Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
642414 | 6r96 RC | 34388 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 PHE 1 HN PHE 1 0.833 3.983 -8.454
2 HA PHE 1 HA PHE 1 3.290 4.328 -7.022
3 HB2 PHE 1 HB1 PHE 1 2.696 6.678 -6.274
4 HB3 PHE 1 HB2 PHE 1 3.064 6.545 -8.031
5 HD1 PHE 1 HD1 PHE 1 1.261 6.677 -9.715
6 HD2 PHE 1 HD2 PHE 1 0.459 7.288 -5.543
7 HE1 PHE 1 HE1 PHE 1 -0.887 7.766 -10.290
8 HE2 PHE 1 HE2 PHE 1 -1.680 8.396 -6.114
9 HZ PHE 1 HZ PHE 1 -2.362 8.628 -8.490
10 H LEU 2 HN LEU 2 3.152 3.696 -4.983
11 HA LEU 2 HA LEU 2 2.359 2.759 -3.175
12 HB2 LEU 2 HB1 LEU 2 -0.194 4.346 -3.707
13 HB3 LEU 2 HB2 LEU 2 -0.103 3.181 -2.377
14 HG LEU 2 HG LEU 2 0.220 5.436 -1.591
15 HD11 LEU 2 HD11 LEU 2 2.221 5.107 -0.190
16 HD12 LEU 2 HD12 LEU 2 2.826 3.816 -1.287
17 HD13 LEU 2 HD13 LEU 2 1.299 3.572 -0.348
18 HD21 LEU 2 HD21 LEU 2 2.845 5.605 -3.186
19 HD22 LEU 2 HD22 LEU 2 2.160 6.840 -2.069
20 HD23 LEU 2 HD23 LEU 2 1.305 6.446 -3.609
21 HA PRO 3 HA PRO 3 -0.247 -0.719 -4.556
22 HB2 PRO 3 HB1 PRO 3 -1.142 -1.782 -2.149
23 HB3 PRO 3 HB2 PRO 3 0.567 -1.972 -2.688
24 HG2 PRO 3 HG1 PRO 3 -0.535 0.199 -0.809
25 HG3 PRO 3 HG2 PRO 3 0.833 -0.949 -0.491
26 HD2 PRO 3 HD1 PRO 3 1.243 1.601 -1.473
27 HD3 PRO 3 HD2 PRO 3 2.262 0.209 -2.059
28 H ILE 4 HN ILE 4 -2.734 -1.332 -3.497
29 HA ILE 4 HA ILE 4 -4.274 0.403 -4.786
30 HB ILE 4 HB ILE 4 -6.243 -0.641 -3.733
31 HG12 ILE 4 HG11 ILE 4 -4.182 -2.138 -1.984
32 HG13 ILE 4 HG12 ILE 4 -5.300 -0.866 -1.395
33 HG21 ILE 4 HG21 ILE 4 -4.957 -1.594 -5.679
34 HG22 ILE 4 HG22 ILE 4 -3.984 -2.595 -4.537
35 HG23 ILE 4 HG23 ILE 4 -5.758 -2.854 -4.685
36 HD11 ILE 4 HD1 ILE 4 -6.134 -3.592 -2.592
37 HD12 ILE 4 HD2 ILE 4 -6.249 -3.076 -0.873
38 HD13 ILE 4 HD3 ILE 4 -7.274 -2.279 -2.121
39 H LEU 5 HN LEU 5 -3.366 1.010 -1.497
40 HA LEU 5 HA LEU 5 -5.216 2.572 -0.385
41 HB2 LEU 5 HB1 LEU 5 -2.231 3.224 -0.553
42 HB3 LEU 5 HB2 LEU 5 -3.357 3.719 0.752
43 HG LEU 5 HG LEU 5 -2.500 0.831 0.081
44 HD11 LEU 5 HD11 LEU 5 -0.690 2.210 1.097
45 HD12 LEU 5 HD12 LEU 5 -1.279 0.937 2.233
46 HD13 LEU 5 HD13 LEU 5 -1.788 2.648 2.459
47 HD21 LEU 5 HD21 LEU 5 -4.305 1.889 2.351
48 HD22 LEU 5 HD22 LEU 5 -3.641 0.221 2.238
49 HD23 LEU 5 HD23 LEU 5 -4.808 0.801 1.001
50 H ALA 6 HN ALA 6 -3.060 3.867 -2.999
51 HA ALA 6 HA ALA 6 -4.054 6.515 -2.830
52 HB1 ALA 6 HB1 ALA 6 -1.913 5.888 -3.963
53 HB2 ALA 6 HB2 ALA 6 -2.815 4.904 -5.158
54 HB3 ALA 6 HB3 ALA 6 -3.011 6.695 -5.139
55 H SER 7 HN SER 7 -5.038 3.753 -4.940
56 HA SER 7 HA SER 7 -7.237 5.047 -6.131
57 HB2 SER 7 HB1 SER 7 -6.892 2.032 -5.644
58 HB3 SER 7 HB2 SER 7 -7.910 2.808 -6.904
59 HG SER 7 HG1 SER 7 -6.042 3.405 -7.969
60 H LEU 8 HN LEU 8 -6.946 3.164 -3.092
61 HA LEU 8 HA LEU 8 -9.737 3.143 -2.582
62 HB2 LEU 8 HB1 LEU 8 -7.407 2.982 -0.616
63 HB3 LEU 8 HB2 LEU 8 -9.126 2.778 -0.161
64 HG LEU 8 HG LEU 8 -7.615 0.974 -2.134
65 HD11 LEU 8 HD11 LEU 8 -7.744 -0.720 -0.296
66 HD12 LEU 8 HD12 LEU 8 -8.504 0.502 0.786
67 HD13 LEU 8 HD13 LEU 8 -6.809 0.735 0.217
68 HD21 LEU 8 HD21 LEU 8 -10.044 0.988 -2.677
69 HD22 LEU 8 HD22 LEU 8 -10.448 0.740 -0.928
70 HD23 LEU 8 HD23 LEU 8 -9.606 -0.551 -1.856
71 H ALA 9 HN ALA 9 -7.229 5.563 -1.691
72 HA ALA 9 HA ALA 9 -8.960 7.328 -0.402
73 HB1 ALA 9 HB1 ALA 9 -6.490 7.953 -2.142
74 HB2 ALA 9 HB2 ALA 9 -7.255 9.073 -0.950
75 HB3 ALA 9 HB3 ALA 9 -6.471 7.554 -0.389
76 H ALA 10 HN ALA 10 -8.226 6.980 -3.889
77 HA ALA 10 HA ALA 10 -9.909 8.960 -4.841
78 HB1 ALA 10 HB1 ALA 10 -9.719 7.723 -6.995
79 HB2 ALA 10 HB2 ALA 10 -8.146 7.587 -6.110
80 HB3 ALA 10 HB3 ALA 10 -9.298 6.209 -6.141
81 H LYS 11 HN LYS 11 -10.743 5.527 -4.203
82 HA LYS 11 HA LYS 11 -13.378 5.857 -5.327
83 HB2 LYS 11 HB1 LYS 11 -12.071 3.805 -5.620
84 HB3 LYS 11 HB2 LYS 11 -12.009 3.518 -3.862
85 HG2 LYS 11 HG1 LYS 11 -14.717 3.670 -5.301
86 HG3 LYS 11 HG2 LYS 11 -13.713 2.200 -5.463
87 HD2 LYS 11 HD1 LYS 11 -13.767 1.681 -3.138
88 HD3 LYS 11 HD2 LYS 11 -14.295 3.324 -2.693
89 HE2 LYS 11 HE1 LYS 11 -16.552 2.830 -3.884
90 HE3 LYS 11 HE2 LYS 11 -16.034 1.092 -3.904
91 HZ1 LYS 11 HZ1 LYS 11 -16.301 2.898 -1.551
92 HZ2 LYS 11 HZ2 LYS 11 -15.611 1.373 -1.467
93 HZ3 LYS 11 HZ3 LYS 11 -17.248 1.530 -1.894
94 H PHE 12 HN PHE 12 -12.139 5.515 -1.954
95 HA PHE 12 HA PHE 12 -14.897 5.567 -0.966
96 HB2 PHE 12 HB1 PHE 12 -12.136 5.129 0.283
97 HB3 PHE 12 HB2 PHE 12 -13.535 5.557 1.332
98 HD1 PHE 12 HD1 PHE 12 -15.502 4.157 1.471
99 HD2 PHE 12 HD2 PHE 12 -12.013 2.882 -0.672
100 HE1 PHE 12 HE1 PHE 12 -16.236 1.804 1.696
101 HE2 PHE 12 HE2 PHE 12 -12.750 0.519 -0.468
102 HZ PHE 12 HZ PHE 12 -14.850 -0.023 0.740
103 H GLY 13 HN GLY 13 -12.288 7.741 -1.574
104 HA2 GLY 13 HA1 GLY 13 -13.974 9.912 -0.492
105 HA3 GLY 13 HA2 GLY 13 -12.227 9.958 -0.920
106 HA PRO 14 HA PRO 14 -14.459 10.624 -5.008
107 HB2 PRO 14 HB1 PRO 14 -17.152 11.404 -4.870
108 HB3 PRO 14 HB2 PRO 14 -16.634 9.702 -5.178
109 HG2 PRO 14 HG1 PRO 14 -17.425 10.940 -2.484
110 HG3 PRO 14 HG2 PRO 14 -18.012 9.392 -3.219
111 HD2 PRO 14 HD1 PRO 14 -15.969 9.416 -1.363
112 HD3 PRO 14 HD2 PRO 14 -15.909 8.284 -2.781
113 H LYS 15 HN LYS 15 -15.298 11.969 -1.887
114 HA LYS 15 HA LYS 15 -14.909 14.718 -2.470
115 HB2 LYS 15 HB1 LYS 15 -14.136 13.104 0.048
116 HB3 LYS 15 HB2 LYS 15 -14.235 14.887 -0.050
117 HG2 LYS 15 HG1 LYS 15 -16.694 14.735 -0.457
118 HG3 LYS 15 HG2 LYS 15 -16.611 12.945 -0.337
119 HD2 LYS 15 HD1 LYS 15 -15.632 13.154 1.973
120 HD3 LYS 15 HD2 LYS 15 -15.752 14.940 1.853
121 HE2 LYS 15 HE1 LYS 15 -18.267 14.771 1.715
122 HE3 LYS 15 HE2 LYS 15 -18.147 12.969 1.830
123 HZ1 LYS 15 HZ1 LYS 15 -18.598 13.981 3.975
124 HZ2 LYS 15 HZ2 LYS 15 -17.196 14.922 3.879
125 HZ3 LYS 15 HZ3 LYS 15 -17.077 13.240 3.988
126 H LEU 16 HN LEU 16 -12.564 12.103 -1.542
127 HA LEU 16 HA LEU 16 -10.341 13.859 -1.572
128 HB2 LEU 16 HB1 LEU 16 -10.442 10.821 -1.653
129 HB3 LEU 16 HB2 LEU 16 -8.956 11.785 -1.423
130 HG LEU 16 HG LEU 16 -11.352 11.794 0.507
131 HD11 LEU 16 HD11 LEU 16 -10.156 9.590 0.414
132 HD12 LEU 16 HD12 LEU 16 -9.869 10.436 1.983
133 HD13 LEU 16 HD13 LEU 16 -8.593 10.431 0.712
134 HD21 LEU 16 HD21 LEU 16 -9.754 12.936 2.073
135 HD22 LEU 16 HD22 LEU 16 -10.056 13.944 0.613
136 HD23 LEU 16 HD23 LEU 16 -8.522 13.007 0.767
137 H PHE 17 HN PHE 17 -11.518 11.493 -4.100
138 HA PHE 17 HA PHE 17 -9.325 12.176 -5.730
139 HB2 PHE 17 HB1 PHE 17 -11.247 10.205 -5.921
140 HB3 PHE 17 HB2 PHE 17 -11.859 11.325 -7.175
141 HD1 PHE 17 HD1 PHE 17 -11.312 10.193 -9.181
142 HD2 PHE 17 HD2 PHE 17 -8.292 10.422 -6.131
143 HE1 PHE 17 HE1 PHE 17 -9.680 9.092 -10.689
144 HE2 PHE 17 HE2 PHE 17 -6.675 9.354 -7.648
145 HZ PHE 17 HZ PHE 17 -7.354 8.699 -9.930
146 H ABA 18 HN AGL 18 -12.543 13.723 -5.521
147 HA ABA 18 HA AGL 18 -11.957 15.595 -7.577
148 HB3 ABA 18 HB2 AGL 18 -13.776 17.004 -6.380
149 HB2 ABA 18 HB1 AGL 18 -13.933 15.642 -5.244
150 HG3 ABA 18 HG AGL 18 -14.884 14.191 -6.962
151 H LEU 19 HN LEU 19 -11.220 15.688 -4.040
152 HA LEU 19 HA LEU 19 -10.190 18.373 -4.393
153 HB2 LEU 19 HB1 LEU 19 -11.391 17.767 -2.329
154 HB3 LEU 19 HB2 LEU 19 -10.190 16.491 -1.979
155 HG LEU 19 HG LEU 19 -8.400 18.234 -1.731
156 HD11 LEU 19 HD11 LEU 19 -9.024 20.656 -1.571
157 HD12 LEU 19 HD12 LEU 19 -10.679 20.267 -2.176
158 HD13 LEU 19 HD13 LEU 19 -9.236 20.017 -3.235
159 HD21 LEU 19 HD21 LEU 19 -9.664 17.466 0.261
160 HD22 LEU 19 HD22 LEU 19 -10.884 18.775 0.003
161 HD23 LEU 19 HD23 LEU 19 -9.178 19.194 0.407
162 H VAL 20 HN VAL 20 -8.612 15.269 -3.338
163 HA VAL 20 HA VAL 20 -6.051 16.491 -3.180
164 HB VAL 20 HB VAL 20 -6.841 13.535 -3.158
165 HG11 VAL 20 HG11 VAL 20 -4.612 13.266 -1.969
166 HG12 VAL 20 HG12 VAL 20 -4.411 13.802 -3.669
167 HG13 VAL 20 HG13 VAL 20 -4.234 14.992 -2.326
168 HG21 VAL 20 HG21 VAL 20 -6.366 15.575 -0.878
169 HG22 VAL 20 HG22 VAL 20 -7.951 14.821 -1.309
170 HG23 VAL 20 HG23 VAL 20 -6.614 13.807 -0.657
171 H THR 21 HN THR 21 -7.550 14.192 -5.491
172 HA THR 21 HA THR 21 -5.144 14.428 -7.162
173 HB THR 21 HB THR 21 -7.498 12.630 -7.760
174 HG1 THR 21 HG1 THR 21 -6.203 11.091 -6.630
175 HG21 THR 21 HG21 THR 21 -5.614 11.216 -8.749
176 HG22 THR 21 HG22 THR 21 -4.431 12.488 -8.274
177 HG23 THR 21 HG23 THR 21 -5.676 12.823 -9.530
178 H LYS 22 HN LYS 22 -7.927 16.115 -6.842
179 HA LYS 22 HA LYS 22 -9.141 17.493 -8.070
180 HB2 LYS 22 HB1 LYS 22 -6.609 18.158 -8.256
181 HB3 LYS 22 HB2 LYS 22 -6.807 17.835 -9.989
182 HG2 LYS 22 HG1 LYS 22 -8.458 19.786 -8.231
183 HG3 LYS 22 HG2 LYS 22 -7.035 20.278 -9.174
184 HD2 LYS 22 HD1 LYS 22 -9.719 19.252 -10.310
185 HD3 LYS 22 HD2 LYS 22 -9.227 20.955 -10.213
186 HE2 LYS 22 HE1 LYS 22 -7.889 18.775 -11.980
187 HE3 LYS 22 HE2 LYS 22 -9.002 20.083 -12.529
188 HZ1 LYS 22 HZ1 LYS 22 -6.353 20.439 -11.236
189 HZ2 LYS 22 HZ2 LYS 22 -7.372 21.693 -11.767
190 HZ3 LYS 22 HZ3 LYS 22 -6.688 20.615 -12.891
191 H LYS 23 HN LYS 23 -9.917 14.900 -8.852
192 HA LYS 23 HA LYS 23 -10.018 15.027 -11.788
193 HB2 LYS 23 HB1 LYS 23 -10.413 12.888 -9.735
194 HB3 LYS 23 HB2 LYS 23 -11.347 12.694 -11.236
195 HG2 LYS 23 HG1 LYS 23 -8.299 13.033 -11.040
196 HG3 LYS 23 HG2 LYS 23 -9.174 11.508 -11.327
197 HD2 LYS 23 HD1 LYS 23 -8.899 13.896 -13.267
198 HD3 LYS 23 HD2 LYS 23 -8.204 12.269 -13.371
199 HE2 LYS 23 HE1 LYS 23 -9.901 12.017 -14.904
200 HE3 LYS 23 HE2 LYS 23 -10.743 11.412 -13.429
201 HZ1 LYS 23 HZ1 LYS 23 -10.925 14.154 -14.605
202 HZ2 LYS 23 HZ2 LYS 23 -11.733 13.668 -13.213
203 HZ3 LYS 23 HZ3 LYS 23 -12.105 12.947 -14.690
204 H ABA 24 HN AGL 24 -11.889 16.460 -9.543
205 HA ABA 24 HA AGL 24 -14.353 16.166 -11.145
206 HB3 ABA 24 HB2 AGL 24 -15.432 17.544 -9.321
207 HB2 ABA 24 HB1 AGL 24 -13.871 17.577 -8.457
208 HG3 ABA 24 HG AGL 24 -15.531 14.995 -9.119
Start of MODEL 2
1 H1 PHE 1 HN PHE 1 2.300 0.435 1.669
2 HA PHE 1 HA PHE 1 3.626 1.772 -0.276
3 HB2 PHE 1 HB1 PHE 1 4.980 -0.492 -0.599
4 HB3 PHE 1 HB2 PHE 1 5.002 0.342 0.989
5 HD1 PHE 1 HD1 PHE 1 4.218 -0.684 2.937
6 HD2 PHE 1 HD2 PHE 1 3.339 -2.476 -0.867
7 HE1 PHE 1 HE1 PHE 1 3.322 -2.679 4.089
8 HE2 PHE 1 HE2 PHE 1 2.402 -4.461 0.294
9 HZ PHE 1 HZ PHE 1 2.405 -4.567 2.769
10 H LEU 2 HN LEU 2 1.150 -0.600 -0.766
11 HA LEU 2 HA LEU 2 1.359 -1.153 -3.443
12 HB2 LEU 2 HB1 LEU 2 -1.232 -0.516 -1.925
13 HB3 LEU 2 HB2 LEU 2 -1.096 -1.413 -3.472
14 HG LEU 2 HG LEU 2 -1.560 -3.019 -1.899
15 HD11 LEU 2 HD11 LEU 2 1.503 -3.195 -2.162
16 HD12 LEU 2 HD12 LEU 2 0.298 -3.718 -3.403
17 HD13 LEU 2 HD13 LEU 2 0.371 -4.543 -1.803
18 HD21 LEU 2 HD21 LEU 2 0.596 -2.045 0.063
19 HD22 LEU 2 HD22 LEU 2 -0.558 -3.399 0.278
20 HD23 LEU 2 HD23 LEU 2 -1.172 -1.711 0.178
21 HA PRO 3 HA PRO 3 0.767 2.791 -5.302
22 HB2 PRO 3 HB1 PRO 3 -0.058 2.172 -7.917
23 HB3 PRO 3 HB2 PRO 3 1.594 1.791 -7.301
24 HG2 PRO 3 HG1 PRO 3 -0.833 -0.092 -7.385
25 HG3 PRO 3 HG2 PRO 3 0.836 -0.404 -8.017
26 HD2 PRO 3 HD1 PRO 3 0.093 -1.290 -5.520
27 HD3 PRO 3 HD2 PRO 3 1.741 -0.551 -5.766
28 H ILE 4 HN ILE 4 -1.898 0.573 -5.245
29 HA ILE 4 HA ILE 4 -4.002 2.124 -6.069
30 HB ILE 4 HB ILE 4 -5.510 0.674 -4.896
31 HG12 ILE 4 HG11 ILE 4 -3.047 -0.610 -3.578
32 HG13 ILE 4 HG12 ILE 4 -4.205 0.467 -2.732
33 HG21 ILE 4 HG21 ILE 4 -3.152 -0.891 -6.144
34 HG22 ILE 4 HG22 ILE 4 -4.880 -1.388 -6.067
35 HG23 ILE 4 HG23 ILE 4 -4.405 0.024 -7.068
36 HD11 ILE 4 HD1 ILE 4 -6.080 -1.144 -3.234
37 HD12 ILE 4 HD2 ILE 4 -4.897 -2.268 -3.997
38 HD13 ILE 4 HD3 ILE 4 -4.770 -1.881 -2.246
39 H LEU 5 HN LEU 5 -2.223 2.804 -3.183
40 HA LEU 5 HA LEU 5 -4.313 3.728 -1.581
41 HB2 LEU 5 HB1 LEU 5 -1.412 4.695 -1.727
42 HB3 LEU 5 HB2 LEU 5 -2.544 4.980 -0.364
43 HG LEU 5 HG LEU 5 -1.510 2.237 -1.318
44 HD11 LEU 5 HD11 LEU 5 0.249 3.588 -0.235
45 HD12 LEU 5 HD12 LEU 5 -0.259 2.229 0.830
46 HD13 LEU 5 HD13 LEU 5 -0.830 3.902 1.181
47 HD21 LEU 5 HD21 LEU 5 -2.527 1.360 0.810
48 HD22 LEU 5 HD22 LEU 5 -3.771 1.944 -0.348
49 HD23 LEU 5 HD23 LEU 5 -3.315 2.955 1.081
50 H ALA 6 HN ALA 6 -2.543 5.451 -4.162
51 HA ALA 6 HA ALA 6 -3.845 7.944 -3.848
52 HB1 ALA 6 HB1 ALA 6 -2.687 6.519 -6.334
53 HB2 ALA 6 HB2 ALA 6 -3.079 8.277 -6.239
54 HB3 ALA 6 HB3 ALA 6 -1.769 7.587 -5.218
55 H SER 7 HN SER 7 -4.701 5.020 -5.773
56 HA SER 7 HA SER 7 -7.046 6.040 -6.917
57 HB2 SER 7 HB1 SER 7 -6.535 3.099 -6.178
58 HB3 SER 7 HB2 SER 7 -7.619 3.718 -7.466
59 HG SER 7 HG1 SER 7 -5.827 4.254 -8.654
60 H LEU 8 HN LEU 8 -6.542 4.273 -3.835
61 HA LEU 8 HA LEU 8 -9.262 4.152 -3.120
62 HB2 LEU 8 HB1 LEU 8 -6.712 4.079 -1.442
63 HB3 LEU 8 HB2 LEU 8 -8.343 3.846 -0.738
64 HG LEU 8 HG LEU 8 -7.153 2.071 -2.944
65 HD11 LEU 8 HD11 LEU 8 -6.830 0.384 -1.137
66 HD12 LEU 8 HD12 LEU 8 -7.406 1.574 0.090
67 HD13 LEU 8 HD13 LEU 8 -5.876 1.880 -0.811
68 HD21 LEU 8 HD21 LEU 8 -9.657 1.729 -1.173
69 HD22 LEU 8 HD22 LEU 8 -9.001 0.498 -2.311
70 HD23 LEU 8 HD23 LEU 8 -9.657 2.044 -2.956
71 H ALA 9 HN ALA 9 -6.811 6.676 -2.480
72 HA ALA 9 HA ALA 9 -8.435 8.364 -0.988
73 HB1 ALA 9 HB1 ALA 9 -5.962 8.653 -1.329
74 HB2 ALA 9 HB2 ALA 9 -6.259 9.099 -3.038
75 HB3 ALA 9 HB3 ALA 9 -6.875 10.166 -1.714
76 H ALA 10 HN ALA 10 -8.215 8.025 -4.572
77 HA ALA 10 HA ALA 10 -10.236 9.940 -5.097
78 HB1 ALA 10 HB1 ALA 10 -9.521 7.408 -6.736
79 HB2 ALA 10 HB2 ALA 10 -10.238 8.942 -7.355
80 HB3 ALA 10 HB3 ALA 10 -8.537 8.903 -6.752
81 H LYS 11 HN LYS 11 -10.451 6.378 -4.796
82 HA LYS 11 HA LYS 11 -13.167 6.302 -5.508
83 HB2 LYS 11 HB1 LYS 11 -11.570 4.464 -5.858
84 HB3 LYS 11 HB2 LYS 11 -11.420 4.193 -4.103
85 HG2 LYS 11 HG1 LYS 11 -14.163 4.050 -5.459
86 HG3 LYS 11 HG2 LYS 11 -13.026 2.687 -5.669
87 HD2 LYS 11 HD1 LYS 11 -13.006 2.125 -3.345
88 HD3 LYS 11 HD2 LYS 11 -13.645 3.717 -2.864
89 HE2 LYS 11 HE1 LYS 11 -15.849 3.082 -4.127
90 HE3 LYS 11 HE2 LYS 11 -15.218 1.384 -4.099
91 HZ1 LYS 11 HZ1 LYS 11 -16.534 1.762 -2.158
92 HZ2 LYS 11 HZ2 LYS 11 -15.718 3.206 -1.800
93 HZ3 LYS 11 HZ3 LYS 11 -14.912 1.742 -1.643
94 H PHE 12 HN PHE 12 -11.674 6.191 -2.227
95 HA PHE 12 HA PHE 12 -14.389 6.079 -1.074
96 HB2 PHE 12 HB1 PHE 12 -11.556 5.713 0.052
97 HB3 PHE 12 HB2 PHE 12 -12.944 6.054 1.142
98 HD1 PHE 12 HD1 PHE 12 -14.856 4.552 1.295
99 HD2 PHE 12 HD2 PHE 12 -11.331 3.492 -0.900
100 HE1 PHE 12 HE1 PHE 12 -15.466 2.162 1.492
101 HE2 PHE 12 HE2 PHE 12 -11.942 1.090 -0.723
102 HZ PHE 12 HZ PHE 12 -14.000 0.423 0.493
103 H GLY 13 HN GLY 13 -12.078 8.322 -2.090
104 HA2 GLY 13 HA1 GLY 13 -13.573 10.414 -0.620
105 HA3 GLY 13 HA2 GLY 13 -11.851 10.485 -1.124
106 HA PRO 14 HA PRO 14 -14.291 11.589 -4.998
107 HB2 PRO 14 HB1 PRO 14 -17.075 11.853 -4.805
108 HB3 PRO 14 HB2 PRO 14 -16.271 10.332 -5.351
109 HG2 PRO 14 HG1 PRO 14 -17.250 10.986 -2.518
110 HG3 PRO 14 HG2 PRO 14 -17.569 9.495 -3.497
111 HD2 PRO 14 HD1 PRO 14 -15.545 9.571 -1.620
112 HD3 PRO 14 HD2 PRO 14 -15.306 8.707 -3.201
113 H LYS 15 HN LYS 15 -15.410 12.202 -1.758
114 HA LYS 15 HA LYS 15 -15.511 15.021 -1.752
115 HB2 LYS 15 HB1 LYS 15 -14.606 12.962 0.349
116 HB3 LYS 15 HB2 LYS 15 -14.878 14.692 0.734
117 HG2 LYS 15 HG1 LYS 15 -17.200 14.500 0.690
118 HG3 LYS 15 HG2 LYS 15 -17.187 13.265 -0.585
119 HD2 LYS 15 HD1 LYS 15 -18.006 12.216 1.453
120 HD3 LYS 15 HD2 LYS 15 -16.459 11.505 0.941
121 HE2 LYS 15 HE1 LYS 15 -16.445 11.659 3.360
122 HE3 LYS 15 HE2 LYS 15 -15.238 12.843 2.732
123 HZ1 LYS 15 HZ1 LYS 15 -18.024 13.465 3.609
124 HZ2 LYS 15 HZ2 LYS 15 -16.890 14.589 3.036
125 HZ3 LYS 15 HZ3 LYS 15 -16.611 13.760 4.487
126 H LEU 16 HN LEU 16 -12.684 12.764 -1.275
127 HA LEU 16 HA LEU 16 -10.837 14.894 -0.843
128 HB2 LEU 16 HB1 LEU 16 -10.473 11.926 -1.512
129 HB3 LEU 16 HB2 LEU 16 -9.107 13.055 -1.484
130 HG LEU 16 HG LEU 16 -9.457 13.634 0.852
131 HD11 LEU 16 HD11 LEU 16 -11.614 11.426 0.922
132 HD12 LEU 16 HD12 LEU 16 -11.888 13.201 1.198
133 HD13 LEU 16 HD13 LEU 16 -10.881 12.249 2.342
134 HD21 LEU 16 HD21 LEU 16 -7.895 11.828 0.151
135 HD22 LEU 16 HD22 LEU 16 -9.218 10.612 0.283
136 HD23 LEU 16 HD23 LEU 16 -8.620 11.461 1.758
137 H PHE 17 HN PHE 17 -11.681 12.907 -3.726
138 HA PHE 17 HA PHE 17 -9.588 14.028 -5.202
139 HB2 PHE 17 HB1 PHE 17 -11.297 11.772 -5.454
140 HB3 PHE 17 HB2 PHE 17 -11.680 12.748 -6.905
141 HD1 PHE 17 HD1 PHE 17 -10.504 11.828 -8.705
142 HD2 PHE 17 HD2 PHE 17 -8.512 12.042 -4.904
143 HE1 PHE 17 HE1 PHE 17 -8.450 10.830 -9.708
144 HE2 PHE 17 HE2 PHE 17 -6.469 11.107 -5.915
145 HZ PHE 17 HZ PHE 17 -6.429 10.501 -8.306
146 H ABA 18 HN AGL 18 -12.645 15.444 -4.635
147 HA ABA 18 HA AGL 18 -12.585 17.146 -6.938
148 HB3 ABA 18 HB2 AGL 18 -13.999 18.693 -5.395
149 HB2 ABA 18 HB1 AGL 18 -13.875 17.408 -4.168
150 HG3 ABA 18 HG AGL 18 -15.283 15.895 -5.472
151 H LEU 19 HN LEU 19 -10.680 17.093 -3.982
152 HA LEU 19 HA LEU 19 -9.415 19.658 -4.752
153 HB2 LEU 19 HB1 LEU 19 -9.266 17.910 -2.220
154 HB3 LEU 19 HB2 LEU 19 -8.097 19.219 -2.576
155 HG LEU 19 HG LEU 19 -9.968 20.880 -2.629
156 HD11 LEU 19 HD11 LEU 19 -11.652 18.538 -1.520
157 HD12 LEU 19 HD12 LEU 19 -11.977 19.493 -3.019
158 HD13 LEU 19 HD13 LEU 19 -12.110 20.280 -1.414
159 HD21 LEU 19 HD21 LEU 19 -10.110 20.995 -0.146
160 HD22 LEU 19 HD22 LEU 19 -8.461 20.503 -0.666
161 HD23 LEU 19 HD23 LEU 19 -9.607 19.269 -0.023
162 H VAL 20 HN VAL 20 -8.581 16.294 -3.764
163 HA VAL 20 HA VAL 20 -5.891 16.490 -4.124
164 HB VAL 20 HB VAL 20 -7.689 14.042 -4.090
165 HG11 VAL 20 HG11 VAL 20 -4.600 14.230 -3.906
166 HG12 VAL 20 HG12 VAL 20 -5.567 12.785 -3.439
167 HG13 VAL 20 HG13 VAL 20 -5.543 13.328 -5.149
168 HG21 VAL 20 HG21 VAL 20 -7.696 15.503 -2.019
169 HG22 VAL 20 HG22 VAL 20 -6.847 13.944 -1.712
170 HG23 VAL 20 HG23 VAL 20 -5.896 15.444 -1.985
171 H THR 21 HN THR 21 -8.192 15.404 -6.681
172 HA THR 21 HA THR 21 -6.032 16.183 -8.490
173 HB THR 21 HB THR 21 -7.405 13.556 -9.102
174 HG1 THR 21 HG1 THR 21 -5.116 14.188 -7.644
175 HG21 THR 21 HG21 THR 21 -5.433 13.341 -10.674
176 HG22 THR 21 HG22 THR 21 -4.839 14.958 -10.171
177 HG23 THR 21 HG23 THR 21 -6.382 14.814 -11.092
178 H LYS 22 HN LYS 22 -8.280 17.407 -7.535
179 HA LYS 22 HA LYS 22 -10.289 18.237 -8.001
180 HB2 LYS 22 HB1 LYS 22 -10.022 20.140 -9.425
181 HB3 LYS 22 HB2 LYS 22 -8.551 19.870 -8.464
182 HG2 LYS 22 HG1 LYS 22 -7.226 19.212 -10.276
183 HG3 LYS 22 HG2 LYS 22 -8.585 18.664 -11.267
184 HD2 LYS 22 HD1 LYS 22 -7.742 21.571 -10.722
185 HD3 LYS 22 HD2 LYS 22 -7.614 20.672 -12.255
186 HE2 LYS 22 HE1 LYS 22 -10.182 21.729 -10.893
187 HE3 LYS 22 HE2 LYS 22 -9.469 22.239 -12.468
188 HZ1 LYS 22 HZ1 LYS 22 -9.974 20.049 -13.351
189 HZ2 LYS 22 HZ2 LYS 22 -11.383 20.745 -12.698
190 HZ3 LYS 22 HZ3 LYS 22 -10.572 19.539 -11.855
191 H LYS 23 HN LYS 23 -11.229 15.971 -8.757
192 HA LYS 23 HA LYS 23 -12.199 16.223 -11.527
193 HB2 LYS 23 HB1 LYS 23 -12.435 13.938 -9.517
194 HB3 LYS 23 HB2 LYS 23 -13.091 13.905 -11.184
195 HG2 LYS 23 HG1 LYS 23 -10.118 14.202 -10.445
196 HG3 LYS 23 HG2 LYS 23 -10.923 12.690 -10.980
197 HD2 LYS 23 HD1 LYS 23 -11.427 13.711 -13.212
198 HD3 LYS 23 HD2 LYS 23 -10.780 15.280 -12.664
199 HE2 LYS 23 HE1 LYS 23 -9.124 14.280 -14.107
200 HE3 LYS 23 HE2 LYS 23 -8.482 14.339 -12.419
201 HZ1 LYS 23 HZ1 LYS 23 -9.073 12.027 -12.170
202 HZ2 LYS 23 HZ2 LYS 23 -8.053 12.230 -13.514
203 HZ3 LYS 23 HZ3 LYS 23 -9.712 11.967 -13.742
204 H ABA 24 HN AGL 24 -13.129 17.819 -9.034
205 HA ABA 24 HA AGL 24 -15.994 17.614 -9.732
206 HB3 ABA 24 HB2 AGL 24 -16.391 19.146 -7.776
207 HB2 ABA 24 HB1 AGL 24 -14.637 19.128 -7.424
208 HG3 ABA 24 HG AGL 24 -16.491 16.598 -7.400
Start of MODEL 3
1 H1 PHE 1 HN PHE 1 1.188 4.926 -7.926
2 HA PHE 1 HA PHE 1 3.487 5.064 -6.240
3 HB2 PHE 1 HB1 PHE 1 2.716 7.155 -5.039
4 HB3 PHE 1 HB2 PHE 1 3.231 7.449 -6.738
5 HD1 PHE 1 HD1 PHE 1 1.529 7.841 -8.517
6 HD2 PHE 1 HD2 PHE 1 0.445 7.590 -4.373
7 HE1 PHE 1 HE1 PHE 1 -0.617 8.973 -9.013
8 HE2 PHE 1 HE2 PHE 1 -1.691 8.740 -4.858
9 HZ PHE 1 HZ PHE 1 -2.232 9.429 -7.180
10 H LEU 2 HN LEU 2 3.204 3.914 -4.464
11 HA LEU 2 HA LEU 2 2.288 2.630 -2.956
12 HB2 LEU 2 HB1 LEU 2 -0.243 4.294 -3.315
13 HB3 LEU 2 HB2 LEU 2 -0.216 2.860 -2.276
14 HG LEU 2 HG LEU 2 1.737 3.881 -0.985
15 HD11 LEU 2 HD11 LEU 2 1.889 6.393 -1.015
16 HD12 LEU 2 HD12 LEU 2 0.823 6.430 -2.468
17 HD13 LEU 2 HD13 LEU 2 2.463 5.679 -2.565
18 HD21 LEU 2 HD21 LEU 2 0.182 5.316 0.363
19 HD22 LEU 2 HD22 LEU 2 -0.581 3.759 -0.122
20 HD23 LEU 2 HD23 LEU 2 -1.008 5.284 -0.990
21 HA PRO 3 HA PRO 3 -0.152 -0.493 -5.205
22 HB2 PRO 3 HB1 PRO 3 -1.171 -2.047 -3.146
23 HB3 PRO 3 HB2 PRO 3 0.583 -2.069 -3.556
24 HG2 PRO 3 HG1 PRO 3 -0.761 -0.341 -1.394
25 HG3 PRO 3 HG2 PRO 3 0.611 -1.511 -1.181
26 HD2 PRO 3 HD1 PRO 3 1.036 1.181 -1.608
27 HD3 PRO 3 HD2 PRO 3 2.132 -0.059 -2.363
28 H ILE 4 HN ILE 4 -2.674 -1.364 -4.299
29 HA ILE 4 HA ILE 4 -4.285 0.459 -5.368
30 HB ILE 4 HB ILE 4 -6.210 -0.788 -4.477
31 HG12 ILE 4 HG11 ILE 4 -4.122 -2.409 -2.884
32 HG13 ILE 4 HG12 ILE 4 -5.281 -1.242 -2.167
33 HG21 ILE 4 HG21 ILE 4 -4.878 -1.470 -6.502
34 HG22 ILE 4 HG22 ILE 4 -3.879 -2.562 -5.468
35 HG23 ILE 4 HG23 ILE 4 -5.641 -2.860 -5.668
36 HD11 ILE 4 HD1 ILE 4 -6.047 -3.827 -3.676
37 HD12 ILE 4 HD2 ILE 4 -6.172 -3.522 -1.907
38 HD13 ILE 4 HD3 ILE 4 -7.211 -2.603 -3.051
39 H LEU 5 HN LEU 5 -3.400 0.665 -1.999
40 HA LEU 5 HA LEU 5 -5.415 2.027 -0.811
41 HB2 LEU 5 HB1 LEU 5 -2.423 2.645 -0.615
42 HB3 LEU 5 HB2 LEU 5 -3.656 2.986 0.641
43 HG LEU 5 HG LEU 5 -2.768 0.192 -0.324
44 HD11 LEU 5 HD11 LEU 5 -1.715 0.011 1.917
45 HD12 LEU 5 HD12 LEU 5 -2.220 1.693 2.305
46 HD13 LEU 5 HD13 LEU 5 -1.025 1.396 0.989
47 HD21 LEU 5 HD21 LEU 5 -5.138 0.090 0.415
48 HD22 LEU 5 HD22 LEU 5 -4.728 1.001 1.919
49 HD23 LEU 5 HD23 LEU 5 -4.073 -0.653 1.659
50 H ALA 6 HN ALA 6 -3.027 3.610 -3.037
51 HA ALA 6 HA ALA 6 -4.012 6.237 -2.669
52 HB1 ALA 6 HB1 ALA 6 -2.643 4.825 -5.055
53 HB2 ALA 6 HB2 ALA 6 -2.880 6.607 -4.935
54 HB3 ALA 6 HB3 ALA 6 -1.822 5.752 -3.759
55 H SER 7 HN SER 7 -4.925 3.672 -5.023
56 HA SER 7 HA SER 7 -6.960 5.134 -6.315
57 HB2 SER 7 HB1 SER 7 -6.795 2.080 -6.003
58 HB3 SER 7 HB2 SER 7 -7.662 2.985 -7.289
59 HG SER 7 HG1 SER 7 -5.652 3.595 -8.112
60 H LEU 8 HN LEU 8 -7.004 3.018 -3.421
61 HA LEU 8 HA LEU 8 -9.827 3.043 -3.138
62 HB2 LEU 8 HB1 LEU 8 -7.623 2.664 -1.050
63 HB3 LEU 8 HB2 LEU 8 -9.367 2.469 -0.701
64 HG LEU 8 HG LEU 8 -7.793 0.787 -2.730
65 HD11 LEU 8 HD11 LEU 8 -7.122 0.376 -0.347
66 HD12 LEU 8 HD12 LEU 8 -8.014 -1.034 -1.040
67 HD13 LEU 8 HD13 LEU 8 -8.847 0.097 0.088
68 HD21 LEU 8 HD21 LEU 8 -10.202 0.923 -3.372
69 HD22 LEU 8 HD22 LEU 8 -10.685 0.525 -1.675
70 HD23 LEU 8 HD23 LEU 8 -9.831 -0.698 -2.682
71 H ALA 9 HN ALA 9 -7.320 5.228 -1.774
72 HA ALA 9 HA ALA 9 -9.078 6.958 -0.470
73 HB1 ALA 9 HB1 ALA 9 -6.583 6.982 -0.207
74 HB2 ALA 9 HB2 ALA 9 -6.410 7.547 -1.904
75 HB3 ALA 9 HB3 ALA 9 -7.195 8.611 -0.674
76 H ALA 10 HN ALA 10 -7.986 6.904 -3.877
77 HA ALA 10 HA ALA 10 -9.448 9.096 -4.722
78 HB1 ALA 10 HB1 ALA 10 -9.100 8.092 -6.999
79 HB2 ALA 10 HB2 ALA 10 -7.623 7.828 -5.990
80 HB3 ALA 10 HB3 ALA 10 -8.783 6.487 -6.274
81 H LYS 11 HN LYS 11 -10.525 5.643 -4.820
82 HA LYS 11 HA LYS 11 -13.007 6.431 -6.045
83 HB2 LYS 11 HB1 LYS 11 -11.782 4.304 -6.490
84 HB3 LYS 11 HB2 LYS 11 -12.118 3.747 -4.835
85 HG2 LYS 11 HG1 LYS 11 -14.290 4.366 -6.965
86 HG3 LYS 11 HG2 LYS 11 -13.534 2.762 -6.710
87 HD2 LYS 11 HD1 LYS 11 -14.294 2.930 -4.247
88 HD3 LYS 11 HD2 LYS 11 -15.335 4.298 -4.767
89 HE2 LYS 11 HE1 LYS 11 -16.562 2.793 -6.356
90 HE3 LYS 11 HE2 LYS 11 -15.556 1.396 -5.781
91 HZ1 LYS 11 HZ1 LYS 11 -17.620 1.528 -4.548
92 HZ2 LYS 11 HZ2 LYS 11 -17.300 3.139 -4.106
93 HZ3 LYS 11 HZ3 LYS 11 -16.315 1.903 -3.524
94 H PHE 12 HN PHE 12 -12.124 5.343 -2.697
95 HA PHE 12 HA PHE 12 -14.963 5.522 -1.975
96 HB2 PHE 12 HB1 PHE 12 -12.474 4.391 -0.570
97 HB3 PHE 12 HB2 PHE 12 -14.016 4.662 0.309
98 HD1 PHE 12 HD1 PHE 12 -16.067 3.508 -0.306
99 HD2 PHE 12 HD2 PHE 12 -12.301 2.500 -2.085
100 HE1 PHE 12 HE1 PHE 12 -16.974 1.293 -0.940
101 HE2 PHE 12 HE2 PHE 12 -13.206 0.288 -2.756
102 HZ PHE 12 HZ PHE 12 -15.539 -0.326 -2.171
103 H GLY 13 HN GLY 13 -12.194 7.502 -1.960
104 HA2 GLY 13 HA1 GLY 13 -13.734 9.428 -0.328
105 HA3 GLY 13 HA2 GLY 13 -12.028 9.548 -0.875
106 HA PRO 14 HA PRO 14 -14.421 10.848 -4.679
107 HB2 PRO 14 HB1 PRO 14 -17.160 11.320 -4.597
108 HB3 PRO 14 HB2 PRO 14 -16.486 9.679 -4.939
109 HG2 PRO 14 HG1 PRO 14 -17.430 10.745 -2.214
110 HG3 PRO 14 HG2 PRO 14 -17.915 9.204 -3.037
111 HD2 PRO 14 HD1 PRO 14 -15.885 9.258 -1.153
112 HD3 PRO 14 HD2 PRO 14 -15.764 8.205 -2.631
113 H LYS 15 HN LYS 15 -15.226 11.724 -1.418
114 HA LYS 15 HA LYS 15 -15.100 14.558 -1.841
115 HB2 LYS 15 HB1 LYS 15 -16.010 13.368 0.279
116 HB3 LYS 15 HB2 LYS 15 -14.324 12.931 0.648
117 HG2 LYS 15 HG1 LYS 15 -14.478 14.777 1.955
118 HG3 LYS 15 HG2 LYS 15 -13.917 15.612 0.490
119 HD2 LYS 15 HD1 LYS 15 -16.836 15.301 1.469
120 HD3 LYS 15 HD2 LYS 15 -15.796 16.741 1.710
121 HE2 LYS 15 HE1 LYS 15 -15.719 17.124 -0.787
122 HE3 LYS 15 HE2 LYS 15 -16.812 15.701 -1.028
123 HZ1 LYS 15 HZ1 LYS 15 -18.456 16.803 0.354
124 HZ2 LYS 15 HZ2 LYS 15 -18.042 17.757 -0.986
125 HZ3 LYS 15 HZ3 LYS 15 -17.442 18.142 0.556
126 H LEU 16 HN LEU 16 -12.617 12.029 -1.074
127 HA LEU 16 HA LEU 16 -10.481 13.858 -0.921
128 HB2 LEU 16 HB1 LEU 16 -10.420 10.850 -1.459
129 HB3 LEU 16 HB2 LEU 16 -9.000 11.859 -1.065
130 HG LEU 16 HG LEU 16 -11.397 11.426 0.812
131 HD11 LEU 16 HD11 LEU 16 -8.551 10.236 0.866
132 HD12 LEU 16 HD12 LEU 16 -10.057 9.343 0.439
133 HD13 LEU 16 HD13 LEU 16 -9.832 9.989 2.107
134 HD21 LEU 16 HD21 LEU 16 -8.669 12.806 1.266
135 HD22 LEU 16 HD22 LEU 16 -9.875 12.434 2.545
136 HD23 LEU 16 HD23 LEU 16 -10.280 13.619 1.257
137 H PHE 17 HN PHE 17 -11.639 11.867 -3.703
138 HA PHE 17 HA PHE 17 -9.509 13.016 -5.307
139 HB2 PHE 17 HB1 PHE 17 -10.826 10.561 -5.241
140 HB3 PHE 17 HB2 PHE 17 -11.519 11.294 -6.717
141 HD1 PHE 17 HD1 PHE 17 -8.106 11.135 -5.014
142 HD2 PHE 17 HD2 PHE 17 -10.390 10.528 -8.593
143 HE1 PHE 17 HE1 PHE 17 -6.098 10.244 -6.134
144 HE2 PHE 17 HE2 PHE 17 -8.359 9.655 -9.735
145 HZ PHE 17 HZ PHE 17 -6.213 9.516 -8.506
146 H ABA 18 HN AGL 18 -12.092 14.511 -4.341
147 HA ABA 18 HA AGL 18 -11.881 16.151 -6.792
148 HB3 ABA 18 HB2 AGL 18 -14.021 17.298 -6.082
149 HB2 ABA 18 HB1 AGL 18 -14.199 16.098 -4.768
150 HG3 ABA 18 HG AGL 18 -14.731 14.300 -6.314
151 H LEU 19 HN LEU 19 -10.435 15.648 -3.997
152 HA LEU 19 HA LEU 19 -10.135 18.510 -3.363
153 HB2 LEU 19 HB1 LEU 19 -11.278 17.362 -1.489
154 HB3 LEU 19 HB2 LEU 19 -10.007 16.112 -1.446
155 HG LEU 19 HG LEU 19 -8.309 17.856 -0.803
156 HD11 LEU 19 HD11 LEU 19 -9.286 19.889 -1.832
157 HD12 LEU 19 HD12 LEU 19 -9.073 20.123 -0.065
158 HD13 LEU 19 HD13 LEU 19 -10.715 19.787 -0.732
159 HD21 LEU 19 HD21 LEU 19 -9.108 18.217 1.509
160 HD22 LEU 19 HD22 LEU 19 -9.489 16.549 0.948
161 HD23 LEU 19 HD23 LEU 19 -10.791 17.801 1.018
162 H VAL 20 HN VAL 20 -8.382 15.457 -2.672
163 HA VAL 20 HA VAL 20 -5.800 16.582 -2.800
164 HB VAL 20 HB VAL 20 -6.755 13.678 -3.043
165 HG11 VAL 20 HG11 VAL 20 -4.412 13.877 -3.884
166 HG12 VAL 20 HG12 VAL 20 -3.954 14.870 -2.453
167 HG13 VAL 20 HG13 VAL 20 -4.399 13.137 -2.250
168 HG21 VAL 20 HG21 VAL 20 -5.821 15.361 -0.619
169 HG22 VAL 20 HG22 VAL 20 -7.492 14.736 -0.897
170 HG23 VAL 20 HG23 VAL 20 -6.140 13.590 -0.592
171 H THR 21 HN THR 21 -7.808 14.807 -5.122
172 HA THR 21 HA THR 21 -5.919 15.586 -7.278
173 HB THR 21 HB THR 21 -7.675 13.109 -7.197
174 HG1 THR 21 HG1 THR 21 -5.786 12.049 -7.059
175 HG21 THR 21 HG21 THR 21 -6.444 12.502 -9.331
176 HG22 THR 21 HG22 THR 21 -5.666 14.128 -9.332
177 HG23 THR 21 HG23 THR 21 -7.459 13.965 -9.557
178 H LYS 22 HN LYS 22 -6.849 16.755 -8.964
179 HA LYS 22 HA LYS 22 -9.675 17.330 -8.830
180 HB2 LYS 22 HB1 LYS 22 -9.257 18.712 -10.843
181 HB3 LYS 22 HB2 LYS 22 -8.215 19.135 -9.465
182 HG2 LYS 22 HG1 LYS 22 -6.247 18.469 -10.468
183 HG3 LYS 22 HG2 LYS 22 -7.002 17.171 -11.433
184 HD2 LYS 22 HD1 LYS 22 -7.335 20.170 -12.036
185 HD3 LYS 22 HD2 LYS 22 -6.107 19.096 -12.787
186 HE2 LYS 22 HE1 LYS 22 -7.926 17.637 -13.743
187 HE3 LYS 22 HE2 LYS 22 -9.177 18.725 -13.035
188 HZ1 LYS 22 HZ1 LYS 22 -8.262 20.535 -14.363
189 HZ2 LYS 22 HZ2 LYS 22 -8.774 19.243 -15.327
190 HZ3 LYS 22 HZ3 LYS 22 -7.119 19.491 -15.055
191 H LYS 23 HN LYS 23 -10.289 14.838 -9.094
192 HA LYS 23 HA LYS 23 -10.673 14.403 -12.016
193 HB2 LYS 23 HB1 LYS 23 -10.829 12.578 -9.618
194 HB3 LYS 23 HB2 LYS 23 -11.787 12.189 -11.071
195 HG2 LYS 23 HG1 LYS 23 -8.751 12.655 -11.177
196 HG3 LYS 23 HG2 LYS 23 -9.537 11.054 -10.948
197 HD2 LYS 23 HD1 LYS 23 -10.805 11.354 -13.085
198 HD3 LYS 23 HD2 LYS 23 -9.912 12.878 -13.400
199 HE2 LYS 23 HE1 LYS 23 -7.741 11.625 -13.486
200 HE3 LYS 23 HE2 LYS 23 -8.594 10.090 -13.061
201 HZ1 LYS 23 HZ1 LYS 23 -9.858 10.275 -15.101
202 HZ2 LYS 23 HZ2 LYS 23 -8.198 10.285 -15.433
203 HZ3 LYS 23 HZ3 LYS 23 -9.086 11.724 -15.510
204 H ABA 24 HN AGL 24 -12.154 15.981 -9.462
205 HA ABA 24 HA AGL 24 -14.787 15.780 -10.753
206 HB3 ABA 24 HB2 AGL 24 -15.551 17.329 -8.941
207 HB2 ABA 24 HB1 AGL 24 -13.867 17.438 -8.331
208 HG3 ABA 24 HG AGL 24 -15.343 14.697 -8.574
Start of MODEL 4
1 H1 PHE 1 HN PHE 1 4.629 2.204 -6.921
2 HA PHE 1 HA PHE 1 5.379 4.473 -5.332
3 HB2 PHE 1 HB1 PHE 1 4.522 4.682 -7.716
4 HB3 PHE 1 HB2 PHE 1 2.941 4.007 -7.214
5 HD1 PHE 1 HD1 PHE 1 1.281 5.616 -6.851
6 HD2 PHE 1 HD2 PHE 1 5.377 6.705 -6.144
7 HE1 PHE 1 HE1 PHE 1 0.574 7.926 -6.305
8 HE2 PHE 1 HE2 PHE 1 4.670 9.009 -5.588
9 HZ PHE 1 HZ PHE 1 2.268 9.625 -5.673
10 H LEU 2 HN LEU 2 2.058 3.260 -5.683
11 HA LEU 2 HA LEU 2 1.986 2.332 -2.957
12 HB2 LEU 2 HB1 LEU 2 -0.073 4.322 -4.172
13 HB3 LEU 2 HB2 LEU 2 -0.424 3.257 -2.781
14 HG LEU 2 HG LEU 2 1.716 4.450 -1.708
15 HD11 LEU 2 HD11 LEU 2 2.260 5.896 -3.677
16 HD12 LEU 2 HD12 LEU 2 1.750 6.892 -2.269
17 HD13 LEU 2 HD13 LEU 2 0.601 6.602 -3.629
18 HD21 LEU 2 HD21 LEU 2 -0.560 4.393 -0.732
19 HD22 LEU 2 HD22 LEU 2 -1.115 5.675 -1.882
20 HD23 LEU 2 HD23 LEU 2 0.118 6.056 -0.623
21 HA PRO 3 HA PRO 3 -0.596 -0.150 -5.774
22 HB2 PRO 3 HB1 PRO 3 -1.555 -2.094 -4.121
23 HB3 PRO 3 HB2 PRO 3 0.214 -1.871 -4.297
24 HG2 PRO 3 HG1 PRO 3 -1.526 -0.721 -2.039
25 HG3 PRO 3 HG2 PRO 3 -0.035 -1.740 -1.890
26 HD2 PRO 3 HD1 PRO 3 -0.004 1.078 -1.871
27 HD3 PRO 3 HD2 PRO 3 1.377 0.074 -2.507
28 H ILE 4 HN ILE 4 -3.101 -1.208 -4.238
29 HA ILE 4 HA ILE 4 -4.962 0.467 -5.199
30 HB ILE 4 HB ILE 4 -6.607 -0.673 -3.785
31 HG12 ILE 4 HG11 ILE 4 -4.180 -2.087 -2.504
32 HG13 ILE 4 HG12 ILE 4 -5.206 -0.860 -1.691
33 HG21 ILE 4 HG21 ILE 4 -6.251 -2.863 -4.831
34 HG22 ILE 4 HG22 ILE 4 -5.712 -1.581 -5.961
35 HG23 ILE 4 HG23 ILE 4 -4.494 -2.548 -5.044
36 HD11 ILE 4 HD1 ILE 4 -5.948 -3.102 -1.004
37 HD12 ILE 4 HD2 ILE 4 -7.229 -2.347 -2.018
38 HD13 ILE 4 HD3 ILE 4 -6.158 -3.617 -2.714
39 H LEU 5 HN LEU 5 -3.328 1.133 -2.175
40 HA LEU 5 HA LEU 5 -5.338 2.394 -0.792
41 HB2 LEU 5 HB1 LEU 5 -2.368 3.133 -0.810
42 HB3 LEU 5 HB2 LEU 5 -3.536 3.449 0.514
43 HG LEU 5 HG LEU 5 -2.591 0.677 -0.456
44 HD11 LEU 5 HD11 LEU 5 -1.433 0.567 1.735
45 HD12 LEU 5 HD12 LEU 5 -1.991 2.230 2.132
46 HD13 LEU 5 HD13 LEU 5 -0.842 1.970 0.767
47 HD21 LEU 5 HD21 LEU 5 -3.766 -0.195 1.595
48 HD22 LEU 5 HD22 LEU 5 -4.917 0.481 0.391
49 HD23 LEU 5 HD23 LEU 5 -4.482 1.433 1.864
50 H ALA 6 HN ALA 6 -3.260 3.933 -3.292
51 HA ALA 6 HA ALA 6 -4.301 6.548 -2.966
52 HB1 ALA 6 HB1 ALA 6 -2.196 6.005 -4.225
53 HB2 ALA 6 HB2 ALA 6 -3.155 5.080 -5.432
54 HB3 ALA 6 HB3 ALA 6 -3.362 6.867 -5.292
55 H SER 7 HN SER 7 -5.360 3.785 -5.019
56 HA SER 7 HA SER 7 -7.563 5.096 -6.194
57 HB2 SER 7 HB1 SER 7 -7.233 2.081 -5.703
58 HB3 SER 7 HB2 SER 7 -8.277 2.860 -6.938
59 HG SER 7 HG1 SER 7 -6.475 3.366 -8.091
60 H LEU 8 HN LEU 8 -7.253 3.192 -3.173
61 HA LEU 8 HA LEU 8 -10.026 3.179 -2.607
62 HB2 LEU 8 HB1 LEU 8 -7.607 2.970 -0.752
63 HB3 LEU 8 HB2 LEU 8 -9.298 2.805 -0.187
64 HG LEU 8 HG LEU 8 -7.968 0.982 -2.268
65 HD11 LEU 8 HD11 LEU 8 -7.020 0.723 0.037
66 HD12 LEU 8 HD12 LEU 8 -7.992 -0.721 -0.444
67 HD13 LEU 8 HD13 LEU 8 -8.680 0.492 0.695
68 HD21 LEU 8 HD21 LEU 8 -9.978 -0.487 -1.887
69 HD22 LEU 8 HD22 LEU 8 -10.435 1.083 -2.636
70 HD23 LEU 8 HD23 LEU 8 -10.715 0.802 -0.869
71 H ALA 9 HN ALA 9 -7.474 5.542 -1.741
72 HA ALA 9 HA ALA 9 -9.161 7.338 -0.427
73 HB1 ALA 9 HB1 ALA 9 -6.660 7.513 -0.473
74 HB2 ALA 9 HB2 ALA 9 -6.722 7.909 -2.225
75 HB3 ALA 9 HB3 ALA 9 -7.434 9.047 -1.018
76 H ALA 10 HN ALA 10 -8.462 6.996 -3.942
77 HA ALA 10 HA ALA 10 -10.118 9.013 -4.839
78 HB1 ALA 10 HB1 ALA 10 -10.009 7.811 -7.003
79 HB2 ALA 10 HB2 ALA 10 -8.443 7.514 -6.147
80 HB3 ALA 10 HB3 ALA 10 -9.708 6.246 -6.204
81 H LYS 11 HN LYS 11 -11.021 5.584 -4.321
82 HA LYS 11 HA LYS 11 -13.669 6.013 -5.315
83 HB2 LYS 11 HB1 LYS 11 -12.429 3.923 -5.646
84 HB3 LYS 11 HB2 LYS 11 -12.361 3.618 -3.892
85 HG2 LYS 11 HG1 LYS 11 -15.071 3.936 -5.291
86 HG3 LYS 11 HG2 LYS 11 -14.157 2.412 -5.503
87 HD2 LYS 11 HD1 LYS 11 -14.188 1.892 -3.143
88 HD3 LYS 11 HD2 LYS 11 -14.747 3.531 -2.713
89 HE2 LYS 11 HE1 LYS 11 -16.938 3.032 -4.017
90 HE3 LYS 11 HE2 LYS 11 -16.411 1.299 -4.018
91 HZ1 LYS 11 HZ1 LYS 11 -17.748 1.704 -2.097
92 HZ2 LYS 11 HZ2 LYS 11 -16.857 3.086 -1.678
93 HZ3 LYS 11 HZ3 LYS 11 -16.142 1.571 -1.550
94 H PHE 12 HN PHE 12 -12.374 5.549 -1.961
95 HA PHE 12 HA PHE 12 -15.119 5.709 -0.946
96 HB2 PHE 12 HB1 PHE 12 -12.388 5.149 0.337
97 HB3 PHE 12 HB2 PHE 12 -13.813 5.576 1.346
98 HD1 PHE 12 HD1 PHE 12 -15.790 4.194 1.437
99 HD2 PHE 12 HD2 PHE 12 -12.314 2.950 -0.742
100 HE1 PHE 12 HE1 PHE 12 -16.591 1.854 1.516
101 HE2 PHE 12 HE2 PHE 12 -13.119 0.602 -0.687
102 HZ PHE 12 HZ PHE 12 -15.249 0.049 0.460
103 H GLY 13 HN GLY 13 -12.451 7.802 -1.570
104 HA2 GLY 13 HA1 GLY 13 -14.037 10.002 -0.395
105 HA3 GLY 13 HA2 GLY 13 -12.299 10.002 -0.849
106 HA PRO 14 HA PRO 14 -14.566 10.734 -4.910
107 HB2 PRO 14 HB1 PRO 14 -17.240 11.569 -4.766
108 HB3 PRO 14 HB2 PRO 14 -16.755 9.856 -5.054
109 HG2 PRO 14 HG1 PRO 14 -17.508 11.137 -2.372
110 HG3 PRO 14 HG2 PRO 14 -18.121 9.587 -3.085
111 HD2 PRO 14 HD1 PRO 14 -16.065 9.595 -1.242
112 HD3 PRO 14 HD2 PRO 14 -16.031 8.456 -2.658
113 H LYS 15 HN LYS 15 -15.356 12.167 -1.802
114 HA LYS 15 HA LYS 15 -14.835 14.877 -2.512
115 HB2 LYS 15 HB1 LYS 15 -14.245 13.430 0.157
116 HB3 LYS 15 HB2 LYS 15 -14.136 15.187 -0.132
117 HG2 LYS 15 HG1 LYS 15 -16.104 15.117 0.921
118 HG3 LYS 15 HG2 LYS 15 -16.678 15.079 -0.772
119 HD2 LYS 15 HD1 LYS 15 -17.112 12.665 -0.631
120 HD3 LYS 15 HD2 LYS 15 -16.271 12.524 0.940
121 HE2 LYS 15 HE1 LYS 15 -18.884 14.132 0.481
122 HE3 LYS 15 HE2 LYS 15 -18.810 12.438 1.108
123 HZ1 LYS 15 HZ1 LYS 15 -17.567 14.824 2.397
124 HZ2 LYS 15 HZ2 LYS 15 -17.504 13.235 2.976
125 HZ3 LYS 15 HZ3 LYS 15 -18.986 14.044 2.891
126 H LEU 16 HN LEU 16 -12.610 12.180 -1.482
127 HA LEU 16 HA LEU 16 -10.333 13.861 -1.495
128 HB2 LEU 16 HB1 LEU 16 -10.493 10.828 -1.606
129 HB3 LEU 16 HB2 LEU 16 -8.995 11.768 -1.357
130 HG LEU 16 HG LEU 16 -11.398 11.814 0.559
131 HD11 LEU 16 HD11 LEU 16 -9.963 10.417 2.042
132 HD12 LEU 16 HD12 LEU 16 -8.682 10.368 0.778
133 HD13 LEU 16 HD13 LEU 16 -10.271 9.576 0.475
134 HD21 LEU 16 HD21 LEU 16 -8.538 12.952 0.828
135 HD22 LEU 16 HD22 LEU 16 -9.768 12.902 2.137
136 HD23 LEU 16 HD23 LEU 16 -10.050 13.925 0.684
137 H PHE 17 HN PHE 17 -11.573 11.581 -4.068
138 HA PHE 17 HA PHE 17 -9.349 12.280 -5.688
139 HB2 PHE 17 HB1 PHE 17 -11.353 10.339 -5.905
140 HB3 PHE 17 HB2 PHE 17 -11.807 11.454 -7.225
141 HD1 PHE 17 HD1 PHE 17 -11.137 10.270 -9.164
142 HD2 PHE 17 HD2 PHE 17 -8.385 10.415 -5.865
143 HE1 PHE 17 HE1 PHE 17 -9.446 9.035 -10.494
144 HE2 PHE 17 HE2 PHE 17 -6.707 9.216 -7.209
145 HZ PHE 17 HZ PHE 17 -7.222 8.541 -9.528
146 H ABA 18 HN AGL 18 -12.499 13.880 -5.337
147 HA ABA 18 HA AGL 18 -11.960 15.797 -7.365
148 HB3 ABA 18 HB2 AGL 18 -13.599 17.245 -5.906
149 HB2 ABA 18 HB1 AGL 18 -13.771 15.788 -4.898
150 HG3 ABA 18 HG AGL 18 -14.919 14.576 -6.693
151 H LEU 19 HN LEU 19 -11.103 15.820 -3.842
152 HA LEU 19 HA LEU 19 -9.879 18.419 -4.242
153 HB2 LEU 19 HB1 LEU 19 -10.487 16.651 -1.875
154 HB3 LEU 19 HB2 LEU 19 -9.170 17.845 -1.696
155 HG LEU 19 HG LEU 19 -11.283 18.690 -0.835
156 HD11 LEU 19 HD11 LEU 19 -9.512 20.244 -1.689
157 HD12 LEU 19 HD12 LEU 19 -11.171 20.936 -1.833
158 HD13 LEU 19 HD13 LEU 19 -10.335 20.296 -3.292
159 HD21 LEU 19 HD21 LEU 19 -12.898 17.612 -2.429
160 HD22 LEU 19 HD22 LEU 19 -12.341 18.731 -3.731
161 HD23 LEU 19 HD23 LEU 19 -13.157 19.393 -2.270
162 H VAL 20 HN VAL 20 -8.497 15.207 -3.254
163 HA VAL 20 HA VAL 20 -5.855 16.264 -3.105
164 HB VAL 20 HB VAL 20 -6.823 13.362 -3.204
165 HG11 VAL 20 HG11 VAL 20 -4.111 14.609 -2.369
166 HG12 VAL 20 HG12 VAL 20 -4.592 12.898 -2.086
167 HG13 VAL 20 HG13 VAL 20 -4.395 13.502 -3.764
168 HG21 VAL 20 HG21 VAL 20 -6.515 13.481 -0.702
169 HG22 VAL 20 HG22 VAL 20 -6.164 15.239 -0.830
170 HG23 VAL 20 HG23 VAL 20 -7.803 14.608 -1.256
171 H THR 21 HN THR 21 -7.559 14.184 -5.483
172 HA THR 21 HA THR 21 -5.176 14.356 -7.197
173 HB THR 21 HB THR 21 -7.602 12.627 -7.659
174 HG1 THR 21 HG1 THR 21 -6.385 11.092 -6.542
175 HG21 THR 21 HG21 THR 21 -5.933 12.788 -9.586
176 HG22 THR 21 HG22 THR 21 -5.783 11.192 -8.786
177 HG23 THR 21 HG23 THR 21 -4.589 12.495 -8.428
178 H LYS 22 HN LYS 22 -7.882 16.151 -6.794
179 HA LYS 22 HA LYS 22 -9.023 17.621 -7.981
180 HB2 LYS 22 HB1 LYS 22 -6.468 18.132 -8.184
181 HB3 LYS 22 HB2 LYS 22 -6.703 17.861 -9.922
182 HG2 LYS 22 HG1 LYS 22 -8.242 19.846 -8.100
183 HG3 LYS 22 HG2 LYS 22 -6.795 20.297 -9.026
184 HD2 LYS 22 HD1 LYS 22 -9.529 19.437 -10.186
185 HD3 LYS 22 HD2 LYS 22 -8.945 21.108 -10.049
186 HE2 LYS 22 HE1 LYS 22 -7.734 18.901 -11.874
187 HE3 LYS 22 HE2 LYS 22 -8.768 20.287 -12.386
188 HZ1 LYS 22 HZ1 LYS 22 -6.103 20.452 -11.089
189 HZ2 LYS 22 HZ2 LYS 22 -7.047 21.778 -11.579
190 HZ3 LYS 22 HZ3 LYS 22 -6.428 20.699 -12.738
191 H LYS 23 HN LYS 23 -10.090 15.193 -8.763
192 HA LYS 23 HA LYS 23 -10.439 15.538 -11.692
193 HB2 LYS 23 HB1 LYS 23 -11.020 13.107 -9.958
194 HB3 LYS 23 HB2 LYS 23 -11.434 13.280 -11.691
195 HG2 LYS 23 HG1 LYS 23 -8.810 13.965 -11.897
196 HG3 LYS 23 HG2 LYS 23 -8.699 13.072 -10.368
197 HD2 LYS 23 HD1 LYS 23 -8.189 11.477 -12.104
198 HD3 LYS 23 HD2 LYS 23 -9.813 11.078 -11.476
199 HE2 LYS 23 HE1 LYS 23 -9.739 10.824 -13.945
200 HE3 LYS 23 HE2 LYS 23 -10.904 12.119 -13.475
201 HZ1 LYS 23 HZ1 LYS 23 -8.101 12.540 -14.404
202 HZ2 LYS 23 HZ2 LYS 23 -9.199 13.749 -13.952
203 HZ3 LYS 23 HZ3 LYS 23 -9.511 12.787 -15.315
204 H ABA 24 HN AGL 24 -11.810 17.042 -9.335
205 HA ABA 24 HA AGL 24 -14.455 16.928 -10.665
206 HB3 ABA 24 HB2 AGL 24 -15.345 18.191 -8.666
207 HB2 ABA 24 HB1 AGL 24 -13.745 18.024 -7.887
208 HG3 ABA 24 HG AGL 24 -15.616 15.641 -8.716
Start of MODEL 5
1 H1 PHE 1 HN PHE 1 2.070 0.531 1.310
2 HA PHE 1 HA PHE 1 3.134 0.946 -0.984
3 HB2 PHE 1 HB1 PHE 1 4.375 -1.302 -0.978
4 HB3 PHE 1 HB2 PHE 1 4.402 -0.415 0.583
5 HD1 PHE 1 HD1 PHE 1 3.251 -1.247 2.536
6 HD2 PHE 1 HD2 PHE 1 3.012 -3.367 -1.190
7 HE1 PHE 1 HE1 PHE 1 2.345 -3.217 3.720
8 HE2 PHE 1 HE2 PHE 1 2.101 -5.346 -0.001
9 HZ PHE 1 HZ PHE 1 1.766 -5.268 2.456
10 H LEU 2 HN LEU 2 0.690 -1.646 -0.720
11 HA LEU 2 HA LEU 2 0.418 -2.511 -3.138
12 HB2 LEU 2 HB1 LEU 2 -1.894 -1.522 -1.405
13 HB3 LEU 2 HB2 LEU 2 -2.054 -2.717 -2.737
14 HG LEU 2 HG LEU 2 -0.379 -3.150 -0.194
15 HD11 LEU 2 HD11 LEU 2 -2.818 -2.983 0.299
16 HD12 LEU 2 HD12 LEU 2 -2.208 -4.662 0.518
17 HD13 LEU 2 HD13 LEU 2 -3.165 -4.236 -0.951
18 HD21 LEU 2 HD21 LEU 2 -1.215 -5.105 -2.440
19 HD22 LEU 2 HD22 LEU 2 -0.374 -5.545 -0.909
20 HD23 LEU 2 HD23 LEU 2 0.465 -4.510 -2.116
21 HA PRO 3 HA PRO 3 -0.375 0.848 -5.807
22 HB2 PRO 3 HB1 PRO 3 -1.362 -0.386 -8.133
23 HB3 PRO 3 HB2 PRO 3 0.332 -0.600 -7.549
24 HG2 PRO 3 HG1 PRO 3 -2.055 -2.466 -7.028
25 HG3 PRO 3 HG2 PRO 3 -0.414 -2.910 -7.656
26 HD2 PRO 3 HD1 PRO 3 -1.008 -3.158 -4.979
27 HD3 PRO 3 HD2 PRO 3 0.610 -2.502 -5.498
28 H ILE 4 HN ILE 4 -3.057 -1.329 -5.209
29 HA ILE 4 HA ILE 4 -5.203 0.131 -6.117
30 HB ILE 4 HB ILE 4 -6.595 -1.139 -4.556
31 HG12 ILE 4 HG11 ILE 4 -3.941 -2.346 -3.555
32 HG13 ILE 4 HG12 ILE 4 -4.966 -1.208 -2.618
33 HG21 ILE 4 HG21 ILE 4 -5.855 -1.978 -6.816
34 HG22 ILE 4 HG22 ILE 4 -4.462 -2.824 -6.036
35 HG23 ILE 4 HG23 ILE 4 -6.151 -3.301 -5.641
36 HD11 ILE 4 HD1 ILE 4 -5.787 -4.041 -3.560
37 HD12 ILE 4 HD2 ILE 4 -5.425 -3.515 -1.880
38 HD13 ILE 4 HD3 ILE 4 -6.877 -2.874 -2.726
39 H LEU 5 HN LEU 5 -3.205 1.100 -3.473
40 HA LEU 5 HA LEU 5 -5.116 2.467 -1.949
41 HB2 LEU 5 HB1 LEU 5 -2.148 3.080 -2.374
42 HB3 LEU 5 HB2 LEU 5 -3.168 3.701 -1.033
43 HG LEU 5 HG LEU 5 -2.440 0.754 -1.565
44 HD11 LEU 5 HD11 LEU 5 -1.094 0.966 0.517
45 HD12 LEU 5 HD12 LEU 5 -1.517 2.715 0.622
46 HD13 LEU 5 HD13 LEU 5 -0.533 2.101 -0.762
47 HD21 LEU 5 HD21 LEU 5 -4.665 0.794 -0.507
48 HD22 LEU 5 HD22 LEU 5 -4.093 1.989 0.726
49 HD23 LEU 5 HD23 LEU 5 -3.436 0.313 0.711
50 H ALA 6 HN ALA 6 -3.424 3.431 -4.928
51 HA ALA 6 HA ALA 6 -4.338 6.100 -5.030
52 HB1 ALA 6 HB1 ALA 6 -3.753 4.019 -7.248
53 HB2 ALA 6 HB2 ALA 6 -3.883 5.797 -7.517
54 HB3 ALA 6 HB3 ALA 6 -2.542 5.126 -6.519
55 H SER 7 HN SER 7 -5.829 3.011 -6.187
56 HA SER 7 HA SER 7 -8.148 4.161 -7.267
57 HB2 SER 7 HB1 SER 7 -7.924 1.376 -5.992
58 HB3 SER 7 HB2 SER 7 -9.138 1.911 -7.200
59 HG SER 7 HG1 SER 7 -7.534 1.953 -8.734
60 H LEU 8 HN LEU 8 -7.481 2.921 -3.947
61 HA LEU 8 HA LEU 8 -10.068 3.412 -2.955
62 HB2 LEU 8 HB1 LEU 8 -7.392 3.380 -1.470
63 HB3 LEU 8 HB2 LEU 8 -9.000 3.370 -0.681
64 HG LEU 8 HG LEU 8 -7.888 1.159 -2.504
65 HD11 LEU 8 HD11 LEU 8 -8.353 1.214 0.544
66 HD12 LEU 8 HD12 LEU 8 -6.753 1.360 -0.268
67 HD13 LEU 8 HD13 LEU 8 -7.708 -0.165 -0.419
68 HD21 LEU 8 HD21 LEU 8 -9.829 -0.200 -1.709
69 HD22 LEU 8 HD22 LEU 8 -10.383 1.220 -2.666
70 HD23 LEU 8 HD23 LEU 8 -10.496 1.234 -0.858
71 H ALA 9 HN ALA 9 -7.183 5.539 -3.030
72 HA ALA 9 HA ALA 9 -8.307 7.734 -1.760
73 HB1 ALA 9 HB1 ALA 9 -5.867 7.432 -2.279
74 HB2 ALA 9 HB2 ALA 9 -6.223 7.603 -4.030
75 HB3 ALA 9 HB3 ALA 9 -6.473 9.004 -2.920
76 H ALA 10 HN ALA 10 -8.407 6.849 -5.265
77 HA ALA 10 HA ALA 10 -9.946 9.083 -6.029
78 HB1 ALA 10 HB1 ALA 10 -10.365 7.671 -8.092
79 HB2 ALA 10 HB2 ALA 10 -8.633 7.664 -7.596
80 HB3 ALA 10 HB3 ALA 10 -9.680 6.249 -7.219
81 H LYS 11 HN LYS 11 -11.005 5.741 -5.203
82 HA LYS 11 HA LYS 11 -13.735 6.275 -5.798
83 HB2 LYS 11 HB1 LYS 11 -12.834 4.033 -6.118
84 HB3 LYS 11 HB2 LYS 11 -12.213 3.998 -4.446
85 HG2 LYS 11 HG1 LYS 11 -14.075 2.488 -4.589
86 HG3 LYS 11 HG2 LYS 11 -14.503 3.850 -3.521
87 HD2 LYS 11 HD1 LYS 11 -15.656 4.901 -5.654
88 HD3 LYS 11 HD2 LYS 11 -15.525 3.270 -6.366
89 HE2 LYS 11 HE1 LYS 11 -17.038 4.153 -3.799
90 HE3 LYS 11 HE2 LYS 11 -17.769 3.564 -5.344
91 HZ1 LYS 11 HZ1 LYS 11 -16.655 1.427 -4.932
92 HZ2 LYS 11 HZ2 LYS 11 -17.744 1.835 -3.692
93 HZ3 LYS 11 HZ3 LYS 11 -16.074 2.018 -3.451
94 H PHE 12 HN PHE 12 -12.038 5.930 -2.625
95 HA PHE 12 HA PHE 12 -14.636 6.476 -1.316
96 HB2 PHE 12 HB1 PHE 12 -12.024 5.206 -0.289
97 HB3 PHE 12 HB2 PHE 12 -13.450 5.578 0.749
98 HD1 PHE 12 HD1 PHE 12 -15.738 4.622 0.007
99 HD2 PHE 12 HD2 PHE 12 -11.957 3.095 -1.314
100 HE1 PHE 12 HE1 PHE 12 -16.788 2.426 -0.426
101 HE2 PHE 12 HE2 PHE 12 -13.000 0.889 -1.763
102 HZ PHE 12 HZ PHE 12 -15.412 0.542 -1.297
103 H GLY 13 HN GLY 13 -11.685 7.928 -2.175
104 HA2 GLY 13 HA1 GLY 13 -12.373 10.209 -0.416
105 HA3 GLY 13 HA2 GLY 13 -10.824 9.919 -1.273
106 HA PRO 14 HA PRO 14 -13.354 11.407 -4.858
107 HB2 PRO 14 HB1 PRO 14 -16.032 12.142 -4.725
108 HB3 PRO 14 HB2 PRO 14 -15.490 10.451 -5.048
109 HG2 PRO 14 HG1 PRO 14 -16.290 11.636 -2.330
110 HG3 PRO 14 HG2 PRO 14 -16.892 10.110 -3.104
111 HD2 PRO 14 HD1 PRO 14 -14.824 10.043 -1.267
112 HD3 PRO 14 HD2 PRO 14 -14.796 8.985 -2.748
113 H LYS 15 HN LYS 15 -14.004 12.651 -1.653
114 HA LYS 15 HA LYS 15 -13.822 15.427 -2.276
115 HB2 LYS 15 HB1 LYS 15 -12.791 13.978 0.256
116 HB3 LYS 15 HB2 LYS 15 -12.970 15.737 0.036
117 HG2 LYS 15 HG1 LYS 15 -14.788 15.358 1.269
118 HG3 LYS 15 HG2 LYS 15 -15.536 15.231 -0.348
119 HD2 LYS 15 HD1 LYS 15 -15.623 12.803 -0.206
120 HD3 LYS 15 HD2 LYS 15 -14.493 12.744 1.176
121 HE2 LYS 15 HE1 LYS 15 -17.341 13.960 1.313
122 HE3 LYS 15 HE2 LYS 15 -16.919 12.268 1.793
123 HZ1 LYS 15 HZ1 LYS 15 -16.964 13.767 3.683
124 HZ2 LYS 15 HZ2 LYS 15 -15.764 14.742 2.997
125 HZ3 LYS 15 HZ3 LYS 15 -15.409 13.150 3.447
126 H LEU 16 HN LEU 16 -11.291 12.931 -1.514
127 HA LEU 16 HA LEU 16 -9.125 14.757 -1.771
128 HB2 LEU 16 HB1 LEU 16 -9.234 11.684 -1.919
129 HB3 LEU 16 HB2 LEU 16 -7.725 12.635 -1.999
130 HG LEU 16 HG LEU 16 -9.631 12.603 0.402
131 HD11 LEU 16 HD11 LEU 16 -6.857 11.321 -0.043
132 HD12 LEU 16 HD12 LEU 16 -8.421 10.431 0.032
133 HD13 LEU 16 HD13 LEU 16 -7.795 11.293 1.491
134 HD21 LEU 16 HD21 LEU 16 -7.707 13.763 1.572
135 HD22 LEU 16 HD22 LEU 16 -8.421 14.783 0.275
136 HD23 LEU 16 HD23 LEU 16 -6.863 13.919 -0.007
137 H PHE 17 HN PHE 17 -10.633 12.407 -3.990
138 HA PHE 17 HA PHE 17 -8.851 12.765 -6.026
139 HB2 PHE 17 HB1 PHE 17 -10.735 10.988 -5.701
140 HB3 PHE 17 HB2 PHE 17 -11.841 12.164 -6.475
141 HD1 PHE 17 HD1 PHE 17 -8.335 12.034 -7.873
142 HD2 PHE 17 HD2 PHE 17 -12.275 10.284 -7.996
143 HE1 PHE 17 HE1 PHE 17 -7.790 10.961 -9.985
144 HE2 PHE 17 HE2 PHE 17 -11.703 9.197 -10.146
145 HZ PHE 17 HZ PHE 17 -9.448 9.518 -11.137
146 H ABA 18 HN AGL 18 -11.843 14.680 -5.430
147 HA ABA 18 HA AGL 18 -11.509 16.378 -7.676
148 HB3 ABA 18 HB2 AGL 18 -13.103 17.926 -6.339
149 HB2 ABA 18 HB1 AGL 18 -13.102 16.665 -5.082
150 HG3 ABA 18 HG AGL 18 -14.186 15.024 -6.624
151 H LEU 19 HN LEU 19 -10.346 16.843 -4.251
152 HA LEU 19 HA LEU 19 -9.372 19.482 -4.873
153 HB2 LEU 19 HB1 LEU 19 -9.154 17.590 -2.522
154 HB3 LEU 19 HB2 LEU 19 -7.937 18.893 -2.677
155 HG LEU 19 HG LEU 19 -9.718 20.610 -2.821
156 HD11 LEU 19 HD11 LEU 19 -11.670 19.231 -3.569
157 HD12 LEU 19 HD12 LEU 19 -12.027 20.101 -2.035
158 HD13 LEU 19 HD13 LEU 19 -11.635 18.338 -2.001
159 HD21 LEU 19 HD21 LEU 19 -10.186 20.604 -0.376
160 HD22 LEU 19 HD22 LEU 19 -8.497 20.082 -0.715
161 HD23 LEU 19 HD23 LEU 19 -9.747 18.854 -0.286
162 H VAL 20 HN VAL 20 -7.786 16.230 -4.719
163 HA VAL 20 HA VAL 20 -5.245 17.282 -5.402
164 HB VAL 20 HB VAL 20 -6.283 14.430 -5.540
165 HG11 VAL 20 HG11 VAL 20 -3.788 13.863 -5.534
166 HG12 VAL 20 HG12 VAL 20 -4.285 14.693 -7.047
167 HG13 VAL 20 HG13 VAL 20 -3.419 15.609 -5.763
168 HG21 VAL 20 HG21 VAL 20 -4.578 15.990 -3.468
169 HG22 VAL 20 HG22 VAL 20 -6.270 15.421 -3.217
170 HG23 VAL 20 HG23 VAL 20 -4.936 14.227 -3.399
171 H THR 21 HN THR 21 -7.946 15.956 -7.396
172 HA THR 21 HA THR 21 -6.494 17.025 -9.717
173 HB THR 21 HB THR 21 -6.925 15.226 -11.176
174 HG1 THR 21 HG1 THR 21 -8.483 14.218 -9.074
175 HG21 THR 21 HG21 THR 21 -5.639 13.363 -10.222
176 HG22 THR 21 HG22 THR 21 -5.942 13.942 -8.549
177 HG23 THR 21 HG23 THR 21 -4.921 14.922 -9.663
178 H LYS 22 HN LYS 22 -7.787 17.866 -11.471
179 HA LYS 22 HA LYS 22 -10.503 18.410 -10.647
180 HB2 LYS 22 HB1 LYS 22 -9.118 20.003 -12.030
181 HB3 LYS 22 HB2 LYS 22 -9.348 18.897 -13.418
182 HG2 LYS 22 HG1 LYS 22 -11.917 19.110 -12.968
183 HG3 LYS 22 HG2 LYS 22 -11.502 20.407 -11.798
184 HD2 LYS 22 HD1 LYS 22 -10.327 21.643 -13.714
185 HD3 LYS 22 HD2 LYS 22 -10.933 20.399 -14.839
186 HE2 LYS 22 HE1 LYS 22 -12.615 22.373 -13.127
187 HE3 LYS 22 HE2 LYS 22 -12.401 22.396 -14.918
188 HZ1 LYS 22 HZ1 LYS 22 -13.473 20.179 -14.952
189 HZ2 LYS 22 HZ2 LYS 22 -14.485 21.407 -14.368
190 HZ3 LYS 22 HZ3 LYS 22 -13.785 20.311 -13.294
191 H LYS 23 HN LYS 23 -11.165 16.125 -10.351
192 HA LYS 23 HA LYS 23 -12.548 15.287 -12.851
193 HB2 LYS 23 HB1 LYS 23 -12.347 13.958 -10.102
194 HB3 LYS 23 HB2 LYS 23 -13.250 13.275 -11.488
195 HG2 LYS 23 HG1 LYS 23 -10.211 13.853 -11.642
196 HG3 LYS 23 HG2 LYS 23 -10.873 12.412 -10.857
197 HD2 LYS 23 HD1 LYS 23 -10.275 11.726 -13.045
198 HD3 LYS 23 HD2 LYS 23 -12.049 11.697 -12.913
199 HE2 LYS 23 HE1 LYS 23 -11.260 12.483 -15.149
200 HE3 LYS 23 HE2 LYS 23 -12.244 13.749 -14.327
201 HZ1 LYS 23 HZ1 LYS 23 -10.350 14.993 -13.864
202 HZ2 LYS 23 HZ2 LYS 23 -10.070 14.424 -15.428
203 HZ3 LYS 23 HZ3 LYS 23 -9.288 13.694 -14.108
204 H ABA 24 HN AGL 24 -12.814 17.388 -10.280
205 HA ABA 24 HA AGL 24 -15.772 17.327 -10.401
206 HB3 ABA 24 HB2 AGL 24 -15.694 18.499 -8.183
207 HB2 ABA 24 HB1 AGL 24 -13.902 18.485 -8.251
208 HG3 ABA 24 HG AGL 24 -15.566 15.847 -8.373
Start of MODEL 6
1 H1 PHE 1 HN PHE 1 4.956 1.499 -6.712
2 HA PHE 1 HA PHE 1 4.391 4.226 -6.624
3 HB2 PHE 1 HB1 PHE 1 3.349 3.589 -8.896
4 HB3 PHE 1 HB2 PHE 1 2.301 2.416 -8.029
5 HD1 PHE 1 HD1 PHE 1 0.147 3.171 -7.570
6 HD2 PHE 1 HD2 PHE 1 3.301 6.075 -7.800
7 HE1 PHE 1 HE1 PHE 1 -1.493 4.976 -7.159
8 HE2 PHE 1 HE2 PHE 1 1.665 7.885 -7.372
9 HZ PHE 1 HZ PHE 1 -0.733 7.340 -7.045
10 H LEU 2 HN LEU 2 2.254 4.452 -5.237
11 HA LEU 2 HA LEU 2 2.047 2.815 -3.018
12 HB2 LEU 2 HB1 LEU 2 0.010 4.528 -4.557
13 HB3 LEU 2 HB2 LEU 2 -0.454 3.651 -3.078
14 HG LEU 2 HG LEU 2 -0.097 5.924 -2.532
15 HD11 LEU 2 HD11 LEU 2 1.485 5.743 -0.658
16 HD12 LEU 2 HD12 LEU 2 2.263 4.301 -1.397
17 HD13 LEU 2 HD13 LEU 2 0.550 4.214 -0.830
18 HD21 LEU 2 HD21 LEU 2 2.829 5.773 -3.462
19 HD22 LEU 2 HD22 LEU 2 1.981 7.176 -2.727
20 HD23 LEU 2 HD23 LEU 2 1.486 6.588 -4.358
21 HA PRO 3 HA PRO 3 -0.546 -0.415 -4.846
22 HB2 PRO 3 HB1 PRO 3 -1.497 -1.709 -2.617
23 HB3 PRO 3 HB2 PRO 3 0.268 -1.646 -2.953
24 HG2 PRO 3 HG1 PRO 3 -1.298 0.245 -1.104
25 HG3 PRO 3 HG2 PRO 3 0.157 -0.757 -0.692
26 HD2 PRO 3 HD1 PRO 3 0.319 1.905 -1.537
27 HD3 PRO 3 HD2 PRO 3 1.600 0.678 -1.959
28 H ILE 4 HN ILE 4 -3.027 -1.170 -3.693
29 HA ILE 4 HA ILE 4 -4.795 0.458 -4.860
30 HB ILE 4 HB ILE 4 -6.572 -0.722 -3.621
31 HG12 ILE 4 HG11 ILE 4 -4.250 -2.085 -2.107
32 HG13 ILE 4 HG12 ILE 4 -5.382 -0.890 -1.395
33 HG21 ILE 4 HG21 ILE 4 -6.047 -2.898 -4.635
34 HG22 ILE 4 HG22 ILE 4 -5.444 -1.588 -5.699
35 HG23 ILE 4 HG23 ILE 4 -4.289 -2.523 -4.676
36 HD11 ILE 4 HD1 ILE 4 -6.164 -3.659 -2.526
37 HD12 ILE 4 HD2 ILE 4 -6.117 -3.163 -0.798
38 HD13 ILE 4 HD3 ILE 4 -7.323 -2.424 -1.910
39 H LEU 5 HN LEU 5 -3.573 1.113 -1.653
40 HA LEU 5 HA LEU 5 -5.660 2.469 -0.514
41 HB2 LEU 5 HB1 LEU 5 -2.681 3.161 -0.319
42 HB3 LEU 5 HB2 LEU 5 -3.945 3.555 0.890
43 HG LEU 5 HG LEU 5 -3.007 0.716 0.119
44 HD11 LEU 5 HD11 LEU 5 -2.503 2.378 2.660
45 HD12 LEU 5 HD12 LEU 5 -1.288 2.016 1.377
46 HD13 LEU 5 HD13 LEU 5 -1.980 0.681 2.373
47 HD21 LEU 5 HD21 LEU 5 -4.312 -0.015 2.141
48 HD22 LEU 5 HD22 LEU 5 -5.368 0.611 0.829
49 HD23 LEU 5 HD23 LEU 5 -5.010 1.636 2.276
50 H ALA 6 HN ALA 6 -3.373 3.847 -2.927
51 HA ALA 6 HA ALA 6 -4.358 6.504 -2.784
52 HB1 ALA 6 HB1 ALA 6 -3.091 4.895 -5.098
53 HB2 ALA 6 HB2 ALA 6 -3.270 6.692 -5.065
54 HB3 ALA 6 HB3 ALA 6 -2.194 5.868 -3.880
55 H SER 7 HN SER 7 -5.359 3.688 -4.806
56 HA SER 7 HA SER 7 -7.459 5.017 -6.147
57 HB2 SER 7 HB1 SER 7 -7.221 2.013 -5.538
58 HB3 SER 7 HB2 SER 7 -8.193 2.766 -6.845
59 HG SER 7 HG1 SER 7 -6.366 3.101 -7.965
60 H LEU 8 HN LEU 8 -7.361 3.182 -3.064
61 HA LEU 8 HA LEU 8 -10.157 3.239 -2.645
62 HB2 LEU 8 HB1 LEU 8 -7.862 3.064 -0.634
63 HB3 LEU 8 HB2 LEU 8 -9.587 2.919 -0.185
64 HG LEU 8 HG LEU 8 -8.107 1.030 -2.100
65 HD11 LEU 8 HD11 LEU 8 -9.092 0.617 0.798
66 HD12 LEU 8 HD12 LEU 8 -7.381 0.862 0.304
67 HD13 LEU 8 HD13 LEU 8 -8.277 -0.612 -0.236
68 HD21 LEU 8 HD21 LEU 8 -10.966 0.903 -0.938
69 HD22 LEU 8 HD22 LEU 8 -10.152 -0.422 -1.843
70 HD23 LEU 8 HD23 LEU 8 -10.535 1.124 -2.681
71 H ALA 9 HN ALA 9 -7.626 5.604 -1.767
72 HA ALA 9 HA ALA 9 -9.311 7.465 -0.568
73 HB1 ALA 9 HB1 ALA 9 -6.807 7.603 -0.579
74 HB2 ALA 9 HB2 ALA 9 -6.842 7.973 -2.339
75 HB3 ALA 9 HB3 ALA 9 -7.563 9.132 -1.160
76 H ALA 10 HN ALA 10 -8.689 6.892 -4.081
77 HA ALA 10 HA ALA 10 -10.420 8.930 -4.948
78 HB1 ALA 10 HB1 ALA 10 -10.340 7.790 -7.127
79 HB2 ALA 10 HB2 ALA 10 -8.742 7.453 -6.357
80 HB3 ALA 10 HB3 ALA 10 -10.008 6.195 -6.376
81 H LYS 11 HN LYS 11 -11.125 5.484 -4.396
82 HA LYS 11 HA LYS 11 -13.757 5.746 -5.419
83 HB2 LYS 11 HB1 LYS 11 -12.379 3.717 -5.601
84 HB3 LYS 11 HB2 LYS 11 -12.420 3.472 -3.835
85 HG2 LYS 11 HG1 LYS 11 -15.026 3.631 -5.449
86 HG3 LYS 11 HG2 LYS 11 -14.047 2.135 -5.514
87 HD2 LYS 11 HD1 LYS 11 -14.238 1.749 -3.125
88 HD3 LYS 11 HD2 LYS 11 -14.941 3.366 -2.849
89 HE2 LYS 11 HE1 LYS 11 -16.955 2.653 -4.317
90 HE3 LYS 11 HE2 LYS 11 -16.316 0.962 -4.190
91 HZ1 LYS 11 HZ1 LYS 11 -17.102 2.804 -1.988
92 HZ2 LYS 11 HZ2 LYS 11 -16.301 1.350 -1.725
93 HZ3 LYS 11 HZ3 LYS 11 -17.855 1.345 -2.423
94 H PHE 12 HN PHE 12 -12.551 5.515 -2.029
95 HA PHE 12 HA PHE 12 -15.337 5.737 -1.092
96 HB2 PHE 12 HB1 PHE 12 -12.650 5.146 0.282
97 HB3 PHE 12 HB2 PHE 12 -14.113 5.594 1.227
98 HD1 PHE 12 HD1 PHE 12 -16.137 4.240 1.180
99 HD2 PHE 12 HD2 PHE 12 -12.507 2.914 -0.676
100 HE1 PHE 12 HE1 PHE 12 -16.951 1.905 1.283
101 HE2 PHE 12 HE2 PHE 12 -13.321 0.569 -0.593
102 HZ PHE 12 HZ PHE 12 -15.533 0.060 0.409
103 H GLY 13 HN GLY 13 -12.613 7.702 -1.795
104 HA2 GLY 13 HA1 GLY 13 -14.097 9.991 -0.648
105 HA3 GLY 13 HA2 GLY 13 -12.347 9.904 -1.027
106 HA PRO 14 HA PRO 14 -14.441 10.728 -5.167
107 HB2 PRO 14 HB1 PRO 14 -17.135 11.497 -5.156
108 HB3 PRO 14 HB2 PRO 14 -16.592 9.800 -5.433
109 HG2 PRO 14 HG1 PRO 14 -17.512 11.029 -2.779
110 HG3 PRO 14 HG2 PRO 14 -18.053 9.475 -3.544
111 HD2 PRO 14 HD1 PRO 14 -16.096 9.502 -1.600
112 HD3 PRO 14 HD2 PRO 14 -15.960 8.387 -3.031
113 H LYS 15 HN LYS 15 -15.378 12.109 -2.074
114 HA LYS 15 HA LYS 15 -14.920 14.841 -2.748
115 HB2 LYS 15 HB1 LYS 15 -14.307 13.399 -0.080
116 HB3 LYS 15 HB2 LYS 15 -14.347 15.161 -0.351
117 HG2 LYS 15 HG1 LYS 15 -16.278 14.785 0.752
118 HG3 LYS 15 HG2 LYS 15 -16.857 14.917 -0.941
119 HD2 LYS 15 HD1 LYS 15 -17.487 12.611 -0.990
120 HD3 LYS 15 HD2 LYS 15 -16.178 12.145 0.133
121 HE2 LYS 15 HE1 LYS 15 -18.382 11.799 1.211
122 HE3 LYS 15 HE2 LYS 15 -17.374 13.009 2.095
123 HZ1 LYS 15 HZ1 LYS 15 -18.620 14.764 0.996
124 HZ2 LYS 15 HZ2 LYS 15 -19.633 13.747 1.894
125 HZ3 LYS 15 HZ3 LYS 15 -19.597 13.625 0.203
126 H LEU 16 HN LEU 16 -12.671 12.196 -1.650
127 HA LEU 16 HA LEU 16 -10.440 13.922 -1.513
128 HB2 LEU 16 HB1 LEU 16 -10.662 10.897 -1.446
129 HB3 LEU 16 HB2 LEU 16 -9.093 11.732 -1.516
130 HG LEU 16 HG LEU 16 -9.554 12.970 0.558
131 HD11 LEU 16 HD11 LEU 16 -12.044 11.166 0.847
132 HD12 LEU 16 HD12 LEU 16 -12.037 12.979 0.700
133 HD13 LEU 16 HD13 LEU 16 -11.315 12.182 2.138
134 HD21 LEU 16 HD21 LEU 16 -9.175 11.008 2.055
135 HD22 LEU 16 HD22 LEU 16 -8.243 10.860 0.521
136 HD23 LEU 16 HD23 LEU 16 -9.752 9.900 0.754
137 H PHE 17 HN PHE 17 -11.437 11.615 -4.190
138 HA PHE 17 HA PHE 17 -9.118 12.593 -5.639
139 HB2 PHE 17 HB1 PHE 17 -11.099 10.458 -6.119
140 HB3 PHE 17 HB2 PHE 17 -10.785 11.401 -7.609
141 HD1 PHE 17 HD1 PHE 17 -9.374 10.139 -8.928
142 HD2 PHE 17 HD2 PHE 17 -8.446 10.462 -4.739
143 HE1 PHE 17 HE1 PHE 17 -7.298 8.827 -9.276
144 HE2 PHE 17 HE2 PHE 17 -6.398 9.144 -5.088
145 HZ PHE 17 HZ PHE 17 -5.811 8.325 -7.353
146 H ABA 18 HN AGL 18 -12.385 13.869 -5.394
147 HA ABA 18 HA AGL 18 -11.965 15.651 -7.589
148 HB3 ABA 18 HB2 AGL 18 -13.627 17.157 -6.188
149 HB2 ABA 18 HB1 AGL 18 -13.780 15.732 -5.133
150 HG3 ABA 18 HG AGL 18 -14.910 14.455 -6.893
151 H LEU 19 HN LEU 19 -10.995 15.788 -4.135
152 HA LEU 19 HA LEU 19 -9.866 18.419 -4.594
153 HB2 LEU 19 HB1 LEU 19 -11.027 17.900 -2.479
154 HB3 LEU 19 HB2 LEU 19 -9.865 16.587 -2.141
155 HG LEU 19 HG LEU 19 -8.005 18.263 -1.983
156 HD11 LEU 19 HD11 LEU 19 -8.805 20.052 -3.502
157 HD12 LEU 19 HD12 LEU 19 -8.534 20.712 -1.856
158 HD13 LEU 19 HD13 LEU 19 -10.213 20.376 -2.417
159 HD21 LEU 19 HD21 LEU 19 -8.702 19.295 0.157
160 HD22 LEU 19 HD22 LEU 19 -9.260 17.586 0.053
161 HD23 LEU 19 HD23 LEU 19 -10.430 18.937 -0.210
162 H VAL 20 HN VAL 20 -8.390 15.312 -3.426
163 HA VAL 20 HA VAL 20 -5.782 16.355 -3.379
164 HB VAL 20 HB VAL 20 -6.771 13.458 -3.352
165 HG11 VAL 20 HG11 VAL 20 -4.344 13.521 -3.915
166 HG12 VAL 20 HG12 VAL 20 -4.038 14.705 -2.588
167 HG13 VAL 20 HG13 VAL 20 -4.545 13.016 -2.206
168 HG21 VAL 20 HG21 VAL 20 -6.095 15.448 -1.077
169 HG22 VAL 20 HG22 VAL 20 -7.741 14.816 -1.479
170 HG23 VAL 20 HG23 VAL 20 -6.473 13.702 -0.858
171 H THR 21 HN THR 21 -7.409 14.154 -5.665
172 HA THR 21 HA THR 21 -5.061 14.356 -7.447
173 HB THR 21 HB THR 21 -7.429 12.489 -7.745
174 HG1 THR 21 HG1 THR 21 -6.157 11.064 -6.658
175 HG21 THR 21 HG21 THR 21 -4.497 12.498 -8.781
176 HG22 THR 21 HG22 THR 21 -5.969 12.662 -9.814
177 HG23 THR 21 HG23 THR 21 -5.628 11.109 -8.974
178 H LYS 22 HN LYS 22 -7.717 16.075 -6.940
179 HA LYS 22 HA LYS 22 -8.883 17.585 -8.039
180 HB2 LYS 22 HB1 LYS 22 -6.329 18.002 -8.190
181 HB3 LYS 22 HB2 LYS 22 -6.507 17.777 -9.940
182 HG2 LYS 22 HG1 LYS 22 -8.070 19.891 -8.252
183 HG3 LYS 22 HG2 LYS 22 -6.421 20.127 -8.880
184 HD2 LYS 22 HD1 LYS 22 -7.450 21.182 -10.568
185 HD3 LYS 22 HD2 LYS 22 -7.448 19.536 -11.240
186 HE2 LYS 22 HE1 LYS 22 -9.886 19.804 -9.661
187 HE3 LYS 22 HE2 LYS 22 -9.720 21.368 -10.553
188 HZ1 LYS 22 HZ1 LYS 22 -10.928 19.525 -11.711
189 HZ2 LYS 22 HZ2 LYS 22 -9.476 18.683 -11.749
190 HZ3 LYS 22 HZ3 LYS 22 -9.608 20.145 -12.613
191 H LYS 23 HN LYS 23 -9.913 15.128 -8.994
192 HA LYS 23 HA LYS 23 -10.170 15.567 -11.912
193 HB2 LYS 23 HB1 LYS 23 -10.787 13.123 -10.191
194 HB3 LYS 23 HB2 LYS 23 -11.098 13.241 -11.955
195 HG2 LYS 23 HG1 LYS 23 -8.343 13.373 -10.597
196 HG3 LYS 23 HG2 LYS 23 -9.030 11.997 -11.524
197 HD2 LYS 23 HD1 LYS 23 -9.117 13.533 -13.594
198 HD3 LYS 23 HD2 LYS 23 -8.364 14.815 -12.605
199 HE2 LYS 23 HE1 LYS 23 -6.593 13.929 -13.914
200 HE3 LYS 23 HE2 LYS 23 -6.330 13.353 -12.220
201 HZ1 LYS 23 HZ1 LYS 23 -6.001 11.610 -13.857
202 HZ2 LYS 23 HZ2 LYS 23 -7.574 11.801 -14.448
203 HZ3 LYS 23 HZ3 LYS 23 -7.332 11.243 -12.866
204 H ABA 24 HN AGL 24 -11.873 16.747 -9.385
205 HA ABA 24 HA AGL 24 -14.394 16.547 -10.915
206 HB3 ABA 24 HB2 AGL 24 -15.348 17.960 -9.032
207 HB2 ABA 24 HB1 AGL 24 -13.756 17.869 -8.226
208 HG3 ABA 24 HG AGL 24 -15.583 15.422 -8.963
Start of MODEL 7
1 H1 PHE 1 HN PHE 1 3.363 1.402 -6.492
2 HA PHE 1 HA PHE 1 5.780 2.634 -5.550
3 HB2 PHE 1 HB1 PHE 1 4.876 3.930 -7.681
4 HB3 PHE 1 HB2 PHE 1 3.612 4.589 -6.597
5 HD1 PHE 1 HD1 PHE 1 4.977 5.287 -4.088
6 HD2 PHE 1 HD2 PHE 1 6.455 5.486 -8.125
7 HE1 PHE 1 HE1 PHE 1 6.549 7.045 -3.422
8 HE2 PHE 1 HE2 PHE 1 8.034 7.264 -7.451
9 HZ PHE 1 HZ PHE 1 8.094 8.042 -5.093
10 H LEU 2 HN LEU 2 2.242 3.258 -5.591
11 HA LEU 2 HA LEU 2 2.162 2.495 -2.747
12 HB2 LEU 2 HB1 LEU 2 0.151 4.179 -4.401
13 HB3 LEU 2 HB2 LEU 2 -0.204 3.483 -2.796
14 HG LEU 2 HG LEU 2 0.185 5.727 -2.390
15 HD11 LEU 2 HD11 LEU 2 1.370 4.210 -0.779
16 HD12 LEU 2 HD12 LEU 2 2.150 5.829 -0.919
17 HD13 LEU 2 HD13 LEU 2 2.891 4.409 -1.734
18 HD21 LEU 2 HD21 LEU 2 2.788 5.675 -4.025
19 HD22 LEU 2 HD22 LEU 2 2.093 7.084 -3.145
20 HD23 LEU 2 HD23 LEU 2 1.213 6.379 -4.553
21 HA PRO 3 HA PRO 3 -0.497 -0.484 -4.942
22 HB2 PRO 3 HB1 PRO 3 -1.598 -1.895 -2.863
23 HB3 PRO 3 HB2 PRO 3 0.183 -1.892 -3.105
24 HG2 PRO 3 HG1 PRO 3 -1.392 -0.083 -1.183
25 HG3 PRO 3 HG2 PRO 3 0.007 -1.169 -0.794
26 HD2 PRO 3 HD1 PRO 3 0.283 1.555 -1.443
27 HD3 PRO 3 HD2 PRO 3 1.558 0.315 -1.834
28 H ILE 4 HN ILE 4 -3.079 -1.132 -3.808
29 HA ILE 4 HA ILE 4 -4.688 0.653 -4.970
30 HB ILE 4 HB ILE 4 -6.564 -0.419 -3.768
31 HG12 ILE 4 HG11 ILE 4 -4.339 -1.899 -2.211
32 HG13 ILE 4 HG12 ILE 4 -5.477 -0.694 -1.527
33 HG21 ILE 4 HG21 ILE 4 -4.402 -2.377 -4.797
34 HG22 ILE 4 HG22 ILE 4 -6.185 -2.608 -4.802
35 HG23 ILE 4 HG23 ILE 4 -5.452 -1.344 -5.839
36 HD11 ILE 4 HD1 ILE 4 -7.419 -2.213 -2.187
37 HD12 ILE 4 HD2 ILE 4 -6.222 -3.458 -2.696
38 HD13 ILE 4 HD3 ILE 4 -6.298 -2.935 -0.978
39 H LEU 5 HN LEU 5 -3.461 1.198 -1.733
40 HA LEU 5 HA LEU 5 -5.536 2.532 -0.564
41 HB2 LEU 5 HB1 LEU 5 -2.547 3.133 -0.275
42 HB3 LEU 5 HB2 LEU 5 -3.821 3.540 0.918
43 HG LEU 5 HG LEU 5 -3.009 0.686 0.076
44 HD11 LEU 5 HD11 LEU 5 -2.441 2.262 2.658
45 HD12 LEU 5 HD12 LEU 5 -1.235 1.873 1.375
46 HD13 LEU 5 HD13 LEU 5 -1.995 0.549 2.337
47 HD21 LEU 5 HD21 LEU 5 -5.394 0.721 0.786
48 HD22 LEU 5 HD22 LEU 5 -4.953 1.653 2.269
49 HD23 LEU 5 HD23 LEU 5 -4.371 -0.034 2.057
50 H ALA 6 HN ALA 6 -3.145 4.082 -2.783
51 HA ALA 6 HA ALA 6 -4.113 6.725 -2.416
52 HB1 ALA 6 HB1 ALA 6 -1.912 6.173 -3.488
53 HB2 ALA 6 HB2 ALA 6 -2.768 5.342 -4.834
54 HB3 ALA 6 HB3 ALA 6 -2.933 7.127 -4.622
55 H SER 7 HN SER 7 -4.978 4.172 -4.798
56 HA SER 7 HA SER 7 -6.995 5.594 -6.126
57 HB2 SER 7 HB1 SER 7 -6.825 2.548 -5.709
58 HB3 SER 7 HB2 SER 7 -7.690 3.398 -7.032
59 HG SER 7 HG1 SER 7 -5.753 3.846 -7.956
60 H LEU 8 HN LEU 8 -7.123 3.425 -3.275
61 HA LEU 8 HA LEU 8 -9.920 3.437 -2.995
62 HB2 LEU 8 HB1 LEU 8 -7.686 2.989 -0.955
63 HB3 LEU 8 HB2 LEU 8 -9.415 2.867 -0.521
64 HG LEU 8 HG LEU 8 -8.022 1.112 -2.610
65 HD11 LEU 8 HD11 LEU 8 -7.256 0.662 -0.280
66 HD12 LEU 8 HD12 LEU 8 -8.319 -0.679 -0.856
67 HD13 LEU 8 HD13 LEU 8 -8.965 0.555 0.281
68 HD21 LEU 8 HD21 LEU 8 -10.866 0.965 -1.412
69 HD22 LEU 8 HD22 LEU 8 -10.112 -0.271 -2.478
70 HD23 LEU 8 HD23 LEU 8 -10.465 1.368 -3.132
71 H ALA 9 HN ALA 9 -7.473 5.691 -1.636
72 HA ALA 9 HA ALA 9 -9.226 7.189 -0.094
73 HB1 ALA 9 HB1 ALA 9 -7.516 9.020 -0.388
74 HB2 ALA 9 HB2 ALA 9 -6.730 7.427 -0.087
75 HB3 ALA 9 HB3 ALA 9 -6.783 8.091 -1.754
76 H ALA 10 HN ALA 10 -8.376 7.596 -3.553
77 HA ALA 10 HA ALA 10 -10.280 9.580 -4.144
78 HB1 ALA 10 HB1 ALA 10 -8.394 9.074 -5.640
79 HB2 ALA 10 HB2 ALA 10 -8.880 7.349 -5.754
80 HB3 ALA 10 HB3 ALA 10 -9.896 8.602 -6.533
81 H LYS 11 HN LYS 11 -10.618 5.969 -4.464
82 HA LYS 11 HA LYS 11 -13.194 6.225 -5.572
83 HB2 LYS 11 HB1 LYS 11 -11.722 4.299 -5.950
84 HB3 LYS 11 HB2 LYS 11 -11.891 3.791 -4.252
85 HG2 LYS 11 HG1 LYS 11 -14.513 4.173 -5.718
86 HG3 LYS 11 HG2 LYS 11 -13.448 2.966 -6.464
87 HD2 LYS 11 HD1 LYS 11 -13.762 1.417 -4.903
88 HD3 LYS 11 HD2 LYS 11 -13.517 2.530 -3.539
89 HE2 LYS 11 HE1 LYS 11 -16.178 2.441 -5.125
90 HE3 LYS 11 HE2 LYS 11 -15.839 1.327 -3.741
91 HZ1 LYS 11 HZ1 LYS 11 -17.024 3.397 -3.128
92 HZ2 LYS 11 HZ2 LYS 11 -15.645 4.287 -3.544
93 HZ3 LYS 11 HZ3 LYS 11 -15.566 3.153 -2.299
94 H PHE 12 HN PHE 12 -12.281 5.699 -2.125
95 HA PHE 12 HA PHE 12 -15.152 5.506 -1.464
96 HB2 PHE 12 HB1 PHE 12 -12.563 4.881 0.042
97 HB3 PHE 12 HB2 PHE 12 -14.062 5.247 0.967
98 HD1 PHE 12 HD1 PHE 12 -16.134 3.983 0.603
99 HD2 PHE 12 HD2 PHE 12 -12.389 2.741 -1.077
100 HE1 PHE 12 HE1 PHE 12 -17.059 1.712 0.245
101 HE2 PHE 12 HE2 PHE 12 -13.310 0.457 -1.435
102 HZ PHE 12 HZ PHE 12 -15.648 -0.051 -0.780
103 H GLY 13 HN GLY 13 -12.544 7.851 -1.344
104 HA2 GLY 13 HA1 GLY 13 -14.530 9.735 -0.233
105 HA3 GLY 13 HA2 GLY 13 -12.777 9.978 -0.525
106 HA PRO 14 HA PRO 14 -14.645 10.489 -4.823
107 HB2 PRO 14 HB1 PRO 14 -17.313 11.390 -4.986
108 HB3 PRO 14 HB2 PRO 14 -16.834 9.657 -5.119
109 HG2 PRO 14 HG1 PRO 14 -17.787 11.123 -2.598
110 HG3 PRO 14 HG2 PRO 14 -18.380 9.545 -3.263
111 HD2 PRO 14 HD1 PRO 14 -16.499 9.594 -1.256
112 HD3 PRO 14 HD2 PRO 14 -16.325 8.413 -2.627
113 H LYS 15 HN LYS 15 -15.708 12.176 -1.993
114 HA LYS 15 HA LYS 15 -15.179 14.855 -2.714
115 HB2 LYS 15 HB1 LYS 15 -14.869 13.296 -0.076
116 HB3 LYS 15 HB2 LYS 15 -14.741 15.079 -0.190
117 HG2 LYS 15 HG1 LYS 15 -17.055 15.337 -0.779
118 HG3 LYS 15 HG2 LYS 15 -17.284 13.583 -1.074
119 HD2 LYS 15 HD1 LYS 15 -16.937 13.063 1.299
120 HD3 LYS 15 HD2 LYS 15 -16.517 14.773 1.661
121 HE2 LYS 15 HE1 LYS 15 -18.831 15.519 1.154
122 HE3 LYS 15 HE2 LYS 15 -19.298 13.848 0.648
123 HZ1 LYS 15 HZ1 LYS 15 -19.964 14.393 2.928
124 HZ2 LYS 15 HZ2 LYS 15 -18.349 14.607 3.379
125 HZ3 LYS 15 HZ3 LYS 15 -18.894 13.084 2.886
126 H LEU 16 HN LEU 16 -12.977 12.244 -1.457
127 HA LEU 16 HA LEU 16 -10.663 13.897 -1.552
128 HB2 LEU 16 HB1 LEU 16 -10.957 10.877 -1.357
129 HB3 LEU 16 HB2 LEU 16 -9.392 11.739 -1.290
130 HG LEU 16 HG LEU 16 -11.676 12.140 0.725
131 HD11 LEU 16 HD11 LEU 16 -10.229 10.821 2.275
132 HD12 LEU 16 HD12 LEU 16 -9.033 10.564 0.955
133 HD13 LEU 16 HD13 LEU 16 -10.676 9.840 0.826
134 HD21 LEU 16 HD21 LEU 16 -8.746 13.129 0.716
135 HD22 LEU 16 HD22 LEU 16 -9.888 13.273 2.096
136 HD23 LEU 16 HD23 LEU 16 -10.215 14.168 0.570
137 H PHE 17 HN PHE 17 -12.088 11.566 -3.938
138 HA PHE 17 HA PHE 17 -9.937 11.738 -5.688
139 HB2 PHE 17 HB1 PHE 17 -12.195 10.324 -5.822
140 HB3 PHE 17 HB2 PHE 17 -12.853 11.698 -6.741
141 HD1 PHE 17 HD1 PHE 17 -9.261 11.117 -7.525
142 HD2 PHE 17 HD2 PHE 17 -13.257 9.686 -8.244
143 HE1 PHE 17 HE1 PHE 17 -8.457 9.862 -9.443
144 HE2 PHE 17 HE2 PHE 17 -12.433 8.401 -10.186
145 HZ PHE 17 HZ PHE 17 -10.014 8.449 -10.771
146 H ABA 18 HN AGL 18 -12.836 13.811 -5.478
147 HA ABA 18 HA AGL 18 -12.095 15.684 -7.431
148 HB3 ABA 18 HB2 AGL 18 -13.702 17.204 -5.963
149 HB2 ABA 18 HB1 AGL 18 -13.962 15.731 -5.001
150 HG3 ABA 18 HG AGL 18 -14.915 14.516 -6.979
151 H LEU 19 HN LEU 19 -11.354 15.691 -3.876
152 HA LEU 19 HA LEU 19 -10.046 18.218 -4.183
153 HB2 LEU 19 HB1 LEU 19 -11.238 17.422 -2.130
154 HB3 LEU 19 HB2 LEU 19 -9.945 16.229 -1.843
155 HG LEU 19 HG LEU 19 -9.912 18.325 -0.444
156 HD11 LEU 19 HD11 LEU 19 -7.521 18.679 -0.386
157 HD12 LEU 19 HD12 LEU 19 -7.308 18.065 -2.056
158 HD13 LEU 19 HD13 LEU 19 -7.830 16.939 -0.742
159 HD21 LEU 19 HD21 LEU 19 -8.959 19.795 -2.978
160 HD22 LEU 19 HD22 LEU 19 -9.104 20.468 -1.319
161 HD23 LEU 19 HD23 LEU 19 -10.588 19.976 -2.218
162 H VAL 20 HN VAL 20 -8.707 14.912 -3.496
163 HA VAL 20 HA VAL 20 -6.052 15.818 -3.373
164 HB VAL 20 HB VAL 20 -7.130 12.985 -3.724
165 HG11 VAL 20 HG11 VAL 20 -4.872 12.336 -2.749
166 HG12 VAL 20 HG12 VAL 20 -4.713 13.080 -4.375
167 HG13 VAL 20 HG13 VAL 20 -4.336 14.048 -2.903
168 HG21 VAL 20 HG21 VAL 20 -7.966 14.117 -1.636
169 HG22 VAL 20 HG22 VAL 20 -6.721 12.882 -1.231
170 HG23 VAL 20 HG23 VAL 20 -6.282 14.627 -1.237
171 H THR 21 HN THR 21 -7.933 14.328 -6.041
172 HA THR 21 HA THR 21 -5.543 14.745 -7.748
173 HB THR 21 HB THR 21 -6.327 13.370 -9.420
174 HG1 THR 21 HG1 THR 21 -8.761 13.385 -8.012
175 HG21 THR 21 HG21 THR 21 -6.874 11.985 -6.702
176 HG22 THR 21 HG22 THR 21 -5.251 12.279 -7.430
177 HG23 THR 21 HG23 THR 21 -6.424 11.193 -8.259
178 H LYS 22 HN LYS 22 -7.793 16.694 -6.751
179 HA LYS 22 HA LYS 22 -8.976 18.400 -7.461
180 HB2 LYS 22 HB1 LYS 22 -7.783 20.091 -8.635
181 HB3 LYS 22 HB2 LYS 22 -6.742 19.275 -7.445
182 HG2 LYS 22 HG1 LYS 22 -5.351 18.307 -9.019
183 HG3 LYS 22 HG2 LYS 22 -6.588 18.204 -10.282
184 HD2 LYS 22 HD1 LYS 22 -5.151 20.785 -9.389
185 HD3 LYS 22 HD2 LYS 22 -4.770 19.818 -10.839
186 HE2 LYS 22 HE1 LYS 22 -7.323 21.487 -10.330
187 HE3 LYS 22 HE2 LYS 22 -6.045 21.752 -11.579
188 HZ1 LYS 22 HZ1 LYS 22 -7.990 19.527 -11.387
189 HZ2 LYS 22 HZ2 LYS 22 -6.709 19.526 -12.490
190 HZ3 LYS 22 HZ3 LYS 22 -7.931 20.713 -12.583
191 H LYS 23 HN LYS 23 -10.253 16.328 -8.808
192 HA LYS 23 HA LYS 23 -10.550 17.364 -11.580
193 HB2 LYS 23 HB1 LYS 23 -10.886 15.194 -12.379
194 HB3 LYS 23 HB2 LYS 23 -9.417 15.180 -11.354
195 HG2 LYS 23 HG1 LYS 23 -10.749 14.206 -9.458
196 HG3 LYS 23 HG2 LYS 23 -12.203 14.137 -10.504
197 HD2 LYS 23 HD1 LYS 23 -9.511 12.738 -11.022
198 HD3 LYS 23 HD2 LYS 23 -10.964 11.967 -10.308
199 HE2 LYS 23 HE1 LYS 23 -12.244 12.294 -12.426
200 HE3 LYS 23 HE2 LYS 23 -10.833 13.138 -13.183
201 HZ1 LYS 23 HZ1 LYS 23 -10.787 10.364 -12.122
202 HZ2 LYS 23 HZ2 LYS 23 -9.535 11.167 -12.932
203 HZ3 LYS 23 HZ3 LYS 23 -10.964 10.785 -13.763
204 H ABA 24 HN AGL 24 -12.305 17.901 -8.991
205 HA ABA 24 HA AGL 24 -14.847 17.510 -10.479
206 HB3 ABA 24 HB2 AGL 24 -15.982 18.278 -8.354
207 HB2 ABA 24 HB1 AGL 24 -14.392 18.287 -7.548
208 HG3 ABA 24 HG AGL 24 -15.874 15.793 -8.752
Start of MODEL 8
1 H1 PHE 1 HN PHE 1 2.527 2.689 -7.729
2 HA PHE 1 HA PHE 1 3.594 4.910 -6.154
3 HB2 PHE 1 HB1 PHE 1 1.140 4.839 -8.026
4 HB3 PHE 1 HB2 PHE 1 1.468 6.191 -6.887
5 HD1 PHE 1 HD1 PHE 1 3.842 7.264 -7.019
6 HD2 PHE 1 HD2 PHE 1 2.021 5.024 -10.197
7 HE1 PHE 1 HE1 PHE 1 5.307 8.406 -8.661
8 HE2 PHE 1 HE2 PHE 1 3.476 6.170 -11.842
9 HZ PHE 1 HZ PHE 1 5.123 7.858 -11.076
10 H LEU 2 HN LEU 2 3.487 3.526 -4.340
11 HA LEU 2 HA LEU 2 2.631 2.648 -2.508
12 HB2 LEU 2 HB1 LEU 2 0.042 4.141 -3.241
13 HB3 LEU 2 HB2 LEU 2 0.198 3.178 -1.769
14 HG LEU 2 HG LEU 2 0.401 5.435 -1.178
15 HD11 LEU 2 HD11 LEU 2 2.543 5.510 0.024
16 HD12 LEU 2 HD12 LEU 2 3.243 4.250 -1.052
17 HD13 LEU 2 HD13 LEU 2 1.872 3.838 0.056
18 HD21 LEU 2 HD21 LEU 2 2.795 5.845 -3.060
19 HD22 LEU 2 HD22 LEU 2 2.020 7.059 -1.980
20 HD23 LEU 2 HD23 LEU 2 1.106 6.387 -3.385
21 HA PRO 3 HA PRO 3 -0.126 -0.735 -3.887
22 HB2 PRO 3 HB1 PRO 3 -1.400 -1.532 -1.532
23 HB3 PRO 3 HB2 PRO 3 0.326 -1.925 -1.868
24 HG2 PRO 3 HG1 PRO 3 -0.731 0.478 -0.265
25 HG3 PRO 3 HG2 PRO 3 0.467 -0.772 0.276
26 HD2 PRO 3 HD1 PRO 3 1.290 1.623 -0.786
27 HD3 PRO 3 HD2 PRO 3 2.150 0.084 -1.249
28 H ILE 4 HN ILE 4 -2.729 -1.132 -3.272
29 HA ILE 4 HA ILE 4 -4.018 0.711 -4.700
30 HB ILE 4 HB ILE 4 -6.137 -0.300 -3.852
31 HG12 ILE 4 HG11 ILE 4 -4.251 -1.879 -1.971
32 HG13 ILE 4 HG12 ILE 4 -5.445 -0.644 -1.461
33 HG21 ILE 4 HG21 ILE 4 -5.645 -2.498 -4.829
34 HG22 ILE 4 HG22 ILE 4 -4.721 -1.246 -5.717
35 HG23 ILE 4 HG23 ILE 4 -3.885 -2.311 -4.523
36 HD11 ILE 4 HD1 ILE 4 -6.417 -2.863 -1.098
37 HD12 ILE 4 HD2 ILE 4 -7.299 -2.087 -2.462
38 HD13 ILE 4 HD3 ILE 4 -6.074 -3.366 -2.790
39 H LEU 5 HN LEU 5 -3.464 1.155 -1.302
40 HA LEU 5 HA LEU 5 -5.411 2.697 -0.332
41 HB2 LEU 5 HB1 LEU 5 -2.407 3.179 -0.024
42 HB3 LEU 5 HB2 LEU 5 -3.676 3.698 1.130
43 HG LEU 5 HG LEU 5 -2.931 0.782 0.450
44 HD11 LEU 5 HD11 LEU 5 -1.173 1.975 1.770
45 HD12 LEU 5 HD12 LEU 5 -2.011 0.713 2.750
46 HD13 LEU 5 HD13 LEU 5 -2.417 2.445 2.988
47 HD21 LEU 5 HD21 LEU 5 -5.343 0.901 1.087
48 HD22 LEU 5 HD22 LEU 5 -4.914 1.890 2.539
49 HD23 LEU 5 HD23 LEU 5 -4.368 0.185 2.420
50 H ALA 6 HN ALA 6 -2.850 4.109 -2.485
51 HA ALA 6 HA ALA 6 -3.722 6.782 -2.178
52 HB1 ALA 6 HB1 ALA 6 -2.339 7.126 -4.283
53 HB2 ALA 6 HB2 ALA 6 -1.481 6.110 -3.066
54 HB3 ALA 6 HB3 ALA 6 -2.257 5.335 -4.482
55 H SER 7 HN SER 7 -4.527 4.336 -4.699
56 HA SER 7 HA SER 7 -6.463 5.858 -6.058
57 HB2 SER 7 HB1 SER 7 -6.360 2.797 -5.742
58 HB3 SER 7 HB2 SER 7 -7.164 3.712 -7.065
59 HG SER 7 HG1 SER 7 -5.147 4.282 -7.824
60 H LEU 8 HN LEU 8 -6.709 3.581 -3.303
61 HA LEU 8 HA LEU 8 -9.511 3.562 -3.165
62 HB2 LEU 8 HB1 LEU 8 -7.443 3.075 -0.966
63 HB3 LEU 8 HB2 LEU 8 -9.200 2.923 -0.693
64 HG LEU 8 HG LEU 8 -7.591 1.212 -2.655
65 HD11 LEU 8 HD11 LEU 8 -8.113 -0.616 -0.992
66 HD12 LEU 8 HD12 LEU 8 -8.862 0.598 0.101
67 HD13 LEU 8 HD13 LEU 8 -7.098 0.687 -0.264
68 HD21 LEU 8 HD21 LEU 8 -9.951 1.456 -3.458
69 HD22 LEU 8 HD22 LEU 8 -10.556 1.045 -1.798
70 HD23 LEU 8 HD23 LEU 8 -9.674 -0.186 -2.769
71 H ALA 9 HN ALA 9 -7.187 5.854 -1.693
72 HA ALA 9 HA ALA 9 -9.014 7.206 -0.100
73 HB1 ALA 9 HB1 ALA 9 -7.337 9.093 -0.262
74 HB2 ALA 9 HB2 ALA 9 -6.546 7.494 -0.001
75 HB3 ALA 9 HB3 ALA 9 -6.545 8.232 -1.634
76 H ALA 10 HN ALA 10 -8.096 7.925 -3.502
77 HA ALA 10 HA ALA 10 -10.114 9.796 -4.017
78 HB1 ALA 10 HB1 ALA 10 -8.665 7.723 -5.802
79 HB2 ALA 10 HB2 ALA 10 -9.559 9.153 -6.418
80 HB3 ALA 10 HB3 ALA 10 -8.069 9.384 -5.431
81 H LYS 11 HN LYS 11 -10.205 6.202 -4.550
82 HA LYS 11 HA LYS 11 -12.766 6.279 -5.686
83 HB2 LYS 11 HB1 LYS 11 -11.186 4.451 -6.054
84 HB3 LYS 11 HB2 LYS 11 -11.325 3.930 -4.356
85 HG2 LYS 11 HG1 LYS 11 -13.949 4.113 -5.871
86 HG3 LYS 11 HG2 LYS 11 -12.785 2.967 -6.553
87 HD2 LYS 11 HD1 LYS 11 -13.026 1.438 -4.968
88 HD3 LYS 11 HD2 LYS 11 -12.916 2.592 -3.620
89 HE2 LYS 11 HE1 LYS 11 -15.505 2.240 -5.291
90 HE3 LYS 11 HE2 LYS 11 -15.127 1.211 -3.854
91 HZ1 LYS 11 HZ1 LYS 11 -16.500 3.208 -3.373
92 HZ2 LYS 11 HZ2 LYS 11 -15.167 4.178 -3.763
93 HZ3 LYS 11 HZ3 LYS 11 -15.067 3.097 -2.475
94 H PHE 12 HN PHE 12 -11.946 5.781 -2.206
95 HA PHE 12 HA PHE 12 -14.831 5.431 -1.656
96 HB2 PHE 12 HB1 PHE 12 -12.266 4.851 -0.099
97 HB3 PHE 12 HB2 PHE 12 -13.769 5.194 0.818
98 HD1 PHE 12 HD1 PHE 12 -15.849 3.930 0.380
99 HD2 PHE 12 HD2 PHE 12 -12.025 2.680 -1.104
100 HE1 PHE 12 HE1 PHE 12 -16.733 1.637 0.059
101 HE2 PHE 12 HE2 PHE 12 -12.905 0.374 -1.426
102 HZ PHE 12 HZ PHE 12 -15.264 -0.139 -0.854
103 H GLY 13 HN GLY 13 -12.372 7.935 -1.458
104 HA2 GLY 13 HA1 GLY 13 -14.416 9.639 -0.191
105 HA3 GLY 13 HA2 GLY 13 -12.711 10.014 -0.604
106 HA PRO 14 HA PRO 14 -14.946 10.599 -4.687
107 HB2 PRO 14 HB1 PRO 14 -17.640 11.448 -4.588
108 HB3 PRO 14 HB2 PRO 14 -17.119 9.734 -4.828
109 HG2 PRO 14 HG1 PRO 14 -17.886 11.090 -2.182
110 HG3 PRO 14 HG2 PRO 14 -18.502 9.513 -2.838
111 HD2 PRO 14 HD1 PRO 14 -16.458 9.519 -1.017
112 HD3 PRO 14 HD2 PRO 14 -16.380 8.421 -2.459
113 H LYS 15 HN LYS 15 -15.669 12.254 -1.716
114 HA LYS 15 HA LYS 15 -15.203 14.919 -2.572
115 HB2 LYS 15 HB1 LYS 15 -14.352 13.651 0.117
116 HB3 LYS 15 HB2 LYS 15 -14.510 15.384 -0.265
117 HG2 LYS 15 HG1 LYS 15 -16.393 15.147 0.899
118 HG3 LYS 15 HG2 LYS 15 -17.077 14.788 -0.713
119 HD2 LYS 15 HD1 LYS 15 -17.070 12.379 -0.244
120 HD3 LYS 15 HD2 LYS 15 -16.076 12.581 1.226
121 HE2 LYS 15 HE1 LYS 15 -18.970 13.651 0.904
122 HE3 LYS 15 HE2 LYS 15 -18.529 12.077 1.674
123 HZ1 LYS 15 HZ1 LYS 15 -18.846 13.818 3.303
124 HZ2 LYS 15 HZ2 LYS 15 -17.633 14.767 2.604
125 HZ3 LYS 15 HZ3 LYS 15 -17.245 13.283 3.319
126 H LEU 16 HN LEU 16 -12.932 12.281 -1.579
127 HA LEU 16 HA LEU 16 -10.620 13.913 -1.836
128 HB2 LEU 16 HB1 LEU 16 -10.895 10.897 -1.600
129 HB3 LEU 16 HB2 LEU 16 -9.355 11.803 -1.506
130 HG LEU 16 HG LEU 16 -11.702 12.081 0.468
131 HD11 LEU 16 HD11 LEU 16 -10.181 10.954 2.095
132 HD12 LEU 16 HD12 LEU 16 -8.957 10.711 0.801
133 HD13 LEU 16 HD13 LEU 16 -10.554 9.880 0.697
134 HD21 LEU 16 HD21 LEU 16 -8.861 13.281 0.591
135 HD22 LEU 16 HD22 LEU 16 -10.105 13.384 1.876
136 HD23 LEU 16 HD23 LEU 16 -10.378 14.220 0.306
137 H PHE 17 HN PHE 17 -12.296 11.638 -4.082
138 HA PHE 17 HA PHE 17 -10.280 11.715 -6.005
139 HB2 PHE 17 HB1 PHE 17 -12.714 10.421 -5.854
140 HB3 PHE 17 HB2 PHE 17 -13.183 11.687 -7.023
141 HD1 PHE 17 HD1 PHE 17 -9.838 11.273 -7.955
142 HD2 PHE 17 HD2 PHE 17 -13.474 8.986 -7.728
143 HE1 PHE 17 HE1 PHE 17 -9.018 9.816 -9.717
144 HE2 PHE 17 HE2 PHE 17 -12.670 7.552 -9.582
145 HZ PHE 17 HZ PHE 17 -10.429 7.957 -10.577
146 H ABA 18 HN AGL 18 -13.045 13.894 -5.527
147 HA ABA 18 HA AGL 18 -12.314 15.724 -7.568
148 HB3 ABA 18 HB2 AGL 18 -13.871 17.299 -6.131
149 HB2 ABA 18 HB1 AGL 18 -14.159 15.852 -5.130
150 HG3 ABA 18 HG AGL 18 -15.311 14.700 -6.975
151 H LEU 19 HN LEU 19 -11.356 15.580 -4.117
152 HA LEU 19 HA LEU 19 -9.999 18.116 -4.439
153 HB2 LEU 19 HB1 LEU 19 -11.330 17.442 -2.417
154 HB3 LEU 19 HB2 LEU 19 -10.078 16.239 -2.010
155 HG LEU 19 HG LEU 19 -10.058 18.388 -0.709
156 HD11 LEU 19 HD11 LEU 19 -7.980 16.970 -0.868
157 HD12 LEU 19 HD12 LEU 19 -7.668 18.719 -0.567
158 HD13 LEU 19 HD13 LEU 19 -7.395 18.039 -2.202
159 HD21 LEU 19 HD21 LEU 19 -9.177 20.482 -1.636
160 HD22 LEU 19 HD22 LEU 19 -10.641 19.979 -2.564
161 HD23 LEU 19 HD23 LEU 19 -8.989 19.740 -3.262
162 H VAL 20 HN VAL 20 -8.792 14.790 -3.518
163 HA VAL 20 HA VAL 20 -6.157 15.733 -3.165
164 HB VAL 20 HB VAL 20 -7.240 12.890 -3.427
165 HG11 VAL 20 HG11 VAL 20 -4.786 12.871 -3.904
166 HG12 VAL 20 HG12 VAL 20 -4.479 13.946 -2.490
167 HG13 VAL 20 HG13 VAL 20 -5.075 12.264 -2.242
168 HG21 VAL 20 HG21 VAL 20 -8.183 14.197 -1.490
169 HG22 VAL 20 HG22 VAL 20 -7.017 12.949 -0.915
170 HG23 VAL 20 HG23 VAL 20 -6.512 14.674 -1.000
171 H THR 21 HN THR 21 -7.646 13.793 -5.842
172 HA THR 21 HA THR 21 -5.195 14.378 -7.392
173 HB THR 21 HB THR 21 -5.876 12.851 -9.078
174 HG1 THR 21 HG1 THR 21 -8.073 13.031 -8.989
175 HG21 THR 21 HG21 THR 21 -6.275 11.595 -6.279
176 HG22 THR 21 HG22 THR 21 -4.679 11.961 -7.043
177 HG23 THR 21 HG23 THR 21 -5.785 10.747 -7.790
178 H LYS 22 HN LYS 22 -7.793 16.074 -6.673
179 HA LYS 22 HA LYS 22 -8.988 17.687 -7.585
180 HB2 LYS 22 HB1 LYS 22 -6.467 18.210 -7.640
181 HB3 LYS 22 HB2 LYS 22 -6.598 18.184 -9.402
182 HG2 LYS 22 HG1 LYS 22 -8.157 19.928 -7.366
183 HG3 LYS 22 HG2 LYS 22 -6.698 20.479 -8.218
184 HD2 LYS 22 HD1 LYS 22 -9.393 19.855 -9.615
185 HD3 LYS 22 HD2 LYS 22 -8.908 21.436 -8.981
186 HE2 LYS 22 HE1 LYS 22 -8.567 21.436 -11.380
187 HE3 LYS 22 HE2 LYS 22 -6.966 21.578 -10.555
188 HZ1 LYS 22 HZ1 LYS 22 -8.016 18.945 -11.316
189 HZ2 LYS 22 HZ2 LYS 22 -6.424 19.423 -11.135
190 HZ3 LYS 22 HZ3 LYS 22 -7.301 19.914 -12.515
191 H LYS 23 HN LYS 23 -10.142 15.438 -8.871
192 HA LYS 23 HA LYS 23 -10.204 16.292 -11.721
193 HB2 LYS 23 HB1 LYS 23 -10.591 14.186 -12.467
194 HB3 LYS 23 HB2 LYS 23 -9.298 14.024 -11.270
195 HG2 LYS 23 HG1 LYS 23 -10.543 12.773 -9.824
196 HG3 LYS 23 HG2 LYS 23 -12.102 13.546 -10.170
197 HD2 LYS 23 HD1 LYS 23 -10.733 11.758 -12.275
198 HD3 LYS 23 HD2 LYS 23 -11.659 11.070 -10.919
199 HE2 LYS 23 HE1 LYS 23 -13.098 11.157 -12.886
200 HE3 LYS 23 HE2 LYS 23 -13.732 12.231 -11.580
201 HZ1 LYS 23 HZ1 LYS 23 -13.828 13.235 -13.796
202 HZ2 LYS 23 HZ2 LYS 23 -12.139 13.156 -13.927
203 HZ3 LYS 23 HZ3 LYS 23 -12.859 14.118 -12.736
204 H ABA 24 HN AGL 24 -11.998 17.192 -9.311
205 HA ABA 24 HA AGL 24 -14.495 17.070 -10.899
206 HB3 ABA 24 HB2 AGL 24 -15.510 18.330 -8.924
207 HB2 ABA 24 HB1 AGL 24 -13.962 18.122 -8.064
208 HG3 ABA 24 HG AGL 24 -15.861 15.808 -9.027
Start of MODEL 9
1 H1 PHE 1 HN PHE 1 -0.158 2.565 -8.305
2 HA PHE 1 HA PHE 1 2.545 2.780 -7.632
3 HB2 PHE 1 HB1 PHE 1 2.296 4.693 -9.339
4 HB3 PHE 1 HB2 PHE 1 1.048 5.420 -8.271
5 HD1 PHE 1 HD1 PHE 1 1.786 6.975 -6.672
6 HD2 PHE 1 HD2 PHE 1 4.592 4.116 -8.207
7 HE1 PHE 1 HE1 PHE 1 3.597 8.073 -5.388
8 HE2 PHE 1 HE2 PHE 1 6.411 5.204 -6.920
9 HZ PHE 1 HZ PHE 1 5.912 7.185 -5.504
10 H LEU 2 HN LEU 2 2.751 3.229 -5.422
11 HA LEU 2 HA LEU 2 2.158 2.684 -3.366
12 HB2 LEU 2 HB1 LEU 2 -0.466 4.113 -4.022
13 HB3 LEU 2 HB2 LEU 2 -0.291 3.228 -2.501
14 HG LEU 2 HG LEU 2 0.026 5.562 -2.137
15 HD11 LEU 2 HD11 LEU 2 2.723 4.112 -1.778
16 HD12 LEU 2 HD12 LEU 2 1.290 4.001 -0.678
17 HD13 LEU 2 HD13 LEU 2 2.152 5.566 -0.886
18 HD21 LEU 2 HD21 LEU 2 0.885 6.236 -4.382
19 HD22 LEU 2 HD22 LEU 2 2.491 5.527 -3.972
20 HD23 LEU 2 HD23 LEU 2 1.856 6.920 -3.022
21 HA PRO 3 HA PRO 3 -0.573 -0.961 -3.899
22 HB2 PRO 3 HB1 PRO 3 -1.576 -1.437 -1.336
23 HB3 PRO 3 HB2 PRO 3 0.124 -1.827 -1.791
24 HG2 PRO 3 HG1 PRO 3 -0.873 0.749 -0.442
25 HG3 PRO 3 HG2 PRO 3 0.434 -0.369 0.138
26 HD2 PRO 3 HD1 PRO 3 1.013 1.881 -1.339
27 HD3 PRO 3 HD2 PRO 3 1.909 0.329 -1.660
28 H ILE 4 HN ILE 4 -3.083 -1.358 -3.036
29 HA ILE 4 HA ILE 4 -4.573 0.265 -4.533
30 HB ILE 4 HB ILE 4 -6.578 -0.697 -3.456
31 HG12 ILE 4 HG11 ILE 4 -4.569 -2.052 -1.539
32 HG13 ILE 4 HG12 ILE 4 -5.700 -0.736 -1.083
33 HG21 ILE 4 HG21 ILE 4 -5.251 -1.810 -5.286
34 HG22 ILE 4 HG22 ILE 4 -4.307 -2.714 -4.041
35 HG23 ILE 4 HG23 ILE 4 -6.077 -2.981 -4.208
36 HD11 ILE 4 HD1 ILE 4 -7.656 -2.202 -1.739
37 HD12 ILE 4 HD2 ILE 4 -6.510 -3.549 -2.080
38 HD13 ILE 4 HD3 ILE 4 -6.662 -2.899 -0.411
39 H LEU 5 HN LEU 5 -3.758 1.112 -1.273
40 HA LEU 5 HA LEU 5 -5.675 2.740 -0.365
41 HB2 LEU 5 HB1 LEU 5 -2.683 3.363 -0.316
42 HB3 LEU 5 HB2 LEU 5 -3.912 3.890 0.878
43 HG LEU 5 HG LEU 5 -2.978 0.994 0.362
44 HD11 LEU 5 HD11 LEU 5 -2.528 2.867 2.761
45 HD12 LEU 5 HD12 LEU 5 -1.295 2.425 1.521
46 HD13 LEU 5 HD13 LEU 5 -1.973 1.162 2.617
47 HD21 LEU 5 HD21 LEU 5 -5.355 0.921 1.069
48 HD22 LEU 5 HD22 LEU 5 -5.009 2.065 2.426
49 HD23 LEU 5 HD23 LEU 5 -4.293 0.416 2.427
50 H ALA 6 HN ALA 6 -3.344 3.839 -2.915
51 HA ALA 6 HA ALA 6 -4.274 6.513 -2.981
52 HB1 ALA 6 HB1 ALA 6 -2.984 4.722 -5.144
53 HB2 ALA 6 HB2 ALA 6 -3.138 6.516 -5.251
54 HB3 ALA 6 HB3 ALA 6 -2.107 5.770 -3.980
55 H SER 7 HN SER 7 -5.310 3.602 -4.832
56 HA SER 7 HA SER 7 -7.370 4.901 -6.288
57 HB2 SER 7 HB1 SER 7 -7.176 1.931 -5.502
58 HB3 SER 7 HB2 SER 7 -8.149 2.613 -6.848
59 HG SER 7 HG1 SER 7 -6.239 3.057 -7.927
60 H LEU 8 HN LEU 8 -7.290 3.229 -3.124
61 HA LEU 8 HA LEU 8 -10.093 3.319 -2.720
62 HB2 LEU 8 HB1 LEU 8 -7.812 3.198 -0.695
63 HB3 LEU 8 HB2 LEU 8 -9.542 3.098 -0.248
64 HG LEU 8 HG LEU 8 -8.085 1.107 -2.075
65 HD11 LEU 8 HD11 LEU 8 -8.304 -0.446 -0.128
66 HD12 LEU 8 HD12 LEU 8 -9.069 0.865 0.842
67 HD13 LEU 8 HD13 LEU 8 -7.352 1.022 0.321
68 HD21 LEU 8 HD21 LEU 8 -10.512 1.210 -2.665
69 HD22 LEU 8 HD22 LEU 8 -10.949 1.060 -0.915
70 HD23 LEU 8 HD23 LEU 8 -10.146 -0.305 -1.769
71 H ALA 9 HN ALA 9 -7.550 5.706 -1.970
72 HA ALA 9 HA ALA 9 -9.200 7.626 -0.823
73 HB1 ALA 9 HB1 ALA 9 -6.778 8.045 -2.684
74 HB2 ALA 9 HB2 ALA 9 -7.463 9.262 -1.545
75 HB3 ALA 9 HB3 ALA 9 -6.693 7.760 -0.912
76 H ALA 10 HN ALA 10 -8.561 7.025 -4.356
77 HA ALA 10 HA ALA 10 -10.414 8.898 -5.234
78 HB1 ALA 10 HB1 ALA 10 -10.025 6.113 -6.558
79 HB2 ALA 10 HB2 ALA 10 -10.390 7.676 -7.357
80 HB3 ALA 10 HB3 ALA 10 -8.765 7.374 -6.634
81 H LYS 11 HN LYS 11 -11.034 5.463 -4.518
82 HA LYS 11 HA LYS 11 -13.686 5.613 -5.496
83 HB2 LYS 11 HB1 LYS 11 -12.541 3.552 -5.771
84 HB3 LYS 11 HB2 LYS 11 -12.004 3.529 -4.072
85 HG2 LYS 11 HG1 LYS 11 -13.659 1.761 -4.475
86 HG3 LYS 11 HG2 LYS 11 -14.186 2.938 -3.253
87 HD2 LYS 11 HD1 LYS 11 -15.436 4.031 -5.463
88 HD3 LYS 11 HD2 LYS 11 -15.287 2.359 -6.045
89 HE2 LYS 11 HE1 LYS 11 -17.499 2.800 -4.948
90 HE3 LYS 11 HE2 LYS 11 -16.586 1.545 -4.017
91 HZ1 LYS 11 HZ1 LYS 11 -17.682 3.548 -2.792
92 HZ2 LYS 11 HZ2 LYS 11 -16.305 4.394 -3.323
93 HZ3 LYS 11 HZ3 LYS 11 -16.127 3.042 -2.340
94 H PHE 12 HN PHE 12 -12.461 5.596 -2.113
95 HA PHE 12 HA PHE 12 -15.276 5.886 -1.220
96 HB2 PHE 12 HB1 PHE 12 -12.712 4.900 0.144
97 HB3 PHE 12 HB2 PHE 12 -14.132 5.451 1.110
98 HD1 PHE 12 HD1 PHE 12 -16.366 4.444 0.751
99 HD2 PHE 12 HD2 PHE 12 -12.806 2.725 -0.912
100 HE1 PHE 12 HE1 PHE 12 -17.568 2.303 0.412
101 HE2 PHE 12 HE2 PHE 12 -14.006 0.579 -1.264
102 HZ PHE 12 HZ PHE 12 -16.391 0.371 -0.611
103 H GLY 13 HN GLY 13 -12.584 7.725 -1.984
104 HA2 GLY 13 HA1 GLY 13 -13.827 9.986 -0.533
105 HA3 GLY 13 HA2 GLY 13 -12.143 9.862 -1.136
106 HA PRO 14 HA PRO 14 -14.712 10.900 -4.952
107 HB2 PRO 14 HB1 PRO 14 -17.332 11.820 -4.547
108 HB3 PRO 14 HB2 PRO 14 -16.931 10.104 -4.928
109 HG2 PRO 14 HG1 PRO 14 -17.388 11.318 -2.147
110 HG3 PRO 14 HG2 PRO 14 -18.133 9.819 -2.849
111 HD2 PRO 14 HD1 PRO 14 -15.925 9.681 -1.209
112 HD3 PRO 14 HD2 PRO 14 -16.045 8.602 -2.668
113 H LYS 15 HN LYS 15 -15.253 12.350 -1.754
114 HA LYS 15 HA LYS 15 -14.553 15.003 -2.591
115 HB2 LYS 15 HB1 LYS 15 -14.298 13.601 0.137
116 HB3 LYS 15 HB2 LYS 15 -13.808 15.287 -0.170
117 HG2 LYS 15 HG1 LYS 15 -15.795 15.952 0.406
118 HG3 LYS 15 HG2 LYS 15 -16.402 15.359 -1.162
119 HD2 LYS 15 HD1 LYS 15 -17.110 13.220 -0.094
120 HD3 LYS 15 HD2 LYS 15 -16.254 13.674 1.423
121 HE2 LYS 15 HE1 LYS 15 -17.819 15.663 1.692
122 HE3 LYS 15 HE2 LYS 15 -18.750 15.093 0.253
123 HZ1 LYS 15 HZ1 LYS 15 -18.309 13.563 2.781
124 HZ2 LYS 15 HZ2 LYS 15 -19.216 13.037 1.448
125 HZ3 LYS 15 HZ3 LYS 15 -19.721 14.379 2.348
126 H LEU 16 HN LEU 16 -12.499 12.198 -1.437
127 HA LEU 16 HA LEU 16 -10.177 13.794 -1.486
128 HB2 LEU 16 HB1 LEU 16 -10.421 10.769 -1.375
129 HB3 LEU 16 HB2 LEU 16 -8.868 11.626 -1.458
130 HG LEU 16 HG LEU 16 -9.350 10.961 0.802
131 HD11 LEU 16 HD11 LEU 16 -9.389 14.032 0.539
132 HD12 LEU 16 HD12 LEU 16 -7.939 12.965 0.385
133 HD13 LEU 16 HD13 LEU 16 -8.819 13.070 1.947
134 HD21 LEU 16 HD21 LEU 16 -11.725 12.920 0.855
135 HD22 LEU 16 HD22 LEU 16 -11.057 11.977 2.229
136 HD23 LEU 16 HD23 LEU 16 -11.845 11.106 0.865
137 H PHE 17 HN PHE 17 -11.463 11.615 -4.129
138 HA PHE 17 HA PHE 17 -9.165 12.411 -5.677
139 HB2 PHE 17 HB1 PHE 17 -11.284 10.478 -6.050
140 HB3 PHE 17 HB2 PHE 17 -11.334 11.563 -7.466
141 HD1 PHE 17 HD1 PHE 17 -10.351 10.349 -9.200
142 HD2 PHE 17 HD2 PHE 17 -8.343 10.390 -5.392
143 HE1 PHE 17 HE1 PHE 17 -8.452 9.071 -10.167
144 HE2 PHE 17 HE2 PHE 17 -6.465 9.155 -6.361
145 HZ PHE 17 HZ PHE 17 -6.503 8.479 -8.742
146 H ABA 18 HN AGL 18 -12.262 14.015 -5.183
147 HA ABA 18 HA AGL 18 -11.794 15.882 -7.297
148 HB3 ABA 18 HB2 AGL 18 -13.231 17.436 -5.736
149 HB2 ABA 18 HB1 AGL 18 -13.432 15.990 -4.715
150 HG3 ABA 18 HG AGL 18 -14.745 14.841 -6.448
151 H LEU 19 HN LEU 19 -10.698 15.789 -3.864
152 HA LEU 19 HA LEU 19 -9.322 18.305 -4.265
153 HB2 LEU 19 HB1 LEU 19 -9.355 16.343 -1.915
154 HB3 LEU 19 HB2 LEU 19 -8.539 17.942 -1.898
155 HG LEU 19 HG LEU 19 -11.555 17.504 -2.294
156 HD11 LEU 19 HD11 LEU 19 -11.754 18.416 0.022
157 HD12 LEU 19 HD12 LEU 19 -9.958 18.491 0.153
158 HD13 LEU 19 HD13 LEU 19 -10.781 16.894 -0.001
159 HD21 LEU 19 HD21 LEU 19 -9.902 20.087 -1.939
160 HD22 LEU 19 HD22 LEU 19 -11.701 19.991 -1.888
161 HD23 LEU 19 HD23 LEU 19 -10.826 19.598 -3.409
162 H VAL 20 HN VAL 20 -8.087 14.979 -3.504
163 HA VAL 20 HA VAL 20 -5.391 15.819 -3.517
164 HB VAL 20 HB VAL 20 -6.601 13.016 -3.681
165 HG11 VAL 20 HG11 VAL 20 -4.218 12.946 -4.412
166 HG12 VAL 20 HG12 VAL 20 -3.731 13.978 -3.015
167 HG13 VAL 20 HG13 VAL 20 -4.349 12.307 -2.742
168 HG21 VAL 20 HG21 VAL 20 -7.319 14.264 -1.628
169 HG22 VAL 20 HG22 VAL 20 -6.103 13.007 -1.204
170 HG23 VAL 20 HG23 VAL 20 -5.606 14.735 -1.304
171 H THR 21 HN THR 21 -7.392 14.111 -5.935
172 HA THR 21 HA THR 21 -5.098 14.345 -7.815
173 HB THR 21 HB THR 21 -7.230 12.206 -7.906
174 HG1 THR 21 HG1 THR 21 -4.605 12.234 -6.833
175 HG21 THR 21 HG21 THR 21 -5.406 11.005 -9.219
176 HG22 THR 21 HG22 THR 21 -4.418 12.512 -9.205
177 HG23 THR 21 HG23 THR 21 -5.995 12.462 -10.083
178 H LYS 22 HN LYS 22 -7.646 16.031 -7.169
179 HA LYS 22 HA LYS 22 -8.919 17.460 -8.249
180 HB2 LYS 22 HB1 LYS 22 -6.369 17.873 -8.769
181 HB3 LYS 22 HB2 LYS 22 -6.851 17.631 -10.459
182 HG2 LYS 22 HG1 LYS 22 -7.991 19.665 -8.420
183 HG3 LYS 22 HG2 LYS 22 -6.744 20.057 -9.626
184 HD2 LYS 22 HD1 LYS 22 -9.663 19.234 -10.223
185 HD3 LYS 22 HD2 LYS 22 -9.081 20.908 -10.174
186 HE2 LYS 22 HE1 LYS 22 -8.131 18.760 -12.213
187 HE3 LYS 22 HE2 LYS 22 -9.381 20.026 -12.511
188 HZ1 LYS 22 HZ1 LYS 22 -6.538 20.497 -11.787
189 HZ2 LYS 22 HZ2 LYS 22 -7.705 21.699 -12.082
190 HZ3 LYS 22 HZ3 LYS 22 -7.221 20.659 -13.334
191 H LYS 23 HN LYS 23 -10.202 15.153 -8.843
192 HA LYS 23 HA LYS 23 -10.898 15.460 -11.712
193 HB2 LYS 23 HB1 LYS 23 -11.387 13.111 -9.827
194 HB3 LYS 23 HB2 LYS 23 -11.912 13.201 -11.541
195 HG2 LYS 23 HG1 LYS 23 -9.009 13.196 -10.513
196 HG3 LYS 23 HG2 LYS 23 -9.867 11.839 -11.316
197 HD2 LYS 23 HD1 LYS 23 -10.063 13.274 -13.426
198 HD3 LYS 23 HD2 LYS 23 -9.218 14.593 -12.573
199 HE2 LYS 23 HE1 LYS 23 -7.589 13.595 -14.001
200 HE3 LYS 23 HE2 LYS 23 -7.162 13.166 -12.298
201 HZ1 LYS 23 HZ1 LYS 23 -8.225 11.027 -12.648
202 HZ2 LYS 23 HZ2 LYS 23 -6.998 11.281 -13.798
203 HZ3 LYS 23 HZ3 LYS 23 -8.625 11.442 -14.244
204 H ABA 24 HN AGL 24 -11.762 17.217 -9.466
205 HA ABA 24 HA AGL 24 -14.559 17.230 -10.398
206 HB3 ABA 24 HB2 AGL 24 -15.182 18.516 -8.313
207 HB2 ABA 24 HB1 AGL 24 -13.526 18.256 -7.687
208 HG3 ABA 24 HG AGL 24 -15.570 15.973 -8.372
Start of MODEL 10
1 H1 PHE 1 HN PHE 1 4.572 1.240 -6.696
2 HA PHE 1 HA PHE 1 6.030 3.157 -5.095
3 HB2 PHE 1 HB1 PHE 1 5.287 3.678 -7.479
4 HB3 PHE 1 HB2 PHE 1 3.577 3.572 -6.969
5 HD1 PHE 1 HD1 PHE 1 2.545 5.613 -6.292
6 HD2 PHE 1 HD2 PHE 1 6.827 5.290 -6.125
7 HE1 PHE 1 HE1 PHE 1 2.697 7.990 -5.629
8 HE2 PHE 1 HE2 PHE 1 6.980 7.677 -5.478
9 HZ PHE 1 HZ PHE 1 4.913 9.026 -5.219
10 H LEU 2 HN LEU 2 2.620 3.693 -5.345
11 HA LEU 2 HA LEU 2 2.081 2.429 -2.762
12 HB2 LEU 2 HB1 LEU 2 2.046 4.994 -2.573
13 HB3 LEU 2 HB2 LEU 2 0.851 5.027 -3.898
14 HG LEU 2 HG LEU 2 -0.702 3.617 -2.408
15 HD11 LEU 2 HD11 LEU 2 0.986 2.692 -0.795
16 HD12 LEU 2 HD12 LEU 2 -0.220 3.709 0.082
17 HD13 LEU 2 HD13 LEU 2 1.414 4.362 -0.278
18 HD21 LEU 2 HD21 LEU 2 -1.429 5.554 -1.035
19 HD22 LEU 2 HD22 LEU 2 -0.970 6.088 -2.696
20 HD23 LEU 2 HD23 LEU 2 0.154 6.368 -1.316
21 HA PRO 3 HA PRO 3 -0.578 1.005 -6.128
22 HB2 PRO 3 HB1 PRO 3 -1.305 -1.417 -5.181
23 HB3 PRO 3 HB2 PRO 3 0.428 -0.968 -5.201
24 HG2 PRO 3 HG1 PRO 3 -1.438 -0.758 -2.762
25 HG3 PRO 3 HG2 PRO 3 0.157 -1.607 -2.886
26 HD2 PRO 3 HD1 PRO 3 -0.119 1.054 -2.008
27 HD3 PRO 3 HD2 PRO 3 1.351 0.416 -2.873
28 H ILE 4 HN ILE 4 -2.867 -0.721 -4.641
29 HA ILE 4 HA ILE 4 -4.999 0.748 -5.366
30 HB ILE 4 HB ILE 4 -6.397 -0.714 -3.991
31 HG12 ILE 4 HG11 ILE 4 -3.758 -1.923 -2.944
32 HG13 ILE 4 HG12 ILE 4 -4.849 -0.871 -1.982
33 HG21 ILE 4 HG21 ILE 4 -5.811 -2.753 -5.229
34 HG22 ILE 4 HG22 ILE 4 -5.509 -1.323 -6.269
35 HG23 ILE 4 HG23 ILE 4 -4.126 -2.183 -5.491
36 HD11 ILE 4 HD1 ILE 4 -5.309 -3.226 -1.435
37 HD12 ILE 4 HD2 ILE 4 -6.728 -2.524 -2.291
38 HD13 ILE 4 HD3 ILE 4 -5.599 -3.625 -3.165
39 H LEU 5 HN LEU 5 -3.287 1.300 -2.351
40 HA LEU 5 HA LEU 5 -5.379 2.458 -0.920
41 HB2 LEU 5 HB1 LEU 5 -2.405 3.159 -0.791
42 HB3 LEU 5 HB2 LEU 5 -3.630 3.442 0.488
43 HG LEU 5 HG LEU 5 -2.663 0.697 -0.541
44 HD11 LEU 5 HD11 LEU 5 -0.975 1.839 0.866
45 HD12 LEU 5 HD12 LEU 5 -1.712 0.457 1.753
46 HD13 LEU 5 HD13 LEU 5 -2.217 2.139 2.141
47 HD21 LEU 5 HD21 LEU 5 -5.032 0.470 0.124
48 HD22 LEU 5 HD22 LEU 5 -4.717 1.369 1.662
49 HD23 LEU 5 HD23 LEU 5 -3.982 -0.250 1.390
50 H ALA 6 HN ALA 6 -3.317 3.984 -3.424
51 HA ALA 6 HA ALA 6 -4.345 6.612 -3.099
52 HB1 ALA 6 HB1 ALA 6 -3.474 6.879 -5.468
53 HB2 ALA 6 HB2 ALA 6 -2.270 6.048 -4.418
54 HB3 ALA 6 HB3 ALA 6 -3.261 5.088 -5.565
55 H SER 7 HN SER 7 -5.388 3.822 -5.129
56 HA SER 7 HA SER 7 -7.614 5.059 -6.294
57 HB2 SER 7 HB1 SER 7 -7.319 2.064 -5.678
58 HB3 SER 7 HB2 SER 7 -8.317 2.809 -6.971
59 HG SER 7 HG1 SER 7 -6.452 3.279 -8.073
60 H LEU 8 HN LEU 8 -7.338 3.191 -3.239
61 HA LEU 8 HA LEU 8 -10.103 3.232 -2.673
62 HB2 LEU 8 HB1 LEU 8 -7.681 2.985 -0.824
63 HB3 LEU 8 HB2 LEU 8 -9.372 2.846 -0.252
64 HG LEU 8 HG LEU 8 -8.079 1.003 -2.339
65 HD11 LEU 8 HD11 LEU 8 -8.786 0.509 0.625
66 HD12 LEU 8 HD12 LEU 8 -7.127 0.753 -0.028
67 HD13 LEU 8 HD13 LEU 8 -8.088 -0.694 -0.522
68 HD21 LEU 8 HD21 LEU 8 -10.551 1.144 -2.684
69 HD22 LEU 8 HD22 LEU 8 -10.816 0.857 -0.915
70 HD23 LEU 8 HD23 LEU 8 -10.106 -0.437 -1.948
71 H ALA 9 HN ALA 9 -7.516 5.566 -1.810
72 HA ALA 9 HA ALA 9 -9.177 7.361 -0.462
73 HB1 ALA 9 HB1 ALA 9 -6.675 7.507 -0.531
74 HB2 ALA 9 HB2 ALA 9 -6.747 7.912 -2.279
75 HB3 ALA 9 HB3 ALA 9 -7.430 9.055 -1.059
76 H ALA 10 HN ALA 10 -8.500 7.043 -3.978
77 HA ALA 10 HA ALA 10 -10.153 9.082 -4.840
78 HB1 ALA 10 HB1 ALA 10 -8.453 7.623 -6.178
79 HB2 ALA 10 HB2 ALA 10 -9.720 6.358 -6.277
80 HB3 ALA 10 HB3 ALA 10 -10.010 7.952 -7.037
81 H LYS 11 HN LYS 11 -11.038 5.644 -4.391
82 HA LYS 11 HA LYS 11 -13.678 6.092 -5.419
83 HB2 LYS 11 HB1 LYS 11 -12.427 4.026 -5.842
84 HB3 LYS 11 HB2 LYS 11 -12.357 3.644 -4.103
85 HG2 LYS 11 HG1 LYS 11 -15.072 4.020 -5.467
86 HG3 LYS 11 HG2 LYS 11 -14.160 2.511 -5.775
87 HD2 LYS 11 HD1 LYS 11 -14.207 1.827 -3.471
88 HD3 LYS 11 HD2 LYS 11 -14.686 3.450 -2.910
89 HE2 LYS 11 HE1 LYS 11 -16.916 3.131 -4.229
90 HE3 LYS 11 HE2 LYS 11 -16.462 1.380 -4.325
91 HZ1 LYS 11 HZ1 LYS 11 -17.773 1.740 -2.378
92 HZ2 LYS 11 HZ2 LYS 11 -16.822 3.059 -1.892
93 HZ3 LYS 11 HZ3 LYS 11 -16.173 1.510 -1.846
94 H PHE 12 HN PHE 12 -12.408 5.472 -2.078
95 HA PHE 12 HA PHE 12 -15.164 5.556 -1.090
96 HB2 PHE 12 HB1 PHE 12 -12.454 4.951 0.209
97 HB3 PHE 12 HB2 PHE 12 -13.885 5.361 1.214
98 HD1 PHE 12 HD1 PHE 12 -15.854 3.985 1.288
99 HD2 PHE 12 HD2 PHE 12 -12.405 2.792 -0.961
100 HE1 PHE 12 HE1 PHE 12 -16.679 1.652 1.283
101 HE2 PHE 12 HE2 PHE 12 -13.233 0.449 -0.989
102 HZ PHE 12 HZ PHE 12 -15.368 -0.124 0.143
103 H GLY 13 HN GLY 13 -12.479 7.701 -1.540
104 HA2 GLY 13 HA1 GLY 13 -14.166 9.839 -0.383
105 HA3 GLY 13 HA2 GLY 13 -12.408 9.887 -0.747
106 HA PRO 14 HA PRO 14 -14.491 10.649 -4.906
107 HB2 PRO 14 HB1 PRO 14 -17.187 11.399 -4.888
108 HB3 PRO 14 HB2 PRO 14 -16.648 9.692 -5.127
109 HG2 PRO 14 HG1 PRO 14 -17.548 10.981 -2.492
110 HG3 PRO 14 HG2 PRO 14 -18.106 9.419 -3.224
111 HD2 PRO 14 HD1 PRO 14 -16.126 9.481 -1.298
112 HD3 PRO 14 HD2 PRO 14 -16.030 8.321 -2.693
113 H LYS 15 HN LYS 15 -15.578 12.002 -1.853
114 HA LYS 15 HA LYS 15 -15.077 14.735 -2.368
115 HB2 LYS 15 HB1 LYS 15 -14.664 13.064 0.192
116 HB3 LYS 15 HB2 LYS 15 -14.652 14.853 0.130
117 HG2 LYS 15 HG1 LYS 15 -17.026 14.896 -0.550
118 HG3 LYS 15 HG2 LYS 15 -17.095 13.103 -0.567
119 HD2 LYS 15 HD1 LYS 15 -16.528 13.026 1.857
120 HD3 LYS 15 HD2 LYS 15 -16.375 14.813 1.897
121 HE2 LYS 15 HE1 LYS 15 -18.821 15.063 1.379
122 HE3 LYS 15 HE2 LYS 15 -18.995 13.265 1.294
123 HZ1 LYS 15 HZ1 LYS 15 -19.657 14.160 3.444
124 HZ2 LYS 15 HZ2 LYS 15 -18.119 14.815 3.694
125 HZ3 LYS 15 HZ3 LYS 15 -18.320 13.139 3.609
126 H LEU 16 HN LEU 16 -12.820 12.076 -1.304
127 HA LEU 16 HA LEU 16 -10.602 13.837 -1.117
128 HB2 LEU 16 HB1 LEU 16 -10.627 10.806 -1.372
129 HB3 LEU 16 HB2 LEU 16 -9.186 11.797 -1.015
130 HG LEU 16 HG LEU 16 -11.664 11.649 0.796
131 HD11 LEU 16 HD11 LEU 16 -8.900 10.303 1.051
132 HD12 LEU 16 HD12 LEU 16 -10.441 9.465 0.642
133 HD13 LEU 16 HD13 LEU 16 -10.229 10.232 2.263
134 HD21 LEU 16 HD21 LEU 16 -8.870 12.893 1.235
135 HD22 LEU 16 HD22 LEU 16 -10.140 12.714 2.494
136 HD23 LEU 16 HD23 LEU 16 -10.422 13.802 1.088
137 H PHE 17 HN PHE 17 -11.640 11.631 -3.836
138 HA PHE 17 HA PHE 17 -9.396 12.433 -5.348
139 HB2 PHE 17 HB1 PHE 17 -11.362 10.494 -5.717
140 HB3 PHE 17 HB2 PHE 17 -11.836 11.677 -6.967
141 HD1 PHE 17 HD1 PHE 17 -11.092 10.789 -9.007
142 HD2 PHE 17 HD2 PHE 17 -8.436 10.520 -5.640
143 HE1 PHE 17 HE1 PHE 17 -9.358 9.726 -10.437
144 HE2 PHE 17 HE2 PHE 17 -6.736 9.449 -7.060
145 HZ PHE 17 HZ PHE 17 -7.174 9.074 -9.464
146 H ABA 18 HN AGL 18 -12.602 13.955 -5.074
147 HA ABA 18 HA AGL 18 -12.101 15.972 -6.989
148 HB3 ABA 18 HB2 AGL 18 -13.801 17.305 -5.514
149 HB2 ABA 18 HB1 AGL 18 -13.914 15.829 -4.526
150 HG3 ABA 18 HG AGL 18 -14.961 14.569 -6.369
151 H LEU 19 HN LEU 19 -11.129 15.784 -3.519
152 HA LEU 19 HA LEU 19 -9.970 18.446 -3.784
153 HB2 LEU 19 HB1 LEU 19 -10.463 16.503 -1.539
154 HB3 LEU 19 HB2 LEU 19 -9.083 17.623 -1.337
155 HG LEU 19 HG LEU 19 -11.101 18.480 -0.278
156 HD11 LEU 19 HD11 LEU 19 -9.326 20.037 -1.127
157 HD12 LEU 19 HD12 LEU 19 -10.962 20.794 -1.112
158 HD13 LEU 19 HD13 LEU 19 -10.243 20.240 -2.664
159 HD21 LEU 19 HD21 LEU 19 -12.845 17.578 -1.844
160 HD22 LEU 19 HD22 LEU 19 -12.327 18.771 -3.094
161 HD23 LEU 19 HD23 LEU 19 -13.033 19.350 -1.542
162 H VAL 20 HN VAL 20 -8.522 15.205 -3.064
163 HA VAL 20 HA VAL 20 -5.886 16.215 -2.969
164 HB VAL 20 HB VAL 20 -6.931 13.357 -3.301
165 HG11 VAL 20 HG11 VAL 20 -4.120 14.428 -2.555
166 HG12 VAL 20 HG12 VAL 20 -4.655 12.717 -2.366
167 HG13 VAL 20 HG13 VAL 20 -4.547 13.439 -4.003
168 HG21 VAL 20 HG21 VAL 20 -6.471 13.235 -0.822
169 HG22 VAL 20 HG22 VAL 20 -6.054 14.985 -0.817
170 HG23 VAL 20 HG23 VAL 20 -7.740 14.454 -1.193
171 H THR 21 HN THR 21 -7.698 14.448 -5.488
172 HA THR 21 HA THR 21 -5.362 14.727 -7.276
173 HB THR 21 HB THR 21 -7.799 12.983 -7.736
174 HG1 THR 21 HG1 THR 21 -6.485 11.387 -6.872
175 HG21 THR 21 HG21 THR 21 -6.338 13.263 -9.772
176 HG22 THR 21 HG22 THR 21 -6.051 11.642 -9.065
177 HG23 THR 21 HG23 THR 21 -4.868 12.968 -8.765
178 H LYS 22 HN LYS 22 -7.948 16.470 -6.561
179 HA LYS 22 HA LYS 22 -9.346 17.871 -7.470
180 HB2 LYS 22 HB1 LYS 22 -8.468 19.590 -8.842
181 HB3 LYS 22 HB2 LYS 22 -7.259 19.084 -7.623
182 HG2 LYS 22 HG1 LYS 22 -5.945 17.888 -9.321
183 HG3 LYS 22 HG2 LYS 22 -7.255 18.092 -10.530
184 HD2 LYS 22 HD1 LYS 22 -6.897 20.694 -10.106
185 HD3 LYS 22 HD2 LYS 22 -5.290 20.195 -9.502
186 HE2 LYS 22 HE1 LYS 22 -6.547 19.728 -12.303
187 HE3 LYS 22 HE2 LYS 22 -5.107 20.755 -11.922
188 HZ1 LYS 22 HZ1 LYS 22 -3.927 18.760 -11.272
189 HZ2 LYS 22 HZ2 LYS 22 -4.543 18.564 -12.848
190 HZ3 LYS 22 HZ3 LYS 22 -5.307 17.816 -11.525
191 H LYS 23 HN LYS 23 -10.237 15.432 -8.446
192 HA LYS 23 HA LYS 23 -10.748 15.915 -11.308
193 HB2 LYS 23 HB1 LYS 23 -11.207 13.457 -9.576
194 HB3 LYS 23 HB2 LYS 23 -11.765 13.611 -11.268
195 HG2 LYS 23 HG1 LYS 23 -9.109 14.380 -11.558
196 HG3 LYS 23 HG2 LYS 23 -8.982 13.241 -10.196
197 HD2 LYS 23 HD1 LYS 23 -8.626 11.965 -12.198
198 HD3 LYS 23 HD2 LYS 23 -10.274 11.531 -11.622
199 HE2 LYS 23 HE1 LYS 23 -11.276 13.093 -13.358
200 HE3 LYS 23 HE2 LYS 23 -9.613 13.541 -13.900
201 HZ1 LYS 23 HZ1 LYS 23 -9.252 11.232 -14.519
202 HZ2 LYS 23 HZ2 LYS 23 -10.611 11.865 -15.304
203 HZ3 LYS 23 HZ3 LYS 23 -10.811 10.810 -13.997
204 H ABA 24 HN AGL 24 -12.152 17.475 -9.056
205 HA ABA 24 HA AGL 24 -14.842 17.122 -10.231
206 HB3 ABA 24 HB2 AGL 24 -15.765 18.215 -8.142
207 HB2 ABA 24 HB1 AGL 24 -14.128 18.154 -7.426
208 HG3 ABA 24 HG AGL 24 -15.808 15.653 -8.313
Start of MODEL 11
1 H1 PHE 1 HN PHE 1 0.552 3.648 -8.424
2 HA PHE 1 HA PHE 1 3.055 2.899 -7.555
3 HB2 PHE 1 HB1 PHE 1 3.715 5.165 -8.519
4 HB3 PHE 1 HB2 PHE 1 2.491 5.944 -7.453
5 HD1 PHE 1 HD1 PHE 1 3.140 6.608 -5.289
6 HD2 PHE 1 HD2 PHE 1 5.510 3.683 -7.347
7 HE1 PHE 1 HE1 PHE 1 4.753 6.605 -3.410
8 HE2 PHE 1 HE2 PHE 1 7.131 3.671 -5.471
9 HZ PHE 1 HZ PHE 1 6.747 5.127 -3.492
10 H LEU 2 HN LEU 2 3.208 3.194 -5.185
11 HA LEU 2 HA LEU 2 2.441 2.668 -3.205
12 HB2 LEU 2 HB1 LEU 2 1.126 4.909 -3.622
13 HB3 LEU 2 HB2 LEU 2 -0.297 3.869 -3.853
14 HG LEU 2 HG LEU 2 -0.041 3.045 -1.485
15 HD11 LEU 2 HD11 LEU 2 1.479 4.290 0.082
16 HD12 LEU 2 HD12 LEU 2 2.170 5.210 -1.303
17 HD13 LEU 2 HD13 LEU 2 2.456 3.434 -1.164
18 HD21 LEU 2 HD21 LEU 2 -0.174 6.104 -1.794
19 HD22 LEU 2 HD22 LEU 2 -0.796 5.148 -0.396
20 HD23 LEU 2 HD23 LEU 2 -1.533 4.944 -2.031
21 HA PRO 3 HA PRO 3 -0.446 -0.801 -4.125
22 HB2 PRO 3 HB1 PRO 3 -1.611 -1.378 -1.607
23 HB3 PRO 3 HB2 PRO 3 0.014 -1.946 -2.135
24 HG2 PRO 3 HG1 PRO 3 -0.621 0.582 -0.509
25 HG3 PRO 3 HG2 PRO 3 0.543 -0.748 -0.088
26 HD2 PRO 3 HD1 PRO 3 1.461 1.511 -1.305
27 HD3 PRO 3 HD2 PRO 3 2.017 -0.102 -1.937
28 H ILE 4 HN ILE 4 -2.959 -1.229 -3.350
29 HA ILE 4 HA ILE 4 -4.419 0.472 -4.798
30 HB ILE 4 HB ILE 4 -6.441 -0.577 -3.823
31 HG12 ILE 4 HG11 ILE 4 -4.455 -2.040 -1.963
32 HG13 ILE 4 HG12 ILE 4 -5.610 -0.771 -1.442
33 HG21 ILE 4 HG21 ILE 4 -5.900 -2.802 -4.717
34 HG22 ILE 4 HG22 ILE 4 -5.071 -1.551 -5.698
35 HG23 ILE 4 HG23 ILE 4 -4.136 -2.526 -4.500
36 HD11 ILE 4 HD1 ILE 4 -6.365 -3.517 -2.642
37 HD12 ILE 4 HD2 ILE 4 -6.557 -2.984 -0.936
38 HD13 ILE 4 HD3 ILE 4 -7.535 -2.210 -2.233
39 H LEU 5 HN LEU 5 -3.710 1.056 -1.454
40 HA LEU 5 HA LEU 5 -5.562 2.643 -0.430
41 HB2 LEU 5 HB1 LEU 5 -2.573 3.277 -0.474
42 HB3 LEU 5 HB2 LEU 5 -3.751 3.767 0.788
43 HG LEU 5 HG LEU 5 -2.842 0.893 0.132
44 HD11 LEU 5 HD11 LEU 5 -1.751 0.986 2.352
45 HD12 LEU 5 HD12 LEU 5 -2.305 2.683 2.575
46 HD13 LEU 5 HD13 LEU 5 -1.120 2.290 1.274
47 HD21 LEU 5 HD21 LEU 5 -4.089 0.240 2.219
48 HD22 LEU 5 HD22 LEU 5 -5.196 0.804 0.921
49 HD23 LEU 5 HD23 LEU 5 -4.793 1.892 2.306
50 H ALA 6 HN ALA 6 -3.328 3.932 -2.978
51 HA ALA 6 HA ALA 6 -4.285 6.590 -2.849
52 HB1 ALA 6 HB1 ALA 6 -3.098 4.946 -5.185
53 HB2 ALA 6 HB2 ALA 6 -3.241 6.744 -5.156
54 HB3 ALA 6 HB3 ALA 6 -2.153 5.904 -3.997
55 H SER 7 HN SER 7 -5.323 3.810 -4.888
56 HA SER 7 HA SER 7 -7.469 5.164 -6.154
57 HB2 SER 7 HB1 SER 7 -7.116 2.144 -5.687
58 HB3 SER 7 HB2 SER 7 -8.179 2.911 -6.915
59 HG SER 7 HG1 SER 7 -6.379 3.485 -8.057
60 H LEU 8 HN LEU 8 -7.206 3.277 -3.122
61 HA LEU 8 HA LEU 8 -10.016 3.240 -2.659
62 HB2 LEU 8 HB1 LEU 8 -7.711 3.044 -0.666
63 HB3 LEU 8 HB2 LEU 8 -9.435 2.842 -0.234
64 HG LEU 8 HG LEU 8 -7.887 1.053 -2.188
65 HD11 LEU 8 HD11 LEU 8 -8.103 -0.658 -0.375
66 HD12 LEU 8 HD12 LEU 8 -8.918 0.551 0.681
67 HD13 LEU 8 HD13 LEU 8 -7.197 0.793 0.205
68 HD21 LEU 8 HD21 LEU 8 -10.773 0.836 -1.105
69 HD22 LEU 8 HD22 LEU 8 -9.909 -0.447 -2.027
70 HD23 LEU 8 HD23 LEU 8 -10.296 1.114 -2.831
71 H ALA 9 HN ALA 9 -7.507 5.606 -1.684
72 HA ALA 9 HA ALA 9 -9.215 7.384 -0.391
73 HB1 ALA 9 HB1 ALA 9 -6.733 7.952 -2.136
74 HB2 ALA 9 HB2 ALA 9 -7.451 9.088 -0.933
75 HB3 ALA 9 HB3 ALA 9 -6.707 7.542 -0.386
76 H ALA 10 HN ALA 10 -8.400 7.117 -3.881
77 HA ALA 10 HA ALA 10 -10.045 9.134 -4.816
78 HB1 ALA 10 HB1 ALA 10 -9.453 6.367 -6.108
79 HB2 ALA 10 HB2 ALA 10 -9.901 7.858 -6.977
80 HB3 ALA 10 HB3 ALA 10 -8.315 7.756 -6.113
81 H LYS 11 HN LYS 11 -10.917 5.664 -4.386
82 HA LYS 11 HA LYS 11 -13.537 6.081 -5.431
83 HB2 LYS 11 HB1 LYS 11 -12.282 4.010 -5.740
84 HB3 LYS 11 HB2 LYS 11 -12.235 3.701 -3.987
85 HG2 LYS 11 HG1 LYS 11 -14.933 3.985 -5.411
86 HG3 LYS 11 HG2 LYS 11 -13.990 2.479 -5.632
87 HD2 LYS 11 HD1 LYS 11 -13.998 1.973 -3.252
88 HD3 LYS 11 HD2 LYS 11 -14.672 3.577 -2.849
89 HE2 LYS 11 HE1 LYS 11 -16.793 2.947 -4.184
90 HE3 LYS 11 HE2 LYS 11 -16.157 1.250 -4.210
91 HZ1 LYS 11 HZ1 LYS 11 -15.951 1.478 -1.738
92 HZ2 LYS 11 HZ2 LYS 11 -17.554 1.536 -2.306
93 HZ3 LYS 11 HZ3 LYS 11 -16.744 2.954 -1.840
94 H PHE 12 HN PHE 12 -12.361 5.617 -2.035
95 HA PHE 12 HA PHE 12 -15.138 5.750 -1.110
96 HB2 PHE 12 HB1 PHE 12 -12.440 5.212 0.248
97 HB3 PHE 12 HB2 PHE 12 -13.885 5.644 1.225
98 HD1 PHE 12 HD1 PHE 12 -15.870 4.267 1.272
99 HD2 PHE 12 HD2 PHE 12 -12.323 2.992 -0.771
100 HE1 PHE 12 HE1 PHE 12 -16.655 1.923 1.394
101 HE2 PHE 12 HE2 PHE 12 -13.110 0.639 -0.670
102 HZ PHE 12 HZ PHE 12 -15.267 0.101 0.433
103 H GLY 13 HN GLY 13 -12.459 7.870 -1.620
104 HA2 GLY 13 HA1 GLY 13 -14.102 10.055 -0.498
105 HA3 GLY 13 HA2 GLY 13 -12.351 10.072 -0.908
106 HA PRO 14 HA PRO 14 -14.497 10.736 -5.043
107 HB2 PRO 14 HB1 PRO 14 -17.178 11.563 -4.999
108 HB3 PRO 14 HB2 PRO 14 -16.677 9.848 -5.244
109 HG2 PRO 14 HG1 PRO 14 -17.510 11.171 -2.607
110 HG3 PRO 14 HG2 PRO 14 -18.109 9.612 -3.315
111 HD2 PRO 14 HD1 PRO 14 -16.109 9.628 -1.415
112 HD3 PRO 14 HD2 PRO 14 -16.025 8.486 -2.825
113 H LYS 15 HN LYS 15 -15.384 12.204 -1.987
114 HA LYS 15 HA LYS 15 -14.928 14.913 -2.673
115 HB2 LYS 15 HB1 LYS 15 -14.125 13.579 -0.005
116 HB3 LYS 15 HB2 LYS 15 -14.412 15.306 -0.329
117 HG2 LYS 15 HG1 LYS 15 -16.334 14.885 0.712
118 HG3 LYS 15 HG2 LYS 15 -16.907 14.456 -0.925
119 HD2 LYS 15 HD1 LYS 15 -16.669 12.064 -0.454
120 HD3 LYS 15 HD2 LYS 15 -15.711 12.358 1.022
121 HE2 LYS 15 HE1 LYS 15 -18.697 13.129 0.708
122 HE3 LYS 15 HE2 LYS 15 -18.100 11.594 1.454
123 HZ1 LYS 15 HZ1 LYS 15 -18.574 13.270 3.113
124 HZ2 LYS 15 HZ2 LYS 15 -17.468 14.346 2.417
125 HZ3 LYS 15 HZ3 LYS 15 -16.926 12.898 3.106
126 H LEU 16 HN LEU 16 -12.645 12.277 -1.684
127 HA LEU 16 HA LEU 16 -10.382 13.997 -1.685
128 HB2 LEU 16 HB1 LEU 16 -10.527 10.957 -1.724
129 HB3 LEU 16 HB2 LEU 16 -9.037 11.914 -1.483
130 HG LEU 16 HG LEU 16 -11.464 11.969 0.404
131 HD11 LEU 16 HD11 LEU 16 -10.292 9.755 0.382
132 HD12 LEU 16 HD12 LEU 16 -10.019 10.633 1.934
133 HD13 LEU 16 HD13 LEU 16 -8.722 10.585 0.687
134 HD21 LEU 16 HD21 LEU 16 -9.871 13.125 1.977
135 HD22 LEU 16 HD22 LEU 16 -10.176 14.111 0.503
136 HD23 LEU 16 HD23 LEU 16 -8.637 13.186 0.672
137 H PHE 17 HN PHE 17 -11.637 11.649 -4.172
138 HA PHE 17 HA PHE 17 -9.452 12.257 -5.847
139 HB2 PHE 17 HB1 PHE 17 -11.418 10.332 -5.970
140 HB3 PHE 17 HB2 PHE 17 -12.045 11.449 -7.218
141 HD1 PHE 17 HD1 PHE 17 -11.621 10.180 -9.171
142 HD2 PHE 17 HD2 PHE 17 -8.441 10.541 -6.303
143 HE1 PHE 17 HE1 PHE 17 -10.099 8.930 -10.672
144 HE2 PHE 17 HE2 PHE 17 -6.925 9.353 -7.827
145 HZ PHE 17 HZ PHE 17 -7.736 8.552 -10.018
146 H ABA 18 HN AGL 18 -12.618 13.889 -5.580
147 HA ABA 18 HA AGL 18 -12.043 15.768 -7.621
148 HB3 ABA 18 HB2 AGL 18 -13.706 17.244 -6.246
149 HB2 ABA 18 HB1 AGL 18 -13.864 15.842 -5.160
150 HG3 ABA 18 HG AGL 18 -14.981 14.512 -6.893
151 H LEU 19 HN LEU 19 -11.207 15.846 -4.089
152 HA LEU 19 HA LEU 19 -10.065 18.461 -4.474
153 HB2 LEU 19 HB1 LEU 19 -11.198 17.838 -2.373
154 HB3 LEU 19 HB2 LEU 19 -10.000 16.541 -2.093
155 HG LEU 19 HG LEU 19 -8.181 18.256 -1.886
156 HD11 LEU 19 HD11 LEU 19 -9.047 20.082 -3.321
157 HD12 LEU 19 HD12 LEU 19 -8.770 20.683 -1.652
158 HD13 LEU 19 HD13 LEU 19 -10.449 20.326 -2.206
159 HD21 LEU 19 HD21 LEU 19 -8.881 19.178 0.304
160 HD22 LEU 19 HD22 LEU 19 -9.395 17.459 0.130
161 HD23 LEU 19 HD23 LEU 19 -10.603 18.789 -0.061
162 H VAL 20 HN VAL 20 -8.544 15.287 -3.570
163 HA VAL 20 HA VAL 20 -5.936 16.422 -3.490
164 HB VAL 20 HB VAL 20 -6.834 13.494 -3.509
165 HG11 VAL 20 HG11 VAL 20 -4.569 13.102 -2.432
166 HG12 VAL 20 HG12 VAL 20 -4.427 13.664 -4.128
167 HG13 VAL 20 HG13 VAL 20 -4.130 14.816 -2.772
168 HG21 VAL 20 HG21 VAL 20 -6.175 15.449 -1.200
169 HG22 VAL 20 HG22 VAL 20 -7.806 14.769 -1.579
170 HG23 VAL 20 HG23 VAL 20 -6.484 13.685 -1.016
171 H THR 21 HN THR 21 -7.611 14.230 -5.777
172 HA THR 21 HA THR 21 -5.268 14.412 -7.550
173 HB THR 21 HB THR 21 -7.670 12.631 -7.985
174 HG1 THR 21 HG1 THR 21 -6.309 11.093 -6.918
175 HG21 THR 21 HG21 THR 21 -5.949 12.747 -9.866
176 HG22 THR 21 HG22 THR 21 -5.839 11.170 -9.024
177 HG23 THR 21 HG23 THR 21 -4.634 12.453 -8.663
178 H LYS 22 HN LYS 22 -7.964 16.179 -7.138
179 HA LYS 22 HA LYS 22 -9.209 17.544 -8.338
180 HB2 LYS 22 HB1 LYS 22 -6.671 18.167 -8.609
181 HB3 LYS 22 HB2 LYS 22 -6.956 17.877 -10.337
182 HG2 LYS 22 HG1 LYS 22 -8.476 19.816 -8.456
183 HG3 LYS 22 HG2 LYS 22 -7.133 20.310 -9.509
184 HD2 LYS 22 HD1 LYS 22 -9.888 19.254 -10.436
185 HD3 LYS 22 HD2 LYS 22 -9.438 20.968 -10.347
186 HE2 LYS 22 HE1 LYS 22 -8.143 18.871 -12.242
187 HE3 LYS 22 HE2 LYS 22 -9.387 20.098 -12.687
188 HZ1 LYS 22 HZ1 LYS 22 -7.828 21.821 -12.050
189 HZ2 LYS 22 HZ2 LYS 22 -7.160 20.806 -13.238
190 HZ3 LYS 22 HZ3 LYS 22 -6.671 20.653 -11.618
191 H LYS 23 HN LYS 23 -10.214 15.112 -9.019
192 HA LYS 23 HA LYS 23 -10.577 15.282 -11.957
193 HB2 LYS 23 HB1 LYS 23 -11.169 12.977 -10.060
194 HB3 LYS 23 HB2 LYS 23 -11.505 13.005 -11.817
195 HG2 LYS 23 HG1 LYS 23 -8.792 13.788 -11.724
196 HG3 LYS 23 HG2 LYS 23 -8.917 12.692 -10.336
197 HD2 LYS 23 HD1 LYS 23 -8.255 11.309 -12.189
198 HD3 LYS 23 HD2 LYS 23 -9.967 10.937 -11.843
199 HE2 LYS 23 HE1 LYS 23 -9.591 11.000 -14.283
200 HE3 LYS 23 HE2 LYS 23 -10.707 12.334 -13.801
201 HZ1 LYS 23 HZ1 LYS 23 -7.778 12.581 -14.302
202 HZ2 LYS 23 HZ2 LYS 23 -8.812 13.832 -13.818
203 HZ3 LYS 23 HZ3 LYS 23 -9.024 13.093 -15.333
204 H ABA 24 HN AGL 24 -11.963 16.907 -9.681
205 HA ABA 24 HA AGL 24 -14.614 16.699 -10.981
206 HB3 ABA 24 HB2 AGL 24 -15.512 18.021 -9.025
207 HB2 ABA 24 HB1 AGL 24 -13.902 17.927 -8.255
208 HG3 ABA 24 HG AGL 24 -15.718 15.463 -8.955
Start of MODEL 12
1 H1 PHE 1 HN PHE 1 3.339 2.234 -6.670
2 HA PHE 1 HA PHE 1 5.472 3.431 -5.084
3 HB2 PHE 1 HB1 PHE 1 4.508 5.705 -5.501
4 HB3 PHE 1 HB2 PHE 1 5.042 4.896 -7.010
5 HD1 PHE 1 HD1 PHE 1 3.207 3.708 -8.460
6 HD2 PHE 1 HD2 PHE 1 2.349 6.615 -5.414
7 HE1 PHE 1 HE1 PHE 1 0.962 4.065 -9.429
8 HE2 PHE 1 HE2 PHE 1 0.105 6.976 -6.392
9 HZ PHE 1 HZ PHE 1 -0.596 5.686 -8.392
10 H LEU 2 HN LEU 2 1.994 4.088 -5.179
11 HA LEU 2 HA LEU 2 1.645 2.727 -2.595
12 HB2 LEU 2 HB1 LEU 2 0.055 4.991 -3.955
13 HB3 LEU 2 HB2 LEU 2 -0.735 3.867 -2.810
14 HG LEU 2 HG LEU 2 0.840 4.543 -1.006
15 HD11 LEU 2 HD11 LEU 2 2.098 6.708 -1.240
16 HD12 LEU 2 HD12 LEU 2 1.749 6.709 -3.010
17 HD13 LEU 2 HD13 LEU 2 2.778 5.412 -2.284
18 HD21 LEU 2 HD21 LEU 2 -0.771 6.828 -2.316
19 HD22 LEU 2 HD22 LEU 2 -0.281 6.730 -0.584
20 HD23 LEU 2 HD23 LEU 2 -1.449 5.535 -1.258
21 HA PRO 3 HA PRO 3 -0.590 0.384 -5.805
22 HB2 PRO 3 HB1 PRO 3 -1.390 -1.818 -4.410
23 HB3 PRO 3 HB2 PRO 3 0.352 -1.442 -4.591
24 HG2 PRO 3 HG1 PRO 3 -1.381 -0.739 -2.151
25 HG3 PRO 3 HG2 PRO 3 0.188 -1.645 -2.188
26 HD2 PRO 3 HD1 PRO 3 0.022 1.128 -1.773
27 HD3 PRO 3 HD2 PRO 3 1.431 0.342 -2.619
28 H ILE 4 HN ILE 4 -2.956 -1.000 -4.038
29 HA ILE 4 HA ILE 4 -5.023 0.504 -4.906
30 HB ILE 4 HB ILE 4 -6.456 -0.675 -3.311
31 HG12 ILE 4 HG11 ILE 4 -3.841 -1.890 -2.206
32 HG13 ILE 4 HG12 ILE 4 -4.858 -0.685 -1.349
33 HG21 ILE 4 HG21 ILE 4 -4.340 -2.460 -4.692
34 HG22 ILE 4 HG22 ILE 4 -6.046 -2.882 -4.311
35 HG23 ILE 4 HG23 ILE 4 -5.694 -1.610 -5.527
36 HD11 ILE 4 HD1 ILE 4 -5.748 -3.528 -2.172
37 HD12 ILE 4 HD2 ILE 4 -5.398 -2.934 -0.511
38 HD13 ILE 4 HD3 ILE 4 -6.811 -2.287 -1.416
39 H LEU 5 HN LEU 5 -3.171 1.354 -2.054
40 HA LEU 5 HA LEU 5 -5.119 2.701 -0.626
41 HB2 LEU 5 HB1 LEU 5 -2.146 3.407 -0.862
42 HB3 LEU 5 HB2 LEU 5 -3.237 3.828 0.499
43 HG LEU 5 HG LEU 5 -2.378 0.980 -0.322
44 HD11 LEU 5 HD11 LEU 5 -1.587 2.708 2.097
45 HD12 LEU 5 HD12 LEU 5 -0.535 2.329 0.683
46 HD13 LEU 5 HD13 LEU 5 -1.077 1.012 1.788
47 HD21 LEU 5 HD21 LEU 5 -4.092 1.936 2.059
48 HD22 LEU 5 HD22 LEU 5 -3.429 0.278 1.852
49 HD23 LEU 5 HD23 LEU 5 -4.651 0.900 0.691
50 H ALA 6 HN ALA 6 -3.182 3.996 -3.358
51 HA ALA 6 HA ALA 6 -4.181 6.652 -3.168
52 HB1 ALA 6 HB1 ALA 6 -3.088 4.988 -5.535
53 HB2 ALA 6 HB2 ALA 6 -3.313 6.783 -5.550
54 HB3 ALA 6 HB3 ALA 6 -2.115 6.031 -4.440
55 H SER 7 HN SER 7 -5.273 3.747 -4.987
56 HA SER 7 HA SER 7 -7.489 4.920 -6.233
57 HB2 SER 7 HB1 SER 7 -7.197 1.978 -5.401
58 HB3 SER 7 HB2 SER 7 -8.221 2.625 -6.726
59 HG SER 7 HG1 SER 7 -6.374 3.029 -7.890
60 H LEU 8 HN LEU 8 -7.217 3.276 -3.055
61 HA LEU 8 HA LEU 8 -9.974 3.340 -2.474
62 HB2 LEU 8 HB1 LEU 8 -7.519 3.267 -0.653
63 HB3 LEU 8 HB2 LEU 8 -9.195 3.151 -0.034
64 HG LEU 8 HG LEU 8 -7.963 1.174 -2.034
65 HD11 LEU 8 HD11 LEU 8 -7.827 -0.390 -0.097
66 HD12 LEU 8 HD12 LEU 8 -8.421 0.906 1.004
67 HD13 LEU 8 HD13 LEU 8 -6.824 1.084 0.189
68 HD21 LEU 8 HD21 LEU 8 -10.450 1.243 -2.213
69 HD22 LEU 8 HD22 LEU 8 -10.590 1.081 -0.417
70 HD23 LEU 8 HD23 LEU 8 -9.919 -0.271 -1.396
71 H ALA 9 HN ALA 9 -7.390 5.729 -1.771
72 HA ALA 9 HA ALA 9 -9.048 7.627 -0.561
73 HB1 ALA 9 HB1 ALA 9 -6.545 7.723 -0.567
74 HB2 ALA 9 HB2 ALA 9 -6.557 8.009 -2.340
75 HB3 ALA 9 HB3 ALA 9 -7.248 9.249 -1.223
76 H ALA 10 HN ALA 10 -8.302 7.069 -4.027
77 HA ALA 10 HA ALA 10 -9.869 9.100 -5.052
78 HB1 ALA 10 HB1 ALA 10 -9.365 6.277 -6.251
79 HB2 ALA 10 HB2 ALA 10 -9.720 7.772 -7.168
80 HB3 ALA 10 HB3 ALA 10 -8.166 7.612 -6.265
81 H LYS 11 HN LYS 11 -10.889 5.688 -4.499
82 HA LYS 11 HA LYS 11 -13.483 6.252 -5.623
83 HB2 LYS 11 HB1 LYS 11 -12.223 4.127 -5.927
84 HB3 LYS 11 HB2 LYS 11 -12.372 3.764 -4.193
85 HG2 LYS 11 HG1 LYS 11 -14.767 4.029 -6.149
86 HG3 LYS 11 HG2 LYS 11 -13.904 2.503 -5.784
87 HD2 LYS 11 HD1 LYS 11 -14.436 2.937 -3.293
88 HD3 LYS 11 HD2 LYS 11 -15.600 4.181 -3.863
89 HE2 LYS 11 HE1 LYS 11 -16.868 2.427 -5.145
90 HE3 LYS 11 HE2 LYS 11 -15.730 1.166 -4.504
91 HZ1 LYS 11 HZ1 LYS 11 -17.685 1.334 -3.114
92 HZ2 LYS 11 HZ2 LYS 11 -17.444 3.000 -2.897
93 HZ3 LYS 11 HZ3 LYS 11 -16.333 1.906 -2.260
94 H PHE 12 HN PHE 12 -12.325 5.515 -2.254
95 HA PHE 12 HA PHE 12 -15.098 5.702 -1.343
96 HB2 PHE 12 HB1 PHE 12 -12.459 4.936 0.030
97 HB3 PHE 12 HB2 PHE 12 -13.953 5.271 0.971
98 HD1 PHE 12 HD1 PHE 12 -15.958 3.924 0.726
99 HD2 PHE 12 HD2 PHE 12 -12.305 2.864 -1.247
100 HE1 PHE 12 HE1 PHE 12 -16.786 1.606 0.464
101 HE2 PHE 12 HE2 PHE 12 -13.135 0.544 -1.544
102 HZ PHE 12 HZ PHE 12 -15.370 -0.093 -0.675
103 H GLY 13 HN GLY 13 -12.346 7.736 -1.681
104 HA2 GLY 13 HA1 GLY 13 -13.914 9.883 -0.387
105 HA3 GLY 13 HA2 GLY 13 -12.193 9.904 -0.892
106 HA PRO 14 HA PRO 14 -14.553 10.686 -4.899
107 HB2 PRO 14 HB1 PRO 14 -17.220 11.524 -4.746
108 HB3 PRO 14 HB2 PRO 14 -16.745 9.797 -4.960
109 HG2 PRO 14 HG1 PRO 14 -17.436 11.203 -2.320
110 HG3 PRO 14 HG2 PRO 14 -18.086 9.634 -2.957
111 HD2 PRO 14 HD1 PRO 14 -15.987 9.687 -1.164
112 HD3 PRO 14 HD2 PRO 14 -16.004 8.496 -2.534
113 H LYS 15 HN LYS 15 -15.289 12.212 -1.825
114 HA LYS 15 HA LYS 15 -14.789 14.906 -2.668
115 HB2 LYS 15 HB1 LYS 15 -14.438 13.504 0.057
116 HB3 LYS 15 HB2 LYS 15 -14.024 15.214 -0.230
117 HG2 LYS 15 HG1 LYS 15 -16.052 15.352 0.787
118 HG3 LYS 15 HG2 LYS 15 -16.394 15.692 -0.938
119 HD2 LYS 15 HD1 LYS 15 -17.346 13.430 -1.239
120 HD3 LYS 15 HD2 LYS 15 -16.875 12.941 0.417
121 HE2 LYS 15 HE1 LYS 15 -18.894 15.196 -0.278
122 HE3 LYS 15 HE2 LYS 15 -19.349 13.507 0.179
123 HZ1 LYS 15 HZ1 LYS 15 -19.448 14.998 2.066
124 HZ2 LYS 15 HZ2 LYS 15 -17.827 15.435 1.874
125 HZ3 LYS 15 HZ3 LYS 15 -18.228 13.851 2.303
126 H LEU 16 HN LEU 16 -12.592 12.239 -1.515
127 HA LEU 16 HA LEU 16 -10.333 13.945 -1.510
128 HB2 LEU 16 HB1 LEU 16 -10.564 10.923 -1.331
129 HB3 LEU 16 HB2 LEU 16 -9.000 11.764 -1.399
130 HG LEU 16 HG LEU 16 -9.541 11.147 0.863
131 HD11 LEU 16 HD11 LEU 16 -9.546 14.210 0.518
132 HD12 LEU 16 HD12 LEU 16 -8.106 13.119 0.464
133 HD13 LEU 16 HD13 LEU 16 -9.049 13.291 1.983
134 HD21 LEU 16 HD21 LEU 16 -11.906 13.116 0.847
135 HD22 LEU 16 HD22 LEU 16 -11.259 12.189 2.244
136 HD23 LEU 16 HD23 LEU 16 -12.035 11.302 0.887
137 H PHE 17 HN PHE 17 -11.477 11.589 -4.057
138 HA PHE 17 HA PHE 17 -9.257 12.254 -5.666
139 HB2 PHE 17 HB1 PHE 17 -11.283 10.386 -5.922
140 HB3 PHE 17 HB2 PHE 17 -11.816 11.557 -7.156
141 HD1 PHE 17 HD1 PHE 17 -11.367 10.311 -9.127
142 HD2 PHE 17 HD2 PHE 17 -8.267 10.531 -6.158
143 HE1 PHE 17 HE1 PHE 17 -9.803 9.131 -10.644
144 HE2 PHE 17 HE2 PHE 17 -6.716 9.399 -7.687
145 HZ PHE 17 HZ PHE 17 -7.463 8.714 -9.940
146 H ABA 18 HN AGL 18 -12.393 13.907 -5.383
147 HA ABA 18 HA AGL 18 -11.830 15.789 -7.435
148 HB3 ABA 18 HB2 AGL 18 -13.536 17.238 -6.100
149 HB2 ABA 18 HB1 AGL 18 -13.689 15.839 -5.006
150 HG3 ABA 18 HG AGL 18 -14.736 14.467 -6.748
151 H LEU 19 HN LEU 19 -11.015 15.839 -3.910
152 HA LEU 19 HA LEU 19 -9.814 18.449 -4.255
153 HB2 LEU 19 HB1 LEU 19 -9.922 16.521 -1.885
154 HB3 LEU 19 HB2 LEU 19 -9.162 18.145 -1.818
155 HG LEU 19 HG LEU 19 -12.122 17.611 -2.439
156 HD11 LEU 19 HD11 LEU 19 -10.736 18.664 0.109
157 HD12 LEU 19 HD12 LEU 19 -11.495 17.041 -0.087
158 HD13 LEU 19 HD13 LEU 19 -12.515 18.533 -0.146
159 HD21 LEU 19 HD21 LEU 19 -12.375 20.095 -2.057
160 HD22 LEU 19 HD22 LEU 19 -11.382 19.724 -3.510
161 HD23 LEU 19 HD23 LEU 19 -10.580 20.247 -1.981
162 H VAL 20 HN VAL 20 -8.375 15.213 -3.421
163 HA VAL 20 HA VAL 20 -5.743 16.307 -3.296
164 HB VAL 20 HB VAL 20 -6.704 13.406 -3.433
165 HG11 VAL 20 HG11 VAL 20 -4.311 13.522 -4.105
166 HG12 VAL 20 HG12 VAL 20 -3.943 14.623 -2.726
167 HG13 VAL 20 HG13 VAL 20 -4.423 12.908 -2.426
168 HG21 VAL 20 HG21 VAL 20 -6.282 13.483 -0.945
169 HG22 VAL 20 HG22 VAL 20 -5.925 15.247 -1.069
170 HG23 VAL 20 HG23 VAL 20 -7.581 14.630 -1.431
171 H THR 21 HN THR 21 -7.489 14.276 -5.669
172 HA THR 21 HA THR 21 -5.109 14.444 -7.402
173 HB THR 21 HB THR 21 -7.529 12.702 -7.904
174 HG1 THR 21 HG1 THR 21 -6.194 11.138 -6.879
175 HG21 THR 21 HG21 THR 21 -5.852 12.875 -9.802
176 HG22 THR 21 HG22 THR 21 -5.696 11.276 -9.011
177 HG23 THR 21 HG23 THR 21 -4.511 12.584 -8.634
178 H LYS 22 HN LYS 22 -7.838 16.210 -6.978
179 HA LYS 22 HA LYS 22 -9.049 17.624 -8.160
180 HB2 LYS 22 HB1 LYS 22 -6.673 18.474 -8.274
181 HB3 LYS 22 HB2 LYS 22 -6.618 17.899 -9.961
182 HG2 LYS 22 HG1 LYS 22 -9.042 19.559 -9.384
183 HG3 LYS 22 HG2 LYS 22 -7.558 20.424 -8.913
184 HD2 LYS 22 HD1 LYS 22 -8.120 19.225 -11.698
185 HD3 LYS 22 HD2 LYS 22 -8.361 20.937 -11.234
186 HE2 LYS 22 HE1 LYS 22 -5.894 21.179 -10.767
187 HE3 LYS 22 HE2 LYS 22 -5.633 19.454 -11.244
188 HZ1 LYS 22 HZ1 LYS 22 -6.510 19.981 -13.426
189 HZ2 LYS 22 HZ2 LYS 22 -5.172 20.956 -13.060
190 HZ3 LYS 22 HZ3 LYS 22 -6.740 21.600 -12.991
191 H LYS 23 HN LYS 23 -10.044 15.253 -8.848
192 HA LYS 23 HA LYS 23 -10.366 15.357 -11.791
193 HB2 LYS 23 HB1 LYS 23 -10.943 13.118 -9.807
194 HB3 LYS 23 HB2 LYS 23 -11.291 13.047 -11.557
195 HG2 LYS 23 HG1 LYS 23 -8.516 13.880 -11.309
196 HG3 LYS 23 HG2 LYS 23 -8.774 12.608 -10.104
197 HD2 LYS 23 HD1 LYS 23 -8.020 11.513 -12.125
198 HD3 LYS 23 HD2 LYS 23 -9.732 11.090 -11.851
199 HE2 LYS 23 HE1 LYS 23 -9.302 11.473 -14.261
200 HE3 LYS 23 HE2 LYS 23 -10.472 12.692 -13.626
201 HZ1 LYS 23 HZ1 LYS 23 -8.636 14.242 -13.402
202 HZ2 LYS 23 HZ2 LYS 23 -8.796 13.704 -15.009
203 HZ3 LYS 23 HZ3 LYS 23 -7.547 13.103 -14.027
204 H ABA 24 HN AGL 24 -11.842 16.990 -9.527
205 HA ABA 24 HA AGL 24 -14.487 16.630 -10.812
206 HB3 ABA 24 HB2 AGL 24 -15.433 17.947 -8.878
207 HB2 ABA 24 HB1 AGL 24 -13.818 17.934 -8.110
208 HG3 ABA 24 HG AGL 24 -15.533 15.394 -8.789
Start of MODEL 13
1 H1 PHE 1 HN PHE 1 0.509 4.112 -8.413
2 HA PHE 1 HA PHE 1 2.831 2.888 -7.729
3 HB2 PHE 1 HB1 PHE 1 3.908 5.066 -8.534
4 HB3 PHE 1 HB2 PHE 1 2.949 5.958 -7.302
5 HD1 PHE 1 HD1 PHE 1 3.940 6.292 -5.199
6 HD2 PHE 1 HD2 PHE 1 5.325 3.032 -7.621
7 HE1 PHE 1 HE1 PHE 1 5.623 5.731 -3.471
8 HE2 PHE 1 HE2 PHE 1 7.010 2.460 -5.897
9 HZ PHE 1 HZ PHE 1 7.154 3.805 -3.810
10 H LEU 2 HN LEU 2 3.169 3.212 -5.265
11 HA LEU 2 HA LEU 2 2.376 2.641 -3.301
12 HB2 LEU 2 HB1 LEU 2 1.109 4.925 -3.602
13 HB3 LEU 2 HB2 LEU 2 -0.331 3.930 -3.919
14 HG LEU 2 HG LEU 2 -0.159 2.977 -1.603
15 HD11 LEU 2 HD11 LEU 2 2.129 5.037 -1.242
16 HD12 LEU 2 HD12 LEU 2 2.345 3.248 -1.208
17 HD13 LEU 2 HD13 LEU 2 1.372 4.063 0.069
18 HD21 LEU 2 HD21 LEU 2 -1.557 4.976 -2.073
19 HD22 LEU 2 HD22 LEU 2 -0.155 6.054 -1.730
20 HD23 LEU 2 HD23 LEU 2 -0.858 5.046 -0.411
21 HA PRO 3 HA PRO 3 -0.540 -0.703 -4.521
22 HB2 PRO 3 HB1 PRO 3 -1.617 -1.633 -2.102
23 HB3 PRO 3 HB2 PRO 3 0.047 -2.013 -2.669
24 HG2 PRO 3 HG1 PRO 3 -0.764 0.274 -0.784
25 HG3 PRO 3 HG2 PRO 3 0.465 -1.029 -0.485
26 HD2 PRO 3 HD1 PRO 3 1.262 1.395 -1.448
27 HD3 PRO 3 HD2 PRO 3 1.934 -0.114 -2.210
28 H ILE 4 HN ILE 4 -3.052 -1.224 -3.529
29 HA ILE 4 HA ILE 4 -4.573 0.478 -4.879
30 HB ILE 4 HB ILE 4 -6.519 -0.563 -4.027
31 HG12 ILE 4 HG11 ILE 4 -6.139 -0.575 -1.595
32 HG13 ILE 4 HG12 ILE 4 -6.635 -2.155 -2.242
33 HG21 ILE 4 HG21 ILE 4 -4.219 -2.603 -4.324
34 HG22 ILE 4 HG22 ILE 4 -5.973 -2.891 -4.586
35 HG23 ILE 4 HG23 ILE 4 -5.086 -1.756 -5.660
36 HD11 ILE 4 HD1 ILE 4 -3.786 -1.400 -1.313
37 HD12 ILE 4 HD2 ILE 4 -4.952 -2.491 -0.500
38 HD13 ILE 4 HD3 ILE 4 -4.241 -2.981 -2.073
39 H LEU 5 HN LEU 5 -3.670 1.107 -1.601
40 HA LEU 5 HA LEU 5 -5.591 2.627 -0.522
41 HB2 LEU 5 HB1 LEU 5 -2.610 3.299 -0.520
42 HB3 LEU 5 HB2 LEU 5 -3.806 3.719 0.750
43 HG LEU 5 HG LEU 5 -2.838 0.888 -0.008
44 HD11 LEU 5 HD11 LEU 5 -1.752 0.920 2.217
45 HD12 LEU 5 HD12 LEU 5 -2.330 2.601 2.495
46 HD13 LEU 5 HD13 LEU 5 -1.141 2.265 1.182
47 HD21 LEU 5 HD21 LEU 5 -4.076 0.136 2.053
48 HD22 LEU 5 HD22 LEU 5 -5.186 0.719 0.766
49 HD23 LEU 5 HD23 LEU 5 -4.817 1.769 2.190
50 H ALA 6 HN ALA 6 -3.365 3.922 -3.060
51 HA ALA 6 HA ALA 6 -4.311 6.585 -2.940
52 HB1 ALA 6 HB1 ALA 6 -3.277 6.725 -5.249
53 HB2 ALA 6 HB2 ALA 6 -2.187 5.887 -4.090
54 HB3 ALA 6 HB3 ALA 6 -3.137 4.926 -5.272
55 H SER 7 HN SER 7 -5.397 3.775 -4.917
56 HA SER 7 HA SER 7 -7.546 5.141 -6.177
57 HB2 SER 7 HB1 SER 7 -7.237 2.121 -5.686
58 HB3 SER 7 HB2 SER 7 -8.274 2.901 -6.929
59 HG SER 7 HG1 SER 7 -6.443 3.439 -8.053
60 H LEU 8 HN LEU 8 -7.265 3.302 -3.117
61 HA LEU 8 HA LEU 8 -10.066 3.292 -2.619
62 HB2 LEU 8 HB1 LEU 8 -7.743 3.152 -0.642
63 HB3 LEU 8 HB2 LEU 8 -9.463 2.978 -0.186
64 HG LEU 8 HG LEU 8 -7.936 1.105 -2.074
65 HD11 LEU 8 HD11 LEU 8 -9.007 0.722 0.801
66 HD12 LEU 8 HD12 LEU 8 -7.279 0.943 0.346
67 HD13 LEU 8 HD13 LEU 8 -8.176 -0.529 -0.194
68 HD21 LEU 8 HD21 LEU 8 -9.978 -0.366 -1.869
69 HD22 LEU 8 HD22 LEU 8 -10.334 1.163 -2.743
70 HD23 LEU 8 HD23 LEU 8 -10.834 0.967 -1.014
71 H ALA 9 HN ALA 9 -7.543 5.687 -1.793
72 HA ALA 9 HA ALA 9 -9.234 7.514 -0.542
73 HB1 ALA 9 HB1 ALA 9 -6.797 8.047 -2.354
74 HB2 ALA 9 HB2 ALA 9 -7.514 9.212 -1.179
75 HB3 ALA 9 HB3 ALA 9 -6.734 7.699 -0.592
76 H ALA 10 HN ALA 10 -8.565 7.022 -4.041
77 HA ALA 10 HA ALA 10 -10.256 9.001 -4.992
78 HB1 ALA 10 HB1 ALA 10 -8.570 7.400 -6.256
79 HB2 ALA 10 HB2 ALA 10 -9.897 6.203 -6.306
80 HB3 ALA 10 HB3 ALA 10 -10.111 7.779 -7.123
81 H LYS 11 HN LYS 11 -11.061 5.585 -4.360
82 HA LYS 11 HA LYS 11 -13.708 5.890 -5.370
83 HB2 LYS 11 HB1 LYS 11 -12.390 3.845 -5.625
84 HB3 LYS 11 HB2 LYS 11 -12.308 3.603 -3.861
85 HG2 LYS 11 HG1 LYS 11 -15.029 3.775 -5.251
86 HG3 LYS 11 HG2 LYS 11 -14.068 2.276 -5.434
87 HD2 LYS 11 HD1 LYS 11 -14.119 1.758 -3.101
88 HD3 LYS 11 HD2 LYS 11 -14.555 3.426 -2.650
89 HE2 LYS 11 HE1 LYS 11 -16.821 3.061 -3.887
90 HE3 LYS 11 HE2 LYS 11 -16.411 1.296 -3.864
91 HZ1 LYS 11 HZ1 LYS 11 -16.047 1.606 -1.411
92 HZ2 LYS 11 HZ2 LYS 11 -17.657 1.838 -1.913
93 HZ3 LYS 11 HZ3 LYS 11 -16.657 3.163 -1.558
94 H PHE 12 HN PHE 12 -12.428 5.629 -2.000
95 HA PHE 12 HA PHE 12 -15.180 5.802 -0.998
96 HB2 PHE 12 HB1 PHE 12 -12.446 5.349 0.321
97 HB3 PHE 12 HB2 PHE 12 -13.880 5.820 1.297
98 HD1 PHE 12 HD1 PHE 12 -15.831 4.416 1.483
99 HD2 PHE 12 HD2 PHE 12 -12.346 3.087 -0.632
100 HE1 PHE 12 HE1 PHE 12 -16.596 2.073 1.714
101 HE2 PHE 12 HE2 PHE 12 -13.116 0.735 -0.423
102 HZ PHE 12 HZ PHE 12 -15.232 0.226 0.769
103 H GLY 13 HN GLY 13 -12.512 7.890 -1.729
104 HA2 GLY 13 HA1 GLY 13 -14.159 10.128 -0.714
105 HA3 GLY 13 HA2 GLY 13 -12.397 10.119 -1.055
106 HA PRO 14 HA PRO 14 -14.451 10.791 -5.247
107 HB2 PRO 14 HB1 PRO 14 -17.143 11.587 -5.211
108 HB3 PRO 14 HB2 PRO 14 -16.622 9.883 -5.491
109 HG2 PRO 14 HG1 PRO 14 -17.504 11.135 -2.834
110 HG3 PRO 14 HG2 PRO 14 -18.067 9.582 -3.581
111 HD2 PRO 14 HD1 PRO 14 -16.097 9.615 -1.652
112 HD3 PRO 14 HD2 PRO 14 -15.980 8.477 -3.066
113 H LYS 15 HN LYS 15 -15.477 12.188 -2.194
114 HA LYS 15 HA LYS 15 -14.980 14.915 -2.765
115 HB2 LYS 15 HB1 LYS 15 -14.399 13.319 -0.184
116 HB3 LYS 15 HB2 LYS 15 -14.482 15.102 -0.307
117 HG2 LYS 15 HG1 LYS 15 -16.910 14.965 -0.858
118 HG3 LYS 15 HG2 LYS 15 -16.848 13.175 -0.746
119 HD2 LYS 15 HD1 LYS 15 -16.055 13.356 1.635
120 HD3 LYS 15 HD2 LYS 15 -16.146 15.143 1.524
121 HE2 LYS 15 HE1 LYS 15 -18.640 15.006 1.170
122 HE3 LYS 15 HE2 LYS 15 -18.552 13.202 1.262
123 HZ1 LYS 15 HZ1 LYS 15 -19.203 14.184 3.364
124 HZ2 LYS 15 HZ2 LYS 15 -17.787 15.104 3.436
125 HZ3 LYS 15 HZ3 LYS 15 -17.705 13.417 3.523
126 H LEU 16 HN LEU 16 -12.731 12.270 -1.675
127 HA LEU 16 HA LEU 16 -10.485 13.992 -1.563
128 HB2 LEU 16 HB1 LEU 16 -10.598 10.954 -1.683
129 HB3 LEU 16 HB2 LEU 16 -9.123 11.906 -1.369
130 HG LEU 16 HG LEU 16 -11.607 11.905 0.443
131 HD11 LEU 16 HD11 LEU 16 -10.402 9.700 0.401
132 HD12 LEU 16 HD12 LEU 16 -10.198 10.545 1.984
133 HD13 LEU 16 HD13 LEU 16 -8.858 10.548 0.783
134 HD21 LEU 16 HD21 LEU 16 -8.794 13.122 0.837
135 HD22 LEU 16 HD22 LEU 16 -10.079 13.034 2.090
136 HD23 LEU 16 HD23 LEU 16 -10.325 14.054 0.628
137 H PHE 17 HN PHE 17 -11.530 11.671 -4.185
138 HA PHE 17 HA PHE 17 -9.244 12.417 -5.693
139 HB2 PHE 17 HB1 PHE 17 -11.286 10.459 -6.010
140 HB3 PHE 17 HB2 PHE 17 -11.509 11.528 -7.423
141 HD1 PHE 17 HD1 PHE 17 -10.571 10.382 -9.236
142 HD2 PHE 17 HD2 PHE 17 -8.370 10.408 -5.544
143 HE1 PHE 17 HE1 PHE 17 -8.706 9.146 -10.319
144 HE2 PHE 17 HE2 PHE 17 -6.539 9.168 -6.622
145 HZ PHE 17 HZ PHE 17 -6.684 8.562 -9.018
146 H ABA 18 HN AGL 18 -12.404 14.003 -5.452
147 HA ABA 18 HA AGL 18 -11.820 15.862 -7.533
148 HB3 ABA 18 HB2 AGL 18 -13.492 17.352 -6.162
149 HB2 ABA 18 HB1 AGL 18 -13.701 15.919 -5.124
150 HG3 ABA 18 HG AGL 18 -14.804 14.668 -6.912
151 H LEU 19 HN LEU 19 -11.018 15.903 -4.005
152 HA LEU 19 HA LEU 19 -9.806 18.516 -4.354
153 HB2 LEU 19 HB1 LEU 19 -9.986 16.631 -1.949
154 HB3 LEU 19 HB2 LEU 19 -9.227 18.255 -1.895
155 HG LEU 19 HG LEU 19 -12.168 17.707 -2.581
156 HD11 LEU 19 HD11 LEU 19 -10.842 18.836 -0.034
157 HD12 LEU 19 HD12 LEU 19 -11.604 17.211 -0.200
158 HD13 LEU 19 HD13 LEU 19 -12.615 18.704 -0.330
159 HD21 LEU 19 HD21 LEU 19 -12.421 20.206 -2.293
160 HD22 LEU 19 HD22 LEU 19 -11.390 19.781 -3.703
161 HD23 LEU 19 HD23 LEU 19 -10.627 20.352 -2.172
162 H VAL 20 HN VAL 20 -8.447 15.296 -3.424
163 HA VAL 20 HA VAL 20 -5.790 16.320 -3.255
164 HB VAL 20 HB VAL 20 -6.821 13.441 -3.427
165 HG11 VAL 20 HG11 VAL 20 -4.580 12.906 -2.345
166 HG12 VAL 20 HG12 VAL 20 -4.405 13.533 -4.017
167 HG13 VAL 20 HG13 VAL 20 -4.074 14.615 -2.614
168 HG21 VAL 20 HG21 VAL 20 -7.758 14.666 -1.448
169 HG22 VAL 20 HG22 VAL 20 -6.496 13.495 -0.923
170 HG23 VAL 20 HG23 VAL 20 -6.102 15.249 -1.023
171 H THR 21 HN THR 21 -7.550 14.304 -5.646
172 HA THR 21 HA THR 21 -5.137 14.440 -7.334
173 HB THR 21 HB THR 21 -7.517 12.629 -7.764
174 HG1 THR 21 HG1 THR 21 -6.187 11.154 -6.696
175 HG21 THR 21 HG21 THR 21 -4.508 12.525 -8.539
176 HG22 THR 21 HG22 THR 21 -5.861 12.808 -9.697
177 HG23 THR 21 HG23 THR 21 -5.700 11.222 -8.883
178 H LYS 22 HN LYS 22 -7.862 16.230 -7.033
179 HA LYS 22 HA LYS 22 -8.963 17.658 -8.302
180 HB2 LYS 22 HB1 LYS 22 -6.377 18.165 -8.519
181 HB3 LYS 22 HB2 LYS 22 -6.645 17.869 -10.246
182 HG2 LYS 22 HG1 LYS 22 -8.184 19.867 -8.442
183 HG3 LYS 22 HG2 LYS 22 -6.756 20.323 -9.396
184 HD2 LYS 22 HD1 LYS 22 -9.485 19.378 -10.496
185 HD3 LYS 22 HD2 LYS 22 -8.930 21.063 -10.434
186 HE2 LYS 22 HE1 LYS 22 -7.666 18.804 -12.159
187 HE3 LYS 22 HE2 LYS 22 -8.764 20.112 -12.740
188 HZ1 LYS 22 HZ1 LYS 22 -6.090 20.453 -11.493
189 HZ2 LYS 22 HZ2 LYS 22 -7.099 21.717 -12.021
190 HZ3 LYS 22 HZ3 LYS 22 -6.458 20.612 -13.144
191 H LYS 23 HN LYS 23 -9.992 15.212 -8.965
192 HA LYS 23 HA LYS 23 -10.331 15.402 -11.909
193 HB2 LYS 23 HB1 LYS 23 -10.952 13.070 -10.057
194 HB3 LYS 23 HB2 LYS 23 -11.310 13.153 -11.809
195 HG2 LYS 23 HG1 LYS 23 -8.651 13.796 -11.932
196 HG3 LYS 23 HG2 LYS 23 -8.634 12.940 -10.381
197 HD2 LYS 23 HD1 LYS 23 -8.076 11.305 -12.069
198 HD3 LYS 23 HD2 LYS 23 -9.718 10.932 -11.478
199 HE2 LYS 23 HE1 LYS 23 -9.561 10.615 -13.939
200 HE3 LYS 23 HE2 LYS 23 -10.740 11.921 -13.540
201 HZ1 LYS 23 HZ1 LYS 23 -9.292 12.546 -15.349
202 HZ2 LYS 23 HZ2 LYS 23 -7.909 12.314 -14.395
203 HZ3 LYS 23 HZ3 LYS 23 -9.012 13.538 -14.001
204 H ABA 24 HN AGL 24 -11.678 17.034 -9.614
205 HA ABA 24 HA AGL 24 -14.324 16.890 -10.934
206 HB3 ABA 24 HB2 AGL 24 -15.220 18.223 -8.994
207 HB2 ABA 24 HB1 AGL 24 -13.630 18.091 -8.189
208 HG3 ABA 24 HG AGL 24 -15.485 15.679 -8.958
Start of MODEL 14
1 H1 PHE 1 HN PHE 1 1.678 3.254 -8.033
2 HA PHE 1 HA PHE 1 3.995 3.890 -6.528
3 HB2 PHE 1 HB1 PHE 1 3.673 6.004 -7.913
4 HB3 PHE 1 HB2 PHE 1 1.980 6.105 -7.336
5 HD1 PHE 1 HD1 PHE 1 1.544 7.396 -5.428
6 HD2 PHE 1 HD2 PHE 1 5.514 5.862 -6.010
7 HE1 PHE 1 HE1 PHE 1 2.307 8.612 -3.410
8 HE2 PHE 1 HE2 PHE 1 6.273 7.065 -3.975
9 HZ PHE 1 HZ PHE 1 4.666 8.434 -2.675
10 H LEU 2 HN LEU 2 3.586 3.723 -4.372
11 HA LEU 2 HA LEU 2 2.616 2.927 -2.580
12 HB2 LEU 2 HB1 LEU 2 0.146 4.326 -3.690
13 HB3 LEU 2 HB2 LEU 2 0.086 3.458 -2.143
14 HG LEU 2 HG LEU 2 2.055 5.738 -2.744
15 HD11 LEU 2 HD11 LEU 2 -0.241 6.618 -2.843
16 HD12 LEU 2 HD12 LEU 2 0.535 7.146 -1.314
17 HD13 LEU 2 HD13 LEU 2 -0.658 5.794 -1.291
18 HD21 LEU 2 HD21 LEU 2 2.291 5.835 -0.248
19 HD22 LEU 2 HD22 LEU 2 2.831 4.244 -0.886
20 HD23 LEU 2 HD23 LEU 2 1.220 4.394 -0.092
21 HA PRO 3 HA PRO 3 0.200 -0.756 -3.716
22 HB2 PRO 3 HB1 PRO 3 -1.329 -1.296 -1.437
23 HB3 PRO 3 HB2 PRO 3 0.441 -1.634 -1.512
24 HG2 PRO 3 HG1 PRO 3 -0.889 0.909 -0.409
25 HG3 PRO 3 HG2 PRO 3 0.284 -0.185 0.444
26 HD2 PRO 3 HD1 PRO 3 1.132 2.083 -0.854
27 HD3 PRO 3 HD2 PRO 3 2.097 0.550 -0.995
28 H ILE 4 HN ILE 4 -2.356 -1.263 -3.618
29 HA ILE 4 HA ILE 4 -3.499 0.452 -5.294
30 HB ILE 4 HB ILE 4 -5.635 -0.706 -4.942
31 HG12 ILE 4 HG11 ILE 4 -4.147 -2.182 -2.677
32 HG13 ILE 4 HG12 ILE 4 -5.467 -0.993 -2.439
33 HG21 ILE 4 HG21 ILE 4 -4.781 -2.865 -5.747
34 HG22 ILE 4 HG22 ILE 4 -3.775 -1.549 -6.420
35 HG23 ILE 4 HG23 ILE 4 -3.156 -2.549 -5.057
36 HD11 ILE 4 HD1 ILE 4 -6.392 -3.269 -2.284
37 HD12 ILE 4 HD2 ILE 4 -7.028 -2.470 -3.764
38 HD13 ILE 4 HD3 ILE 4 -5.727 -3.704 -3.892
39 H LEU 5 HN LEU 5 -3.705 0.815 -1.879
40 HA LEU 5 HA LEU 5 -5.867 2.200 -1.267
41 HB2 LEU 5 HB1 LEU 5 -3.058 2.935 -0.304
42 HB3 LEU 5 HB2 LEU 5 -4.595 3.103 0.602
43 HG LEU 5 HG LEU 5 -3.192 0.473 -0.205
44 HD11 LEU 5 HD11 LEU 5 -2.829 0.203 2.227
45 HD12 LEU 5 HD12 LEU 5 -3.638 1.781 2.541
46 HD13 LEU 5 HD13 LEU 5 -2.081 1.735 1.637
47 HD21 LEU 5 HD21 LEU 5 -5.792 0.862 1.413
48 HD22 LEU 5 HD22 LEU 5 -4.892 -0.684 1.223
49 HD23 LEU 5 HD23 LEU 5 -5.663 0.080 -0.211
50 H ALA 6 HN ALA 6 -3.167 3.752 -3.064
51 HA ALA 6 HA ALA 6 -4.025 6.412 -2.863
52 HB1 ALA 6 HB1 ALA 6 -1.831 5.615 -3.846
53 HB2 ALA 6 HB2 ALA 6 -2.712 4.883 -5.221
54 HB3 ALA 6 HB3 ALA 6 -2.702 6.679 -5.002
55 H SER 7 HN SER 7 -5.072 3.784 -5.041
56 HA SER 7 HA SER 7 -6.907 5.481 -6.499
57 HB2 SER 7 HB1 SER 7 -7.554 3.543 -7.767
58 HB3 SER 7 HB2 SER 7 -5.768 3.513 -7.612
59 HG SER 7 HG1 SER 7 -6.119 1.999 -5.838
60 H LEU 8 HN LEU 8 -7.067 3.590 -3.530
61 HA LEU 8 HA LEU 8 -9.919 3.420 -3.500
62 HB2 LEU 8 HB1 LEU 8 -7.968 3.422 -1.145
63 HB3 LEU 8 HB2 LEU 8 -9.729 3.173 -1.008
64 HG LEU 8 HG LEU 8 -7.797 1.338 -2.518
65 HD11 LEU 8 HD11 LEU 8 -9.400 0.926 0.094
66 HD12 LEU 8 HD12 LEU 8 -7.645 1.288 0.014
67 HD13 LEU 8 HD13 LEU 8 -8.281 -0.257 -0.672
68 HD21 LEU 8 HD21 LEU 8 -10.036 1.268 -3.622
69 HD22 LEU 8 HD22 LEU 8 -10.833 1.062 -2.006
70 HD23 LEU 8 HD23 LEU 8 -9.764 -0.231 -2.662
71 H ALA 9 HN ALA 9 -7.629 5.928 -2.376
72 HA ALA 9 HA ALA 9 -9.589 7.724 -1.476
73 HB1 ALA 9 HB1 ALA 9 -7.123 8.013 -1.101
74 HB2 ALA 9 HB2 ALA 9 -6.897 8.306 -2.861
75 HB3 ALA 9 HB3 ALA 9 -7.845 9.472 -1.864
76 H ALA 10 HN ALA 10 -8.253 7.205 -4.762
77 HA ALA 10 HA ALA 10 -9.830 9.091 -6.076
78 HB1 ALA 10 HB1 ALA 10 -7.756 7.946 -6.967
79 HB2 ALA 10 HB2 ALA 10 -8.741 6.467 -7.252
80 HB3 ALA 10 HB3 ALA 10 -9.110 8.003 -8.135
81 H LYS 11 HN LYS 11 -10.716 5.683 -5.462
82 HA LYS 11 HA LYS 11 -13.193 6.101 -6.933
83 HB2 LYS 11 HB1 LYS 11 -11.908 4.016 -7.143
84 HB3 LYS 11 HB2 LYS 11 -12.158 3.645 -5.422
85 HG2 LYS 11 HG1 LYS 11 -14.582 4.130 -7.246
86 HG3 LYS 11 HG2 LYS 11 -13.683 2.584 -7.368
87 HD2 LYS 11 HD1 LYS 11 -14.069 2.047 -5.023
88 HD3 LYS 11 HD2 LYS 11 -14.833 3.638 -4.717
89 HE2 LYS 11 HE1 LYS 11 -16.698 3.026 -6.353
90 HE3 LYS 11 HE2 LYS 11 -15.995 1.356 -6.436
91 HZ1 LYS 11 HZ1 LYS 11 -17.674 1.419 -4.751
92 HZ2 LYS 11 HZ2 LYS 11 -16.994 2.791 -4.022
93 HZ3 LYS 11 HZ3 LYS 11 -16.173 1.330 -3.963
94 H PHE 12 HN PHE 12 -12.362 5.516 -3.432
95 HA PHE 12 HA PHE 12 -15.237 5.589 -2.854
96 HB2 PHE 12 HB1 PHE 12 -12.728 4.738 -1.298
97 HB3 PHE 12 HB2 PHE 12 -14.250 5.097 -0.427
98 HD1 PHE 12 HD1 PHE 12 -16.275 3.823 -0.766
99 HD2 PHE 12 HD2 PHE 12 -12.544 2.650 -2.522
100 HE1 PHE 12 HE1 PHE 12 -17.105 1.500 -0.954
101 HE2 PHE 12 HE2 PHE 12 -13.374 0.319 -2.731
102 HZ PHE 12 HZ PHE 12 -15.650 -0.263 -1.929
103 H GLY 13 HN GLY 13 -12.605 7.754 -2.939
104 HA2 GLY 13 HA1 GLY 13 -14.113 9.608 -1.189
105 HA3 GLY 13 HA2 GLY 13 -12.384 9.684 -1.662
106 HA PRO 14 HA PRO 14 -14.661 11.725 -5.223
107 HB2 PRO 14 HB1 PRO 14 -17.370 12.325 -4.923
108 HB3 PRO 14 HB2 PRO 14 -16.797 10.794 -5.710
109 HG2 PRO 14 HG1 PRO 14 -17.687 11.166 -2.796
110 HG3 PRO 14 HG2 PRO 14 -18.191 9.875 -3.969
111 HD2 PRO 14 HD1 PRO 14 -16.170 9.509 -2.091
112 HD3 PRO 14 HD2 PRO 14 -16.097 8.721 -3.727
113 H LYS 15 HN LYS 15 -15.761 12.026 -1.850
114 HA LYS 15 HA LYS 15 -15.320 14.829 -1.677
115 HB2 LYS 15 HB1 LYS 15 -16.627 13.580 0.040
116 HB3 LYS 15 HB2 LYS 15 -15.188 12.610 0.448
117 HG2 LYS 15 HG1 LYS 15 -15.558 14.264 2.171
118 HG3 LYS 15 HG2 LYS 15 -14.026 14.656 1.315
119 HD2 LYS 15 HD1 LYS 15 -15.273 16.385 -0.053
120 HD3 LYS 15 HD2 LYS 15 -16.747 16.079 0.925
121 HE2 LYS 15 HE1 LYS 15 -14.015 17.150 1.942
122 HE3 LYS 15 HE2 LYS 15 -15.505 18.138 1.670
123 HZ1 LYS 15 HZ1 LYS 15 -16.623 16.801 3.363
124 HZ2 LYS 15 HZ2 LYS 15 -15.249 17.576 3.977
125 HZ3 LYS 15 HZ3 LYS 15 -15.202 15.916 3.634
126 H LEU 16 HN LEU 16 -13.082 12.024 -1.100
127 HA LEU 16 HA LEU 16 -10.958 13.746 -0.319
128 HB2 LEU 16 HB1 LEU 16 -10.774 10.863 -1.329
129 HB3 LEU 16 HB2 LEU 16 -9.468 11.787 -0.545
130 HG LEU 16 HG LEU 16 -12.120 11.092 0.846
131 HD11 LEU 16 HD11 LEU 16 -9.330 9.806 1.078
132 HD12 LEU 16 HD12 LEU 16 -10.781 9.050 0.315
133 HD13 LEU 16 HD13 LEU 16 -10.763 9.401 2.080
134 HD21 LEU 16 HD21 LEU 16 -11.038 13.132 1.823
135 HD22 LEU 16 HD22 LEU 16 -9.471 12.245 1.933
136 HD23 LEU 16 HD23 LEU 16 -10.858 11.726 2.928
137 H PHE 17 HN PHE 17 -11.643 12.181 -3.524
138 HA PHE 17 HA PHE 17 -9.101 13.282 -4.466
139 HB2 PHE 17 HB1 PHE 17 -10.231 10.812 -4.597
140 HB3 PHE 17 HB2 PHE 17 -10.831 11.436 -6.145
141 HD1 PHE 17 HD1 PHE 17 -7.776 10.805 -4.061
142 HD2 PHE 17 HD2 PHE 17 -9.289 11.538 -8.015
143 HE1 PHE 17 HE1 PHE 17 -5.581 10.192 -5.012
144 HE2 PHE 17 HE2 PHE 17 -7.097 10.899 -8.973
145 HZ PHE 17 HZ PHE 17 -5.241 10.214 -7.478
146 H ABA 18 HN AGL 18 -11.822 14.837 -4.267
147 HA ABA 18 HA AGL 18 -11.065 16.215 -6.790
148 HB3 ABA 18 HB2 AGL 18 -13.076 17.672 -6.445
149 HB2 ABA 18 HB1 AGL 18 -13.520 16.692 -5.013
150 HG3 ABA 18 HG AGL 18 -14.028 14.708 -6.395
151 H LEU 19 HN LEU 19 -10.058 15.821 -3.723
152 HA LEU 19 HA LEU 19 -9.222 18.648 -3.506
153 HB2 LEU 19 HB1 LEU 19 -10.898 18.066 -1.728
154 HB3 LEU 19 HB2 LEU 19 -9.857 16.698 -1.214
155 HG LEU 19 HG LEU 19 -8.029 18.328 -0.612
156 HD11 LEU 19 HD11 LEU 19 -10.123 20.489 -1.308
157 HD12 LEU 19 HD12 LEU 19 -8.532 20.219 -2.126
158 HD13 LEU 19 HD13 LEU 19 -8.574 20.770 -0.421
159 HD21 LEU 19 HD21 LEU 19 -9.617 17.540 1.122
160 HD22 LEU 19 HD22 LEU 19 -10.726 18.913 0.739
161 HD23 LEU 19 HD23 LEU 19 -9.095 19.232 1.423
162 H VAL 20 HN VAL 20 -8.336 15.277 -2.552
163 HA VAL 20 HA VAL 20 -5.604 15.828 -2.080
164 HB VAL 20 HB VAL 20 -7.150 13.254 -2.649
165 HG11 VAL 20 HG11 VAL 20 -5.133 12.079 -1.604
166 HG12 VAL 20 HG12 VAL 20 -4.766 12.799 -3.205
167 HG13 VAL 20 HG13 VAL 20 -4.225 13.639 -1.702
168 HG21 VAL 20 HG21 VAL 20 -6.054 14.525 -0.052
169 HG22 VAL 20 HG22 VAL 20 -7.795 14.442 -0.523
170 HG23 VAL 20 HG23 VAL 20 -6.889 12.923 -0.163
171 H THR 21 HN THR 21 -7.424 15.282 -4.958
172 HA THR 21 HA THR 21 -5.309 15.916 -6.684
173 HB THR 21 HB THR 21 -6.300 13.054 -6.685
174 HG1 THR 21 HG1 THR 21 -4.271 13.957 -5.618
175 HG21 THR 21 HG21 THR 21 -4.854 12.751 -8.800
176 HG22 THR 21 HG22 THR 21 -4.747 14.523 -8.915
177 HG23 THR 21 HG23 THR 21 -6.374 13.657 -9.036
178 H LYS 22 HN LYS 22 -6.535 15.894 -9.018
179 HA LYS 22 HA LYS 22 -9.380 16.535 -8.496
180 HB2 LYS 22 HB1 LYS 22 -8.041 18.437 -9.380
181 HB3 LYS 22 HB2 LYS 22 -7.313 17.369 -10.607
182 HG2 LYS 22 HG1 LYS 22 -9.603 17.118 -11.727
183 HG3 LYS 22 HG2 LYS 22 -10.202 18.425 -10.619
184 HD2 LYS 22 HD1 LYS 22 -8.717 20.045 -11.682
185 HD3 LYS 22 HD2 LYS 22 -7.629 18.749 -12.259
186 HE2 LYS 22 HE1 LYS 22 -8.763 19.675 -14.202
187 HE3 LYS 22 HE2 LYS 22 -9.299 17.976 -13.960
188 HZ1 LYS 22 HZ1 LYS 22 -11.149 19.395 -14.448
189 HZ2 LYS 22 HZ2 LYS 22 -10.785 20.429 -13.159
190 HZ3 LYS 22 HZ3 LYS 22 -11.285 18.851 -12.858
191 H LYS 23 HN LYS 23 -10.542 14.593 -8.934
192 HA LYS 23 HA LYS 23 -10.444 14.016 -11.849
193 HB2 LYS 23 HB1 LYS 23 -11.637 11.971 -11.457
194 HB3 LYS 23 HB2 LYS 23 -10.169 11.996 -10.405
195 HG2 LYS 23 HG1 LYS 23 -11.619 12.760 -8.496
196 HG3 LYS 23 HG2 LYS 23 -13.080 12.527 -9.515
197 HD2 LYS 23 HD1 LYS 23 -11.007 10.344 -8.938
198 HD3 LYS 23 HD2 LYS 23 -12.431 10.628 -7.904
199 HE2 LYS 23 HE1 LYS 23 -14.001 10.112 -9.726
200 HE3 LYS 23 HE2 LYS 23 -12.659 9.964 -10.906
201 HZ1 LYS 23 HZ1 LYS 23 -13.586 7.861 -9.797
202 HZ2 LYS 23 HZ2 LYS 23 -12.661 8.356 -8.458
203 HZ3 LYS 23 HZ3 LYS 23 -11.900 8.058 -9.915
204 H ABA 24 HN AGL 24 -11.686 16.184 -9.920
205 HA ABA 24 HA AGL 24 -14.482 16.013 -10.849
206 HB3 ABA 24 HB2 AGL 24 -14.958 17.673 -9.031
207 HB2 ABA 24 HB1 AGL 24 -13.214 17.705 -8.625
208 HG3 ABA 24 HG AGL 24 -14.806 15.025 -8.608
Start of MODEL 15
1 H1 PHE 1 HN PHE 1 3.514 3.979 -7.512
2 HA PHE 1 HA PHE 1 5.385 3.612 -5.385
3 HB2 PHE 1 HB1 PHE 1 5.102 6.051 -4.965
4 HB3 PHE 1 HB2 PHE 1 5.378 5.727 -6.710
5 HD1 PHE 1 HD1 PHE 1 3.555 6.056 -8.354
6 HD2 PHE 1 HD2 PHE 1 2.963 6.850 -4.174
7 HE1 PHE 1 HE1 PHE 1 1.501 7.330 -8.886
8 HE2 PHE 1 HE2 PHE 1 0.921 8.143 -4.707
9 HZ PHE 1 HZ PHE 1 0.182 8.378 -7.065
10 H LEU 2 HN LEU 2 2.119 3.081 -5.757
11 HA LEU 2 HA LEU 2 1.772 2.479 -2.976
12 HB2 LEU 2 HB1 LEU 2 0.045 4.498 -4.553
13 HB3 LEU 2 HB2 LEU 2 -0.705 3.520 -3.253
14 HG LEU 2 HG LEU 2 1.637 5.438 -2.818
15 HD11 LEU 2 HD11 LEU 2 -0.066 6.927 -1.763
16 HD12 LEU 2 HD12 LEU 2 -1.374 5.764 -2.203
17 HD13 LEU 2 HD13 LEU 2 -0.458 6.625 -3.499
18 HD21 LEU 2 HD21 LEU 2 1.599 3.621 -1.122
19 HD22 LEU 2 HD22 LEU 2 -0.165 3.899 -0.833
20 HD23 LEU 2 HD23 LEU 2 1.039 5.163 -0.389
21 HA PRO 3 HA PRO 3 -0.753 -0.207 -5.627
22 HB2 PRO 3 HB1 PRO 3 -1.669 -2.028 -3.818
23 HB3 PRO 3 HB2 PRO 3 0.096 -1.759 -3.976
24 HG2 PRO 3 HG1 PRO 3 -1.740 -0.486 -1.866
25 HG3 PRO 3 HG2 PRO 3 -0.209 -1.419 -1.599
26 HD2 PRO 3 HD1 PRO 3 -0.326 1.401 -1.855
27 HD3 PRO 3 HD2 PRO 3 1.130 0.402 -2.305
28 H ILE 4 HN ILE 4 -3.237 -1.211 -4.099
29 HA ILE 4 HA ILE 4 -5.144 0.382 -5.111
30 HB ILE 4 HB ILE 4 -6.758 -0.755 -3.669
31 HG12 ILE 4 HG11 ILE 4 -4.298 -2.069 -2.340
32 HG13 ILE 4 HG12 ILE 4 -5.363 -0.852 -1.567
33 HG21 ILE 4 HG21 ILE 4 -4.593 -2.611 -4.871
34 HG22 ILE 4 HG22 ILE 4 -6.342 -2.965 -4.655
35 HG23 ILE 4 HG23 ILE 4 -5.832 -1.701 -5.817
36 HD11 ILE 4 HD1 ILE 4 -7.342 -2.402 -1.857
37 HD12 ILE 4 HD2 ILE 4 -6.234 -3.657 -2.521
38 HD13 ILE 4 HD3 ILE 4 -6.041 -3.099 -0.825
39 H LEU 5 HN LEU 5 -3.510 1.149 -2.119
40 HA LEU 5 HA LEU 5 -5.498 2.521 -0.795
41 HB2 LEU 5 HB1 LEU 5 -2.510 3.187 -0.866
42 HB3 LEU 5 HB2 LEU 5 -3.666 3.635 0.428
43 HG LEU 5 HG LEU 5 -2.819 0.767 -0.325
44 HD11 LEU 5 HD11 LEU 5 -2.151 2.495 2.131
45 HD12 LEU 5 HD12 LEU 5 -1.018 2.087 0.789
46 HD13 LEU 5 HD13 LEU 5 -1.656 0.787 1.865
47 HD21 LEU 5 HD21 LEU 5 -4.672 1.766 1.932
48 HD22 LEU 5 HD22 LEU 5 -4.015 0.098 1.785
49 HD23 LEU 5 HD23 LEU 5 -5.145 0.720 0.536
50 H ALA 6 HN ALA 6 -3.431 3.826 -3.430
51 HA ALA 6 HA ALA 6 -4.401 6.484 -3.277
52 HB1 ALA 6 HB1 ALA 6 -3.545 6.590 -5.658
53 HB2 ALA 6 HB2 ALA 6 -2.360 5.775 -4.577
54 HB3 ALA 6 HB3 ALA 6 -3.396 4.791 -5.665
55 H SER 7 HN SER 7 -5.577 3.601 -5.104
56 HA SER 7 HA SER 7 -7.763 4.890 -6.328
57 HB2 SER 7 HB1 SER 7 -7.521 1.904 -5.638
58 HB3 SER 7 HB2 SER 7 -8.554 2.633 -6.913
59 HG SER 7 HG1 SER 7 -6.737 3.030 -8.103
60 H LEU 8 HN LEU 8 -7.486 3.121 -3.223
61 HA LEU 8 HA LEU 8 -10.240 3.243 -2.607
62 HB2 LEU 8 HB1 LEU 8 -7.793 3.006 -0.796
63 HB3 LEU 8 HB2 LEU 8 -9.478 2.904 -0.195
64 HG LEU 8 HG LEU 8 -8.232 0.990 -2.250
65 HD11 LEU 8 HD11 LEU 8 -7.241 0.769 0.038
66 HD12 LEU 8 HD12 LEU 8 -8.259 -0.662 -0.382
67 HD13 LEU 8 HD13 LEU 8 -8.892 0.598 0.738
68 HD21 LEU 8 HD21 LEU 8 -10.956 0.907 -0.797
69 HD22 LEU 8 HD22 LEU 8 -10.262 -0.422 -1.793
70 HD23 LEU 8 HD23 LEU 8 -10.702 1.137 -2.576
71 H ALA 9 HN ALA 9 -7.590 5.543 -1.908
72 HA ALA 9 HA ALA 9 -9.145 7.439 -0.587
73 HB1 ALA 9 HB1 ALA 9 -6.640 7.515 -0.748
74 HB2 ALA 9 HB2 ALA 9 -6.771 7.892 -2.502
75 HB3 ALA 9 HB3 ALA 9 -7.391 9.064 -1.277
76 H ALA 10 HN ALA 10 -8.716 6.873 -4.122
77 HA ALA 10 HA ALA 10 -10.437 8.941 -4.888
78 HB1 ALA 10 HB1 ALA 10 -10.452 7.823 -7.085
79 HB2 ALA 10 HB2 ALA 10 -8.830 7.492 -6.365
80 HB3 ALA 10 HB3 ALA 10 -10.088 6.221 -6.357
81 H LYS 11 HN LYS 11 -11.227 5.493 -4.383
82 HA LYS 11 HA LYS 11 -13.882 5.864 -5.301
83 HB2 LYS 11 HB1 LYS 11 -12.557 3.795 -5.563
84 HB3 LYS 11 HB2 LYS 11 -12.598 3.503 -3.803
85 HG2 LYS 11 HG1 LYS 11 -15.189 3.755 -5.451
86 HG3 LYS 11 HG2 LYS 11 -14.246 2.233 -5.467
87 HD2 LYS 11 HD1 LYS 11 -14.474 1.932 -3.052
88 HD3 LYS 11 HD2 LYS 11 -15.247 3.531 -2.869
89 HE2 LYS 11 HE1 LYS 11 -17.169 2.676 -4.394
90 HE3 LYS 11 HE2 LYS 11 -16.468 1.021 -4.157
91 HZ1 LYS 11 HZ1 LYS 11 -18.082 1.405 -2.465
92 HZ2 LYS 11 HZ2 LYS 11 -17.436 2.931 -2.091
93 HZ3 LYS 11 HZ3 LYS 11 -16.560 1.548 -1.713
94 H PHE 12 HN PHE 12 -12.567 5.524 -1.967
95 HA PHE 12 HA PHE 12 -15.315 5.837 -0.931
96 HB2 PHE 12 HB1 PHE 12 -12.630 5.010 0.319
97 HB3 PHE 12 HB2 PHE 12 -14.046 5.470 1.332
98 HD1 PHE 12 HD1 PHE 12 -16.186 4.252 1.145
99 HD2 PHE 12 HD2 PHE 12 -12.575 2.810 -0.664
100 HE1 PHE 12 HE1 PHE 12 -17.107 1.956 1.160
101 HE2 PHE 12 HE2 PHE 12 -13.496 0.506 -0.669
102 HZ PHE 12 HZ PHE 12 -15.753 0.071 0.267
103 H GLY 13 HN GLY 13 -12.626 7.683 -1.788
104 HA2 GLY 13 HA1 GLY 13 -13.966 9.973 -0.473
105 HA3 GLY 13 HA2 GLY 13 -12.225 9.864 -0.929
106 HA PRO 14 HA PRO 14 -14.383 10.553 -5.049
107 HB2 PRO 14 HB1 PRO 14 -17.057 11.436 -5.048
108 HB3 PRO 14 HB2 PRO 14 -16.574 9.710 -5.237
109 HG2 PRO 14 HG1 PRO 14 -17.417 11.115 -2.645
110 HG3 PRO 14 HG2 PRO 14 -18.016 9.543 -3.313
111 HD2 PRO 14 HD1 PRO 14 -16.035 9.585 -1.396
112 HD3 PRO 14 HD2 PRO 14 -15.937 8.424 -2.792
113 H LYS 15 HN LYS 15 -15.569 12.291 -2.185
114 HA LYS 15 HA LYS 15 -14.817 14.842 -3.119
115 HB2 LYS 15 HB1 LYS 15 -15.210 15.729 -1.060
116 HB3 LYS 15 HB2 LYS 15 -16.349 14.367 -1.135
117 HG2 LYS 15 HG1 LYS 15 -13.674 14.467 0.431
118 HG3 LYS 15 HG2 LYS 15 -15.315 14.755 1.080
119 HD2 LYS 15 HD1 LYS 15 -15.919 12.361 0.272
120 HD3 LYS 15 HD2 LYS 15 -14.161 12.086 0.097
121 HE2 LYS 15 HE1 LYS 15 -15.714 12.832 2.680
122 HE3 LYS 15 HE2 LYS 15 -14.996 11.221 2.286
123 HZ1 LYS 15 HZ1 LYS 15 -13.493 13.764 2.692
124 HZ2 LYS 15 HZ2 LYS 15 -12.801 12.258 2.335
125 HZ3 LYS 15 HZ3 LYS 15 -13.624 12.490 3.796
126 H LEU 16 HN LEU 16 -12.817 12.237 -1.743
127 HA LEU 16 HA LEU 16 -10.590 13.998 -1.269
128 HB2 LEU 16 HB1 LEU 16 -10.563 10.956 -1.420
129 HB3 LEU 16 HB2 LEU 16 -9.209 11.997 -0.916
130 HG LEU 16 HG LEU 16 -11.884 11.786 0.565
131 HD11 LEU 16 HD11 LEU 16 -10.554 10.517 2.285
132 HD12 LEU 16 HD12 LEU 16 -9.104 10.628 1.232
133 HD13 LEU 16 HD13 LEU 16 -10.527 9.682 0.685
134 HD21 LEU 16 HD21 LEU 16 -9.241 13.237 1.242
135 HD22 LEU 16 HD22 LEU 16 -10.572 13.012 2.416
136 HD23 LEU 16 HD23 LEU 16 -10.824 14.026 0.936
137 H PHE 17 HN PHE 17 -11.352 11.615 -3.957
138 HA PHE 17 HA PHE 17 -8.975 12.489 -5.266
139 HB2 PHE 17 HB1 PHE 17 -11.046 10.515 -5.904
140 HB3 PHE 17 HB2 PHE 17 -10.735 11.521 -7.347
141 HD1 PHE 17 HD1 PHE 17 -9.481 10.177 -8.756
142 HD2 PHE 17 HD2 PHE 17 -8.262 10.448 -4.634
143 HE1 PHE 17 HE1 PHE 17 -7.462 8.833 -9.252
144 HE2 PHE 17 HE2 PHE 17 -6.251 9.130 -5.144
145 HZ PHE 17 HZ PHE 17 -5.849 8.298 -7.442
146 H ABA 18 HN AGL 18 -12.286 13.788 -5.477
147 HA ABA 18 HA AGL 18 -11.699 15.588 -7.556
148 HB3 ABA 18 HB2 AGL 18 -13.506 17.052 -6.303
149 HB2 ABA 18 HB1 AGL 18 -13.647 15.670 -5.191
150 HG3 ABA 18 HG AGL 18 -14.501 14.195 -6.998
151 H LEU 19 HN LEU 19 -11.016 15.881 -4.014
152 HA LEU 19 HA LEU 19 -9.837 18.465 -4.480
153 HB2 LEU 19 HB1 LEU 19 -10.955 17.681 -2.351
154 HB3 LEU 19 HB2 LEU 19 -9.561 16.614 -2.042
155 HG LEU 19 HG LEU 19 -9.628 18.770 -0.757
156 HD11 LEU 19 HD11 LEU 19 -7.282 19.353 -0.865
157 HD12 LEU 19 HD12 LEU 19 -7.114 18.691 -2.521
158 HD13 LEU 19 HD13 LEU 19 -7.436 17.576 -1.138
159 HD21 LEU 19 HD21 LEU 19 -9.096 20.937 -1.781
160 HD22 LEU 19 HD22 LEU 19 -10.572 20.249 -2.561
161 HD23 LEU 19 HD23 LEU 19 -8.980 20.192 -3.411
162 H VAL 20 HN VAL 20 -8.398 15.250 -3.645
163 HA VAL 20 HA VAL 20 -5.764 16.185 -3.659
164 HB VAL 20 HB VAL 20 -6.890 13.355 -3.774
165 HG11 VAL 20 HG11 VAL 20 -4.588 12.684 -2.910
166 HG12 VAL 20 HG12 VAL 20 -4.540 13.269 -4.608
167 HG13 VAL 20 HG13 VAL 20 -3.999 14.348 -3.268
168 HG21 VAL 20 HG21 VAL 20 -5.760 15.112 -1.483
169 HG22 VAL 20 HG22 VAL 20 -7.499 14.690 -1.712
170 HG23 VAL 20 HG23 VAL 20 -6.300 13.403 -1.321
171 H THR 21 HN THR 21 -7.606 14.494 -6.263
172 HA THR 21 HA THR 21 -5.153 14.791 -7.924
173 HB THR 21 HB THR 21 -5.916 13.171 -9.462
174 HG1 THR 21 HG1 THR 21 -8.206 13.055 -7.801
175 HG21 THR 21 HG21 THR 21 -4.621 12.463 -7.421
176 HG22 THR 21 HG22 THR 21 -5.718 11.185 -8.053
177 HG23 THR 21 HG23 THR 21 -6.178 12.112 -6.573
178 H LYS 22 HN LYS 22 -7.982 16.409 -7.359
179 HA LYS 22 HA LYS 22 -9.173 17.902 -8.474
180 HB2 LYS 22 HB1 LYS 22 -6.650 18.530 -8.746
181 HB3 LYS 22 HB2 LYS 22 -6.893 18.207 -10.473
182 HG2 LYS 22 HG1 LYS 22 -8.510 20.195 -8.719
183 HG3 LYS 22 HG2 LYS 22 -7.032 20.656 -9.592
184 HD2 LYS 22 HD1 LYS 22 -9.717 19.778 -10.827
185 HD3 LYS 22 HD2 LYS 22 -9.078 21.435 -10.766
186 HE2 LYS 22 HE1 LYS 22 -7.915 19.075 -12.424
187 HE3 LYS 22 HE2 LYS 22 -8.836 20.494 -13.046
188 HZ1 LYS 22 HZ1 LYS 22 -7.048 21.910 -12.242
189 HZ2 LYS 22 HZ2 LYS 22 -6.464 20.730 -13.321
190 HZ3 LYS 22 HZ3 LYS 22 -6.216 20.548 -11.650
191 H LYS 23 HN LYS 23 -9.973 15.290 -9.250
192 HA LYS 23 HA LYS 23 -10.515 15.638 -12.148
193 HB2 LYS 23 HB1 LYS 23 -10.697 13.120 -10.455
194 HB3 LYS 23 HB2 LYS 23 -11.237 13.278 -12.156
195 HG2 LYS 23 HG1 LYS 23 -8.751 14.256 -12.530
196 HG3 LYS 23 HG2 LYS 23 -8.407 13.376 -11.022
197 HD2 LYS 23 HD1 LYS 23 -7.831 11.913 -12.812
198 HD3 LYS 23 HD2 LYS 23 -9.365 11.263 -12.147
199 HE2 LYS 23 HE1 LYS 23 -10.642 12.302 -14.067
200 HE3 LYS 23 HE2 LYS 23 -9.121 13.072 -14.669
201 HZ1 LYS 23 HZ1 LYS 23 -8.206 10.876 -15.029
202 HZ2 LYS 23 HZ2 LYS 23 -9.662 11.064 -15.870
203 HZ3 LYS 23 HZ3 LYS 23 -9.622 10.140 -14.451
204 H ABA 24 HN AGL 24 -11.880 17.077 -9.880
205 HA ABA 24 HA AGL 24 -14.578 16.614 -10.987
206 HB3 ABA 24 HB2 AGL 24 -15.513 17.711 -8.917
207 HB2 ABA 24 HB1 AGL 24 -13.864 17.766 -8.227
208 HG3 ABA 24 HG AGL 24 -15.381 15.130 -9.006
Start of MODEL 16
1 H1 PHE 1 HN PHE 1 -0.212 3.898 -8.349
2 HA PHE 1 HA PHE 1 2.359 3.151 -7.846
3 HB2 PHE 1 HB1 PHE 1 2.861 5.430 -8.950
4 HB3 PHE 1 HB2 PHE 1 1.935 6.216 -7.626
5 HD1 PHE 1 HD1 PHE 1 3.175 6.929 -5.770
6 HD2 PHE 1 HD2 PHE 1 4.737 3.727 -8.162
7 HE1 PHE 1 HE1 PHE 1 5.202 6.862 -4.347
8 HE2 PHE 1 HE2 PHE 1 6.767 3.652 -6.745
9 HZ PHE 1 HZ PHE 1 6.999 5.216 -4.826
10 H LEU 2 HN LEU 2 2.850 3.689 -5.436
11 HA LEU 2 HA LEU 2 2.271 2.997 -3.418
12 HB2 LEU 2 HB1 LEU 2 -0.193 4.641 -3.998
13 HB3 LEU 2 HB2 LEU 2 -0.330 3.444 -2.700
14 HG LEU 2 HG LEU 2 1.707 4.422 -1.581
15 HD11 LEU 2 HD11 LEU 2 1.304 6.668 -3.660
16 HD12 LEU 2 HD12 LEU 2 2.762 5.620 -3.486
17 HD13 LEU 2 HD13 LEU 2 2.331 6.787 -2.181
18 HD21 LEU 2 HD21 LEU 2 -0.711 6.285 -2.026
19 HD22 LEU 2 HD22 LEU 2 0.424 6.332 -0.625
20 HD23 LEU 2 HD23 LEU 2 -0.640 4.897 -0.875
21 HA PRO 3 HA PRO 3 -0.368 -0.684 -4.130
22 HB2 PRO 3 HB1 PRO 3 -1.380 -1.296 -1.608
23 HB3 PRO 3 HB2 PRO 3 0.342 -1.602 -2.039
24 HG2 PRO 3 HG1 PRO 3 -0.784 0.883 -0.621
25 HG3 PRO 3 HG2 PRO 3 0.550 -0.205 -0.050
26 HD2 PRO 3 HD1 PRO 3 1.059 2.120 -1.438
27 HD3 PRO 3 HD2 PRO 3 2.044 0.627 -1.767
28 H ILE 4 HN ILE 4 -2.886 -1.163 -3.286
29 HA ILE 4 HA ILE 4 -4.395 0.507 -4.719
30 HB ILE 4 HB ILE 4 -6.391 -0.518 -3.695
31 HG12 ILE 4 HG11 ILE 4 -4.381 -1.933 -1.824
32 HG13 ILE 4 HG12 ILE 4 -5.527 -0.647 -1.321
33 HG21 ILE 4 HG21 ILE 4 -5.865 -2.763 -4.543
34 HG22 ILE 4 HG22 ILE 4 -5.045 -1.538 -5.563
35 HG23 ILE 4 HG23 ILE 4 -4.098 -2.487 -4.354
36 HD11 ILE 4 HD1 ILE 4 -7.467 -2.103 -2.048
37 HD12 ILE 4 HD2 ILE 4 -6.305 -3.425 -2.435
38 HD13 ILE 4 HD3 ILE 4 -6.473 -2.843 -0.743
39 H LEU 5 HN LEU 5 -3.591 1.225 -1.427
40 HA LEU 5 HA LEU 5 -5.559 2.752 -0.453
41 HB2 LEU 5 HB1 LEU 5 -2.581 3.432 -0.330
42 HB3 LEU 5 HB2 LEU 5 -3.835 3.886 0.869
43 HG LEU 5 HG LEU 5 -2.851 1.032 0.237
44 HD11 LEU 5 HD11 LEU 5 -1.207 2.429 1.489
45 HD12 LEU 5 HD12 LEU 5 -1.888 1.111 2.515
46 HD13 LEU 5 HD13 LEU 5 -2.469 2.801 2.725
47 HD21 LEU 5 HD21 LEU 5 -4.197 0.343 2.249
48 HD22 LEU 5 HD22 LEU 5 -5.235 0.892 0.892
49 HD23 LEU 5 HD23 LEU 5 -4.936 1.983 2.306
50 H ALA 6 HN ALA 6 -3.240 4.044 -2.923
51 HA ALA 6 HA ALA 6 -4.231 6.694 -2.843
52 HB1 ALA 6 HB1 ALA 6 -2.058 6.036 -3.902
53 HB2 ALA 6 HB2 ALA 6 -2.934 5.053 -5.120
54 HB3 ALA 6 HB3 ALA 6 -3.113 6.848 -5.112
55 H SER 7 HN SER 7 -5.211 3.872 -4.867
56 HA SER 7 HA SER 7 -7.343 5.204 -6.181
57 HB2 SER 7 HB1 SER 7 -7.016 2.192 -5.653
58 HB3 SER 7 HB2 SER 7 -8.040 2.947 -6.923
59 HG SER 7 HG1 SER 7 -6.189 3.512 -8.009
60 H LEU 8 HN LEU 8 -7.151 3.356 -3.114
61 HA LEU 8 HA LEU 8 -9.965 3.340 -2.707
62 HB2 LEU 8 HB1 LEU 8 -7.711 3.166 -0.655
63 HB3 LEU 8 HB2 LEU 8 -9.447 2.969 -0.268
64 HG LEU 8 HG LEU 8 -7.835 1.154 -2.144
65 HD11 LEU 8 HD11 LEU 8 -9.004 0.683 0.677
66 HD12 LEU 8 HD12 LEU 8 -7.263 0.930 0.288
67 HD13 LEU 8 HD13 LEU 8 -8.127 -0.531 -0.324
68 HD21 LEU 8 HD21 LEU 8 -10.773 0.973 -1.203
69 HD22 LEU 8 HD22 LEU 8 -9.874 -0.332 -2.061
70 HD23 LEU 8 HD23 LEU 8 -10.204 1.221 -2.904
71 H ALA 9 HN ALA 9 -7.484 5.743 -1.835
72 HA ALA 9 HA ALA 9 -9.184 7.555 -0.584
73 HB1 ALA 9 HB1 ALA 9 -6.683 7.762 -0.645
74 HB2 ALA 9 HB2 ALA 9 -6.764 8.131 -2.402
75 HB3 ALA 9 HB3 ALA 9 -7.489 9.271 -1.210
76 H ALA 10 HN ALA 10 -8.604 6.998 -4.092
77 HA ALA 10 HA ALA 10 -10.367 8.987 -4.972
78 HB1 ALA 10 HB1 ALA 10 -8.691 7.445 -6.345
79 HB2 ALA 10 HB2 ALA 10 -10.003 6.232 -6.370
80 HB3 ALA 10 HB3 ALA 10 -10.276 7.830 -7.125
81 H LYS 11 HN LYS 11 -11.002 5.533 -4.352
82 HA LYS 11 HA LYS 11 -13.652 5.704 -5.328
83 HB2 LYS 11 HB1 LYS 11 -12.208 3.718 -5.499
84 HB3 LYS 11 HB2 LYS 11 -12.242 3.485 -3.732
85 HG2 LYS 11 HG1 LYS 11 -14.851 3.571 -5.340
86 HG3 LYS 11 HG2 LYS 11 -13.838 2.098 -5.406
87 HD2 LYS 11 HD1 LYS 11 -14.038 1.678 -3.039
88 HD3 LYS 11 HD2 LYS 11 -14.709 3.301 -2.724
89 HE2 LYS 11 HE1 LYS 11 -16.757 2.661 -4.166
90 HE3 LYS 11 HE2 LYS 11 -16.147 0.955 -4.109
91 HZ1 LYS 11 HZ1 LYS 11 -16.842 2.731 -1.822
92 HZ2 LYS 11 HZ2 LYS 11 -16.096 1.235 -1.641
93 HZ3 LYS 11 HZ3 LYS 11 -17.660 1.324 -2.308
94 H PHE 12 HN PHE 12 -12.399 5.579 -1.961
95 HA PHE 12 HA PHE 12 -15.177 5.775 -0.977
96 HB2 PHE 12 HB1 PHE 12 -12.462 5.178 0.341
97 HB3 PHE 12 HB2 PHE 12 -13.905 5.618 1.322
98 HD1 PHE 12 HD1 PHE 12 -15.950 4.260 1.267
99 HD2 PHE 12 HD2 PHE 12 -12.299 2.942 -0.555
100 HE1 PHE 12 HE1 PHE 12 -16.744 1.919 1.393
101 HE2 PHE 12 HE2 PHE 12 -13.091 0.593 -0.446
102 HZ PHE 12 HZ PHE 12 -15.307 0.077 0.545
103 H GLY 13 HN GLY 13 -12.655 7.763 -1.946
104 HA2 GLY 13 HA1 GLY 13 -14.133 9.998 -0.697
105 HA3 GLY 13 HA2 GLY 13 -12.365 9.981 -1.046
106 HA PRO 14 HA PRO 14 -14.437 10.558 -5.251
107 HB2 PRO 14 HB1 PRO 14 -17.139 11.384 -5.244
108 HB3 PRO 14 HB2 PRO 14 -16.603 9.679 -5.488
109 HG2 PRO 14 HG1 PRO 14 -17.500 10.975 -2.857
110 HG3 PRO 14 HG2 PRO 14 -18.044 9.405 -3.577
111 HD2 PRO 14 HD1 PRO 14 -16.087 9.441 -1.649
112 HD3 PRO 14 HD2 PRO 14 -15.919 8.343 -3.087
113 H LYS 15 HN LYS 15 -15.624 12.251 -2.363
114 HA LYS 15 HA LYS 15 -14.909 14.815 -3.304
115 HB2 LYS 15 HB1 LYS 15 -15.150 15.715 -1.185
116 HB3 LYS 15 HB2 LYS 15 -16.467 14.548 -1.422
117 HG2 LYS 15 HG1 LYS 15 -13.933 14.093 0.306
118 HG3 LYS 15 HG2 LYS 15 -15.519 14.689 0.873
119 HD2 LYS 15 HD1 LYS 15 -16.535 12.509 -0.141
120 HD3 LYS 15 HD2 LYS 15 -14.865 11.867 -0.126
121 HE2 LYS 15 HE1 LYS 15 -16.511 12.912 2.300
122 HE3 LYS 15 HE2 LYS 15 -16.198 11.179 1.902
123 HZ1 LYS 15 HZ1 LYS 15 -13.854 11.551 2.286
124 HZ2 LYS 15 HZ2 LYS 15 -14.751 12.028 3.635
125 HZ3 LYS 15 HZ3 LYS 15 -14.116 13.199 2.595
126 H LEU 16 HN LEU 16 -12.829 12.267 -1.858
127 HA LEU 16 HA LEU 16 -10.601 14.070 -1.586
128 HB2 LEU 16 HB1 LEU 16 -10.747 11.030 -1.508
129 HB3 LEU 16 HB2 LEU 16 -9.206 11.899 -1.615
130 HG LEU 16 HG LEU 16 -9.625 13.130 0.467
131 HD11 LEU 16 HD11 LEU 16 -11.308 12.289 2.095
132 HD12 LEU 16 HD12 LEU 16 -12.035 11.239 0.814
133 HD13 LEU 16 HD13 LEU 16 -12.094 13.056 0.660
134 HD21 LEU 16 HD21 LEU 16 -9.132 11.175 1.946
135 HD22 LEU 16 HD22 LEU 16 -8.257 11.061 0.380
136 HD23 LEU 16 HD23 LEU 16 -9.721 10.052 0.661
137 H PHE 17 HN PHE 17 -11.559 11.667 -4.178
138 HA PHE 17 HA PHE 17 -9.300 12.467 -5.691
139 HB2 PHE 17 HB1 PHE 17 -11.296 10.440 -6.006
140 HB3 PHE 17 HB2 PHE 17 -11.468 11.466 -7.459
141 HD1 PHE 17 HD1 PHE 17 -10.386 10.352 -9.211
142 HD2 PHE 17 HD2 PHE 17 -8.421 10.452 -5.386
143 HE1 PHE 17 HE1 PHE 17 -8.445 9.134 -10.160
144 HE2 PHE 17 HE2 PHE 17 -6.518 9.211 -6.327
145 HZ PHE 17 HZ PHE 17 -6.511 8.561 -8.718
146 H ABA 18 HN AGL 18 -12.594 13.844 -5.664
147 HA ABA 18 HA AGL 18 -11.998 15.652 -7.758
148 HB3 ABA 18 HB2 AGL 18 -13.848 17.098 -6.566
149 HB2 ABA 18 HB1 AGL 18 -14.038 15.695 -5.486
150 HG3 ABA 18 HG AGL 18 -14.956 14.331 -7.294
151 H LEU 19 HN LEU 19 -11.159 15.818 -4.284
152 HA LEU 19 HA LEU 19 -10.153 18.524 -4.738
153 HB2 LEU 19 HB1 LEU 19 -11.419 18.058 -2.677
154 HB3 LEU 19 HB2 LEU 19 -10.254 16.784 -2.222
155 HG LEU 19 HG LEU 19 -8.437 18.503 -2.023
156 HD11 LEU 19 HD11 LEU 19 -9.016 20.944 -2.025
157 HD12 LEU 19 HD12 LEU 19 -10.655 20.552 -2.668
158 HD13 LEU 19 HD13 LEU 19 -9.179 20.214 -3.657
159 HD21 LEU 19 HD21 LEU 19 -9.275 19.606 0.029
160 HD22 LEU 19 HD22 LEU 19 -9.798 17.882 -0.037
161 HD23 LEU 19 HD23 LEU 19 -10.973 19.201 -0.423
162 H VAL 20 HN VAL 20 -8.667 15.515 -3.360
163 HA VAL 20 HA VAL 20 -6.095 16.651 -3.198
164 HB VAL 20 HB VAL 20 -6.981 13.722 -3.095
165 HG11 VAL 20 HG11 VAL 20 -4.525 13.876 -3.481
166 HG12 VAL 20 HG12 VAL 20 -4.370 15.125 -2.191
167 HG13 VAL 20 HG13 VAL 20 -4.829 13.432 -1.771
168 HG21 VAL 20 HG21 VAL 20 -6.573 15.845 -0.880
169 HG22 VAL 20 HG22 VAL 20 -8.152 15.118 -1.371
170 HG23 VAL 20 HG23 VAL 20 -6.889 14.095 -0.597
171 H THR 21 HN THR 21 -7.503 14.255 -5.458
172 HA THR 21 HA THR 21 -5.069 14.481 -7.105
173 HB THR 21 HB THR 21 -7.354 12.564 -7.620
174 HG1 THR 21 HG1 THR 21 -6.073 11.143 -6.404
175 HG21 THR 21 HG21 THR 21 -5.545 12.741 -9.406
176 HG22 THR 21 HG22 THR 21 -5.411 11.181 -8.533
177 HG23 THR 21 HG23 THR 21 -4.285 12.529 -8.137
178 H LYS 22 HN LYS 22 -7.750 16.169 -6.806
179 HA LYS 22 HA LYS 22 -9.137 17.358 -8.012
180 HB2 LYS 22 HB1 LYS 22 -6.544 18.130 -8.222
181 HB3 LYS 22 HB2 LYS 22 -6.983 18.190 -9.933
182 HG2 LYS 22 HG1 LYS 22 -8.339 19.576 -7.524
183 HG3 LYS 22 HG2 LYS 22 -7.250 20.373 -8.685
184 HD2 LYS 22 HD1 LYS 22 -10.071 19.270 -9.359
185 HD3 LYS 22 HD2 LYS 22 -9.673 20.937 -8.901
186 HE2 LYS 22 HE1 LYS 22 -9.489 21.435 -11.085
187 HE3 LYS 22 HE2 LYS 22 -7.888 20.602 -11.025
188 HZ1 LYS 22 HZ1 LYS 22 -9.059 18.551 -11.612
189 HZ2 LYS 22 HZ2 LYS 22 -9.260 19.737 -12.815
190 HZ3 LYS 22 HZ3 LYS 22 -10.509 19.354 -11.725
191 H LYS 23 HN LYS 23 -9.835 14.895 -8.974
192 HA LYS 23 HA LYS 23 -9.795 15.048 -11.898
193 HB2 LYS 23 HB1 LYS 23 -10.654 12.987 -9.859
194 HB3 LYS 23 HB2 LYS 23 -11.158 12.802 -11.562
195 HG2 LYS 23 HG1 LYS 23 -8.226 13.403 -11.218
196 HG3 LYS 23 HG2 LYS 23 -8.762 11.894 -10.451
197 HD2 LYS 23 HD1 LYS 23 -8.001 11.366 -12.672
198 HD3 LYS 23 HD2 LYS 23 -9.771 11.088 -12.577
199 HE2 LYS 23 HE1 LYS 23 -10.174 13.264 -13.814
200 HE3 LYS 23 HE2 LYS 23 -8.389 13.546 -13.878
201 HZ1 LYS 23 HZ1 LYS 23 -9.229 12.579 -15.917
202 HZ2 LYS 23 HZ2 LYS 23 -9.848 11.240 -15.091
203 HZ3 LYS 23 HZ3 LYS 23 -8.175 11.499 -15.153
204 H ABA 24 HN AGL 24 -11.769 16.479 -9.626
205 HA ABA 24 HA AGL 24 -14.134 16.377 -11.387
206 HB3 ABA 24 HB2 AGL 24 -15.244 17.757 -9.589
207 HB2 ABA 24 HB1 AGL 24 -13.726 17.707 -8.649
208 HG3 ABA 24 HG AGL 24 -15.432 15.202 -9.469
Start of MODEL 17
1 H1 PHE 1 HN PHE 1 3.324 2.247 1.169
2 HA PHE 1 HA PHE 1 4.467 0.564 -0.254
3 HB2 PHE 1 HB1 PHE 1 3.484 -0.068 1.974
4 HB3 PHE 1 HB2 PHE 1 1.890 -0.343 1.208
5 HD1 PHE 1 HD1 PHE 1 1.586 -2.601 1.744
6 HD2 PHE 1 HD2 PHE 1 5.325 -1.452 -0.054
7 HE1 PHE 1 HE1 PHE 1 2.227 -4.981 1.539
8 HE2 PHE 1 HE2 PHE 1 5.952 -3.822 -0.256
9 HZ PHE 1 HZ PHE 1 4.420 -5.594 0.550
10 H LEU 2 HN LEU 2 1.289 -0.811 -0.608
11 HA LEU 2 HA LEU 2 1.330 -1.380 -3.245
12 HB2 LEU 2 HB1 LEU 2 -1.169 -0.539 -1.686
13 HB3 LEU 2 HB2 LEU 2 -1.106 -1.631 -3.115
14 HG LEU 2 HG LEU 2 0.070 -2.242 -0.340
15 HD11 LEU 2 HD11 LEU 2 -2.423 -2.168 -0.346
16 HD12 LEU 2 HD12 LEU 2 -1.806 -3.847 -0.134
17 HD13 LEU 2 HD13 LEU 2 -2.458 -3.324 -1.731
18 HD21 LEU 2 HD21 LEU 2 1.322 -3.404 -2.172
19 HD22 LEU 2 HD22 LEU 2 -0.232 -4.049 -2.829
20 HD23 LEU 2 HD23 LEU 2 0.346 -4.558 -1.199
21 HA PRO 3 HA PRO 3 0.797 2.534 -5.242
22 HB2 PRO 3 HB1 PRO 3 -0.081 1.813 -7.815
23 HB3 PRO 3 HB2 PRO 3 1.588 1.467 -7.223
24 HG2 PRO 3 HG1 PRO 3 -0.824 -0.436 -7.191
25 HG3 PRO 3 HG2 PRO 3 0.837 -0.760 -7.836
26 HD2 PRO 3 HD1 PRO 3 0.127 -1.551 -5.294
27 HD3 PRO 3 HD2 PRO 3 1.775 -0.833 -5.596
28 H ILE 4 HN ILE 4 -1.858 0.284 -5.129
29 HA ILE 4 HA ILE 4 -3.980 1.870 -5.841
30 HB ILE 4 HB ILE 4 -5.469 0.420 -4.658
31 HG12 ILE 4 HG11 ILE 4 -3.012 -1.006 -3.496
32 HG13 ILE 4 HG12 ILE 4 -4.046 0.122 -2.555
33 HG21 ILE 4 HG21 ILE 4 -4.919 -1.624 -5.905
34 HG22 ILE 4 HG22 ILE 4 -4.467 -0.191 -6.885
35 HG23 ILE 4 HG23 ILE 4 -3.190 -1.148 -6.039
36 HD11 ILE 4 HD1 ILE 4 -4.985 -2.527 -3.844
37 HD12 ILE 4 HD2 ILE 4 -4.737 -2.198 -2.093
38 HD13 ILE 4 HD3 ILE 4 -6.048 -1.352 -2.986
39 H LEU 5 HN LEU 5 -2.079 2.466 -3.004
40 HA LEU 5 HA LEU 5 -4.121 3.419 -1.338
41 HB2 LEU 5 HB1 LEU 5 -1.194 4.286 -1.545
42 HB3 LEU 5 HB2 LEU 5 -2.286 4.639 -0.164
43 HG LEU 5 HG LEU 5 -1.416 1.833 -1.100
44 HD11 LEU 5 HD11 LEU 5 0.453 3.125 -0.131
45 HD12 LEU 5 HD12 LEU 5 -0.051 1.796 0.973
46 HD13 LEU 5 HD13 LEU 5 -0.535 3.497 1.335
47 HD21 LEU 5 HD21 LEU 5 -3.068 2.700 1.358
48 HD22 LEU 5 HD22 LEU 5 -2.387 1.055 1.090
49 HD23 LEU 5 HD23 LEU 5 -3.645 1.690 -0.026
50 H ALA 6 HN ALA 6 -2.355 5.105 -3.949
51 HA ALA 6 HA ALA 6 -3.608 7.623 -3.621
52 HB1 ALA 6 HB1 ALA 6 -2.520 6.159 -6.118
53 HB2 ALA 6 HB2 ALA 6 -2.880 7.926 -6.032
54 HB3 ALA 6 HB3 ALA 6 -1.563 7.218 -5.028
55 H SER 7 HN SER 7 -4.529 4.709 -5.531
56 HA SER 7 HA SER 7 -6.867 5.748 -6.655
57 HB2 SER 7 HB1 SER 7 -6.407 2.806 -5.898
58 HB3 SER 7 HB2 SER 7 -7.482 3.436 -7.189
59 HG SER 7 HG1 SER 7 -5.688 3.911 -8.390
60 H LEU 8 HN LEU 8 -6.384 3.992 -3.562
61 HA LEU 8 HA LEU 8 -9.099 3.921 -2.833
62 HB2 LEU 8 HB1 LEU 8 -6.542 3.852 -1.160
63 HB3 LEU 8 HB2 LEU 8 -8.172 3.656 -0.447
64 HG LEU 8 HG LEU 8 -6.983 1.802 -2.587
65 HD11 LEU 8 HD11 LEU 8 -5.759 1.676 -0.411
66 HD12 LEU 8 HD12 LEU 8 -6.714 0.176 -0.717
67 HD13 LEU 8 HD13 LEU 8 -7.315 1.406 0.456
68 HD21 LEU 8 HD21 LEU 8 -9.530 1.544 -0.859
69 HD22 LEU 8 HD22 LEU 8 -8.860 0.269 -1.936
70 HD23 LEU 8 HD23 LEU 8 -9.485 1.797 -2.652
71 H ALA 9 HN ALA 9 -6.577 6.404 -2.160
72 HA ALA 9 HA ALA 9 -8.213 8.106 -0.683
73 HB1 ALA 9 HB1 ALA 9 -5.733 8.376 -0.957
74 HB2 ALA 9 HB2 ALA 9 -5.970 8.797 -2.686
75 HB3 ALA 9 HB3 ALA 9 -6.603 9.891 -1.396
76 H ALA 10 HN ALA 10 -7.779 7.923 -4.253
77 HA ALA 10 HA ALA 10 -9.732 9.831 -4.872
78 HB1 ALA 10 HB1 ALA 10 -9.673 8.685 -7.148
79 HB2 ALA 10 HB2 ALA 10 -8.018 8.970 -6.480
80 HB3 ALA 10 HB3 ALA 10 -8.752 7.334 -6.404
81 H LYS 11 HN LYS 11 -10.177 6.233 -4.573
82 HA LYS 11 HA LYS 11 -12.922 6.577 -5.429
83 HB2 LYS 11 HB1 LYS 11 -11.547 4.762 -6.268
84 HB3 LYS 11 HB2 LYS 11 -11.294 4.109 -4.635
85 HG2 LYS 11 HG1 LYS 11 -14.193 4.410 -5.490
86 HG3 LYS 11 HG2 LYS 11 -13.235 3.289 -6.477
87 HD2 LYS 11 HD1 LYS 11 -13.085 1.692 -4.917
88 HD3 LYS 11 HD2 LYS 11 -12.735 2.813 -3.583
89 HE2 LYS 11 HE1 LYS 11 -15.598 2.500 -4.719
90 HE3 LYS 11 HE2 LYS 11 -14.939 1.382 -3.458
91 HZ1 LYS 11 HZ1 LYS 11 -14.932 4.332 -3.153
92 HZ2 LYS 11 HZ2 LYS 11 -14.611 3.165 -1.986
93 HZ3 LYS 11 HZ3 LYS 11 -16.187 3.343 -2.589
94 H PHE 12 HN PHE 12 -11.407 6.089 -2.217
95 HA PHE 12 HA PHE 12 -14.144 5.818 -1.101
96 HB2 PHE 12 HB1 PHE 12 -11.358 5.169 -0.003
97 HB3 PHE 12 HB2 PHE 12 -12.733 5.494 1.111
98 HD1 PHE 12 HD1 PHE 12 -14.776 4.166 1.056
99 HD2 PHE 12 HD2 PHE 12 -11.330 3.083 -1.252
100 HE1 PHE 12 HE1 PHE 12 -15.681 1.874 0.800
101 HE2 PHE 12 HE2 PHE 12 -12.225 0.775 -1.505
102 HZ PHE 12 HZ PHE 12 -14.406 0.176 -0.482
103 H GLY 13 HN GLY 13 -11.662 8.141 -1.670
104 HA2 GLY 13 HA1 GLY 13 -13.431 10.045 -0.253
105 HA3 GLY 13 HA2 GLY 13 -11.766 10.319 -0.868
106 HA PRO 14 HA PRO 14 -14.421 10.570 -4.765
107 HB2 PRO 14 HB1 PRO 14 -17.175 11.057 -4.477
108 HB3 PRO 14 HB2 PRO 14 -16.480 9.407 -4.691
109 HG2 PRO 14 HG1 PRO 14 -17.218 10.776 -2.049
110 HG3 PRO 14 HG2 PRO 14 -17.664 9.113 -2.607
111 HD2 PRO 14 HD1 PRO 14 -15.512 9.518 -0.930
112 HD3 PRO 14 HD2 PRO 14 -15.410 8.302 -2.274
113 H LYS 15 HN LYS 15 -15.294 12.157 -1.751
114 HA LYS 15 HA LYS 15 -15.235 14.842 -2.658
115 HB2 LYS 15 HB1 LYS 15 -14.311 13.589 0.011
116 HB3 LYS 15 HB2 LYS 15 -14.440 15.354 -0.289
117 HG2 LYS 15 HG1 LYS 15 -16.883 15.156 -0.621
118 HG3 LYS 15 HG2 LYS 15 -16.802 13.390 -0.320
119 HD2 LYS 15 HD1 LYS 15 -15.892 13.789 1.975
120 HD3 LYS 15 HD2 LYS 15 -15.853 15.554 1.673
121 HE2 LYS 15 HE1 LYS 15 -18.355 15.607 1.513
122 HE3 LYS 15 HE2 LYS 15 -18.412 13.817 1.795
123 HZ1 LYS 15 HZ1 LYS 15 -17.301 15.843 3.691
124 HZ2 LYS 15 HZ2 LYS 15 -17.391 14.176 3.958
125 HZ3 LYS 15 HZ3 LYS 15 -18.806 15.088 3.818
126 H LEU 16 HN LEU 16 -12.552 12.627 -1.554
127 HA LEU 16 HA LEU 16 -10.537 14.569 -1.893
128 HB2 LEU 16 HB1 LEU 16 -10.318 11.530 -1.831
129 HB3 LEU 16 HB2 LEU 16 -8.932 12.651 -1.794
130 HG LEU 16 HG LEU 16 -11.106 12.522 0.369
131 HD11 LEU 16 HD11 LEU 16 -8.206 11.463 0.346
132 HD12 LEU 16 HD12 LEU 16 -9.691 10.450 0.269
133 HD13 LEU 16 HD13 LEU 16 -9.336 11.425 1.746
134 HD21 LEU 16 HD21 LEU 16 -9.465 13.905 1.697
135 HD22 LEU 16 HD22 LEU 16 -10.058 14.795 0.249
136 HD23 LEU 16 HD23 LEU 16 -8.417 14.043 0.246
137 H PHE 17 HN PHE 17 -11.682 11.980 -4.175
138 HA PHE 17 HA PHE 17 -9.698 12.549 -6.028
139 HB2 PHE 17 HB1 PHE 17 -11.362 10.575 -6.081
140 HB3 PHE 17 HB2 PHE 17 -12.552 11.680 -6.829
141 HD1 PHE 17 HD1 PHE 17 -8.773 11.366 -7.464
142 HD2 PHE 17 HD2 PHE 17 -12.756 10.688 -8.958
143 HE1 PHE 17 HE1 PHE 17 -7.844 10.650 -9.619
144 HE2 PHE 17 HE2 PHE 17 -11.803 9.961 -11.123
145 HZ PHE 17 HZ PHE 17 -9.349 9.933 -11.453
146 H ABA 18 HN AGL 18 -12.849 14.205 -5.625
147 HA ABA 18 HA AGL 18 -12.379 15.963 -7.853
148 HB3 ABA 18 HB2 AGL 18 -14.135 17.391 -6.566
149 HB2 ABA 18 HB1 AGL 18 -14.223 16.035 -5.406
150 HG3 ABA 18 HG AGL 18 -14.774 14.436 -7.392
151 H LEU 19 HN LEU 19 -11.856 16.376 -4.271
152 HA LEU 19 HA LEU 19 -10.821 18.951 -4.685
153 HB2 LEU 19 HB1 LEU 19 -11.055 17.066 -2.363
154 HB3 LEU 19 HB2 LEU 19 -9.821 18.350 -2.205
155 HG LEU 19 HG LEU 19 -11.891 19.050 -1.189
156 HD11 LEU 19 HD11 LEU 19 -12.015 21.286 -2.125
157 HD12 LEU 19 HD12 LEU 19 -11.428 20.732 -3.735
158 HD13 LEU 19 HD13 LEU 19 -10.324 20.709 -2.310
159 HD21 LEU 19 HD21 LEU 19 -13.234 18.929 -3.965
160 HD22 LEU 19 HD22 LEU 19 -13.958 19.557 -2.443
161 HD23 LEU 19 HD23 LEU 19 -13.557 17.807 -2.588
162 H VAL 20 HN VAL 20 -8.959 15.910 -4.231
163 HA VAL 20 HA VAL 20 -6.469 17.133 -3.946
164 HB VAL 20 HB VAL 20 -7.256 14.347 -4.887
165 HG11 VAL 20 HG11 VAL 20 -4.444 15.474 -4.235
166 HG12 VAL 20 HG12 VAL 20 -4.843 13.723 -4.348
167 HG13 VAL 20 HG13 VAL 20 -4.977 14.764 -5.804
168 HG21 VAL 20 HG21 VAL 20 -6.513 13.738 -2.564
169 HG22 VAL 20 HG22 VAL 20 -6.114 15.459 -2.226
170 HG23 VAL 20 HG23 VAL 20 -7.829 14.966 -2.492
171 H THR 21 HN THR 21 -8.208 16.149 -6.923
172 HA THR 21 HA THR 21 -5.914 17.283 -8.413
173 HB THR 21 HB THR 21 -6.210 16.114 -10.276
174 HG1 THR 21 HG1 THR 21 -8.351 16.413 -10.522
175 HG21 THR 21 HG21 THR 21 -6.311 13.736 -9.635
176 HG22 THR 21 HG22 THR 21 -7.153 14.137 -8.090
177 HG23 THR 21 HG23 THR 21 -5.448 14.664 -8.360
178 H LYS 22 HN LYS 22 -8.104 18.925 -7.137
179 HA LYS 22 HA LYS 22 -9.511 20.551 -7.571
180 HB2 LYS 22 HB1 LYS 22 -8.742 22.397 -8.957
181 HB3 LYS 22 HB2 LYS 22 -7.439 21.740 -7.934
182 HG2 LYS 22 HG1 LYS 22 -6.183 20.949 -9.692
183 HG3 LYS 22 HG2 LYS 22 -7.572 20.601 -10.738
184 HD2 LYS 22 HD1 LYS 22 -6.469 23.422 -10.153
185 HD3 LYS 22 HD2 LYS 22 -6.099 22.441 -11.596
186 HE2 LYS 22 HE1 LYS 22 -8.838 23.665 -10.846
187 HE3 LYS 22 HE2 LYS 22 -7.768 24.096 -12.236
188 HZ1 LYS 22 HZ1 LYS 22 -9.254 21.582 -11.767
189 HZ2 LYS 22 HZ2 LYS 22 -8.098 21.736 -12.994
190 HZ3 LYS 22 HZ3 LYS 22 -9.509 22.693 -13.011
191 H LYS 23 HN LYS 23 -11.027 18.659 -8.454
192 HA LYS 23 HA LYS 23 -12.266 19.734 -10.861
193 HB2 LYS 23 HB1 LYS 23 -12.478 17.646 -12.032
194 HB3 LYS 23 HB2 LYS 23 -10.761 17.952 -11.685
195 HG2 LYS 23 HG1 LYS 23 -10.814 16.331 -9.789
196 HG3 LYS 23 HG2 LYS 23 -12.552 16.004 -10.106
197 HD2 LYS 23 HD1 LYS 23 -11.989 15.302 -12.461
198 HD3 LYS 23 HD2 LYS 23 -10.255 15.531 -12.120
199 HE2 LYS 23 HE1 LYS 23 -12.130 13.479 -10.733
200 HE3 LYS 23 HE2 LYS 23 -10.922 13.127 -12.029
201 HZ1 LYS 23 HZ1 LYS 23 -9.260 14.178 -10.400
202 HZ2 LYS 23 HZ2 LYS 23 -9.858 12.627 -10.032
203 HZ3 LYS 23 HZ3 LYS 23 -10.411 14.002 -9.236
204 H ABA 24 HN AGL 24 -14.252 17.750 -11.135
205 HA ABA 24 HA AGL 24 -16.345 17.473 -10.569
206 HB3 ABA 24 HB2 AGL 24 -17.285 17.583 -8.263
207 HB2 ABA 24 HB1 AGL 24 -15.719 18.138 -7.645
208 HG3 ABA 24 HG AGL 24 -16.368 15.341 -8.904
Start of MODEL 18
1 H1 PHE 1 HN PHE 1 4.192 2.894 -6.118
2 HA PHE 1 HA PHE 1 6.299 2.863 -4.104
3 HB2 PHE 1 HB1 PHE 1 6.060 5.304 -3.695
4 HB3 PHE 1 HB2 PHE 1 6.536 4.966 -5.394
5 HD1 PHE 1 HD1 PHE 1 4.700 5.040 -7.220
6 HD2 PHE 1 HD2 PHE 1 4.109 6.565 -3.243
7 HE1 PHE 1 HE1 PHE 1 2.749 6.345 -8.005
8 HE2 PHE 1 HE2 PHE 1 2.163 7.872 -4.037
9 HZ PHE 1 HZ PHE 1 1.470 7.745 -6.413
10 H LEU 2 HN LEU 2 2.939 4.086 -4.463
11 HA LEU 2 HA LEU 2 2.183 2.402 -2.185
12 HB2 LEU 2 HB1 LEU 2 2.122 4.923 -1.678
13 HB3 LEU 2 HB2 LEU 2 1.013 5.122 -3.061
14 HG LEU 2 HG LEU 2 -0.626 3.555 -1.861
15 HD11 LEU 2 HD11 LEU 2 0.949 2.384 -0.298
16 HD12 LEU 2 HD12 LEU 2 -0.279 3.310 0.649
17 HD13 LEU 2 HD13 LEU 2 1.383 3.959 0.458
18 HD21 LEU 2 HD21 LEU 2 -1.416 5.297 -0.274
19 HD22 LEU 2 HD22 LEU 2 -0.845 6.056 -1.808
20 HD23 LEU 2 HD23 LEU 2 0.192 6.107 -0.336
21 HA PRO 3 HA PRO 3 -0.223 1.453 -5.904
22 HB2 PRO 3 HB1 PRO 3 -1.002 -1.075 -5.341
23 HB3 PRO 3 HB2 PRO 3 0.730 -0.636 -5.212
24 HG2 PRO 3 HG1 PRO 3 -1.258 -0.771 -2.865
25 HG3 PRO 3 HG2 PRO 3 0.351 -1.587 -3.023
26 HD2 PRO 3 HD1 PRO 3 -0.015 0.925 -1.799
27 HD3 PRO 3 HD2 PRO 3 1.515 0.415 -2.643
28 H ILE 4 HN ILE 4 -2.586 -0.449 -4.724
29 HA ILE 4 HA ILE 4 -4.674 1.093 -5.421
30 HB ILE 4 HB ILE 4 -6.144 -0.487 -4.265
31 HG12 ILE 4 HG11 ILE 4 -3.569 -1.793 -3.176
32 HG13 ILE 4 HG12 ILE 4 -4.715 -0.825 -2.191
33 HG21 ILE 4 HG21 ILE 4 -5.487 -2.413 -5.636
34 HG22 ILE 4 HG22 ILE 4 -5.125 -0.903 -6.533
35 HG23 ILE 4 HG23 ILE 4 -3.789 -1.833 -5.751
36 HD11 ILE 4 HD1 ILE 4 -5.205 -3.213 -1.877
37 HD12 ILE 4 HD2 ILE 4 -6.571 -2.435 -2.750
38 HD13 ILE 4 HD3 ILE 4 -5.396 -3.462 -3.649
39 H LEU 5 HN LEU 5 -3.141 1.363 -2.256
40 HA LEU 5 HA LEU 5 -5.369 2.367 -0.893
41 HB2 LEU 5 HB1 LEU 5 -2.417 2.988 -0.403
42 HB3 LEU 5 HB2 LEU 5 -3.759 3.204 0.765
43 HG LEU 5 HG LEU 5 -2.779 0.516 -0.390
44 HD11 LEU 5 HD11 LEU 5 -2.046 0.070 1.962
45 HD12 LEU 5 HD12 LEU 5 -2.518 1.743 2.423
46 HD13 LEU 5 HD13 LEU 5 -1.180 1.475 1.242
47 HD21 LEU 5 HD21 LEU 5 -5.202 0.331 0.061
48 HD22 LEU 5 HD22 LEU 5 -4.990 1.105 1.682
49 HD23 LEU 5 HD23 LEU 5 -4.287 -0.517 1.354
50 H ALA 6 HN ALA 6 -3.052 4.154 -2.975
51 HA ALA 6 HA ALA 6 -4.121 6.736 -2.456
52 HB1 ALA 6 HB1 ALA 6 -2.778 5.497 -4.956
53 HB2 ALA 6 HB2 ALA 6 -3.020 7.265 -4.689
54 HB3 ALA 6 HB3 ALA 6 -1.916 6.329 -3.621
55 H SER 7 HN SER 7 -4.875 4.221 -4.902
56 HA SER 7 HA SER 7 -6.919 5.571 -6.232
57 HB2 SER 7 HB1 SER 7 -6.742 2.525 -5.826
58 HB3 SER 7 HB2 SER 7 -7.533 3.385 -7.186
59 HG SER 7 HG1 SER 7 -5.499 3.944 -7.933
60 H LEU 8 HN LEU 8 -7.093 3.372 -3.398
61 HA LEU 8 HA LEU 8 -9.894 3.343 -3.209
62 HB2 LEU 8 HB1 LEU 8 -7.682 2.859 -1.156
63 HB3 LEU 8 HB2 LEU 8 -9.412 2.715 -0.727
64 HG LEU 8 HG LEU 8 -8.036 1.045 -2.898
65 HD11 LEU 8 HD11 LEU 8 -7.196 0.556 -0.585
66 HD12 LEU 8 HD12 LEU 8 -8.181 -0.812 -1.235
67 HD13 LEU 8 HD13 LEU 8 -8.889 0.317 -0.020
68 HD21 LEU 8 HD21 LEU 8 -10.499 1.289 -3.321
69 HD22 LEU 8 HD22 LEU 8 -10.832 0.814 -1.605
70 HD23 LEU 8 HD23 LEU 8 -10.103 -0.371 -2.746
71 H ALA 9 HN ALA 9 -7.509 5.561 -1.672
72 HA ALA 9 HA ALA 9 -9.364 7.005 -0.173
73 HB1 ALA 9 HB1 ALA 9 -7.616 8.823 -0.256
74 HB2 ALA 9 HB2 ALA 9 -6.874 7.210 0.041
75 HB3 ALA 9 HB3 ALA 9 -6.788 7.939 -1.598
76 H ALA 10 HN ALA 10 -8.251 7.502 -3.529
77 HA ALA 10 HA ALA 10 -10.017 9.557 -4.213
78 HB1 ALA 10 HB1 ALA 10 -9.419 8.639 -6.574
79 HB2 ALA 10 HB2 ALA 10 -7.999 8.962 -5.504
80 HB3 ALA 10 HB3 ALA 10 -8.591 7.284 -5.744
81 H LYS 11 HN LYS 11 -10.493 5.971 -4.710
82 HA LYS 11 HA LYS 11 -12.988 6.391 -5.970
83 HB2 LYS 11 HB1 LYS 11 -11.587 4.442 -6.400
84 HB3 LYS 11 HB2 LYS 11 -11.764 3.866 -4.723
85 HG2 LYS 11 HG1 LYS 11 -14.241 4.291 -6.476
86 HG3 LYS 11 HG2 LYS 11 -13.226 2.847 -6.757
87 HD2 LYS 11 HD1 LYS 11 -13.831 1.796 -4.775
88 HD3 LYS 11 HD2 LYS 11 -13.944 3.337 -3.889
89 HE2 LYS 11 HE1 LYS 11 -16.135 3.818 -5.250
90 HE3 LYS 11 HE2 LYS 11 -16.100 2.058 -5.677
91 HZ1 LYS 11 HZ1 LYS 11 -17.387 2.372 -3.704
92 HZ2 LYS 11 HZ2 LYS 11 -16.174 3.300 -2.970
93 HZ3 LYS 11 HZ3 LYS 11 -15.924 1.658 -3.212
94 H PHE 12 HN PHE 12 -12.284 5.534 -2.526
95 HA PHE 12 HA PHE 12 -15.164 5.276 -2.062
96 HB2 PHE 12 HB1 PHE 12 -12.645 4.659 -0.449
97 HB3 PHE 12 HB2 PHE 12 -14.163 4.996 0.446
98 HD1 PHE 12 HD1 PHE 12 -16.142 3.644 0.207
99 HD2 PHE 12 HD2 PHE 12 -12.474 2.582 -1.741
100 HE1 PHE 12 HE1 PHE 12 -16.975 1.329 -0.075
101 HE2 PHE 12 HE2 PHE 12 -13.307 0.259 -2.045
102 HZ PHE 12 HZ PHE 12 -15.557 -0.367 -1.204
103 H GLY 13 HN GLY 13 -12.675 7.698 -1.657
104 HA2 GLY 13 HA1 GLY 13 -14.728 9.429 -0.412
105 HA3 GLY 13 HA2 GLY 13 -12.961 9.698 -0.556
106 HA PRO 14 HA PRO 14 -14.590 11.032 -4.756
107 HB2 PRO 14 HB1 PRO 14 -17.258 11.936 -4.860
108 HB3 PRO 14 HB2 PRO 14 -16.744 10.275 -5.346
109 HG2 PRO 14 HG1 PRO 14 -17.866 11.142 -2.625
110 HG3 PRO 14 HG2 PRO 14 -18.380 9.743 -3.654
111 HD2 PRO 14 HD1 PRO 14 -16.618 9.395 -1.563
112 HD3 PRO 14 HD2 PRO 14 -16.361 8.507 -3.126
113 H LYS 15 HN LYS 15 -15.833 12.074 -1.670
114 HA LYS 15 HA LYS 15 -15.259 14.845 -1.818
115 HB2 LYS 15 HB1 LYS 15 -15.177 12.766 0.450
116 HB3 LYS 15 HB2 LYS 15 -14.842 14.487 0.765
117 HG2 LYS 15 HG1 LYS 15 -17.475 13.482 -0.470
118 HG3 LYS 15 HG2 LYS 15 -17.225 13.610 1.287
119 HD2 LYS 15 HD1 LYS 15 -17.030 15.933 -0.743
120 HD3 LYS 15 HD2 LYS 15 -18.450 15.579 0.270
121 HE2 LYS 15 HE1 LYS 15 -15.661 16.477 1.297
122 HE3 LYS 15 HE2 LYS 15 -17.148 17.490 1.182
123 HZ1 LYS 15 HZ1 LYS 15 -16.818 15.062 2.879
124 HZ2 LYS 15 HZ2 LYS 15 -18.219 16.007 2.768
125 HZ3 LYS 15 HZ3 LYS 15 -16.800 16.667 3.411
126 H LEU 16 HN LEU 16 -13.150 12.023 -0.928
127 HA LEU 16 HA LEU 16 -10.885 13.691 -0.450
128 HB2 LEU 16 HB1 LEU 16 -11.072 10.686 -0.947
129 HB3 LEU 16 HB2 LEU 16 -9.581 11.549 -0.470
130 HG LEU 16 HG LEU 16 -12.128 11.405 1.243
131 HD11 LEU 16 HD11 LEU 16 -9.435 9.919 1.484
132 HD12 LEU 16 HD12 LEU 16 -10.994 9.183 0.963
133 HD13 LEU 16 HD13 LEU 16 -10.808 9.817 2.644
134 HD21 LEU 16 HD21 LEU 16 -10.797 13.470 1.739
135 HD22 LEU 16 HD22 LEU 16 -9.295 12.479 1.858
136 HD23 LEU 16 HD23 LEU 16 -10.610 12.266 3.065
137 H PHE 17 HN PHE 17 -11.945 11.734 -3.284
138 HA PHE 17 HA PHE 17 -9.644 11.926 -4.706
139 HB2 PHE 17 HB1 PHE 17 -11.976 10.733 -5.169
140 HB3 PHE 17 HB2 PHE 17 -12.382 12.164 -6.138
141 HD1 PHE 17 HD1 PHE 17 -8.912 11.907 -6.827
142 HD2 PHE 17 HD2 PHE 17 -12.562 9.683 -7.387
143 HE1 PHE 17 HE1 PHE 17 -7.904 10.724 -8.708
144 HE2 PHE 17 HE2 PHE 17 -11.532 8.506 -9.309
145 HZ PHE 17 HZ PHE 17 -9.194 9.026 -9.968
146 H ABA 18 HN AGL 18 -12.385 14.288 -4.842
147 HA ABA 18 HA AGL 18 -11.007 15.862 -6.823
148 HB3 ABA 18 HB2 AGL 18 -12.870 17.521 -6.444
149 HB2 ABA 18 HB1 AGL 18 -13.478 16.498 -5.118
150 HG3 ABA 18 HG AGL 18 -13.921 14.587 -6.705
151 H LEU 19 HN LEU 19 -10.876 15.726 -3.340
152 HA LEU 19 HA LEU 19 -9.613 18.313 -3.118
153 HB2 LEU 19 HB1 LEU 19 -10.958 17.308 -1.252
154 HB3 LEU 19 HB2 LEU 19 -9.778 15.970 -1.144
155 HG LEU 19 HG LEU 19 -7.980 17.616 -0.524
156 HD11 LEU 19 HD11 LEU 19 -10.263 19.696 -0.550
157 HD12 LEU 19 HD12 LEU 19 -8.799 19.687 -1.610
158 HD13 LEU 19 HD13 LEU 19 -8.622 19.947 0.156
159 HD21 LEU 19 HD21 LEU 19 -10.508 17.771 1.233
160 HD22 LEU 19 HD22 LEU 19 -8.814 18.084 1.768
161 HD23 LEU 19 HD23 LEU 19 -9.293 16.432 1.231
162 H VAL 20 HN VAL 20 -8.504 14.888 -3.040
163 HA VAL 20 HA VAL 20 -5.763 15.462 -2.817
164 HB VAL 20 HB VAL 20 -7.279 12.984 -3.724
165 HG11 VAL 20 HG11 VAL 20 -4.998 12.861 -4.770
166 HG12 VAL 20 HG12 VAL 20 -4.241 13.361 -3.213
167 HG13 VAL 20 HG13 VAL 20 -5.064 11.767 -3.343
168 HG21 VAL 20 HG21 VAL 20 -5.724 13.728 -1.143
169 HG22 VAL 20 HG22 VAL 20 -7.516 13.719 -1.293
170 HG23 VAL 20 HG23 VAL 20 -6.588 12.178 -1.440
171 H THR 21 HN THR 21 -7.816 14.944 -5.757
172 HA THR 21 HA THR 21 -5.862 16.508 -7.132
173 HB THR 21 HB THR 21 -4.802 14.324 -7.378
174 HG1 THR 21 HG1 THR 21 -4.428 14.554 -9.487
175 HG21 THR 21 HG21 THR 21 -5.830 12.583 -8.825
176 HG22 THR 21 HG22 THR 21 -7.327 13.569 -9.018
177 HG23 THR 21 HG23 THR 21 -6.884 12.904 -7.401
178 H LYS 22 HN LYS 22 -6.483 17.301 -9.189
179 HA LYS 22 HA LYS 22 -9.255 18.020 -8.930
180 HB2 LYS 22 HB1 LYS 22 -8.722 19.680 -10.751
181 HB3 LYS 22 HB2 LYS 22 -7.677 19.802 -9.320
182 HG2 LYS 22 HG1 LYS 22 -5.780 19.019 -10.350
183 HG3 LYS 22 HG2 LYS 22 -6.621 18.025 -11.562
184 HD2 LYS 22 HD1 LYS 22 -6.917 21.071 -11.725
185 HD3 LYS 22 HD2 LYS 22 -5.364 20.316 -12.165
186 HE2 LYS 22 HE1 LYS 22 -6.660 20.603 -14.214
187 HE3 LYS 22 HE2 LYS 22 -6.447 18.846 -13.859
188 HZ1 LYS 22 HZ1 LYS 22 -8.688 19.335 -14.545
189 HZ2 LYS 22 HZ2 LYS 22 -8.894 20.461 -13.291
190 HZ3 LYS 22 HZ3 LYS 22 -8.676 18.823 -12.938
191 H LYS 23 HN LYS 23 -9.610 15.495 -9.654
192 HA LYS 23 HA LYS 23 -10.135 15.479 -12.552
193 HB2 LYS 23 HB1 LYS 23 -10.533 13.144 -12.406
194 HB3 LYS 23 HB2 LYS 23 -9.081 13.545 -11.478
195 HG2 LYS 23 HG1 LYS 23 -10.184 11.902 -10.242
196 HG3 LYS 23 HG2 LYS 23 -10.315 13.416 -9.321
197 HD2 LYS 23 HD1 LYS 23 -12.308 12.141 -9.055
198 HD3 LYS 23 HD2 LYS 23 -12.762 13.581 -9.967
199 HE2 LYS 23 HE1 LYS 23 -12.287 10.740 -11.172
200 HE3 LYS 23 HE2 LYS 23 -13.893 11.421 -10.698
201 HZ1 LYS 23 HZ1 LYS 23 -13.120 13.328 -12.292
202 HZ2 LYS 23 HZ2 LYS 23 -13.847 11.928 -12.912
203 HZ3 LYS 23 HZ3 LYS 23 -12.161 12.129 -12.958
204 H ABA 24 HN AGL 24 -11.589 16.855 -10.029
205 HA ABA 24 HA AGL 24 -14.345 16.461 -11.003
206 HB3 ABA 24 HB2 AGL 24 -14.980 17.810 -8.957
207 HB2 ABA 24 HB1 AGL 24 -13.251 17.904 -8.507
208 HG3 ABA 24 HG AGL 24 -14.722 15.172 -8.861
Start of MODEL 19
1 H1 PHE 1 HN PHE 1 3.312 2.143 -7.591
2 HA PHE 1 HA PHE 1 5.498 2.813 -5.802
3 HB2 PHE 1 HB1 PHE 1 4.515 4.288 -7.806
4 HB3 PHE 1 HB2 PHE 1 3.284 4.818 -6.614
5 HD1 PHE 1 HD1 PHE 1 4.596 5.357 -4.126
6 HD2 PHE 1 HD2 PHE 1 6.218 5.755 -8.092
7 HE1 PHE 1 HE1 PHE 1 6.204 7.015 -3.299
8 HE2 PHE 1 HE2 PHE 1 7.832 7.430 -7.256
9 HZ PHE 1 HZ PHE 1 7.832 8.064 -4.854
10 H LEU 2 HN LEU 2 1.912 3.200 -5.761
11 HA LEU 2 HA LEU 2 1.983 2.486 -2.900
12 HB2 LEU 2 HB1 LEU 2 -0.162 4.079 -4.473
13 HB3 LEU 2 HB2 LEU 2 -0.399 3.415 -2.835
14 HG LEU 2 HG LEU 2 -0.051 5.665 -2.489
15 HD11 LEU 2 HD11 LEU 2 2.744 4.463 -2.007
16 HD12 LEU 2 HD12 LEU 2 1.302 4.224 -0.945
17 HD13 LEU 2 HD13 LEU 2 2.004 5.869 -1.165
18 HD21 LEU 2 HD21 LEU 2 2.414 5.674 -4.324
19 HD22 LEU 2 HD22 LEU 2 1.752 7.073 -3.403
20 HD23 LEU 2 HD23 LEU 2 0.779 6.323 -4.724
21 HA PRO 3 HA PRO 3 -0.681 -0.665 -4.787
22 HB2 PRO 3 HB1 PRO 3 -1.783 -1.875 -2.567
23 HB3 PRO 3 HB2 PRO 3 -0.011 -1.944 -2.864
24 HG2 PRO 3 HG1 PRO 3 -1.478 0.069 -1.063
25 HG3 PRO 3 HG2 PRO 3 -0.102 -1.025 -0.616
26 HD2 PRO 3 HD1 PRO 3 0.257 1.611 -1.470
27 HD3 PRO 3 HD2 PRO 3 1.459 0.300 -1.865
28 H ILE 4 HN ILE 4 -3.246 -1.279 -3.771
29 HA ILE 4 HA ILE 4 -4.830 0.481 -5.012
30 HB ILE 4 HB ILE 4 -6.750 -0.605 -3.909
31 HG12 ILE 4 HG11 ILE 4 -4.625 -2.112 -2.250
32 HG13 ILE 4 HG12 ILE 4 -5.741 -0.863 -1.608
33 HG21 ILE 4 HG21 ILE 4 -5.528 -1.532 -5.915
34 HG22 ILE 4 HG22 ILE 4 -4.516 -2.544 -4.815
35 HG23 ILE 4 HG23 ILE 4 -6.292 -2.802 -4.906
36 HD11 ILE 4 HD1 ILE 4 -7.718 -2.289 -2.292
37 HD12 ILE 4 HD2 ILE 4 -6.579 -3.580 -2.822
38 HD13 ILE 4 HD3 ILE 4 -6.643 -3.093 -1.094
39 H LEU 5 HN LEU 5 -3.757 1.033 -1.737
40 HA LEU 5 HA LEU 5 -5.880 2.362 -0.653
41 HB2 LEU 5 HB1 LEU 5 -2.909 2.976 -0.232
42 HB3 LEU 5 HB2 LEU 5 -4.238 3.331 0.916
43 HG LEU 5 HG LEU 5 -3.303 0.521 0.049
44 HD11 LEU 5 HD11 LEU 5 -1.656 1.721 1.490
45 HD12 LEU 5 HD12 LEU 5 -2.432 0.347 2.365
46 HD13 LEU 5 HD13 LEU 5 -2.951 2.035 2.705
47 HD21 LEU 5 HD21 LEU 5 -5.436 1.364 2.111
48 HD22 LEU 5 HD22 LEU 5 -4.756 -0.292 1.938
49 HD23 LEU 5 HD23 LEU 5 -5.709 0.421 0.592
50 H ALA 6 HN ALA 6 -3.399 3.880 -2.786
51 HA ALA 6 HA ALA 6 -4.369 6.529 -2.513
52 HB1 ALA 6 HB1 ALA 6 -2.146 5.931 -3.521
53 HB2 ALA 6 HB2 ALA 6 -2.983 5.086 -4.872
54 HB3 ALA 6 HB3 ALA 6 -3.132 6.876 -4.693
55 H SER 7 HN SER 7 -5.225 3.919 -4.848
56 HA SER 7 HA SER 7 -7.213 5.376 -6.208
57 HB2 SER 7 HB1 SER 7 -6.974 2.332 -5.857
58 HB3 SER 7 HB2 SER 7 -7.970 3.192 -7.089
59 HG SER 7 HG1 SER 7 -5.912 2.503 -7.888
60 H LEU 8 HN LEU 8 -7.361 3.310 -3.282
61 HA LEU 8 HA LEU 8 -10.183 3.355 -3.082
62 HB2 LEU 8 HB1 LEU 8 -8.044 3.021 -0.921
63 HB3 LEU 8 HB2 LEU 8 -9.797 2.894 -0.595
64 HG LEU 8 HG LEU 8 -8.240 1.058 -2.493
65 HD11 LEU 8 HD11 LEU 8 -7.676 0.781 -0.052
66 HD12 LEU 8 HD12 LEU 8 -8.572 -0.648 -0.702
67 HD13 LEU 8 HD13 LEU 8 -9.424 0.567 0.319
68 HD21 LEU 8 HD21 LEU 8 -11.169 0.954 -1.508
69 HD22 LEU 8 HD22 LEU 8 -10.334 -0.345 -2.429
70 HD23 LEU 8 HD23 LEU 8 -10.633 1.249 -3.211
71 H ALA 9 HN ALA 9 -7.722 5.616 -1.750
72 HA ALA 9 HA ALA 9 -9.538 7.317 -0.482
73 HB1 ALA 9 HB1 ALA 9 -6.894 7.972 -1.934
74 HB2 ALA 9 HB2 ALA 9 -7.719 9.039 -0.736
75 HB3 ALA 9 HB3 ALA 9 -7.045 7.449 -0.222
76 H ALA 10 HN ALA 10 -8.348 7.343 -3.869
77 HA ALA 10 HA ALA 10 -9.948 9.427 -4.785
78 HB1 ALA 10 HB1 ALA 10 -8.857 6.885 -6.159
79 HB2 ALA 10 HB2 ALA 10 -9.485 8.318 -7.035
80 HB3 ALA 10 HB3 ALA 10 -8.006 8.463 -6.006
81 H LYS 11 HN LYS 11 -10.782 5.878 -4.825
82 HA LYS 11 HA LYS 11 -13.302 6.425 -6.066
83 HB2 LYS 11 HB1 LYS 11 -12.371 4.268 -6.475
84 HB3 LYS 11 HB2 LYS 11 -12.002 4.021 -4.749
85 HG2 LYS 11 HG1 LYS 11 -13.784 2.507 -5.398
86 HG3 LYS 11 HG2 LYS 11 -14.359 3.683 -4.190
87 HD2 LYS 11 HD1 LYS 11 -15.044 4.913 -6.650
88 HD3 LYS 11 HD2 LYS 11 -15.283 3.184 -7.003
89 HE2 LYS 11 HE1 LYS 11 -16.629 4.916 -4.802
90 HE3 LYS 11 HE2 LYS 11 -17.414 4.133 -6.223
91 HZ1 LYS 11 HZ1 LYS 11 -16.166 2.771 -3.883
92 HZ2 LYS 11 HZ2 LYS 11 -16.827 1.977 -5.228
93 HZ3 LYS 11 HZ3 LYS 11 -17.817 2.912 -4.210
94 H PHE 12 HN PHE 12 -12.498 5.709 -2.589
95 HA PHE 12 HA PHE 12 -15.399 5.839 -2.069
96 HB2 PHE 12 HB1 PHE 12 -12.995 4.696 -0.544
97 HB3 PHE 12 HB2 PHE 12 -14.553 5.019 0.296
98 HD1 PHE 12 HD1 PHE 12 -16.659 4.009 -0.494
99 HD2 PHE 12 HD2 PHE 12 -12.829 2.726 -1.929
100 HE1 PHE 12 HE1 PHE 12 -17.653 1.847 -1.179
101 HE2 PHE 12 HE2 PHE 12 -13.818 0.562 -2.640
102 HZ PHE 12 HZ PHE 12 -16.230 0.116 -2.254
103 H GLY 13 HN GLY 13 -12.671 7.858 -1.878
104 HA2 GLY 13 HA1 GLY 13 -14.349 9.748 -0.341
105 HA3 GLY 13 HA2 GLY 13 -12.606 9.884 -0.752
106 HA PRO 14 HA PRO 14 -14.807 11.325 -4.647
107 HB2 PRO 14 HB1 PRO 14 -17.415 12.317 -4.320
108 HB3 PRO 14 HB2 PRO 14 -17.051 10.649 -4.903
109 HG2 PRO 14 HG1 PRO 14 -17.698 11.504 -2.028
110 HG3 PRO 14 HG2 PRO 14 -18.427 10.146 -2.982
111 HD2 PRO 14 HD1 PRO 14 -16.373 9.690 -1.199
112 HD3 PRO 14 HD2 PRO 14 -16.406 8.821 -2.794
113 H LYS 15 HN LYS 15 -15.516 12.328 -1.352
114 HA LYS 15 HA LYS 15 -14.819 15.071 -1.610
115 HB2 LYS 15 HB1 LYS 15 -14.272 13.117 0.723
116 HB3 LYS 15 HB2 LYS 15 -14.150 14.899 0.811
117 HG2 LYS 15 HG1 LYS 15 -16.607 15.096 0.404
118 HG3 LYS 15 HG2 LYS 15 -16.745 13.305 0.366
119 HD2 LYS 15 HD1 LYS 15 -15.762 13.190 2.682
120 HD3 LYS 15 HD2 LYS 15 -15.634 14.977 2.710
121 HE2 LYS 15 HE1 LYS 15 -18.151 15.166 2.573
122 HE3 LYS 15 HE2 LYS 15 -18.276 13.361 2.562
123 HZ1 LYS 15 HZ1 LYS 15 -17.083 15.024 4.739
124 HZ2 LYS 15 HZ2 LYS 15 -17.190 13.337 4.732
125 HZ3 LYS 15 HZ3 LYS 15 -18.597 14.273 4.772
126 H LEU 16 HN LEU 16 -12.794 12.127 -0.961
127 HA LEU 16 HA LEU 16 -10.414 13.657 -0.751
128 HB2 LEU 16 HB1 LEU 16 -10.743 10.662 -1.109
129 HB3 LEU 16 HB2 LEU 16 -9.200 11.493 -0.763
130 HG LEU 16 HG LEU 16 -11.640 11.532 1.105
131 HD11 LEU 16 HD11 LEU 16 -9.022 9.908 1.246
132 HD12 LEU 16 HD12 LEU 16 -10.650 9.244 0.852
133 HD13 LEU 16 HD13 LEU 16 -10.322 9.929 2.490
134 HD21 LEU 16 HD21 LEU 16 -9.971 12.382 2.796
135 HD22 LEU 16 HD22 LEU 16 -10.178 13.539 1.432
136 HD23 LEU 16 HD23 LEU 16 -8.724 12.476 1.505
137 H PHE 17 HN PHE 17 -11.759 11.748 -3.541
138 HA PHE 17 HA PHE 17 -9.487 12.121 -5.060
139 HB2 PHE 17 HB1 PHE 17 -11.744 10.740 -5.507
140 HB3 PHE 17 HB2 PHE 17 -12.218 12.149 -6.483
141 HD1 PHE 17 HD1 PHE 17 -8.579 11.750 -6.815
142 HD2 PHE 17 HD2 PHE 17 -12.340 10.023 -8.020
143 HE1 PHE 17 HE1 PHE 17 -7.443 10.520 -8.557
144 HE2 PHE 17 HE2 PHE 17 -11.183 8.797 -9.824
145 HZ PHE 17 HZ PHE 17 -8.714 8.977 -10.058
146 H ABA 18 HN AGL 18 -12.277 14.282 -4.687
147 HA ABA 18 HA AGL 18 -11.436 16.274 -6.497
148 HB3 ABA 18 HB2 AGL 18 -13.172 16.234 -3.971
149 HB2 ABA 18 HB1 AGL 18 -13.760 16.006 -5.623
150 HG3 ABA 18 HG AGL 18 -13.884 18.409 -4.178
151 H LEU 19 HN LEU 19 -10.734 15.752 -2.991
152 HA LEU 19 HA LEU 19 -9.168 18.092 -2.774
153 HB2 LEU 19 HB1 LEU 19 -10.264 16.912 -0.861
154 HB3 LEU 19 HB2 LEU 19 -9.130 15.543 -1.077
155 HG LEU 19 HG LEU 19 -7.203 17.054 -0.538
156 HD11 LEU 19 HD11 LEU 19 -9.370 19.197 -0.038
157 HD12 LEU 19 HD12 LEU 19 -8.057 19.255 -1.279
158 HD13 LEU 19 HD13 LEU 19 -7.642 19.319 0.466
159 HD21 LEU 19 HD21 LEU 19 -9.456 17.097 1.564
160 HD22 LEU 19 HD22 LEU 19 -7.693 17.301 1.884
161 HD23 LEU 19 HD23 LEU 19 -8.315 15.730 1.254
162 H VAL 20 HN VAL 20 -8.119 14.678 -3.353
163 HA VAL 20 HA VAL 20 -5.356 15.599 -3.344
164 HB VAL 20 HB VAL 20 -4.621 13.396 -3.150
165 HG11 VAL 20 HG11 VAL 20 -5.596 14.502 -1.110
166 HG12 VAL 20 HG12 VAL 20 -7.174 13.689 -1.433
167 HG13 VAL 20 HG13 VAL 20 -5.716 12.704 -1.055
168 HG21 VAL 20 HG21 VAL 20 -7.490 12.468 -3.844
169 HG22 VAL 20 HG22 VAL 20 -5.982 12.170 -4.785
170 HG23 VAL 20 HG23 VAL 20 -6.196 11.410 -3.175
171 H THR 21 HN THR 21 -7.628 15.460 -5.771
172 HA THR 21 HA THR 21 -5.517 15.536 -7.725
173 HB THR 21 HB THR 21 -7.758 13.476 -8.084
174 HG1 THR 21 HG1 THR 21 -5.417 13.247 -6.904
175 HG21 THR 21 HG21 THR 21 -7.021 14.412 -10.310
176 HG22 THR 21 HG22 THR 21 -6.332 12.763 -10.089
177 HG23 THR 21 HG23 THR 21 -5.287 14.197 -9.824
178 H LYS 22 HN LYS 22 -6.303 16.675 -9.739
179 HA LYS 22 HA LYS 22 -8.732 18.143 -9.264
180 HB2 LYS 22 HB1 LYS 22 -8.413 19.139 -11.469
181 HB3 LYS 22 HB2 LYS 22 -7.003 19.323 -10.400
182 HG2 LYS 22 HG1 LYS 22 -5.627 17.895 -11.642
183 HG3 LYS 22 HG2 LYS 22 -6.982 16.995 -12.384
184 HD2 LYS 22 HD1 LYS 22 -6.342 19.934 -13.037
185 HD3 LYS 22 HD2 LYS 22 -5.690 18.530 -13.945
186 HE2 LYS 22 HE1 LYS 22 -8.030 17.786 -14.526
187 HE3 LYS 22 HE2 LYS 22 -8.702 19.223 -13.667
188 HZ1 LYS 22 HZ1 LYS 22 -8.528 19.590 -16.031
189 HZ2 LYS 22 HZ2 LYS 22 -6.862 19.294 -16.018
190 HZ3 LYS 22 HZ3 LYS 22 -7.491 20.642 -15.208
191 H LYS 23 HN LYS 23 -9.933 16.000 -8.949
192 HA LYS 23 HA LYS 23 -11.442 15.452 -11.450
193 HB2 LYS 23 HB1 LYS 23 -11.251 13.758 -8.891
194 HB3 LYS 23 HB2 LYS 23 -12.191 13.334 -10.354
195 HG2 LYS 23 HG1 LYS 23 -9.128 13.601 -10.165
196 HG3 LYS 23 HG2 LYS 23 -10.064 12.073 -10.098
197 HD2 LYS 23 HD1 LYS 23 -10.842 12.369 -12.430
198 HD3 LYS 23 HD2 LYS 23 -10.126 14.002 -12.512
199 HE2 LYS 23 HE1 LYS 23 -8.704 12.351 -13.734
200 HE3 LYS 23 HE2 LYS 23 -7.828 13.115 -12.347
201 HZ1 LYS 23 HZ1 LYS 23 -8.435 11.167 -11.020
202 HZ2 LYS 23 HZ2 LYS 23 -7.457 10.763 -12.350
203 HZ3 LYS 23 HZ3 LYS 23 -9.125 10.437 -12.378
204 H ABA 24 HN AGL 24 -11.421 17.618 -9.273
205 HA ABA 24 HA AGL 24 -13.886 17.187 -7.858
206 HB3 ABA 24 HB2 AGL 24 -12.189 19.748 -7.822
207 HB2 ABA 24 HB1 AGL 24 -11.484 18.276 -7.171
208 HG3 ABA 24 HG AGL 24 -13.510 20.007 -5.861
Start of MODEL 20
1 H1 PHE 1 HN PHE 1 1.141 -1.354 2.404
2 HA PHE 1 HA PHE 1 2.110 -0.312 -0.139
3 HB2 PHE 1 HB1 PHE 1 3.707 -1.458 1.631
4 HB3 PHE 1 HB2 PHE 1 2.981 -3.014 1.099
5 HD1 PHE 1 HD1 PHE 1 3.080 -3.541 -1.463
6 HD2 PHE 1 HD2 PHE 1 5.362 -0.411 0.384
7 HE1 PHE 1 HE1 PHE 1 4.517 -3.407 -3.473
8 HE2 PHE 1 HE2 PHE 1 6.831 -0.302 -1.608
9 HZ PHE 1 HZ PHE 1 6.400 -1.796 -3.550
10 H LEU 2 HN LEU 2 0.022 -0.537 -1.322
11 HA LEU 2 HA LEU 2 -0.080 -3.196 -2.435
12 HB2 LEU 2 HB1 LEU 2 -1.697 -2.710 -0.289
13 HB3 LEU 2 HB2 LEU 2 -2.753 -2.014 -1.530
14 HG LEU 2 HG LEU 2 -2.809 -4.218 -2.711
15 HD11 LEU 2 HD11 LEU 2 -1.091 -5.201 -0.339
16 HD12 LEU 2 HD12 LEU 2 -0.586 -5.196 -2.067
17 HD13 LEU 2 HD13 LEU 2 -1.928 -6.272 -1.528
18 HD21 LEU 2 HD21 LEU 2 -3.411 -4.423 0.316
19 HD22 LEU 2 HD22 LEU 2 -4.189 -5.384 -0.996
20 HD23 LEU 2 HD23 LEU 2 -4.468 -3.606 -0.883
21 HA PRO 3 HA PRO 3 -0.851 -0.496 -5.902
22 HB2 PRO 3 HB1 PRO 3 -1.842 -2.326 -7.835
23 HB3 PRO 3 HB2 PRO 3 -0.107 -2.205 -7.362
24 HG2 PRO 3 HG1 PRO 3 -2.204 -4.161 -6.264
25 HG3 PRO 3 HG2 PRO 3 -0.544 -4.533 -6.876
26 HD2 PRO 3 HD1 PRO 3 -1.020 -4.248 -4.192
27 HD3 PRO 3 HD2 PRO 3 0.483 -3.526 -4.921
28 H ILE 4 HN ILE 4 -3.521 -2.756 -5.088
29 HA ILE 4 HA ILE 4 -5.594 -1.278 -6.116
30 HB ILE 4 HB ILE 4 -7.162 -2.448 -4.822
31 HG12 ILE 4 HG11 ILE 4 -4.823 -3.685 -3.269
32 HG13 ILE 4 HG12 ILE 4 -5.912 -2.410 -2.622
33 HG21 ILE 4 HG21 ILE 4 -4.893 -4.330 -5.763
34 HG22 ILE 4 HG22 ILE 4 -6.641 -4.712 -5.623
35 HG23 ILE 4 HG23 ILE 4 -6.098 -3.515 -6.836
36 HD11 ILE 4 HD1 ILE 4 -6.681 -4.585 -1.792
37 HD12 ILE 4 HD2 ILE 4 -7.896 -3.958 -2.959
38 HD13 ILE 4 HD3 ILE 4 -6.760 -5.266 -3.452
39 H LEU 5 HN LEU 5 -3.683 -0.206 -3.478
40 HA LEU 5 HA LEU 5 -5.481 1.248 -1.946
41 HB2 LEU 5 HB1 LEU 5 -2.623 1.867 -2.875
42 HB3 LEU 5 HB2 LEU 5 -3.488 2.904 -1.698
43 HG LEU 5 HG LEU 5 -2.703 -0.019 -1.278
44 HD11 LEU 5 HD11 LEU 5 -1.719 2.631 -0.053
45 HD12 LEU 5 HD12 LEU 5 -0.829 1.613 -1.241
46 HD13 LEU 5 HD13 LEU 5 -1.156 0.985 0.421
47 HD21 LEU 5 HD21 LEU 5 -4.793 0.315 -0.061
48 HD22 LEU 5 HD22 LEU 5 -4.245 1.926 0.550
49 HD23 LEU 5 HD23 LEU 5 -3.447 0.416 1.122
50 H ALA 6 HN ALA 6 -4.236 2.038 -5.181
51 HA ALA 6 HA ALA 6 -5.098 4.703 -5.305
52 HB1 ALA 6 HB1 ALA 6 -5.052 4.284 -7.802
53 HB2 ALA 6 HB2 ALA 6 -3.603 3.572 -7.000
54 HB3 ALA 6 HB3 ALA 6 -4.967 2.510 -7.488
55 H SER 7 HN SER 7 -6.896 1.617 -5.840
56 HA SER 7 HA SER 7 -9.334 2.834 -6.574
57 HB2 SER 7 HB1 SER 7 -9.006 0.120 -5.178
58 HB3 SER 7 HB2 SER 7 -10.412 0.682 -6.133
59 HG SER 7 HG1 SER 7 -9.091 0.637 -7.976
60 H LEU 8 HN LEU 8 -7.915 2.048 -3.347
61 HA LEU 8 HA LEU 8 -10.356 2.507 -1.986
62 HB2 LEU 8 HB1 LEU 8 -7.536 2.851 -0.868
63 HB3 LEU 8 HB2 LEU 8 -9.053 2.759 0.076
64 HG LEU 8 HG LEU 8 -7.792 0.512 -1.590
65 HD11 LEU 8 HD11 LEU 8 -8.290 0.761 1.447
66 HD12 LEU 8 HD12 LEU 8 -6.719 1.096 0.644
67 HD13 LEU 8 HD13 LEU 8 -7.422 -0.567 0.600
68 HD21 LEU 8 HD21 LEU 8 -10.266 0.254 -1.736
69 HD22 LEU 8 HD22 LEU 8 -10.407 0.475 0.057
70 HD23 LEU 8 HD23 LEU 8 -9.574 -0.971 -0.614
71 H ALA 9 HN ALA 9 -7.655 4.758 -2.752
72 HA ALA 9 HA ALA 9 -9.086 6.970 -1.635
73 HB1 ALA 9 HB1 ALA 9 -6.612 6.889 -1.750
74 HB2 ALA 9 HB2 ALA 9 -6.690 6.872 -3.550
75 HB3 ALA 9 HB3 ALA 9 -7.251 8.325 -2.627
76 H ALA 10 HN ALA 10 -9.194 5.460 -4.853
77 HA ALA 10 HA ALA 10 -10.533 7.748 -5.993
78 HB1 ALA 10 HB1 ALA 10 -10.184 4.857 -6.985
79 HB2 ALA 10 HB2 ALA 10 -10.754 6.253 -7.985
80 HB3 ALA 10 HB3 ALA 10 -9.080 6.229 -7.324
81 H LYS 11 HN LYS 11 -11.623 4.692 -4.485
82 HA LYS 11 HA LYS 11 -14.387 5.223 -5.280
83 HB2 LYS 11 HB1 LYS 11 -13.219 2.998 -5.511
84 HB3 LYS 11 HB2 LYS 11 -13.078 2.895 -3.743
85 HG2 LYS 11 HG1 LYS 11 -15.742 2.896 -5.338
86 HG3 LYS 11 HG2 LYS 11 -14.829 1.457 -4.795
87 HD2 LYS 11 HD1 LYS 11 -14.987 2.608 -2.399
88 HD3 LYS 11 HD2 LYS 11 -16.399 3.445 -3.123
89 HE2 LYS 11 HE1 LYS 11 -17.479 1.199 -3.581
90 HE3 LYS 11 HE2 LYS 11 -16.031 0.375 -2.868
91 HZ1 LYS 11 HZ1 LYS 11 -17.772 0.649 -1.221
92 HZ2 LYS 11 HZ2 LYS 11 -17.794 2.331 -1.476
93 HZ3 LYS 11 HZ3 LYS 11 -16.423 1.600 -0.826
94 H PHE 12 HN PHE 12 -12.351 5.269 -2.298
95 HA PHE 12 HA PHE 12 -14.736 6.161 -0.804
96 HB2 PHE 12 HB1 PHE 12 -12.087 4.997 0.244
97 HB3 PHE 12 HB2 PHE 12 -13.438 5.592 1.253
98 HD1 PHE 12 HD1 PHE 12 -15.420 4.277 1.605
99 HD2 PHE 12 HD2 PHE 12 -12.287 2.857 -0.950
100 HE1 PHE 12 HE1 PHE 12 -16.258 1.967 1.874
101 HE2 PHE 12 HE2 PHE 12 -13.133 0.541 -0.711
102 HZ PHE 12 HZ PHE 12 -15.099 0.084 0.732
103 H GLY 13 HN GLY 13 -12.446 7.590 -2.622
104 HA2 GLY 13 HA1 GLY 13 -12.440 9.938 -0.823
105 HA3 GLY 13 HA2 GLY 13 -10.927 9.324 -1.560
106 HA PRO 14 HA PRO 14 -12.945 10.741 -5.472
107 HB2 PRO 14 HB1 PRO 14 -15.545 11.733 -5.660
108 HB3 PRO 14 HB2 PRO 14 -15.200 9.963 -5.625
109 HG2 PRO 14 HG1 PRO 14 -15.901 11.752 -3.222
110 HG3 PRO 14 HG2 PRO 14 -16.731 10.222 -3.738
111 HD2 PRO 14 HD1 PRO 14 -14.751 10.154 -1.816
112 HD3 PRO 14 HD2 PRO 14 -14.812 8.877 -3.110
113 H LYS 15 HN LYS 15 -13.567 12.623 -2.597
114 HA LYS 15 HA LYS 15 -13.610 15.197 -3.793
115 HB2 LYS 15 HB1 LYS 15 -12.456 14.398 -1.037
116 HB3 LYS 15 HB2 LYS 15 -12.697 16.066 -1.619
117 HG2 LYS 15 HG1 LYS 15 -14.480 15.885 -0.299
118 HG3 LYS 15 HG2 LYS 15 -15.227 15.452 -1.865
119 HD2 LYS 15 HD1 LYS 15 -15.204 13.067 -1.293
120 HD3 LYS 15 HD2 LYS 15 -14.157 13.333 0.129
121 HE2 LYS 15 HE1 LYS 15 -17.041 14.434 -0.144
122 HE3 LYS 15 HE2 LYS 15 -16.606 12.893 0.701
123 HZ1 LYS 15 HZ1 LYS 15 -16.800 14.754 2.231
124 HZ2 LYS 15 HZ2 LYS 15 -15.587 15.606 1.414
125 HZ3 LYS 15 HZ3 LYS 15 -15.218 14.159 2.207
126 H LEU 16 HN LEU 16 -10.835 13.191 -2.563
127 HA LEU 16 HA LEU 16 -8.930 15.206 -3.087
128 HB2 LEU 16 HB1 LEU 16 -8.566 12.173 -2.890
129 HB3 LEU 16 HB2 LEU 16 -7.236 13.375 -2.910
130 HG LEU 16 HG LEU 16 -9.422 13.233 -0.754
131 HD11 LEU 16 HD11 LEU 16 -7.934 11.220 -0.769
132 HD12 LEU 16 HD12 LEU 16 -7.644 12.252 0.683
133 HD13 LEU 16 HD13 LEU 16 -6.487 12.291 -0.697
134 HD21 LEU 16 HD21 LEU 16 -8.464 15.544 -0.950
135 HD22 LEU 16 HD22 LEU 16 -6.796 14.860 -0.880
136 HD23 LEU 16 HD23 LEU 16 -7.881 14.732 0.546
137 H PHE 17 HN PHE 17 -10.153 12.498 -5.012
138 HA PHE 17 HA PHE 17 -8.471 12.869 -7.193
139 HB2 PHE 17 HB1 PHE 17 -10.051 10.933 -6.460
140 HB3 PHE 17 HB2 PHE 17 -11.368 11.815 -7.292
141 HD1 PHE 17 HD1 PHE 17 -8.400 12.356 -9.295
142 HD2 PHE 17 HD2 PHE 17 -11.201 9.287 -8.120
143 HE1 PHE 17 HE1 PHE 17 -7.798 11.052 -11.256
144 HE2 PHE 17 HE2 PHE 17 -10.578 7.979 -10.124
145 HZ PHE 17 HZ PHE 17 -8.873 8.859 -11.697
146 H ABA 18 HN AGL 18 -11.730 14.381 -6.581
147 HA ABA 18 HA AGL 18 -11.601 15.826 -9.062
148 HB3 ABA 18 HB2 AGL 18 -13.613 17.078 -8.122
149 HB2 ABA 18 HB1 AGL 18 -13.478 16.047 -6.663
150 HG3 ABA 18 HG AGL 18 -13.611 13.963 -8.297
151 H LEU 19 HN LEU 19 -10.381 16.633 -5.810
152 HA LEU 19 HA LEU 19 -9.938 19.401 -6.604
153 HB2 LEU 19 HB1 LEU 19 -9.247 17.716 -4.175
154 HB3 LEU 19 HB2 LEU 19 -8.384 19.259 -4.462
155 HG LEU 19 HG LEU 19 -10.444 20.545 -4.455
156 HD11 LEU 19 HD11 LEU 19 -12.155 18.886 -5.217
157 HD12 LEU 19 HD12 LEU 19 -12.606 19.635 -3.642
158 HD13 LEU 19 HD13 LEU 19 -11.935 17.969 -3.675
159 HD21 LEU 19 HD21 LEU 19 -9.148 20.215 -2.372
160 HD22 LEU 19 HD22 LEU 19 -10.041 18.689 -2.022
161 HD23 LEU 19 HD23 LEU 19 -10.907 20.270 -1.979
162 H VAL 20 HN VAL 20 -7.810 16.454 -6.241
163 HA VAL 20 HA VAL 20 -5.423 17.796 -6.767
164 HB VAL 20 HB VAL 20 -6.256 14.887 -7.079
165 HG11 VAL 20 HG11 VAL 20 -3.467 16.113 -7.656
166 HG12 VAL 20 HG12 VAL 20 -3.766 14.365 -7.341
167 HG13 VAL 20 HG13 VAL 20 -4.475 15.136 -8.788
168 HG21 VAL 20 HG21 VAL 20 -5.979 15.880 -4.751
169 HG22 VAL 20 HG22 VAL 20 -4.738 14.622 -5.111
170 HG23 VAL 20 HG23 VAL 20 -4.294 16.365 -5.186
171 H THR 21 HN THR 21 -7.481 15.946 -9.100
172 HA THR 21 HA THR 21 -5.908 17.214 -11.237
173 HB THR 21 HB THR 21 -7.423 15.823 -12.796
174 HG1 THR 21 HG1 THR 21 -8.710 15.091 -10.801
175 HG21 THR 21 HG21 THR 21 -5.838 13.938 -12.535
176 HG22 THR 21 HG22 THR 21 -5.321 14.569 -10.929
177 HG23 THR 21 HG23 THR 21 -4.982 15.520 -12.426
178 H LYS 22 HN LYS 22 -8.232 18.431 -9.415
179 HA LYS 22 HA LYS 22 -9.891 19.898 -9.628
180 HB2 LYS 22 HB1 LYS 22 -7.771 21.069 -10.401
181 HB3 LYS 22 HB2 LYS 22 -8.354 20.800 -12.078
182 HG2 LYS 22 HG1 LYS 22 -10.585 21.994 -10.811
183 HG3 LYS 22 HG2 LYS 22 -9.241 22.810 -9.988
184 HD2 LYS 22 HD1 LYS 22 -10.002 22.702 -12.970
185 HD3 LYS 22 HD2 LYS 22 -9.927 24.146 -11.932
186 HE2 LYS 22 HE1 LYS 22 -7.579 22.519 -13.144
187 HE3 LYS 22 HE2 LYS 22 -8.039 24.227 -13.499
188 HZ1 LYS 22 HZ1 LYS 22 -6.150 24.032 -11.983
189 HZ2 LYS 22 HZ2 LYS 22 -7.120 23.172 -10.882
190 HZ3 LYS 22 HZ3 LYS 22 -7.478 24.795 -11.230
191 H LYS 23 HN LYS 23 -11.136 17.789 -10.387
192 HA LYS 23 HA LYS 23 -12.415 18.295 -13.013
193 HB2 LYS 23 HB1 LYS 23 -11.930 15.498 -11.840
194 HB3 LYS 23 HB2 LYS 23 -12.698 15.896 -13.419
195 HG2 LYS 23 HG1 LYS 23 -10.398 17.030 -14.024
196 HG3 LYS 23 HG2 LYS 23 -9.789 16.206 -12.573
197 HD2 LYS 23 HD1 LYS 23 -9.202 14.683 -14.260
198 HD3 LYS 23 HD2 LYS 23 -10.664 13.982 -13.537
199 HE2 LYS 23 HE1 LYS 23 -10.780 13.736 -15.986
200 HE3 LYS 23 HE2 LYS 23 -12.040 14.929 -15.484
201 HZ1 LYS 23 HZ1 LYS 23 -10.831 15.720 -17.388
202 HZ2 LYS 23 HZ2 LYS 23 -9.342 15.538 -16.602
203 HZ3 LYS 23 HZ3 LYS 23 -10.448 16.694 -16.053
204 H ABA 24 HN AGL 24 -14.327 16.067 -12.490
205 HA ABA 24 HA AGL 24 -16.331 15.769 -11.671
206 HB3 ABA 24 HB2 AGL 24 -16.913 16.222 -9.301
207 HB2 ABA 24 HB1 AGL 24 -15.451 17.223 -9.119
208 HG3 ABA 24 HG AGL 24 -15.498 14.148 -9.722