917
99 H VAL 13 H VAL 13 1.567 0.612 0.284
100 HA VAL 13 HA VAL 13 2.080 1.455 -2.327
101 HB VAL 13 HB VAL 13 -0.532 1.712 -0.831
102 HG11 VAL 13 HG11 VAL 13 0.185 2.556 -3.402
103 HG12 VAL 13 HG12 VAL 13 -0.742 1.072 -3.625
104 HG13 VAL 13 HG13 VAL 13 -1.439 2.423 -2.731
105 HG21 VAL 13 HG21 VAL 13 0.576 -0.594 -2.429
106 HG22 VAL 13 HG22 VAL 13 0.327 -0.557 -0.683
107 HG23 VAL 13 HG23 VAL 13 -1.059 -0.497 -1.773
108 H VAL 14 H VAL 14 0.721 3.302 0.399
109 HA VAL 14 HA VAL 14 0.343 5.735 -0.849
110 HB VAL 14 HB VAL 14 1.268 5.267 1.989
111 HG11 VAL 14 HG11 VAL 14 -0.219 7.531 2.058
112 HG12 VAL 14 HG12 VAL 14 1.542 7.499 1.953
113 HG13 VAL 14 HG13 VAL 14 0.574 7.699 0.492
114 HG21 VAL 14 HG21 VAL 14 -0.972 5.120 2.619
115 HG22 VAL 14 HG22 VAL 14 -1.544 5.818 1.104
116 HG23 VAL 14 HG23 VAL 14 -0.899 4.177 1.131
117 H GLY 15 H GLY 15 3.314 4.305 0.360
118 HA2 GLY 15 HA2 GLY 15 4.945 6.595 0.289
119 HA3 GLY 15 HA3 GLY 15 5.510 4.936 0.152
120 H ALA 16 H ALA 16 3.778 4.539 -2.259
121 HA ALA 16 HA ALA 16 5.668 5.677 -4.175
122 HB1 ALA 16 HB1 ALA 16 3.561 3.808 -5.078
123 HB2 ALA 16 HB2 ALA 16 5.269 3.890 -5.510
124 HB3 ALA 16 HB3 ALA 16 4.781 3.167 -3.976
125 H ILE 17 H ILE 17 2.151 5.361 -3.725
126 HA ILE 17 HA ILE 17 1.327 6.847 -5.925
127 HB ILE 17 HB ILE 17 -0.012 6.674 -3.223
128 HG12 ILE 17 HG12 ILE 17 -0.404 5.018 -5.724
129 HG13 ILE 17 HG13 ILE 17 0.419 4.479 -4.264
130 HG21 ILE 17 HG21 ILE 17 -1.860 6.930 -5.356
131 HG22 ILE 17 HG22 ILE 17 -1.566 8.040 -4.019
132 HG23 ILE 17 HG23 ILE 17 -0.658 8.211 -5.521
133 HD11 ILE 17 HD11 ILE 17 -2.481 5.254 -4.470
134 HD12 ILE 17 HD12 ILE 17 -1.844 3.612 -4.377
135 HD13 ILE 17 HD13 ILE 17 -1.657 4.710 -3.009
136 H ALA 18 H ALA 18 2.373 7.905 -2.736
137 HA ALA 18 HA ALA 18 1.634 10.638 -3.093
138 HB1 ALA 18 HB1 ALA 18 3.670 9.516 -1.176
139 HB2 ALA 18 HB2 ALA 18 2.819 11.056 -1.051
140 HB3 ALA 18 HB3 ALA 18 1.931 9.541 -0.879
141 H GLU 19 H GLU 19 4.142 8.742 -4.332
142 HA GLU 19 HA GLU 19 6.178 10.742 -4.471
143 HB2 GLU 19 HB2 GLU 19 6.335 8.126 -4.673
144 HB3 GLU 19 HB3 GLU 19 6.052 8.440 -6.380
145 HG2 GLU 19 HG2 GLU 19 8.378 8.327 -6.130
146 HG3 GLU 19 HG3 GLU 19 8.000 10.042 -6.279
147 H HIS 20 H HIS 20 3.915 9.378 -6.858
148 HA HIS 20 HA HIS 20 4.665 11.285 -8.871
149 HB2 HIS 20 HB2 HIS 20 3.282 10.113 -10.303
150 HB3 HIS 20 HB3 HIS 20 3.679 8.862 -9.128
151 HD1 HIS 20 HD1 HIS 20 0.859 10.929 -10.395
152 HD2 HIS 20 HD2 HIS 20 1.553 8.098 -7.434
153 HE1 HIS 20 HE1 HIS 20 -1.418 10.223 -9.592
154 H PHE 21 H PHE 21 2.355 11.144 -6.313
155 HA PHE 21 HA PHE 21 1.065 13.588 -7.338
156 HB2 PHE 21 HB2 PHE 21 -0.173 11.236 -6.675
157 HB3 PHE 21 HB3 PHE 21 -0.315 12.148 -5.177
158 HD1 PHE 21 HD1 PHE 21 -0.846 12.535 -8.845
159 HD2 PHE 21 HD2 PHE 21 -2.092 13.586 -4.913
160 HE1 PHE 21 HE1 PHE 21 -2.758 13.766 -9.783
161 HE2 PHE 21 HE2 PHE 21 -4.006 14.819 -5.846
162 HZ PHE 21 HZ PHE 21 -4.342 14.910 -8.283
163 HN1 NH2 22 HN1 NH2 22 3.706 13.537 -5.934
164 HN2 NH2 22 HN2 NH2 22 3.491 14.393 -4.377
Start of MODEL 20
1 H1 GLY 1 H1 GLY 1 -2.727 -17.581 2.742
2 H2 GLY 1 H2 GLY 1 -1.577 -17.588 1.583
3 H3 GLY 1 H3 GLY 1 -2.259 -16.360 2.049
4 HA2 GLY 1 HA2 GLY 1 -3.185 -18.332 0.169
5 HA3 GLY 1 HA3 GLY 1 -4.429 -17.828 1.304
6 H LEU 2 H LEU 2 -5.600 -16.091 0.799
7 HA LEU 2 HA LEU 2 -4.977 -14.641 -1.619
8 HB2 LEU 2 HB2 LEU 2 -7.302 -15.413 -0.480
9 HB3 LEU 2 HB3 LEU 2 -7.215 -13.743 0.074
10 HG LEU 2 HG LEU 2 -8.551 -13.926 -1.949
11 HD11 LEU 2 HD11 LEU 2 -5.916 -12.600 -2.555
12 HD12 LEU 2 HD12 LEU 2 -7.167 -11.908 -1.524
13 HD13 LEU 2 HD13 LEU 2 -7.494 -12.200 -3.233
14 HD21 LEU 2 HD21 LEU 2 -6.454 -15.701 -2.747
15 HD22 LEU 2 HD22 LEU 2 -6.618 -14.408 -3.935
16 HD23 LEU 2 HD23 LEU 2 -8.014 -15.401 -3.515
17 H PHE 3 H PHE 3 -5.813 -13.609 1.695
18 HA PHE 3 HA PHE 3 -4.991 -10.953 1.390
19 HB2 PHE 3 HB2 PHE 3 -6.018 -12.581 3.476
20 HB3 PHE 3 HB3 PHE 3 -4.579 -11.781 4.099
21 HD1 PHE 3 HD1 PHE 3 -4.481 -9.355 4.272
22 HD2 PHE 3 HD2 PHE 3 -7.990 -11.339 2.906
23 HE1 PHE 3 HE1 PHE 3 -5.780 -7.298 4.632
24 HE2 PHE 3 HE2 PHE 3 -9.294 -9.284 3.262
25 HZ PHE 3 HZ PHE 3 -8.190 -7.259 4.124
26 H GLY 4 H GLY 4 -3.187 -13.851 2.052
27 HA2 GLY 4 HA2 GLY 4 -0.887 -12.882 3.238
28 HA3 GLY 4 HA3 GLY 4 -0.922 -14.233 2.114
29 H VAL 5 H VAL 5 -1.963 -12.472 -0.050
30 HA VAL 5 HA VAL 5 0.633 -11.375 -0.840
31 HB VAL 5 HB VAL 5 -1.840 -11.892 -2.498
32 HG11 VAL 5 HG11 VAL 5 -0.898 -10.425 -3.901
33 HG12 VAL 5 HG12 VAL 5 0.643 -10.450 -3.040
34 HG13 VAL 5 HG13 VAL 5 0.274 -11.703 -4.224
35 HG21 VAL 5 HG21 VAL 5 0.757 -13.407 -2.256
36 HG22 VAL 5 HG22 VAL 5 -0.842 -13.961 -1.758
37 HG23 VAL 5 HG23 VAL 5 -0.484 -13.723 -3.469
38 H LEU 6 H LEU 6 -2.602 -10.415 -0.039
39 HA LEU 6 HA LEU 6 -2.782 -7.928 -1.259
40 HB2 LEU 6 HB2 LEU 6 -3.944 -9.164 1.174
41 HB3 LEU 6 HB3 LEU 6 -4.080 -7.415 1.009
42 HG LEU 6 HG LEU 6 -5.049 -9.359 -1.080
43 HD11 LEU 6 HD11 LEU 6 -6.302 -8.414 1.428
44 HD12 LEU 6 HD12 LEU 6 -6.540 -9.914 0.532
45 HD13 LEU 6 HD13 LEU 6 -7.312 -8.426 -0.019
46 HD21 LEU 6 HD21 LEU 6 -4.582 -7.082 -1.855
47 HD22 LEU 6 HD22 LEU 6 -5.643 -6.440 -0.599
48 HD23 LEU 6 HD23 LEU 6 -6.309 -7.442 -1.889
49 H ALA 7 H ALA 7 -0.844 -8.950 1.418
50 HA ALA 7 HA ALA 7 -0.365 -6.455 2.634
51 HB1 ALA 7 HB1 ALA 7 0.734 -9.144 2.784
52 HB2 ALA 7 HB2 ALA 7 1.950 -7.890 3.035
53 HB3 ALA 7 HB3 ALA 7 0.510 -7.938 4.053
54 H LYS 8 H LYS 8 0.784 -7.850 -0.300
55 HA LYS 8 HA LYS 8 3.187 -6.360 -0.560
56 HB2 LYS 8 HB2 LYS 8 1.997 -8.419 -1.947
57 HB3 LYS 8 HB3 LYS 8 1.846 -7.071 -3.066
58 HG2 LYS 8 HG2 LYS 8 4.494 -7.315 -1.850
59 HG3 LYS 8 HG3 LYS 8 4.019 -8.696 -2.843
60 HD2 LYS 8 HD2 LYS 8 3.477 -7.138 -4.685
61 HD3 LYS 8 HD3 LYS 8 4.057 -5.799 -3.690
62 HE2 LYS 8 HE2 LYS 8 5.989 -6.201 -4.792
63 HE3 LYS 8 HE3 LYS 8 6.185 -7.424 -3.537
64 HZ1 LYS 8 HZ1 LYS 8 5.354 -7.784 -6.346
65 HZ2 LYS 8 HZ2 LYS 8 4.983 -8.949 -5.176
66 HZ3 LYS 8 HZ3 LYS 8 6.597 -8.560 -5.500
67 H VAL 9 H VAL 9 -0.048 -5.446 -0.691
68 HA VAL 9 HA VAL 9 0.699 -2.869 -1.868
69 HB VAL 9 HB VAL 9 -1.917 -4.165 -2.596
70 HG11 VAL 9 HG11 VAL 9 -1.907 -2.513 -4.389
71 HG12 VAL 9 HG12 VAL 9 -1.753 -1.732 -2.813
72 HG13 VAL 9 HG13 VAL 9 -0.337 -1.921 -3.848
73 HG21 VAL 9 HG21 VAL 9 -0.498 -5.684 -3.603
74 HG22 VAL 9 HG22 VAL 9 -0.690 -4.476 -4.874
75 HG23 VAL 9 HG23 VAL 9 0.764 -4.484 -3.877
76 H ALA 10 H ALA 10 0.567 -3.116 0.768
77 HA ALA 10 HA ALA 10 -1.575 -1.369 1.488
78 HB1 ALA 10 HB1 ALA 10 -1.619 -4.120 2.722
79 HB2 ALA 10 HB2 ALA 10 -2.696 -2.775 3.099
80 HB3 ALA 10 HB3 ALA 10 -2.758 -3.536 1.510
81 HB2 I4G 11 HB2 I4G 11 -0.370 0.184 1.228
82 HB3 I4G 11 HB3 I4G 11 0.462 1.333 2.036
83 HG I4G 11 HG I4G 11 -2.164 0.417 3.080
84 HD13 I4G 11 HD13 I4G 11 -0.685 3.099 3.308
85 HD11 I4G 11 HD11 I4G 11 -2.255 2.732 4.045
86 HD12 I4G 11 HD12 I4G 11 -0.806 1.876 4.580
87 HD23 I4G 11 HD23 I4G 11 -2.562 1.054 0.709
88 HD22 I4G 11 HD22 I4G 11 -1.787 2.621 0.987
89 HD21 I4G 11 HD21 I4G 11 -3.306 2.222 1.809
90 HA2 I4G 11 HA2 I4G 11 1.653 -0.691 4.499
91 HA3 I4G 11 HA3 I4G 11 0.881 0.746 4.577
92 H HIS 12 H HIS 12 2.202 -0.342 1.672
93 HA HIS 12 HA HIS 12 4.346 1.668 1.902
94 HB2 HIS 12 HB2 HIS 12 5.270 0.081 -0.070
95 HB3 HIS 12 HB3 HIS 12 5.648 -0.177 1.630
96 HD1 HIS 12 HD1 HIS 12 5.451 -2.559 2.214
97 HD2 HIS 12 HD2 HIS 12 2.634 -1.443 -0.629
98 HE1 HIS 12 HE1 HIS 12 4.123 -4.640 1.731
99 H VAL 13 H VAL 13 1.520 0.774 0.301
100 HA VAL 13 HA VAL 13 1.967 1.653 -2.318
101 HB VAL 13 HB VAL 13 -0.584 1.740 -0.701
102 HG11 VAL 13 HG11 VAL 13 0.017 2.779 -3.303
103 HG12 VAL 13 HG12 VAL 13 -1.135 1.449 -3.441
104 HG13 VAL 13 HG13 VAL 13 -1.500 2.831 -2.404
105 HG21 VAL 13 HG21 VAL 13 -1.070 -0.388 -1.501
106 HG22 VAL 13 HG22 VAL 13 0.110 -0.276 -2.807
107 HG23 VAL 13 HG23 VAL 13 0.654 -0.484 -1.142
108 H VAL 14 H VAL 14 0.745 3.426 0.512
109 HA VAL 14 HA VAL 14 0.225 5.873 -0.643
110 HB VAL 14 HB VAL 14 1.412 5.370 2.090
111 HG11 VAL 14 HG11 VAL 14 1.550 7.584 2.256
112 HG12 VAL 14 HG12 VAL 14 0.747 7.813 0.701
113 HG13 VAL 14 HG13 VAL 14 -0.210 7.629 2.171
114 HG21 VAL 14 HG21 VAL 14 -1.469 5.734 1.275
115 HG22 VAL 14 HG22 VAL 14 -0.711 4.180 1.624
116 HG23 VAL 14 HG23 VAL 14 -0.862 5.393 2.895
117 H GLY 15 H GLY 15 3.319 4.725 0.694
118 HA2 GLY 15 HA2 GLY 15 4.829 7.023 0.268
119 HA3 GLY 15 HA3 GLY 15 5.477 5.391 0.285
120 H ALA 16 H ALA 16 3.641 4.729 -2.032
121 HA ALA 16 HA ALA 16 5.487 5.623 -4.101
122 HB1 ALA 16 HB1 ALA 16 3.273 3.577 -4.169
123 HB2 ALA 16 HB2 ALA 16 4.359 3.942 -5.511
124 HB3 ALA 16 HB3 ALA 16 5.000 3.258 -4.017
125 H ILE 17 H ILE 17 1.964 5.516 -3.572
126 HA ILE 17 HA ILE 17 1.184 6.903 -5.851
127 HB ILE 17 HB ILE 17 -0.131 6.956 -3.132
128 HG12 ILE 17 HG12 ILE 17 -0.628 5.173 -5.525
129 HG13 ILE 17 HG13 ILE 17 0.189 4.684 -4.045
130 HG21 ILE 17 HG21 ILE 17 -0.732 8.378 -5.517
131 HG22 ILE 17 HG22 ILE 17 -1.989 7.168 -5.261
132 HG23 ILE 17 HG23 ILE 17 -1.627 8.345 -3.998
133 HD11 ILE 17 HD11 ILE 17 -1.850 5.061 -2.781
134 HD12 ILE 17 HD12 ILE 17 -2.672 5.591 -4.249
135 HD13 ILE 17 HD13 ILE 17 -2.122 3.922 -4.100
136 H ALA 18 H ALA 18 2.313 8.103 -2.743
137 HA ALA 18 HA ALA 18 1.698 10.842 -3.269
138 HB1 ALA 18 HB1 ALA 18 2.841 11.335 -1.247
139 HB2 ALA 18 HB2 ALA 18 1.979 9.816 -0.991
140 HB3 ALA 18 HB3 ALA 18 3.718 9.804 -1.292
141 H GLU 19 H GLU 19 4.112 8.751 -4.380
142 HA GLU 19 HA GLU 19 6.241 10.639 -4.645
143 HB2 GLU 19 HB2 GLU 19 6.264 8.007 -4.683
144 HB3 GLU 19 HB3 GLU 19 6.005 8.233 -6.407
145 HG2 GLU 19 HG2 GLU 19 8.216 8.345 -6.566
146 HG3 GLU 19 HG3 GLU 19 8.064 9.963 -5.884
147 H HIS 20 H HIS 20 3.894 9.249 -6.931
148 HA HIS 20 HA HIS 20 4.736 10.982 -9.065
149 HB2 HIS 20 HB2 HIS 20 3.296 9.788 -10.421
150 HB3 HIS 20 HB3 HIS 20 3.634 8.597 -9.169
151 HD1 HIS 20 HD1 HIS 20 0.914 10.719 -10.561
152 HD2 HIS 20 HD2 HIS 20 1.479 8.038 -7.436
153 HE1 HIS 20 HE1 HIS 20 -1.392 10.174 -9.717
154 H PHE 21 H PHE 21 2.433 11.115 -6.502
155 HA PHE 21 HA PHE 21 1.245 13.538 -7.683
156 HB2 PHE 21 HB2 PHE 21 -0.087 11.300 -6.845
157 HB3 PHE 21 HB3 PHE 21 -0.165 12.318 -5.409
158 HD1 PHE 21 HD1 PHE 21 -0.715 12.506 -9.091
159 HD2 PHE 21 HD2 PHE 21 -1.892 13.823 -5.219
160 HE1 PHE 21 HE1 PHE 21 -2.585 13.757 -10.089
161 HE2 PHE 21 HE2 PHE 21 -3.763 15.076 -6.210
162 HZ PHE 21 HZ PHE 21 -4.112 15.043 -8.647
163 HN1 NH2 22 HN1 NH2 22 3.901 13.453 -6.294
164 HN2 NH2 22 HN2 NH2 22 3.745 14.435 -4.806