NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
15393 |
1y4e   |
6446 | cing | 1-original | 2 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H PHE 155 HT1 PHE 155 -3.892 4.181 -16.540
2 2H PHE 155 HT2 PHE 155 -2.378 4.368 -17.326
3 3H PHE 155 HT3 PHE 155 -2.451 4.254 -15.615
4 HA PHE 155 HA PHE 155 -2.913 2.179 -17.631
5 1HB PHE 155 HB2 PHE 155 -1.217 2.197 -15.130
6 2HB PHE 155 HB1 PHE 155 -1.145 1.056 -16.468
7 HD1 PHE 155 HD1 PHE 155 0.423 3.786 -15.023
8 HD2 PHE 155 HD2 PHE 155 -0.703 2.248 -18.827
9 HE1 PHE 155 HE1 PHE 155 2.164 5.160 -16.089
10 HE2 PHE 155 HE2 PHE 155 1.036 3.618 -19.901
11 HZ PHE 155 HZ PHE 155 2.473 5.076 -18.531
12 H LEU 156 HN LEU 156 -3.209 -0.009 -16.431
13 HA LEU 156 HA LEU 156 -4.668 0.008 -13.994
14 1HB LEU 156 HB2 LEU 156 -6.832 -0.623 -14.819
15 2HB LEU 156 HB1 LEU 156 -6.363 0.899 -15.549
16 HG LEU 156 HG LEU 156 -5.493 -0.947 -17.392
17 1HD1 LEU 156 HD11 LEU 156 -6.940 -2.549 -15.899
18 2HD1 LEU 156 HD12 LEU 156 -6.986 -2.659 -17.659
19 3HD1 LEU 156 HD13 LEU 156 -8.273 -1.818 -16.795
20 1HD2 LEU 156 HD21 LEU 156 -6.513 1.069 -18.061
21 2HD2 LEU 156 HD22 LEU 156 -8.006 0.688 -17.202
22 3HD2 LEU 156 HD23 LEU 156 -7.566 -0.216 -18.651
23 H GLN 157 HN GLN 157 -3.428 -1.650 -13.269
24 HA GLN 157 HA GLN 157 -4.097 -4.283 -14.043
25 1HB GLN 157 HB2 GLN 157 -1.983 -5.035 -14.973
26 2HB GLN 157 HB1 GLN 157 -2.648 -3.740 -15.959
27 1HG GLN 157 HG2 GLN 157 -0.667 -2.762 -15.821
28 2HG GLN 157 HG1 GLN 157 -1.039 -2.429 -14.130
29 1HE2 GLN 157 HE21 GLN 157 0.605 -4.584 -16.332
30 2HE2 GLN 157 HE22 GLN 157 1.658 -5.294 -15.161
31 H SER 158 HN SER 158 -1.938 -2.111 -12.352
32 HA SER 158 HA SER 158 -0.823 -4.088 -10.625
33 1HB SER 158 HB2 SER 158 0.125 -1.752 -11.218
34 2HB SER 158 HB1 SER 158 -0.976 -1.151 -9.967
35 HG SER 158 HG SER 158 1.415 -2.239 -9.648
36 H ASP 159 HN ASP 159 -3.217 -4.868 -10.378
37 HA ASP 159 HA ASP 159 -4.798 -5.433 -8.837
38 1HB ASP 159 HB2 ASP 159 -2.781 -4.198 -7.256
39 2HB ASP 159 HB1 ASP 159 -4.337 -3.594 -6.694
40 H VAL 160 HN VAL 160 -4.182 -1.940 -8.507
41 HA VAL 160 HA VAL 160 -5.474 -0.161 -9.158
42 HB VAL 160 HB VAL 160 -6.749 -2.117 -10.585
43 1HG1 VAL 160 HG11 VAL 160 -8.339 -2.485 -8.700
44 2HG1 VAL 160 HG12 VAL 160 -9.112 -2.003 -10.208
45 3HG1 VAL 160 HG13 VAL 160 -8.899 -0.827 -8.912
46 1HG2 VAL 160 HG21 VAL 160 -7.007 0.818 -10.325
47 2HG2 VAL 160 HG22 VAL 160 -8.242 -0.016 -11.269
48 3HG2 VAL 160 HG23 VAL 160 -6.542 -0.165 -11.713
49 H PHE 161 HN PHE 161 -7.072 -2.642 -7.179
50 HA PHE 161 HA PHE 161 -8.662 -0.817 -5.696
51 1HB PHE 161 HB2 PHE 161 -8.122 -3.675 -5.698
52 2HB PHE 161 HB1 PHE 161 -8.262 -3.041 -4.061
53 HD1 PHE 161 HD1 PHE 161 -10.285 -1.040 -4.189
54 HD2 PHE 161 HD2 PHE 161 -10.066 -4.740 -6.278
55 HE1 PHE 161 HE1 PHE 161 -12.738 -1.068 -4.387
56 HE2 PHE 161 HE2 PHE 161 -12.518 -4.775 -6.481
57 HZ PHE 161 HZ PHE 161 -13.857 -2.937 -5.535
58 H PHE 162 HN PHE 162 -5.406 -1.970 -5.422
59 HA PHE 162 HA PHE 162 -4.897 -1.249 -2.731
60 1HB PHE 162 HB2 PHE 162 -3.362 -2.025 -5.117
61 2HB PHE 162 HB1 PHE 162 -2.476 -1.072 -3.927
62 HD1 PHE 162 HD1 PHE 162 -2.545 -4.182 -4.930
63 HD2 PHE 162 HD2 PHE 162 -3.584 -2.039 -1.403
64 HE1 PHE 162 HE1 PHE 162 -2.175 -6.213 -3.592
65 HE2 PHE 162 HE2 PHE 162 -3.215 -4.067 -0.058
66 HZ PHE 162 HZ PHE 162 -2.509 -6.157 -1.153
67 H LEU 163 HN LEU 163 -3.843 0.299 -5.747
68 HA LEU 163 HA LEU 163 -3.016 2.724 -4.536
69 1HB LEU 163 HB2 LEU 163 -3.580 1.800 -7.322
70 2HB LEU 163 HB1 LEU 163 -3.321 3.508 -7.020
71 HG LEU 163 HG LEU 163 -1.332 1.385 -6.228
72 1HD1 LEU 163 HD11 LEU 163 -1.798 2.736 -8.826
73 2HD1 LEU 163 HD12 LEU 163 -1.172 1.124 -8.480
74 3HD1 LEU 163 HD13 LEU 163 -0.129 2.533 -8.291
75 1HD2 LEU 163 HD21 LEU 163 0.199 3.394 -6.306
76 2HD2 LEU 163 HD22 LEU 163 -0.978 3.369 -4.993
77 3HD2 LEU 163 HD23 LEU 163 -1.255 4.387 -6.406
78 H PHE 164 HN PHE 164 -6.006 1.438 -4.948
79 HA PHE 164 HA PHE 164 -7.528 3.717 -5.703
80 1HB PHE 164 HB2 PHE 164 -7.903 0.948 -5.380
81 2HB PHE 164 HB1 PHE 164 -9.020 1.716 -4.255
82 HD1 PHE 164 HD1 PHE 164 -11.121 1.497 -5.203
83 HD2 PHE 164 HD2 PHE 164 -7.878 2.826 -7.618
84 HE1 PHE 164 HE1 PHE 164 -12.683 1.939 -7.052
85 HE2 PHE 164 HE2 PHE 164 -9.435 3.271 -9.471
86 HZ PHE 164 HZ PHE 164 -11.841 2.827 -9.189
87 H LEU 165 HN LEU 165 -7.724 1.838 -2.677
88 HA LEU 165 HA LEU 165 -8.879 3.949 -1.207
89 1HB LEU 165 HB2 LEU 165 -8.322 1.242 -0.786
90 2HB LEU 165 HB1 LEU 165 -7.441 2.091 0.471
91 HG LEU 165 HG LEU 165 -9.813 3.324 0.709
92 1HD1 LEU 165 HD11 LEU 165 -10.497 1.515 -1.157
93 2HD1 LEU 165 HD12 LEU 165 -11.619 2.151 0.046
94 3HD1 LEU 165 HD13 LEU 165 -10.837 0.592 0.307
95 1HD2 LEU 165 HD21 LEU 165 -10.145 2.055 2.651
96 2HD2 LEU 165 HD22 LEU 165 -8.402 2.018 2.387
97 3HD2 LEU 165 HD23 LEU 165 -9.390 0.624 1.950
98 H LEU 166 HN LEU 166 -5.603 2.563 -1.010
99 HA LEU 166 HA LEU 166 -4.430 5.158 -0.653
100 1HB LEU 166 HB2 LEU 166 -5.294 3.743 1.639
101 2HB LEU 166 HB1 LEU 166 -3.542 3.640 1.612
102 HG LEU 166 HG LEU 166 -4.399 6.344 1.059
103 1HD1 LEU 166 HD11 LEU 166 -5.056 5.681 3.855
104 2HD1 LEU 166 HD12 LEU 166 -6.240 5.196 2.641
105 3HD1 LEU 166 HD13 LEU 166 -5.756 6.886 2.774
106 1HD2 LEU 166 HD21 LEU 166 -2.969 5.456 3.525
107 2HD2 LEU 166 HD22 LEU 166 -2.712 6.890 2.532
108 3HD2 LEU 166 HD23 LEU 166 -2.182 5.311 1.954
109 HA PRO 167 HA PRO 167 -1.021 3.063 -2.506
110 1HB PRO 167 HB2 PRO 167 1.060 4.552 -1.530
111 2HB PRO 167 HB1 PRO 167 0.004 5.075 -2.856
112 1HG PRO 167 HG2 PRO 167 -0.095 5.797 0.050
113 2HG PRO 167 HG1 PRO 167 -0.313 6.836 -1.371
114 1HD PRO 167 HD2 PRO 167 -2.404 5.932 0.061
115 2HD PRO 167 HD1 PRO 167 -2.496 6.140 -1.701
116 HA PRO 168 HA PRO 168 0.171 0.437 0.988
117 1HB PRO 168 HB2 PRO 168 0.636 -1.789 -0.418
118 2HB PRO 168 HB1 PRO 168 -1.018 -1.203 -0.145
119 1HG PRO 168 HG2 PRO 168 0.726 -0.903 -2.566
120 2HG PRO 168 HG1 PRO 168 -0.993 -1.330 -2.473
121 1HD PRO 168 HD2 PRO 168 -0.069 1.191 -3.025
122 2HD PRO 168 HD1 PRO 168 -1.647 0.855 -2.285
123 H ILE 169 HN ILE 169 2.073 2.306 -0.159
124 HA ILE 169 HA ILE 169 4.439 0.850 -0.882
125 HB ILE 169 HB ILE 169 3.845 3.748 -0.368
126 1HG1 ILE 169 HG12 ILE 169 4.914 3.744 -2.769
127 2HG1 ILE 169 HG11 ILE 169 4.523 2.028 -2.723
128 1HG2 ILE 169 HG21 ILE 169 6.252 4.159 -1.081
129 2HG2 ILE 169 HG22 ILE 169 6.548 2.472 -0.662
130 3HG2 ILE 169 HG23 ILE 169 5.992 3.603 0.573
131 1HD1 ILE 169 HD11 ILE 169 2.685 2.977 -3.755
132 2HD1 ILE 169 HD12 ILE 169 2.684 4.381 -2.688
133 3HD1 ILE 169 HD13 ILE 169 2.159 2.812 -2.080
134 H ILE 170 HN ILE 170 3.997 3.207 1.729
135 HA ILE 170 HA ILE 170 6.136 2.119 3.262
136 HB ILE 170 HB ILE 170 4.084 4.171 4.081
137 1HG1 ILE 170 HG12 ILE 170 6.341 5.575 3.575
138 2HG1 ILE 170 HG11 ILE 170 6.502 4.292 2.379
139 1HG2 ILE 170 HG21 ILE 170 5.989 2.860 5.626
140 2HG2 ILE 170 HG22 ILE 170 5.136 4.347 6.035
141 3HG2 ILE 170 HG23 ILE 170 6.715 4.423 5.253
142 1HD1 ILE 170 HD11 ILE 170 4.695 4.996 1.183
143 2HD1 ILE 170 HD12 ILE 170 5.266 6.536 1.825
144 3HD1 ILE 170 HD13 ILE 170 3.904 5.714 2.586
145 H LEU 171 HN LEU 171 2.618 2.374 3.958
146 HA LEU 171 HA LEU 171 2.744 0.927 6.353
147 1HB LEU 171 HB2 LEU 171 0.378 0.752 6.257
148 2HB LEU 171 HB1 LEU 171 0.817 2.315 5.609
149 HG LEU 171 HG LEU 171 0.157 -0.046 3.859
150 1HD1 LEU 171 HD11 LEU 171 -1.659 2.117 4.895
151 2HD1 LEU 171 HD12 LEU 171 -1.776 0.388 5.222
152 3HD1 LEU 171 HD13 LEU 171 -2.060 0.999 3.592
153 1HD2 LEU 171 HD21 LEU 171 -0.355 1.852 2.262
154 2HD2 LEU 171 HD22 LEU 171 1.348 1.589 2.635
155 3HD2 LEU 171 HD23 LEU 171 0.471 2.910 3.406
156 H ASP 172 HN ASP 172 1.892 -0.169 3.109
157 HA ASP 172 HA ASP 172 1.800 -2.926 3.865
158 1HB ASP 172 HB2 ASP 172 0.974 -1.389 1.640
159 2HB ASP 172 HB1 ASP 172 2.112 -2.598 1.030
160 H ALA 173 HN ALA 173 4.382 -0.977 3.752
161 HA ALA 173 HA ALA 173 6.193 -2.449 2.121
162 1HB ALA 173 HB1 ALA 173 7.678 -0.837 2.624
163 2HB ALA 173 HB2 ALA 173 7.357 -0.943 4.354
164 3HB ALA 173 HB3 ALA 173 6.288 -0.004 3.315
165 H GLY 174 HN GLY 174 6.292 -1.989 5.655
166 1HA GLY 174 HA2 GLY 174 7.197 -4.791 5.901
167 2HA GLY 174 HA1 GLY 174 7.592 -3.493 7.045
168 H TYR 175 HN TYR 175 4.519 -2.881 6.245
169 HA TYR 175 HA TYR 175 2.469 -3.209 7.145
170 1HB TYR 175 HB2 TYR 175 3.236 -5.713 6.733
171 2HB TYR 175 HB1 TYR 175 3.303 -5.750 8.492
172 HD1 TYR 175 HD1 TYR 175 1.488 -7.034 9.171
173 HD2 TYR 175 HD2 TYR 175 0.901 -4.030 6.216
174 HE1 TYR 175 HE1 TYR 175 -0.936 -7.433 9.256
175 HE2 TYR 175 HE2 TYR 175 -1.526 -4.420 6.294
176 HH TYR 175 HH TYR 175 -2.955 -6.935 7.286
177 H PHE 176 HN PHE 176 4.801 -4.602 9.450
178 HA PHE 176 HA PHE 176 3.641 -2.934 11.568
179 1HB PHE 176 HB2 PHE 176 3.700 -5.312 12.080
180 2HB PHE 176 HB1 PHE 176 5.429 -5.375 11.715
181 HD1 PHE 176 HD1 PHE 176 6.559 -5.843 13.658
182 HD2 PHE 176 HD2 PHE 176 3.393 -3.002 13.754
183 HE1 PHE 176 HE1 PHE 176 7.072 -5.358 16.015
184 HE2 PHE 176 HE2 PHE 176 3.901 -2.510 16.111
185 HZ PHE 176 HZ PHE 176 5.743 -3.688 17.244
186 H LEU 177 HN LEU 177 6.506 -3.499 9.705
187 HA LEU 177 HA LEU 177 8.422 -2.262 11.320
188 1HB LEU 177 HB2 LEU 177 8.409 -2.187 8.315
189 2HB LEU 177 HB1 LEU 177 9.797 -2.145 9.384
190 HG LEU 177 HG LEU 177 7.992 -4.509 8.876
191 1HD1 LEU 177 HD11 LEU 177 9.384 -4.614 7.100
192 2HD1 LEU 177 HD12 LEU 177 10.465 -5.342 8.288
193 3HD1 LEU 177 HD13 LEU 177 10.628 -3.635 7.876
194 1HD2 LEU 177 HD21 LEU 177 9.975 -3.947 11.000
195 2HD2 LEU 177 HD22 LEU 177 10.020 -5.548 10.262
196 3HD2 LEU 177 HD23 LEU 177 8.540 -4.971 11.028
197 HA PRO 178 HA PRO 178 7.207 1.742 8.623
198 1HB PRO 178 HB2 PRO 178 4.279 1.217 8.876
199 2HB PRO 178 HB1 PRO 178 5.171 2.016 7.575
200 1HG PRO 178 HG2 PRO 178 4.305 -0.467 7.251
201 2HG PRO 178 HG1 PRO 178 5.917 0.002 6.676
202 1HD PRO 178 HD2 PRO 178 5.155 -1.568 9.099
203 2HD PRO 178 HD1 PRO 178 6.535 -1.780 8.001
204 H LEU 179 HN LEU 179 5.405 0.318 11.296
205 HA LEU 179 HA LEU 179 4.717 2.796 12.514
206 1HB LEU 179 HB2 LEU 179 4.576 -0.067 13.251
207 2HB LEU 179 HB1 LEU 179 4.610 1.074 14.582
208 HG LEU 179 HG LEU 179 2.319 0.438 13.938
209 1HD1 LEU 179 HD11 LEU 179 2.150 2.449 14.957
210 2HD1 LEU 179 HD12 LEU 179 1.663 2.964 13.342
211 3HD1 LEU 179 HD13 LEU 179 3.322 3.215 13.884
212 1HD2 LEU 179 HD21 LEU 179 1.378 1.128 11.834
213 2HD2 LEU 179 HD22 LEU 179 2.794 0.123 11.525
214 3HD2 LEU 179 HD23 LEU 179 2.902 1.875 11.352
215 H ARG 180 HN ARG 180 7.634 1.171 12.230
216 HA ARG 180 HA ARG 180 8.884 2.956 14.146
217 1HB ARG 180 HB2 ARG 180 10.285 0.940 14.975
218 2HB ARG 180 HB1 ARG 180 8.667 1.176 15.647
219 1HG ARG 180 HG2 ARG 180 8.312 -0.450 13.399
220 2HG ARG 180 HG1 ARG 180 9.751 -1.069 14.210
221 1HD ARG 180 HD2 ARG 180 7.559 -2.069 14.952
222 2HD ARG 180 HD1 ARG 180 8.578 -1.416 16.234
223 HE ARG 180 HE ARG 180 6.635 0.452 15.234
224 1HH1 ARG 180 1HH1 ARG 180 7.211 -2.136 17.503
225 2HH1 ARG 180 2HH1 ARG 180 5.950 -1.639 18.581
226 1HH2 ARG 180 1HH2 ARG 180 4.977 1.107 16.651
227 2HH2 ARG 180 2HH2 ARG 180 4.681 0.202 18.097
228 1HG HSL 181 HG1 HSL 181 10.268 4.505 7.646
229 2HG HSL 181 HG2 HSL 181 8.970 4.780 8.920
230 H HSL 181 HN HSL 181 9.022 3.498 11.676
231 HA HSL 181 HA HSL 181 11.661 2.359 10.621
232 1HB HSL 181 HB1 HSL 181 10.844 2.365 8.455
233 2HB HSL 181 HB2 HSL 181 9.170 2.412 9.233
Start of MODEL 2
1 1H PHE 155 HT1 PHE 155 -7.367 5.621 -8.531
2 2H PHE 155 HT2 PHE 155 -7.955 4.486 -9.677
3 3H PHE 155 HT3 PHE 155 -9.055 5.376 -8.707
4 HA PHE 155 HA PHE 155 -7.375 6.298 -10.924
5 1HB PHE 155 HB2 PHE 155 -10.323 6.372 -10.247
6 2HB PHE 155 HB1 PHE 155 -9.618 7.216 -11.623
7 HD1 PHE 155 HD1 PHE 155 -9.353 6.128 -13.657
8 HD2 PHE 155 HD2 PHE 155 -9.997 3.836 -10.129
9 HE1 PHE 155 HE1 PHE 155 -9.586 4.095 -15.024
10 HE2 PHE 155 HE2 PHE 155 -10.231 1.800 -11.490
11 HZ PHE 155 HZ PHE 155 -10.026 1.928 -13.941
12 H LEU 156 HN LEU 156 -7.007 8.437 -11.207
13 HA LEU 156 HA LEU 156 -6.790 10.008 -8.846
14 1HB LEU 156 HB2 LEU 156 -6.024 11.768 -10.570
15 2HB LEU 156 HB1 LEU 156 -5.041 10.344 -10.299
16 HG LEU 156 HG LEU 156 -5.685 9.369 -12.354
17 1HD1 LEU 156 HD11 LEU 156 -7.691 11.583 -12.736
18 2HD1 LEU 156 HD12 LEU 156 -8.091 9.950 -12.202
19 3HD1 LEU 156 HD13 LEU 156 -7.401 10.210 -13.804
20 1HD2 LEU 156 HD21 LEU 156 -4.210 11.567 -12.272
21 2HD2 LEU 156 HD22 LEU 156 -5.528 12.187 -13.267
22 3HD2 LEU 156 HD23 LEU 156 -4.617 10.770 -13.792
23 H GLN 157 HN GLN 157 -9.290 9.730 -8.636
24 HA GLN 157 HA GLN 157 -10.421 12.301 -9.004
25 1HB GLN 157 HB2 GLN 157 -10.648 11.167 -11.311
26 2HB GLN 157 HB1 GLN 157 -11.868 10.158 -10.545
27 1HG GLN 157 HG2 GLN 157 -13.184 11.799 -11.406
28 2HG GLN 157 HG1 GLN 157 -12.860 12.473 -9.809
29 1HE2 GLN 157 HE21 GLN 157 -13.120 14.587 -10.407
30 2HE2 GLN 157 HE22 GLN 157 -12.025 15.418 -11.453
31 H SER 158 HN SER 158 -9.996 10.852 -6.781
32 HA SER 158 HA SER 158 -12.602 10.724 -5.631
33 1HB SER 158 HB2 SER 158 -11.221 8.139 -5.201
34 2HB SER 158 HB1 SER 158 -12.950 8.487 -5.371
35 HG SER 158 HG SER 158 -12.791 7.937 -7.382
36 H ASP 159 HN ASP 159 -10.789 12.420 -4.923
37 HA ASP 159 HA ASP 159 -9.839 13.275 -3.028
38 1HB ASP 159 HB2 ASP 159 -11.217 11.172 -1.971
39 2HB ASP 159 HB1 ASP 159 -9.563 10.740 -1.549
40 H VAL 160 HN VAL 160 -8.643 9.987 -3.740
41 HA VAL 160 HA VAL 160 -6.569 9.220 -4.273
42 HB VAL 160 HB VAL 160 -5.799 12.134 -4.420
43 1HG1 VAL 160 HG11 VAL 160 -4.329 9.612 -5.049
44 2HG1 VAL 160 HG12 VAL 160 -3.762 11.063 -4.223
45 3HG1 VAL 160 HG13 VAL 160 -3.998 11.078 -5.971
46 1HG2 VAL 160 HG21 VAL 160 -6.462 10.237 -6.660
47 2HG2 VAL 160 HG22 VAL 160 -6.113 11.961 -6.787
48 3HG2 VAL 160 HG23 VAL 160 -7.589 11.416 -5.991
49 H PHE 161 HN PHE 161 -6.276 12.045 -2.125
50 HA PHE 161 HA PHE 161 -4.128 10.942 -0.618
51 1HB PHE 161 HB2 PHE 161 -5.758 13.408 -0.555
52 2HB PHE 161 HB1 PHE 161 -5.076 12.904 0.988
53 HD1 PHE 161 HD1 PHE 161 -4.421 14.388 -2.226
54 HD2 PHE 161 HD2 PHE 161 -2.605 12.635 1.201
55 HE1 PHE 161 HE1 PHE 161 -2.265 15.390 -2.860
56 HE2 PHE 161 HE2 PHE 161 -0.446 13.636 0.573
57 HZ PHE 161 HZ PHE 161 -0.274 15.016 -1.459
58 H PHE 162 HN PHE 162 -7.164 9.892 -0.772
59 HA PHE 162 HA PHE 162 -7.035 8.582 1.768
60 1HB PHE 162 HB2 PHE 162 -9.172 10.644 1.236
61 2HB PHE 162 HB1 PHE 162 -9.360 9.358 2.431
62 HD1 PHE 162 HD1 PHE 162 -7.854 12.558 1.681
63 HD2 PHE 162 HD2 PHE 162 -7.853 9.280 4.397
64 HE1 PHE 162 HE1 PHE 162 -6.685 13.941 3.346
65 HE2 PHE 162 HE2 PHE 162 -6.684 10.659 6.067
66 HZ PHE 162 HZ PHE 162 -6.099 12.993 5.542
67 H LEU 163 HN LEU 163 -7.504 8.350 -1.346
68 HA LEU 163 HA LEU 163 -9.973 6.991 -1.644
69 1HB LEU 163 HB2 LEU 163 -8.303 7.981 -3.417
70 2HB LEU 163 HB1 LEU 163 -7.574 6.388 -3.329
71 HG LEU 163 HG LEU 163 -10.481 6.828 -3.947
72 1HD1 LEU 163 HD11 LEU 163 -8.855 7.881 -5.594
73 2HD1 LEU 163 HD12 LEU 163 -10.013 6.723 -6.246
74 3HD1 LEU 163 HD13 LEU 163 -8.341 6.236 -5.967
75 1HD2 LEU 163 HD21 LEU 163 -9.977 4.503 -5.030
76 2HD2 LEU 163 HD22 LEU 163 -10.298 4.637 -3.300
77 3HD2 LEU 163 HD23 LEU 163 -8.640 4.489 -3.880
78 H PHE 164 HN PHE 164 -6.842 6.198 -0.498
79 HA PHE 164 HA PHE 164 -6.018 4.396 0.606
80 1HB PHE 164 HB2 PHE 164 -8.535 4.381 1.401
81 2HB PHE 164 HB1 PHE 164 -8.596 2.903 0.442
82 HD1 PHE 164 HD1 PHE 164 -7.302 0.946 1.087
83 HD2 PHE 164 HD2 PHE 164 -7.268 4.493 3.440
84 HE1 PHE 164 HE1 PHE 164 -6.322 -0.311 2.961
85 HE2 PHE 164 HE2 PHE 164 -6.287 3.241 5.318
86 HZ PHE 164 HZ PHE 164 -5.813 0.836 5.079
87 H LEU 165 HN LEU 165 -6.444 4.509 -2.453
88 HA LEU 165 HA LEU 165 -6.663 1.842 -3.365
89 1HB LEU 165 HB2 LEU 165 -6.100 4.405 -4.512
90 2HB LEU 165 HB1 LEU 165 -4.915 3.243 -5.090
91 HG LEU 165 HG LEU 165 -7.774 2.428 -5.193
92 1HD1 LEU 165 HD11 LEU 165 -7.313 3.683 -7.637
93 2HD1 LEU 165 HD12 LEU 165 -6.816 4.857 -6.418
94 3HD1 LEU 165 HD13 LEU 165 -8.444 4.180 -6.378
95 1HD2 LEU 165 HD21 LEU 165 -5.595 2.157 -7.247
96 2HD2 LEU 165 HD22 LEU 165 -7.072 1.207 -7.086
97 3HD2 LEU 165 HD23 LEU 165 -5.780 1.036 -5.898
98 H LEU 166 HN LEU 166 -3.835 3.923 -2.894
99 HA LEU 166 HA LEU 166 -2.279 1.706 -1.928
100 1HB LEU 166 HB2 LEU 166 -0.888 1.386 -3.716
101 2HB LEU 166 HB1 LEU 166 -2.382 1.789 -4.546
102 HG LEU 166 HG LEU 166 0.065 3.509 -4.197
103 1HD1 LEU 166 HD11 LEU 166 -1.306 2.107 -6.406
104 2HD1 LEU 166 HD12 LEU 166 0.410 2.417 -6.145
105 3HD1 LEU 166 HD13 LEU 166 -0.632 3.698 -6.764
106 1HD2 LEU 166 HD21 LEU 166 -1.402 5.205 -3.871
107 2HD2 LEU 166 HD22 LEU 166 -2.754 4.317 -4.572
108 3HD2 LEU 166 HD23 LEU 166 -1.566 5.087 -5.622
109 HA PRO 167 HA PRO 167 -1.052 6.230 -0.831
110 1HB PRO 167 HB2 PRO 167 -2.243 5.755 1.802
111 2HB PRO 167 HB1 PRO 167 -2.444 7.129 0.703
112 1HG PRO 167 HG2 PRO 167 -4.398 5.308 1.167
113 2HG PRO 167 HG1 PRO 167 -4.228 6.180 -0.364
114 1HD PRO 167 HD2 PRO 167 -3.512 3.366 0.306
115 2HD PRO 167 HD1 PRO 167 -4.138 4.049 -1.199
116 HA PRO 168 HA PRO 168 1.401 4.185 2.635
117 1HB PRO 168 HB2 PRO 168 0.475 2.194 4.099
118 2HB PRO 168 HB1 PRO 168 -0.257 3.805 4.238
119 1HG PRO 168 HG2 PRO 168 -1.251 1.394 2.776
120 2HG PRO 168 HG1 PRO 168 -2.156 2.570 3.745
121 1HD PRO 168 HD2 PRO 168 -1.893 2.593 0.958
122 2HD PRO 168 HD1 PRO 168 -2.449 3.942 1.965
123 H ILE 169 HN ILE 169 2.292 3.479 0.394
124 HA ILE 169 HA ILE 169 2.290 0.682 -0.207
125 HB ILE 169 HB ILE 169 2.725 2.683 -1.797
126 1HG1 ILE 169 HG12 ILE 169 4.727 0.523 -2.250
127 2HG1 ILE 169 HG11 ILE 169 3.036 0.055 -2.085
128 1HG2 ILE 169 HG21 ILE 169 5.026 3.288 -2.158
129 2HG2 ILE 169 HG22 ILE 169 5.550 2.199 -0.875
130 3HG2 ILE 169 HG23 ILE 169 4.588 3.625 -0.484
131 1HD1 ILE 169 HD11 ILE 169 4.135 0.646 -4.422
132 2HD1 ILE 169 HD12 ILE 169 3.653 2.273 -3.942
133 3HD1 ILE 169 HD13 ILE 169 2.445 0.995 -4.058
134 H ILE 170 HN ILE 170 4.481 2.912 1.370
135 HA ILE 170 HA ILE 170 6.572 1.020 1.825
136 HB ILE 170 HB ILE 170 6.143 3.578 3.356
137 1HG1 ILE 170 HG12 ILE 170 7.973 4.105 1.321
138 2HG1 ILE 170 HG11 ILE 170 6.689 3.205 0.521
139 1HG2 ILE 170 HG21 ILE 170 7.966 2.773 4.376
140 2HG2 ILE 170 HG22 ILE 170 8.817 3.291 2.921
141 3HG2 ILE 170 HG23 ILE 170 8.296 1.615 3.087
142 1HD1 ILE 170 HD11 ILE 170 6.486 5.727 0.559
143 2HD1 ILE 170 HD12 ILE 170 6.123 5.566 2.277
144 3HD1 ILE 170 HD13 ILE 170 5.074 4.806 1.079
145 H LEU 171 HN LEU 171 4.001 2.436 3.831
146 HA LEU 171 HA LEU 171 4.687 1.070 6.210
147 1HB LEU 171 HB2 LEU 171 2.101 2.273 5.228
148 2HB LEU 171 HB1 LEU 171 2.253 1.533 6.810
149 HG LEU 171 HG LEU 171 2.467 3.887 7.102
150 1HD1 LEU 171 HD11 LEU 171 4.237 3.818 8.475
151 2HD1 LEU 171 HD12 LEU 171 5.344 3.328 7.192
152 3HD1 LEU 171 HD13 LEU 171 4.329 2.126 7.988
153 1HD2 LEU 171 HD21 LEU 171 4.791 3.992 5.213
154 2HD2 LEU 171 HD22 LEU 171 3.808 5.314 5.841
155 3HD2 LEU 171 HD23 LEU 171 3.138 4.210 4.639
156 H ASP 172 HN ASP 172 2.210 0.439 3.754
157 HA ASP 172 HA ASP 172 1.551 -2.140 4.798
158 1HB ASP 172 HB2 ASP 172 0.041 -0.561 3.430
159 2HB ASP 172 HB1 ASP 172 0.901 -1.186 2.015
160 H ALA 173 HN ALA 173 4.285 -1.123 3.303
161 HA ALA 173 HA ALA 173 4.663 -3.166 1.354
162 1HB ALA 173 HB1 ALA 173 7.159 -2.195 2.373
163 2HB ALA 173 HB2 ALA 173 6.042 -0.849 2.159
164 3HB ALA 173 HB3 ALA 173 6.412 -1.910 0.801
165 H GLY 174 HN GLY 174 5.960 -2.615 4.618
166 1HA GLY 174 HA2 GLY 174 6.636 -5.485 4.777
167 2HA GLY 174 HA1 GLY 174 7.366 -4.205 5.766
168 H TYR 175 HN TYR 175 4.519 -3.063 5.941
169 HA TYR 175 HA TYR 175 2.672 -3.183 7.249
170 1HB TYR 175 HB2 TYR 175 2.421 -5.526 6.494
171 2HB TYR 175 HB1 TYR 175 3.465 -6.048 7.812
172 HD1 TYR 175 HD1 TYR 175 0.763 -3.493 7.888
173 HD2 TYR 175 HD2 TYR 175 2.053 -7.348 9.143
174 HE1 TYR 175 HE1 TYR 175 -1.191 -3.656 9.373
175 HE2 TYR 175 HE2 TYR 175 0.101 -7.523 10.629
176 HH TYR 175 HH TYR 175 -2.528 -5.340 10.478
177 H PHE 176 HN PHE 176 5.769 -4.185 8.469
178 HA PHE 176 HA PHE 176 4.978 -3.569 11.213
179 1HB PHE 176 HB2 PHE 176 7.239 -4.435 11.799
180 2HB PHE 176 HB1 PHE 176 6.240 -5.615 10.937
181 HD1 PHE 176 HD1 PHE 176 7.123 -6.722 9.121
182 HD2 PHE 176 HD2 PHE 176 8.841 -3.017 10.319
183 HE1 PHE 176 HE1 PHE 176 8.903 -7.010 7.447
184 HE2 PHE 176 HE2 PHE 176 10.623 -3.298 8.647
185 HZ PHE 176 HZ PHE 176 10.657 -5.296 7.208
186 H LEU 177 HN LEU 177 5.585 -1.667 8.810
187 HA LEU 177 HA LEU 177 7.828 -0.148 9.785
188 1HB LEU 177 HB2 LEU 177 5.952 0.053 7.484
189 2HB LEU 177 HB1 LEU 177 6.785 1.509 7.991
190 HG LEU 177 HG LEU 177 8.032 -1.056 7.011
191 1HD1 LEU 177 HD11 LEU 177 7.143 1.250 5.684
192 2HD1 LEU 177 HD12 LEU 177 8.124 -0.062 5.032
193 3HD1 LEU 177 HD13 LEU 177 8.903 1.357 5.732
194 1HD2 LEU 177 HD21 LEU 177 9.568 -0.458 8.616
195 2HD2 LEU 177 HD22 LEU 177 9.213 1.264 8.469
196 3HD2 LEU 177 HD23 LEU 177 10.156 0.448 7.222
197 HA PRO 178 HA PRO 178 3.967 2.902 10.669
198 1HB PRO 178 HB2 PRO 178 2.267 0.658 11.669
199 2HB PRO 178 HB1 PRO 178 1.788 2.171 10.893
200 1HG PRO 178 HG2 PRO 178 1.772 -0.111 9.527
201 2HG PRO 178 HG1 PRO 178 2.306 1.400 8.768
202 1HD PRO 178 HD2 PRO 178 3.918 -0.915 9.722
203 2HD PRO 178 HD1 PRO 178 4.208 0.177 8.355
204 H LEU 179 HN LEU 179 5.603 3.373 12.214
205 HA LEU 179 HA LEU 179 5.189 2.109 14.843
206 1HB LEU 179 HB2 LEU 179 7.622 2.905 13.382
207 2HB LEU 179 HB1 LEU 179 7.600 3.359 15.075
208 HG LEU 179 HG LEU 179 8.709 1.184 14.651
209 1HD1 LEU 179 HD11 LEU 179 6.207 0.688 16.223
210 2HD1 LEU 179 HD12 LEU 179 7.427 1.832 16.783
211 3HD1 LEU 179 HD13 LEU 179 7.852 0.138 16.544
212 1HD2 LEU 179 HD21 LEU 179 7.304 -0.760 14.101
213 2HD2 LEU 179 HD22 LEU 179 7.365 0.413 12.787
214 3HD2 LEU 179 HD23 LEU 179 5.940 0.323 13.821
215 H ARG 180 HN ARG 180 6.588 5.149 13.610
216 HA ARG 180 HA ARG 180 5.398 6.598 15.829
217 1HB ARG 180 HB2 ARG 180 7.306 7.382 13.625
218 2HB ARG 180 HB1 ARG 180 6.619 8.561 14.749
219 1HG ARG 180 HG2 ARG 180 8.152 8.065 16.265
220 2HG ARG 180 HG1 ARG 180 7.701 6.360 16.223
221 1HD ARG 180 HD2 ARG 180 9.430 7.525 14.076
222 2HD ARG 180 HD1 ARG 180 10.129 7.057 15.626
223 HE ARG 180 HE ARG 180 8.522 5.005 14.413
224 1HH1 ARG 180 1HH1 ARG 180 11.705 6.426 14.578
225 2HH1 ARG 180 2HH1 ARG 180 12.512 4.985 14.055
226 1HH2 ARG 180 1HH2 ARG 180 9.582 3.109 13.722
227 2HH2 ARG 180 2HH2 ARG 180 11.307 3.104 13.568
228 1HG HSL 181 HG1 HSL 181 0.502 6.931 10.589
229 2HG HSL 181 HG2 HSL 181 0.679 5.109 10.389
230 H HSL 181 HN HSL 181 3.862 5.343 13.565
231 HA HSL 181 HA HSL 181 2.382 7.845 12.593
232 1HB HSL 181 HB1 HSL 181 2.899 6.856 10.500
233 2HB HSL 181 HB2 HSL 181 2.954 5.155 11.212
Start of MODEL 3
1 1H PHE 155 HT1 PHE 155 -3.288 10.909 -15.637
2 2H PHE 155 HT2 PHE 155 -4.541 10.330 -14.618
3 3H PHE 155 HT3 PHE 155 -4.898 10.835 -16.218
4 HA PHE 155 HA PHE 155 -4.903 8.562 -16.318
5 1HB PHE 155 HB2 PHE 155 -3.410 9.946 -17.935
6 2HB PHE 155 HB1 PHE 155 -2.064 9.199 -17.081
7 HD1 PHE 155 HD1 PHE 155 -5.358 7.855 -18.195
8 HD2 PHE 155 HD2 PHE 155 -1.116 7.624 -18.460
9 HE1 PHE 155 HE1 PHE 155 -5.559 5.865 -19.630
10 HE2 PHE 155 HE2 PHE 155 -1.310 5.635 -19.896
11 HZ PHE 155 HZ PHE 155 -3.533 4.752 -20.481
12 H LEU 156 HN LEU 156 -3.463 6.531 -16.147
13 HA LEU 156 HA LEU 156 -2.845 6.161 -13.395
14 1HB LEU 156 HB2 LEU 156 -2.422 3.874 -13.961
15 2HB LEU 156 HB1 LEU 156 -3.843 4.410 -14.838
16 HG LEU 156 HG LEU 156 -2.137 4.853 -16.777
17 1HD1 LEU 156 HD11 LEU 156 -0.045 4.434 -16.005
18 2HD1 LEU 156 HD12 LEU 156 -0.461 2.804 -16.536
19 3HD1 LEU 156 HD13 LEU 156 -0.595 3.237 -14.832
20 1HD2 LEU 156 HD21 LEU 156 -4.016 3.125 -16.568
21 2HD2 LEU 156 HD22 LEU 156 -2.741 1.982 -16.146
22 3HD2 LEU 156 HD23 LEU 156 -2.718 2.791 -17.713
23 H GLN 157 HN GLN 157 -0.728 4.825 -12.919
24 HA GLN 157 HA GLN 157 1.605 5.459 -14.388
25 1HB GLN 157 HB2 GLN 157 1.159 7.707 -13.500
26 2HB GLN 157 HB1 GLN 157 1.153 7.061 -11.865
27 1HG GLN 157 HG2 GLN 157 3.311 7.528 -11.763
28 2HG GLN 157 HG1 GLN 157 3.580 6.233 -12.932
29 1HE2 GLN 157 HE21 GLN 157 3.654 6.790 -15.174
30 2HE2 GLN 157 HE22 GLN 157 4.140 8.374 -15.663
31 H SER 158 HN SER 158 0.558 5.016 -11.012
32 HA SER 158 HA SER 158 2.804 3.355 -10.385
33 1HB SER 158 HB2 SER 158 1.396 4.857 -8.797
34 2HB SER 158 HB1 SER 158 0.290 3.474 -8.740
35 HG SER 158 HG SER 158 1.779 2.304 -7.712
36 H ASP 159 HN ASP 159 2.049 2.067 -12.465
37 HA ASP 159 HA ASP 159 1.569 -0.021 -13.231
38 1HB ASP 159 HB2 ASP 159 1.618 -0.384 -10.361
39 2HB ASP 159 HB1 ASP 159 0.413 -1.431 -11.103
40 H VAL 160 HN VAL 160 -0.887 1.185 -10.963
41 HA VAL 160 HA VAL 160 -3.058 1.772 -11.404
42 HB VAL 160 HB VAL 160 -2.268 1.437 -13.988
43 1HG1 VAL 160 HG11 VAL 160 -3.901 0.009 -15.121
44 2HG1 VAL 160 HG12 VAL 160 -4.496 -0.552 -13.560
45 3HG1 VAL 160 HG13 VAL 160 -2.851 -0.932 -14.064
46 1HG2 VAL 160 HG21 VAL 160 -5.145 1.799 -13.200
47 2HG2 VAL 160 HG22 VAL 160 -4.296 2.494 -14.583
48 3HG2 VAL 160 HG23 VAL 160 -3.910 3.034 -12.948
49 H PHE 161 HN PHE 161 -2.254 -1.565 -12.389
50 HA PHE 161 HA PHE 161 -4.646 -2.601 -11.177
51 1HB PHE 161 HB2 PHE 161 -4.085 -4.656 -12.092
52 2HB PHE 161 HB1 PHE 161 -3.333 -3.538 -13.223
53 HD1 PHE 161 HD1 PHE 161 -2.772 -6.558 -12.365
54 HD2 PHE 161 HD2 PHE 161 -0.911 -2.807 -11.608
55 HE1 PHE 161 HE1 PHE 161 -0.617 -7.699 -12.037
56 HE2 PHE 161 HE2 PHE 161 1.247 -3.942 -11.279
57 HZ PHE 161 HZ PHE 161 1.397 -6.389 -11.494
58 H PHE 162 HN PHE 162 -2.922 -1.137 -9.408
59 HA PHE 162 HA PHE 162 -2.919 -2.892 -7.190
60 1HB PHE 162 HB2 PHE 162 -0.328 -2.358 -8.574
61 2HB PHE 162 HB1 PHE 162 -0.348 -2.425 -6.809
62 HD1 PHE 162 HD1 PHE 162 0.878 -4.276 -9.114
63 HD2 PHE 162 HD2 PHE 162 -2.416 -4.561 -6.433
64 HE1 PHE 162 HE1 PHE 162 1.012 -6.730 -9.215
65 HE2 PHE 162 HE2 PHE 162 -2.287 -7.015 -6.531
66 HZ PHE 162 HZ PHE 162 -0.572 -8.103 -7.922
67 H LEU 163 HN LEU 163 -2.561 0.186 -8.622
68 HA LEU 163 HA LEU 163 -1.572 1.687 -6.471
69 1HB LEU 163 HB2 LEU 163 -1.881 2.492 -8.829
70 2HB LEU 163 HB1 LEU 163 -3.605 2.568 -8.526
71 HG LEU 163 HG LEU 163 -3.333 4.326 -6.929
72 1HD1 LEU 163 HD11 LEU 163 -0.509 3.458 -6.984
73 2HD1 LEU 163 HD12 LEU 163 -1.500 4.025 -5.643
74 3HD1 LEU 163 HD13 LEU 163 -0.810 5.183 -6.779
75 1HD2 LEU 163 HD21 LEU 163 -1.952 4.607 -9.547
76 2HD2 LEU 163 HD22 LEU 163 -1.845 5.938 -8.395
77 3HD2 LEU 163 HD23 LEU 163 -3.422 5.379 -8.954
78 H PHE 164 HN PHE 164 -4.731 0.445 -7.273
79 HA PHE 164 HA PHE 164 -6.739 0.462 -6.181
80 1HB PHE 164 HB2 PHE 164 -4.857 -0.780 -4.696
81 2HB PHE 164 HB1 PHE 164 -5.382 0.450 -3.548
82 HD1 PHE 164 HD1 PHE 164 -6.811 -2.092 -5.872
83 HD2 PHE 164 HD2 PHE 164 -7.162 -0.020 -2.171
84 HE1 PHE 164 HE1 PHE 164 -8.758 -3.479 -5.284
85 HE2 PHE 164 HE2 PHE 164 -9.108 -1.404 -1.576
86 HZ PHE 164 HZ PHE 164 -9.907 -3.136 -3.134
87 H LEU 165 HN LEU 165 -5.854 3.071 -6.796
88 HA LEU 165 HA LEU 165 -6.763 5.165 -6.424
89 1HB LEU 165 HB2 LEU 165 -8.240 3.741 -4.626
90 2HB LEU 165 HB1 LEU 165 -7.347 4.820 -3.563
91 HG LEU 165 HG LEU 165 -9.439 5.855 -4.050
92 1HD1 LEU 165 HD11 LEU 165 -7.243 7.196 -4.201
93 2HD1 LEU 165 HD12 LEU 165 -8.732 7.941 -4.780
94 3HD1 LEU 165 HD13 LEU 165 -7.582 7.260 -5.929
95 1HD2 LEU 165 HD21 LEU 165 -10.344 4.893 -5.922
96 2HD2 LEU 165 HD22 LEU 165 -8.843 5.003 -6.841
97 3HD2 LEU 165 HD23 LEU 165 -9.824 6.445 -6.581
98 H LEU 166 HN LEU 166 -4.711 3.566 -4.116
99 HA LEU 166 HA LEU 166 -2.874 5.766 -4.099
100 1HB LEU 166 HB2 LEU 166 -4.896 5.685 -2.141
101 2HB LEU 166 HB1 LEU 166 -3.426 5.161 -1.335
102 HG LEU 166 HG LEU 166 -2.766 7.458 -2.870
103 1HD1 LEU 166 HD11 LEU 166 -4.923 8.284 -2.997
104 2HD1 LEU 166 HD12 LEU 166 -4.308 9.042 -1.528
105 3HD1 LEU 166 HD13 LEU 166 -5.373 7.641 -1.417
106 1HD2 LEU 166 HD21 LEU 166 -2.679 8.356 -0.370
107 2HD2 LEU 166 HD22 LEU 166 -1.489 7.219 -1.004
108 3HD2 LEU 166 HD23 LEU 166 -2.834 6.633 -0.022
109 HA PRO 167 HA PRO 167 -0.446 2.114 -3.366
110 1HB PRO 167 HB2 PRO 167 1.982 3.156 -3.743
111 2HB PRO 167 HB1 PRO 167 0.825 2.985 -5.077
112 1HG PRO 167 HG2 PRO 167 1.648 5.420 -3.580
113 2HG PRO 167 HG1 PRO 167 1.152 5.253 -5.271
114 1HD PRO 167 HD2 PRO 167 -0.449 6.124 -3.108
115 2HD PRO 167 HD1 PRO 167 -1.000 5.728 -4.746
116 HA PRO 168 HA PRO 168 0.418 3.010 1.046
117 1HB PRO 168 HB2 PRO 168 0.125 0.452 1.874
118 2HB PRO 168 HB1 PRO 168 -1.266 1.515 1.579
119 1HG PRO 168 HG2 PRO 168 -0.055 -0.562 -0.224
120 2HG PRO 168 HG1 PRO 168 -1.764 -0.289 0.168
121 1HD PRO 168 HD2 PRO 168 -0.662 0.616 -2.111
122 2HD PRO 168 HD1 PRO 168 -1.925 1.524 -1.255
123 H ILE 169 HN ILE 169 2.635 3.431 0.179
124 HA ILE 169 HA ILE 169 4.456 1.274 -0.185
125 HB ILE 169 HB ILE 169 4.546 3.868 -0.866
126 1HG1 ILE 169 HG12 ILE 169 5.938 2.193 -1.876
127 2HG1 ILE 169 HG11 ILE 169 6.976 3.514 -1.349
128 1HG2 ILE 169 HG21 ILE 169 6.524 3.780 1.390
129 2HG2 ILE 169 HG22 ILE 169 4.910 4.472 1.566
130 3HG2 ILE 169 HG23 ILE 169 6.042 5.160 0.402
131 1HD1 ILE 169 HD11 ILE 169 6.579 0.894 0.075
132 2HD1 ILE 169 HD12 ILE 169 7.604 2.220 0.628
133 3HD1 ILE 169 HD13 ILE 169 7.989 1.371 -0.871
134 H ILE 170 HN ILE 170 3.473 3.215 2.522
135 HA ILE 170 HA ILE 170 5.532 2.280 4.299
136 HB ILE 170 HB ILE 170 2.987 3.743 5.007
137 1HG1 ILE 170 HG12 ILE 170 5.008 5.589 5.146
138 2HG1 ILE 170 HG11 ILE 170 5.480 4.648 3.735
139 1HG2 ILE 170 HG21 ILE 170 3.684 3.716 7.119
140 2HG2 ILE 170 HG22 ILE 170 5.296 4.264 6.659
141 3HG2 ILE 170 HG23 ILE 170 4.907 2.544 6.627
142 1HD1 ILE 170 HD11 ILE 170 2.805 5.073 3.316
143 2HD1 ILE 170 HD12 ILE 170 4.127 5.992 2.598
144 3HD1 ILE 170 HD13 ILE 170 3.339 6.578 4.063
145 H LEU 171 HN LEU 171 2.004 1.811 4.040
146 HA LEU 171 HA LEU 171 1.831 -0.084 6.133
147 1HB LEU 171 HB2 LEU 171 0.052 0.475 3.764
148 2HB LEU 171 HB1 LEU 171 -0.348 -0.710 4.990
149 HG LEU 171 HG LEU 171 -0.247 1.138 6.688
150 1HD1 LEU 171 HD11 LEU 171 -0.632 3.443 5.587
151 2HD1 LEU 171 HD12 LEU 171 0.183 2.732 4.194
152 3HD1 LEU 171 HD13 LEU 171 1.016 2.835 5.744
153 1HD2 LEU 171 HD21 LEU 171 -2.411 2.222 5.776
154 2HD2 LEU 171 HD22 LEU 171 -2.399 0.492 6.121
155 3HD2 LEU 171 HD23 LEU 171 -2.240 1.061 4.459
156 H ASP 172 HN ASP 172 1.925 -0.441 2.623
157 HA ASP 172 HA ASP 172 2.102 -3.288 2.690
158 1HB ASP 172 HB2 ASP 172 1.302 -1.614 0.779
159 2HB ASP 172 HB1 ASP 172 2.994 -1.768 0.286
160 H ALA 173 HN ALA 173 4.327 -0.945 3.479
161 HA ALA 173 HA ALA 173 6.665 -2.025 2.269
162 1HB ALA 173 HB1 ALA 173 7.446 -0.725 4.622
163 2HB ALA 173 HB2 ALA 173 6.032 0.152 4.043
164 3HB ALA 173 HB3 ALA 173 7.429 -0.059 2.990
165 H GLY 174 HN GLY 174 5.808 -1.852 5.685
166 1HA GLY 174 HA2 GLY 174 6.729 -4.641 6.039
167 2HA GLY 174 HA1 GLY 174 7.094 -3.366 7.220
168 H TYR 175 HN TYR 175 4.447 -2.136 6.768
169 HA TYR 175 HA TYR 175 2.298 -2.218 7.389
170 1HB TYR 175 HB2 TYR 175 2.322 -4.560 6.393
171 2HB TYR 175 HB1 TYR 175 2.588 -5.155 8.029
172 HD1 TYR 175 HD1 TYR 175 0.852 -4.586 9.803
173 HD2 TYR 175 HD2 TYR 175 0.156 -4.057 5.639
174 HE1 TYR 175 HE1 TYR 175 -1.570 -4.533 10.220
175 HE2 TYR 175 HE2 TYR 175 -2.268 -4.004 6.045
176 HH TYR 175 HH TYR 175 -3.854 -4.910 7.859
177 H PHE 176 HN PHE 176 4.860 -3.373 9.380
178 HA PHE 176 HA PHE 176 3.278 -3.076 11.819
179 1HB PHE 176 HB2 PHE 176 5.181 -4.892 11.253
180 2HB PHE 176 HB1 PHE 176 6.199 -3.628 11.956
181 HD1 PHE 176 HD1 PHE 176 6.826 -4.421 14.036
182 HD2 PHE 176 HD2 PHE 176 2.747 -4.696 12.852
183 HE1 PHE 176 HE1 PHE 176 6.226 -5.198 16.293
184 HE2 PHE 176 HE2 PHE 176 2.140 -5.473 15.107
185 HZ PHE 176 HZ PHE 176 3.882 -5.725 16.831
186 H LEU 177 HN LEU 177 3.441 -0.789 10.429
187 HA LEU 177 HA LEU 177 3.955 1.396 10.540
188 1HB LEU 177 HB2 LEU 177 4.621 0.464 13.307
189 2HB LEU 177 HB1 LEU 177 4.991 2.114 12.839
190 HG LEU 177 HG LEU 177 2.233 1.198 12.283
191 1HD1 LEU 177 HD11 LEU 177 2.054 0.296 14.348
192 2HD1 LEU 177 HD12 LEU 177 1.856 1.987 14.807
193 3HD1 LEU 177 HD13 LEU 177 3.425 1.203 14.986
194 1HD2 LEU 177 HD21 LEU 177 3.693 3.678 12.948
195 2HD2 LEU 177 HD22 LEU 177 2.033 3.559 13.530
196 3HD2 LEU 177 HD23 LEU 177 2.376 3.404 11.808
197 HA PRO 178 HA PRO 178 8.424 -0.086 9.481
198 1HB PRO 178 HB2 PRO 178 7.269 1.333 7.098
199 2HB PRO 178 HB1 PRO 178 8.456 0.021 7.146
200 1HG PRO 178 HG2 PRO 178 5.943 -0.505 6.599
201 2HG PRO 178 HG1 PRO 178 6.836 -1.563 7.706
202 1HD PRO 178 HD2 PRO 178 4.740 0.466 8.295
203 2HD PRO 178 HD1 PRO 178 5.104 -1.063 9.119
204 H LEU 179 HN LEU 179 6.556 2.896 9.308
205 HA LEU 179 HA LEU 179 8.630 4.691 8.779
206 1HB LEU 179 HB2 LEU 179 5.902 4.852 9.368
207 2HB LEU 179 HB1 LEU 179 6.688 5.787 10.625
208 HG LEU 179 HG LEU 179 7.729 7.225 8.992
209 1HD1 LEU 179 HD11 LEU 179 6.605 6.635 6.548
210 2HD1 LEU 179 HD12 LEU 179 7.047 5.051 7.185
211 3HD1 LEU 179 HD13 LEU 179 8.270 6.312 7.031
212 1HD2 LEU 179 HD21 LEU 179 5.873 8.444 8.439
213 2HD2 LEU 179 HD22 LEU 179 5.190 7.369 9.659
214 3HD2 LEU 179 HD23 LEU 179 4.949 7.023 7.946
215 H ARG 180 HN ARG 180 7.284 3.680 11.914
216 HA ARG 180 HA ARG 180 9.508 4.955 13.290
217 1HB ARG 180 HB2 ARG 180 7.048 3.526 14.303
218 2HB ARG 180 HB1 ARG 180 8.306 4.169 15.360
219 1HG ARG 180 HG2 ARG 180 6.046 5.492 14.205
220 2HG ARG 180 HG1 ARG 180 7.186 6.077 15.412
221 1HD ARG 180 HD2 ARG 180 7.689 6.168 12.439
222 2HD ARG 180 HD1 ARG 180 6.986 7.494 13.356
223 HE ARG 180 HE ARG 180 9.732 6.828 13.182
224 1HH1 ARG 180 1HH1 ARG 180 7.329 8.034 15.410
225 2HH1 ARG 180 2HH1 ARG 180 8.478 8.895 16.377
226 1HH2 ARG 180 1HH2 ARG 180 11.242 7.963 14.451
227 2HH2 ARG 180 2HH2 ARG 180 10.701 8.856 15.832
228 1HG HSL 181 HG1 HSL 181 11.234 -1.186 10.008
229 2HG HSL 181 HG2 HSL 181 10.457 0.429 9.588
230 H HSL 181 HN HSL 181 9.803 2.588 11.496
231 HA HSL 181 HA HSL 181 11.055 0.648 13.515
232 1HB HSL 181 HB1 HSL 181 10.435 -1.186 12.238
233 2HB HSL 181 HB2 HSL 181 9.145 -0.065 11.548
Start of MODEL 4
1 1H PHE 155 HT1 PHE 155 3.076 -0.372 -12.863
2 2H PHE 155 HT2 PHE 155 4.434 0.456 -12.217
3 3H PHE 155 HT3 PHE 155 3.260 1.310 -13.133
4 HA PHE 155 HA PHE 155 2.847 0.012 -10.524
5 1HB PHE 155 HB2 PHE 155 2.636 2.329 -9.721
6 2HB PHE 155 HB1 PHE 155 4.223 2.037 -10.425
7 HD1 PHE 155 HD1 PHE 155 0.859 3.373 -11.294
8 HD2 PHE 155 HD2 PHE 155 5.052 3.497 -12.010
9 HE1 PHE 155 HE1 PHE 155 0.544 5.302 -12.788
10 HE2 PHE 155 HE2 PHE 155 4.744 5.427 -13.504
11 HZ PHE 155 HZ PHE 155 2.487 6.333 -13.894
12 H LEU 156 HN LEU 156 0.763 0.717 -9.559
13 HA LEU 156 HA LEU 156 -1.313 1.699 -11.244
14 1HB LEU 156 HB2 LEU 156 -1.088 -1.239 -10.711
15 2HB LEU 156 HB1 LEU 156 -2.667 -0.499 -10.881
16 HG LEU 156 HG LEU 156 -1.376 0.435 -13.100
17 1HD1 LEU 156 HD11 LEU 156 -0.668 -2.439 -13.174
18 2HD1 LEU 156 HD12 LEU 156 0.414 -1.357 -12.298
19 3HD1 LEU 156 HD13 LEU 156 0.068 -1.067 -14.003
20 1HD2 LEU 156 HD21 LEU 156 -2.701 -1.262 -14.316
21 2HD2 LEU 156 HD22 LEU 156 -3.627 -0.420 -13.072
22 3HD2 LEU 156 HD23 LEU 156 -3.038 -2.056 -12.778
23 H GLN 157 HN GLN 157 -1.440 -0.736 -8.669
24 HA GLN 157 HA GLN 157 -2.029 -0.591 -6.464
25 1HB GLN 157 HB2 GLN 157 -2.542 2.358 -6.778
26 2HB GLN 157 HB1 GLN 157 -2.182 1.465 -5.308
27 1HG GLN 157 HG2 GLN 157 -0.015 1.040 -7.047
28 2HG GLN 157 HG1 GLN 157 -0.395 2.760 -7.122
29 1HE2 GLN 157 HE21 GLN 157 -1.302 3.180 -4.549
30 2HE2 GLN 157 HE22 GLN 157 0.008 2.969 -3.442
31 H SER 158 HN SER 158 -3.917 0.142 -9.101
32 HA SER 158 HA SER 158 -6.122 -0.257 -9.508
33 1HB SER 158 HB2 SER 158 -7.403 -1.484 -8.040
34 2HB SER 158 HB1 SER 158 -5.787 -1.823 -7.398
35 HG SER 158 HG SER 158 -7.874 -0.474 -6.262
36 H ASP 159 HN ASP 159 -5.604 1.638 -6.530
37 HA ASP 159 HA ASP 159 -7.944 3.225 -6.936
38 1HB ASP 159 HB2 ASP 159 -5.656 3.243 -5.021
39 2HB ASP 159 HB1 ASP 159 -6.645 4.693 -5.160
40 H VAL 160 HN VAL 160 -4.546 3.562 -7.734
41 HA VAL 160 HA VAL 160 -3.412 4.945 -9.052
42 HB VAL 160 HB VAL 160 -4.349 5.368 -10.971
43 1HG1 VAL 160 HG11 VAL 160 -6.254 4.239 -11.533
44 2HG1 VAL 160 HG12 VAL 160 -7.105 4.729 -10.071
45 3HG1 VAL 160 HG13 VAL 160 -5.850 3.492 -9.988
46 1HG2 VAL 160 HG21 VAL 160 -6.448 7.043 -9.611
47 2HG2 VAL 160 HG22 VAL 160 -6.201 6.946 -11.354
48 3HG2 VAL 160 HG23 VAL 160 -4.942 7.623 -10.322
49 H PHE 161 HN PHE 161 -6.188 6.703 -7.624
50 HA PHE 161 HA PHE 161 -4.890 9.200 -7.531
51 1HB PHE 161 HB2 PHE 161 -7.373 8.749 -7.244
52 2HB PHE 161 HB1 PHE 161 -7.006 8.242 -5.598
53 HD1 PHE 161 HD1 PHE 161 -5.736 9.954 -4.128
54 HD2 PHE 161 HD2 PHE 161 -7.835 10.965 -7.689
55 HE1 PHE 161 HE1 PHE 161 -5.878 12.292 -3.375
56 HE2 PHE 161 HE2 PHE 161 -7.980 13.305 -6.943
57 HZ PHE 161 HZ PHE 161 -7.001 13.971 -4.784
58 H PHE 162 HN PHE 162 -4.631 6.360 -5.617
59 HA PHE 162 HA PHE 162 -3.596 7.510 -3.239
60 1HB PHE 162 HB2 PHE 162 -3.975 4.849 -4.385
61 2HB PHE 162 HB1 PHE 162 -2.580 4.975 -3.313
62 HD1 PHE 162 HD1 PHE 162 -3.644 6.978 -1.362
63 HD2 PHE 162 HD2 PHE 162 -5.449 3.547 -3.119
64 HE1 PHE 162 HE1 PHE 162 -5.132 6.767 0.586
65 HE2 PHE 162 HE2 PHE 162 -6.940 3.331 -1.175
66 HZ PHE 162 HZ PHE 162 -6.782 4.942 0.681
67 H LEU 163 HN LEU 163 -1.980 5.601 -5.765
68 HA LEU 163 HA LEU 163 0.654 6.263 -4.979
69 1HB LEU 163 HB2 LEU 163 0.446 4.314 -6.240
70 2HB LEU 163 HB1 LEU 163 -0.638 5.066 -7.392
71 HG LEU 163 HG LEU 163 1.294 6.360 -8.293
72 1HD1 LEU 163 HD11 LEU 163 3.559 5.540 -7.720
73 2HD1 LEU 163 HD12 LEU 163 2.847 4.592 -6.413
74 3HD1 LEU 163 HD13 LEU 163 2.748 6.352 -6.380
75 1HD2 LEU 163 HD21 LEU 163 2.365 4.375 -9.385
76 2HD2 LEU 163 HD22 LEU 163 0.603 4.414 -9.471
77 3HD2 LEU 163 HD23 LEU 163 1.407 3.354 -8.313
78 H PHE 164 HN PHE 164 -1.745 8.046 -6.394
79 HA PHE 164 HA PHE 164 -0.264 9.648 -8.212
80 1HB PHE 164 HB2 PHE 164 -2.968 9.273 -7.366
81 2HB PHE 164 HB1 PHE 164 -2.591 10.994 -7.279
82 HD1 PHE 164 HD1 PHE 164 -1.491 8.349 -9.663
83 HD2 PHE 164 HD2 PHE 164 -3.571 12.019 -9.099
84 HE1 PHE 164 HE1 PHE 164 -1.814 8.535 -12.096
85 HE2 PHE 164 HE2 PHE 164 -3.899 12.211 -11.530
86 HZ PHE 164 HZ PHE 164 -3.020 10.467 -13.032
87 H LEU 165 HN LEU 165 -1.976 10.708 -5.266
88 HA LEU 165 HA LEU 165 -0.376 13.017 -4.949
89 1HB LEU 165 HB2 LEU 165 -2.685 11.916 -3.748
90 2HB LEU 165 HB1 LEU 165 -1.536 12.223 -2.458
91 HG LEU 165 HG LEU 165 -2.934 14.150 -2.676
92 1HD1 LEU 165 HD11 LEU 165 -0.555 15.155 -4.124
93 2HD1 LEU 165 HD12 LEU 165 -0.276 14.292 -2.612
94 3HD1 LEU 165 HD13 LEU 165 -1.303 15.725 -2.632
95 1HD2 LEU 165 HD21 LEU 165 -2.599 15.376 -5.033
96 2HD2 LEU 165 HD22 LEU 165 -3.931 14.268 -4.703
97 3HD2 LEU 165 HD23 LEU 165 -2.501 13.696 -5.564
98 H LEU 166 HN LEU 166 -0.479 9.967 -3.122
99 HA LEU 166 HA LEU 166 2.361 10.025 -2.698
100 1HB LEU 166 HB2 LEU 166 0.798 11.377 -0.844
101 2HB LEU 166 HB1 LEU 166 1.084 9.818 -0.092
102 HG LEU 166 HG LEU 166 2.749 11.501 0.580
103 1HD1 LEU 166 HD11 LEU 166 4.422 9.987 0.667
104 2HD1 LEU 166 HD12 LEU 166 4.363 9.659 -1.065
105 3HD1 LEU 166 HD13 LEU 166 3.184 8.913 0.015
106 1HD2 LEU 166 HD21 LEU 166 4.308 12.431 -0.957
107 2HD2 LEU 166 HD22 LEU 166 2.697 12.727 -1.608
108 3HD2 LEU 166 HD23 LEU 166 3.695 11.438 -2.278
109 HA PRO 167 HA PRO 167 0.934 5.745 -2.854
110 1HB PRO 167 HB2 PRO 167 3.338 4.632 -3.370
111 2HB PRO 167 HB1 PRO 167 2.375 5.451 -4.613
112 1HG PRO 167 HG2 PRO 167 4.705 6.480 -3.039
113 2HG PRO 167 HG1 PRO 167 4.354 6.666 -4.767
114 1HD PRO 167 HD2 PRO 167 3.854 8.614 -2.938
115 2HD PRO 167 HD1 PRO 167 2.887 8.400 -4.410
116 HA PRO 168 HA PRO 168 2.245 4.974 1.429
117 1HB PRO 168 HB2 PRO 168 0.153 3.436 2.109
118 2HB PRO 168 HB1 PRO 168 -0.008 5.198 1.962
119 1HG PRO 168 HG2 PRO 168 -0.751 3.058 -0.005
120 2HG PRO 168 HG1 PRO 168 -1.677 4.488 0.491
121 1HD PRO 168 HD2 PRO 168 -0.207 4.375 -1.802
122 2HD PRO 168 HD1 PRO 168 -0.508 5.879 -0.912
123 H ILE 169 HN ILE 169 3.834 3.711 -0.193
124 HA ILE 169 HA ILE 169 3.352 0.911 -0.479
125 HB ILE 169 HB ILE 169 4.903 2.478 -1.860
126 1HG1 ILE 169 HG12 ILE 169 6.024 -0.227 -1.155
127 2HG1 ILE 169 HG11 ILE 169 4.521 -0.046 -2.056
128 1HG2 ILE 169 HG21 ILE 169 6.253 3.125 0.153
129 2HG2 ILE 169 HG22 ILE 169 7.188 2.574 -1.239
130 3HG2 ILE 169 HG23 ILE 169 6.926 1.495 0.132
131 1HD1 ILE 169 HD11 ILE 169 7.051 1.266 -2.969
132 2HD1 ILE 169 HD12 ILE 169 5.602 0.878 -3.897
133 3HD1 ILE 169 HD13 ILE 169 6.681 -0.412 -3.365
134 H ILE 170 HN ILE 170 5.198 2.902 1.732
135 HA ILE 170 HA ILE 170 6.467 0.794 3.129
136 HB ILE 170 HB ILE 170 5.871 3.471 4.346
137 1HG1 ILE 170 HG12 ILE 170 6.670 4.047 2.163
138 2HG1 ILE 170 HG11 ILE 170 8.009 4.261 3.282
139 1HG2 ILE 170 HG21 ILE 170 8.502 2.150 4.575
140 2HG2 ILE 170 HG22 ILE 170 7.148 1.360 5.382
141 3HG2 ILE 170 HG23 ILE 170 7.561 3.028 5.781
142 1HD1 ILE 170 HD11 ILE 170 7.774 1.655 1.890
143 2HD1 ILE 170 HD12 ILE 170 9.207 2.553 2.389
144 3HD1 ILE 170 HD13 ILE 170 8.304 3.056 0.962
145 H LEU 171 HN LEU 171 3.386 2.405 3.477
146 HA LEU 171 HA LEU 171 2.789 1.438 6.087
147 1HB LEU 171 HB2 LEU 171 1.092 2.504 3.850
148 2HB LEU 171 HB1 LEU 171 0.413 2.020 5.392
149 HG LEU 171 HG LEU 171 2.356 3.733 6.217
150 1HD1 LEU 171 HD11 LEU 171 2.445 4.155 3.547
151 2HD1 LEU 171 HD12 LEU 171 2.852 5.370 4.760
152 3HD1 LEU 171 HD13 LEU 171 1.245 5.353 4.033
153 1HD2 LEU 171 HD21 LEU 171 -0.455 4.471 5.410
154 2HD2 LEU 171 HD22 LEU 171 0.560 5.343 6.559
155 3HD2 LEU 171 HD23 LEU 171 0.014 3.707 6.929
156 H ASP 172 HN ASP 172 3.128 -0.180 3.265
157 HA ASP 172 HA ASP 172 1.774 -2.516 4.293
158 1HB ASP 172 HB2 ASP 172 1.139 -1.531 1.502
159 2HB ASP 172 HB1 ASP 172 0.442 -2.930 2.331
160 H ALA 173 HN ALA 173 4.489 -1.300 3.354
161 HA ALA 173 HA ALA 173 5.338 -3.170 1.328
162 1HB ALA 173 HB1 ALA 173 7.636 -2.181 1.954
163 2HB ALA 173 HB2 ALA 173 6.710 -1.015 2.894
164 3HB ALA 173 HB3 ALA 173 6.468 -1.134 1.151
165 H GLY 174 HN GLY 174 5.606 -2.627 4.775
166 1HA GLY 174 HA2 GLY 174 6.626 -5.390 5.079
167 2HA GLY 174 HA1 GLY 174 7.317 -4.048 6.010
168 H TYR 175 HN TYR 175 4.351 -3.017 5.998
169 HA TYR 175 HA TYR 175 2.516 -3.127 7.314
170 1HB TYR 175 HB2 TYR 175 1.623 -5.172 7.452
171 2HB TYR 175 HB1 TYR 175 3.150 -5.831 6.887
172 HD1 TYR 175 HD1 TYR 175 4.339 -7.311 8.238
173 HD2 TYR 175 HD2 TYR 175 1.384 -4.815 10.009
174 HE1 TYR 175 HE1 TYR 175 4.606 -8.516 10.364
175 HE2 TYR 175 HE2 TYR 175 1.643 -6.013 12.142
176 HH TYR 175 HH TYR 175 2.523 -8.571 12.720
177 H PHE 176 HN PHE 176 5.414 -4.518 8.851
178 HA PHE 176 HA PHE 176 4.668 -3.306 11.392
179 1HB PHE 176 HB2 PHE 176 5.468 -5.555 11.569
180 2HB PHE 176 HB1 PHE 176 6.888 -5.190 10.580
181 HD1 PHE 176 HD1 PHE 176 5.348 -4.839 13.891
182 HD2 PHE 176 HD2 PHE 176 8.807 -4.106 11.523
183 HE1 PHE 176 HE1 PHE 176 6.638 -4.359 15.931
184 HE2 PHE 176 HE2 PHE 176 10.104 -3.625 13.559
185 HZ PHE 176 HZ PHE 176 9.019 -3.751 15.765
186 H LEU 177 HN LEU 177 6.240 -2.318 8.653
187 HA LEU 177 HA LEU 177 8.559 -1.065 9.575
188 1HB LEU 177 HB2 LEU 177 6.824 0.121 7.430
189 2HB LEU 177 HB1 LEU 177 8.570 0.155 7.568
190 HG LEU 177 HG LEU 177 6.865 -2.221 6.827
191 1HD1 LEU 177 HD11 LEU 177 8.559 -1.987 4.818
192 2HD1 LEU 177 HD12 LEU 177 8.578 -0.303 5.342
193 3HD1 LEU 177 HD13 LEU 177 7.057 -1.063 4.874
194 1HD2 LEU 177 HD21 LEU 177 9.656 -2.020 7.779
195 2HD2 LEU 177 HD22 LEU 177 9.370 -3.054 6.378
196 3HD2 LEU 177 HD23 LEU 177 8.510 -3.357 7.889
197 HA PRO 178 HA PRO 178 5.749 2.839 10.352
198 1HB PRO 178 HB2 PRO 178 3.114 1.652 10.896
199 2HB PRO 178 HB1 PRO 178 3.538 3.001 9.841
200 1HG PRO 178 HG2 PRO 178 2.755 0.627 8.857
201 2HG PRO 178 HG1 PRO 178 3.970 1.627 8.037
202 1HD PRO 178 HD2 PRO 178 4.360 -0.775 9.791
203 2HD PRO 178 HD1 PRO 178 5.158 -0.361 8.258
204 H LEU 179 HN LEU 179 7.259 1.628 12.112
205 HA LEU 179 HA LEU 179 5.665 1.305 14.565
206 1HB LEU 179 HB2 LEU 179 7.830 -0.185 13.484
207 2HB LEU 179 HB1 LEU 179 8.408 0.590 14.946
208 HG LEU 179 HG LEU 179 7.530 -1.692 15.329
209 1HD1 LEU 179 HD11 LEU 179 7.324 0.427 16.925
210 2HD1 LEU 179 HD12 LEU 179 6.713 -1.165 17.376
211 3HD1 LEU 179 HD13 LEU 179 5.609 0.059 16.744
212 1HD2 LEU 179 HD21 LEU 179 5.596 -1.081 13.561
213 2HD2 LEU 179 HD22 LEU 179 4.736 -0.787 15.072
214 3HD2 LEU 179 HD23 LEU 179 5.454 -2.368 14.759
215 H ARG 180 HN ARG 180 8.817 2.576 13.494
216 HA ARG 180 HA ARG 180 8.878 4.422 15.736
217 1HB ARG 180 HB2 ARG 180 11.101 5.053 14.849
218 2HB ARG 180 HB1 ARG 180 10.954 3.315 15.132
219 1HG ARG 180 HG2 ARG 180 10.161 3.745 12.473
220 2HG ARG 180 HG1 ARG 180 11.610 4.721 12.721
221 1HD ARG 180 HD2 ARG 180 12.736 2.830 12.320
222 2HD ARG 180 HD1 ARG 180 12.271 2.369 13.956
223 HE ARG 180 HE ARG 180 10.174 1.538 12.472
224 1HH1 ARG 180 1HH1 ARG 180 13.618 1.042 12.203
225 2HH1 ARG 180 2HH1 ARG 180 13.462 -0.514 11.461
226 1HH2 ARG 180 1HH2 ARG 180 9.966 -0.509 11.498
227 2HH2 ARG 180 2HH2 ARG 180 11.389 -1.395 11.061
228 1HG HSL 181 HG1 HSL 181 3.871 6.352 11.096
229 2HG HSL 181 HG2 HSL 181 4.280 4.924 12.182
230 H HSL 181 HN HSL 181 6.765 4.640 13.790
231 HA HSL 181 HA HSL 181 7.373 7.399 12.602
232 1HB HSL 181 HB1 HSL 181 6.133 6.920 10.701
233 2HB HSL 181 HB2 HSL 181 6.435 5.152 11.138
Start of MODEL 5
1 1H PHE 155 HT1 PHE 155 -2.087 7.690 -5.609
2 2H PHE 155 HT2 PHE 155 -3.214 7.547 -6.896
3 3H PHE 155 HT3 PHE 155 -1.722 8.357 -7.145
4 HA PHE 155 HA PHE 155 -1.884 5.541 -6.353
5 1HB PHE 155 HB2 PHE 155 -2.898 6.596 -8.698
6 2HB PHE 155 HB1 PHE 155 -1.277 6.088 -9.150
7 HD1 PHE 155 HD1 PHE 155 -4.596 5.069 -8.892
8 HD2 PHE 155 HD2 PHE 155 -0.627 3.672 -8.260
9 HE1 PHE 155 HE1 PHE 155 -5.387 2.747 -9.091
10 HE2 PHE 155 HE2 PHE 155 -1.409 1.347 -8.459
11 HZ PHE 155 HZ PHE 155 -3.791 0.883 -8.875
12 H LEU 156 HN LEU 156 0.102 4.469 -6.593
13 HA LEU 156 HA LEU 156 2.394 6.101 -6.164
14 1HB LEU 156 HB2 LEU 156 3.608 4.010 -5.942
15 2HB LEU 156 HB1 LEU 156 2.111 3.957 -5.032
16 HG LEU 156 HG LEU 156 1.370 2.869 -7.439
17 1HD1 LEU 156 HD11 LEU 156 3.807 1.322 -6.877
18 2HD1 LEU 156 HD12 LEU 156 4.056 2.877 -7.671
19 3HD1 LEU 156 HD13 LEU 156 3.007 1.668 -8.411
20 1HD2 LEU 156 HD21 LEU 156 2.335 1.529 -4.920
21 2HD2 LEU 156 HD22 LEU 156 1.454 0.710 -6.211
22 3HD2 LEU 156 HD23 LEU 156 0.684 2.015 -5.308
23 H GLN 157 HN GLN 157 3.533 7.057 -7.710
24 HA GLN 157 HA GLN 157 4.559 5.663 -9.947
25 1HB GLN 157 HB2 GLN 157 2.022 6.335 -10.452
26 2HB GLN 157 HB1 GLN 157 2.789 7.852 -10.899
27 1HG GLN 157 HG2 GLN 157 4.209 5.621 -12.032
28 2HG GLN 157 HG1 GLN 157 2.502 5.568 -12.466
29 1HE2 GLN 157 HE21 GLN 157 5.152 7.918 -12.214
30 2HE2 GLN 157 HE22 GLN 157 4.770 8.760 -13.673
31 H SER 158 HN SER 158 3.758 8.803 -8.549
32 HA SER 158 HA SER 158 5.852 10.195 -9.904
33 1HB SER 158 HB2 SER 158 5.113 11.620 -7.556
34 2HB SER 158 HB1 SER 158 4.622 11.942 -9.226
35 HG SER 158 HG SER 158 2.866 11.567 -7.721
36 H ASP 159 HN ASP 159 7.291 8.295 -9.195
37 HA ASP 159 HA ASP 159 9.299 7.819 -8.214
38 1HB ASP 159 HB2 ASP 159 8.962 10.502 -7.526
39 2HB ASP 159 HB1 ASP 159 9.267 9.693 -5.993
40 H VAL 160 HN VAL 160 7.124 8.980 -5.645
41 HA VAL 160 HA VAL 160 6.051 7.837 -3.977
42 HB VAL 160 HB VAL 160 6.539 5.768 -5.755
43 1HG1 VAL 160 HG11 VAL 160 7.232 3.855 -4.411
44 2HG1 VAL 160 HG12 VAL 160 7.555 4.920 -3.043
45 3HG1 VAL 160 HG13 VAL 160 8.519 5.055 -4.513
46 1HG2 VAL 160 HG21 VAL 160 4.844 4.574 -4.501
47 2HG2 VAL 160 HG22 VAL 160 4.447 6.290 -4.589
48 3HG2 VAL 160 HG23 VAL 160 5.116 5.616 -3.103
49 H PHE 161 HN PHE 161 9.411 6.829 -4.492
50 HA PHE 161 HA PHE 161 9.976 6.545 -1.705
51 1HB PHE 161 HB2 PHE 161 12.275 6.157 -2.410
52 2HB PHE 161 HB1 PHE 161 11.166 5.234 -3.418
53 HD1 PHE 161 HD1 PHE 161 11.048 5.585 -5.753
54 HD2 PHE 161 HD2 PHE 161 13.328 8.221 -3.309
55 HE1 PHE 161 HE1 PHE 161 12.057 6.575 -7.767
56 HE2 PHE 161 HE2 PHE 161 14.338 9.217 -5.320
57 HZ PHE 161 HZ PHE 161 13.703 8.394 -7.553
58 H PHE 162 HN PHE 162 9.225 9.246 -3.206
59 HA PHE 162 HA PHE 162 10.613 10.916 -1.367
60 1HB PHE 162 HB2 PHE 162 12.017 10.402 -3.694
61 2HB PHE 162 HB1 PHE 162 11.223 11.945 -4.015
62 HD1 PHE 162 HD1 PHE 162 13.305 10.229 -1.447
63 HD2 PHE 162 HD2 PHE 162 12.173 13.902 -3.270
64 HE1 PHE 162 HE1 PHE 162 15.035 11.402 -0.150
65 HE2 PHE 162 HE2 PHE 162 13.902 15.083 -1.977
66 HZ PHE 162 HZ PHE 162 15.335 13.832 -0.415
67 H LEU 163 HN LEU 163 7.938 10.216 -3.007
68 HA LEU 163 HA LEU 163 7.082 12.695 -4.055
69 1HB LEU 163 HB2 LEU 163 6.028 10.112 -3.811
70 2HB LEU 163 HB1 LEU 163 4.949 11.116 -2.861
71 HG LEU 163 HG LEU 163 5.678 11.840 -5.684
72 1HD1 LEU 163 HD11 LEU 163 4.679 9.927 -6.306
73 2HD1 LEU 163 HD12 LEU 163 3.192 10.781 -5.896
74 3HD1 LEU 163 HD13 LEU 163 3.930 9.684 -4.729
75 1HD2 LEU 163 HD21 LEU 163 4.513 13.377 -3.909
76 2HD2 LEU 163 HD22 LEU 163 3.089 12.423 -4.328
77 3HD2 LEU 163 HD23 LEU 163 3.939 13.333 -5.577
78 H PHE 164 HN PHE 164 7.070 11.165 -0.925
79 HA PHE 164 HA PHE 164 6.725 11.930 1.181
80 1HB PHE 164 HB2 PHE 164 8.268 13.775 -0.120
81 2HB PHE 164 HB1 PHE 164 6.952 14.779 0.495
82 HD1 PHE 164 HD1 PHE 164 6.410 13.200 3.032
83 HD2 PHE 164 HD2 PHE 164 10.020 14.556 1.231
84 HE1 PHE 164 HE1 PHE 164 7.491 13.244 5.241
85 HE2 PHE 164 HE2 PHE 164 11.108 14.601 3.436
86 HZ PHE 164 HZ PHE 164 9.843 13.945 5.445
87 H LEU 165 HN LEU 165 4.581 12.583 -1.242
88 HA LEU 165 HA LEU 165 2.803 14.386 0.053
89 1HB LEU 165 HB2 LEU 165 2.955 13.031 -2.448
90 2HB LEU 165 HB1 LEU 165 1.381 12.709 -1.744
91 HG LEU 165 HG LEU 165 2.400 15.522 -1.886
92 1HD1 LEU 165 HD11 LEU 165 0.863 15.415 -4.074
93 2HD1 LEU 165 HD12 LEU 165 1.575 13.802 -4.139
94 3HD1 LEU 165 HD13 LEU 165 2.616 15.226 -4.115
95 1HD2 LEU 165 HD21 LEU 165 -0.347 14.281 -1.966
96 2HD2 LEU 165 HD22 LEU 165 0.001 16.009 -2.024
97 3HD2 LEU 165 HD23 LEU 165 0.398 15.078 -0.581
98 H LEU 166 HN LEU 166 2.392 10.941 -0.708
99 HA LEU 166 HA LEU 166 1.535 10.285 1.939
100 1HB LEU 166 HB2 LEU 166 -0.423 11.131 -0.032
101 2HB LEU 166 HB1 LEU 166 -0.739 9.498 0.525
102 HG LEU 166 HG LEU 166 -0.396 11.864 2.366
103 1HD1 LEU 166 HD11 LEU 166 -2.981 11.230 2.604
104 2HD1 LEU 166 HD12 LEU 166 -2.743 10.816 0.907
105 3HD1 LEU 166 HD13 LEU 166 -2.391 12.449 1.474
106 1HD2 LEU 166 HD21 LEU 166 -1.733 10.122 3.820
107 2HD2 LEU 166 HD22 LEU 166 0.026 10.057 3.706
108 3HD2 LEU 166 HD23 LEU 166 -0.962 8.966 2.734
109 HA PRO 167 HA PRO 167 3.294 7.027 -1.088
110 1HB PRO 167 HB2 PRO 167 5.053 6.163 0.917
111 2HB PRO 167 HB1 PRO 167 5.468 7.158 -0.490
112 1HG PRO 167 HG2 PRO 167 4.902 7.983 2.319
113 2HG PRO 167 HG1 PRO 167 6.042 8.674 1.149
114 1HD PRO 167 HD2 PRO 167 3.725 9.891 1.726
115 2HD PRO 167 HD1 PRO 167 4.385 9.901 0.076
116 HA PRO 168 HA PRO 168 0.411 4.487 1.343
117 1HB PRO 168 HB2 PRO 168 -0.423 2.970 -0.716
118 2HB PRO 168 HB1 PRO 168 -1.021 4.622 -0.455
119 1HG PRO 168 HG2 PRO 168 1.133 3.663 -2.317
120 2HG PRO 168 HG1 PRO 168 -0.203 4.783 -2.646
121 1HD PRO 168 HD2 PRO 168 2.303 5.636 -2.113
122 2HD PRO 168 HD1 PRO 168 0.866 6.551 -1.614
123 H ILE 169 HN ILE 169 3.375 3.788 -0.082
124 HA ILE 169 HA ILE 169 3.260 0.943 0.057
125 HB ILE 169 HB ILE 169 4.838 1.904 -1.448
126 1HG1 ILE 169 HG12 ILE 169 6.945 1.088 0.359
127 2HG1 ILE 169 HG11 ILE 169 5.552 0.021 0.498
128 1HG2 ILE 169 HG21 ILE 169 5.682 3.898 -0.978
129 2HG2 ILE 169 HG22 ILE 169 6.869 3.069 0.028
130 3HG2 ILE 169 HG23 ILE 169 5.387 3.698 0.749
131 1HD1 ILE 169 HD11 ILE 169 5.662 -0.580 -1.771
132 2HD1 ILE 169 HD12 ILE 169 7.319 -0.641 -1.169
133 3HD1 ILE 169 HD13 ILE 169 6.784 0.730 -2.142
134 H ILE 170 HN ILE 170 6.011 2.111 1.743
135 HA ILE 170 HA ILE 170 6.761 1.260 3.781
136 HB ILE 170 HB ILE 170 4.753 3.164 4.894
137 1HG1 ILE 170 HG12 ILE 170 5.373 4.177 2.763
138 2HG1 ILE 170 HG11 ILE 170 6.117 5.063 4.091
139 1HG2 ILE 170 HG21 ILE 170 6.501 2.092 6.294
140 2HG2 ILE 170 HG22 ILE 170 6.588 3.853 6.277
141 3HG2 ILE 170 HG23 ILE 170 7.724 2.904 5.318
142 1HD1 ILE 170 HD11 ILE 170 7.352 3.970 1.822
143 2HD1 ILE 170 HD12 ILE 170 7.901 3.021 3.204
144 3HD1 ILE 170 HD13 ILE 170 8.115 4.772 3.196
145 H LEU 171 HN LEU 171 3.332 1.901 4.265
146 HA LEU 171 HA LEU 171 3.031 -0.038 6.320
147 1HB LEU 171 HB2 LEU 171 0.511 0.306 5.730
148 2HB LEU 171 HB1 LEU 171 1.423 1.582 6.508
149 HG LEU 171 HG LEU 171 1.312 1.656 3.538
150 1HD1 LEU 171 HD11 LEU 171 -1.001 2.876 4.888
151 2HD1 LEU 171 HD12 LEU 171 -1.032 1.118 4.739
152 3HD1 LEU 171 HD13 LEU 171 -0.874 2.123 3.298
153 1HD2 LEU 171 HD21 LEU 171 1.789 3.437 5.788
154 2HD2 LEU 171 HD22 LEU 171 0.672 4.117 4.604
155 3HD2 LEU 171 HD23 LEU 171 2.278 3.588 4.101
156 H ASP 172 HN ASP 172 1.983 -0.011 2.917
157 HA ASP 172 HA ASP 172 1.052 -2.711 3.000
158 1HB ASP 172 HB2 ASP 172 0.619 -0.614 1.311
159 2HB ASP 172 HB1 ASP 172 1.759 -1.584 0.365
160 H ALA 173 HN ALA 173 4.107 -1.259 2.726
161 HA ALA 173 HA ALA 173 5.361 -3.303 1.159
162 1HB ALA 173 HB1 ALA 173 6.093 -0.747 2.276
163 2HB ALA 173 HB2 ALA 173 6.809 -1.630 0.927
164 3HB ALA 173 HB3 ALA 173 7.349 -1.950 2.575
165 H GLY 174 HN GLY 174 5.722 -2.313 4.573
166 1HA GLY 174 HA2 GLY 174 6.440 -5.121 5.173
167 2HA GLY 174 HA1 GLY 174 7.165 -3.730 5.998
168 H TYR 175 HN TYR 175 4.382 -2.455 5.980
169 HA TYR 175 HA TYR 175 2.555 -2.317 7.325
170 1HB TYR 175 HB2 TYR 175 1.464 -4.265 7.076
171 2HB TYR 175 HB1 TYR 175 2.958 -5.187 7.039
172 HD1 TYR 175 HD1 TYR 175 0.433 -3.694 9.302
173 HD2 TYR 175 HD2 TYR 175 3.648 -6.452 8.916
174 HE1 TYR 175 HE1 TYR 175 -0.093 -4.608 11.523
175 HE2 TYR 175 HE2 TYR 175 3.131 -7.376 11.136
176 HH TYR 175 HH TYR 175 1.161 -5.848 13.349
177 H PHE 176 HN PHE 176 5.153 -4.246 8.837
178 HA PHE 176 HA PHE 176 4.590 -2.980 11.396
179 1HB PHE 176 HB2 PHE 176 5.439 -5.510 10.729
180 2HB PHE 176 HB1 PHE 176 6.942 -4.731 11.240
181 HD1 PHE 176 HD1 PHE 176 7.478 -5.351 13.378
182 HD2 PHE 176 HD2 PHE 176 3.407 -4.538 12.435
183 HE1 PHE 176 HE1 PHE 176 6.863 -5.714 15.732
184 HE2 PHE 176 HE2 PHE 176 2.786 -4.899 14.788
185 HZ PHE 176 HZ PHE 176 4.515 -5.487 16.440
186 H LEU 177 HN LEU 177 5.976 -1.794 8.841
187 HA LEU 177 HA LEU 177 8.599 -1.086 9.695
188 1HB LEU 177 HB2 LEU 177 6.793 -0.378 7.464
189 2HB LEU 177 HB1 LEU 177 7.977 0.841 7.894
190 HG LEU 177 HG LEU 177 8.553 -2.001 7.057
191 1HD1 LEU 177 HD11 LEU 177 7.910 0.056 5.448
192 2HD1 LEU 177 HD12 LEU 177 9.032 -1.228 4.996
193 3HD1 LEU 177 HD13 LEU 177 9.649 0.311 5.597
194 1HD2 LEU 177 HD21 LEU 177 10.232 -1.507 8.605
195 2HD2 LEU 177 HD22 LEU 177 10.323 0.182 8.107
196 3HD2 LEU 177 HD23 LEU 177 10.945 -1.085 7.049
197 HA PRO 178 HA PRO 178 6.238 3.201 10.649
198 1HB PRO 178 HB2 PRO 178 3.729 1.835 11.529
199 2HB PRO 178 HB1 PRO 178 3.942 3.420 10.774
200 1HG PRO 178 HG2 PRO 178 3.048 1.370 9.350
201 2HG PRO 178 HG1 PRO 178 4.211 2.512 8.650
202 1HD PRO 178 HD2 PRO 178 4.651 -0.260 9.667
203 2HD PRO 178 HD1 PRO 178 5.407 0.577 8.296
204 H LEU 179 HN LEU 179 7.921 2.777 12.231
205 HA LEU 179 HA LEU 179 7.070 1.538 14.733
206 1HB LEU 179 HB2 LEU 179 9.449 1.488 13.398
207 2HB LEU 179 HB1 LEU 179 9.750 2.742 14.585
208 HG LEU 179 HG LEU 179 10.524 0.662 15.482
209 1HD1 LEU 179 HD11 LEU 179 9.299 2.255 16.981
210 2HD1 LEU 179 HD12 LEU 179 9.343 0.583 17.542
211 3HD1 LEU 179 HD13 LEU 179 7.878 1.226 16.800
212 1HD2 LEU 179 HD21 LEU 179 8.534 -1.062 15.917
213 2HD2 LEU 179 HD22 LEU 179 9.539 -1.112 14.469
214 3HD2 LEU 179 HD23 LEU 179 7.953 -0.343 14.414
215 H ARG 180 HN ARG 180 8.737 4.550 13.793
216 HA ARG 180 HA ARG 180 7.849 5.828 16.245
217 1HB ARG 180 HB2 ARG 180 9.572 6.815 13.961
218 2HB ARG 180 HB1 ARG 180 9.189 7.764 15.402
219 1HG ARG 180 HG2 ARG 180 10.559 5.088 15.510
220 2HG ARG 180 HG1 ARG 180 11.427 6.621 15.397
221 1HD ARG 180 HD2 ARG 180 11.389 6.206 17.682
222 2HD ARG 180 HD1 ARG 180 10.031 7.306 17.453
223 HE ARG 180 HE ARG 180 9.308 4.526 17.322
224 1HH1 ARG 180 1HH1 ARG 180 9.809 7.260 19.432
225 2HH1 ARG 180 2HH1 ARG 180 8.782 6.643 20.682
226 1HH2 ARG 180 1HH2 ARG 180 7.957 3.712 18.963
227 2HH2 ARG 180 2HH2 ARG 180 7.731 4.628 20.417
228 1HG HSL 181 HG1 HSL 181 2.617 7.122 11.495
229 2HG HSL 181 HG2 HSL 181 2.633 5.327 11.084
230 H HSL 181 HN HSL 181 6.051 4.958 13.989
231 HA HSL 181 HA HSL 181 4.714 7.659 13.428
232 1HB HSL 181 HB1 HSL 181 4.986 6.893 11.201
233 2HB HSL 181 HB2 HSL 181 4.962 5.119 11.709
Start of MODEL 6
1 1H PHE 155 HT1 PHE 155 -4.426 8.065 -8.021
2 2H PHE 155 HT2 PHE 155 -3.557 8.598 -9.402
3 3H PHE 155 HT3 PHE 155 -5.233 8.936 -9.256
4 HA PHE 155 HA PHE 155 -3.222 9.898 -7.349
5 1HB PHE 155 HB2 PHE 155 -3.790 12.099 -8.743
6 2HB PHE 155 HB1 PHE 155 -2.474 11.026 -9.200
7 HD1 PHE 155 HD1 PHE 155 -2.380 10.173 -11.346
8 HD2 PHE 155 HD2 PHE 155 -6.082 11.651 -9.857
9 HE1 PHE 155 HE1 PHE 155 -3.386 9.888 -13.574
10 HE2 PHE 155 HE2 PHE 155 -7.095 11.367 -12.081
11 HZ PHE 155 HZ PHE 155 -5.747 10.484 -13.943
12 H LEU 156 HN LEU 156 -4.047 11.387 -5.885
13 HA LEU 156 HA LEU 156 -5.590 12.282 -4.483
14 1HB LEU 156 HB2 LEU 156 -6.928 12.578 -7.145
15 2HB LEU 156 HB1 LEU 156 -7.760 13.059 -5.682
16 HG LEU 156 HG LEU 156 -5.144 14.202 -5.685
17 1HD1 LEU 156 HD11 LEU 156 -5.173 15.557 -7.634
18 2HD1 LEU 156 HD12 LEU 156 -6.771 14.971 -8.093
19 3HD1 LEU 156 HD13 LEU 156 -5.382 13.886 -8.161
20 1HD2 LEU 156 HD21 LEU 156 -7.481 14.868 -4.661
21 2HD2 LEU 156 HD22 LEU 156 -7.602 15.801 -6.152
22 3HD2 LEU 156 HD23 LEU 156 -6.263 16.085 -5.041
23 H GLN 157 HN GLN 157 -5.560 9.401 -4.903
24 HA GLN 157 HA GLN 157 -8.236 8.481 -4.914
25 1HB GLN 157 HB2 GLN 157 -7.313 6.478 -5.235
26 2HB GLN 157 HB1 GLN 157 -5.760 7.295 -5.246
27 1HG GLN 157 HG2 GLN 157 -5.494 6.856 -2.868
28 2HG GLN 157 HG1 GLN 157 -7.079 6.088 -2.822
29 1HE2 GLN 157 HE21 GLN 157 -7.055 3.968 -2.918
30 2HE2 GLN 157 HE22 GLN 157 -5.830 2.990 -3.644
31 H SER 158 HN SER 158 -5.819 8.674 -2.307
32 HA SER 158 HA SER 158 -7.833 9.405 -0.426
33 1HB SER 158 HB2 SER 158 -8.231 6.957 -0.579
34 2HB SER 158 HB1 SER 158 -6.554 6.681 -0.080
35 HG SER 158 HG SER 158 -8.120 6.593 1.652
36 H ASP 159 HN ASP 159 -5.444 10.542 -1.298
37 HA ASP 159 HA ASP 159 -4.181 11.030 1.224
38 1HB ASP 159 HB2 ASP 159 -2.827 9.352 -0.841
39 2HB ASP 159 HB1 ASP 159 -1.853 10.521 0.048
40 H VAL 160 HN VAL 160 -3.546 11.266 -2.255
41 HA VAL 160 HA VAL 160 -3.150 13.012 -3.649
42 HB VAL 160 HB VAL 160 -4.251 14.749 -1.451
43 1HG1 VAL 160 HG11 VAL 160 -3.302 16.116 -3.110
44 2HG1 VAL 160 HG12 VAL 160 -5.028 16.092 -3.469
45 3HG1 VAL 160 HG13 VAL 160 -3.917 15.101 -4.414
46 1HG2 VAL 160 HG21 VAL 160 -6.352 14.088 -1.846
47 2HG2 VAL 160 HG22 VAL 160 -5.602 12.643 -2.523
48 3HG2 VAL 160 HG23 VAL 160 -6.087 13.963 -3.584
49 H PHE 161 HN PHE 161 -2.634 14.309 -0.422
50 HA PHE 161 HA PHE 161 -0.257 15.720 -1.173
51 1HB PHE 161 HB2 PHE 161 -1.272 15.312 1.633
52 2HB PHE 161 HB1 PHE 161 -0.280 16.630 1.016
53 HD1 PHE 161 HD1 PHE 161 -3.656 15.258 1.251
54 HD2 PHE 161 HD2 PHE 161 -1.264 18.445 -0.240
55 HE1 PHE 161 HE1 PHE 161 -5.687 16.586 0.844
56 HE2 PHE 161 HE2 PHE 161 -3.289 19.780 -0.649
57 HZ PHE 161 HZ PHE 161 -5.505 18.851 -0.106
58 H PHE 162 HN PHE 162 -0.632 12.529 -0.697
59 HA PHE 162 HA PHE 162 2.117 12.126 -0.200
60 1HB PHE 162 HB2 PHE 162 0.471 12.319 2.112
61 2HB PHE 162 HB1 PHE 162 1.019 10.648 1.958
62 HD1 PHE 162 HD1 PHE 162 1.721 13.261 3.809
63 HD2 PHE 162 HD2 PHE 162 3.678 10.941 0.827
64 HE1 PHE 162 HE1 PHE 162 3.902 13.895 4.754
65 HE2 PHE 162 HE2 PHE 162 5.864 11.570 1.767
66 HZ PHE 162 HZ PHE 162 5.978 13.047 3.733
67 H LEU 163 HN LEU 163 -0.463 11.243 -1.732
68 HA LEU 163 HA LEU 163 -0.604 8.430 -1.400
69 1HB LEU 163 HB2 LEU 163 -2.203 10.105 -2.614
70 2HB LEU 163 HB1 LEU 163 -1.159 9.820 -3.992
71 HG LEU 163 HG LEU 163 -2.483 7.571 -2.503
72 1HD1 LEU 163 HD11 LEU 163 -4.198 9.129 -3.308
73 2HD1 LEU 163 HD12 LEU 163 -4.227 7.591 -4.169
74 3HD1 LEU 163 HD13 LEU 163 -3.521 9.014 -4.932
75 1HD2 LEU 163 HD21 LEU 163 -0.636 6.921 -3.865
76 2HD2 LEU 163 HD22 LEU 163 -1.240 7.861 -5.228
77 3HD2 LEU 163 HD23 LEU 163 -2.122 6.436 -4.677
78 H PHE 164 HN PHE 164 1.253 10.643 -3.372
79 HA PHE 164 HA PHE 164 3.034 10.344 -4.783
80 1HB PHE 164 HB2 PHE 164 3.660 9.355 -2.301
81 2HB PHE 164 HB1 PHE 164 4.076 7.999 -3.346
82 HD1 PHE 164 HD1 PHE 164 5.678 10.267 -1.640
83 HD2 PHE 164 HD2 PHE 164 5.055 9.354 -5.749
84 HE1 PHE 164 HE1 PHE 164 7.809 11.362 -2.202
85 HE2 PHE 164 HE2 PHE 164 7.184 10.447 -6.319
86 HZ PHE 164 HZ PHE 164 8.564 11.453 -4.545
87 H LEU 165 HN LEU 165 0.590 8.792 -5.338
88 HA LEU 165 HA LEU 165 0.039 7.527 -7.209
89 1HB LEU 165 HB2 LEU 165 2.705 7.668 -7.644
90 2HB LEU 165 HB1 LEU 165 2.534 5.954 -7.284
91 HG LEU 165 HG LEU 165 0.490 6.674 -9.138
92 1HD1 LEU 165 HD11 LEU 165 1.452 7.869 -10.785
93 2HD1 LEU 165 HD12 LEU 165 3.049 7.176 -10.503
94 3HD1 LEU 165 HD13 LEU 165 2.460 8.481 -9.473
95 1HD2 LEU 165 HD21 LEU 165 1.508 4.961 -10.484
96 2HD2 LEU 165 HD22 LEU 165 1.546 4.458 -8.794
97 3HD2 LEU 165 HD23 LEU 165 3.008 5.074 -9.564
98 H LEU 166 HN LEU 166 1.621 6.271 -4.378
99 HA LEU 166 HA LEU 166 -0.367 4.214 -4.145
100 1HB LEU 166 HB2 LEU 166 1.978 3.621 -5.536
101 2HB LEU 166 HB1 LEU 166 2.212 2.917 -3.941
102 HG LEU 166 HG LEU 166 -0.134 1.867 -4.307
103 1HD1 LEU 166 HD11 LEU 166 -0.274 1.362 -6.880
104 2HD1 LEU 166 HD12 LEU 166 0.542 2.921 -7.007
105 3HD1 LEU 166 HD13 LEU 166 -1.020 2.807 -6.196
106 1HD2 LEU 166 HD21 LEU 166 1.881 0.700 -6.154
107 2HD2 LEU 166 HD22 LEU 166 0.888 -0.079 -4.923
108 3HD2 LEU 166 HD23 LEU 166 2.301 0.864 -4.449
109 HA PRO 167 HA PRO 167 0.917 5.654 -0.046
110 1HB PRO 167 HB2 PRO 167 -1.376 4.996 1.230
111 2HB PRO 167 HB1 PRO 167 -1.179 6.480 0.278
112 1HG PRO 167 HG2 PRO 167 -2.492 3.902 -0.471
113 2HG PRO 167 HG1 PRO 167 -2.997 5.563 -0.821
114 1HD PRO 167 HD2 PRO 167 -1.738 3.966 -2.639
115 2HD PRO 167 HD1 PRO 167 -1.619 5.731 -2.637
116 HA PRO 168 HA PRO 168 0.564 1.297 1.750
117 1HB PRO 168 HB2 PRO 168 -0.124 -0.764 0.279
118 2HB PRO 168 HB1 PRO 168 -1.348 0.438 0.741
119 1HG PRO 168 HG2 PRO 168 0.144 0.173 -1.851
120 2HG PRO 168 HG1 PRO 168 -1.599 0.388 -1.588
121 1HD PRO 168 HD2 PRO 168 0.154 2.441 -2.129
122 2HD PRO 168 HD1 PRO 168 -1.390 2.635 -1.282
123 H ILE 169 HN ILE 169 2.554 2.444 -0.432
124 HA ILE 169 HA ILE 169 4.144 0.157 -1.108
125 HB ILE 169 HB ILE 169 3.969 2.464 -2.312
126 1HG1 ILE 169 HG12 ILE 169 6.662 2.054 -2.727
127 2HG1 ILE 169 HG11 ILE 169 6.128 0.499 -2.095
128 1HG2 ILE 169 HG21 ILE 169 5.627 4.085 -1.770
129 2HG2 ILE 169 HG22 ILE 169 6.314 3.045 -0.523
130 3HG2 ILE 169 HG23 ILE 169 4.710 3.743 -0.304
131 1HD1 ILE 169 HD11 ILE 169 5.709 1.687 -4.695
132 2HD1 ILE 169 HD12 ILE 169 4.199 1.150 -3.958
133 3HD1 ILE 169 HD13 ILE 169 5.529 0.012 -4.172
134 H ILE 170 HN ILE 170 4.277 2.706 1.298
135 HA ILE 170 HA ILE 170 6.773 1.779 2.413
136 HB ILE 170 HB ILE 170 4.893 3.865 3.512
137 1HG1 ILE 170 HG12 ILE 170 7.176 5.072 2.401
138 2HG1 ILE 170 HG11 ILE 170 6.643 3.890 1.210
139 1HG2 ILE 170 HG21 ILE 170 7.825 3.415 4.048
140 2HG2 ILE 170 HG22 ILE 170 6.515 2.934 5.126
141 3HG2 ILE 170 HG23 ILE 170 6.793 4.641 4.783
142 1HD1 ILE 170 HD11 ILE 170 5.554 5.869 0.635
143 2HD1 ILE 170 HD12 ILE 170 5.152 6.242 2.311
144 3HD1 ILE 170 HD13 ILE 170 4.330 4.921 1.479
145 H LEU 171 HN LEU 171 3.669 2.414 4.049
146 HA LEU 171 HA LEU 171 4.270 0.738 6.234
147 1HB LEU 171 HB2 LEU 171 1.747 0.944 6.662
148 2HB LEU 171 HB1 LEU 171 2.729 2.394 6.715
149 HG LEU 171 HG LEU 171 1.738 2.033 4.047
150 1HD1 LEU 171 HD11 LEU 171 -0.523 2.391 5.955
151 2HD1 LEU 171 HD12 LEU 171 -0.009 0.763 5.515
152 3HD1 LEU 171 HD13 LEU 171 -0.543 1.887 4.266
153 1HD2 LEU 171 HD21 LEU 171 2.227 4.199 4.516
154 2HD2 LEU 171 HD22 LEU 171 1.708 4.070 6.196
155 3HD2 LEU 171 HD23 LEU 171 0.509 4.230 4.913
156 H ASP 172 HN ASP 172 2.122 0.219 3.447
157 HA ASP 172 HA ASP 172 1.423 -2.422 4.262
158 1HB ASP 172 HB2 ASP 172 0.474 -0.580 2.371
159 2HB ASP 172 HB1 ASP 172 1.015 -1.982 1.436
160 H ALA 173 HN ALA 173 4.323 -1.329 3.236
161 HA ALA 173 HA ALA 173 4.988 -3.307 1.290
162 1HB ALA 173 HB1 ALA 173 6.264 -1.035 2.464
163 2HB ALA 173 HB2 ALA 173 6.696 -1.914 1.000
164 3HB ALA 173 HB3 ALA 173 7.349 -2.421 2.558
165 H GLY 174 HN GLY 174 5.746 -2.836 4.718
166 1HA GLY 174 HA2 GLY 174 6.264 -5.741 4.931
167 2HA GLY 174 HA1 GLY 174 7.133 -4.523 5.884
168 H TYR 175 HN TYR 175 4.409 -3.070 6.020
169 HA TYR 175 HA TYR 175 2.540 -3.000 7.317
170 1HB TYR 175 HB2 TYR 175 2.371 -5.496 6.672
171 2HB TYR 175 HB1 TYR 175 3.033 -5.810 8.274
172 HD1 TYR 175 HD1 TYR 175 0.115 -4.692 6.392
173 HD2 TYR 175 HD2 TYR 175 1.736 -5.272 10.283
174 HE1 TYR 175 HE1 TYR 175 -2.141 -4.507 7.353
175 HE2 TYR 175 HE2 TYR 175 -0.517 -5.091 11.254
176 HH TYR 175 HH TYR 175 -2.749 -3.959 10.529
177 H PHE 176 HN PHE 176 5.470 -4.418 8.681
178 HA PHE 176 HA PHE 176 4.773 -3.399 11.324
179 1HB PHE 176 HB2 PHE 176 6.323 -5.600 10.364
180 2HB PHE 176 HB1 PHE 176 7.381 -4.545 11.310
181 HD1 PHE 176 HD1 PHE 176 4.030 -6.173 11.467
182 HD2 PHE 176 HD2 PHE 176 7.446 -4.793 13.597
183 HE1 PHE 176 HE1 PHE 176 3.121 -7.136 13.541
184 HE2 PHE 176 HE2 PHE 176 6.543 -5.754 15.675
185 HZ PHE 176 HZ PHE 176 4.379 -6.928 15.648
186 H LEU 177 HN LEU 177 5.635 -1.789 8.857
187 HA LEU 177 HA LEU 177 8.141 -0.613 9.667
188 1HB LEU 177 HB2 LEU 177 6.244 -0.285 7.411
189 2HB LEU 177 HB1 LEU 177 7.233 1.104 7.819
190 HG LEU 177 HG LEU 177 8.233 -1.635 7.040
191 1HD1 LEU 177 HD11 LEU 177 9.294 0.188 5.306
192 2HD1 LEU 177 HD12 LEU 177 7.674 0.831 5.575
193 3HD1 LEU 177 HD13 LEU 177 7.881 -0.818 4.988
194 1HD2 LEU 177 HD21 LEU 177 9.858 -0.921 8.514
195 2HD2 LEU 177 HD22 LEU 177 9.613 0.782 8.126
196 3HD2 LEU 177 HD23 LEU 177 10.447 -0.271 6.984
197 HA PRO 178 HA PRO 178 4.908 3.039 10.590
198 1HB PRO 178 HB2 PRO 178 2.743 1.245 11.574
199 2HB PRO 178 HB1 PRO 178 2.626 2.776 10.699
200 1HG PRO 178 HG2 PRO 178 2.161 0.476 9.455
201 2HG PRO 178 HG1 PRO 178 3.048 1.781 8.642
202 1HD PRO 178 HD2 PRO 178 4.086 -0.736 9.878
203 2HD PRO 178 HD1 PRO 178 4.604 0.090 8.394
204 H LEU 179 HN LEU 179 3.330 3.011 12.932
205 HA LEU 179 HA LEU 179 3.409 2.853 15.210
206 1HB LEU 179 HB2 LEU 179 4.699 0.495 14.402
207 2HB LEU 179 HB1 LEU 179 5.769 1.223 15.583
208 HG LEU 179 HG LEU 179 2.859 0.921 16.212
209 1HD1 LEU 179 HD11 LEU 179 3.077 -1.288 16.911
210 2HD1 LEU 179 HD12 LEU 179 4.838 -1.238 16.840
211 3HD1 LEU 179 HD13 LEU 179 3.897 -1.264 15.349
212 1HD2 LEU 179 HD21 LEU 179 3.696 1.979 18.006
213 2HD2 LEU 179 HD22 LEU 179 5.357 1.523 17.628
214 3HD2 LEU 179 HD23 LEU 179 4.295 0.383 18.454
215 H ARG 180 HN ARG 180 4.135 5.084 14.675
216 HA ARG 180 HA ARG 180 5.403 6.894 15.216
217 1HB ARG 180 HB2 ARG 180 7.125 4.975 16.798
218 2HB ARG 180 HB1 ARG 180 7.031 6.730 16.994
219 1HG ARG 180 HG2 ARG 180 5.637 6.198 18.671
220 2HG ARG 180 HG1 ARG 180 4.447 6.066 17.374
221 1HD ARG 180 HD2 ARG 180 4.177 3.897 17.771
222 2HD ARG 180 HD1 ARG 180 5.909 3.607 17.622
223 HE ARG 180 HE ARG 180 4.398 3.775 20.034
224 1HH1 ARG 180 1HH1 ARG 180 7.544 4.389 18.655
225 2HH1 ARG 180 2HH1 ARG 180 8.378 4.218 20.164
226 1HH2 ARG 180 1HH2 ARG 180 5.494 3.551 22.020
227 2HH2 ARG 180 2HH2 ARG 180 7.214 3.743 22.074
228 1HG HSL 181 HG1 HSL 181 9.209 5.529 9.512
229 2HG HSL 181 HG2 HSL 181 7.565 5.307 8.712
230 H HSL 181 HN HSL 181 5.777 6.045 12.777
231 HA HSL 181 HA HSL 181 8.811 6.050 12.340
232 1HB HSL 181 HB1 HSL 181 8.257 4.071 11.161
233 2HB HSL 181 HB2 HSL 181 6.543 4.651 10.805
Start of MODEL 7
1 1H PHE 155 HT1 PHE 155 0.557 8.887 -9.311
2 2H PHE 155 HT2 PHE 155 -0.595 9.690 -8.325
3 3H PHE 155 HT3 PHE 155 0.666 8.778 -7.604
4 HA PHE 155 HA PHE 155 1.166 11.089 -9.335
5 1HB PHE 155 HB2 PHE 155 0.011 11.002 -6.699
6 2HB PHE 155 HB1 PHE 155 1.584 11.788 -6.650
7 HD1 PHE 155 HD1 PHE 155 1.701 13.166 -9.205
8 HD2 PHE 155 HD2 PHE 155 -1.563 12.683 -6.517
9 HE1 PHE 155 HE1 PHE 155 0.696 15.242 -10.060
10 HE2 PHE 155 HE2 PHE 155 -2.575 14.759 -7.368
11 HZ PHE 155 HZ PHE 155 -1.446 16.040 -9.143
12 H LEU 156 HN LEU 156 3.312 11.916 -9.028
13 HA LEU 156 HA LEU 156 5.251 9.856 -8.708
14 1HB LEU 156 HB2 LEU 156 5.246 12.703 -9.498
15 2HB LEU 156 HB1 LEU 156 6.745 12.098 -8.821
16 HG LEU 156 HG LEU 156 5.532 10.443 -10.948
17 1HD1 LEU 156 HD11 LEU 156 7.079 12.806 -11.865
18 2HD1 LEU 156 HD12 LEU 156 5.364 13.014 -11.513
19 3HD1 LEU 156 HD13 LEU 156 5.880 11.836 -12.719
20 1HD2 LEU 156 HD21 LEU 156 8.346 11.438 -10.536
21 2HD2 LEU 156 HD22 LEU 156 7.818 10.106 -11.566
22 3HD2 LEU 156 HD23 LEU 156 7.701 9.964 -9.812
23 H GLN 157 HN GLN 157 7.362 10.652 -7.432
24 HA GLN 157 HA GLN 157 6.955 12.024 -4.995
25 1HB GLN 157 HB2 GLN 157 5.673 9.957 -4.499
26 2HB GLN 157 HB1 GLN 157 7.136 9.018 -4.758
27 1HG GLN 157 HG2 GLN 157 7.014 9.230 -2.453
28 2HG GLN 157 HG1 GLN 157 8.167 10.478 -2.925
29 1HE2 GLN 157 HE21 GLN 157 4.624 10.262 -2.835
30 2HE2 GLN 157 HE22 GLN 157 4.389 11.706 -1.915
31 H SER 158 HN SER 158 8.829 9.066 -5.493
32 HA SER 158 HA SER 158 11.221 10.442 -6.195
33 1HB SER 158 HB2 SER 158 12.512 10.128 -4.206
34 2HB SER 158 HB1 SER 158 11.003 10.907 -3.704
35 HG SER 158 HG SER 158 10.471 9.172 -2.626
36 H ASP 159 HN ASP 159 9.537 8.193 -6.997
37 HA ASP 159 HA ASP 159 11.627 6.307 -7.534
38 1HB ASP 159 HB2 ASP 159 10.011 4.442 -6.662
39 2HB ASP 159 HB1 ASP 159 11.087 5.270 -5.547
40 H VAL 160 HN VAL 160 8.104 6.710 -7.505
41 HA VAL 160 HA VAL 160 6.615 6.833 -9.233
42 HB VAL 160 HB VAL 160 8.955 7.306 -10.610
43 1HG1 VAL 160 HG11 VAL 160 8.847 6.007 -12.674
44 2HG1 VAL 160 HG12 VAL 160 7.553 5.020 -11.997
45 3HG1 VAL 160 HG13 VAL 160 9.166 4.968 -11.287
46 1HG2 VAL 160 HG21 VAL 160 6.650 8.352 -10.762
47 2HG2 VAL 160 HG22 VAL 160 6.275 7.104 -11.950
48 3HG2 VAL 160 HG23 VAL 160 7.577 8.255 -12.258
49 H PHE 161 HN PHE 161 8.908 4.115 -9.562
50 HA PHE 161 HA PHE 161 6.972 2.309 -10.586
51 1HB PHE 161 HB2 PHE 161 9.760 2.295 -10.103
52 2HB PHE 161 HB1 PHE 161 9.090 0.921 -9.230
53 HD1 PHE 161 HD1 PHE 161 6.880 0.116 -10.984
54 HD2 PHE 161 HD2 PHE 161 10.830 1.381 -11.940
55 HE1 PHE 161 HE1 PHE 161 6.779 -1.167 -13.081
56 HE2 PHE 161 HE2 PHE 161 10.736 0.101 -14.039
57 HZ PHE 161 HZ PHE 161 8.709 -1.176 -14.612
58 H PHE 162 HN PHE 162 7.992 3.198 -7.384
59 HA PHE 162 HA PHE 162 6.842 1.022 -5.976
60 1HB PHE 162 HB2 PHE 162 8.034 3.623 -5.377
61 2HB PHE 162 HB1 PHE 162 6.856 3.069 -4.188
62 HD1 PHE 162 HD1 PHE 162 7.343 0.148 -4.273
63 HD2 PHE 162 HD2 PHE 162 10.072 3.413 -4.268
64 HE1 PHE 162 HE1 PHE 162 9.058 -1.292 -3.256
65 HE2 PHE 162 HE2 PHE 162 11.792 1.979 -3.252
66 HZ PHE 162 HZ PHE 162 11.287 -0.378 -2.743
67 H LEU 163 HN LEU 163 5.783 4.401 -6.297
68 HA LEU 163 HA LEU 163 3.211 3.984 -5.185
69 1HB LEU 163 HB2 LEU 163 4.522 6.131 -6.799
70 2HB LEU 163 HB1 LEU 163 2.785 6.181 -6.570
71 HG LEU 163 HG LEU 163 4.885 6.268 -4.405
72 1HD1 LEU 163 HD11 LEU 163 4.113 8.504 -4.014
73 2HD1 LEU 163 HD12 LEU 163 2.843 8.325 -5.225
74 3HD1 LEU 163 HD13 LEU 163 4.536 8.345 -5.719
75 1HD2 LEU 163 HD21 LEU 163 2.798 6.741 -2.977
76 2HD2 LEU 163 HD22 LEU 163 3.146 5.069 -3.419
77 3HD2 LEU 163 HD23 LEU 163 1.904 5.972 -4.288
78 H PHE 164 HN PHE 164 4.554 2.933 -7.985
79 HA PHE 164 HA PHE 164 2.382 3.208 -9.807
80 1HB PHE 164 HB2 PHE 164 5.116 2.506 -9.860
81 2HB PHE 164 HB1 PHE 164 4.235 1.112 -10.481
82 HD1 PHE 164 HD1 PHE 164 3.482 4.738 -10.837
83 HD2 PHE 164 HD2 PHE 164 4.608 1.116 -12.766
84 HE1 PHE 164 HE1 PHE 164 3.271 5.842 -13.027
85 HE2 PHE 164 HE2 PHE 164 4.400 2.213 -14.958
86 HZ PHE 164 HZ PHE 164 3.731 4.579 -15.091
87 H LEU 165 HN LEU 165 3.810 0.492 -7.992
88 HA LEU 165 HA LEU 165 1.936 -1.445 -8.836
89 1HB LEU 165 HB2 LEU 165 3.299 -1.594 -6.173
90 2HB LEU 165 HB1 LEU 165 2.899 -2.892 -7.283
91 HG LEU 165 HG LEU 165 5.114 -0.869 -7.626
92 1HD1 LEU 165 HD11 LEU 165 5.443 -3.833 -7.474
93 2HD1 LEU 165 HD12 LEU 165 5.282 -2.884 -5.997
94 3HD1 LEU 165 HD13 LEU 165 6.603 -2.552 -7.117
95 1HD2 LEU 165 HD21 LEU 165 4.902 -3.194 -9.427
96 2HD2 LEU 165 HD22 LEU 165 5.444 -1.548 -9.754
97 3HD2 LEU 165 HD23 LEU 165 3.720 -1.909 -9.680
98 H LEU 166 HN LEU 166 2.171 0.404 -5.804
99 HA LEU 166 HA LEU 166 -0.695 0.412 -5.542
100 1HB LEU 166 HB2 LEU 166 0.965 -1.561 -4.225
101 2HB LEU 166 HB1 LEU 166 0.078 -0.594 -3.055
102 HG LEU 166 HG LEU 166 -1.139 -2.163 -5.330
103 1HD1 LEU 166 HD11 LEU 166 -1.586 -3.843 -3.889
104 2HD1 LEU 166 HD12 LEU 166 -1.766 -2.760 -2.509
105 3HD1 LEU 166 HD13 LEU 166 -0.157 -3.214 -3.069
106 1HD2 LEU 166 HD21 LEU 166 -2.255 -0.225 -3.363
107 2HD2 LEU 166 HD22 LEU 166 -3.236 -1.603 -3.861
108 3HD2 LEU 166 HD23 LEU 166 -2.648 -0.457 -5.067
109 HA PRO 167 HA PRO 167 0.384 4.411 -3.915
110 1HB PRO 167 HB2 PRO 167 -1.997 4.508 -2.350
111 2HB PRO 167 HB1 PRO 167 -1.668 5.317 -3.890
112 1HG PRO 167 HG2 PRO 167 -3.192 2.867 -3.351
113 2HG PRO 167 HG1 PRO 167 -3.236 3.936 -4.759
114 1HD PRO 167 HD2 PRO 167 -2.146 1.437 -4.790
115 2HD PRO 167 HD1 PRO 167 -1.629 2.749 -5.865
116 HA PRO 168 HA PRO 168 0.339 3.244 0.657
117 1HB PRO 168 HB2 PRO 168 -0.803 1.047 1.561
118 2HB PRO 168 HB1 PRO 168 -1.793 2.406 0.989
119 1HG PRO 168 HG2 PRO 168 -1.071 -0.131 -0.440
120 2HG PRO 168 HG1 PRO 168 -2.654 0.660 -0.304
121 1HD PRO 168 HD2 PRO 168 -0.941 0.949 -2.446
122 2HD PRO 168 HD1 PRO 168 -2.195 2.118 -1.997
123 H ILE 169 HN ILE 169 2.476 2.788 -0.720
124 HA ILE 169 HA ILE 169 3.542 0.129 -0.494
125 HB ILE 169 HB ILE 169 4.124 2.053 -2.177
126 1HG1 ILE 169 HG12 ILE 169 5.042 -0.256 -2.165
127 2HG1 ILE 169 HG11 ILE 169 6.216 0.946 -2.690
128 1HG2 ILE 169 HG21 ILE 169 6.344 2.519 -0.222
129 2HG2 ILE 169 HG22 ILE 169 4.895 3.525 -0.248
130 3HG2 ILE 169 HG23 ILE 169 5.933 3.437 -1.672
131 1HD1 ILE 169 HD11 ILE 169 7.589 -0.037 -1.244
132 2HD1 ILE 169 HD12 ILE 169 6.268 -0.851 -0.405
133 3HD1 ILE 169 HD13 ILE 169 6.674 0.818 0.000
134 H ILE 170 HN ILE 170 3.761 3.119 1.287
135 HA ILE 170 HA ILE 170 5.916 2.379 2.977
136 HB ILE 170 HB ILE 170 3.776 4.416 3.583
137 1HG1 ILE 170 HG12 ILE 170 5.945 5.813 2.640
138 2HG1 ILE 170 HG11 ILE 170 5.934 4.399 1.590
139 1HG2 ILE 170 HG21 ILE 170 5.071 5.154 5.275
140 2HG2 ILE 170 HG22 ILE 170 6.573 4.824 4.409
141 3HG2 ILE 170 HG23 ILE 170 5.717 3.513 5.223
142 1HD1 ILE 170 HD11 ILE 170 3.345 5.042 1.472
143 2HD1 ILE 170 HD12 ILE 170 4.559 5.707 0.379
144 3HD1 ILE 170 HD13 ILE 170 4.029 6.639 1.780
145 H LEU 171 HN LEU 171 2.388 2.214 3.356
146 HA LEU 171 HA LEU 171 2.445 1.325 6.051
147 1HB LEU 171 HB2 LEU 171 0.273 0.637 4.089
148 2HB LEU 171 HB1 LEU 171 0.136 0.900 5.817
149 HG LEU 171 HG LEU 171 0.598 2.998 3.700
150 1HD1 LEU 171 HD11 LEU 171 -1.709 2.120 3.952
151 2HD1 LEU 171 HD12 LEU 171 -1.554 3.832 4.346
152 3HD1 LEU 171 HD13 LEU 171 -1.679 2.638 5.638
153 1HD2 LEU 171 HD21 LEU 171 0.666 3.178 6.701
154 2HD2 LEU 171 HD22 LEU 171 0.375 4.575 5.665
155 3HD2 LEU 171 HD23 LEU 171 1.896 3.692 5.546
156 H ASP 172 HN ASP 172 1.779 -0.438 3.050
157 HA ASP 172 HA ASP 172 2.098 -3.004 4.251
158 1HB ASP 172 HB2 ASP 172 1.865 -2.139 1.362
159 2HB ASP 172 HB1 ASP 172 1.922 -3.828 1.888
160 H ALA 173 HN ALA 173 4.415 -0.835 3.853
161 HA ALA 173 HA ALA 173 6.376 -2.227 2.327
162 1HB ALA 173 HB1 ALA 173 6.157 0.307 3.491
163 2HB ALA 173 HB2 ALA 173 7.506 -0.316 2.541
164 3HB ALA 173 HB3 ALA 173 7.524 -0.460 4.300
165 H GLY 174 HN GLY 174 5.759 -1.791 5.781
166 1HA GLY 174 HA2 GLY 174 7.411 -4.191 6.312
167 2HA GLY 174 HA1 GLY 174 7.280 -2.824 7.440
168 H TYR 175 HN TYR 175 4.439 -2.478 6.784
169 HA TYR 175 HA TYR 175 2.379 -3.142 7.363
170 1HB TYR 175 HB2 TYR 175 3.264 -5.396 6.360
171 2HB TYR 175 HB1 TYR 175 3.321 -5.915 8.042
172 HD1 TYR 175 HD1 TYR 175 0.932 -4.141 5.768
173 HD2 TYR 175 HD2 TYR 175 1.485 -7.076 8.798
174 HE1 TYR 175 HE1 TYR 175 -1.464 -4.680 5.675
175 HE2 TYR 175 HE2 TYR 175 -0.911 -7.625 8.711
176 HH TYR 175 HH TYR 175 -2.786 -7.443 7.140
177 H PHE 176 HN PHE 176 5.056 -4.025 9.465
178 HA PHE 176 HA PHE 176 3.338 -4.019 11.816
179 1HB PHE 176 HB2 PHE 176 6.019 -4.994 11.168
180 2HB PHE 176 HB1 PHE 176 5.975 -4.119 12.703
181 HD1 PHE 176 HD1 PHE 176 5.098 -7.155 10.962
182 HD2 PHE 176 HD2 PHE 176 4.444 -4.892 14.507
183 HE1 PHE 176 HE1 PHE 176 4.204 -9.161 12.074
184 HE2 PHE 176 HE2 PHE 176 3.550 -6.893 15.624
185 HZ PHE 176 HZ PHE 176 3.430 -9.032 14.408
186 H LEU 177 HN LEU 177 3.106 -1.695 10.603
187 HA LEU 177 HA LEU 177 3.182 0.529 10.854
188 1HB LEU 177 HB2 LEU 177 4.330 -0.320 13.500
189 2HB LEU 177 HB1 LEU 177 4.060 1.367 13.101
190 HG LEU 177 HG LEU 177 1.718 -0.359 12.686
191 1HD1 LEU 177 HD11 LEU 177 1.187 -0.713 14.974
192 2HD1 LEU 177 HD12 LEU 177 2.589 0.212 15.512
193 3HD1 LEU 177 HD13 LEU 177 2.813 -1.350 14.724
194 1HD2 LEU 177 HD21 LEU 177 1.783 2.139 12.541
195 2HD2 LEU 177 HD22 LEU 177 2.059 2.175 14.282
196 3HD2 LEU 177 HD23 LEU 177 0.562 1.499 13.641
197 HA PRO 178 HA PRO 178 7.599 0.321 9.325
198 1HB PRO 178 HB2 PRO 178 6.154 1.638 7.072
199 2HB PRO 178 HB1 PRO 178 7.387 0.373 7.027
200 1HG PRO 178 HG2 PRO 178 4.868 -0.241 6.565
201 2HG PRO 178 HG1 PRO 178 5.851 -1.293 7.603
202 1HD PRO 178 HD2 PRO 178 3.836 0.785 8.389
203 2HD PRO 178 HD1 PRO 178 4.037 -0.872 9.001
204 H LEU 179 HN LEU 179 7.764 2.705 7.456
205 HA LEU 179 HA LEU 179 7.936 5.000 7.506
206 1HB LEU 179 HB2 LEU 179 6.087 4.684 9.482
207 2HB LEU 179 HB1 LEU 179 7.434 5.345 10.390
208 HG LEU 179 HG LEU 179 6.043 7.167 9.741
209 1HD1 LEU 179 HD11 LEU 179 7.645 8.552 8.915
210 2HD1 LEU 179 HD12 LEU 179 8.130 7.423 7.650
211 3HD1 LEU 179 HD13 LEU 179 8.658 7.164 9.313
212 1HD2 LEU 179 HD21 LEU 179 5.445 7.624 7.423
213 2HD2 LEU 179 HD22 LEU 179 4.839 6.046 7.931
214 3HD2 LEU 179 HD23 LEU 179 6.273 6.153 6.910
215 H ARG 180 HN ARG 180 10.133 4.255 7.220
216 HA ARG 180 HA ARG 180 12.364 4.470 7.637
217 1HB ARG 180 HB2 ARG 180 11.569 5.934 10.163
218 2HB ARG 180 HB1 ARG 180 13.124 6.018 9.321
219 1HG ARG 180 HG2 ARG 180 10.934 6.729 7.573
220 2HG ARG 180 HG1 ARG 180 10.956 7.731 9.025
221 1HD ARG 180 HD2 ARG 180 12.887 8.749 8.451
222 2HD ARG 180 HD1 ARG 180 13.572 7.282 7.753
223 HE ARG 180 HE ARG 180 11.666 7.959 5.969
224 1HH1 ARG 180 1HH1 ARG 180 14.273 9.755 7.441
225 2HH1 ARG 180 2HH1 ARG 180 14.487 10.802 6.078
226 1HH2 ARG 180 1HH2 ARG 180 11.948 9.335 4.176
227 2HH2 ARG 180 2HH2 ARG 180 13.168 10.564 4.225
228 1HG HSL 181 HG1 HSL 181 10.475 -1.888 9.403
229 2HG HSL 181 HG2 HSL 181 10.231 -0.569 8.141
230 H HSL 181 HN HSL 181 11.254 2.103 8.180
231 HA HSL 181 HA HSL 181 12.559 1.210 10.806
232 1HB HSL 181 HB1 HSL 181 10.875 -0.357 11.177
233 2HB HSL 181 HB2 HSL 181 9.855 0.763 10.123
Start of MODEL 8
1 1H PHE 155 HT1 PHE 155 -16.439 10.599 -1.246
2 2H PHE 155 HT2 PHE 155 -16.762 9.470 0.006
3 3H PHE 155 HT3 PHE 155 -17.992 10.544 -0.521
4 HA PHE 155 HA PHE 155 -18.540 8.579 -1.502
5 1HB PHE 155 HB2 PHE 155 -18.473 10.523 -3.028
6 2HB PHE 155 HB1 PHE 155 -16.827 10.100 -3.483
7 HD1 PHE 155 HD1 PHE 155 -17.037 9.620 -5.753
8 HD2 PHE 155 HD2 PHE 155 -19.705 7.817 -2.971
9 HE1 PHE 155 HE1 PHE 155 -17.909 8.168 -7.537
10 HE2 PHE 155 HE2 PHE 155 -20.581 6.360 -4.749
11 HZ PHE 155 HZ PHE 155 -19.683 6.534 -7.036
12 H LEU 156 HN LEU 156 -15.341 9.031 -2.986
13 HA LEU 156 HA LEU 156 -14.239 6.687 -1.839
14 1HB LEU 156 HB2 LEU 156 -15.647 6.489 -4.423
15 2HB LEU 156 HB1 LEU 156 -14.072 5.722 -4.355
16 HG LEU 156 HG LEU 156 -15.358 4.880 -2.038
17 1HD1 LEU 156 HD11 LEU 156 -17.516 4.280 -2.506
18 2HD1 LEU 156 HD12 LEU 156 -17.253 4.279 -4.250
19 3HD1 LEU 156 HD13 LEU 156 -17.414 5.806 -3.382
20 1HD2 LEU 156 HD21 LEU 156 -14.834 2.822 -2.819
21 2HD2 LEU 156 HD22 LEU 156 -13.897 3.765 -3.979
22 3HD2 LEU 156 HD23 LEU 156 -15.488 3.145 -4.425
23 H GLN 157 HN GLN 157 -13.525 7.303 -5.204
24 HA GLN 157 HA GLN 157 -11.795 8.352 -6.245
25 1HB GLN 157 HB2 GLN 157 -11.069 9.713 -3.661
26 2HB GLN 157 HB1 GLN 157 -10.767 10.259 -5.304
27 1HG GLN 157 HG2 GLN 157 -13.488 10.102 -5.256
28 2HG GLN 157 HG1 GLN 157 -13.118 10.604 -3.607
29 1HE2 GLN 157 HE21 GLN 157 -11.270 12.340 -3.619
30 2HE2 GLN 157 HE22 GLN 157 -11.550 13.668 -4.687
31 H SER 158 HN SER 158 -11.019 6.131 -6.209
32 HA SER 158 HA SER 158 -9.373 4.596 -5.998
33 1HB SER 158 HB2 SER 158 -7.152 5.349 -5.832
34 2HB SER 158 HB1 SER 158 -8.016 6.741 -6.506
35 HG SER 158 HG SER 158 -6.929 6.369 -3.954
36 H ASP 159 HN ASP 159 -11.112 4.227 -4.142
37 HA ASP 159 HA ASP 159 -11.395 3.108 -2.173
38 1HB ASP 159 HB2 ASP 159 -8.640 2.843 -2.627
39 2HB ASP 159 HB1 ASP 159 -8.784 3.400 -0.963
40 H VAL 160 HN VAL 160 -9.008 5.699 -1.616
41 HA VAL 160 HA VAL 160 -9.211 7.653 -0.440
42 HB VAL 160 HB VAL 160 -11.895 7.070 -0.793
43 1HG1 VAL 160 HG11 VAL 160 -11.412 7.457 2.159
44 2HG1 VAL 160 HG12 VAL 160 -12.115 6.036 1.387
45 3HG1 VAL 160 HG13 VAL 160 -12.977 7.571 1.356
46 1HG2 VAL 160 HG21 VAL 160 -10.766 9.426 0.705
47 2HG2 VAL 160 HG22 VAL 160 -12.264 9.373 -0.225
48 3HG2 VAL 160 HG23 VAL 160 -10.711 9.231 -1.047
49 H PHE 161 HN PHE 161 -10.609 4.843 1.232
50 HA PHE 161 HA PHE 161 -9.440 5.557 3.749
51 1HB PHE 161 HB2 PHE 161 -11.580 4.192 3.359
52 2HB PHE 161 HB1 PHE 161 -10.509 2.837 3.018
53 HD1 PHE 161 HD1 PHE 161 -10.744 5.520 5.608
54 HD2 PHE 161 HD2 PHE 161 -10.239 1.382 4.756
55 HE1 PHE 161 HE1 PHE 161 -10.583 5.049 8.017
56 HE2 PHE 161 HE2 PHE 161 -10.078 0.902 7.164
57 HZ PHE 161 HZ PHE 161 -10.249 2.737 8.798
58 H PHE 162 HN PHE 162 -7.468 5.455 1.740
59 HA PHE 162 HA PHE 162 -5.587 3.720 2.977
60 1HB PHE 162 HB2 PHE 162 -6.724 2.970 0.320
61 2HB PHE 162 HB1 PHE 162 -5.033 2.619 0.684
62 HD1 PHE 162 HD1 PHE 162 -8.115 1.175 0.583
63 HD2 PHE 162 HD2 PHE 162 -4.829 1.630 3.248
64 HE1 PHE 162 HE1 PHE 162 -8.799 -0.870 1.770
65 HE2 PHE 162 HE2 PHE 162 -5.506 -0.413 4.439
66 HZ PHE 162 HZ PHE 162 -7.493 -1.666 3.701
67 H LEU 163 HN LEU 163 -6.408 6.106 0.581
68 HA LEU 163 HA LEU 163 -3.865 6.522 -0.533
69 1HB LEU 163 HB2 LEU 163 -6.288 7.601 -0.986
70 2HB LEU 163 HB1 LEU 163 -5.590 8.886 -0.017
71 HG LEU 163 HG LEU 163 -3.768 9.151 -1.599
72 1HD1 LEU 163 HD11 LEU 163 -4.004 7.864 -3.805
73 2HD1 LEU 163 HD12 LEU 163 -5.000 6.739 -2.882
74 3HD1 LEU 163 HD13 LEU 163 -3.321 7.017 -2.418
75 1HD2 LEU 163 HD21 LEU 163 -5.593 10.518 -2.127
76 2HD2 LEU 163 HD22 LEU 163 -6.555 9.161 -2.714
77 3HD2 LEU 163 HD23 LEU 163 -5.175 9.735 -3.650
78 H PHE 164 HN PHE 164 -5.433 7.659 2.376
79 HA PHE 164 HA PHE 164 -4.698 8.880 4.169
80 1HB PHE 164 HB2 PHE 164 -3.510 6.482 4.039
81 2HB PHE 164 HB1 PHE 164 -2.073 7.501 3.982
82 HD1 PHE 164 HD1 PHE 164 -5.276 7.389 5.903
83 HD2 PHE 164 HD2 PHE 164 -1.048 7.864 5.991
84 HE1 PHE 164 HE1 PHE 164 -5.359 7.641 8.350
85 HE2 PHE 164 HE2 PHE 164 -1.122 8.116 8.436
86 HZ PHE 164 HZ PHE 164 -3.280 8.005 9.619
87 H LEU 165 HN LEU 165 -4.362 10.444 1.948
88 HA LEU 165 HA LEU 165 -3.430 12.421 1.372
89 1HB LEU 165 HB2 LEU 165 -1.319 11.812 3.381
90 2HB LEU 165 HB1 LEU 165 -1.736 13.376 2.724
91 HG LEU 165 HG LEU 165 -3.486 11.738 4.554
92 1HD1 LEU 165 HD11 LEU 165 -3.008 13.549 6.184
93 2HD1 LEU 165 HD12 LEU 165 -1.792 14.174 5.070
94 3HD1 LEU 165 HD13 LEU 165 -1.599 12.570 5.777
95 1HD2 LEU 165 HD21 LEU 165 -5.024 12.983 3.410
96 2HD2 LEU 165 HD22 LEU 165 -3.880 14.278 3.059
97 3HD2 LEU 165 HD23 LEU 165 -4.580 14.132 4.672
98 H LEU 166 HN LEU 166 -1.559 9.526 1.664
99 HA LEU 166 HA LEU 166 -0.252 10.004 -0.838
100 1HB LEU 166 HB2 LEU 166 0.963 10.893 1.530
101 2HB LEU 166 HB1 LEU 166 1.806 9.407 1.104
102 HG LEU 166 HG LEU 166 1.800 10.658 -1.302
103 1HD1 LEU 166 HD11 LEU 166 1.571 12.746 0.809
104 2HD1 LEU 166 HD12 LEU 166 0.920 12.720 -0.831
105 3HD1 LEU 166 HD13 LEU 166 2.636 13.030 -0.568
106 1HD2 LEU 166 HD21 LEU 166 4.066 10.801 -1.027
107 2HD2 LEU 166 HD22 LEU 166 3.663 9.710 0.299
108 3HD2 LEU 166 HD23 LEU 166 3.939 11.423 0.619
109 HA PRO 167 HA PRO 167 -0.892 5.616 -1.046
110 1HB PRO 167 HB2 PRO 167 1.541 5.137 -2.457
111 2HB PRO 167 HB1 PRO 167 -0.089 5.292 -3.134
112 1HG PRO 167 HG2 PRO 167 2.081 7.305 -2.935
113 2HG PRO 167 HG1 PRO 167 0.781 7.160 -4.131
114 1HD PRO 167 HD2 PRO 167 0.744 9.064 -2.241
115 2HD PRO 167 HD1 PRO 167 -0.750 8.268 -2.782
116 HA PRO 168 HA PRO 168 1.781 4.726 2.520
117 1HB PRO 168 HB2 PRO 168 0.322 2.599 3.392
118 2HB PRO 168 HB1 PRO 168 -0.109 4.284 3.744
119 1HG PRO 168 HG2 PRO 168 -1.195 2.446 1.642
120 2HG PRO 168 HG1 PRO 168 -2.064 3.568 2.706
121 1HD PRO 168 HD2 PRO 168 -1.500 4.164 0.134
122 2HD PRO 168 HD1 PRO 168 -1.543 5.403 1.405
123 H ILE 169 HN ILE 169 3.371 4.094 0.837
124 HA ILE 169 HA ILE 169 3.406 1.405 -0.141
125 HB ILE 169 HB ILE 169 4.558 3.483 -1.144
126 1HG1 ILE 169 HG12 ILE 169 6.304 2.086 -2.175
127 2HG1 ILE 169 HG11 ILE 169 6.072 0.876 -0.918
128 1HG2 ILE 169 HG21 ILE 169 6.849 3.880 -0.496
129 2HG2 ILE 169 HG22 ILE 169 6.739 2.639 0.752
130 3HG2 ILE 169 HG23 ILE 169 5.785 4.116 0.889
131 1HD1 ILE 169 HD11 ILE 169 4.160 0.093 -1.836
132 2HD1 ILE 169 HD12 ILE 169 4.921 0.713 -3.302
133 3HD1 ILE 169 HD13 ILE 169 3.690 1.668 -2.476
134 H ILE 170 HN ILE 170 4.999 3.147 2.449
135 HA ILE 170 HA ILE 170 6.657 1.031 3.338
136 HB ILE 170 HB ILE 170 5.681 3.374 4.970
137 1HG1 ILE 170 HG12 ILE 170 8.353 3.509 3.740
138 2HG1 ILE 170 HG11 ILE 170 7.020 3.580 2.592
139 1HG2 ILE 170 HG21 ILE 170 7.691 1.256 5.357
140 2HG2 ILE 170 HG22 ILE 170 6.765 2.177 6.542
141 3HG2 ILE 170 HG23 ILE 170 8.197 2.887 5.796
142 1HD1 ILE 170 HD11 ILE 170 7.946 5.559 4.528
143 2HD1 ILE 170 HD12 ILE 170 6.197 5.338 4.493
144 3HD1 ILE 170 HD13 ILE 170 7.061 5.769 3.017
145 H LEU 171 HN LEU 171 3.402 2.100 4.159
146 HA LEU 171 HA LEU 171 3.076 0.463 6.453
147 1HB LEU 171 HB2 LEU 171 1.577 2.401 5.211
148 2HB LEU 171 HB1 LEU 171 0.673 0.949 4.824
149 HG LEU 171 HG LEU 171 -0.315 1.785 6.781
150 1HD1 LEU 171 HD11 LEU 171 0.305 0.127 8.545
151 2HD1 LEU 171 HD12 LEU 171 1.632 -0.394 7.505
152 3HD1 LEU 171 HD13 LEU 171 -0.038 -0.572 6.962
153 1HD2 LEU 171 HD21 LEU 171 1.577 1.954 8.782
154 2HD2 LEU 171 HD22 LEU 171 0.838 3.307 7.926
155 3HD2 LEU 171 HD23 LEU 171 2.387 2.661 7.384
156 H ASP 172 HN ASP 172 1.906 0.101 3.133
157 HA ASP 172 HA ASP 172 1.233 -2.657 3.463
158 1HB ASP 172 HB2 ASP 172 1.269 -0.737 1.158
159 2HB ASP 172 HB1 ASP 172 1.109 -2.472 0.851
160 H ALA 173 HN ALA 173 4.172 -1.145 3.235
161 HA ALA 173 HA ALA 173 5.520 -2.872 1.412
162 1HB ALA 173 HB1 ALA 173 6.331 -0.781 3.345
163 2HB ALA 173 HB2 ALA 173 6.736 -0.961 1.640
164 3HB ALA 173 HB3 ALA 173 7.551 -1.951 2.850
165 H GLY 174 HN GLY 174 6.016 -2.471 4.903
166 1HA GLY 174 HA2 GLY 174 6.483 -5.385 5.097
167 2HA GLY 174 HA1 GLY 174 7.281 -4.177 6.121
168 H TYR 175 HN TYR 175 4.472 -2.810 6.065
169 HA TYR 175 HA TYR 175 2.532 -2.814 7.258
170 1HB TYR 175 HB2 TYR 175 2.492 -5.307 6.626
171 2HB TYR 175 HB1 TYR 175 3.117 -5.600 8.246
172 HD1 TYR 175 HD1 TYR 175 1.412 -6.523 9.510
173 HD2 TYR 175 HD2 TYR 175 0.533 -3.216 6.982
174 HE1 TYR 175 HE1 TYR 175 -0.876 -6.455 10.408
175 HE2 TYR 175 HE2 TYR 175 -1.758 -3.137 7.873
176 HH TYR 175 HH TYR 175 -3.063 -5.645 9.817
177 H PHE 176 HN PHE 176 5.320 -4.305 8.886
178 HA PHE 176 HA PHE 176 4.490 -3.127 11.421
179 1HB PHE 176 HB2 PHE 176 6.183 -4.489 12.449
180 2HB PHE 176 HB1 PHE 176 5.297 -5.500 11.298
181 HD1 PHE 176 HD1 PHE 176 8.493 -4.006 12.152
182 HD2 PHE 176 HD2 PHE 176 6.346 -6.159 9.174
183 HE1 PHE 176 HE1 PHE 176 10.615 -4.615 11.068
184 HE2 PHE 176 HE2 PHE 176 8.466 -6.772 8.085
185 HZ PHE 176 HZ PHE 176 10.604 -6.001 9.032
186 H LEU 177 HN LEU 177 6.532 -2.424 8.790
187 HA LEU 177 HA LEU 177 8.685 -1.135 9.979
188 1HB LEU 177 HB2 LEU 177 7.276 -0.437 7.404
189 2HB LEU 177 HB1 LEU 177 8.858 0.152 7.876
190 HG LEU 177 HG LEU 177 8.152 -2.742 7.384
191 1HD1 LEU 177 HD11 LEU 177 8.322 -0.984 5.438
192 2HD1 LEU 177 HD12 LEU 177 9.062 -2.578 5.291
193 3HD1 LEU 177 HD13 LEU 177 10.054 -1.182 5.710
194 1HD2 LEU 177 HD21 LEU 177 9.886 -2.712 8.975
195 2HD2 LEU 177 HD22 LEU 177 10.696 -1.360 8.186
196 3HD2 LEU 177 HD23 LEU 177 10.684 -2.949 7.421
197 HA PRO 178 HA PRO 178 5.800 2.926 9.690
198 1HB PRO 178 HB2 PRO 178 3.420 1.481 10.766
199 2HB PRO 178 HB1 PRO 178 3.497 2.863 9.668
200 1HG PRO 178 HG2 PRO 178 2.957 0.426 8.746
201 2HG PRO 178 HG1 PRO 178 3.980 1.545 7.826
202 1HD PRO 178 HD2 PRO 178 4.746 -0.853 9.417
203 2HD PRO 178 HD1 PRO 178 5.475 -0.194 7.940
204 H LEU 179 HN LEU 179 4.488 0.673 12.134
205 HA LEU 179 HA LEU 179 4.590 0.668 14.403
206 1HB LEU 179 HB2 LEU 179 7.248 1.812 13.645
207 2HB LEU 179 HB1 LEU 179 6.772 1.805 15.333
208 HG LEU 179 HG LEU 179 6.544 -0.758 13.845
209 1HD1 LEU 179 HD11 LEU 179 8.849 0.587 13.486
210 2HD1 LEU 179 HD12 LEU 179 8.743 -1.171 13.594
211 3HD1 LEU 179 HD13 LEU 179 9.194 -0.225 15.014
212 1HD2 LEU 179 HD21 LEU 179 7.491 -0.047 16.619
213 2HD2 LEU 179 HD22 LEU 179 7.201 -1.671 15.995
214 3HD2 LEU 179 HD23 LEU 179 5.855 -0.548 16.191
215 H ARG 180 HN ARG 180 2.832 2.376 13.687
216 HA ARG 180 HA ARG 180 1.649 4.213 14.332
217 1HB ARG 180 HB2 ARG 180 3.828 4.674 16.378
218 2HB ARG 180 HB1 ARG 180 2.174 5.296 16.420
219 1HG ARG 180 HG2 ARG 180 3.022 2.417 16.686
220 2HG ARG 180 HG1 ARG 180 2.407 3.463 17.966
221 1HD ARG 180 HD2 ARG 180 0.300 3.699 16.618
222 2HD ARG 180 HD1 ARG 180 0.925 2.443 15.550
223 HE ARG 180 HE ARG 180 0.443 0.874 17.154
224 1HH1 ARG 180 1HH1 ARG 180 0.219 4.060 18.564
225 2HH1 ARG 180 2HH1 ARG 180 -0.479 3.491 20.044
226 1HH2 ARG 180 1HH2 ARG 180 -0.472 0.126 19.099
227 2HH2 ARG 180 2HH2 ARG 180 -0.870 1.259 20.348
228 1HG HSL 181 HG1 HSL 181 4.857 6.020 8.563
229 2HG HSL 181 HG2 HSL 181 3.897 4.654 9.337
230 H HSL 181 HN HSL 181 2.982 4.521 12.104
231 HA HSL 181 HA HSL 181 4.296 7.284 12.286
232 1HB HSL 181 HB1 HSL 181 5.812 6.740 10.611
233 2HB HSL 181 HB2 HSL 181 5.486 4.997 11.118
Start of MODEL 9
1 1H PHE 155 HT1 PHE 155 0.594 2.337 -12.561
2 2H PHE 155 HT2 PHE 155 0.929 2.405 -14.242
3 3H PHE 155 HT3 PHE 155 0.344 0.954 -13.540
4 HA PHE 155 HA PHE 155 -1.085 3.497 -13.836
5 1HB PHE 155 HB2 PHE 155 -0.888 0.997 -15.335
6 2HB PHE 155 HB1 PHE 155 -2.543 1.475 -14.984
7 HD1 PHE 155 HD1 PHE 155 0.386 3.645 -15.686
8 HD2 PHE 155 HD2 PHE 155 -3.364 2.164 -17.046
9 HE1 PHE 155 HE1 PHE 155 0.446 5.233 -17.565
10 HE2 PHE 155 HE2 PHE 155 -3.311 3.749 -18.928
11 HZ PHE 155 HZ PHE 155 -1.405 5.285 -19.190
12 H LEU 156 HN LEU 156 -0.568 0.943 -11.800
13 HA LEU 156 HA LEU 156 -1.602 0.203 -9.953
14 1HB LEU 156 HB2 LEU 156 -3.197 2.670 -10.503
15 2HB LEU 156 HB1 LEU 156 -3.597 1.623 -9.159
16 HG LEU 156 HG LEU 156 -2.013 3.743 -8.899
17 1HD1 LEU 156 HD11 LEU 156 -2.649 2.595 -6.979
18 2HD1 LEU 156 HD12 LEU 156 -0.892 2.436 -6.990
19 3HD1 LEU 156 HD13 LEU 156 -1.902 1.089 -7.516
20 1HD2 LEU 156 HD21 LEU 156 -0.057 1.521 -9.469
21 2HD2 LEU 156 HD22 LEU 156 0.326 3.154 -8.925
22 3HD2 LEU 156 HD23 LEU 156 -0.361 2.897 -10.530
23 H GLN 157 HN GLN 157 -4.449 1.436 -11.668
24 HA GLN 157 HA GLN 157 -6.037 0.262 -12.899
25 1HB GLN 157 HB2 GLN 157 -4.346 -1.758 -12.780
26 2HB GLN 157 HB1 GLN 157 -5.413 -2.310 -11.496
27 1HG GLN 157 HG2 GLN 157 -7.161 -2.691 -12.919
28 2HG GLN 157 HG1 GLN 157 -6.609 -1.497 -14.093
29 1HE2 GLN 157 HE21 GLN 157 -4.971 -2.058 -15.549
30 2HE2 GLN 157 HE22 GLN 157 -4.578 -3.707 -15.883
31 H SER 158 HN SER 158 -5.326 -0.208 -9.521
32 HA SER 158 HA SER 158 -8.062 -0.696 -8.822
33 1HB SER 158 HB2 SER 158 -6.512 -1.761 -7.379
34 2HB SER 158 HB1 SER 158 -5.550 -0.284 -7.203
35 HG SER 158 HG SER 158 -6.706 0.005 -5.475
36 H ASP 159 HN ASP 159 -8.536 1.354 -10.118
37 HA ASP 159 HA ASP 159 -9.605 3.377 -9.989
38 1HB ASP 159 HB2 ASP 159 -9.407 2.704 -7.275
39 2HB ASP 159 HB1 ASP 159 -8.733 4.327 -7.394
40 H VAL 160 HN VAL 160 -6.421 3.276 -8.420
41 HA VAL 160 HA VAL 160 -4.531 4.393 -8.722
42 HB VAL 160 HB VAL 160 -3.906 4.561 -10.806
43 1HG1 VAL 160 HG11 VAL 160 -5.990 3.009 -10.976
44 2HG1 VAL 160 HG12 VAL 160 -5.126 3.520 -12.425
45 3HG1 VAL 160 HG13 VAL 160 -6.626 4.323 -11.967
46 1HG2 VAL 160 HG21 VAL 160 -4.415 6.942 -10.829
47 2HG2 VAL 160 HG22 VAL 160 -6.067 6.591 -11.336
48 3HG2 VAL 160 HG23 VAL 160 -4.719 6.223 -12.410
49 H PHE 161 HN PHE 161 -7.250 6.515 -9.713
50 HA PHE 161 HA PHE 161 -6.019 8.903 -8.909
51 1HB PHE 161 HB2 PHE 161 -8.993 8.436 -8.758
52 2HB PHE 161 HB1 PHE 161 -8.139 9.927 -9.146
53 HD1 PHE 161 HD1 PHE 161 -6.291 9.212 -11.206
54 HD2 PHE 161 HD2 PHE 161 -10.256 7.805 -10.571
55 HE1 PHE 161 HE1 PHE 161 -6.490 8.702 -13.605
56 HE2 PHE 161 HE2 PHE 161 -10.462 7.291 -12.969
57 HZ PHE 161 HZ PHE 161 -8.576 7.739 -14.489
58 H PHE 162 HN PHE 162 -7.592 6.386 -7.165
59 HA PHE 162 HA PHE 162 -8.084 7.797 -4.743
60 1HB PHE 162 HB2 PHE 162 -8.799 5.383 -5.784
61 2HB PHE 162 HB1 PHE 162 -7.605 4.913 -4.575
62 HD1 PHE 162 HD1 PHE 162 -10.314 7.482 -4.706
63 HD2 PHE 162 HD2 PHE 162 -8.611 4.166 -2.652
64 HE1 PHE 162 HE1 PHE 162 -12.023 7.698 -2.949
65 HE2 PHE 162 HE2 PHE 162 -10.317 4.377 -0.891
66 HZ PHE 162 HZ PHE 162 -12.026 6.144 -1.038
67 H LEU 163 HN LEU 163 -5.796 5.193 -5.469
68 HA LEU 163 HA LEU 163 -4.129 5.656 -3.222
69 1HB LEU 163 HB2 LEU 163 -4.469 3.629 -4.974
70 2HB LEU 163 HB1 LEU 163 -3.002 4.344 -5.613
71 HG LEU 163 HG LEU 163 -2.048 4.147 -3.259
72 1HD1 LEU 163 HD11 LEU 163 -4.615 3.514 -2.577
73 2HD1 LEU 163 HD12 LEU 163 -3.187 3.170 -1.601
74 3HD1 LEU 163 HD13 LEU 163 -3.851 1.927 -2.662
75 1HD2 LEU 163 HD21 LEU 163 -1.356 2.687 -5.066
76 2HD2 LEU 163 HD22 LEU 163 -2.751 1.646 -4.788
77 3HD2 LEU 163 HD23 LEU 163 -1.489 1.775 -3.563
78 H PHE 164 HN PHE 164 -4.563 7.407 -5.966
79 HA PHE 164 HA PHE 164 -1.907 8.152 -6.628
80 1HB PHE 164 HB2 PHE 164 -3.380 8.457 -8.379
81 2HB PHE 164 HB1 PHE 164 -4.674 9.022 -7.330
82 HD1 PHE 164 HD1 PHE 164 -4.619 11.367 -6.486
83 HD2 PHE 164 HD2 PHE 164 -1.888 9.959 -9.430
84 HE1 PHE 164 HE1 PHE 164 -4.097 13.691 -7.107
85 HE2 PHE 164 HE2 PHE 164 -1.360 12.279 -10.056
86 HZ PHE 164 HZ PHE 164 -2.466 14.148 -8.894
87 H LEU 165 HN LEU 165 -4.256 9.245 -4.303
88 HA LEU 165 HA LEU 165 -3.251 11.838 -3.843
89 1HB LEU 165 HB2 LEU 165 -5.273 10.188 -2.784
90 2HB LEU 165 HB1 LEU 165 -4.267 10.667 -1.430
91 HG LEU 165 HG LEU 165 -5.265 12.736 -3.352
92 1HD1 LEU 165 HD11 LEU 165 -7.225 13.058 -1.897
93 2HD1 LEU 165 HD12 LEU 165 -6.805 11.578 -1.034
94 3HD1 LEU 165 HD13 LEU 165 -7.253 11.509 -2.738
95 1HD2 LEU 165 HD21 LEU 165 -4.907 14.227 -1.580
96 2HD2 LEU 165 HD22 LEU 165 -3.521 13.137 -1.534
97 3HD2 LEU 165 HD23 LEU 165 -4.844 12.931 -0.386
98 H LEU 166 HN LEU 166 -2.684 8.787 -2.103
99 HA LEU 166 HA LEU 166 0.054 9.469 -1.596
100 1HB LEU 166 HB2 LEU 166 -1.898 10.288 0.287
101 2HB LEU 166 HB1 LEU 166 -1.043 8.930 0.999
102 HG LEU 166 HG LEU 166 0.176 11.510 0.014
103 1HD1 LEU 166 HD11 LEU 166 -1.074 11.179 2.328
104 2HD1 LEU 166 HD12 LEU 166 0.396 12.143 2.186
105 3HD1 LEU 166 HD13 LEU 166 0.483 10.485 2.779
106 1HD2 LEU 166 HD21 LEU 166 1.362 8.876 0.635
107 2HD2 LEU 166 HD22 LEU 166 2.185 10.291 1.292
108 3HD2 LEU 166 HD23 LEU 166 1.925 10.150 -0.446
109 HA PRO 167 HA PRO 167 -0.792 4.966 -1.988
110 1HB PRO 167 HB2 PRO 167 1.661 4.403 -3.055
111 2HB PRO 167 HB1 PRO 167 0.253 4.899 -4.014
112 1HG PRO 167 HG2 PRO 167 2.564 6.539 -3.044
113 2HG PRO 167 HG1 PRO 167 1.757 6.562 -4.624
114 1HD PRO 167 HD2 PRO 167 1.258 8.421 -2.740
115 2HD PRO 167 HD1 PRO 167 -0.006 7.842 -3.845
116 HA PRO 168 HA PRO 168 1.515 4.432 1.891
117 1HB PRO 168 HB2 PRO 168 -0.037 2.464 2.876
118 2HB PRO 168 HB1 PRO 168 -0.553 4.163 2.902
119 1HG PRO 168 HG2 PRO 168 -1.297 1.986 0.976
120 2HG PRO 168 HG1 PRO 168 -2.340 3.187 1.760
121 1HD PRO 168 HD2 PRO 168 -1.431 3.448 -0.789
122 2HD PRO 168 HD1 PRO 168 -1.772 4.837 0.261
123 H ILE 169 HN ILE 169 2.982 3.568 -0.043
124 HA ILE 169 HA ILE 169 3.046 0.739 -0.422
125 HB ILE 169 HB ILE 169 3.983 2.677 -1.916
126 1HG1 ILE 169 HG12 ILE 169 3.968 0.352 -2.593
127 2HG1 ILE 169 HG11 ILE 169 5.532 1.057 -2.988
128 1HG2 ILE 169 HG21 ILE 169 6.473 1.965 -0.390
129 2HG2 ILE 169 HG22 ILE 169 5.568 3.462 -0.165
130 3HG2 ILE 169 HG23 ILE 169 6.319 3.111 -1.722
131 1HD1 ILE 169 HD11 ILE 169 6.097 -0.994 -2.104
132 2HD1 ILE 169 HD12 ILE 169 4.835 -0.929 -0.874
133 3HD1 ILE 169 HD13 ILE 169 6.273 0.079 -0.715
134 H ILE 170 HN ILE 170 4.790 3.004 1.609
135 HA ILE 170 HA ILE 170 6.704 1.160 2.603
136 HB ILE 170 HB ILE 170 5.768 3.677 3.974
137 1HG1 ILE 170 HG12 ILE 170 8.086 4.343 2.678
138 2HG1 ILE 170 HG11 ILE 170 7.319 3.278 1.505
139 1HG2 ILE 170 HG21 ILE 170 8.386 2.185 4.081
140 2HG2 ILE 170 HG22 ILE 170 7.153 2.208 5.341
141 3HG2 ILE 170 HG23 ILE 170 8.018 3.688 4.928
142 1HD1 ILE 170 HD11 ILE 170 6.669 5.998 2.255
143 2HD1 ILE 170 HD12 ILE 170 5.267 4.929 2.300
144 3HD1 ILE 170 HD13 ILE 170 6.216 5.077 0.820
145 H LEU 171 HN LEU 171 3.576 2.306 3.838
146 HA LEU 171 HA LEU 171 3.729 0.937 6.315
147 1HB LEU 171 HB2 LEU 171 1.201 1.605 4.811
148 2HB LEU 171 HB1 LEU 171 1.389 1.393 6.541
149 HG LEU 171 HG LEU 171 2.636 3.643 4.963
150 1HD1 LEU 171 HD11 LEU 171 0.905 5.024 6.153
151 2HD1 LEU 171 HD12 LEU 171 0.093 3.513 6.564
152 3HD1 LEU 171 HD13 LEU 171 0.292 3.976 4.874
153 1HD2 LEU 171 HD21 LEU 171 3.481 4.448 6.919
154 2HD2 LEU 171 HD22 LEU 171 3.537 2.722 7.277
155 3HD2 LEU 171 HD23 LEU 171 2.215 3.709 7.900
156 H ASP 172 HN ASP 172 1.953 0.188 3.342
157 HA ASP 172 HA ASP 172 1.347 -2.486 4.143
158 1HB ASP 172 HB2 ASP 172 0.858 -0.793 1.746
159 2HB ASP 172 HB1 ASP 172 0.815 -2.548 1.520
160 H ALA 173 HN ALA 173 4.231 -1.188 3.314
161 HA ALA 173 HA ALA 173 5.190 -3.059 1.392
162 1HB ALA 173 HB1 ALA 173 6.782 -1.508 1.293
163 2HB ALA 173 HB2 ALA 173 7.388 -2.089 2.843
164 3HB ALA 173 HB3 ALA 173 6.220 -0.770 2.790
165 H GLY 174 HN GLY 174 5.994 -2.607 4.825
166 1HA GLY 174 HA2 GLY 174 6.514 -5.513 5.004
167 2HA GLY 174 HA1 GLY 174 7.332 -4.288 5.993
168 H TYR 175 HN TYR 175 4.441 -3.025 5.964
169 HA TYR 175 HA TYR 175 2.598 -2.981 7.268
170 1HB TYR 175 HB2 TYR 175 1.942 -5.163 6.697
171 2HB TYR 175 HB1 TYR 175 3.290 -5.899 7.549
172 HD1 TYR 175 HD1 TYR 175 -0.050 -4.430 7.902
173 HD2 TYR 175 HD2 TYR 175 3.193 -6.283 9.939
174 HE1 TYR 175 HE1 TYR 175 -1.496 -4.799 9.857
175 HE2 TYR 175 HE2 TYR 175 1.757 -6.659 11.898
176 HH TYR 175 HH TYR 175 -0.521 -6.784 12.520
177 H PHE 176 HN PHE 176 5.582 -4.215 8.644
178 HA PHE 176 HA PHE 176 4.780 -3.388 11.323
179 1HB PHE 176 HB2 PHE 176 5.974 -5.584 10.879
180 2HB PHE 176 HB1 PHE 176 7.411 -4.624 10.502
181 HD1 PHE 176 HD1 PHE 176 8.905 -5.060 12.213
182 HD2 PHE 176 HD2 PHE 176 4.859 -4.151 13.168
183 HE1 PHE 176 HE1 PHE 176 9.488 -4.993 14.602
184 HE2 PHE 176 HE2 PHE 176 5.435 -4.082 15.559
185 HZ PHE 176 HZ PHE 176 7.752 -4.503 16.279
186 H LEU 177 HN LEU 177 6.360 -2.118 8.622
187 HA LEU 177 HA LEU 177 8.427 -0.602 9.676
188 1HB LEU 177 HB2 LEU 177 6.546 0.043 7.407
189 2HB LEU 177 HB1 LEU 177 8.012 0.939 7.755
190 HG LEU 177 HG LEU 177 7.886 -1.980 6.990
191 1HD1 LEU 177 HD11 LEU 177 9.278 -0.822 5.028
192 2HD1 LEU 177 HD12 LEU 177 8.218 0.522 5.450
193 3HD1 LEU 177 HD13 LEU 177 7.527 -1.029 4.969
194 1HD2 LEU 177 HD21 LEU 177 10.316 -1.830 6.849
195 2HD2 LEU 177 HD22 LEU 177 9.755 -1.473 8.483
196 3HD2 LEU 177 HD23 LEU 177 10.254 -0.161 7.416
197 HA PRO 178 HA PRO 178 4.825 2.877 10.244
198 1HB PRO 178 HB2 PRO 178 3.104 0.821 11.581
199 2HB PRO 178 HB1 PRO 178 2.634 2.297 10.731
200 1HG PRO 178 HG2 PRO 178 2.410 -0.060 9.534
201 2HG PRO 178 HG1 PRO 178 2.979 1.359 8.634
202 1HD PRO 178 HD2 PRO 178 4.504 -0.986 9.634
203 2HD PRO 178 HD1 PRO 178 4.789 0.019 8.202
204 H LEU 179 HN LEU 179 6.534 3.491 11.634
205 HA LEU 179 HA LEU 179 6.762 2.281 14.249
206 1HB LEU 179 HB2 LEU 179 8.294 4.174 12.626
207 2HB LEU 179 HB1 LEU 179 8.252 4.594 14.329
208 HG LEU 179 HG LEU 179 9.179 2.420 14.920
209 1HD1 LEU 179 HD11 LEU 179 8.145 1.175 13.034
210 2HD1 LEU 179 HD12 LEU 179 9.854 0.814 13.277
211 3HD1 LEU 179 HD13 LEU 179 9.357 1.878 11.963
212 1HD2 LEU 179 HD21 LEU 179 11.399 2.672 13.728
213 2HD2 LEU 179 HD22 LEU 179 10.807 4.095 14.587
214 3HD2 LEU 179 HD23 LEU 179 10.658 3.998 12.832
215 H ARG 180 HN ARG 180 6.357 5.683 13.274
216 HA ARG 180 HA ARG 180 4.943 6.231 15.752
217 1HB ARG 180 HB2 ARG 180 5.083 8.571 15.098
218 2HB ARG 180 HB1 ARG 180 6.666 7.801 14.932
219 1HG ARG 180 HG2 ARG 180 5.029 7.741 12.501
220 2HG ARG 180 HG1 ARG 180 5.474 9.358 13.049
221 1HD ARG 180 HD2 ARG 180 7.441 9.048 12.052
222 2HD ARG 180 HD1 ARG 180 7.806 7.870 13.311
223 HE ARG 180 HE ARG 180 6.407 6.440 11.474
224 1HH1 ARG 180 1HH1 ARG 180 9.244 8.468 11.312
225 2HH1 ARG 180 2HH1 ARG 180 9.952 7.586 10.001
226 1HH2 ARG 180 1HH2 ARG 180 7.337 5.280 9.749
227 2HH2 ARG 180 2HH2 ARG 180 8.870 5.776 9.112
228 1HG HSL 181 HG1 HSL 181 -0.216 4.638 11.040
229 2HG HSL 181 HG2 HSL 181 0.731 3.150 10.512
230 H HSL 181 HN HSL 181 3.893 4.569 13.440
231 HA HSL 181 HA HSL 181 1.283 6.107 12.976
232 1HB HSL 181 HB1 HSL 181 1.921 5.697 10.722
233 2HB HSL 181 HB2 HSL 181 2.841 4.158 11.167
Start of MODEL 10
1 1H PHE 155 HT1 PHE 155 -16.067 -4.719 -6.214
2 2H PHE 155 HT2 PHE 155 -14.515 -5.449 -6.148
3 3H PHE 155 HT3 PHE 155 -15.359 -5.355 -7.640
4 HA PHE 155 HA PHE 155 -15.289 -2.919 -7.413
5 1HB PHE 155 HB2 PHE 155 -14.271 -3.682 -4.885
6 2HB PHE 155 HB1 PHE 155 -12.980 -2.848 -5.739
7 HD1 PHE 155 HD1 PHE 155 -13.685 -0.602 -6.895
8 HD2 PHE 155 HD2 PHE 155 -15.802 -2.447 -3.698
9 HE1 PHE 155 HE1 PHE 155 -14.713 1.562 -6.333
10 HE2 PHE 155 HE2 PHE 155 -16.834 -0.287 -3.130
11 HZ PHE 155 HZ PHE 155 -16.291 1.721 -4.448
12 H LEU 156 HN LEU 156 -13.850 -1.944 -8.805
13 HA LEU 156 HA LEU 156 -11.259 -2.975 -9.348
14 1HB LEU 156 HB2 LEU 156 -11.580 -3.869 -11.525
15 2HB LEU 156 HB1 LEU 156 -12.732 -4.661 -10.468
16 HG LEU 156 HG LEU 156 -14.237 -2.607 -11.412
17 1HD1 LEU 156 HD11 LEU 156 -13.178 -1.663 -13.139
18 2HD1 LEU 156 HD12 LEU 156 -13.602 -3.130 -14.021
19 3HD1 LEU 156 HD13 LEU 156 -12.015 -2.983 -13.267
20 1HD2 LEU 156 HD21 LEU 156 -13.957 -5.204 -12.896
21 2HD2 LEU 156 HD22 LEU 156 -15.408 -4.233 -12.648
22 3HD2 LEU 156 HD23 LEU 156 -14.685 -5.099 -11.292
23 H GLN 157 HN GLN 157 -10.138 -1.191 -9.759
24 HA GLN 157 HA GLN 157 -10.764 0.579 -11.867
25 1HB GLN 157 HB2 GLN 157 -11.775 1.268 -9.190
26 2HB GLN 157 HB1 GLN 157 -10.852 2.545 -9.970
27 1HG GLN 157 HG2 GLN 157 -12.755 1.325 -11.778
28 2HG GLN 157 HG1 GLN 157 -13.529 1.974 -10.334
29 1HE2 GLN 157 HE21 GLN 157 -10.928 2.915 -12.559
30 2HE2 GLN 157 HE22 GLN 157 -11.460 4.547 -12.760
31 H SER 158 HN SER 158 -8.629 0.135 -12.383
32 HA SER 158 HA SER 158 -6.448 0.748 -12.543
33 1HB SER 158 HB2 SER 158 -7.179 2.984 -11.648
34 2HB SER 158 HB1 SER 158 -6.739 2.386 -10.038
35 HG SER 158 HG SER 158 -4.611 1.966 -11.008
36 H ASP 159 HN ASP 159 -7.328 0.321 -9.205
37 HA ASP 159 HA ASP 159 -5.830 -2.079 -8.941
38 1HB ASP 159 HB2 ASP 159 -4.666 0.491 -7.966
39 2HB ASP 159 HB1 ASP 159 -4.443 -0.956 -6.988
40 H VAL 160 HN VAL 160 -7.553 0.586 -7.518
41 HA VAL 160 HA VAL 160 -9.281 0.573 -6.014
42 HB VAL 160 HB VAL 160 -9.170 -2.157 -6.697
43 1HG1 VAL 160 HG11 VAL 160 -8.087 -2.711 -4.607
44 2HG1 VAL 160 HG12 VAL 160 -9.752 -3.288 -4.592
45 3HG1 VAL 160 HG13 VAL 160 -9.319 -1.827 -3.704
46 1HG2 VAL 160 HG21 VAL 160 -11.373 -1.429 -4.938
47 2HG2 VAL 160 HG22 VAL 160 -11.384 -1.907 -6.636
48 3HG2 VAL 160 HG23 VAL 160 -11.061 -0.231 -6.195
49 H PHE 161 HN PHE 161 -6.579 -1.518 -4.993
50 HA PHE 161 HA PHE 161 -6.633 -0.550 -2.291
51 1HB PHE 161 HB2 PHE 161 -4.982 -2.459 -3.867
52 2HB PHE 161 HB1 PHE 161 -4.227 -1.737 -2.452
53 HD1 PHE 161 HD1 PHE 161 -4.032 -3.914 -1.387
54 HD2 PHE 161 HD2 PHE 161 -7.827 -2.331 -2.483
55 HE1 PHE 161 HE1 PHE 161 -5.139 -5.580 0.049
56 HE2 PHE 161 HE2 PHE 161 -8.939 -3.994 -1.050
57 HZ PHE 161 HZ PHE 161 -7.596 -5.619 0.219
58 H PHE 162 HN PHE 162 -6.445 1.565 -4.173
59 HA PHE 162 HA PHE 162 -4.203 2.998 -3.135
60 1HB PHE 162 HB2 PHE 162 -2.821 2.099 -4.728
61 2HB PHE 162 HB1 PHE 162 -4.139 1.829 -5.865
62 HD1 PHE 162 HD1 PHE 162 -3.487 2.849 -7.847
63 HD2 PHE 162 HD2 PHE 162 -3.023 4.954 -4.176
64 HE1 PHE 162 HE1 PHE 162 -2.831 4.868 -9.092
65 HE2 PHE 162 HE2 PHE 162 -2.368 6.977 -5.415
66 HZ PHE 162 HZ PHE 162 -2.272 6.936 -7.874
67 H LEU 163 HN LEU 163 -6.563 2.835 -5.785
68 HA LEU 163 HA LEU 163 -6.972 5.649 -5.979
69 1HB LEU 163 HB2 LEU 163 -8.339 3.193 -6.943
70 2HB LEU 163 HB1 LEU 163 -9.280 4.670 -6.911
71 HG LEU 163 HG LEU 163 -6.790 4.113 -8.511
72 1HD1 LEU 163 HD11 LEU 163 -9.352 3.584 -9.123
73 2HD1 LEU 163 HD12 LEU 163 -8.136 4.027 -10.320
74 3HD1 LEU 163 HD13 LEU 163 -9.241 5.248 -9.693
75 1HD2 LEU 163 HD21 LEU 163 -7.493 6.557 -9.335
76 2HD2 LEU 163 HD22 LEU 163 -6.305 6.283 -8.061
77 3HD2 LEU 163 HD23 LEU 163 -7.970 6.684 -7.643
78 H PHE 164 HN PHE 164 -7.546 3.523 -3.595
79 HA PHE 164 HA PHE 164 -10.120 4.224 -2.647
80 1HB PHE 164 HB2 PHE 164 -9.363 2.141 -1.934
81 2HB PHE 164 HB1 PHE 164 -7.723 2.720 -1.648
82 HD1 PHE 164 HD1 PHE 164 -11.184 3.328 -0.360
83 HD2 PHE 164 HD2 PHE 164 -7.052 2.858 0.538
84 HE1 PHE 164 HE1 PHE 164 -11.687 3.527 2.039
85 HE2 PHE 164 HE2 PHE 164 -7.547 3.056 2.940
86 HZ PHE 164 HZ PHE 164 -9.869 3.390 3.694
87 H LEU 165 HN LEU 165 -6.853 5.394 -2.083
88 HA LEU 165 HA LEU 165 -7.676 7.920 -1.186
89 1HB LEU 165 HB2 LEU 165 -7.875 6.001 0.818
90 2HB LEU 165 HB1 LEU 165 -6.354 6.814 1.145
91 HG LEU 165 HG LEU 165 -7.599 8.994 1.088
92 1HD1 LEU 165 HD11 LEU 165 -10.036 7.222 1.181
93 2HD1 LEU 165 HD12 LEU 165 -9.531 8.173 -0.216
94 3HD1 LEU 165 HD13 LEU 165 -9.999 8.984 1.277
95 1HD2 LEU 165 HD21 LEU 165 -8.932 8.296 3.288
96 2HD2 LEU 165 HD22 LEU 165 -7.176 8.450 3.246
97 3HD2 LEU 165 HD23 LEU 165 -7.924 6.859 3.110
98 H LEU 166 HN LEU 166 -5.162 5.499 -0.579
99 HA LEU 166 HA LEU 166 -3.188 7.042 -1.967
100 1HB LEU 166 HB2 LEU 166 -2.134 8.049 -0.267
101 2HB LEU 166 HB1 LEU 166 -3.600 7.745 0.648
102 HG LEU 166 HG LEU 166 -2.408 5.475 1.235
103 1HD1 LEU 166 HD11 LEU 166 -0.110 5.411 1.139
104 2HD1 LEU 166 HD12 LEU 166 0.041 7.163 1.004
105 3HD1 LEU 166 HD13 LEU 166 -0.499 6.214 -0.381
106 1HD2 LEU 166 HD21 LEU 166 -1.733 8.157 2.429
107 2HD2 LEU 166 HD22 LEU 166 -1.362 6.612 3.193
108 3HD2 LEU 166 HD23 LEU 166 -3.040 7.071 2.900
109 HA PRO 167 HA PRO 167 -1.637 2.937 -2.505
110 1HB PRO 167 HB2 PRO 167 0.958 3.477 -3.150
111 2HB PRO 167 HB1 PRO 167 -0.393 3.716 -4.274
112 1HG PRO 167 HG2 PRO 167 1.033 5.720 -2.563
113 2HG PRO 167 HG1 PRO 167 0.498 5.863 -4.248
114 1HD PRO 167 HD2 PRO 167 -0.882 6.952 -2.195
115 2HD PRO 167 HD1 PRO 167 -1.683 6.322 -3.648
116 HA PRO 168 HA PRO 168 0.084 2.506 1.687
117 1HB PRO 168 HB2 PRO 168 -0.539 -0.110 1.988
118 2HB PRO 168 HB1 PRO 168 -1.732 1.188 2.191
119 1HG PRO 168 HG2 PRO 168 -1.235 -0.577 -0.183
120 2HG PRO 168 HG1 PRO 168 -2.778 -0.101 0.553
121 1HD PRO 168 HD2 PRO 168 -1.798 1.093 -1.671
122 2HD PRO 168 HD1 PRO 168 -2.772 1.966 -0.469
123 H ILE 169 HN ILE 169 1.994 2.680 -0.202
124 HA ILE 169 HA ILE 169 3.432 0.214 -0.546
125 HB ILE 169 HB ILE 169 3.486 2.264 -2.090
126 1HG1 ILE 169 HG12 ILE 169 5.884 1.839 -2.685
127 2HG1 ILE 169 HG11 ILE 169 6.031 0.896 -1.206
128 1HG2 ILE 169 HG21 ILE 169 3.967 3.916 -0.335
129 2HG2 ILE 169 HG22 ILE 169 5.145 3.956 -1.647
130 3HG2 ILE 169 HG23 ILE 169 5.557 3.187 -0.113
131 1HD1 ILE 169 HD11 ILE 169 3.984 0.254 -3.296
132 2HD1 ILE 169 HD12 ILE 169 4.593 -0.771 -1.996
133 3HD1 ILE 169 HD13 ILE 169 5.632 -0.372 -3.366
134 H ILE 170 HN ILE 170 3.718 3.087 1.443
135 HA ILE 170 HA ILE 170 6.084 2.252 2.808
136 HB ILE 170 HB ILE 170 4.112 4.353 3.706
137 1HG1 ILE 170 HG12 ILE 170 6.226 5.678 2.529
138 2HG1 ILE 170 HG11 ILE 170 5.982 4.309 1.449
139 1HG2 ILE 170 HG21 ILE 170 5.508 4.182 5.487
140 2HG2 ILE 170 HG22 ILE 170 6.489 5.262 4.498
141 3HG2 ILE 170 HG23 ILE 170 6.837 3.533 4.525
142 1HD1 ILE 170 HD11 ILE 170 4.320 6.675 1.907
143 2HD1 ILE 170 HD12 ILE 170 3.435 5.154 1.790
144 3HD1 ILE 170 HD13 ILE 170 4.494 5.662 0.474
145 H LEU 171 HN LEU 171 2.630 2.379 3.669
146 HA LEU 171 HA LEU 171 2.947 1.340 6.282
147 1HB LEU 171 HB2 LEU 171 0.515 1.094 4.509
148 2HB LEU 171 HB1 LEU 171 0.555 0.989 6.259
149 HG LEU 171 HG LEU 171 1.519 3.513 5.019
150 1HD1 LEU 171 HD11 LEU 171 -0.705 4.394 4.768
151 2HD1 LEU 171 HD12 LEU 171 -1.411 2.865 5.292
152 3HD1 LEU 171 HD13 LEU 171 -0.535 2.954 3.763
153 1HD2 LEU 171 HD21 LEU 171 -0.378 3.429 7.280
154 2HD2 LEU 171 HD22 LEU 171 1.081 4.394 7.056
155 3HD2 LEU 171 HD23 LEU 171 1.208 2.710 7.565
156 H ASP 172 HN ASP 172 1.823 -0.213 3.292
157 HA ASP 172 HA ASP 172 1.966 -2.841 4.405
158 1HB ASP 172 HB2 ASP 172 0.602 -1.745 2.311
159 2HB ASP 172 HB1 ASP 172 1.902 -2.602 1.469
160 H ALA 173 HN ALA 173 4.456 -0.976 3.990
161 HA ALA 173 HA ALA 173 6.139 -2.423 2.200
162 1HB ALA 173 HB1 ALA 173 7.321 -0.795 4.385
163 2HB ALA 173 HB2 ALA 173 6.306 0.036 3.205
164 3HB ALA 173 HB3 ALA 173 7.731 -0.857 2.672
165 H GLY 174 HN GLY 174 6.147 -2.056 5.741
166 1HA GLY 174 HA2 GLY 174 7.331 -4.754 5.955
167 2HA GLY 174 HA1 GLY 174 7.615 -3.443 7.118
168 H TYR 175 HN TYR 175 4.529 -3.057 6.254
169 HA TYR 175 HA TYR 175 2.490 -3.505 7.102
170 1HB TYR 175 HB2 TYR 175 3.910 -6.084 7.516
171 2HB TYR 175 HB1 TYR 175 2.450 -5.830 8.466
172 HD1 TYR 175 HD1 TYR 175 0.437 -6.492 7.551
173 HD2 TYR 175 HD2 TYR 175 3.645 -5.500 4.938
174 HE1 TYR 175 HE1 TYR 175 -0.934 -7.161 5.623
175 HE2 TYR 175 HE2 TYR 175 2.282 -6.164 3.003
176 HH TYR 175 HH TYR 175 -0.109 -6.406 2.429
177 H PHE 176 HN PHE 176 4.832 -4.788 9.463
178 HA PHE 176 HA PHE 176 3.508 -3.180 11.537
179 1HB PHE 176 HB2 PHE 176 3.998 -5.832 11.592
180 2HB PHE 176 HB1 PHE 176 5.496 -5.236 12.319
181 HD1 PHE 176 HD1 PHE 176 1.892 -5.616 12.726
182 HD2 PHE 176 HD2 PHE 176 5.466 -4.086 14.455
183 HE1 PHE 176 HE1 PHE 176 0.743 -5.393 14.889
184 HE2 PHE 176 HE2 PHE 176 4.325 -3.859 16.622
185 HZ PHE 176 HZ PHE 176 1.961 -4.513 16.842
186 H LEU 177 HN LEU 177 6.226 -3.205 9.585
187 HA LEU 177 HA LEU 177 8.084 -2.133 11.497
188 1HB LEU 177 HB2 LEU 177 8.453 -1.983 8.533
189 2HB LEU 177 HB1 LEU 177 9.669 -2.121 9.789
190 HG LEU 177 HG LEU 177 7.783 -4.303 8.890
191 1HD1 LEU 177 HD11 LEU 177 10.179 -5.320 8.451
192 2HD1 LEU 177 HD12 LEU 177 10.615 -3.617 8.302
193 3HD1 LEU 177 HD13 LEU 177 9.374 -4.304 7.254
194 1HD2 LEU 177 HD21 LEU 177 10.034 -4.534 10.872
195 2HD2 LEU 177 HD22 LEU 177 8.802 -5.731 10.473
196 3HD2 LEU 177 HD23 LEU 177 8.358 -4.267 11.351
197 HA PRO 178 HA PRO 178 7.118 1.955 9.305
198 1HB PRO 178 HB2 PRO 178 5.164 1.872 7.317
199 2HB PRO 178 HB1 PRO 178 6.907 1.799 7.058
200 1HG PRO 178 HG2 PRO 178 5.010 -0.256 6.590
201 2HG PRO 178 HG1 PRO 178 6.771 -0.370 6.467
202 1HD PRO 178 HD2 PRO 178 4.965 -1.218 8.662
203 2HD PRO 178 HD1 PRO 178 6.553 -1.858 8.189
204 H LEU 179 HN LEU 179 5.207 0.322 11.141
205 HA LEU 179 HA LEU 179 2.635 1.417 10.965
206 1HB LEU 179 HB2 LEU 179 3.323 -0.531 12.378
207 2HB LEU 179 HB1 LEU 179 4.080 0.599 13.484
208 HG LEU 179 HG LEU 179 1.907 1.616 13.965
209 1HD1 LEU 179 HD11 LEU 179 -0.148 0.606 13.110
210 2HD1 LEU 179 HD12 LEU 179 0.805 -0.485 12.104
211 3HD1 LEU 179 HD13 LEU 179 0.845 1.252 11.803
212 1HD2 LEU 179 HD21 LEU 179 1.339 0.047 15.490
213 2HD2 LEU 179 HD22 LEU 179 2.841 -0.700 14.944
214 3HD2 LEU 179 HD23 LEU 179 1.295 -1.254 14.299
215 H ARG 180 HN ARG 180 5.375 2.408 13.009
216 HA ARG 180 HA ARG 180 4.022 4.881 13.702
217 1HB ARG 180 HB2 ARG 180 6.583 3.566 14.573
218 2HB ARG 180 HB1 ARG 180 6.243 5.251 14.980
219 1HG ARG 180 HG2 ARG 180 4.615 2.838 15.754
220 2HG ARG 180 HG1 ARG 180 5.610 3.837 16.815
221 1HD ARG 180 HD2 ARG 180 3.589 4.784 17.243
222 2HD ARG 180 HD1 ARG 180 4.045 5.748 15.839
223 HE ARG 180 HE ARG 180 2.696 3.561 14.845
224 1HH1 ARG 180 1HH1 ARG 180 1.987 6.188 17.030
225 2HH1 ARG 180 2HH1 ARG 180 0.300 6.219 16.643
226 1HH2 ARG 180 1HH2 ARG 180 0.476 3.598 14.338
227 2HH2 ARG 180 2HH2 ARG 180 -0.560 4.749 15.116
228 1HG HSL 181 HG1 HSL 181 5.376 5.586 6.906
229 2HG HSL 181 HG2 HSL 181 4.303 4.639 8.063
230 H HSL 181 HN HSL 181 4.429 4.692 10.990
231 HA HSL 181 HA HSL 181 6.662 6.732 10.481
232 1HB HSL 181 HB1 HSL 181 7.177 5.755 8.439
233 2HB HSL 181 HB2 HSL 181 6.411 4.240 9.164
Start of MODEL 11
1 1H PHE 155 HT1 PHE 155 -7.383 -6.167 15.176
2 2H PHE 155 HT2 PHE 155 -6.368 -6.724 13.910
3 3H PHE 155 HT3 PHE 155 -8.074 -6.808 13.744
4 HA PHE 155 HA PHE 155 -8.154 -4.399 13.888
5 1HB PHE 155 HB2 PHE 155 -5.334 -4.887 14.408
6 2HB PHE 155 HB1 PHE 155 -5.593 -3.670 13.166
7 HD1 PHE 155 HD1 PHE 155 -5.742 -4.424 16.686
8 HD2 PHE 155 HD2 PHE 155 -6.935 -1.643 13.694
9 HE1 PHE 155 HE1 PHE 155 -6.189 -2.746 18.430
10 HE2 PHE 155 HE2 PHE 155 -7.384 0.040 15.432
11 HZ PHE 155 HZ PHE 155 -7.010 -0.511 17.803
12 H LEU 156 HN LEU 156 -7.033 -6.942 12.062
13 HA LEU 156 HA LEU 156 -7.074 -7.406 9.861
14 1HB LEU 156 HB2 LEU 156 -8.884 -5.051 10.030
15 2HB LEU 156 HB1 LEU 156 -8.383 -5.599 8.441
16 HG LEU 156 HG LEU 156 -9.879 -7.214 10.506
17 1HD1 LEU 156 HD11 LEU 156 -11.771 -6.799 9.357
18 2HD1 LEU 156 HD12 LEU 156 -10.947 -6.770 7.798
19 3HD1 LEU 156 HD13 LEU 156 -10.896 -5.354 8.847
20 1HD2 LEU 156 HD21 LEU 156 -8.763 -8.916 9.518
21 2HD2 LEU 156 HD22 LEU 156 -8.407 -7.986 8.063
22 3HD2 LEU 156 HD23 LEU 156 -10.004 -8.701 8.283
23 H GLN 157 HN GLN 157 -4.871 -5.943 10.944
24 HA GLN 157 HA GLN 157 -2.900 -5.124 10.138
25 1HB GLN 157 HB2 GLN 157 -4.161 -6.008 7.806
26 2HB GLN 157 HB1 GLN 157 -3.678 -4.355 7.450
27 1HG GLN 157 HG2 GLN 157 -1.721 -6.238 8.683
28 2HG GLN 157 HG1 GLN 157 -2.065 -6.326 6.956
29 1HE2 GLN 157 HE21 GLN 157 -1.666 -4.441 5.670
30 2HE2 GLN 157 HE22 GLN 157 -0.463 -3.300 6.155
31 H SER 158 HN SER 158 -3.578 -3.419 11.639
32 HA SER 158 HA SER 158 -3.772 -1.231 12.217
33 1HB SER 158 HB2 SER 158 -1.873 -1.079 10.547
34 2HB SER 158 HB1 SER 158 -3.079 -0.599 9.340
35 HG SER 158 HG SER 158 -1.853 1.047 10.775
36 H ASP 159 HN ASP 159 -6.149 -2.391 11.773
37 HA ASP 159 HA ASP 159 -8.348 -1.826 11.568
38 1HB ASP 159 HB2 ASP 159 -7.037 0.699 11.526
39 2HB ASP 159 HB1 ASP 159 -8.273 0.724 10.272
40 H VAL 160 HN VAL 160 -6.508 -0.504 8.815
41 HA VAL 160 HA VAL 160 -6.500 -1.177 6.626
42 HB VAL 160 HB VAL 160 -7.828 -3.330 7.710
43 1HG1 VAL 160 HG11 VAL 160 -9.591 -2.206 5.535
44 2HG1 VAL 160 HG12 VAL 160 -10.022 -2.365 7.237
45 3HG1 VAL 160 HG13 VAL 160 -9.735 -3.805 6.262
46 1HG2 VAL 160 HG21 VAL 160 -7.469 -4.381 5.524
47 2HG2 VAL 160 HG22 VAL 160 -6.081 -3.423 6.040
48 3HG2 VAL 160 HG23 VAL 160 -7.182 -2.790 4.818
49 H PHE 161 HN PHE 161 -9.747 -0.570 7.968
50 HA PHE 161 HA PHE 161 -10.727 0.702 5.624
51 1HB PHE 161 HB2 PHE 161 -11.657 0.322 8.410
52 2HB PHE 161 HB1 PHE 161 -12.319 1.715 7.562
53 HD1 PHE 161 HD1 PHE 161 -12.995 -1.528 8.371
54 HD2 PHE 161 HD2 PHE 161 -12.938 1.035 4.975
55 HE1 PHE 161 HE1 PHE 161 -14.621 -2.992 7.244
56 HE2 PHE 161 HE2 PHE 161 -14.564 -0.423 3.843
57 HZ PHE 161 HZ PHE 161 -15.408 -2.440 4.977
58 H PHE 162 HN PHE 162 -8.997 1.780 8.442
59 HA PHE 162 HA PHE 162 -9.406 4.568 8.158
60 1HB PHE 162 HB2 PHE 162 -7.740 2.750 9.716
61 2HB PHE 162 HB1 PHE 162 -6.956 4.289 9.364
62 HD1 PHE 162 HD1 PHE 162 -9.202 6.161 9.448
63 HD2 PHE 162 HD2 PHE 162 -8.310 2.841 11.956
64 HE1 PHE 162 HE1 PHE 162 -10.455 7.216 11.284
65 HE2 PHE 162 HE2 PHE 162 -9.561 3.890 13.797
66 HZ PHE 162 HZ PHE 162 -10.636 6.080 13.462
67 H LEU 163 HN LEU 163 -6.568 2.564 7.427
68 HA LEU 163 HA LEU 163 -5.180 4.547 5.956
69 1HB LEU 163 HB2 LEU 163 -4.315 2.408 7.079
70 2HB LEU 163 HB1 LEU 163 -4.890 1.575 5.652
71 HG LEU 163 HG LEU 163 -3.143 2.254 4.382
72 1HD1 LEU 163 HD11 LEU 163 -3.187 4.845 5.912
73 2HD1 LEU 163 HD12 LEU 163 -3.671 4.565 4.240
74 3HD1 LEU 163 HD13 LEU 163 -1.971 4.453 4.697
75 1HD2 LEU 163 HD21 LEU 163 -1.133 2.879 5.991
76 2HD2 LEU 163 HD22 LEU 163 -1.802 1.248 5.919
77 3HD2 LEU 163 HD23 LEU 163 -2.280 2.341 7.217
78 H PHE 164 HN PHE 164 -7.950 3.003 5.277
79 HA PHE 164 HA PHE 164 -7.684 2.282 2.557
80 1HB PHE 164 HB2 PHE 164 -9.445 1.748 4.536
81 2HB PHE 164 HB1 PHE 164 -10.346 2.969 3.645
82 HD1 PHE 164 HD1 PHE 164 -10.826 2.601 1.212
83 HD2 PHE 164 HD2 PHE 164 -9.258 -0.455 3.723
84 HE1 PHE 164 HE1 PHE 164 -11.535 0.902 -0.421
85 HE2 PHE 164 HE2 PHE 164 -9.963 -2.160 2.096
86 HZ PHE 164 HZ PHE 164 -11.102 -1.482 0.020
87 H LEU 165 HN LEU 165 -8.048 5.326 4.102
88 HA LEU 165 HA LEU 165 -9.619 6.690 2.189
89 1HB LEU 165 HB2 LEU 165 -7.374 8.179 3.429
90 2HB LEU 165 HB1 LEU 165 -9.064 8.628 3.265
91 HG LEU 165 HG LEU 165 -7.827 6.865 5.362
92 1HD1 LEU 165 HD11 LEU 165 -9.302 9.484 5.437
93 2HD1 LEU 165 HD12 LEU 165 -7.611 9.189 5.846
94 3HD1 LEU 165 HD13 LEU 165 -8.893 8.538 6.868
95 1HD2 LEU 165 HD21 LEU 165 -9.828 6.013 5.987
96 2HD2 LEU 165 HD22 LEU 165 -10.227 6.271 4.290
97 3HD2 LEU 165 HD23 LEU 165 -10.713 7.457 5.500
98 H LEU 166 HN LEU 166 -6.274 5.790 2.344
99 HA LEU 166 HA LEU 166 -5.907 6.332 -0.453
100 1HB LEU 166 HB2 LEU 166 -5.334 8.482 0.011
101 2HB LEU 166 HB1 LEU 166 -4.891 8.122 1.667
102 HG LEU 166 HG LEU 166 -3.036 7.018 -0.337
103 1HD1 LEU 166 HD11 LEU 166 -2.930 9.980 0.059
104 2HD1 LEU 166 HD12 LEU 166 -3.865 9.280 -1.263
105 3HD1 LEU 166 HD13 LEU 166 -2.129 8.984 -1.156
106 1HD2 LEU 166 HD21 LEU 166 -1.697 8.684 1.429
107 2HD2 LEU 166 HD22 LEU 166 -1.908 6.940 1.582
108 3HD2 LEU 166 HD23 LEU 166 -3.038 8.038 2.376
109 HA PRO 167 HA PRO 167 -3.819 2.489 0.898
110 1HB PRO 167 HB2 PRO 167 -3.128 1.942 -1.784
111 2HB PRO 167 HB1 PRO 167 -4.501 1.275 -0.882
112 1HG PRO 167 HG2 PRO 167 -4.411 3.550 -2.800
113 2HG PRO 167 HG1 PRO 167 -5.707 2.380 -2.498
114 1HD PRO 167 HD2 PRO 167 -5.862 4.896 -1.600
115 2HD PRO 167 HD1 PRO 167 -6.485 3.537 -0.640
116 HA PRO 168 HA PRO 168 0.208 4.519 0.686
117 1HB PRO 168 HB2 PRO 168 1.363 3.157 2.683
118 2HB PRO 168 HB1 PRO 168 0.105 4.365 3.003
119 1HG PRO 168 HG2 PRO 168 -0.129 1.379 2.857
120 2HG PRO 168 HG1 PRO 168 -0.801 2.496 4.059
121 1HD PRO 168 HD2 PRO 168 -2.234 1.494 1.960
122 2HD PRO 168 HD1 PRO 168 -2.578 3.057 2.725
123 H ILE 169 HN ILE 169 2.439 2.860 1.438
124 HA ILE 169 HA ILE 169 2.523 0.563 -0.274
125 HB ILE 169 HB ILE 169 2.791 2.596 -1.811
126 1HG1 ILE 169 HG12 ILE 169 5.080 1.344 -2.685
127 2HG1 ILE 169 HG11 ILE 169 4.333 0.110 -1.675
128 1HG2 ILE 169 HG21 ILE 169 4.986 3.606 -1.949
129 2HG2 ILE 169 HG22 ILE 169 5.526 2.661 -0.563
130 3HG2 ILE 169 HG23 ILE 169 4.275 3.887 -0.361
131 1HD1 ILE 169 HD11 ILE 169 2.916 -0.382 -3.294
132 2HD1 ILE 169 HD12 ILE 169 3.711 0.806 -4.326
133 3HD1 ILE 169 HD13 ILE 169 2.336 1.283 -3.332
134 H ILE 170 HN ILE 170 4.381 3.024 1.430
135 HA ILE 170 HA ILE 170 6.564 1.280 2.065
136 HB ILE 170 HB ILE 170 5.859 3.912 3.371
137 1HG1 ILE 170 HG12 ILE 170 7.962 4.366 1.629
138 2HG1 ILE 170 HG11 ILE 170 6.909 3.291 0.713
139 1HG2 ILE 170 HG21 ILE 170 8.258 2.134 3.405
140 2HG2 ILE 170 HG22 ILE 170 7.455 2.967 4.738
141 3HG2 ILE 170 HG23 ILE 170 8.453 3.876 3.603
142 1HD1 ILE 170 HD11 ILE 170 5.192 5.164 1.825
143 2HD1 ILE 170 HD12 ILE 170 5.748 5.089 0.152
144 3HD1 ILE 170 HD13 ILE 170 6.607 6.090 1.323
145 H LEU 171 HN LEU 171 3.659 2.437 3.705
146 HA LEU 171 HA LEU 171 4.265 1.320 6.248
147 1HB LEU 171 HB2 LEU 171 1.642 2.078 4.957
148 2HB LEU 171 HB1 LEU 171 1.777 1.532 6.617
149 HG LEU 171 HG LEU 171 2.995 4.038 5.457
150 1HD1 LEU 171 HD11 LEU 171 1.462 5.003 7.310
151 2HD1 LEU 171 HD12 LEU 171 0.611 3.464 7.167
152 3HD1 LEU 171 HD13 LEU 171 0.756 4.525 5.765
153 1HD2 LEU 171 HD21 LEU 171 3.139 2.902 8.247
154 2HD2 LEU 171 HD22 LEU 171 3.665 4.519 7.780
155 3HD2 LEU 171 HD23 LEU 171 4.482 3.102 7.120
156 H ASP 172 HN ASP 172 2.026 0.276 3.699
157 HA ASP 172 HA ASP 172 1.691 -2.336 4.810
158 1HB ASP 172 HB2 ASP 172 0.878 -1.139 2.153
159 2HB ASP 172 HB1 ASP 172 0.461 -2.782 2.661
160 H ALA 173 HN ALA 173 4.345 -1.067 3.444
161 HA ALA 173 HA ALA 173 5.020 -3.013 1.479
162 1HB ALA 173 HB1 ALA 173 7.379 -1.900 2.603
163 2HB ALA 173 HB2 ALA 173 6.167 -0.623 2.506
164 3HB ALA 173 HB3 ALA 173 6.615 -1.523 1.058
165 H GLY 174 HN GLY 174 5.817 -2.515 4.884
166 1HA GLY 174 HA2 GLY 174 6.689 -5.340 5.023
167 2HA GLY 174 HA1 GLY 174 7.472 -4.047 5.952
168 H TYR 175 HN TYR 175 4.288 -3.280 5.859
169 HA TYR 175 HA TYR 175 2.610 -3.224 7.305
170 1HB TYR 175 HB2 TYR 175 2.579 -5.701 8.577
171 2HB TYR 175 HB1 TYR 175 1.685 -5.207 7.149
172 HD1 TYR 175 HD1 TYR 175 3.952 -7.562 8.447
173 HD2 TYR 175 HD2 TYR 175 2.975 -5.463 4.876
174 HE1 TYR 175 HE1 TYR 175 5.109 -9.283 7.124
175 HE2 TYR 175 HE2 TYR 175 4.129 -7.178 3.546
176 HH TYR 175 HH TYR 175 6.141 -9.561 4.962
177 H PHE 176 HN PHE 176 5.628 -4.373 8.730
178 HA PHE 176 HA PHE 176 4.717 -3.613 11.386
179 1HB PHE 176 HB2 PHE 176 6.068 -5.710 10.952
180 2HB PHE 176 HB1 PHE 176 7.444 -4.653 10.604
181 HD1 PHE 176 HD1 PHE 176 5.534 -6.299 13.139
182 HD2 PHE 176 HD2 PHE 176 8.230 -3.085 12.430
183 HE1 PHE 176 HE1 PHE 176 6.070 -6.226 15.540
184 HE2 PHE 176 HE2 PHE 176 8.772 -3.005 14.829
185 HZ PHE 176 HZ PHE 176 7.691 -4.577 16.388
186 H LEU 177 HN LEU 177 6.416 -2.268 8.749
187 HA LEU 177 HA LEU 177 8.238 -0.573 9.997
188 1HB LEU 177 HB2 LEU 177 6.659 0.189 7.554
189 2HB LEU 177 HB1 LEU 177 8.286 0.678 7.984
190 HG LEU 177 HG LEU 177 7.402 -2.056 7.065
191 1HD1 LEU 177 HD11 LEU 177 7.939 0.098 5.547
192 2HD1 LEU 177 HD12 LEU 177 8.274 -1.560 5.049
193 3HD1 LEU 177 HD13 LEU 177 9.563 -0.566 5.729
194 1HD2 LEU 177 HD21 LEU 177 9.683 -2.772 7.305
195 2HD2 LEU 177 HD22 LEU 177 9.116 -2.165 8.860
196 3HD2 LEU 177 HD23 LEU 177 10.173 -1.171 7.858
197 HA PRO 178 HA PRO 178 4.408 2.637 9.993
198 1HB PRO 178 HB2 PRO 178 2.471 0.581 10.946
199 2HB PRO 178 HB1 PRO 178 2.203 1.992 9.917
200 1HG PRO 178 HG2 PRO 178 2.285 -0.446 8.863
201 2HG PRO 178 HG1 PRO 178 3.018 0.932 8.022
202 1HD PRO 178 HD2 PRO 178 4.326 -1.271 9.549
203 2HD PRO 178 HD1 PRO 178 4.875 -0.427 8.088
204 H LEU 179 HN LEU 179 5.976 3.037 11.724
205 HA LEU 179 HA LEU 179 5.283 1.974 14.352
206 1HB LEU 179 HB2 LEU 179 7.573 3.576 13.264
207 2HB LEU 179 HB1 LEU 179 7.276 3.531 14.992
208 HG LEU 179 HG LEU 179 7.859 1.151 13.229
209 1HD1 LEU 179 HD11 LEU 179 9.802 1.163 15.064
210 2HD1 LEU 179 HD12 LEU 179 9.499 2.897 14.957
211 3HD1 LEU 179 HD13 LEU 179 9.940 1.989 13.511
212 1HD2 LEU 179 HD21 LEU 179 7.210 1.367 16.159
213 2HD2 LEU 179 HD22 LEU 179 8.004 -0.037 15.445
214 3HD2 LEU 179 HD23 LEU 179 6.379 0.414 14.928
215 H ARG 180 HN ARG 180 6.011 5.215 13.059
216 HA ARG 180 HA ARG 180 4.296 6.419 15.075
217 1HB ARG 180 HB2 ARG 180 5.914 7.736 12.879
218 2HB ARG 180 HB1 ARG 180 5.135 8.554 14.238
219 1HG ARG 180 HG2 ARG 180 7.070 8.370 15.306
220 2HG ARG 180 HG1 ARG 180 6.743 6.640 15.434
221 1HD ARG 180 HD2 ARG 180 7.754 6.802 12.919
222 2HD ARG 180 HD1 ARG 180 8.649 8.088 13.729
223 HE ARG 180 HE ARG 180 8.607 5.609 15.185
224 1HH1 ARG 180 1HH1 ARG 180 10.243 7.449 12.711
225 2HH1 ARG 180 2HH1 ARG 180 11.746 6.611 12.906
226 1HH2 ARG 180 1HH2 ARG 180 10.584 4.505 15.441
227 2HH2 ARG 180 2HH2 ARG 180 11.940 4.941 14.454
228 1HG HSL 181 HG1 HSL 181 0.013 3.004 10.729
229 2HG HSL 181 HG2 HSL 181 1.296 2.662 12.004
230 H HSL 181 HN HSL 181 2.968 4.716 13.355
231 HA HSL 181 HA HSL 181 1.304 6.630 11.636
232 1HB HSL 181 HB1 HSL 181 1.035 5.007 9.994
233 2HB HSL 181 HB2 HSL 181 2.559 4.248 10.710
Start of MODEL 12
1 1H PHE 155 HT1 PHE 155 3.238 0.645 -14.905
2 2H PHE 155 HT2 PHE 155 3.017 -0.984 -15.396
3 3H PHE 155 HT3 PHE 155 4.030 -0.618 -14.061
4 HA PHE 155 HA PHE 155 1.799 -1.509 -13.530
5 1HB PHE 155 HB2 PHE 155 3.465 0.220 -12.260
6 2HB PHE 155 HB1 PHE 155 1.976 1.158 -12.279
7 HD1 PHE 155 HD1 PHE 155 2.568 -2.497 -11.889
8 HD2 PHE 155 HD2 PHE 155 1.103 1.099 -10.149
9 HE1 PHE 155 HE1 PHE 155 1.750 -3.773 -9.950
10 HE2 PHE 155 HE2 PHE 155 0.282 -0.170 -8.207
11 HZ PHE 155 HZ PHE 155 0.606 -2.609 -8.106
12 H LEU 156 HN LEU 156 -0.174 0.061 -12.510
13 HA LEU 156 HA LEU 156 -1.208 1.933 -14.373
14 1HB LEU 156 HB2 LEU 156 -3.009 0.694 -15.305
15 2HB LEU 156 HB1 LEU 156 -1.548 -0.230 -15.580
16 HG LEU 156 HG LEU 156 -2.944 -0.965 -13.119
17 1HD1 LEU 156 HD11 LEU 156 -4.390 -0.876 -15.692
18 2HD1 LEU 156 HD12 LEU 156 -5.003 -0.800 -14.040
19 3HD1 LEU 156 HD13 LEU 156 -4.545 -2.353 -14.739
20 1HD2 LEU 156 HD21 LEU 156 -1.085 -2.245 -13.998
21 2HD2 LEU 156 HD22 LEU 156 -1.952 -2.505 -15.512
22 3HD2 LEU 156 HD23 LEU 156 -2.554 -3.220 -14.016
23 H GLN 157 HN GLN 157 -3.949 1.606 -13.855
24 HA GLN 157 HA GLN 157 -5.582 1.819 -12.266
25 1HB GLN 157 HB2 GLN 157 -3.726 0.340 -10.860
26 2HB GLN 157 HB1 GLN 157 -3.922 1.771 -9.859
27 1HG GLN 157 HG2 GLN 157 -6.404 0.527 -10.844
28 2HG GLN 157 HG1 GLN 157 -5.471 -0.404 -9.672
29 1HE2 GLN 157 HE21 GLN 157 -5.094 0.490 -7.606
30 2HE2 GLN 157 HE22 GLN 157 -6.123 1.721 -6.966
31 H SER 158 HN SER 158 -4.968 3.970 -13.426
32 HA SER 158 HA SER 158 -4.934 6.235 -13.316
33 1HB SER 158 HB2 SER 158 -5.890 5.417 -10.621
34 2HB SER 158 HB1 SER 158 -5.354 7.096 -10.807
35 HG SER 158 HG SER 158 -6.955 7.470 -12.204
36 H ASP 159 HN ASP 159 -2.490 5.055 -13.359
37 HA ASP 159 HA ASP 159 -0.307 5.690 -13.203
38 1HB ASP 159 HB2 ASP 159 -1.616 8.030 -12.562
39 2HB ASP 159 HB1 ASP 159 -0.570 7.774 -11.167
40 H VAL 160 HN VAL 160 -1.901 6.021 -10.016
41 HA VAL 160 HA VAL 160 -1.501 4.994 -8.020
42 HB VAL 160 HB VAL 160 0.203 3.180 -9.730
43 1HG1 VAL 160 HG11 VAL 160 1.326 2.847 -7.768
44 2HG1 VAL 160 HG12 VAL 160 -0.016 1.727 -7.530
45 3HG1 VAL 160 HG13 VAL 160 -0.049 3.318 -6.771
46 1HG2 VAL 160 HG21 VAL 160 -1.559 1.563 -9.272
47 2HG2 VAL 160 HG22 VAL 160 -2.218 3.020 -10.014
48 3HG2 VAL 160 HG23 VAL 160 -2.405 2.750 -8.281
49 H PHE 161 HN PHE 161 1.549 5.221 -9.850
50 HA PHE 161 HA PHE 161 3.120 5.834 -7.559
51 1HB PHE 161 HB2 PHE 161 3.606 5.124 -10.250
52 2HB PHE 161 HB1 PHE 161 4.392 6.678 -9.994
53 HD1 PHE 161 HD1 PHE 161 6.038 6.908 -8.113
54 HD2 PHE 161 HD2 PHE 161 4.516 3.144 -9.389
55 HE1 PHE 161 HE1 PHE 161 7.916 5.775 -6.995
56 HE2 PHE 161 HE2 PHE 161 6.390 2.004 -8.274
57 HZ PHE 161 HZ PHE 161 8.092 3.319 -7.075
58 H PHE 162 HN PHE 162 0.829 7.652 -8.913
59 HA PHE 162 HA PHE 162 1.844 10.074 -7.806
60 1HB PHE 162 HB2 PHE 162 1.968 9.626 -10.725
61 2HB PHE 162 HB1 PHE 162 1.274 11.168 -10.215
62 HD1 PHE 162 HD1 PHE 162 4.178 9.764 -11.296
63 HD2 PHE 162 HD2 PHE 162 2.734 12.169 -8.097
64 HE1 PHE 162 HE1 PHE 162 6.440 10.672 -10.963
65 HE2 PHE 162 HE2 PHE 162 4.993 13.082 -7.757
66 HZ PHE 162 HZ PHE 162 6.849 12.335 -9.192
67 H LEU 163 HN LEU 163 -0.562 8.095 -8.053
68 HA LEU 163 HA LEU 163 -2.764 9.658 -8.925
69 1HB LEU 163 HB2 LEU 163 -2.468 7.062 -8.362
70 2HB LEU 163 HB1 LEU 163 -3.086 7.589 -6.806
71 HG LEU 163 HG LEU 163 -4.502 8.146 -9.399
72 1HD1 LEU 163 HD11 LEU 163 -4.338 5.754 -9.168
73 2HD1 LEU 163 HD12 LEU 163 -5.981 6.264 -8.782
74 3HD1 LEU 163 HD13 LEU 163 -4.859 5.846 -7.486
75 1HD2 LEU 163 HD21 LEU 163 -5.399 9.597 -7.868
76 2HD2 LEU 163 HD22 LEU 163 -5.095 8.520 -6.506
77 3HD2 LEU 163 HD23 LEU 163 -6.423 8.183 -7.617
78 H PHE 164 HN PHE 164 -0.957 9.260 -6.003
79 HA PHE 164 HA PHE 164 -0.841 10.458 -4.076
80 1HB PHE 164 HB2 PHE 164 -1.107 12.357 -5.803
81 2HB PHE 164 HB1 PHE 164 -2.762 12.469 -5.211
82 HD1 PHE 164 HD1 PHE 164 0.748 12.412 -3.962
83 HD2 PHE 164 HD2 PHE 164 -3.220 13.856 -3.431
84 HE1 PHE 164 HE1 PHE 164 1.516 13.827 -2.102
85 HE2 PHE 164 HE2 PHE 164 -2.458 15.275 -1.571
86 HZ PHE 164 HZ PHE 164 -0.088 15.262 -0.904
87 H LEU 165 HN LEU 165 -3.413 8.754 -4.926
88 HA LEU 165 HA LEU 165 -5.476 9.695 -3.230
89 1HB LEU 165 HB2 LEU 165 -5.005 7.387 -4.888
90 2HB LEU 165 HB1 LEU 165 -5.678 6.900 -3.337
91 HG LEU 165 HG LEU 165 -7.302 7.360 -5.277
92 1HD1 LEU 165 HD11 LEU 165 -8.156 6.992 -3.108
93 2HD1 LEU 165 HD12 LEU 165 -8.925 8.465 -3.697
94 3HD1 LEU 165 HD13 LEU 165 -7.598 8.566 -2.540
95 1HD2 LEU 165 HD21 LEU 165 -7.481 9.397 -6.153
96 2HD2 LEU 165 HD22 LEU 165 -5.994 9.814 -5.303
97 3HD2 LEU 165 HD23 LEU 165 -7.557 10.149 -4.560
98 H LEU 166 HN LEU 166 -3.323 6.895 -2.842
99 HA LEU 166 HA LEU 166 -2.849 7.515 -0.085
100 1HB LEU 166 HB2 LEU 166 -4.200 5.974 0.936
101 2HB LEU 166 HB1 LEU 166 -5.198 6.428 -0.433
102 HG LEU 166 HG LEU 166 -5.491 4.185 -0.503
103 1HD1 LEU 166 HD11 LEU 166 -3.964 5.083 -2.514
104 2HD1 LEU 166 HD12 LEU 166 -4.600 3.443 -2.421
105 3HD1 LEU 166 HD13 LEU 166 -2.944 3.776 -1.916
106 1HD2 LEU 166 HD21 LEU 166 -2.982 2.943 -0.036
107 2HD2 LEU 166 HD22 LEU 166 -4.451 2.874 0.936
108 3HD2 LEU 166 HD23 LEU 166 -3.257 4.137 1.232
109 HA PRO 167 HA PRO 167 0.032 4.652 -2.773
110 1HB PRO 167 HB2 PRO 167 2.124 6.504 -2.580
111 2HB PRO 167 HB1 PRO 167 1.157 6.141 -4.019
112 1HG PRO 167 HG2 PRO 167 0.887 8.375 -2.064
113 2HG PRO 167 HG1 PRO 167 0.573 8.362 -3.809
114 1HD PRO 167 HD2 PRO 167 -1.430 8.332 -2.026
115 2HD PRO 167 HD1 PRO 167 -1.534 7.420 -3.548
116 HA PRO 168 HA PRO 168 1.383 3.866 1.495
117 1HB PRO 168 HB2 PRO 168 1.414 1.187 1.277
118 2HB PRO 168 HB1 PRO 168 -0.102 2.089 1.467
119 1HG PRO 168 HG2 PRO 168 1.157 1.030 -1.051
120 2HG PRO 168 HG1 PRO 168 -0.525 0.894 -0.510
121 1HD PRO 168 HD2 PRO 168 0.295 2.746 -2.298
122 2HD PRO 168 HD1 PRO 168 -1.030 3.044 -1.156
123 H ILE 169 HN ILE 169 2.700 1.065 -0.037
124 HA ILE 169 HA ILE 169 4.768 0.480 -0.786
125 HB ILE 169 HB ILE 169 4.791 3.163 -1.399
126 1HG1 ILE 169 HG12 ILE 169 7.310 1.687 -1.890
127 2HG1 ILE 169 HG11 ILE 169 5.830 0.891 -2.413
128 1HG2 ILE 169 HG21 ILE 169 5.975 3.588 0.766
129 2HG2 ILE 169 HG22 ILE 169 6.828 4.144 -0.671
130 3HG2 ILE 169 HG23 ILE 169 7.330 2.657 0.132
131 1HD1 ILE 169 HD11 ILE 169 7.272 2.740 -3.837
132 2HD1 ILE 169 HD12 ILE 169 5.929 3.684 -3.192
133 3HD1 ILE 169 HD13 ILE 169 5.611 2.244 -4.160
134 H ILE 170 HN ILE 170 4.567 2.586 2.026
135 HA ILE 170 HA ILE 170 6.835 1.319 3.310
136 HB ILE 170 HB ILE 170 4.981 3.261 4.657
137 1HG1 ILE 170 HG12 ILE 170 6.944 4.885 3.787
138 2HG1 ILE 170 HG11 ILE 170 6.888 3.754 2.438
139 1HG2 ILE 170 HG21 ILE 170 7.351 3.909 5.576
140 2HG2 ILE 170 HG22 ILE 170 7.765 2.281 5.041
141 3HG2 ILE 170 HG23 ILE 170 6.480 2.519 6.225
142 1HD1 ILE 170 HD11 ILE 170 4.264 4.276 2.726
143 2HD1 ILE 170 HD12 ILE 170 5.340 5.189 1.670
144 3HD1 ILE 170 HD13 ILE 170 4.953 5.801 3.277
145 H LEU 171 HN LEU 171 3.520 1.997 4.415
146 HA LEU 171 HA LEU 171 3.546 -0.078 6.348
147 1HB LEU 171 HB2 LEU 171 1.871 1.189 7.087
148 2HB LEU 171 HB1 LEU 171 1.829 2.073 5.578
149 HG LEU 171 HG LEU 171 0.411 -0.560 5.785
150 1HD1 LEU 171 HD11 LEU 171 -0.340 1.999 7.090
151 2HD1 LEU 171 HD12 LEU 171 -0.636 0.337 7.599
152 3HD1 LEU 171 HD13 LEU 171 -1.608 1.053 6.313
153 1HD2 LEU 171 HD21 LEU 171 -0.007 0.034 3.674
154 2HD2 LEU 171 HD22 LEU 171 0.568 1.681 3.936
155 3HD2 LEU 171 HD23 LEU 171 -1.092 1.251 4.348
156 H ASP 172 HN ASP 172 2.246 0.199 3.083
157 HA ASP 172 HA ASP 172 1.010 -2.371 3.086
158 1HB ASP 172 HB2 ASP 172 0.360 -0.457 1.582
159 2HB ASP 172 HB1 ASP 172 1.848 -0.753 0.673
160 H ALA 173 HN ALA 173 4.220 -1.420 3.009
161 HA ALA 173 HA ALA 173 5.224 -3.390 1.202
162 1HB ALA 173 HB1 ALA 173 6.315 -1.256 2.820
163 2HB ALA 173 HB2 ALA 173 6.948 -1.984 1.346
164 3HB ALA 173 HB3 ALA 173 7.307 -2.710 2.913
165 H GLY 174 HN GLY 174 5.623 -3.010 4.715
166 1HA GLY 174 HA2 GLY 174 5.479 -5.956 4.963
167 2HA GLY 174 HA1 GLY 174 6.654 -4.987 5.873
168 H TYR 175 HN TYR 175 4.374 -2.893 6.045
169 HA TYR 175 HA TYR 175 2.632 -2.343 7.401
170 1HB TYR 175 HB2 TYR 175 1.774 -4.680 6.801
171 2HB TYR 175 HB1 TYR 175 2.454 -5.204 8.335
172 HD1 TYR 175 HD1 TYR 175 1.343 -1.890 8.734
173 HD2 TYR 175 HD2 TYR 175 -0.106 -5.883 8.442
174 HE1 TYR 175 HE1 TYR 175 -0.725 -1.218 9.875
175 HE2 TYR 175 HE2 TYR 175 -2.178 -5.217 9.585
176 HH TYR 175 HH TYR 175 -3.002 -1.931 10.137
177 H PHE 176 HN PHE 176 5.397 -4.062 8.513
178 HA PHE 176 HA PHE 176 4.968 -3.177 11.266
179 1HB PHE 176 HB2 PHE 176 6.851 -5.135 9.977
180 2HB PHE 176 HB1 PHE 176 7.180 -4.496 11.594
181 HD1 PHE 176 HD1 PHE 176 4.166 -5.770 9.786
182 HD2 PHE 176 HD2 PHE 176 6.613 -5.951 13.262
183 HE1 PHE 176 HE1 PHE 176 2.661 -7.459 10.752
184 HE2 PHE 176 HE2 PHE 176 5.113 -7.642 14.235
185 HZ PHE 176 HZ PHE 176 3.134 -8.399 12.979
186 H LEU 177 HN LEU 177 5.681 -1.476 8.871
187 HA LEU 177 HA LEU 177 8.350 -0.540 9.461
188 1HB LEU 177 HB2 LEU 177 6.292 0.008 7.401
189 2HB LEU 177 HB1 LEU 177 7.428 1.297 7.752
190 HG LEU 177 HG LEU 177 8.038 -0.225 5.840
191 1HD1 LEU 177 HD11 LEU 177 10.435 -0.608 6.948
192 2HD1 LEU 177 HD12 LEU 177 9.754 0.514 8.126
193 3HD1 LEU 177 HD13 LEU 177 9.861 0.976 6.427
194 1HD2 LEU 177 HD21 LEU 177 7.359 -2.256 7.441
195 2HD2 LEU 177 HD22 LEU 177 9.093 -2.201 7.765
196 3HD2 LEU 177 HD23 LEU 177 8.510 -2.421 6.115
197 HA PRO 178 HA PRO 178 5.650 3.308 10.851
198 1HB PRO 178 HB2 PRO 178 3.134 1.943 11.603
199 2HB PRO 178 HB1 PRO 178 3.371 3.462 10.734
200 1HG PRO 178 HG2 PRO 178 2.528 1.273 9.467
201 2HG PRO 178 HG1 PRO 178 3.663 2.398 8.695
202 1HD PRO 178 HD2 PRO 178 4.212 -0.239 10.014
203 2HD PRO 178 HD1 PRO 178 4.861 0.417 8.497
204 H LEU 179 HN LEU 179 7.397 2.288 12.357
205 HA LEU 179 HA LEU 179 6.300 1.179 14.811
206 1HB LEU 179 HB2 LEU 179 8.658 0.780 13.511
207 2HB LEU 179 HB1 LEU 179 9.144 1.940 14.732
208 HG LEU 179 HG LEU 179 7.589 -0.026 16.050
209 1HD1 LEU 179 HD11 LEU 179 8.577 -2.083 15.515
210 2HD1 LEU 179 HD12 LEU 179 9.824 -1.325 14.524
211 3HD1 LEU 179 HD13 LEU 179 8.153 -1.367 13.961
212 1HD2 LEU 179 HD21 LEU 179 10.586 0.183 16.077
213 2HD2 LEU 179 HD22 LEU 179 9.503 -0.281 17.389
214 3HD2 LEU 179 HD23 LEU 179 9.551 1.393 16.835
215 H ARG 180 HN ARG 180 8.622 3.811 14.185
216 HA ARG 180 HA ARG 180 7.739 5.168 16.595
217 1HB ARG 180 HB2 ARG 180 9.595 6.695 16.187
218 2HB ARG 180 HB1 ARG 180 10.143 5.017 16.081
219 1HG ARG 180 HG2 ARG 180 9.413 5.706 13.480
220 2HG ARG 180 HG1 ARG 180 10.252 7.124 14.113
221 1HD ARG 180 HD2 ARG 180 11.805 5.580 13.028
222 2HD ARG 180 HD1 ARG 180 12.147 5.732 14.751
223 HE ARG 180 HE ARG 180 10.544 3.564 14.643
224 1HH1 ARG 180 1HH1 ARG 180 13.449 4.454 12.924
225 2HH1 ARG 180 2HH1 ARG 180 13.977 2.818 12.717
226 1HH2 ARG 180 1HH2 ARG 180 11.238 1.411 14.371
227 2HH2 ARG 180 2HH2 ARG 180 12.723 1.090 13.538
228 1HG HSL 181 HG1 HSL 181 2.641 5.713 11.760
229 2HG HSL 181 HG2 HSL 181 3.527 4.436 12.746
230 H HSL 181 HN HSL 181 5.823 4.885 14.509
231 HA HSL 181 HA HSL 181 5.422 7.805 13.667
232 1HB HSL 181 HB1 HSL 181 4.514 7.159 11.628
233 2HB HSL 181 HB2 HSL 181 5.460 5.598 11.894
Start of MODEL 13
1 1H PHE 155 HT1 PHE 155 4.777 -1.545 -12.891
2 2H PHE 155 HT2 PHE 155 3.149 -1.750 -12.390
3 3H PHE 155 HT3 PHE 155 4.115 -0.517 -11.689
4 HA PHE 155 HA PHE 155 4.314 0.494 -13.889
5 1HB PHE 155 HB2 PHE 155 1.916 -0.896 -14.861
6 2HB PHE 155 HB1 PHE 155 3.382 -0.448 -15.723
7 HD1 PHE 155 HD1 PHE 155 5.257 -1.975 -15.866
8 HD2 PHE 155 HD2 PHE 155 1.692 -3.053 -13.808
9 HE1 PHE 155 HE1 PHE 155 5.966 -4.331 -15.880
10 HE2 PHE 155 HE2 PHE 155 2.394 -5.412 -13.818
11 HZ PHE 155 HZ PHE 155 4.534 -6.053 -14.855
12 H LEU 156 HN LEU 156 1.084 -0.760 -13.076
13 HA LEU 156 HA LEU 156 0.343 1.542 -11.588
14 1HB LEU 156 HB2 LEU 156 -1.268 2.482 -13.109
15 2HB LEU 156 HB1 LEU 156 0.309 2.458 -13.873
16 HG LEU 156 HG LEU 156 -0.595 0.160 -14.848
17 1HD1 LEU 156 HD11 LEU 156 -3.156 1.570 -15.074
18 2HD1 LEU 156 HD12 LEU 156 -2.812 0.914 -13.474
19 3HD1 LEU 156 HD13 LEU 156 -2.816 -0.149 -14.880
20 1HD2 LEU 156 HD21 LEU 156 0.079 1.641 -16.444
21 2HD2 LEU 156 HD22 LEU 156 -0.864 2.970 -15.768
22 3HD2 LEU 156 HD23 LEU 156 -1.664 1.710 -16.708
23 H GLN 157 HN GLN 157 -1.118 0.879 -10.156
24 HA GLN 157 HA GLN 157 -3.390 -0.675 -10.813
25 1HB GLN 157 HB2 GLN 157 -1.697 -2.471 -10.907
26 2HB GLN 157 HB1 GLN 157 -1.237 -2.110 -9.250
27 1HG GLN 157 HG2 GLN 157 -3.005 -3.187 -8.383
28 2HG GLN 157 HG1 GLN 157 -4.093 -2.655 -9.665
29 1HE2 GLN 157 HE21 GLN 157 -1.086 -4.537 -9.661
30 2HE2 GLN 157 HE22 GLN 157 -1.736 -5.902 -10.494
31 H SER 158 HN SER 158 -1.174 0.421 -8.310
32 HA SER 158 HA SER 158 -3.093 0.285 -6.200
33 1HB SER 158 HB2 SER 158 -0.377 1.574 -6.474
34 2HB SER 158 HB1 SER 158 -1.368 1.785 -5.021
35 HG SER 158 HG SER 158 -0.173 0.026 -4.584
36 H ASP 159 HN ASP 159 -4.635 1.402 -7.800
37 HA ASP 159 HA ASP 159 -6.093 3.145 -8.019
38 1HB ASP 159 HB2 ASP 159 -4.566 3.922 -5.720
39 2HB ASP 159 HB1 ASP 159 -4.817 5.338 -6.738
40 H VAL 160 HN VAL 160 -2.836 4.547 -7.881
41 HA VAL 160 HA VAL 160 -1.569 5.659 -9.403
42 HB VAL 160 HB VAL 160 -3.521 4.584 -11.437
43 1HG1 VAL 160 HG11 VAL 160 -1.534 4.866 -12.975
44 2HG1 VAL 160 HG12 VAL 160 -0.800 5.841 -11.702
45 3HG1 VAL 160 HG13 VAL 160 -2.314 6.356 -12.444
46 1HG2 VAL 160 HG21 VAL 160 -0.852 3.375 -11.130
47 2HG2 VAL 160 HG22 VAL 160 -2.409 2.622 -11.473
48 3HG2 VAL 160 HG23 VAL 160 -1.992 3.071 -9.819
49 H PHE 161 HN PHE 161 -5.037 6.040 -10.079
50 HA PHE 161 HA PHE 161 -4.785 8.643 -11.170
51 1HB PHE 161 HB2 PHE 161 -7.329 8.679 -10.725
52 2HB PHE 161 HB1 PHE 161 -6.699 7.521 -11.890
53 HD1 PHE 161 HD1 PHE 161 -7.398 7.727 -8.228
54 HD2 PHE 161 HD2 PHE 161 -7.500 5.382 -11.777
55 HE1 PHE 161 HE1 PHE 161 -8.477 5.900 -6.985
56 HE2 PHE 161 HE2 PHE 161 -8.577 3.547 -10.539
57 HZ PHE 161 HZ PHE 161 -9.069 3.807 -8.139
58 H PHE 162 HN PHE 162 -4.449 7.567 -8.046
59 HA PHE 162 HA PHE 162 -4.418 10.217 -7.019
60 1HB PHE 162 HB2 PHE 162 -6.749 8.462 -6.431
61 2HB PHE 162 HB1 PHE 162 -6.094 9.454 -5.124
62 HD1 PHE 162 HD1 PHE 162 -8.337 9.377 -7.838
63 HD2 PHE 162 HD2 PHE 162 -5.729 11.967 -5.695
64 HE1 PHE 162 HE1 PHE 162 -9.586 11.323 -8.677
65 HE2 PHE 162 HE2 PHE 162 -6.975 13.919 -6.529
66 HZ PHE 162 HZ PHE 162 -8.906 13.597 -8.022
67 H LEU 163 HN LEU 163 -2.920 7.520 -7.184
68 HA LEU 163 HA LEU 163 -2.512 6.704 -4.481
69 1HB LEU 163 HB2 LEU 163 -1.921 5.426 -6.634
70 2HB LEU 163 HB1 LEU 163 -0.492 6.438 -6.698
71 HG LEU 163 HG LEU 163 0.263 5.561 -4.557
72 1HD1 LEU 163 HD11 LEU 163 -2.460 4.430 -4.516
73 2HD1 LEU 163 HD12 LEU 163 -1.438 4.988 -3.191
74 3HD1 LEU 163 HD13 LEU 163 -1.174 3.395 -3.898
75 1HD2 LEU 163 HD21 LEU 163 1.159 4.287 -6.254
76 2HD2 LEU 163 HD22 LEU 163 -0.411 3.665 -6.762
77 3HD2 LEU 163 HD23 LEU 163 0.343 3.059 -5.287
78 H PHE 164 HN PHE 164 -1.838 9.464 -6.145
79 HA PHE 164 HA PHE 164 0.718 10.171 -5.084
80 1HB PHE 164 HB2 PHE 164 -0.154 11.098 -7.181
81 2HB PHE 164 HB1 PHE 164 -1.487 11.845 -6.305
82 HD1 PHE 164 HD1 PHE 164 -0.963 13.651 -4.631
83 HD2 PHE 164 HD2 PHE 164 1.920 12.168 -7.386
84 HE1 PHE 164 HE1 PHE 164 0.402 15.670 -4.285
85 HE2 PHE 164 HE2 PHE 164 3.291 14.183 -7.044
86 HZ PHE 164 HZ PHE 164 2.532 15.937 -5.491
87 H LEU 165 HN LEU 165 -2.558 10.383 -3.950
88 HA LEU 165 HA LEU 165 -2.290 12.527 -2.145
89 1HB LEU 165 HB2 LEU 165 -4.288 10.699 -2.877
90 2HB LEU 165 HB1 LEU 165 -4.075 10.501 -1.147
91 HG LEU 165 HG LEU 165 -4.397 12.974 -0.896
92 1HD1 LEU 165 HD11 LEU 165 -5.640 14.009 -2.883
93 2HD1 LEU 165 HD12 LEU 165 -4.906 12.721 -3.839
94 3HD1 LEU 165 HD13 LEU 165 -3.884 13.876 -2.984
95 1HD2 LEU 165 HD21 LEU 165 -6.788 11.808 -2.263
96 2HD2 LEU 165 HD22 LEU 165 -6.701 12.799 -0.806
97 3HD2 LEU 165 HD23 LEU 165 -6.197 11.110 -0.755
98 H LEU 166 HN LEU 166 -2.030 9.019 -1.636
99 HA LEU 166 HA LEU 166 -0.003 9.371 0.362
100 1HB LEU 166 HB2 LEU 166 -2.666 9.430 1.219
101 2HB LEU 166 HB1 LEU 166 -2.110 7.809 1.592
102 HG LEU 166 HG LEU 166 -1.805 9.290 3.500
103 1HD1 LEU 166 HD11 LEU 166 -0.213 7.469 3.176
104 2HD1 LEU 166 HD12 LEU 166 0.560 8.865 3.924
105 3HD1 LEU 166 HD13 LEU 166 0.813 8.530 2.211
106 1HD2 LEU 166 HD21 LEU 166 -0.234 11.157 3.406
107 2HD2 LEU 166 HD22 LEU 166 -1.578 11.397 2.289
108 3HD2 LEU 166 HD23 LEU 166 -0.005 10.884 1.679
109 HA PRO 167 HA PRO 167 0.210 5.484 -2.137
110 1HB PRO 167 HB2 PRO 167 2.955 5.436 -2.112
111 2HB PRO 167 HB1 PRO 167 1.975 6.230 -3.359
112 1HG PRO 167 HG2 PRO 167 3.344 7.418 -0.977
113 2HG PRO 167 HG1 PRO 167 3.211 8.054 -2.627
114 1HD PRO 167 HD2 PRO 167 1.674 8.978 -0.621
115 2HD PRO 167 HD1 PRO 167 1.063 8.844 -2.283
116 HA PRO 168 HA PRO 168 0.878 3.375 1.823
117 1HB PRO 168 HB2 PRO 168 -0.677 1.262 1.312
118 2HB PRO 168 HB1 PRO 168 -1.383 2.856 1.656
119 1HG PRO 168 HG2 PRO 168 -0.922 1.519 -0.994
120 2HG PRO 168 HG1 PRO 168 -2.367 2.369 -0.411
121 1HD PRO 168 HD2 PRO 168 -0.492 3.511 -2.032
122 2HD PRO 168 HD1 PRO 168 -1.489 4.435 -0.890
123 H ILE 169 HN ILE 169 2.855 3.227 -0.307
124 HA ILE 169 HA ILE 169 3.336 0.467 -0.912
125 HB ILE 169 HB ILE 169 4.079 2.561 -2.239
126 1HG1 ILE 169 HG12 ILE 169 4.612 0.218 -2.823
127 2HG1 ILE 169 HG11 ILE 169 5.922 1.320 -3.233
128 1HG2 ILE 169 HG21 ILE 169 6.292 3.396 -1.778
129 2HG2 ILE 169 HG22 ILE 169 6.443 2.317 -0.391
130 3HG2 ILE 169 HG23 ILE 169 5.266 3.630 -0.363
131 1HD1 ILE 169 HD11 ILE 169 6.757 0.605 -0.821
132 2HD1 ILE 169 HD12 ILE 169 7.128 -0.331 -2.269
133 3HD1 ILE 169 HD13 ILE 169 5.810 -0.830 -1.209
134 H ILE 170 HN ILE 170 4.626 2.814 1.345
135 HA ILE 170 HA ILE 170 6.649 1.124 2.426
136 HB ILE 170 HB ILE 170 5.456 3.552 3.753
137 1HG1 ILE 170 HG12 ILE 170 7.815 4.322 2.486
138 2HG1 ILE 170 HG11 ILE 170 6.988 3.332 1.287
139 1HG2 ILE 170 HG21 ILE 170 6.858 2.698 5.329
140 2HG2 ILE 170 HG22 ILE 170 8.027 3.637 4.400
141 3HG2 ILE 170 HG23 ILE 170 7.887 1.898 4.140
142 1HD1 ILE 170 HD11 ILE 170 5.955 5.802 2.649
143 2HD1 ILE 170 HD12 ILE 170 4.965 4.749 1.639
144 3HD1 ILE 170 HD13 ILE 170 6.350 5.591 0.943
145 H LEU 171 HN LEU 171 3.545 2.293 3.789
146 HA LEU 171 HA LEU 171 3.705 0.722 6.122
147 1HB LEU 171 HB2 LEU 171 1.261 1.120 6.310
148 2HB LEU 171 HB1 LEU 171 2.193 2.582 6.055
149 HG LEU 171 HG LEU 171 1.552 2.050 3.506
150 1HD1 LEU 171 HD11 LEU 171 0.156 0.074 4.703
151 2HD1 LEU 171 HD12 LEU 171 -0.307 0.827 3.178
152 3HD1 LEU 171 HD13 LEU 171 -1.052 1.358 4.685
153 1HD2 LEU 171 HD21 LEU 171 -0.532 3.514 4.001
154 2HD2 LEU 171 HD22 LEU 171 1.079 4.167 4.301
155 3HD2 LEU 171 HD23 LEU 171 0.109 3.561 5.643
156 H ASP 172 HN ASP 172 1.988 0.193 3.073
157 HA ASP 172 HA ASP 172 1.159 -2.451 3.771
158 1HB ASP 172 HB2 ASP 172 0.169 -0.716 2.018
159 2HB ASP 172 HB1 ASP 172 1.257 -1.580 0.920
160 H ALA 173 HN ALA 173 4.168 -1.311 3.126
161 HA ALA 173 HA ALA 173 5.119 -3.257 1.272
162 1HB ALA 173 HB1 ALA 173 7.198 -2.292 3.011
163 2HB ALA 173 HB2 ALA 173 6.170 -0.960 2.490
164 3HB ALA 173 HB3 ALA 173 6.950 -1.988 1.292
165 H GLY 174 HN GLY 174 6.012 -2.802 4.680
166 1HA GLY 174 HA2 GLY 174 6.123 -5.744 4.966
167 2HA GLY 174 HA1 GLY 174 7.103 -4.600 5.906
168 H TYR 175 HN TYR 175 4.682 -2.815 6.069
169 HA TYR 175 HA TYR 175 2.880 -2.412 7.366
170 1HB TYR 175 HB2 TYR 175 2.086 -4.672 6.538
171 2HB TYR 175 HB1 TYR 175 2.758 -5.363 8.011
172 HD1 TYR 175 HD1 TYR 175 0.901 -2.167 7.558
173 HD2 TYR 175 HD2 TYR 175 0.895 -6.087 9.210
174 HE1 TYR 175 HE1 TYR 175 -1.193 -1.658 8.744
175 HE2 TYR 175 HE2 TYR 175 -1.198 -5.590 10.400
176 HH TYR 175 HH TYR 175 -3.093 -2.849 9.718
177 H PHE 176 HN PHE 176 5.584 -4.190 8.573
178 HA PHE 176 HA PHE 176 4.944 -3.467 11.330
179 1HB PHE 176 HB2 PHE 176 6.227 -5.678 10.218
180 2HB PHE 176 HB1 PHE 176 7.546 -4.721 10.907
181 HD1 PHE 176 HD1 PHE 176 6.659 -3.641 13.322
182 HD2 PHE 176 HD2 PHE 176 5.578 -7.378 11.597
183 HE1 PHE 176 HE1 PHE 176 6.125 -4.515 15.559
184 HE2 PHE 176 HE2 PHE 176 5.042 -8.259 13.831
185 HZ PHE 176 HZ PHE 176 5.316 -6.827 15.815
186 H LEU 177 HN LEU 177 5.672 -1.599 9.104
187 HA LEU 177 HA LEU 177 8.264 -0.585 9.823
188 1HB LEU 177 HB2 LEU 177 6.171 0.453 7.920
189 2HB LEU 177 HB1 LEU 177 7.752 1.176 8.145
190 HG LEU 177 HG LEU 177 8.798 -0.911 7.366
191 1HD1 LEU 177 HD11 LEU 177 7.256 -2.524 6.164
192 2HD1 LEU 177 HD12 LEU 177 5.957 -1.792 7.106
193 3HD1 LEU 177 HD13 LEU 177 7.298 -2.591 7.926
194 1HD2 LEU 177 HD21 LEU 177 7.009 0.752 5.727
195 2HD2 LEU 177 HD22 LEU 177 7.570 -0.745 4.983
196 3HD2 LEU 177 HD23 LEU 177 8.737 0.442 5.565
197 HA PRO 178 HA PRO 178 5.086 3.066 11.192
198 1HB PRO 178 HB2 PRO 178 3.225 1.011 12.334
199 2HB PRO 178 HB1 PRO 178 2.868 2.642 11.745
200 1HG PRO 178 HG2 PRO 178 2.322 0.542 10.233
201 2HG PRO 178 HG1 PRO 178 3.029 2.000 9.510
202 1HD PRO 178 HD2 PRO 178 4.302 -0.624 10.121
203 2HD PRO 178 HD1 PRO 178 4.624 0.509 8.794
204 H LEU 179 HN LEU 179 5.087 0.003 13.033
205 HA LEU 179 HA LEU 179 5.851 -0.529 15.107
206 1HB LEU 179 HB2 LEU 179 7.649 1.764 14.388
207 2HB LEU 179 HB1 LEU 179 7.745 1.022 15.974
208 HG LEU 179 HG LEU 179 8.218 -0.347 13.325
209 1HD1 LEU 179 HD11 LEU 179 10.432 -0.143 13.691
210 2HD1 LEU 179 HD12 LEU 179 10.267 -0.277 15.441
211 3HD1 LEU 179 HD13 LEU 179 9.929 1.256 14.640
212 1HD2 LEU 179 HD21 LEU 179 9.054 -2.149 15.068
213 2HD2 LEU 179 HD22 LEU 179 7.377 -2.094 14.527
214 3HD2 LEU 179 HD23 LEU 179 7.825 -1.390 16.080
215 H ARG 180 HN ARG 180 3.500 0.518 15.311
216 HA ARG 180 HA ARG 180 2.042 1.537 16.731
217 1HB ARG 180 HB2 ARG 180 4.459 2.122 18.453
218 2HB ARG 180 HB1 ARG 180 2.769 2.087 18.969
219 1HG ARG 180 HG2 ARG 180 3.413 0.037 19.692
220 2HG ARG 180 HG1 ARG 180 2.936 -0.394 18.049
221 1HD ARG 180 HD2 ARG 180 5.054 -0.819 17.405
222 2HD ARG 180 HD1 ARG 180 5.719 0.510 18.355
223 HE ARG 180 HE ARG 180 6.089 -0.949 20.084
224 1HH1 ARG 180 1HH1 ARG 180 3.978 -2.460 17.753
225 2HH1 ARG 180 2HH1 ARG 180 4.060 -4.019 18.502
226 1HH2 ARG 180 1HH2 ARG 180 6.199 -2.998 21.071
227 2HH2 ARG 180 2HH2 ARG 180 5.320 -4.325 20.387
228 1HG HSL 181 HG1 HSL 181 3.725 7.494 13.312
229 2HG HSL 181 HG2 HSL 181 3.911 6.426 11.823
230 H HSL 181 HN HSL 181 3.023 2.945 14.544
231 HA HSL 181 HA HSL 181 3.128 5.822 15.599
232 1HB HSL 181 HB1 HSL 181 5.115 5.810 14.306
233 2HB HSL 181 HB2 HSL 181 4.480 4.500 13.172
Start of MODEL 14
1 1H PHE 155 HT1 PHE 155 -12.559 0.180 -7.345
2 2H PHE 155 HT2 PHE 155 -12.752 -1.337 -8.125
3 3H PHE 155 HT3 PHE 155 -13.896 -0.819 -6.956
4 HA PHE 155 HA PHE 155 -14.809 -0.546 -9.084
5 1HB PHE 155 HB2 PHE 155 -15.017 1.202 -7.204
6 2HB PHE 155 HB1 PHE 155 -13.920 2.180 -8.173
7 HD1 PHE 155 HD1 PHE 155 -17.305 1.041 -7.732
8 HD2 PHE 155 HD2 PHE 155 -14.616 2.888 -10.464
9 HE1 PHE 155 HE1 PHE 155 -19.214 1.867 -9.047
10 HE2 PHE 155 HE2 PHE 155 -16.520 3.717 -11.783
11 HZ PHE 155 HZ PHE 155 -18.823 3.208 -11.074
12 H LEU 156 HN LEU 156 -11.531 -0.067 -9.010
13 HA LEU 156 HA LEU 156 -9.979 0.254 -10.608
14 1HB LEU 156 HB2 LEU 156 -12.385 -0.453 -12.162
15 2HB LEU 156 HB1 LEU 156 -11.105 0.342 -13.059
16 HG LEU 156 HG LEU 156 -10.697 -2.152 -11.412
17 1HD1 LEU 156 HD11 LEU 156 -10.669 -3.355 -13.540
18 2HD1 LEU 156 HD12 LEU 156 -11.117 -1.872 -14.384
19 3HD1 LEU 156 HD13 LEU 156 -12.239 -2.608 -13.240
20 1HD2 LEU 156 HD21 LEU 156 -8.813 -0.420 -12.132
21 2HD2 LEU 156 HD22 LEU 156 -8.917 -1.334 -13.637
22 3HD2 LEU 156 HD23 LEU 156 -8.539 -2.162 -12.127
23 H GLN 157 HN GLN 157 -9.106 2.226 -10.467
24 HA GLN 157 HA GLN 157 -9.909 4.303 -12.217
25 1HB GLN 157 HB2 GLN 157 -11.641 4.446 -10.359
26 2HB GLN 157 HB1 GLN 157 -10.326 4.943 -9.302
27 1HG GLN 157 HG2 GLN 157 -11.634 6.830 -10.194
28 2HG GLN 157 HG1 GLN 157 -9.926 6.903 -10.624
29 1HE2 GLN 157 HE21 GLN 157 -9.475 7.318 -12.663
30 2HE2 GLN 157 HE22 GLN 157 -10.540 7.096 -14.006
31 H SER 158 HN SER 158 -7.690 3.995 -12.716
32 HA SER 158 HA SER 158 -5.457 4.415 -12.607
33 1HB SER 158 HB2 SER 158 -6.617 6.754 -12.424
34 2HB SER 158 HB1 SER 158 -6.033 6.706 -10.751
35 HG SER 158 HG SER 158 -3.934 6.499 -11.540
36 H ASP 159 HN ASP 159 -5.366 2.416 -11.287
37 HA ASP 159 HA ASP 159 -4.588 1.163 -9.605
38 1HB ASP 159 HB2 ASP 159 -2.939 2.673 -8.042
39 2HB ASP 159 HB1 ASP 159 -2.480 1.845 -9.522
40 H VAL 160 HN VAL 160 -5.390 4.355 -8.245
41 HA VAL 160 HA VAL 160 -6.877 4.889 -6.604
42 HB VAL 160 HB VAL 160 -7.748 2.309 -7.222
43 1HG1 VAL 160 HG11 VAL 160 -7.350 2.539 -4.242
44 2HG1 VAL 160 HG12 VAL 160 -6.628 1.338 -5.313
45 3HG1 VAL 160 HG13 VAL 160 -8.368 1.343 -5.041
46 1HG2 VAL 160 HG21 VAL 160 -9.782 3.129 -6.640
47 2HG2 VAL 160 HG22 VAL 160 -8.881 4.645 -6.675
48 3HG2 VAL 160 HG23 VAL 160 -9.193 3.839 -5.138
49 H PHE 161 HN PHE 161 -4.889 2.048 -5.744
50 HA PHE 161 HA PHE 161 -4.386 3.038 -3.096
51 1HB PHE 161 HB2 PHE 161 -3.688 0.642 -4.669
52 2HB PHE 161 HB1 PHE 161 -2.470 1.131 -3.498
53 HD1 PHE 161 HD1 PHE 161 -2.697 -0.758 -2.075
54 HD2 PHE 161 HD2 PHE 161 -6.080 1.652 -3.003
55 HE1 PHE 161 HE1 PHE 161 -3.972 -1.863 -0.285
56 HE2 PHE 161 HE2 PHE 161 -7.361 0.551 -1.212
57 HZ PHE 161 HZ PHE 161 -6.306 -1.209 0.149
58 H PHE 162 HN PHE 162 -3.732 4.980 -5.008
59 HA PHE 162 HA PHE 162 -1.061 5.626 -4.254
60 1HB PHE 162 HB2 PHE 162 -0.877 3.936 -6.176
61 2HB PHE 162 HB1 PHE 162 -1.493 5.236 -7.193
62 HD1 PHE 162 HD1 PHE 162 -0.197 7.556 -6.796
63 HD2 PHE 162 HD2 PHE 162 1.403 3.673 -6.106
64 HE1 PHE 162 HE1 PHE 162 2.079 8.458 -7.023
65 HE2 PHE 162 HE2 PHE 162 3.683 4.568 -6.332
66 HZ PHE 162 HZ PHE 162 4.024 6.963 -6.790
67 H LEU 163 HN LEU 163 -3.342 6.220 -6.917
68 HA LEU 163 HA LEU 163 -2.864 9.014 -7.059
69 1HB LEU 163 HB2 LEU 163 -3.841 7.639 -8.890
70 2HB LEU 163 HB1 LEU 163 -5.295 7.446 -7.926
71 HG LEU 163 HG LEU 163 -5.699 9.864 -8.039
72 1HD1 LEU 163 HD11 LEU 163 -4.226 10.974 -9.942
73 2HD1 LEU 163 HD12 LEU 163 -3.035 9.822 -9.339
74 3HD1 LEU 163 HD13 LEU 163 -3.746 11.009 -8.246
75 1HD2 LEU 163 HD21 LEU 163 -5.234 8.626 -10.749
76 2HD2 LEU 163 HD22 LEU 163 -6.302 9.982 -10.391
77 3HD2 LEU 163 HD23 LEU 163 -6.659 8.382 -9.740
78 H PHE 164 HN PHE 164 -4.255 7.155 -4.752
79 HA PHE 164 HA PHE 164 -6.448 8.784 -3.935
80 1HB PHE 164 HB2 PHE 164 -6.533 6.434 -3.534
81 2HB PHE 164 HB1 PHE 164 -4.960 6.440 -2.745
82 HD1 PHE 164 HD1 PHE 164 -4.914 6.375 -0.443
83 HD2 PHE 164 HD2 PHE 164 -8.359 7.958 -2.376
84 HE1 PHE 164 HE1 PHE 164 -6.025 6.608 1.739
85 HE2 PHE 164 HE2 PHE 164 -9.477 8.196 -0.196
86 HZ PHE 164 HZ PHE 164 -8.310 7.520 1.865
87 H LEU 165 HN LEU 165 -4.188 10.404 -4.148
88 HA LEU 165 HA LEU 165 -3.347 12.183 -2.995
89 1HB LEU 165 HB2 LEU 165 -5.276 11.310 -1.253
90 2HB LEU 165 HB1 LEU 165 -3.820 11.231 -0.276
91 HG LEU 165 HG LEU 165 -3.400 13.652 -1.053
92 1HD1 LEU 165 HD11 LEU 165 -4.915 13.969 -2.795
93 2HD1 LEU 165 HD12 LEU 165 -5.653 14.818 -1.437
94 3HD1 LEU 165 HD13 LEU 165 -6.241 13.223 -1.906
95 1HD2 LEU 165 HD21 LEU 165 -4.244 12.763 1.215
96 2HD2 LEU 165 HD22 LEU 165 -5.819 13.354 0.689
97 3HD2 LEU 165 HD23 LEU 165 -4.465 14.473 0.843
98 H LEU 166 HN LEU 166 -2.745 8.980 -1.585
99 HA LEU 166 HA LEU 166 0.087 9.427 -1.777
100 1HB LEU 166 HB2 LEU 166 -1.186 10.208 0.574
101 2HB LEU 166 HB1 LEU 166 -0.483 8.647 0.960
102 HG LEU 166 HG LEU 166 1.322 10.532 -0.419
103 1HD1 LEU 166 HD11 LEU 166 1.794 11.729 1.718
104 2HD1 LEU 166 HD12 LEU 166 0.308 11.040 2.372
105 3HD1 LEU 166 HD13 LEU 166 0.240 12.132 0.988
106 1HD2 LEU 166 HD21 LEU 166 2.616 9.653 1.765
107 2HD2 LEU 166 HD22 LEU 166 2.521 8.742 0.258
108 3HD2 LEU 166 HD23 LEU 166 1.421 8.367 1.584
109 HA PRO 167 HA PRO 167 -0.399 4.999 -2.079
110 1HB PRO 167 HB2 PRO 167 2.010 4.427 -3.062
111 2HB PRO 167 HB1 PRO 167 0.817 5.323 -4.020
112 1HG PRO 167 HG2 PRO 167 3.238 6.315 -2.596
113 2HG PRO 167 HG1 PRO 167 2.521 6.871 -4.117
114 1HD PRO 167 HD2 PRO 167 2.191 8.048 -1.583
115 2HD PRO 167 HD1 PRO 167 1.243 8.402 -3.039
116 HA PRO 168 HA PRO 168 1.572 4.178 1.975
117 1HB PRO 168 HB2 PRO 168 -0.041 2.086 2.605
118 2HB PRO 168 HB1 PRO 168 -0.528 3.778 2.835
119 1HG PRO 168 HG2 PRO 168 -1.187 1.906 0.583
120 2HG PRO 168 HG1 PRO 168 -2.260 3.005 1.471
121 1HD PRO 168 HD2 PRO 168 -1.258 3.633 -0.948
122 2HD PRO 168 HD1 PRO 168 -1.524 4.862 0.305
123 H ILE 169 HN ILE 169 3.154 3.486 0.011
124 HA ILE 169 HA ILE 169 3.308 0.674 -0.489
125 HB ILE 169 HB ILE 169 5.598 1.270 -1.418
126 1HG1 ILE 169 HG12 ILE 169 4.594 4.096 -1.221
127 2HG1 ILE 169 HG11 ILE 169 5.642 3.404 0.011
128 1HG2 ILE 169 HG21 ILE 169 3.153 1.305 -2.530
129 2HG2 ILE 169 HG22 ILE 169 4.635 1.640 -3.424
130 3HG2 ILE 169 HG23 ILE 169 3.646 2.972 -2.827
131 1HD1 ILE 169 HD11 ILE 169 7.420 3.142 -1.513
132 2HD1 ILE 169 HD12 ILE 169 6.771 4.760 -1.783
133 3HD1 ILE 169 HD13 ILE 169 6.373 3.452 -2.898
134 H ILE 170 HN ILE 170 4.860 2.902 1.715
135 HA ILE 170 HA ILE 170 6.848 1.076 2.635
136 HB ILE 170 HB ILE 170 5.847 3.595 3.968
137 1HG1 ILE 170 HG12 ILE 170 8.418 3.550 2.496
138 2HG1 ILE 170 HG11 ILE 170 6.959 3.501 1.511
139 1HG2 ILE 170 HG21 ILE 170 8.189 3.549 4.946
140 2HG2 ILE 170 HG22 ILE 170 8.274 1.875 4.396
141 3HG2 ILE 170 HG23 ILE 170 7.050 2.356 5.570
142 1HD1 ILE 170 HD11 ILE 170 6.205 5.571 2.379
143 2HD1 ILE 170 HD12 ILE 170 7.900 5.777 1.939
144 3HD1 ILE 170 HD13 ILE 170 7.447 5.571 3.631
145 H LEU 171 HN LEU 171 3.811 2.304 4.053
146 HA LEU 171 HA LEU 171 3.974 0.716 6.389
147 1HB LEU 171 HB2 LEU 171 1.476 1.780 5.062
148 2HB LEU 171 HB1 LEU 171 1.628 1.261 6.728
149 HG LEU 171 HG LEU 171 1.717 3.533 6.994
150 1HD1 LEU 171 HD11 LEU 171 3.984 4.235 7.423
151 2HD1 LEU 171 HD12 LEU 171 4.611 2.939 6.405
152 3HD1 LEU 171 HD13 LEU 171 3.780 2.553 7.913
153 1HD2 LEU 171 HD21 LEU 171 3.535 4.206 4.776
154 2HD2 LEU 171 HD22 LEU 171 2.110 5.052 5.377
155 3HD2 LEU 171 HD23 LEU 171 1.925 3.654 4.318
156 H ASP 172 HN ASP 172 2.109 0.327 3.402
157 HA ASP 172 HA ASP 172 1.231 -2.309 4.056
158 1HB ASP 172 HB2 ASP 172 1.219 -1.030 1.319
159 2HB ASP 172 HB1 ASP 172 0.178 -2.332 1.912
160 H ALA 173 HN ALA 173 4.255 -1.295 3.333
161 HA ALA 173 HA ALA 173 5.027 -3.168 1.330
162 1HB ALA 173 HB1 ALA 173 7.258 -2.474 2.958
163 2HB ALA 173 HB2 ALA 173 6.262 -1.039 2.737
164 3HB ALA 173 HB3 ALA 173 6.863 -1.916 1.332
165 H GLY 174 HN GLY 174 6.020 -2.985 4.739
166 1HA GLY 174 HA2 GLY 174 6.033 -5.941 4.815
167 2HA GLY 174 HA1 GLY 174 7.086 -4.906 5.799
168 H TYR 175 HN TYR 175 4.486 -3.157 5.957
169 HA TYR 175 HA TYR 175 2.667 -2.901 7.288
170 1HB TYR 175 HB2 TYR 175 2.227 -5.356 6.678
171 2HB TYR 175 HB1 TYR 175 2.939 -5.748 8.239
172 HD1 TYR 175 HD1 TYR 175 1.169 -6.518 9.544
173 HD2 TYR 175 HD2 TYR 175 0.676 -2.942 7.292
174 HE1 TYR 175 HE1 TYR 175 -1.004 -6.141 10.631
175 HE2 TYR 175 HE2 TYR 175 -1.498 -2.554 8.374
176 HH TYR 175 HH TYR 175 -3.272 -3.977 9.504
177 H PHE 176 HN PHE 176 5.722 -3.891 8.358
178 HA PHE 176 HA PHE 176 5.118 -3.332 11.165
179 1HB PHE 176 HB2 PHE 176 6.445 -5.332 10.747
180 2HB PHE 176 HB1 PHE 176 7.631 -4.383 9.839
181 HD1 PHE 176 HD1 PHE 176 5.995 -4.298 13.203
182 HD2 PHE 176 HD2 PHE 176 9.574 -3.898 10.936
183 HE1 PHE 176 HE1 PHE 176 7.260 -3.904 15.276
184 HE2 PHE 176 HE2 PHE 176 10.846 -3.505 13.005
185 HZ PHE 176 HZ PHE 176 9.688 -3.509 15.179
186 H LEU 177 HN LEU 177 6.133 -1.749 8.397
187 HA LEU 177 HA LEU 177 8.142 -0.035 9.254
188 1HB LEU 177 HB2 LEU 177 5.991 0.181 7.194
189 2HB LEU 177 HB1 LEU 177 7.046 1.544 7.514
190 HG LEU 177 HG LEU 177 7.688 -0.006 5.604
191 1HD1 LEU 177 HD11 LEU 177 9.969 0.096 7.475
192 2HD1 LEU 177 HD12 LEU 177 9.156 1.621 7.120
193 3HD1 LEU 177 HD13 LEU 177 9.840 0.660 5.809
194 1HD2 LEU 177 HD21 LEU 177 7.261 -2.117 6.773
195 2HD2 LEU 177 HD22 LEU 177 8.574 -1.752 7.892
196 3HD2 LEU 177 HD23 LEU 177 8.921 -2.016 6.183
197 HA PRO 178 HA PRO 178 4.358 2.942 10.514
198 1HB PRO 178 HB2 PRO 178 2.758 0.757 11.758
199 2HB PRO 178 HB1 PRO 178 2.212 2.212 10.915
200 1HG PRO 178 HG2 PRO 178 2.093 -0.164 9.727
201 2HG PRO 178 HG1 PRO 178 2.559 1.285 8.816
202 1HD PRO 178 HD2 PRO 178 4.266 -0.933 9.858
203 2HD PRO 178 HD1 PRO 178 4.405 -0.017 8.345
204 H LEU 179 HN LEU 179 3.078 2.464 13.067
205 HA LEU 179 HA LEU 179 3.487 2.428 15.302
206 1HB LEU 179 HB2 LEU 179 5.913 0.884 14.413
207 2HB LEU 179 HB1 LEU 179 5.652 1.310 16.090
208 HG LEU 179 HG LEU 179 4.914 -0.949 15.728
209 1HD1 LEU 179 HD11 LEU 179 3.503 0.882 17.036
210 2HD1 LEU 179 HD12 LEU 179 2.969 -0.793 16.888
211 3HD1 LEU 179 HD13 LEU 179 2.301 0.444 15.822
212 1HD2 LEU 179 HD21 LEU 179 2.891 0.036 13.739
213 2HD2 LEU 179 HD22 LEU 179 3.376 -1.623 14.092
214 3HD2 LEU 179 HD23 LEU 179 4.483 -0.542 13.245
215 H ARG 180 HN ARG 180 3.642 4.755 14.647
216 HA ARG 180 HA ARG 180 4.530 6.811 15.068
217 1HB ARG 180 HB2 ARG 180 6.863 5.434 16.398
218 2HB ARG 180 HB1 ARG 180 6.245 7.061 16.698
219 1HG ARG 180 HG2 ARG 180 4.362 4.834 17.172
220 2HG ARG 180 HG1 ARG 180 5.731 4.962 18.279
221 1HD ARG 180 HD2 ARG 180 5.068 7.028 19.069
222 2HD ARG 180 HD1 ARG 180 4.128 7.394 17.623
223 HE ARG 180 HE ARG 180 2.784 5.317 18.674
224 1HH1 ARG 180 1HH1 ARG 180 3.935 8.307 20.062
225 2HH1 ARG 180 2HH1 ARG 180 2.665 8.394 21.235
226 1HH2 ARG 180 1HH2 ARG 180 1.114 5.433 20.214
227 2HH2 ARG 180 2HH2 ARG 180 1.063 6.764 21.322
228 1HG HSL 181 HG1 HSL 181 7.866 6.175 8.946
229 2HG HSL 181 HG2 HSL 181 6.226 5.577 8.361
230 H HSL 181 HN HSL 181 4.808 6.002 12.596
231 HA HSL 181 HA HSL 181 7.696 6.674 11.818
232 1HB HSL 181 HB1 HSL 181 7.477 4.596 10.705
233 2HB HSL 181 HB2 HSL 181 5.646 4.759 10.561
Start of MODEL 15
1 1H PHE 155 HT1 PHE 155 11.750 17.025 6.566
2 2H PHE 155 HT2 PHE 155 11.502 16.837 8.254
3 3H PHE 155 HT3 PHE 155 11.032 18.290 7.472
4 HA PHE 155 HA PHE 155 9.095 17.120 7.811
5 1HB PHE 155 HB2 PHE 155 9.951 16.450 4.993
6 2HB PHE 155 HB1 PHE 155 8.329 16.826 5.562
7 HD1 PHE 155 HD1 PHE 155 8.651 19.225 7.113
8 HD2 PHE 155 HD2 PHE 155 10.584 18.076 3.500
9 HE1 PHE 155 HE1 PHE 155 9.001 21.595 6.551
10 HE2 PHE 155 HE2 PHE 155 10.939 20.444 2.932
11 HZ PHE 155 HZ PHE 155 10.147 22.207 4.459
12 H LEU 156 HN LEU 156 7.862 15.191 7.775
13 HA LEU 156 HA LEU 156 9.361 12.859 8.432
14 1HB LEU 156 HB2 LEU 156 6.463 13.563 8.313
15 2HB LEU 156 HB1 LEU 156 6.923 11.874 8.411
16 HG LEU 156 HG LEU 156 7.793 13.965 10.403
17 1HD1 LEU 156 HD11 LEU 156 5.326 12.361 10.187
18 2HD1 LEU 156 HD12 LEU 156 5.609 13.913 10.975
19 3HD1 LEU 156 HD13 LEU 156 6.090 12.417 11.775
20 1HD2 LEU 156 HD21 LEU 156 8.287 11.078 10.032
21 2HD2 LEU 156 HD22 LEU 156 7.946 11.612 11.679
22 3HD2 LEU 156 HD23 LEU 156 9.293 12.317 10.784
23 H GLN 157 HN GLN 157 10.341 13.076 6.096
24 HA GLN 157 HA GLN 157 10.761 11.831 4.222
25 1HB GLN 157 HB2 GLN 157 9.436 10.019 5.546
26 2HB GLN 157 HB1 GLN 157 8.119 10.426 4.456
27 1HG GLN 157 HG2 GLN 157 9.771 9.994 2.567
28 2HG GLN 157 HG1 GLN 157 10.795 9.250 3.795
29 1HE2 GLN 157 HE21 GLN 157 7.325 9.215 3.031
30 2HE2 GLN 157 HE22 GLN 157 7.169 7.494 3.035
31 H SER 158 HN SER 158 10.449 13.931 3.241
32 HA SER 158 HA SER 158 9.577 15.395 1.739
33 1HB SER 158 HB2 SER 158 8.085 14.025 -0.052
34 2HB SER 158 HB1 SER 158 9.856 14.019 -0.055
35 HG SER 158 HG SER 158 9.414 11.919 -0.021
36 H ASP 159 HN ASP 159 8.246 15.815 3.865
37 HA ASP 159 HA ASP 159 6.329 16.741 4.663
38 1HB ASP 159 HB2 ASP 159 5.970 16.811 1.849
39 2HB ASP 159 HB1 ASP 159 4.450 16.260 2.548
40 H VAL 160 HN VAL 160 5.409 13.992 2.583
41 HA VAL 160 HA VAL 160 4.448 11.988 3.088
42 HB VAL 160 HB VAL 160 5.659 12.706 5.545
43 1HG1 VAL 160 HG11 VAL 160 3.502 13.115 6.543
44 2HG1 VAL 160 HG12 VAL 160 4.163 11.609 7.177
45 3HG1 VAL 160 HG13 VAL 160 2.896 11.567 5.951
46 1HG2 VAL 160 HG21 VAL 160 4.547 10.070 4.599
47 2HG2 VAL 160 HG22 VAL 160 5.731 10.287 5.888
48 3HG2 VAL 160 HG23 VAL 160 6.144 10.720 4.229
49 H PHE 161 HN PHE 161 3.196 14.573 5.181
50 HA PHE 161 HA PHE 161 0.528 13.590 5.155
51 1HB PHE 161 HB2 PHE 161 1.448 14.941 7.006
52 2HB PHE 161 HB1 PHE 161 1.543 16.329 5.927
53 HD1 PHE 161 HD1 PHE 161 -0.864 13.892 7.365
54 HD2 PHE 161 HD2 PHE 161 -0.261 17.770 5.719
55 HE1 PHE 161 HE1 PHE 161 -3.176 14.495 7.950
56 HE2 PHE 161 HE2 PHE 161 -2.572 18.381 6.302
57 HZ PHE 161 HZ PHE 161 -4.032 16.743 7.420
58 H PHE 162 HN PHE 162 2.085 14.651 2.573
59 HA PHE 162 HA PHE 162 -0.292 15.412 1.227
60 1HB PHE 162 HB2 PHE 162 1.588 17.541 2.108
61 2HB PHE 162 HB1 PHE 162 0.879 17.675 0.496
62 HD1 PHE 162 HD1 PHE 162 -1.811 16.654 0.880
63 HD2 PHE 162 HD2 PHE 162 0.544 19.131 3.415
64 HE1 PHE 162 HE1 PHE 162 -3.862 17.602 1.852
65 HE2 PHE 162 HE2 PHE 162 -1.503 20.083 4.393
66 HZ PHE 162 HZ PHE 162 -3.710 19.319 3.611
67 H LEU 163 HN LEU 163 2.629 13.994 1.181
68 HA LEU 163 HA LEU 163 3.649 14.778 -1.345
69 1HB LEU 163 HB2 LEU 163 4.538 13.189 0.711
70 2HB LEU 163 HB1 LEU 163 4.122 11.998 -0.505
71 HG LEU 163 HG LEU 163 6.191 14.162 -0.638
72 1HD1 LEU 163 HD11 LEU 163 7.680 12.370 -1.122
73 2HD1 LEU 163 HD12 LEU 163 6.344 11.236 -1.323
74 3HD1 LEU 163 HD13 LEU 163 6.713 11.892 0.273
75 1HD2 LEU 163 HD21 LEU 163 5.583 14.532 -2.763
76 2HD2 LEU 163 HD22 LEU 163 4.580 13.084 -2.830
77 3HD2 LEU 163 HD23 LEU 163 6.321 12.961 -3.081
78 H PHE 164 HN PHE 164 1.584 12.201 -0.157
79 HA PHE 164 HA PHE 164 0.104 10.803 -1.169
80 1HB PHE 164 HB2 PHE 164 -0.381 13.368 -2.097
81 2HB PHE 164 HB1 PHE 164 -0.333 12.402 -3.572
82 HD1 PHE 164 HD1 PHE 164 -2.523 12.145 -4.268
83 HD2 PHE 164 HD2 PHE 164 -1.569 11.568 -0.160
84 HE1 PHE 164 HE1 PHE 164 -4.827 11.392 -3.842
85 HE2 PHE 164 HE2 PHE 164 -3.870 10.813 0.273
86 HZ PHE 164 HZ PHE 164 -5.502 10.724 -1.570
87 H LEU 165 HN LEU 165 3.088 11.159 -2.271
88 HA LEU 165 HA LEU 165 2.963 10.077 -4.896
89 1HB LEU 165 HB2 LEU 165 4.934 11.178 -3.310
90 2HB LEU 165 HB1 LEU 165 5.407 9.494 -3.420
91 HG LEU 165 HG LEU 165 4.671 10.815 -5.965
92 1HD1 LEU 165 HD11 LEU 165 7.173 11.495 -4.434
93 2HD1 LEU 165 HD12 LEU 165 5.928 12.606 -5.003
94 3HD1 LEU 165 HD13 LEU 165 6.961 11.771 -6.163
95 1HD2 LEU 165 HD21 LEU 165 6.436 9.439 -6.828
96 2HD2 LEU 165 HD22 LEU 165 5.423 8.457 -5.770
97 3HD2 LEU 165 HD23 LEU 165 6.985 9.044 -5.200
98 H LEU 166 HN LEU 166 3.487 8.702 -1.681
99 HA LEU 166 HA LEU 166 2.457 6.158 -2.543
100 1HB LEU 166 HB2 LEU 166 5.213 6.612 -2.830
101 2HB LEU 166 HB1 LEU 166 5.052 5.601 -1.407
102 HG LEU 166 HG LEU 166 5.365 4.117 -3.210
103 1HD1 LEU 166 HD11 LEU 166 3.651 2.715 -2.816
104 2HD1 LEU 166 HD12 LEU 166 2.432 3.913 -3.251
105 3HD1 LEU 166 HD13 LEU 166 3.170 3.948 -1.650
106 1HD2 LEU 166 HD21 LEU 166 4.507 4.311 -5.328
107 2HD2 LEU 166 HD22 LEU 166 4.646 6.008 -4.870
108 3HD2 LEU 166 HD23 LEU 166 3.082 5.199 -4.789
109 HA PRO 167 HA PRO 167 2.108 7.832 2.001
110 1HB PRO 167 HB2 PRO 167 -0.574 6.777 1.706
111 2HB PRO 167 HB1 PRO 167 -0.061 8.430 2.083
112 1HG PRO 167 HG2 PRO 167 -0.886 7.283 -0.479
113 2HG PRO 167 HG1 PRO 167 -0.721 8.982 -0.011
114 1HD PRO 167 HD2 PRO 167 0.949 7.748 -1.769
115 2HD PRO 167 HD1 PRO 167 1.457 9.095 -0.730
116 HA PRO 168 HA PRO 168 1.094 3.332 2.998
117 1HB PRO 168 HB2 PRO 168 -0.092 1.702 1.294
118 2HB PRO 168 HB1 PRO 168 -0.993 3.058 2.005
119 1HG PRO 168 HG2 PRO 168 0.239 2.823 -0.716
120 2HG PRO 168 HG1 PRO 168 -1.336 3.495 -0.254
121 1HD PRO 168 HD2 PRO 168 0.986 4.974 -0.698
122 2HD PRO 168 HD1 PRO 168 -0.444 5.538 0.185
123 H ILE 169 HN ILE 169 3.546 4.116 1.694
124 HA ILE 169 HA ILE 169 4.457 1.897 0.096
125 HB ILE 169 HB ILE 169 5.342 4.504 0.469
126 1HG1 ILE 169 HG12 ILE 169 5.501 3.094 -1.560
127 2HG1 ILE 169 HG11 ILE 169 6.996 3.957 -1.211
128 1HG2 ILE 169 HG21 ILE 169 7.692 4.312 1.166
129 2HG2 ILE 169 HG22 ILE 169 7.408 2.634 1.628
130 3HG2 ILE 169 HG23 ILE 169 6.577 3.936 2.481
131 1HD1 ILE 169 HD11 ILE 169 6.393 1.045 -0.965
132 2HD1 ILE 169 HD12 ILE 169 7.699 1.773 -0.029
133 3HD1 ILE 169 HD13 ILE 169 7.727 1.849 -1.792
134 H ILE 170 HN ILE 170 5.095 3.113 3.320
135 HA ILE 170 HA ILE 170 6.748 0.948 4.114
136 HB ILE 170 HB ILE 170 6.718 2.003 6.304
137 1HG1 ILE 170 HG12 ILE 170 4.461 3.459 5.061
138 2HG1 ILE 170 HG11 ILE 170 4.648 2.896 6.712
139 1HG2 ILE 170 HG21 ILE 170 8.155 3.650 5.691
140 2HG2 ILE 170 HG22 ILE 170 7.058 4.301 4.473
141 3HG2 ILE 170 HG23 ILE 170 7.993 2.845 4.130
142 1HD1 ILE 170 HD11 ILE 170 5.410 5.464 5.476
143 2HD1 ILE 170 HD12 ILE 170 6.499 4.819 6.706
144 3HD1 ILE 170 HD13 ILE 170 4.806 5.115 7.096
145 H LEU 171 HN LEU 171 3.422 1.936 4.804
146 HA LEU 171 HA LEU 171 2.861 -0.108 6.666
147 1HB LEU 171 HB2 LEU 171 1.423 1.823 6.515
148 2HB LEU 171 HB1 LEU 171 1.056 1.476 4.837
149 HG LEU 171 HG LEU 171 -0.092 -0.612 5.572
150 1HD1 LEU 171 HD11 LEU 171 -0.282 0.387 8.341
151 2HD1 LEU 171 HD12 LEU 171 1.252 -0.354 7.883
152 3HD1 LEU 171 HD13 LEU 171 -0.250 -1.266 7.726
153 1HD2 LEU 171 HD21 LEU 171 -1.160 1.908 6.835
154 2HD2 LEU 171 HD22 LEU 171 -2.091 0.493 6.341
155 3HD2 LEU 171 HD23 LEU 171 -1.299 1.496 5.125
156 H ASP 172 HN ASP 172 2.052 0.171 3.212
157 HA ASP 172 HA ASP 172 1.243 -2.568 3.036
158 1HB ASP 172 HB2 ASP 172 0.482 -0.594 1.552
159 2HB ASP 172 HB1 ASP 172 1.998 -0.848 0.676
160 H ALA 173 HN ALA 173 4.242 -1.172 3.356
161 HA ALA 173 HA ALA 173 5.736 -2.746 1.512
162 1HB ALA 173 HB1 ALA 173 7.169 -1.123 2.054
163 2HB ALA 173 HB2 ALA 173 7.505 -2.063 3.508
164 3HB ALA 173 HB3 ALA 173 6.314 -0.766 3.552
165 H GLY 174 HN GLY 174 5.776 -2.744 5.053
166 1HA GLY 174 HA2 GLY 174 5.808 -5.695 5.022
167 2HA GLY 174 HA1 GLY 174 6.948 -4.778 6.025
168 H TYR 175 HN TYR 175 4.108 -3.070 5.902
169 HA TYR 175 HA TYR 175 2.341 -2.746 7.276
170 1HB TYR 175 HB2 TYR 175 1.749 -5.069 6.861
171 2HB TYR 175 HB1 TYR 175 2.838 -5.595 8.143
172 HD1 TYR 175 HD1 TYR 175 -0.479 -4.583 7.346
173 HD2 TYR 175 HD2 TYR 175 2.348 -4.731 10.521
174 HE1 TYR 175 HE1 TYR 175 -2.306 -4.370 8.976
175 HE2 TYR 175 HE2 TYR 175 0.529 -4.519 12.160
176 HH TYR 175 HH TYR 175 -1.852 -3.560 12.153
177 H PHE 176 HN PHE 176 5.054 -4.383 8.893
178 HA PHE 176 HA PHE 176 4.524 -2.803 11.293
179 1HB PHE 176 HB2 PHE 176 6.382 -4.260 12.252
180 2HB PHE 176 HB1 PHE 176 4.878 -5.079 11.813
181 HD1 PHE 176 HD1 PHE 176 8.136 -4.154 10.229
182 HD2 PHE 176 HD2 PHE 176 5.068 -7.065 10.700
183 HE1 PHE 176 HE1 PHE 176 9.399 -5.710 8.804
184 HE2 PHE 176 HE2 PHE 176 6.327 -8.627 9.276
185 HZ PHE 176 HZ PHE 176 8.496 -7.951 8.326
186 H LEU 177 HN LEU 177 5.959 -2.103 8.554
187 HA LEU 177 HA LEU 177 8.536 -1.199 9.503
188 1HB LEU 177 HB2 LEU 177 7.149 -0.792 6.856
189 2HB LEU 177 HB1 LEU 177 8.800 -0.319 7.211
190 HG LEU 177 HG LEU 177 7.708 -3.129 7.095
191 1HD1 LEU 177 HD11 LEU 177 10.030 -2.410 5.484
192 2HD1 LEU 177 HD12 LEU 177 8.575 -1.506 5.066
193 3HD1 LEU 177 HD13 LEU 177 8.557 -3.268 5.036
194 1HD2 LEU 177 HD21 LEU 177 10.100 -3.781 7.475
195 2HD2 LEU 177 HD22 LEU 177 9.281 -3.100 8.880
196 3HD2 LEU 177 HD23 LEU 177 10.410 -2.111 7.953
197 HA PRO 178 HA PRO 178 5.836 2.960 8.660
198 1HB PRO 178 HB2 PRO 178 3.775 1.954 10.580
199 2HB PRO 178 HB1 PRO 178 3.597 3.075 9.223
200 1HG PRO 178 HG2 PRO 178 2.813 0.564 8.962
201 2HG PRO 178 HG1 PRO 178 3.679 1.369 7.638
202 1HD PRO 178 HD2 PRO 178 4.664 -0.655 9.597
203 2HD PRO 178 HD1 PRO 178 5.070 -0.456 7.880
204 H LEU 179 HN LEU 179 6.779 1.060 11.375
205 HA LEU 179 HA LEU 179 6.484 2.674 13.555
206 1HB LEU 179 HB2 LEU 179 8.980 1.141 12.829
207 2HB LEU 179 HB1 LEU 179 8.540 1.684 14.437
208 HG LEU 179 HG LEU 179 6.840 -0.243 12.865
209 1HD1 LEU 179 HD11 LEU 179 7.982 -1.821 14.685
210 2HD1 LEU 179 HD12 LEU 179 9.315 -0.697 14.420
211 3HD1 LEU 179 HD13 LEU 179 8.644 -1.601 13.064
212 1HD2 LEU 179 HD21 LEU 179 6.115 1.173 14.980
213 2HD2 LEU 179 HD22 LEU 179 6.967 -0.117 15.829
214 3HD2 LEU 179 HD23 LEU 179 5.612 -0.504 14.768
215 H ARG 180 HN ARG 180 8.774 3.016 10.930
216 HA ARG 180 HA ARG 180 10.047 5.309 12.193
217 1HB ARG 180 HB2 ARG 180 10.594 3.651 9.761
218 2HB ARG 180 HB1 ARG 180 11.321 5.257 9.905
219 1HG ARG 180 HG2 ARG 180 12.817 4.562 11.409
220 2HG ARG 180 HG1 ARG 180 11.622 3.620 12.301
221 1HD ARG 180 HD2 ARG 180 12.633 2.665 9.652
222 2HD ARG 180 HD1 ARG 180 13.583 2.404 11.114
223 HE ARG 180 HE ARG 180 10.851 1.557 11.365
224 1HH1 ARG 180 1HH1 ARG 180 14.038 0.630 10.285
225 2HH1 ARG 180 2HH1 ARG 180 13.736 -1.068 10.446
226 1HH2 ARG 180 1HH2 ARG 180 10.450 -0.678 11.573
227 2HH2 ARG 180 2HH2 ARG 180 11.699 -1.810 11.176
228 1HG HSL 181 HG1 HSL 181 3.460 6.880 10.113
229 2HG HSL 181 HG2 HSL 181 4.366 5.727 11.227
230 H HSL 181 HN HSL 181 7.231 5.428 11.489
231 HA HSL 181 HA HSL 181 7.298 7.670 9.397
232 1HB HSL 181 HB1 HSL 181 5.233 7.029 8.542
233 2HB HSL 181 HB2 HSL 181 5.667 5.370 9.224
Start of MODEL 16
1 1H PHE 155 HT1 PHE 155 -2.684 10.950 -9.652
2 2H PHE 155 HT2 PHE 155 -3.415 10.448 -11.122
3 3H PHE 155 HT3 PHE 155 -1.707 10.573 -11.009
4 HA PHE 155 HA PHE 155 -3.484 8.645 -9.685
5 1HB PHE 155 HB2 PHE 155 -1.090 8.176 -11.462
6 2HB PHE 155 HB1 PHE 155 -2.349 7.031 -11.012
7 HD1 PHE 155 HD1 PHE 155 -1.708 10.119 -12.954
8 HD2 PHE 155 HD2 PHE 155 -4.265 6.774 -12.328
9 HE1 PHE 155 HE1 PHE 155 -2.951 10.690 -15.000
10 HE2 PHE 155 HE2 PHE 155 -5.510 7.339 -14.372
11 HZ PHE 155 HZ PHE 155 -4.854 9.299 -15.712
12 H LEU 156 HN LEU 156 0.002 9.210 -10.188
13 HA LEU 156 HA LEU 156 0.549 9.338 -7.398
14 1HB LEU 156 HB2 LEU 156 1.796 7.283 -7.179
15 2HB LEU 156 HB1 LEU 156 0.147 6.932 -7.662
16 HG LEU 156 HG LEU 156 1.212 6.934 -10.083
17 1HD1 LEU 156 HD11 LEU 156 3.521 6.636 -8.226
18 2HD1 LEU 156 HD12 LEU 156 3.427 7.442 -9.792
19 3HD1 LEU 156 HD13 LEU 156 3.490 5.683 -9.709
20 1HD2 LEU 156 HD21 LEU 156 1.707 4.456 -9.700
21 2HD2 LEU 156 HD22 LEU 156 0.079 5.029 -9.335
22 3HD2 LEU 156 HD23 LEU 156 1.229 4.747 -8.028
23 H GLN 157 HN GLN 157 1.151 10.618 -10.096
24 HA GLN 157 HA GLN 157 3.967 10.310 -10.476
25 1HB GLN 157 HB2 GLN 157 2.545 10.937 -12.348
26 2HB GLN 157 HB1 GLN 157 2.039 12.397 -11.507
27 1HG GLN 157 HG2 GLN 157 3.718 12.801 -13.268
28 2HG GLN 157 HG1 GLN 157 4.236 13.330 -11.669
29 1HE2 GLN 157 HE21 GLN 157 6.406 13.241 -12.182
30 2HE2 GLN 157 HE22 GLN 157 7.251 11.751 -12.402
31 H SER 158 HN SER 158 2.065 12.046 -8.264
32 HA SER 158 HA SER 158 3.835 14.256 -7.904
33 1HB SER 158 HB2 SER 158 2.482 14.405 -5.662
34 2HB SER 158 HB1 SER 158 1.681 14.766 -7.200
35 HG SER 158 HG SER 158 0.358 13.223 -6.715
36 H ASP 159 HN ASP 159 5.617 12.417 -7.889
37 HA ASP 159 HA ASP 159 7.410 11.621 -6.752
38 1HB ASP 159 HB2 ASP 159 6.303 13.578 -4.978
39 2HB ASP 159 HB1 ASP 159 6.840 12.197 -4.028
40 H VAL 160 HN VAL 160 4.620 11.308 -4.576
41 HA VAL 160 HA VAL 160 3.484 9.450 -3.863
42 HB VAL 160 HB VAL 160 4.690 8.410 -6.105
43 1HG1 VAL 160 HG11 VAL 160 5.432 6.600 -3.810
44 2HG1 VAL 160 HG12 VAL 160 6.570 7.526 -4.786
45 3HG1 VAL 160 HG13 VAL 160 5.614 6.244 -5.526
46 1HG2 VAL 160 HG21 VAL 160 2.963 6.930 -4.129
47 2HG2 VAL 160 HG22 VAL 160 3.149 6.555 -5.842
48 3HG2 VAL 160 HG23 VAL 160 2.385 8.067 -5.347
49 H PHE 161 HN PHE 161 7.006 9.176 -3.781
50 HA PHE 161 HA PHE 161 7.071 7.758 -1.301
51 1HB PHE 161 HB2 PHE 161 9.169 9.038 -3.037
52 2HB PHE 161 HB1 PHE 161 9.567 8.367 -1.460
53 HD1 PHE 161 HD1 PHE 161 9.207 5.933 -1.041
54 HD2 PHE 161 HD2 PHE 161 8.855 7.656 -4.917
55 HE1 PHE 161 HE1 PHE 161 9.434 3.700 -2.051
56 HE2 PHE 161 HE2 PHE 161 9.078 5.426 -5.933
57 HZ PHE 161 HZ PHE 161 9.369 3.445 -4.499
58 H PHE 162 HN PHE 162 6.109 10.780 -1.814
59 HA PHE 162 HA PHE 162 6.629 11.611 0.860
60 1HB PHE 162 HB2 PHE 162 8.253 12.720 -1.372
61 2HB PHE 162 HB1 PHE 162 7.665 13.854 -0.151
62 HD1 PHE 162 HD1 PHE 162 10.491 12.360 -1.015
63 HD2 PHE 162 HD2 PHE 162 7.850 12.417 2.321
64 HE1 PHE 162 HE1 PHE 162 12.353 11.725 0.464
65 HE2 PHE 162 HE2 PHE 162 9.707 11.783 3.807
66 HZ PHE 162 HZ PHE 162 11.962 11.437 2.878
67 H LEU 163 HN LEU 163 4.576 11.365 -1.519
68 HA LEU 163 HA LEU 163 3.489 13.970 -1.818
69 1HB LEU 163 HB2 LEU 163 2.990 12.160 -3.398
70 2HB LEU 163 HB1 LEU 163 2.195 11.254 -2.126
71 HG LEU 163 HG LEU 163 0.496 13.054 -1.950
72 1HD1 LEU 163 HD11 LEU 163 0.753 14.346 -4.409
73 2HD1 LEU 163 HD12 LEU 163 2.358 14.407 -3.680
74 3HD1 LEU 163 HD13 LEU 163 0.968 15.047 -2.805
75 1HD2 LEU 163 HD21 LEU 163 0.904 11.663 -4.584
76 2HD2 LEU 163 HD22 LEU 163 -0.556 12.576 -4.205
77 3HD2 LEU 163 HD23 LEU 163 -0.117 11.171 -3.233
78 H PHE 164 HN PHE 164 3.084 11.306 0.390
79 HA PHE 164 HA PHE 164 2.184 11.158 2.468
80 1HB PHE 164 HB2 PHE 164 3.376 13.335 2.788
81 2HB PHE 164 HB1 PHE 164 1.879 14.161 2.362
82 HD1 PHE 164 HD1 PHE 164 2.831 11.334 4.614
83 HD2 PHE 164 HD2 PHE 164 0.767 15.029 4.162
84 HE1 PHE 164 HE1 PHE 164 2.097 11.207 6.959
85 HE2 PHE 164 HE2 PHE 164 0.030 14.909 6.507
86 HZ PHE 164 HZ PHE 164 0.696 12.996 7.908
87 H LEU 165 HN LEU 165 0.439 12.010 -0.176
88 HA LEU 165 HA LEU 165 -2.050 12.767 0.949
89 1HB LEU 165 HB2 LEU 165 -1.056 11.922 -1.671
90 2HB LEU 165 HB1 LEU 165 -2.702 11.407 -1.350
91 HG LEU 165 HG LEU 165 -3.283 13.784 -0.839
92 1HD1 LEU 165 HD11 LEU 165 -0.612 14.186 -0.624
93 2HD1 LEU 165 HD12 LEU 165 -1.799 15.466 -0.884
94 3HD1 LEU 165 HD13 LEU 165 -0.917 14.788 -2.252
95 1HD2 LEU 165 HD21 LEU 165 -3.467 12.589 -3.121
96 2HD2 LEU 165 HD22 LEU 165 -2.120 13.624 -3.592
97 3HD2 LEU 165 HD23 LEU 165 -3.640 14.343 -3.062
98 H LEU 166 HN LEU 166 -1.110 9.669 -0.515
99 HA LEU 166 HA LEU 166 -2.086 8.136 1.665
100 1HB LEU 166 HB2 LEU 166 -3.980 8.948 -0.267
101 2HB LEU 166 HB1 LEU 166 -3.650 7.255 -0.589
102 HG LEU 166 HG LEU 166 -4.626 8.427 2.014
103 1HD1 LEU 166 HD11 LEU 166 -6.252 8.165 0.099
104 2HD1 LEU 166 HD12 LEU 166 -6.663 7.314 1.588
105 3HD1 LEU 166 HD13 LEU 166 -5.980 6.427 0.226
106 1HD2 LEU 166 HD21 LEU 166 -3.439 6.700 2.867
107 2HD2 LEU 166 HD22 LEU 166 -3.422 5.813 1.342
108 3HD2 LEU 166 HD23 LEU 166 -4.861 5.787 2.362
109 HA PRO 167 HA PRO 167 0.734 6.014 -1.323
110 1HB PRO 167 HB2 PRO 167 3.144 6.685 -0.487
111 2HB PRO 167 HB1 PRO 167 2.180 7.788 -1.488
112 1HG PRO 167 HG2 PRO 167 2.829 7.945 1.399
113 2HG PRO 167 HG1 PRO 167 2.430 9.245 0.266
114 1HD PRO 167 HD2 PRO 167 0.686 7.921 2.135
115 2HD PRO 167 HD1 PRO 167 0.289 9.228 1.004
116 HA PRO 168 HA PRO 168 0.812 3.218 2.458
117 1HB PRO 168 HB2 PRO 168 -0.328 1.142 1.123
118 2HB PRO 168 HB1 PRO 168 -1.283 2.434 1.884
119 1HG PRO 168 HG2 PRO 168 -0.346 2.242 -0.981
120 2HG PRO 168 HG1 PRO 168 -2.003 2.493 -0.385
121 1HD PRO 168 HD2 PRO 168 -0.581 4.560 -1.161
122 2HD PRO 168 HD1 PRO 168 -1.497 4.669 0.361
123 H ILE 169 HN ILE 169 3.117 3.780 0.823
124 HA ILE 169 HA ILE 169 3.982 1.340 -0.404
125 HB ILE 169 HB ILE 169 4.726 3.897 -0.785
126 1HG1 ILE 169 HG12 ILE 169 6.783 1.766 -1.245
127 2HG1 ILE 169 HG11 ILE 169 5.219 1.667 -2.049
128 1HG2 ILE 169 HG21 ILE 169 5.872 4.069 1.377
129 2HG2 ILE 169 HG22 ILE 169 6.979 4.285 0.022
130 3HG2 ILE 169 HG23 ILE 169 6.949 2.757 0.901
131 1HD1 ILE 169 HD11 ILE 169 6.888 4.144 -2.210
132 2HD1 ILE 169 HD12 ILE 169 5.600 3.598 -3.285
133 3HD1 ILE 169 HD13 ILE 169 7.162 2.776 -3.287
134 H ILE 170 HN ILE 170 4.746 3.067 2.574
135 HA ILE 170 HA ILE 170 6.552 1.070 3.550
136 HB ILE 170 HB ILE 170 5.249 3.294 5.118
137 1HG1 ILE 170 HG12 ILE 170 7.850 4.068 4.526
138 2HG1 ILE 170 HG11 ILE 170 7.270 3.378 3.013
139 1HG2 ILE 170 HG21 ILE 170 6.258 2.159 6.774
140 2HG2 ILE 170 HG22 ILE 170 7.717 2.941 6.167
141 3HG2 ILE 170 HG23 ILE 170 7.329 1.294 5.671
142 1HD1 ILE 170 HD11 ILE 170 6.865 5.751 3.060
143 2HD1 ILE 170 HD12 ILE 170 5.979 5.600 4.577
144 3HD1 ILE 170 HD13 ILE 170 5.330 4.884 3.102
145 H LEU 171 HN LEU 171 3.198 2.002 4.121
146 HA LEU 171 HA LEU 171 2.695 0.268 6.293
147 1HB LEU 171 HB2 LEU 171 0.786 1.304 4.185
148 2HB LEU 171 HB1 LEU 171 0.311 0.553 5.694
149 HG LEU 171 HG LEU 171 0.085 2.678 6.393
150 1HD1 LEU 171 HD11 LEU 171 3.082 2.798 6.487
151 2HD1 LEU 171 HD12 LEU 171 2.144 1.749 7.549
152 3HD1 LEU 171 HD13 LEU 171 1.914 3.496 7.609
153 1HD2 LEU 171 HD21 LEU 171 0.279 3.733 4.291
154 2HD2 LEU 171 HD22 LEU 171 2.016 3.441 4.219
155 3HD2 LEU 171 HD23 LEU 171 1.365 4.597 5.379
156 H ASP 172 HN ASP 172 1.834 -0.021 2.872
157 HA ASP 172 HA ASP 172 1.190 -2.795 3.069
158 1HB ASP 172 HB2 ASP 172 0.561 -0.826 1.284
159 2HB ASP 172 HB1 ASP 172 1.793 -1.723 0.387
160 H ALA 173 HN ALA 173 4.117 -1.231 3.133
161 HA ALA 173 HA ALA 173 5.649 -2.908 1.417
162 1HB ALA 173 HB1 ALA 173 6.989 -1.152 1.774
163 2HB ALA 173 HB2 ALA 173 7.438 -1.968 3.272
164 3HB ALA 173 HB3 ALA 173 6.179 -0.736 3.282
165 H GLY 174 HN GLY 174 5.931 -2.556 4.922
166 1HA GLY 174 HA2 GLY 174 6.137 -5.498 5.150
167 2HA GLY 174 HA1 GLY 174 7.124 -4.382 6.114
168 H TYR 175 HN TYR 175 4.367 -2.768 5.975
169 HA TYR 175 HA TYR 175 2.561 -2.434 7.290
170 1HB TYR 175 HB2 TYR 175 1.858 -4.703 6.707
171 2HB TYR 175 HB1 TYR 175 2.865 -5.363 7.990
172 HD1 TYR 175 HD1 TYR 175 1.439 -6.292 9.567
173 HD2 TYR 175 HD2 TYR 175 0.528 -2.455 7.972
174 HE1 TYR 175 HE1 TYR 175 -0.430 -6.084 11.151
175 HE2 TYR 175 HE2 TYR 175 -1.344 -2.236 9.553
176 HH TYR 175 HH TYR 175 -1.704 -3.975 12.229
177 H PHE 176 HN PHE 176 5.037 -4.414 8.921
178 HA PHE 176 HA PHE 176 4.530 -2.988 11.412
179 1HB PHE 176 HB2 PHE 176 5.945 -5.500 10.650
180 2HB PHE 176 HB1 PHE 176 6.490 -4.652 12.104
181 HD1 PHE 176 HD1 PHE 176 4.834 -7.382 11.380
182 HD2 PHE 176 HD2 PHE 176 4.001 -3.637 13.221
183 HE1 PHE 176 HE1 PHE 176 3.008 -8.422 12.658
184 HE2 PHE 176 HE2 PHE 176 2.173 -4.671 14.503
185 HZ PHE 176 HZ PHE 176 1.675 -7.066 14.223
186 H LEU 177 HN LEU 177 5.970 -1.971 8.865
187 HA LEU 177 HA LEU 177 8.649 -1.440 9.771
188 1HB LEU 177 HB2 LEU 177 7.028 -0.817 7.364
189 2HB LEU 177 HB1 LEU 177 8.359 0.265 7.724
190 HG LEU 177 HG LEU 177 8.561 -2.711 7.262
191 1HD1 LEU 177 HD11 LEU 177 10.004 -0.782 5.572
192 2HD1 LEU 177 HD12 LEU 177 8.250 -0.809 5.380
193 3HD1 LEU 177 HD13 LEU 177 9.187 -2.285 5.142
194 1HD2 LEU 177 HD21 LEU 177 10.268 -2.305 8.769
195 2HD2 LEU 177 HD22 LEU 177 10.537 -0.664 8.179
196 3HD2 LEU 177 HD23 LEU 177 11.067 -2.044 7.218
197 HA PRO 178 HA PRO 178 6.529 3.029 10.145
198 1HB PRO 178 HB2 PRO 178 3.904 2.020 11.121
199 2HB PRO 178 HB1 PRO 178 4.262 3.411 10.092
200 1HG PRO 178 HG2 PRO 178 3.224 1.192 9.061
201 2HG PRO 178 HG1 PRO 178 4.463 2.106 8.182
202 1HD PRO 178 HD2 PRO 178 4.720 -0.435 9.732
203 2HD PRO 178 HD1 PRO 178 5.503 0.044 8.212
204 H LEU 179 HN LEU 179 4.868 3.650 12.358
205 HA LEU 179 HA LEU 179 4.740 3.645 14.641
206 1HB LEU 179 HB2 LEU 179 5.500 1.024 14.153
207 2HB LEU 179 HB1 LEU 179 6.744 1.613 15.241
208 HG LEU 179 HG LEU 179 3.982 2.241 16.056
209 1HD1 LEU 179 HD11 LEU 179 3.265 0.157 15.520
210 2HD1 LEU 179 HD12 LEU 179 4.035 -0.221 17.061
211 3HD1 LEU 179 HD13 LEU 179 4.889 -0.531 15.548
212 1HD2 LEU 179 HD21 LEU 179 4.975 1.326 18.223
213 2HD2 LEU 179 HD22 LEU 179 5.668 2.813 17.576
214 3HD2 LEU 179 HD23 LEU 179 6.510 1.280 17.356
215 H ARG 180 HN ARG 180 5.874 5.657 14.096
216 HA ARG 180 HA ARG 180 7.427 7.235 14.630
217 1HB ARG 180 HB2 ARG 180 8.742 5.115 16.338
218 2HB ARG 180 HB1 ARG 180 8.900 6.869 16.496
219 1HG ARG 180 HG2 ARG 180 6.917 7.088 17.569
220 2HG ARG 180 HG1 ARG 180 6.170 5.746 16.701
221 1HD ARG 180 HD2 ARG 180 8.100 5.601 19.008
222 2HD ARG 180 HD1 ARG 180 6.412 5.093 18.984
223 HE ARG 180 HE ARG 180 7.517 3.554 17.071
224 1HH1 ARG 180 1HH1 ARG 180 8.412 4.203 20.382
225 2HH1 ARG 180 2HH1 ARG 180 9.148 2.653 20.616
226 1HH2 ARG 180 1HH2 ARG 180 8.483 1.517 17.378
227 2HH2 ARG 180 2HH2 ARG 180 9.188 1.128 18.912
228 1HG HSL 181 HG1 HSL 181 11.104 4.780 9.170
229 2HG HSL 181 HG2 HSL 181 9.456 4.693 8.352
230 H HSL 181 HN HSL 181 7.702 6.065 12.247
231 HA HSL 181 HA HSL 181 10.721 5.645 11.930
232 1HB HSL 181 HB1 HSL 181 9.954 3.640 10.934
233 2HB HSL 181 HB2 HSL 181 8.331 4.383 10.468
Start of MODEL 17
1 1H PHE 155 HT1 PHE 155 7.044 12.978 -9.825
2 2H PHE 155 HT2 PHE 155 7.743 13.159 -11.382
3 3H PHE 155 HT3 PHE 155 6.868 14.455 -10.676
4 HA PHE 155 HA PHE 155 9.466 13.348 -9.872
5 1HB PHE 155 HB2 PHE 155 8.452 15.979 -10.943
6 2HB PHE 155 HB1 PHE 155 10.021 15.835 -10.160
7 HD1 PHE 155 HD1 PHE 155 8.017 14.849 -13.077
8 HD2 PHE 155 HD2 PHE 155 11.867 14.805 -11.264
9 HE1 PHE 155 HE1 PHE 155 9.011 14.146 -15.214
10 HE2 PHE 155 HE2 PHE 155 12.868 14.101 -13.398
11 HZ PHE 155 HZ PHE 155 11.439 13.771 -15.377
12 H LEU 156 HN LEU 156 7.653 16.293 -9.092
13 HA LEU 156 HA LEU 156 7.156 15.566 -6.392
14 1HB LEU 156 HB2 LEU 156 8.694 17.003 -5.271
15 2HB LEU 156 HB1 LEU 156 9.609 15.965 -6.347
16 HG LEU 156 HG LEU 156 9.442 17.988 -7.998
17 1HD1 LEU 156 HD11 LEU 156 9.702 20.066 -6.337
18 2HD1 LEU 156 HD12 LEU 156 8.537 19.112 -5.419
19 3HD1 LEU 156 HD13 LEU 156 8.164 19.609 -7.069
20 1HD2 LEU 156 HD21 LEU 156 11.277 18.563 -5.745
21 2HD2 LEU 156 HD22 LEU 156 11.603 18.448 -7.474
22 3HD2 LEU 156 HD23 LEU 156 11.409 16.982 -6.514
23 H GLN 157 HN GLN 157 5.822 17.040 -5.339
24 HA GLN 157 HA GLN 157 5.338 19.670 -6.344
25 1HB GLN 157 HB2 GLN 157 4.179 18.181 -8.025
26 2HB GLN 157 HB1 GLN 157 3.093 17.691 -6.732
27 1HG GLN 157 HG2 GLN 157 2.199 19.467 -8.223
28 2HG GLN 157 HG1 GLN 157 2.229 19.896 -6.514
29 1HE2 GLN 157 HE21 GLN 157 2.612 21.989 -6.369
30 2HE2 GLN 157 HE22 GLN 157 3.832 22.861 -7.229
31 H SER 158 HN SER 158 5.701 17.950 -3.815
32 HA SER 158 HA SER 158 4.169 19.591 -2.100
33 1HB SER 158 HB2 SER 158 2.651 17.545 -3.065
34 2HB SER 158 HB1 SER 158 3.326 16.811 -1.602
35 HG SER 158 HG SER 158 1.273 18.131 -1.485
36 H ASP 159 HN ASP 159 6.883 18.736 -2.514
37 HA ASP 159 HA ASP 159 8.720 18.329 -1.256
38 1HB ASP 159 HB2 ASP 159 6.633 18.593 0.811
39 2HB ASP 159 HB1 ASP 159 8.076 17.711 1.299
40 H VAL 160 HN VAL 160 6.455 16.098 -2.020
41 HA VAL 160 HA VAL 160 6.663 13.868 -2.429
42 HB VAL 160 HB VAL 160 9.304 14.530 -1.988
43 1HG1 VAL 160 HG11 VAL 160 9.221 13.781 0.340
44 2HG1 VAL 160 HG12 VAL 160 10.265 12.743 -0.628
45 3HG1 VAL 160 HG13 VAL 160 8.647 12.200 -0.186
46 1HG2 VAL 160 HG21 VAL 160 8.150 13.035 -3.703
47 2HG2 VAL 160 HG22 VAL 160 8.422 11.723 -2.556
48 3HG2 VAL 160 HG23 VAL 160 9.792 12.610 -3.223
49 H PHE 161 HN PHE 161 7.628 14.747 0.879
50 HA PHE 161 HA PHE 161 6.305 12.477 2.029
51 1HB PHE 161 HB2 PHE 161 7.150 13.181 4.089
52 2HB PHE 161 HB1 PHE 161 8.370 13.738 2.952
53 HD1 PHE 161 HD1 PHE 161 6.831 16.166 1.930
54 HD2 PHE 161 HD2 PHE 161 7.572 14.678 5.849
55 HE1 PHE 161 HE1 PHE 161 6.620 18.445 2.833
56 HE2 PHE 161 HE2 PHE 161 7.360 16.955 6.756
57 HZ PHE 161 HZ PHE 161 6.883 18.841 5.248
58 H PHE 162 HN PHE 162 4.787 14.431 0.398
59 HA PHE 162 HA PHE 162 2.445 14.558 2.018
60 1HB PHE 162 HB2 PHE 162 4.125 16.942 1.709
61 2HB PHE 162 HB1 PHE 162 2.442 17.183 1.231
62 HD1 PHE 162 HD1 PHE 162 4.707 16.517 4.013
63 HD2 PHE 162 HD2 PHE 162 0.645 16.994 2.845
64 HE1 PHE 162 HE1 PHE 162 4.066 16.780 6.373
65 HE2 PHE 162 HE2 PHE 162 -0.005 17.257 5.202
66 HZ PHE 162 HZ PHE 162 1.706 17.150 6.970
67 H LEU 163 HN LEU 163 3.988 14.321 -0.917
68 HA LEU 163 HA LEU 163 2.167 15.534 -2.689
69 1HB LEU 163 HB2 LEU 163 4.282 13.470 -2.861
70 2HB LEU 163 HB1 LEU 163 3.047 13.388 -4.102
71 HG LEU 163 HG LEU 163 4.457 15.974 -3.546
72 1HD1 LEU 163 HD11 LEU 163 5.557 14.482 -5.775
73 2HD1 LEU 163 HD12 LEU 163 5.835 13.676 -4.231
74 3HD1 LEU 163 HD13 LEU 163 6.379 15.336 -4.469
75 1HD2 LEU 163 HD21 LEU 163 2.718 16.374 -4.998
76 2HD2 LEU 163 HD22 LEU 163 2.833 14.781 -5.746
77 3HD2 LEU 163 HD23 LEU 163 4.027 16.021 -6.128
78 H PHE 164 HN PHE 164 2.098 12.726 -0.729
79 HA PHE 164 HA PHE 164 0.510 11.160 -0.303
80 1HB PHE 164 HB2 PHE 164 -0.789 13.448 -0.341
81 2HB PHE 164 HB1 PHE 164 -1.528 12.764 -1.788
82 HD1 PHE 164 HD1 PHE 164 -2.959 10.795 -1.645
83 HD2 PHE 164 HD2 PHE 164 -1.256 12.555 1.837
84 HE1 PHE 164 HE1 PHE 164 -4.543 9.542 -0.239
85 HE2 PHE 164 HE2 PHE 164 -2.835 11.304 3.247
86 HZ PHE 164 HZ PHE 164 -4.483 9.794 2.209
87 H LEU 165 HN LEU 165 1.901 11.331 -3.053
88 HA LEU 165 HA LEU 165 0.133 10.187 -4.946
89 1HB LEU 165 HB2 LEU 165 2.883 10.955 -4.826
90 2HB LEU 165 HB1 LEU 165 2.776 9.337 -5.492
91 HG LEU 165 HG LEU 165 2.779 11.023 -7.257
92 1HD1 LEU 165 HD11 LEU 165 0.304 10.408 -8.088
93 2HD1 LEU 165 HD12 LEU 165 0.496 9.209 -6.808
94 3HD1 LEU 165 HD13 LEU 165 1.654 9.275 -8.136
95 1HD2 LEU 165 HD21 LEU 165 0.659 12.196 -5.571
96 2HD2 LEU 165 HD22 LEU 165 0.409 12.279 -7.314
97 3HD2 LEU 165 HD23 LEU 165 1.860 12.980 -6.596
98 H LEU 166 HN LEU 166 2.488 8.813 -2.693
99 HA LEU 166 HA LEU 166 1.013 6.360 -2.525
100 1HB LEU 166 HB2 LEU 166 3.004 6.559 -4.508
101 2HB LEU 166 HB1 LEU 166 3.694 5.578 -3.228
102 HG LEU 166 HG LEU 166 0.948 4.885 -4.120
103 1HD1 LEU 166 HD11 LEU 166 3.346 4.789 -5.857
104 2HD1 LEU 166 HD12 LEU 166 1.644 4.975 -6.280
105 3HD1 LEU 166 HD13 LEU 166 2.280 3.384 -5.857
106 1HD2 LEU 166 HD21 LEU 166 2.563 3.782 -2.337
107 2HD2 LEU 166 HD22 LEU 166 3.179 2.957 -3.769
108 3HD2 LEU 166 HD23 LEU 166 1.476 2.812 -3.331
109 HA PRO 167 HA PRO 167 3.833 7.731 1.023
110 1HB PRO 167 HB2 PRO 167 1.857 8.326 2.804
111 2HB PRO 167 HB1 PRO 167 2.615 9.513 1.725
112 1HG PRO 167 HG2 PRO 167 0.007 8.085 1.449
113 2HG PRO 167 HG1 PRO 167 0.417 9.764 1.060
114 1HD PRO 167 HD2 PRO 167 0.202 7.818 -0.826
115 2HD PRO 167 HD1 PRO 167 1.293 9.207 -0.990
116 HA PRO 168 HA PRO 168 1.774 4.175 3.336
117 1HB PRO 168 HB2 PRO 168 -0.248 2.828 2.332
118 2HB PRO 168 HB1 PRO 168 -0.491 4.481 2.935
119 1HG PRO 168 HG2 PRO 168 -0.183 3.531 0.111
120 2HG PRO 168 HG1 PRO 168 -1.342 4.695 0.778
121 1HD PRO 168 HD2 PRO 168 1.054 5.348 -0.464
122 2HD PRO 168 HD1 PRO 168 0.137 6.411 0.616
123 H ILE 169 HN ILE 169 3.729 4.088 1.080
124 HA ILE 169 HA ILE 169 3.584 1.436 -0.023
125 HB ILE 169 HB ILE 169 4.796 3.592 -0.940
126 1HG1 ILE 169 HG12 ILE 169 4.628 1.486 -2.150
127 2HG1 ILE 169 HG11 ILE 169 6.257 2.137 -2.303
128 1HG2 ILE 169 HG21 ILE 169 7.148 2.274 0.372
129 2HG2 ILE 169 HG22 ILE 169 6.295 3.622 1.127
130 3HG2 ILE 169 HG23 ILE 169 7.068 3.836 -0.444
131 1HD1 ILE 169 HD11 ILE 169 6.668 0.570 -0.208
132 2HD1 ILE 169 HD12 ILE 169 6.765 -0.025 -1.865
133 3HD1 ILE 169 HD13 ILE 169 5.303 -0.293 -0.914
134 H ILE 170 HN ILE 170 5.182 3.029 2.617
135 HA ILE 170 HA ILE 170 6.913 0.897 3.351
136 HB ILE 170 HB ILE 170 5.993 3.095 5.185
137 1HG1 ILE 170 HG12 ILE 170 6.635 4.245 3.187
138 2HG1 ILE 170 HG11 ILE 170 7.979 4.382 4.317
139 1HG2 ILE 170 HG21 ILE 170 7.352 1.915 6.524
140 2HG2 ILE 170 HG22 ILE 170 8.645 2.711 5.626
141 3HG2 ILE 170 HG23 ILE 170 8.129 1.086 5.175
142 1HD1 ILE 170 HD11 ILE 170 8.551 3.888 1.908
143 2HD1 ILE 170 HD12 ILE 170 7.886 2.278 2.184
144 3HD1 ILE 170 HD13 ILE 170 9.273 2.832 3.122
145 H LEU 171 HN LEU 171 3.803 2.096 4.615
146 HA LEU 171 HA LEU 171 3.603 0.170 6.683
147 1HB LEU 171 HB2 LEU 171 1.178 0.744 6.679
148 2HB LEU 171 HB1 LEU 171 2.238 2.133 6.812
149 HG LEU 171 HG LEU 171 1.881 2.160 4.162
150 1HD1 LEU 171 HD11 LEU 171 0.209 0.114 4.797
151 2HD1 LEU 171 HD12 LEU 171 0.039 1.148 3.378
152 3HD1 LEU 171 HD13 LEU 171 -0.894 1.491 4.835
153 1HD2 LEU 171 HD21 LEU 171 -0.176 3.654 4.720
154 2HD2 LEU 171 HD22 LEU 171 1.424 4.115 5.299
155 3HD2 LEU 171 HD23 LEU 171 0.282 3.337 6.393
156 H ASP 172 HN ASP 172 2.232 0.353 3.433
157 HA ASP 172 HA ASP 172 1.136 -2.285 3.511
158 1HB ASP 172 HB2 ASP 172 0.304 -0.356 2.073
159 2HB ASP 172 HB1 ASP 172 1.707 -0.647 1.036
160 H ALA 173 HN ALA 173 4.271 -1.180 3.310
161 HA ALA 173 HA ALA 173 5.309 -2.969 1.351
162 1HB ALA 173 HB1 ALA 173 7.398 -2.313 3.081
163 2HB ALA 173 HB2 ALA 173 6.345 -0.900 3.060
164 3HB ALA 173 HB3 ALA 173 6.994 -1.535 1.550
165 H GLY 174 HN GLY 174 5.874 -2.835 4.861
166 1HA GLY 174 HA2 GLY 174 5.932 -5.795 4.879
167 2HA GLY 174 HA1 GLY 174 6.996 -4.795 5.885
168 H TYR 175 HN TYR 175 4.353 -3.038 6.032
169 HA TYR 175 HA TYR 175 2.507 -2.845 7.355
170 1HB TYR 175 HB2 TYR 175 2.150 -5.313 6.791
171 2HB TYR 175 HB1 TYR 175 2.911 -5.665 8.339
172 HD1 TYR 175 HD1 TYR 175 1.390 -6.230 9.967
173 HD2 TYR 175 HD2 TYR 175 0.333 -3.224 7.150
174 HE1 TYR 175 HE1 TYR 175 -0.771 -5.936 11.102
175 HE2 TYR 175 HE2 TYR 175 -1.831 -2.920 8.277
176 HH TYR 175 HH TYR 175 -3.355 -4.384 9.762
177 H PHE 176 HN PHE 176 5.471 -4.204 8.644
178 HA PHE 176 HA PHE 176 4.843 -3.153 11.299
179 1HB PHE 176 HB2 PHE 176 6.724 -4.414 12.111
180 2HB PHE 176 HB1 PHE 176 5.769 -5.469 11.061
181 HD1 PHE 176 HD1 PHE 176 6.571 -5.874 8.712
182 HD2 PHE 176 HD2 PHE 176 8.978 -3.983 11.667
183 HE1 PHE 176 HE1 PHE 176 8.583 -6.366 7.383
184 HE2 PHE 176 HE2 PHE 176 10.994 -4.470 10.344
185 HZ PHE 176 HZ PHE 176 10.798 -5.664 8.198
186 H LEU 177 HN LEU 177 5.977 -1.875 8.569
187 HA LEU 177 HA LEU 177 8.289 -0.495 9.626
188 1HB LEU 177 HB2 LEU 177 6.873 -0.114 6.992
189 2HB LEU 177 HB1 LEU 177 8.448 0.521 7.427
190 HG LEU 177 HG LEU 177 7.799 -2.419 7.208
191 1HD1 LEU 177 HD11 LEU 177 7.732 -1.000 5.068
192 2HD1 LEU 177 HD12 LEU 177 8.744 -2.444 5.081
193 3HD1 LEU 177 HD13 LEU 177 9.476 -0.852 5.283
194 1HD2 LEU 177 HD21 LEU 177 9.803 -1.283 8.628
195 2HD2 LEU 177 HD22 LEU 177 10.570 -1.450 7.049
196 3HD2 LEU 177 HD23 LEU 177 9.904 -2.868 7.859
197 HA PRO 178 HA PRO 178 4.589 2.920 9.116
198 1HB PRO 178 HB2 PRO 178 3.184 1.421 11.298
199 2HB PRO 178 HB1 PRO 178 2.514 2.470 10.040
200 1HG PRO 178 HG2 PRO 178 2.356 -0.162 9.792
201 2HG PRO 178 HG1 PRO 178 2.736 0.850 8.387
202 1HD PRO 178 HD2 PRO 178 4.517 -0.900 10.000
203 2HD PRO 178 HD1 PRO 178 4.583 -0.513 8.270
204 H LEU 179 HN LEU 179 6.441 3.989 9.972
205 HA LEU 179 HA LEU 179 6.582 4.094 12.910
206 1HB LEU 179 HB2 LEU 179 8.624 3.620 11.272
207 2HB LEU 179 HB1 LEU 179 8.648 5.370 11.182
208 HG LEU 179 HG LEU 179 10.212 4.453 12.868
209 1HD1 LEU 179 HD11 LEU 179 7.970 6.063 14.079
210 2HD1 LEU 179 HD12 LEU 179 9.255 6.723 13.066
211 3HD1 LEU 179 HD13 LEU 179 9.646 5.998 14.625
212 1HD2 LEU 179 HD21 LEU 179 8.418 2.614 13.452
213 2HD2 LEU 179 HD22 LEU 179 7.917 3.809 14.648
214 3HD2 LEU 179 HD23 LEU 179 9.567 3.187 14.660
215 H ARG 180 HN ARG 180 7.183 6.309 10.187
216 HA ARG 180 HA ARG 180 6.146 8.534 11.749
217 1HB ARG 180 HB2 ARG 180 6.868 9.913 9.822
218 2HB ARG 180 HB1 ARG 180 8.178 8.918 10.469
219 1HG ARG 180 HG2 ARG 180 6.953 7.378 8.473
220 2HG ARG 180 HG1 ARG 180 7.091 9.008 7.815
221 1HD ARG 180 HD2 ARG 180 9.051 7.456 7.413
222 2HD ARG 180 HD1 ARG 180 9.428 9.034 8.097
223 HE ARG 180 HE ARG 180 9.429 6.481 9.560
224 1HH1 ARG 180 1HH1 ARG 180 10.329 9.857 9.351
225 2HH1 ARG 180 2HH1 ARG 180 11.392 9.778 10.713
226 1HH2 ARG 180 1HH2 ARG 180 10.824 6.391 11.348
227 2HH2 ARG 180 2HH2 ARG 180 11.674 7.816 11.845
228 1HG HSL 181 HG1 HSL 181 0.733 4.366 9.982
229 2HG HSL 181 HG2 HSL 181 2.247 4.294 11.025
230 H HSL 181 HN HSL 181 4.342 6.456 11.141
231 HA HSL 181 HA HSL 181 2.426 7.833 9.187
232 1HB HSL 181 HB1 HSL 181 1.706 5.787 8.366
233 2HB HSL 181 HB2 HSL 181 3.296 5.122 9.029
Start of MODEL 18
1 1H PHE 155 HT1 PHE 155 -2.855 18.409 -11.441
2 2H PHE 155 HT2 PHE 155 -1.972 17.269 -10.510
3 3H PHE 155 HT3 PHE 155 -3.655 17.471 -10.251
4 HA PHE 155 HA PHE 155 -4.179 16.574 -12.324
5 1HB PHE 155 HB2 PHE 155 -2.230 15.734 -13.753
6 2HB PHE 155 HB1 PHE 155 -2.495 17.474 -13.718
7 HD1 PHE 155 HD1 PHE 155 -0.174 14.820 -13.132
8 HD2 PHE 155 HD2 PHE 155 -1.053 18.873 -12.177
9 HE1 PHE 155 HE1 PHE 155 2.159 15.156 -12.427
10 HE2 PHE 155 HE2 PHE 155 1.278 19.217 -11.472
11 HZ PHE 155 HZ PHE 155 2.888 17.357 -11.597
12 H LEU 156 HN LEU 156 -4.868 14.591 -12.000
13 HA LEU 156 HA LEU 156 -3.696 12.916 -10.017
14 1HB LEU 156 HB2 LEU 156 -5.868 12.222 -11.983
15 2HB LEU 156 HB1 LEU 156 -5.528 11.415 -10.464
16 HG LEU 156 HG LEU 156 -6.660 14.185 -10.838
17 1HD1 LEU 156 HD11 LEU 156 -7.991 12.143 -9.183
18 2HD1 LEU 156 HD12 LEU 156 -7.971 11.840 -10.920
19 3HD1 LEU 156 HD13 LEU 156 -8.674 13.332 -10.293
20 1HD2 LEU 156 HD21 LEU 156 -6.834 13.614 -8.166
21 2HD2 LEU 156 HD22 LEU 156 -5.641 14.681 -8.909
22 3HD2 LEU 156 HD23 LEU 156 -5.236 12.995 -8.582
23 H GLN 157 HN GLN 157 -1.847 11.850 -10.442
24 HA GLN 157 HA GLN 157 -1.772 9.843 -12.434
25 1HB GLN 157 HB2 GLN 157 -1.412 11.761 -13.916
26 2HB GLN 157 HB1 GLN 157 -0.043 12.270 -12.937
27 1HG GLN 157 HG2 GLN 157 0.605 11.113 -15.017
28 2HG GLN 157 HG1 GLN 157 1.203 10.322 -13.559
29 1HE2 GLN 157 HE21 GLN 157 -0.540 9.963 -16.424
30 2HE2 GLN 157 HE22 GLN 157 -1.125 8.358 -16.161
31 H SER 158 HN SER 158 0.460 12.011 -10.686
32 HA SER 158 HA SER 158 2.325 9.901 -10.189
33 1HB SER 158 HB2 SER 158 2.398 12.341 -8.496
34 2HB SER 158 HB1 SER 158 3.706 11.528 -9.371
35 HG SER 158 HG SER 158 2.588 12.378 -11.319
36 H ASP 159 HN ASP 159 0.232 8.681 -9.326
37 HA ASP 159 HA ASP 159 -0.553 7.478 -7.556
38 1HB ASP 159 HB2 ASP 159 1.925 8.372 -6.649
39 2HB ASP 159 HB1 ASP 159 0.806 8.826 -5.367
40 H VAL 160 HN VAL 160 -0.095 10.904 -6.743
41 HA VAL 160 HA VAL 160 -1.573 12.515 -6.140
42 HB VAL 160 HB VAL 160 -3.667 10.348 -6.296
43 1HG1 VAL 160 HG11 VAL 160 -4.732 11.921 -5.017
44 2HG1 VAL 160 HG12 VAL 160 -5.096 12.538 -6.629
45 3HG1 VAL 160 HG13 VAL 160 -3.791 13.256 -5.683
46 1HG2 VAL 160 HG21 VAL 160 -2.975 12.504 -8.278
47 2HG2 VAL 160 HG22 VAL 160 -4.236 11.284 -8.453
48 3HG2 VAL 160 HG23 VAL 160 -2.539 10.804 -8.435
49 H PHE 161 HN PHE 161 -2.599 9.472 -4.561
50 HA PHE 161 HA PHE 161 -3.128 10.688 -2.061
51 1HB PHE 161 HB2 PHE 161 -2.305 7.812 -2.226
52 2HB PHE 161 HB1 PHE 161 -3.566 8.555 -1.250
53 HD1 PHE 161 HD1 PHE 161 -2.986 6.466 -3.939
54 HD2 PHE 161 HD2 PHE 161 -5.487 9.695 -2.750
55 HE1 PHE 161 HE1 PHE 161 -4.663 5.771 -5.600
56 HE2 PHE 161 HE2 PHE 161 -7.171 9.007 -4.408
57 HZ PHE 161 HZ PHE 161 -6.759 7.042 -5.834
58 H PHE 162 HN PHE 162 -0.266 9.650 -3.605
59 HA PHE 162 HA PHE 162 1.432 9.266 -1.367
60 1HB PHE 162 HB2 PHE 162 1.867 8.488 -3.688
61 2HB PHE 162 HB1 PHE 162 2.075 10.170 -4.172
62 HD1 PHE 162 HD1 PHE 162 3.900 11.493 -2.829
63 HD2 PHE 162 HD2 PHE 162 3.726 7.251 -3.126
64 HE1 PHE 162 HE1 PHE 162 6.295 11.361 -2.278
65 HE2 PHE 162 HE2 PHE 162 6.121 7.111 -2.574
66 HZ PHE 162 HZ PHE 162 7.408 9.168 -2.150
67 H LEU 163 HN LEU 163 1.220 11.906 -3.707
68 HA LEU 163 HA LEU 163 2.714 13.771 -2.165
69 1HB LEU 163 HB2 LEU 163 2.583 13.956 -4.584
70 2HB LEU 163 HB1 LEU 163 0.836 14.120 -4.508
71 HG LEU 163 HG LEU 163 1.040 16.294 -3.457
72 1HD1 LEU 163 HD11 LEU 163 3.536 17.191 -3.491
73 2HD1 LEU 163 HD12 LEU 163 3.881 15.485 -3.203
74 3HD1 LEU 163 HD13 LEU 163 2.849 16.378 -2.084
75 1HD2 LEU 163 HD21 LEU 163 1.019 16.767 -5.666
76 2HD2 LEU 163 HD22 LEU 163 2.384 15.709 -6.019
77 3HD2 LEU 163 HD23 LEU 163 2.664 17.310 -5.335
78 H PHE 164 HN PHE 164 -0.316 12.508 -1.834
79 HA PHE 164 HA PHE 164 -1.754 14.802 -0.927
80 1HB PHE 164 HB2 PHE 164 -2.654 12.665 -2.017
81 2HB PHE 164 HB1 PHE 164 -2.426 11.897 -0.458
82 HD1 PHE 164 HD1 PHE 164 -3.810 15.174 -1.597
83 HD2 PHE 164 HD2 PHE 164 -4.410 11.622 0.666
84 HE1 PHE 164 HE1 PHE 164 -6.013 16.006 -0.885
85 HE2 PHE 164 HE2 PHE 164 -6.615 12.447 1.383
86 HZ PHE 164 HZ PHE 164 -7.418 14.641 0.607
87 H LEU 165 HN LEU 165 -2.482 12.407 1.262
88 HA LEU 165 HA LEU 165 -1.504 13.860 3.470
89 1HB LEU 165 HB2 LEU 165 -2.997 11.387 3.018
90 2HB LEU 165 HB1 LEU 165 -1.980 11.338 4.447
91 HG LEU 165 HG LEU 165 -3.661 13.753 4.139
92 1HD1 LEU 165 HD11 LEU 165 -5.658 12.626 4.984
93 2HD1 LEU 165 HD12 LEU 165 -4.849 11.067 4.820
94 3HD1 LEU 165 HD13 LEU 165 -5.208 12.029 3.387
95 1HD2 LEU 165 HD21 LEU 165 -4.022 13.162 6.600
96 2HD2 LEU 165 HD22 LEU 165 -2.398 13.643 6.107
97 3HD2 LEU 165 HD23 LEU 165 -2.775 11.939 6.359
98 H LEU 166 HN LEU 166 -0.473 10.790 2.011
99 HA LEU 166 HA LEU 166 2.260 11.258 2.680
100 1HB LEU 166 HB2 LEU 166 2.500 10.129 4.594
101 2HB LEU 166 HB1 LEU 166 0.753 10.224 4.734
102 HG LEU 166 HG LEU 166 2.250 7.910 3.494
103 1HD1 LEU 166 HD11 LEU 166 1.190 8.379 6.257
104 2HD1 LEU 166 HD12 LEU 166 2.775 7.788 5.760
105 3HD1 LEU 166 HD13 LEU 166 1.358 6.751 5.599
106 1HD2 LEU 166 HD21 LEU 166 -0.532 7.649 4.434
107 2HD2 LEU 166 HD22 LEU 166 0.263 6.953 3.023
108 3HD2 LEU 166 HD23 LEU 166 -0.291 8.627 2.986
109 HA PRO 167 HA PRO 167 2.768 8.208 -0.473
110 1HB PRO 167 HB2 PRO 167 5.119 7.074 0.052
111 2HB PRO 167 HB1 PRO 167 4.994 8.794 -0.372
112 1HG PRO 167 HG2 PRO 167 5.345 7.527 2.317
113 2HG PRO 167 HG1 PRO 167 6.106 8.986 1.660
114 1HD PRO 167 HD2 PRO 167 3.924 8.980 3.357
115 2HD PRO 167 HD1 PRO 167 4.343 10.309 2.257
116 HA PRO 168 HA PRO 168 1.282 4.441 1.521
117 1HB PRO 168 HB2 PRO 168 -0.394 3.674 -0.377
118 2HB PRO 168 HB1 PRO 168 -0.749 5.100 0.622
119 1HG PRO 168 HG2 PRO 168 0.387 4.967 -2.156
120 2HG PRO 168 HG1 PRO 168 -0.871 6.041 -1.519
121 1HD PRO 168 HD2 PRO 168 1.790 6.714 -1.797
122 2HD PRO 168 HD1 PRO 168 0.662 7.505 -0.679
123 H ILE 169 HN ILE 169 3.331 3.388 1.386
124 HA ILE 169 HA ILE 169 3.420 1.272 -0.571
125 HB ILE 169 HB ILE 169 4.562 3.218 -1.711
126 1HG1 ILE 169 HG12 ILE 169 6.426 0.913 -1.142
127 2HG1 ILE 169 HG11 ILE 169 4.999 0.761 -2.164
128 1HG2 ILE 169 HG21 ILE 169 5.619 4.187 0.282
129 2HG2 ILE 169 HG22 ILE 169 6.798 3.850 -0.985
130 3HG2 ILE 169 HG23 ILE 169 6.670 2.774 0.410
131 1HD1 ILE 169 HD11 ILE 169 6.321 1.326 -3.853
132 2HD1 ILE 169 HD12 ILE 169 7.610 1.849 -2.768
133 3HD1 ILE 169 HD13 ILE 169 6.309 2.961 -3.193
134 H ILE 170 HN ILE 170 5.160 3.058 1.859
135 HA ILE 170 HA ILE 170 6.763 0.922 2.768
136 HB ILE 170 HB ILE 170 7.188 2.504 4.700
137 1HG1 ILE 170 HG12 ILE 170 6.342 4.847 3.325
138 2HG1 ILE 170 HG11 ILE 170 4.957 3.782 3.510
139 1HG2 ILE 170 HG21 ILE 170 8.381 2.258 2.360
140 2HG2 ILE 170 HG22 ILE 170 8.851 3.507 3.513
141 3HG2 ILE 170 HG23 ILE 170 7.787 3.906 2.163
142 1HD1 ILE 170 HD11 ILE 170 6.692 4.925 5.669
143 2HD1 ILE 170 HD12 ILE 170 5.510 3.643 5.942
144 3HD1 ILE 170 HD13 ILE 170 4.979 5.223 5.369
145 H LEU 171 HN LEU 171 3.694 2.275 3.798
146 HA LEU 171 HA LEU 171 3.526 0.958 6.293
147 1HB LEU 171 HB2 LEU 171 0.916 1.159 5.049
148 2HB LEU 171 HB1 LEU 171 1.521 1.940 6.491
149 HG LEU 171 HG LEU 171 0.738 3.620 4.973
150 1HD1 LEU 171 HD11 LEU 171 3.272 4.484 4.325
151 2HD1 LEU 171 HD12 LEU 171 3.541 3.430 5.713
152 3HD1 LEU 171 HD13 LEU 171 2.423 4.786 5.840
153 1HD2 LEU 171 HD21 LEU 171 2.030 1.939 2.983
154 2HD2 LEU 171 HD22 LEU 171 2.368 3.656 2.786
155 3HD2 LEU 171 HD23 LEU 171 0.701 3.087 2.821
156 H ASP 172 HN ASP 172 1.841 0.160 3.277
157 HA ASP 172 HA ASP 172 1.300 -2.520 4.089
158 1HB ASP 172 HB2 ASP 172 0.959 -1.082 1.452
159 2HB ASP 172 HB1 ASP 172 0.467 -2.761 1.721
160 H ALA 173 HN ALA 173 4.167 -1.209 3.286
161 HA ALA 173 HA ALA 173 5.142 -3.023 1.321
162 1HB ALA 173 HB1 ALA 173 6.261 -0.899 3.003
163 2HB ALA 173 HB2 ALA 173 6.605 -1.314 1.326
164 3HB ALA 173 HB3 ALA 173 7.384 -2.204 2.632
165 H GLY 174 HN GLY 174 5.970 -2.676 4.754
166 1HA GLY 174 HA2 GLY 174 6.381 -5.602 4.885
167 2HA GLY 174 HA1 GLY 174 7.245 -4.423 5.892
168 H TYR 175 HN TYR 175 4.551 -2.941 6.027
169 HA TYR 175 HA TYR 175 2.661 -2.867 7.284
170 1HB TYR 175 HB2 TYR 175 2.687 -5.481 6.629
171 2HB TYR 175 HB1 TYR 175 2.902 -5.619 8.370
172 HD1 TYR 175 HD1 TYR 175 0.865 -3.273 6.292
173 HD2 TYR 175 HD2 TYR 175 0.890 -6.283 9.299
174 HE1 TYR 175 HE1 TYR 175 -1.554 -2.968 6.610
175 HE2 TYR 175 HE2 TYR 175 -1.529 -5.988 9.624
176 HH TYR 175 HH TYR 175 -3.197 -3.729 9.080
177 H PHE 176 HN PHE 176 5.579 -4.297 8.618
178 HA PHE 176 HA PHE 176 4.845 -3.418 11.308
179 1HB PHE 176 HB2 PHE 176 6.144 -5.678 10.415
180 2HB PHE 176 HB1 PHE 176 7.480 -4.661 10.970
181 HD1 PHE 176 HD1 PHE 176 7.680 -4.045 13.307
182 HD2 PHE 176 HD2 PHE 176 4.520 -6.553 11.954
183 HE1 PHE 176 HE1 PHE 176 7.220 -4.713 15.631
184 HE2 PHE 176 HE2 PHE 176 4.053 -7.225 14.274
185 HZ PHE 176 HZ PHE 176 5.404 -6.304 16.116
186 H LEU 177 HN LEU 177 5.861 -1.769 8.852
187 HA LEU 177 HA LEU 177 8.302 -0.626 9.890
188 1HB LEU 177 HB2 LEU 177 6.658 0.506 7.646
189 2HB LEU 177 HB1 LEU 177 8.379 0.679 7.931
190 HG LEU 177 HG LEU 177 6.948 -1.811 7.005
191 1HD1 LEU 177 HD11 LEU 177 7.663 -1.347 4.922
192 2HD1 LEU 177 HD12 LEU 177 9.179 -0.643 5.484
193 3HD1 LEU 177 HD13 LEU 177 7.697 0.312 5.520
194 1HD2 LEU 177 HD21 LEU 177 8.602 -2.833 8.158
195 2HD2 LEU 177 HD22 LEU 177 9.626 -1.398 8.178
196 3HD2 LEU 177 HD23 LEU 177 9.547 -2.405 6.732
197 HA PRO 178 HA PRO 178 5.092 3.099 10.422
198 1HB PRO 178 HB2 PRO 178 2.780 1.414 11.230
199 2HB PRO 178 HB1 PRO 178 2.809 2.910 10.290
200 1HG PRO 178 HG2 PRO 178 2.384 0.565 9.102
201 2HG PRO 178 HG1 PRO 178 3.365 1.819 8.321
202 1HD PRO 178 HD2 PRO 178 4.233 -0.674 9.723
203 2HD PRO 178 HD1 PRO 178 4.901 0.095 8.268
204 H LEU 179 HN LEU 179 6.655 3.112 12.149
205 HA LEU 179 HA LEU 179 6.018 1.737 14.613
206 1HB LEU 179 HB2 LEU 179 8.324 2.969 13.453
207 2HB LEU 179 HB1 LEU 179 8.038 3.686 15.028
208 HG LEU 179 HG LEU 179 9.596 1.756 15.081
209 1HD1 LEU 179 HD11 LEU 179 7.224 0.828 16.591
210 2HD1 LEU 179 HD12 LEU 179 7.796 2.466 16.907
211 3HD1 LEU 179 HD13 LEU 179 8.882 1.094 17.129
212 1HD2 LEU 179 HD21 LEU 179 9.079 -0.311 14.334
213 2HD2 LEU 179 HD22 LEU 179 7.966 0.581 13.298
214 3HD2 LEU 179 HD23 LEU 179 7.380 -0.168 14.782
215 H ARG 180 HN ARG 180 6.752 5.169 13.982
216 HA ARG 180 HA ARG 180 5.070 5.940 16.218
217 1HB ARG 180 HB2 ARG 180 5.942 8.186 15.855
218 2HB ARG 180 HB1 ARG 180 7.264 7.013 15.902
219 1HG ARG 180 HG2 ARG 180 6.270 7.456 13.209
220 2HG ARG 180 HG1 ARG 180 6.840 8.940 13.973
221 1HD ARG 180 HD2 ARG 180 8.871 8.282 13.297
222 2HD ARG 180 HD1 ARG 180 8.796 7.163 14.657
223 HE ARG 180 HE ARG 180 8.774 5.471 13.142
224 1HH1 ARG 180 1HH1 ARG 180 7.470 8.314 11.594
225 2HH1 ARG 180 2HH1 ARG 180 7.264 7.539 10.060
226 1HH2 ARG 180 1HH2 ARG 180 8.504 4.448 11.124
227 2HH2 ARG 180 2HH2 ARG 180 7.851 5.343 9.793
228 1HG HSL 181 HG1 HSL 181 0.765 6.189 10.448
229 2HG HSL 181 HG2 HSL 181 1.452 4.572 9.900
230 H HSL 181 HN HSL 181 4.152 4.825 13.506
231 HA HSL 181 HA HSL 181 2.129 7.033 12.853
232 1HB HSL 181 HB1 HSL 181 3.088 6.732 10.703
233 2HB HSL 181 HB2 HSL 181 3.544 4.979 11.050
Start of MODEL 19
1 1H PHE 155 HT1 PHE 155 3.918 19.088 0.618
2 2H PHE 155 HT2 PHE 155 3.932 19.217 -1.094
3 3H PHE 155 HT3 PHE 155 3.432 20.549 -0.134
4 HA PHE 155 HA PHE 155 5.701 20.664 -1.097
5 1HB PHE 155 HB2 PHE 155 5.025 20.934 1.824
6 2HB PHE 155 HB1 PHE 155 6.610 21.401 1.216
7 HD1 PHE 155 HD1 PHE 155 6.117 22.703 -1.273
8 HD2 PHE 155 HD2 PHE 155 3.807 22.816 2.299
9 HE1 PHE 155 HE1 PHE 155 5.220 24.899 -1.926
10 HE2 PHE 155 HE2 PHE 155 2.905 25.012 1.652
11 HZ PHE 155 HZ PHE 155 3.611 26.055 -0.464
12 H LEU 156 HN LEU 156 7.989 20.278 -0.229
13 HA LEU 156 HA LEU 156 8.469 17.472 -0.259
14 1HB LEU 156 HB2 LEU 156 10.798 18.032 -0.281
15 2HB LEU 156 HB1 LEU 156 9.947 19.128 -1.353
16 HG LEU 156 HG LEU 156 9.928 20.669 0.805
17 1HD1 LEU 156 HD11 LEU 156 12.435 20.228 1.668
18 2HD1 LEU 156 HD12 LEU 156 11.911 18.568 1.384
19 3HD1 LEU 156 HD13 LEU 156 10.999 19.606 2.480
20 1HD2 LEU 156 HD21 LEU 156 12.059 21.662 -0.011
21 2HD2 LEU 156 HD22 LEU 156 10.882 21.347 -1.287
22 3HD2 LEU 156 HD23 LEU 156 12.255 20.262 -1.066
23 H GLN 157 HN GLN 157 9.164 16.131 1.353
24 HA GLN 157 HA GLN 157 10.046 17.008 3.893
25 1HB GLN 157 HB2 GLN 157 7.173 16.747 3.521
26 2HB GLN 157 HB1 GLN 157 7.766 15.690 4.794
27 1HG GLN 157 HG2 GLN 157 8.005 17.384 6.199
28 2HG GLN 157 HG1 GLN 157 8.920 18.320 5.018
29 1HE2 GLN 157 HE21 GLN 157 5.566 17.166 5.162
30 2HE2 GLN 157 HE22 GLN 157 4.841 18.717 4.929
31 H SER 158 HN SER 158 7.850 14.295 3.289
32 HA SER 158 HA SER 158 9.802 12.429 4.256
33 1HB SER 158 HB2 SER 158 7.987 10.737 3.575
34 2HB SER 158 HB1 SER 158 7.576 11.903 4.844
35 HG SER 158 HG SER 158 6.984 12.326 2.105
36 H ASP 159 HN ASP 159 11.216 13.359 2.363
37 HA ASP 159 HA ASP 159 12.525 12.676 0.617
38 1HB ASP 159 HB2 ASP 159 11.373 10.321 1.314
39 2HB ASP 159 HB1 ASP 159 10.755 10.506 -0.324
40 H VAL 160 HN VAL 160 9.032 12.613 0.065
41 HA VAL 160 HA VAL 160 7.825 13.979 -1.342
42 HB VAL 160 HB VAL 160 10.232 15.153 -1.766
43 1HG1 VAL 160 HG11 VAL 160 10.773 13.522 -3.579
44 2HG1 VAL 160 HG12 VAL 160 10.782 15.206 -4.094
45 3HG1 VAL 160 HG13 VAL 160 9.414 14.170 -4.494
46 1HG2 VAL 160 HG21 VAL 160 8.994 16.884 -2.510
47 2HG2 VAL 160 HG22 VAL 160 7.653 15.843 -2.030
48 3HG2 VAL 160 HG23 VAL 160 8.157 15.908 -3.719
49 H PHE 161 HN PHE 161 10.221 11.812 -2.837
50 HA PHE 161 HA PHE 161 8.595 11.137 -5.067
51 1HB PHE 161 HB2 PHE 161 11.142 10.787 -4.733
52 2HB PHE 161 HB1 PHE 161 10.681 9.305 -3.902
53 HD1 PHE 161 HD1 PHE 161 11.512 10.730 -7.001
54 HD2 PHE 161 HD2 PHE 161 9.049 7.745 -5.231
55 HE1 PHE 161 HE1 PHE 161 11.369 9.571 -9.166
56 HE2 PHE 161 HE2 PHE 161 8.902 6.579 -7.392
57 HZ PHE 161 HZ PHE 161 10.062 7.492 -9.364
58 H PHE 162 HN PHE 162 8.781 10.060 -1.799
59 HA PHE 162 HA PHE 162 7.417 7.579 -2.062
60 1HB PHE 162 HB2 PHE 162 8.283 9.399 0.091
61 2HB PHE 162 HB1 PHE 162 6.951 8.312 0.487
62 HD1 PHE 162 HD1 PHE 162 8.000 6.870 2.019
63 HD2 PHE 162 HD2 PHE 162 9.795 7.590 -1.772
64 HE1 PHE 162 HE1 PHE 162 9.609 5.057 2.440
65 HE2 PHE 162 HE2 PHE 162 11.405 5.776 -1.359
66 HZ PHE 162 HZ PHE 162 11.313 4.508 0.750
67 H LEU 163 HN LEU 163 6.360 10.633 -0.583
68 HA LEU 163 HA LEU 163 3.606 9.974 -0.547
69 1HB LEU 163 HB2 LEU 163 4.749 11.664 0.910
70 2HB LEU 163 HB1 LEU 163 4.876 12.711 -0.491
71 HG LEU 163 HG LEU 163 2.210 12.213 -0.482
72 1HD1 LEU 163 HD11 LEU 163 1.329 11.792 1.541
73 2HD1 LEU 163 HD12 LEU 163 2.553 12.740 2.386
74 3HD1 LEU 163 HD13 LEU 163 2.911 11.090 1.876
75 1HD2 LEU 163 HD21 LEU 163 2.123 14.429 0.868
76 2HD2 LEU 163 HD22 LEU 163 2.890 14.409 -0.720
77 3HD2 LEU 163 HD23 LEU 163 3.881 14.369 0.738
78 H PHE 164 HN PHE 164 5.637 10.687 -3.044
79 HA PHE 164 HA PHE 164 3.915 12.265 -4.679
80 1HB PHE 164 HB2 PHE 164 6.140 12.617 -5.177
81 2HB PHE 164 HB1 PHE 164 6.572 10.931 -4.912
82 HD1 PHE 164 HD1 PHE 164 4.568 13.046 -7.253
83 HD2 PHE 164 HD2 PHE 164 7.078 9.644 -6.757
84 HE1 PHE 164 HE1 PHE 164 4.541 12.675 -9.685
85 HE2 PHE 164 HE2 PHE 164 7.057 9.269 -9.188
86 HZ PHE 164 HZ PHE 164 5.787 10.785 -10.656
87 H LEU 165 HN LEU 165 5.349 9.099 -5.453
88 HA LEU 165 HA LEU 165 3.289 8.386 -7.242
89 1HB LEU 165 HB2 LEU 165 5.787 7.398 -6.577
90 2HB LEU 165 HB1 LEU 165 4.695 6.121 -6.074
91 HG LEU 165 HG LEU 165 3.785 6.800 -8.609
92 1HD1 LEU 165 HD11 LEU 165 6.682 7.306 -8.376
93 2HD1 LEU 165 HD12 LEU 165 5.501 7.947 -9.518
94 3HD1 LEU 165 HD13 LEU 165 6.166 6.330 -9.751
95 1HD2 LEU 165 HD21 LEU 165 4.168 4.554 -7.408
96 2HD2 LEU 165 HD22 LEU 165 5.776 4.611 -8.130
97 3HD2 LEU 165 HD23 LEU 165 4.345 4.609 -9.161
98 H LEU 166 HN LEU 166 4.072 7.057 -4.034
99 HA LEU 166 HA LEU 166 1.277 6.813 -3.358
100 1HB LEU 166 HB2 LEU 166 2.692 4.619 -4.527
101 2HB LEU 166 HB1 LEU 166 2.366 4.229 -2.850
102 HG LEU 166 HG LEU 166 0.592 3.336 -4.173
103 1HD1 LEU 166 HD11 LEU 166 -1.341 4.959 -3.407
104 2HD1 LEU 166 HD12 LEU 166 -0.034 5.689 -2.477
105 3HD1 LEU 166 HD13 LEU 166 -0.433 3.988 -2.250
106 1HD2 LEU 166 HD21 LEU 166 -0.540 4.403 -5.859
107 2HD2 LEU 166 HD22 LEU 166 1.070 5.102 -6.036
108 3HD2 LEU 166 HD23 LEU 166 -0.202 6.011 -5.219
109 HA PRO 167 HA PRO 167 3.672 7.825 0.337
110 1HB PRO 167 HB2 PRO 167 1.459 8.250 1.928
111 2HB PRO 167 HB1 PRO 167 2.251 9.473 0.920
112 1HG PRO 167 HG2 PRO 167 -0.221 7.898 0.411
113 2HG PRO 167 HG1 PRO 167 0.171 9.562 -0.048
114 1HD PRO 167 HD2 PRO 167 0.230 7.481 -1.798
115 2HD PRO 167 HD1 PRO 167 1.265 8.912 -1.956
116 HA PRO 168 HA PRO 168 1.946 4.194 2.804
117 1HB PRO 168 HB2 PRO 168 -0.053 2.714 1.960
118 2HB PRO 168 HB1 PRO 168 -0.352 4.391 2.466
119 1HG PRO 168 HG2 PRO 168 -0.127 3.260 -0.296
120 2HG PRO 168 HG1 PRO 168 -1.267 4.464 0.332
121 1HD PRO 168 HD2 PRO 168 1.119 5.005 -1.038
122 2HD PRO 168 HD1 PRO 168 0.167 6.164 -0.097
123 H ILE 169 HN ILE 169 3.951 4.006 0.720
124 HA ILE 169 HA ILE 169 3.817 1.384 -0.449
125 HB ILE 169 HB ILE 169 6.092 1.793 -1.192
126 1HG1 ILE 169 HG12 ILE 169 5.906 4.267 0.529
127 2HG1 ILE 169 HG11 ILE 169 6.970 2.889 0.799
128 1HG2 ILE 169 HG21 ILE 169 5.436 4.332 -2.045
129 2HG2 ILE 169 HG22 ILE 169 3.875 3.583 -1.715
130 3HG2 ILE 169 HG23 ILE 169 5.001 2.818 -2.836
131 1HD1 ILE 169 HD11 ILE 169 7.472 5.240 -0.687
132 2HD1 ILE 169 HD12 ILE 169 7.440 3.890 -1.822
133 3HD1 ILE 169 HD13 ILE 169 8.531 3.851 -0.437
134 H ILE 170 HN ILE 170 5.499 2.921 2.176
135 HA ILE 170 HA ILE 170 7.046 0.683 2.933
136 HB ILE 170 HB ILE 170 7.750 2.059 4.778
137 1HG1 ILE 170 HG12 ILE 170 5.356 3.628 3.976
138 2HG1 ILE 170 HG11 ILE 170 5.892 3.175 5.585
139 1HG2 ILE 170 HG21 ILE 170 8.988 3.510 3.521
140 2HG2 ILE 170 HG22 ILE 170 7.611 3.981 2.525
141 3HG2 ILE 170 HG23 ILE 170 8.399 2.425 2.261
142 1HD1 ILE 170 HD11 ILE 170 6.440 5.347 5.715
143 2HD1 ILE 170 HD12 ILE 170 6.537 5.534 3.964
144 3HD1 ILE 170 HD13 ILE 170 7.889 4.831 4.852
145 H LEU 171 HN LEU 171 4.159 2.221 4.329
146 HA LEU 171 HA LEU 171 3.993 0.516 6.566
147 1HB LEU 171 HB2 LEU 171 1.423 1.142 6.278
148 2HB LEU 171 HB1 LEU 171 2.598 2.273 6.917
149 HG LEU 171 HG LEU 171 2.217 2.347 3.986
150 1HD1 LEU 171 HD11 LEU 171 -0.002 2.704 5.890
151 2HD1 LEU 171 HD12 LEU 171 -0.028 2.311 4.171
152 3HD1 LEU 171 HD13 LEU 171 0.199 3.982 4.691
153 1HD2 LEU 171 HD21 LEU 171 1.924 4.849 5.293
154 2HD2 LEU 171 HD22 LEU 171 3.274 4.267 4.320
155 3HD2 LEU 171 HD23 LEU 171 3.256 3.986 6.061
156 H ASP 172 HN ASP 172 2.185 0.446 3.513
157 HA ASP 172 HA ASP 172 1.126 -2.161 3.998
158 1HB ASP 172 HB2 ASP 172 1.119 -0.301 1.633
159 2HB ASP 172 HB1 ASP 172 0.519 -1.959 1.490
160 H ALA 173 HN ALA 173 4.212 -1.262 3.352
161 HA ALA 173 HA ALA 173 4.916 -3.097 1.288
162 1HB ALA 173 HB1 ALA 173 6.231 -1.072 2.789
163 2HB ALA 173 HB2 ALA 173 6.778 -1.886 1.325
164 3HB ALA 173 HB3 ALA 173 7.176 -2.554 2.907
165 H GLY 174 HN GLY 174 5.947 -3.042 4.683
166 1HA GLY 174 HA2 GLY 174 5.780 -5.995 4.708
167 2HA GLY 174 HA1 GLY 174 6.964 -5.058 5.639
168 H TYR 175 HN TYR 175 4.414 -3.173 5.911
169 HA TYR 175 HA TYR 175 2.698 -2.842 7.359
170 1HB TYR 175 HB2 TYR 175 2.112 -5.262 6.826
171 2HB TYR 175 HB1 TYR 175 2.980 -5.690 8.297
172 HD1 TYR 175 HD1 TYR 175 2.068 -5.153 10.481
173 HD2 TYR 175 HD2 TYR 175 -0.020 -4.090 6.931
174 HE1 TYR 175 HE1 TYR 175 0.042 -4.728 11.808
175 HE2 TYR 175 HE2 TYR 175 -2.052 -3.660 8.248
176 HH TYR 175 HH TYR 175 -2.647 -3.089 10.584
177 H PHE 176 HN PHE 176 5.781 -3.792 8.208
178 HA PHE 176 HA PHE 176 5.392 -3.288 11.059
179 1HB PHE 176 HB2 PHE 176 7.900 -4.099 9.582
180 2HB PHE 176 HB1 PHE 176 7.658 -4.102 11.335
181 HD1 PHE 176 HD1 PHE 176 8.136 -6.249 8.837
182 HD2 PHE 176 HD2 PHE 176 5.152 -5.396 11.748
183 HE1 PHE 176 HE1 PHE 176 7.349 -8.576 8.707
184 HE2 PHE 176 HE2 PHE 176 4.360 -7.722 11.624
185 HZ PHE 176 HZ PHE 176 5.460 -9.316 10.103
186 H LEU 177 HN LEU 177 5.809 -1.474 8.394
187 HA LEU 177 HA LEU 177 7.896 0.288 9.267
188 1HB LEU 177 HB2 LEU 177 5.977 0.226 6.986
189 2HB LEU 177 HB1 LEU 177 6.849 1.705 7.342
190 HG LEU 177 HG LEU 177 7.765 -0.077 5.623
191 1HD1 LEU 177 HD11 LEU 177 9.871 0.983 7.408
192 2HD1 LEU 177 HD12 LEU 177 8.748 2.142 6.699
193 3HD1 LEU 177 HD13 LEU 177 9.707 1.092 5.656
194 1HD2 LEU 177 HD21 LEU 177 7.782 -1.886 7.343
195 2HD2 LEU 177 HD22 LEU 177 9.062 -1.004 8.174
196 3HD2 LEU 177 HD23 LEU 177 9.331 -1.622 6.545
197 HA PRO 178 HA PRO 178 3.662 2.899 10.020
198 1HB PRO 178 HB2 PRO 178 2.644 0.683 11.754
199 2HB PRO 178 HB1 PRO 178 1.744 1.883 10.817
200 1HG PRO 178 HG2 PRO 178 1.979 -0.593 9.910
201 2HG PRO 178 HG1 PRO 178 2.124 0.782 8.799
202 1HD PRO 178 HD2 PRO 178 4.251 -0.978 9.928
203 2HD PRO 178 HD1 PRO 178 4.143 -0.227 8.324
204 H LEU 179 HN LEU 179 5.462 3.928 11.058
205 HA LEU 179 HA LEU 179 5.705 3.343 13.937
206 1HB LEU 179 HB2 LEU 179 7.714 3.481 12.130
207 2HB LEU 179 HB1 LEU 179 7.639 5.162 12.628
208 HG LEU 179 HG LEU 179 7.623 3.819 15.037
209 1HD1 LEU 179 HD11 LEU 179 8.330 1.857 13.323
210 2HD1 LEU 179 HD12 LEU 179 8.871 1.949 14.999
211 3HD1 LEU 179 HD13 LEU 179 9.911 2.540 13.704
212 1HD2 LEU 179 HD21 LEU 179 8.955 5.659 15.014
213 2HD2 LEU 179 HD22 LEU 179 9.614 5.301 13.418
214 3HD2 LEU 179 HD23 LEU 179 10.203 4.427 14.831
215 H ARG 180 HN ARG 180 6.136 6.135 11.793
216 HA ARG 180 HA ARG 180 4.994 7.897 13.801
217 1HB ARG 180 HB2 ARG 180 5.708 8.949 11.119
218 2HB ARG 180 HB1 ARG 180 6.040 9.616 12.720
219 1HG ARG 180 HG2 ARG 180 8.154 9.057 12.182
220 2HG ARG 180 HG1 ARG 180 7.653 7.475 12.785
221 1HD ARG 180 HD2 ARG 180 6.864 7.178 10.276
222 2HD ARG 180 HD1 ARG 180 8.105 8.395 9.993
223 HE ARG 180 HE ARG 180 8.504 5.645 10.765
224 1HH1 ARG 180 1HH1 ARG 180 9.905 8.840 10.661
225 2HH1 ARG 180 2HH1 ARG 180 11.537 8.261 10.695
226 1HH2 ARG 180 1HH2 ARG 180 10.651 4.882 10.811
227 2HH2 ARG 180 2HH2 ARG 180 11.961 6.015 10.780
228 1HG HSL 181 HG1 HSL 181 -0.034 3.847 10.884
229 2HG HSL 181 HG2 HSL 181 1.506 3.655 11.873
230 H HSL 181 HN HSL 181 3.362 5.858 12.608
231 HA HSL 181 HA HSL 181 1.303 7.561 11.108
232 1HB HSL 181 HB1 HSL 181 0.737 5.770 9.741
233 2HB HSL 181 HB2 HSL 181 2.404 5.106 10.179
Start of MODEL 20
1 1H PHE 155 HT1 PHE 155 8.070 4.484 -12.499
2 2H PHE 155 HT2 PHE 155 6.451 5.011 -12.713
3 3H PHE 155 HT3 PHE 155 7.277 4.228 -13.997
4 HA PHE 155 HA PHE 155 7.291 2.202 -12.901
5 1HB PHE 155 HB2 PHE 155 7.646 3.522 -10.656
6 2HB PHE 155 HB1 PHE 155 5.894 3.386 -10.526
7 HD1 PHE 155 HD1 PHE 155 5.493 1.853 -8.846
8 HD2 PHE 155 HD2 PHE 155 8.408 0.963 -11.818
9 HE1 PHE 155 HE1 PHE 155 5.738 -0.415 -7.923
10 HE2 PHE 155 HE2 PHE 155 8.657 -1.306 -10.900
11 HZ PHE 155 HZ PHE 155 7.320 -1.998 -8.950
12 H LEU 156 HN LEU 156 5.291 0.866 -12.219
13 HA LEU 156 HA LEU 156 2.722 1.979 -12.713
14 1HB LEU 156 HB2 LEU 156 2.236 0.792 -14.775
15 2HB LEU 156 HB1 LEU 156 3.568 1.906 -14.993
16 HG LEU 156 HG LEU 156 4.636 -0.631 -14.291
17 1HD1 LEU 156 HD11 LEU 156 2.904 -0.777 -16.739
18 2HD1 LEU 156 HD12 LEU 156 2.409 -1.420 -15.174
19 3HD1 LEU 156 HD13 LEU 156 3.835 -2.069 -15.983
20 1HD2 LEU 156 HD21 LEU 156 4.678 0.836 -16.920
21 2HD2 LEU 156 HD22 LEU 156 5.826 -0.385 -16.370
22 3HD2 LEU 156 HD23 LEU 156 5.744 1.177 -15.556
23 H GLN 157 HN GLN 157 2.164 0.969 -10.791
24 HA GLN 157 HA GLN 157 1.253 -1.707 -11.004
25 1HB GLN 157 HB2 GLN 157 3.611 -2.229 -10.648
26 2HB GLN 157 HB1 GLN 157 3.630 -1.234 -9.198
27 1HG GLN 157 HG2 GLN 157 2.324 -2.747 -7.998
28 2HG GLN 157 HG1 GLN 157 1.770 -3.565 -9.458
29 1HE2 GLN 157 HE21 GLN 157 4.497 -3.075 -7.313
30 2HE2 GLN 157 HE22 GLN 157 5.346 -4.514 -7.753
31 H SER 158 HN SER 158 2.227 0.857 -8.763
32 HA SER 158 HA SER 158 0.287 0.141 -6.781
33 1HB SER 158 HB2 SER 158 0.914 2.553 -5.955
34 2HB SER 158 HB1 SER 158 2.108 1.248 -5.845
35 HG SER 158 HG SER 158 3.301 2.237 -7.272
36 H ASP 159 HN ASP 159 -1.316 0.134 -8.756
37 HA ASP 159 HA ASP 159 -3.342 0.936 -9.435
38 1HB ASP 159 HB2 ASP 159 -2.963 2.309 -7.077
39 2HB ASP 159 HB1 ASP 159 -3.202 3.607 -8.244
40 H VAL 160 HN VAL 160 -0.960 3.579 -9.269
41 HA VAL 160 HA VAL 160 0.064 4.708 -10.984
42 HB VAL 160 HB VAL 160 -1.066 2.694 -12.478
43 1HG1 VAL 160 HG11 VAL 160 -2.178 3.700 -14.385
44 2HG1 VAL 160 HG12 VAL 160 -2.084 5.291 -13.630
45 3HG1 VAL 160 HG13 VAL 160 -3.085 4.031 -12.911
46 1HG2 VAL 160 HG21 VAL 160 0.442 5.101 -13.487
47 2HG2 VAL 160 HG22 VAL 160 0.310 3.543 -14.303
48 3HG2 VAL 160 HG23 VAL 160 1.152 3.661 -12.758
49 H PHE 161 HN PHE 161 -3.488 4.617 -11.085
50 HA PHE 161 HA PHE 161 -3.758 7.337 -11.872
51 1HB PHE 161 HB2 PHE 161 -5.633 5.326 -10.633
52 2HB PHE 161 HB1 PHE 161 -6.124 6.998 -10.875
53 HD1 PHE 161 HD1 PHE 161 -4.937 7.640 -13.462
54 HD2 PHE 161 HD2 PHE 161 -6.849 4.073 -12.143
55 HE1 PHE 161 HE1 PHE 161 -5.559 7.118 -15.785
56 HE2 PHE 161 HE2 PHE 161 -7.475 3.546 -14.463
57 HZ PHE 161 HZ PHE 161 -6.830 5.069 -16.288
58 H PHE 162 HN PHE 162 -4.262 5.686 -8.763
59 HA PHE 162 HA PHE 162 -4.308 8.133 -7.284
60 1HB PHE 162 HB2 PHE 162 -3.860 5.380 -6.164
61 2HB PHE 162 HB1 PHE 162 -4.525 6.798 -5.349
62 HD1 PHE 162 HD1 PHE 162 -6.485 7.760 -7.292
63 HD2 PHE 162 HD2 PHE 162 -5.541 3.788 -6.097
64 HE1 PHE 162 HE1 PHE 162 -8.758 7.042 -7.899
65 HE2 PHE 162 HE2 PHE 162 -7.811 3.060 -6.702
66 HZ PHE 162 HZ PHE 162 -9.424 4.688 -7.604
67 H LEU 163 HN LEU 163 -1.835 6.186 -8.558
68 HA LEU 163 HA LEU 163 0.208 6.545 -6.628
69 1HB LEU 163 HB2 LEU 163 0.355 4.910 -8.448
70 2HB LEU 163 HB1 LEU 163 0.364 6.212 -9.623
71 HG LEU 163 HG LEU 163 2.534 6.976 -8.771
72 1HD1 LEU 163 HD11 LEU 163 3.639 5.064 -7.275
73 2HD1 LEU 163 HD12 LEU 163 1.971 4.918 -6.724
74 3HD1 LEU 163 HD13 LEU 163 2.814 6.461 -6.584
75 1HD2 LEU 163 HD21 LEU 163 3.008 5.629 -10.523
76 2HD2 LEU 163 HD22 LEU 163 2.090 4.272 -9.869
77 3HD2 LEU 163 HD23 LEU 163 3.710 4.617 -9.260
78 H PHE 164 HN PHE 164 -1.493 8.700 -8.363
79 HA PHE 164 HA PHE 164 0.424 10.614 -9.185
80 1HB PHE 164 HB2 PHE 164 -2.518 10.357 -8.958
81 2HB PHE 164 HB1 PHE 164 -1.890 12.006 -8.926
82 HD1 PHE 164 HD1 PHE 164 -2.424 12.934 -10.978
83 HD2 PHE 164 HD2 PHE 164 -0.721 9.037 -10.839
84 HE1 PHE 164 HE1 PHE 164 -2.261 12.922 -13.433
85 HE2 PHE 164 HE2 PHE 164 -0.554 9.017 -13.294
86 HZ PHE 164 HZ PHE 164 -1.324 10.962 -14.595
87 H LEU 165 HN LEU 165 -1.990 10.678 -6.552
88 HA LEU 165 HA LEU 165 -0.997 12.993 -5.314
89 1HB LEU 165 HB2 LEU 165 -2.983 10.962 -4.746
90 2HB LEU 165 HB1 LEU 165 -2.154 11.480 -3.286
91 HG LEU 165 HG LEU 165 -3.250 13.541 -5.158
92 1HD1 LEU 165 HD11 LEU 165 -4.932 12.365 -2.977
93 2HD1 LEU 165 HD12 LEU 165 -4.986 11.727 -4.619
94 3HD1 LEU 165 HD13 LEU 165 -5.412 13.410 -4.314
95 1HD2 LEU 165 HD21 LEU 165 -1.774 13.965 -3.099
96 2HD2 LEU 165 HD22 LEU 165 -3.210 13.554 -2.161
97 3HD2 LEU 165 HD23 LEU 165 -3.246 14.918 -3.279
98 H LEU 166 HN LEU 166 -0.898 9.744 -3.899
99 HA LEU 166 HA LEU 166 1.911 9.910 -3.347
100 1HB LEU 166 HB2 LEU 166 1.349 11.321 -1.583
101 2HB LEU 166 HB1 LEU 166 -0.148 10.472 -1.252
102 HG LEU 166 HG LEU 166 1.775 10.270 0.443
103 1HD1 LEU 166 HD11 LEU 166 0.784 8.414 1.233
104 2HD1 LEU 166 HD12 LEU 166 0.969 7.536 -0.287
105 3HD1 LEU 166 HD13 LEU 166 -0.343 8.699 -0.094
106 1HD2 LEU 166 HD21 LEU 166 3.341 9.655 -1.589
107 2HD2 LEU 166 HD22 LEU 166 2.771 8.024 -1.232
108 3HD2 LEU 166 HD23 LEU 166 3.596 8.961 0.013
109 HA PRO 167 HA PRO 167 0.917 5.550 -3.803
110 1HB PRO 167 HB2 PRO 167 3.469 4.673 -3.146
111 2HB PRO 167 HB1 PRO 167 2.935 5.126 -4.775
112 1HG PRO 167 HG2 PRO 167 4.461 6.720 -2.761
113 2HG PRO 167 HG1 PRO 167 4.660 6.646 -4.521
114 1HD PRO 167 HD2 PRO 167 3.434 8.714 -3.330
115 2HD PRO 167 HD1 PRO 167 2.892 8.098 -4.905
116 HA PRO 168 HA PRO 168 0.402 4.931 0.647
117 1HB PRO 168 HB2 PRO 168 -1.581 3.137 0.516
118 2HB PRO 168 HB1 PRO 168 -1.855 4.854 0.151
119 1HG PRO 168 HG2 PRO 168 -1.486 2.547 -1.725
120 2HG PRO 168 HG1 PRO 168 -2.629 3.899 -1.822
121 1HD PRO 168 HD2 PRO 168 -0.258 3.770 -3.213
122 2HD PRO 168 HD1 PRO 168 -1.093 5.280 -2.799
123 H ILE 169 HN ILE 169 2.466 3.434 -0.946
124 HA ILE 169 HA ILE 169 2.219 0.693 -0.160
125 HB ILE 169 HB ILE 169 3.470 1.043 -2.123
126 1HG1 ILE 169 HG12 ILE 169 5.913 0.667 -0.577
127 2HG1 ILE 169 HG11 ILE 169 4.576 -0.297 0.043
128 1HG2 ILE 169 HG21 ILE 169 4.442 3.376 -0.761
129 2HG2 ILE 169 HG22 ILE 169 4.440 2.996 -2.483
130 3HG2 ILE 169 HG23 ILE 169 5.779 2.466 -1.465
131 1HD1 ILE 169 HD11 ILE 169 5.638 -1.681 -1.495
132 2HD1 ILE 169 HD12 ILE 169 5.848 -0.378 -2.664
133 3HD1 ILE 169 HD13 ILE 169 4.244 -1.051 -2.373
134 H ILE 170 HN ILE 170 5.281 2.168 0.582
135 HA ILE 170 HA ILE 170 6.556 1.779 2.471
136 HB ILE 170 HB ILE 170 4.522 3.743 3.507
137 1HG1 ILE 170 HG12 ILE 170 6.632 5.193 2.453
138 2HG1 ILE 170 HG11 ILE 170 6.385 3.922 1.259
139 1HG2 ILE 170 HG21 ILE 170 7.211 2.873 4.330
140 2HG2 ILE 170 HG22 ILE 170 5.891 3.552 5.284
141 3HG2 ILE 170 HG23 ILE 170 6.935 4.616 4.342
142 1HD1 ILE 170 HD11 ILE 170 3.867 5.044 2.063
143 2HD1 ILE 170 HD12 ILE 170 4.598 4.953 0.461
144 3HD1 ILE 170 HD13 ILE 170 4.972 6.309 1.524
145 H LEU 171 HN LEU 171 3.296 2.208 3.718
146 HA LEU 171 HA LEU 171 3.745 0.588 6.018
147 1HB LEU 171 HB2 LEU 171 1.279 0.758 6.333
148 2HB LEU 171 HB1 LEU 171 2.102 2.297 6.178
149 HG LEU 171 HG LEU 171 1.377 1.996 3.630
150 1HD1 LEU 171 HD11 LEU 171 -0.286 0.570 3.204
151 2HD1 LEU 171 HD12 LEU 171 -1.127 0.959 4.704
152 3HD1 LEU 171 HD13 LEU 171 0.184 -0.220 4.710
153 1HD2 LEU 171 HD21 LEU 171 0.739 3.692 5.564
154 2HD2 LEU 171 HD22 LEU 171 -0.811 2.859 5.438
155 3HD2 LEU 171 HD23 LEU 171 -0.123 3.661 4.026
156 H ASP 172 HN ASP 172 1.942 0.038 3.028
157 HA ASP 172 HA ASP 172 1.193 -2.621 3.673
158 1HB ASP 172 HB2 ASP 172 1.102 -0.922 1.212
159 2HB ASP 172 HB1 ASP 172 0.863 -2.669 1.055
160 H ALA 173 HN ALA 173 4.170 -1.321 2.885
161 HA ALA 173 HA ALA 173 5.165 -3.447 1.253
162 1HB ALA 173 HB1 ALA 173 6.862 -1.564 2.865
163 2HB ALA 173 HB2 ALA 173 6.064 -1.060 1.376
164 3HB ALA 173 HB3 ALA 173 7.250 -2.367 1.344
165 H GLY 174 HN GLY 174 5.860 -2.441 4.611
166 1HA GLY 174 HA2 GLY 174 6.597 -5.248 5.182
167 2HA GLY 174 HA1 GLY 174 7.241 -3.841 6.050
168 H TYR 175 HN TYR 175 4.622 -2.532 6.144
169 HA TYR 175 HA TYR 175 2.718 -2.427 7.379
170 1HB TYR 175 HB2 TYR 175 2.790 -5.098 6.658
171 2HB TYR 175 HB1 TYR 175 2.656 -5.163 8.412
172 HD1 TYR 175 HD1 TYR 175 1.154 -3.189 5.607
173 HD2 TYR 175 HD2 TYR 175 0.515 -5.320 9.233
174 HE1 TYR 175 HE1 TYR 175 -1.259 -2.750 5.432
175 HE2 TYR 175 HE2 TYR 175 -1.901 -4.888 9.068
176 HH TYR 175 HH TYR 175 -3.348 -3.601 6.225
177 H PHE 176 HN PHE 176 5.417 -4.231 8.771
178 HA PHE 176 HA PHE 176 4.679 -3.367 11.452
179 1HB PHE 176 HB2 PHE 176 5.882 -5.652 10.524
180 2HB PHE 176 HB1 PHE 176 7.272 -4.717 11.094
181 HD1 PHE 176 HD1 PHE 176 5.715 -7.350 12.096
182 HD2 PHE 176 HD2 PHE 176 6.029 -3.313 13.405
183 HE1 PHE 176 HE1 PHE 176 5.237 -8.064 14.402
184 HE2 PHE 176 HE2 PHE 176 5.552 -4.020 15.712
185 HZ PHE 176 HZ PHE 176 5.156 -6.399 16.213
186 H LEU 177 HN LEU 177 6.060 -1.915 8.921
187 HA LEU 177 HA LEU 177 8.483 -0.870 9.818
188 1HB LEU 177 HB2 LEU 177 6.450 -0.099 7.809
189 2HB LEU 177 HB1 LEU 177 7.564 1.157 8.313
190 HG LEU 177 HG LEU 177 8.676 -1.481 7.491
191 1HD1 LEU 177 HD11 LEU 177 8.440 -1.152 5.231
192 2HD1 LEU 177 HD12 LEU 177 8.149 0.581 5.403
193 3HD1 LEU 177 HD13 LEU 177 6.884 -0.574 5.826
194 1HD2 LEU 177 HD21 LEU 177 10.067 0.371 8.417
195 2HD2 LEU 177 HD22 LEU 177 9.619 1.341 7.014
196 3HD2 LEU 177 HD23 LEU 177 10.541 -0.147 6.798
197 HA PRO 178 HA PRO 178 5.752 2.890 11.515
198 1HB PRO 178 HB2 PRO 178 3.330 1.260 12.127
199 2HB PRO 178 HB1 PRO 178 3.446 2.937 11.578
200 1HG PRO 178 HG2 PRO 178 2.693 1.026 9.901
201 2HG PRO 178 HG1 PRO 178 3.785 2.315 9.362
202 1HD PRO 178 HD2 PRO 178 4.407 -0.519 10.088
203 2HD PRO 178 HD1 PRO 178 5.071 0.485 8.785
204 H LEU 179 HN LEU 179 4.563 3.006 13.849
205 HA LEU 179 HA LEU 179 4.579 2.478 16.069
206 1HB LEU 179 HB2 LEU 179 6.004 -0.096 15.443
207 2HB LEU 179 HB1 LEU 179 5.036 0.291 16.852
208 HG LEU 179 HG LEU 179 4.017 -0.171 14.049
209 1HD1 LEU 179 HD11 LEU 179 4.706 -2.172 15.369
210 2HD1 LEU 179 HD12 LEU 179 2.995 -2.137 14.940
211 3HD1 LEU 179 HD13 LEU 179 3.501 -1.723 16.577
212 1HD2 LEU 179 HD21 LEU 179 2.617 1.495 14.931
213 2HD2 LEU 179 HD22 LEU 179 2.640 0.781 16.542
214 3HD2 LEU 179 HD23 LEU 179 1.769 -0.021 15.235
215 H ARG 180 HN ARG 180 6.132 4.277 15.851
216 HA ARG 180 HA ARG 180 8.032 5.309 16.564
217 1HB ARG 180 HB2 ARG 180 8.910 2.639 17.671
218 2HB ARG 180 HB1 ARG 180 9.411 4.249 18.204
219 1HG ARG 180 HG2 ARG 180 6.575 3.261 18.410
220 2HG ARG 180 HG1 ARG 180 7.772 3.042 19.689
221 1HD ARG 180 HD2 ARG 180 7.044 5.025 20.435
222 2HD ARG 180 HD1 ARG 180 8.028 5.700 19.137
223 HE ARG 180 HE ARG 180 5.681 5.241 17.908
224 1HH1 ARG 180 1HH1 ARG 180 6.484 6.867 20.891
225 2HH1 ARG 180 2HH1 ARG 180 5.143 7.959 20.800
226 1HH2 ARG 180 1HH2 ARG 180 3.920 6.676 17.789
227 2HH2 ARG 180 2HH2 ARG 180 3.688 7.851 19.041
228 1HG HSL 181 HG1 HSL 181 10.889 3.708 10.393
229 2HG HSL 181 HG2 HSL 181 9.301 4.391 9.762
230 H HSL 181 HN HSL 181 8.050 4.920 14.024
231 HA HSL 181 HA HSL 181 10.785 3.722 13.328
232 1HB HSL 181 HB1 HSL 181 9.443 2.467 11.841
233 2HB HSL 181 HB2 HSL 181 8.130 3.762 11.780
Start of MODEL 21
1 1H PHE 155 HT1 PHE 155 3.239 9.630 2.387
2 2H PHE 155 HT2 PHE 155 3.405 9.185 4.035
3 3H PHE 155 HT3 PHE 155 4.781 9.669 3.131
4 HA PHE 155 HA PHE 155 2.488 11.446 3.512
5 1HB PHE 155 HB2 PHE 155 4.865 11.028 5.339
6 2HB PHE 155 HB1 PHE 155 3.755 12.389 5.449
7 HD1 PHE 155 HD1 PHE 155 4.417 9.042 6.451
8 HD2 PHE 155 HD2 PHE 155 1.285 11.861 5.856
9 HE1 PHE 155 HE1 PHE 155 2.948 7.712 7.909
10 HE2 PHE 155 HE2 PHE 155 -0.189 10.537 7.314
11 HZ PHE 155 HZ PHE 155 0.642 8.459 8.343
12 H LEU 156 HN LEU 156 6.001 11.691 3.922
13 HA LEU 156 HA LEU 156 6.450 12.970 1.431
14 1HB LEU 156 HB2 LEU 156 6.995 15.184 2.300
15 2HB LEU 156 HB1 LEU 156 5.313 14.781 2.567
16 HG LEU 156 HG LEU 156 6.596 13.967 4.893
17 1HD1 LEU 156 HD11 LEU 156 8.357 15.691 3.731
18 2HD1 LEU 156 HD12 LEU 156 8.221 15.396 5.465
19 3HD1 LEU 156 HD13 LEU 156 7.397 16.775 4.736
20 1HD2 LEU 156 HD21 LEU 156 5.496 16.291 5.631
21 2HD2 LEU 156 HD22 LEU 156 4.548 14.845 5.283
22 3HD2 LEU 156 HD23 LEU 156 4.731 16.097 4.054
23 H GLN 157 HN GLN 157 7.844 10.982 1.904
24 HA GLN 157 HA GLN 157 10.500 11.840 2.342
25 1HB GLN 157 HB2 GLN 157 10.917 10.326 4.356
26 2HB GLN 157 HB1 GLN 157 10.117 11.864 4.647
27 1HG GLN 157 HG2 GLN 157 7.932 10.560 4.490
28 2HG GLN 157 HG1 GLN 157 8.930 9.113 4.629
29 1HE2 GLN 157 HE21 GLN 157 10.685 9.487 6.465
30 2HE2 GLN 157 HE22 GLN 157 10.009 9.976 7.977
31 H SER 158 HN SER 158 8.232 9.289 1.686
32 HA SER 158 HA SER 158 10.083 7.188 1.433
33 1HB SER 158 HB2 SER 158 7.866 6.482 1.681
34 2HB SER 158 HB1 SER 158 7.288 7.615 0.447
35 HG SER 158 HG SER 158 8.781 5.233 0.068
36 H ASP 159 HN ASP 159 8.848 9.529 -0.780
37 HA ASP 159 HA ASP 159 11.096 9.331 -2.495
38 1HB ASP 159 HB2 ASP 159 8.639 7.818 -3.196
39 2HB ASP 159 HB1 ASP 159 9.379 8.757 -4.490
40 H VAL 160 HN VAL 160 7.787 10.278 -1.980
41 HA VAL 160 HA VAL 160 6.684 12.249 -2.263
42 HB VAL 160 HB VAL 160 9.277 13.035 -1.665
43 1HG1 VAL 160 HG11 VAL 160 8.331 14.623 -4.049
44 2HG1 VAL 160 HG12 VAL 160 9.765 13.599 -3.977
45 3HG1 VAL 160 HG13 VAL 160 9.674 15.058 -2.993
46 1HG2 VAL 160 HG21 VAL 160 7.494 13.874 -0.422
47 2HG2 VAL 160 HG22 VAL 160 6.670 14.500 -1.851
48 3HG2 VAL 160 HG23 VAL 160 8.132 15.288 -1.260
49 H PHE 161 HN PHE 161 9.209 11.897 -4.754
50 HA PHE 161 HA PHE 161 7.686 13.179 -6.786
51 1HB PHE 161 HB2 PHE 161 10.327 11.967 -6.532
52 2HB PHE 161 HB1 PHE 161 9.579 11.621 -8.086
53 HD1 PHE 161 HD1 PHE 161 10.096 14.505 -5.776
54 HD2 PHE 161 HD2 PHE 161 9.935 13.109 -9.794
55 HE1 PHE 161 HE1 PHE 161 10.737 16.741 -6.575
56 HE2 PHE 161 HE2 PHE 161 10.576 15.344 -10.599
57 HZ PHE 161 HZ PHE 161 10.978 17.163 -8.990
58 H PHE 162 HN PHE 162 7.160 10.337 -5.281
59 HA PHE 162 HA PHE 162 5.456 9.374 -7.375
60 1HB PHE 162 HB2 PHE 162 7.591 7.500 -6.368
61 2HB PHE 162 HB1 PHE 162 6.404 7.209 -7.643
62 HD1 PHE 162 HD1 PHE 162 6.663 8.265 -9.838
63 HD2 PHE 162 HD2 PHE 162 9.602 8.708 -6.794
64 HE1 PHE 162 HE1 PHE 162 8.277 9.056 -11.518
65 HE2 PHE 162 HE2 PHE 162 11.223 9.501 -8.467
66 HZ PHE 162 HZ PHE 162 10.561 9.676 -10.832
67 H LEU 163 HN LEU 163 5.762 10.137 -4.328
68 HA LEU 163 HA LEU 163 4.801 7.857 -2.914
69 1HB LEU 163 HB2 LEU 163 5.877 9.723 -1.756
70 2HB LEU 163 HB1 LEU 163 4.611 10.809 -2.297
71 HG LEU 163 HG LEU 163 2.973 9.508 -0.953
72 1HD1 LEU 163 HD11 LEU 163 5.453 8.009 -0.168
73 2HD1 LEU 163 HD12 LEU 163 3.936 7.368 -0.798
74 3HD1 LEU 163 HD13 LEU 163 4.003 8.032 0.834
75 1HD2 LEU 163 HD21 LEU 163 3.351 10.840 0.808
76 2HD2 LEU 163 HD22 LEU 163 4.700 11.452 -0.148
77 3HD2 LEU 163 HD23 LEU 163 4.976 10.203 1.066
78 H PHE 164 HN PHE 164 3.526 9.775 -5.271
79 HA PHE 164 HA PHE 164 0.802 9.992 -4.451
80 1HB PHE 164 HB2 PHE 164 2.395 11.098 -6.409
81 2HB PHE 164 HB1 PHE 164 1.360 10.017 -7.331
82 HD1 PHE 164 HD1 PHE 164 1.542 13.083 -5.407
83 HD2 PHE 164 HD2 PHE 164 -1.081 10.337 -7.327
84 HE1 PHE 164 HE1 PHE 164 -0.255 14.763 -5.346
85 HE2 PHE 164 HE2 PHE 164 -2.884 12.012 -7.270
86 HZ PHE 164 HZ PHE 164 -2.471 14.228 -6.279
87 H LEU 165 HN LEU 165 2.694 7.655 -6.270
88 HA LEU 165 HA LEU 165 0.573 6.232 -7.447
89 1HB LEU 165 HB2 LEU 165 3.323 6.075 -7.480
90 2HB LEU 165 HB1 LEU 165 2.855 4.589 -6.671
91 HG LEU 165 HG LEU 165 1.578 5.370 -9.272
92 1HD1 LEU 165 HD11 LEU 165 3.433 3.619 -10.085
93 2HD1 LEU 165 HD12 LEU 165 4.342 4.439 -8.815
94 3HD1 LEU 165 HD13 LEU 165 3.659 5.366 -10.150
95 1HD2 LEU 165 HD21 LEU 165 0.444 3.566 -8.412
96 2HD2 LEU 165 HD22 LEU 165 1.875 2.904 -7.622
97 3HD2 LEU 165 HD23 LEU 165 1.686 2.756 -9.368
98 H LEU 166 HN LEU 166 2.112 5.993 -4.296
99 HA LEU 166 HA LEU 166 -0.142 4.594 -3.225
100 1HB LEU 166 HB2 LEU 166 1.909 3.052 -4.334
101 2HB LEU 166 HB1 LEU 166 2.194 2.995 -2.603
102 HG LEU 166 HG LEU 166 0.844 1.111 -3.207
103 1HD1 LEU 166 HD11 LEU 166 0.319 2.353 -1.098
104 2HD1 LEU 166 HD12 LEU 166 -1.007 1.383 -1.738
105 3HD1 LEU 166 HD13 LEU 166 -1.006 3.133 -1.963
106 1HD2 LEU 166 HD21 LEU 166 -1.215 1.243 -4.385
107 2HD2 LEU 166 HD22 LEU 166 -0.025 2.149 -5.320
108 3HD2 LEU 166 HD23 LEU 166 -1.207 3.006 -4.329
109 HA PRO 167 HA PRO 167 1.936 7.746 -0.457
110 1HB PRO 167 HB2 PRO 167 -0.486 7.344 1.086
111 2HB PRO 167 HB1 PRO 167 0.096 8.814 0.286
112 1HG PRO 167 HG2 PRO 167 -1.902 6.889 -0.615
113 2HG PRO 167 HG1 PRO 167 -1.539 8.503 -1.243
114 1HD PRO 167 HD2 PRO 167 -1.006 6.190 -2.594
115 2HD PRO 167 HD1 PRO 167 -0.090 7.694 -2.820
116 HA PRO 168 HA PRO 168 1.690 4.533 2.998
117 1HB PRO 168 HB2 PRO 168 -0.094 2.587 3.018
118 2HB PRO 168 HB1 PRO 168 -0.606 4.268 3.277
119 1HG PRO 168 HG2 PRO 168 -0.800 2.595 0.800
120 2HG PRO 168 HG1 PRO 168 -1.996 3.701 1.499
121 1HD PRO 168 HD2 PRO 168 -0.222 4.329 -0.561
122 2HD PRO 168 HD1 PRO 168 -1.086 5.503 0.450
123 H ILE 169 HN ILE 169 3.521 4.192 1.159
124 HA ILE 169 HA ILE 169 3.613 1.584 -0.011
125 HB ILE 169 HB ILE 169 4.848 3.713 -0.770
126 1HG1 ILE 169 HG12 ILE 169 6.963 2.043 -1.230
127 2HG1 ILE 169 HG11 ILE 169 5.693 0.895 -0.818
128 1HG2 ILE 169 HG21 ILE 169 5.917 4.201 1.382
129 2HG2 ILE 169 HG22 ILE 169 7.091 4.032 0.077
130 3HG2 ILE 169 HG23 ILE 169 6.864 2.721 1.233
131 1HD1 ILE 169 HD11 ILE 169 6.155 1.919 -3.295
132 2HD1 ILE 169 HD12 ILE 169 4.853 2.952 -2.708
133 3HD1 ILE 169 HD13 ILE 169 4.637 1.202 -2.756
134 H ILE 170 HN ILE 170 5.017 3.107 2.812
135 HA ILE 170 HA ILE 170 6.589 0.915 3.663
136 HB ILE 170 HB ILE 170 5.502 3.101 5.429
137 1HG1 ILE 170 HG12 ILE 170 8.082 3.820 4.725
138 2HG1 ILE 170 HG11 ILE 170 7.404 3.233 3.211
139 1HG2 ILE 170 HG21 ILE 170 6.867 0.911 6.156
140 2HG2 ILE 170 HG22 ILE 170 7.011 2.462 6.982
141 3HG2 ILE 170 HG23 ILE 170 8.211 1.989 5.780
142 1HD1 ILE 170 HD11 ILE 170 5.402 4.782 3.853
143 2HD1 ILE 170 HD12 ILE 170 6.860 5.451 3.120
144 3HD1 ILE 170 HD13 ILE 170 6.612 5.575 4.862
145 H LEU 171 HN LEU 171 3.294 1.973 4.334
146 HA LEU 171 HA LEU 171 2.782 0.152 6.450
147 1HB LEU 171 HB2 LEU 171 1.053 1.702 4.543
148 2HB LEU 171 HB1 LEU 171 0.335 0.497 5.596
149 HG LEU 171 HG LEU 171 1.268 1.725 7.554
150 1HD1 LEU 171 HD11 LEU 171 2.365 3.392 5.376
151 2HD1 LEU 171 HD12 LEU 171 3.016 3.037 6.976
152 3HD1 LEU 171 HD13 LEU 171 1.742 4.241 6.791
153 1HD2 LEU 171 HD21 LEU 171 -0.274 3.772 7.190
154 2HD2 LEU 171 HD22 LEU 171 -0.980 2.156 7.202
155 3HD2 LEU 171 HD23 LEU 171 -0.687 2.978 5.670
156 H ASP 172 HN ASP 172 1.997 0.105 3.006
157 HA ASP 172 HA ASP 172 1.186 -2.644 3.028
158 1HB ASP 172 HB2 ASP 172 1.680 -0.649 0.811
159 2HB ASP 172 HB1 ASP 172 1.217 -2.328 0.499
160 H ALA 173 HN ALA 173 4.167 -1.157 3.182
161 HA ALA 173 HA ALA 173 5.664 -2.855 1.449
162 1HB ALA 173 HB1 ALA 173 6.376 -0.893 3.579
163 2HB ALA 173 HB2 ALA 173 6.774 -0.873 1.863
164 3HB ALA 173 HB3 ALA 173 7.602 -1.987 2.947
165 H GLY 174 HN GLY 174 6.013 -2.508 4.952
166 1HA GLY 174 HA2 GLY 174 6.240 -5.451 5.160
167 2HA GLY 174 HA1 GLY 174 7.153 -4.316 6.172
168 H TYR 175 HN TYR 175 4.491 -2.684 6.111
169 HA TYR 175 HA TYR 175 2.590 -2.461 7.333
170 1HB TYR 175 HB2 TYR 175 2.460 -5.060 6.700
171 2HB TYR 175 HB1 TYR 175 2.658 -5.219 8.442
172 HD1 TYR 175 HD1 TYR 175 0.248 -5.520 6.201
173 HD2 TYR 175 HD2 TYR 175 1.128 -3.004 9.517
174 HE1 TYR 175 HE1 TYR 175 -2.154 -5.086 6.502
175 HE2 TYR 175 HE2 TYR 175 -1.271 -2.564 9.827
176 HH TYR 175 HH TYR 175 -3.341 -2.613 8.482
177 H PHE 176 HN PHE 176 5.046 -4.467 8.977
178 HA PHE 176 HA PHE 176 4.447 -3.132 11.499
179 1HB PHE 176 HB2 PHE 176 5.202 -5.727 10.861
180 2HB PHE 176 HB1 PHE 176 6.674 -5.017 11.537
181 HD1 PHE 176 HD1 PHE 176 3.018 -4.872 12.313
182 HD2 PHE 176 HD2 PHE 176 6.976 -5.487 13.750
183 HE1 PHE 176 HE1 PHE 176 2.136 -5.229 14.582
184 HE2 PHE 176 HE2 PHE 176 6.101 -5.844 16.021
185 HZ PHE 176 HZ PHE 176 3.677 -5.716 16.440
186 H LEU 177 HN LEU 177 5.965 -2.000 9.044
187 HA LEU 177 HA LEU 177 8.537 -1.381 10.269
188 1HB LEU 177 HB2 LEU 177 7.636 -0.253 7.651
189 2HB LEU 177 HB1 LEU 177 9.257 -0.640 8.191
190 HG LEU 177 HG LEU 177 7.129 -2.598 7.331
191 1HD1 LEU 177 HD11 LEU 177 8.416 -2.978 5.431
192 2HD1 LEU 177 HD12 LEU 177 9.849 -2.225 6.133
193 3HD1 LEU 177 HD13 LEU 177 8.485 -1.227 5.631
194 1HD2 LEU 177 HD21 LEU 177 8.593 -4.366 7.853
195 2HD2 LEU 177 HD22 LEU 177 8.587 -3.329 9.280
196 3HD2 LEU 177 HD23 LEU 177 9.942 -3.269 8.151
197 HA PRO 178 HA PRO 178 6.505 3.031 9.749
198 1HB PRO 178 HB2 PRO 178 3.633 2.397 9.905
199 2HB PRO 178 HB1 PRO 178 4.488 3.480 8.803
200 1HG PRO 178 HG2 PRO 178 3.476 1.140 7.973
201 2HG PRO 178 HG1 PRO 178 4.991 1.787 7.317
202 1HD PRO 178 HD2 PRO 178 4.573 -0.358 9.365
203 2HD PRO 178 HD1 PRO 178 5.737 -0.291 8.026
204 H LEU 179 HN LEU 179 5.812 0.495 11.874
205 HA LEU 179 HA LEU 179 4.310 1.709 13.872
206 1HB LEU 179 HB2 LEU 179 6.504 -0.344 14.145
207 2HB LEU 179 HB1 LEU 179 5.353 0.065 15.403
208 HG LEU 179 HG LEU 179 4.769 -1.279 12.769
209 1HD1 LEU 179 HD11 LEU 179 5.018 -2.141 15.586
210 2HD1 LEU 179 HD12 LEU 179 5.384 -3.006 14.094
211 3HD1 LEU 179 HD13 LEU 179 3.715 -2.860 14.640
212 1HD2 LEU 179 HD21 LEU 179 2.889 0.040 12.989
213 2HD2 LEU 179 HD22 LEU 179 2.958 0.030 14.751
214 3HD2 LEU 179 HD23 LEU 179 2.417 -1.406 13.882
215 H ARG 180 HN ARG 180 7.516 2.355 12.882
216 HA ARG 180 HA ARG 180 7.789 4.310 15.024
217 1HB ARG 180 HB2 ARG 180 9.913 2.248 14.386
218 2HB ARG 180 HB1 ARG 180 10.137 3.640 15.449
219 1HG ARG 180 HG2 ARG 180 9.669 2.094 17.028
220 2HG ARG 180 HG1 ARG 180 8.016 2.572 16.645
221 1HD ARG 180 HD2 ARG 180 8.717 0.038 16.748
222 2HD ARG 180 HD1 ARG 180 7.555 0.614 15.558
223 HE ARG 180 HE ARG 180 9.020 -0.006 13.933
224 1HH1 ARG 180 1HH1 ARG 180 10.816 0.464 16.889
225 2HH1 ARG 180 2HH1 ARG 180 12.317 -0.067 16.208
226 1HH2 ARG 180 1HH2 ARG 180 10.994 -0.704 13.037
227 2HH2 ARG 180 2HH2 ARG 180 12.419 -0.730 14.021
228 1HG HSL 181 HG1 HSL 181 8.552 7.058 8.615
229 2HG HSL 181 HG2 HSL 181 6.749 6.720 8.465
230 H HSL 181 HN HSL 181 7.008 4.869 12.543
231 HA HSL 181 HA HSL 181 9.484 6.045 11.176
232 1HB HSL 181 HB1 HSL 181 8.601 4.784 9.375
233 2HB HSL 181 HB2 HSL 181 6.879 4.879 10.032
Start of MODEL 22
1 1H PHE 155 HT1 PHE 155 -3.502 12.076 -1.078
2 2H PHE 155 HT2 PHE 155 -2.957 10.509 -0.641
3 3H PHE 155 HT3 PHE 155 -1.829 11.788 -0.837
4 HA PHE 155 HA PHE 155 -3.892 11.523 1.231
5 1HB PHE 155 HB2 PHE 155 -1.395 10.420 1.054
6 2HB PHE 155 HB1 PHE 155 -1.076 11.911 1.931
7 HD1 PHE 155 HD1 PHE 155 -3.463 9.046 1.948
8 HD2 PHE 155 HD2 PHE 155 -1.248 11.880 4.223
9 HE1 PHE 155 HE1 PHE 155 -4.237 7.978 4.025
10 HE2 PHE 155 HE2 PHE 155 -2.017 10.817 6.304
11 HZ PHE 155 HZ PHE 155 -3.513 8.862 6.207
12 H LEU 156 HN LEU 156 -2.372 13.675 -0.782
13 HA LEU 156 HA LEU 156 -2.287 15.919 -0.855
14 1HB LEU 156 HB2 LEU 156 -4.265 15.449 1.294
15 2HB LEU 156 HB1 LEU 156 -3.568 17.054 1.210
16 HG LEU 156 HG LEU 156 -4.748 15.793 -1.239
17 1HD1 LEU 156 HD11 LEU 156 -6.560 15.569 0.229
18 2HD1 LEU 156 HD12 LEU 156 -6.843 17.097 -0.606
19 3HD1 LEU 156 HD13 LEU 156 -6.205 17.095 1.038
20 1HD2 LEU 156 HD21 LEU 156 -3.793 17.721 -1.943
21 2HD2 LEU 156 HD22 LEU 156 -3.874 18.474 -0.349
22 3HD2 LEU 156 HD23 LEU 156 -5.313 18.405 -1.367
23 H GLN 157 HN GLN 157 -0.020 14.923 -0.037
24 HA GLN 157 HA GLN 157 1.101 16.950 1.589
25 1HB GLN 157 HB2 GLN 157 0.266 14.466 2.908
26 2HB GLN 157 HB1 GLN 157 1.947 14.893 3.199
27 1HG GLN 157 HG2 GLN 157 0.756 17.276 3.624
28 2HG GLN 157 HG1 GLN 157 -0.522 16.176 4.136
29 1HE2 GLN 157 HE21 GLN 157 -0.220 17.002 6.264
30 2HE2 GLN 157 HE22 GLN 157 1.079 16.432 7.250
31 H SER 158 HN SER 158 1.715 13.508 0.867
32 HA SER 158 HA SER 158 4.496 13.982 0.392
33 1HB SER 158 HB2 SER 158 3.274 11.501 -0.676
34 2HB SER 158 HB1 SER 158 4.704 11.713 0.348
35 HG SER 158 HG SER 158 3.485 11.613 2.096
36 H ASP 159 HN ASP 159 3.614 15.788 -1.190
37 HA ASP 159 HA ASP 159 3.861 16.581 -3.318
38 1HB ASP 159 HB2 ASP 159 5.310 14.233 -3.414
39 2HB ASP 159 HB1 ASP 159 4.158 14.037 -4.731
40 H VAL 160 HN VAL 160 2.110 13.493 -3.240
41 HA VAL 160 HA VAL 160 -0.070 13.022 -3.732
42 HB VAL 160 HB VAL 160 -0.227 15.836 -4.802
43 1HG1 VAL 160 HG11 VAL 160 -2.144 13.596 -4.724
44 2HG1 VAL 160 HG12 VAL 160 -2.028 14.951 -5.846
45 3HG1 VAL 160 HG13 VAL 160 -2.771 15.177 -4.263
46 1HG2 VAL 160 HG21 VAL 160 -1.379 16.396 -2.753
47 2HG2 VAL 160 HG22 VAL 160 0.202 15.711 -2.376
48 3HG2 VAL 160 HG23 VAL 160 -1.253 14.729 -2.195
49 H PHE 161 HN PHE 161 1.128 15.218 -6.264
50 HA PHE 161 HA PHE 161 0.309 13.446 -8.373
51 1HB PHE 161 HB2 PHE 161 1.381 16.157 -8.135
52 2HB PHE 161 HB1 PHE 161 2.055 15.282 -9.504
53 HD1 PHE 161 HD1 PHE 161 -0.137 17.665 -8.978
54 HD2 PHE 161 HD2 PHE 161 -0.167 13.663 -10.423
55 HE1 PHE 161 HE1 PHE 161 -2.168 18.154 -10.279
56 HE2 PHE 161 HE2 PHE 161 -2.197 14.144 -11.726
57 HZ PHE 161 HZ PHE 161 -3.201 16.391 -11.655
58 H PHE 162 HN PHE 162 1.921 12.004 -6.699
59 HA PHE 162 HA PHE 162 3.925 11.015 -8.434
60 1HB PHE 162 HB2 PHE 162 4.821 13.204 -7.240
61 2HB PHE 162 HB1 PHE 162 5.126 12.067 -5.928
62 HD1 PHE 162 HD1 PHE 162 7.104 10.872 -5.897
63 HD2 PHE 162 HD2 PHE 162 5.743 12.531 -9.573
64 HE1 PHE 162 HE1 PHE 162 9.202 10.183 -6.981
65 HE2 PHE 162 HE2 PHE 162 7.839 11.844 -10.663
66 HZ PHE 162 HZ PHE 162 9.572 10.669 -9.367
67 H LEU 163 HN LEU 163 3.180 11.367 -4.983
68 HA LEU 163 HA LEU 163 3.911 8.715 -4.244
69 1HB LEU 163 HB2 LEU 163 3.691 10.722 -2.732
70 2HB LEU 163 HB1 LEU 163 1.952 10.553 -2.894
71 HG LEU 163 HG LEU 163 2.639 8.051 -2.079
72 1HD1 LEU 163 HD11 LEU 163 4.621 9.981 -0.915
73 2HD1 LEU 163 HD12 LEU 163 4.918 8.412 -1.664
74 3HD1 LEU 163 HD13 LEU 163 4.149 8.502 -0.079
75 1HD2 LEU 163 HD21 LEU 163 0.912 8.841 -0.874
76 2HD2 LEU 163 HD22 LEU 163 1.566 10.477 -0.815
77 3HD2 LEU 163 HD23 LEU 163 2.164 9.247 0.299
78 H PHE 164 HN PHE 164 1.548 9.784 -6.175
79 HA PHE 164 HA PHE 164 -0.757 8.396 -5.344
80 1HB PHE 164 HB2 PHE 164 -0.108 10.333 -7.190
81 2HB PHE 164 HB1 PHE 164 -0.495 8.947 -8.208
82 HD1 PHE 164 HD1 PHE 164 -1.920 11.761 -7.449
83 HD2 PHE 164 HD2 PHE 164 -2.621 7.641 -6.644
84 HE1 PHE 164 HE1 PHE 164 -4.320 12.226 -7.176
85 HE2 PHE 164 HE2 PHE 164 -5.022 8.099 -6.371
86 HZ PHE 164 HZ PHE 164 -5.876 10.395 -6.637
87 H LEU 165 HN LEU 165 2.091 7.334 -6.995
88 HA LEU 165 HA LEU 165 0.915 5.219 -8.489
89 1HB LEU 165 HB2 LEU 165 3.509 4.380 -7.755
90 2HB LEU 165 HB1 LEU 165 2.975 5.025 -9.295
91 HG LEU 165 HG LEU 165 3.417 7.343 -8.214
92 1HD1 LEU 165 HD11 LEU 165 5.004 5.514 -6.419
93 2HD1 LEU 165 HD12 LEU 165 3.732 6.635 -5.937
94 3HD1 LEU 165 HD13 LEU 165 5.263 7.253 -6.553
95 1HD2 LEU 165 HD21 LEU 165 4.810 6.927 -9.961
96 2HD2 LEU 165 HD22 LEU 165 5.319 5.362 -9.327
97 3HD2 LEU 165 HD23 LEU 165 5.989 6.846 -8.650
98 H LEU 166 HN LEU 166 2.131 5.490 -5.213
99 HA LEU 166 HA LEU 166 0.632 3.192 -4.392
100 1HB LEU 166 HB2 LEU 166 3.157 2.684 -5.360
101 2HB LEU 166 HB1 LEU 166 3.437 2.816 -3.633
102 HG LEU 166 HG LEU 166 1.172 1.096 -4.459
103 1HD1 LEU 166 HD11 LEU 166 2.512 -0.751 -5.106
104 2HD1 LEU 166 HD12 LEU 166 4.003 0.117 -4.737
105 3HD1 LEU 166 HD13 LEU 166 3.007 0.615 -6.106
106 1HD2 LEU 166 HD21 LEU 166 3.315 0.253 -2.598
107 2HD2 LEU 166 HD22 LEU 166 1.565 0.063 -2.477
108 3HD2 LEU 166 HD23 LEU 166 2.312 1.618 -2.106
109 HA PRO 167 HA PRO 167 1.143 6.905 -1.483
110 1HB PRO 167 HB2 PRO 167 -1.325 5.828 -0.408
111 2HB PRO 167 HB1 PRO 167 -1.023 7.412 -1.138
112 1HG PRO 167 HG2 PRO 167 -2.221 5.037 -2.324
113 2HG PRO 167 HG1 PRO 167 -2.184 6.695 -2.938
114 1HD PRO 167 HD2 PRO 167 -0.804 4.612 -4.058
115 2HD PRO 167 HD1 PRO 167 -0.310 6.312 -4.191
116 HA PRO 168 HA PRO 168 1.140 3.711 2.003
117 1HB PRO 168 HB2 PRO 168 -0.093 1.385 1.813
118 2HB PRO 168 HB1 PRO 168 -1.043 2.885 1.901
119 1HG PRO 168 HG2 PRO 168 -0.376 1.206 -0.489
120 2HG PRO 168 HG1 PRO 168 -1.911 1.982 -0.059
121 1HD PRO 168 HD2 PRO 168 -0.002 3.020 -1.815
122 2HD PRO 168 HD1 PRO 168 -1.298 3.943 -1.032
123 H ILE 169 HN ILE 169 3.329 3.807 0.614
124 HA ILE 169 HA ILE 169 4.197 1.274 -0.424
125 HB ILE 169 HB ILE 169 4.990 3.700 -1.027
126 1HG1 ILE 169 HG12 ILE 169 5.732 1.574 -2.078
127 2HG1 ILE 169 HG11 ILE 169 7.011 2.780 -1.989
128 1HG2 ILE 169 HG21 ILE 169 7.170 3.032 0.907
129 2HG2 ILE 169 HG22 ILE 169 5.798 4.036 1.373
130 3HG2 ILE 169 HG23 ILE 169 6.861 4.548 0.063
131 1HD1 ILE 169 HD11 ILE 169 8.096 0.860 -1.349
132 2HD1 ILE 169 HD12 ILE 169 6.699 0.237 -0.471
133 3HD1 ILE 169 HD13 ILE 169 7.650 1.559 0.206
134 H ILE 170 HN ILE 170 4.581 3.078 2.532
135 HA ILE 170 HA ILE 170 6.474 1.284 3.730
136 HB ILE 170 HB ILE 170 4.824 3.256 5.274
137 1HG1 ILE 170 HG12 ILE 170 5.581 4.538 3.384
138 2HG1 ILE 170 HG11 ILE 170 6.596 4.952 4.760
139 1HG2 ILE 170 HG21 ILE 170 7.729 2.793 5.677
140 2HG2 ILE 170 HG22 ILE 170 6.607 1.523 6.164
141 3HG2 ILE 170 HG23 ILE 170 6.461 3.139 6.854
142 1HD1 ILE 170 HD11 ILE 170 7.684 4.574 2.465
143 2HD1 ILE 170 HD12 ILE 170 7.455 2.860 2.812
144 3HD1 ILE 170 HD13 ILE 170 8.435 3.854 3.890
145 H LEU 171 HN LEU 171 3.024 2.004 4.234
146 HA LEU 171 HA LEU 171 2.614 0.137 6.300
147 1HB LEU 171 HB2 LEU 171 0.952 1.772 6.056
148 2HB LEU 171 HB1 LEU 171 0.812 1.506 4.329
149 HG LEU 171 HG LEU 171 -0.340 -0.606 4.715
150 1HD1 LEU 171 HD11 LEU 171 -0.703 -0.176 7.596
151 2HD1 LEU 171 HD12 LEU 171 0.918 -0.678 7.112
152 3HD1 LEU 171 HD13 LEU 171 -0.477 -1.670 6.687
153 1HD2 LEU 171 HD21 LEU 171 -1.871 1.099 6.547
154 2HD2 LEU 171 HD22 LEU 171 -2.327 0.402 4.992
155 3HD2 LEU 171 HD23 LEU 171 -1.374 1.884 5.048
156 H ASP 172 HN ASP 172 1.872 -0.070 2.840
157 HA ASP 172 HA ASP 172 1.301 -2.869 2.956
158 1HB ASP 172 HB2 ASP 172 1.818 -1.129 0.531
159 2HB ASP 172 HB1 ASP 172 1.095 -2.743 0.525
160 H ALA 173 HN ALA 173 4.166 -1.237 3.192
161 HA ALA 173 HA ALA 173 5.821 -2.820 1.491
162 1HB ALA 173 HB1 ALA 173 6.190 -0.639 3.349
163 2HB ALA 173 HB2 ALA 173 7.190 -1.129 1.982
164 3HB ALA 173 HB3 ALA 173 7.430 -1.873 3.563
165 H GLY 174 HN GLY 174 5.717 -2.596 5.020
166 1HA GLY 174 HA2 GLY 174 5.930 -5.534 5.184
167 2HA GLY 174 HA1 GLY 174 6.979 -4.489 6.162
168 H TYR 175 HN TYR 175 4.214 -2.800 5.989
169 HA TYR 175 HA TYR 175 2.419 -2.429 7.310
170 1HB TYR 175 HB2 TYR 175 2.237 -5.068 6.861
171 2HB TYR 175 HB1 TYR 175 2.499 -5.109 8.601
172 HD1 TYR 175 HD1 TYR 175 1.024 -2.528 9.269
173 HD2 TYR 175 HD2 TYR 175 0.001 -5.826 6.785
174 HE1 TYR 175 HE1 TYR 175 -1.361 -2.050 9.627
175 HE2 TYR 175 HE2 TYR 175 -2.387 -5.357 7.135
176 HH TYR 175 HH TYR 175 -3.495 -3.114 9.500
177 H PHE 176 HN PHE 176 4.921 -4.356 8.974
178 HA PHE 176 HA PHE 176 4.469 -2.839 11.421
179 1HB PHE 176 HB2 PHE 176 5.068 -5.463 11.035
180 2HB PHE 176 HB1 PHE 176 6.683 -4.798 11.319
181 HD1 PHE 176 HD1 PHE 176 3.249 -4.844 12.762
182 HD2 PHE 176 HD2 PHE 176 7.428 -4.488 13.483
183 HE1 PHE 176 HE1 PHE 176 2.829 -4.880 15.186
184 HE2 PHE 176 HE2 PHE 176 7.016 -4.523 15.908
185 HZ PHE 176 HZ PHE 176 4.715 -4.721 16.762
186 H LEU 177 HN LEU 177 6.180 -2.407 8.648
187 HA LEU 177 HA LEU 177 8.750 -1.677 9.439
188 1HB LEU 177 HB2 LEU 177 6.967 -0.920 7.171
189 2HB LEU 177 HB1 LEU 177 8.459 -0.033 7.409
190 HG LEU 177 HG LEU 177 8.252 -2.220 5.863
191 1HD1 LEU 177 HD11 LEU 177 10.486 -2.007 5.592
192 2HD1 LEU 177 HD12 LEU 177 10.808 -2.004 7.327
193 3HD1 LEU 177 HD13 LEU 177 10.211 -0.543 6.538
194 1HD2 LEU 177 HD21 LEU 177 7.706 -3.602 7.894
195 2HD2 LEU 177 HD22 LEU 177 9.362 -3.319 8.431
196 3HD2 LEU 177 HD23 LEU 177 9.059 -4.177 6.920
197 HA PRO 178 HA PRO 178 6.641 2.846 9.878
198 1HB PRO 178 HB2 PRO 178 4.266 1.708 11.297
199 2HB PRO 178 HB1 PRO 178 4.385 3.152 10.284
200 1HG PRO 178 HG2 PRO 178 3.292 0.945 9.318
201 2HG PRO 178 HG1 PRO 178 4.381 1.918 8.308
202 1HD PRO 178 HD2 PRO 178 4.899 -0.666 9.710
203 2HD PRO 178 HD1 PRO 178 5.478 -0.104 8.130
204 H LEU 179 HN LEU 179 5.499 3.641 12.241
205 HA LEU 179 HA LEU 179 5.761 3.827 14.499
206 1HB LEU 179 HB2 LEU 179 7.586 1.433 14.484
207 2HB LEU 179 HB1 LEU 179 6.708 2.109 15.841
208 HG LEU 179 HG LEU 179 5.217 0.977 13.500
209 1HD1 LEU 179 HD11 LEU 179 6.512 -0.883 13.959
210 2HD1 LEU 179 HD12 LEU 179 5.108 -1.127 14.999
211 3HD1 LEU 179 HD13 LEU 179 6.615 -0.514 15.681
212 1HD2 LEU 179 HD21 LEU 179 3.810 0.371 15.704
213 2HD2 LEU 179 HD22 LEU 179 3.632 1.891 14.826
214 3HD2 LEU 179 HD23 LEU 179 4.642 1.820 16.270
215 H ARG 180 HN ARG 180 8.014 4.063 12.164
216 HA ARG 180 HA ARG 180 9.686 5.806 13.743
217 1HB ARG 180 HB2 ARG 180 10.680 3.247 12.513
218 2HB ARG 180 HB1 ARG 180 11.750 4.650 12.625
219 1HG ARG 180 HG2 ARG 180 10.349 3.331 14.946
220 2HG ARG 180 HG1 ARG 180 12.041 3.098 14.499
221 1HD ARG 180 HD2 ARG 180 12.597 4.883 15.695
222 2HD ARG 180 HD1 ARG 180 11.575 5.888 14.668
223 HE ARG 180 HE ARG 180 10.134 4.480 16.721
224 1HH1 ARG 180 1HH1 ARG 180 11.940 7.369 15.958
225 2HH1 ARG 180 2HH1 ARG 180 11.198 8.312 17.207
226 1HH2 ARG 180 1HH2 ARG 180 9.155 5.719 18.359
227 2HH2 ARG 180 2HH2 ARG 180 9.616 7.376 18.570
228 1HG HSL 181 HG1 HSL 181 5.539 7.413 8.252
229 2HG HSL 181 HG2 HSL 181 5.328 6.737 9.950
230 H HSL 181 HN HSL 181 7.689 6.064 11.774
231 HA HSL 181 HA HSL 181 9.274 7.143 9.389
232 1HB HSL 181 HB1 HSL 181 7.639 6.393 7.930
233 2HB HSL 181 HB2 HSL 181 7.110 5.276 9.304
Start of MODEL 23
1 1H PHE 155 HT1 PHE 155 -7.176 -5.881 -3.730
2 2H PHE 155 HT2 PHE 155 -5.614 -6.313 -4.294
3 3H PHE 155 HT3 PHE 155 -6.629 -5.313 -5.251
4 HA PHE 155 HA PHE 155 -5.657 -4.578 -2.578
5 1HB PHE 155 HB2 PHE 155 -4.094 -3.093 -3.951
6 2HB PHE 155 HB1 PHE 155 -3.700 -4.808 -3.890
7 HD1 PHE 155 HD1 PHE 155 -4.466 -2.010 -5.990
8 HD2 PHE 155 HD2 PHE 155 -4.350 -6.262 -5.844
9 HE1 PHE 155 HE1 PHE 155 -4.462 -2.091 -8.449
10 HE2 PHE 155 HE2 PHE 155 -4.345 -6.350 -8.303
11 HZ PHE 155 HZ PHE 155 -4.401 -4.263 -9.608
12 H LEU 156 HN LEU 156 -6.671 -2.847 -1.823
13 HA LEU 156 HA LEU 156 -8.059 -1.057 -1.668
14 1HB LEU 156 HB2 LEU 156 -6.465 -0.610 -4.079
15 2HB LEU 156 HB1 LEU 156 -7.973 0.284 -4.045
16 HG LEU 156 HG LEU 156 -5.819 0.384 -1.937
17 1HD1 LEU 156 HD11 LEU 156 -6.613 2.800 -3.410
18 2HD1 LEU 156 HD12 LEU 156 -5.755 1.585 -4.356
19 3HD1 LEU 156 HD13 LEU 156 -5.017 2.250 -2.899
20 1HD2 LEU 156 HD21 LEU 156 -8.544 0.855 -1.646
21 2HD2 LEU 156 HD22 LEU 156 -7.833 2.457 -1.844
22 3HD2 LEU 156 HD23 LEU 156 -7.255 1.387 -0.567
23 H GLN 157 HN GLN 157 -9.274 -3.458 -2.399
24 HA GLN 157 HA GLN 157 -11.097 -3.061 -4.564
25 1HB GLN 157 HB2 GLN 157 -10.438 -5.166 -2.700
26 2HB GLN 157 HB1 GLN 157 -12.183 -4.984 -2.827
27 1HG GLN 157 HG2 GLN 157 -12.205 -5.507 -5.083
28 2HG GLN 157 HG1 GLN 157 -10.494 -5.135 -5.287
29 1HE2 GLN 157 HE21 GLN 157 -9.997 -7.094 -6.210
30 2HE2 GLN 157 HE22 GLN 157 -9.991 -8.576 -5.323
31 H SER 158 HN SER 158 -10.916 -1.553 -1.639
32 HA SER 158 HA SER 158 -13.631 -1.566 -0.838
33 1HB SER 158 HB2 SER 158 -11.891 -1.093 0.786
34 2HB SER 158 HB1 SER 158 -11.399 0.332 -0.145
35 HG SER 158 HG SER 158 -12.785 0.809 1.657
36 H ASP 159 HN ASP 159 -11.641 0.785 -2.436
37 HA ASP 159 HA ASP 159 -13.766 1.724 -4.079
38 1HB ASP 159 HB2 ASP 159 -13.646 4.066 -3.196
39 2HB ASP 159 HB1 ASP 159 -14.389 2.913 -2.094
40 H VAL 160 HN VAL 160 -10.607 2.180 -2.688
41 HA VAL 160 HA VAL 160 -8.562 2.449 -3.663
42 HB VAL 160 HB VAL 160 -9.760 1.352 -5.737
43 1HG1 VAL 160 HG11 VAL 160 -10.297 2.628 -7.513
44 2HG1 VAL 160 HG12 VAL 160 -8.946 3.730 -7.259
45 3HG1 VAL 160 HG13 VAL 160 -10.429 3.929 -6.333
46 1HG2 VAL 160 HG21 VAL 160 -7.547 0.930 -5.747
47 2HG2 VAL 160 HG22 VAL 160 -7.115 2.602 -5.395
48 3HG2 VAL 160 HG23 VAL 160 -7.543 2.130 -7.038
49 H PHE 161 HN PHE 161 -11.104 4.725 -4.662
50 HA PHE 161 HA PHE 161 -9.304 6.856 -5.193
51 1HB PHE 161 HB2 PHE 161 -11.319 8.311 -5.076
52 2HB PHE 161 HB1 PHE 161 -11.502 6.943 -6.166
53 HD1 PHE 161 HD1 PHE 161 -13.492 5.829 -6.112
54 HD2 PHE 161 HD2 PHE 161 -12.143 7.781 -2.578
55 HE1 PHE 161 HE1 PHE 161 -15.582 5.205 -4.974
56 HE2 PHE 161 HE2 PHE 161 -14.227 7.154 -1.432
57 HZ PHE 161 HZ PHE 161 -15.951 5.866 -2.630
58 H PHE 162 HN PHE 162 -10.762 5.585 -2.335
59 HA PHE 162 HA PHE 162 -10.422 7.829 -0.631
60 1HB PHE 162 HB2 PHE 162 -11.809 5.644 -0.358
61 2HB PHE 162 HB1 PHE 162 -10.314 4.992 0.310
62 HD1 PHE 162 HD1 PHE 162 -12.925 5.212 1.779
63 HD2 PHE 162 HD2 PHE 162 -9.625 7.886 1.499
64 HE1 PHE 162 HE1 PHE 162 -13.508 6.158 3.973
65 HE2 PHE 162 HE2 PHE 162 -10.202 8.835 3.692
66 HZ PHE 162 HZ PHE 162 -12.146 7.971 4.933
67 H LEU 163 HN LEU 163 -8.606 4.777 -0.855
68 HA LEU 163 HA LEU 163 -6.417 5.647 0.731
69 1HB LEU 163 HB2 LEU 163 -7.176 3.259 0.111
70 2HB LEU 163 HB1 LEU 163 -6.281 3.517 -1.376
71 HG LEU 163 HG LEU 163 -4.234 3.941 -0.006
72 1HD1 LEU 163 HD11 LEU 163 -5.944 4.272 2.075
73 2HD1 LEU 163 HD12 LEU 163 -4.218 3.948 2.236
74 3HD1 LEU 163 HD13 LEU 163 -5.378 2.625 2.351
75 1HD2 LEU 163 HD21 LEU 163 -5.545 1.265 0.458
76 2HD2 LEU 163 HD22 LEU 163 -3.816 1.609 0.499
77 3HD2 LEU 163 HD23 LEU 163 -4.707 1.748 -1.016
78 H PHE 164 HN PHE 164 -7.415 6.600 -2.229
79 HA PHE 164 HA PHE 164 -5.002 6.774 -3.700
80 1HB PHE 164 HB2 PHE 164 -7.686 7.035 -4.208
81 2HB PHE 164 HB1 PHE 164 -7.128 8.702 -4.319
82 HD1 PHE 164 HD1 PHE 164 -6.676 9.400 -6.451
83 HD2 PHE 164 HD2 PHE 164 -5.856 5.358 -5.401
84 HE1 PHE 164 HE1 PHE 164 -5.855 8.979 -8.732
85 HE2 PHE 164 HE2 PHE 164 -5.033 4.930 -7.681
86 HZ PHE 164 HZ PHE 164 -5.032 6.742 -9.349
87 H LEU 165 HN LEU 165 -6.411 8.661 -1.181
88 HA LEU 165 HA LEU 165 -5.295 11.188 -1.749
89 1HB LEU 165 HB2 LEU 165 -6.925 10.163 0.200
90 2HB LEU 165 HB1 LEU 165 -5.434 10.442 1.087
91 HG LEU 165 HG LEU 165 -7.056 12.330 1.201
92 1HD1 LEU 165 HD11 LEU 165 -4.764 13.475 -0.258
93 2HD1 LEU 165 HD12 LEU 165 -4.373 12.411 1.093
94 3HD1 LEU 165 HD13 LEU 165 -5.382 13.834 1.355
95 1HD2 LEU 165 HD21 LEU 165 -7.574 11.901 -1.376
96 2HD2 LEU 165 HD22 LEU 165 -6.344 13.154 -1.555
97 3HD2 LEU 165 HD23 LEU 165 -7.801 13.475 -0.613
98 H LEU 166 HN LEU 166 -4.096 8.319 -0.179
99 HA LEU 166 HA LEU 166 -1.370 9.179 -0.455
100 1HB LEU 166 HB2 LEU 166 -1.462 10.256 1.546
101 2HB LEU 166 HB1 LEU 166 -2.828 9.314 2.112
102 HG LEU 166 HG LEU 166 -1.373 7.498 2.769
103 1HD1 LEU 166 HD11 LEU 166 0.596 8.973 1.130
104 2HD1 LEU 166 HD12 LEU 166 0.367 7.237 1.343
105 3HD1 LEU 166 HD13 LEU 166 1.201 8.175 2.582
106 1HD2 LEU 166 HD21 LEU 166 0.310 9.014 4.203
107 2HD2 LEU 166 HD22 LEU 166 -1.398 8.826 4.597
108 3HD2 LEU 166 HD23 LEU 166 -0.849 10.247 3.707
109 HA PRO 167 HA PRO 167 -1.862 4.683 -1.040
110 1HB PRO 167 HB2 PRO 167 0.488 4.385 -2.406
111 2HB PRO 167 HB1 PRO 167 -1.046 4.861 -3.160
112 1HG PRO 167 HG2 PRO 167 1.259 6.569 -2.296
113 2HG PRO 167 HG1 PRO 167 0.275 6.673 -3.768
114 1HD PRO 167 HD2 PRO 167 -0.111 8.321 -1.673
115 2HD PRO 167 HD1 PRO 167 -1.456 7.760 -2.687
116 HA PRO 168 HA PRO 168 0.916 3.902 2.451
117 1HB PRO 168 HB2 PRO 168 -0.430 1.832 3.470
118 2HB PRO 168 HB1 PRO 168 -1.061 3.487 3.612
119 1HG PRO 168 HG2 PRO 168 -1.812 1.334 1.660
120 2HG PRO 168 HG1 PRO 168 -2.868 2.417 2.587
121 1HD PRO 168 HD2 PRO 168 -2.168 2.844 -0.023
122 2HD PRO 168 HD1 PRO 168 -2.593 4.145 1.106
123 H ILE 169 HN ILE 169 1.895 3.137 0.003
124 HA ILE 169 HA ILE 169 2.132 0.301 -0.250
125 HB ILE 169 HB ILE 169 2.424 2.201 -2.039
126 1HG1 ILE 169 HG12 ILE 169 2.439 -0.165 -2.568
127 2HG1 ILE 169 HG11 ILE 169 3.753 0.631 -3.428
128 1HG2 ILE 169 HG21 ILE 169 4.357 3.221 -0.843
129 2HG2 ILE 169 HG22 ILE 169 4.671 2.826 -2.532
130 3HG2 ILE 169 HG23 ILE 169 5.297 1.786 -1.253
131 1HD1 ILE 169 HD11 ILE 169 5.200 -0.117 -1.428
132 2HD1 ILE 169 HD12 ILE 169 4.732 -1.306 -2.644
133 3HD1 ILE 169 HD13 ILE 169 3.877 -1.236 -1.103
134 H ILE 170 HN ILE 170 4.110 2.854 1.104
135 HA ILE 170 HA ILE 170 6.391 1.233 1.632
136 HB ILE 170 HB ILE 170 5.676 3.826 2.995
137 1HG1 ILE 170 HG12 ILE 170 7.502 4.400 0.987
138 2HG1 ILE 170 HG11 ILE 170 6.390 3.272 0.216
139 1HG2 ILE 170 HG21 ILE 170 8.285 2.398 2.516
140 2HG2 ILE 170 HG22 ILE 170 7.497 2.696 4.065
141 3HG2 ILE 170 HG23 ILE 170 8.154 4.043 3.135
142 1HD1 ILE 170 HD11 ILE 170 5.896 5.775 0.062
143 2HD1 ILE 170 HD12 ILE 170 5.379 5.637 1.741
144 3HD1 ILE 170 HD13 ILE 170 4.573 4.691 0.490
145 H LEU 171 HN LEU 171 3.776 2.497 3.713
146 HA LEU 171 HA LEU 171 4.731 1.224 6.057
147 1HB LEU 171 HB2 LEU 171 2.198 1.479 6.724
148 2HB LEU 171 HB1 LEU 171 3.257 2.873 6.636
149 HG LEU 171 HG LEU 171 1.749 2.202 4.172
150 1HD1 LEU 171 HD11 LEU 171 -0.109 3.712 5.317
151 2HD1 LEU 171 HD12 LEU 171 0.481 2.891 6.761
152 3HD1 LEU 171 HD13 LEU 171 -0.144 1.952 5.406
153 1HD2 LEU 171 HD21 LEU 171 1.459 4.868 4.757
154 2HD2 LEU 171 HD22 LEU 171 2.717 4.171 3.738
155 3HD2 LEU 171 HD23 LEU 171 3.039 4.490 5.443
156 H ASP 172 HN ASP 172 2.189 0.362 3.737
157 HA ASP 172 HA ASP 172 1.730 -2.202 4.926
158 1HB ASP 172 HB2 ASP 172 0.889 -1.271 2.174
159 2HB ASP 172 HB1 ASP 172 0.187 -2.588 3.123
160 H ALA 173 HN ALA 173 4.338 -1.097 3.287
161 HA ALA 173 HA ALA 173 4.760 -3.183 1.394
162 1HB ALA 173 HB1 ALA 173 6.436 -1.870 0.750
163 2HB ALA 173 HB2 ALA 173 7.233 -2.054 2.311
164 3HB ALA 173 HB3 ALA 173 6.044 -0.776 2.075
165 H GLY 174 HN GLY 174 5.760 -2.554 4.709
166 1HA GLY 174 HA2 GLY 174 6.671 -5.361 4.909
167 2HA GLY 174 HA1 GLY 174 7.433 -4.027 5.796
168 H TYR 175 HN TYR 175 4.261 -3.289 5.766
169 HA TYR 175 HA TYR 175 2.619 -3.221 7.259
170 1HB TYR 175 HB2 TYR 175 2.475 -5.660 8.518
171 2HB TYR 175 HB1 TYR 175 1.692 -5.209 7.013
172 HD1 TYR 175 HD1 TYR 175 3.012 -5.658 4.834
173 HD2 TYR 175 HD2 TYR 175 3.937 -7.472 8.571
174 HE1 TYR 175 HE1 TYR 175 4.217 -7.449 3.659
175 HE2 TYR 175 HE2 TYR 175 5.147 -9.268 7.404
176 HH TYR 175 HH TYR 175 4.854 -9.870 4.150
177 H PHE 176 HN PHE 176 5.594 -4.542 8.668
178 HA PHE 176 HA PHE 176 4.740 -3.627 11.297
179 1HB PHE 176 HB2 PHE 176 6.837 -4.705 12.089
180 2HB PHE 176 HB1 PHE 176 5.761 -5.815 11.229
181 HD1 PHE 176 HD1 PHE 176 6.510 -7.001 9.367
182 HD2 PHE 176 HD2 PHE 176 8.810 -3.737 10.836
183 HE1 PHE 176 HE1 PHE 176 8.348 -7.621 7.854
184 HE2 PHE 176 HE2 PHE 176 10.652 -4.350 9.324
185 HZ PHE 176 HZ PHE 176 10.422 -6.294 7.831
186 H LEU 177 HN LEU 177 5.484 -1.821 9.002
187 HA LEU 177 HA LEU 177 7.921 -0.549 9.916
188 1HB LEU 177 HB2 LEU 177 6.146 -0.338 7.574
189 2HB LEU 177 HB1 LEU 177 6.878 1.170 8.085
190 HG LEU 177 HG LEU 177 8.324 -1.352 7.276
191 1HD1 LEU 177 HD11 LEU 177 7.741 -0.374 5.288
192 2HD1 LEU 177 HD12 LEU 177 9.270 0.444 5.616
193 3HD1 LEU 177 HD13 LEU 177 7.743 1.256 5.963
194 1HD2 LEU 177 HD21 LEU 177 9.239 1.115 8.659
195 2HD2 LEU 177 HD22 LEU 177 10.292 0.398 7.440
196 3HD2 LEU 177 HD23 LEU 177 9.787 -0.552 8.836
197 HA PRO 178 HA PRO 178 4.572 2.928 10.852
198 1HB PRO 178 HB2 PRO 178 2.234 1.167 11.345
199 2HB PRO 178 HB1 PRO 178 2.310 2.741 10.546
200 1HG PRO 178 HG2 PRO 178 1.962 0.507 9.135
201 2HG PRO 178 HG1 PRO 178 2.972 1.830 8.522
202 1HD PRO 178 HD2 PRO 178 3.793 -0.766 9.763
203 2HD PRO 178 HD1 PRO 178 4.511 0.107 8.394
204 H LEU 179 HN LEU 179 3.367 -0.049 12.412
205 HA LEU 179 HA LEU 179 3.358 -0.740 14.576
206 1HB LEU 179 HB2 LEU 179 5.898 0.798 14.374
207 2HB LEU 179 HB1 LEU 179 5.335 0.363 15.976
208 HG LEU 179 HG LEU 179 5.973 -1.541 13.723
209 1HD1 LEU 179 HD11 LEU 179 7.986 -0.761 14.684
210 2HD1 LEU 179 HD12 LEU 179 7.674 -2.339 15.407
211 3HD1 LEU 179 HD13 LEU 179 7.333 -0.868 16.319
212 1HD2 LEU 179 HD21 LEU 179 4.502 -1.886 16.266
213 2HD2 LEU 179 HD22 LEU 179 5.682 -3.130 15.850
214 3HD2 LEU 179 HD23 LEU 179 4.360 -2.762 14.742
215 H ARG 180 HN ARG 180 1.457 0.990 14.192
216 HA ARG 180 HA ARG 180 0.044 2.461 15.198
217 1HB ARG 180 HB2 ARG 180 1.855 2.101 17.596
218 2HB ARG 180 HB1 ARG 180 0.212 2.755 17.616
219 1HG ARG 180 HG2 ARG 180 -0.262 0.631 18.227
220 2HG ARG 180 HG1 ARG 180 -0.302 0.404 16.477
221 1HD ARG 180 HD2 ARG 180 1.508 -0.914 16.496
222 2HD ARG 180 HD1 ARG 180 2.369 0.136 17.622
223 HE ARG 180 HE ARG 180 1.810 -1.324 19.270
224 1HH1 ARG 180 1HH1 ARG 180 -0.559 -1.620 16.725
225 2HH1 ARG 180 2HH1 ARG 180 -1.420 -2.905 17.504
226 1HH2 ARG 180 1HH2 ARG 180 0.679 -3.014 20.297
227 2HH2 ARG 180 2HH2 ARG 180 -0.718 -3.697 19.532
228 1HG HSL 181 HG1 HSL 181 4.241 7.645 13.014
229 2HG HSL 181 HG2 HSL 181 4.349 6.681 11.450
230 H HSL 181 HN HSL 181 1.805 3.582 13.523
231 HA HSL 181 HA HSL 181 2.673 6.161 14.934
232 1HB HSL 181 HB1 HSL 181 4.750 5.513 13.992
233 2HB HSL 181 HB2 HSL 181 3.942 4.595 12.610
Start of MODEL 24
1 1H PHE 155 HT1 PHE 155 -4.956 11.659 -2.190
2 2H PHE 155 HT2 PHE 155 -6.573 11.912 -1.673
3 3H PHE 155 HT3 PHE 155 -5.552 13.254 -1.990
4 HA PHE 155 HA PHE 155 -6.766 11.365 -3.868
5 1HB PHE 155 HB2 PHE 155 -7.617 13.740 -2.914
6 2HB PHE 155 HB1 PHE 155 -6.647 14.299 -4.272
7 HD1 PHE 155 HD1 PHE 155 -8.135 14.979 -5.900
8 HD2 PHE 155 HD2 PHE 155 -8.786 11.275 -3.909
9 HE1 PHE 155 HE1 PHE 155 -9.998 14.489 -7.431
10 HE2 PHE 155 HE2 PHE 155 -10.651 10.777 -5.436
11 HZ PHE 155 HZ PHE 155 -11.258 12.386 -7.200
12 H LEU 156 HN LEU 156 -6.187 11.781 -6.149
13 HA LEU 156 HA LEU 156 -3.362 11.686 -6.494
14 1HB LEU 156 HB2 LEU 156 -5.741 11.481 -8.270
15 2HB LEU 156 HB1 LEU 156 -4.187 11.810 -9.006
16 HG LEU 156 HG LEU 156 -3.964 9.618 -7.162
17 1HD1 LEU 156 HD11 LEU 156 -5.327 8.092 -8.796
18 2HD1 LEU 156 HD12 LEU 156 -6.250 9.571 -9.064
19 3HD1 LEU 156 HD13 LEU 156 -6.119 8.895 -7.440
20 1HD2 LEU 156 HD21 LEU 156 -3.696 9.656 -10.160
21 2HD2 LEU 156 HD22 LEU 156 -2.947 8.529 -9.028
22 3HD2 LEU 156 HD23 LEU 156 -2.446 10.220 -9.050
23 H GLN 157 HN GLN 157 -2.609 13.724 -5.782
24 HA GLN 157 HA GLN 157 -3.551 16.165 -6.879
25 1HB GLN 157 HB2 GLN 157 -1.185 15.380 -5.230
26 2HB GLN 157 HB1 GLN 157 -1.242 16.980 -5.953
27 1HG GLN 157 HG2 GLN 157 -3.628 16.093 -4.445
28 2HG GLN 157 HG1 GLN 157 -2.175 16.463 -3.520
29 1HE2 GLN 157 HE21 GLN 157 -4.555 17.744 -5.745
30 2HE2 GLN 157 HE22 GLN 157 -4.285 19.410 -5.377
31 H SER 158 HN SER 158 -0.172 15.205 -7.111
32 HA SER 158 HA SER 158 -0.186 15.008 -9.952
33 1HB SER 158 HB2 SER 158 0.898 16.999 -10.580
34 2HB SER 158 HB1 SER 158 -0.319 17.545 -9.413
35 HG SER 158 HG SER 158 2.462 17.190 -9.025
36 H ASP 159 HN ASP 159 0.665 13.532 -7.651
37 HA ASP 159 HA ASP 159 3.270 12.790 -8.576
38 1HB ASP 159 HB2 ASP 159 3.101 14.672 -6.433
39 2HB ASP 159 HB1 ASP 159 3.685 13.146 -5.777
40 H VAL 160 HN VAL 160 1.144 12.581 -5.734
41 HA VAL 160 HA VAL 160 0.197 10.807 -4.657
42 HB VAL 160 HB VAL 160 0.967 9.254 -7.128
43 1HG1 VAL 160 HG11 VAL 160 -0.478 8.523 -4.656
44 2HG1 VAL 160 HG12 VAL 160 0.478 7.524 -5.749
45 3HG1 VAL 160 HG13 VAL 160 -1.176 7.962 -6.175
46 1HG2 VAL 160 HG21 VAL 160 -1.734 9.604 -7.211
47 2HG2 VAL 160 HG22 VAL 160 -0.559 10.589 -8.081
48 3HG2 VAL 160 HG23 VAL 160 -1.191 11.136 -6.528
49 H PHE 161 HN PHE 161 3.097 9.627 -6.347
50 HA PHE 161 HA PHE 161 3.859 7.881 -4.227
51 1HB PHE 161 HB2 PHE 161 6.127 8.356 -5.850
52 2HB PHE 161 HB1 PHE 161 5.061 6.958 -5.866
53 HD1 PHE 161 HD1 PHE 161 3.325 6.737 -7.542
54 HD2 PHE 161 HD2 PHE 161 5.932 10.100 -7.504
55 HE1 PHE 161 HE1 PHE 161 2.622 7.303 -9.831
56 HE2 PHE 161 HE2 PHE 161 5.234 10.673 -9.792
57 HZ PHE 161 HZ PHE 161 3.576 9.273 -10.958
58 H PHE 162 HN PHE 162 3.728 11.024 -4.074
59 HA PHE 162 HA PHE 162 5.751 11.224 -2.075
60 1HB PHE 162 HB2 PHE 162 6.079 12.642 -4.700
61 2HB PHE 162 HB1 PHE 162 6.717 13.343 -3.209
62 HD1 PHE 162 HD1 PHE 162 7.710 11.030 -1.768
63 HD2 PHE 162 HD2 PHE 162 7.900 11.923 -5.924
64 HE1 PHE 162 HE1 PHE 162 9.727 9.636 -1.969
65 HE2 PHE 162 HE2 PHE 162 9.917 10.530 -6.135
66 HZ PHE 162 HZ PHE 162 10.833 9.385 -4.156
67 H LEU 163 HN LEU 163 2.775 11.723 -2.902
68 HA LEU 163 HA LEU 163 2.266 14.459 -2.333
69 1HB LEU 163 HB2 LEU 163 0.780 12.295 -3.198
70 2HB LEU 163 HB1 LEU 163 0.176 12.551 -1.572
71 HG LEU 163 HG LEU 163 0.317 14.732 -3.634
72 1HD1 LEU 163 HD11 LEU 163 -2.193 14.333 -3.743
73 2HD1 LEU 163 HD12 LEU 163 -1.862 12.765 -3.009
74 3HD1 LEU 163 HD13 LEU 163 -1.161 13.170 -4.576
75 1HD2 LEU 163 HD21 LEU 163 -0.644 16.081 -2.111
76 2HD2 LEU 163 HD22 LEU 163 0.040 14.942 -0.951
77 3HD2 LEU 163 HD23 LEU 163 -1.645 14.790 -1.447
78 H PHE 164 HN PHE 164 2.769 11.561 -0.541
79 HA PHE 164 HA PHE 164 3.168 11.144 1.659
80 1HB PHE 164 HB2 PHE 164 4.570 13.168 1.561
81 2HB PHE 164 HB1 PHE 164 3.166 14.154 1.957
82 HD1 PHE 164 HD1 PHE 164 4.178 10.894 3.418
83 HD2 PHE 164 HD2 PHE 164 3.715 15.082 4.015
84 HE1 PHE 164 HE1 PHE 164 4.649 10.600 5.815
85 HE2 PHE 164 HE2 PHE 164 4.185 14.797 6.413
86 HZ PHE 164 HZ PHE 164 4.653 12.554 7.316
87 H LEU 165 HN LEU 165 0.370 11.996 0.489
88 HA LEU 165 HA LEU 165 -1.151 12.884 2.705
89 1HB LEU 165 HB2 LEU 165 -1.633 12.092 -0.008
90 2HB LEU 165 HB1 LEU 165 -2.798 11.306 1.042
91 HG LEU 165 HG LEU 165 -3.573 13.479 0.093
92 1HD1 LEU 165 HD11 LEU 165 -3.431 13.964 3.002
93 2HD1 LEU 165 HD12 LEU 165 -4.088 12.410 2.491
94 3HD1 LEU 165 HD13 LEU 165 -4.826 13.907 1.924
95 1HD2 LEU 165 HD21 LEU 165 -1.096 14.399 0.602
96 2HD2 LEU 165 HD22 LEU 165 -1.947 14.998 2.026
97 3HD2 LEU 165 HD23 LEU 165 -2.507 15.441 0.414
98 H LEU 166 HN LEU 166 -0.806 9.665 1.239
99 HA LEU 166 HA LEU 166 -0.824 8.375 3.800
100 1HB LEU 166 HB2 LEU 166 -3.302 8.898 2.707
101 2HB LEU 166 HB1 LEU 166 -2.985 7.259 2.169
102 HG LEU 166 HG LEU 166 -4.219 7.141 4.213
103 1HD1 LEU 166 HD11 LEU 166 -1.569 6.568 5.354
104 2HD1 LEU 166 HD12 LEU 166 -1.911 5.814 3.797
105 3HD1 LEU 166 HD13 LEU 166 -2.979 5.525 5.169
106 1HD2 LEU 166 HD21 LEU 166 -3.839 9.307 5.137
107 2HD2 LEU 166 HD22 LEU 166 -2.113 8.991 5.316
108 3HD2 LEU 166 HD23 LEU 166 -3.278 8.119 6.312
109 HA PRO 167 HA PRO 167 1.292 6.513 -0.075
110 1HB PRO 167 HB2 PRO 167 3.675 6.229 1.365
111 2HB PRO 167 HB1 PRO 167 3.324 7.455 0.134
112 1HG PRO 167 HG2 PRO 167 3.206 7.657 3.107
113 2HG PRO 167 HG1 PRO 167 3.667 8.883 1.911
114 1HD PRO 167 HD2 PRO 167 1.284 8.950 3.142
115 2HD PRO 167 HD1 PRO 167 1.463 9.432 1.441
116 HA PRO 168 HA PRO 168 0.403 2.699 2.220
117 1HB PRO 168 HB2 PRO 168 -0.525 1.313 0.137
118 2HB PRO 168 HB1 PRO 168 -1.490 2.615 0.864
119 1HG PRO 168 HG2 PRO 168 0.257 2.702 -1.581
120 2HG PRO 168 HG1 PRO 168 -1.403 3.295 -1.383
121 1HD PRO 168 HD2 PRO 168 0.779 4.903 -1.218
122 2HD PRO 168 HD1 PRO 168 -0.716 5.210 -0.311
123 H ILE 169 HN ILE 169 2.890 3.545 0.235
124 HA ILE 169 HA ILE 169 3.803 0.979 -0.612
125 HB ILE 169 HB ILE 169 5.978 2.201 -1.033
126 1HG1 ILE 169 HG12 ILE 169 4.334 4.665 -0.507
127 2HG1 ILE 169 HG11 ILE 169 5.392 3.972 0.716
128 1HG2 ILE 169 HG21 ILE 169 4.959 3.567 -2.905
129 2HG2 ILE 169 HG22 ILE 169 3.385 3.075 -2.276
130 3HG2 ILE 169 HG23 ILE 169 4.523 1.859 -2.858
131 1HD1 ILE 169 HD11 ILE 169 7.248 4.175 -1.009
132 2HD1 ILE 169 HD12 ILE 169 6.644 5.669 -0.291
133 3HD1 ILE 169 HD13 ILE 169 6.134 5.200 -1.912
134 H ILE 170 HN ILE 170 4.481 3.066 2.129
135 HA ILE 170 HA ILE 170 6.602 1.404 3.135
136 HB ILE 170 HB ILE 170 5.193 3.582 4.655
137 1HG1 ILE 170 HG12 ILE 170 5.786 4.635 2.616
138 2HG1 ILE 170 HG11 ILE 170 7.064 5.049 3.752
139 1HG2 ILE 170 HG21 ILE 170 8.083 2.783 4.792
140 2HG2 ILE 170 HG22 ILE 170 6.844 1.977 5.754
141 3HG2 ILE 170 HG23 ILE 170 7.136 3.704 5.960
142 1HD1 ILE 170 HD11 ILE 170 8.296 4.511 1.916
143 2HD1 ILE 170 HD12 ILE 170 7.139 3.304 1.356
144 3HD1 ILE 170 HD13 ILE 170 8.218 2.935 2.702
145 H LEU 171 HN LEU 171 3.303 2.208 4.238
146 HA LEU 171 HA LEU 171 3.326 0.469 6.456
147 1HB LEU 171 HB2 LEU 171 0.728 0.526 5.989
148 2HB LEU 171 HB1 LEU 171 1.571 1.918 6.638
149 HG LEU 171 HG LEU 171 1.456 1.875 3.705
150 1HD1 LEU 171 HD11 LEU 171 -1.030 1.732 5.346
151 2HD1 LEU 171 HD12 LEU 171 -0.680 1.027 3.768
152 3HD1 LEU 171 HD13 LEU 171 -0.989 2.758 3.911
153 1HD2 LEU 171 HD21 LEU 171 2.224 3.853 4.645
154 2HD2 LEU 171 HD22 LEU 171 1.015 3.830 5.928
155 3HD2 LEU 171 HD23 LEU 171 0.539 4.219 4.275
156 H ASP 172 HN ASP 172 1.942 0.058 3.219
157 HA ASP 172 HA ASP 172 1.348 -2.705 3.604
158 1HB ASP 172 HB2 ASP 172 0.420 -0.859 1.876
159 2HB ASP 172 HB1 ASP 172 1.622 -1.649 0.844
160 H ALA 173 HN ALA 173 4.258 -1.181 3.307
161 HA ALA 173 HA ALA 173 5.580 -2.877 1.439
162 1HB ALA 173 HB1 ALA 173 7.444 -1.817 3.308
163 2HB ALA 173 HB2 ALA 173 6.244 -0.573 2.963
164 3HB ALA 173 HB3 ALA 173 7.148 -1.313 1.644
165 H GLY 174 HN GLY 174 5.709 -2.611 4.978
166 1HA GLY 174 HA2 GLY 174 6.241 -5.514 5.106
167 2HA GLY 174 HA1 GLY 174 7.165 -4.365 6.091
168 H TYR 175 HN TYR 175 4.194 -3.043 5.957
169 HA TYR 175 HA TYR 175 2.376 -2.937 7.303
170 1HB TYR 175 HB2 TYR 175 2.488 -5.544 6.803
171 2HB TYR 175 HB1 TYR 175 2.897 -5.620 8.513
172 HD1 TYR 175 HD1 TYR 175 1.067 -3.035 9.026
173 HD2 TYR 175 HD2 TYR 175 0.458 -6.861 7.265
174 HE1 TYR 175 HE1 TYR 175 -1.322 -2.914 9.599
175 HE2 TYR 175 HE2 TYR 175 -1.931 -6.749 7.833
176 HH TYR 175 HH TYR 175 -3.211 -4.365 9.939
177 H PHE 176 HN PHE 176 4.951 -4.718 9.045
178 HA PHE 176 HA PHE 176 4.402 -3.129 11.426
179 1HB PHE 176 HB2 PHE 176 4.880 -5.697 11.346
180 2HB PHE 176 HB1 PHE 176 6.575 -5.196 11.239
181 HD1 PHE 176 HD1 PHE 176 7.689 -4.186 13.116
182 HD2 PHE 176 HD2 PHE 176 3.586 -5.289 13.358
183 HE1 PHE 176 HE1 PHE 176 7.770 -3.935 15.563
184 HE2 PHE 176 HE2 PHE 176 3.659 -5.038 15.803
185 HZ PHE 176 HZ PHE 176 5.752 -4.360 16.910
186 H LEU 177 HN LEU 177 5.656 -2.032 8.943
187 HA LEU 177 HA LEU 177 8.368 -1.419 9.760
188 1HB LEU 177 HB2 LEU 177 6.722 -0.982 7.322
189 2HB LEU 177 HB1 LEU 177 8.065 0.104 7.608
190 HG LEU 177 HG LEU 177 8.254 -2.184 6.209
191 1HD1 LEU 177 HD11 LEU 177 9.916 -0.240 6.772
192 2HD1 LEU 177 HD12 LEU 177 10.508 -1.779 6.149
193 3HD1 LEU 177 HD13 LEU 177 10.603 -1.431 7.875
194 1HD2 LEU 177 HD21 LEU 177 7.738 -3.487 8.308
195 2HD2 LEU 177 HD22 LEU 177 9.310 -2.964 8.914
196 3HD2 LEU 177 HD23 LEU 177 9.211 -3.950 7.455
197 HA PRO 178 HA PRO 178 6.081 3.031 9.650
198 1HB PRO 178 HB2 PRO 178 3.565 1.848 10.785
199 2HB PRO 178 HB1 PRO 178 3.776 3.292 9.787
200 1HG PRO 178 HG2 PRO 178 2.908 1.042 8.700
201 2HG PRO 178 HG1 PRO 178 4.091 2.050 7.844
202 1HD PRO 178 HD2 PRO 178 4.489 -0.528 9.286
203 2HD PRO 178 HD1 PRO 178 5.303 0.096 7.837
204 H LEU 179 HN LEU 179 4.237 1.482 12.244
205 HA LEU 179 HA LEU 179 4.396 1.646 14.500
206 1HB LEU 179 HB2 LEU 179 6.784 0.546 13.548
207 2HB LEU 179 HB1 LEU 179 7.284 1.752 14.717
208 HG LEU 179 HG LEU 179 7.044 -0.496 15.704
209 1HD1 LEU 179 HD11 LEU 179 4.923 1.320 16.810
210 2HD1 LEU 179 HD12 LEU 179 6.645 1.667 16.965
211 3HD1 LEU 179 HD13 LEU 179 5.974 0.199 17.678
212 1HD2 LEU 179 HD21 LEU 179 4.969 -0.908 14.127
213 2HD2 LEU 179 HD22 LEU 179 4.083 -0.295 15.523
214 3HD2 LEU 179 HD23 LEU 179 5.113 -1.717 15.687
215 H ARG 180 HN ARG 180 3.804 3.980 13.578
216 HA ARG 180 HA ARG 180 3.793 6.209 14.050
217 1HB ARG 180 HB2 ARG 180 5.650 5.292 16.252
218 2HB ARG 180 HB1 ARG 180 5.104 6.964 16.082
219 1HG ARG 180 HG2 ARG 180 3.142 4.707 16.261
220 2HG ARG 180 HG1 ARG 180 3.861 5.414 17.709
221 1HD ARG 180 HD2 ARG 180 1.838 6.572 17.386
222 2HD ARG 180 HD1 ARG 180 3.100 7.661 16.813
223 HE ARG 180 HE ARG 180 1.953 6.016 14.751
224 1HH1 ARG 180 1HH1 ARG 180 1.660 9.006 16.527
225 2HH1 ARG 180 2HH1 ARG 180 0.764 9.805 15.280
226 1HH2 ARG 180 1HH2 ARG 180 0.774 7.067 13.108
227 2HH2 ARG 180 2HH2 ARG 180 0.261 8.704 13.339
228 1HG HSL 181 HG1 HSL 181 7.639 5.638 8.401
229 2HG HSL 181 HG2 HSL 181 6.067 5.038 9.148
230 H HSL 181 HN HSL 181 5.132 5.603 11.889
231 HA HSL 181 HA HSL 181 7.722 7.235 12.023
232 1HB HSL 181 HB1 HSL 181 8.752 5.840 10.482
233 2HB HSL 181 HB2 HSL 181 7.508 4.591 11.027
Start of MODEL 25
1 1H PHE 155 HT1 PHE 155 -13.801 11.901 -8.831
2 2H PHE 155 HT2 PHE 155 -13.089 11.102 -7.489
3 3H PHE 155 HT3 PHE 155 -14.400 10.377 -8.325
4 HA PHE 155 HA PHE 155 -13.125 10.022 -10.220
5 1HB PHE 155 HB2 PHE 155 -11.836 12.293 -9.484
6 2HB PHE 155 HB1 PHE 155 -10.627 11.087 -9.060
7 HD1 PHE 155 HD1 PHE 155 -13.021 11.558 -11.888
8 HD2 PHE 155 HD2 PHE 155 -9.007 10.862 -10.657
9 HE1 PHE 155 HE1 PHE 155 -12.323 11.439 -14.244
10 HE2 PHE 155 HE2 PHE 155 -8.302 10.742 -13.012
11 HZ PHE 155 HZ PHE 155 -9.962 11.031 -14.808
12 H LEU 156 HN LEU 156 -11.597 8.278 -10.466
13 HA LEU 156 HA LEU 156 -11.610 6.507 -8.238
14 1HB LEU 156 HB2 LEU 156 -10.628 4.900 -9.701
15 2HB LEU 156 HB1 LEU 156 -11.839 5.785 -10.609
16 HG LEU 156 HG LEU 156 -9.667 7.235 -11.251
17 1HD1 LEU 156 HD11 LEU 156 -7.706 6.033 -11.378
18 2HD1 LEU 156 HD12 LEU 156 -8.527 4.477 -11.260
19 3HD1 LEU 156 HD13 LEU 156 -8.355 5.495 -9.830
20 1HD2 LEU 156 HD21 LEU 156 -9.887 6.342 -13.351
21 2HD2 LEU 156 HD22 LEU 156 -11.414 5.845 -12.625
22 3HD2 LEU 156 HD23 LEU 156 -10.082 4.696 -12.750
23 H GLN 157 HN GLN 157 -9.921 5.784 -6.984
24 HA GLN 157 HA GLN 157 -7.206 6.460 -7.425
25 1HB GLN 157 HB2 GLN 157 -8.835 8.408 -6.018
26 2HB GLN 157 HB1 GLN 157 -7.520 7.825 -5.007
27 1HG GLN 157 HG2 GLN 157 -5.885 8.563 -6.522
28 2HG GLN 157 HG1 GLN 157 -7.069 8.800 -7.806
29 1HE2 GLN 157 HE21 GLN 157 -7.268 9.771 -4.423
30 2HE2 GLN 157 HE22 GLN 157 -7.357 11.469 -4.727
31 H SER 158 HN SER 158 -7.513 4.118 -7.064
32 HA SER 158 HA SER 158 -7.202 2.239 -5.877
33 1HB SER 158 HB2 SER 158 -6.212 2.680 -3.456
34 2HB SER 158 HB1 SER 158 -5.233 2.862 -4.921
35 HG SER 158 HG SER 158 -5.352 5.014 -4.751
36 H ASP 159 HN ASP 159 -8.362 4.556 -3.577
37 HA ASP 159 HA ASP 159 -10.813 3.138 -3.140
38 1HB ASP 159 HB2 ASP 159 -10.367 2.973 -0.658
39 2HB ASP 159 HB1 ASP 159 -9.459 1.853 -1.669
40 H VAL 160 HN VAL 160 -8.626 5.768 -2.428
41 HA VAL 160 HA VAL 160 -9.047 8.000 -2.193
42 HB VAL 160 HB VAL 160 -11.455 7.143 -3.280
43 1HG1 VAL 160 HG11 VAL 160 -12.040 8.756 -0.799
44 2HG1 VAL 160 HG12 VAL 160 -12.573 7.109 -1.135
45 3HG1 VAL 160 HG13 VAL 160 -13.183 8.447 -2.106
46 1HG2 VAL 160 HG21 VAL 160 -9.845 9.250 -3.541
47 2HG2 VAL 160 HG22 VAL 160 -11.170 10.022 -2.670
48 3HG2 VAL 160 HG23 VAL 160 -11.478 9.208 -4.204
49 H PHE 161 HN PHE 161 -11.250 6.011 -0.223
50 HA PHE 161 HA PHE 161 -11.056 7.749 2.045
51 1HB PHE 161 HB2 PHE 161 -12.230 4.989 1.706
52 2HB PHE 161 HB1 PHE 161 -12.305 5.901 3.208
53 HD1 PHE 161 HD1 PHE 161 -14.750 4.956 2.059
54 HD2 PHE 161 HD2 PHE 161 -12.571 8.500 1.148
55 HE1 PHE 161 HE1 PHE 161 -16.824 6.032 1.291
56 HE2 PHE 161 HE2 PHE 161 -14.643 9.579 0.379
57 HZ PHE 161 HZ PHE 161 -16.772 8.346 0.451
58 H PHE 162 HN PHE 162 -8.589 6.353 0.908
59 HA PHE 162 HA PHE 162 -7.339 5.851 3.425
60 1HB PHE 162 HB2 PHE 162 -7.905 3.552 1.565
61 2HB PHE 162 HB1 PHE 162 -6.568 3.518 2.717
62 HD1 PHE 162 HD1 PHE 162 -9.813 2.487 2.218
63 HD2 PHE 162 HD2 PHE 162 -7.369 4.315 5.184
64 HE1 PHE 162 HE1 PHE 162 -11.358 1.707 3.966
65 HE2 PHE 162 HE2 PHE 162 -8.909 3.537 6.938
66 HZ PHE 162 HZ PHE 162 -10.907 2.231 6.330
67 H LEU 163 HN LEU 163 -7.234 6.739 0.211
68 HA LEU 163 HA LEU 163 -4.603 6.028 -0.520
69 1HB LEU 163 HB2 LEU 163 -6.564 7.012 -1.934
70 2HB LEU 163 HB1 LEU 163 -5.936 8.563 -1.413
71 HG LEU 163 HG LEU 163 -5.196 7.675 -3.686
72 1HD1 LEU 163 HD11 LEU 163 -3.880 9.428 -3.300
73 2HD1 LEU 163 HD12 LEU 163 -2.660 8.251 -2.817
74 3HD1 LEU 163 HD13 LEU 163 -3.681 9.013 -1.599
75 1HD2 LEU 163 HD21 LEU 163 -4.595 5.403 -2.403
76 2HD2 LEU 163 HD22 LEU 163 -3.028 6.205 -2.330
77 3HD2 LEU 163 HD23 LEU 163 -3.796 5.913 -3.890
78 H PHE 164 HN PHE 164 -6.040 8.737 1.159
79 HA PHE 164 HA PHE 164 -5.185 10.435 2.408
80 1HB PHE 164 HB2 PHE 164 -4.126 8.088 3.313
81 2HB PHE 164 HB1 PHE 164 -2.668 9.035 3.020
82 HD1 PHE 164 HD1 PHE 164 -4.307 8.012 5.623
83 HD2 PHE 164 HD2 PHE 164 -3.597 11.747 3.710
84 HE1 PHE 164 HE1 PHE 164 -4.637 9.169 7.768
85 HE2 PHE 164 HE2 PHE 164 -3.925 12.911 5.852
86 HZ PHE 164 HZ PHE 164 -4.447 11.622 7.885
87 H LEU 165 HN LEU 165 -4.640 10.668 -0.334
88 HA LEU 165 HA LEU 165 -3.531 12.245 -1.598
89 1HB LEU 165 HB2 LEU 165 -2.623 12.943 0.877
90 2HB LEU 165 HB1 LEU 165 -1.131 12.471 0.079
91 HG LEU 165 HG LEU 165 -1.625 14.085 -1.735
92 1HD1 LEU 165 HD11 LEU 165 -3.966 14.267 -1.736
93 2HD1 LEU 165 HD12 LEU 165 -3.382 15.832 -1.167
94 3HD1 LEU 165 HD13 LEU 165 -4.020 14.657 -0.017
95 1HD2 LEU 165 HD21 LEU 165 -1.075 16.072 -0.480
96 2HD2 LEU 165 HD22 LEU 165 -0.218 14.690 0.201
97 3HD2 LEU 165 HD23 LEU 165 -1.649 15.327 1.012
98 H LEU 166 HN LEU 166 -1.920 9.536 -0.135
99 HA LEU 166 HA LEU 166 -0.781 8.795 -2.658
100 1HB LEU 166 HB2 LEU 166 1.259 9.633 -2.383
101 2HB LEU 166 HB1 LEU 166 0.740 10.380 -0.883
102 HG LEU 166 HG LEU 166 1.732 7.536 -0.947
103 1HD1 LEU 166 HD11 LEU 166 3.272 10.046 -1.194
104 2HD1 LEU 166 HD12 LEU 166 3.657 8.414 -1.743
105 3HD1 LEU 166 HD13 LEU 166 3.874 8.849 -0.047
106 1HD2 LEU 166 HD21 LEU 166 0.542 8.971 1.024
107 2HD2 LEU 166 HD22 LEU 166 2.243 9.323 1.327
108 3HD2 LEU 166 HD23 LEU 166 1.680 7.652 1.298
109 HA PRO 167 HA PRO 167 -1.834 4.894 -0.824
110 1HB PRO 167 HB2 PRO 167 -0.292 3.311 -2.491
111 2HB PRO 167 HB1 PRO 167 -1.920 3.904 -2.871
112 1HG PRO 167 HG2 PRO 167 0.741 4.986 -3.705
113 2HG PRO 167 HG1 PRO 167 -0.755 4.834 -4.646
114 1HD PRO 167 HD2 PRO 167 0.023 7.188 -3.628
115 2HD PRO 167 HD1 PRO 167 -1.692 6.731 -3.698
116 HA PRO 168 HA PRO 168 1.734 4.627 1.935
117 1HB PRO 168 HB2 PRO 168 0.600 2.742 3.585
118 2HB PRO 168 HB1 PRO 168 0.322 4.488 3.728
119 1HG PRO 168 HG2 PRO 168 -1.377 2.392 2.435
120 2HG PRO 168 HG1 PRO 168 -1.864 3.770 3.440
121 1HD PRO 168 HD2 PRO 168 -2.092 3.816 0.762
122 2HD PRO 168 HD1 PRO 168 -1.681 5.273 1.689
123 H ILE 169 HN ILE 169 2.860 3.617 0.110
124 HA ILE 169 HA ILE 169 2.707 0.792 -0.306
125 HB ILE 169 HB ILE 169 3.583 2.705 -1.877
126 1HG1 ILE 169 HG12 ILE 169 4.899 -0.014 -1.741
127 2HG1 ILE 169 HG11 ILE 169 3.352 0.343 -2.502
128 1HG2 ILE 169 HG21 ILE 169 6.231 1.793 -0.820
129 2HG2 ILE 169 HG22 ILE 169 5.432 3.232 -0.186
130 3HG2 ILE 169 HG23 ILE 169 5.870 3.147 -1.893
131 1HD1 ILE 169 HD11 ILE 169 5.953 1.576 -3.360
132 2HD1 ILE 169 HD12 ILE 169 4.401 1.641 -4.194
133 3HD1 ILE 169 HD13 ILE 169 5.272 0.113 -4.070
134 H ILE 170 HN ILE 170 4.677 2.944 1.582
135 HA ILE 170 HA ILE 170 6.653 1.055 2.359
136 HB ILE 170 HB ILE 170 5.911 3.538 3.889
137 1HG1 ILE 170 HG12 ILE 170 6.145 4.320 1.657
138 2HG1 ILE 170 HG11 ILE 170 7.681 4.655 2.450
139 1HG2 ILE 170 HG21 ILE 170 8.483 2.002 3.568
140 2HG2 ILE 170 HG22 ILE 170 7.485 2.116 5.018
141 3HG2 ILE 170 HG23 ILE 170 8.332 3.542 4.416
142 1HD1 ILE 170 HD11 ILE 170 7.250 2.189 0.800
143 2HD1 ILE 170 HD12 ILE 170 8.770 2.931 1.300
144 3HD1 ILE 170 HD13 ILE 170 7.756 3.723 0.094
145 H LEU 171 HN LEU 171 3.685 2.279 3.876
146 HA LEU 171 HA LEU 171 3.991 0.831 6.298
147 1HB LEU 171 HB2 LEU 171 2.372 2.338 6.717
148 2HB LEU 171 HB1 LEU 171 1.956 2.490 5.023
149 HG LEU 171 HG LEU 171 0.547 0.464 5.203
150 1HD1 LEU 171 HD11 LEU 171 1.994 -0.168 7.381
151 2HD1 LEU 171 HD12 LEU 171 0.391 -0.822 7.046
152 3HD1 LEU 171 HD13 LEU 171 0.573 0.543 8.147
153 1HD2 LEU 171 HD21 LEU 171 0.007 2.774 7.049
154 2HD2 LEU 171 HD22 LEU 171 -1.177 1.504 6.743
155 3HD2 LEU 171 HD23 LEU 171 -0.601 2.511 5.415
156 H ASP 172 HN ASP 172 2.035 0.261 3.400
157 HA ASP 172 HA ASP 172 1.306 -2.395 4.164
158 1HB ASP 172 HB2 ASP 172 1.103 -1.063 1.451
159 2HB ASP 172 HB1 ASP 172 0.262 -2.533 1.966
160 H ALA 173 HN ALA 173 4.216 -1.191 3.214
161 HA ALA 173 HA ALA 173 5.016 -3.126 1.281
162 1HB ALA 173 HB1 ALA 173 6.675 -1.665 1.061
163 2HB ALA 173 HB2 ALA 173 7.301 -2.171 2.631
164 3HB ALA 173 HB3 ALA 173 6.166 -0.826 2.526
165 H GLY 174 HN GLY 174 5.972 -2.636 4.672
166 1HA GLY 174 HA2 GLY 174 6.495 -5.538 4.868
167 2HA GLY 174 HA1 GLY 174 7.294 -4.299 5.854
168 H TYR 175 HN TYR 175 4.536 -2.956 5.986
169 HA TYR 175 HA TYR 175 2.641 -2.976 7.242
170 1HB TYR 175 HB2 TYR 175 2.886 -5.631 6.659
171 2HB TYR 175 HB1 TYR 175 2.974 -5.661 8.418
172 HD1 TYR 175 HD1 TYR 175 0.971 -6.092 9.459
173 HD2 TYR 175 HD2 TYR 175 0.943 -3.863 5.835
174 HE1 TYR 175 HE1 TYR 175 -1.478 -5.926 9.586
175 HE2 TYR 175 HE2 TYR 175 -1.506 -3.690 5.953
176 HH TYR 175 HH TYR 175 -3.405 -5.224 7.141
177 H PHE 176 HN PHE 176 5.643 -4.181 8.590
178 HA PHE 176 HA PHE 176 4.840 -3.350 11.268
179 1HB PHE 176 HB2 PHE 176 6.156 -5.032 11.932
180 2HB PHE 176 HB1 PHE 176 6.568 -5.365 10.246
181 HD1 PHE 176 HD1 PHE 176 7.818 -4.459 13.414
182 HD2 PHE 176 HD2 PHE 176 8.479 -3.901 9.247
183 HE1 PHE 176 HE1 PHE 176 10.152 -3.830 13.872
184 HE2 PHE 176 HE2 PHE 176 10.814 -3.270 9.697
185 HZ PHE 176 HZ PHE 176 11.653 -3.235 12.013
186 H LEU 177 HN LEU 177 6.015 -1.867 8.608
187 HA LEU 177 HA LEU 177 8.207 -0.375 9.478
188 1HB LEU 177 HB2 LEU 177 6.148 -0.085 7.363
189 2HB LEU 177 HB1 LEU 177 7.076 1.343 7.775
190 HG LEU 177 HG LEU 177 7.842 -0.274 5.855
191 1HD1 LEU 177 HD11 LEU 177 10.090 0.491 7.620
192 2HD1 LEU 177 HD12 LEU 177 8.984 1.770 7.116
193 3HD1 LEU 177 HD13 LEU 177 9.832 0.810 5.904
194 1HD2 LEU 177 HD21 LEU 177 7.860 -2.214 7.530
195 2HD2 LEU 177 HD22 LEU 177 9.362 -1.506 8.126
196 3HD2 LEU 177 HD23 LEU 177 9.244 -2.043 6.450
197 HA PRO 178 HA PRO 178 4.925 2.978 10.856
198 1HB PRO 178 HB2 PRO 178 2.595 1.278 11.493
199 2HB PRO 178 HB1 PRO 178 2.662 2.813 10.622
200 1HG PRO 178 HG2 PRO 178 2.179 0.510 9.352
201 2HG PRO 178 HG1 PRO 178 3.142 1.796 8.603
202 1HD PRO 178 HD2 PRO 178 4.057 -0.729 9.931
203 2HD PRO 178 HD1 PRO 178 4.641 0.032 8.438
204 H LEU 179 HN LEU 179 6.745 2.162 12.405
205 HA LEU 179 HA LEU 179 5.551 1.109 14.877
206 1HB LEU 179 HB2 LEU 179 8.169 0.820 13.591
207 2HB LEU 179 HB1 LEU 179 8.264 1.165 15.308
208 HG LEU 179 HG LEU 179 6.499 -1.040 14.301
209 1HD1 LEU 179 HD11 LEU 179 8.322 -2.611 14.567
210 2HD1 LEU 179 HD12 LEU 179 9.430 -1.295 14.955
211 3HD1 LEU 179 HD13 LEU 179 8.729 -1.410 13.341
212 1HD2 LEU 179 HD21 LEU 179 7.634 -0.141 16.886
213 2HD2 LEU 179 HD22 LEU 179 7.463 -1.878 16.634
214 3HD2 LEU 179 HD23 LEU 179 6.052 -0.826 16.518
215 H ARG 180 HN ARG 180 7.848 3.574 13.730
216 HA ARG 180 HA ARG 180 7.636 5.009 16.246
217 1HB ARG 180 HB2 ARG 180 9.335 6.491 15.335
218 2HB ARG 180 HB1 ARG 180 9.821 4.807 15.112
219 1HG ARG 180 HG2 ARG 180 8.360 6.106 12.885
220 2HG ARG 180 HG1 ARG 180 10.018 6.628 13.187
221 1HD ARG 180 HD2 ARG 180 10.733 4.845 12.075
222 2HD ARG 180 HD1 ARG 180 10.042 3.824 13.335
223 HE ARG 180 HE ARG 180 8.477 3.175 11.823
224 1HH1 ARG 180 1HH1 ARG 180 9.621 6.338 10.892
225 2HH1 ARG 180 2HH1 ARG 180 8.652 6.404 9.458
226 1HH2 ARG 180 1HH2 ARG 180 7.201 3.261 9.936
227 2HH2 ARG 180 2HH2 ARG 180 7.278 4.658 8.916
228 1HG HSL 181 HG1 HSL 181 2.576 7.711 11.810
229 2HG HSL 181 HG2 HSL 181 2.288 6.027 11.125
230 H HSL 181 HN HSL 181 5.581 4.640 13.868
231 HA HSL 181 HA HSL 181 4.719 7.579 13.757
232 1HB HSL 181 HB1 HSL 181 4.873 7.131 11.434
233 2HB HSL 181 HB2 HSL 181 4.542 5.331 11.665
Start of MODEL 26
1 1H PHE 155 HT1 PHE 155 -4.851 6.333 -18.182
2 2H PHE 155 HT2 PHE 155 -5.993 5.052 -18.202
3 3H PHE 155 HT3 PHE 155 -4.801 5.162 -19.432
4 HA PHE 155 HA PHE 155 -4.449 3.482 -17.637
5 1HB PHE 155 HB2 PHE 155 -1.985 4.162 -17.532
6 2HB PHE 155 HB1 PHE 155 -2.685 3.983 -19.138
7 HD1 PHE 155 HD1 PHE 155 -2.768 5.796 -20.641
8 HD2 PHE 155 HD2 PHE 155 -1.653 6.446 -16.586
9 HE1 PHE 155 HE1 PHE 155 -2.048 8.079 -21.210
10 HE2 PHE 155 HE2 PHE 155 -0.932 8.730 -17.147
11 HZ PHE 155 HZ PHE 155 -1.129 9.550 -19.461
12 H LEU 156 HN LEU 156 -3.528 3.160 -15.543
13 HA LEU 156 HA LEU 156 -4.531 4.964 -13.585
14 1HB LEU 156 HB2 LEU 156 -3.619 3.402 -11.957
15 2HB LEU 156 HB1 LEU 156 -4.509 2.556 -13.207
16 HG LEU 156 HG LEU 156 -2.194 2.185 -14.303
17 1HD1 LEU 156 HD11 LEU 156 -1.478 3.219 -11.602
18 2HD1 LEU 156 HD12 LEU 156 -0.686 3.480 -13.158
19 3HD1 LEU 156 HD13 LEU 156 -0.499 1.939 -12.318
20 1HD2 LEU 156 HD21 LEU 156 -2.376 0.668 -11.766
21 2HD2 LEU 156 HD22 LEU 156 -2.196 0.091 -13.422
22 3HD2 LEU 156 HD23 LEU 156 -3.774 0.619 -12.839
23 H GLN 157 HN GLN 157 -2.848 5.290 -11.598
24 HA GLN 157 HA GLN 157 -0.190 5.971 -12.338
25 1HB GLN 157 HB2 GLN 157 -2.269 7.996 -12.663
26 2HB GLN 157 HB1 GLN 157 -0.972 8.525 -11.601
27 1HG GLN 157 HG2 GLN 157 -0.742 7.608 -14.454
28 2HG GLN 157 HG1 GLN 157 -0.453 9.224 -13.812
29 1HE2 GLN 157 HE21 GLN 157 1.055 6.610 -14.974
30 2HE2 GLN 157 HE22 GLN 157 2.568 6.727 -14.146
31 H SER 158 HN SER 158 -1.755 4.616 -10.232
32 HA SER 158 HA SER 158 -0.179 5.410 -8.024
33 1HB SER 158 HB2 SER 158 -1.503 7.094 -7.291
34 2HB SER 158 HB1 SER 158 -2.881 6.562 -8.265
35 HG SER 158 HG SER 158 -3.382 5.066 -6.668
36 H ASP 159 HN ASP 159 -0.684 3.083 -9.515
37 HA ASP 159 HA ASP 159 -0.691 0.847 -9.029
38 1HB ASP 159 HB2 ASP 159 -0.509 1.808 -6.531
39 2HB ASP 159 HB1 ASP 159 -2.113 1.085 -6.444
40 H VAL 160 HN VAL 160 -3.547 2.798 -8.475
41 HA VAL 160 HA VAL 160 -5.660 2.540 -9.316
42 HB VAL 160 HB VAL 160 -4.283 0.742 -10.909
43 1HG1 VAL 160 HG11 VAL 160 -6.646 -0.719 -9.733
44 2HG1 VAL 160 HG12 VAL 160 -4.952 -1.132 -9.467
45 3HG1 VAL 160 HG13 VAL 160 -5.645 -1.257 -11.084
46 1HG2 VAL 160 HG21 VAL 160 -7.222 1.409 -10.985
47 2HG2 VAL 160 HG22 VAL 160 -6.258 0.809 -12.335
48 3HG2 VAL 160 HG23 VAL 160 -5.916 2.395 -11.645
49 H PHE 161 HN PHE 161 -4.315 -0.317 -7.724
50 HA PHE 161 HA PHE 161 -6.779 -1.045 -6.467
51 1HB PHE 161 HB2 PHE 161 -4.965 -2.688 -6.976
52 2HB PHE 161 HB1 PHE 161 -3.961 -1.901 -5.762
53 HD1 PHE 161 HD1 PHE 161 -7.527 -2.995 -5.847
54 HD2 PHE 161 HD2 PHE 161 -3.749 -3.213 -3.901
55 HE1 PHE 161 HE1 PHE 161 -8.509 -4.435 -4.110
56 HE2 PHE 161 HE2 PHE 161 -4.723 -4.653 -2.160
57 HZ PHE 161 HZ PHE 161 -7.107 -5.266 -2.265
58 H PHE 162 HN PHE 162 -5.239 1.640 -6.129
59 HA PHE 162 HA PHE 162 -6.021 2.074 -3.414
60 1HB PHE 162 HB2 PHE 162 -3.116 2.189 -4.220
61 2HB PHE 162 HB1 PHE 162 -3.766 2.947 -2.763
62 HD1 PHE 162 HD1 PHE 162 -2.090 0.169 -3.923
63 HD2 PHE 162 HD2 PHE 162 -5.305 1.232 -1.345
64 HE1 PHE 162 HE1 PHE 162 -1.801 -1.945 -2.699
65 HE2 PHE 162 HE2 PHE 162 -5.022 -0.881 -0.116
66 HZ PHE 162 HZ PHE 162 -3.268 -2.473 -0.791
67 H LEU 163 HN LEU 163 -5.955 3.047 -6.459
68 HA LEU 163 HA LEU 163 -5.212 5.796 -6.330
69 1HB LEU 163 HB2 LEU 163 -6.429 3.959 -8.236
70 2HB LEU 163 HB1 LEU 163 -7.180 5.539 -8.284
71 HG LEU 163 HG LEU 163 -4.206 5.215 -8.471
72 1HD1 LEU 163 HD11 LEU 163 -4.307 4.455 -10.549
73 2HD1 LEU 163 HD12 LEU 163 -5.450 5.715 -11.010
74 3HD1 LEU 163 HD13 LEU 163 -6.036 4.198 -10.327
75 1HD2 LEU 163 HD21 LEU 163 -6.191 7.389 -8.991
76 2HD2 LEU 163 HD22 LEU 163 -4.645 7.378 -9.840
77 3HD2 LEU 163 HD23 LEU 163 -4.683 7.443 -8.078
78 H PHE 164 HN PHE 164 -7.522 4.028 -4.879
79 HA PHE 164 HA PHE 164 -9.831 5.667 -5.061
80 1HB PHE 164 HB2 PHE 164 -9.232 3.163 -4.091
81 2HB PHE 164 HB1 PHE 164 -9.542 4.073 -2.617
82 HD1 PHE 164 HD1 PHE 164 -11.068 4.036 -6.024
83 HD2 PHE 164 HD2 PHE 164 -11.656 3.696 -1.824
84 HE1 PHE 164 HE1 PHE 164 -13.489 3.788 -6.388
85 HE2 PHE 164 HE2 PHE 164 -14.077 3.446 -2.179
86 HZ PHE 164 HZ PHE 164 -14.997 3.491 -4.463
87 H LEU 165 HN LEU 165 -6.900 6.177 -3.467
88 HA LEU 165 HA LEU 165 -7.736 8.577 -2.278
89 1HB LEU 165 HB2 LEU 165 -8.075 6.196 -0.658
90 2HB LEU 165 HB1 LEU 165 -6.990 7.348 0.101
91 HG LEU 165 HG LEU 165 -9.752 8.061 -0.879
92 1HD1 LEU 165 HD11 LEU 165 -8.837 6.810 1.631
93 2HD1 LEU 165 HD12 LEU 165 -10.406 6.738 0.827
94 3HD1 LEU 165 HD13 LEU 165 -9.970 8.152 1.788
95 1HD2 LEU 165 HD21 LEU 165 -7.867 9.489 0.991
96 2HD2 LEU 165 HD22 LEU 165 -9.457 10.047 0.471
97 3HD2 LEU 165 HD23 LEU 165 -8.144 9.915 -0.699
98 H LEU 166 HN LEU 166 -5.520 6.001 -1.230
99 HA LEU 166 HA LEU 166 -3.218 7.379 -2.238
100 1HB LEU 166 HB2 LEU 166 -4.108 7.829 0.487
101 2HB LEU 166 HB1 LEU 166 -2.496 7.140 0.447
102 HG LEU 166 HG LEU 166 -2.988 9.427 -1.371
103 1HD1 LEU 166 HD11 LEU 166 -2.428 10.056 1.489
104 2HD1 LEU 166 HD12 LEU 166 -4.097 9.847 0.958
105 3HD1 LEU 166 HD13 LEU 166 -3.084 11.084 0.215
106 1HD2 LEU 166 HD21 LEU 166 -0.804 8.019 -0.699
107 2HD2 LEU 166 HD22 LEU 166 -0.712 9.302 0.506
108 3HD2 LEU 166 HD23 LEU 166 -0.751 9.706 -1.210
109 HA PRO 167 HA PRO 167 -2.183 3.038 -2.106
110 1HB PRO 167 HB2 PRO 167 0.170 3.165 -3.413
111 2HB PRO 167 HB1 PRO 167 -1.390 3.334 -4.245
112 1HG PRO 167 HG2 PRO 167 0.532 5.458 -3.368
113 2HG PRO 167 HG1 PRO 167 -0.372 5.326 -4.887
114 1HD PRO 167 HD2 PRO 167 -1.140 6.927 -2.814
115 2HD PRO 167 HD1 PRO 167 -2.281 6.211 -3.968
116 HA PRO 168 HA PRO 168 0.490 3.452 1.551
117 1HB PRO 168 HB2 PRO 168 -0.238 1.147 2.723
118 2HB PRO 168 HB1 PRO 168 -1.294 2.575 2.741
119 1HG PRO 168 HG2 PRO 168 -1.387 0.173 0.943
120 2HG PRO 168 HG1 PRO 168 -2.718 0.982 1.792
121 1HD PRO 168 HD2 PRO 168 -2.158 1.415 -0.831
122 2HD PRO 168 HD1 PRO 168 -2.862 2.658 0.223
123 H ILE 169 HN ILE 169 2.233 3.149 -0.126
124 HA ILE 169 HA ILE 169 3.131 0.493 -0.711
125 HB ILE 169 HB ILE 169 3.532 2.625 -2.084
126 1HG1 ILE 169 HG12 ILE 169 6.010 1.724 -2.545
127 2HG1 ILE 169 HG11 ILE 169 5.423 0.395 -1.551
128 1HG2 ILE 169 HG21 ILE 169 5.846 2.900 -0.183
129 2HG2 ILE 169 HG22 ILE 169 4.450 3.976 -0.266
130 3HG2 ILE 169 HG23 ILE 169 5.558 3.863 -1.634
131 1HD1 ILE 169 HD11 ILE 169 4.515 1.295 -4.241
132 2HD1 ILE 169 HD12 ILE 169 3.396 0.439 -3.179
133 3HD1 ILE 169 HD13 ILE 169 4.908 -0.326 -3.667
134 H ILE 170 HN ILE 170 4.169 3.055 1.471
135 HA ILE 170 HA ILE 170 6.352 1.585 2.583
136 HB ILE 170 HB ILE 170 4.975 3.979 3.800
137 1HG1 ILE 170 HG12 ILE 170 7.234 4.949 2.601
138 2HG1 ILE 170 HG11 ILE 170 6.717 3.734 1.436
139 1HG2 ILE 170 HG21 ILE 170 6.868 4.268 5.108
140 2HG2 ILE 170 HG22 ILE 170 7.870 3.265 4.059
141 3HG2 ILE 170 HG23 ILE 170 6.659 2.517 5.101
142 1HD1 ILE 170 HD11 ILE 170 4.381 5.026 1.974
143 2HD1 ILE 170 HD12 ILE 170 5.447 5.368 0.611
144 3HD1 ILE 170 HD13 ILE 170 5.563 6.331 2.083
145 H LEU 171 HN LEU 171 3.028 2.277 3.609
146 HA LEU 171 HA LEU 171 3.234 1.061 6.155
147 1HB LEU 171 HB2 LEU 171 1.039 1.967 4.384
148 2HB LEU 171 HB1 LEU 171 0.615 0.747 5.569
149 HG LEU 171 HG LEU 171 0.201 3.113 6.285
150 1HD1 LEU 171 HD11 LEU 171 1.848 2.603 8.435
151 2HD1 LEU 171 HD12 LEU 171 1.574 1.004 7.742
152 3HD1 LEU 171 HD13 LEU 171 0.202 2.007 8.219
153 1HD2 LEU 171 HD21 LEU 171 3.067 3.455 6.914
154 2HD2 LEU 171 HD22 LEU 171 1.842 4.654 6.500
155 3HD2 LEU 171 HD23 LEU 171 2.597 3.689 5.231
156 H ASP 172 HN ASP 172 1.755 -0.117 3.147
157 HA ASP 172 HA ASP 172 1.572 -2.807 4.098
158 1HB ASP 172 HB2 ASP 172 1.298 -1.772 1.267
159 2HB ASP 172 HB1 ASP 172 0.756 -3.345 1.870
160 H ALA 173 HN ALA 173 4.243 -1.112 3.372
161 HA ALA 173 HA ALA 173 5.603 -2.865 1.587
162 1HB ALA 173 HB1 ALA 173 7.009 -1.148 1.513
163 2HB ALA 173 HB2 ALA 173 7.475 -1.451 3.187
164 3HB ALA 173 HB3 ALA 173 6.132 -0.367 2.827
165 H GLY 174 HN GLY 174 5.912 -2.230 5.070
166 1HA GLY 174 HA2 GLY 174 6.884 -5.004 5.406
167 2HA GLY 174 HA1 GLY 174 7.522 -3.641 6.346
168 H TYR 175 HN TYR 175 4.346 -3.020 5.935
169 HA TYR 175 HA TYR 175 2.555 -2.921 7.263
170 1HB TYR 175 HB2 TYR 175 2.183 -5.284 8.518
171 2HB TYR 175 HB1 TYR 175 1.748 -4.976 6.844
172 HD1 TYR 175 HD1 TYR 175 3.391 -5.671 5.031
173 HD2 TYR 175 HD2 TYR 175 3.731 -6.954 9.073
174 HE1 TYR 175 HE1 TYR 175 4.831 -7.531 4.313
175 HE2 TYR 175 HE2 TYR 175 5.173 -8.815 8.368
176 HH TYR 175 HH TYR 175 6.492 -9.026 5.210
177 H PHE 176 HN PHE 176 4.927 -4.824 9.117
178 HA PHE 176 HA PHE 176 4.170 -3.329 11.510
179 1HB PHE 176 HB2 PHE 176 5.568 -5.917 10.999
180 2HB PHE 176 HB1 PHE 176 5.935 -5.049 12.497
181 HD1 PHE 176 HD1 PHE 176 3.692 -4.129 13.692
182 HD2 PHE 176 HD2 PHE 176 3.952 -7.524 11.140
183 HE1 PHE 176 HE1 PHE 176 1.665 -5.059 14.731
184 HE2 PHE 176 HE2 PHE 176 1.924 -8.460 12.173
185 HZ PHE 176 HZ PHE 176 0.779 -7.229 13.972
186 H LEU 177 HN LEU 177 5.842 -2.262 9.238
187 HA LEU 177 HA LEU 177 8.418 -1.842 10.520
188 1HB LEU 177 HB2 LEU 177 7.289 -1.265 7.816
189 2HB LEU 177 HB1 LEU 177 8.689 -0.363 8.365
190 HG LEU 177 HG LEU 177 8.499 -3.357 8.049
191 1HD1 LEU 177 HD11 LEU 177 9.792 -3.155 6.152
192 2HD1 LEU 177 HD12 LEU 177 10.402 -1.565 6.608
193 3HD1 LEU 177 HD13 LEU 177 8.746 -1.739 6.027
194 1HD2 LEU 177 HD21 LEU 177 11.083 -2.983 8.438
195 2HD2 LEU 177 HD22 LEU 177 9.974 -3.227 9.789
196 3HD2 LEU 177 HD23 LEU 177 10.503 -1.599 9.365
197 HA PRO 178 HA PRO 178 6.599 2.711 10.243
198 1HB PRO 178 HB2 PRO 178 3.708 2.075 10.402
199 2HB PRO 178 HB1 PRO 178 4.539 3.296 9.434
200 1HG PRO 178 HG2 PRO 178 3.540 1.094 8.307
201 2HG PRO 178 HG1 PRO 178 5.075 1.792 7.757
202 1HD PRO 178 HD2 PRO 178 4.592 -0.586 9.510
203 2HD PRO 178 HD1 PRO 178 5.788 -0.360 8.219
204 H LEU 179 HN LEU 179 5.027 0.090 11.969
205 HA LEU 179 HA LEU 179 4.214 1.543 14.245
206 1HB LEU 179 HB2 LEU 179 4.812 -1.367 13.774
207 2HB LEU 179 HB1 LEU 179 4.307 -0.770 15.342
208 HG LEU 179 HG LEU 179 2.188 -0.021 14.425
209 1HD1 LEU 179 HD11 LEU 179 2.785 0.669 12.231
210 2HD1 LEU 179 HD12 LEU 179 1.620 -0.643 12.062
211 3HD1 LEU 179 HD13 LEU 179 3.337 -0.950 11.803
212 1HD2 LEU 179 HD21 LEU 179 2.842 -2.564 14.942
213 2HD2 LEU 179 HD22 LEU 179 2.352 -2.730 13.256
214 3HD2 LEU 179 HD23 LEU 179 1.226 -2.068 14.441
215 H ARG 180 HN ARG 180 7.014 -0.624 13.812
216 HA ARG 180 HA ARG 180 8.239 0.431 16.223
217 1HB ARG 180 HB2 ARG 180 9.191 -1.668 14.261
218 2HB ARG 180 HB1 ARG 180 10.002 -1.250 15.774
219 1HG ARG 180 HG2 ARG 180 7.214 -2.373 15.535
220 2HG ARG 180 HG1 ARG 180 8.659 -3.289 15.969
221 1HD ARG 180 HD2 ARG 180 8.074 -2.815 18.082
222 2HD ARG 180 HD1 ARG 180 8.763 -1.228 17.746
223 HE ARG 180 HE ARG 180 6.208 -0.956 16.927
224 1HH1 ARG 180 1HH1 ARG 180 7.630 -2.119 19.894
225 2HH1 ARG 180 2HH1 ARG 180 6.302 -1.605 20.878
226 1HH2 ARG 180 1HH2 ARG 180 4.461 -0.279 18.220
227 2HH2 ARG 180 2HH2 ARG 180 4.503 -0.560 19.928
228 1HG HSL 181 HG1 HSL 181 8.365 5.833 11.855
229 2HG HSL 181 HG2 HSL 181 7.205 4.808 12.850
230 H HSL 181 HN HSL 181 7.859 2.412 14.370
231 HA HSL 181 HA HSL 181 10.697 2.993 13.369
232 1HB HSL 181 HB1 HSL 181 9.881 4.050 11.467
233 2HB HSL 181 HB2 HSL 181 8.381 3.013 11.747
Start of MODEL 27
1 1H PHE 155 HT1 PHE 155 -7.186 -3.025 -11.565
2 2H PHE 155 HT2 PHE 155 -8.145 -3.266 -12.967
3 3H PHE 155 HT3 PHE 155 -6.777 -4.262 -12.678
4 HA PHE 155 HA PHE 155 -8.616 -5.521 -12.129
5 1HB PHE 155 HB2 PHE 155 -6.644 -4.741 -10.292
6 2HB PHE 155 HB1 PHE 155 -8.144 -4.813 -9.377
7 HD1 PHE 155 HD1 PHE 155 -9.442 -7.042 -10.990
8 HD2 PHE 155 HD2 PHE 155 -5.544 -6.596 -9.340
9 HE1 PHE 155 HE1 PHE 155 -9.232 -9.487 -10.837
10 HE2 PHE 155 HE2 PHE 155 -5.326 -9.042 -9.185
11 HZ PHE 155 HZ PHE 155 -7.172 -10.491 -9.934
12 H LEU 156 HN LEU 156 -10.129 -5.565 -9.873
13 HA LEU 156 HA LEU 156 -11.599 -3.174 -9.468
14 1HB LEU 156 HB2 LEU 156 -13.672 -3.799 -10.510
15 2HB LEU 156 HB1 LEU 156 -12.394 -3.793 -11.705
16 HG LEU 156 HG LEU 156 -13.642 -5.670 -12.254
17 1HD1 LEU 156 HD11 LEU 156 -11.189 -6.120 -11.952
18 2HD1 LEU 156 HD12 LEU 156 -12.240 -7.535 -11.931
19 3HD1 LEU 156 HD13 LEU 156 -11.602 -6.889 -10.421
20 1HD2 LEU 156 HD21 LEU 156 -14.470 -5.587 -9.573
21 2HD2 LEU 156 HD22 LEU 156 -13.777 -7.188 -9.830
22 3HD2 LEU 156 HD23 LEU 156 -15.084 -6.617 -10.865
23 H GLN 157 HN GLN 157 -12.364 -3.256 -7.474
24 HA GLN 157 HA GLN 157 -13.760 -5.438 -6.373
25 1HB GLN 157 HB2 GLN 157 -10.880 -5.544 -6.144
26 2HB GLN 157 HB1 GLN 157 -11.624 -5.445 -4.553
27 1HG GLN 157 HG2 GLN 157 -12.539 -7.500 -4.698
28 2HG GLN 157 HG1 GLN 157 -12.830 -7.369 -6.433
29 1HE2 GLN 157 HE21 GLN 157 -10.666 -7.211 -7.701
30 2HE2 GLN 157 HE22 GLN 157 -9.495 -8.412 -7.288
31 H SER 158 HN SER 158 -15.079 -3.556 -6.015
32 HA SER 158 HA SER 158 -16.023 -1.986 -4.675
33 1HB SER 158 HB2 SER 158 -14.161 -3.382 -2.800
34 2HB SER 158 HB1 SER 158 -14.919 -1.871 -2.267
35 HG SER 158 HG SER 158 -16.845 -2.811 -2.284
36 H ASP 159 HN ASP 159 -14.863 -0.611 -6.340
37 HA ASP 159 HA ASP 159 -14.009 1.464 -6.743
38 1HB ASP 159 HB2 ASP 159 -14.555 1.628 -4.090
39 2HB ASP 159 HB1 ASP 159 -12.812 1.870 -4.075
40 H VAL 160 HN VAL 160 -11.843 -0.105 -4.390
41 HA VAL 160 HA VAL 160 -9.691 -0.847 -4.575
42 HB VAL 160 HB VAL 160 -9.954 -0.113 -7.489
43 1HG1 VAL 160 HG11 VAL 160 -7.638 -0.015 -6.974
44 2HG1 VAL 160 HG12 VAL 160 -7.921 -1.578 -7.741
45 3HG1 VAL 160 HG13 VAL 160 -7.729 -1.476 -5.990
46 1HG2 VAL 160 HG21 VAL 160 -10.583 -2.260 -7.917
47 2HG2 VAL 160 HG22 VAL 160 -11.265 -2.080 -6.300
48 3HG2 VAL 160 HG23 VAL 160 -9.723 -2.906 -6.519
49 H PHE 161 HN PHE 161 -10.337 2.151 -6.362
50 HA PHE 161 HA PHE 161 -7.790 3.303 -5.850
51 1HB PHE 161 HB2 PHE 161 -9.670 3.859 -7.655
52 2HB PHE 161 HB1 PHE 161 -10.142 5.034 -6.431
53 HD1 PHE 161 HD1 PHE 161 -6.769 3.862 -7.486
54 HD2 PHE 161 HD2 PHE 161 -9.515 7.103 -7.229
55 HE1 PHE 161 HE1 PHE 161 -5.024 5.399 -8.291
56 HE2 PHE 161 HE2 PHE 161 -7.776 8.645 -8.034
57 HZ PHE 161 HZ PHE 161 -5.526 7.794 -8.567
58 H PHE 162 HN PHE 162 -10.227 2.615 -3.774
59 HA PHE 162 HA PHE 162 -9.177 4.322 -1.739
60 1HB PHE 162 HB2 PHE 162 -11.895 4.859 -2.902
61 2HB PHE 162 HB1 PHE 162 -11.543 5.224 -1.210
62 HD1 PHE 162 HD1 PHE 162 -12.045 6.872 -4.017
63 HD2 PHE 162 HD2 PHE 162 -8.840 6.253 -1.286
64 HE1 PHE 162 HE1 PHE 162 -11.059 9.023 -4.691
65 HE2 PHE 162 HE2 PHE 162 -7.850 8.403 -1.954
66 HZ PHE 162 HZ PHE 162 -8.959 9.792 -3.658
67 H LEU 163 HN LEU 163 -10.074 1.432 -2.565
68 HA LEU 163 HA LEU 163 -11.960 0.631 -0.604
69 1HB LEU 163 HB2 LEU 163 -11.541 -0.760 -2.542
70 2HB LEU 163 HB1 LEU 163 -9.849 -0.916 -2.113
71 HG LEU 163 HG LEU 163 -10.468 -2.198 -0.112
72 1HD1 LEU 163 HD11 LEU 163 -12.636 -1.219 0.337
73 2HD1 LEU 163 HD12 LEU 163 -12.788 -2.967 0.161
74 3HD1 LEU 163 HD13 LEU 163 -13.281 -1.902 -1.156
75 1HD2 LEU 163 HD21 LEU 163 -11.894 -3.937 -1.774
76 2HD2 LEU 163 HD22 LEU 163 -10.153 -3.909 -1.494
77 3HD2 LEU 163 HD23 LEU 163 -10.843 -3.014 -2.847
78 H PHE 164 HN PHE 164 -8.687 1.525 -0.541
79 HA PHE 164 HA PHE 164 -7.181 1.735 1.142
80 1HB PHE 164 HB2 PHE 164 -9.365 2.283 2.410
81 2HB PHE 164 HB1 PHE 164 -9.202 0.666 3.092
82 HD1 PHE 164 HD1 PHE 164 -7.790 4.038 2.972
83 HD2 PHE 164 HD2 PHE 164 -7.450 0.149 4.667
84 HE1 PHE 164 HE1 PHE 164 -6.252 4.920 4.677
85 HE2 PHE 164 HE2 PHE 164 -5.911 1.024 6.376
86 HZ PHE 164 HZ PHE 164 -5.312 3.413 6.384
87 H LEU 165 HN LEU 165 -7.780 -0.871 -0.287
88 HA LEU 165 HA LEU 165 -7.190 -2.999 1.485
89 1HB LEU 165 HB2 LEU 165 -7.846 -2.727 -1.220
90 2HB LEU 165 HB1 LEU 165 -6.264 -3.483 -1.205
91 HG LEU 165 HG LEU 165 -8.195 -5.075 -1.278
92 1HD1 LEU 165 HD11 LEU 165 -7.106 -6.666 -0.018
93 2HD1 LEU 165 HD12 LEU 165 -6.692 -5.525 1.262
94 3HD1 LEU 165 HD13 LEU 165 -5.829 -5.478 -0.276
95 1HD2 LEU 165 HD21 LEU 165 -9.199 -3.475 0.754
96 2HD2 LEU 165 HD22 LEU 165 -8.717 -4.964 1.567
97 3HD2 LEU 165 HD23 LEU 165 -9.845 -5.025 0.213
98 H LEU 166 HN LEU 166 -5.178 -1.138 -0.776
99 HA LEU 166 HA LEU 166 -2.875 -1.467 0.918
100 1HB LEU 166 HB2 LEU 166 -3.313 -3.488 -0.853
101 2HB LEU 166 HB1 LEU 166 -2.300 -2.418 -1.806
102 HG LEU 166 HG LEU 166 -0.924 -2.515 0.557
103 1HD1 LEU 166 HD11 LEU 166 -2.141 -5.232 0.085
104 2HD1 LEU 166 HD12 LEU 166 -2.359 -4.208 1.505
105 3HD1 LEU 166 HD13 LEU 166 -0.776 -4.901 1.153
106 1HD2 LEU 166 HD21 LEU 166 0.413 -2.759 -1.255
107 2HD2 LEU 166 HD22 LEU 166 -0.715 -3.830 -2.084
108 3HD2 LEU 166 HD23 LEU 166 0.314 -4.459 -0.797
109 HA PRO 167 HA PRO 167 -3.181 2.170 -2.214
110 1HB PRO 167 HB2 PRO 167 -3.620 4.130 -0.317
111 2HB PRO 167 HB1 PRO 167 -4.868 3.390 -1.334
112 1HG PRO 167 HG2 PRO 167 -4.147 2.834 1.500
113 2HG PRO 167 HG1 PRO 167 -5.733 2.818 0.714
114 1HD PRO 167 HD2 PRO 167 -4.373 0.550 1.326
115 2HD PRO 167 HD1 PRO 167 -5.471 0.670 -0.062
116 HA PRO 168 HA PRO 168 0.542 3.681 0.287
117 1HB PRO 168 HB2 PRO 168 1.026 2.883 2.735
118 2HB PRO 168 HB1 PRO 168 -0.417 3.873 2.433
119 1HG PRO 168 HG2 PRO 168 -0.205 0.932 2.882
120 2HG PRO 168 HG1 PRO 168 -1.442 2.070 3.446
121 1HD PRO 168 HD2 PRO 168 -1.550 0.443 1.135
122 2HD PRO 168 HD1 PRO 168 -2.670 1.734 1.585
123 H ILE 169 HN ILE 169 2.224 2.903 -0.775
124 HA ILE 169 HA ILE 169 2.861 0.143 -1.045
125 HB ILE 169 HB ILE 169 3.425 2.028 -2.675
126 1HG1 ILE 169 HG12 ILE 169 5.659 0.940 -3.271
127 2HG1 ILE 169 HG11 ILE 169 5.441 -0.048 -1.830
128 1HG2 ILE 169 HG21 ILE 169 5.770 2.395 -0.807
129 2HG2 ILE 169 HG22 ILE 169 4.451 3.543 -1.036
130 3HG2 ILE 169 HG23 ILE 169 5.544 3.180 -2.372
131 1HD1 ILE 169 HD11 ILE 169 4.734 -1.131 -3.951
132 2HD1 ILE 169 HD12 ILE 169 3.460 0.083 -4.087
133 3HD1 ILE 169 HD13 ILE 169 3.469 -1.039 -2.726
134 H ILE 170 HN ILE 170 4.176 2.800 0.790
135 HA ILE 170 HA ILE 170 6.351 1.379 1.907
136 HB ILE 170 HB ILE 170 6.634 3.347 3.321
137 1HG1 ILE 170 HG12 ILE 170 3.905 3.886 2.295
138 2HG1 ILE 170 HG11 ILE 170 4.570 4.179 3.893
139 1HG2 ILE 170 HG21 ILE 170 7.473 3.216 0.973
140 2HG2 ILE 170 HG22 ILE 170 7.218 4.857 1.568
141 3HG2 ILE 170 HG23 ILE 170 6.043 4.121 0.477
142 1HD1 ILE 170 HD11 ILE 170 4.496 5.915 1.517
143 2HD1 ILE 170 HD12 ILE 170 5.976 5.975 2.477
144 3HD1 ILE 170 HD13 ILE 170 4.422 6.325 3.232
145 H LEU 171 HN LEU 171 3.171 2.325 3.187
146 HA LEU 171 HA LEU 171 3.622 1.320 5.795
147 1HB LEU 171 HB2 LEU 171 1.813 2.882 5.350
148 2HB LEU 171 HB1 LEU 171 1.046 1.733 4.273
149 HG LEU 171 HG LEU 171 0.090 2.026 6.649
150 1HD1 LEU 171 HD11 LEU 171 -0.058 0.026 4.841
151 2HD1 LEU 171 HD12 LEU 171 -0.942 0.050 6.367
152 3HD1 LEU 171 HD13 LEU 171 0.572 -0.843 6.239
153 1HD2 LEU 171 HD21 LEU 171 1.145 1.113 8.450
154 2HD2 LEU 171 HD22 LEU 171 2.555 1.633 7.528
155 3HD2 LEU 171 HD23 LEU 171 2.040 -0.054 7.476
156 H ASP 172 HN ASP 172 1.723 -0.024 3.115
157 HA ASP 172 HA ASP 172 1.522 -2.604 4.322
158 1HB ASP 172 HB2 ASP 172 0.754 -1.467 1.648
159 2HB ASP 172 HB1 ASP 172 0.664 -3.207 1.952
160 H ALA 173 HN ALA 173 4.190 -1.190 3.145
161 HA ALA 173 HA ALA 173 5.193 -3.160 1.349
162 1HB ALA 173 HB1 ALA 173 6.074 -0.663 2.367
163 2HB ALA 173 HB2 ALA 173 6.765 -1.610 1.050
164 3HB ALA 173 HB3 ALA 173 7.334 -1.849 2.702
165 H GLY 174 HN GLY 174 5.916 -2.368 4.730
166 1HA GLY 174 HA2 GLY 174 6.767 -5.168 5.142
167 2HA GLY 174 HA1 GLY 174 7.379 -3.786 6.075
168 H TYR 175 HN TYR 175 4.645 -2.607 6.123
169 HA TYR 175 HA TYR 175 2.757 -2.589 7.367
170 1HB TYR 175 HB2 TYR 175 2.728 -5.093 6.456
171 2HB TYR 175 HB1 TYR 175 2.986 -5.455 8.158
172 HD1 TYR 175 HD1 TYR 175 0.590 -6.387 6.725
173 HD2 TYR 175 HD2 TYR 175 1.295 -2.719 8.766
174 HE1 TYR 175 HE1 TYR 175 -1.822 -6.156 7.135
175 HE2 TYR 175 HE2 TYR 175 -1.114 -2.480 9.182
176 HH TYR 175 HH TYR 175 -3.326 -3.504 7.829
177 H PHE 176 HN PHE 176 5.427 -4.446 8.771
178 HA PHE 176 HA PHE 176 4.648 -3.631 11.448
179 1HB PHE 176 HB2 PHE 176 6.692 -5.496 10.301
180 2HB PHE 176 HB1 PHE 176 6.875 -4.912 11.962
181 HD1 PHE 176 HD1 PHE 176 6.069 -7.705 10.422
182 HD2 PHE 176 HD2 PHE 176 4.159 -4.874 12.960
183 HE1 PHE 176 HE1 PHE 176 4.516 -9.451 11.191
184 HE2 PHE 176 HE2 PHE 176 2.603 -6.615 13.736
185 HZ PHE 176 HZ PHE 176 2.780 -8.906 12.852
186 H LEU 177 HN LEU 177 6.015 -2.033 9.038
187 HA LEU 177 HA LEU 177 8.448 -1.054 10.034
188 1HB LEU 177 HB2 LEU 177 6.524 -0.307 7.940
189 2HB LEU 177 HB1 LEU 177 7.464 1.032 8.572
190 HG LEU 177 HG LEU 177 8.279 -0.333 6.490
191 1HD1 LEU 177 HD11 LEU 177 10.372 0.181 8.556
192 2HD1 LEU 177 HD12 LEU 177 9.414 1.514 7.913
193 3HD1 LEU 177 HD13 LEU 177 10.392 0.527 6.827
194 1HD2 LEU 177 HD21 LEU 177 9.740 -1.911 8.558
195 2HD2 LEU 177 HD22 LEU 177 9.491 -2.257 6.847
196 3HD2 LEU 177 HD23 LEU 177 8.165 -2.464 7.991
197 HA PRO 178 HA PRO 178 5.769 2.731 11.730
198 1HB PRO 178 HB2 PRO 178 3.210 1.228 12.023
199 2HB PRO 178 HB1 PRO 178 3.473 2.926 11.606
200 1HG PRO 178 HG2 PRO 178 2.766 1.171 9.746
201 2HG PRO 178 HG1 PRO 178 3.957 2.435 9.390
202 1HD PRO 178 HD2 PRO 178 4.377 -0.474 9.918
203 2HD PRO 178 HD1 PRO 178 5.218 0.607 8.793
204 H LEU 179 HN LEU 179 4.434 2.841 13.949
205 HA LEU 179 HA LEU 179 4.309 2.307 16.144
206 1HB LEU 179 HB2 LEU 179 4.349 -0.303 14.833
207 2HB LEU 179 HB1 LEU 179 5.033 -0.345 16.446
208 HG LEU 179 HG LEU 179 2.988 0.504 17.403
209 1HD1 LEU 179 HD11 LEU 179 2.357 1.102 14.580
210 2HD1 LEU 179 HD12 LEU 179 1.945 1.984 16.051
211 3HD1 LEU 179 HD13 LEU 179 1.020 0.554 15.592
212 1HD2 LEU 179 HD21 LEU 179 1.951 -1.535 15.506
213 2HD2 LEU 179 HD22 LEU 179 1.784 -1.429 17.259
214 3HD2 LEU 179 HD23 LEU 179 3.304 -1.973 16.548
215 H ARG 180 HN ARG 180 6.233 3.694 16.042
216 HA ARG 180 HA ARG 180 8.255 4.248 16.953
217 1HB ARG 180 HB2 ARG 180 8.629 1.372 17.787
218 2HB ARG 180 HB1 ARG 180 9.320 2.825 18.520
219 1HG ARG 180 HG2 ARG 180 7.452 3.269 19.723
220 2HG ARG 180 HG1 ARG 180 6.366 2.602 18.502
221 1HD ARG 180 HD2 ARG 180 8.163 0.945 20.267
222 2HD ARG 180 HD1 ARG 180 6.466 1.280 20.613
223 HE ARG 180 HE ARG 180 6.379 0.229 18.129
224 1HH1 ARG 180 1HH1 ARG 180 7.860 -0.842 21.103
225 2HH1 ARG 180 2HH1 ARG 180 7.702 -2.524 20.720
226 1HH2 ARG 180 1HH2 ARG 180 6.168 -1.981 17.627
227 2HH2 ARG 180 2HH2 ARG 180 6.742 -3.170 18.748
228 1HG HSL 181 HG1 HSL 181 9.485 4.377 10.341
229 2HG HSL 181 HG2 HSL 181 8.382 5.048 11.652
230 H HSL 181 HN HSL 181 8.404 4.283 14.486
231 HA HSL 181 HA HSL 181 10.726 2.492 13.599
232 1HB HSL 181 HB1 HSL 181 9.845 2.317 11.459
233 2HB HSL 181 HB2 HSL 181 8.235 2.723 12.268
Start of MODEL 28
1 1H PHE 155 HT1 PHE 155 1.043 12.144 -11.929
2 2H PHE 155 HT2 PHE 155 1.080 12.833 -13.501
3 3H PHE 155 HT3 PHE 155 0.027 11.521 -13.161
4 HA PHE 155 HA PHE 155 -0.113 14.253 -12.100
5 1HB PHE 155 HB2 PHE 155 -0.904 13.483 -14.495
6 2HB PHE 155 HB1 PHE 155 -2.263 12.817 -13.597
7 HD1 PHE 155 HD1 PHE 155 -0.725 15.796 -14.921
8 HD2 PHE 155 HD2 PHE 155 -3.714 14.338 -12.266
9 HE1 PHE 155 HE1 PHE 155 -1.805 18.006 -14.930
10 HE2 PHE 155 HE2 PHE 155 -4.800 16.546 -12.269
11 HZ PHE 155 HZ PHE 155 -3.846 18.383 -13.603
12 H LEU 156 HN LEU 156 -0.479 11.046 -11.316
13 HA LEU 156 HA LEU 156 -1.457 9.971 -9.601
14 1HB LEU 156 HB2 LEU 156 -1.556 12.798 -8.679
15 2HB LEU 156 HB1 LEU 156 -2.445 11.591 -7.770
16 HG LEU 156 HG LEU 156 0.522 11.528 -8.326
17 1HD1 LEU 156 HD11 LEU 156 -0.929 12.041 -5.737
18 2HD1 LEU 156 HD12 LEU 156 -0.204 13.293 -6.745
19 3HD1 LEU 156 HD13 LEU 156 0.814 12.058 -6.006
20 1HD2 LEU 156 HD21 LEU 156 0.191 9.323 -8.008
21 2HD2 LEU 156 HD22 LEU 156 -1.381 9.561 -7.245
22 3HD2 LEU 156 HD23 LEU 156 0.097 9.785 -6.308
23 H GLN 157 HN GLN 157 -3.060 11.186 -11.946
24 HA GLN 157 HA GLN 157 -5.705 11.515 -10.915
25 1HB GLN 157 HB2 GLN 157 -6.391 11.595 -13.259
26 2HB GLN 157 HB1 GLN 157 -4.996 12.628 -12.976
27 1HG GLN 157 HG2 GLN 157 -3.621 11.362 -14.255
28 2HG GLN 157 HG1 GLN 157 -4.458 9.860 -13.867
29 1HE2 GLN 157 HE21 GLN 157 -6.822 9.899 -14.715
30 2HE2 GLN 157 HE22 GLN 157 -6.994 10.382 -16.366
31 H SER 158 HN SER 158 -3.858 8.798 -11.155
32 HA SER 158 HA SER 158 -5.769 6.978 -12.241
33 1HB SER 158 HB2 SER 158 -3.618 6.061 -10.373
34 2HB SER 158 HB1 SER 158 -4.193 5.325 -11.878
35 HG SER 158 HG SER 158 -2.566 6.283 -12.779
36 H ASP 159 HN ASP 159 -7.309 8.295 -10.598
37 HA ASP 159 HA ASP 159 -8.881 8.050 -8.987
38 1HB ASP 159 HB2 ASP 159 -7.868 5.351 -9.370
39 2HB ASP 159 HB1 ASP 159 -8.380 5.621 -7.707
40 H VAL 160 HN VAL 160 -6.012 6.393 -7.754
41 HA VAL 160 HA VAL 160 -4.664 6.747 -5.970
42 HB VAL 160 HB VAL 160 -5.179 9.293 -6.922
43 1HG1 VAL 160 HG11 VAL 160 -5.609 9.307 -3.936
44 2HG1 VAL 160 HG12 VAL 160 -6.768 9.803 -5.169
45 3HG1 VAL 160 HG13 VAL 160 -5.290 10.730 -4.927
46 1HG2 VAL 160 HG21 VAL 160 -3.067 9.751 -6.185
47 2HG2 VAL 160 HG22 VAL 160 -3.056 7.991 -6.091
48 3HG2 VAL 160 HG23 VAL 160 -3.313 8.950 -4.634
49 H PHE 161 HN PHE 161 -7.830 8.244 -5.324
50 HA PHE 161 HA PHE 161 -7.788 7.528 -2.560
51 1HB PHE 161 HB2 PHE 161 -9.228 9.326 -4.155
52 2HB PHE 161 HB1 PHE 161 -10.423 8.184 -3.550
53 HD1 PHE 161 HD1 PHE 161 -10.568 7.804 -1.057
54 HD2 PHE 161 HD2 PHE 161 -8.366 11.009 -2.786
55 HE1 PHE 161 HE1 PHE 161 -10.611 8.990 1.097
56 HE2 PHE 161 HE2 PHE 161 -8.404 12.201 -0.633
57 HZ PHE 161 HZ PHE 161 -9.528 11.192 1.312
58 H PHE 162 HN PHE 162 -8.119 5.580 -5.144
59 HA PHE 162 HA PHE 162 -9.319 3.509 -3.634
60 1HB PHE 162 HB2 PHE 162 -11.220 5.115 -4.683
61 2HB PHE 162 HB1 PHE 162 -10.992 3.983 -6.018
62 HD1 PHE 162 HD1 PHE 162 -12.282 4.445 -2.661
63 HD2 PHE 162 HD2 PHE 162 -11.429 1.590 -5.698
64 HE1 PHE 162 HE1 PHE 162 -13.725 2.809 -1.523
65 HE2 PHE 162 HE2 PHE 162 -12.871 -0.051 -4.567
66 HZ PHE 162 HZ PHE 162 -14.022 0.558 -2.477
67 H LEU 163 HN LEU 163 -7.093 4.332 -5.667
68 HA LEU 163 HA LEU 163 -7.370 2.540 -7.851
69 1HB LEU 163 HB2 LEU 163 -5.739 4.471 -7.692
70 2HB LEU 163 HB1 LEU 163 -4.804 3.502 -6.572
71 HG LEU 163 HG LEU 163 -4.833 1.756 -8.544
72 1HD1 LEU 163 HD11 LEU 163 -6.295 3.685 -9.761
73 2HD1 LEU 163 HD12 LEU 163 -5.332 2.473 -10.609
74 3HD1 LEU 163 HD13 LEU 163 -4.670 4.082 -10.324
75 1HD2 LEU 163 HD21 LEU 163 -2.699 2.582 -9.250
76 2HD2 LEU 163 HD22 LEU 163 -2.867 2.900 -7.523
77 3HD2 LEU 163 HD23 LEU 163 -3.085 4.208 -8.686
78 H PHE 164 HN PHE 164 -6.171 2.416 -4.593
79 HA PHE 164 HA PHE 164 -5.508 0.732 -3.225
80 1HB PHE 164 HB2 PHE 164 -7.925 0.092 -4.205
81 2HB PHE 164 HB1 PHE 164 -7.007 -1.303 -4.775
82 HD1 PHE 164 HD1 PHE 164 -8.454 0.368 -1.910
83 HD2 PHE 164 HD2 PHE 164 -5.879 -2.783 -3.154
84 HE1 PHE 164 HE1 PHE 164 -8.635 -0.656 0.320
85 HE2 PHE 164 HE2 PHE 164 -6.057 -3.815 -0.927
86 HZ PHE 164 HZ PHE 164 -7.437 -2.750 0.813
87 H LEU 165 HN LEU 165 -4.283 0.974 -6.169
88 HA LEU 165 HA LEU 165 -3.172 -1.608 -6.628
89 1HB LEU 165 HB2 LEU 165 -3.284 0.772 -8.035
90 2HB LEU 165 HB1 LEU 165 -1.581 0.601 -7.650
91 HG LEU 165 HG LEU 165 -1.486 -1.537 -8.763
92 1HD1 LEU 165 HD11 LEU 165 -3.726 -2.039 -10.125
93 2HD1 LEU 165 HD12 LEU 165 -4.432 -1.290 -8.694
94 3HD1 LEU 165 HD13 LEU 165 -3.405 -2.715 -8.528
95 1HD2 LEU 165 HD21 LEU 165 -1.078 0.221 -10.257
96 2HD2 LEU 165 HD22 LEU 165 -2.777 0.689 -10.307
97 3HD2 LEU 165 HD23 LEU 165 -2.251 -0.804 -11.085
98 H LEU 166 HN LEU 166 -1.782 1.424 -5.397
99 HA LEU 166 HA LEU 166 -0.195 -0.015 -3.483
100 1HB LEU 166 HB2 LEU 166 0.875 0.247 -6.014
101 2HB LEU 166 HB1 LEU 166 1.606 1.576 -5.133
102 HG LEU 166 HG LEU 166 3.008 -0.442 -5.097
103 1HD1 LEU 166 HD11 LEU 166 2.108 -0.251 -2.289
104 2HD1 LEU 166 HD12 LEU 166 2.575 1.257 -3.077
105 3HD1 LEU 166 HD13 LEU 166 3.721 -0.080 -2.981
106 1HD2 LEU 166 HD21 LEU 166 1.085 -2.043 -5.165
107 2HD2 LEU 166 HD22 LEU 166 0.821 -1.705 -3.455
108 3HD2 LEU 166 HD23 LEU 166 2.334 -2.440 -3.985
109 HA PRO 167 HA PRO 167 -1.164 4.642 -2.846
110 1HB PRO 167 HB2 PRO 167 -2.803 3.642 -0.604
111 2HB PRO 167 HB1 PRO 167 -3.182 4.874 -1.820
112 1HG PRO 167 HG2 PRO 167 -4.326 2.429 -1.837
113 2HG PRO 167 HG1 PRO 167 -3.989 3.338 -3.320
114 1HD PRO 167 HD2 PRO 167 -2.542 1.007 -2.153
115 2HD PRO 167 HD1 PRO 167 -2.824 1.434 -3.848
116 HA PRO 168 HA PRO 168 0.796 3.705 1.373
117 1HB PRO 168 HB2 PRO 168 0.319 1.478 2.698
118 2HB PRO 168 HB1 PRO 168 -0.995 2.648 2.458
119 1HG PRO 168 HG2 PRO 168 -0.463 0.076 1.032
120 2HG PRO 168 HG1 PRO 168 -2.006 0.767 1.563
121 1HD PRO 168 HD2 PRO 168 -0.898 0.958 -1.010
122 2HD PRO 168 HD1 PRO 168 -2.247 1.911 -0.372
123 H ILE 169 HN ILE 169 2.821 3.646 0.322
124 HA ILE 169 HA ILE 169 3.964 1.196 -0.635
125 HB ILE 169 HB ILE 169 4.505 3.575 -1.430
126 1HG1 ILE 169 HG12 ILE 169 5.713 1.513 -2.125
127 2HG1 ILE 169 HG11 ILE 169 6.737 2.944 -2.108
128 1HG2 ILE 169 HG21 ILE 169 6.369 4.698 -0.306
129 2HG2 ILE 169 HG22 ILE 169 6.326 3.489 0.980
130 3HG2 ILE 169 HG23 ILE 169 4.957 4.575 0.743
131 1HD1 ILE 169 HD11 ILE 169 7.150 1.965 0.389
132 2HD1 ILE 169 HD12 ILE 169 8.165 1.624 -1.013
133 3HD1 ILE 169 HD13 ILE 169 6.906 0.485 -0.538
134 H ILE 170 HN ILE 170 4.441 3.243 2.165
135 HA ILE 170 HA ILE 170 6.465 1.621 3.331
136 HB ILE 170 HB ILE 170 6.320 3.166 5.214
137 1HG1 ILE 170 HG12 ILE 170 3.832 3.912 3.792
138 2HG1 ILE 170 HG11 ILE 170 4.150 3.830 5.517
139 1HG2 ILE 170 HG21 ILE 170 7.624 3.630 3.121
140 2HG2 ILE 170 HG22 ILE 170 7.200 5.049 4.078
141 3HG2 ILE 170 HG23 ILE 170 6.291 4.669 2.616
142 1HD1 ILE 170 HD11 ILE 170 4.434 6.077 3.635
143 2HD1 ILE 170 HD12 ILE 170 5.687 5.934 4.871
144 3HD1 ILE 170 HD13 ILE 170 3.993 6.068 5.343
145 H LEU 171 HN LEU 171 3.030 2.200 4.088
146 HA LEU 171 HA LEU 171 3.001 0.583 6.403
147 1HB LEU 171 HB2 LEU 171 1.228 2.167 6.023
148 2HB LEU 171 HB1 LEU 171 0.787 1.385 4.520
149 HG LEU 171 HG LEU 171 -0.696 0.986 6.580
150 1HD1 LEU 171 HD11 LEU 171 0.117 -1.639 5.496
151 2HD1 LEU 171 HD12 LEU 171 -0.356 -0.406 4.326
152 3HD1 LEU 171 HD13 LEU 171 -1.478 -0.893 5.597
153 1HD2 LEU 171 HD21 LEU 171 1.279 -1.163 7.236
154 2HD2 LEU 171 HD22 LEU 171 -0.040 -0.517 8.214
155 3HD2 LEU 171 HD23 LEU 171 1.422 0.436 7.967
156 H ASP 172 HN ASP 172 1.790 -0.111 3.131
157 HA ASP 172 HA ASP 172 1.527 -2.906 3.656
158 1HB ASP 172 HB2 ASP 172 0.979 -1.090 1.415
159 2HB ASP 172 HB1 ASP 172 1.492 -2.708 0.922
160 H ALA 173 HN ALA 173 4.261 -1.176 3.455
161 HA ALA 173 HA ALA 173 5.788 -2.676 1.575
162 1HB ALA 173 HB1 ALA 173 7.438 -1.560 3.635
163 2HB ALA 173 HB2 ALA 173 6.200 -0.393 3.172
164 3HB ALA 173 HB3 ALA 173 7.278 -1.066 1.951
165 H GLY 174 HN GLY 174 5.712 -2.560 5.113
166 1HA GLY 174 HA2 GLY 174 6.342 -5.439 5.181
167 2HA GLY 174 HA1 GLY 174 7.243 -4.304 6.201
168 H TYR 175 HN TYR 175 4.174 -3.122 5.929
169 HA TYR 175 HA TYR 175 2.313 -3.082 7.208
170 1HB TYR 175 HB2 TYR 175 2.879 -5.778 6.997
171 2HB TYR 175 HB1 TYR 175 2.753 -5.539 8.736
172 HD1 TYR 175 HD1 TYR 175 0.946 -6.375 5.901
173 HD2 TYR 175 HD2 TYR 175 0.650 -3.976 9.402
174 HE1 TYR 175 HE1 TYR 175 -1.506 -6.427 5.721
175 HE2 TYR 175 HE2 TYR 175 -1.803 -4.022 9.233
176 HH TYR 175 HH TYR 175 -3.457 -4.706 6.636
177 H PHE 176 HN PHE 176 4.925 -4.586 9.149
178 HA PHE 176 HA PHE 176 4.172 -2.865 11.381
179 1HB PHE 176 HB2 PHE 176 5.004 -4.449 12.767
180 2HB PHE 176 HB1 PHE 176 4.849 -5.488 11.345
181 HD1 PHE 176 HD1 PHE 176 6.896 -5.807 9.879
182 HD2 PHE 176 HD2 PHE 176 7.073 -4.087 13.767
183 HE1 PHE 176 HE1 PHE 176 9.303 -6.304 9.984
184 HE2 PHE 176 HE2 PHE 176 9.481 -4.579 13.879
185 HZ PHE 176 HZ PHE 176 10.599 -5.688 11.987
186 H LEU 177 HN LEU 177 6.355 -2.834 8.821
187 HA LEU 177 HA LEU 177 8.700 -1.827 9.885
188 1HB LEU 177 HB2 LEU 177 7.310 -1.261 7.278
189 2HB LEU 177 HB1 LEU 177 8.880 -0.582 7.665
190 HG LEU 177 HG LEU 177 8.289 -3.539 7.585
191 1HD1 LEU 177 HD11 LEU 177 9.970 -2.200 5.540
192 2HD1 LEU 177 HD12 LEU 177 8.218 -2.042 5.401
193 3HD1 LEU 177 HD13 LEU 177 8.961 -3.642 5.413
194 1HD2 LEU 177 HD21 LEU 177 10.383 -3.890 8.278
195 2HD2 LEU 177 HD22 LEU 177 10.341 -2.217 8.833
196 3HD2 LEU 177 HD23 LEU 177 11.033 -2.608 7.258
197 HA PRO 178 HA PRO 178 6.617 2.614 9.525
198 1HB PRO 178 HB2 PRO 178 3.844 1.871 10.259
199 2HB PRO 178 HB1 PRO 178 4.417 3.017 9.044
200 1HG PRO 178 HG2 PRO 178 3.373 0.672 8.330
201 2HG PRO 178 HG1 PRO 178 4.752 1.364 7.455
202 1HD PRO 178 HD2 PRO 178 4.711 -0.813 9.514
203 2HD PRO 178 HD1 PRO 178 5.635 -0.713 8.001
204 H LEU 179 HN LEU 179 7.999 1.870 11.502
205 HA LEU 179 HA LEU 179 6.443 2.479 13.925
206 1HB LEU 179 HB2 LEU 179 7.549 0.039 13.453
207 2HB LEU 179 HB1 LEU 179 8.870 0.842 14.280
208 HG LEU 179 HG LEU 179 7.594 -0.360 15.907
209 1HD1 LEU 179 HD11 LEU 179 8.245 2.234 16.161
210 2HD1 LEU 179 HD12 LEU 179 7.523 1.276 17.455
211 3HD1 LEU 179 HD13 LEU 179 6.509 2.323 16.463
212 1HD2 LEU 179 HD21 LEU 179 5.167 0.302 16.272
213 2HD2 LEU 179 HD22 LEU 179 5.514 -0.710 14.869
214 3HD2 LEU 179 HD23 LEU 179 5.233 1.019 14.662
215 H ARG 180 HN ARG 180 9.859 2.080 12.986
216 HA ARG 180 HA ARG 180 10.567 4.443 14.520
217 1HB ARG 180 HB2 ARG 180 12.490 2.865 12.834
218 2HB ARG 180 HB1 ARG 180 12.799 3.766 14.323
219 1HG ARG 180 HG2 ARG 180 11.329 1.147 14.069
220 2HG ARG 180 HG1 ARG 180 12.939 1.399 14.748
221 1HD ARG 180 HD2 ARG 180 12.113 2.438 16.650
222 2HD ARG 180 HD1 ARG 180 10.583 2.855 15.880
223 HE ARG 180 HE ARG 180 9.754 0.822 16.515
224 1HH1 ARG 180 1HH1 ARG 180 13.235 0.733 16.753
225 2HH1 ARG 180 2HH1 ARG 180 13.268 -0.818 17.521
226 1HH2 ARG 180 1HH2 ARG 180 9.796 -1.219 17.524
227 2HH2 ARG 180 2HH2 ARG 180 11.316 -1.927 17.959
228 1HG HSL 181 HG1 HSL 181 9.136 6.879 7.922
229 2HG HSL 181 HG2 HSL 181 7.563 5.925 7.971
230 H HSL 181 HN HSL 181 8.918 4.436 12.005
231 HA HSL 181 HA HSL 181 10.632 6.358 10.343
232 1HB HSL 181 HB1 HSL 181 10.058 4.789 8.659
233 2HB HSL 181 HB2 HSL 181 8.494 4.306 9.511
Start of MODEL 29
1 1H PHE 155 HT1 PHE 155 -1.773 13.270 0.207
2 2H PHE 155 HT2 PHE 155 -1.309 14.854 -0.260
3 3H PHE 155 HT3 PHE 155 -0.895 13.513 -1.245
4 HA PHE 155 HA PHE 155 -3.391 13.117 -1.337
5 1HB PHE 155 HB2 PHE 155 -3.405 16.097 -0.911
6 2HB PHE 155 HB1 PHE 155 -4.769 14.987 -0.942
7 HD1 PHE 155 HD1 PHE 155 -3.416 17.116 1.154
8 HD2 PHE 155 HD2 PHE 155 -3.972 12.904 0.914
9 HE1 PHE 155 HE1 PHE 155 -3.342 16.970 3.609
10 HE2 PHE 155 HE2 PHE 155 -3.900 12.750 3.369
11 HZ PHE 155 HZ PHE 155 -3.585 14.785 4.719
12 H LEU 156 HN LEU 156 -3.732 12.959 -3.434
13 HA LEU 156 HA LEU 156 -3.239 13.076 -5.671
14 1HB LEU 156 HB2 LEU 156 -3.975 15.176 -6.666
15 2HB LEU 156 HB1 LEU 156 -5.065 14.639 -5.404
16 HG LEU 156 HG LEU 156 -2.991 16.545 -4.540
17 1HD1 LEU 156 HD11 LEU 156 -4.760 18.335 -5.458
18 2HD1 LEU 156 HD12 LEU 156 -4.850 17.135 -6.748
19 3HD1 LEU 156 HD13 LEU 156 -3.301 17.873 -6.335
20 1HD2 LEU 156 HD21 LEU 156 -5.967 16.317 -4.129
21 2HD2 LEU 156 HD22 LEU 156 -4.923 17.502 -3.346
22 3HD2 LEU 156 HD23 LEU 156 -4.708 15.784 -3.015
23 H GLN 157 HN GLN 157 -0.964 12.585 -5.421
24 HA GLN 157 HA GLN 157 0.679 14.457 -6.783
25 1HB GLN 157 HB2 GLN 157 0.556 14.992 -4.111
26 2HB GLN 157 HB1 GLN 157 1.939 13.907 -4.177
27 1HG GLN 157 HG2 GLN 157 3.247 15.477 -5.042
28 2HG GLN 157 HG1 GLN 157 2.049 15.914 -6.259
29 1HE2 GLN 157 HE21 GLN 157 1.736 16.031 -2.751
30 2HE2 GLN 157 HE22 GLN 157 1.515 17.741 -2.645
31 H SER 158 HN SER 158 -0.030 11.857 -7.325
32 HA SER 158 HA SER 158 2.506 10.643 -7.662
33 1HB SER 158 HB2 SER 158 1.314 10.016 -5.254
34 2HB SER 158 HB1 SER 158 0.895 8.649 -6.299
35 HG SER 158 HG SER 158 3.235 8.669 -6.836
36 H ASP 159 HN ASP 159 -0.920 10.248 -7.693
37 HA ASP 159 HA ASP 159 -0.994 9.515 -10.435
38 1HB ASP 159 HB2 ASP 159 -0.389 7.370 -8.918
39 2HB ASP 159 HB1 ASP 159 -2.146 7.328 -8.793
40 H VAL 160 HN VAL 160 -2.524 9.665 -7.308
41 HA VAL 160 HA VAL 160 -4.474 10.661 -6.654
42 HB VAL 160 HB VAL 160 -4.082 11.859 -9.128
43 1HG1 VAL 160 HG11 VAL 160 -6.901 10.792 -9.023
44 2HG1 VAL 160 HG12 VAL 160 -5.676 10.397 -10.227
45 3HG1 VAL 160 HG13 VAL 160 -6.317 12.035 -10.128
46 1HG2 VAL 160 HG21 VAL 160 -6.154 13.258 -8.202
47 2HG2 VAL 160 HG22 VAL 160 -4.548 13.333 -7.477
48 3HG2 VAL 160 HG23 VAL 160 -5.793 12.310 -6.760
49 H PHE 161 HN PHE 161 -4.882 8.723 -9.608
50 HA PHE 161 HA PHE 161 -7.409 7.664 -8.794
51 1HB PHE 161 HB2 PHE 161 -5.537 6.786 -11.000
52 2HB PHE 161 HB1 PHE 161 -7.196 6.234 -10.792
53 HD1 PHE 161 HD1 PHE 161 -5.193 8.404 -12.578
54 HD2 PHE 161 HD2 PHE 161 -8.922 8.290 -10.530
55 HE1 PHE 161 HE1 PHE 161 -5.986 10.302 -13.927
56 HE2 PHE 161 HE2 PHE 161 -9.723 10.188 -11.876
57 HZ PHE 161 HZ PHE 161 -8.255 11.196 -13.577
58 H PHE 162 HN PHE 162 -4.726 7.170 -7.259
59 HA PHE 162 HA PHE 162 -5.446 4.574 -6.329
60 1HB PHE 162 HB2 PHE 162 -3.128 4.895 -8.180
61 2HB PHE 162 HB1 PHE 162 -2.984 3.763 -6.830
62 HD1 PHE 162 HD1 PHE 162 -4.122 4.211 -10.153
63 HD2 PHE 162 HD2 PHE 162 -4.869 2.020 -6.582
64 HE1 PHE 162 HE1 PHE 162 -5.327 2.506 -11.455
65 HE2 PHE 162 HE2 PHE 162 -6.075 0.310 -7.877
66 HZ PHE 162 HZ PHE 162 -6.304 0.552 -10.317
67 H LEU 163 HN LEU 163 -4.211 7.549 -5.791
68 HA LEU 163 HA LEU 163 -2.115 7.032 -3.959
69 1HB LEU 163 HB2 LEU 163 -2.955 9.265 -5.130
70 2HB LEU 163 HB1 LEU 163 -3.889 9.413 -3.655
71 HG LEU 163 HG LEU 163 -1.854 9.379 -2.320
72 1HD1 LEU 163 HD11 LEU 163 0.342 9.569 -3.596
73 2HD1 LEU 163 HD12 LEU 163 -0.538 8.909 -4.975
74 3HD1 LEU 163 HD13 LEU 163 -0.393 7.969 -3.490
75 1HD2 LEU 163 HD21 LEU 163 -0.734 11.435 -3.624
76 2HD2 LEU 163 HD22 LEU 163 -2.240 11.571 -2.716
77 3HD2 LEU 163 HD23 LEU 163 -2.282 11.362 -4.467
78 H PHE 164 HN PHE 164 -5.583 7.084 -3.818
79 HA PHE 164 HA PHE 164 -7.090 6.622 -2.172
80 1HB PHE 164 HB2 PHE 164 -5.644 4.495 -2.373
81 2HB PHE 164 HB1 PHE 164 -4.912 5.013 -0.857
82 HD1 PHE 164 HD1 PHE 164 -5.647 3.526 0.749
83 HD2 PHE 164 HD2 PHE 164 -8.451 5.175 -1.995
84 HE1 PHE 164 HE1 PHE 164 -7.484 2.467 1.996
85 HE2 PHE 164 HE2 PHE 164 -10.294 4.119 -0.752
86 HZ PHE 164 HZ PHE 164 -9.811 2.763 1.247
87 H LEU 165 HN LEU 165 -5.555 8.992 -1.831
88 HA LEU 165 HA LEU 165 -5.572 10.674 -0.262
89 1HB LEU 165 HB2 LEU 165 -6.973 8.708 1.124
90 2HB LEU 165 HB1 LEU 165 -5.639 9.122 2.187
91 HG LEU 165 HG LEU 165 -7.433 10.507 2.834
92 1HD1 LEU 165 HD11 LEU 165 -5.140 11.591 2.343
93 2HD1 LEU 165 HD12 LEU 165 -6.531 12.633 2.644
94 3HD1 LEU 165 HD13 LEU 165 -5.974 12.359 0.993
95 1HD2 LEU 165 HD21 LEU 165 -8.765 10.111 0.762
96 2HD2 LEU 165 HD22 LEU 165 -7.800 11.355 -0.033
97 3HD2 LEU 165 HD23 LEU 165 -8.811 11.773 1.351
98 H LEU 166 HN LEU 166 -3.792 7.719 0.241
99 HA LEU 166 HA LEU 166 -1.329 9.135 0.523
100 1HB LEU 166 HB2 LEU 166 -2.777 8.728 2.859
101 2HB LEU 166 HB1 LEU 166 -1.605 7.420 2.860
102 HG LEU 166 HG LEU 166 -0.796 9.375 4.100
103 1HD1 LEU 166 HD11 LEU 166 0.578 7.924 2.147
104 2HD1 LEU 166 HD12 LEU 166 1.266 8.817 3.502
105 3HD1 LEU 166 HD13 LEU 166 1.083 9.600 1.932
106 1HD2 LEU 166 HD21 LEU 166 -2.014 11.065 2.746
107 2HD2 LEU 166 HD22 LEU 166 -0.838 10.820 1.455
108 3HD2 LEU 166 HD23 LEU 166 -0.316 11.460 3.013
109 HA PRO 167 HA PRO 167 -0.398 5.212 -1.422
110 1HB PRO 167 HB2 PRO 167 2.288 5.587 -1.685
111 2HB PRO 167 HB1 PRO 167 1.083 6.289 -2.782
112 1HG PRO 167 HG2 PRO 167 2.521 7.553 -0.478
113 2HG PRO 167 HG1 PRO 167 2.146 8.231 -2.074
114 1HD PRO 167 HD2 PRO 167 0.702 8.831 0.132
115 2HD PRO 167 HD1 PRO 167 -0.026 8.744 -1.484
116 HA PRO 168 HA PRO 168 0.999 3.252 2.421
117 1HB PRO 168 HB2 PRO 168 -0.246 0.925 2.070
118 2HB PRO 168 HB1 PRO 168 -1.168 2.393 2.457
119 1HG PRO 168 HG2 PRO 168 -0.719 1.095 -0.214
120 2HG PRO 168 HG1 PRO 168 -2.232 1.698 0.488
121 1HD PRO 168 HD2 PRO 168 -0.718 3.112 -1.293
122 2HD PRO 168 HD1 PRO 168 -1.761 3.871 -0.074
123 H ILE 169 HN ILE 169 2.915 3.480 0.438
124 HA ILE 169 HA ILE 169 3.723 0.911 -0.553
125 HB ILE 169 HB ILE 169 4.283 3.148 -1.612
126 1HG1 ILE 169 HG12 ILE 169 6.763 2.342 -2.023
127 2HG1 ILE 169 HG11 ILE 169 6.223 0.931 -1.120
128 1HG2 ILE 169 HG21 ILE 169 5.028 4.285 0.437
129 2HG2 ILE 169 HG22 ILE 169 6.246 4.337 -0.837
130 3HG2 ILE 169 HG23 ILE 169 6.426 3.212 0.511
131 1HD1 ILE 169 HD11 ILE 169 6.056 1.052 -3.741
132 2HD1 ILE 169 HD12 ILE 169 4.539 1.871 -3.372
133 3HD1 ILE 169 HD13 ILE 169 4.828 0.237 -2.775
134 H ILE 170 HN ILE 170 4.794 3.076 1.976
135 HA ILE 170 HA ILE 170 6.825 1.330 2.959
136 HB ILE 170 HB ILE 170 7.102 2.999 4.720
137 1HG1 ILE 170 HG12 ILE 170 4.507 3.899 3.620
138 2HG1 ILE 170 HG11 ILE 170 5.070 3.890 5.281
139 1HG2 ILE 170 HG21 ILE 170 8.112 4.574 3.366
140 2HG2 ILE 170 HG22 ILE 170 6.816 4.523 2.171
141 3HG2 ILE 170 HG23 ILE 170 7.968 3.192 2.281
142 1HD1 ILE 170 HD11 ILE 170 5.330 5.963 3.193
143 2HD1 ILE 170 HD12 ILE 170 6.665 5.791 4.333
144 3HD1 ILE 170 HD13 ILE 170 5.037 6.124 4.925
145 H LEU 171 HN LEU 171 3.614 2.329 4.053
146 HA LEU 171 HA LEU 171 3.650 0.878 6.479
147 1HB LEU 171 HB2 LEU 171 2.069 2.655 6.203
148 2HB LEU 171 HB1 LEU 171 1.402 1.919 4.760
149 HG LEU 171 HG LEU 171 0.953 -0.028 6.638
150 1HD1 LEU 171 HD11 LEU 171 0.771 0.766 8.705
151 2HD1 LEU 171 HD12 LEU 171 -0.166 2.157 8.160
152 3HD1 LEU 171 HD13 LEU 171 1.597 2.218 8.141
153 1HD2 LEU 171 HD21 LEU 171 -0.840 0.346 5.309
154 2HD2 LEU 171 HD22 LEU 171 -0.638 2.097 5.338
155 3HD2 LEU 171 HD23 LEU 171 -1.383 1.272 6.708
156 H ASP 172 HN ASP 172 1.973 0.196 3.427
157 HA ASP 172 HA ASP 172 1.396 -2.506 4.131
158 1HB ASP 172 HB2 ASP 172 0.136 -0.917 2.491
159 2HB ASP 172 HB1 ASP 172 1.318 -1.496 1.307
160 H ALA 173 HN ALA 173 4.302 -1.217 3.512
161 HA ALA 173 HA ALA 173 5.347 -2.960 1.522
162 1HB ALA 173 HB1 ALA 173 7.392 -2.093 3.324
163 2HB ALA 173 HB2 ALA 173 6.288 -0.755 3.016
164 3HB ALA 173 HB3 ALA 173 7.080 -1.569 1.669
165 H GLY 174 HN GLY 174 6.006 -2.777 5.007
166 1HA GLY 174 HA2 GLY 174 6.342 -5.715 5.027
167 2HA GLY 174 HA1 GLY 174 7.190 -4.604 6.120
168 H TYR 175 HN TYR 175 4.509 -3.070 6.164
169 HA TYR 175 HA TYR 175 2.590 -2.975 7.360
170 1HB TYR 175 HB2 TYR 175 2.249 -5.348 6.486
171 2HB TYR 175 HB1 TYR 175 2.887 -5.900 8.032
172 HD1 TYR 175 HD1 TYR 175 0.596 -3.056 7.296
173 HD2 TYR 175 HD2 TYR 175 1.070 -6.867 9.126
174 HE1 TYR 175 HE1 TYR 175 -1.644 -2.851 8.288
175 HE2 TYR 175 HE2 TYR 175 -1.169 -6.673 10.123
176 HH TYR 175 HH TYR 175 -3.458 -4.657 9.128
177 H PHE 176 HN PHE 176 5.563 -3.965 8.588
178 HA PHE 176 HA PHE 176 4.700 -3.419 11.346
179 1HB PHE 176 HB2 PHE 176 7.083 -5.013 10.385
180 2HB PHE 176 HB1 PHE 176 6.649 -4.725 12.076
181 HD1 PHE 176 HD1 PHE 176 3.781 -5.175 12.099
182 HD2 PHE 176 HD2 PHE 176 6.841 -7.270 10.013
183 HE1 PHE 176 HE1 PHE 176 2.375 -7.194 12.073
184 HE2 PHE 176 HE2 PHE 176 5.442 -9.292 9.982
185 HZ PHE 176 HZ PHE 176 3.205 -9.257 11.013
186 H LEU 177 HN LEU 177 6.213 -2.080 8.747
187 HA LEU 177 HA LEU 177 8.336 -0.733 10.160
188 1HB LEU 177 HB2 LEU 177 9.208 -0.760 8.128
189 2HB LEU 177 HB1 LEU 177 7.699 -1.330 7.450
190 HG LEU 177 HG LEU 177 6.985 1.122 7.373
191 1HD1 LEU 177 HD11 LEU 177 9.785 1.950 7.202
192 2HD1 LEU 177 HD12 LEU 177 9.256 1.529 8.830
193 3HD1 LEU 177 HD13 LEU 177 8.399 2.771 7.918
194 1HD2 LEU 177 HD21 LEU 177 8.067 -0.469 5.531
195 2HD2 LEU 177 HD22 LEU 177 9.327 0.764 5.595
196 3HD2 LEU 177 HD23 LEU 177 7.669 1.218 5.210
197 HA PRO 178 HA PRO 178 4.770 2.706 9.214
198 1HB PRO 178 HB2 PRO 178 3.072 1.219 11.177
199 2HB PRO 178 HB1 PRO 178 2.588 2.273 9.841
200 1HG PRO 178 HG2 PRO 178 2.438 -0.358 9.576
201 2HG PRO 178 HG1 PRO 178 3.019 0.648 8.236
202 1HD PRO 178 HD2 PRO 178 4.548 -1.103 10.093
203 2HD PRO 178 HD1 PRO 178 4.843 -0.749 8.379
204 H LEU 179 HN LEU 179 6.052 1.005 11.963
205 HA LEU 179 HA LEU 179 5.464 2.673 14.070
206 1HB LEU 179 HB2 LEU 179 6.839 0.502 14.020
207 2HB LEU 179 HB1 LEU 179 8.216 1.530 13.669
208 HG LEU 179 HG LEU 179 6.482 1.813 16.124
209 1HD1 LEU 179 HD11 LEU 179 7.500 -0.189 16.565
210 2HD1 LEU 179 HD12 LEU 179 8.726 0.933 17.158
211 3HD1 LEU 179 HD13 LEU 179 8.910 0.182 15.572
212 1HD2 LEU 179 HD21 LEU 179 8.817 2.960 16.750
213 2HD2 LEU 179 HD22 LEU 179 7.474 3.845 16.027
214 3HD2 LEU 179 HD23 LEU 179 8.800 3.275 15.014
215 H ARG 180 HN ARG 180 8.070 2.994 11.697
216 HA ARG 180 HA ARG 180 8.804 5.596 12.790
217 1HB ARG 180 HB2 ARG 180 10.639 5.531 11.136
218 2HB ARG 180 HB1 ARG 180 10.628 4.115 12.194
219 1HG ARG 180 HG2 ARG 180 9.100 3.307 10.053
220 2HG ARG 180 HG1 ARG 180 10.353 4.299 9.304
221 1HD ARG 180 HD2 ARG 180 11.070 1.984 9.421
222 2HD ARG 180 HD1 ARG 180 12.070 2.990 10.467
223 HE ARG 180 HE ARG 180 9.936 1.908 11.953
224 1HH1 ARG 180 1HH1 ARG 180 12.922 0.952 10.422
225 2HH1 ARG 180 2HH1 ARG 180 13.208 -0.360 11.515
226 1HH2 ARG 180 1HH2 ARG 180 10.309 0.185 13.392
227 2HH2 ARG 180 2HH2 ARG 180 11.724 -0.797 13.202
228 1HG HSL 181 HG1 HSL 181 2.632 5.958 9.246
229 2HG HSL 181 HG2 HSL 181 3.338 5.071 10.696
230 H HSL 181 HN HSL 181 6.185 5.199 11.581
231 HA HSL 181 HA HSL 181 6.406 7.130 9.209
232 1HB HSL 181 HB1 HSL 181 4.691 6.052 8.084
233 2HB HSL 181 HB2 HSL 181 5.117 4.604 9.144
Start of MODEL 30
1 1H PHE 155 HT1 PHE 155 -13.161 -6.728 -5.773
2 2H PHE 155 HT2 PHE 155 -13.767 -7.428 -7.217
3 3H PHE 155 HT3 PHE 155 -13.795 -5.724 -7.010
4 HA PHE 155 HA PHE 155 -11.447 -7.455 -7.308
5 1HB PHE 155 HB2 PHE 155 -13.088 -5.796 -9.059
6 2HB PHE 155 HB1 PHE 155 -11.369 -5.439 -9.170
7 HD1 PHE 155 HD1 PHE 155 -13.167 -8.657 -8.647
8 HD2 PHE 155 HD2 PHE 155 -10.607 -6.349 -11.141
9 HE1 PHE 155 HE1 PHE 155 -12.860 -10.601 -10.123
10 HE2 PHE 155 HE2 PHE 155 -10.295 -8.288 -12.622
11 HZ PHE 155 HZ PHE 155 -11.423 -10.418 -12.114
12 H LEU 156 HN LEU 156 -12.643 -4.837 -5.672
13 HA LEU 156 HA LEU 156 -11.747 -3.041 -4.655
14 1HB LEU 156 HB2 LEU 156 -9.841 -3.461 -3.341
15 2HB LEU 156 HB1 LEU 156 -10.656 -5.002 -3.517
16 HG LEU 156 HG LEU 156 -8.548 -4.471 -5.506
17 1HD1 LEU 156 HD11 LEU 156 -6.941 -5.366 -3.582
18 2HD1 LEU 156 HD12 LEU 156 -8.030 -4.388 -2.598
19 3HD1 LEU 156 HD13 LEU 156 -7.145 -3.650 -3.934
20 1HD2 LEU 156 HD21 LEU 156 -8.581 -6.867 -3.784
21 2HD2 LEU 156 HD22 LEU 156 -8.381 -6.726 -5.531
22 3HD2 LEU 156 HD23 LEU 156 -9.991 -6.625 -4.816
23 H GLN 157 HN GLN 157 -9.074 -2.070 -4.557
24 HA GLN 157 HA GLN 157 -8.000 -1.710 -7.156
25 1HB GLN 157 HB2 GLN 157 -10.015 -0.366 -7.478
26 2HB GLN 157 HB1 GLN 157 -9.640 0.571 -6.038
27 1HG GLN 157 HG2 GLN 157 -7.491 1.236 -7.200
28 2HG GLN 157 HG1 GLN 157 -8.187 0.542 -8.663
29 1HE2 GLN 157 HE21 GLN 157 -9.455 2.550 -6.022
30 2HE2 GLN 157 HE22 GLN 157 -10.102 3.784 -7.044
31 H SER 158 HN SER 158 -6.054 -2.106 -6.146
32 HA SER 158 HA SER 158 -4.189 -1.731 -4.885
33 1HB SER 158 HB2 SER 158 -3.819 0.963 -4.771
34 2HB SER 158 HB1 SER 158 -3.434 -0.031 -6.185
35 HG SER 158 HG SER 158 -4.808 1.215 -7.167
36 H ASP 159 HN ASP 159 -5.363 -2.527 -2.980
37 HA ASP 159 HA ASP 159 -5.615 -2.430 -0.712
38 1HB ASP 159 HB2 ASP 159 -3.891 -0.372 -1.140
39 2HB ASP 159 HB1 ASP 159 -5.260 0.487 -0.440
40 H VAL 160 HN VAL 160 -6.809 0.650 -2.049
41 HA VAL 160 HA VAL 160 -8.956 1.412 -2.288
42 HB VAL 160 HB VAL 160 -9.493 -1.266 -1.889
43 1HG1 VAL 160 HG11 VAL 160 -11.093 0.281 0.148
44 2HG1 VAL 160 HG12 VAL 160 -9.874 -0.940 0.505
45 3HG1 VAL 160 HG13 VAL 160 -11.359 -1.395 -0.326
46 1HG2 VAL 160 HG21 VAL 160 -11.954 -0.334 -2.304
47 2HG2 VAL 160 HG22 VAL 160 -10.710 -0.334 -3.554
48 3HG2 VAL 160 HG23 VAL 160 -11.043 1.137 -2.640
49 H PHE 161 HN PHE 161 -8.235 0.044 0.917
50 HA PHE 161 HA PHE 161 -9.623 2.133 2.304
51 1HB PHE 161 HB2 PHE 161 -8.919 -0.372 3.001
52 2HB PHE 161 HB1 PHE 161 -7.601 0.521 3.749
53 HD1 PHE 161 HD1 PHE 161 -9.250 3.029 4.379
54 HD2 PHE 161 HD2 PHE 161 -9.959 -1.122 4.991
55 HE1 PHE 161 HE1 PHE 161 -10.701 3.563 6.293
56 HE2 PHE 161 HE2 PHE 161 -11.411 -0.595 6.905
57 HZ PHE 161 HZ PHE 161 -11.783 1.750 7.559
58 H PHE 162 HN PHE 162 -7.378 2.895 0.462
59 HA PHE 162 HA PHE 162 -6.225 4.914 2.105
60 1HB PHE 162 HB2 PHE 162 -4.490 2.636 1.194
61 2HB PHE 162 HB1 PHE 162 -3.851 4.226 1.606
62 HD1 PHE 162 HD1 PHE 162 -4.825 5.114 3.968
63 HD2 PHE 162 HD2 PHE 162 -4.339 1.044 2.826
64 HE1 PHE 162 HE1 PHE 162 -4.731 4.465 6.339
65 HE2 PHE 162 HE2 PHE 162 -4.245 0.386 5.195
66 HZ PHE 162 HZ PHE 162 -4.442 2.098 6.955
67 H LEU 163 HN LEU 163 -6.603 3.321 -0.956
68 HA LEU 163 HA LEU 163 -5.040 5.023 -2.586
69 1HB LEU 163 HB2 LEU 163 -6.249 2.796 -3.128
70 2HB LEU 163 HB1 LEU 163 -7.644 3.816 -3.427
71 HG LEU 163 HG LEU 163 -6.100 5.097 -5.058
72 1HD1 LEU 163 HD11 LEU 163 -4.441 2.777 -4.307
73 2HD1 LEU 163 HD12 LEU 163 -3.969 4.381 -4.867
74 3HD1 LEU 163 HD13 LEU 163 -4.509 3.166 -6.026
75 1HD2 LEU 163 HD21 LEU 163 -7.582 2.595 -5.362
76 2HD2 LEU 163 HD22 LEU 163 -6.401 2.886 -6.638
77 3HD2 LEU 163 HD23 LEU 163 -7.654 4.083 -6.308
78 H PHE 164 HN PHE 164 -7.454 5.749 -0.605
79 HA PHE 164 HA PHE 164 -9.107 7.521 -2.060
80 1HB PHE 164 HB2 PHE 164 -9.931 6.448 -0.091
81 2HB PHE 164 HB1 PHE 164 -8.567 7.015 0.867
82 HD1 PHE 164 HD1 PHE 164 -8.618 9.131 1.920
83 HD2 PHE 164 HD2 PHE 164 -11.680 8.059 -0.833
84 HE1 PHE 164 HE1 PHE 164 -9.937 11.081 2.634
85 HE2 PHE 164 HE2 PHE 164 -13.005 10.008 -0.125
86 HZ PHE 164 HZ PHE 164 -12.133 11.523 1.610
87 H LEU 165 HN LEU 165 -5.927 7.896 -1.564
88 HA LEU 165 HA LEU 165 -5.955 10.688 -1.949
89 1HB LEU 165 HB2 LEU 165 -6.198 9.961 0.722
90 2HB LEU 165 HB1 LEU 165 -4.496 10.345 0.534
91 HG LEU 165 HG LEU 165 -5.319 12.532 -0.562
92 1HD1 LEU 165 HD11 LEU 165 -7.622 12.019 -0.884
93 2HD1 LEU 165 HD12 LEU 165 -7.526 13.266 0.359
94 3HD1 LEU 165 HD13 LEU 165 -7.825 11.588 0.814
95 1HD2 LEU 165 HD21 LEU 165 -6.068 12.533 2.299
96 2HD2 LEU 165 HD22 LEU 165 -4.952 13.574 1.415
97 3HD2 LEU 165 HD23 LEU 165 -4.451 11.954 1.899
98 H LEU 166 HN LEU 166 -4.042 7.995 -0.659
99 HA LEU 166 HA LEU 166 -2.055 8.357 -2.701
100 1HB LEU 166 HB2 LEU 166 -1.726 9.781 -0.318
101 2HB LEU 166 HB1 LEU 166 -0.659 8.396 -0.163
102 HG LEU 166 HG LEU 166 0.448 9.001 -2.269
103 1HD1 LEU 166 HD11 LEU 166 -1.485 11.309 -2.242
104 2HD1 LEU 166 HD12 LEU 166 -1.331 10.051 -3.469
105 3HD1 LEU 166 HD13 LEU 166 -0.043 11.236 -3.256
106 1HD2 LEU 166 HD21 LEU 166 1.665 9.905 -0.569
107 2HD2 LEU 166 HD22 LEU 166 0.315 10.867 0.034
108 3HD2 LEU 166 HD23 LEU 166 1.198 11.388 -1.401
109 HA PRO 167 HA PRO 167 -1.848 3.999 -1.912
110 1HB PRO 167 HB2 PRO 167 0.379 3.401 -3.341
111 2HB PRO 167 HB1 PRO 167 -1.180 3.778 -4.102
112 1HG PRO 167 HG2 PRO 167 1.203 5.546 -3.676
113 2HG PRO 167 HG1 PRO 167 0.173 5.381 -5.111
114 1HD PRO 167 HD2 PRO 167 -0.099 7.416 -3.343
115 2HD PRO 167 HD1 PRO 167 -1.471 6.739 -4.240
116 HA PRO 168 HA PRO 168 1.123 4.166 1.500
117 1HB PRO 168 HB2 PRO 168 0.092 2.126 2.921
118 2HB PRO 168 HB1 PRO 168 -0.680 3.724 2.874
119 1HG PRO 168 HG2 PRO 168 -1.372 1.234 1.357
120 2HG PRO 168 HG1 PRO 168 -2.449 2.394 2.156
121 1HD PRO 168 HD2 PRO 168 -1.954 2.391 -0.532
122 2HD PRO 168 HD1 PRO 168 -2.401 3.844 0.380
123 H ILE 169 HN ILE 169 2.752 3.454 -0.094
124 HA ILE 169 HA ILE 169 3.141 0.656 -0.573
125 HB ILE 169 HB ILE 169 3.936 2.758 -1.947
126 1HG1 ILE 169 HG12 ILE 169 5.728 1.333 -2.966
127 2HG1 ILE 169 HG11 ILE 169 5.531 0.211 -1.624
128 1HG2 ILE 169 HG21 ILE 169 5.382 3.492 0.031
129 2HG2 ILE 169 HG22 ILE 169 6.107 3.530 -1.577
130 3HG2 ILE 169 HG23 ILE 169 6.485 2.210 -0.472
131 1HD1 ILE 169 HD11 ILE 169 4.167 0.203 -4.044
132 2HD1 ILE 169 HD12 ILE 169 2.996 0.780 -2.857
133 3HD1 ILE 169 HD13 ILE 169 3.811 -0.765 -2.613
134 H ILE 170 HN ILE 170 4.399 3.032 1.642
135 HA ILE 170 HA ILE 170 6.489 1.427 2.720
136 HB ILE 170 HB ILE 170 5.199 3.740 4.141
137 1HG1 ILE 170 HG12 ILE 170 5.574 4.580 1.932
138 2HG1 ILE 170 HG11 ILE 170 6.885 5.177 2.942
139 1HG2 ILE 170 HG21 ILE 170 8.058 2.793 4.067
140 2HG2 ILE 170 HG22 ILE 170 6.895 2.387 5.328
141 3HG2 ILE 170 HG23 ILE 170 7.389 4.064 5.091
142 1HD1 ILE 170 HD11 ILE 170 8.442 3.746 1.968
143 2HD1 ILE 170 HD12 ILE 170 7.457 4.307 0.616
144 3HD1 ILE 170 HD13 ILE 170 7.195 2.699 1.292
145 H LEU 171 HN LEU 171 3.214 2.272 3.844
146 HA LEU 171 HA LEU 171 3.373 0.835 6.272
147 1HB LEU 171 HB2 LEU 171 1.659 2.485 6.011
148 2HB LEU 171 HB1 LEU 171 1.036 1.699 4.574
149 HG LEU 171 HG LEU 171 0.238 -0.180 5.924
150 1HD1 LEU 171 HD11 LEU 171 1.684 1.282 8.077
151 2HD1 LEU 171 HD12 LEU 171 1.611 -0.447 7.738
152 3HD1 LEU 171 HD13 LEU 171 0.236 0.363 8.488
153 1HD2 LEU 171 HD21 LEU 171 -0.903 2.252 5.701
154 2HD2 LEU 171 HD22 LEU 171 -0.836 2.094 7.456
155 3HD2 LEU 171 HD23 LEU 171 -1.670 0.875 6.492
156 H ASP 172 HN ASP 172 1.870 0.027 3.168
157 HA ASP 172 HA ASP 172 1.400 -2.699 3.871
158 1HB ASP 172 HB2 ASP 172 1.274 -1.223 1.235
159 2HB ASP 172 HB1 ASP 172 0.853 -2.932 1.418
160 H ALA 173 HN ALA 173 4.237 -1.133 3.261
161 HA ALA 173 HA ALA 173 5.508 -2.955 1.479
162 1HB ALA 173 HB1 ALA 173 7.475 -1.733 3.085
163 2HB ALA 173 HB2 ALA 173 6.210 -0.533 2.829
164 3HB ALA 173 HB3 ALA 173 6.989 -1.298 1.447
165 H GLY 174 HN GLY 174 5.992 -2.343 4.948
166 1HA GLY 174 HA2 GLY 174 6.740 -5.188 5.259
167 2HA GLY 174 HA1 GLY 174 7.402 -3.872 6.249
168 H TYR 175 HN TYR 175 4.461 -2.798 6.063
169 HA TYR 175 HA TYR 175 2.559 -2.854 7.289
170 1HB TYR 175 HB2 TYR 175 2.459 -5.254 6.556
171 2HB TYR 175 HB1 TYR 175 3.280 -5.686 8.053
172 HD1 TYR 175 HD1 TYR 175 2.141 -5.100 10.253
173 HD2 TYR 175 HD2 TYR 175 0.128 -4.964 6.508
174 HE1 TYR 175 HE1 TYR 175 -0.020 -5.187 11.419
175 HE2 TYR 175 HE2 TYR 175 -2.041 -5.050 7.664
176 HH TYR 175 HH TYR 175 -2.492 -4.372 10.780
177 H PHE 176 HN PHE 176 5.174 -4.565 8.999
178 HA PHE 176 HA PHE 176 4.377 -3.264 11.485
179 1HB PHE 176 HB2 PHE 176 6.229 -5.528 10.797
180 2HB PHE 176 HB1 PHE 176 6.263 -4.770 12.395
181 HD1 PHE 176 HD1 PHE 176 4.563 -5.209 13.996
182 HD2 PHE 176 HD2 PHE 176 4.213 -6.711 10.028
183 HE1 PHE 176 HE1 PHE 176 2.706 -6.655 14.710
184 HE2 PHE 176 HE2 PHE 176 2.353 -8.158 10.737
185 HZ PHE 176 HZ PHE 176 1.597 -8.131 13.080
186 H LEU 177 HN LEU 177 6.130 -2.320 8.957
187 HA LEU 177 HA LEU 177 8.551 -1.461 10.223
188 1HB LEU 177 HB2 LEU 177 9.177 -1.409 8.098
189 2HB LEU 177 HB1 LEU 177 7.521 -1.630 7.571
190 HG LEU 177 HG LEU 177 7.243 0.878 7.775
191 1HD1 LEU 177 HD11 LEU 177 8.911 2.210 8.424
192 2HD1 LEU 177 HD12 LEU 177 10.097 1.350 7.444
193 3HD1 LEU 177 HD13 LEU 177 9.677 0.749 9.048
194 1HD2 LEU 177 HD21 LEU 177 9.152 -0.345 5.797
195 2HD2 LEU 177 HD22 LEU 177 8.534 1.300 5.649
196 3HD2 LEU 177 HD23 LEU 177 7.420 -0.067 5.612
197 HA PRO 178 HA PRO 178 5.869 2.736 9.958
198 1HB PRO 178 HB2 PRO 178 3.531 1.489 11.317
199 2HB PRO 178 HB1 PRO 178 3.574 2.757 10.086
200 1HG PRO 178 HG2 PRO 178 2.848 0.281 9.451
201 2HG PRO 178 HG1 PRO 178 3.854 1.243 8.350
202 1HD PRO 178 HD2 PRO 178 4.637 -0.987 10.177
203 2HD PRO 178 HD1 PRO 178 5.224 -0.605 8.546
204 H LEU 179 HN LEU 179 4.133 3.168 12.322
205 HA LEU 179 HA LEU 179 4.212 3.379 14.603
206 1HB LEU 179 HB2 LEU 179 5.784 1.144 14.288
207 2HB LEU 179 HB1 LEU 179 6.890 2.272 15.050
208 HG LEU 179 HG LEU 179 5.876 0.989 16.779
209 1HD1 LEU 179 HD11 LEU 179 5.286 2.684 18.172
210 2HD1 LEU 179 HD12 LEU 179 4.195 3.420 16.998
211 3HD1 LEU 179 HD13 LEU 179 5.937 3.641 16.841
212 1HD2 LEU 179 HD21 LEU 179 3.786 0.631 15.125
213 2HD2 LEU 179 HD22 LEU 179 3.106 1.834 16.222
214 3HD2 LEU 179 HD23 LEU 179 3.725 0.310 16.858
215 H ARG 180 HN ARG 180 4.436 5.567 13.823
216 HA ARG 180 HA ARG 180 5.327 7.653 14.058
217 1HB ARG 180 HB2 ARG 180 7.670 6.366 15.466
218 2HB ARG 180 HB1 ARG 180 7.112 8.039 15.603
219 1HG ARG 180 HG2 ARG 180 5.200 5.904 16.355
220 2HG ARG 180 HG1 ARG 180 6.573 6.181 17.427
221 1HD ARG 180 HD2 ARG 180 5.369 7.816 18.339
222 2HD ARG 180 HD1 ARG 180 5.666 8.728 16.862
223 HE ARG 180 HE ARG 180 3.222 7.288 17.570
224 1HH1 ARG 180 1HH1 ARG 180 4.961 9.259 15.264
225 2HH1 ARG 180 2HH1 ARG 180 3.537 9.703 14.388
226 1HH2 ARG 180 1HH2 ARG 180 1.356 7.873 16.411
227 2HH2 ARG 180 2HH2 ARG 180 1.494 8.917 15.036
228 1HG HSL 181 HG1 HSL 181 8.450 6.523 7.913
229 2HG HSL 181 HG2 HSL 181 6.772 5.940 7.427
230 H HSL 181 HN HSL 181 5.522 6.697 11.668
231 HA HSL 181 HA HSL 181 8.399 7.222 10.748
232 1HB HSL 181 HB1 HSL 181 8.080 5.081 9.789
233 2HB HSL 181 HB2 HSL 181 6.250 5.292 9.696
Start of MODEL 31
1 1H PHE 155 HT1 PHE 155 -15.149 -0.379 6.124
2 2H PHE 155 HT2 PHE 155 -14.480 1.138 6.572
3 3H PHE 155 HT3 PHE 155 -14.587 -0.129 7.724
4 HA PHE 155 HA PHE 155 -12.379 0.054 6.995
5 1HB PHE 155 HB2 PHE 155 -13.777 -2.204 7.183
6 2HB PHE 155 HB1 PHE 155 -13.350 -2.314 5.479
7 HD1 PHE 155 HD1 PHE 155 -11.366 -3.330 4.900
8 HD2 PHE 155 HD2 PHE 155 -11.778 -1.668 8.795
9 HE1 PHE 155 HE1 PHE 155 -9.156 -4.224 5.511
10 HE2 PHE 155 HE2 PHE 155 -9.569 -2.559 9.414
11 HZ PHE 155 HZ PHE 155 -8.255 -3.838 7.770
12 H LEU 156 HN LEU 156 -14.582 0.789 4.645
13 HA LEU 156 HA LEU 156 -14.398 1.652 2.576
14 1HB LEU 156 HB2 LEU 156 -11.602 1.803 3.542
15 2HB LEU 156 HB1 LEU 156 -11.874 2.027 1.825
16 HG LEU 156 HG LEU 156 -13.566 3.615 3.675
17 1HD1 LEU 156 HD11 LEU 156 -10.872 4.701 3.057
18 2HD1 LEU 156 HD12 LEU 156 -11.029 3.571 4.402
19 3HD1 LEU 156 HD13 LEU 156 -11.964 5.068 4.393
20 1HD2 LEU 156 HD21 LEU 156 -12.128 4.812 1.401
21 2HD2 LEU 156 HD22 LEU 156 -13.818 4.959 1.884
22 3HD2 LEU 156 HD23 LEU 156 -13.276 3.536 0.993
23 H GLN 157 HN GLN 157 -15.189 0.071 1.300
24 HA GLN 157 HA GLN 157 -13.741 -2.309 0.685
25 1HB GLN 157 HB2 GLN 157 -16.325 -1.840 0.675
26 2HB GLN 157 HB1 GLN 157 -16.030 -1.329 -0.981
27 1HG GLN 157 HG2 GLN 157 -16.332 -3.458 -1.529
28 2HG GLN 157 HG1 GLN 157 -14.727 -3.738 -0.854
29 1HE2 GLN 157 HE21 GLN 157 -17.878 -3.088 0.633
30 2HE2 GLN 157 HE22 GLN 157 -17.897 -4.503 1.624
31 H SER 158 HN SER 158 -13.732 0.872 -0.531
32 HA SER 158 HA SER 158 -12.943 0.257 -3.199
33 1HB SER 158 HB2 SER 158 -12.188 2.870 -1.986
34 2HB SER 158 HB1 SER 158 -12.934 2.525 -3.556
35 HG SER 158 HG SER 158 -14.100 3.124 -1.167
36 H ASP 159 HN ASP 159 -11.409 -1.380 -2.141
37 HA ASP 159 HA ASP 159 -9.339 -2.180 -1.856
38 1HB ASP 159 HB2 ASP 159 -7.480 -1.159 -2.934
39 2HB ASP 159 HB1 ASP 159 -8.887 -0.893 -3.954
40 H VAL 160 HN VAL 160 -9.183 1.257 -0.974
41 HA VAL 160 HA VAL 160 -8.755 2.256 1.010
42 HB VAL 160 HB VAL 160 -9.720 -0.063 1.968
43 1HG1 VAL 160 HG11 VAL 160 -7.114 -0.011 3.415
44 2HG1 VAL 160 HG12 VAL 160 -7.219 -0.902 1.900
45 3HG1 VAL 160 HG13 VAL 160 -8.280 -1.321 3.242
46 1HG2 VAL 160 HG21 VAL 160 -9.794 2.263 2.912
47 2HG2 VAL 160 HG22 VAL 160 -8.277 1.896 3.734
48 3HG2 VAL 160 HG23 VAL 160 -9.729 0.964 4.103
49 H PHE 161 HN PHE 161 -6.644 -0.414 0.063
50 HA PHE 161 HA PHE 161 -4.308 0.787 1.214
51 1HB PHE 161 HB2 PHE 161 -4.730 -1.548 -0.646
52 2HB PHE 161 HB1 PHE 161 -3.128 -1.005 -0.161
53 HD1 PHE 161 HD1 PHE 161 -6.230 -2.594 0.947
54 HD2 PHE 161 HD2 PHE 161 -2.316 -1.360 2.074
55 HE1 PHE 161 HE1 PHE 161 -6.387 -3.966 2.984
56 HE2 PHE 161 HE2 PHE 161 -2.467 -2.730 4.112
57 HZ PHE 161 HZ PHE 161 -4.504 -4.035 4.569
58 H PHE 162 HN PHE 162 -5.782 2.508 -0.597
59 HA PHE 162 HA PHE 162 -3.639 3.444 -2.203
60 1HB PHE 162 HB2 PHE 162 -5.304 1.459 -3.306
61 2HB PHE 162 HB1 PHE 162 -5.681 2.974 -4.120
62 HD1 PHE 162 HD1 PHE 162 -3.575 4.352 -4.901
63 HD2 PHE 162 HD2 PHE 162 -3.586 0.167 -4.129
64 HE1 PHE 162 HE1 PHE 162 -1.580 4.090 -6.317
65 HE2 PHE 162 HE2 PHE 162 -1.590 -0.103 -5.543
66 HZ PHE 162 HZ PHE 162 -0.584 1.861 -6.639
67 H LEU 163 HN LEU 163 -7.182 3.379 -2.213
68 HA LEU 163 HA LEU 163 -7.523 6.080 -2.992
69 1HB LEU 163 HB2 LEU 163 -9.261 3.981 -1.762
70 2HB LEU 163 HB1 LEU 163 -9.854 5.624 -1.920
71 HG LEU 163 HG LEU 163 -9.012 3.790 -4.165
72 1HD1 LEU 163 HD11 LEU 163 -11.549 4.689 -4.665
73 2HD1 LEU 163 HD12 LEU 163 -11.556 4.472 -2.916
74 3HD1 LEU 163 HD13 LEU 163 -11.130 3.124 -3.970
75 1HD2 LEU 163 HD21 LEU 163 -9.429 6.721 -4.059
76 2HD2 LEU 163 HD22 LEU 163 -10.103 5.858 -5.442
77 3HD2 LEU 163 HD23 LEU 163 -8.375 5.760 -5.098
78 H PHE 164 HN PHE 164 -6.293 4.819 -0.269
79 HA PHE 164 HA PHE 164 -7.450 6.423 1.768
80 1HB PHE 164 HB2 PHE 164 -5.790 4.188 1.556
81 2HB PHE 164 HB1 PHE 164 -4.781 5.413 2.310
82 HD1 PHE 164 HD1 PHE 164 -7.246 6.789 3.697
83 HD2 PHE 164 HD2 PHE 164 -5.785 2.794 3.531
84 HE1 PHE 164 HE1 PHE 164 -8.283 6.322 5.878
85 HE2 PHE 164 HE2 PHE 164 -6.822 2.322 5.712
86 HZ PHE 164 HZ PHE 164 -8.072 4.087 6.888
87 H LEU 165 HN LEU 165 -6.837 8.232 -0.158
88 HA LEU 165 HA LEU 165 -5.948 10.334 -0.279
89 1HB LEU 165 HB2 LEU 165 -5.244 9.590 2.322
90 2HB LEU 165 HB1 LEU 165 -3.751 10.140 1.582
91 HG LEU 165 HG LEU 165 -4.744 12.005 2.685
92 1HD1 LEU 165 HD11 LEU 165 -4.624 13.542 0.999
93 2HD1 LEU 165 HD12 LEU 165 -5.589 12.566 -0.109
94 3HD1 LEU 165 HD13 LEU 165 -3.903 12.148 0.196
95 1HD2 LEU 165 HD21 LEU 165 -6.960 11.590 3.058
96 2HD2 LEU 165 HD22 LEU 165 -7.238 10.994 1.421
97 3HD2 LEU 165 HD23 LEU 165 -7.085 12.727 1.715
98 H LEU 166 HN LEU 166 -3.658 7.672 0.140
99 HA LEU 166 HA LEU 166 -2.388 8.315 -2.347
100 1HB LEU 166 HB2 LEU 166 -0.514 9.327 -1.641
101 2HB LEU 166 HB1 LEU 166 -1.443 9.683 -0.195
102 HG LEU 166 HG LEU 166 0.418 7.322 -0.513
103 1HD1 LEU 166 HD11 LEU 166 1.518 8.841 1.410
104 2HD1 LEU 166 HD12 LEU 166 0.823 10.099 0.388
105 3HD1 LEU 166 HD13 LEU 166 1.968 8.944 -0.292
106 1HD2 LEU 166 HD21 LEU 166 -0.201 6.623 1.541
107 2HD2 LEU 166 HD22 LEU 166 -1.696 7.472 1.151
108 3HD2 LEU 166 HD23 LEU 166 -0.465 8.261 2.138
109 HA PRO 167 HA PRO 167 -1.300 4.039 -2.245
110 1HB PRO 167 HB2 PRO 167 1.195 3.895 -3.267
111 2HB PRO 167 HB1 PRO 167 -0.210 4.359 -4.248
112 1HG PRO 167 HG2 PRO 167 1.869 6.097 -2.969
113 2HG PRO 167 HG1 PRO 167 1.164 6.206 -4.593
114 1HD PRO 167 HD2 PRO 167 0.365 7.772 -2.518
115 2HD PRO 167 HD1 PRO 167 -0.718 7.290 -3.838
116 HA PRO 168 HA PRO 168 0.849 3.832 1.772
117 1HB PRO 168 HB2 PRO 168 -0.195 1.418 2.481
118 2HB PRO 168 HB1 PRO 168 -1.063 2.951 2.695
119 1HG PRO 168 HG2 PRO 168 -1.323 0.910 0.515
120 2HG PRO 168 HG1 PRO 168 -2.595 1.790 1.383
121 1HD PRO 168 HD2 PRO 168 -1.773 2.509 -1.086
122 2HD PRO 168 HD1 PRO 168 -2.316 3.697 0.116
123 H ILE 169 HN ILE 169 2.742 3.579 0.223
124 HA ILE 169 HA ILE 169 3.538 0.929 -0.512
125 HB ILE 169 HB ILE 169 4.203 3.107 -1.661
126 1HG1 ILE 169 HG12 ILE 169 6.514 2.198 -2.195
127 2HG1 ILE 169 HG11 ILE 169 6.204 0.958 -0.983
128 1HG2 ILE 169 HG21 ILE 169 6.302 3.155 0.492
129 2HG2 ILE 169 HG22 ILE 169 4.963 4.292 0.348
130 3HG2 ILE 169 HG23 ILE 169 6.202 4.227 -0.904
131 1HD1 ILE 169 HD11 ILE 169 5.125 1.266 -3.700
132 2HD1 ILE 169 HD12 ILE 169 3.991 0.702 -2.473
133 3HD1 ILE 169 HD13 ILE 169 5.482 -0.191 -2.772
134 H ILE 170 HN ILE 170 4.552 3.227 1.960
135 HA ILE 170 HA ILE 170 6.501 1.505 3.130
136 HB ILE 170 HB ILE 170 5.194 3.926 4.372
137 1HG1 ILE 170 HG12 ILE 170 7.673 4.725 3.515
138 2HG1 ILE 170 HG11 ILE 170 7.174 3.646 2.216
139 1HG2 ILE 170 HG21 ILE 170 6.381 2.540 5.974
140 2HG2 ILE 170 HG22 ILE 170 7.254 4.047 5.701
141 3HG2 ILE 170 HG23 ILE 170 7.817 2.555 4.950
142 1HD1 ILE 170 HD11 ILE 170 6.261 5.532 1.407
143 2HD1 ILE 170 HD12 ILE 170 6.133 6.284 2.998
144 3HD1 ILE 170 HD13 ILE 170 4.936 5.094 2.484
145 H LEU 171 HN LEU 171 3.125 2.252 3.804
146 HA LEU 171 HA LEU 171 2.986 0.960 6.313
147 1HB LEU 171 HB2 LEU 171 0.707 1.168 4.356
148 2HB LEU 171 HB1 LEU 171 0.626 1.115 6.106
149 HG LEU 171 HG LEU 171 1.645 3.409 4.429
150 1HD1 LEU 171 HD11 LEU 171 -0.924 2.763 4.912
151 2HD1 LEU 171 HD12 LEU 171 -0.344 4.417 4.722
152 3HD1 LEU 171 HD13 LEU 171 -0.572 3.744 6.335
153 1HD2 LEU 171 HD21 LEU 171 1.483 4.465 6.855
154 2HD2 LEU 171 HD22 LEU 171 2.953 3.682 6.275
155 3HD2 LEU 171 HD23 LEU 171 1.845 2.805 7.329
156 H ASP 172 HN ASP 172 1.761 -0.130 3.157
157 HA ASP 172 HA ASP 172 1.589 -2.860 4.037
158 1HB ASP 172 HB2 ASP 172 0.086 -1.676 2.308
159 2HB ASP 172 HB1 ASP 172 1.412 -1.946 1.167
160 H ALA 173 HN ALA 173 4.260 -1.157 3.504
161 HA ALA 173 HA ALA 173 5.678 -2.742 1.610
162 1HB ALA 173 HB1 ALA 173 6.979 -0.933 1.793
163 2HB ALA 173 HB2 ALA 173 7.579 -1.623 3.301
164 3HB ALA 173 HB3 ALA 173 6.241 -0.475 3.328
165 H GLY 174 HN GLY 174 5.912 -2.440 5.133
166 1HA GLY 174 HA2 GLY 174 6.658 -5.298 5.270
167 2HA GLY 174 HA1 GLY 174 7.414 -4.067 6.301
168 H TYR 175 HN TYR 175 4.333 -3.081 5.952
169 HA TYR 175 HA TYR 175 2.457 -3.067 7.186
170 1HB TYR 175 HB2 TYR 175 3.383 -5.879 7.650
171 2HB TYR 175 HB1 TYR 175 1.938 -5.258 8.437
172 HD1 TYR 175 HD1 TYR 175 3.418 -6.375 5.305
173 HD2 TYR 175 HD2 TYR 175 -0.042 -4.668 7.098
174 HE1 TYR 175 HE1 TYR 175 2.115 -6.915 3.290
175 HE2 TYR 175 HE2 TYR 175 -1.354 -5.204 5.089
176 HH TYR 175 HH TYR 175 -0.168 -7.254 2.611
177 H PHE 176 HN PHE 176 4.951 -4.758 9.113
178 HA PHE 176 HA PHE 176 4.188 -3.134 11.422
179 1HB PHE 176 HB2 PHE 176 5.560 -5.742 11.043
180 2HB PHE 176 HB1 PHE 176 6.074 -4.765 12.426
181 HD1 PHE 176 HD1 PHE 176 4.211 -3.912 13.987
182 HD2 PHE 176 HD2 PHE 176 3.695 -7.095 11.212
183 HE1 PHE 176 HE1 PHE 176 2.275 -4.714 15.276
184 HE2 PHE 176 HE2 PHE 176 1.758 -7.905 12.494
185 HZ PHE 176 HZ PHE 176 1.045 -6.714 14.528
186 H LEU 177 HN LEU 177 5.912 -2.380 8.961
187 HA LEU 177 HA LEU 177 8.461 -1.747 10.167
188 1HB LEU 177 HB2 LEU 177 7.250 -1.372 7.457
189 2HB LEU 177 HB1 LEU 177 8.700 -0.489 7.899
190 HG LEU 177 HG LEU 177 8.416 -3.495 7.875
191 1HD1 LEU 177 HD11 LEU 177 9.922 -3.417 5.969
192 2HD1 LEU 177 HD12 LEU 177 9.943 -1.655 6.039
193 3HD1 LEU 177 HD13 LEU 177 8.450 -2.503 5.635
194 1HD2 LEU 177 HD21 LEU 177 10.594 -1.646 8.748
195 2HD2 LEU 177 HD22 LEU 177 10.998 -3.217 8.054
196 3HD2 LEU 177 HD23 LEU 177 10.003 -3.124 9.508
197 HA PRO 178 HA PRO 178 6.252 2.716 9.301
198 1HB PRO 178 HB2 PRO 178 3.818 1.637 10.691
199 2HB PRO 178 HB1 PRO 178 3.948 2.973 9.538
200 1HG PRO 178 HG2 PRO 178 3.095 0.607 8.716
201 2HG PRO 178 HG1 PRO 178 4.227 1.542 7.718
202 1HD PRO 178 HD2 PRO 178 4.715 -0.879 9.374
203 2HD PRO 178 HD1 PRO 178 5.503 -0.364 7.870
204 H LEU 179 HN LEU 179 6.025 0.440 11.970
205 HA LEU 179 HA LEU 179 5.795 2.155 14.131
206 1HB LEU 179 HB2 LEU 179 6.121 -0.512 13.848
207 2HB LEU 179 HB1 LEU 179 7.713 -0.073 14.438
208 HG LEU 179 HG LEU 179 5.078 0.399 15.830
209 1HD1 LEU 179 HD11 LEU 179 6.505 -1.879 15.751
210 2HD1 LEU 179 HD12 LEU 179 5.559 -1.366 17.149
211 3HD1 LEU 179 HD13 LEU 179 7.297 -1.066 17.101
212 1HD2 LEU 179 HD21 LEU 179 6.303 1.431 17.609
213 2HD2 LEU 179 HD22 LEU 179 6.692 2.278 16.112
214 3HD2 LEU 179 HD23 LEU 179 7.838 1.126 16.796
215 H ARG 180 HN ARG 180 8.702 1.170 12.369
216 HA ARG 180 HA ARG 180 10.379 2.901 13.993
217 1HB ARG 180 HB2 ARG 180 10.906 0.946 11.767
218 2HB ARG 180 HB1 ARG 180 12.159 2.064 12.320
219 1HG ARG 180 HG2 ARG 180 10.710 0.119 14.109
220 2HG ARG 180 HG1 ARG 180 12.270 -0.197 13.346
221 1HD ARG 180 HD2 ARG 180 13.149 0.684 15.208
222 2HD ARG 180 HD1 ARG 180 12.686 2.238 14.518
223 HE ARG 180 HE ARG 180 10.459 1.501 15.834
224 1HH1 ARG 180 1HH1 ARG 180 13.812 1.655 16.795
225 2HH1 ARG 180 2HH1 ARG 180 13.450 1.984 18.455
226 1HH2 ARG 180 1HH2 ARG 180 9.983 1.933 18.019
227 2HH2 ARG 180 2HH2 ARG 180 11.278 2.141 19.151
228 1HG HSL 181 HG1 HSL 181 6.088 6.845 9.947
229 2HG HSL 181 HG2 HSL 181 5.977 5.583 11.283
230 H HSL 181 HN HSL 181 8.246 4.096 12.454
231 HA HSL 181 HA HSL 181 9.871 5.809 10.498
232 1HB HSL 181 HB1 HSL 181 8.081 5.953 9.031
233 2HB HSL 181 HB2 HSL 181 7.503 4.399 9.842
Start of MODEL 32
1 1H PHE 155 HT1 PHE 155 -11.550 6.657 -7.584
2 2H PHE 155 HT2 PHE 155 -11.878 5.579 -6.289
3 3H PHE 155 HT3 PHE 155 -10.360 5.527 -7.089
4 HA PHE 155 HA PHE 155 -11.345 7.900 -5.672
5 1HB PHE 155 HB2 PHE 155 -9.650 7.011 -3.902
6 2HB PHE 155 HB1 PHE 155 -11.278 6.343 -3.938
7 HD1 PHE 155 HD1 PHE 155 -8.080 5.673 -5.756
8 HD2 PHE 155 HD2 PHE 155 -11.340 4.101 -3.516
9 HE1 PHE 155 HE1 PHE 155 -7.142 3.409 -5.986
10 HE2 PHE 155 HE2 PHE 155 -10.408 1.835 -3.741
11 HZ PHE 155 HZ PHE 155 -8.306 1.487 -4.977
12 H LEU 156 HN LEU 156 -9.078 8.748 -4.618
13 HA LEU 156 HA LEU 156 -6.819 8.543 -6.348
14 1HB LEU 156 HB2 LEU 156 -8.571 10.985 -6.450
15 2HB LEU 156 HB1 LEU 156 -6.870 11.052 -6.864
16 HG LEU 156 HG LEU 156 -7.674 9.007 -8.444
17 1HD1 LEU 156 HD11 LEU 156 -10.068 9.832 -7.521
18 2HD1 LEU 156 HD12 LEU 156 -9.822 9.099 -9.107
19 3HD1 LEU 156 HD13 LEU 156 -9.906 10.854 -8.950
20 1HD2 LEU 156 HD21 LEU 156 -8.080 11.788 -9.436
21 2HD2 LEU 156 HD22 LEU 156 -7.255 10.428 -10.198
22 3HD2 LEU 156 HD23 LEU 156 -6.483 11.297 -8.871
23 H GLN 157 HN GLN 157 -5.884 8.024 -4.322
24 HA GLN 157 HA GLN 157 -5.916 9.867 -2.148
25 1HB GLN 157 HB2 GLN 157 -5.519 7.282 -2.145
26 2HB GLN 157 HB1 GLN 157 -3.844 7.727 -2.445
27 1HG GLN 157 HG2 GLN 157 -3.545 8.569 -0.363
28 2HG GLN 157 HG1 GLN 157 -5.223 9.090 -0.211
29 1HE2 GLN 157 HE21 GLN 157 -3.958 7.845 1.867
30 2HE2 GLN 157 HE22 GLN 157 -4.631 6.272 2.104
31 H SER 158 HN SER 158 -3.998 9.429 -4.962
32 HA SER 158 HA SER 158 -2.608 11.859 -4.479
33 1HB SER 158 HB2 SER 158 -1.384 9.792 -3.256
34 2HB SER 158 HB1 SER 158 -0.656 9.658 -4.866
35 HG SER 158 HG SER 158 0.579 11.240 -4.280
36 H ASP 159 HN ASP 159 -4.129 11.703 -6.457
37 HA ASP 159 HA ASP 159 -4.144 12.144 -8.707
38 1HB ASP 159 HB2 ASP 159 -1.488 12.258 -8.275
39 2HB ASP 159 HB1 ASP 159 -1.565 10.846 -9.325
40 H VAL 160 HN VAL 160 -3.210 9.037 -7.463
41 HA VAL 160 HA VAL 160 -4.048 6.971 -7.947
42 HB VAL 160 HB VAL 160 -5.937 8.628 -9.225
43 1HG1 VAL 160 HG11 VAL 160 -6.570 7.281 -11.204
44 2HG1 VAL 160 HG12 VAL 160 -5.045 6.409 -11.060
45 3HG1 VAL 160 HG13 VAL 160 -5.043 8.139 -11.403
46 1HG2 VAL 160 HG21 VAL 160 -6.553 7.006 -7.612
47 2HG2 VAL 160 HG22 VAL 160 -5.898 5.691 -8.587
48 3HG2 VAL 160 HG23 VAL 160 -7.342 6.552 -9.122
49 H PHE 161 HN PHE 161 -3.277 8.846 -10.869
50 HA PHE 161 HA PHE 161 -2.016 6.633 -12.172
51 1HB PHE 161 HB2 PHE 161 -2.672 9.419 -12.804
52 2HB PHE 161 HB1 PHE 161 -1.136 8.895 -13.482
53 HD1 PHE 161 HD1 PHE 161 -4.230 6.912 -12.947
54 HD2 PHE 161 HD2 PHE 161 -1.571 8.694 -15.751
55 HE1 PHE 161 HE1 PHE 161 -5.426 5.796 -14.785
56 HE2 PHE 161 HE2 PHE 161 -2.763 7.582 -17.595
57 HZ PHE 161 HZ PHE 161 -4.694 6.133 -17.112
58 H PHE 162 HN PHE 162 -0.921 7.094 -9.579
59 HA PHE 162 HA PHE 162 1.845 7.209 -10.278
60 1HB PHE 162 HB2 PHE 162 0.612 9.462 -8.741
61 2HB PHE 162 HB1 PHE 162 2.298 9.001 -8.489
62 HD1 PHE 162 HD1 PHE 162 3.786 8.886 -10.593
63 HD2 PHE 162 HD2 PHE 162 0.069 10.950 -10.430
64 HE1 PHE 162 HE1 PHE 162 4.456 10.237 -12.537
65 HE2 PHE 162 HE2 PHE 162 0.730 12.304 -12.375
66 HZ PHE 162 HZ PHE 162 2.927 11.948 -13.431
67 H LEU 163 HN LEU 163 -0.676 6.671 -7.952
68 HA LEU 163 HA LEU 163 0.891 6.018 -5.715
69 1HB LEU 163 HB2 LEU 163 -1.802 5.092 -6.660
70 2HB LEU 163 HB1 LEU 163 -1.082 4.480 -5.180
71 HG LEU 163 HG LEU 163 -2.603 6.275 -4.681
72 1HD1 LEU 163 HD11 LEU 163 -1.271 6.913 -3.025
73 2HD1 LEU 163 HD12 LEU 163 -0.286 7.867 -4.132
74 3HD1 LEU 163 HD13 LEU 163 0.076 6.161 -3.879
75 1HD2 LEU 163 HD21 LEU 163 -2.459 8.443 -5.565
76 2HD2 LEU 163 HD22 LEU 163 -2.298 7.364 -6.948
77 3HD2 LEU 163 HD23 LEU 163 -0.870 8.136 -6.260
78 H PHE 164 HN PHE 164 -0.025 4.356 -8.606
79 HA PHE 164 HA PHE 164 0.687 2.468 -9.618
80 1HB PHE 164 HB2 PHE 164 2.872 3.770 -8.853
81 2HB PHE 164 HB1 PHE 164 3.089 2.323 -7.864
82 HD1 PHE 164 HD1 PHE 164 3.859 0.313 -8.807
83 HD2 PHE 164 HD2 PHE 164 2.650 3.514 -11.337
84 HE1 PHE 164 HE1 PHE 164 4.791 -0.876 -10.750
85 HE2 PHE 164 HE2 PHE 164 3.579 2.331 -13.285
86 HZ PHE 164 HZ PHE 164 4.651 0.134 -12.992
87 H LEU 165 HN LEU 165 -0.889 1.086 -8.935
88 HA LEU 165 HA LEU 165 -1.461 -1.029 -8.241
89 1HB LEU 165 HB2 LEU 165 1.181 -1.084 -7.619
90 2HB LEU 165 HB1 LEU 165 0.459 -1.251 -6.026
91 HG LEU 165 HG LEU 165 -0.752 -3.231 -6.739
92 1HD1 LEU 165 HD11 LEU 165 0.164 -2.352 -9.407
93 2HD1 LEU 165 HD12 LEU 165 -1.331 -3.152 -8.922
94 3HD1 LEU 165 HD13 LEU 165 0.151 -4.090 -9.104
95 1HD2 LEU 165 HD21 LEU 165 1.047 -4.718 -6.801
96 2HD2 LEU 165 HD22 LEU 165 1.703 -3.288 -6.003
97 3HD2 LEU 165 HD23 LEU 165 2.065 -3.595 -7.701
98 H LEU 166 HN LEU 166 -0.419 1.128 -5.586
99 HA LEU 166 HA LEU 166 -3.089 1.113 -4.520
100 1HB LEU 166 HB2 LEU 166 -1.279 -0.875 -3.674
101 2HB LEU 166 HB1 LEU 166 -1.402 0.269 -2.353
102 HG LEU 166 HG LEU 166 -4.045 -0.212 -3.211
103 1HD1 LEU 166 HD11 LEU 166 -3.861 -2.793 -2.582
104 2HD1 LEU 166 HD12 LEU 166 -2.308 -2.600 -3.395
105 3HD1 LEU 166 HD13 LEU 166 -3.803 -2.212 -4.246
106 1HD2 LEU 166 HD21 LEU 166 -3.505 0.299 -0.950
107 2HD2 LEU 166 HD22 LEU 166 -2.455 -1.112 -0.817
108 3HD2 LEU 166 HD23 LEU 166 -4.199 -1.322 -0.968
109 HA PRO 167 HA PRO 167 -2.234 5.171 -3.103
110 1HB PRO 167 HB2 PRO 167 -3.026 4.597 -0.379
111 2HB PRO 167 HB1 PRO 167 -3.862 5.564 -1.604
112 1HG PRO 167 HG2 PRO 167 -4.365 2.821 -0.765
113 2HG PRO 167 HG1 PRO 167 -5.365 3.888 -1.758
114 1HD PRO 167 HD2 PRO 167 -4.057 1.674 -2.707
115 2HD PRO 167 HD1 PRO 167 -4.507 3.068 -3.708
116 HA PRO 168 HA PRO 168 0.973 4.345 0.256
117 1HB PRO 168 HB2 PRO 168 0.907 2.232 1.836
118 2HB PRO 168 HB1 PRO 168 -0.351 3.478 1.979
119 1HG PRO 168 HG2 PRO 168 -0.478 0.799 0.657
120 2HG PRO 168 HG1 PRO 168 -1.698 1.622 1.647
121 1HD PRO 168 HD2 PRO 168 -1.590 1.596 -1.151
122 2HD PRO 168 HD1 PRO 168 -2.553 2.696 -0.153
123 H ILE 169 HN ILE 169 2.691 2.501 1.052
124 HA ILE 169 HA ILE 169 3.314 0.457 -0.804
125 HB ILE 169 HB ILE 169 3.846 2.648 -2.063
126 1HG1 ILE 169 HG12 ILE 169 4.523 0.379 -2.775
127 2HG1 ILE 169 HG11 ILE 169 5.724 1.596 -3.197
128 1HG2 ILE 169 HG21 ILE 169 6.307 2.513 -0.336
129 2HG2 ILE 169 HG22 ILE 169 5.038 3.732 -0.204
130 3HG2 ILE 169 HG23 ILE 169 6.012 3.628 -1.671
131 1HD1 ILE 169 HD11 ILE 169 7.086 -0.018 -2.373
132 2HD1 ILE 169 HD12 ILE 169 5.873 -0.627 -1.247
133 3HD1 ILE 169 HD13 ILE 169 6.752 0.857 -0.879
134 H ILE 170 HN ILE 170 4.629 2.785 1.477
135 HA ILE 170 HA ILE 170 6.738 1.092 2.409
136 HB ILE 170 HB ILE 170 5.639 3.462 3.905
137 1HG1 ILE 170 HG12 ILE 170 7.746 4.457 2.463
138 2HG1 ILE 170 HG11 ILE 170 6.989 3.382 1.293
139 1HG2 ILE 170 HG21 ILE 170 8.353 3.517 4.107
140 2HG2 ILE 170 HG22 ILE 170 8.034 1.783 4.035
141 3HG2 ILE 170 HG23 ILE 170 7.267 2.770 5.279
142 1HD1 ILE 170 HD11 ILE 170 5.804 5.245 0.842
143 2HD1 ILE 170 HD12 ILE 170 6.011 5.904 2.464
144 3HD1 ILE 170 HD13 ILE 170 4.813 4.644 2.171
145 H LEU 171 HN LEU 171 3.695 2.239 3.891
146 HA LEU 171 HA LEU 171 3.923 0.614 6.198
147 1HB LEU 171 HB2 LEU 171 2.461 2.438 6.396
148 2HB LEU 171 HB1 LEU 171 1.662 2.082 4.877
149 HG LEU 171 HG LEU 171 0.552 0.152 5.889
150 1HD1 LEU 171 HD11 LEU 171 1.261 -0.798 7.761
151 2HD1 LEU 171 HD12 LEU 171 1.075 0.712 8.652
152 3HD1 LEU 171 HD13 LEU 171 2.585 0.365 7.810
153 1HD2 LEU 171 HD21 LEU 171 -0.121 2.735 6.197
154 2HD2 LEU 171 HD22 LEU 171 -0.014 2.247 7.888
155 3HD2 LEU 171 HD23 LEU 171 -1.102 1.396 6.792
156 H ASP 172 HN ASP 172 2.080 0.272 3.208
157 HA ASP 172 HA ASP 172 1.128 -2.344 3.803
158 1HB ASP 172 HB2 ASP 172 0.994 -0.478 1.494
159 2HB ASP 172 HB1 ASP 172 0.773 -2.199 1.147
160 H ALA 173 HN ALA 173 4.192 -1.324 3.108
161 HA ALA 173 HA ALA 173 4.988 -3.289 1.208
162 1HB ALA 173 HB1 ALA 173 6.810 -2.019 1.146
163 2HB ALA 173 HB2 ALA 173 7.211 -2.497 2.797
164 3HB ALA 173 HB3 ALA 173 6.203 -1.081 2.508
165 H GLY 174 HN GLY 174 5.849 -2.909 4.639
166 1HA GLY 174 HA2 GLY 174 5.910 -5.860 4.861
167 2HA GLY 174 HA1 GLY 174 6.988 -4.781 5.767
168 H TYR 175 HN TYR 175 4.483 -2.957 5.975
169 HA TYR 175 HA TYR 175 2.719 -2.600 7.368
170 1HB TYR 175 HB2 TYR 175 2.120 -5.015 6.725
171 2HB TYR 175 HB1 TYR 175 2.846 -5.476 8.261
172 HD1 TYR 175 HD1 TYR 175 1.611 -5.346 10.249
173 HD2 TYR 175 HD2 TYR 175 0.186 -3.351 6.772
174 HE1 TYR 175 HE1 TYR 175 -0.508 -4.867 11.400
175 HE2 TYR 175 HE2 TYR 175 -1.937 -2.864 7.915
176 HH TYR 175 HH TYR 175 -3.272 -3.779 9.788
177 H PHE 176 HN PHE 176 5.739 -3.757 8.328
178 HA PHE 176 HA PHE 176 5.245 -3.321 11.171
179 1HB PHE 176 HB2 PHE 176 6.571 -5.297 10.459
180 2HB PHE 176 HB1 PHE 176 7.781 -4.206 9.771
181 HD1 PHE 176 HD1 PHE 176 6.190 -5.309 12.918
182 HD2 PHE 176 HD2 PHE 176 9.419 -3.193 11.129
183 HE1 PHE 176 HE1 PHE 176 7.327 -5.210 15.097
184 HE2 PHE 176 HE2 PHE 176 10.563 -3.089 13.305
185 HZ PHE 176 HZ PHE 176 9.516 -4.099 15.293
186 H LEU 177 HN LEU 177 5.999 -1.491 8.529
187 HA LEU 177 HA LEU 177 8.108 0.138 9.305
188 1HB LEU 177 HB2 LEU 177 5.685 0.624 7.608
189 2HB LEU 177 HB1 LEU 177 6.862 1.892 7.898
190 HG LEU 177 HG LEU 177 7.372 0.866 5.805
191 1HD1 LEU 177 HD11 LEU 177 9.383 -0.393 7.614
192 2HD1 LEU 177 HD12 LEU 177 9.215 1.362 7.560
193 3HD1 LEU 177 HD13 LEU 177 9.625 0.471 6.095
194 1HD2 LEU 177 HD21 LEU 177 7.635 -1.787 7.188
195 2HD2 LEU 177 HD22 LEU 177 7.678 -1.452 5.457
196 3HD2 LEU 177 HD23 LEU 177 6.169 -1.280 6.353
197 HA PRO 178 HA PRO 178 4.511 2.896 11.379
198 1HB PRO 178 HB2 PRO 178 3.078 0.524 12.499
199 2HB PRO 178 HB1 PRO 178 2.429 2.076 11.955
200 1HG PRO 178 HG2 PRO 178 2.149 -0.071 10.442
201 2HG PRO 178 HG1 PRO 178 2.578 1.485 9.704
202 1HD PRO 178 HD2 PRO 178 4.321 -0.871 10.308
203 2HD PRO 178 HD1 PRO 178 4.315 0.190 8.886
204 H LEU 179 HN LEU 179 3.512 1.628 13.996
205 HA LEU 179 HA LEU 179 4.277 1.048 16.077
206 1HB LEU 179 HB2 LEU 179 7.113 1.212 15.074
207 2HB LEU 179 HB1 LEU 179 6.525 0.414 16.519
208 HG LEU 179 HG LEU 179 6.082 -0.476 13.670
209 1HD1 LEU 179 HD11 LEU 179 7.345 -2.163 15.752
210 2HD1 LEU 179 HD12 LEU 179 8.297 -0.838 15.083
211 3HD1 LEU 179 HD13 LEU 179 7.648 -2.082 14.017
212 1HD2 LEU 179 HD21 LEU 179 4.736 -1.197 16.201
213 2HD2 LEU 179 HD22 LEU 179 5.195 -2.527 15.138
214 3HD2 LEU 179 HD23 LEU 179 4.140 -1.247 14.541
215 H ARG 180 HN ARG 180 3.390 3.219 16.325
216 HA ARG 180 HA ARG 180 3.449 5.287 17.267
217 1HB ARG 180 HB2 ARG 180 6.347 4.726 17.918
218 2HB ARG 180 HB1 ARG 180 5.260 5.859 18.732
219 1HG ARG 180 HG2 ARG 180 4.601 4.279 20.136
220 2HG ARG 180 HG1 ARG 180 4.125 3.232 18.799
221 1HD ARG 180 HD2 ARG 180 6.753 2.859 18.669
222 2HD ARG 180 HD1 ARG 180 6.638 3.286 20.377
223 HE ARG 180 HE ARG 180 4.719 1.411 20.094
224 1HH1 ARG 180 1HH1 ARG 180 8.098 1.494 19.224
225 2HH1 ARG 180 2HH1 ARG 180 8.317 -0.213 19.413
226 1HH2 ARG 180 1HH2 ARG 180 5.007 -0.834 20.346
227 2HH2 ARG 180 2HH2 ARG 180 6.563 -1.535 20.050
228 1HG HSL 181 HG1 HSL 181 5.631 7.668 11.028
229 2HG HSL 181 HG2 HSL 181 4.407 6.480 10.338
230 H HSL 181 HN HSL 181 3.635 5.214 14.592
231 HA HSL 181 HA HSL 181 5.694 7.382 13.913
232 1HB HSL 181 HB1 HSL 181 6.304 5.752 12.304
233 2HB HSL 181 HB2 HSL 181 4.610 5.024 12.260
Start of MODEL 33
1 1H PHE 155 HT1 PHE 155 2.816 21.903 2.186
2 2H PHE 155 HT2 PHE 155 1.578 20.748 1.904
3 3H PHE 155 HT3 PHE 155 1.741 22.104 0.867
4 HA PHE 155 HA PHE 155 2.577 20.006 -0.046
5 1HB PHE 155 HB2 PHE 155 4.554 21.068 -0.973
6 2HB PHE 155 HB1 PHE 155 3.280 22.268 -0.793
7 HD1 PHE 155 HD1 PHE 155 3.361 23.802 1.228
8 HD2 PHE 155 HD2 PHE 155 6.643 21.377 0.015
9 HE1 PHE 155 HE1 PHE 155 4.889 25.223 2.533
10 HE2 PHE 155 HE2 PHE 155 8.176 22.794 1.319
11 HZ PHE 155 HZ PHE 155 7.299 24.720 2.580
12 H LEU 156 HN LEU 156 3.630 18.162 0.361
13 HA LEU 156 HA LEU 156 6.010 18.035 1.890
14 1HB LEU 156 HB2 LEU 156 5.262 16.807 3.786
15 2HB LEU 156 HB1 LEU 156 4.307 18.270 3.679
16 HG LEU 156 HG LEU 156 2.926 16.222 2.284
17 1HD1 LEU 156 HD11 LEU 156 3.768 15.443 5.068
18 2HD1 LEU 156 HD12 LEU 156 4.212 14.616 3.575
19 3HD1 LEU 156 HD13 LEU 156 2.531 14.637 4.105
20 1HD2 LEU 156 HD21 LEU 156 1.479 17.726 3.130
21 2HD2 LEU 156 HD22 LEU 156 2.504 18.084 4.519
22 3HD2 LEU 156 HD23 LEU 156 1.481 16.648 4.525
23 H GLN 157 HN GLN 157 6.932 15.895 1.978
24 HA GLN 157 HA GLN 157 7.476 13.874 1.089
25 1HB GLN 157 HB2 GLN 157 5.232 13.234 1.968
26 2HB GLN 157 HB1 GLN 157 4.540 13.646 0.405
27 1HG GLN 157 HG2 GLN 157 6.770 11.814 0.157
28 2HG GLN 157 HG1 GLN 157 5.493 11.178 1.193
29 1HE2 GLN 157 HE21 GLN 157 6.560 10.973 -1.786
30 2HE2 GLN 157 HE22 GLN 157 5.086 10.811 -2.672
31 H SER 158 HN SER 158 7.271 16.389 -0.540
32 HA SER 158 HA SER 158 7.476 17.099 -2.685
33 1HB SER 158 HB2 SER 158 9.340 15.217 -2.285
34 2HB SER 158 HB1 SER 158 8.440 14.436 -3.595
35 HG SER 158 HG SER 158 10.276 16.098 -3.992
36 H ASP 159 HN ASP 159 4.949 15.978 -1.993
37 HA ASP 159 HA ASP 159 3.837 15.745 -4.612
38 1HB ASP 159 HB2 ASP 159 4.163 13.316 -2.907
39 2HB ASP 159 HB1 ASP 159 2.663 13.493 -3.811
40 H VAL 160 HN VAL 160 3.179 14.893 -1.240
41 HA VAL 160 HA VAL 160 1.671 15.654 0.265
42 HB VAL 160 HB VAL 160 2.082 17.893 -1.226
43 1HG1 VAL 160 HG11 VAL 160 0.088 17.396 -2.640
44 2HG1 VAL 160 HG12 VAL 160 -0.018 18.928 -1.778
45 3HG1 VAL 160 HG13 VAL 160 -0.914 17.526 -1.197
46 1HG2 VAL 160 HG21 VAL 160 1.891 17.753 1.198
47 2HG2 VAL 160 HG22 VAL 160 0.142 17.581 1.060
48 3HG2 VAL 160 HG23 VAL 160 0.923 19.081 0.561
49 H PHE 161 HN PHE 161 0.265 15.508 -3.027
50 HA PHE 161 HA PHE 161 -2.352 14.935 -2.191
51 1HB PHE 161 HB2 PHE 161 -2.836 14.425 -4.434
52 2HB PHE 161 HB1 PHE 161 -1.534 15.605 -4.528
53 HD1 PHE 161 HD1 PHE 161 0.808 13.886 -3.968
54 HD2 PHE 161 HD2 PHE 161 -2.622 13.199 -6.388
55 HE1 PHE 161 HE1 PHE 161 2.111 12.335 -5.364
56 HE2 PHE 161 HE2 PHE 161 -1.328 11.646 -7.789
57 HZ PHE 161 HZ PHE 161 1.042 11.211 -7.278
58 H PHE 162 HN PHE 162 0.471 13.015 -2.221
59 HA PHE 162 HA PHE 162 -0.717 10.441 -2.378
60 1HB PHE 162 HB2 PHE 162 1.860 11.525 -2.272
61 2HB PHE 162 HB1 PHE 162 1.722 10.491 -0.851
62 HD1 PHE 162 HD1 PHE 162 3.314 10.309 -3.638
63 HD2 PHE 162 HD2 PHE 162 -0.085 8.385 -1.946
64 HE1 PHE 162 HE1 PHE 162 3.736 8.334 -5.046
65 HE2 PHE 162 HE2 PHE 162 0.332 6.407 -3.350
66 HZ PHE 162 HZ PHE 162 2.244 6.380 -4.901
67 H LEU 163 HN LEU 163 0.746 12.183 0.333
68 HA LEU 163 HA LEU 163 -0.330 10.500 2.347
69 1HB LEU 163 HB2 LEU 163 0.964 13.197 2.292
70 2HB LEU 163 HB1 LEU 163 0.288 12.568 3.786
71 HG LEU 163 HG LEU 163 1.737 10.525 3.404
72 1HD1 LEU 163 HD11 LEU 163 3.709 10.839 2.001
73 2HD1 LEU 163 HD12 LEU 163 3.060 12.383 1.448
74 3HD1 LEU 163 HD13 LEU 163 2.215 10.883 1.065
75 1HD2 LEU 163 HD21 LEU 163 2.191 12.819 4.776
76 2HD2 LEU 163 HD22 LEU 163 3.624 12.740 3.752
77 3HD2 LEU 163 HD23 LEU 163 3.236 11.400 4.830
78 H PHE 164 HN PHE 164 -1.742 12.632 0.330
79 HA PHE 164 HA PHE 164 -3.635 13.891 2.074
80 1HB PHE 164 HB2 PHE 164 -2.616 14.298 -0.498
81 2HB PHE 164 HB1 PHE 164 -4.323 13.939 -0.734
82 HD1 PHE 164 HD1 PHE 164 -6.008 15.275 0.671
83 HD2 PHE 164 HD2 PHE 164 -1.953 16.438 0.122
84 HE1 PHE 164 HE1 PHE 164 -6.590 17.585 1.290
85 HE2 PHE 164 HE2 PHE 164 -2.526 18.749 0.739
86 HZ PHE 164 HZ PHE 164 -4.848 19.324 1.326
87 H LEU 165 HN LEU 165 -3.543 10.840 1.745
88 HA LEU 165 HA LEU 165 -6.338 10.421 1.904
89 1HB LEU 165 HB2 LEU 165 -5.047 10.062 -0.706
90 2HB LEU 165 HB1 LEU 165 -5.984 8.678 -0.168
91 HG LEU 165 HG LEU 165 -7.627 10.906 0.294
92 1HD1 LEU 165 HD11 LEU 165 -5.811 11.828 -1.460
93 2HD1 LEU 165 HD12 LEU 165 -7.498 12.341 -1.440
94 3HD1 LEU 165 HD13 LEU 165 -6.969 11.096 -2.571
95 1HD2 LEU 165 HD21 LEU 165 -8.246 8.598 -0.413
96 2HD2 LEU 165 HD22 LEU 165 -7.712 9.008 -2.044
97 3HD2 LEU 165 HD23 LEU 165 -9.065 9.874 -1.314
98 H LEU 166 HN LEU 166 -3.825 8.335 0.501
99 HA LEU 166 HA LEU 166 -3.422 6.916 2.965
100 1HB LEU 166 HB2 LEU 166 -5.557 6.127 1.311
101 2HB LEU 166 HB1 LEU 166 -4.284 4.951 1.034
102 HG LEU 166 HG LEU 166 -5.687 4.099 2.764
103 1HD1 LEU 166 HD11 LEU 166 -3.176 3.933 3.017
104 2HD1 LEU 166 HD12 LEU 166 -4.127 3.697 4.484
105 3HD1 LEU 166 HD13 LEU 166 -3.306 5.232 4.203
106 1HD2 LEU 166 HD21 LEU 166 -6.348 5.270 4.695
107 2HD2 LEU 166 HD22 LEU 166 -6.600 6.390 3.356
108 3HD2 LEU 166 HD23 LEU 166 -5.192 6.569 4.402
109 HA PRO 167 HA PRO 167 0.101 6.915 -0.003
110 1HB PRO 167 HB2 PRO 167 2.010 7.141 1.918
111 2HB PRO 167 HB1 PRO 167 1.196 8.527 1.169
112 1HG PRO 167 HG2 PRO 167 0.644 7.199 3.799
113 2HG PRO 167 HG1 PRO 167 0.678 8.928 3.405
114 1HD PRO 167 HD2 PRO 167 -1.631 7.548 3.642
115 2HD PRO 167 HD1 PRO 167 -1.447 8.890 2.494
116 HA PRO 168 HA PRO 168 0.658 2.577 1.113
117 1HB PRO 168 HB2 PRO 168 0.838 1.627 -1.356
118 2HB PRO 168 HB1 PRO 168 -0.716 2.252 -0.760
119 1HG PRO 168 HG2 PRO 168 1.318 3.593 -2.510
120 2HG PRO 168 HG1 PRO 168 -0.445 3.546 -2.688
121 1HD PRO 168 HD2 PRO 168 0.979 5.610 -1.552
122 2HD PRO 168 HD1 PRO 168 -0.737 5.284 -1.243
123 H ILE 169 HN ILE 169 2.291 0.993 -0.254
124 HA ILE 169 HA ILE 169 4.427 0.434 -0.828
125 HB ILE 169 HB ILE 169 4.328 3.040 -1.695
126 1HG1 ILE 169 HG12 ILE 169 6.660 2.425 -2.668
127 2HG1 ILE 169 HG11 ILE 169 6.407 0.881 -1.859
128 1HG2 ILE 169 HG21 ILE 169 5.412 3.726 0.468
129 2HG2 ILE 169 HG22 ILE 169 6.263 4.216 -0.994
130 3HG2 ILE 169 HG23 ILE 169 6.843 2.840 -0.056
131 1HD1 ILE 169 HD11 ILE 169 5.189 1.961 -4.286
132 2HD1 ILE 169 HD12 ILE 169 4.055 1.186 -3.178
133 3HD1 ILE 169 HD13 ILE 169 5.446 0.289 -3.786
134 H ILE 170 HN ILE 170 4.030 2.773 1.775
135 HA ILE 170 HA ILE 170 6.365 1.867 3.201
136 HB ILE 170 HB ILE 170 4.200 3.625 4.331
137 1HG1 ILE 170 HG12 ILE 170 6.043 5.412 3.502
138 2HG1 ILE 170 HG11 ILE 170 6.198 4.216 2.220
139 1HG2 ILE 170 HG21 ILE 170 6.391 4.601 5.386
140 2HG2 ILE 170 HG22 ILE 170 7.041 3.012 4.981
141 3HG2 ILE 170 HG23 ILE 170 5.644 3.147 6.048
142 1HD1 ILE 170 HD11 ILE 170 3.503 4.485 2.371
143 2HD1 ILE 170 HD12 ILE 170 4.546 5.372 1.262
144 3HD1 ILE 170 HD13 ILE 170 4.044 6.112 2.781
145 H LEU 171 HN LEU 171 2.937 2.095 4.149
146 HA LEU 171 HA LEU 171 3.172 0.243 6.274
147 1HB LEU 171 HB2 LEU 171 0.660 0.202 6.154
148 2HB LEU 171 HB1 LEU 171 1.378 1.787 6.363
149 HG LEU 171 HG LEU 171 1.144 1.636 3.636
150 1HD1 LEU 171 HD11 LEU 171 -0.142 -0.205 3.298
151 2HD1 LEU 171 HD12 LEU 171 -1.423 0.971 3.591
152 3HD1 LEU 171 HD13 LEU 171 -0.902 -0.108 4.886
153 1HD2 LEU 171 HD21 LEU 171 0.561 3.571 4.915
154 2HD2 LEU 171 HD22 LEU 171 -0.777 2.720 5.689
155 3HD2 LEU 171 HD23 LEU 171 -0.850 3.098 3.967
156 H ASP 172 HN ASP 172 1.982 -0.029 2.975
157 HA ASP 172 HA ASP 172 1.303 -2.782 3.145
158 1HB ASP 172 HB2 ASP 172 1.000 -0.686 1.258
159 2HB ASP 172 HB1 ASP 172 1.854 -2.001 0.438
160 H ALA 173 HN ALA 173 4.278 -1.276 3.148
161 HA ALA 173 HA ALA 173 5.701 -3.077 1.458
162 1HB ALA 173 HB1 ALA 173 7.534 -1.986 3.259
163 2HB ALA 173 HB2 ALA 173 6.322 -0.734 3.005
164 3HB ALA 173 HB3 ALA 173 7.176 -1.423 1.627
165 H GLY 174 HN GLY 174 5.793 -2.559 4.978
166 1HA GLY 174 HA2 GLY 174 6.147 -5.473 5.316
167 2HA GLY 174 HA1 GLY 174 7.165 -4.318 6.195
168 H TYR 175 HN TYR 175 4.169 -2.946 5.946
169 HA TYR 175 HA TYR 175 2.528 -2.465 7.362
170 1HB TYR 175 HB2 TYR 175 2.093 -4.906 8.718
171 2HB TYR 175 HB1 TYR 175 1.198 -4.206 7.383
172 HD1 TYR 175 HD1 TYR 175 2.097 -4.669 5.006
173 HD2 TYR 175 HD2 TYR 175 3.188 -6.947 8.430
174 HE1 TYR 175 HE1 TYR 175 2.782 -6.526 3.546
175 HE2 TYR 175 HE2 TYR 175 3.877 -8.809 6.979
176 HH TYR 175 HH TYR 175 2.974 -9.237 3.984
177 H PHE 176 HN PHE 176 4.810 -4.599 9.117
178 HA PHE 176 HA PHE 176 4.314 -3.054 11.537
179 1HB PHE 176 HB2 PHE 176 5.497 -5.703 10.916
180 2HB PHE 176 HB1 PHE 176 6.174 -4.847 12.309
181 HD1 PHE 176 HD1 PHE 176 5.372 -5.908 14.191
182 HD2 PHE 176 HD2 PHE 176 2.683 -5.018 11.015
183 HE1 PHE 176 HE1 PHE 176 3.488 -6.674 15.577
184 HE2 PHE 176 HE2 PHE 176 0.794 -5.782 12.395
185 HZ PHE 176 HZ PHE 176 1.195 -6.611 14.679
186 H LEU 177 HN LEU 177 5.893 -2.154 9.068
187 HA LEU 177 HA LEU 177 8.571 -1.798 10.064
188 1HB LEU 177 HB2 LEU 177 8.915 -1.690 7.868
189 2HB LEU 177 HB1 LEU 177 7.200 -1.528 7.553
190 HG LEU 177 HG LEU 177 7.444 0.940 7.970
191 1HD1 LEU 177 HD11 LEU 177 9.823 0.334 9.078
192 2HD1 LEU 177 HD12 LEU 177 9.417 1.924 8.432
193 3HD1 LEU 177 HD13 LEU 177 10.338 0.783 7.452
194 1HD2 LEU 177 HD21 LEU 177 7.772 1.272 5.765
195 2HD2 LEU 177 HD22 LEU 177 7.757 -0.491 5.705
196 3HD2 LEU 177 HD23 LEU 177 9.291 0.377 5.748
197 HA PRO 178 HA PRO 178 6.651 2.859 10.125
198 1HB PRO 178 HB2 PRO 178 4.138 1.759 11.336
199 2HB PRO 178 HB1 PRO 178 4.376 3.243 10.403
200 1HG PRO 178 HG2 PRO 178 3.332 1.100 9.245
201 2HG PRO 178 HG1 PRO 178 4.512 2.103 8.380
202 1HD PRO 178 HD2 PRO 178 4.849 -0.582 9.609
203 2HD PRO 178 HD1 PRO 178 5.655 0.120 8.193
204 H LEU 179 HN LEU 179 5.842 0.280 12.443
205 HA LEU 179 HA LEU 179 6.312 0.018 14.652
206 1HB LEU 179 HB2 LEU 179 8.463 1.811 13.697
207 2HB LEU 179 HB1 LEU 179 8.199 1.794 15.431
208 HG LEU 179 HG LEU 179 9.950 0.221 14.788
209 1HD1 LEU 179 HD11 LEU 179 9.297 -1.460 16.200
210 2HD1 LEU 179 HD12 LEU 179 7.662 -1.527 15.543
211 3HD1 LEU 179 HD13 LEU 179 8.125 -0.210 16.620
212 1HD2 LEU 179 HD21 LEU 179 9.569 -0.532 12.659
213 2HD2 LEU 179 HD22 LEU 179 7.838 -0.746 12.927
214 3HD2 LEU 179 HD23 LEU 179 8.984 -1.911 13.589
215 H ARG 180 HN ARG 180 4.073 1.153 14.482
216 HA ARG 180 HA ARG 180 2.550 2.462 15.563
217 1HB ARG 180 HB2 ARG 180 4.806 3.542 17.253
218 2HB ARG 180 HB1 ARG 180 3.091 3.419 17.670
219 1HG ARG 180 HG2 ARG 180 5.069 1.164 17.388
220 2HG ARG 180 HG1 ARG 180 4.306 1.743 18.870
221 1HD ARG 180 HD2 ARG 180 2.820 0.104 18.514
222 2HD ARG 180 HD1 ARG 180 2.142 1.192 17.302
223 HE ARG 180 HE ARG 180 2.773 -0.319 15.729
224 1HH1 ARG 180 1HH1 ARG 180 4.871 -0.708 18.491
225 2HH1 ARG 180 2HH1 ARG 180 5.735 -2.043 17.805
226 1HH2 ARG 180 1HH2 ARG 180 3.910 -2.073 14.823
227 2HH2 ARG 180 2HH2 ARG 180 5.189 -2.818 15.723
228 1HG HSL 181 HG1 HSL 181 4.640 7.417 10.970
229 2HG HSL 181 HG2 HSL 181 4.953 6.039 9.789
230 H HSL 181 HN HSL 181 3.761 3.290 13.176
231 HA HSL 181 HA HSL 181 3.814 6.337 13.503
232 1HB HSL 181 HB1 HSL 181 5.914 6.011 12.444
233 2HB HSL 181 HB2 HSL 181 5.352 4.472 11.594
Start of MODEL 34
1 1H PHE 155 HT1 PHE 155 5.227 5.017 -8.541
2 2H PHE 155 HT2 PHE 155 4.380 3.532 -8.385
3 3H PHE 155 HT3 PHE 155 3.521 5.018 -8.373
4 HA PHE 155 HA PHE 155 3.197 4.108 -10.457
5 1HB PHE 155 HB2 PHE 155 5.441 6.132 -10.626
6 2HB PHE 155 HB1 PHE 155 4.242 5.802 -11.872
7 HD1 PHE 155 HD1 PHE 155 5.097 8.267 -9.847
8 HD2 PHE 155 HD2 PHE 155 1.742 5.720 -10.451
9 HE1 PHE 155 HE1 PHE 155 3.625 9.982 -8.876
10 HE2 PHE 155 HE2 PHE 155 0.263 7.431 -9.482
11 HZ PHE 155 HZ PHE 155 1.204 9.565 -8.693
12 H LEU 156 HN LEU 156 3.714 2.506 -11.782
13 HA LEU 156 HA LEU 156 4.867 0.873 -12.855
14 1HB LEU 156 HB2 LEU 156 6.928 3.045 -12.700
15 2HB LEU 156 HB1 LEU 156 7.293 1.500 -13.443
16 HG LEU 156 HG LEU 156 4.982 2.165 -14.718
17 1HD1 LEU 156 HD11 LEU 156 5.756 4.631 -15.425
18 2HD1 LEU 156 HD12 LEU 156 6.239 4.644 -13.729
19 3HD1 LEU 156 HD13 LEU 156 4.562 4.314 -14.167
20 1HD2 LEU 156 HD21 LEU 156 7.686 3.087 -15.654
21 2HD2 LEU 156 HD22 LEU 156 6.326 2.528 -16.626
22 3HD2 LEU 156 HD23 LEU 156 7.215 1.388 -15.615
23 H GLN 157 HN GLN 157 5.377 -0.987 -11.941
24 HA GLN 157 HA GLN 157 7.722 -1.388 -10.405
25 1HB GLN 157 HB2 GLN 157 5.310 -0.664 -8.962
26 2HB GLN 157 HB1 GLN 157 5.893 -2.249 -8.476
27 1HG GLN 157 HG2 GLN 157 7.404 0.348 -8.401
28 2HG GLN 157 HG1 GLN 157 6.840 -0.605 -7.031
29 1HE2 GLN 157 HE21 GLN 157 7.565 -3.139 -7.881
30 2HE2 GLN 157 HE22 GLN 157 9.289 -3.246 -7.926
31 H SER 158 HN SER 158 6.687 -2.548 -12.680
32 HA SER 158 HA SER 158 6.565 -4.613 -13.624
33 1HB SER 158 HB2 SER 158 7.224 -6.502 -12.467
34 2HB SER 158 HB1 SER 158 7.905 -5.236 -11.433
35 HG SER 158 HG SER 158 5.845 -7.008 -10.951
36 H ASP 159 HN ASP 159 4.630 -4.695 -10.628
37 HA ASP 159 HA ASP 159 2.457 -6.016 -11.967
38 1HB ASP 159 HB2 ASP 159 2.410 -4.711 -9.241
39 2HB ASP 159 HB1 ASP 159 1.339 -5.973 -9.843
40 H VAL 160 HN VAL 160 3.006 -2.798 -10.588
41 HA VAL 160 HA VAL 160 2.142 -0.757 -11.074
42 HB VAL 160 HB VAL 160 0.909 -2.126 -13.466
43 1HG1 VAL 160 HG11 VAL 160 0.893 0.661 -12.504
44 2HG1 VAL 160 HG12 VAL 160 -0.260 -0.194 -13.529
45 3HG1 VAL 160 HG13 VAL 160 1.236 0.436 -14.219
46 1HG2 VAL 160 HG21 VAL 160 2.875 -0.801 -14.572
47 2HG2 VAL 160 HG22 VAL 160 3.161 -2.382 -13.843
48 3HG2 VAL 160 HG23 VAL 160 3.584 -0.914 -12.961
49 H PHE 161 HN PHE 161 -0.344 -3.245 -11.807
50 HA PHE 161 HA PHE 161 -2.525 -1.674 -10.993
51 1HB PHE 161 HB2 PHE 161 -3.834 -3.566 -11.295
52 2HB PHE 161 HB1 PHE 161 -2.448 -3.928 -12.315
53 HD1 PHE 161 HD1 PHE 161 -4.502 -5.046 -9.644
54 HD2 PHE 161 HD2 PHE 161 -0.595 -5.384 -11.297
55 HE1 PHE 161 HE1 PHE 161 -4.174 -7.157 -8.425
56 HE2 PHE 161 HE2 PHE 161 -0.260 -7.497 -10.081
57 HZ PHE 161 HZ PHE 161 -2.050 -8.386 -8.643
58 H PHE 162 HN PHE 162 -0.154 -3.417 -9.230
59 HA PHE 162 HA PHE 162 -1.551 -3.795 -6.790
60 1HB PHE 162 HB2 PHE 162 0.822 -4.614 -7.816
61 2HB PHE 162 HB1 PHE 162 1.359 -3.371 -6.687
62 HD1 PHE 162 HD1 PHE 162 -0.558 -3.666 -4.495
63 HD2 PHE 162 HD2 PHE 162 1.399 -6.633 -6.835
64 HE1 PHE 162 HE1 PHE 162 -0.770 -5.264 -2.637
65 HE2 PHE 162 HE2 PHE 162 1.190 -8.238 -4.981
66 HZ PHE 162 HZ PHE 162 0.105 -7.554 -2.879
67 H LEU 163 HN LEU 163 1.040 -1.514 -7.633
68 HA LEU 163 HA LEU 163 0.644 0.169 -5.382
69 1HB LEU 163 HB2 LEU 163 2.187 0.293 -7.931
70 2HB LEU 163 HB1 LEU 163 1.939 1.790 -7.047
71 HG LEU 163 HG LEU 163 3.060 -0.614 -5.648
72 1HD1 LEU 163 HD11 LEU 163 5.236 0.959 -6.278
73 2HD1 LEU 163 HD12 LEU 163 4.325 0.890 -7.786
74 3HD1 LEU 163 HD13 LEU 163 4.832 -0.600 -6.993
75 1HD2 LEU 163 HD21 LEU 163 2.712 0.936 -4.033
76 2HD2 LEU 163 HD22 LEU 163 2.801 2.292 -5.157
77 3HD2 LEU 163 HD23 LEU 163 4.280 1.515 -4.594
78 H PHE 164 HN PHE 164 -1.173 -0.351 -8.074
79 HA PHE 164 HA PHE 164 -2.086 2.293 -8.637
80 1HB PHE 164 HB2 PHE 164 -2.241 -0.309 -9.774
81 2HB PHE 164 HB1 PHE 164 -3.888 0.281 -9.569
82 HD1 PHE 164 HD1 PHE 164 -1.792 -0.152 -12.038
83 HD2 PHE 164 HD2 PHE 164 -3.596 3.147 -10.045
84 HE1 PHE 164 HE1 PHE 164 -1.557 1.204 -14.077
85 HE2 PHE 164 HE2 PHE 164 -3.364 4.509 -12.081
86 HZ PHE 164 HZ PHE 164 -2.343 3.538 -14.101
87 H LEU 165 HN LEU 165 -3.438 -0.568 -6.997
88 HA LEU 165 HA LEU 165 -5.914 0.588 -6.330
89 1HB LEU 165 HB2 LEU 165 -4.574 -1.865 -5.846
90 2HB LEU 165 HB1 LEU 165 -5.112 -1.252 -4.287
91 HG LEU 165 HG LEU 165 -7.406 -1.169 -5.068
92 1HD1 LEU 165 HD11 LEU 165 -7.718 -2.393 -7.397
93 2HD1 LEU 165 HD12 LEU 165 -6.136 -1.675 -7.699
94 3HD1 LEU 165 HD13 LEU 165 -7.506 -0.647 -7.278
95 1HD2 LEU 165 HD21 LEU 165 -7.780 -3.370 -4.762
96 2HD2 LEU 165 HD22 LEU 165 -6.042 -3.416 -4.463
97 3HD2 LEU 165 HD23 LEU 165 -6.675 -3.846 -6.052
98 H LEU 166 HN LEU 166 -3.523 -0.317 -3.912
99 HA LEU 166 HA LEU 166 -4.310 1.921 -2.271
100 1HB LEU 166 HB2 LEU 166 -3.495 0.716 -0.500
101 2HB LEU 166 HB1 LEU 166 -3.953 -0.563 -1.616
102 HG LEU 166 HG LEU 166 -1.388 -0.328 -2.327
103 1HD1 LEU 166 HD11 LEU 166 -0.025 -0.019 -0.277
104 2HD1 LEU 166 HD12 LEU 166 -1.471 0.560 0.552
105 3HD1 LEU 166 HD13 LEU 166 -0.822 1.459 -0.817
106 1HD2 LEU 166 HD21 LEU 166 -2.882 -2.203 -1.137
107 2HD2 LEU 166 HD22 LEU 166 -1.773 -1.832 0.183
108 3HD2 LEU 166 HD23 LEU 166 -1.142 -2.363 -1.376
109 HA PRO 167 HA PRO 167 -0.810 4.134 -4.056
110 1HB PRO 167 HB2 PRO 167 -1.422 6.540 -2.912
111 2HB PRO 167 HB1 PRO 167 -2.115 5.951 -4.433
112 1HG PRO 167 HG2 PRO 167 -3.282 5.957 -1.689
113 2HG PRO 167 HG1 PRO 167 -4.072 6.240 -3.249
114 1HD PRO 167 HD2 PRO 167 -4.252 3.887 -1.892
115 2HD PRO 167 HD1 PRO 167 -4.345 4.002 -3.660
116 HA PRO 168 HA PRO 168 0.956 5.052 0.242
117 1HB PRO 168 HB2 PRO 168 -0.285 4.347 2.436
118 2HB PRO 168 HB1 PRO 168 -0.929 5.683 1.458
119 1HG PRO 168 HG2 PRO 168 -1.841 2.830 1.585
120 2HG PRO 168 HG1 PRO 168 -2.812 4.314 1.606
121 1HD PRO 168 HD2 PRO 168 -2.277 2.782 -0.648
122 2HD PRO 168 HD1 PRO 168 -2.793 4.478 -0.659
123 H ILE 169 HN ILE 169 2.374 3.427 -0.672
124 HA ILE 169 HA ILE 169 2.145 0.705 0.171
125 HB ILE 169 HB ILE 169 3.291 1.025 -1.870
126 1HG1 ILE 169 HG12 ILE 169 5.842 0.583 -0.655
127 2HG1 ILE 169 HG11 ILE 169 4.611 -0.194 0.335
128 1HG2 ILE 169 HG21 ILE 169 4.275 2.958 -2.298
129 2HG2 ILE 169 HG22 ILE 169 5.654 2.418 -1.341
130 3HG2 ILE 169 HG23 ILE 169 4.365 3.352 -0.581
131 1HD1 ILE 169 HD11 ILE 169 4.138 -1.740 -1.232
132 2HD1 ILE 169 HD12 ILE 169 5.785 -1.375 -1.746
133 3HD1 ILE 169 HD13 ILE 169 4.417 -0.630 -2.574
134 H ILE 170 HN ILE 170 5.274 2.139 0.719
135 HA ILE 170 HA ILE 170 6.603 1.767 2.596
136 HB ILE 170 HB ILE 170 4.682 3.861 3.594
137 1HG1 ILE 170 HG12 ILE 170 6.993 4.950 2.277
138 2HG1 ILE 170 HG11 ILE 170 6.154 3.866 1.173
139 1HG2 ILE 170 HG21 ILE 170 6.480 2.957 5.118
140 2HG2 ILE 170 HG22 ILE 170 6.496 4.701 4.854
141 3HG2 ILE 170 HG23 ILE 170 7.653 3.670 4.011
142 1HD1 ILE 170 HD11 ILE 170 4.695 5.464 0.749
143 2HD1 ILE 170 HD12 ILE 170 5.494 6.524 1.909
144 3HD1 ILE 170 HD13 ILE 170 4.196 5.456 2.440
145 H LEU 171 HN LEU 171 3.343 2.333 3.839
146 HA LEU 171 HA LEU 171 3.765 0.885 6.250
147 1HB LEU 171 HB2 LEU 171 1.067 1.368 5.021
148 2HB LEU 171 HB1 LEU 171 1.486 1.258 6.720
149 HG LEU 171 HG LEU 171 2.145 3.532 4.849
150 1HD1 LEU 171 HD11 LEU 171 0.365 3.391 7.277
151 2HD1 LEU 171 HD12 LEU 171 -0.180 3.460 5.600
152 3HD1 LEU 171 HD13 LEU 171 0.688 4.825 6.303
153 1HD2 LEU 171 HD21 LEU 171 3.183 4.624 6.726
154 2HD2 LEU 171 HD22 LEU 171 3.964 3.064 6.467
155 3HD2 LEU 171 HD23 LEU 171 2.802 3.263 7.779
156 H ASP 172 HN ASP 172 1.976 0.087 3.291
157 HA ASP 172 HA ASP 172 1.380 -2.575 4.100
158 1HB ASP 172 HB2 ASP 172 -0.010 -1.325 2.482
159 2HB ASP 172 HB1 ASP 172 1.331 -1.353 1.329
160 H ALA 173 HN ALA 173 4.241 -1.156 3.124
161 HA ALA 173 HA ALA 173 5.282 -3.281 1.521
162 1HB ALA 173 HB1 ALA 173 6.185 -0.689 2.462
163 2HB ALA 173 HB2 ALA 173 6.635 -1.582 1.008
164 3HB ALA 173 HB3 ALA 173 7.462 -1.904 2.532
165 H GLY 174 HN GLY 174 6.103 -2.128 4.806
166 1HA GLY 174 HA2 GLY 174 7.166 -4.808 5.395
167 2HA GLY 174 HA1 GLY 174 7.498 -3.332 6.320
168 H TYR 175 HN TYR 175 4.521 -2.712 6.073
169 HA TYR 175 HA TYR 175 2.604 -2.994 7.247
170 1HB TYR 175 HB2 TYR 175 2.690 -5.336 6.421
171 2HB TYR 175 HB1 TYR 175 3.627 -5.781 7.843
172 HD1 TYR 175 HD1 TYR 175 2.579 -6.071 9.979
173 HD2 TYR 175 HD2 TYR 175 0.316 -4.706 6.644
174 HE1 TYR 175 HE1 TYR 175 0.501 -6.481 11.229
175 HE2 TYR 175 HE2 TYR 175 -1.768 -5.111 7.886
176 HH TYR 175 HH TYR 175 -2.430 -6.738 9.892
177 H PHE 176 HN PHE 176 5.204 -4.690 9.016
178 HA PHE 176 HA PHE 176 4.321 -3.420 11.490
179 1HB PHE 176 HB2 PHE 176 4.932 -5.913 11.257
180 2HB PHE 176 HB1 PHE 176 6.613 -5.361 11.216
181 HD1 PHE 176 HD1 PHE 176 7.604 -5.919 13.208
182 HD2 PHE 176 HD2 PHE 176 3.676 -4.286 13.253
183 HE1 PHE 176 HE1 PHE 176 7.650 -5.890 15.668
184 HE2 PHE 176 HE2 PHE 176 3.714 -4.251 15.712
185 HZ PHE 176 HZ PHE 176 5.702 -5.054 16.923
186 H LEU 177 HN LEU 177 5.828 -2.128 9.155
187 HA LEU 177 HA LEU 177 8.340 -1.362 10.366
188 1HB LEU 177 HB2 LEU 177 7.014 -0.895 7.742
189 2HB LEU 177 HB1 LEU 177 8.258 0.227 8.256
190 HG LEU 177 HG LEU 177 8.582 -2.748 7.867
191 1HD1 LEU 177 HD11 LEU 177 9.701 -0.397 6.348
192 2HD1 LEU 177 HD12 LEU 177 8.446 -1.499 5.781
193 3HD1 LEU 177 HD13 LEU 177 10.083 -2.093 6.054
194 1HD2 LEU 177 HD21 LEU 177 11.084 -1.833 8.128
195 2HD2 LEU 177 HD22 LEU 177 10.139 -2.451 9.483
196 3HD2 LEU 177 HD23 LEU 177 10.254 -0.713 9.208
197 HA PRO 178 HA PRO 178 5.952 2.862 10.485
198 1HB PRO 178 HB2 PRO 178 3.121 2.118 10.379
199 2HB PRO 178 HB1 PRO 178 4.004 3.298 9.406
200 1HG PRO 178 HG2 PRO 178 3.088 0.985 8.373
201 2HG PRO 178 HG1 PRO 178 4.593 1.740 7.817
202 1HD PRO 178 HD2 PRO 178 4.212 -0.546 9.722
203 2HD PRO 178 HD1 PRO 178 5.379 -0.370 8.393
204 H LEU 179 HN LEU 179 5.333 0.011 12.172
205 HA LEU 179 HA LEU 179 3.707 1.020 14.274
206 1HB LEU 179 HB2 LEU 179 5.377 -1.417 13.857
207 2HB LEU 179 HB1 LEU 179 4.827 -1.038 15.478
208 HG LEU 179 HG LEU 179 3.291 -2.596 14.499
209 1HD1 LEU 179 HD11 LEU 179 2.430 -0.651 15.865
210 2HD1 LEU 179 HD12 LEU 179 1.252 -1.460 14.833
211 3HD1 LEU 179 HD13 LEU 179 1.945 0.085 14.338
212 1HD2 LEU 179 HD21 LEU 179 2.386 -0.796 12.349
213 2HD2 LEU 179 HD22 LEU 179 2.528 -2.553 12.378
214 3HD2 LEU 179 HD23 LEU 179 3.958 -1.557 12.107
215 H ARG 180 HN ARG 180 7.122 0.024 14.360
216 HA ARG 180 HA ARG 180 7.562 1.752 16.657
217 1HB ARG 180 HB2 ARG 180 9.750 0.688 16.814
218 2HB ARG 180 HB1 ARG 180 8.475 -0.529 16.688
219 1HG ARG 180 HG2 ARG 180 9.808 0.357 14.184
220 2HG ARG 180 HG1 ARG 180 10.720 -0.670 15.288
221 1HD ARG 180 HD2 ARG 180 8.312 -1.284 13.662
222 2HD ARG 180 HD1 ARG 180 9.732 -2.270 13.994
223 HE ARG 180 HE ARG 180 7.280 -2.299 15.416
224 1HH1 ARG 180 1HH1 ARG 180 10.728 -2.589 15.869
225 2HH1 ARG 180 2HH1 ARG 180 10.586 -3.569 17.290
226 1HH2 ARG 180 1HH2 ARG 180 7.091 -3.587 17.286
227 2HH2 ARG 180 2HH2 ARG 180 8.520 -4.137 18.093
228 1HG HSL 181 HG1 HSL 181 6.875 5.743 10.898
229 2HG HSL 181 HG2 HSL 181 5.919 4.560 11.935
230 H HSL 181 HN HSL 181 6.918 3.006 14.181
231 HA HSL 181 HA HSL 181 9.535 4.480 13.569
232 1HB HSL 181 HB1 HSL 181 8.963 4.701 11.328
233 2HB HSL 181 HB2 HSL 181 7.904 3.221 11.633
Start of MODEL 35
1 1H PHE 155 HT1 PHE 155 -17.584 0.329 -3.115
2 2H PHE 155 HT2 PHE 155 -18.754 1.583 -3.190
3 3H PHE 155 HT3 PHE 155 -19.196 0.027 -2.617
4 HA PHE 155 HA PHE 155 -18.961 1.556 -0.826
5 1HB PHE 155 HB2 PHE 155 -17.520 -0.914 -1.202
6 2HB PHE 155 HB1 PHE 155 -16.701 0.115 -0.034
7 HD1 PHE 155 HD1 PHE 155 -17.337 -0.006 2.168
8 HD2 PHE 155 HD2 PHE 155 -20.123 -1.120 -0.851
9 HE1 PHE 155 HE1 PHE 155 -18.935 -0.701 3.905
10 HE2 PHE 155 HE2 PHE 155 -21.727 -1.815 0.880
11 HZ PHE 155 HZ PHE 155 -21.134 -1.606 3.262
12 H LEU 156 HN LEU 156 -15.583 0.808 -1.507
13 HA LEU 156 HA LEU 156 -14.827 3.464 -2.113
14 1HB LEU 156 HB2 LEU 156 -14.701 2.500 0.697
15 2HB LEU 156 HB1 LEU 156 -13.364 3.473 0.111
16 HG LEU 156 HG LEU 156 -16.221 4.253 0.552
17 1HD1 LEU 156 HD11 LEU 156 -14.068 4.552 2.094
18 2HD1 LEU 156 HD12 LEU 156 -15.385 5.725 2.049
19 3HD1 LEU 156 HD13 LEU 156 -13.917 6.013 1.116
20 1HD2 LEU 156 HD21 LEU 156 -15.706 6.386 -0.648
21 2HD2 LEU 156 HD22 LEU 156 -15.876 4.975 -1.694
22 3HD2 LEU 156 HD23 LEU 156 -14.272 5.598 -1.308
23 H GLN 157 HN GLN 157 -13.262 0.936 -0.159
24 HA GLN 157 HA GLN 157 -11.530 -0.479 -0.620
25 1HB GLN 157 HB2 GLN 157 -12.713 -0.393 -3.016
26 2HB GLN 157 HB1 GLN 157 -11.218 0.432 -3.434
27 1HG GLN 157 HG2 GLN 157 -11.138 -1.981 -3.878
28 2HG GLN 157 HG1 GLN 157 -9.916 -1.460 -2.719
29 1HE2 GLN 157 HE21 GLN 157 -9.687 -3.483 -1.814
30 2HE2 GLN 157 HE22 GLN 157 -10.903 -4.207 -0.821
31 H SER 158 HN SER 158 -10.857 1.637 0.698
32 HA SER 158 HA SER 158 -9.147 3.014 1.274
33 1HB SER 158 HB2 SER 158 -7.671 1.165 0.899
34 2HB SER 158 HB1 SER 158 -7.751 1.384 -0.858
35 HG SER 158 HG SER 158 -6.536 3.090 1.057
36 H ASP 159 HN ASP 159 -10.857 4.430 0.042
37 HA ASP 159 HA ASP 159 -11.095 6.445 -1.001
38 1HB ASP 159 HB2 ASP 159 -8.504 6.538 -0.492
39 2HB ASP 159 HB1 ASP 159 -8.377 6.326 -2.235
40 H VAL 160 HN VAL 160 -9.019 4.406 -3.065
41 HA VAL 160 HA VAL 160 -9.493 3.375 -5.062
42 HB VAL 160 HB VAL 160 -12.060 3.847 -4.222
43 1HG1 VAL 160 HG11 VAL 160 -11.824 5.130 -6.942
44 2HG1 VAL 160 HG12 VAL 160 -12.150 5.991 -5.440
45 3HG1 VAL 160 HG13 VAL 160 -13.313 4.817 -6.051
46 1HG2 VAL 160 HG21 VAL 160 -12.691 2.503 -6.280
47 2HG2 VAL 160 HG22 VAL 160 -11.457 1.809 -5.228
48 3HG2 VAL 160 HG23 VAL 160 -10.990 2.598 -6.735
49 H PHE 161 HN PHE 161 -10.451 6.777 -4.834
50 HA PHE 161 HA PHE 161 -9.636 7.416 -7.499
51 1HB PHE 161 HB2 PHE 161 -10.877 8.807 -5.242
52 2HB PHE 161 HB1 PHE 161 -9.754 9.817 -6.147
53 HD1 PHE 161 HD1 PHE 161 -11.076 11.269 -7.369
54 HD2 PHE 161 HD2 PHE 161 -12.022 7.120 -7.332
55 HE1 PHE 161 HE1 PHE 161 -12.800 11.651 -9.081
56 HE2 PHE 161 HE2 PHE 161 -13.749 7.494 -9.044
57 HZ PHE 161 HZ PHE 161 -14.138 9.762 -9.922
58 H PHE 162 HN PHE 162 -7.777 6.438 -5.117
59 HA PHE 162 HA PHE 162 -5.429 7.715 -6.113
60 1HB PHE 162 HB2 PHE 162 -6.621 8.577 -3.519
61 2HB PHE 162 HB1 PHE 162 -4.865 8.400 -3.603
62 HD1 PHE 162 HD1 PHE 162 -7.143 10.814 -3.561
63 HD2 PHE 162 HD2 PHE 162 -4.148 9.343 -6.204
64 HE1 PHE 162 HE1 PHE 162 -6.969 13.039 -4.599
65 HE2 PHE 162 HE2 PHE 162 -3.968 11.565 -7.245
66 HZ PHE 162 HZ PHE 162 -5.381 13.416 -6.442
67 H LEU 163 HN LEU 163 -6.883 5.079 -5.167
68 HA LEU 163 HA LEU 163 -5.103 3.884 -3.306
69 1HB LEU 163 HB2 LEU 163 -7.273 2.941 -3.474
70 2HB LEU 163 HB1 LEU 163 -7.176 2.832 -5.218
71 HG LEU 163 HG LEU 163 -5.137 1.183 -4.469
72 1HD1 LEU 163 HD11 LEU 163 -6.154 1.594 -2.077
73 2HD1 LEU 163 HD12 LEU 163 -5.572 0.003 -2.566
74 3HD1 LEU 163 HD13 LEU 163 -7.299 0.362 -2.605
75 1HD2 LEU 163 HD21 LEU 163 -7.818 -0.050 -4.594
76 2HD2 LEU 163 HD22 LEU 163 -6.358 -0.408 -5.516
77 3HD2 LEU 163 HD23 LEU 163 -7.356 0.979 -5.951
78 H PHE 164 HN PHE 164 -5.388 4.052 -6.798
79 HA PHE 164 HA PHE 164 -4.017 3.361 -8.497
80 1HB PHE 164 HB2 PHE 164 -2.646 5.083 -6.899
81 2HB PHE 164 HB1 PHE 164 -1.569 3.690 -6.875
82 HD1 PHE 164 HD1 PHE 164 0.146 3.803 -8.384
83 HD2 PHE 164 HD2 PHE 164 -3.626 5.470 -9.436
84 HE1 PHE 164 HE1 PHE 164 1.053 4.467 -10.573
85 HE2 PHE 164 HE2 PHE 164 -2.725 6.137 -11.626
86 HZ PHE 164 HZ PHE 164 -0.383 5.635 -12.197
87 H LEU 165 HN LEU 165 -4.917 1.343 -6.590
88 HA LEU 165 HA LEU 165 -4.722 -0.962 -6.650
89 1HB LEU 165 HB2 LEU 165 -2.814 -0.394 -8.482
90 2HB LEU 165 HB1 LEU 165 -1.818 -1.025 -7.179
91 HG LEU 165 HG LEU 165 -2.463 -2.734 -8.861
92 1HD1 LEU 165 HD11 LEU 165 -2.492 -4.353 -7.296
93 2HD1 LEU 165 HD12 LEU 165 -3.855 -3.644 -6.430
94 3HD1 LEU 165 HD13 LEU 165 -2.229 -3.002 -6.194
95 1HD2 LEU 165 HD21 LEU 165 -5.201 -2.913 -7.785
96 2HD2 LEU 165 HD22 LEU 165 -4.593 -3.231 -9.410
97 3HD2 LEU 165 HD23 LEU 165 -4.890 -1.573 -8.888
98 H LEU 166 HN LEU 166 -2.323 1.132 -5.201
99 HA LEU 166 HA LEU 166 -2.606 -0.197 -2.687
100 1HB LEU 166 HB2 LEU 166 -0.647 -1.162 -4.467
101 2HB LEU 166 HB1 LEU 166 0.217 -0.269 -3.224
102 HG LEU 166 HG LEU 166 -1.721 -1.917 -1.934
103 1HD1 LEU 166 HD11 LEU 166 -1.190 -3.089 -4.303
104 2HD1 LEU 166 HD12 LEU 166 -1.557 -3.976 -2.824
105 3HD1 LEU 166 HD13 LEU 166 0.120 -3.745 -3.321
106 1HD2 LEU 166 HD21 LEU 166 0.666 -1.004 -1.311
107 2HD2 LEU 166 HD22 LEU 166 1.186 -2.559 -1.961
108 3HD2 LEU 166 HD23 LEU 166 0.053 -2.502 -0.610
109 HA PRO 167 HA PRO 167 -1.588 4.306 -2.468
110 1HB PRO 167 HB2 PRO 167 -3.022 4.551 -0.076
111 2HB PRO 167 HB1 PRO 167 -3.574 5.015 -1.693
112 1HG PRO 167 HG2 PRO 167 -4.270 2.661 -0.073
113 2HG PRO 167 HG1 PRO 167 -5.161 3.427 -1.393
114 1HD PRO 167 HD2 PRO 167 -3.801 1.031 -1.583
115 2HD PRO 167 HD1 PRO 167 -4.234 2.067 -2.953
116 HA PRO 168 HA PRO 168 0.543 3.359 1.642
117 1HB PRO 168 HB2 PRO 168 0.089 1.164 3.014
118 2HB PRO 168 HB1 PRO 168 -1.181 2.399 2.892
119 1HG PRO 168 HG2 PRO 168 -0.907 -0.187 1.406
120 2HG PRO 168 HG1 PRO 168 -2.356 0.543 2.122
121 1HD PRO 168 HD2 PRO 168 -1.583 0.736 -0.559
122 2HD PRO 168 HD1 PRO 168 -2.764 1.769 0.261
123 H ILE 169 HN ILE 169 2.265 3.163 -0.004
124 HA ILE 169 HA ILE 169 3.249 0.585 -0.733
125 HB ILE 169 HB ILE 169 5.168 1.787 -1.670
126 1HG1 ILE 169 HG12 ILE 169 3.842 4.188 -0.413
127 2HG1 ILE 169 HG11 ILE 169 5.420 3.528 -0.012
128 1HG2 ILE 169 HG21 ILE 169 3.938 3.065 -3.352
129 2HG2 ILE 169 HG22 ILE 169 2.509 3.053 -2.318
130 3HG2 ILE 169 HG23 ILE 169 3.127 1.542 -2.986
131 1HD1 ILE 169 HD11 ILE 169 4.617 4.890 -2.566
132 2HD1 ILE 169 HD12 ILE 169 6.166 4.085 -2.314
133 3HD1 ILE 169 HD13 ILE 169 5.729 5.486 -1.334
134 H ILE 170 HN ILE 170 4.254 3.065 1.571
135 HA ILE 170 HA ILE 170 6.484 1.542 2.542
136 HB ILE 170 HB ILE 170 5.214 3.968 3.812
137 1HG1 ILE 170 HG12 ILE 170 7.542 4.786 2.555
138 2HG1 ILE 170 HG11 ILE 170 6.829 3.675 1.391
139 1HG2 ILE 170 HG21 ILE 170 7.916 2.671 4.116
140 2HG2 ILE 170 HG22 ILE 170 6.659 2.838 5.342
141 3HG2 ILE 170 HG23 ILE 170 7.509 4.265 4.750
142 1HD1 ILE 170 HD11 ILE 170 5.393 6.011 2.625
143 2HD1 ILE 170 HD12 ILE 170 4.800 4.959 1.339
144 3HD1 ILE 170 HD13 ILE 170 6.174 6.024 1.045
145 H LEU 171 HN LEU 171 3.238 2.342 3.742
146 HA LEU 171 HA LEU 171 3.513 1.069 6.248
147 1HB LEU 171 HB2 LEU 171 1.118 1.767 4.560
148 2HB LEU 171 HB1 LEU 171 0.954 0.971 6.111
149 HG LEU 171 HG LEU 171 0.619 3.458 6.141
150 1HD1 LEU 171 HD11 LEU 171 2.923 3.086 7.906
151 2HD1 LEU 171 HD12 LEU 171 1.709 1.811 8.008
152 3HD1 LEU 171 HD13 LEU 171 1.250 3.490 8.288
153 1HD2 LEU 171 HD21 LEU 171 2.423 3.978 4.521
154 2HD2 LEU 171 HD22 LEU 171 3.607 3.541 5.754
155 3HD2 LEU 171 HD23 LEU 171 2.528 4.912 6.013
156 H ASP 172 HN ASP 172 1.810 -0.006 3.324
157 HA ASP 172 HA ASP 172 1.568 -2.698 4.240
158 1HB ASP 172 HB2 ASP 172 0.038 -1.429 2.595
159 2HB ASP 172 HB1 ASP 172 1.254 -1.834 1.374
160 H ALA 173 HN ALA 173 4.277 -1.126 3.383
161 HA ALA 173 HA ALA 173 5.440 -2.903 1.488
162 1HB ALA 173 HB1 ALA 173 6.964 -1.287 1.401
163 2HB ALA 173 HB2 ALA 173 7.457 -1.642 3.057
164 3HB ALA 173 HB3 ALA 173 6.173 -0.475 2.750
165 H GLY 174 HN GLY 174 5.842 -2.417 4.973
166 1HA GLY 174 HA2 GLY 174 6.750 -5.223 5.190
167 2HA GLY 174 HA1 GLY 174 7.423 -3.916 6.182
168 H TYR 175 HN TYR 175 4.320 -3.065 5.939
169 HA TYR 175 HA TYR 175 2.459 -3.202 7.212
170 1HB TYR 175 HB2 TYR 175 2.300 -5.539 6.664
171 2HB TYR 175 HB1 TYR 175 3.542 -5.957 7.836
172 HD1 TYR 175 HD1 TYR 175 0.079 -4.667 7.510
173 HD2 TYR 175 HD2 TYR 175 2.984 -6.425 10.074
174 HE1 TYR 175 HE1 TYR 175 -1.657 -5.045 9.210
175 HE2 TYR 175 HE2 TYR 175 1.256 -6.808 11.780
176 HH TYR 175 HH TYR 175 -1.453 -7.103 11.622
177 H PHE 176 HN PHE 176 5.202 -4.628 9.020
178 HA PHE 176 HA PHE 176 4.328 -3.233 11.422
179 1HB PHE 176 HB2 PHE 176 4.923 -5.443 11.918
180 2HB PHE 176 HB1 PHE 176 6.330 -5.404 10.850
181 HD1 PHE 176 HD1 PHE 176 5.017 -3.924 14.006
182 HD2 PHE 176 HD2 PHE 176 8.432 -5.068 11.740
183 HE1 PHE 176 HE1 PHE 176 6.459 -3.427 15.936
184 HE2 PHE 176 HE2 PHE 176 9.881 -4.574 13.666
185 HZ PHE 176 HZ PHE 176 8.894 -3.752 15.768
186 H LEU 177 HN LEU 177 6.295 -2.581 8.801
187 HA LEU 177 HA LEU 177 8.571 -1.407 9.875
188 1HB LEU 177 HB2 LEU 177 6.964 -0.808 7.407
189 2HB LEU 177 HB1 LEU 177 8.403 0.113 7.803
190 HG LEU 177 HG LEU 177 8.446 -2.886 7.541
191 1HD1 LEU 177 HD11 LEU 177 9.369 -1.102 5.343
192 2HD1 LEU 177 HD12 LEU 177 7.652 -1.487 5.469
193 3HD1 LEU 177 HD13 LEU 177 8.836 -2.781 5.286
194 1HD2 LEU 177 HD21 LEU 177 10.751 -2.693 7.520
195 2HD2 LEU 177 HD22 LEU 177 10.284 -1.465 8.695
196 3HD2 LEU 177 HD23 LEU 177 10.709 -0.995 7.050
197 HA PRO 178 HA PRO 178 5.805 2.716 10.062
198 1HB PRO 178 HB2 PRO 178 3.338 1.361 11.022
199 2HB PRO 178 HB1 PRO 178 3.515 2.753 9.949
200 1HG PRO 178 HG2 PRO 178 2.834 0.379 8.973
201 2HG PRO 178 HG1 PRO 178 3.957 1.433 8.094
202 1HD PRO 178 HD2 PRO 178 4.534 -0.988 9.749
203 2HD PRO 178 HD1 PRO 178 5.268 -0.466 8.219
204 H LEU 179 HN LEU 179 7.472 2.485 11.780
205 HA LEU 179 HA LEU 179 6.578 1.600 14.384
206 1HB LEU 179 HB2 LEU 179 9.110 3.051 13.612
207 2HB LEU 179 HB1 LEU 179 8.799 2.252 15.142
208 HG LEU 179 HG LEU 179 8.418 0.371 13.011
209 1HD1 LEU 179 HD11 LEU 179 10.774 0.290 12.225
210 2HD1 LEU 179 HD12 LEU 179 11.034 1.864 12.976
211 3HD1 LEU 179 HD13 LEU 179 9.878 1.698 11.654
212 1HD2 LEU 179 HD21 LEU 179 9.225 0.312 15.577
213 2HD2 LEU 179 HD22 LEU 179 10.783 0.189 14.759
214 3HD2 LEU 179 HD23 LEU 179 9.517 -0.994 14.429
215 H ARG 180 HN ARG 180 8.024 4.673 13.315
216 HA ARG 180 HA ARG 180 6.541 6.084 15.379
217 1HB ARG 180 HB2 ARG 180 7.899 8.007 14.813
218 2HB ARG 180 HB1 ARG 180 8.938 6.590 14.997
219 1HG ARG 180 HG2 ARG 180 7.961 7.286 12.271
220 2HG ARG 180 HG1 ARG 180 9.223 8.283 12.992
221 1HD ARG 180 HD2 ARG 180 9.303 5.437 12.125
222 2HD ARG 180 HD1 ARG 180 10.494 6.716 11.909
223 HE ARG 180 HE ARG 180 10.386 4.835 14.033
224 1HH1 ARG 180 1HH1 ARG 180 11.210 8.149 13.310
225 2HH1 ARG 180 2HH1 ARG 180 12.351 8.279 14.606
226 1HH2 ARG 180 1HH2 ARG 180 11.886 5.006 15.739
227 2HH2 ARG 180 2HH2 ARG 180 12.736 6.495 15.986
228 1HG HSL 181 HG1 HSL 181 1.625 4.168 10.861
229 2HG HSL 181 HG2 HSL 181 2.738 3.455 12.141
230 H HSL 181 HN HSL 181 4.867 4.925 13.585
231 HA HSL 181 HA HSL 181 3.831 7.279 11.919
232 1HB HSL 181 HB1 HSL 181 3.163 5.848 10.213
233 2HB HSL 181 HB2 HSL 181 4.410 4.680 10.915
Start of MODEL 36
1 1H PHE 155 HT1 PHE 155 2.301 -1.311 -13.143
2 2H PHE 155 HT2 PHE 155 1.748 0.088 -12.317
3 3H PHE 155 HT3 PHE 155 0.899 -0.491 -13.691
4 HA PHE 155 HA PHE 155 0.110 -2.326 -12.597
5 1HB PHE 155 HB2 PHE 155 0.938 -2.978 -10.370
6 2HB PHE 155 HB1 PHE 155 2.239 -2.948 -11.555
7 HD1 PHE 155 HD1 PHE 155 3.658 -0.791 -11.655
8 HD2 PHE 155 HD2 PHE 155 1.172 -1.851 -8.366
9 HE1 PHE 155 HE1 PHE 155 4.954 0.707 -10.195
10 HE2 PHE 155 HE2 PHE 155 2.463 -0.353 -6.903
11 HZ PHE 155 HZ PHE 155 4.357 0.928 -7.817
12 H LEU 156 HN LEU 156 -1.473 -2.399 -10.821
13 HA LEU 156 HA LEU 156 -2.019 -0.029 -9.320
14 1HB LEU 156 HB2 LEU 156 -3.881 -0.829 -11.557
15 2HB LEU 156 HB1 LEU 156 -4.263 0.345 -10.313
16 HG LEU 156 HG LEU 156 -2.060 0.633 -12.358
17 1HD1 LEU 156 HD11 LEU 156 -3.639 2.566 -13.051
18 2HD1 LEU 156 HD12 LEU 156 -4.877 1.614 -12.231
19 3HD1 LEU 156 HD13 LEU 156 -3.988 0.923 -13.589
20 1HD2 LEU 156 HD21 LEU 156 -2.274 1.824 -9.872
21 2HD2 LEU 156 HD22 LEU 156 -2.956 3.021 -10.973
22 3HD2 LEU 156 HD23 LEU 156 -1.323 2.411 -11.235
23 H GLN 157 HN GLN 157 -3.092 -0.547 -7.505
24 HA GLN 157 HA GLN 157 -5.072 -2.562 -7.329
25 1HB GLN 157 HB2 GLN 157 -2.655 -3.719 -7.452
26 2HB GLN 157 HB1 GLN 157 -2.725 -3.406 -5.723
27 1HG GLN 157 HG2 GLN 157 -4.268 -4.990 -5.366
28 2HG GLN 157 HG1 GLN 157 -5.147 -4.612 -6.846
29 1HE2 GLN 157 HE21 GLN 157 -4.043 -5.304 -8.884
30 2HE2 GLN 157 HE22 GLN 157 -3.249 -6.838 -8.871
31 H SER 158 HN SER 158 -2.762 -0.471 -5.740
32 HA SER 158 HA SER 158 -3.962 -0.596 -3.159
33 1HB SER 158 HB2 SER 158 -1.859 1.085 -4.463
34 2HB SER 158 HB1 SER 158 -2.595 1.665 -2.959
35 HG SER 158 HG SER 158 -0.855 0.429 -2.387
36 H ASP 159 HN ASP 159 -6.126 -0.321 -4.375
37 HA ASP 159 HA ASP 159 -8.070 0.876 -4.362
38 1HB ASP 159 HB2 ASP 159 -6.383 2.459 -2.723
39 2HB ASP 159 HB1 ASP 159 -7.173 3.556 -3.852
40 H VAL 160 HN VAL 160 -5.528 3.110 -5.422
41 HA VAL 160 HA VAL 160 -5.099 4.107 -7.418
42 HB VAL 160 HB VAL 160 -6.097 1.634 -8.168
43 1HG1 VAL 160 HG11 VAL 160 -8.282 2.609 -8.703
44 2HG1 VAL 160 HG12 VAL 160 -7.466 2.004 -10.143
45 3HG1 VAL 160 HG13 VAL 160 -7.504 3.736 -9.813
46 1HG2 VAL 160 HG21 VAL 160 -4.607 3.838 -9.454
47 2HG2 VAL 160 HG22 VAL 160 -5.231 2.575 -10.514
48 3HG2 VAL 160 HG23 VAL 160 -4.148 2.155 -9.188
49 H PHE 161 HN PHE 161 -8.565 3.512 -6.936
50 HA PHE 161 HA PHE 161 -9.404 5.825 -8.350
51 1HB PHE 161 HB2 PHE 161 -11.618 5.344 -7.189
52 2HB PHE 161 HB1 PHE 161 -10.981 4.072 -8.225
53 HD1 PHE 161 HD1 PHE 161 -10.999 5.159 -4.664
54 HD2 PHE 161 HD2 PHE 161 -10.862 1.917 -7.416
55 HE1 PHE 161 HE1 PHE 161 -11.159 3.569 -2.793
56 HE2 PHE 161 HE2 PHE 161 -11.022 0.320 -5.550
57 HZ PHE 161 HZ PHE 161 -11.172 1.147 -3.234
58 H PHE 162 HN PHE 162 -7.856 5.537 -5.436
59 HA PHE 162 HA PHE 162 -8.370 8.259 -4.766
60 1HB PHE 162 HB2 PHE 162 -9.591 6.078 -3.115
61 2HB PHE 162 HB1 PHE 162 -9.060 7.583 -2.359
62 HD1 PHE 162 HD1 PHE 162 -11.903 6.131 -3.068
63 HD2 PHE 162 HD2 PHE 162 -9.773 9.584 -4.354
64 HE1 PHE 162 HE1 PHE 162 -14.025 7.200 -3.700
65 HE2 PHE 162 HE2 PHE 162 -11.892 10.659 -4.989
66 HZ PHE 162 HZ PHE 162 -14.023 9.467 -4.661
67 H LEU 163 HN LEU 163 -6.218 6.039 -5.158
68 HA LEU 163 HA LEU 163 -4.735 6.002 -2.719
69 1HB LEU 163 HB2 LEU 163 -4.496 4.412 -4.699
70 2HB LEU 163 HB1 LEU 163 -3.613 5.697 -5.499
71 HG LEU 163 HG LEU 163 -1.903 5.643 -3.762
72 1HD1 LEU 163 HD11 LEU 163 -2.141 3.476 -2.248
73 2HD1 LEU 163 HD12 LEU 163 -3.856 3.833 -2.461
74 3HD1 LEU 163 HD13 LEU 163 -2.784 5.043 -1.756
75 1HD2 LEU 163 HD21 LEU 163 -1.621 4.189 -5.687
76 2HD2 LEU 163 HD22 LEU 163 -2.542 2.917 -4.883
77 3HD2 LEU 163 HD23 LEU 163 -0.980 3.419 -4.235
78 H PHE 164 HN PHE 164 -5.525 8.380 -4.841
79 HA PHE 164 HA PHE 164 -3.114 9.898 -4.957
80 1HB PHE 164 HB2 PHE 164 -4.825 10.107 -6.670
81 2HB PHE 164 HB1 PHE 164 -6.008 10.616 -5.467
82 HD1 PHE 164 HD1 PHE 164 -2.574 11.623 -6.561
83 HD2 PHE 164 HD2 PHE 164 -6.495 12.851 -5.451
84 HE1 PHE 164 HE1 PHE 164 -1.944 13.971 -6.944
85 HE2 PHE 164 HE2 PHE 164 -5.873 15.201 -5.834
86 HZ PHE 164 HZ PHE 164 -3.595 15.763 -6.582
87 H LEU 165 HN LEU 165 -5.615 9.535 -2.598
88 HA LEU 165 HA LEU 165 -5.507 12.080 -1.383
89 1HB LEU 165 HB2 LEU 165 -5.924 9.543 0.174
90 2HB LEU 165 HB1 LEU 165 -6.599 11.133 0.474
91 HG LEU 165 HG LEU 165 -7.379 9.756 -2.053
92 1HD1 LEU 165 HD11 LEU 165 -9.280 8.717 -0.738
93 2HD1 LEU 165 HD12 LEU 165 -8.299 8.990 0.702
94 3HD1 LEU 165 HD13 LEU 165 -7.702 7.943 -0.587
95 1HD2 LEU 165 HD21 LEU 165 -9.292 11.061 -1.891
96 2HD2 LEU 165 HD22 LEU 165 -8.035 12.120 -1.254
97 3HD2 LEU 165 HD23 LEU 165 -9.118 11.275 -0.149
98 H LEU 166 HN LEU 166 -3.860 9.045 -0.610
99 HA LEU 166 HA LEU 166 -1.511 10.434 0.279
100 1HB LEU 166 HB2 LEU 166 -2.626 10.759 2.289
101 2HB LEU 166 HB1 LEU 166 -3.509 9.250 2.161
102 HG LEU 166 HG LEU 166 -1.682 7.988 2.964
103 1HD1 LEU 166 HD11 LEU 166 0.515 9.429 3.445
104 2HD1 LEU 166 HD12 LEU 166 -0.078 10.285 2.022
105 3HD1 LEU 166 HD13 LEU 166 0.254 8.555 1.936
106 1HD2 LEU 166 HD21 LEU 166 -2.703 9.099 4.781
107 2HD2 LEU 166 HD22 LEU 166 -1.874 10.612 4.418
108 3HD2 LEU 166 HD23 LEU 166 -0.964 9.235 5.037
109 HA PRO 167 HA PRO 167 -0.981 6.192 -1.549
110 1HB PRO 167 HB2 PRO 167 1.290 6.876 -2.920
111 2HB PRO 167 HB1 PRO 167 -0.352 6.979 -3.584
112 1HG PRO 167 HG2 PRO 167 1.365 9.138 -2.421
113 2HG PRO 167 HG1 PRO 167 0.290 9.197 -3.830
114 1HD PRO 167 HD2 PRO 167 -0.418 10.231 -1.441
115 2HD PRO 167 HD1 PRO 167 -1.602 9.483 -2.532
116 HA PRO 168 HA PRO 168 2.095 5.661 1.714
117 1HB PRO 168 HB2 PRO 168 1.349 3.215 2.465
118 2HB PRO 168 HB1 PRO 168 0.336 4.625 2.841
119 1HG PRO 168 HG2 PRO 168 0.045 2.618 0.634
120 2HG PRO 168 HG1 PRO 168 -1.201 3.287 1.704
121 1HD PRO 168 HD2 PRO 168 -0.693 4.174 -0.837
122 2HD PRO 168 HD1 PRO 168 -1.439 5.165 0.429
123 H ILE 169 HN ILE 169 3.225 3.324 2.208
124 HA ILE 169 HA ILE 169 4.050 1.785 -0.022
125 HB ILE 169 HB ILE 169 5.227 3.983 -0.477
126 1HG1 ILE 169 HG12 ILE 169 7.150 1.715 0.011
127 2HG1 ILE 169 HG11 ILE 169 5.939 1.658 -1.267
128 1HG2 ILE 169 HG21 ILE 169 7.201 4.534 0.825
129 2HG2 ILE 169 HG22 ILE 169 6.893 3.176 1.910
130 3HG2 ILE 169 HG23 ILE 169 5.770 4.535 1.856
131 1HD1 ILE 169 HD11 ILE 169 6.991 3.952 -1.945
132 2HD1 ILE 169 HD12 ILE 169 7.758 2.433 -2.410
133 3HD1 ILE 169 HD13 ILE 169 8.374 3.347 -1.032
134 H ILE 170 HN ILE 170 5.020 3.126 3.039
135 HA ILE 170 HA ILE 170 6.609 0.981 3.922
136 HB ILE 170 HB ILE 170 6.599 2.117 6.062
137 1HG1 ILE 170 HG12 ILE 170 4.380 3.646 4.769
138 2HG1 ILE 170 HG11 ILE 170 4.408 2.880 6.349
139 1HG2 ILE 170 HG21 ILE 170 6.843 4.141 3.856
140 2HG2 ILE 170 HG22 ILE 170 8.027 2.865 4.138
141 3HG2 ILE 170 HG23 ILE 170 7.736 4.087 5.376
142 1HD1 ILE 170 HD11 ILE 170 5.543 5.501 5.497
143 2HD1 ILE 170 HD12 ILE 170 6.219 4.656 6.891
144 3HD1 ILE 170 HD13 ILE 170 4.516 5.117 6.878
145 H LEU 171 HN LEU 171 3.279 1.972 4.609
146 HA LEU 171 HA LEU 171 2.747 -0.026 6.535
147 1HB LEU 171 HB2 LEU 171 0.737 1.184 4.636
148 2HB LEU 171 HB1 LEU 171 0.420 0.480 6.210
149 HG LEU 171 HG LEU 171 2.184 2.891 5.981
150 1HD1 LEU 171 HD11 LEU 171 -0.781 3.112 6.358
151 2HD1 LEU 171 HD12 LEU 171 -0.048 3.196 4.757
152 3HD1 LEU 171 HD13 LEU 171 0.390 4.378 5.990
153 1HD2 LEU 171 HD21 LEU 171 0.259 2.549 8.174
154 2HD2 LEU 171 HD22 LEU 171 1.959 3.016 8.214
155 3HD2 LEU 171 HD23 LEU 171 1.515 1.315 8.080
156 H ASP 172 HN ASP 172 2.066 0.159 3.069
157 HA ASP 172 HA ASP 172 1.220 -2.573 2.898
158 1HB ASP 172 HB2 ASP 172 0.827 -0.385 1.318
159 2HB ASP 172 HB1 ASP 172 2.093 -1.229 0.414
160 H ALA 173 HN ALA 173 4.217 -1.113 3.217
161 HA ALA 173 HA ALA 173 5.752 -2.798 1.504
162 1HB ALA 173 HB1 ALA 173 7.592 -1.952 3.248
163 2HB ALA 173 HB2 ALA 173 6.341 -0.750 3.536
164 3HB ALA 173 HB3 ALA 173 7.000 -0.960 1.917
165 H GLY 174 HN GLY 174 6.073 -2.498 5.014
166 1HA GLY 174 HA2 GLY 174 6.252 -5.447 5.186
167 2HA GLY 174 HA1 GLY 174 7.164 -4.334 6.224
168 H TYR 175 HN TYR 175 4.490 -2.697 6.140
169 HA TYR 175 HA TYR 175 2.552 -2.514 7.316
170 1HB TYR 175 HB2 TYR 175 2.227 -4.952 6.667
171 2HB TYR 175 HB1 TYR 175 2.879 -5.363 8.251
172 HD1 TYR 175 HD1 TYR 175 1.553 -5.161 10.217
173 HD2 TYR 175 HD2 TYR 175 0.086 -3.697 6.502
174 HE1 TYR 175 HE1 TYR 175 -0.682 -4.903 11.209
175 HE2 TYR 175 HE2 TYR 175 -2.153 -3.433 7.484
176 HH TYR 175 HH TYR 175 -3.312 -4.811 9.819
177 H PHE 176 HN PHE 176 5.129 -4.299 9.017
178 HA PHE 176 HA PHE 176 4.383 -2.964 11.506
179 1HB PHE 176 HB2 PHE 176 5.172 -5.522 11.052
180 2HB PHE 176 HB1 PHE 176 6.716 -4.778 11.492
181 HD1 PHE 176 HD1 PHE 176 7.226 -5.393 13.646
182 HD2 PHE 176 HD2 PHE 176 3.239 -4.226 12.724
183 HE1 PHE 176 HE1 PHE 176 6.630 -5.566 16.027
184 HE2 PHE 176 HE2 PHE 176 2.635 -4.396 15.104
185 HZ PHE 176 HZ PHE 176 4.331 -5.066 16.759
186 H LEU 177 HN LEU 177 6.429 -2.425 8.914
187 HA LEU 177 HA LEU 177 8.693 -1.374 10.296
188 1HB LEU 177 HB2 LEU 177 7.864 -0.687 7.489
189 2HB LEU 177 HB1 LEU 177 9.479 -0.673 8.173
190 HG LEU 177 HG LEU 177 7.818 -3.134 7.636
191 1HD1 LEU 177 HD11 LEU 177 10.361 -2.271 6.285
192 2HD1 LEU 177 HD12 LEU 177 8.760 -1.898 5.649
193 3HD1 LEU 177 HD13 LEU 177 9.269 -3.577 5.824
194 1HD2 LEU 177 HD21 LEU 177 9.390 -3.195 9.624
195 2HD2 LEU 177 HD22 LEU 177 10.706 -3.022 8.462
196 3HD2 LEU 177 HD23 LEU 177 9.639 -4.425 8.385
197 HA PRO 178 HA PRO 178 6.273 2.800 9.094
198 1HB PRO 178 HB2 PRO 178 3.642 1.843 10.091
199 2HB PRO 178 HB1 PRO 178 4.011 2.909 8.732
200 1HG PRO 178 HG2 PRO 178 3.258 0.380 8.341
201 2HG PRO 178 HG1 PRO 178 4.477 1.149 7.307
202 1HD PRO 178 HD2 PRO 178 4.826 -0.837 9.505
203 2HD PRO 178 HD1 PRO 178 5.722 -0.668 7.981
204 H LEU 179 HN LEU 179 4.302 3.802 10.882
205 HA LEU 179 HA LEU 179 3.948 4.474 13.036
206 1HB LEU 179 HB2 LEU 179 4.852 1.881 13.394
207 2HB LEU 179 HB1 LEU 179 5.952 2.826 14.377
208 HG LEU 179 HG LEU 179 4.005 3.817 15.553
209 1HD1 LEU 179 HD11 LEU 179 2.116 3.737 14.321
210 2HD1 LEU 179 HD12 LEU 179 1.900 2.201 15.159
211 3HD1 LEU 179 HD13 LEU 179 2.565 2.229 13.526
212 1HD2 LEU 179 HD21 LEU 179 5.250 1.638 16.194
213 2HD2 LEU 179 HD22 LEU 179 3.755 0.840 15.706
214 3HD2 LEU 179 HD23 LEU 179 3.735 2.033 17.005
215 H ARG 180 HN ARG 180 5.154 6.254 11.885
216 HA ARG 180 HA ARG 180 6.642 7.969 11.960
217 1HB ARG 180 HB2 ARG 180 7.193 6.757 14.674
218 2HB ARG 180 HB1 ARG 180 7.927 8.264 14.115
219 1HG ARG 180 HG2 ARG 180 6.158 9.370 14.843
220 2HG ARG 180 HG1 ARG 180 5.151 8.499 13.685
221 1HD ARG 180 HD2 ARG 180 5.813 6.956 16.080
222 2HD ARG 180 HD1 ARG 180 4.878 8.414 16.408
223 HE ARG 180 HE ARG 180 3.902 6.026 15.281
224 1HH1 ARG 180 1HH1 ARG 180 3.641 9.488 14.915
225 2HH1 ARG 180 2HH1 ARG 180 2.037 9.423 14.266
226 1HH2 ARG 180 1HH2 ARG 180 1.793 5.940 14.427
227 2HH2 ARG 180 2HH2 ARG 180 0.988 7.410 13.989
228 1HG HSL 181 HG1 HSL 181 9.571 3.960 7.346
229 2HG HSL 181 HG2 HSL 181 7.977 4.769 7.787
230 H HSL 181 HN HSL 181 7.434 6.300 10.244
231 HA HSL 181 HA HSL 181 10.373 5.663 10.834
232 1HB HSL 181 HB1 HSL 181 10.259 3.700 9.599
233 2HB HSL 181 HB2 HSL 181 8.446 3.786 9.935
Start of MODEL 37
1 1H PHE 155 HT1 PHE 155 -5.603 -3.739 -3.479
2 2H PHE 155 HT2 PHE 155 -6.002 -3.821 -1.811
3 3H PHE 155 HT3 PHE 155 -4.811 -2.712 -2.359
4 HA PHE 155 HA PHE 155 -7.640 -2.660 -3.162
5 1HB PHE 155 HB2 PHE 155 -7.888 -0.845 -1.558
6 2HB PHE 155 HB1 PHE 155 -7.316 -2.290 -0.731
7 HD1 PHE 155 HD1 PHE 155 -6.419 1.070 -1.880
8 HD2 PHE 155 HD2 PHE 155 -5.131 -2.381 0.251
9 HE1 PHE 155 HE1 PHE 155 -4.533 2.352 -0.955
10 HE2 PHE 155 HE2 PHE 155 -3.244 -1.105 1.181
11 HZ PHE 155 HZ PHE 155 -2.942 1.264 0.579
12 H LEU 156 HN LEU 156 -7.825 0.065 -3.293
13 HA LEU 156 HA LEU 156 -5.669 1.223 -4.764
14 1HB LEU 156 HB2 LEU 156 -8.195 0.425 -6.206
15 2HB LEU 156 HB1 LEU 156 -7.042 1.582 -6.838
16 HG LEU 156 HG LEU 156 -6.497 -1.336 -6.293
17 1HD1 LEU 156 HD11 LEU 156 -6.447 0.006 -8.963
18 2HD1 LEU 156 HD12 LEU 156 -7.959 -0.601 -8.287
19 3HD1 LEU 156 HD13 LEU 156 -6.615 -1.707 -8.575
20 1HD2 LEU 156 HD21 LEU 156 -4.556 0.215 -5.931
21 2HD2 LEU 156 HD22 LEU 156 -4.700 0.680 -7.625
22 3HD2 LEU 156 HD23 LEU 156 -4.323 -0.989 -7.197
23 H GLN 157 HN GLN 157 -6.666 3.320 -5.942
24 HA GLN 157 HA GLN 157 -8.905 4.539 -4.712
25 1HB GLN 157 HB2 GLN 157 -6.697 4.525 -3.065
26 2HB GLN 157 HB1 GLN 157 -6.578 6.094 -3.846
27 1HG GLN 157 HG2 GLN 157 -8.836 5.026 -2.180
28 2HG GLN 157 HG1 GLN 157 -7.790 6.404 -1.843
29 1HE2 GLN 157 HE21 GLN 157 -7.846 7.554 -4.420
30 2HE2 GLN 157 HE22 GLN 157 -9.428 8.192 -4.685
31 H SER 158 HN SER 158 -9.321 4.988 -6.889
32 HA SER 158 HA SER 158 -9.499 6.477 -8.600
33 1HB SER 158 HB2 SER 158 -8.668 8.613 -8.456
34 2HB SER 158 HB1 SER 158 -8.545 8.120 -6.759
35 HG SER 158 HG SER 158 -6.561 8.615 -8.614
36 H ASP 159 HN ASP 159 -6.140 6.010 -7.815
37 HA ASP 159 HA ASP 159 -5.594 4.439 -10.110
38 1HB ASP 159 HB2 ASP 159 -5.687 7.060 -10.766
39 2HB ASP 159 HB1 ASP 159 -4.005 6.937 -10.261
40 H VAL 160 HN VAL 160 -4.509 6.381 -7.435
41 HA VAL 160 HA VAL 160 -3.039 5.867 -5.756
42 HB VAL 160 HB VAL 160 -2.194 3.547 -7.482
43 1HG1 VAL 160 HG11 VAL 160 -1.248 2.718 -5.264
44 2HG1 VAL 160 HG12 VAL 160 -1.403 4.385 -4.710
45 3HG1 VAL 160 HG13 VAL 160 -0.363 4.004 -6.082
46 1HG2 VAL 160 HG21 VAL 160 -4.576 3.674 -6.449
47 2HG2 VAL 160 HG22 VAL 160 -3.740 3.306 -4.941
48 3HG2 VAL 160 HG23 VAL 160 -3.638 2.188 -6.300
49 H PHE 161 HN PHE 161 -1.616 5.239 -8.959
50 HA PHE 161 HA PHE 161 0.863 6.504 -8.294
51 1HB PHE 161 HB2 PHE 161 -0.304 5.153 -10.652
52 2HB PHE 161 HB1 PHE 161 0.925 6.366 -10.997
53 HD1 PHE 161 HD1 PHE 161 0.683 4.022 -8.124
54 HD2 PHE 161 HD2 PHE 161 2.779 5.141 -11.654
55 HE1 PHE 161 HE1 PHE 161 2.441 2.384 -7.596
56 HE2 PHE 161 HE2 PHE 161 4.541 3.505 -11.132
57 HZ PHE 161 HZ PHE 161 4.373 2.123 -9.100
58 H PHE 162 HN PHE 162 -1.482 8.183 -7.937
59 HA PHE 162 HA PHE 162 -0.517 10.566 -9.108
60 1HB PHE 162 HB2 PHE 162 -2.886 9.250 -10.366
61 2HB PHE 162 HB1 PHE 162 -2.830 11.011 -10.253
62 HD1 PHE 162 HD1 PHE 162 -2.048 8.270 -12.262
63 HD2 PHE 162 HD2 PHE 162 -0.538 12.065 -11.069
64 HE1 PHE 162 HE1 PHE 162 -0.664 8.352 -14.294
65 HE2 PHE 162 HE2 PHE 162 0.848 12.156 -13.099
66 HZ PHE 162 HZ PHE 162 0.786 10.298 -14.715
67 H LEU 163 HN LEU 163 -2.687 8.827 -7.095
68 HA LEU 163 HA LEU 163 -4.429 10.847 -6.268
69 1HB LEU 163 HB2 LEU 163 -4.757 8.524 -5.630
70 2HB LEU 163 HB1 LEU 163 -3.256 8.526 -4.724
71 HG LEU 163 HG LEU 163 -4.174 9.977 -3.055
72 1HD1 LEU 163 HD11 LEU 163 -5.477 11.498 -4.320
73 2HD1 LEU 163 HD12 LEU 163 -6.584 10.682 -3.216
74 3HD1 LEU 163 HD13 LEU 163 -6.526 10.211 -4.915
75 1HD2 LEU 163 HD21 LEU 163 -5.119 7.409 -3.580
76 2HD2 LEU 163 HD22 LEU 163 -6.549 8.349 -3.157
77 3HD2 LEU 163 HD23 LEU 163 -5.181 8.277 -2.046
78 H PHE 164 HN PHE 164 -1.208 9.923 -5.168
79 HA PHE 164 HA PHE 164 0.408 11.041 -4.036
80 1HB PHE 164 HB2 PHE 164 -0.390 12.714 -5.889
81 2HB PHE 164 HB1 PHE 164 -1.003 13.632 -4.514
82 HD1 PHE 164 HD1 PHE 164 0.366 15.410 -4.055
83 HD2 PHE 164 HD2 PHE 164 2.125 11.681 -5.106
84 HE1 PHE 164 HE1 PHE 164 2.603 16.368 -3.691
85 HE2 PHE 164 HE2 PHE 164 4.366 12.632 -4.742
86 HZ PHE 164 HZ PHE 164 4.606 14.978 -4.035
87 H LEU 165 HN LEU 165 -2.826 11.292 -2.973
88 HA LEU 165 HA LEU 165 -2.477 12.919 -0.696
89 1HB LEU 165 HB2 LEU 165 -4.578 11.456 -1.900
90 2HB LEU 165 HB1 LEU 165 -4.478 10.936 -0.227
91 HG LEU 165 HG LEU 165 -6.077 12.778 -0.540
92 1HD1 LEU 165 HD11 LEU 165 -5.215 14.243 1.235
93 2HD1 LEU 165 HD12 LEU 165 -3.627 13.498 1.060
94 3HD1 LEU 165 HD13 LEU 165 -4.997 12.534 1.610
95 1HD2 LEU 165 HD21 LEU 165 -5.605 14.733 -1.562
96 2HD2 LEU 165 HD22 LEU 165 -4.355 13.773 -2.355
97 3HD2 LEU 165 HD23 LEU 165 -3.948 14.771 -0.959
98 H LEU 166 HN LEU 166 -2.191 9.447 -1.239
99 HA LEU 166 HA LEU 166 -0.493 9.169 1.066
100 1HB LEU 166 HB2 LEU 166 -3.197 8.907 1.513
101 2HB LEU 166 HB1 LEU 166 -2.694 7.247 1.248
102 HG LEU 166 HG LEU 166 -2.656 7.752 3.615
103 1HD1 LEU 166 HD11 LEU 166 -1.031 6.182 3.178
104 2HD1 LEU 166 HD12 LEU 166 -0.094 7.446 3.973
105 3HD1 LEU 166 HD13 LEU 166 -0.061 7.296 2.216
106 1HD2 LEU 166 HD21 LEU 166 -0.725 9.950 2.885
107 2HD2 LEU 166 HD22 LEU 166 -1.132 9.446 4.524
108 3HD2 LEU 166 HD23 LEU 166 -2.367 10.162 3.490
109 HA PRO 167 HA PRO 167 0.621 6.345 -2.345
110 1HB PRO 167 HB2 PRO 167 3.231 6.108 -1.592
111 2HB PRO 167 HB1 PRO 167 2.610 7.415 -2.617
112 1HG PRO 167 HG2 PRO 167 3.189 7.418 0.323
113 2HG PRO 167 HG1 PRO 167 3.526 8.672 -0.887
114 1HD PRO 167 HD2 PRO 167 1.425 8.827 0.800
115 2HD PRO 167 HD1 PRO 167 1.353 9.460 -0.858
116 HA PRO 168 HA PRO 168 0.289 2.825 0.475
117 1HB PRO 168 HB2 PRO 168 -0.970 1.194 -1.214
118 2HB PRO 168 HB1 PRO 168 -1.818 2.582 -0.500
119 1HG PRO 168 HG2 PRO 168 -0.601 2.299 -3.224
120 2HG PRO 168 HG1 PRO 168 -2.154 3.021 -2.764
121 1HD PRO 168 HD2 PRO 168 0.158 4.441 -3.254
122 2HD PRO 168 HD1 PRO 168 -1.192 5.031 -2.265
123 H ILE 169 HN ILE 169 2.536 2.428 0.528
124 HA ILE 169 HA ILE 169 3.381 0.184 -1.084
125 HB ILE 169 HB ILE 169 3.919 2.314 -2.409
126 1HG1 ILE 169 HG12 ILE 169 4.916 0.052 -2.791
127 2HG1 ILE 169 HG11 ILE 169 5.978 1.382 -3.244
128 1HG2 ILE 169 HG21 ILE 169 5.962 3.503 -1.786
129 2HG2 ILE 169 HG22 ILE 169 6.074 2.560 -0.297
130 3HG2 ILE 169 HG23 ILE 169 4.726 3.671 -0.541
131 1HD1 ILE 169 HD11 ILE 169 6.320 -0.696 -1.225
132 2HD1 ILE 169 HD12 ILE 169 6.726 0.926 -0.667
133 3HD1 ILE 169 HD13 ILE 169 7.521 0.260 -2.093
134 H ILE 170 HN ILE 170 4.391 2.705 1.149
135 HA ILE 170 HA ILE 170 6.480 1.177 2.299
136 HB ILE 170 HB ILE 170 6.591 3.017 3.947
137 1HG1 ILE 170 HG12 ILE 170 5.098 5.009 2.854
138 2HG1 ILE 170 HG11 ILE 170 4.048 3.617 2.643
139 1HG2 ILE 170 HG21 ILE 170 6.493 4.397 1.355
140 2HG2 ILE 170 HG22 ILE 170 7.473 2.931 1.414
141 3HG2 ILE 170 HG23 ILE 170 7.811 4.263 2.520
142 1HD1 ILE 170 HD11 ILE 170 5.037 3.518 5.277
143 2HD1 ILE 170 HD12 ILE 170 3.386 3.818 4.733
144 3HD1 ILE 170 HD13 ILE 170 4.495 5.168 4.972
145 H LEU 171 HN LEU 171 3.271 2.173 3.502
146 HA LEU 171 HA LEU 171 3.512 0.755 5.952
147 1HB LEU 171 HB2 LEU 171 1.048 1.052 6.097
148 2HB LEU 171 HB1 LEU 171 1.914 2.544 5.792
149 HG LEU 171 HG LEU 171 1.329 1.884 3.259
150 1HD1 LEU 171 HD11 LEU 171 -1.255 1.113 4.423
151 2HD1 LEU 171 HD12 LEU 171 0.013 -0.109 4.527
152 3HD1 LEU 171 HD13 LEU 171 -0.451 0.548 2.958
153 1HD2 LEU 171 HD21 LEU 171 -0.106 3.452 5.335
154 2HD2 LEU 171 HD22 LEU 171 -0.890 3.221 3.772
155 3HD2 LEU 171 HD23 LEU 171 0.694 3.992 3.859
156 H ASP 172 HN ASP 172 1.916 0.084 2.893
157 HA ASP 172 HA ASP 172 1.121 -2.565 3.582
158 1HB ASP 172 HB2 ASP 172 0.887 -0.782 1.249
159 2HB ASP 172 HB1 ASP 172 1.025 -2.499 0.845
160 H ALA 173 HN ALA 173 4.120 -1.301 2.988
161 HA ALA 173 HA ALA 173 5.221 -3.290 1.270
162 1HB ALA 173 HB1 ALA 173 6.915 -1.844 1.260
163 2HB ALA 173 HB2 ALA 173 7.242 -2.207 2.954
164 3HB ALA 173 HB3 ALA 173 6.129 -0.907 2.530
165 H GLY 174 HN GLY 174 5.997 -2.643 4.678
166 1HA GLY 174 HA2 GLY 174 6.184 -5.565 5.090
167 2HA GLY 174 HA1 GLY 174 7.125 -4.361 5.991
168 H TYR 175 HN TYR 175 4.665 -2.616 6.073
169 HA TYR 175 HA TYR 175 2.872 -2.192 7.397
170 1HB TYR 175 HB2 TYR 175 2.479 -4.824 6.664
171 2HB TYR 175 HB1 TYR 175 2.434 -4.906 8.422
172 HD1 TYR 175 HD1 TYR 175 0.429 -4.614 5.650
173 HD2 TYR 175 HD2 TYR 175 1.017 -2.795 9.450
174 HE1 TYR 175 HE1 TYR 175 -1.895 -3.811 5.619
175 HE2 TYR 175 HE2 TYR 175 -1.306 -1.988 9.430
176 HH TYR 175 HH TYR 175 -3.164 -1.802 6.768
177 H PHE 176 HN PHE 176 5.684 -3.753 8.482
178 HA PHE 176 HA PHE 176 5.042 -3.375 11.298
179 1HB PHE 176 HB2 PHE 176 7.074 -4.587 11.776
180 2HB PHE 176 HB1 PHE 176 6.170 -5.478 10.545
181 HD1 PHE 176 HD1 PHE 176 6.909 -5.347 8.164
182 HD2 PHE 176 HD2 PHE 176 9.246 -3.794 11.363
183 HE1 PHE 176 HE1 PHE 176 8.894 -5.348 6.709
184 HE2 PHE 176 HE2 PHE 176 11.235 -3.791 9.913
185 HZ PHE 176 HZ PHE 176 11.059 -4.567 7.583
186 H LEU 177 HN LEU 177 6.322 -1.646 8.738
187 HA LEU 177 HA LEU 177 8.512 -0.291 9.641
188 1HB LEU 177 HB2 LEU 177 6.158 0.631 8.028
189 2HB LEU 177 HB1 LEU 177 7.469 1.726 8.416
190 HG LEU 177 HG LEU 177 7.900 0.892 6.248
191 1HD1 LEU 177 HD11 LEU 177 10.039 -0.054 6.468
192 2HD1 LEU 177 HD12 LEU 177 9.622 -0.836 7.993
193 3HD1 LEU 177 HD13 LEU 177 9.802 0.917 7.922
194 1HD2 LEU 177 HD21 LEU 177 7.561 -1.229 5.499
195 2HD2 LEU 177 HD22 LEU 177 6.373 -1.195 6.802
196 3HD2 LEU 177 HD23 LEU 177 7.942 -1.959 7.059
197 HA PRO 178 HA PRO 178 5.531 2.695 12.108
198 1HB PRO 178 HB2 PRO 178 3.184 0.967 12.563
199 2HB PRO 178 HB1 PRO 178 3.249 2.645 12.013
200 1HG PRO 178 HG2 PRO 178 2.557 0.669 10.356
201 2HG PRO 178 HG1 PRO 178 3.548 2.032 9.795
202 1HD PRO 178 HD2 PRO 178 4.418 -0.726 10.609
203 2HD PRO 178 HD1 PRO 178 4.893 0.223 9.185
204 H LEU 179 HN LEU 179 7.463 1.173 13.127
205 HA LEU 179 HA LEU 179 6.413 -0.331 15.391
206 1HB LEU 179 HB2 LEU 179 8.828 -0.386 13.836
207 2HB LEU 179 HB1 LEU 179 9.229 -0.194 15.532
208 HG LEU 179 HG LEU 179 7.366 -2.356 14.583
209 1HD1 LEU 179 HD11 LEU 179 9.156 -3.130 13.441
210 2HD1 LEU 179 HD12 LEU 179 9.638 -3.697 15.040
211 3HD1 LEU 179 HD13 LEU 179 10.307 -2.197 14.397
212 1HD2 LEU 179 HD21 LEU 179 8.666 -1.584 17.117
213 2HD2 LEU 179 HD22 LEU 179 8.629 -3.310 16.753
214 3HD2 LEU 179 HD23 LEU 179 7.124 -2.392 16.829
215 H ARG 180 HN ARG 180 7.110 2.818 14.747
216 HA ARG 180 HA ARG 180 7.232 3.479 17.566
217 1HB ARG 180 HB2 ARG 180 9.127 5.067 17.222
218 2HB ARG 180 HB1 ARG 180 9.594 3.370 17.057
219 1HG ARG 180 HG2 ARG 180 8.838 4.903 14.617
220 2HG ARG 180 HG1 ARG 180 10.422 5.173 15.349
221 1HD ARG 180 HD2 ARG 180 9.295 2.552 14.374
222 2HD ARG 180 HD1 ARG 180 10.606 3.479 13.644
223 HE ARG 180 HE ARG 180 10.776 1.718 15.908
224 1HH1 ARG 180 1HH1 ARG 180 12.224 4.465 14.312
225 2HH1 ARG 180 2HH1 ARG 180 13.788 4.205 15.010
226 1HH2 ARG 180 1HH2 ARG 180 12.833 1.376 16.827
227 2HH2 ARG 180 2HH2 ARG 180 14.134 2.451 16.436
228 1HG HSL 181 HG1 HSL 181 1.593 4.967 13.831
229 2HG HSL 181 HG2 HSL 181 2.444 3.520 14.583
230 H HSL 181 HN HSL 181 5.116 3.639 15.943
231 HA HSL 181 HA HSL 181 4.866 6.617 15.274
232 1HB HSL 181 HB1 HSL 181 3.602 6.132 13.392
233 2HB HSL 181 HB2 HSL 181 4.367 4.453 13.493
Start of MODEL 38
1 1H PHE 155 HT1 PHE 155 1.368 13.926 2.918
2 2H PHE 155 HT2 PHE 155 2.079 14.275 1.394
3 3H PHE 155 HT3 PHE 155 2.288 15.357 2.711
4 HA PHE 155 HA PHE 155 3.494 13.680 3.906
5 1HB PHE 155 HB2 PHE 155 3.228 12.124 1.323
6 2HB PHE 155 HB1 PHE 155 4.123 11.618 2.753
7 HD1 PHE 155 HD1 PHE 155 1.273 10.987 1.009
8 HD2 PHE 155 HD2 PHE 155 2.514 11.877 4.980
9 HE1 PHE 155 HE1 PHE 155 -0.751 9.895 1.881
10 HE2 PHE 155 HE2 PHE 155 0.493 10.786 5.861
11 HZ PHE 155 HZ PHE 155 -1.144 9.793 4.311
12 H LEU 156 HN LEU 156 5.810 12.862 3.029
13 HA LEU 156 HA LEU 156 6.906 14.351 0.872
14 1HB LEU 156 HB2 LEU 156 8.316 15.852 2.120
15 2HB LEU 156 HB1 LEU 156 6.640 16.130 2.543
16 HG LEU 156 HG LEU 156 7.577 14.285 4.421
17 1HD1 LEU 156 HD11 LEU 156 9.834 15.327 3.432
18 2HD1 LEU 156 HD12 LEU 156 9.642 14.873 5.126
19 3HD1 LEU 156 HD13 LEU 156 9.447 16.556 4.636
20 1HD2 LEU 156 HD21 LEU 156 7.339 16.246 5.968
21 2HD2 LEU 156 HD22 LEU 156 5.940 15.928 4.942
22 3HD2 LEU 156 HD23 LEU 156 7.045 17.243 4.543
23 H GLN 157 HN GLN 157 7.435 12.087 0.500
24 HA GLN 157 HA GLN 157 9.370 10.814 2.216
25 1HB GLN 157 HB2 GLN 157 7.511 9.905 0.375
26 2HB GLN 157 HB1 GLN 157 9.049 9.637 -0.432
27 1HG GLN 157 HG2 GLN 157 8.349 7.678 0.828
28 2HG GLN 157 HG1 GLN 157 9.846 8.353 1.468
29 1HE2 GLN 157 HE21 GLN 157 9.269 7.091 3.368
30 2HE2 GLN 157 HE22 GLN 157 8.190 7.773 4.532
31 H SER 158 HN SER 158 10.018 13.392 0.861
32 HA SER 158 HA SER 158 11.926 14.353 0.114
33 1HB SER 158 HB2 SER 158 13.014 12.256 1.219
34 2HB SER 158 HB1 SER 158 13.181 11.680 -0.448
35 HG SER 158 HG SER 158 14.968 12.813 -0.308
36 H ASP 159 HN ASP 159 9.679 13.444 -1.521
37 HA ASP 159 HA ASP 159 10.812 14.013 -4.100
38 1HB ASP 159 HB2 ASP 159 9.355 11.386 -3.718
39 2HB ASP 159 HB1 ASP 159 9.996 12.018 -5.231
40 H VAL 160 HN VAL 160 7.953 12.720 -2.453
41 HA VAL 160 HA VAL 160 5.827 13.492 -2.273
42 HB VAL 160 HB VAL 160 6.789 15.834 -3.910
43 1HG1 VAL 160 HG11 VAL 160 4.546 16.037 -4.234
44 2HG1 VAL 160 HG12 VAL 160 4.663 16.812 -2.655
45 3HG1 VAL 160 HG13 VAL 160 4.144 15.131 -2.775
46 1HG2 VAL 160 HG21 VAL 160 6.968 17.030 -1.857
47 2HG2 VAL 160 HG22 VAL 160 7.845 15.513 -1.664
48 3HG2 VAL 160 HG23 VAL 160 6.242 15.702 -0.955
49 H PHE 161 HN PHE 161 7.001 14.274 -5.564
50 HA PHE 161 HA PHE 161 4.573 13.561 -6.829
51 1HB PHE 161 HB2 PHE 161 7.386 13.777 -7.924
52 2HB PHE 161 HB1 PHE 161 5.954 13.551 -8.923
53 HD1 PHE 161 HD1 PHE 161 4.317 15.336 -9.170
54 HD2 PHE 161 HD2 PHE 161 7.877 15.893 -6.906
55 HE1 PHE 161 HE1 PHE 161 3.973 17.771 -9.236
56 HE2 PHE 161 HE2 PHE 161 7.540 18.329 -6.968
57 HZ PHE 161 HZ PHE 161 5.585 19.271 -8.134
58 H PHE 162 HN PHE 162 7.383 11.776 -5.858
59 HA PHE 162 HA PHE 162 6.865 9.415 -7.375
60 1HB PHE 162 HB2 PHE 162 8.838 10.411 -5.579
61 2HB PHE 162 HB1 PHE 162 8.346 8.802 -5.053
62 HD1 PHE 162 HD1 PHE 162 9.141 6.894 -6.144
63 HD2 PHE 162 HD2 PHE 162 9.593 10.706 -7.980
64 HE1 PHE 162 HE1 PHE 162 10.581 5.889 -7.868
65 HE2 PHE 162 HE2 PHE 162 11.033 9.708 -9.707
66 HZ PHE 162 HZ PHE 162 11.529 7.296 -9.653
67 H LEU 163 HN LEU 163 6.703 10.060 -3.894
68 HA LEU 163 HA LEU 163 5.200 7.749 -3.236
69 1HB LEU 163 HB2 LEU 163 6.673 9.327 -1.781
70 2HB LEU 163 HB1 LEU 163 5.204 10.272 -1.626
71 HG LEU 163 HG LEU 163 4.187 7.945 -0.883
72 1HD1 LEU 163 HD11 LEU 163 6.141 6.984 0.636
73 2HD1 LEU 163 HD12 LEU 163 7.122 7.583 -0.702
74 3HD1 LEU 163 HD13 LEU 163 5.848 6.402 -1.003
75 1HD2 LEU 163 HD21 LEU 163 4.758 10.232 0.376
76 2HD2 LEU 163 HD22 LEU 163 5.869 9.158 1.225
77 3HD2 LEU 163 HD23 LEU 163 4.140 8.806 1.210
78 H PHE 164 HN PHE 164 4.341 10.420 -4.914
79 HA PHE 164 HA PHE 164 1.773 11.005 -3.865
80 1HB PHE 164 HB2 PHE 164 2.527 12.806 -5.027
81 2HB PHE 164 HB1 PHE 164 3.480 11.818 -6.127
82 HD1 PHE 164 HD1 PHE 164 2.858 11.863 -8.335
83 HD2 PHE 164 HD2 PHE 164 -0.125 12.471 -5.361
84 HE1 PHE 164 HE1 PHE 164 1.178 12.217 -10.098
85 HE2 PHE 164 HE2 PHE 164 -1.811 12.823 -7.119
86 HZ PHE 164 HZ PHE 164 -1.160 12.697 -9.491
87 H LEU 165 HN LEU 165 2.988 8.845 -6.377
88 HA LEU 165 HA LEU 165 0.520 8.294 -7.624
89 1HB LEU 165 HB2 LEU 165 2.577 6.150 -7.364
90 2HB LEU 165 HB1 LEU 165 1.577 6.571 -8.740
91 HG LEU 165 HG LEU 165 4.032 8.043 -7.785
92 1HD1 LEU 165 HD11 LEU 165 4.029 5.822 -9.214
93 2HD1 LEU 165 HD12 LEU 165 5.142 7.146 -9.560
94 3HD1 LEU 165 HD13 LEU 165 3.677 6.952 -10.523
95 1HD2 LEU 165 HD21 LEU 165 2.604 9.748 -8.533
96 2HD2 LEU 165 HD22 LEU 165 1.969 8.759 -9.847
97 3HD2 LEU 165 HD23 LEU 165 3.621 9.371 -9.923
98 H LEU 166 HN LEU 166 2.186 6.798 -4.896
99 HA LEU 166 HA LEU 166 -0.294 5.843 -3.839
100 1HB LEU 166 HB2 LEU 166 -0.284 3.735 -4.545
101 2HB LEU 166 HB1 LEU 166 0.949 4.228 -5.690
102 HG LEU 166 HG LEU 166 1.706 3.206 -2.965
103 1HD1 LEU 166 HD11 LEU 166 0.824 1.227 -3.454
104 2HD1 LEU 166 HD12 LEU 166 2.025 1.105 -4.739
105 3HD1 LEU 166 HD13 LEU 166 0.417 1.732 -5.093
106 1HD2 LEU 166 HD21 LEU 166 3.738 3.645 -3.771
107 2HD2 LEU 166 HD22 LEU 166 3.074 4.067 -5.350
108 3HD2 LEU 166 HD23 LEU 166 3.472 2.390 -4.981
109 HA PRO 167 HA PRO 167 2.657 6.872 -0.565
110 1HB PRO 167 HB2 PRO 167 0.818 7.647 1.249
111 2HB PRO 167 HB1 PRO 167 1.370 8.687 -0.077
112 1HG PRO 167 HG2 PRO 167 -1.118 7.035 0.131
113 2HG PRO 167 HG1 PRO 167 -0.916 8.682 -0.492
114 1HD PRO 167 HD2 PRO 167 -1.104 6.502 -2.107
115 2HD PRO 167 HD1 PRO 167 -0.185 7.954 -2.542
116 HA PRO 168 HA PRO 168 0.877 3.555 2.287
117 1HB PRO 168 HB2 PRO 168 -1.072 1.965 1.534
118 2HB PRO 168 HB1 PRO 168 -1.413 3.673 1.892
119 1HG PRO 168 HG2 PRO 168 -1.046 2.343 -0.774
120 2HG PRO 168 HG1 PRO 168 -2.301 3.489 -0.263
121 1HD PRO 168 HD2 PRO 168 0.014 4.174 -1.624
122 2HD PRO 168 HD1 PRO 168 -0.965 5.286 -0.650
123 H ILE 169 HN ILE 169 2.603 3.232 -0.290
124 HA ILE 169 HA ILE 169 2.625 0.384 -0.717
125 HB ILE 169 HB ILE 169 3.344 2.291 -2.348
126 1HG1 ILE 169 HG12 ILE 169 4.778 0.703 -3.563
127 2HG1 ILE 169 HG11 ILE 169 4.950 -0.260 -2.100
128 1HG2 ILE 169 HG21 ILE 169 5.590 2.936 -2.381
129 2HG2 ILE 169 HG22 ILE 169 6.051 1.700 -1.211
130 3HG2 ILE 169 HG23 ILE 169 5.105 3.095 -0.693
131 1HD1 ILE 169 HD11 ILE 169 2.180 0.096 -2.626
132 2HD1 ILE 169 HD12 ILE 169 3.128 -1.391 -2.622
133 3HD1 ILE 169 HD13 ILE 169 2.977 -0.446 -4.103
134 H ILE 170 HN ILE 170 4.508 2.718 1.074
135 HA ILE 170 HA ILE 170 6.559 0.911 1.882
136 HB ILE 170 HB ILE 170 5.897 3.434 3.361
137 1HG1 ILE 170 HG12 ILE 170 5.830 4.080 1.034
138 2HG1 ILE 170 HG11 ILE 170 7.349 4.635 1.726
139 1HG2 ILE 170 HG21 ILE 170 7.689 2.612 4.453
140 2HG2 ILE 170 HG22 ILE 170 8.578 3.344 3.117
141 3HG2 ILE 170 HG23 ILE 170 8.202 1.622 3.087
142 1HD1 ILE 170 HD11 ILE 170 8.597 3.127 0.527
143 2HD1 ILE 170 HD12 ILE 170 7.307 3.520 -0.612
144 3HD1 ILE 170 HD13 ILE 170 7.242 2.017 0.309
145 H LEU 171 HN LEU 171 3.762 2.325 3.615
146 HA LEU 171 HA LEU 171 4.263 0.910 6.013
147 1HB LEU 171 HB2 LEU 171 2.360 1.877 6.821
148 2HB LEU 171 HB1 LEU 171 2.674 2.947 5.473
149 HG LEU 171 HG LEU 171 1.035 1.449 4.156
150 1HD1 LEU 171 HD11 LEU 171 0.503 -0.398 5.351
151 2HD1 LEU 171 HD12 LEU 171 -0.724 0.675 6.022
152 3HD1 LEU 171 HD13 LEU 171 0.778 0.392 6.902
153 1HD2 LEU 171 HD21 LEU 171 -0.632 2.949 4.592
154 2HD2 LEU 171 HD22 LEU 171 0.741 3.808 5.290
155 3HD2 LEU 171 HD23 LEU 171 -0.362 2.912 6.334
156 H ASP 172 HN ASP 172 2.132 0.315 3.283
157 HA ASP 172 HA ASP 172 1.275 -2.252 4.225
158 1HB ASP 172 HB2 ASP 172 0.112 -0.544 2.567
159 2HB ASP 172 HB1 ASP 172 1.013 -1.465 1.354
160 H ALA 173 HN ALA 173 4.184 -1.238 3.046
161 HA ALA 173 HA ALA 173 4.787 -3.324 1.198
162 1HB ALA 173 HB1 ALA 173 6.077 -0.985 2.161
163 2HB ALA 173 HB2 ALA 173 6.537 -2.009 0.803
164 3HB ALA 173 HB3 ALA 173 7.169 -2.345 2.414
165 H GLY 174 HN GLY 174 5.841 -2.695 4.547
166 1HA GLY 174 HA2 GLY 174 6.239 -5.613 4.853
167 2HA GLY 174 HA1 GLY 174 7.199 -4.386 5.705
168 H TYR 175 HN TYR 175 4.463 -2.891 5.883
169 HA TYR 175 HA TYR 175 2.773 -2.629 7.370
170 1HB TYR 175 HB2 TYR 175 3.047 -5.557 7.205
171 2HB TYR 175 HB1 TYR 175 2.290 -4.972 8.680
172 HD1 TYR 175 HD1 TYR 175 1.513 -6.267 5.648
173 HD2 TYR 175 HD2 TYR 175 0.584 -2.853 8.012
174 HE1 TYR 175 HE1 TYR 175 -0.615 -6.020 4.443
175 HE2 TYR 175 HE2 TYR 175 -1.548 -2.598 6.814
176 HH TYR 175 HH TYR 175 -2.230 -3.868 3.981
177 H PHE 176 HN PHE 176 5.853 -3.654 8.237
178 HA PHE 176 HA PHE 176 5.406 -3.410 11.099
179 1HB PHE 176 HB2 PHE 176 7.674 -4.318 9.377
180 2HB PHE 176 HB1 PHE 176 8.037 -3.714 11.000
181 HD1 PHE 176 HD1 PHE 176 7.796 -6.604 9.341
182 HD2 PHE 176 HD2 PHE 176 5.976 -4.696 12.681
183 HE1 PHE 176 HE1 PHE 176 7.221 -8.805 10.280
184 HE2 PHE 176 HE2 PHE 176 5.400 -6.893 13.627
185 HZ PHE 176 HZ PHE 176 6.022 -8.950 12.427
186 H LEU 177 HN LEU 177 5.768 -1.323 8.601
187 HA LEU 177 HA LEU 177 7.728 0.493 9.323
188 1HB LEU 177 HB2 LEU 177 5.421 0.449 7.607
189 2HB LEU 177 HB1 LEU 177 5.512 1.995 8.425
190 HG LEU 177 HG LEU 177 6.636 1.817 6.151
191 1HD1 LEU 177 HD11 LEU 177 7.822 2.913 8.644
192 2HD1 LEU 177 HD12 LEU 177 7.204 3.748 7.219
193 3HD1 LEU 177 HD13 LEU 177 8.784 2.968 7.165
194 1HD2 LEU 177 HD21 LEU 177 8.865 0.512 7.684
195 2HD2 LEU 177 HD22 LEU 177 8.724 0.764 5.944
196 3HD2 LEU 177 HD23 LEU 177 7.696 -0.421 6.749
197 HA PRO 178 HA PRO 178 4.285 2.671 12.092
198 1HB PRO 178 HB2 PRO 178 2.610 0.283 12.660
199 2HB PRO 178 HB1 PRO 178 2.118 1.950 12.335
200 1HG PRO 178 HG2 PRO 178 1.770 0.058 10.502
201 2HG PRO 178 HG1 PRO 178 2.305 1.685 10.031
202 1HD PRO 178 HD2 PRO 178 3.919 -0.823 10.347
203 2HD PRO 178 HD1 PRO 178 3.993 0.409 9.069
204 H LEU 179 HN LEU 179 6.382 2.371 13.201
205 HA LEU 179 HA LEU 179 6.480 0.207 15.152
206 1HB LEU 179 HB2 LEU 179 8.472 2.338 14.388
207 2HB LEU 179 HB1 LEU 179 8.747 1.158 15.657
208 HG LEU 179 HG LEU 179 8.248 0.458 12.763
209 1HD1 LEU 179 HD11 LEU 179 10.481 1.673 13.662
210 2HD1 LEU 179 HD12 LEU 179 10.458 0.503 12.343
211 3HD1 LEU 179 HD13 LEU 179 10.888 -0.014 13.974
212 1HD2 LEU 179 HD21 LEU 179 9.092 -1.187 15.144
213 2HD2 LEU 179 HD22 LEU 179 9.107 -1.755 13.475
214 3HD2 LEU 179 HD23 LEU 179 7.582 -1.316 14.244
215 H ARG 180 HN ARG 180 7.430 3.617 15.489
216 HA ARG 180 HA ARG 180 6.408 3.615 18.205
217 1HB ARG 180 HB2 ARG 180 7.838 5.777 16.641
218 2HB ARG 180 HB1 ARG 180 7.445 5.846 18.363
219 1HG ARG 180 HG2 ARG 180 9.297 3.871 17.035
220 2HG ARG 180 HG1 ARG 180 9.772 5.252 18.028
221 1HD ARG 180 HD2 ARG 180 9.844 3.654 19.637
222 2HD ARG 180 HD1 ARG 180 8.131 4.056 19.754
223 HE ARG 180 HE ARG 180 7.618 1.985 18.919
224 1HH1 ARG 180 1HH1 ARG 180 11.009 2.618 18.386
225 2HH1 ARG 180 2HH1 ARG 180 11.354 1.007 17.851
226 1HH2 ARG 180 1HH2 ARG 180 8.070 -0.134 18.211
227 2HH2 ARG 180 2HH2 ARG 180 9.686 -0.554 17.750
228 1HG HSL 181 HG1 HSL 181 0.711 5.755 14.478
229 2HG HSL 181 HG2 HSL 181 0.875 4.184 13.534
230 H HSL 181 HN HSL 181 4.558 3.378 15.974
231 HA HSL 181 HA HSL 181 2.921 5.941 16.367
232 1HB HSL 181 HB1 HSL 181 3.052 5.931 14.003
233 2HB HSL 181 HB2 HSL 181 3.260 4.099 13.926
Start of MODEL 39
1 1H PHE 155 HT1 PHE 155 11.677 10.503 -4.085
2 2H PHE 155 HT2 PHE 155 10.022 10.319 -3.671
3 3H PHE 155 HT3 PHE 155 10.573 11.780 -4.381
4 HA PHE 155 HA PHE 155 11.236 10.455 -6.333
5 1HB PHE 155 HB2 PHE 155 9.262 8.396 -5.636
6 2HB PHE 155 HB1 PHE 155 10.818 8.228 -6.439
7 HD1 PHE 155 HD1 PHE 155 9.033 8.103 -3.283
8 HD2 PHE 155 HD2 PHE 155 12.865 7.925 -5.123
9 HE1 PHE 155 HE1 PHE 155 9.971 7.138 -1.224
10 HE2 PHE 155 HE2 PHE 155 13.812 6.958 -3.067
11 HZ PHE 155 HZ PHE 155 12.363 6.563 -1.114
12 H LEU 156 HN LEU 156 8.610 11.457 -4.487
13 HA LEU 156 HA LEU 156 6.689 12.497 -5.002
14 1HB LEU 156 HB2 LEU 156 8.236 12.746 -7.501
15 2HB LEU 156 HB1 LEU 156 6.507 12.992 -7.648
16 HG LEU 156 HG LEU 156 8.404 14.548 -5.891
17 1HD1 LEU 156 HD11 LEU 156 8.050 16.358 -7.335
18 2HD1 LEU 156 HD12 LEU 156 6.676 15.578 -8.118
19 3HD1 LEU 156 HD13 LEU 156 8.309 14.979 -8.402
20 1HD2 LEU 156 HD21 LEU 156 6.285 15.958 -5.547
21 2HD2 LEU 156 HD22 LEU 156 6.447 14.462 -4.627
22 3HD2 LEU 156 HD23 LEU 156 5.411 14.511 -6.053
23 H GLN 157 HN GLN 157 4.757 12.324 -6.763
24 HA GLN 157 HA GLN 157 4.381 9.794 -7.977
25 1HB GLN 157 HB2 GLN 157 3.750 10.006 -5.152
26 2HB GLN 157 HB1 GLN 157 2.330 9.578 -6.094
27 1HG GLN 157 HG2 GLN 157 3.250 7.588 -6.826
28 2HG GLN 157 HG1 GLN 157 4.901 8.115 -6.498
29 1HE2 GLN 157 HE21 GLN 157 5.285 8.620 -4.110
30 2HE2 GLN 157 HE22 GLN 157 4.668 7.463 -2.986
31 H SER 158 HN SER 158 4.054 12.425 -8.798
32 HA SER 158 HA SER 158 2.632 13.692 -10.017
33 1HB SER 158 HB2 SER 158 1.635 11.992 -11.199
34 2HB SER 158 HB1 SER 158 1.049 11.189 -9.734
35 HG SER 158 HG SER 158 -0.712 12.367 -9.788
36 H ASP 159 HN ASP 159 0.685 12.203 -7.529
37 HA ASP 159 HA ASP 159 0.216 14.782 -6.283
38 1HB ASP 159 HB2 ASP 159 -1.622 13.912 -8.090
39 2HB ASP 159 HB1 ASP 159 -2.263 13.225 -6.601
40 H VAL 160 HN VAL 160 0.265 11.322 -6.154
41 HA VAL 160 HA VAL 160 0.238 9.797 -4.511
42 HB VAL 160 HB VAL 160 2.147 11.208 -3.725
43 1HG1 VAL 160 HG11 VAL 160 1.745 12.419 -1.543
44 2HG1 VAL 160 HG12 VAL 160 0.034 12.390 -1.946
45 3HG1 VAL 160 HG13 VAL 160 1.174 13.226 -2.999
46 1HG2 VAL 160 HG21 VAL 160 2.146 9.216 -2.640
47 2HG2 VAL 160 HG22 VAL 160 0.507 9.424 -2.023
48 3HG2 VAL 160 HG23 VAL 160 1.850 10.273 -1.260
49 H PHE 161 HN PHE 161 -1.314 12.763 -3.268
50 HA PHE 161 HA PHE 161 -3.024 11.343 -1.503
51 1HB PHE 161 HB2 PHE 161 -2.446 14.083 -2.124
52 2HB PHE 161 HB1 PHE 161 -4.190 13.845 -2.144
53 HD1 PHE 161 HD1 PHE 161 -1.308 14.322 -0.113
54 HD2 PHE 161 HD2 PHE 161 -5.251 12.720 -0.113
55 HE1 PHE 161 HE1 PHE 161 -1.345 14.420 2.345
56 HE2 PHE 161 HE2 PHE 161 -5.294 12.815 2.345
57 HZ PHE 161 HZ PHE 161 -3.340 13.667 3.577
58 H PHE 162 HN PHE 162 -2.975 11.367 -4.799
59 HA PHE 162 HA PHE 162 -5.598 10.283 -4.973
60 1HB PHE 162 HB2 PHE 162 -5.077 13.053 -5.968
61 2HB PHE 162 HB1 PHE 162 -6.208 12.012 -6.838
62 HD1 PHE 162 HD1 PHE 162 -6.277 14.632 -4.812
63 HD2 PHE 162 HD2 PHE 162 -7.622 10.595 -4.785
64 HE1 PHE 162 HE1 PHE 162 -8.050 15.238 -3.217
65 HE2 PHE 162 HE2 PHE 162 -9.399 11.194 -3.192
66 HZ PHE 162 HZ PHE 162 -9.614 13.518 -2.407
67 H LEU 163 HN LEU 163 -2.573 10.053 -5.847
68 HA LEU 163 HA LEU 163 -2.708 9.813 -8.682
69 1HB LEU 163 HB2 LEU 163 -0.574 10.115 -7.498
70 2HB LEU 163 HB1 LEU 163 -0.782 8.556 -6.722
71 HG LEU 163 HG LEU 163 -0.686 7.464 -8.938
72 1HD1 LEU 163 HD11 LEU 163 0.477 9.225 -10.633
73 2HD1 LEU 163 HD12 LEU 163 -0.692 10.262 -9.817
74 3HD1 LEU 163 HD13 LEU 163 -1.235 8.805 -10.649
75 1HD2 LEU 163 HD21 LEU 163 1.789 9.049 -8.945
76 2HD2 LEU 163 HD22 LEU 163 1.557 7.305 -8.831
77 3HD2 LEU 163 HD23 LEU 163 1.370 8.315 -7.397
78 H PHE 164 HN PHE 164 -3.335 7.754 -5.955
79 HA PHE 164 HA PHE 164 -4.378 5.763 -5.733
80 1HB PHE 164 HB2 PHE 164 -6.248 5.927 -6.938
81 2HB PHE 164 HB1 PHE 164 -5.443 6.919 -8.145
82 HD1 PHE 164 HD1 PHE 164 -6.473 3.529 -7.227
83 HD2 PHE 164 HD2 PHE 164 -4.608 5.949 -10.188
84 HE1 PHE 164 HE1 PHE 164 -6.679 1.692 -8.851
85 HE2 PHE 164 HE2 PHE 164 -4.813 4.119 -11.819
86 HZ PHE 164 HZ PHE 164 -5.850 1.987 -11.151
87 H LEU 165 HN LEU 165 -1.651 6.149 -7.492
88 HA LEU 165 HA LEU 165 -1.387 3.645 -8.789
89 1HB LEU 165 HB2 LEU 165 0.263 5.954 -8.289
90 2HB LEU 165 HB1 LEU 165 1.176 4.481 -8.030
91 HG LEU 165 HG LEU 165 -0.015 3.912 -10.402
92 1HD1 LEU 165 HD11 LEU 165 -0.997 6.199 -10.464
93 2HD1 LEU 165 HD12 LEU 165 0.041 5.821 -11.838
94 3HD1 LEU 165 HD13 LEU 165 0.642 6.847 -10.536
95 1HD2 LEU 165 HD21 LEU 165 2.481 5.496 -10.559
96 2HD2 LEU 165 HD22 LEU 165 2.101 3.905 -11.219
97 3HD2 LEU 165 HD23 LEU 165 2.490 4.079 -9.507
98 H LEU 166 HN LEU 166 0.326 4.780 -5.882
99 HA LEU 166 HA LEU 166 -0.280 2.377 -4.431
100 1HB LEU 166 HB2 LEU 166 2.001 2.395 -6.105
101 2HB LEU 166 HB1 LEU 166 2.591 2.510 -4.459
102 HG LEU 166 HG LEU 166 2.563 0.214 -4.923
103 1HD1 LEU 166 HD11 LEU 166 -0.133 0.369 -3.673
104 2HD1 LEU 166 HD12 LEU 166 1.238 1.095 -2.834
105 3HD1 LEU 166 HD13 LEU 166 1.261 -0.621 -3.239
106 1HD2 LEU 166 HD21 LEU 166 1.108 -0.894 -6.269
107 2HD2 LEU 166 HD22 LEU 166 0.892 0.729 -6.925
108 3HD2 LEU 166 HD23 LEU 166 -0.273 0.082 -5.769
109 HA PRO 167 HA PRO 167 0.701 6.401 -2.111
110 1HB PRO 167 HB2 PRO 167 -1.861 5.666 -0.821
111 2HB PRO 167 HB1 PRO 167 -1.301 7.241 -1.413
112 1HG PRO 167 HG2 PRO 167 -3.169 5.832 -2.724
113 2HG PRO 167 HG1 PRO 167 -1.965 6.813 -3.579
114 1HD PRO 167 HD2 PRO 167 -2.089 3.852 -3.213
115 2HD PRO 167 HD1 PRO 167 -1.542 4.798 -4.612
116 HA PRO 168 HA PRO 168 0.608 3.615 1.714
117 1HB PRO 168 HB2 PRO 168 -0.944 1.491 1.898
118 2HB PRO 168 HB1 PRO 168 -1.668 3.113 1.877
119 1HG PRO 168 HG2 PRO 168 -1.473 1.100 -0.329
120 2HG PRO 168 HG1 PRO 168 -2.830 2.151 0.113
121 1HD PRO 168 HD2 PRO 168 -0.942 2.669 -1.887
122 2HD PRO 168 HD1 PRO 168 -2.041 3.856 -1.162
123 H ILE 169 HN ILE 169 2.344 3.150 -0.487
124 HA ILE 169 HA ILE 169 2.826 0.344 -0.793
125 HB ILE 169 HB ILE 169 3.461 2.353 -2.360
126 1HG1 ILE 169 HG12 ILE 169 3.796 -0.009 -2.895
127 2HG1 ILE 169 HG11 ILE 169 5.184 0.945 -3.411
128 1HG2 ILE 169 HG21 ILE 169 5.633 3.223 -2.166
129 2HG2 ILE 169 HG22 ILE 169 6.075 2.059 -0.919
130 3HG2 ILE 169 HG23 ILE 169 4.934 3.352 -0.552
131 1HD1 ILE 169 HD11 ILE 169 6.193 -0.874 -2.453
132 2HD1 ILE 169 HD12 ILE 169 4.961 -1.037 -1.202
133 3HD1 ILE 169 HD13 ILE 169 6.158 0.255 -1.098
134 H ILE 170 HN ILE 170 4.128 2.923 1.156
135 HA ILE 170 HA ILE 170 6.313 1.454 2.245
136 HB ILE 170 HB ILE 170 5.064 3.853 3.547
137 1HG1 ILE 170 HG12 ILE 170 5.253 4.512 1.251
138 2HG1 ILE 170 HG11 ILE 170 6.604 5.232 2.116
139 1HG2 ILE 170 HG21 ILE 170 6.764 3.348 4.929
140 2HG2 ILE 170 HG22 ILE 170 7.742 4.161 3.709
141 3HG2 ILE 170 HG23 ILE 170 7.613 2.401 3.707
142 1HD1 ILE 170 HD11 ILE 170 8.151 3.891 1.088
143 2HD1 ILE 170 HD12 ILE 170 6.962 4.102 -0.196
144 3HD1 ILE 170 HD13 ILE 170 6.981 2.615 0.749
145 H LEU 171 HN LEU 171 3.051 2.251 3.395
146 HA LEU 171 HA LEU 171 3.361 1.103 5.966
147 1HB LEU 171 HB2 LEU 171 0.907 1.622 4.284
148 2HB LEU 171 HB1 LEU 171 0.836 1.018 5.929
149 HG LEU 171 HG LEU 171 0.430 3.344 6.061
150 1HD1 LEU 171 HD11 LEU 171 2.006 2.437 7.737
151 2HD1 LEU 171 HD12 LEU 171 2.245 4.155 7.419
152 3HD1 LEU 171 HD13 LEU 171 3.346 2.968 6.721
153 1HD2 LEU 171 HD21 LEU 171 2.972 4.139 4.754
154 2HD2 LEU 171 HD22 LEU 171 1.422 4.978 4.825
155 3HD2 LEU 171 HD23 LEU 171 1.642 3.621 3.718
156 H ASP 172 HN ASP 172 1.746 -0.097 3.048
157 HA ASP 172 HA ASP 172 1.481 -2.756 4.059
158 1HB ASP 172 HB2 ASP 172 0.935 -1.417 1.430
159 2HB ASP 172 HB1 ASP 172 0.948 -3.184 1.529
160 H ALA 173 HN ALA 173 4.177 -1.131 3.124
161 HA ALA 173 HA ALA 173 5.432 -3.029 1.416
162 1HB ALA 173 HB1 ALA 173 6.828 -1.312 1.184
163 2HB ALA 173 HB2 ALA 173 7.427 -1.614 2.815
164 3HB ALA 173 HB3 ALA 173 6.094 -0.489 2.559
165 H GLY 174 HN GLY 174 5.918 -2.172 4.825
166 1HA GLY 174 HA2 GLY 174 6.935 -4.907 5.303
167 2HA GLY 174 HA1 GLY 174 7.428 -3.478 6.235
168 H TYR 175 HN TYR 175 4.536 -2.559 6.108
169 HA TYR 175 HA TYR 175 2.629 -2.679 7.320
170 1HB TYR 175 HB2 TYR 175 2.710 -5.113 6.451
171 2HB TYR 175 HB1 TYR 175 3.261 -5.526 8.069
172 HD1 TYR 175 HD1 TYR 175 1.228 -2.875 8.730
173 HD2 TYR 175 HD2 TYR 175 0.943 -6.875 7.303
174 HE1 TYR 175 HE1 TYR 175 -1.105 -2.975 9.494
175 HE2 TYR 175 HE2 TYR 175 -1.393 -6.983 8.063
176 HH TYR 175 HH TYR 175 -2.722 -5.025 10.211
177 H PHE 176 HN PHE 176 5.193 -4.554 8.967
178 HA PHE 176 HA PHE 176 4.391 -3.399 11.515
179 1HB PHE 176 HB2 PHE 176 5.673 -5.822 10.677
180 2HB PHE 176 HB1 PHE 176 6.740 -4.973 11.803
181 HD1 PHE 176 HD1 PHE 176 3.040 -5.467 11.585
182 HD2 PHE 176 HD2 PHE 176 6.584 -5.839 13.911
183 HE1 PHE 176 HE1 PHE 176 1.707 -6.312 13.472
184 HE2 PHE 176 HE2 PHE 176 5.257 -6.684 15.803
185 HZ PHE 176 HZ PHE 176 2.816 -6.923 15.584
186 H LEU 177 HN LEU 177 6.194 -2.353 9.022
187 HA LEU 177 HA LEU 177 8.626 -1.532 10.139
188 1HB LEU 177 HB2 LEU 177 8.874 -1.049 7.980
189 2HB LEU 177 HB1 LEU 177 7.144 -1.109 7.714
190 HG LEU 177 HG LEU 177 7.018 1.272 8.488
191 1HD1 LEU 177 HD11 LEU 177 8.817 2.467 9.114
192 2HD1 LEU 177 HD12 LEU 177 9.881 1.672 7.954
193 3HD1 LEU 177 HD13 LEU 177 9.496 0.882 9.484
194 1HD2 LEU 177 HD21 LEU 177 8.881 1.337 6.208
195 2HD2 LEU 177 HD22 LEU 177 7.248 1.986 6.362
196 3HD2 LEU 177 HD23 LEU 177 7.488 0.270 6.033
197 HA PRO 178 HA PRO 178 6.162 2.693 11.023
198 1HB PRO 178 HB2 PRO 178 3.597 1.328 11.710
199 2HB PRO 178 HB1 PRO 178 3.867 2.905 10.957
200 1HG PRO 178 HG2 PRO 178 3.068 0.836 9.498
201 2HG PRO 178 HG1 PRO 178 4.267 1.979 8.864
202 1HD PRO 178 HD2 PRO 178 4.658 -0.777 9.946
203 2HD PRO 178 HD1 PRO 178 5.484 0.034 8.600
204 H LEU 179 HN LEU 179 7.755 2.157 12.694
205 HA LEU 179 HA LEU 179 6.439 1.533 15.249
206 1HB LEU 179 HB2 LEU 179 8.700 0.186 13.984
207 2HB LEU 179 HB1 LEU 179 9.064 0.737 15.609
208 HG LEU 179 HG LEU 179 7.207 -0.538 16.508
209 1HD1 LEU 179 HD11 LEU 179 6.201 -2.206 14.701
210 2HD1 LEU 179 HD12 LEU 179 6.527 -0.835 13.641
211 3HD1 LEU 179 HD13 LEU 179 5.477 -0.634 15.042
212 1HD2 LEU 179 HD21 LEU 179 8.852 -2.220 14.622
213 2HD2 LEU 179 HD22 LEU 179 8.026 -2.777 16.077
214 3HD2 LEU 179 HD23 LEU 179 9.379 -1.653 16.207
215 H ARG 180 HN ARG 180 9.684 2.552 14.176
216 HA ARG 180 HA ARG 180 9.727 4.585 16.250
217 1HB ARG 180 HB2 ARG 180 11.843 3.966 14.178
218 2HB ARG 180 HB1 ARG 180 12.046 4.909 15.659
219 1HG ARG 180 HG2 ARG 180 12.560 3.082 16.790
220 2HG ARG 180 HG1 ARG 180 11.029 2.331 16.337
221 1HD ARG 180 HD2 ARG 180 13.639 2.239 14.838
222 2HD ARG 180 HD1 ARG 180 12.796 0.900 15.610
223 HE ARG 180 HE ARG 180 11.207 0.921 13.864
224 1HH1 ARG 180 1HH1 ARG 180 13.771 3.248 13.362
225 2HH1 ARG 180 2HH1 ARG 180 13.465 3.398 11.666
226 1HH2 ARG 180 1HH2 ARG 180 10.812 1.126 11.636
227 2HH2 ARG 180 2HH2 ARG 180 11.788 2.197 10.687
228 1HG HSL 181 HG1 HSL 181 6.837 7.918 10.627
229 2HG HSL 181 HG2 HSL 181 5.613 6.548 10.513
230 H HSL 181 HN HSL 181 7.878 4.664 13.941
231 HA HSL 181 HA HSL 181 8.724 7.346 12.721
232 1HB HSL 181 HB1 HSL 181 8.390 6.089 10.732
233 2HB HSL 181 HB2 HSL 181 7.152 4.976 11.532
Start of MODEL 40
1 1H PHE 155 HT1 PHE 155 -9.293 -4.666 4.140
2 2H PHE 155 HT2 PHE 155 -8.938 -6.284 4.577
3 3H PHE 155 HT3 PHE 155 -9.344 -5.899 2.953
4 HA PHE 155 HA PHE 155 -7.062 -4.636 4.256
5 1HB PHE 155 HB2 PHE 155 -5.968 -6.717 2.804
6 2HB PHE 155 HB1 PHE 155 -6.095 -6.643 4.554
7 HD1 PHE 155 HD1 PHE 155 -8.612 -7.367 1.875
8 HD2 PHE 155 HD2 PHE 155 -6.579 -8.724 5.360
9 HE1 PHE 155 HE1 PHE 155 -9.972 -9.414 1.866
10 HE2 PHE 155 HE2 PHE 155 -7.937 -10.774 5.357
11 HZ PHE 155 HZ PHE 155 -9.637 -11.121 3.608
12 H LEU 156 HN LEU 156 -7.118 -6.509 1.275
13 HA LEU 156 HA LEU 156 -7.676 -4.311 -0.436
14 1HB LEU 156 HB2 LEU 156 -5.519 -3.923 -1.358
15 2HB LEU 156 HB1 LEU 156 -5.388 -3.750 0.381
16 HG LEU 156 HG LEU 156 -4.627 -6.269 0.263
17 1HD1 LEU 156 HD11 LEU 156 -3.108 -6.214 -1.946
18 2HD1 LEU 156 HD12 LEU 156 -4.521 -5.339 -2.537
19 3HD1 LEU 156 HD13 LEU 156 -4.702 -6.967 -1.884
20 1HD2 LEU 156 HD21 LEU 156 -2.287 -5.477 0.021
21 2HD2 LEU 156 HD22 LEU 156 -3.246 -4.510 1.141
22 3HD2 LEU 156 HD23 LEU 156 -2.911 -3.906 -0.482
23 H GLN 157 HN GLN 157 -7.945 -4.937 -2.574
24 HA GLN 157 HA GLN 157 -7.008 -7.407 -3.601
25 1HB GLN 157 HB2 GLN 157 -9.347 -8.399 -3.897
26 2HB GLN 157 HB1 GLN 157 -8.624 -8.518 -2.298
27 1HG GLN 157 HG2 GLN 157 -10.311 -7.421 -1.385
28 2HG GLN 157 HG1 GLN 157 -10.127 -6.086 -2.521
29 1HE2 GLN 157 HE21 GLN 157 -11.580 -5.838 -4.106
30 2HE2 GLN 157 HE22 GLN 157 -12.890 -6.918 -4.422
31 H SER 158 HN SER 158 -6.519 -5.298 -4.788
32 HA SER 158 HA SER 158 -7.926 -5.372 -7.261
33 1HB SER 158 HB2 SER 158 -8.772 -3.123 -7.323
34 2HB SER 158 HB1 SER 158 -9.388 -3.861 -5.835
35 HG SER 158 HG SER 158 -7.183 -2.089 -6.086
36 H ASP 159 HN ASP 159 -5.376 -5.966 -6.585
37 HA ASP 159 HA ASP 159 -3.276 -5.665 -7.434
38 1HB ASP 159 HB2 ASP 159 -4.774 -3.858 -9.003
39 2HB ASP 159 HB1 ASP 159 -3.385 -2.951 -8.410
40 H VAL 160 HN VAL 160 -4.574 -2.566 -6.268
41 HA VAL 160 HA VAL 160 -3.957 -1.151 -4.634
42 HB VAL 160 HB VAL 160 -3.732 -3.584 -3.446
43 1HG1 VAL 160 HG11 VAL 160 -1.662 -3.506 -2.054
44 2HG1 VAL 160 HG12 VAL 160 -1.034 -2.269 -3.139
45 3HG1 VAL 160 HG13 VAL 160 -1.378 -3.887 -3.749
46 1HG2 VAL 160 HG21 VAL 160 -2.873 -1.309 -1.777
47 2HG2 VAL 160 HG22 VAL 160 -4.206 -2.444 -1.563
48 3HG2 VAL 160 HG23 VAL 160 -4.367 -1.097 -2.691
49 H PHE 161 HN PHE 161 -1.091 -3.098 -5.480
50 HA PHE 161 HA PHE 161 0.649 -0.821 -5.300
51 1HB PHE 161 HB2 PHE 161 2.345 -2.474 -6.256
52 2HB PHE 161 HB1 PHE 161 1.663 -2.859 -4.679
53 HD1 PHE 161 HD1 PHE 161 0.831 -4.971 -4.305
54 HD2 PHE 161 HD2 PHE 161 1.114 -3.536 -8.301
55 HE1 PHE 161 HE1 PHE 161 0.140 -7.179 -5.143
56 HE2 PHE 161 HE2 PHE 161 0.421 -5.741 -9.146
57 HZ PHE 161 HZ PHE 161 -0.068 -7.565 -7.566
58 H PHE 162 HN PHE 162 -1.623 -1.068 -7.351
59 HA PHE 162 HA PHE 162 -0.322 0.318 -9.435
60 1HB PHE 162 HB2 PHE 162 -0.852 -2.586 -9.813
61 2HB PHE 162 HB1 PHE 162 -1.177 -1.503 -11.169
62 HD1 PHE 162 HD1 PHE 162 1.048 -3.762 -10.404
63 HD2 PHE 162 HD2 PHE 162 0.974 0.461 -10.918
64 HE1 PHE 162 HE1 PHE 162 3.434 -3.797 -11.001
65 HE2 PHE 162 HE2 PHE 162 3.360 0.435 -11.515
66 HZ PHE 162 HZ PHE 162 4.594 -1.696 -11.558
67 H LEU 163 HN LEU 163 -2.989 -0.412 -7.676
68 HA LEU 163 HA LEU 163 -5.086 -0.205 -9.547
69 1HB LEU 163 HB2 LEU 163 -5.344 -0.933 -7.171
70 2HB LEU 163 HB1 LEU 163 -5.062 0.723 -6.671
71 HG LEU 163 HG LEU 163 -7.093 1.368 -8.035
72 1HD1 LEU 163 HD11 LEU 163 -7.642 -1.592 -7.968
73 2HD1 LEU 163 HD12 LEU 163 -7.095 -0.717 -9.399
74 3HD1 LEU 163 HD13 LEU 163 -8.652 -0.326 -8.669
75 1HD2 LEU 163 HD21 LEU 163 -8.619 0.043 -6.274
76 2HD2 LEU 163 HD22 LEU 163 -7.640 1.446 -5.842
77 3HD2 LEU 163 HD23 LEU 163 -7.040 -0.182 -5.521
78 H PHE 164 HN PHE 164 -2.811 2.009 -8.293
79 HA PHE 164 HA PHE 164 -2.424 4.216 -8.643
80 1HB PHE 164 HB2 PHE 164 -3.165 3.229 -11.031
81 2HB PHE 164 HB1 PHE 164 -4.444 4.422 -10.807
82 HD1 PHE 164 HD1 PHE 164 -3.805 6.823 -10.428
83 HD2 PHE 164 HD2 PHE 164 -1.004 3.870 -11.670
84 HE1 PHE 164 HE1 PHE 164 -2.284 8.596 -11.203
85 HE2 PHE 164 HE2 PHE 164 0.521 5.637 -12.445
86 HZ PHE 164 HZ PHE 164 -0.119 8.004 -12.213
87 H LEU 165 HN LEU 165 -3.422 4.670 -6.610
88 HA LEU 165 HA LEU 165 -5.418 6.680 -6.779
89 1HB LEU 165 HB2 LEU 165 -6.438 4.097 -6.643
90 2HB LEU 165 HB1 LEU 165 -6.541 4.691 -4.994
91 HG LEU 165 HG LEU 165 -7.814 6.652 -5.803
92 1HD1 LEU 165 HD11 LEU 165 -6.969 6.805 -8.057
93 2HD1 LEU 165 HD12 LEU 165 -8.720 6.596 -8.098
94 3HD1 LEU 165 HD13 LEU 165 -7.660 5.232 -8.457
95 1HD2 LEU 165 HD21 LEU 165 -8.726 4.168 -5.293
96 2HD2 LEU 165 HD22 LEU 165 -9.342 4.398 -6.929
97 3HD2 LEU 165 HD23 LEU 165 -9.772 5.540 -5.656
98 H LEU 166 HN LEU 166 -4.122 4.233 -4.529
99 HA LEU 166 HA LEU 166 -2.903 6.263 -2.912
100 1HB LEU 166 HB2 LEU 166 -5.566 5.518 -2.336
101 2HB LEU 166 HB1 LEU 166 -4.568 4.757 -1.109
102 HG LEU 166 HG LEU 166 -3.550 7.293 -1.126
103 1HD1 LEU 166 HD11 LEU 166 -5.821 7.575 -2.631
104 2HD1 LEU 166 HD12 LEU 166 -5.018 8.863 -1.732
105 3HD1 LEU 166 HD13 LEU 166 -6.377 8.002 -1.012
106 1HD2 LEU 166 HD21 LEU 166 -5.150 7.600 0.876
107 2HD2 LEU 166 HD22 LEU 166 -3.980 6.280 0.919
108 3HD2 LEU 166 HD23 LEU 166 -5.665 5.952 0.516
109 HA PRO 167 HA PRO 167 -1.246 1.782 -3.157
110 1HB PRO 167 HB2 PRO 167 1.283 2.712 -3.874
111 2HB PRO 167 HB1 PRO 167 0.073 2.026 -4.975
112 1HG PRO 167 HG2 PRO 167 0.710 4.887 -4.394
113 2HG PRO 167 HG1 PRO 167 0.266 4.122 -5.932
114 1HD PRO 167 HD2 PRO 167 -1.501 5.576 -4.547
115 2HD PRO 167 HD1 PRO 167 -1.998 4.103 -5.408
116 HA PRO 168 HA PRO 168 0.268 2.995 0.970
117 1HB PRO 168 HB2 PRO 168 -0.182 0.585 2.112
118 2HB PRO 168 HB1 PRO 168 -1.485 1.764 1.851
119 1HG PRO 168 HG2 PRO 168 -0.730 -0.624 0.195
120 2HG PRO 168 HG1 PRO 168 -2.340 -0.095 0.719
121 1HD PRO 168 HD2 PRO 168 -1.379 0.409 -1.758
122 2HD PRO 168 HD1 PRO 168 -2.471 1.530 -0.919
123 H ILE 169 HN ILE 169 2.387 3.104 -0.120
124 HA ILE 169 HA ILE 169 3.926 0.721 -0.465
125 HB ILE 169 HB ILE 169 4.138 3.085 -1.600
126 1HG1 ILE 169 HG12 ILE 169 5.413 1.037 -2.167
127 2HG1 ILE 169 HG11 ILE 169 6.380 2.501 -2.317
128 1HG2 ILE 169 HG21 ILE 169 5.673 4.581 -0.718
129 2HG2 ILE 169 HG22 ILE 169 6.318 3.400 0.420
130 3HG2 ILE 169 HG23 ILE 169 4.720 4.098 0.684
131 1HD1 ILE 169 HD11 ILE 169 7.848 1.116 -1.254
132 2HD1 ILE 169 HD12 ILE 169 6.582 0.284 -0.351
133 3HD1 ILE 169 HD13 ILE 169 7.092 1.902 0.131
134 H ILE 170 HN ILE 170 3.645 3.184 2.000
135 HA ILE 170 HA ILE 170 5.865 2.255 3.560
136 HB ILE 170 HB ILE 170 3.650 3.966 4.637
137 1HG1 ILE 170 HG12 ILE 170 4.165 4.975 2.526
138 2HG1 ILE 170 HG11 ILE 170 4.954 5.927 3.778
139 1HG2 ILE 170 HG21 ILE 170 6.618 4.049 5.138
140 2HG2 ILE 170 HG22 ILE 170 5.481 3.120 6.114
141 3HG2 ILE 170 HG23 ILE 170 5.350 4.877 6.042
142 1HD1 ILE 170 HD11 ILE 170 7.064 5.196 3.171
143 2HD1 ILE 170 HD12 ILE 170 6.236 5.382 1.624
144 3HD1 ILE 170 HD13 ILE 170 6.436 3.780 2.329
145 H LEU 171 HN LEU 171 2.319 2.087 3.977
146 HA LEU 171 HA LEU 171 2.418 0.557 6.352
147 1HB LEU 171 HB2 LEU 171 0.232 0.619 4.263
148 2HB LEU 171 HB1 LEU 171 0.065 0.059 5.916
149 HG LEU 171 HG LEU 171 0.925 2.570 6.383
150 1HD1 LEU 171 HD11 LEU 171 1.025 3.605 4.372
151 2HD1 LEU 171 HD12 LEU 171 -0.694 3.842 4.686
152 3HD1 LEU 171 HD13 LEU 171 -0.162 2.530 3.633
153 1HD2 LEU 171 HD21 LEU 171 -1.128 2.870 7.271
154 2HD2 LEU 171 HD22 LEU 171 -1.311 1.160 6.878
155 3HD2 LEU 171 HD23 LEU 171 -1.958 2.389 5.791
156 H ASP 172 HN ASP 172 1.862 -0.358 2.978
157 HA ASP 172 HA ASP 172 2.001 -3.163 3.495
158 1HB ASP 172 HB2 ASP 172 0.911 -1.759 1.491
159 2HB ASP 172 HB1 ASP 172 2.472 -2.133 0.745
160 H ALA 173 HN ALA 173 4.368 -0.894 3.625
161 HA ALA 173 HA ALA 173 6.455 -2.150 2.140
162 1HB ALA 173 HB1 ALA 173 7.462 -0.587 4.335
163 2HB ALA 173 HB2 ALA 173 6.132 0.268 3.554
164 3HB ALA 173 HB3 ALA 173 7.526 -0.247 2.606
165 H GLY 174 HN GLY 174 5.651 -1.950 5.585
166 1HA GLY 174 HA2 GLY 174 7.070 -4.521 5.987
167 2HA GLY 174 HA1 GLY 174 7.200 -3.187 7.150
168 H TYR 175 HN TYR 175 4.334 -2.504 6.642
169 HA TYR 175 HA TYR 175 2.246 -3.014 7.293
170 1HB TYR 175 HB2 TYR 175 2.671 -5.315 6.384
171 2HB TYR 175 HB1 TYR 175 3.208 -5.793 7.990
172 HD1 TYR 175 HD1 TYR 175 0.355 -3.565 7.160
173 HD2 TYR 175 HD2 TYR 175 1.582 -7.383 8.584
174 HE1 TYR 175 HE1 TYR 175 -1.967 -4.070 7.791
175 HE2 TYR 175 HE2 TYR 175 -0.737 -7.898 9.217
176 HH TYR 175 HH TYR 175 -2.899 -6.180 9.842
177 H PHE 176 HN PHE 176 4.983 -3.550 9.310
178 HA PHE 176 HA PHE 176 3.366 -3.441 11.741
179 1HB PHE 176 HB2 PHE 176 6.294 -3.937 11.207
180 2HB PHE 176 HB1 PHE 176 5.683 -3.631 12.839
181 HD1 PHE 176 HD1 PHE 176 5.394 -5.906 9.928
182 HD2 PHE 176 HD2 PHE 176 4.694 -5.346 14.089
183 HE1 PHE 176 HE1 PHE 176 4.820 -8.289 10.148
184 HE2 PHE 176 HE2 PHE 176 4.120 -7.728 14.316
185 HZ PHE 176 HZ PHE 176 4.182 -9.202 12.344
186 H LEU 177 HN LEU 177 2.938 -1.239 10.434
187 HA LEU 177 HA LEU 177 3.121 1.013 10.318
188 1HB LEU 177 HB2 LEU 177 3.850 0.408 13.169
189 2HB LEU 177 HB1 LEU 177 3.808 2.061 12.590
190 HG LEU 177 HG LEU 177 1.383 0.555 11.946
191 1HD1 LEU 177 HD11 LEU 177 1.288 -0.522 13.924
192 2HD1 LEU 177 HD12 LEU 177 0.734 1.049 14.503
193 3HD1 LEU 177 HD13 LEU 177 2.423 0.580 14.705
194 1HD2 LEU 177 HD21 LEU 177 1.746 3.114 13.490
195 2HD2 LEU 177 HD22 LEU 177 0.311 2.566 12.623
196 3HD2 LEU 177 HD23 LEU 177 1.760 3.027 11.729
197 HA PRO 178 HA PRO 178 7.815 0.800 9.834
198 1HB PRO 178 HB2 PRO 178 7.263 0.446 6.973
199 2HB PRO 178 HB1 PRO 178 8.262 -0.538 8.046
200 1HG PRO 178 HG2 PRO 178 5.944 -1.429 7.066
201 2HG PRO 178 HG1 PRO 178 6.469 -1.848 8.703
202 1HD PRO 178 HD2 PRO 178 4.550 0.288 7.815
203 2HD PRO 178 HD1 PRO 178 4.353 -0.933 9.089
204 H LEU 179 HN LEU 179 7.048 3.111 10.400
205 HA LEU 179 HA LEU 179 6.910 4.837 8.037
206 1HB LEU 179 HB2 LEU 179 5.932 4.987 10.759
207 2HB LEU 179 HB1 LEU 179 6.868 6.415 10.359
208 HG LEU 179 HG LEU 179 5.277 6.227 8.162
209 1HD1 LEU 179 HD11 LEU 179 4.152 4.313 9.631
210 2HD1 LEU 179 HD12 LEU 179 3.220 5.365 8.565
211 3HD1 LEU 179 HD13 LEU 179 3.294 5.704 10.294
212 1HD2 LEU 179 HD21 LEU 179 5.325 8.314 9.041
213 2HD2 LEU 179 HD22 LEU 179 5.195 7.738 10.703
214 3HD2 LEU 179 HD23 LEU 179 3.759 7.817 9.682
215 H ARG 180 HN ARG 180 8.771 4.310 10.980
216 HA ARG 180 HA ARG 180 10.864 6.135 10.108
217 1HB ARG 180 HB2 ARG 180 10.278 4.604 12.625
218 2HB ARG 180 HB1 ARG 180 11.901 5.237 12.336
219 1HG ARG 180 HG2 ARG 180 10.234 6.629 13.715
220 2HG ARG 180 HG1 ARG 180 11.209 7.436 12.487
221 1HD ARG 180 HD2 ARG 180 8.499 6.398 11.776
222 2HD ARG 180 HD1 ARG 180 8.642 7.907 12.674
223 HE ARG 180 HE ARG 180 9.087 7.563 9.915
224 1HH1 ARG 180 1HH1 ARG 180 10.416 9.221 12.685
225 2HH1 ARG 180 2HH1 ARG 180 11.103 10.502 11.746
226 1HH2 ARG 180 1HH2 ARG 180 9.981 9.253 8.679
227 2HH2 ARG 180 2HH2 ARG 180 10.854 10.522 9.471
228 1HG HSL 181 HG1 HSL 181 10.433 -0.220 6.756
229 2HG HSL 181 HG2 HSL 181 9.334 1.194 7.184
230 H HSL 181 HN HSL 181 10.069 3.522 8.809
231 HA HSL 181 HA HSL 181 12.804 2.142 8.881
232 1HB HSL 181 HB1 HSL 181 11.812 0.049 8.664
233 2HB HSL 181 HB2 HSL 181 10.311 0.869 9.361
Start of MODEL 41
1 1H PHE 155 HT1 PHE 155 -2.518 8.418 -7.793
2 2H PHE 155 HT2 PHE 155 -3.843 8.853 -6.794
3 3H PHE 155 HT3 PHE 155 -2.706 10.043 -7.280
4 HA PHE 155 HA PHE 155 -4.614 10.330 -8.564
5 1HB PHE 155 HB2 PHE 155 -2.616 8.806 -10.242
6 2HB PHE 155 HB1 PHE 155 -3.639 10.147 -10.746
7 HD1 PHE 155 HD1 PHE 155 -3.263 12.122 -8.676
8 HD2 PHE 155 HD2 PHE 155 -0.428 9.484 -10.438
9 HE1 PHE 155 HE1 PHE 155 -1.459 13.704 -8.131
10 HE2 PHE 155 HE2 PHE 155 1.383 11.059 -9.896
11 HZ PHE 155 HZ PHE 155 0.868 13.173 -8.740
12 H LEU 156 HN LEU 156 -6.270 9.526 -9.902
13 HA LEU 156 HA LEU 156 -7.158 6.904 -9.236
14 1HB LEU 156 HB2 LEU 156 -8.229 8.973 -11.149
15 2HB LEU 156 HB1 LEU 156 -9.032 7.449 -10.823
16 HG LEU 156 HG LEU 156 -8.446 9.545 -8.731
17 1HD1 LEU 156 HD11 LEU 156 -11.210 8.964 -9.595
18 2HD1 LEU 156 HD12 LEU 156 -10.212 9.905 -10.703
19 3HD1 LEU 156 HD13 LEU 156 -10.480 10.476 -9.056
20 1HD2 LEU 156 HD21 LEU 156 -10.539 7.544 -8.284
21 2HD2 LEU 156 HD22 LEU 156 -9.293 8.151 -7.194
22 3HD2 LEU 156 HD23 LEU 156 -8.904 6.887 -8.360
23 H GLN 157 HN GLN 157 -5.525 5.555 -10.043
24 HA GLN 157 HA GLN 157 -5.986 4.551 -12.652
25 1HB GLN 157 HB2 GLN 157 -3.685 4.968 -13.546
26 2HB GLN 157 HB1 GLN 157 -4.683 6.409 -13.426
27 1HG GLN 157 HG2 GLN 157 -2.966 7.349 -12.386
28 2HG GLN 157 HG1 GLN 157 -3.380 6.340 -11.002
29 1HE2 GLN 157 HE21 GLN 157 -1.474 5.772 -10.183
30 2HE2 GLN 157 HE22 GLN 157 -0.199 5.001 -11.059
31 H SER 158 HN SER 158 -3.813 4.768 -9.896
32 HA SER 158 HA SER 158 -2.660 2.183 -10.275
33 1HB SER 158 HB2 SER 158 -1.516 2.560 -8.211
34 2HB SER 158 HB1 SER 158 -1.582 4.130 -9.029
35 HG SER 158 HG SER 158 -2.302 3.746 -6.633
36 H ASP 159 HN ASP 159 -4.923 1.360 -10.600
37 HA ASP 159 HA ASP 159 -6.296 -0.352 -9.874
38 1HB ASP 159 HB2 ASP 159 -4.604 -0.365 -7.791
39 2HB ASP 159 HB1 ASP 159 -6.033 0.275 -6.985
40 H VAL 160 HN VAL 160 -6.393 2.581 -7.853
41 HA VAL 160 HA VAL 160 -8.044 4.110 -7.518
42 HB VAL 160 HB VAL 160 -9.597 2.535 -9.566
43 1HG1 VAL 160 HG11 VAL 160 -10.108 5.295 -8.468
44 2HG1 VAL 160 HG12 VAL 160 -11.057 3.852 -8.105
45 3HG1 VAL 160 HG13 VAL 160 -11.027 4.498 -9.746
46 1HG2 VAL 160 HG21 VAL 160 -8.950 4.844 -10.784
47 2HG2 VAL 160 HG22 VAL 160 -7.983 3.373 -10.898
48 3HG2 VAL 160 HG23 VAL 160 -7.539 4.632 -9.746
49 H PHE 161 HN PHE 161 -9.305 0.790 -7.796
50 HA PHE 161 HA PHE 161 -11.352 1.169 -5.857
51 1HB PHE 161 HB2 PHE 161 -10.506 -0.907 -7.645
52 2HB PHE 161 HB1 PHE 161 -10.716 -1.588 -6.035
53 HD1 PHE 161 HD1 PHE 161 -12.816 -2.255 -5.366
54 HD2 PHE 161 HD2 PHE 161 -12.451 0.625 -8.478
55 HE1 PHE 161 HE1 PHE 161 -15.251 -2.324 -5.710
56 HE2 PHE 161 HE2 PHE 161 -14.886 0.562 -8.827
57 HZ PHE 161 HZ PHE 161 -16.290 -0.914 -7.442
58 H PHE 162 HN PHE 162 -8.290 1.525 -5.261
59 HA PHE 162 HA PHE 162 -8.486 0.794 -2.521
60 1HB PHE 162 HB2 PHE 162 -7.895 -1.390 -3.376
61 2HB PHE 162 HB1 PHE 162 -6.518 -0.709 -4.243
62 HD1 PHE 162 HD1 PHE 162 -4.436 -0.650 -3.232
63 HD2 PHE 162 HD2 PHE 162 -7.907 -1.126 -0.818
64 HE1 PHE 162 HE1 PHE 162 -3.010 -1.029 -1.264
65 HE2 PHE 162 HE2 PHE 162 -6.488 -1.504 1.156
66 HZ PHE 162 HZ PHE 162 -4.035 -1.455 0.934
67 H LEU 163 HN LEU 163 -7.406 2.797 -4.864
68 HA LEU 163 HA LEU 163 -4.818 3.505 -4.007
69 1HB LEU 163 HB2 LEU 163 -5.642 4.316 -6.123
70 2HB LEU 163 HB1 LEU 163 -7.020 5.078 -5.352
71 HG LEU 163 HG LEU 163 -4.984 6.366 -4.108
72 1HD1 LEU 163 HD11 LEU 163 -4.052 5.707 -6.893
73 2HD1 LEU 163 HD12 LEU 163 -3.237 5.331 -5.374
74 3HD1 LEU 163 HD13 LEU 163 -3.387 7.007 -5.904
75 1HD2 LEU 163 HD21 LEU 163 -6.399 7.032 -6.679
76 2HD2 LEU 163 HD22 LEU 163 -5.412 8.186 -5.781
77 3HD2 LEU 163 HD23 LEU 163 -6.857 7.497 -5.041
78 H PHE 164 HN PHE 164 -8.044 4.138 -2.936
79 HA PHE 164 HA PHE 164 -8.934 5.321 -1.202
80 1HB PHE 164 HB2 PHE 164 -7.585 3.256 -0.318
81 2HB PHE 164 HB1 PHE 164 -6.522 4.488 0.365
82 HD1 PHE 164 HD1 PHE 164 -7.281 5.943 2.148
83 HD2 PHE 164 HD2 PHE 164 -9.831 2.956 0.513
84 HE1 PHE 164 HE1 PHE 164 -8.795 6.189 4.071
85 HE2 PHE 164 HE2 PHE 164 -11.351 3.196 2.432
86 HZ PHE 164 HZ PHE 164 -10.834 4.815 4.214
87 H LEU 165 HN LEU 165 -7.415 6.974 -2.887
88 HA LEU 165 HA LEU 165 -6.937 9.229 -2.855
89 1HB LEU 165 HB2 LEU 165 -7.750 8.932 -0.266
90 2HB LEU 165 HB1 LEU 165 -6.072 9.408 -0.054
91 HG LEU 165 HG LEU 165 -7.518 11.076 -1.979
92 1HD1 LEU 165 HD11 LEU 165 -8.517 10.776 0.827
93 2HD1 LEU 165 HD12 LEU 165 -9.431 10.888 -0.677
94 3HD1 LEU 165 HD13 LEU 165 -8.634 12.318 -0.020
95 1HD2 LEU 165 HD21 LEU 165 -5.233 11.276 -0.561
96 2HD2 LEU 165 HD22 LEU 165 -6.330 12.197 0.468
97 3HD2 LEU 165 HD23 LEU 165 -6.108 12.659 -1.219
98 H LEU 166 HN LEU 166 -4.974 6.888 -1.172
99 HA LEU 166 HA LEU 166 -2.653 7.697 -2.630
100 1HB LEU 166 HB2 LEU 166 -1.716 9.058 -1.143
101 2HB LEU 166 HB1 LEU 166 -3.154 8.929 -0.146
102 HG LEU 166 HG LEU 166 -0.911 6.930 0.073
103 1HD1 LEU 166 HD11 LEU 166 0.299 8.238 1.487
104 2HD1 LEU 166 HD12 LEU 166 -1.098 9.193 1.980
105 3HD1 LEU 166 HD13 LEU 166 -0.335 9.489 0.418
106 1HD2 LEU 166 HD21 LEU 166 -3.408 6.908 1.113
107 2HD2 LEU 166 HD22 LEU 166 -2.527 7.753 2.387
108 3HD2 LEU 166 HD23 LEU 166 -2.010 6.146 1.873
109 HA PRO 167 HA PRO 167 -2.154 3.318 -1.996
110 1HB PRO 167 HB2 PRO 167 0.251 3.015 -3.209
111 2HB PRO 167 HB1 PRO 167 -1.254 3.275 -4.113
112 1HG PRO 167 HG2 PRO 167 0.879 5.246 -3.372
113 2HG PRO 167 HG1 PRO 167 0.026 5.047 -4.914
114 1HD PRO 167 HD2 PRO 167 -0.639 6.960 -3.112
115 2HD PRO 167 HD1 PRO 167 -1.832 6.193 -4.180
116 HA PRO 168 HA PRO 168 0.348 3.708 1.776
117 1HB PRO 168 HB2 PRO 168 -0.496 1.379 2.895
118 2HB PRO 168 HB1 PRO 168 -1.443 2.879 2.951
119 1HG PRO 168 HG2 PRO 168 -1.714 0.530 1.107
120 2HG PRO 168 HG1 PRO 168 -2.981 1.449 1.944
121 1HD PRO 168 HD2 PRO 168 -2.382 1.858 -0.659
122 2HD PRO 168 HD1 PRO 168 -2.924 3.170 0.407
123 H ILE 169 HN ILE 169 2.167 3.346 0.192
124 HA ILE 169 HA ILE 169 3.069 0.666 -0.276
125 HB ILE 169 HB ILE 169 3.569 2.781 -1.665
126 1HG1 ILE 169 HG12 ILE 169 5.796 0.853 -0.980
127 2HG1 ILE 169 HG11 ILE 169 4.501 0.557 -2.137
128 1HG2 ILE 169 HG21 ILE 169 4.453 4.117 0.199
129 2HG2 ILE 169 HG22 ILE 169 5.597 3.977 -1.136
130 3HG2 ILE 169 HG23 ILE 169 5.820 3.008 0.320
131 1HD1 ILE 169 HD11 ILE 169 5.403 2.708 -3.281
132 2HD1 ILE 169 HD12 ILE 169 6.237 1.170 -3.505
133 3HD1 ILE 169 HD13 ILE 169 6.864 2.355 -2.359
134 H ILE 170 HN ILE 170 3.919 3.262 1.921
135 HA ILE 170 HA ILE 170 6.095 1.929 3.171
136 HB ILE 170 HB ILE 170 4.478 4.113 4.460
137 1HG1 ILE 170 HG12 ILE 170 6.552 5.399 3.189
138 2HG1 ILE 170 HG11 ILE 170 6.059 4.209 1.988
139 1HG2 ILE 170 HG21 ILE 170 6.344 4.541 5.733
140 2HG2 ILE 170 HG22 ILE 170 7.447 3.852 4.541
141 3HG2 ILE 170 HG23 ILE 170 6.456 2.791 5.541
142 1HD1 ILE 170 HD11 ILE 170 4.678 5.899 1.399
143 2HD1 ILE 170 HD12 ILE 170 4.618 6.567 3.030
144 3HD1 ILE 170 HD13 ILE 170 3.659 5.144 2.625
145 H LEU 171 HN LEU 171 2.644 2.212 3.871
146 HA LEU 171 HA LEU 171 2.736 1.000 6.432
147 1HB LEU 171 HB2 LEU 171 0.797 2.233 4.989
148 2HB LEU 171 HB1 LEU 171 0.333 0.557 4.761
149 HG LEU 171 HG LEU 171 0.838 1.631 7.515
150 1HD1 LEU 171 HD11 LEU 171 -1.835 1.739 7.365
151 2HD1 LEU 171 HD12 LEU 171 -1.426 2.227 5.719
152 3HD1 LEU 171 HD13 LEU 171 -0.791 3.135 7.092
153 1HD2 LEU 171 HD21 LEU 171 0.534 -0.588 7.801
154 2HD2 LEU 171 HD22 LEU 171 -0.347 -0.776 6.285
155 3HD2 LEU 171 HD23 LEU 171 -1.169 -0.141 7.710
156 H ASP 172 HN ASP 172 1.844 -0.264 3.244
157 HA ASP 172 HA ASP 172 1.908 -2.997 4.112
158 1HB ASP 172 HB2 ASP 172 1.146 -1.525 1.704
159 2HB ASP 172 HB1 ASP 172 1.980 -3.043 1.343
160 H ALA 173 HN ALA 173 4.366 -0.873 3.648
161 HA ALA 173 HA ALA 173 6.144 -2.415 2.041
162 1HB ALA 173 HB1 ALA 173 7.834 -0.835 3.383
163 2HB ALA 173 HB2 ALA 173 6.336 0.052 3.653
164 3HB ALA 173 HB3 ALA 173 6.880 -0.275 2.010
165 H GLY 174 HN GLY 174 5.729 -1.893 5.518
166 1HA GLY 174 HA2 GLY 174 7.408 -4.287 6.007
167 2HA GLY 174 HA1 GLY 174 7.335 -2.901 7.114
168 H TYR 175 HN TYR 175 4.391 -2.736 6.418
169 HA TYR 175 HA TYR 175 2.399 -3.392 7.154
170 1HB TYR 175 HB2 TYR 175 3.867 -5.996 7.286
171 2HB TYR 175 HB1 TYR 175 2.207 -5.877 7.855
172 HD1 TYR 175 HD1 TYR 175 4.374 -6.105 4.981
173 HD2 TYR 175 HD2 TYR 175 0.412 -5.201 6.235
174 HE1 TYR 175 HE1 TYR 175 3.585 -6.397 2.671
175 HE2 TYR 175 HE2 TYR 175 -0.391 -5.491 3.929
176 HH TYR 175 HH TYR 175 1.573 -6.853 1.456
177 H PHE 176 HN PHE 176 5.118 -3.458 9.175
178 HA PHE 176 HA PHE 176 3.527 -3.873 11.593
179 1HB PHE 176 HB2 PHE 176 6.077 -4.638 11.019
180 2HB PHE 176 HB1 PHE 176 6.375 -3.104 11.847
181 HD1 PHE 176 HD1 PHE 176 7.079 -3.520 13.990
182 HD2 PHE 176 HD2 PHE 176 3.887 -5.834 12.388
183 HE1 PHE 176 HE1 PHE 176 6.807 -4.644 16.163
184 HE2 PHE 176 HE2 PHE 176 3.610 -6.962 14.558
185 HZ PHE 176 HZ PHE 176 5.071 -6.366 16.449
186 H LEU 177 HN LEU 177 2.927 -1.676 9.970
187 HA LEU 177 HA LEU 177 2.465 0.521 10.060
188 1HB LEU 177 HB2 LEU 177 3.120 -0.087 12.911
189 2HB LEU 177 HB1 LEU 177 2.935 1.589 12.431
190 HG LEU 177 HG LEU 177 0.816 -0.501 11.952
191 1HD1 LEU 177 HD11 LEU 177 0.988 1.482 14.216
192 2HD1 LEU 177 HD12 LEU 177 1.272 -0.253 14.361
193 3HD1 LEU 177 HD13 LEU 177 -0.323 0.343 13.908
194 1HD2 LEU 177 HD21 LEU 177 -0.547 1.722 11.982
195 2HD2 LEU 177 HD22 LEU 177 0.331 1.244 10.529
196 3HD2 LEU 177 HD23 LEU 177 1.012 2.458 11.612
197 HA PRO 178 HA PRO 178 7.317 0.916 9.694
198 1HB PRO 178 HB2 PRO 178 6.083 1.503 7.009
199 2HB PRO 178 HB1 PRO 178 7.696 0.875 7.377
200 1HG PRO 178 HG2 PRO 178 5.795 -0.771 6.633
201 2HG PRO 178 HG1 PRO 178 6.849 -1.218 7.986
202 1HD PRO 178 HD2 PRO 178 4.016 -0.302 8.010
203 2HD PRO 178 HD1 PRO 178 4.856 -1.426 9.095
204 H LEU 179 HN LEU 179 5.486 2.998 7.481
205 HA LEU 179 HA LEU 179 5.355 5.259 7.315
206 1HB LEU 179 HB2 LEU 179 5.172 5.104 10.323
207 2HB LEU 179 HB1 LEU 179 4.679 6.462 9.330
208 HG LEU 179 HG LEU 179 3.393 3.735 9.452
209 1HD1 LEU 179 HD11 LEU 179 2.781 6.417 10.536
210 2HD1 LEU 179 HD12 LEU 179 2.426 4.818 11.189
211 3HD1 LEU 179 HD13 LEU 179 1.426 5.486 9.898
212 1HD2 LEU 179 HD21 LEU 179 3.280 5.843 7.393
213 2HD2 LEU 179 HD22 LEU 179 1.728 5.188 7.917
214 3HD2 LEU 179 HD23 LEU 179 2.966 4.112 7.268
215 H ARG 180 HN ARG 180 7.895 4.429 7.075
216 HA ARG 180 HA ARG 180 10.052 5.159 7.108
217 1HB ARG 180 HB2 ARG 180 8.761 7.643 8.256
218 2HB ARG 180 HB1 ARG 180 10.455 7.538 7.762
219 1HG ARG 180 HG2 ARG 180 9.731 8.296 5.794
220 2HG ARG 180 HG1 ARG 180 9.150 6.652 5.531
221 1HD ARG 180 HD2 ARG 180 7.418 8.332 5.066
222 2HD ARG 180 HD1 ARG 180 6.964 7.253 6.385
223 HE ARG 180 HE ARG 180 8.118 9.397 7.621
224 1HH1 ARG 180 1HH1 ARG 180 5.478 8.984 5.375
225 2HH1 ARG 180 2HH1 ARG 180 4.600 10.356 5.963
226 1HH2 ARG 180 1HH2 ARG 180 6.962 11.202 8.395
227 2HH2 ARG 180 2HH2 ARG 180 5.443 11.615 7.676
228 1HG HSL 181 HG1 HSL 181 10.512 2.455 13.580
229 2HG HSL 181 HG2 HSL 181 9.493 1.074 12.914
230 H HSL 181 HN HSL 181 9.358 3.428 9.063
231 HA HSL 181 HA HSL 181 10.839 4.466 11.538
232 1HB HSL 181 HB1 HSL 181 8.802 3.790 12.550
233 2HB HSL 181 HB2 HSL 181 8.473 2.518 11.255
Start of MODEL 42
1 1H PHE 155 HT1 PHE 155 3.044 11.843 -6.767
2 2H PHE 155 HT2 PHE 155 2.419 12.299 -8.300
3 3H PHE 155 HT3 PHE 155 3.385 13.397 -7.403
4 HA PHE 155 HA PHE 155 4.518 12.311 -9.262
5 1HB PHE 155 HB2 PHE 155 5.307 12.673 -6.518
6 2HB PHE 155 HB1 PHE 155 6.231 11.368 -7.252
7 HD1 PHE 155 HD1 PHE 155 5.247 14.912 -7.716
8 HD2 PHE 155 HD2 PHE 155 8.021 11.829 -8.668
9 HE1 PHE 155 HE1 PHE 155 6.703 16.567 -8.809
10 HE2 PHE 155 HE2 PHE 155 9.483 13.477 -9.762
11 HZ PHE 155 HZ PHE 155 8.826 15.849 -9.834
12 H LEU 156 HN LEU 156 5.216 10.460 -10.243
13 HA LEU 156 HA LEU 156 3.850 8.046 -9.613
14 1HB LEU 156 HB2 LEU 156 6.064 8.590 -11.586
15 2HB LEU 156 HB1 LEU 156 5.135 7.106 -11.506
16 HG LEU 156 HG LEU 156 3.100 8.786 -11.807
17 1HD1 LEU 156 HD11 LEU 156 5.503 10.268 -12.792
18 2HD1 LEU 156 HD12 LEU 156 4.120 10.860 -11.871
19 3HD1 LEU 156 HD13 LEU 156 3.939 10.472 -13.581
20 1HD2 LEU 156 HD21 LEU 156 4.262 6.901 -13.326
21 2HD2 LEU 156 HD22 LEU 156 4.558 8.321 -14.330
22 3HD2 LEU 156 HD23 LEU 156 2.909 7.892 -13.874
23 H GLN 157 HN GLN 157 5.405 5.962 -9.907
24 HA GLN 157 HA GLN 157 7.050 4.630 -9.066
25 1HB GLN 157 HB2 GLN 157 8.277 7.141 -8.938
26 2HB GLN 157 HB1 GLN 157 8.445 6.480 -7.318
27 1HG GLN 157 HG2 GLN 157 10.318 5.613 -8.231
28 2HG GLN 157 HG1 GLN 157 9.193 4.335 -8.691
29 1HE2 GLN 157 HE21 GLN 157 11.714 5.282 -9.919
30 2HE2 GLN 157 HE22 GLN 157 11.313 5.643 -11.560
31 H SER 158 HN SER 158 4.531 5.088 -7.908
32 HA SER 158 HA SER 158 4.931 3.830 -5.388
33 1HB SER 158 HB2 SER 158 3.337 6.316 -5.032
34 2HB SER 158 HB1 SER 158 4.383 5.467 -3.883
35 HG SER 158 HG SER 158 5.947 6.749 -4.432
36 H ASP 159 HN ASP 159 3.735 2.376 -6.809
37 HA ASP 159 HA ASP 159 1.808 1.203 -7.171
38 1HB ASP 159 HB2 ASP 159 0.986 3.082 -5.182
39 2HB ASP 159 HB1 ASP 159 -0.278 2.988 -6.404
40 H VAL 160 HN VAL 160 1.183 4.688 -7.690
41 HA VAL 160 HA VAL 160 0.633 5.860 -9.558
42 HB VAL 160 HB VAL 160 1.979 3.512 -10.639
43 1HG1 VAL 160 HG11 VAL 160 -0.079 3.238 -11.922
44 2HG1 VAL 160 HG12 VAL 160 1.245 3.774 -12.954
45 3HG1 VAL 160 HG13 VAL 160 0.010 4.922 -12.437
46 1HG2 VAL 160 HG21 VAL 160 3.239 5.092 -11.787
47 2HG2 VAL 160 HG22 VAL 160 2.779 5.926 -10.304
48 3HG2 VAL 160 HG23 VAL 160 1.924 6.267 -11.808
49 H PHE 161 HN PHE 161 -0.673 2.562 -9.577
50 HA PHE 161 HA PHE 161 -3.027 3.255 -11.014
51 1HB PHE 161 HB2 PHE 161 -3.527 1.025 -10.974
52 2HB PHE 161 HB1 PHE 161 -1.810 0.918 -10.617
53 HD1 PHE 161 HD1 PHE 161 -4.532 -0.744 -9.906
54 HD2 PHE 161 HD2 PHE 161 -1.691 1.611 -7.784
55 HE1 PHE 161 HE1 PHE 161 -5.054 -1.980 -7.845
56 HE2 PHE 161 HE2 PHE 161 -2.210 0.377 -5.718
57 HZ PHE 161 HZ PHE 161 -3.892 -1.421 -5.747
58 H PHE 162 HN PHE 162 -2.050 4.034 -7.995
59 HA PHE 162 HA PHE 162 -4.634 4.923 -7.189
60 1HB PHE 162 HB2 PHE 162 -3.761 2.376 -6.262
61 2HB PHE 162 HB1 PHE 162 -3.723 3.501 -4.909
62 HD1 PHE 162 HD1 PHE 162 -6.170 3.944 -7.602
63 HD2 PHE 162 HD2 PHE 162 -5.449 2.287 -3.747
64 HE1 PHE 162 HE1 PHE 162 -8.588 3.651 -7.280
65 HE2 PHE 162 HE2 PHE 162 -7.869 1.993 -3.420
66 HZ PHE 162 HZ PHE 162 -9.442 2.674 -5.188
67 H LEU 163 HN LEU 163 -1.739 5.718 -7.685
68 HA LEU 163 HA LEU 163 -0.678 6.672 -5.220
69 1HB LEU 163 HB2 LEU 163 0.304 6.415 -7.729
70 2HB LEU 163 HB1 LEU 163 -0.061 8.130 -7.715
71 HG LEU 163 HG LEU 163 1.516 6.912 -5.494
72 1HD1 LEU 163 HD11 LEU 163 3.577 7.392 -6.702
73 2HD1 LEU 163 HD12 LEU 163 2.643 7.881 -8.115
74 3HD1 LEU 163 HD13 LEU 163 2.608 6.204 -7.574
75 1HD2 LEU 163 HD21 LEU 163 1.239 9.649 -6.698
76 2HD2 LEU 163 HD22 LEU 163 2.520 9.231 -5.559
77 3HD2 LEU 163 HD23 LEU 163 0.831 9.123 -5.064
78 H PHE 164 HN PHE 164 -3.339 7.414 -6.940
79 HA PHE 164 HA PHE 164 -3.465 10.244 -6.805
80 1HB PHE 164 HB2 PHE 164 -5.303 7.985 -7.395
81 2HB PHE 164 HB1 PHE 164 -6.054 9.508 -6.917
82 HD1 PHE 164 HD1 PHE 164 -5.671 7.762 -9.662
83 HD2 PHE 164 HD2 PHE 164 -4.324 11.501 -8.142
84 HE1 PHE 164 HE1 PHE 164 -5.420 8.602 -11.961
85 HE2 PHE 164 HE2 PHE 164 -4.073 12.348 -10.437
86 HZ PHE 164 HZ PHE 164 -4.621 10.899 -12.351
87 H LEU 165 HN LEU 165 -5.457 7.867 -5.027
88 HA LEU 165 HA LEU 165 -6.251 9.723 -3.055
89 1HB LEU 165 HB2 LEU 165 -6.619 6.882 -3.581
90 2HB LEU 165 HB1 LEU 165 -6.513 7.243 -1.867
91 HG LEU 165 HG LEU 165 -8.834 7.221 -2.643
92 1HD1 LEU 165 HD11 LEU 165 -8.793 8.590 -0.840
93 2HD1 LEU 165 HD12 LEU 165 -9.242 9.789 -2.053
94 3HD1 LEU 165 HD13 LEU 165 -7.563 9.648 -1.530
95 1HD2 LEU 165 HD21 LEU 165 -7.739 9.090 -4.663
96 2HD2 LEU 165 HD22 LEU 165 -9.362 9.413 -4.058
97 3HD2 LEU 165 HD23 LEU 165 -8.996 7.863 -4.815
98 H LEU 166 HN LEU 166 -4.417 6.758 -2.390
99 HA LEU 166 HA LEU 166 -2.281 8.145 -1.088
100 1HB LEU 166 HB2 LEU 166 -4.638 7.433 0.415
101 2HB LEU 166 HB1 LEU 166 -3.236 6.577 1.034
102 HG LEU 166 HG LEU 166 -3.562 9.567 0.786
103 1HD1 LEU 166 HD11 LEU 166 -3.060 9.270 3.319
104 2HD1 LEU 166 HD12 LEU 166 -3.609 7.616 3.046
105 3HD1 LEU 166 HD13 LEU 166 -4.687 8.971 2.708
106 1HD2 LEU 166 HD21 LEU 166 -1.302 9.305 2.174
107 2HD2 LEU 166 HD22 LEU 166 -1.325 9.458 0.418
108 3HD2 LEU 166 HD23 LEU 166 -1.167 7.867 1.161
109 HA PRO 167 HA PRO 167 -0.993 4.033 -2.572
110 1HB PRO 167 HB2 PRO 167 1.659 4.639 -2.691
111 2HB PRO 167 HB1 PRO 167 0.507 5.027 -3.983
112 1HG PRO 167 HG2 PRO 167 1.598 6.789 -1.819
113 2HG PRO 167 HG1 PRO 167 1.334 7.154 -3.534
114 1HD PRO 167 HD2 PRO 167 -0.374 7.962 -1.601
115 2HD PRO 167 HD1 PRO 167 -0.922 7.534 -3.235
116 HA PRO 168 HA PRO 168 0.136 2.948 1.687
117 1HB PRO 168 HB2 PRO 168 -0.717 0.408 1.599
118 2HB PRO 168 HB1 PRO 168 -1.858 1.765 1.707
119 1HG PRO 168 HG2 PRO 168 -1.013 0.186 -0.702
120 2HG PRO 168 HG1 PRO 168 -2.643 0.683 -0.210
121 1HD PRO 168 HD2 PRO 168 -1.173 2.011 -2.081
122 2HD PRO 168 HD1 PRO 168 -2.381 2.803 -1.050
123 H ILE 169 HN ILE 169 2.228 3.113 -0.161
124 HA ILE 169 HA ILE 169 3.494 0.570 -0.502
125 HB ILE 169 HB ILE 169 5.521 1.983 -1.079
126 1HG1 ILE 169 HG12 ILE 169 3.536 4.244 -1.109
127 2HG1 ILE 169 HG11 ILE 169 4.594 3.952 0.265
128 1HG2 ILE 169 HG21 ILE 169 3.024 2.559 -2.664
129 2HG2 ILE 169 HG22 ILE 169 3.912 1.037 -2.722
130 3HG2 ILE 169 HG23 ILE 169 4.683 2.528 -3.258
131 1HD1 ILE 169 HD11 ILE 169 6.525 4.407 -1.005
132 2HD1 ILE 169 HD12 ILE 169 5.367 5.678 -1.396
133 3HD1 ILE 169 HD13 ILE 169 5.631 4.347 -2.522
134 H ILE 170 HN ILE 170 3.694 3.199 1.784
135 HA ILE 170 HA ILE 170 5.983 2.190 3.177
136 HB ILE 170 HB ILE 170 3.992 4.210 4.196
137 1HG1 ILE 170 HG12 ILE 170 4.632 5.089 2.098
138 2HG1 ILE 170 HG11 ILE 170 5.679 5.888 3.265
139 1HG2 ILE 170 HG21 ILE 170 6.765 3.400 4.938
140 2HG2 ILE 170 HG22 ILE 170 5.367 3.706 5.970
141 3HG2 ILE 170 HG23 ILE 170 6.230 5.055 5.231
142 1HD1 ILE 170 HD11 ILE 170 7.144 5.348 1.584
143 2HD1 ILE 170 HD12 ILE 170 6.344 3.817 1.231
144 3HD1 ILE 170 HD13 ILE 170 7.339 3.979 2.679
145 H LEU 171 HN LEU 171 2.478 2.194 3.739
146 HA LEU 171 HA LEU 171 2.574 0.968 6.286
147 1HB LEU 171 HB2 LEU 171 0.614 2.152 4.996
148 2HB LEU 171 HB1 LEU 171 0.287 0.535 4.404
149 HG LEU 171 HG LEU 171 -1.118 0.994 6.310
150 1HD1 LEU 171 HD11 LEU 171 1.018 -0.836 7.343
151 2HD1 LEU 171 HD12 LEU 171 0.011 -1.280 5.965
152 3HD1 LEU 171 HD13 LEU 171 -0.731 -0.955 7.530
153 1HD2 LEU 171 HD21 LEU 171 0.622 2.665 7.253
154 2HD2 LEU 171 HD22 LEU 171 1.278 1.253 8.081
155 3HD2 LEU 171 HD23 LEU 171 -0.387 1.751 8.374
156 H ASP 172 HN ASP 172 1.791 -0.382 3.096
157 HA ASP 172 HA ASP 172 1.989 -3.087 4.002
158 1HB ASP 172 HB2 ASP 172 1.031 -1.730 1.676
159 2HB ASP 172 HB1 ASP 172 2.187 -2.968 1.163
160 H ALA 173 HN ALA 173 4.363 -0.900 3.678
161 HA ALA 173 HA ALA 173 6.271 -2.289 2.088
162 1HB ALA 173 HB1 ALA 173 7.407 -0.388 2.315
163 2HB ALA 173 HB2 ALA 173 7.524 -0.619 4.059
164 3HB ALA 173 HB3 ALA 173 6.128 0.209 3.371
165 H GLY 174 HN GLY 174 5.679 -1.956 5.554
166 1HA GLY 174 HA2 GLY 174 7.286 -4.404 6.003
167 2HA GLY 174 HA1 GLY 174 7.253 -3.051 7.152
168 H TYR 175 HN TYR 175 4.396 -2.599 6.623
169 HA TYR 175 HA TYR 175 2.339 -3.228 7.244
170 1HB TYR 175 HB2 TYR 175 2.839 -5.428 6.188
171 2HB TYR 175 HB1 TYR 175 3.461 -5.995 7.733
172 HD1 TYR 175 HD1 TYR 175 1.938 -6.382 9.620
173 HD2 TYR 175 HD2 TYR 175 0.473 -5.226 5.797
174 HE1 TYR 175 HE1 TYR 175 -0.324 -7.081 10.283
175 HE2 TYR 175 HE2 TYR 175 -1.794 -5.922 6.448
176 HH TYR 175 HH TYR 175 -2.412 -7.738 9.295
177 H PHE 176 HN PHE 176 5.061 -3.501 9.251
178 HA PHE 176 HA PHE 176 3.451 -3.825 11.671
179 1HB PHE 176 HB2 PHE 176 5.570 -3.981 12.866
180 2HB PHE 176 HB1 PHE 176 5.583 -5.090 11.487
181 HD1 PHE 176 HD1 PHE 176 6.870 -4.481 9.446
182 HD2 PHE 176 HD2 PHE 176 7.140 -2.238 13.053
183 HE1 PHE 176 HE1 PHE 176 8.970 -3.469 8.655
184 HE2 PHE 176 HE2 PHE 176 9.240 -1.221 12.268
185 HZ PHE 176 HZ PHE 176 10.157 -1.836 10.067
186 H LEU 177 HN LEU 177 3.018 -1.571 10.088
187 HA LEU 177 HA LEU 177 2.729 0.653 10.210
188 1HB LEU 177 HB2 LEU 177 3.402 -0.016 13.048
189 2HB LEU 177 HB1 LEU 177 3.261 1.666 12.571
190 HG LEU 177 HG LEU 177 1.021 -0.145 11.839
191 1HD1 LEU 177 HD11 LEU 177 1.917 -0.378 14.368
192 2HD1 LEU 177 HD12 LEU 177 0.219 -0.509 13.910
193 3HD1 LEU 177 HD13 LEU 177 0.848 1.014 14.539
194 1HD2 LEU 177 HD21 LEU 177 0.577 1.992 11.152
195 2HD2 LEU 177 HD22 LEU 177 1.458 2.726 12.491
196 3HD2 LEU 177 HD23 LEU 177 -0.138 2.028 12.764
197 HA PRO 178 HA PRO 178 7.595 0.720 9.817
198 1HB PRO 178 HB2 PRO 178 6.405 1.361 7.124
199 2HB PRO 178 HB1 PRO 178 7.970 0.623 7.502
200 1HG PRO 178 HG2 PRO 178 5.970 -0.897 6.765
201 2HG PRO 178 HG1 PRO 178 6.973 -1.397 8.139
202 1HD PRO 178 HD2 PRO 178 4.218 -0.256 8.115
203 2HD PRO 178 HD1 PRO 178 4.942 -1.453 9.206
204 H LEU 179 HN LEU 179 5.582 2.838 7.766
205 HA LEU 179 HA LEU 179 5.468 5.100 7.589
206 1HB LEU 179 HB2 LEU 179 5.499 4.561 10.500
207 2HB LEU 179 HB1 LEU 179 5.818 6.216 10.017
208 HG LEU 179 HG LEU 179 3.453 5.886 10.524
209 1HD1 LEU 179 HD11 LEU 179 2.742 7.228 8.856
210 2HD1 LEU 179 HD12 LEU 179 3.355 6.163 7.590
211 3HD1 LEU 179 HD13 LEU 179 4.455 7.249 8.441
212 1HD2 LEU 179 HD21 LEU 179 2.067 4.457 9.090
213 2HD2 LEU 179 HD22 LEU 179 3.267 3.525 9.986
214 3HD2 LEU 179 HD23 LEU 179 3.520 3.877 8.277
215 H ARG 180 HN ARG 180 7.768 4.303 6.684
216 HA ARG 180 HA ARG 180 9.892 4.949 6.183
217 1HB ARG 180 HB2 ARG 180 9.013 7.383 7.745
218 2HB ARG 180 HB1 ARG 180 10.592 7.264 6.960
219 1HG ARG 180 HG2 ARG 180 9.700 7.383 4.848
220 2HG ARG 180 HG1 ARG 180 8.128 6.765 5.357
221 1HD ARG 180 HD2 ARG 180 9.131 9.414 6.333
222 2HD ARG 180 HD1 ARG 180 8.356 9.269 4.757
223 HE ARG 180 HE ARG 180 6.599 8.061 6.421
224 1HH1 ARG 180 1HH1 ARG 180 8.176 11.175 6.464
225 2HH1 ARG 180 2HH1 ARG 180 6.873 11.962 7.290
226 1HH2 ARG 180 1HH2 ARG 180 4.885 9.096 7.506
227 2HH2 ARG 180 2HH2 ARG 180 5.005 10.783 7.882
228 1HG HSL 181 HG1 HSL 181 10.883 0.062 10.853
229 2HG HSL 181 HG2 HSL 181 9.945 0.399 9.307
230 H HSL 181 HN HSL 181 9.887 3.035 7.880
231 HA HSL 181 HA HSL 181 11.806 3.828 10.133
232 1HB HSL 181 HB1 HSL 181 10.820 2.310 11.581
233 2HB HSL 181 HB2 HSL 181 9.356 2.421 10.463
Start of MODEL 43
1 1H PHE 155 HT1 PHE 155 -13.098 10.266 -3.093
2 2H PHE 155 HT2 PHE 155 -14.082 10.553 -4.469
3 3H PHE 155 HT3 PHE 155 -13.382 11.872 -3.624
4 HA PHE 155 HA PHE 155 -12.283 11.320 -5.714
5 1HB PHE 155 HB2 PHE 155 -9.979 11.231 -4.582
6 2HB PHE 155 HB1 PHE 155 -11.037 12.570 -4.152
7 HD1 PHE 155 HD1 PHE 155 -12.340 12.434 -1.997
8 HD2 PHE 155 HD2 PHE 155 -9.170 9.759 -2.950
9 HE1 PHE 155 HE1 PHE 155 -12.132 11.839 0.382
10 HE2 PHE 155 HE2 PHE 155 -8.957 9.159 -0.572
11 HZ PHE 155 HZ PHE 155 -10.439 10.199 1.095
12 H LEU 156 HN LEU 156 -11.716 9.764 -7.062
13 HA LEU 156 HA LEU 156 -11.832 7.023 -6.294
14 1HB LEU 156 HB2 LEU 156 -11.094 8.396 -8.870
15 2HB LEU 156 HB1 LEU 156 -11.119 6.654 -8.695
16 HG LEU 156 HG LEU 156 -13.212 8.223 -9.552
17 1HD1 LEU 156 HD11 LEU 156 -14.372 6.235 -9.755
18 2HD1 LEU 156 HD12 LEU 156 -13.706 5.573 -8.262
19 3HD1 LEU 156 HD13 LEU 156 -12.693 5.697 -9.701
20 1HD2 LEU 156 HD21 LEU 156 -13.697 9.092 -7.362
21 2HD2 LEU 156 HD22 LEU 156 -13.712 7.466 -6.677
22 3HD2 LEU 156 HD23 LEU 156 -14.961 7.952 -7.822
23 H GLN 157 HN GLN 157 -9.245 9.255 -7.205
24 HA GLN 157 HA GLN 157 -6.994 9.186 -6.871
25 1HB GLN 157 HB2 GLN 157 -7.704 8.434 -4.574
26 2HB GLN 157 HB1 GLN 157 -7.489 6.779 -5.123
27 1HG GLN 157 HG2 GLN 157 -5.580 7.715 -3.825
28 2HG GLN 157 HG1 GLN 157 -5.154 7.089 -5.416
29 1HE2 GLN 157 HE21 GLN 157 -6.256 10.136 -3.959
30 2HE2 GLN 157 HE22 GLN 157 -5.151 11.145 -4.821
31 H SER 158 HN SER 158 -8.495 7.447 -8.856
32 HA SER 158 HA SER 158 -8.108 5.805 -10.374
33 1HB SER 158 HB2 SER 158 -6.549 7.575 -11.109
34 2HB SER 158 HB1 SER 158 -5.279 6.853 -10.108
35 HG SER 158 HG SER 158 -6.489 5.848 -12.449
36 H ASP 159 HN ASP 159 -8.417 4.550 -8.155
37 HA ASP 159 HA ASP 159 -6.797 2.213 -8.450
38 1HB ASP 159 HB2 ASP 159 -6.352 4.068 -6.160
39 2HB ASP 159 HB1 ASP 159 -6.371 2.342 -5.812
40 H VAL 160 HN VAL 160 -8.618 3.688 -5.803
41 HA VAL 160 HA VAL 160 -10.576 3.160 -4.786
42 HB VAL 160 HB VAL 160 -10.964 2.250 -7.514
43 1HG1 VAL 160 HG11 VAL 160 -11.440 0.073 -6.724
44 2HG1 VAL 160 HG12 VAL 160 -13.001 0.853 -6.976
45 3HG1 VAL 160 HG13 VAL 160 -12.351 0.691 -5.345
46 1HG2 VAL 160 HG21 VAL 160 -12.720 3.643 -7.407
47 2HG2 VAL 160 HG22 VAL 160 -11.961 4.176 -5.906
48 3HG2 VAL 160 HG23 VAL 160 -13.273 2.999 -5.861
49 H PHE 161 HN PHE 161 -9.398 0.201 -6.384
50 HA PHE 161 HA PHE 161 -10.084 -1.456 -4.166
51 1HB PHE 161 HB2 PHE 161 -9.322 -3.260 -5.452
52 2HB PHE 161 HB1 PHE 161 -9.929 -2.117 -6.643
53 HD1 PHE 161 HD1 PHE 161 -7.509 -0.227 -6.516
54 HD2 PHE 161 HD2 PHE 161 -7.859 -4.454 -6.879
55 HE1 PHE 161 HE1 PHE 161 -5.345 -0.302 -7.683
56 HE2 PHE 161 HE2 PHE 161 -5.695 -4.534 -8.045
57 HZ PHE 161 HZ PHE 161 -4.435 -2.458 -8.447
58 H PHE 162 HN PHE 162 -7.953 0.818 -3.929
59 HA PHE 162 HA PHE 162 -6.402 -0.475 -1.972
60 1HB PHE 162 HB2 PHE 162 -5.417 -0.868 -4.539
61 2HB PHE 162 HB1 PHE 162 -4.418 0.421 -3.866
62 HD1 PHE 162 HD1 PHE 162 -5.949 -2.407 -2.019
63 HD2 PHE 162 HD2 PHE 162 -2.383 -0.676 -3.567
64 HE1 PHE 162 HE1 PHE 162 -4.614 -4.071 -0.794
65 HE2 PHE 162 HE2 PHE 162 -1.042 -2.337 -2.345
66 HZ PHE 162 HZ PHE 162 -2.156 -4.037 -0.956
67 H LEU 163 HN LEU 163 -7.496 2.270 -3.537
68 HA LEU 163 HA LEU 163 -5.587 4.172 -2.770
69 1HB LEU 163 HB2 LEU 163 -6.980 5.352 -4.049
70 2HB LEU 163 HB1 LEU 163 -8.224 4.131 -3.913
71 HG LEU 163 HG LEU 163 -8.886 5.211 -1.731
72 1HD1 LEU 163 HD11 LEU 163 -7.287 7.541 -2.750
73 2HD1 LEU 163 HD12 LEU 163 -6.689 6.437 -1.513
74 3HD1 LEU 163 HD13 LEU 163 -8.141 7.393 -1.216
75 1HD2 LEU 163 HD21 LEU 163 -9.854 5.578 -4.133
76 2HD2 LEU 163 HD22 LEU 163 -9.172 7.192 -3.937
77 3HD2 LEU 163 HD23 LEU 163 -10.375 6.599 -2.793
78 H PHE 164 HN PHE 164 -8.395 2.772 -1.183
79 HA PHE 164 HA PHE 164 -9.168 2.918 0.977
80 1HB PHE 164 HB2 PHE 164 -6.707 1.668 0.757
81 2HB PHE 164 HB1 PHE 164 -6.482 2.767 2.119
82 HD1 PHE 164 HD1 PHE 164 -9.493 0.868 1.032
83 HD2 PHE 164 HD2 PHE 164 -6.519 1.451 4.020
84 HE1 PHE 164 HE1 PHE 164 -10.659 -0.728 2.497
85 HE2 PHE 164 HE2 PHE 164 -7.679 -0.144 5.491
86 HZ PHE 164 HZ PHE 164 -9.751 -1.236 4.730
87 H LEU 165 HN LEU 165 -8.728 5.486 -0.130
88 HA LEU 165 HA LEU 165 -9.047 7.618 0.724
89 1HB LEU 165 HB2 LEU 165 -9.051 6.261 3.070
90 2HB LEU 165 HB1 LEU 165 -7.559 7.175 3.237
91 HG LEU 165 HG LEU 165 -9.360 8.388 4.281
92 1HD1 LEU 165 HD11 LEU 165 -7.649 9.700 3.137
93 2HD1 LEU 165 HD12 LEU 165 -9.217 10.503 3.080
94 3HD1 LEU 165 HD13 LEU 165 -8.606 9.663 1.655
95 1HD2 LEU 165 HD21 LEU 165 -11.331 7.639 3.317
96 2HD2 LEU 165 HD22 LEU 165 -10.752 7.916 1.674
97 3HD2 LEU 165 HD23 LEU 165 -11.191 9.284 2.696
98 H LEU 166 HN LEU 166 -6.070 5.844 1.146
99 HA LEU 166 HA LEU 166 -4.562 7.836 -0.226
100 1HB LEU 166 HB2 LEU 166 -4.820 8.084 2.581
101 2HB LEU 166 HB1 LEU 166 -3.185 7.519 2.271
102 HG LEU 166 HG LEU 166 -4.419 9.975 1.019
103 1HD1 LEU 166 HD11 LEU 166 -2.176 10.207 2.913
104 2HD1 LEU 166 HD12 LEU 166 -3.735 9.771 3.613
105 3HD1 LEU 166 HD13 LEU 166 -3.576 11.253 2.671
106 1HD2 LEU 166 HD21 LEU 166 -1.502 9.571 1.092
107 2HD2 LEU 166 HD22 LEU 166 -2.525 10.256 -0.171
108 3HD2 LEU 166 HD23 LEU 166 -2.399 8.506 0.010
109 HA PRO 167 HA PRO 167 -2.943 3.610 -0.822
110 1HB PRO 167 HB2 PRO 167 -1.519 4.259 -3.075
111 2HB PRO 167 HB1 PRO 167 -3.216 3.746 -3.068
112 1HG PRO 167 HG2 PRO 167 -2.068 6.504 -3.231
113 2HG PRO 167 HG1 PRO 167 -3.460 5.816 -4.087
114 1HD PRO 167 HD2 PRO 167 -3.750 7.442 -1.959
115 2HD PRO 167 HD1 PRO 167 -4.873 6.105 -2.280
116 HA PRO 168 HA PRO 168 1.005 4.808 0.982
117 1HB PRO 168 HB2 PRO 168 1.286 2.709 2.574
118 2HB PRO 168 HB1 PRO 168 -0.002 3.891 2.888
119 1HG PRO 168 HG2 PRO 168 -0.174 1.203 1.577
120 2HG PRO 168 HG1 PRO 168 -1.268 1.940 2.760
121 1HD PRO 168 HD2 PRO 168 -1.642 1.912 0.009
122 2HD PRO 168 HD1 PRO 168 -2.442 3.018 1.142
123 H ILE 169 HN ILE 169 2.841 2.873 1.640
124 HA ILE 169 HA ILE 169 3.318 0.996 -0.440
125 HB ILE 169 HB ILE 169 3.868 3.284 -1.487
126 1HG1 ILE 169 HG12 ILE 169 4.494 1.097 -2.443
127 2HG1 ILE 169 HG11 ILE 169 5.711 2.329 -2.759
128 1HG2 ILE 169 HG21 ILE 169 5.114 4.194 0.412
129 2HG2 ILE 169 HG22 ILE 169 6.085 4.168 -1.060
130 3HG2 ILE 169 HG23 ILE 169 6.346 2.951 0.189
131 1HD1 ILE 169 HD11 ILE 169 7.074 0.644 -2.123
132 2HD1 ILE 169 HD12 ILE 169 5.855 -0.103 -1.090
133 3HD1 ILE 169 HD13 ILE 169 6.738 1.316 -0.528
134 H ILE 170 HN ILE 170 4.857 3.046 1.989
135 HA ILE 170 HA ILE 170 6.833 1.085 2.697
136 HB ILE 170 HB ILE 170 6.059 3.572 4.225
137 1HG1 ILE 170 HG12 ILE 170 8.435 4.106 2.930
138 2HG1 ILE 170 HG11 ILE 170 7.527 3.210 1.716
139 1HG2 ILE 170 HG21 ILE 170 7.528 1.606 5.194
140 2HG2 ILE 170 HG22 ILE 170 7.935 3.295 5.500
141 3HG2 ILE 170 HG23 ILE 170 8.789 2.394 4.246
142 1HD1 ILE 170 HD11 ILE 170 6.975 5.416 1.295
143 2HD1 ILE 170 HD12 ILE 170 6.876 5.823 3.009
144 3HD1 ILE 170 HD13 ILE 170 5.616 4.842 2.261
145 H LEU 171 HN LEU 171 3.830 2.324 4.103
146 HA LEU 171 HA LEU 171 3.936 0.820 6.493
147 1HB LEU 171 HB2 LEU 171 1.481 1.778 5.010
148 2HB LEU 171 HB1 LEU 171 1.564 1.334 6.704
149 HG LEU 171 HG LEU 171 2.881 3.719 5.406
150 1HD1 LEU 171 HD11 LEU 171 0.488 3.339 7.161
151 2HD1 LEU 171 HD12 LEU 171 0.652 4.283 5.680
152 3HD1 LEU 171 HD13 LEU 171 1.386 4.858 7.176
153 1HD2 LEU 171 HD21 LEU 171 4.248 2.652 7.207
154 2HD2 LEU 171 HD22 LEU 171 2.911 2.951 8.318
155 3HD2 LEU 171 HD23 LEU 171 3.740 4.305 7.551
156 H ASP 172 HN ASP 172 2.074 0.314 3.521
157 HA ASP 172 HA ASP 172 1.344 -2.361 4.206
158 1HB ASP 172 HB2 ASP 172 1.022 -0.641 1.762
159 2HB ASP 172 HB1 ASP 172 0.652 -2.371 1.698
160 H ALA 173 HN ALA 173 4.285 -1.178 3.412
161 HA ALA 173 HA ALA 173 5.125 -3.012 1.401
162 1HB ALA 173 HB1 ALA 173 6.869 -1.637 1.344
163 2HB ALA 173 HB2 ALA 173 7.346 -2.161 2.960
164 3HB ALA 173 HB3 ALA 173 6.249 -0.795 2.764
165 H GLY 174 HN GLY 174 5.939 -2.745 4.852
166 1HA GLY 174 HA2 GLY 174 6.292 -5.682 4.916
167 2HA GLY 174 HA1 GLY 174 7.225 -4.553 5.917
168 H TYR 175 HN TYR 175 4.424 -3.092 6.005
169 HA TYR 175 HA TYR 175 2.614 -2.971 7.353
170 1HB TYR 175 HB2 TYR 175 1.930 -5.165 6.696
171 2HB TYR 175 HB1 TYR 175 3.143 -5.924 7.716
172 HD1 TYR 175 HD1 TYR 175 2.781 -6.205 10.081
173 HD2 TYR 175 HD2 TYR 175 -0.100 -4.202 7.675
174 HE1 TYR 175 HE1 TYR 175 1.145 -6.376 11.909
175 HE2 TYR 175 HE2 TYR 175 -1.743 -4.366 9.496
176 HH TYR 175 HH TYR 175 -0.877 -5.323 12.674
177 H PHE 176 HN PHE 176 5.674 -3.995 8.514
178 HA PHE 176 HA PHE 176 4.937 -3.454 11.294
179 1HB PHE 176 HB2 PHE 176 6.514 -5.418 10.268
180 2HB PHE 176 HB1 PHE 176 7.729 -4.194 10.664
181 HD1 PHE 176 HD1 PHE 176 8.812 -4.920 12.563
182 HD2 PHE 176 HD2 PHE 176 4.566 -5.142 12.392
183 HE1 PHE 176 HE1 PHE 176 8.759 -5.629 14.918
184 HE2 PHE 176 HE2 PHE 176 4.505 -5.852 14.747
185 HZ PHE 176 HZ PHE 176 6.603 -6.095 16.014
186 H LEU 177 HN LEU 177 6.437 -2.015 8.586
187 HA LEU 177 HA LEU 177 8.285 -0.306 9.812
188 1HB LEU 177 HB2 LEU 177 6.673 0.184 7.311
189 2HB LEU 177 HB1 LEU 177 8.140 1.027 7.772
190 HG LEU 177 HG LEU 177 7.877 -1.867 6.965
191 1HD1 LEU 177 HD11 LEU 177 7.954 -0.535 5.040
192 2HD1 LEU 177 HD12 LEU 177 9.618 -1.069 5.280
193 3HD1 LEU 177 HD13 LEU 177 9.140 0.565 5.741
194 1HD2 LEU 177 HD21 LEU 177 10.423 -1.797 7.214
195 2HD2 LEU 177 HD22 LEU 177 9.461 -1.953 8.684
196 3HD2 LEU 177 HD23 LEU 177 10.156 -0.392 8.246
197 HA PRO 178 HA PRO 178 4.331 2.797 9.738
198 1HB PRO 178 HB2 PRO 178 2.668 0.704 11.082
199 2HB PRO 178 HB1 PRO 178 2.165 2.038 10.036
200 1HG PRO 178 HG2 PRO 178 2.292 -0.433 9.078
201 2HG PRO 178 HG1 PRO 178 2.834 0.942 8.101
202 1HD PRO 178 HD2 PRO 178 4.437 -1.120 9.521
203 2HD PRO 178 HD1 PRO 178 4.785 -0.270 8.003
204 H LEU 179 HN LEU 179 3.123 3.554 11.820
205 HA LEU 179 HA LEU 179 3.148 4.127 14.020
206 1HB LEU 179 HB2 LEU 179 4.910 1.692 14.299
207 2HB LEU 179 HB1 LEU 179 4.435 2.701 15.648
208 HG LEU 179 HG LEU 179 3.009 0.784 15.617
209 1HD1 LEU 179 HD11 LEU 179 2.092 3.310 15.738
210 2HD1 LEU 179 HD12 LEU 179 1.077 1.887 15.973
211 3HD1 LEU 179 HD13 LEU 179 1.119 2.690 14.404
212 1HD2 LEU 179 HD21 LEU 179 1.820 -0.006 13.764
213 2HD2 LEU 179 HD22 LEU 179 3.419 0.379 13.127
214 3HD2 LEU 179 HD23 LEU 179 2.071 1.484 12.855
215 H ARG 180 HN ARG 180 4.277 5.912 12.923
216 HA ARG 180 HA ARG 180 5.836 7.570 13.038
217 1HB ARG 180 HB2 ARG 180 7.334 5.890 15.054
218 2HB ARG 180 HB1 ARG 180 7.414 7.642 14.830
219 1HG ARG 180 HG2 ARG 180 5.524 8.015 16.010
220 2HG ARG 180 HG1 ARG 180 4.761 6.514 15.480
221 1HD ARG 180 HD2 ARG 180 6.917 6.809 17.566
222 2HD ARG 180 HD1 ARG 180 5.225 6.400 17.848
223 HE ARG 180 HE ARG 180 6.350 4.520 16.088
224 1HH1 ARG 180 1HH1 ARG 180 6.501 5.494 19.436
225 2HH1 ARG 180 2HH1 ARG 180 6.942 3.918 20.004
226 1HH2 ARG 180 1HH2 ARG 180 6.928 2.446 16.834
227 2HH2 ARG 180 2HH2 ARG 180 7.184 2.188 18.528
228 1HG HSL 181 HG1 HSL 181 9.045 4.279 7.787
229 2HG HSL 181 HG2 HSL 181 7.340 4.289 7.094
230 H HSL 181 HN HSL 181 5.983 6.200 10.889
231 HA HSL 181 HA HSL 181 8.931 5.458 10.486
232 1HB HSL 181 HB1 HSL 181 7.940 3.447 9.737
233 2HB HSL 181 HB2 HSL 181 6.354 4.279 9.297
Start of MODEL 44
1 1H PHE 155 HT1 PHE 155 1.092 -5.486 -20.035
2 2H PHE 155 HT2 PHE 155 0.494 -5.957 -18.496
3 3H PHE 155 HT3 PHE 155 1.721 -4.762 -18.613
4 HA PHE 155 HA PHE 155 0.130 -3.407 -19.905
5 1HB PHE 155 HB2 PHE 155 -1.687 -5.595 -18.879
6 2HB PHE 155 HB1 PHE 155 -2.278 -4.041 -19.459
7 HD1 PHE 155 HD1 PHE 155 -1.360 -3.369 -21.855
8 HD2 PHE 155 HD2 PHE 155 -1.629 -7.343 -20.359
9 HE1 PHE 155 HE1 PHE 155 -1.375 -4.230 -24.159
10 HE2 PHE 155 HE2 PHE 155 -1.643 -8.212 -22.661
11 HZ PHE 155 HZ PHE 155 -1.516 -6.654 -24.565
12 H LEU 156 HN LEU 156 -1.853 -2.344 -18.527
13 HA LEU 156 HA LEU 156 -1.490 -2.390 -15.699
14 1HB LEU 156 HB2 LEU 156 -0.430 -0.082 -17.318
15 2HB LEU 156 HB1 LEU 156 -0.854 0.080 -15.627
16 HG LEU 156 HG LEU 156 1.305 -1.683 -16.775
17 1HD1 LEU 156 HD11 LEU 156 1.503 0.654 -14.891
18 2HD1 LEU 156 HD12 LEU 156 1.767 0.757 -16.631
19 3HD1 LEU 156 HD13 LEU 156 2.827 -0.240 -15.636
20 1HD2 LEU 156 HD21 LEU 156 1.821 -2.278 -14.468
21 2HD2 LEU 156 HD22 LEU 156 0.188 -2.788 -14.897
22 3HD2 LEU 156 HD23 LEU 156 0.430 -1.349 -13.909
23 H GLN 157 HN GLN 157 -2.572 -0.010 -14.955
24 HA GLN 157 HA GLN 157 -4.788 0.791 -16.550
25 1HB GLN 157 HB2 GLN 157 -5.151 -1.405 -14.619
26 2HB GLN 157 HB1 GLN 157 -6.326 -0.105 -14.485
27 1HG GLN 157 HG2 GLN 157 -6.577 -0.392 -17.041
28 2HG GLN 157 HG1 GLN 157 -5.814 -1.958 -16.770
29 1HE2 GLN 157 HE21 GLN 157 -8.243 -0.033 -15.036
30 2HE2 GLN 157 HE22 GLN 157 -9.421 -1.294 -14.941
31 H SER 158 HN SER 158 -3.711 2.766 -15.977
32 HA SER 158 HA SER 158 -3.483 4.703 -14.812
33 1HB SER 158 HB2 SER 158 -6.015 3.531 -13.776
34 2HB SER 158 HB1 SER 158 -5.308 4.868 -12.853
35 HG SER 158 HG SER 158 -5.942 6.179 -14.361
36 H ASP 159 HN ASP 159 -1.496 3.355 -14.119
37 HA ASP 159 HA ASP 159 0.093 3.078 -12.515
38 1HB ASP 159 HB2 ASP 159 -1.822 4.838 -11.247
39 2HB ASP 159 HB1 ASP 159 -1.110 3.741 -10.069
40 H VAL 160 HN VAL 160 -3.047 2.334 -11.012
41 HA VAL 160 HA VAL 160 -3.915 0.403 -10.189
42 HB VAL 160 HB VAL 160 -2.264 -0.510 -12.232
43 1HG1 VAL 160 HG11 VAL 160 -1.719 -2.147 -9.757
44 2HG1 VAL 160 HG12 VAL 160 -0.538 -1.205 -10.667
45 3HG1 VAL 160 HG13 VAL 160 -1.305 -2.608 -11.408
46 1HG2 VAL 160 HG21 VAL 160 -3.837 -2.141 -12.450
47 2HG2 VAL 160 HG22 VAL 160 -4.702 -1.046 -11.372
48 3HG2 VAL 160 HG23 VAL 160 -3.897 -2.473 -10.720
49 H PHE 161 HN PHE 161 -0.385 0.528 -9.745
50 HA PHE 161 HA PHE 161 -0.477 -0.733 -7.191
51 1HB PHE 161 HB2 PHE 161 1.498 -0.720 -8.800
52 2HB PHE 161 HB1 PHE 161 1.797 0.931 -8.269
53 HD1 PHE 161 HD1 PHE 161 0.582 -1.724 -6.020
54 HD2 PHE 161 HD2 PHE 161 3.952 0.511 -7.350
55 HE1 PHE 161 HE1 PHE 161 1.889 -2.569 -4.116
56 HE2 PHE 161 HE2 PHE 161 5.264 -0.331 -5.448
57 HZ PHE 161 HZ PHE 161 4.233 -1.873 -3.828
58 H PHE 162 HN PHE 162 -1.594 2.175 -8.085
59 HA PHE 162 HA PHE 162 -1.566 3.186 -5.402
60 1HB PHE 162 HB2 PHE 162 -0.566 5.153 -7.410
61 2HB PHE 162 HB1 PHE 162 -0.364 5.129 -5.657
62 HD1 PHE 162 HD1 PHE 162 0.933 3.963 -8.859
63 HD2 PHE 162 HD2 PHE 162 1.408 3.816 -4.634
64 HE1 PHE 162 HE1 PHE 162 3.196 3.042 -9.150
65 HE2 PHE 162 HE2 PHE 162 3.672 2.896 -4.916
66 HZ PHE 162 HZ PHE 162 4.569 2.508 -7.177
67 H LEU 163 HN LEU 163 -3.237 2.526 -8.027
68 HA LEU 163 HA LEU 163 -4.727 4.906 -8.521
69 1HB LEU 163 HB2 LEU 163 -4.594 2.913 -10.050
70 2HB LEU 163 HB1 LEU 163 -5.604 2.047 -8.909
71 HG LEU 163 HG LEU 163 -7.418 3.657 -9.281
72 1HD1 LEU 163 HD11 LEU 163 -6.951 5.067 -11.488
73 2HD1 LEU 163 HD12 LEU 163 -5.310 5.020 -10.848
74 3HD1 LEU 163 HD13 LEU 163 -6.617 5.693 -9.875
75 1HD2 LEU 163 HD21 LEU 163 -8.170 2.594 -11.129
76 2HD2 LEU 163 HD22 LEU 163 -6.739 1.600 -10.858
77 3HD2 LEU 163 HD23 LEU 163 -6.694 2.905 -12.042
78 H PHE 164 HN PHE 164 -4.433 2.956 -5.899
79 HA PHE 164 HA PHE 164 -7.127 2.829 -4.960
80 1HB PHE 164 HB2 PHE 164 -5.381 1.203 -4.339
81 2HB PHE 164 HB1 PHE 164 -4.507 2.475 -3.492
82 HD1 PHE 164 HD1 PHE 164 -8.108 1.493 -3.564
83 HD2 PHE 164 HD2 PHE 164 -4.598 2.084 -1.232
84 HE1 PHE 164 HE1 PHE 164 -9.389 1.004 -1.521
85 HE2 PHE 164 HE2 PHE 164 -5.871 1.594 0.815
86 HZ PHE 164 HZ PHE 164 -8.270 1.053 0.673
87 H LEU 165 HN LEU 165 -5.701 5.563 -5.502
88 HA LEU 165 HA LEU 165 -6.233 7.665 -4.722
89 1HB LEU 165 HB2 LEU 165 -7.916 6.181 -3.167
90 2HB LEU 165 HB1 LEU 165 -6.868 6.910 -1.957
91 HG LEU 165 HG LEU 165 -8.784 8.315 -2.213
92 1HD1 LEU 165 HD11 LEU 165 -6.661 9.692 -3.825
93 2HD1 LEU 165 HD12 LEU 165 -6.453 9.342 -2.109
94 3HD1 LEU 165 HD13 LEU 165 -7.773 10.383 -2.644
95 1HD2 LEU 165 HD21 LEU 165 -8.208 8.138 -5.160
96 2HD2 LEU 165 HD22 LEU 165 -9.274 9.356 -4.458
97 3HD2 LEU 165 HD23 LEU 165 -9.668 7.644 -4.302
98 H LEU 166 HN LEU 166 -4.306 5.384 -2.982
99 HA LEU 166 HA LEU 166 -2.350 7.422 -2.438
100 1HB LEU 166 HB2 LEU 166 -2.645 7.682 -0.228
101 2HB LEU 166 HB1 LEU 166 -4.265 7.075 -0.544
102 HG LEU 166 HG LEU 166 -3.139 4.736 -0.087
103 1HD1 LEU 166 HD11 LEU 166 -1.465 6.334 1.785
104 2HD1 LEU 166 HD12 LEU 166 -0.886 6.057 0.141
105 3HD1 LEU 166 HD13 LEU 166 -1.242 4.687 1.194
106 1HD2 LEU 166 HD21 LEU 166 -4.823 5.172 1.364
107 2HD2 LEU 166 HD22 LEU 166 -4.237 6.795 1.731
108 3HD2 LEU 166 HD23 LEU 166 -3.473 5.391 2.479
109 HA PRO 167 HA PRO 167 0.234 3.911 -3.080
110 1HB PRO 167 HB2 PRO 167 2.582 4.828 -2.137
111 2HB PRO 167 HB1 PRO 167 1.858 5.430 -3.641
112 1HG PRO 167 HG2 PRO 167 1.838 6.650 -0.904
113 2HG PRO 167 HG1 PRO 167 2.089 7.432 -2.476
114 1HD PRO 167 HD2 PRO 167 -0.292 7.475 -1.145
115 2HD PRO 167 HD1 PRO 167 -0.162 7.554 -2.914
116 HA PRO 168 HA PRO 168 0.209 2.023 1.028
117 1HB PRO 168 HB2 PRO 168 -0.259 -0.464 0.242
118 2HB PRO 168 HB1 PRO 168 -1.523 0.773 0.074
119 1HG PRO 168 HG2 PRO 168 0.343 -0.325 -2.001
120 2HG PRO 168 HG1 PRO 168 -1.392 0.013 -2.129
121 1HD PRO 168 HD2 PRO 168 0.628 1.695 -3.000
122 2HD PRO 168 HD1 PRO 168 -1.031 2.205 -2.631
123 H ILE 169 HN ILE 169 2.672 2.520 -0.728
124 HA ILE 169 HA ILE 169 4.250 0.149 -0.603
125 HB ILE 169 HB ILE 169 4.493 2.295 -2.096
126 1HG1 ILE 169 HG12 ILE 169 5.828 0.250 -2.317
127 2HG1 ILE 169 HG11 ILE 169 6.829 1.682 -2.538
128 1HG2 ILE 169 HG21 ILE 169 6.408 2.967 0.124
129 2HG2 ILE 169 HG22 ILE 169 4.879 3.798 -0.164
130 3HG2 ILE 169 HG23 ILE 169 6.159 3.859 -1.377
131 1HD1 ILE 169 HD11 ILE 169 6.905 -0.381 -0.447
132 2HD1 ILE 169 HD12 ILE 169 7.163 1.277 0.098
133 3HD1 ILE 169 HD13 ILE 169 8.204 0.584 -1.146
134 H ILE 170 HN ILE 170 3.881 2.980 1.419
135 HA ILE 170 HA ILE 170 6.062 2.385 3.163
136 HB ILE 170 HB ILE 170 3.712 4.162 3.792
137 1HG1 ILE 170 HG12 ILE 170 5.806 5.779 2.931
138 2HG1 ILE 170 HG11 ILE 170 5.791 4.454 1.772
139 1HG2 ILE 170 HG21 ILE 170 4.843 4.199 5.738
140 2HG2 ILE 170 HG22 ILE 170 5.887 5.333 4.880
141 3HG2 ILE 170 HG23 ILE 170 6.342 3.634 4.998
142 1HD1 ILE 170 HD11 ILE 170 4.120 6.717 1.868
143 2HD1 ILE 170 HD12 ILE 170 3.115 5.308 2.210
144 3HD1 ILE 170 HD13 ILE 170 4.074 5.371 0.731
145 H LEU 171 HN LEU 171 2.524 2.289 3.674
146 HA LEU 171 HA LEU 171 2.708 1.010 6.188
147 1HB LEU 171 HB2 LEU 171 0.240 0.372 5.587
148 2HB LEU 171 HB1 LEU 171 0.673 2.030 5.948
149 HG LEU 171 HG LEU 171 0.872 1.378 3.099
150 1HD1 LEU 171 HD11 LEU 171 -1.021 -0.066 3.698
151 2HD1 LEU 171 HD12 LEU 171 -1.512 1.291 2.683
152 3HD1 LEU 171 HD13 LEU 171 -1.838 1.324 4.416
153 1HD2 LEU 171 HD21 LEU 171 0.783 3.635 4.530
154 2HD2 LEU 171 HD22 LEU 171 -0.931 3.467 4.154
155 3HD2 LEU 171 HD23 LEU 171 0.254 3.540 2.851
156 H ASP 172 HN ASP 172 1.825 -0.274 2.996
157 HA ASP 172 HA ASP 172 1.817 -2.983 3.892
158 1HB ASP 172 HB2 ASP 172 0.622 -1.770 1.826
159 2HB ASP 172 HB1 ASP 172 2.057 -2.386 0.991
160 H ALA 173 HN ALA 173 4.388 -1.077 3.722
161 HA ALA 173 HA ALA 173 6.177 -2.575 2.081
162 1HB ALA 173 HB1 ALA 173 6.274 -0.146 3.495
163 2HB ALA 173 HB2 ALA 173 7.511 -0.826 2.439
164 3HB ALA 173 HB3 ALA 173 7.550 -1.158 4.170
165 H GLY 174 HN GLY 174 6.184 -2.093 5.603
166 1HA GLY 174 HA2 GLY 174 7.009 -4.919 5.899
167 2HA GLY 174 HA1 GLY 174 7.596 -3.614 6.949
168 H TYR 175 HN TYR 175 4.406 -3.108 6.106
169 HA TYR 175 HA TYR 175 2.482 -3.020 7.212
170 1HB TYR 175 HB2 TYR 175 2.419 -5.474 8.601
171 2HB TYR 175 HB1 TYR 175 1.671 -5.064 7.067
172 HD1 TYR 175 HD1 TYR 175 4.155 -7.061 8.697
173 HD2 TYR 175 HD2 TYR 175 3.014 -5.423 4.940
174 HE1 TYR 175 HE1 TYR 175 5.585 -8.703 7.552
175 HE2 TYR 175 HE2 TYR 175 4.439 -7.061 3.785
176 HH TYR 175 HH TYR 175 5.470 -9.185 4.147
177 H PHE 176 HN PHE 176 4.631 -4.774 9.430
178 HA PHE 176 HA PHE 176 3.705 -3.034 11.604
179 1HB PHE 176 HB2 PHE 176 3.520 -5.523 11.867
180 2HB PHE 176 HB1 PHE 176 5.287 -5.603 11.827
181 HD1 PHE 176 HD1 PHE 176 5.917 -6.265 13.952
182 HD2 PHE 176 HD2 PHE 176 3.048 -3.154 13.511
183 HE1 PHE 176 HE1 PHE 176 5.990 -5.860 16.378
184 HE2 PHE 176 HE2 PHE 176 3.115 -2.742 15.936
185 HZ PHE 176 HZ PHE 176 4.588 -4.097 17.373
186 H LEU 177 HN LEU 177 6.154 -3.083 9.436
187 HA LEU 177 HA LEU 177 8.338 -2.489 11.223
188 1HB LEU 177 HB2 LEU 177 8.186 -2.240 8.223
189 2HB LEU 177 HB1 LEU 177 9.643 -2.122 9.190
190 HG LEU 177 HG LEU 177 7.937 -4.582 8.805
191 1HD1 LEU 177 HD11 LEU 177 10.830 -4.352 8.122
192 2HD1 LEU 177 HD12 LEU 177 9.621 -3.694 7.018
193 3HD1 LEU 177 HD13 LEU 177 9.591 -5.406 7.440
194 1HD2 LEU 177 HD21 LEU 177 9.549 -5.747 10.184
195 2HD2 LEU 177 HD22 LEU 177 8.820 -4.426 11.098
196 3HD2 LEU 177 HD23 LEU 177 10.448 -4.252 10.442
197 HA PRO 178 HA PRO 178 7.517 1.906 9.144
198 1HB PRO 178 HB2 PRO 178 4.553 1.714 9.042
199 2HB PRO 178 HB1 PRO 178 5.673 2.465 7.899
200 1HG PRO 178 HG2 PRO 178 4.485 0.152 7.320
201 2HG PRO 178 HG1 PRO 178 6.173 0.451 6.862
202 1HD PRO 178 HD2 PRO 178 5.078 -1.176 9.123
203 2HD PRO 178 HD1 PRO 178 6.458 -1.510 8.058
204 H LEU 179 HN LEU 179 5.344 3.537 10.006
205 HA LEU 179 HA LEU 179 4.476 4.576 11.831
206 1HB LEU 179 HB2 LEU 179 5.140 2.090 13.406
207 2HB LEU 179 HB1 LEU 179 4.021 3.357 13.859
208 HG LEU 179 HG LEU 179 2.532 1.787 13.151
209 1HD1 LEU 179 HD11 LEU 179 3.135 2.754 10.386
210 2HD1 LEU 179 HD12 LEU 179 2.523 3.863 11.614
211 3HD1 LEU 179 HD13 LEU 179 1.575 2.450 11.151
212 1HD2 LEU 179 HD21 LEU 179 2.995 -0.059 11.913
213 2HD2 LEU 179 HD22 LEU 179 4.643 0.374 12.372
214 3HD2 LEU 179 HD23 LEU 179 4.024 0.820 10.781
215 H ARG 180 HN ARG 180 6.590 5.703 11.337
216 HA ARG 180 HA ARG 180 8.378 6.878 12.114
217 1HB ARG 180 HB2 ARG 180 7.645 5.790 14.841
218 2HB ARG 180 HB1 ARG 180 8.614 7.228 14.492
219 1HG ARG 180 HG2 ARG 180 5.689 6.877 13.850
220 2HG ARG 180 HG1 ARG 180 6.351 7.804 15.198
221 1HD ARG 180 HD2 ARG 180 6.720 9.574 13.899
222 2HD ARG 180 HD1 ARG 180 7.556 8.595 12.694
223 HE ARG 180 HE ARG 180 5.646 8.580 11.441
224 1HH1 ARG 180 1HH1 ARG 180 4.835 9.540 14.697
225 2HH1 ARG 180 2HH1 ARG 180 3.196 9.939 14.304
226 1HH2 ARG 180 1HH2 ARG 180 3.489 9.105 10.923
227 2HH2 ARG 180 2HH2 ARG 180 2.432 9.692 12.163
228 1HG HSL 181 HG1 HSL 181 11.402 1.641 9.010
229 2HG HSL 181 HG2 HSL 181 10.131 2.947 8.755
230 H HSL 181 HN HSL 181 9.181 4.855 10.816
231 HA HSL 181 HA HSL 181 11.249 3.402 12.550
232 1HB HSL 181 HB1 HSL 181 10.981 1.445 11.331
233 2HB HSL 181 HB2 HSL 181 9.333 2.141 10.878
Start of MODEL 45
1 1H PHE 155 HT1 PHE 155 4.775 8.667 -0.430
2 2H PHE 155 HT2 PHE 155 5.237 8.986 -2.052
3 3H PHE 155 HT3 PHE 155 5.027 7.368 -1.520
4 HA PHE 155 HA PHE 155 2.710 7.771 -1.154
5 1HB PHE 155 HB2 PHE 155 3.466 10.506 -2.188
6 2HB PHE 155 HB1 PHE 155 1.804 9.929 -2.121
7 HD1 PHE 155 HD1 PHE 155 3.651 12.175 -0.607
8 HD2 PHE 155 HD2 PHE 155 1.690 8.543 0.427
9 HE1 PHE 155 HE1 PHE 155 3.486 12.933 1.729
10 HE2 PHE 155 HE2 PHE 155 1.521 9.294 2.763
11 HZ PHE 155 HZ PHE 155 2.419 11.492 3.417
12 H LEU 156 HN LEU 156 1.686 6.643 -2.627
13 HA LEU 156 HA LEU 156 1.342 5.457 -4.539
14 1HB LEU 156 HB2 LEU 156 0.667 6.854 -6.432
15 2HB LEU 156 HB1 LEU 156 -0.020 7.397 -4.915
16 HG LEU 156 HG LEU 156 1.818 9.145 -4.848
17 1HD1 LEU 156 HD11 LEU 156 2.599 9.701 -7.245
18 2HD1 LEU 156 HD12 LEU 156 2.252 8.004 -7.578
19 3HD1 LEU 156 HD13 LEU 156 3.438 8.436 -6.348
20 1HD2 LEU 156 HD21 LEU 156 0.615 10.644 -6.305
21 2HD2 LEU 156 HD22 LEU 156 -0.524 9.601 -5.452
22 3HD2 LEU 156 HD23 LEU 156 -0.129 9.281 -7.141
23 H GLN 157 HN GLN 157 1.973 5.468 -7.075
24 HA GLN 157 HA GLN 157 4.610 6.188 -7.739
25 1HB GLN 157 HB2 GLN 157 5.279 4.501 -6.144
26 2HB GLN 157 HB1 GLN 157 4.210 3.319 -6.886
27 1HG GLN 157 HG2 GLN 157 6.454 2.854 -7.552
28 2HG GLN 157 HG1 GLN 157 5.567 3.457 -8.951
29 1HE2 GLN 157 HE21 GLN 157 8.221 3.498 -9.107
30 2HE2 GLN 157 HE22 GLN 157 8.837 5.104 -8.955
31 H SER 158 HN SER 158 3.234 3.037 -8.526
32 HA SER 158 HA SER 158 3.271 3.669 -11.318
33 1HB SER 158 HB2 SER 158 2.797 1.273 -9.658
34 2HB SER 158 HB1 SER 158 1.911 1.315 -11.192
35 HG SER 158 HG SER 158 4.029 1.833 -12.148
36 H ASP 159 HN ASP 159 1.775 5.577 -10.649
37 HA ASP 159 HA ASP 159 -0.194 6.586 -11.237
38 1HB ASP 159 HB2 ASP 159 -0.399 4.292 -12.665
39 2HB ASP 159 HB1 ASP 159 -1.772 4.111 -11.576
40 H VAL 160 HN VAL 160 -0.618 3.622 -9.318
41 HA VAL 160 HA VAL 160 -1.391 3.378 -7.182
42 HB VAL 160 HB VAL 160 -0.958 6.112 -7.197
43 1HG1 VAL 160 HG11 VAL 160 -2.879 7.100 -6.027
44 2HG1 VAL 160 HG12 VAL 160 -3.801 5.626 -6.318
45 3HG1 VAL 160 HG13 VAL 160 -3.280 6.622 -7.676
46 1HG2 VAL 160 HG21 VAL 160 -0.239 4.689 -5.437
47 2HG2 VAL 160 HG22 VAL 160 -1.899 4.269 -5.015
48 3HG2 VAL 160 HG23 VAL 160 -1.303 5.902 -4.725
49 H PHE 161 HN PHE 161 -3.473 5.443 -9.197
50 HA PHE 161 HA PHE 161 -5.885 4.210 -8.260
51 1HB PHE 161 HB2 PHE 161 -5.808 6.562 -9.016
52 2HB PHE 161 HB1 PHE 161 -5.435 6.013 -10.646
53 HD1 PHE 161 HD1 PHE 161 -7.162 5.844 -12.141
54 HD2 PHE 161 HD2 PHE 161 -7.994 5.463 -7.985
55 HE1 PHE 161 HE1 PHE 161 -9.566 5.688 -12.641
56 HE2 PHE 161 HE2 PHE 161 -10.400 5.305 -8.478
57 HZ PHE 161 HZ PHE 161 -11.188 5.418 -10.808
58 H PHE 162 HN PHE 162 -3.986 2.327 -9.333
59 HA PHE 162 HA PHE 162 -5.709 0.813 -10.962
60 1HB PHE 162 HB2 PHE 162 -3.765 2.523 -12.338
61 2HB PHE 162 HB1 PHE 162 -3.727 0.827 -12.827
62 HD1 PHE 162 HD1 PHE 162 -6.177 -0.199 -13.177
63 HD2 PHE 162 HD2 PHE 162 -5.135 3.910 -13.543
64 HE1 PHE 162 HE1 PHE 162 -8.134 0.164 -14.623
65 HE2 PHE 162 HE2 PHE 162 -7.090 4.281 -14.990
66 HZ PHE 162 HZ PHE 162 -8.593 2.407 -15.531
67 H LEU 163 HN LEU 163 -2.704 1.297 -9.349
68 HA LEU 163 HA LEU 163 -1.358 -1.058 -10.007
69 1HB LEU 163 HB2 LEU 163 -1.367 0.793 -7.674
70 2HB LEU 163 HB1 LEU 163 -0.636 -0.784 -7.443
71 HG LEU 163 HG LEU 163 0.200 0.877 -9.782
72 1HD1 LEU 163 HD11 LEU 163 0.275 1.942 -7.251
73 2HD1 LEU 163 HD12 LEU 163 1.318 2.401 -8.596
74 3HD1 LEU 163 HD13 LEU 163 1.871 1.210 -7.419
75 1HD2 LEU 163 HD21 LEU 163 0.869 -1.607 -9.006
76 2HD2 LEU 163 HD22 LEU 163 2.086 -0.679 -8.130
77 3HD2 LEU 163 HD23 LEU 163 1.960 -0.534 -9.884
78 H PHE 164 HN PHE 164 -3.854 -0.352 -7.626
79 HA PHE 164 HA PHE 164 -5.101 -1.707 -6.259
80 1HB PHE 164 HB2 PHE 164 -5.595 -2.172 -8.915
81 2HB PHE 164 HB1 PHE 164 -5.309 -3.804 -8.310
82 HD1 PHE 164 HD1 PHE 164 -6.557 -4.279 -5.981
83 HD2 PHE 164 HD2 PHE 164 -7.752 -1.424 -8.901
84 HE1 PHE 164 HE1 PHE 164 -8.859 -4.358 -5.112
85 HE2 PHE 164 HE2 PHE 164 -10.054 -1.497 -8.038
86 HZ PHE 164 HZ PHE 164 -10.611 -2.966 -6.141
87 H LEU 165 HN LEU 165 -2.656 -2.076 -5.388
88 HA LEU 165 HA LEU 165 -2.645 -4.746 -4.420
89 1HB LEU 165 HB2 LEU 165 -1.530 -4.531 -6.917
90 2HB LEU 165 HB1 LEU 165 -0.127 -4.401 -5.866
91 HG LEU 165 HG LEU 165 -0.756 -6.544 -4.801
92 1HD1 LEU 165 HD11 LEU 165 -2.949 -6.513 -6.864
93 2HD1 LEU 165 HD12 LEU 165 -3.124 -6.561 -5.110
94 3HD1 LEU 165 HD13 LEU 165 -2.454 -7.949 -5.968
95 1HD2 LEU 165 HD21 LEU 165 -0.387 -7.956 -6.918
96 2HD2 LEU 165 HD22 LEU 165 0.854 -6.786 -6.466
97 3HD2 LEU 165 HD23 LEU 165 -0.285 -6.408 -7.757
98 H LEU 166 HN LEU 166 -0.969 -1.703 -4.851
99 HA LEU 166 HA LEU 166 -0.008 -1.856 -2.130
100 1HB LEU 166 HB2 LEU 166 1.640 -2.574 -4.355
101 2HB LEU 166 HB1 LEU 166 2.275 -1.104 -3.636
102 HG LEU 166 HG LEU 166 1.885 -3.779 -2.306
103 1HD1 LEU 166 HD11 LEU 166 4.424 -2.280 -2.190
104 2HD1 LEU 166 HD12 LEU 166 3.967 -2.931 -3.764
105 3HD1 LEU 166 HD13 LEU 166 4.129 -4.009 -2.378
106 1HD2 LEU 166 HD21 LEU 166 1.396 -2.591 -0.462
107 2HD2 LEU 166 HD22 LEU 166 2.015 -1.085 -1.140
108 3HD2 LEU 166 HD23 LEU 166 3.129 -2.260 -0.441
109 HA PRO 167 HA PRO 167 -1.482 2.289 -4.090
110 1HB PRO 167 HB2 PRO 167 -2.591 2.663 -1.447
111 2HB PRO 167 HB1 PRO 167 -3.426 2.620 -3.008
112 1HG PRO 167 HG2 PRO 167 -3.171 0.528 -0.995
113 2HG PRO 167 HG1 PRO 167 -4.242 0.605 -2.399
114 1HD PRO 167 HD2 PRO 167 -2.126 -1.121 -2.168
115 2HD PRO 167 HD1 PRO 167 -2.789 -0.564 -3.717
116 HA PRO 168 HA PRO 168 1.002 4.223 -0.594
117 1HB PRO 168 HB2 PRO 168 1.481 2.980 1.695
118 2HB PRO 168 HB1 PRO 168 -0.137 3.601 1.312
119 1HG PRO 168 HG2 PRO 168 0.889 0.796 1.197
120 2HG PRO 168 HG1 PRO 168 -0.683 1.397 1.754
121 1HD PRO 168 HD2 PRO 168 -0.144 0.351 -0.779
122 2HD PRO 168 HD1 PRO 168 -1.557 1.327 -0.338
123 H ILE 169 HN ILE 169 1.931 0.774 -0.410
124 HA ILE 169 HA ILE 169 3.844 -0.276 -1.083
125 HB ILE 169 HB ILE 169 3.991 1.984 -2.608
126 1HG1 ILE 169 HG12 ILE 169 4.551 -0.335 -3.254
127 2HG1 ILE 169 HG11 ILE 169 5.741 0.826 -3.836
128 1HG2 ILE 169 HG21 ILE 169 6.697 1.855 -1.324
129 2HG2 ILE 169 HG22 ILE 169 5.456 2.961 -0.736
130 3HG2 ILE 169 HG23 ILE 169 6.035 3.087 -2.397
131 1HD1 ILE 169 HD11 ILE 169 7.190 0.223 -1.926
132 2HD1 ILE 169 HD12 ILE 169 6.865 -1.123 -3.020
133 3HD1 ILE 169 HD13 ILE 169 6.020 -1.017 -1.476
134 H ILE 170 HN ILE 170 4.090 2.576 0.941
135 HA ILE 170 HA ILE 170 6.536 1.735 2.200
136 HB ILE 170 HB ILE 170 4.633 3.894 3.103
137 1HG1 ILE 170 HG12 ILE 170 6.662 5.223 1.903
138 2HG1 ILE 170 HG11 ILE 170 6.595 3.785 0.889
139 1HG2 ILE 170 HG21 ILE 170 7.037 4.755 3.857
140 2HG2 ILE 170 HG22 ILE 170 7.347 3.020 3.904
141 3HG2 ILE 170 HG23 ILE 170 6.045 3.709 4.872
142 1HD1 ILE 170 HD11 ILE 170 3.955 4.515 1.113
143 2HD1 ILE 170 HD12 ILE 170 5.020 4.857 -0.250
144 3HD1 ILE 170 HD13 ILE 170 4.801 6.059 1.022
145 H LEU 171 HN LEU 171 3.259 2.346 3.478
146 HA LEU 171 HA LEU 171 3.734 1.000 5.926
147 1HB LEU 171 HB2 LEU 171 1.210 1.854 4.521
148 2HB LEU 171 HB1 LEU 171 1.191 1.062 6.083
149 HG LEU 171 HG LEU 171 0.984 3.542 6.192
150 1HD1 LEU 171 HD11 LEU 171 2.023 3.598 8.190
151 2HD1 LEU 171 HD12 LEU 171 3.547 2.992 7.539
152 3HD1 LEU 171 HD13 LEU 171 2.229 1.873 7.884
153 1HD2 LEU 171 HD21 LEU 171 2.518 4.013 4.300
154 2HD2 LEU 171 HD22 LEU 171 3.871 3.536 5.325
155 3HD2 LEU 171 HD23 LEU 171 2.890 4.937 5.756
156 H ASP 172 HN ASP 172 1.895 0.076 3.051
157 HA ASP 172 HA ASP 172 1.322 -2.551 3.970
158 1HB ASP 172 HB2 ASP 172 -0.115 -1.314 2.369
159 2HB ASP 172 HB1 ASP 172 1.162 -1.460 1.154
160 H ALA 173 HN ALA 173 4.239 -1.352 3.168
161 HA ALA 173 HA ALA 173 5.184 -3.344 1.356
162 1HB ALA 173 HB1 ALA 173 7.353 -2.314 2.858
163 2HB ALA 173 HB2 ALA 173 6.228 -0.985 2.577
164 3HB ALA 173 HB3 ALA 173 6.872 -1.898 1.214
165 H GLY 174 HN GLY 174 6.039 -2.706 4.744
166 1HA GLY 174 HA2 GLY 174 6.404 -5.613 5.123
167 2HA GLY 174 HA1 GLY 174 7.232 -4.357 6.066
168 H TYR 175 HN TYR 175 4.677 -2.789 6.128
169 HA TYR 175 HA TYR 175 2.780 -2.543 7.353
170 1HB TYR 175 HB2 TYR 175 2.710 -5.240 6.707
171 2HB TYR 175 HB1 TYR 175 2.558 -5.241 8.460
172 HD1 TYR 175 HD1 TYR 175 1.043 -2.689 8.832
173 HD2 TYR 175 HD2 TYR 175 0.552 -5.837 6.013
174 HE1 TYR 175 HE1 TYR 175 -1.342 -2.124 8.626
175 HE2 TYR 175 HE2 TYR 175 -1.833 -5.280 5.796
176 HH TYR 175 HH TYR 175 -3.593 -4.025 7.521
177 H PHE 176 HN PHE 176 5.574 -4.142 8.668
178 HA PHE 176 HA PHE 176 4.821 -3.455 11.399
179 1HB PHE 176 HB2 PHE 176 6.881 -5.227 10.158
180 2HB PHE 176 HB1 PHE 176 7.206 -4.559 11.764
181 HD1 PHE 176 HD1 PHE 176 6.066 -7.356 10.181
182 HD2 PHE 176 HD2 PHE 176 4.929 -4.697 13.303
183 HE1 PHE 176 HE1 PHE 176 4.691 -9.131 11.186
184 HE2 PHE 176 HE2 PHE 176 3.552 -6.467 14.315
185 HZ PHE 176 HZ PHE 176 3.432 -8.688 13.257
186 H LEU 177 HN LEU 177 6.228 -1.923 8.844
187 HA LEU 177 HA LEU 177 8.526 -0.722 9.848
188 1HB LEU 177 HB2 LEU 177 6.480 0.070 7.823
189 2HB LEU 177 HB1 LEU 177 7.681 1.247 8.317
190 HG LEU 177 HG LEU 177 8.631 -1.443 7.462
191 1HD1 LEU 177 HD11 LEU 177 8.255 -1.179 5.244
192 2HD1 LEU 177 HD12 LEU 177 8.258 0.583 5.337
193 3HD1 LEU 177 HD13 LEU 177 6.835 -0.326 5.847
194 1HD2 LEU 177 HD21 LEU 177 9.862 1.072 6.544
195 2HD2 LEU 177 HD22 LEU 177 10.608 -0.395 7.177
196 3HD2 LEU 177 HD23 LEU 177 9.900 0.783 8.282
197 HA PRO 178 HA PRO 178 5.347 2.748 11.483
198 1HB PRO 178 HB2 PRO 178 3.321 0.750 12.385
199 2HB PRO 178 HB1 PRO 178 3.086 2.393 11.776
200 1HG PRO 178 HG2 PRO 178 2.556 0.314 10.227
201 2HG PRO 178 HG1 PRO 178 3.371 1.742 9.557
202 1HD PRO 178 HD2 PRO 178 4.519 -0.911 10.329
203 2HD PRO 178 HD1 PRO 178 4.907 0.125 8.941
204 H LEU 179 HN LEU 179 3.974 2.348 13.925
205 HA LEU 179 HA LEU 179 4.195 1.730 16.126
206 1HB LEU 179 HB2 LEU 179 6.812 0.442 15.328
207 2HB LEU 179 HB1 LEU 179 6.096 0.392 16.925
208 HG LEU 179 HG LEU 179 4.213 -0.578 14.967
209 1HD1 LEU 179 HD11 LEU 179 6.126 -1.208 13.648
210 2HD1 LEU 179 HD12 LEU 179 5.422 -2.647 14.381
211 3HD1 LEU 179 HD13 LEU 179 6.895 -1.947 15.051
212 1HD2 LEU 179 HD21 LEU 179 4.542 -2.651 16.494
213 2HD2 LEU 179 HD22 LEU 179 3.813 -1.190 17.159
214 3HD2 LEU 179 HD23 LEU 179 5.509 -1.552 17.477
215 H ARG 180 HN ARG 180 4.271 3.993 16.244
216 HA ARG 180 HA ARG 180 5.082 5.915 17.136
217 1HB ARG 180 HB2 ARG 180 6.759 5.829 18.690
218 2HB ARG 180 HB1 ARG 180 6.395 4.107 18.560
219 1HG ARG 180 HG2 ARG 180 8.324 4.518 16.618
220 2HG ARG 180 HG1 ARG 180 8.838 5.554 17.950
221 1HD ARG 180 HD2 ARG 180 8.565 2.590 17.834
222 2HD ARG 180 HD1 ARG 180 9.856 3.575 18.517
223 HE ARG 180 HE ARG 180 7.421 2.723 19.830
224 1HH1 ARG 180 1HH1 ARG 180 10.145 4.911 19.887
225 2HH1 ARG 180 2HH1 ARG 180 10.031 5.204 21.589
226 1HH2 ARG 180 1HH2 ARG 180 7.273 3.112 22.069
227 2HH2 ARG 180 2HH2 ARG 180 8.402 4.184 22.827
228 1HG HSL 181 HG1 HSL 181 7.909 6.600 10.619
229 2HG HSL 181 HG2 HSL 181 6.634 5.405 10.039
230 H HSL 181 HN HSL 181 5.349 5.091 14.343
231 HA HSL 181 HA HSL 181 7.676 6.897 13.496
232 1HB HSL 181 HB1 HSL 181 8.257 4.930 12.305
233 2HB HSL 181 HB2 HSL 181 6.507 4.355 12.215
Start of MODEL 46
1 1H PHE 155 HT1 PHE 155 -13.693 0.267 -13.512
2 2H PHE 155 HT2 PHE 155 -12.771 -1.173 -13.371
3 3H PHE 155 HT3 PHE 155 -11.983 0.350 -13.438
4 HA PHE 155 HA PHE 155 -13.889 -0.351 -11.324
5 1HB PHE 155 HB2 PHE 155 -11.962 -1.017 -9.968
6 2HB PHE 155 HB1 PHE 155 -12.078 -2.028 -11.404
7 HD1 PHE 155 HD1 PHE 155 -10.029 0.219 -9.514
8 HD2 PHE 155 HD2 PHE 155 -10.565 -1.530 -13.355
9 HE1 PHE 155 HE1 PHE 155 -7.704 0.779 -10.088
10 HE2 PHE 155 HE2 PHE 155 -8.240 -0.976 -13.937
11 HZ PHE 155 HZ PHE 155 -6.806 0.181 -12.302
12 H LEU 156 HN LEU 156 -12.503 0.752 -9.275
13 HA LEU 156 HA LEU 156 -11.425 3.315 -9.900
14 1HB LEU 156 HB2 LEU 156 -14.269 3.072 -8.988
15 2HB LEU 156 HB1 LEU 156 -13.315 4.472 -8.545
16 HG LEU 156 HG LEU 156 -12.903 4.367 -11.240
17 1HD1 LEU 156 HD11 LEU 156 -14.875 2.552 -10.977
18 2HD1 LEU 156 HD12 LEU 156 -14.657 3.566 -12.403
19 3HD1 LEU 156 HD13 LEU 156 -15.825 4.026 -11.164
20 1HD2 LEU 156 HD21 LEU 156 -13.896 6.403 -11.232
21 2HD2 LEU 156 HD22 LEU 156 -13.798 6.173 -9.486
22 3HD2 LEU 156 HD23 LEU 156 -15.306 5.834 -10.337
23 H GLN 157 HN GLN 157 -10.486 4.324 -8.107
24 HA GLN 157 HA GLN 157 -10.966 3.558 -5.434
25 1HB GLN 157 HB2 GLN 157 -9.206 1.842 -6.926
26 2HB GLN 157 HB1 GLN 157 -8.298 2.655 -5.659
27 1HG GLN 157 HG2 GLN 157 -9.929 1.869 -4.004
28 2HG GLN 157 HG1 GLN 157 -10.798 1.021 -5.283
29 1HE2 GLN 157 HE21 GLN 157 -9.807 -0.768 -6.288
30 2HE2 GLN 157 HE22 GLN 157 -8.539 -1.644 -5.507
31 H SER 158 HN SER 158 -10.947 5.788 -5.182
32 HA SER 158 HA SER 158 -9.959 7.684 -4.412
33 1HB SER 158 HB2 SER 158 -8.045 6.094 -3.733
34 2HB SER 158 HB1 SER 158 -7.235 6.714 -5.183
35 HG SER 158 HG SER 158 -8.200 8.268 -3.007
36 H ASP 159 HN ASP 159 -8.277 6.500 -7.216
37 HA ASP 159 HA ASP 159 -9.231 8.590 -8.891
38 1HB ASP 159 HB2 ASP 159 -7.081 9.353 -7.383
39 2HB ASP 159 HB1 ASP 159 -6.294 8.753 -8.840
40 H VAL 160 HN VAL 160 -7.116 5.898 -8.304
41 HA VAL 160 HA VAL 160 -6.729 4.042 -9.591
42 HB VAL 160 HB VAL 160 -8.016 5.579 -11.837
43 1HG1 VAL 160 HG11 VAL 160 -6.904 4.046 -13.071
44 2HG1 VAL 160 HG12 VAL 160 -8.233 3.002 -12.567
45 3HG1 VAL 160 HG13 VAL 160 -6.694 2.948 -11.707
46 1HG2 VAL 160 HG21 VAL 160 -9.316 3.215 -10.638
47 2HG2 VAL 160 HG22 VAL 160 -10.025 4.701 -11.271
48 3HG2 VAL 160 HG23 VAL 160 -9.294 4.687 -9.665
49 H PHE 161 HN PHE 161 -6.236 7.062 -11.411
50 HA PHE 161 HA PHE 161 -3.789 6.162 -12.589
51 1HB PHE 161 HB2 PHE 161 -4.926 8.960 -12.413
52 2HB PHE 161 HB1 PHE 161 -3.619 8.439 -13.471
53 HD1 PHE 161 HD1 PHE 161 -4.057 7.305 -15.510
54 HD2 PHE 161 HD2 PHE 161 -7.228 8.170 -12.807
55 HE1 PHE 161 HE1 PHE 161 -5.696 6.727 -17.253
56 HE2 PHE 161 HE2 PHE 161 -8.872 7.592 -14.543
57 HZ PHE 161 HZ PHE 161 -8.107 6.870 -16.770
58 H PHE 162 HN PHE 162 -3.854 6.045 -9.702
59 HA PHE 162 HA PHE 162 -1.312 7.171 -9.137
60 1HB PHE 162 HB2 PHE 162 -3.758 8.525 -8.061
61 2HB PHE 162 HB1 PHE 162 -2.283 8.466 -7.090
62 HD1 PHE 162 HD1 PHE 162 -3.991 10.688 -8.821
63 HD2 PHE 162 HD2 PHE 162 -0.172 8.823 -9.025
64 HE1 PHE 162 HE1 PHE 162 -3.110 12.633 -10.045
65 HE2 PHE 162 HE2 PHE 162 0.717 10.764 -10.248
66 HZ PHE 162 HZ PHE 162 -0.754 12.672 -10.759
67 H LEU 163 HN LEU 163 -3.953 5.151 -8.424
68 HA LEU 163 HA LEU 163 -3.432 4.445 -5.759
69 1HB LEU 163 HB2 LEU 163 -5.484 3.746 -6.780
70 2HB LEU 163 HB1 LEU 163 -4.634 2.935 -8.078
71 HG LEU 163 HG LEU 163 -3.701 1.588 -5.895
72 1HD1 LEU 163 HD11 LEU 163 -5.616 3.010 -4.720
73 2HD1 LEU 163 HD12 LEU 163 -5.243 1.353 -4.246
74 3HD1 LEU 163 HD13 LEU 163 -6.603 1.677 -5.320
75 1HD2 LEU 163 HD21 LEU 163 -5.962 1.082 -7.791
76 2HD2 LEU 163 HD22 LEU 163 -5.526 -0.101 -6.559
77 3HD2 LEU 163 HD23 LEU 163 -4.344 0.381 -7.776
78 H PHE 164 HN PHE 164 -1.967 3.661 -8.803
79 HA PHE 164 HA PHE 164 -0.159 2.414 -9.397
80 1HB PHE 164 HB2 PHE 164 0.814 4.188 -7.906
81 2HB PHE 164 HB1 PHE 164 0.758 3.026 -6.583
82 HD1 PHE 164 HD1 PHE 164 3.002 2.674 -6.085
83 HD2 PHE 164 HD2 PHE 164 1.692 2.419 -10.126
84 HE1 PHE 164 HE1 PHE 164 5.209 1.808 -6.742
85 HE2 PHE 164 HE2 PHE 164 3.896 1.552 -10.790
86 HZ PHE 164 HZ PHE 164 5.658 1.245 -9.097
87 H LEU 165 HN LEU 165 -2.426 1.062 -7.958
88 HA LEU 165 HA LEU 165 -2.904 -1.157 -7.620
89 1HB LEU 165 HB2 LEU 165 -0.361 -1.367 -8.619
90 2HB LEU 165 HB1 LEU 165 -0.192 -2.085 -7.022
91 HG LEU 165 HG LEU 165 -0.656 -3.844 -8.570
92 1HD1 LEU 165 HD11 LEU 165 -3.305 -3.329 -7.261
93 2HD1 LEU 165 HD12 LEU 165 -1.871 -3.753 -6.326
94 3HD1 LEU 165 HD13 LEU 165 -2.491 -4.868 -7.544
95 1HD2 LEU 165 HD21 LEU 165 -3.280 -2.702 -9.381
96 2HD2 LEU 165 HD22 LEU 165 -2.217 -3.816 -10.240
97 3HD2 LEU 165 HD23 LEU 165 -1.820 -2.100 -10.164
98 H LEU 166 HN LEU 166 -0.897 0.757 -5.575
99 HA LEU 166 HA LEU 166 -2.210 -0.218 -3.247
100 1HB LEU 166 HB2 LEU 166 0.026 -1.652 -4.097
101 2HB LEU 166 HB1 LEU 166 0.616 -0.647 -2.781
102 HG LEU 166 HG LEU 166 -1.910 -2.020 -2.183
103 1HD1 LEU 166 HD11 LEU 166 -1.285 -4.184 -2.323
104 2HD1 LEU 166 HD12 LEU 166 0.419 -3.825 -2.038
105 3HD1 LEU 166 HD13 LEU 166 -0.279 -3.572 -3.637
106 1HD2 LEU 166 HD21 LEU 166 -0.009 -0.745 -0.751
107 2HD2 LEU 166 HD22 LEU 166 0.505 -2.421 -0.552
108 3HD2 LEU 166 HD23 LEU 166 -1.122 -1.935 -0.075
109 HA PRO 167 HA PRO 167 -1.042 4.292 -3.163
110 1HB PRO 167 HB2 PRO 167 -2.710 4.267 -0.796
111 2HB PRO 167 HB1 PRO 167 -2.962 5.120 -2.327
112 1HG PRO 167 HG2 PRO 167 -4.135 2.619 -1.390
113 2HG PRO 167 HG1 PRO 167 -4.614 3.638 -2.754
114 1HD PRO 167 HD2 PRO 167 -3.477 1.170 -3.027
115 2HD PRO 167 HD1 PRO 167 -3.335 2.459 -4.237
116 HA PRO 168 HA PRO 168 0.745 3.561 1.153
117 1HB PRO 168 HB2 PRO 168 -0.031 1.567 2.700
118 2HB PRO 168 HB1 PRO 168 -1.131 2.922 2.372
119 1HG PRO 168 HG2 PRO 168 -1.095 0.181 1.168
120 2HG PRO 168 HG1 PRO 168 -2.480 1.150 1.706
121 1HD PRO 168 HD2 PRO 168 -1.556 0.959 -0.920
122 2HD PRO 168 HD1 PRO 168 -2.618 2.233 -0.290
123 H ILE 169 HN ILE 169 2.500 3.012 -0.389
124 HA ILE 169 HA ILE 169 3.318 0.286 -0.693
125 HB ILE 169 HB ILE 169 5.466 1.347 -1.546
126 1HG1 ILE 169 HG12 ILE 169 3.829 3.868 -1.582
127 2HG1 ILE 169 HG11 ILE 169 4.936 3.506 -0.262
128 1HG2 ILE 169 HG21 ILE 169 2.955 2.228 -2.953
129 2HG2 ILE 169 HG22 ILE 169 3.526 0.560 -2.934
130 3HG2 ILE 169 HG23 ILE 169 4.512 1.821 -3.673
131 1HD1 ILE 169 HD11 ILE 169 6.462 3.108 -2.528
132 2HD1 ILE 169 HD12 ILE 169 6.495 4.520 -1.472
133 3HD1 ILE 169 HD13 ILE 169 5.481 4.521 -2.914
134 H ILE 170 HN ILE 170 4.156 2.926 1.428
135 HA ILE 170 HA ILE 170 6.452 1.677 2.580
136 HB ILE 170 HB ILE 170 4.824 3.965 3.685
137 1HG1 ILE 170 HG12 ILE 170 7.076 5.070 2.594
138 2HG1 ILE 170 HG11 ILE 170 6.722 3.787 1.442
139 1HG2 ILE 170 HG21 ILE 170 7.040 4.552 4.739
140 2HG2 ILE 170 HG22 ILE 170 7.596 2.947 4.264
141 3HG2 ILE 170 HG23 ILE 170 6.243 3.117 5.383
142 1HD1 ILE 170 HD11 ILE 170 5.414 5.330 0.495
143 2HD1 ILE 170 HD12 ILE 170 5.313 6.296 1.967
144 3HD1 ILE 170 HD13 ILE 170 4.270 4.889 1.763
145 H LEU 171 HN LEU 171 3.162 2.332 3.817
146 HA LEU 171 HA LEU 171 3.539 0.922 6.242
147 1HB LEU 171 HB2 LEU 171 0.869 1.249 4.904
148 2HB LEU 171 HB1 LEU 171 1.235 1.212 6.618
149 HG LEU 171 HG LEU 171 2.637 3.426 5.655
150 1HD1 LEU 171 HD11 LEU 171 0.129 2.979 4.148
151 2HD1 LEU 171 HD12 LEU 171 1.604 3.821 3.676
152 3HD1 LEU 171 HD13 LEU 171 0.440 4.612 4.738
153 1HD2 LEU 171 HD21 LEU 171 -0.074 3.402 6.973
154 2HD2 LEU 171 HD22 LEU 171 1.137 4.684 7.039
155 3HD2 LEU 171 HD23 LEU 171 1.449 3.134 7.821
156 H ASP 172 HN ASP 172 1.906 0.042 3.224
157 HA ASP 172 HA ASP 172 1.463 -2.665 4.011
158 1HB ASP 172 HB2 ASP 172 0.281 -1.093 2.187
159 2HB ASP 172 HB1 ASP 172 1.422 -1.941 1.131
160 H ALA 173 HN ALA 173 4.305 -1.200 3.371
161 HA ALA 173 HA ALA 173 5.485 -3.006 1.510
162 1HB ALA 173 HB1 ALA 173 7.121 -1.499 1.544
163 2HB ALA 173 HB2 ALA 173 7.454 -1.853 3.239
164 3HB ALA 173 HB3 ALA 173 6.262 -0.627 2.810
165 H GLY 174 HN GLY 174 6.085 -2.521 4.983
166 1HA GLY 174 HA2 GLY 174 6.672 -5.411 5.203
167 2HA GLY 174 HA1 GLY 174 7.412 -4.164 6.223
168 H TYR 175 HN TYR 175 4.493 -2.971 6.033
169 HA TYR 175 HA TYR 175 2.570 -2.991 7.227
170 1HB TYR 175 HB2 TYR 175 2.581 -5.464 6.562
171 2HB TYR 175 HB1 TYR 175 3.211 -5.781 8.175
172 HD1 TYR 175 HD1 TYR 175 0.300 -5.623 6.269
173 HD2 TYR 175 HD2 TYR 175 1.799 -4.579 10.112
174 HE1 TYR 175 HE1 TYR 175 -1.992 -5.625 7.157
175 HE2 TYR 175 HE2 TYR 175 -0.490 -4.579 11.011
176 HH TYR 175 HH TYR 175 -2.792 -4.325 10.186
177 H PHE 176 HN PHE 176 5.058 -4.792 9.079
178 HA PHE 176 HA PHE 176 4.266 -3.327 11.470
179 1HB PHE 176 HB2 PHE 176 5.258 -4.994 12.729
180 2HB PHE 176 HB1 PHE 176 4.748 -5.894 11.296
181 HD1 PHE 176 HD1 PHE 176 7.062 -6.245 13.489
182 HD2 PHE 176 HD2 PHE 176 6.911 -5.066 9.403
183 HE1 PHE 176 HE1 PHE 176 9.372 -7.032 13.179
184 HE2 PHE 176 HE2 PHE 176 9.218 -5.854 9.086
185 HZ PHE 176 HZ PHE 176 10.452 -6.839 10.975
186 H LEU 177 HN LEU 177 5.858 -2.152 9.167
187 HA LEU 177 HA LEU 177 8.402 -1.557 10.439
188 1HB LEU 177 HB2 LEU 177 7.459 -0.204 7.946
189 2HB LEU 177 HB1 LEU 177 9.089 -0.618 8.434
190 HG LEU 177 HG LEU 177 6.988 -2.558 7.474
191 1HD1 LEU 177 HD11 LEU 177 7.720 -1.454 5.572
192 2HD1 LEU 177 HD12 LEU 177 8.800 -2.846 5.657
193 3HD1 LEU 177 HD13 LEU 177 9.360 -1.262 6.192
194 1HD2 LEU 177 HD21 LEU 177 8.331 -4.284 8.023
195 2HD2 LEU 177 HD22 LEU 177 8.936 -3.155 9.236
196 3HD2 LEU 177 HD23 LEU 177 9.809 -3.371 7.718
197 HA PRO 178 HA PRO 178 6.207 2.857 10.240
198 1HB PRO 178 HB2 PRO 178 3.420 1.894 10.615
199 2HB PRO 178 HB1 PRO 178 4.025 3.242 9.645
200 1HG PRO 178 HG2 PRO 178 3.220 0.991 8.478
201 2HG PRO 178 HG1 PRO 178 4.645 1.865 7.880
202 1HD PRO 178 HD2 PRO 178 4.502 -0.613 9.552
203 2HD PRO 178 HD1 PRO 178 5.607 -0.213 8.222
204 H LEU 179 HN LEU 179 5.378 0.073 12.142
205 HA LEU 179 HA LEU 179 4.506 1.495 14.458
206 1HB LEU 179 HB2 LEU 179 5.334 -1.344 13.937
207 2HB LEU 179 HB1 LEU 179 4.994 -0.784 15.564
208 HG LEU 179 HG LEU 179 2.708 -0.185 14.885
209 1HD1 LEU 179 HD11 LEU 179 2.723 0.344 12.649
210 2HD1 LEU 179 HD12 LEU 179 2.025 -1.277 12.615
211 3HD1 LEU 179 HD13 LEU 179 3.727 -1.040 12.216
212 1HD2 LEU 179 HD21 LEU 179 1.890 -2.503 14.514
213 2HD2 LEU 179 HD22 LEU 179 3.044 -2.360 15.839
214 3HD2 LEU 179 HD23 LEU 179 3.563 -3.012 14.285
215 H ARG 180 HN ARG 180 7.525 1.180 13.077
216 HA ARG 180 HA ARG 180 8.804 2.132 15.503
217 1HB ARG 180 HB2 ARG 180 9.525 -0.440 14.122
218 2HB ARG 180 HB1 ARG 180 10.761 0.498 14.969
219 1HG ARG 180 HG2 ARG 180 10.153 -0.453 16.869
220 2HG ARG 180 HG1 ARG 180 8.554 0.276 16.714
221 1HD ARG 180 HD2 ARG 180 8.443 -1.862 14.980
222 2HD ARG 180 HD1 ARG 180 9.403 -2.484 16.321
223 HE ARG 180 HE ARG 180 6.604 -1.833 16.345
224 1HH1 ARG 180 1HH1 ARG 180 9.465 -2.233 18.302
225 2HH1 ARG 180 2HH1 ARG 180 8.578 -2.568 19.751
226 1HH2 ARG 180 1HH2 ARG 180 5.436 -2.274 18.250
227 2HH2 ARG 180 2HH2 ARG 180 6.291 -2.591 19.722
228 1HG HSL 181 HG1 HSL 181 10.099 5.980 9.748
229 2HG HSL 181 HG2 HSL 181 8.296 6.354 9.798
230 H HSL 181 HN HSL 181 8.072 3.563 13.312
231 HA HSL 181 HA HSL 181 10.723 4.095 11.869
232 1HB HSL 181 HB1 HSL 181 9.323 3.723 9.993
233 2HB HSL 181 HB2 HSL 181 7.807 4.255 10.902
Start of MODEL 47
1 1H PHE 155 HT1 PHE 155 1.561 17.847 4.508
2 2H PHE 155 HT2 PHE 155 2.481 17.424 5.893
3 3H PHE 155 HT3 PHE 155 0.857 16.893 5.746
4 HA PHE 155 HA PHE 155 2.640 15.235 5.288
5 1HB PHE 155 HB2 PHE 155 1.329 14.325 3.378
6 2HB PHE 155 HB1 PHE 155 0.312 14.891 4.699
7 HD1 PHE 155 HD1 PHE 155 -0.630 17.285 4.486
8 HD2 PHE 155 HD2 PHE 155 0.930 15.047 1.221
9 HE1 PHE 155 HE1 PHE 155 -1.875 18.713 2.917
10 HE2 PHE 155 HE2 PHE 155 -0.311 16.472 -0.355
11 HZ PHE 155 HZ PHE 155 -1.717 18.308 0.494
12 H LEU 156 HN LEU 156 4.316 14.619 4.023
13 HA LEU 156 HA LEU 156 4.883 15.745 1.484
14 1HB LEU 156 HB2 LEU 156 6.828 17.026 1.992
15 2HB LEU 156 HB1 LEU 156 5.514 17.616 2.991
16 HG LEU 156 HG LEU 156 7.485 15.629 4.075
17 1HD1 LEU 156 HD11 LEU 156 7.852 18.552 3.622
18 2HD1 LEU 156 HD12 LEU 156 9.017 17.235 3.487
19 3HD1 LEU 156 HD13 LEU 156 8.518 17.812 5.078
20 1HD2 LEU 156 HD21 LEU 156 6.402 17.741 5.777
21 2HD2 LEU 156 HD22 LEU 156 6.488 16.000 6.042
22 3HD2 LEU 156 HD23 LEU 156 5.170 16.682 5.091
23 H GLN 157 HN GLN 157 6.067 14.014 4.314
24 HA GLN 157 HA GLN 157 8.153 12.639 2.927
25 1HB GLN 157 HB2 GLN 157 8.266 11.258 4.989
26 2HB GLN 157 HB1 GLN 157 8.350 12.986 5.300
27 1HG GLN 157 HG2 GLN 157 6.622 12.860 6.667
28 2HG GLN 157 HG1 GLN 157 5.622 12.174 5.388
29 1HE2 GLN 157 HE21 GLN 157 8.086 11.289 7.768
30 2HE2 GLN 157 HE22 GLN 157 7.457 9.714 8.094
31 H SER 158 HN SER 158 4.992 12.384 2.369
32 HA SER 158 HA SER 158 4.556 9.578 2.556
33 1HB SER 158 HB2 SER 158 2.680 11.145 2.608
34 2HB SER 158 HB1 SER 158 3.073 11.690 0.969
35 HG SER 158 HG SER 158 1.909 9.301 1.834
36 H ASP 159 HN ASP 159 6.800 9.385 1.452
37 HA ASP 159 HA ASP 159 7.976 8.427 -0.225
38 1HB ASP 159 HB2 ASP 159 5.176 8.075 -1.173
39 2HB ASP 159 HB1 ASP 159 6.470 7.839 -2.343
40 H VAL 160 HN VAL 160 5.496 10.350 -1.849
41 HA VAL 160 HA VAL 160 5.602 12.165 -3.217
42 HB VAL 160 HB VAL 160 7.594 12.653 -1.363
43 1HG1 VAL 160 HG11 VAL 160 9.312 11.941 -2.989
44 2HG1 VAL 160 HG12 VAL 160 9.460 13.638 -2.538
45 3HG1 VAL 160 HG13 VAL 160 8.756 13.198 -4.092
46 1HG2 VAL 160 HG21 VAL 160 7.518 14.999 -2.572
47 2HG2 VAL 160 HG22 VAL 160 6.130 14.368 -1.684
48 3HG2 VAL 160 HG23 VAL 160 6.185 14.237 -3.442
49 H PHE 161 HN PHE 161 8.459 10.087 -3.419
50 HA PHE 161 HA PHE 161 9.025 10.674 -6.141
51 1HB PHE 161 HB2 PHE 161 10.437 8.533 -5.939
52 2HB PHE 161 HB1 PHE 161 10.877 9.901 -4.922
53 HD1 PHE 161 HD1 PHE 161 8.557 6.975 -4.741
54 HD2 PHE 161 HD2 PHE 161 11.467 9.382 -2.779
55 HE1 PHE 161 HE1 PHE 161 8.393 5.541 -2.747
56 HE2 PHE 161 HE2 PHE 161 11.310 7.952 -0.783
57 HZ PHE 161 HZ PHE 161 9.772 6.029 -0.766
58 H PHE 162 HN PHE 162 6.536 9.012 -4.744
59 HA PHE 162 HA PHE 162 5.680 7.929 -7.236
60 1HB PHE 162 HB2 PHE 162 6.534 6.074 -5.024
61 2HB PHE 162 HB1 PHE 162 5.339 5.606 -6.239
62 HD1 PHE 162 HD1 PHE 162 6.315 6.582 -8.713
63 HD2 PHE 162 HD2 PHE 162 8.525 5.006 -5.435
64 HE1 PHE 162 HE1 PHE 162 8.118 5.923 -10.252
65 HE2 PHE 162 HE2 PHE 162 10.334 4.346 -6.968
66 HZ PHE 162 HZ PHE 162 10.132 4.805 -9.379
67 H LEU 163 HN LEU 163 4.920 9.739 -4.945
68 HA LEU 163 HA LEU 163 2.652 8.623 -3.645
69 1HB LEU 163 HB2 LEU 163 3.847 10.672 -2.883
70 2HB LEU 163 HB1 LEU 163 3.260 11.512 -4.302
71 HG LEU 163 HG LEU 163 0.948 10.555 -3.154
72 1HD1 LEU 163 HD11 LEU 163 2.336 9.928 -1.166
73 2HD1 LEU 163 HD12 LEU 163 1.011 11.041 -0.827
74 3HD1 LEU 163 HD13 LEU 163 2.663 11.646 -0.939
75 1HD2 LEU 163 HD21 LEU 163 0.709 12.675 -3.890
76 2HD2 LEU 163 HD22 LEU 163 2.338 13.141 -3.400
77 3HD2 LEU 163 HD23 LEU 163 1.043 13.074 -2.205
78 H PHE 164 HN PHE 164 3.369 9.443 -6.779
79 HA PHE 164 HA PHE 164 0.766 10.284 -7.679
80 1HB PHE 164 HB2 PHE 164 3.475 10.004 -8.745
81 2HB PHE 164 HB1 PHE 164 2.231 9.556 -9.905
82 HD1 PHE 164 HD1 PHE 164 2.076 12.178 -7.277
83 HD2 PHE 164 HD2 PHE 164 2.276 11.303 -11.438
84 HE1 PHE 164 HE1 PHE 164 1.694 14.554 -7.793
85 HE2 PHE 164 HE2 PHE 164 1.896 13.677 -11.960
86 HZ PHE 164 HZ PHE 164 1.604 15.306 -10.136
87 H LEU 165 HN LEU 165 0.886 7.621 -6.360
88 HA LEU 165 HA LEU 165 -0.688 6.188 -8.237
89 1HB LEU 165 HB2 LEU 165 2.084 5.809 -8.483
90 2HB LEU 165 HB1 LEU 165 1.462 4.364 -7.700
91 HG LEU 165 HG LEU 165 0.544 5.493 -10.351
92 1HD1 LEU 165 HD11 LEU 165 1.473 3.346 -11.211
93 2HD1 LEU 165 HD12 LEU 165 2.179 3.073 -9.618
94 3HD1 LEU 165 HD13 LEU 165 2.685 4.462 -10.581
95 1HD2 LEU 165 HD21 LEU 165 -0.278 2.796 -9.516
96 2HD2 LEU 165 HD22 LEU 165 -1.177 4.045 -10.378
97 3HD2 LEU 165 HD23 LEU 165 -1.023 4.123 -8.623
98 H LEU 166 HN LEU 166 1.438 5.768 -5.418
99 HA LEU 166 HA LEU 166 -0.768 4.723 -3.884
100 1HB LEU 166 HB2 LEU 166 -0.264 2.691 -4.901
101 2HB LEU 166 HB1 LEU 166 1.456 3.014 -4.923
102 HG LEU 166 HG LEU 166 0.868 2.888 -2.213
103 1HD1 LEU 166 HD11 LEU 166 -0.273 0.601 -2.129
104 2HD1 LEU 166 HD12 LEU 166 -0.857 0.981 -3.749
105 3HD1 LEU 166 HD13 LEU 166 -1.289 2.020 -2.392
106 1HD2 LEU 166 HD21 LEU 166 1.661 0.369 -3.513
107 2HD2 LEU 166 HD22 LEU 166 2.446 1.284 -2.227
108 3HD2 LEU 166 HD23 LEU 166 2.641 1.782 -3.907
109 HA PRO 167 HA PRO 167 2.187 7.138 -1.364
110 1HB PRO 167 HB2 PRO 167 0.254 7.876 0.459
111 2HB PRO 167 HB1 PRO 167 0.731 8.810 -0.966
112 1HG PRO 167 HG2 PRO 167 -1.642 7.092 -0.535
113 2HG PRO 167 HG1 PRO 167 -1.457 8.529 -1.548
114 1HD PRO 167 HD2 PRO 167 -1.526 5.958 -2.510
115 2HD PRO 167 HD1 PRO 167 -0.755 7.318 -3.346
116 HA PRO 168 HA PRO 168 1.252 4.311 2.292
117 1HB PRO 168 HB2 PRO 168 -0.649 2.496 2.234
118 2HB PRO 168 HB1 PRO 168 -1.068 4.218 2.344
119 1HG PRO 168 HG2 PRO 168 -1.089 2.427 -0.061
120 2HG PRO 168 HG1 PRO 168 -2.322 3.581 0.480
121 1HD PRO 168 HD2 PRO 168 -0.383 4.122 -1.418
122 2HD PRO 168 HD1 PRO 168 -1.241 5.344 -0.470
123 H ILE 169 HN ILE 169 3.015 3.768 0.167
124 HA ILE 169 HA ILE 169 3.045 0.951 -0.403
125 HB ILE 169 HB ILE 169 4.080 2.920 -1.772
126 1HG1 ILE 169 HG12 ILE 169 5.783 0.452 -1.483
127 2HG1 ILE 169 HG11 ILE 169 4.169 0.384 -2.182
128 1HG2 ILE 169 HG21 ILE 169 5.531 3.585 0.209
129 2HG2 ILE 169 HG22 ILE 169 6.320 3.487 -1.366
130 3HG2 ILE 169 HG23 ILE 169 6.523 2.184 -0.195
131 1HD1 ILE 169 HD11 ILE 169 5.304 0.673 -4.097
132 2HD1 ILE 169 HD12 ILE 169 6.676 1.439 -3.296
133 3HD1 ILE 169 HD13 ILE 169 5.222 2.376 -3.642
134 H ILE 170 HN ILE 170 4.627 3.119 1.816
135 HA ILE 170 HA ILE 170 6.520 1.292 2.857
136 HB ILE 170 HB ILE 170 5.433 3.656 4.362
137 1HG1 ILE 170 HG12 ILE 170 5.913 4.541 2.189
138 2HG1 ILE 170 HG11 ILE 170 7.257 4.977 3.236
139 1HG2 ILE 170 HG21 ILE 170 7.229 1.822 5.136
140 2HG2 ILE 170 HG22 ILE 170 7.273 3.503 5.662
141 3HG2 ILE 170 HG23 ILE 170 8.303 2.969 4.334
142 1HD1 ILE 170 HD11 ILE 170 8.704 3.495 2.204
143 2HD1 ILE 170 HD12 ILE 170 7.747 4.127 0.865
144 3HD1 ILE 170 HD13 ILE 170 7.393 2.532 1.525
145 H LEU 171 HN LEU 171 3.246 2.219 3.830
146 HA LEU 171 HA LEU 171 3.243 0.825 6.295
147 1HB LEU 171 HB2 LEU 171 0.957 1.542 4.450
148 2HB LEU 171 HB1 LEU 171 0.759 0.912 6.074
149 HG LEU 171 HG LEU 171 2.027 3.550 5.337
150 1HD1 LEU 171 HD11 LEU 171 0.004 4.267 6.842
151 2HD1 LEU 171 HD12 LEU 171 -0.669 2.731 6.298
152 3HD1 LEU 171 HD13 LEU 171 -0.215 3.962 5.119
153 1HD2 LEU 171 HD21 LEU 171 1.960 1.977 7.840
154 2HD2 LEU 171 HD22 LEU 171 1.642 3.705 7.978
155 3HD2 LEU 171 HD23 LEU 171 3.151 3.141 7.260
156 H ASP 172 HN ASP 172 1.796 -0.012 3.166
157 HA ASP 172 HA ASP 172 1.395 -2.750 3.881
158 1HB ASP 172 HB2 ASP 172 1.102 -1.191 1.320
159 2HB ASP 172 HB1 ASP 172 0.901 -2.949 1.362
160 H ALA 173 HN ALA 173 4.184 -1.131 3.239
161 HA ALA 173 HA ALA 173 5.457 -2.915 1.416
162 1HB ALA 173 HB1 ALA 173 6.256 -0.601 3.043
163 2HB ALA 173 HB2 ALA 173 6.678 -1.021 1.384
164 3HB ALA 173 HB3 ALA 173 7.531 -1.776 2.729
165 H GLY 174 HN GLY 174 5.995 -2.310 4.877
166 1HA GLY 174 HA2 GLY 174 6.808 -5.139 5.165
167 2HA GLY 174 HA1 GLY 174 7.443 -3.812 6.157
168 H TYR 175 HN TYR 175 4.447 -2.850 5.972
169 HA TYR 175 HA TYR 175 2.540 -3.002 7.184
170 1HB TYR 175 HB2 TYR 175 2.652 -5.452 6.557
171 2HB TYR 175 HB1 TYR 175 3.432 -5.735 8.110
172 HD1 TYR 175 HD1 TYR 175 0.598 -3.467 7.276
173 HD2 TYR 175 HD2 TYR 175 1.877 -6.963 9.338
174 HE1 TYR 175 HE1 TYR 175 -1.607 -3.634 8.349
175 HE2 TYR 175 HE2 TYR 175 -0.327 -7.140 10.414
176 HH TYR 175 HH TYR 175 -2.734 -6.338 9.828
177 H PHE 176 HN PHE 176 5.229 -4.511 9.004
178 HA PHE 176 HA PHE 176 4.334 -3.117 11.400
179 1HB PHE 176 HB2 PHE 176 5.442 -4.693 12.618
180 2HB PHE 176 HB1 PHE 176 5.278 -5.621 11.122
181 HD1 PHE 176 HD1 PHE 176 7.507 -4.554 13.598
182 HD2 PHE 176 HD2 PHE 176 7.263 -5.276 9.411
183 HE1 PHE 176 HE1 PHE 176 9.953 -4.806 13.503
184 HE2 PHE 176 HE2 PHE 176 9.708 -5.530 9.307
185 HZ PHE 176 HZ PHE 176 11.057 -5.294 11.355
186 H LEU 177 HN LEU 177 6.357 -2.507 8.819
187 HA LEU 177 HA LEU 177 8.641 -1.374 9.881
188 1HB LEU 177 HB2 LEU 177 7.021 -0.838 7.430
189 2HB LEU 177 HB1 LEU 177 8.340 0.245 7.830
190 HG LEU 177 HG LEU 177 8.558 -2.721 7.329
191 1HD1 LEU 177 HD11 LEU 177 9.654 -2.162 5.309
192 2HD1 LEU 177 HD12 LEU 177 9.734 -0.455 5.741
193 3HD1 LEU 177 HD13 LEU 177 8.180 -1.195 5.356
194 1HD2 LEU 177 HD21 LEU 177 11.057 -2.098 7.371
195 2HD2 LEU 177 HD22 LEU 177 10.216 -2.298 8.908
196 3HD2 LEU 177 HD23 LEU 177 10.536 -0.682 8.281
197 HA PRO 178 HA PRO 178 5.991 2.810 10.166
198 1HB PRO 178 HB2 PRO 178 3.498 1.470 11.104
199 2HB PRO 178 HB1 PRO 178 3.691 2.912 10.099
200 1HG PRO 178 HG2 PRO 178 2.957 0.607 9.008
201 2HG PRO 178 HG1 PRO 178 4.109 1.672 8.177
202 1HD PRO 178 HD2 PRO 178 4.619 -0.842 9.713
203 2HD PRO 178 HD1 PRO 178 5.375 -0.263 8.216
204 H LEU 179 HN LEU 179 4.419 3.415 12.331
205 HA LEU 179 HA LEU 179 4.367 3.589 14.598
206 1HB LEU 179 HB2 LEU 179 5.039 0.811 14.168
207 2HB LEU 179 HB1 LEU 179 5.862 1.425 15.589
208 HG LEU 179 HG LEU 179 3.804 0.464 16.306
209 1HD1 LEU 179 HD11 LEU 179 4.554 2.846 17.093
210 2HD1 LEU 179 HD12 LEU 179 2.999 2.183 17.596
211 3HD1 LEU 179 HD13 LEU 179 3.073 3.352 16.279
212 1HD2 LEU 179 HD21 LEU 179 2.721 1.870 13.935
213 2HD2 LEU 179 HD22 LEU 179 1.667 1.722 15.341
214 3HD2 LEU 179 HD23 LEU 179 2.337 0.276 14.585
215 H ARG 180 HN ARG 180 5.883 5.320 13.859
216 HA ARG 180 HA ARG 180 7.687 6.633 14.317
217 1HB ARG 180 HB2 ARG 180 8.578 4.531 16.293
218 2HB ARG 180 HB1 ARG 180 8.968 6.254 16.294
219 1HG ARG 180 HG2 ARG 180 6.115 5.428 16.513
220 2HG ARG 180 HG1 ARG 180 7.166 5.260 17.920
221 1HD ARG 180 HD2 ARG 180 5.890 7.429 17.745
222 2HD ARG 180 HD1 ARG 180 7.631 7.577 17.967
223 HE ARG 180 HE ARG 180 6.117 8.183 15.540
224 1HH1 ARG 180 1HH1 ARG 180 9.211 8.028 17.165
225 2HH1 ARG 180 2HH1 ARG 180 10.002 9.046 16.011
226 1HH2 ARG 180 1HH2 ARG 180 7.164 9.517 14.030
227 2HH2 ARG 180 2HH2 ARG 180 8.843 9.891 14.234
228 1HG HSL 181 HG1 HSL 181 9.245 3.866 8.306
229 2HG HSL 181 HG2 HSL 181 7.901 4.733 9.217
230 H HSL 181 HN HSL 181 7.928 5.477 12.055
231 HA HSL 181 HA HSL 181 10.729 4.235 11.967
232 1HB HSL 181 HB1 HSL 181 10.110 2.808 10.243
233 2HB HSL 181 HB2 HSL 181 8.395 3.056 10.877
Start of MODEL 48
1 1H PHE 155 HT1 PHE 155 -3.267 2.977 -6.359
2 2H PHE 155 HT2 PHE 155 -1.890 3.035 -7.381
3 3H PHE 155 HT3 PHE 155 -1.763 2.375 -5.803
4 HA PHE 155 HA PHE 155 -3.517 1.274 -7.884
5 1HB PHE 155 HB2 PHE 155 -0.624 0.727 -7.230
6 2HB PHE 155 HB1 PHE 155 -1.637 -0.464 -8.038
7 HD1 PHE 155 HD1 PHE 155 0.037 2.772 -8.350
8 HD2 PHE 155 HD2 PHE 155 -2.354 -0.148 -10.318
9 HE1 PHE 155 HE1 PHE 155 0.522 3.839 -10.514
10 HE2 PHE 155 HE2 PHE 155 -1.873 0.912 -12.485
11 HZ PHE 155 HZ PHE 155 -0.433 2.908 -12.585
12 H LEU 156 HN LEU 156 -4.682 -0.435 -7.190
13 HA LEU 156 HA LEU 156 -5.709 -1.852 -5.743
14 1HB LEU 156 HB2 LEU 156 -2.819 -2.183 -4.994
15 2HB LEU 156 HB1 LEU 156 -4.077 -3.100 -4.188
16 HG LEU 156 HG LEU 156 -4.107 -3.203 -7.140
17 1HD1 LEU 156 HD11 LEU 156 -2.204 -4.409 -7.479
18 2HD1 LEU 156 HD12 LEU 156 -2.136 -4.983 -5.813
19 3HD1 LEU 156 HD13 LEU 156 -1.643 -3.334 -6.197
20 1HD2 LEU 156 HD21 LEU 156 -5.641 -4.661 -6.336
21 2HD2 LEU 156 HD22 LEU 156 -4.775 -4.905 -4.818
22 3HD2 LEU 156 HD23 LEU 156 -4.241 -5.734 -6.281
23 H GLN 157 HN GLN 157 -3.301 -1.198 -3.282
24 HA GLN 157 HA GLN 157 -3.491 -0.365 -1.174
25 1HB GLN 157 HB2 GLN 157 -5.345 1.732 -2.245
26 2HB GLN 157 HB1 GLN 157 -4.084 1.885 -1.032
27 1HG GLN 157 HG2 GLN 157 -2.472 1.358 -2.978
28 2HG GLN 157 HG1 GLN 157 -3.836 1.794 -4.005
29 1HE2 GLN 157 HE21 GLN 157 -3.940 3.836 -4.582
30 2HE2 GLN 157 HE22 GLN 157 -3.246 5.174 -3.736
31 H SER 158 HN SER 158 -5.612 -2.246 -2.188
32 HA SER 158 HA SER 158 -7.320 -3.353 -1.198
33 1HB SER 158 HB2 SER 158 -6.313 -2.295 0.959
34 2HB SER 158 HB1 SER 158 -7.713 -1.213 0.863
35 HG SER 158 HG SER 158 -8.792 -2.772 1.745
36 H ASP 159 HN ASP 159 -7.501 -0.252 -2.376
37 HA ASP 159 HA ASP 159 -10.122 -0.608 -3.394
38 1HB ASP 159 HB2 ASP 159 -10.175 0.379 -0.851
39 2HB ASP 159 HB1 ASP 159 -10.087 1.870 -1.782
40 H VAL 160 HN VAL 160 -7.482 1.524 -2.599
41 HA VAL 160 HA VAL 160 -6.154 2.788 -3.949
42 HB VAL 160 HB VAL 160 -7.432 1.274 -5.866
43 1HG1 VAL 160 HG11 VAL 160 -7.822 4.173 -6.604
44 2HG1 VAL 160 HG12 VAL 160 -9.093 2.982 -6.333
45 3HG1 VAL 160 HG13 VAL 160 -7.996 2.803 -7.699
46 1HG2 VAL 160 HG21 VAL 160 -5.008 2.332 -5.518
47 2HG2 VAL 160 HG22 VAL 160 -5.575 3.358 -6.835
48 3HG2 VAL 160 HG23 VAL 160 -5.527 1.608 -7.039
49 H PHE 161 HN PHE 161 -9.627 3.413 -4.538
50 HA PHE 161 HA PHE 161 -9.281 6.224 -4.801
51 1HB PHE 161 HB2 PHE 161 -11.306 4.559 -5.404
52 2HB PHE 161 HB1 PHE 161 -11.895 5.165 -3.861
53 HD1 PHE 161 HD1 PHE 161 -10.417 7.940 -4.398
54 HD2 PHE 161 HD2 PHE 161 -13.229 5.557 -6.528
55 HE1 PHE 161 HE1 PHE 161 -11.271 9.957 -5.519
56 HE2 PHE 161 HE2 PHE 161 -14.086 7.570 -7.653
57 HZ PHE 161 HZ PHE 161 -13.107 9.773 -7.149
58 H PHE 162 HN PHE 162 -10.036 4.080 -2.148
59 HA PHE 162 HA PHE 162 -10.614 6.104 -0.227
60 1HB PHE 162 HB2 PHE 162 -10.263 3.188 -0.299
61 2HB PHE 162 HB1 PHE 162 -9.911 3.954 1.251
62 HD1 PHE 162 HD1 PHE 162 -11.895 6.105 1.331
63 HD2 PHE 162 HD2 PHE 162 -12.274 2.081 0.003
64 HE1 PHE 162 HE1 PHE 162 -14.301 6.168 1.843
65 HE2 PHE 162 HE2 PHE 162 -14.681 2.136 0.511
66 HZ PHE 162 HZ PHE 162 -15.697 4.181 1.432
67 H LEU 163 HN LEU 163 -7.921 3.810 -0.425
68 HA LEU 163 HA LEU 163 -6.255 5.140 1.429
69 1HB LEU 163 HB2 LEU 163 -6.228 2.712 0.556
70 2HB LEU 163 HB1 LEU 163 -5.300 3.365 -0.780
71 HG LEU 163 HG LEU 163 -3.421 3.714 0.510
72 1HD1 LEU 163 HD11 LEU 163 -4.189 5.180 2.172
73 2HD1 LEU 163 HD12 LEU 163 -3.541 3.797 3.053
74 3HD1 LEU 163 HD13 LEU 163 -5.283 3.974 2.850
75 1HD2 LEU 163 HD21 LEU 163 -3.657 1.756 2.405
76 2HD2 LEU 163 HD22 LEU 163 -3.217 1.498 0.717
77 3HD2 LEU 163 HD23 LEU 163 -4.892 1.298 1.233
78 H PHE 164 HN PHE 164 -7.190 6.114 -1.514
79 HA PHE 164 HA PHE 164 -4.833 7.010 -2.752
80 1HB PHE 164 HB2 PHE 164 -6.402 7.141 -4.350
81 2HB PHE 164 HB1 PHE 164 -7.695 7.106 -3.154
82 HD1 PHE 164 HD1 PHE 164 -5.587 9.222 -5.259
83 HD2 PHE 164 HD2 PHE 164 -8.670 9.169 -2.327
84 HE1 PHE 164 HE1 PHE 164 -6.106 11.573 -5.769
85 HE2 PHE 164 HE2 PHE 164 -9.195 11.519 -2.831
86 HZ PHE 164 HZ PHE 164 -7.912 12.724 -4.555
87 H LEU 165 HN LEU 165 -6.491 8.149 -0.002
88 HA LEU 165 HA LEU 165 -6.019 10.929 -0.209
89 1HB LEU 165 HB2 LEU 165 -7.206 9.231 1.635
90 2HB LEU 165 HB1 LEU 165 -5.815 9.871 2.497
91 HG LEU 165 HG LEU 165 -7.697 11.262 2.991
92 1HD1 LEU 165 HD11 LEU 165 -5.365 12.243 2.203
93 2HD1 LEU 165 HD12 LEU 165 -6.716 13.285 2.648
94 3HD1 LEU 165 HD13 LEU 165 -6.377 12.959 0.948
95 1HD2 LEU 165 HD21 LEU 165 -8.860 12.489 1.119
96 2HD2 LEU 165 HD22 LEU 165 -9.208 10.764 1.240
97 3HD2 LEU 165 HD23 LEU 165 -8.089 11.354 0.011
98 H LEU 166 HN LEU 166 -4.159 8.226 0.999
99 HA LEU 166 HA LEU 166 -1.681 9.630 0.680
100 1HB LEU 166 HB2 LEU 166 -1.903 10.561 2.752
101 2HB LEU 166 HB1 LEU 166 -2.968 9.294 3.328
102 HG LEU 166 HG LEU 166 -0.186 8.428 2.892
103 1HD1 LEU 166 HD11 LEU 166 0.372 9.501 5.196
104 2HD1 LEU 166 HD12 LEU 166 -0.852 10.682 4.731
105 3HD1 LEU 166 HD13 LEU 166 0.570 10.440 3.717
106 1HD2 LEU 166 HD21 LEU 166 -1.501 8.198 5.514
107 2HD2 LEU 166 HD22 LEU 166 -0.683 6.977 4.541
108 3HD2 LEU 166 HD23 LEU 166 -2.346 7.431 4.170
109 HA PRO 167 HA PRO 167 -1.387 5.163 -0.241
110 1HB PRO 167 HB2 PRO 167 0.993 5.436 -1.608
111 2HB PRO 167 HB1 PRO 167 -0.620 5.569 -2.335
112 1HG PRO 167 HG2 PRO 167 1.243 7.730 -1.436
113 2HG PRO 167 HG1 PRO 167 0.207 7.666 -2.874
114 1HD PRO 167 HD2 PRO 167 -0.473 9.103 -0.711
115 2HD PRO 167 HD1 PRO 167 -1.694 8.258 -1.685
116 HA PRO 168 HA PRO 168 1.578 4.565 3.108
117 1HB PRO 168 HB2 PRO 168 0.575 2.288 4.029
118 2HB PRO 168 HB1 PRO 168 -0.327 3.804 4.226
119 1HG PRO 168 HG2 PRO 168 -0.708 1.618 2.211
120 2HG PRO 168 HG1 PRO 168 -1.930 2.508 3.136
121 1HD PRO 168 HD2 PRO 168 -1.191 3.077 0.533
122 2HD PRO 168 HD1 PRO 168 -1.959 4.230 1.642
123 H ILE 169 HN ILE 169 3.357 4.233 1.638
124 HA ILE 169 HA ILE 169 3.742 1.743 0.286
125 HB ILE 169 HB ILE 169 4.785 4.042 -0.252
126 1HG1 ILE 169 HG12 ILE 169 6.737 2.973 -1.303
127 2HG1 ILE 169 HG11 ILE 169 6.508 1.557 -0.281
128 1HG2 ILE 169 HG21 ILE 169 6.953 4.508 0.692
129 2HG2 ILE 169 HG22 ILE 169 6.856 3.063 1.699
130 3HG2 ILE 169 HG23 ILE 169 5.753 4.410 1.981
131 1HD1 ILE 169 HD11 ILE 169 4.377 2.526 -2.152
132 2HD1 ILE 169 HD12 ILE 169 4.540 0.944 -1.390
133 3HD1 ILE 169 HD13 ILE 169 5.658 1.428 -2.666
134 H ILE 170 HN ILE 170 4.891 3.154 3.272
135 HA ILE 170 HA ILE 170 6.636 1.040 4.009
136 HB ILE 170 HB ILE 170 5.383 2.913 5.992
137 1HG1 ILE 170 HG12 ILE 170 7.732 4.143 5.200
138 2HG1 ILE 170 HG11 ILE 170 7.028 3.612 3.675
139 1HG2 ILE 170 HG21 ILE 170 8.165 1.775 5.787
140 2HG2 ILE 170 HG22 ILE 170 6.866 1.094 6.766
141 3HG2 ILE 170 HG23 ILE 170 7.495 2.700 7.131
142 1HD1 ILE 170 HD11 ILE 170 6.328 5.843 5.303
143 2HD1 ILE 170 HD12 ILE 170 4.941 4.762 5.165
144 3HD1 ILE 170 HD13 ILE 170 5.720 5.389 3.711
145 H LEU 171 HN LEU 171 3.281 1.874 4.802
146 HA LEU 171 HA LEU 171 2.915 -0.207 6.702
147 1HB LEU 171 HB2 LEU 171 1.428 1.938 5.883
148 2HB LEU 171 HB1 LEU 171 0.559 0.613 5.133
149 HG LEU 171 HG LEU 171 1.192 0.785 8.080
150 1HD1 LEU 171 HD11 LEU 171 -1.586 1.003 7.131
151 2HD1 LEU 171 HD12 LEU 171 -0.554 2.398 6.811
152 3HD1 LEU 171 HD13 LEU 171 -0.768 1.821 8.464
153 1HD2 LEU 171 HD21 LEU 171 -0.829 -0.936 7.917
154 2HD2 LEU 171 HD22 LEU 171 0.855 -1.444 7.800
155 3HD2 LEU 171 HD23 LEU 171 -0.105 -1.229 6.336
156 H ASP 172 HN ASP 172 2.086 0.135 3.282
157 HA ASP 172 HA ASP 172 1.276 -2.592 2.987
158 1HB ASP 172 HB2 ASP 172 1.897 -0.415 0.977
159 2HB ASP 172 HB1 ASP 172 1.362 -2.038 0.518
160 H ALA 173 HN ALA 173 4.261 -1.117 3.345
161 HA ALA 173 HA ALA 173 5.795 -2.693 1.535
162 1HB ALA 173 HB1 ALA 173 6.392 -0.767 3.689
163 2HB ALA 173 HB2 ALA 173 7.011 -0.849 2.044
164 3HB ALA 173 HB3 ALA 173 7.652 -1.928 3.283
165 H GLY 174 HN GLY 174 5.744 -2.623 5.089
166 1HA GLY 174 HA2 GLY 174 6.132 -5.557 5.078
167 2HA GLY 174 HA1 GLY 174 6.970 -4.488 6.217
168 H TYR 175 HN TYR 175 4.237 -2.934 6.165
169 HA TYR 175 HA TYR 175 2.253 -2.918 7.293
170 1HB TYR 175 HB2 TYR 175 2.162 -5.383 6.491
171 2HB TYR 175 HB1 TYR 175 2.635 -5.775 8.140
172 HD1 TYR 175 HD1 TYR 175 0.860 -6.488 9.421
173 HD2 TYR 175 HD2 TYR 175 0.204 -3.393 6.578
174 HE1 TYR 175 HE1 TYR 175 -1.490 -6.346 10.128
175 HE2 TYR 175 HE2 TYR 175 -2.148 -3.240 7.278
176 HH TYR 175 HH TYR 175 -3.785 -5.392 8.708
177 H PHE 176 HN PHE 176 5.244 -3.698 8.652
178 HA PHE 176 HA PHE 176 4.303 -2.762 11.264
179 1HB PHE 176 HB2 PHE 176 5.850 -4.390 12.373
180 2HB PHE 176 HB1 PHE 176 4.480 -5.144 11.547
181 HD1 PHE 176 HD1 PHE 176 8.104 -4.606 11.498
182 HD2 PHE 176 HD2 PHE 176 4.806 -6.507 9.595
183 HE1 PHE 176 HE1 PHE 176 9.661 -6.025 10.228
184 HE2 PHE 176 HE2 PHE 176 6.357 -7.930 8.322
185 HZ PHE 176 HZ PHE 176 8.787 -7.691 8.637
186 H LEU 177 HN LEU 177 6.088 -1.978 8.765
187 HA LEU 177 HA LEU 177 8.545 -1.262 10.133
188 1HB LEU 177 HB2 LEU 177 7.666 -0.776 7.289
189 2HB LEU 177 HB1 LEU 177 9.259 -0.422 7.933
190 HG LEU 177 HG LEU 177 8.016 -3.155 7.620
191 1HD1 LEU 177 HD11 LEU 177 9.802 -3.521 6.016
192 2HD1 LEU 177 HD12 LEU 177 10.397 -1.882 6.280
193 3HD1 LEU 177 HD13 LEU 177 8.818 -2.138 5.540
194 1HD2 LEU 177 HD21 LEU 177 10.575 -3.659 8.224
195 2HD2 LEU 177 HD22 LEU 177 9.293 -3.598 9.434
196 3HD2 LEU 177 HD23 LEU 177 10.334 -2.197 9.181
197 HA PRO 178 HA PRO 178 6.356 3.057 8.721
198 1HB PRO 178 HB2 PRO 178 3.862 2.148 10.120
199 2HB PRO 178 HB1 PRO 178 4.052 3.329 8.820
200 1HG PRO 178 HG2 PRO 178 3.217 0.876 8.280
201 2HG PRO 178 HG1 PRO 178 4.370 1.690 7.206
202 1HD PRO 178 HD2 PRO 178 4.823 -0.512 9.151
203 2HD PRO 178 HD1 PRO 178 5.648 -0.176 7.616
204 H LEU 179 HN LEU 179 4.631 2.000 11.644
205 HA LEU 179 HA LEU 179 4.767 2.718 13.798
206 1HB LEU 179 HB2 LEU 179 7.567 2.195 12.970
207 2HB LEU 179 HB1 LEU 179 7.342 3.088 14.461
208 HG LEU 179 HG LEU 179 5.742 0.617 14.189
209 1HD1 LEU 179 HD11 LEU 179 8.251 0.328 13.325
210 2HD1 LEU 179 HD12 LEU 179 7.411 -0.909 14.261
211 3HD1 LEU 179 HD13 LEU 179 8.535 0.192 15.061
212 1HD2 LEU 179 HD21 LEU 179 5.485 1.594 16.252
213 2HD2 LEU 179 HD22 LEU 179 7.157 2.154 16.317
214 3HD2 LEU 179 HD23 LEU 179 6.787 0.450 16.582
215 H ARG 180 HN ARG 180 4.031 4.708 12.207
216 HA ARG 180 HA ARG 180 3.819 6.970 12.091
217 1HB ARG 180 HB2 ARG 180 5.510 6.792 14.588
218 2HB ARG 180 HB1 ARG 180 4.897 8.323 13.951
219 1HG ARG 180 HG2 ARG 180 3.019 7.998 15.069
220 2HG ARG 180 HG1 ARG 180 2.698 6.569 14.083
221 1HD ARG 180 HD2 ARG 180 4.619 6.221 16.298
222 2HD ARG 180 HD1 ARG 180 2.943 6.515 16.764
223 HE ARG 180 HE ARG 180 3.129 4.507 14.758
224 1HH1 ARG 180 1HH1 ARG 180 3.565 5.065 18.175
225 2HH1 ARG 180 2HH1 ARG 180 3.254 3.418 18.611
226 1HH2 ARG 180 1HH2 ARG 180 2.718 2.340 15.331
227 2HH2 ARG 180 2HH2 ARG 180 2.774 1.871 16.997
228 1HG HSL 181 HG1 HSL 181 9.506 6.875 7.961
229 2HG HSL 181 HG2 HSL 181 8.738 5.359 7.254
230 H HSL 181 HN HSL 181 5.502 5.849 10.332
231 HA HSL 181 HA HSL 181 7.853 7.809 10.169
232 1HB HSL 181 HB1 HSL 181 9.048 5.770 10.038
233 2HB HSL 181 HB2 HSL 181 7.604 4.862 9.332
Start of MODEL 49
1 1H PHE 155 HT1 PHE 155 -12.652 11.630 -2.208
2 2H PHE 155 HT2 PHE 155 -11.793 12.955 -1.534
3 3H PHE 155 HT3 PHE 155 -11.122 11.377 -1.480
4 HA PHE 155 HA PHE 155 -11.628 13.005 -3.878
5 1HB PHE 155 HB2 PHE 155 -9.052 12.073 -2.587
6 2HB PHE 155 HB1 PHE 155 -9.194 13.096 -4.013
7 HD1 PHE 155 HD1 PHE 155 -11.298 14.974 -3.171
8 HD2 PHE 155 HD2 PHE 155 -7.979 13.403 -1.021
9 HE1 PHE 155 HE1 PHE 155 -11.284 16.974 -1.739
10 HE2 PHE 155 HE2 PHE 155 -7.959 15.400 0.416
11 HZ PHE 155 HZ PHE 155 -9.613 17.190 0.057
12 H LEU 156 HN LEU 156 -9.744 11.861 -5.457
13 HA LEU 156 HA LEU 156 -9.898 9.015 -5.472
14 1HB LEU 156 HB2 LEU 156 -11.194 8.781 -7.516
15 2HB LEU 156 HB1 LEU 156 -12.137 9.557 -6.259
16 HG LEU 156 HG LEU 156 -11.319 11.765 -7.437
17 1HD1 LEU 156 HD11 LEU 156 -10.802 9.618 -9.436
18 2HD1 LEU 156 HD12 LEU 156 -9.903 11.101 -9.111
19 3HD1 LEU 156 HD13 LEU 156 -11.432 11.171 -9.987
20 1HD2 LEU 156 HD21 LEU 156 -13.657 10.434 -7.311
21 2HD2 LEU 156 HD22 LEU 156 -13.377 10.408 -9.052
22 3HD2 LEU 156 HD23 LEU 156 -13.436 11.946 -8.191
23 H GLN 157 HN GLN 157 -7.994 11.360 -5.780
24 HA GLN 157 HA GLN 157 -6.970 11.151 -8.451
25 1HB GLN 157 HB2 GLN 157 -6.606 12.880 -6.222
26 2HB GLN 157 HB1 GLN 157 -5.029 12.229 -6.647
27 1HG GLN 157 HG2 GLN 157 -6.633 13.149 -8.921
28 2HG GLN 157 HG1 GLN 157 -6.162 14.409 -7.782
29 1HE2 GLN 157 HE21 GLN 157 -4.638 11.516 -9.172
30 2HE2 GLN 157 HE22 GLN 157 -3.178 12.307 -9.650
31 H SER 158 HN SER 158 -6.297 9.753 -5.321
32 HA SER 158 HA SER 158 -3.858 8.506 -6.154
33 1HB SER 158 HB2 SER 158 -4.686 9.242 -3.749
34 2HB SER 158 HB1 SER 158 -5.313 7.586 -3.719
35 HG SER 158 HG SER 158 -3.348 7.071 -3.196
36 H ASP 159 HN ASP 159 -6.085 7.774 -7.832
37 HA ASP 159 HA ASP 159 -6.748 5.899 -8.942
38 1HB ASP 159 HB2 ASP 159 -4.529 4.987 -7.457
39 2HB ASP 159 HB1 ASP 159 -5.798 3.786 -7.236
40 H VAL 160 HN VAL 160 -7.442 6.469 -5.661
41 HA VAL 160 HA VAL 160 -9.463 6.320 -4.604
42 HB VAL 160 HB VAL 160 -10.221 4.337 -6.733
43 1HG1 VAL 160 HG11 VAL 160 -11.640 3.787 -5.001
44 2HG1 VAL 160 HG12 VAL 160 -12.571 5.031 -5.835
45 3HG1 VAL 160 HG13 VAL 160 -11.675 5.434 -4.371
46 1HG2 VAL 160 HG21 VAL 160 -10.636 7.283 -6.442
47 2HG2 VAL 160 HG22 VAL 160 -11.750 6.300 -7.392
48 3HG2 VAL 160 HG23 VAL 160 -10.044 6.378 -7.834
49 H PHE 161 HN PHE 161 -8.199 3.210 -5.811
50 HA PHE 161 HA PHE 161 -9.072 1.693 -3.593
51 1HB PHE 161 HB2 PHE 161 -8.110 1.019 -5.993
52 2HB PHE 161 HB1 PHE 161 -6.628 0.843 -5.058
53 HD1 PHE 161 HD1 PHE 161 -9.695 -0.675 -6.022
54 HD2 PHE 161 HD2 PHE 161 -6.719 -0.645 -2.980
55 HE1 PHE 161 HE1 PHE 161 -10.436 -2.900 -5.280
56 HE2 PHE 161 HE2 PHE 161 -7.454 -2.871 -2.234
57 HZ PHE 161 HZ PHE 161 -9.314 -4.002 -3.384
58 H PHE 162 HN PHE 162 -6.183 3.555 -4.206
59 HA PHE 162 HA PHE 162 -4.611 2.549 -2.078
60 1HB PHE 162 HB2 PHE 162 -4.476 4.620 -4.067
61 2HB PHE 162 HB1 PHE 162 -3.838 5.183 -2.524
62 HD1 PHE 162 HD1 PHE 162 -1.629 4.750 -2.005
63 HD2 PHE 162 HD2 PHE 162 -3.600 2.298 -4.871
64 HE1 PHE 162 HE1 PHE 162 0.491 3.591 -2.466
65 HE2 PHE 162 HE2 PHE 162 -1.485 1.134 -5.336
66 HZ PHE 162 HZ PHE 162 0.565 1.780 -4.134
67 H LEU 163 HN LEU 163 -6.376 5.617 -2.398
68 HA LEU 163 HA LEU 163 -6.120 6.364 0.327
69 1HB LEU 163 HB2 LEU 163 -7.846 7.207 -1.963
70 2HB LEU 163 HB1 LEU 163 -8.190 7.809 -0.354
71 HG LEU 163 HG LEU 163 -5.484 8.126 -1.636
72 1HD1 LEU 163 HD11 LEU 163 -6.953 9.219 -3.141
73 2HD1 LEU 163 HD12 LEU 163 -6.248 10.472 -2.119
74 3HD1 LEU 163 HD13 LEU 163 -7.894 9.916 -1.822
75 1HD2 LEU 163 HD21 LEU 163 -5.152 8.623 0.560
76 2HD2 LEU 163 HD22 LEU 163 -6.833 9.092 0.823
77 3HD2 LEU 163 HD23 LEU 163 -5.728 10.196 0.006
78 H PHE 164 HN PHE 164 -7.749 3.908 -1.078
79 HA PHE 164 HA PHE 164 -10.212 3.901 0.342
80 1HB PHE 164 HB2 PHE 164 -9.205 2.660 -1.872
81 2HB PHE 164 HB1 PHE 164 -9.144 1.358 -0.690
82 HD1 PHE 164 HD1 PHE 164 -11.308 3.489 -2.689
83 HD2 PHE 164 HD2 PHE 164 -11.191 0.509 0.346
84 HE1 PHE 164 HE1 PHE 164 -13.706 3.056 -3.028
85 HE2 PHE 164 HE2 PHE 164 -13.588 0.071 0.014
86 HZ PHE 164 HZ PHE 164 -14.848 1.344 -1.676
87 H LEU 165 HN LEU 165 -7.169 3.535 1.505
88 HA LEU 165 HA LEU 165 -7.991 2.384 3.943
89 1HB LEU 165 HB2 LEU 165 -7.434 0.484 1.991
90 2HB LEU 165 HB1 LEU 165 -5.970 0.554 2.960
91 HG LEU 165 HG LEU 165 -7.327 0.127 4.989
92 1HD1 LEU 165 HD11 LEU 165 -9.586 -0.336 3.049
93 2HD1 LEU 165 HD12 LEU 165 -9.449 1.045 4.137
94 3HD1 LEU 165 HD13 LEU 165 -9.628 -0.581 4.794
95 1HD2 LEU 165 HD21 LEU 165 -7.130 -2.098 4.722
96 2HD2 LEU 165 HD22 LEU 165 -6.398 -1.653 3.180
97 3HD2 LEU 165 HD23 LEU 165 -8.100 -2.114 3.249
98 H LEU 166 HN LEU 166 -5.311 3.023 1.738
99 HA LEU 166 HA LEU 166 -3.929 4.458 3.810
100 1HB LEU 166 HB2 LEU 166 -2.238 3.025 4.271
101 2HB LEU 166 HB1 LEU 166 -3.467 1.841 3.856
102 HG LEU 166 HG LEU 166 -1.444 2.847 1.856
103 1HD1 LEU 166 HD11 LEU 166 -0.512 0.441 2.360
104 2HD1 LEU 166 HD12 LEU 166 -1.223 0.747 3.945
105 3HD1 LEU 166 HD13 LEU 166 0.003 1.839 3.302
106 1HD2 LEU 166 HD21 LEU 166 -2.801 1.747 0.470
107 2HD2 LEU 166 HD22 LEU 166 -3.711 1.031 1.801
108 3HD2 LEU 166 HD23 LEU 166 -2.221 0.271 1.241
109 HA PRO 167 HA PRO 167 -2.887 6.586 0.033
110 1HB PRO 167 HB2 PRO 167 -1.438 8.591 1.165
111 2HB PRO 167 HB1 PRO 167 -3.210 8.560 1.110
112 1HG PRO 167 HG2 PRO 167 -1.365 7.881 3.353
113 2HG PRO 167 HG1 PRO 167 -2.934 8.702 3.395
114 1HD PRO 167 HD2 PRO 167 -2.583 6.076 4.062
115 2HD PRO 167 HD1 PRO 167 -4.102 6.735 3.427
116 HA PRO 168 HA PRO 168 1.788 5.995 0.478
117 1HB PRO 168 HB2 PRO 168 2.834 4.687 2.499
118 2HB PRO 168 HB1 PRO 168 2.169 6.314 2.746
119 1HG PRO 168 HG2 PRO 168 0.896 3.659 3.328
120 2HG PRO 168 HG1 PRO 168 1.028 5.083 4.380
121 1HD PRO 168 HD2 PRO 168 -1.167 4.505 2.841
122 2HD PRO 168 HD1 PRO 168 -0.725 6.135 3.372
123 H ILE 169 HN ILE 169 3.269 3.673 1.174
124 HA ILE 169 HA ILE 169 1.922 1.347 0.132
125 HB ILE 169 HB ILE 169 2.673 2.823 -1.859
126 1HG1 ILE 169 HG12 ILE 169 3.273 0.822 -3.174
127 2HG1 ILE 169 HG11 ILE 169 3.534 -0.070 -1.678
128 1HG2 ILE 169 HG21 ILE 169 4.913 3.317 -0.971
129 2HG2 ILE 169 HG22 ILE 169 4.962 2.588 -2.577
130 3HG2 ILE 169 HG23 ILE 169 5.338 1.615 -1.156
131 1HD1 ILE 169 HD11 ILE 169 1.318 -0.307 -1.275
132 2HD1 ILE 169 HD12 ILE 169 1.270 -0.205 -3.035
133 3HD1 ILE 169 HD13 ILE 169 0.896 1.215 -2.059
134 H ILE 170 HN ILE 170 4.910 2.947 1.006
135 HA ILE 170 HA ILE 170 6.420 0.614 1.549
136 HB ILE 170 HB ILE 170 6.831 3.335 2.787
137 1HG1 ILE 170 HG12 ILE 170 8.595 3.089 0.650
138 2HG1 ILE 170 HG11 ILE 170 7.074 2.473 0.012
139 1HG2 ILE 170 HG21 ILE 170 9.101 2.676 3.067
140 2HG2 ILE 170 HG22 ILE 170 8.858 1.214 2.112
141 3HG2 ILE 170 HG23 ILE 170 8.096 1.371 3.695
142 1HD1 ILE 170 HD11 ILE 170 7.172 5.079 1.472
143 2HD1 ILE 170 HD12 ILE 170 5.994 4.502 0.292
144 3HD1 ILE 170 HD13 ILE 170 7.611 4.972 -0.233
145 H LEU 171 HN LEU 171 3.986 2.379 3.263
146 HA LEU 171 HA LEU 171 4.630 1.561 5.905
147 1HB LEU 171 HB2 LEU 171 2.602 3.076 4.636
148 2HB LEU 171 HB1 LEU 171 1.788 1.795 5.513
149 HG LEU 171 HG LEU 171 3.864 3.430 6.910
150 1HD1 LEU 171 HD11 LEU 171 1.900 4.888 7.650
151 2HD1 LEU 171 HD12 LEU 171 1.073 4.284 6.214
152 3HD1 LEU 171 HD13 LEU 171 2.580 5.186 6.050
153 1HD2 LEU 171 HD21 LEU 171 1.943 1.416 7.590
154 2HD2 LEU 171 HD22 LEU 171 1.597 2.895 8.487
155 3HD2 LEU 171 HD23 LEU 171 3.193 2.150 8.593
156 H ASP 172 HN ASP 172 2.005 0.433 3.797
157 HA ASP 172 HA ASP 172 1.772 -2.061 5.188
158 1HB ASP 172 HB2 ASP 172 -0.186 -0.926 4.170
159 2HB ASP 172 HB1 ASP 172 0.518 -1.201 2.569
160 H ALA 173 HN ALA 173 4.173 -1.065 3.288
161 HA ALA 173 HA ALA 173 4.367 -3.114 1.332
162 1HB ALA 173 HB1 ALA 173 6.305 -1.138 2.475
163 2HB ALA 173 HB2 ALA 173 5.649 -1.231 0.842
164 3HB ALA 173 HB3 ALA 173 6.848 -2.406 1.379
165 H GLY 174 HN GLY 174 5.918 -2.562 4.475
166 1HA GLY 174 HA2 GLY 174 6.669 -5.416 4.562
167 2HA GLY 174 HA1 GLY 174 7.425 -4.127 5.522
168 H TYR 175 HN TYR 175 4.593 -3.031 5.863
169 HA TYR 175 HA TYR 175 2.824 -3.177 7.264
170 1HB TYR 175 HB2 TYR 175 2.756 -5.602 6.442
171 2HB TYR 175 HB1 TYR 175 3.587 -6.010 7.940
172 HD1 TYR 175 HD1 TYR 175 0.630 -3.972 6.880
173 HD2 TYR 175 HD2 TYR 175 2.253 -6.752 9.661
174 HE1 TYR 175 HE1 TYR 175 -1.531 -4.053 8.049
175 HE2 TYR 175 HE2 TYR 175 0.097 -6.841 10.839
176 HH TYR 175 HH TYR 175 -2.260 -6.409 10.403
177 H PHE 176 HN PHE 176 6.011 -3.673 8.165
178 HA PHE 176 HA PHE 176 5.449 -3.557 11.026
179 1HB PHE 176 HB2 PHE 176 8.087 -3.771 9.565
180 2HB PHE 176 HB1 PHE 176 7.850 -3.918 11.312
181 HD1 PHE 176 HD1 PHE 176 5.581 -5.658 11.581
182 HD2 PHE 176 HD2 PHE 176 8.749 -5.805 8.744
183 HE1 PHE 176 HE1 PHE 176 5.229 -8.079 11.319
184 HE2 PHE 176 HE2 PHE 176 8.403 -8.226 8.476
185 HZ PHE 176 HZ PHE 176 6.640 -9.366 9.764
186 H LEU 177 HN LEU 177 5.644 -1.424 8.557
187 HA LEU 177 HA LEU 177 7.391 0.572 9.421
188 1HB LEU 177 HB2 LEU 177 5.165 0.339 7.537
189 2HB LEU 177 HB1 LEU 177 5.367 1.953 8.191
190 HG LEU 177 HG LEU 177 6.559 1.376 5.994
191 1HD1 LEU 177 HD11 LEU 177 8.385 2.451 8.111
192 2HD1 LEU 177 HD12 LEU 177 6.956 3.341 7.587
193 3HD1 LEU 177 HD13 LEU 177 8.225 2.948 6.427
194 1HD2 LEU 177 HD21 LEU 177 7.462 -0.795 7.051
195 2HD2 LEU 177 HD22 LEU 177 8.679 0.249 7.783
196 3HD2 LEU 177 HD23 LEU 177 8.536 0.158 6.027
197 HA PRO 178 HA PRO 178 3.231 2.450 11.501
198 1HB PRO 178 HB2 PRO 178 2.433 -0.257 12.495
199 2HB PRO 178 HB1 PRO 178 1.423 1.140 12.108
200 1HG PRO 178 HG2 PRO 178 1.610 -0.903 10.415
201 2HG PRO 178 HG1 PRO 178 1.549 0.768 9.823
202 1HD PRO 178 HD2 PRO 178 3.849 -1.110 9.963
203 2HD PRO 178 HD1 PRO 178 3.526 0.198 8.808
204 H LEU 179 HN LEU 179 4.254 -0.573 13.115
205 HA LEU 179 HA LEU 179 5.388 -0.960 15.044
206 1HB LEU 179 HB2 LEU 179 6.683 1.251 13.862
207 2HB LEU 179 HB1 LEU 179 6.519 1.637 15.563
208 HG LEU 179 HG LEU 179 7.589 -1.045 14.820
209 1HD1 LEU 179 HD11 LEU 179 9.001 0.131 13.422
210 2HD1 LEU 179 HD12 LEU 179 9.892 0.140 14.944
211 3HD1 LEU 179 HD13 LEU 179 8.987 1.569 14.443
212 1HD2 LEU 179 HD21 LEU 179 7.815 0.882 17.095
213 2HD2 LEU 179 HD22 LEU 179 9.043 -0.359 16.854
214 3HD2 LEU 179 HD23 LEU 179 7.361 -0.822 17.111
215 H ARG 180 HN ARG 180 2.949 -0.756 15.617
216 HA ARG 180 HA ARG 180 1.414 -0.278 17.229
217 1HB ARG 180 HB2 ARG 180 3.771 0.991 18.642
218 2HB ARG 180 HB1 ARG 180 2.215 0.600 19.383
219 1HG ARG 180 HG2 ARG 180 3.157 -1.326 19.972
220 2HG ARG 180 HG1 ARG 180 2.989 -1.795 18.279
221 1HD ARG 180 HD2 ARG 180 5.252 -0.714 17.905
222 2HD ARG 180 HD1 ARG 180 5.399 -0.639 19.660
223 HE ARG 180 HE ARG 180 5.924 -2.851 19.643
224 1HH1 ARG 180 1HH1 ARG 180 4.186 -2.125 16.705
225 2HH1 ARG 180 2HH1 ARG 180 4.375 -3.718 16.052
226 1HH2 ARG 180 1HH2 ARG 180 6.172 -4.947 18.785
227 2HH2 ARG 180 2HH2 ARG 180 5.502 -5.320 17.233
228 1HG HSL 181 HG1 HSL 181 0.316 5.806 13.878
229 2HG HSL 181 HG2 HSL 181 0.480 4.794 12.349
230 H HSL 181 HN HSL 181 1.369 1.311 15.057
231 HA HSL 181 HA HSL 181 0.812 4.108 16.182
232 1HB HSL 181 HB1 HSL 181 2.348 4.681 14.472
233 2HB HSL 181 HB2 HSL 181 1.920 3.199 13.461
Start of MODEL 50
1 1H PHE 155 HT1 PHE 155 -1.506 2.719 -4.548
2 2H PHE 155 HT2 PHE 155 -3.203 2.461 -4.526
3 3H PHE 155 HT3 PHE 155 -2.246 1.791 -5.784
4 HA PHE 155 HA PHE 155 -2.257 1.063 -2.936
5 1HB PHE 155 HB2 PHE 155 -2.861 -0.521 -5.443
6 2HB PHE 155 HB1 PHE 155 -3.029 -1.082 -3.783
7 HD1 PHE 155 HD1 PHE 155 -4.542 0.619 -2.309
8 HD2 PHE 155 HD2 PHE 155 -4.799 0.024 -6.515
9 HE1 PHE 155 HE1 PHE 155 -6.869 1.416 -2.276
10 HE2 PHE 155 HE2 PHE 155 -7.127 0.821 -6.488
11 HZ PHE 155 HZ PHE 155 -8.165 1.519 -4.367
12 H LEU 156 HN LEU 156 -1.008 -0.179 -6.034
13 HA LEU 156 HA LEU 156 1.702 -0.062 -5.189
14 1HB LEU 156 HB2 LEU 156 2.110 -2.463 -5.104
15 2HB LEU 156 HB1 LEU 156 0.981 -1.955 -3.866
16 HG LEU 156 HG LEU 156 -0.699 -2.671 -5.900
17 1HD1 LEU 156 HD11 LEU 156 0.258 -4.088 -7.312
18 2HD1 LEU 156 HD12 LEU 156 0.715 -5.133 -5.967
19 3HD1 LEU 156 HD13 LEU 156 1.807 -3.856 -6.502
20 1HD2 LEU 156 HD21 LEU 156 -0.640 -4.937 -4.466
21 2HD2 LEU 156 HD22 LEU 156 -1.392 -3.446 -3.897
22 3HD2 LEU 156 HD23 LEU 156 0.238 -3.866 -3.372
23 H GLN 157 HN GLN 157 0.481 0.976 -7.404
24 HA GLN 157 HA GLN 157 2.057 -0.098 -9.493
25 1HB GLN 157 HB2 GLN 157 0.043 -0.618 -11.003
26 2HB GLN 157 HB1 GLN 157 0.502 -1.818 -9.802
27 1HG GLN 157 HG2 GLN 157 -1.421 0.073 -8.756
28 2HG GLN 157 HG1 GLN 157 -2.014 -0.744 -10.200
29 1HE2 GLN 157 HE21 GLN 157 -2.841 -0.958 -7.390
30 2HE2 GLN 157 HE22 GLN 157 -2.704 -2.634 -6.988
31 H SER 158 HN SER 158 -0.638 1.956 -8.547
32 HA SER 158 HA SER 158 -0.506 3.621 -10.864
33 1HB SER 158 HB2 SER 158 -1.614 4.723 -8.332
34 2HB SER 158 HB1 SER 158 -2.292 4.740 -9.969
35 HG SER 158 HG SER 158 -2.807 3.054 -7.949
36 H ASP 159 HN ASP 159 1.978 3.574 -10.457
37 HA ASP 159 HA ASP 159 3.827 4.885 -10.251
38 1HB ASP 159 HB2 ASP 159 1.681 6.777 -10.045
39 2HB ASP 159 HB1 ASP 159 2.932 7.207 -8.881
40 H VAL 160 HN VAL 160 1.743 5.563 -7.449
41 HA VAL 160 HA VAL 160 2.005 5.208 -5.222
42 HB VAL 160 HB VAL 160 4.348 3.483 -6.022
43 1HG1 VAL 160 HG11 VAL 160 4.725 3.729 -3.787
44 2HG1 VAL 160 HG12 VAL 160 3.555 2.409 -3.730
45 3HG1 VAL 160 HG13 VAL 160 3.031 4.065 -3.427
46 1HG2 VAL 160 HG21 VAL 160 1.457 3.065 -6.110
47 2HG2 VAL 160 HG22 VAL 160 2.337 1.801 -5.252
48 3HG2 VAL 160 HG23 VAL 160 2.756 2.190 -6.920
49 H PHE 161 HN PHE 161 5.259 5.384 -6.639
50 HA PHE 161 HA PHE 161 6.287 6.972 -4.504
51 1HB PHE 161 HB2 PHE 161 8.368 6.925 -5.681
52 2HB PHE 161 HB1 PHE 161 7.635 5.334 -5.841
53 HD1 PHE 161 HD1 PHE 161 6.865 4.527 -7.974
54 HD2 PHE 161 HD2 PHE 161 8.530 8.424 -7.585
55 HE1 PHE 161 HE1 PHE 161 7.085 4.674 -10.421
56 HE2 PHE 161 HE2 PHE 161 8.752 8.578 -10.031
57 HZ PHE 161 HZ PHE 161 8.029 6.701 -11.452
58 H PHE 162 HN PHE 162 4.128 7.906 -6.664
59 HA PHE 162 HA PHE 162 4.789 10.654 -6.431
60 1HB PHE 162 HB2 PHE 162 5.918 9.368 -8.648
61 2HB PHE 162 HB1 PHE 162 4.532 10.264 -9.270
62 HD1 PHE 162 HD1 PHE 162 6.685 11.258 -6.419
63 HD2 PHE 162 HD2 PHE 162 5.612 11.946 -10.479
64 HE1 PHE 162 HE1 PHE 162 8.013 13.326 -6.415
65 HE2 PHE 162 HE2 PHE 162 6.937 14.016 -10.481
66 HZ PHE 162 HZ PHE 162 8.142 14.709 -8.448
67 H LEU 163 HN LEU 163 2.563 8.355 -6.484
68 HA LEU 163 HA LEU 163 0.534 9.383 -8.168
69 1HB LEU 163 HB2 LEU 163 0.601 7.099 -7.022
70 2HB LEU 163 HB1 LEU 163 0.101 7.925 -5.560
71 HG LEU 163 HG LEU 163 -1.982 8.610 -6.612
72 1HD1 LEU 163 HD11 LEU 163 -1.677 8.954 -8.843
73 2HD1 LEU 163 HD12 LEU 163 -2.406 7.348 -8.892
74 3HD1 LEU 163 HD13 LEU 163 -0.657 7.528 -9.040
75 1HD2 LEU 163 HD21 LEU 163 -1.227 5.719 -6.643
76 2HD2 LEU 163 HD22 LEU 163 -2.837 6.219 -7.159
77 3HD2 LEU 163 HD23 LEU 163 -2.278 6.591 -5.529
78 H PHE 164 HN PHE 164 1.770 10.115 -5.029
79 HA PHE 164 HA PHE 164 1.461 11.822 -3.590
80 1HB PHE 164 HB2 PHE 164 1.433 13.826 -4.595
81 2HB PHE 164 HB1 PHE 164 1.353 12.911 -6.095
82 HD1 PHE 164 HD1 PHE 164 -0.766 14.577 -3.536
83 HD2 PHE 164 HD2 PHE 164 -0.446 13.191 -7.546
84 HE1 PHE 164 HE1 PHE 164 -2.885 15.697 -4.089
85 HE2 PHE 164 HE2 PHE 164 -2.564 14.307 -8.105
86 HZ PHE 164 HZ PHE 164 -3.788 15.563 -6.376
87 H LEU 165 HN LEU 165 -1.175 10.132 -4.821
88 HA LEU 165 HA LEU 165 -3.287 11.487 -3.486
89 1HB LEU 165 HB2 LEU 165 -2.941 8.916 -4.896
90 2HB LEU 165 HB1 LEU 165 -4.208 8.950 -3.680
91 HG LEU 165 HG LEU 165 -3.994 10.853 -6.019
92 1HD1 LEU 165 HD11 LEU 165 -6.118 8.782 -5.670
93 2HD1 LEU 165 HD12 LEU 165 -4.576 8.358 -6.410
94 3HD1 LEU 165 HD13 LEU 165 -5.587 9.608 -7.135
95 1HD2 LEU 165 HD21 LEU 165 -6.514 11.086 -5.187
96 2HD2 LEU 165 HD22 LEU 165 -5.212 12.097 -4.564
97 3HD2 LEU 165 HD23 LEU 165 -5.755 10.694 -3.644
98 H LEU 166 HN LEU 166 -2.213 8.186 -2.811
99 HA LEU 166 HA LEU 166 -1.625 8.703 -0.059
100 1HB LEU 166 HB2 LEU 166 -4.324 8.041 -0.851
101 2HB LEU 166 HB1 LEU 166 -3.667 6.782 0.181
102 HG LEU 166 HG LEU 166 -3.354 9.603 1.079
103 1HD1 LEU 166 HD11 LEU 166 -5.562 9.950 0.752
104 2HD1 LEU 166 HD12 LEU 166 -5.695 9.021 2.245
105 3HD1 LEU 166 HD13 LEU 166 -5.938 8.228 0.689
106 1HD2 LEU 166 HD21 LEU 166 -2.367 7.870 2.412
107 2HD2 LEU 166 HD22 LEU 166 -3.881 6.964 2.437
108 3HD2 LEU 166 HD23 LEU 166 -3.766 8.511 3.275
109 HA PRO 167 HA PRO 167 0.057 4.942 -2.503
110 1HB PRO 167 HB2 PRO 167 2.678 5.645 -1.854
111 2HB PRO 167 HB1 PRO 167 1.878 5.904 -3.413
112 1HG PRO 167 HG2 PRO 167 2.292 7.808 -1.153
113 2HG PRO 167 HG1 PRO 167 2.322 8.111 -2.900
114 1HD PRO 167 HD2 PRO 167 0.223 8.826 -1.398
115 2HD PRO 167 HD1 PRO 167 0.006 8.203 -3.048
116 HA PRO 168 HA PRO 168 0.335 3.266 1.712
117 1HB PRO 168 HB2 PRO 168 -0.674 0.859 1.135
118 2HB PRO 168 HB1 PRO 168 -1.724 2.290 1.218
119 1HG PRO 168 HG2 PRO 168 -0.524 0.966 -1.198
120 2HG PRO 168 HG1 PRO 168 -2.199 1.487 -0.937
121 1HD PRO 168 HD2 PRO 168 -0.385 2.963 -2.316
122 2HD PRO 168 HD1 PRO 168 -1.708 3.691 -1.382
123 H ILE 169 HN ILE 169 2.670 3.521 0.211
124 HA ILE 169 HA ILE 169 3.846 0.969 -0.366
125 HB ILE 169 HB ILE 169 4.462 3.204 -1.428
126 1HG1 ILE 169 HG12 ILE 169 6.834 1.706 -0.327
127 2HG1 ILE 169 HG11 ILE 169 5.762 1.000 -1.534
128 1HG2 ILE 169 HG21 ILE 169 6.080 3.507 1.104
129 2HG2 ILE 169 HG22 ILE 169 4.689 4.490 0.646
130 3HG2 ILE 169 HG23 ILE 169 6.163 4.546 -0.320
131 1HD1 ILE 169 HD11 ILE 169 7.803 2.012 -2.483
132 2HD1 ILE 169 HD12 ILE 169 7.262 3.583 -1.892
133 3HD1 ILE 169 HD13 ILE 169 6.315 2.723 -3.107
134 H ILE 170 HN ILE 170 4.120 3.351 2.177
135 HA ILE 170 HA ILE 170 6.134 2.041 3.647
136 HB ILE 170 HB ILE 170 5.650 3.665 5.385
137 1HG1 ILE 170 HG12 ILE 170 3.190 3.995 3.754
138 2HG1 ILE 170 HG11 ILE 170 3.370 3.971 5.500
139 1HG2 ILE 170 HG21 ILE 170 5.564 4.989 2.690
140 2HG2 ILE 170 HG22 ILE 170 7.003 4.211 3.346
141 3HG2 ILE 170 HG23 ILE 170 6.300 5.602 4.171
142 1HD1 ILE 170 HD11 ILE 170 2.940 6.166 5.291
143 2HD1 ILE 170 HD12 ILE 170 3.479 6.218 3.612
144 3HD1 ILE 170 HD13 ILE 170 4.661 6.261 4.920
145 H LEU 171 HN LEU 171 2.607 2.215 4.084
146 HA LEU 171 HA LEU 171 2.569 0.720 6.480
147 1HB LEU 171 HB2 LEU 171 0.148 0.172 5.633
148 2HB LEU 171 HB1 LEU 171 0.560 1.784 6.178
149 HG LEU 171 HG LEU 171 0.998 1.432 3.313
150 1HD1 LEU 171 HD11 LEU 171 -1.567 0.589 4.508
151 2HD1 LEU 171 HD12 LEU 171 -0.815 0.127 2.982
152 3HD1 LEU 171 HD13 LEU 171 -1.659 1.669 3.117
153 1HD2 LEU 171 HD21 LEU 171 0.979 3.629 3.882
154 2HD2 LEU 171 HD22 LEU 171 -0.170 3.393 5.200
155 3HD2 LEU 171 HD23 LEU 171 -0.740 3.440 3.531
156 H ASP 172 HN ASP 172 1.876 -0.251 3.139
157 HA ASP 172 HA ASP 172 1.884 -3.041 3.765
158 1HB ASP 172 HB2 ASP 172 1.823 -1.528 1.150
159 2HB ASP 172 HB1 ASP 172 1.794 -3.295 1.249
160 H ALA 173 HN ALA 173 4.385 -0.949 3.724
161 HA ALA 173 HA ALA 173 6.276 -2.325 2.092
162 1HB ALA 173 HB1 ALA 173 6.225 0.065 3.640
163 2HB ALA 173 HB2 ALA 173 7.400 -0.438 2.425
164 3HB ALA 173 HB3 ALA 173 7.634 -0.882 4.116
165 H GLY 174 HN GLY 174 5.768 -2.084 5.593
166 1HA GLY 174 HA2 GLY 174 7.129 -4.697 5.895
167 2HA GLY 174 HA1 GLY 174 7.296 -3.384 7.077
168 H TYR 175 HN TYR 175 4.371 -2.757 6.488
169 HA TYR 175 HA TYR 175 2.311 -3.237 7.220
170 1HB TYR 175 HB2 TYR 175 2.582 -5.480 6.264
171 2HB TYR 175 HB1 TYR 175 3.383 -6.021 7.734
172 HD1 TYR 175 HD1 TYR 175 0.179 -4.358 6.743
173 HD2 TYR 175 HD2 TYR 175 2.113 -7.217 9.231
174 HE1 TYR 175 HE1 TYR 175 -1.997 -4.994 7.695
175 HE2 TYR 175 HE2 TYR 175 -0.058 -7.861 10.189
176 HH TYR 175 HH TYR 175 -2.405 -7.778 9.653
177 H PHE 176 HN PHE 176 5.077 -3.513 9.149
178 HA PHE 176 HA PHE 176 3.567 -3.676 11.644
179 1HB PHE 176 HB2 PHE 176 6.477 -3.835 10.920
180 2HB PHE 176 HB1 PHE 176 6.017 -3.389 12.569
181 HD1 PHE 176 HD1 PHE 176 5.938 -6.049 10.037
182 HD2 PHE 176 HD2 PHE 176 5.089 -4.995 14.072
183 HE1 PHE 176 HE1 PHE 176 5.659 -8.428 10.595
184 HE2 PHE 176 HE2 PHE 176 4.809 -7.373 14.638
185 HZ PHE 176 HZ PHE 176 5.095 -9.094 12.899
186 H LEU 177 HN LEU 177 2.902 -1.533 10.160
187 HA LEU 177 HA LEU 177 2.705 0.705 10.098
188 1HB LEU 177 HB2 LEU 177 3.487 0.208 12.952
189 2HB LEU 177 HB1 LEU 177 3.240 1.845 12.374
190 HG LEU 177 HG LEU 177 1.096 -0.192 11.937
191 1HD1 LEU 177 HD11 LEU 177 1.956 0.949 14.531
192 2HD1 LEU 177 HD12 LEU 177 1.160 -0.583 14.171
193 3HD1 LEU 177 HD13 LEU 177 0.225 0.912 14.194
194 1HD2 LEU 177 HD21 LEU 177 0.786 1.918 10.865
195 2HD2 LEU 177 HD22 LEU 177 1.178 2.792 12.346
196 3HD2 LEU 177 HD23 LEU 177 -0.310 1.851 12.245
197 HA PRO 178 HA PRO 178 7.402 1.080 9.547
198 1HB PRO 178 HB2 PRO 178 6.599 1.105 6.696
199 2HB PRO 178 HB1 PRO 178 7.912 0.223 7.482
200 1HG PRO 178 HG2 PRO 178 5.747 -1.039 6.633
201 2HG PRO 178 HG1 PRO 178 6.492 -1.485 8.179
202 1HD PRO 178 HD2 PRO 178 4.093 0.245 7.659
203 2HD PRO 178 HD1 PRO 178 4.294 -1.069 8.836
204 H LEU 179 HN LEU 179 6.158 3.134 10.496
205 HA LEU 179 HA LEU 179 5.625 5.207 8.571
206 1HB LEU 179 HB2 LEU 179 5.278 4.796 11.416
207 2HB LEU 179 HB1 LEU 179 5.941 6.385 11.088
208 HG LEU 179 HG LEU 179 3.520 6.492 11.216
209 1HD1 LEU 179 HD11 LEU 179 3.202 7.126 8.624
210 2HD1 LEU 179 HD12 LEU 179 4.963 7.087 8.715
211 3HD1 LEU 179 HD13 LEU 179 4.048 8.151 9.783
212 1HD2 LEU 179 HD21 LEU 179 2.198 5.351 9.384
213 2HD2 LEU 179 HD22 LEU 179 2.831 4.305 10.657
214 3HD2 LEU 179 HD23 LEU 179 3.634 4.371 9.088
215 H ARG 180 HN ARG 180 7.912 5.076 11.294
216 HA ARG 180 HA ARG 180 9.626 7.010 9.981
217 1HB ARG 180 HB2 ARG 180 10.233 5.612 12.575
218 2HB ARG 180 HB1 ARG 180 10.752 7.214 12.037
219 1HG ARG 180 HG2 ARG 180 9.059 8.105 13.145
220 2HG ARG 180 HG1 ARG 180 7.931 7.237 12.102
221 1HD ARG 180 HD2 ARG 180 9.201 5.786 14.372
222 2HD ARG 180 HD1 ARG 180 7.896 6.920 14.718
223 HE ARG 180 HE ARG 180 6.768 5.469 12.817
224 1HH1 ARG 180 1HH1 ARG 180 8.640 4.435 15.580
225 2HH1 ARG 180 2HH1 ARG 180 7.846 2.901 15.698
226 1HH2 ARG 180 1HH2 ARG 180 5.730 3.452 12.973
227 2HH2 ARG 180 2HH2 ARG 180 6.195 2.343 14.219
228 1HG HSL 181 HG1 HSL 181 10.174 1.112 6.236
229 2HG HSL 181 HG2 HSL 181 8.948 2.417 6.660
230 H HSL 181 HN HSL 181 9.341 4.611 8.575
231 HA HSL 181 HA HSL 181 12.126 3.362 8.854
232 1HB HSL 181 HB1 HSL 181 11.308 1.258 8.313
233 2HB HSL 181 HB2 HSL 181 9.689 1.921 8.901
Start of MODEL 51
1 1H PHE 155 HT1 PHE 155 -18.629 6.185 -4.847
2 2H PHE 155 HT2 PHE 155 -19.246 7.303 -3.700
3 3H PHE 155 HT3 PHE 155 -19.213 5.626 -3.335
4 HA PHE 155 HA PHE 155 -16.787 7.162 -3.926
5 1HB PHE 155 HB2 PHE 155 -18.276 6.795 -1.324
6 2HB PHE 155 HB1 PHE 155 -16.564 7.200 -1.383
7 HD1 PHE 155 HD1 PHE 155 -16.461 9.106 -3.602
8 HD2 PHE 155 HD2 PHE 155 -19.325 8.675 -0.485
9 HE1 PHE 155 HE1 PHE 155 -17.030 11.492 -3.801
10 HE2 PHE 155 HE2 PHE 155 -19.900 11.059 -0.678
11 HZ PHE 155 HZ PHE 155 -18.752 12.471 -2.338
12 H LEU 156 HN LEU 156 -14.923 6.008 -3.497
13 HA LEU 156 HA LEU 156 -13.592 4.166 -3.369
14 1HB LEU 156 HB2 LEU 156 -15.676 3.587 -1.291
15 2HB LEU 156 HB1 LEU 156 -14.401 2.429 -1.627
16 HG LEU 156 HG LEU 156 -13.837 5.286 -0.856
17 1HD1 LEU 156 HD11 LEU 156 -15.016 4.445 1.000
18 2HD1 LEU 156 HD12 LEU 156 -13.308 4.266 1.401
19 3HD1 LEU 156 HD13 LEU 156 -14.242 2.866 0.876
20 1HD2 LEU 156 HD21 LEU 156 -12.123 3.765 -2.030
21 2HD2 LEU 156 HD22 LEU 156 -12.062 2.901 -0.494
22 3HD2 LEU 156 HD23 LEU 156 -11.631 4.610 -0.562
23 H GLN 157 HN GLN 157 -13.837 3.372 -5.452
24 HA GLN 157 HA GLN 157 -14.960 0.793 -5.668
25 1HB GLN 157 HB2 GLN 157 -17.028 2.223 -5.823
26 2HB GLN 157 HB1 GLN 157 -16.376 2.891 -7.312
27 1HG GLN 157 HG2 GLN 157 -18.045 1.095 -7.653
28 2HG GLN 157 HG1 GLN 157 -16.480 0.768 -8.396
29 1HE2 GLN 157 HE21 GLN 157 -16.103 -1.324 -8.296
30 2HE2 GLN 157 HE22 GLN 157 -16.347 -2.339 -6.920
31 H SER 158 HN SER 158 -12.468 1.697 -6.095
32 HA SER 158 HA SER 158 -11.933 0.745 -8.708
33 1HB SER 158 HB2 SER 158 -11.938 3.688 -8.242
34 2HB SER 158 HB1 SER 158 -10.599 3.020 -9.190
35 HG SER 158 HG SER 158 -11.922 2.820 -10.796
36 H ASP 159 HN ASP 159 -10.485 3.018 -6.425
37 HA ASP 159 HA ASP 159 -7.993 1.511 -6.443
38 1HB ASP 159 HB2 ASP 159 -8.803 4.147 -5.234
39 2HB ASP 159 HB1 ASP 159 -7.262 3.384 -4.864
40 H VAL 160 HN VAL 160 -10.514 2.501 -4.222
41 HA VAL 160 HA VAL 160 -11.029 2.000 -2.079
42 HB VAL 160 HB VAL 160 -11.942 0.061 -3.261
43 1HG1 VAL 160 HG11 VAL 160 -9.400 -1.387 -2.540
44 2HG1 VAL 160 HG12 VAL 160 -9.807 -0.817 -4.157
45 3HG1 VAL 160 HG13 VAL 160 -10.800 -2.047 -3.382
46 1HG2 VAL 160 HG21 VAL 160 -10.923 -1.222 -0.815
47 2HG2 VAL 160 HG22 VAL 160 -12.580 -0.946 -1.350
48 3HG2 VAL 160 HG23 VAL 160 -11.666 0.362 -0.599
49 H PHE 161 HN PHE 161 -8.173 0.048 -2.886
50 HA PHE 161 HA PHE 161 -7.221 0.073 -0.203
51 1HB PHE 161 HB2 PHE 161 -6.485 -1.197 -2.698
52 2HB PHE 161 HB1 PHE 161 -5.066 -0.557 -1.878
53 HD1 PHE 161 HD1 PHE 161 -8.182 -2.036 -0.483
54 HD2 PHE 161 HD2 PHE 161 -3.970 -2.382 -0.980
55 HE1 PHE 161 HE1 PHE 161 -8.171 -3.989 1.013
56 HE2 PHE 161 HE2 PHE 161 -3.950 -4.337 0.516
57 HZ PHE 161 HZ PHE 161 -6.053 -5.143 1.514
58 H PHE 162 HN PHE 162 -7.342 2.419 -2.543
59 HA PHE 162 HA PHE 162 -5.599 4.117 -1.087
60 1HB PHE 162 HB2 PHE 162 -3.998 4.557 -2.871
61 2HB PHE 162 HB1 PHE 162 -3.956 2.872 -2.358
62 HD1 PHE 162 HD1 PHE 162 -5.598 1.304 -3.756
63 HD2 PHE 162 HD2 PHE 162 -3.898 4.957 -5.128
64 HE1 PHE 162 HE1 PHE 162 -5.891 0.561 -6.084
65 HE2 PHE 162 HE2 PHE 162 -4.191 4.222 -7.459
66 HZ PHE 162 HZ PHE 162 -5.189 2.022 -7.938
67 H LEU 163 HN LEU 163 -8.377 3.895 -2.421
68 HA LEU 163 HA LEU 163 -8.468 6.102 -4.253
69 1HB LEU 163 HB2 LEU 163 -10.183 4.184 -3.977
70 2HB LEU 163 HB1 LEU 163 -10.808 5.135 -2.647
71 HG LEU 163 HG LEU 163 -10.645 6.962 -4.708
72 1HD1 LEU 163 HD11 LEU 163 -11.678 5.977 -6.629
73 2HD1 LEU 163 HD12 LEU 163 -11.783 4.410 -5.825
74 3HD1 LEU 163 HD13 LEU 163 -10.207 5.077 -6.257
75 1HD2 LEU 163 HD21 LEU 163 -12.555 5.948 -2.973
76 2HD2 LEU 163 HD22 LEU 163 -13.242 5.697 -4.577
77 3HD2 LEU 163 HD23 LEU 163 -12.745 7.313 -4.074
78 H PHE 164 HN PHE 164 -7.946 5.829 -1.007
79 HA PHE 164 HA PHE 164 -9.444 8.009 0.025
80 1HB PHE 164 HB2 PHE 164 -7.879 5.964 1.060
81 2HB PHE 164 HB1 PHE 164 -6.968 7.418 1.450
82 HD1 PHE 164 HD1 PHE 164 -8.734 9.414 2.216
83 HD2 PHE 164 HD2 PHE 164 -9.183 5.221 2.783
84 HE1 PHE 164 HE1 PHE 164 -10.221 9.836 4.130
85 HE2 PHE 164 HE2 PHE 164 -10.672 5.635 4.698
86 HZ PHE 164 HZ PHE 164 -11.193 7.945 5.373
87 H LEU 165 HN LEU 165 -6.056 7.703 -1.051
88 HA LEU 165 HA LEU 165 -5.921 10.365 -1.957
89 1HB LEU 165 HB2 LEU 165 -5.729 10.222 0.787
90 2HB LEU 165 HB1 LEU 165 -4.050 10.256 0.281
91 HG LEU 165 HG LEU 165 -4.910 12.499 0.793
92 1HD1 LEU 165 HD11 LEU 165 -4.487 13.397 -1.682
93 2HD1 LEU 165 HD12 LEU 165 -3.900 11.746 -1.883
94 3HD1 LEU 165 HD13 LEU 165 -3.190 12.789 -0.651
95 1HD2 LEU 165 HD21 LEU 165 -7.251 12.092 0.142
96 2HD2 LEU 165 HD22 LEU 165 -6.759 12.072 -1.551
97 3HD2 LEU 165 HD23 LEU 165 -6.585 13.547 -0.602
98 H LEU 166 HN LEU 166 -4.068 7.689 -0.577
99 HA LEU 166 HA LEU 166 -2.455 7.497 -2.942
100 1HB LEU 166 HB2 LEU 166 -1.571 9.255 -0.988
101 2HB LEU 166 HB1 LEU 166 -0.664 7.790 -0.659
102 HG LEU 166 HG LEU 166 0.231 7.791 -2.924
103 1HD1 LEU 166 HD11 LEU 166 -0.182 9.804 -4.363
104 2HD1 LEU 166 HD12 LEU 166 -1.512 10.217 -3.282
105 3HD1 LEU 166 HD13 LEU 166 -1.554 8.709 -4.195
106 1HD2 LEU 166 HD21 LEU 166 0.704 10.602 -2.185
107 2HD2 LEU 166 HD22 LEU 166 1.848 9.286 -2.455
108 3HD2 LEU 166 HD23 LEU 166 0.998 9.413 -0.916
109 HA PRO 167 HA PRO 167 -2.489 3.332 -1.454
110 1HB PRO 167 HB2 PRO 167 -0.550 2.263 -3.023
111 2HB PRO 167 HB1 PRO 167 -2.163 2.681 -3.635
112 1HG PRO 167 HG2 PRO 167 0.403 4.217 -3.836
113 2HG PRO 167 HG1 PRO 167 -0.839 3.943 -5.073
114 1HD PRO 167 HD2 PRO 167 -0.662 6.250 -3.664
115 2HD PRO 167 HD1 PRO 167 -2.206 5.603 -4.248
116 HA PRO 168 HA PRO 168 0.754 3.750 1.667
117 1HB PRO 168 HB2 PRO 168 -0.010 1.496 3.057
118 2HB PRO 168 HB1 PRO 168 -0.714 3.107 3.292
119 1HG PRO 168 HG2 PRO 168 -1.741 0.798 1.690
120 2HG PRO 168 HG1 PRO 168 -2.630 1.930 2.725
121 1HD PRO 168 HD2 PRO 168 -2.635 2.158 0.050
122 2HD PRO 168 HD1 PRO 168 -2.655 3.586 1.105
123 H ILE 169 HN ILE 169 2.270 3.213 -0.072
124 HA ILE 169 HA ILE 169 2.885 0.483 -0.679
125 HB ILE 169 HB ILE 169 3.400 2.502 -2.137
126 1HG1 ILE 169 HG12 ILE 169 5.958 1.047 -1.859
127 2HG1 ILE 169 HG11 ILE 169 4.526 0.037 -2.027
128 1HG2 ILE 169 HG21 ILE 169 5.759 2.769 -0.269
129 2HG2 ILE 169 HG22 ILE 169 4.412 3.901 -0.394
130 3HG2 ILE 169 HG23 ILE 169 5.501 3.674 -1.763
131 1HD1 ILE 169 HD11 ILE 169 5.658 0.530 -4.163
132 2HD1 ILE 169 HD12 ILE 169 5.288 2.238 -3.928
133 3HD1 ILE 169 HD13 ILE 169 3.980 1.071 -4.119
134 H ILE 170 HN ILE 170 4.251 2.962 1.361
135 HA ILE 170 HA ILE 170 6.417 1.416 2.338
136 HB ILE 170 HB ILE 170 6.756 3.260 3.888
137 1HG1 ILE 170 HG12 ILE 170 4.020 3.935 2.966
138 2HG1 ILE 170 HG11 ILE 170 4.712 4.051 4.575
139 1HG2 ILE 170 HG21 ILE 170 7.294 4.933 2.258
140 2HG2 ILE 170 HG22 ILE 170 6.120 4.261 1.126
141 3HG2 ILE 170 HG23 ILE 170 7.567 3.343 1.544
142 1HD1 ILE 170 HD11 ILE 170 4.668 6.012 2.376
143 2HD1 ILE 170 HD12 ILE 170 6.137 5.953 3.353
144 3HD1 ILE 170 HD13 ILE 170 4.578 6.256 4.121
145 H LEU 171 HN LEU 171 3.260 2.336 3.634
146 HA LEU 171 HA LEU 171 3.608 1.138 6.174
147 1HB LEU 171 HB2 LEU 171 1.802 2.816 5.357
148 2HB LEU 171 HB1 LEU 171 0.946 1.387 4.806
149 HG LEU 171 HG LEU 171 1.536 0.724 7.402
150 1HD1 LEU 171 HD11 LEU 171 0.586 3.554 7.577
151 2HD1 LEU 171 HD12 LEU 171 2.311 3.188 7.567
152 3HD1 LEU 171 HD13 LEU 171 1.276 2.524 8.832
153 1HD2 LEU 171 HD21 LEU 171 -0.600 0.226 6.876
154 2HD2 LEU 171 HD22 LEU 171 -0.817 1.688 5.913
155 3HD2 LEU 171 HD23 LEU 171 -0.935 1.765 7.671
156 H ASP 172 HN ASP 172 1.876 0.054 3.273
157 HA ASP 172 HA ASP 172 1.505 -2.607 4.263
158 1HB ASP 172 HB2 ASP 172 1.208 -1.579 1.432
159 2HB ASP 172 HB1 ASP 172 0.553 -3.090 2.079
160 H ALA 173 HN ALA 173 4.248 -1.095 3.312
161 HA ALA 173 HA ALA 173 5.390 -3.012 1.543
162 1HB ALA 173 HB1 ALA 173 6.129 -0.495 2.612
163 2HB ALA 173 HB2 ALA 173 6.899 -1.397 1.310
164 3HB ALA 173 HB3 ALA 173 7.424 -1.631 2.977
165 H GLY 174 HN GLY 174 6.077 -2.205 4.940
166 1HA GLY 174 HA2 GLY 174 6.988 -4.990 5.333
167 2HA GLY 174 HA1 GLY 174 7.588 -3.598 6.255
168 H TYR 175 HN TYR 175 4.439 -2.965 5.916
169 HA TYR 175 HA TYR 175 2.666 -2.903 7.272
170 1HB TYR 175 HB2 TYR 175 2.336 -5.330 8.454
171 2HB TYR 175 HB1 TYR 175 1.805 -4.914 6.833
172 HD1 TYR 175 HD1 TYR 175 3.840 -7.086 8.798
173 HD2 TYR 175 HD2 TYR 175 3.389 -5.456 4.894
174 HE1 TYR 175 HE1 TYR 175 5.224 -8.902 7.886
175 HE2 TYR 175 HE2 TYR 175 4.772 -7.268 3.970
176 HH TYR 175 HH TYR 175 6.434 -8.859 4.678
177 H PHE 176 HN PHE 176 5.172 -4.754 9.008
178 HA PHE 176 HA PHE 176 4.335 -3.511 11.500
179 1HB PHE 176 HB2 PHE 176 6.127 -5.786 10.753
180 2HB PHE 176 HB1 PHE 176 6.332 -5.012 12.330
181 HD1 PHE 176 HD1 PHE 176 5.182 -7.847 11.155
182 HD2 PHE 176 HD2 PHE 176 3.595 -4.420 13.117
183 HE1 PHE 176 HE1 PHE 176 3.344 -9.216 12.052
184 HE2 PHE 176 HE2 PHE 176 1.756 -5.784 14.019
185 HZ PHE 176 HZ PHE 176 1.629 -8.185 13.487
186 H LEU 177 HN LEU 177 5.917 -2.224 9.143
187 HA LEU 177 HA LEU 177 8.386 -1.462 10.439
188 1HB LEU 177 HB2 LEU 177 7.122 -0.914 7.788
189 2HB LEU 177 HB1 LEU 177 8.381 0.162 8.363
190 HG LEU 177 HG LEU 177 8.640 -2.803 7.874
191 1HD1 LEU 177 HD11 LEU 177 10.461 -1.791 6.294
192 2HD1 LEU 177 HD12 LEU 177 9.448 -0.349 6.388
193 3HD1 LEU 177 HD13 LEU 177 8.774 -1.862 5.783
194 1HD2 LEU 177 HD21 LEU 177 10.382 -0.843 9.276
195 2HD2 LEU 177 HD22 LEU 177 11.145 -2.067 8.260
196 3HD2 LEU 177 HD23 LEU 177 10.111 -2.556 9.604
197 HA PRO 178 HA PRO 178 6.066 2.711 10.757
198 1HB PRO 178 HB2 PRO 178 3.311 2.425 9.995
199 2HB PRO 178 HB1 PRO 178 4.575 3.343 9.178
200 1HG PRO 178 HG2 PRO 178 3.370 1.099 8.144
201 2HG PRO 178 HG1 PRO 178 4.980 1.675 7.679
202 1HD PRO 178 HD2 PRO 178 4.224 -0.496 9.601
203 2HD PRO 178 HD1 PRO 178 5.530 -0.459 8.397
204 H LEU 179 HN LEU 179 6.199 0.784 12.721
205 HA LEU 179 HA LEU 179 3.660 0.671 14.109
206 1HB LEU 179 HB2 LEU 179 6.021 -0.860 14.111
207 2HB LEU 179 HB1 LEU 179 5.904 -0.158 15.713
208 HG LEU 179 HG LEU 179 3.753 -1.169 16.077
209 1HD1 LEU 179 HD11 LEU 179 3.898 -1.698 13.153
210 2HD1 LEU 179 HD12 LEU 179 2.545 -1.134 14.136
211 3HD1 LEU 179 HD13 LEU 179 3.019 -2.833 14.180
212 1HD2 LEU 179 HD21 LEU 179 6.101 -2.560 15.864
213 2HD2 LEU 179 HD22 LEU 179 4.998 -3.526 14.885
214 3HD2 LEU 179 HD23 LEU 179 4.606 -3.177 16.568
215 H ARG 180 HN ARG 180 6.883 1.592 15.313
216 HA ARG 180 HA ARG 180 5.652 3.500 17.122
217 1HB ARG 180 HB2 ARG 180 7.992 3.805 17.958
218 2HB ARG 180 HB1 ARG 180 7.396 2.145 18.057
219 1HG ARG 180 HG2 ARG 180 8.665 2.433 15.548
220 2HG ARG 180 HG1 ARG 180 9.729 3.146 16.761
221 1HD ARG 180 HD2 ARG 180 10.016 0.663 16.281
222 2HD ARG 180 HD1 ARG 180 9.874 1.143 17.972
223 HE ARG 180 HE ARG 180 7.331 0.491 16.940
224 1HH1 ARG 180 1HH1 ARG 180 10.327 -1.009 17.916
225 2HH1 ARG 180 2HH1 ARG 180 9.577 -2.505 18.359
226 1HH2 ARG 180 1HH2 ARG 180 6.343 -1.476 17.525
227 2HH2 ARG 180 2HH2 ARG 180 7.316 -2.771 18.138
228 1HG HSL 181 HG1 HSL 181 4.609 6.442 10.941
229 2HG HSL 181 HG2 HSL 181 4.049 5.041 11.997
230 H HSL 181 HN HSL 181 5.157 4.229 14.554
231 HA HSL 181 HA HSL 181 7.005 6.635 14.111
232 1HB HSL 181 HB1 HSL 181 6.821 6.434 11.803
233 2HB HSL 181 HB2 HSL 181 6.429 4.668 12.164
Start of MODEL 52
1 1H PHE 155 HT1 PHE 155 9.281 13.163 -7.160
2 2H PHE 155 HT2 PHE 155 8.574 11.598 -7.171
3 3H PHE 155 HT3 PHE 155 9.818 11.989 -8.287
4 HA PHE 155 HA PHE 155 11.417 12.107 -6.627
5 1HB PHE 155 HB2 PHE 155 8.993 12.133 -4.866
6 2HB PHE 155 HB1 PHE 155 10.515 11.526 -4.222
7 HD1 PHE 155 HD1 PHE 155 12.462 13.018 -4.032
8 HD2 PHE 155 HD2 PHE 155 8.647 14.454 -5.254
9 HE1 PHE 155 HE1 PHE 155 13.183 15.322 -3.560
10 HE2 PHE 155 HE2 PHE 155 9.361 16.762 -4.785
11 HZ PHE 155 HZ PHE 155 11.632 17.198 -3.937
12 H LEU 156 HN LEU 156 12.015 10.226 -4.982
13 HA LEU 156 HA LEU 156 11.735 7.810 -6.460
14 1HB LEU 156 HB2 LEU 156 13.227 8.715 -4.078
15 2HB LEU 156 HB1 LEU 156 12.874 7.000 -4.148
16 HG LEU 156 HG LEU 156 14.040 8.205 -6.589
17 1HD1 LEU 156 HD11 LEU 156 16.167 8.529 -5.800
18 2HD1 LEU 156 HD12 LEU 156 15.923 7.489 -4.396
19 3HD1 LEU 156 HD13 LEU 156 15.219 9.106 -4.429
20 1HD2 LEU 156 HD21 LEU 156 15.433 5.975 -6.076
21 2HD2 LEU 156 HD22 LEU 156 13.874 5.969 -6.901
22 3HD2 LEU 156 HD23 LEU 156 13.961 5.611 -5.176
23 H GLN 157 HN GLN 157 11.302 8.046 -2.960
24 HA GLN 157 HA GLN 157 9.692 7.317 -1.548
25 1HB GLN 157 HB2 GLN 157 8.125 7.572 -4.067
26 2HB GLN 157 HB1 GLN 157 7.419 6.645 -2.754
27 1HG GLN 157 HG2 GLN 157 6.600 8.636 -2.140
28 2HG GLN 157 HG1 GLN 157 8.193 8.840 -1.412
29 1HE2 GLN 157 HE21 GLN 157 6.965 9.059 -4.733
30 2HE2 GLN 157 HE22 GLN 157 7.572 10.648 -5.036
31 H SER 158 HN SER 158 9.359 5.448 -4.548
32 HA SER 158 HA SER 158 10.444 3.112 -3.331
33 1HB SER 158 HB2 SER 158 8.173 3.015 -2.380
34 2HB SER 158 HB1 SER 158 7.490 3.095 -4.013
35 HG SER 158 HG SER 158 7.592 0.949 -3.373
36 H ASP 159 HN ASP 159 11.210 4.563 -5.487
37 HA ASP 159 HA ASP 159 12.097 4.078 -7.552
38 1HB ASP 159 HB2 ASP 159 11.345 1.592 -6.822
39 2HB ASP 159 HB1 ASP 159 10.264 1.845 -8.188
40 H VAL 160 HN VAL 160 8.951 4.847 -6.812
41 HA VAL 160 HA VAL 160 7.586 6.331 -7.898
42 HB VAL 160 HB VAL 160 9.727 6.483 -9.584
43 1HG1 VAL 160 HG11 VAL 160 8.975 6.231 -11.864
44 2HG1 VAL 160 HG12 VAL 160 7.395 5.674 -11.316
45 3HG1 VAL 160 HG13 VAL 160 8.826 4.688 -11.026
46 1HG2 VAL 160 HG21 VAL 160 7.753 8.099 -8.815
47 2HG2 VAL 160 HG22 VAL 160 7.262 7.843 -10.490
48 3HG2 VAL 160 HG23 VAL 160 8.858 8.501 -10.130
49 H PHE 161 HN PHE 161 8.296 3.345 -9.713
50 HA PHE 161 HA PHE 161 5.686 3.111 -10.801
51 1HB PHE 161 HB2 PHE 161 6.350 0.958 -11.569
52 2HB PHE 161 HB1 PHE 161 7.779 1.980 -11.666
53 HD1 PHE 161 HD1 PHE 161 9.754 1.381 -10.569
54 HD2 PHE 161 HD2 PHE 161 6.118 -0.602 -9.592
55 HE1 PHE 161 HE1 PHE 161 11.011 -0.255 -9.229
56 HE2 PHE 161 HE2 PHE 161 7.368 -2.241 -8.248
57 HZ PHE 161 HZ PHE 161 9.818 -2.069 -8.065
58 H PHE 162 HN PHE 162 7.178 2.011 -7.846
59 HA PHE 162 HA PHE 162 5.123 0.224 -7.041
60 1HB PHE 162 HB2 PHE 162 7.632 0.756 -6.215
61 2HB PHE 162 HB1 PHE 162 6.703 1.589 -4.970
62 HD1 PHE 162 HD1 PHE 162 8.542 -0.965 -4.861
63 HD2 PHE 162 HD2 PHE 162 4.334 -0.342 -4.984
64 HE1 PHE 162 HE1 PHE 162 8.194 -3.108 -3.705
65 HE2 PHE 162 HE2 PHE 162 3.979 -2.484 -3.827
66 HZ PHE 162 HZ PHE 162 5.910 -3.871 -3.186
67 H LEU 163 HN LEU 163 5.967 3.508 -5.938
68 HA LEU 163 HA LEU 163 3.646 3.873 -4.352
69 1HB LEU 163 HB2 LEU 163 5.795 5.180 -4.209
70 2HB LEU 163 HB1 LEU 163 5.315 5.996 -5.686
71 HG LEU 163 HG LEU 163 3.125 6.454 -4.177
72 1HD1 LEU 163 HD11 LEU 163 4.067 5.327 -2.223
73 2HD1 LEU 163 HD12 LEU 163 3.819 7.048 -1.922
74 3HD1 LEU 163 HD13 LEU 163 5.440 6.435 -2.247
75 1HD2 LEU 163 HD21 LEU 163 5.033 7.951 -5.351
76 2HD2 LEU 163 HD22 LEU 163 5.341 8.325 -3.656
77 3HD2 LEU 163 HD23 LEU 163 3.744 8.616 -4.347
78 H PHE 164 HN PHE 164 4.005 3.540 -7.577
79 HA PHE 164 HA PHE 164 2.211 5.470 -8.627
80 1HB PHE 164 HB2 PHE 164 4.127 3.780 -9.619
81 2HB PHE 164 HB1 PHE 164 2.647 2.970 -10.121
82 HD1 PHE 164 HD1 PHE 164 5.004 5.432 -10.974
83 HD2 PHE 164 HD2 PHE 164 0.863 4.502 -11.277
84 HE1 PHE 164 HE1 PHE 164 4.803 6.973 -12.880
85 HE2 PHE 164 HE2 PHE 164 0.653 6.041 -13.185
86 HZ PHE 164 HZ PHE 164 2.626 7.279 -13.989
87 H LEU 165 HN LEU 165 2.001 1.991 -7.904
88 HA LEU 165 HA LEU 165 -0.698 1.686 -8.693
89 1HB LEU 165 HB2 LEU 165 1.324 0.001 -7.890
90 2HB LEU 165 HB1 LEU 165 0.190 -0.095 -6.553
91 HG LEU 165 HG LEU 165 -0.305 -1.871 -8.079
92 1HD1 LEU 165 HD11 LEU 165 -2.552 -1.596 -8.142
93 2HD1 LEU 165 HD12 LEU 165 -2.448 0.006 -8.872
94 3HD1 LEU 165 HD13 LEU 165 -2.156 -0.196 -7.144
95 1HD2 LEU 165 HD21 LEU 165 0.740 -1.089 -10.081
96 2HD2 LEU 165 HD22 LEU 165 -0.373 0.275 -10.192
97 3HD2 LEU 165 HD23 LEU 165 -0.966 -1.369 -10.432
98 H LEU 166 HN LEU 166 0.856 2.558 -5.675
99 HA LEU 166 HA LEU 166 -1.591 3.655 -4.652
100 1HB LEU 166 HB2 LEU 166 -1.050 0.977 -4.097
101 2HB LEU 166 HB1 LEU 166 -0.565 1.830 -2.643
102 HG LEU 166 HG LEU 166 -3.019 2.951 -3.189
103 1HD1 LEU 166 HD11 LEU 166 -4.462 1.507 -4.123
104 2HD1 LEU 166 HD12 LEU 166 -3.691 0.099 -3.391
105 3HD1 LEU 166 HD13 LEU 166 -3.010 0.818 -4.851
106 1HD2 LEU 166 HD21 LEU 166 -3.015 2.457 -1.021
107 2HD2 LEU 166 HD22 LEU 166 -1.837 1.165 -1.244
108 3HD2 LEU 166 HD23 LEU 166 -3.557 0.839 -1.466
109 HA PRO 167 HA PRO 167 1.447 6.323 -2.890
110 1HB PRO 167 HB2 PRO 167 -0.123 7.512 -0.962
111 2HB PRO 167 HB1 PRO 167 -0.030 8.008 -2.660
112 1HG PRO 167 HG2 PRO 167 -2.113 6.440 -1.254
113 2HG PRO 167 HG1 PRO 167 -2.259 7.521 -2.646
114 1HD PRO 167 HD2 PRO 167 -2.304 4.774 -2.796
115 2HD PRO 167 HD1 PRO 167 -1.861 5.846 -4.135
116 HA PRO 168 HA PRO 168 1.536 4.652 1.518
117 1HB PRO 168 HB2 PRO 168 -0.153 2.830 2.376
118 2HB PRO 168 HB1 PRO 168 -0.707 4.497 2.108
119 1HG PRO 168 HG2 PRO 168 -1.026 2.103 0.328
120 2HG PRO 168 HG1 PRO 168 -2.245 3.296 0.816
121 1HD PRO 168 HD2 PRO 168 -0.824 3.398 -1.542
122 2HD PRO 168 HD1 PRO 168 -1.564 4.801 -0.756
123 H ILE 169 HN ILE 169 3.347 3.822 0.094
124 HA ILE 169 HA ILE 169 3.434 1.023 -0.519
125 HB ILE 169 HB ILE 169 4.673 2.522 -1.888
126 1HG1 ILE 169 HG12 ILE 169 6.975 1.553 -1.729
127 2HG1 ILE 169 HG11 ILE 169 6.505 0.829 -0.197
128 1HG2 ILE 169 HG21 ILE 169 5.925 4.233 -1.251
129 2HG2 ILE 169 HG22 ILE 169 6.745 3.290 -0.011
130 3HG2 ILE 169 HG23 ILE 169 5.166 3.999 0.320
131 1HD1 ILE 169 HD11 ILE 169 6.380 -0.477 -2.501
132 2HD1 ILE 169 HD12 ILE 169 4.782 0.269 -2.533
133 3HD1 ILE 169 HD13 ILE 169 5.244 -0.768 -1.183
134 H ILE 170 HN ILE 170 5.082 3.097 1.776
135 HA ILE 170 HA ILE 170 6.564 1.122 3.089
136 HB ILE 170 HB ILE 170 5.584 3.607 4.468
137 1HG1 ILE 170 HG12 ILE 170 6.358 4.478 2.410
138 2HG1 ILE 170 HG11 ILE 170 7.715 4.655 3.517
139 1HG2 ILE 170 HG21 ILE 170 7.033 1.658 5.498
140 2HG2 ILE 170 HG22 ILE 170 7.348 3.348 5.891
141 3HG2 ILE 170 HG23 ILE 170 8.341 2.524 4.691
142 1HD1 ILE 170 HD11 ILE 170 7.412 2.390 1.564
143 2HD1 ILE 170 HD12 ILE 170 8.823 2.770 2.551
144 3HD1 ILE 170 HD13 ILE 170 8.333 3.861 1.254
145 H LEU 171 HN LEU 171 3.256 2.181 3.549
146 HA LEU 171 HA LEU 171 2.864 1.022 6.104
147 1HB LEU 171 HB2 LEU 171 1.282 2.634 5.255
148 2HB LEU 171 HB1 LEU 171 0.939 1.633 3.859
149 HG LEU 171 HG LEU 171 0.049 -0.101 5.514
150 1HD1 LEU 171 HD11 LEU 171 -0.508 0.549 7.690
151 2HD1 LEU 171 HD12 LEU 171 -0.207 2.254 7.355
152 3HD1 LEU 171 HD13 LEU 171 1.144 1.125 7.467
153 1HD2 LEU 171 HD21 LEU 171 -1.680 2.274 5.742
154 2HD2 LEU 171 HD22 LEU 171 -2.031 0.667 5.105
155 3HD2 LEU 171 HD23 LEU 171 -1.174 1.842 4.108
156 H ASP 172 HN ASP 172 1.695 -0.106 2.956
157 HA ASP 172 HA ASP 172 1.360 -2.798 3.885
158 1HB ASP 172 HB2 ASP 172 1.190 -1.701 1.066
159 2HB ASP 172 HB1 ASP 172 0.600 -3.278 1.614
160 H ALA 173 HN ALA 173 4.111 -1.188 3.228
161 HA ALA 173 HA ALA 173 5.451 -2.966 1.452
162 1HB ALA 173 HB1 ALA 173 6.264 -0.731 3.231
163 2HB ALA 173 HB2 ALA 173 6.550 -0.962 1.506
164 3HB ALA 173 HB3 ALA 173 7.510 -1.853 2.686
165 H GLY 174 HN GLY 174 6.151 -2.310 4.861
166 1HA GLY 174 HA2 GLY 174 6.822 -5.165 5.205
167 2HA GLY 174 HA1 GLY 174 7.486 -3.839 6.180
168 H TYR 175 HN TYR 175 4.534 -2.790 5.952
169 HA TYR 175 HA TYR 175 2.640 -2.796 7.180
170 1HB TYR 175 HB2 TYR 175 3.400 -5.652 7.192
171 2HB TYR 175 HB1 TYR 175 2.322 -5.155 8.491
172 HD1 TYR 175 HD1 TYR 175 0.335 -3.542 7.596
173 HD2 TYR 175 HD2 TYR 175 2.400 -6.463 5.291
174 HE1 TYR 175 HE1 TYR 175 -1.577 -3.671 6.053
175 HE2 TYR 175 HE2 TYR 175 0.495 -6.598 3.743
176 HH TYR 175 HH TYR 175 -1.493 -4.798 3.108
177 H PHE 176 HN PHE 176 5.308 -4.435 8.891
178 HA PHE 176 HA PHE 176 4.489 -3.186 11.388
179 1HB PHE 176 HB2 PHE 176 5.150 -5.262 12.028
180 2HB PHE 176 HB1 PHE 176 6.172 -5.481 10.603
181 HD1 PHE 176 HD1 PHE 176 8.483 -4.625 10.606
182 HD2 PHE 176 HD2 PHE 176 6.045 -4.505 14.092
183 HE1 PHE 176 HE1 PHE 176 10.488 -4.281 11.990
184 HE2 PHE 176 HE2 PHE 176 8.046 -4.160 15.483
185 HZ PHE 176 HZ PHE 176 10.271 -4.047 14.431
186 H LEU 177 HN LEU 177 6.365 -2.398 8.753
187 HA LEU 177 HA LEU 177 8.694 -1.296 9.740
188 1HB LEU 177 HB2 LEU 177 6.924 -0.668 7.426
189 2HB LEU 177 HB1 LEU 177 8.217 0.448 7.815
190 HG LEU 177 HG LEU 177 8.457 -1.653 6.128
191 1HD1 LEU 177 HD11 LEU 177 10.032 0.146 6.264
192 2HD1 LEU 177 HD12 LEU 177 10.906 -1.377 6.420
193 3HD1 LEU 177 HD13 LEU 177 10.584 -0.395 7.849
194 1HD2 LEU 177 HD21 LEU 177 9.591 -3.469 7.106
195 2HD2 LEU 177 HD22 LEU 177 8.174 -3.196 8.120
196 3HD2 LEU 177 HD23 LEU 177 9.760 -2.636 8.651
197 HA PRO 178 HA PRO 178 6.170 2.826 10.531
198 1HB PRO 178 HB2 PRO 178 3.477 1.729 11.066
199 2HB PRO 178 HB1 PRO 178 3.946 3.136 10.107
200 1HG PRO 178 HG2 PRO 178 3.066 0.901 8.941
201 2HG PRO 178 HG1 PRO 178 4.368 1.865 8.215
202 1HD PRO 178 HD2 PRO 178 4.550 -0.665 9.816
203 2HD PRO 178 HD1 PRO 178 5.409 -0.210 8.330
204 H LEU 179 HN LEU 179 7.633 1.624 12.283
205 HA LEU 179 HA LEU 179 6.074 1.075 14.699
206 1HB LEU 179 HB2 LEU 179 8.171 -0.262 13.719
207 2HB LEU 179 HB1 LEU 179 9.040 0.910 14.691
208 HG LEU 179 HG LEU 179 7.728 0.178 16.675
209 1HD1 LEU 179 HD11 LEU 179 5.997 -0.902 14.884
210 2HD1 LEU 179 HD12 LEU 179 6.074 -1.332 16.592
211 3HD1 LEU 179 HD13 LEU 179 6.902 -2.326 15.395
212 1HD2 LEU 179 HD21 LEU 179 8.863 -2.028 16.896
213 2HD2 LEU 179 HD22 LEU 179 9.925 -0.723 16.365
214 3HD2 LEU 179 HD23 LEU 179 9.328 -1.906 15.200
215 H ARG 180 HN ARG 180 9.100 2.821 13.976
216 HA ARG 180 HA ARG 180 8.599 4.627 16.195
217 1HB ARG 180 HB2 ARG 180 10.895 4.803 14.249
218 2HB ARG 180 HB1 ARG 180 10.821 5.384 15.918
219 1HG ARG 180 HG2 ARG 180 10.653 2.465 15.231
220 2HG ARG 180 HG1 ARG 180 12.192 3.294 15.467
221 1HD ARG 180 HD2 ARG 180 11.921 3.431 17.699
222 2HD ARG 180 HD1 ARG 180 10.193 3.757 17.572
223 HE ARG 180 HE ARG 180 10.365 1.149 16.900
224 1HH1 ARG 180 1HH1 ARG 180 11.580 2.982 19.611
225 2HH1 ARG 180 2HH1 ARG 180 11.496 1.647 20.710
226 1HH2 ARG 180 1HH2 ARG 180 10.254 -0.607 18.344
227 2HH2 ARG 180 2HH2 ARG 180 10.743 -0.391 19.992
228 1HG HSL 181 HG1 HSL 181 3.981 6.070 11.065
229 2HG HSL 181 HG2 HSL 181 4.435 4.705 12.214
230 H HSL 181 HN HSL 181 6.729 4.672 14.047
231 HA HSL 181 HA HSL 181 7.200 7.477 12.906
232 1HB HSL 181 HB1 HSL 181 6.196 6.896 10.894
233 2HB HSL 181 HB2 HSL 181 6.642 5.167 11.362
Start of MODEL 53
1 1H PHE 155 HT1 PHE 155 3.714 1.904 -10.027
2 2H PHE 155 HT2 PHE 155 4.208 0.658 -11.099
3 3H PHE 155 HT3 PHE 155 2.946 1.730 -11.550
4 HA PHE 155 HA PHE 155 5.760 2.456 -11.084
5 1HB PHE 155 HB2 PHE 155 4.141 2.227 -13.632
6 2HB PHE 155 HB1 PHE 155 5.814 2.762 -13.522
7 HD1 PHE 155 HD1 PHE 155 3.598 -0.049 -13.758
8 HD2 PHE 155 HD2 PHE 155 7.556 1.133 -12.734
9 HE1 PHE 155 HE1 PHE 155 4.352 -2.378 -14.001
10 HE2 PHE 155 HE2 PHE 155 8.318 -1.195 -12.977
11 HZ PHE 155 HZ PHE 155 6.714 -2.954 -13.611
12 H LEU 156 HN LEU 156 6.212 4.617 -11.170
13 HA LEU 156 HA LEU 156 4.075 6.424 -10.644
14 1HB LEU 156 HB2 LEU 156 5.772 8.091 -10.350
15 2HB LEU 156 HB1 LEU 156 6.307 6.603 -9.595
16 HG LEU 156 HG LEU 156 7.454 6.317 -12.018
17 1HD1 LEU 156 HD11 LEU 156 8.487 8.829 -12.113
18 2HD1 LEU 156 HD12 LEU 156 6.796 9.159 -11.731
19 3HD1 LEU 156 HD13 LEU 156 7.210 8.225 -13.169
20 1HD2 LEU 156 HD21 LEU 156 8.310 6.545 -9.484
21 2HD2 LEU 156 HD22 LEU 156 8.969 8.036 -10.158
22 3HD2 LEU 156 HD23 LEU 156 9.395 6.482 -10.873
23 H GLN 157 HN GLN 157 2.964 7.654 -12.030
24 HA GLN 157 HA GLN 157 3.405 7.440 -14.832
25 1HB GLN 157 HB2 GLN 157 1.385 8.592 -13.067
26 2HB GLN 157 HB1 GLN 157 1.661 9.560 -14.507
27 1HG GLN 157 HG2 GLN 157 0.398 8.181 -15.677
28 2HG GLN 157 HG1 GLN 157 1.505 6.856 -15.319
29 1HE2 GLN 157 HE21 GLN 157 -1.182 8.677 -13.901
30 2HE2 GLN 157 HE22 GLN 157 -1.899 7.328 -13.094
31 H SER 158 HN SER 158 3.151 10.423 -12.930
32 HA SER 158 HA SER 158 5.669 11.417 -13.817
33 1HB SER 158 HB2 SER 158 5.015 13.098 -15.330
34 2HB SER 158 HB1 SER 158 4.061 11.691 -15.830
35 HG SER 158 HG SER 158 2.386 12.617 -14.393
36 H ASP 159 HN ASP 159 4.270 10.984 -11.381
37 HA ASP 159 HA ASP 159 4.749 13.522 -10.137
38 1HB ASP 159 HB2 ASP 159 1.949 12.509 -10.499
39 2HB ASP 159 HB1 ASP 159 2.369 13.421 -9.053
40 H VAL 160 HN VAL 160 3.019 10.452 -9.648
41 HA VAL 160 HA VAL 160 3.366 8.758 -8.159
42 HB VAL 160 HB VAL 160 5.892 9.885 -8.285
43 1HG1 VAL 160 HG11 VAL 160 5.512 11.117 -6.194
44 2HG1 VAL 160 HG12 VAL 160 6.772 9.897 -6.019
45 3HG1 VAL 160 HG13 VAL 160 5.160 9.597 -5.372
46 1HG2 VAL 160 HG21 VAL 160 6.578 7.763 -7.901
47 2HG2 VAL 160 HG22 VAL 160 4.859 7.429 -8.115
48 3HG2 VAL 160 HG23 VAL 160 5.536 7.562 -6.492
49 H PHE 161 HN PHE 161 3.772 11.987 -6.774
50 HA PHE 161 HA PHE 161 2.666 11.310 -4.234
51 1HB PHE 161 HB2 PHE 161 3.821 13.680 -5.513
52 2HB PHE 161 HB1 PHE 161 2.503 14.053 -4.408
53 HD1 PHE 161 HD1 PHE 161 2.811 13.974 -2.082
54 HD2 PHE 161 HD2 PHE 161 5.784 12.369 -4.669
55 HE1 PHE 161 HE1 PHE 161 4.349 13.756 -0.174
56 HE2 PHE 161 HE2 PHE 161 7.327 12.146 -2.765
57 HZ PHE 161 HZ PHE 161 6.609 12.840 -0.514
58 H PHE 162 HN PHE 162 1.124 11.213 -6.995
59 HA PHE 162 HA PHE 162 -1.427 11.745 -5.827
60 1HB PHE 162 HB2 PHE 162 -0.290 13.610 -7.877
61 2HB PHE 162 HB1 PHE 162 -2.028 13.295 -7.833
62 HD1 PHE 162 HD1 PHE 162 0.675 15.159 -6.424
63 HD2 PHE 162 HD2 PHE 162 -3.256 13.721 -5.656
64 HE1 PHE 162 HE1 PHE 162 0.416 16.832 -4.639
65 HE2 PHE 162 HE2 PHE 162 -3.524 15.392 -3.871
66 HZ PHE 162 HZ PHE 162 -1.687 16.951 -3.360
67 H LEU 163 HN LEU 163 0.420 9.865 -7.629
68 HA LEU 163 HA LEU 163 -1.136 9.325 -9.934
69 1HB LEU 163 HB2 LEU 163 1.293 8.580 -9.271
70 2HB LEU 163 HB1 LEU 163 0.471 7.235 -8.504
71 HG LEU 163 HG LEU 163 0.561 7.930 -11.418
72 1HD1 LEU 163 HD11 LEU 163 2.220 6.397 -9.955
73 2HD1 LEU 163 HD12 LEU 163 1.876 6.118 -11.663
74 3HD1 LEU 163 HD13 LEU 163 1.017 5.198 -10.428
75 1HD2 LEU 163 HD21 LEU 163 -0.949 5.917 -11.692
76 2HD2 LEU 163 HD22 LEU 163 -1.710 7.395 -11.102
77 3HD2 LEU 163 HD23 LEU 163 -1.326 6.092 -9.977
78 H PHE 164 HN PHE 164 -1.094 8.293 -6.628
79 HA PHE 164 HA PHE 164 -2.649 7.302 -5.299
80 1HB PHE 164 HB2 PHE 164 -4.275 8.738 -6.448
81 2HB PHE 164 HB1 PHE 164 -4.470 7.516 -7.700
82 HD1 PHE 164 HD1 PHE 164 -4.450 7.491 -3.966
83 HD2 PHE 164 HD2 PHE 164 -6.463 6.406 -7.554
84 HE1 PHE 164 HE1 PHE 164 -6.221 6.416 -2.641
85 HE2 PHE 164 HE2 PHE 164 -8.241 5.330 -6.236
86 HZ PHE 164 HZ PHE 164 -8.122 5.335 -3.776
87 H LEU 165 HN LEU 165 -1.204 5.843 -7.822
88 HA LEU 165 HA LEU 165 -2.643 3.412 -8.058
89 1HB LEU 165 HB2 LEU 165 -0.389 4.538 -9.246
90 2HB LEU 165 HB1 LEU 165 0.212 3.109 -8.427
91 HG LEU 165 HG LEU 165 -2.006 2.124 -9.689
92 1HD1 LEU 165 HD11 LEU 165 -2.165 4.400 -10.825
93 2HD1 LEU 165 HD12 LEU 165 -2.197 2.974 -11.861
94 3HD1 LEU 165 HD13 LEU 165 -0.718 3.925 -11.714
95 1HD2 LEU 165 HD21 LEU 165 -0.189 0.791 -9.917
96 2HD2 LEU 165 HD22 LEU 165 0.906 2.143 -10.207
97 3HD2 LEU 165 HD23 LEU 165 -0.131 1.554 -11.507
98 H LEU 166 HN LEU 166 0.351 4.212 -6.318
99 HA LEU 166 HA LEU 166 -0.403 2.604 -4.065
100 1HB LEU 166 HB2 LEU 166 0.887 1.311 -6.166
101 2HB LEU 166 HB1 LEU 166 2.163 1.616 -5.002
102 HG LEU 166 HG LEU 166 0.560 0.559 -3.273
103 1HD1 LEU 166 HD11 LEU 166 -0.842 0.065 -5.824
104 2HD1 LEU 166 HD12 LEU 166 -1.478 0.225 -4.187
105 3HD1 LEU 166 HD13 LEU 166 -0.743 -1.292 -4.702
106 1HD2 LEU 166 HD21 LEU 166 1.529 -1.401 -5.308
107 2HD2 LEU 166 HD22 LEU 166 1.614 -1.474 -3.549
108 3HD2 LEU 166 HD23 LEU 166 2.684 -0.390 -4.439
109 HA PRO 167 HA PRO 167 2.847 6.066 -3.660
110 1HB PRO 167 HB2 PRO 167 1.252 7.854 -2.314
111 2HB PRO 167 HB1 PRO 167 1.594 7.901 -4.052
112 1HG PRO 167 HG2 PRO 167 -0.818 6.931 -2.618
113 2HG PRO 167 HG1 PRO 167 -0.681 7.698 -4.205
114 1HD PRO 167 HD2 PRO 167 -1.075 5.011 -3.829
115 2HD PRO 167 HD1 PRO 167 -0.314 5.712 -5.269
116 HA PRO 168 HA PRO 168 2.147 5.408 0.962
117 1HB PRO 168 HB2 PRO 168 0.065 4.132 1.920
118 2HB PRO 168 HB1 PRO 168 -0.151 5.741 1.198
119 1HG PRO 168 HG2 PRO 168 -0.712 3.047 0.010
120 2HG PRO 168 HG1 PRO 168 -1.699 4.521 -0.045
121 1HD PRO 168 HD2 PRO 168 0.064 3.679 -2.035
122 2HD PRO 168 HD1 PRO 168 -0.574 5.320 -1.846
123 H ILE 169 HN ILE 169 3.977 4.018 0.259
124 HA ILE 169 HA ILE 169 3.602 1.193 0.167
125 HB ILE 169 HB ILE 169 6.164 1.187 0.460
126 1HG1 ILE 169 HG12 ILE 169 5.739 3.781 1.160
127 2HG1 ILE 169 HG11 ILE 169 7.282 3.141 0.615
128 1HG2 ILE 169 HG21 ILE 169 4.912 2.523 -1.936
129 2HG2 ILE 169 HG22 ILE 169 5.011 0.785 -1.652
130 3HG2 ILE 169 HG23 ILE 169 6.485 1.724 -1.897
131 1HD1 ILE 169 HD11 ILE 169 5.264 4.356 -1.249
132 2HD1 ILE 169 HD12 ILE 169 6.961 3.996 -1.566
133 3HD1 ILE 169 HD13 ILE 169 6.527 5.291 -0.450
134 H ILE 170 HN ILE 170 6.211 1.958 2.214
135 HA ILE 170 HA ILE 170 6.649 0.974 4.273
136 HB ILE 170 HB ILE 170 4.653 3.122 4.974
137 1HG1 ILE 170 HG12 ILE 170 7.531 3.761 4.932
138 2HG1 ILE 170 HG11 ILE 170 6.816 3.474 3.350
139 1HG2 ILE 170 HG21 ILE 170 5.413 3.050 7.091
140 2HG2 ILE 170 HG22 ILE 170 7.072 2.716 6.596
141 3HG2 ILE 170 HG23 ILE 170 5.892 1.408 6.662
142 1HD1 ILE 170 HD11 ILE 170 6.870 5.868 4.320
143 2HD1 ILE 170 HD12 ILE 170 5.488 5.327 5.273
144 3HD1 ILE 170 HD13 ILE 170 5.413 5.292 3.511
145 H LEU 171 HN LEU 171 3.214 1.789 4.341
146 HA LEU 171 HA LEU 171 2.535 -0.206 6.243
147 1HB LEU 171 HB2 LEU 171 0.898 1.443 4.331
148 2HB LEU 171 HB1 LEU 171 0.166 0.269 5.407
149 HG LEU 171 HG LEU 171 0.063 2.597 6.258
150 1HD1 LEU 171 HD11 LEU 171 1.847 1.224 8.173
151 2HD1 LEU 171 HD12 LEU 171 0.415 0.340 7.645
152 3HD1 LEU 171 HD13 LEU 171 0.245 1.920 8.410
153 1HD2 LEU 171 HD21 LEU 171 2.023 3.739 6.990
154 2HD2 LEU 171 HD22 LEU 171 2.282 3.266 5.311
155 3HD2 LEU 171 HD23 LEU 171 3.044 2.351 6.612
156 H ASP 172 HN ASP 172 1.988 -0.011 2.732
157 HA ASP 172 HA ASP 172 0.989 -2.684 2.557
158 1HB ASP 172 HB2 ASP 172 1.555 -0.464 0.676
159 2HB ASP 172 HB1 ASP 172 1.626 -2.096 -0.003
160 H ALA 173 HN ALA 173 4.107 -1.271 2.626
161 HA ALA 173 HA ALA 173 5.440 -3.347 1.169
162 1HB ALA 173 HB1 ALA 173 6.111 -0.785 2.090
163 2HB ALA 173 HB2 ALA 173 7.109 -1.884 1.139
164 3HB ALA 173 HB3 ALA 173 7.212 -1.899 2.900
165 H GLY 174 HN GLY 174 6.008 -2.327 4.540
166 1HA GLY 174 HA2 GLY 174 6.378 -5.182 5.202
167 2HA GLY 174 HA1 GLY 174 7.167 -3.835 6.043
168 H TYR 175 HN TYR 175 4.580 -2.313 6.007
169 HA TYR 175 HA TYR 175 2.688 -2.038 7.248
170 1HB TYR 175 HB2 TYR 175 2.051 -4.328 6.533
171 2HB TYR 175 HB1 TYR 175 2.906 -4.977 7.929
172 HD1 TYR 175 HD1 TYR 175 0.524 -2.126 7.486
173 HD2 TYR 175 HD2 TYR 175 1.407 -5.778 9.482
174 HE1 TYR 175 HE1 TYR 175 -1.505 -1.865 8.850
175 HE2 TYR 175 HE2 TYR 175 -0.620 -5.528 10.850
176 HH TYR 175 HH TYR 175 -2.082 -3.556 11.629
177 H PHE 176 HN PHE 176 5.260 -3.942 8.773
178 HA PHE 176 HA PHE 176 4.604 -2.791 11.367
179 1HB PHE 176 HB2 PHE 176 5.756 -5.239 10.512
180 2HB PHE 176 HB1 PHE 176 6.993 -4.376 11.439
181 HD1 PHE 176 HD1 PHE 176 3.392 -5.329 11.613
182 HD2 PHE 176 HD2 PHE 176 7.006 -4.575 13.731
183 HE1 PHE 176 HE1 PHE 176 2.311 -6.044 13.704
184 HE2 PHE 176 HE2 PHE 176 5.932 -5.289 15.826
185 HZ PHE 176 HZ PHE 176 3.582 -6.025 15.815
186 H LEU 177 HN LEU 177 6.514 -2.049 8.705
187 HA LEU 177 HA LEU 177 8.907 -1.121 9.680
188 1HB LEU 177 HB2 LEU 177 7.317 0.474 7.695
189 2HB LEU 177 HB1 LEU 177 9.055 0.278 7.792
190 HG LEU 177 HG LEU 177 7.034 -1.749 6.843
191 1HD1 LEU 177 HD11 LEU 177 7.745 -1.308 4.755
192 2HD1 LEU 177 HD12 LEU 177 9.413 -1.043 5.263
193 3HD1 LEU 177 HD13 LEU 177 8.218 0.239 5.459
194 1HD2 LEU 177 HD21 LEU 177 9.799 -2.097 7.840
195 2HD2 LEU 177 HD22 LEU 177 9.366 -2.956 6.361
196 3HD2 LEU 177 HD23 LEU 177 8.441 -3.222 7.839
197 HA PRO 178 HA PRO 178 6.561 3.077 10.774
198 1HB PRO 178 HB2 PRO 178 3.980 1.883 11.621
199 2HB PRO 178 HB1 PRO 178 4.292 3.378 10.733
200 1HG PRO 178 HG2 PRO 178 3.307 1.242 9.489
201 2HG PRO 178 HG1 PRO 178 4.514 2.278 8.701
202 1HD PRO 178 HD2 PRO 178 4.874 -0.382 10.028
203 2HD PRO 178 HD1 PRO 178 5.584 0.227 8.519
204 H LEU 179 HN LEU 179 6.665 0.027 12.325
205 HA LEU 179 HA LEU 179 5.954 0.654 14.947
206 1HB LEU 179 HB2 LEU 179 6.329 -1.629 14.248
207 2HB LEU 179 HB1 LEU 179 8.012 -1.286 13.892
208 HG LEU 179 HG LEU 179 8.485 -0.961 16.257
209 1HD1 LEU 179 HD11 LEU 179 5.529 -1.121 16.463
210 2HD1 LEU 179 HD12 LEU 179 6.674 -0.100 17.333
211 3HD1 LEU 179 HD13 LEU 179 6.488 -1.796 17.780
212 1HD2 LEU 179 HD21 LEU 179 7.895 -3.295 17.050
213 2HD2 LEU 179 HD22 LEU 179 8.790 -3.185 15.534
214 3HD2 LEU 179 HD23 LEU 179 7.056 -3.500 15.513
215 H ARG 180 HN ARG 180 9.192 0.639 13.475
216 HA ARG 180 HA ARG 180 10.243 2.144 15.737
217 1HB ARG 180 HB2 ARG 180 12.437 1.897 14.502
218 2HB ARG 180 HB1 ARG 180 11.677 0.392 15.030
219 1HG ARG 180 HG2 ARG 180 10.726 0.905 12.429
220 2HG ARG 180 HG1 ARG 180 12.464 1.203 12.404
221 1HD ARG 180 HD2 ARG 180 12.640 -1.015 12.132
222 2HD ARG 180 HD1 ARG 180 12.322 -1.094 13.861
223 HE ARG 180 HE ARG 180 10.095 -1.713 13.406
224 1HH1 ARG 180 1HH1 ARG 180 11.980 -1.326 10.485
225 2HH1 ARG 180 2HH1 ARG 180 10.883 -2.245 9.513
226 1HH2 ARG 180 1HH2 ARG 180 8.659 -2.918 12.120
227 2HH2 ARG 180 2HH2 ARG 180 8.999 -3.145 10.437
228 1HG HSL 181 HG1 HSL 181 7.958 7.527 11.802
229 2HG HSL 181 HG2 HSL 181 6.268 6.932 12.223
230 H HSL 181 HN HSL 181 8.310 3.542 14.392
231 HA HSL 181 HA HSL 181 9.907 5.706 12.921
232 1HB HSL 181 HB1 HSL 181 8.293 5.214 11.254
233 2HB HSL 181 HB2 HSL 181 7.047 4.656 12.495
Start of MODEL 54
1 1H PHE 155 HT1 PHE 155 0.296 11.442 -0.216
2 2H PHE 155 HT2 PHE 155 1.381 10.327 -0.939
3 3H PHE 155 HT3 PHE 155 0.304 11.234 -1.918
4 HA PHE 155 HA PHE 155 2.564 12.239 -0.339
5 1HB PHE 155 HB2 PHE 155 2.948 11.034 -2.543
6 2HB PHE 155 HB1 PHE 155 2.060 12.346 -3.309
7 HD1 PHE 155 HD1 PHE 155 2.975 14.656 -3.226
8 HD2 PHE 155 HD2 PHE 155 5.207 11.283 -1.905
9 HE1 PHE 155 HE1 PHE 155 5.048 15.974 -3.375
10 HE2 PHE 155 HE2 PHE 155 7.283 12.595 -2.049
11 HZ PHE 155 HZ PHE 155 7.205 14.944 -2.784
12 H LEU 156 HN LEU 156 -0.556 12.888 -1.268
13 HA LEU 156 HA LEU 156 -1.822 14.746 -1.298
14 1HB LEU 156 HB2 LEU 156 0.535 15.656 0.300
15 2HB LEU 156 HB1 LEU 156 -0.738 16.789 -0.106
16 HG LEU 156 HG LEU 156 -1.292 14.195 1.317
17 1HD1 LEU 156 HD11 LEU 156 -0.335 16.810 2.384
18 2HD1 LEU 156 HD12 LEU 156 0.082 15.170 2.880
19 3HD1 LEU 156 HD13 LEU 156 -1.481 15.855 3.323
20 1HD2 LEU 156 HD21 LEU 156 -3.030 15.788 0.091
21 2HD2 LEU 156 HD22 LEU 156 -2.917 16.656 1.622
22 3HD2 LEU 156 HD23 LEU 156 -3.412 14.963 1.603
23 H GLN 157 HN GLN 157 -0.013 14.200 -3.517
24 HA GLN 157 HA GLN 157 -0.395 16.591 -4.984
25 1HB GLN 157 HB2 GLN 157 1.702 17.017 -3.500
26 2HB GLN 157 HB1 GLN 157 2.518 15.959 -4.644
27 1HG GLN 157 HG2 GLN 157 2.923 17.850 -5.758
28 2HG GLN 157 HG1 GLN 157 1.266 17.665 -6.329
29 1HE2 GLN 157 HE21 GLN 157 1.139 19.920 -6.613
30 2HE2 GLN 157 HE22 GLN 157 0.911 20.981 -5.270
31 H SER 158 HN SER 158 1.125 13.451 -4.688
32 HA SER 158 HA SER 158 1.669 13.128 -7.470
33 1HB SER 158 HB2 SER 158 2.187 10.820 -6.914
34 2HB SER 158 HB1 SER 158 2.874 11.882 -5.672
35 HG SER 158 HG SER 158 0.784 11.419 -4.536
36 H ASP 159 HN ASP 159 -0.680 14.010 -7.775
37 HA ASP 159 HA ASP 159 -2.632 13.593 -8.875
38 1HB ASP 159 HB2 ASP 159 -1.211 11.272 -9.339
39 2HB ASP 159 HB1 ASP 159 -2.697 10.679 -8.604
40 H VAL 160 HN VAL 160 -2.265 11.064 -6.392
41 HA VAL 160 HA VAL 160 -3.439 10.608 -4.499
42 HB VAL 160 HB VAL 160 -4.830 13.235 -5.012
43 1HG1 VAL 160 HG11 VAL 160 -4.863 11.380 -2.644
44 2HG1 VAL 160 HG12 VAL 160 -6.235 11.940 -3.601
45 3HG1 VAL 160 HG13 VAL 160 -5.368 13.067 -2.558
46 1HG2 VAL 160 HG21 VAL 160 -2.220 12.909 -4.418
47 2HG2 VAL 160 HG22 VAL 160 -2.916 12.954 -2.799
48 3HG2 VAL 160 HG23 VAL 160 -3.180 14.298 -3.909
49 H PHE 161 HN PHE 161 -5.506 11.972 -7.057
50 HA PHE 161 HA PHE 161 -7.742 10.320 -6.415
51 1HB PHE 161 HB2 PHE 161 -7.319 12.593 -7.977
52 2HB PHE 161 HB1 PHE 161 -7.756 11.341 -9.133
53 HD1 PHE 161 HD1 PHE 161 -8.907 11.878 -5.636
54 HD2 PHE 161 HD2 PHE 161 -9.933 11.798 -9.765
55 HE1 PHE 161 HE1 PHE 161 -11.279 12.169 -5.047
56 HE2 PHE 161 HE2 PHE 161 -12.306 12.091 -9.185
57 HZ PHE 161 HZ PHE 161 -12.981 12.277 -6.823
58 H PHE 162 HN PHE 162 -4.878 9.408 -7.519
59 HA PHE 162 HA PHE 162 -5.871 6.981 -8.672
60 1HB PHE 162 HB2 PHE 162 -4.262 8.901 -10.363
61 2HB PHE 162 HB1 PHE 162 -4.497 7.197 -10.757
62 HD1 PHE 162 HD1 PHE 162 -5.741 10.465 -11.188
63 HD2 PHE 162 HD2 PHE 162 -6.974 6.402 -10.890
64 HE1 PHE 162 HE1 PHE 162 -7.846 11.024 -12.333
65 HE2 PHE 162 HE2 PHE 162 -9.081 6.954 -12.036
66 HZ PHE 162 HZ PHE 162 -9.519 9.267 -12.758
67 H LEU 163 HN LEU 163 -3.899 8.458 -6.661
68 HA LEU 163 HA LEU 163 -1.373 7.199 -7.103
69 1HB LEU 163 HB2 LEU 163 -1.790 9.283 -5.745
70 2HB LEU 163 HB1 LEU 163 -2.528 8.254 -4.532
71 HG LEU 163 HG LEU 163 -0.377 7.068 -4.252
72 1HD1 LEU 163 HD11 LEU 163 0.859 7.212 -6.162
73 2HD1 LEU 163 HD12 LEU 163 1.603 8.513 -5.233
74 3HD1 LEU 163 HD13 LEU 163 0.401 8.888 -6.467
75 1HD2 LEU 163 HD21 LEU 163 -0.499 8.615 -2.602
76 2HD2 LEU 163 HD22 LEU 163 -0.749 9.954 -3.722
77 3HD2 LEU 163 HD23 LEU 163 0.871 9.299 -3.477
78 H PHE 164 HN PHE 164 -4.324 6.049 -6.356
79 HA PHE 164 HA PHE 164 -3.966 4.249 -4.257
80 1HB PHE 164 HB2 PHE 164 -6.154 4.927 -5.159
81 2HB PHE 164 HB1 PHE 164 -5.814 4.029 -6.635
82 HD1 PHE 164 HD1 PHE 164 -5.552 3.304 -2.980
83 HD2 PHE 164 HD2 PHE 164 -7.033 2.101 -6.783
84 HE1 PHE 164 HE1 PHE 164 -6.519 1.283 -1.960
85 HE2 PHE 164 HE2 PHE 164 -8.004 0.079 -5.771
86 HZ PHE 164 HZ PHE 164 -7.747 -0.332 -3.356
87 H LEU 165 HN LEU 165 -2.479 4.219 -7.264
88 HA LEU 165 HA LEU 165 -2.447 1.456 -7.857
89 1HB LEU 165 HB2 LEU 165 -1.428 3.764 -9.010
90 2HB LEU 165 HB1 LEU 165 0.007 2.875 -8.528
91 HG LEU 165 HG LEU 165 -0.720 2.448 -10.872
92 1HD1 LEU 165 HD11 LEU 165 -0.394 0.064 -10.787
93 2HD1 LEU 165 HD12 LEU 165 -0.853 0.026 -9.085
94 3HD1 LEU 165 HD13 LEU 165 0.633 0.835 -9.578
95 1HD2 LEU 165 HD21 LEU 165 -2.726 1.507 -11.428
96 2HD2 LEU 165 HD22 LEU 165 -3.220 2.471 -10.035
97 3HD2 LEU 165 HD23 LEU 165 -2.931 0.740 -9.853
98 H LEU 166 HN LEU 166 -0.472 3.563 -5.851
99 HA LEU 166 HA LEU 166 0.411 1.375 -4.232
100 1HB LEU 166 HB2 LEU 166 1.905 1.828 -6.501
101 2HB LEU 166 HB1 LEU 166 2.781 2.735 -5.282
102 HG LEU 166 HG LEU 166 2.012 -0.069 -4.637
103 1HD1 LEU 166 HD11 LEU 166 3.924 -0.977 -5.774
104 2HD1 LEU 166 HD12 LEU 166 4.386 0.620 -6.361
105 3HD1 LEU 166 HD13 LEU 166 2.908 -0.142 -6.949
106 1HD2 LEU 166 HD21 LEU 166 3.297 1.765 -3.224
107 2HD2 LEU 166 HD22 LEU 166 4.675 1.147 -4.135
108 3HD2 LEU 166 HD23 LEU 166 3.721 0.055 -3.130
109 HA PRO 167 HA PRO 167 0.384 5.816 -2.522
110 1HB PRO 167 HB2 PRO 167 -1.605 4.813 -0.632
111 2HB PRO 167 HB1 PRO 167 -1.657 6.243 -1.674
112 1HG PRO 167 HG2 PRO 167 -3.161 4.007 -2.085
113 2HG PRO 167 HG1 PRO 167 -2.674 5.129 -3.362
114 1HD PRO 167 HD2 PRO 167 -1.635 2.425 -2.724
115 2HD PRO 167 HD1 PRO 167 -1.726 3.263 -4.278
116 HA PRO 168 HA PRO 168 1.576 3.806 1.586
117 1HB PRO 168 HB2 PRO 168 0.620 1.477 2.380
118 2HB PRO 168 HB1 PRO 168 -0.447 2.893 2.283
119 1HG PRO 168 HG2 PRO 168 -0.180 0.594 0.385
120 2HG PRO 168 HG1 PRO 168 -1.644 1.417 0.949
121 1HD PRO 168 HD2 PRO 168 -0.306 1.919 -1.450
122 2HD PRO 168 HD1 PRO 168 -1.492 2.988 -0.679
123 H ILE 169 HN ILE 169 3.637 3.642 0.471
124 HA ILE 169 HA ILE 169 4.523 1.088 -0.517
125 HB ILE 169 HB ILE 169 5.297 3.516 -1.175
126 1HG1 ILE 169 HG12 ILE 169 7.212 1.182 -0.968
127 2HG1 ILE 169 HG11 ILE 169 6.036 1.438 -2.254
128 1HG2 ILE 169 HG21 ILE 169 6.105 4.009 1.134
129 2HG2 ILE 169 HG22 ILE 169 7.297 4.276 -0.136
130 3HG2 ILE 169 HG23 ILE 169 7.392 2.833 0.872
131 1HD1 ILE 169 HD11 ILE 169 8.517 3.014 -1.662
132 2HD1 ILE 169 HD12 ILE 169 7.244 3.612 -2.727
133 3HD1 ILE 169 HD13 ILE 169 8.101 2.122 -3.125
134 H ILE 170 HN ILE 170 4.903 2.972 2.391
135 HA ILE 170 HA ILE 170 6.856 1.251 3.599
136 HB ILE 170 HB ILE 170 5.217 3.355 4.995
137 1HG1 ILE 170 HG12 ILE 170 7.693 4.466 4.420
138 2HG1 ILE 170 HG11 ILE 170 7.264 3.631 2.930
139 1HG2 ILE 170 HG21 ILE 170 7.940 2.191 5.562
140 2HG2 ILE 170 HG22 ILE 170 6.456 1.864 6.457
141 3HG2 ILE 170 HG23 ILE 170 7.161 3.480 6.482
142 1HD1 ILE 170 HD11 ILE 170 6.570 6.041 3.098
143 2HD1 ILE 170 HD12 ILE 170 5.407 5.534 4.323
144 3HD1 ILE 170 HD13 ILE 170 5.292 4.900 2.682
145 H LEU 171 HN LEU 171 3.523 2.115 4.601
146 HA LEU 171 HA LEU 171 3.367 0.083 6.544
147 1HB LEU 171 HB2 LEU 171 0.808 0.428 6.169
148 2HB LEU 171 HB1 LEU 171 1.774 1.695 6.898
149 HG LEU 171 HG LEU 171 1.640 1.959 4.002
150 1HD1 LEU 171 HD11 LEU 171 -0.886 1.687 5.570
151 2HD1 LEU 171 HD12 LEU 171 -0.508 1.122 3.943
152 3HD1 LEU 171 HD13 LEU 171 -0.797 2.837 4.235
153 1HD2 LEU 171 HD21 LEU 171 1.617 4.167 4.499
154 2HD2 LEU 171 HD22 LEU 171 2.199 3.580 6.057
155 3HD2 LEU 171 HD23 LEU 171 0.492 3.967 5.841
156 H ASP 172 HN ASP 172 2.126 0.208 3.222
157 HA ASP 172 HA ASP 172 1.175 -2.481 3.291
158 1HB ASP 172 HB2 ASP 172 0.675 -0.354 1.672
159 2HB ASP 172 HB1 ASP 172 1.750 -1.312 0.645
160 H ALA 173 HN ALA 173 4.263 -1.303 3.294
161 HA ALA 173 HA ALA 173 5.472 -3.051 1.392
162 1HB ALA 173 HB1 ALA 173 6.350 -0.969 3.162
163 2HB ALA 173 HB2 ALA 173 7.146 -1.628 1.736
164 3HB ALA 173 HB3 ALA 173 7.401 -2.375 3.312
165 H GLY 174 HN GLY 174 5.779 -2.913 4.924
166 1HA GLY 174 HA2 GLY 174 5.756 -5.870 4.985
167 2HA GLY 174 HA1 GLY 174 6.850 -4.904 5.994
168 H TYR 175 HN TYR 175 4.315 -3.004 6.067
169 HA TYR 175 HA TYR 175 2.481 -2.660 7.366
170 1HB TYR 175 HB2 TYR 175 1.902 -5.067 6.776
171 2HB TYR 175 HB1 TYR 175 2.636 -5.521 8.311
172 HD1 TYR 175 HD1 TYR 175 1.661 -4.583 10.442
173 HD2 TYR 175 HD2 TYR 175 -0.304 -4.236 6.685
174 HE1 TYR 175 HE1 TYR 175 -0.457 -4.114 11.600
175 HE2 TYR 175 HE2 TYR 175 -2.427 -3.764 7.833
176 HH TYR 175 HH TYR 175 -2.643 -2.896 11.018
177 H PHE 176 HN PHE 176 5.270 -4.297 8.704
178 HA PHE 176 HA PHE 176 4.707 -3.167 11.344
179 1HB PHE 176 HB2 PHE 176 6.523 -5.334 10.340
180 2HB PHE 176 HB1 PHE 176 6.852 -4.555 11.894
181 HD1 PHE 176 HD1 PHE 176 5.493 -4.987 13.802
182 HD2 PHE 176 HD2 PHE 176 4.469 -6.630 10.013
183 HE1 PHE 176 HE1 PHE 176 3.869 -6.479 14.892
184 HE2 PHE 176 HE2 PHE 176 2.843 -8.125 11.095
185 HZ PHE 176 HZ PHE 176 2.540 -8.051 13.539
186 H LEU 177 HN LEU 177 5.848 -1.854 8.745
187 HA LEU 177 HA LEU 177 8.423 -0.918 9.691
188 1HB LEU 177 HB2 LEU 177 6.999 0.182 7.297
189 2HB LEU 177 HB1 LEU 177 8.721 0.055 7.591
190 HG LEU 177 HG LEU 177 6.818 -2.157 6.836
191 1HD1 LEU 177 HD11 LEU 177 8.518 -2.420 4.996
192 2HD1 LEU 177 HD12 LEU 177 9.205 -0.883 5.524
193 3HD1 LEU 177 HD13 LEU 177 7.544 -0.951 4.935
194 1HD2 LEU 177 HD21 LEU 177 8.104 -3.391 8.240
195 2HD2 LEU 177 HD22 LEU 177 9.460 -2.266 8.168
196 3HD2 LEU 177 HD23 LEU 177 9.180 -3.395 6.843
197 HA PRO 178 HA PRO 178 5.630 3.210 9.616
198 1HB PRO 178 HB2 PRO 178 3.228 1.820 10.708
199 2HB PRO 178 HB1 PRO 178 3.327 3.215 9.627
200 1HG PRO 178 HG2 PRO 178 2.688 0.804 8.690
201 2HG PRO 178 HG1 PRO 178 3.715 1.906 7.755
202 1HD PRO 178 HD2 PRO 178 4.456 -0.534 9.292
203 2HD PRO 178 HD1 PRO 178 5.164 0.125 7.805
204 H LEU 179 HN LEU 179 5.677 0.508 11.818
205 HA LEU 179 HA LEU 179 5.140 1.923 14.205
206 1HB LEU 179 HB2 LEU 179 6.433 -0.710 13.586
207 2HB LEU 179 HB1 LEU 179 6.397 -0.097 15.228
208 HG LEU 179 HG LEU 179 4.574 -1.628 14.945
209 1HD1 LEU 179 HD11 LEU 179 3.042 0.883 14.749
210 2HD1 LEU 179 HD12 LEU 179 4.304 0.834 15.980
211 3HD1 LEU 179 HD13 LEU 179 3.018 -0.373 15.987
212 1HD2 LEU 179 HD21 LEU 179 3.743 0.083 12.605
213 2HD2 LEU 179 HD22 LEU 179 2.818 -1.262 13.273
214 3HD2 LEU 179 HD23 LEU 179 4.388 -1.556 12.523
215 H ARG 180 HN ARG 180 7.808 2.080 12.167
216 HA ARG 180 HA ARG 180 9.324 3.499 14.204
217 1HB ARG 180 HB2 ARG 180 10.222 0.987 12.854
218 2HB ARG 180 HB1 ARG 180 11.419 2.242 13.192
219 1HG ARG 180 HG2 ARG 180 11.451 1.785 15.377
220 2HG ARG 180 HG1 ARG 180 9.696 1.619 15.468
221 1HD ARG 180 HD2 ARG 180 11.154 -0.520 14.043
222 2HD ARG 180 HD1 ARG 180 11.395 -0.434 15.788
223 HE ARG 180 HE ARG 180 9.000 -1.225 14.399
224 1HH1 ARG 180 1HH1 ARG 180 10.312 -0.001 17.393
225 2HH1 ARG 180 2HH1 ARG 180 8.990 -0.575 18.352
226 1HH2 ARG 180 1HH2 ARG 180 7.259 -1.978 15.658
227 2HH2 ARG 180 2HH2 ARG 180 7.256 -1.698 17.368
228 1HG HSL 181 HG1 HSL 181 8.467 7.166 8.268
229 2HG HSL 181 HG2 HSL 181 6.699 7.208 8.776
230 H HSL 181 HN HSL 181 7.874 4.635 12.255
231 HA HSL 181 HA HSL 181 9.946 5.539 10.185
232 1HB HSL 181 HB1 HSL 181 8.229 4.825 8.721
233 2HB HSL 181 HB2 HSL 181 6.907 5.117 9.976
Start of MODEL 55
1 1H PHE 155 HT1 PHE 155 7.105 0.247 -5.890
2 2H PHE 155 HT2 PHE 155 5.588 0.976 -6.224
3 3H PHE 155 HT3 PHE 155 6.425 0.124 -7.457
4 HA PHE 155 HA PHE 155 6.218 -1.891 -6.168
5 1HB PHE 155 HB2 PHE 155 6.005 -0.696 -3.989
6 2HB PHE 155 HB1 PHE 155 4.384 -0.199 -4.471
7 HD1 PHE 155 HD1 PHE 155 2.547 -1.660 -4.267
8 HD2 PHE 155 HD2 PHE 155 6.499 -3.107 -3.648
9 HE1 PHE 155 HE1 PHE 155 1.632 -3.762 -3.374
10 HE2 PHE 155 HE2 PHE 155 5.593 -5.212 -2.753
11 HZ PHE 155 HZ PHE 155 3.156 -5.541 -2.616
12 H LEU 156 HN LEU 156 4.517 0.412 -7.798
13 HA LEU 156 HA LEU 156 2.774 0.359 -9.220
14 1HB LEU 156 HB2 LEU 156 3.388 -2.559 -8.964
15 2HB LEU 156 HB1 LEU 156 2.073 -1.998 -9.977
16 HG LEU 156 HG LEU 156 4.551 -2.444 -10.893
17 1HD1 LEU 156 HD11 LEU 156 3.076 -0.100 -12.010
18 2HD1 LEU 156 HD12 LEU 156 2.335 -1.701 -12.030
19 3HD1 LEU 156 HD13 LEU 156 3.871 -1.430 -12.851
20 1HD2 LEU 156 HD21 LEU 156 4.544 0.500 -10.241
21 2HD2 LEU 156 HD22 LEU 156 5.753 -0.359 -11.194
22 3HD2 LEU 156 HD23 LEU 156 5.568 -0.717 -9.477
23 H GLN 157 HN GLN 157 1.064 1.218 -8.159
24 HA GLN 157 HA GLN 157 -1.058 -0.471 -7.352
25 1HB GLN 157 HB2 GLN 157 0.320 -0.729 -5.341
26 2HB GLN 157 HB1 GLN 157 0.375 1.018 -5.145
27 1HG GLN 157 HG2 GLN 157 -1.440 0.894 -3.894
28 2HG GLN 157 HG1 GLN 157 -2.340 0.346 -5.307
29 1HE2 GLN 157 HE21 GLN 157 -3.610 -1.220 -4.587
30 2HE2 GLN 157 HE22 GLN 157 -3.093 -2.599 -3.685
31 H SER 158 HN SER 158 -2.184 0.808 -8.814
32 HA SER 158 HA SER 158 -3.603 2.477 -9.419
33 1HB SER 158 HB2 SER 158 -4.216 2.336 -6.946
34 2HB SER 158 HB1 SER 158 -3.153 3.732 -6.707
35 HG SER 158 HG SER 158 -5.671 3.729 -7.500
36 H ASP 159 HN ASP 159 -1.414 2.838 -10.635
37 HA ASP 159 HA ASP 159 -0.157 4.380 -11.734
38 1HB ASP 159 HB2 ASP 159 -2.236 5.962 -10.508
39 2HB ASP 159 HB1 ASP 159 -0.720 6.859 -10.521
40 H VAL 160 HN VAL 160 -0.420 5.429 -8.335
41 HA VAL 160 HA VAL 160 1.160 5.511 -6.681
42 HB VAL 160 HB VAL 160 3.151 4.800 -8.829
43 1HG1 VAL 160 HG11 VAL 160 4.382 5.907 -7.177
44 2HG1 VAL 160 HG12 VAL 160 4.554 4.199 -6.772
45 3HG1 VAL 160 HG13 VAL 160 3.422 5.209 -5.872
46 1HG2 VAL 160 HG21 VAL 160 1.998 2.843 -8.625
47 2HG2 VAL 160 HG22 VAL 160 1.502 3.181 -6.966
48 3HG2 VAL 160 HG23 VAL 160 3.149 2.642 -7.303
49 H PHE 161 HN PHE 161 2.707 6.647 -9.666
50 HA PHE 161 HA PHE 161 3.573 9.094 -8.440
51 1HB PHE 161 HB2 PHE 161 4.147 9.656 -10.914
52 2HB PHE 161 HB1 PHE 161 5.059 8.395 -10.095
53 HD1 PHE 161 HD1 PHE 161 5.605 6.684 -11.504
54 HD2 PHE 161 HD2 PHE 161 1.782 8.513 -11.897
55 HE1 PHE 161 HE1 PHE 161 5.040 5.109 -13.307
56 HE2 PHE 161 HE2 PHE 161 1.210 6.940 -13.696
57 HZ PHE 161 HZ PHE 161 2.839 5.237 -14.406
58 H PHE 162 HN PHE 162 0.917 8.992 -8.040
59 HA PHE 162 HA PHE 162 0.008 11.393 -9.209
60 1HB PHE 162 HB2 PHE 162 -0.981 8.833 -10.344
61 2HB PHE 162 HB1 PHE 162 -2.140 10.137 -10.093
62 HD1 PHE 162 HD1 PHE 162 -0.663 12.521 -10.755
63 HD2 PHE 162 HD2 PHE 162 -0.573 8.693 -12.610
64 HE1 PHE 162 HE1 PHE 162 0.036 13.567 -12.870
65 HE2 PHE 162 HE2 PHE 162 0.128 9.732 -14.728
66 HZ PHE 162 HZ PHE 162 0.434 12.172 -14.859
67 H LEU 163 HN LEU 163 -0.616 8.492 -7.323
68 HA LEU 163 HA LEU 163 -3.033 9.253 -6.140
69 1HB LEU 163 HB2 LEU 163 -1.338 7.130 -5.860
70 2HB LEU 163 HB1 LEU 163 -1.027 7.997 -4.368
71 HG LEU 163 HG LEU 163 -2.763 6.203 -4.206
72 1HD1 LEU 163 HD11 LEU 163 -4.480 7.799 -3.104
73 2HD1 LEU 163 HD12 LEU 163 -3.297 9.049 -3.489
74 3HD1 LEU 163 HD13 LEU 163 -2.846 7.697 -2.451
75 1HD2 LEU 163 HD21 LEU 163 -4.658 8.062 -5.569
76 2HD2 LEU 163 HD22 LEU 163 -4.804 6.330 -5.267
77 3HD2 LEU 163 HD23 LEU 163 -3.712 6.917 -6.522
78 H PHE 164 HN PHE 164 0.290 9.608 -4.959
79 HA PHE 164 HA PHE 164 1.312 11.199 -3.707
80 1HB PHE 164 HB2 PHE 164 0.630 12.476 -5.725
81 2HB PHE 164 HB1 PHE 164 -0.834 12.969 -4.883
82 HD1 PHE 164 HD1 PHE 164 -0.530 15.291 -4.795
83 HD2 PHE 164 HD2 PHE 164 2.557 12.707 -3.414
84 HE1 PHE 164 HE1 PHE 164 0.659 17.224 -3.843
85 HE2 PHE 164 HE2 PHE 164 3.751 14.637 -2.460
86 HZ PHE 164 HZ PHE 164 2.802 16.898 -2.676
87 H LEU 165 HN LEU 165 -2.188 11.142 -3.299
88 HA LEU 165 HA LEU 165 -2.347 12.668 -0.964
89 1HB LEU 165 HB2 LEU 165 -4.080 10.783 -2.412
90 2HB LEU 165 HB1 LEU 165 -4.420 10.937 -0.697
91 HG LEU 165 HG LEU 165 -4.398 13.180 -2.720
92 1HD1 LEU 165 HD11 LEU 165 -6.351 11.356 -2.348
93 2HD1 LEU 165 HD12 LEU 165 -6.637 13.025 -2.838
94 3HD1 LEU 165 HD13 LEU 165 -6.803 12.564 -1.144
95 1HD2 LEU 165 HD21 LEU 165 -3.650 14.165 -0.738
96 2HD2 LEU 165 HD22 LEU 165 -4.700 13.163 0.264
97 3HD2 LEU 165 HD23 LEU 165 -5.392 14.444 -0.732
98 H LEU 166 HN LEU 166 -1.919 9.143 -1.414
99 HA LEU 166 HA LEU 166 -0.657 8.986 1.161
100 1HB LEU 166 HB2 LEU 166 -3.414 8.814 1.157
101 2HB LEU 166 HB1 LEU 166 -2.912 7.133 1.163
102 HG LEU 166 HG LEU 166 -1.523 8.854 3.114
103 1HD1 LEU 166 HD11 LEU 166 -4.464 8.626 3.027
104 2HD1 LEU 166 HD12 LEU 166 -3.439 9.868 3.745
105 3HD1 LEU 166 HD13 LEU 166 -3.698 8.342 4.590
106 1HD2 LEU 166 HD21 LEU 166 -1.607 6.223 2.702
107 2HD2 LEU 166 HD22 LEU 166 -2.963 6.363 3.820
108 3HD2 LEU 166 HD23 LEU 166 -1.362 6.924 4.302
109 HA PRO 167 HA PRO 167 0.632 5.785 -1.944
110 1HB PRO 167 HB2 PRO 167 3.291 6.014 -1.395
111 2HB PRO 167 HB1 PRO 167 2.451 6.995 -2.611
112 1HG PRO 167 HG2 PRO 167 3.217 7.701 0.196
113 2HG PRO 167 HG1 PRO 167 3.302 8.690 -1.274
114 1HD PRO 167 HD2 PRO 167 1.318 8.957 0.547
115 2HD PRO 167 HD1 PRO 167 1.063 9.236 -1.187
116 HA PRO 168 HA PRO 168 0.716 3.144 1.772
117 1HB PRO 168 HB2 PRO 168 -0.340 0.971 0.584
118 2HB PRO 168 HB1 PRO 168 -1.339 2.356 1.070
119 1HG PRO 168 HG2 PRO 168 -0.212 1.694 -1.637
120 2HG PRO 168 HG1 PRO 168 -1.862 2.192 -1.211
121 1HD PRO 168 HD2 PRO 168 -0.034 3.922 -2.191
122 2HD PRO 168 HD1 PRO 168 -1.270 4.417 -1.018
123 H ILE 169 HN ILE 169 3.128 3.591 0.324
124 HA ILE 169 HA ILE 169 4.142 1.082 -0.607
125 HB ILE 169 HB ILE 169 6.298 2.241 -0.786
126 1HG1 ILE 169 HG12 ILE 169 4.763 4.563 0.379
127 2HG1 ILE 169 HG11 ILE 169 6.104 3.716 1.138
128 1HG2 ILE 169 HG21 ILE 169 5.714 3.550 -2.638
129 2HG2 ILE 169 HG22 ILE 169 4.166 4.011 -1.931
130 3HG2 ILE 169 HG23 ILE 169 4.414 2.364 -2.509
131 1HD1 ILE 169 HD11 ILE 169 6.937 5.759 0.275
132 2HD1 ILE 169 HD12 ILE 169 6.189 5.472 -1.296
133 3HD1 ILE 169 HD13 ILE 169 7.539 4.467 -0.764
134 H ILE 170 HN ILE 170 4.591 3.067 2.273
135 HA ILE 170 HA ILE 170 6.469 1.295 3.498
136 HB ILE 170 HB ILE 170 4.883 3.462 4.867
137 1HG1 ILE 170 HG12 ILE 170 7.335 4.556 4.342
138 2HG1 ILE 170 HG11 ILE 170 7.047 3.623 2.877
139 1HG2 ILE 170 HG21 ILE 170 5.949 2.503 6.607
140 2HG2 ILE 170 HG22 ILE 170 7.311 3.459 6.025
141 3HG2 ILE 170 HG23 ILE 170 7.176 1.757 5.583
142 1HD1 ILE 170 HD11 ILE 170 6.004 5.485 2.206
143 2HD1 ILE 170 HD12 ILE 170 5.748 6.062 3.854
144 3HD1 ILE 170 HD13 ILE 170 4.662 4.855 3.162
145 H LEU 171 HN LEU 171 3.029 2.048 4.083
146 HA LEU 171 HA LEU 171 2.719 0.259 6.247
147 1HB LEU 171 HB2 LEU 171 1.065 1.949 5.925
148 2HB LEU 171 HB1 LEU 171 0.759 1.431 4.277
149 HG LEU 171 HG LEU 171 -0.206 -0.679 5.150
150 1HD1 LEU 171 HD11 LEU 171 -0.255 -1.242 7.327
151 2HD1 LEU 171 HD12 LEU 171 -0.496 0.420 7.862
152 3HD1 LEU 171 HD13 LEU 171 1.121 -0.143 7.437
153 1HD2 LEU 171 HD21 LEU 171 -1.578 1.670 6.420
154 2HD2 LEU 171 HD22 LEU 171 -2.297 0.238 5.685
155 3HD2 LEU 171 HD23 LEU 171 -1.517 1.452 4.671
156 H ASP 172 HN ASP 172 1.840 -0.046 2.836
157 HA ASP 172 HA ASP 172 1.233 -2.825 3.019
158 1HB ASP 172 HB2 ASP 172 0.483 -0.955 1.272
159 2HB ASP 172 HB1 ASP 172 1.881 -1.580 0.388
160 H ALA 173 HN ALA 173 4.142 -1.235 3.138
161 HA ALA 173 HA ALA 173 5.720 -2.899 1.451
162 1HB ALA 173 HB1 ALA 173 7.414 -1.905 3.419
163 2HB ALA 173 HB2 ALA 173 6.172 -0.670 3.233
164 3HB ALA 173 HB3 ALA 173 7.106 -1.196 1.835
165 H GLY 174 HN GLY 174 5.956 -2.543 4.961
166 1HA GLY 174 HA2 GLY 174 6.209 -5.482 5.188
167 2HA GLY 174 HA1 GLY 174 7.130 -4.344 6.190
168 H TYR 175 HN TYR 175 4.446 -2.720 6.071
169 HA TYR 175 HA TYR 175 2.532 -2.485 7.269
170 1HB TYR 175 HB2 TYR 175 2.356 -5.058 6.734
171 2HB TYR 175 HB1 TYR 175 2.748 -5.235 8.442
172 HD1 TYR 175 HD1 TYR 175 1.036 -5.190 10.007
173 HD2 TYR 175 HD2 TYR 175 0.383 -3.433 6.187
174 HE1 TYR 175 HE1 TYR 175 -1.320 -4.807 10.594
175 HE2 TYR 175 HE2 TYR 175 -1.975 -3.045 6.763
176 HH TYR 175 HH TYR 175 -3.372 -2.809 8.750
177 H PHE 176 HN PHE 176 5.080 -4.309 8.977
178 HA PHE 176 HA PHE 176 4.438 -2.884 11.440
179 1HB PHE 176 HB2 PHE 176 5.951 -5.345 10.755
180 2HB PHE 176 HB1 PHE 176 6.523 -4.423 12.154
181 HD1 PHE 176 HD1 PHE 176 4.769 -3.824 13.940
182 HD2 PHE 176 HD2 PHE 176 4.199 -6.834 10.986
183 HE1 PHE 176 HE1 PHE 176 3.020 -4.852 15.331
184 HE2 PHE 176 HE2 PHE 176 2.449 -7.868 12.371
185 HZ PHE 176 HZ PHE 176 1.856 -6.877 14.547
186 H LEU 177 HN LEU 177 6.428 -2.490 8.769
187 HA LEU 177 HA LEU 177 8.849 -1.602 9.746
188 1HB LEU 177 HB2 LEU 177 7.198 -0.761 7.386
189 2HB LEU 177 HB1 LEU 177 8.733 0.016 7.729
190 HG LEU 177 HG LEU 177 8.294 -2.911 7.132
191 1HD1 LEU 177 HD11 LEU 177 10.121 -1.278 5.511
192 2HD1 LEU 177 HD12 LEU 177 8.412 -0.865 5.368
193 3HD1 LEU 177 HD13 LEU 177 8.954 -2.507 5.024
194 1HD2 LEU 177 HD21 LEU 177 10.055 -2.939 8.649
195 2HD2 LEU 177 HD22 LEU 177 10.698 -1.397 8.082
196 3HD2 LEU 177 HD23 LEU 177 10.871 -2.844 7.088
197 HA PRO 178 HA PRO 178 6.599 2.810 10.224
198 1HB PRO 178 HB2 PRO 178 4.092 1.653 11.357
199 2HB PRO 178 HB1 PRO 178 4.313 3.094 10.357
200 1HG PRO 178 HG2 PRO 178 3.316 0.881 9.297
201 2HG PRO 178 HG1 PRO 178 4.492 1.855 8.392
202 1HD PRO 178 HD2 PRO 178 4.894 -0.709 9.877
203 2HD PRO 178 HD1 PRO 178 5.577 -0.190 8.324
204 H LEU 179 HN LEU 179 5.014 3.268 12.587
205 HA LEU 179 HA LEU 179 5.119 3.312 14.857
206 1HB LEU 179 HB2 LEU 179 6.144 0.677 14.241
207 2HB LEU 179 HB1 LEU 179 6.973 1.355 15.627
208 HG LEU 179 HG LEU 179 5.075 0.012 16.330
209 1HD1 LEU 179 HD11 LEU 179 5.365 1.600 17.934
210 2HD1 LEU 179 HD12 LEU 179 3.735 2.024 17.411
211 3HD1 LEU 179 HD13 LEU 179 5.119 2.939 16.814
212 1HD2 LEU 179 HD21 LEU 179 3.143 1.939 15.144
213 2HD2 LEU 179 HD22 LEU 179 2.931 0.240 15.567
214 3HD2 LEU 179 HD23 LEU 179 3.823 0.682 14.111
215 H ARG 180 HN ARG 180 6.269 5.281 14.175
216 HA ARG 180 HA ARG 180 7.874 6.833 14.639
217 1HB ARG 180 HB2 ARG 180 9.427 4.722 16.133
218 2HB ARG 180 HB1 ARG 180 9.441 6.473 16.378
219 1HG ARG 180 HG2 ARG 180 7.150 4.611 16.988
220 2HG ARG 180 HG1 ARG 180 8.242 5.347 18.163
221 1HD ARG 180 HD2 ARG 180 7.470 7.569 17.471
222 2HD ARG 180 HD1 ARG 180 6.370 6.821 16.313
223 HE ARG 180 HE ARG 180 5.641 5.682 18.644
224 1HH1 ARG 180 1HH1 ARG 180 6.115 9.005 17.691
225 2HH1 ARG 180 2HH1 ARG 180 4.932 9.620 18.796
226 1HH2 ARG 180 1HH2 ARG 180 4.085 6.491 20.098
227 2HH2 ARG 180 2HH2 ARG 180 3.781 8.195 20.162
228 1HG HSL 181 HG1 HSL 181 10.960 4.631 8.751
229 2HG HSL 181 HG2 HSL 181 9.246 4.676 8.082
230 H HSL 181 HN HSL 181 7.914 5.840 12.210
231 HA HSL 181 HA HSL 181 10.868 5.305 11.585
232 1HB HSL 181 HB1 HSL 181 9.910 3.416 10.528
233 2HB HSL 181 HB2 HSL 181 8.294 4.265 10.265
Start of MODEL 56
1 1H PHE 155 HT1 PHE 155 5.003 4.843 -19.069
2 2H PHE 155 HT2 PHE 155 4.597 5.265 -17.456
3 3H PHE 155 HT3 PHE 155 3.642 4.125 -18.313
4 HA PHE 155 HA PHE 155 5.591 2.686 -18.454
5 1HB PHE 155 HB2 PHE 155 6.934 3.954 -16.200
6 2HB PHE 155 HB1 PHE 155 7.604 3.353 -17.710
7 HD1 PHE 155 HD1 PHE 155 7.425 4.852 -19.764
8 HD2 PHE 155 HD2 PHE 155 6.768 6.237 -15.795
9 HE1 PHE 155 HE1 PHE 155 7.813 7.164 -20.511
10 HE2 PHE 155 HE2 PHE 155 7.154 8.552 -16.534
11 HZ PHE 155 HZ PHE 155 7.676 9.017 -18.895
12 H LEU 156 HN LEU 156 5.287 4.223 -15.269
13 HA LEU 156 HA LEU 156 3.289 2.459 -14.338
14 1HB LEU 156 HB2 LEU 156 6.148 1.766 -13.957
15 2HB LEU 156 HB1 LEU 156 5.081 1.517 -12.588
16 HG LEU 156 HG LEU 156 5.132 0.120 -15.231
17 1HD1 LEU 156 HD11 LEU 156 4.801 -0.832 -12.393
18 2HD1 LEU 156 HD12 LEU 156 6.307 -0.830 -13.310
19 3HD1 LEU 156 HD13 LEU 156 4.963 -1.851 -13.824
20 1HD2 LEU 156 HD21 LEU 156 2.906 -0.872 -14.616
21 2HD2 LEU 156 HD22 LEU 156 2.861 0.806 -15.161
22 3HD2 LEU 156 HD23 LEU 156 2.732 0.433 -13.443
23 H GLN 157 HN GLN 157 3.095 2.589 -11.883
24 HA GLN 157 HA GLN 157 4.363 4.699 -10.482
25 1HB GLN 157 HB2 GLN 157 3.001 6.088 -11.980
26 2HB GLN 157 HB1 GLN 157 1.551 5.250 -11.443
27 1HG GLN 157 HG2 GLN 157 1.790 7.421 -10.368
28 2HG GLN 157 HG1 GLN 157 1.856 6.106 -9.196
29 1HE2 GLN 157 HE21 GLN 157 3.083 6.926 -7.623
30 2HE2 GLN 157 HE22 GLN 157 4.687 7.534 -7.829
31 H SER 158 HN SER 158 4.491 2.795 -9.127
32 HA SER 158 HA SER 158 3.859 1.445 -7.408
33 1HB SER 158 HB2 SER 158 3.384 3.949 -6.635
34 2HB SER 158 HB1 SER 158 1.712 3.361 -6.607
35 HG SER 158 HG SER 158 3.942 2.336 -5.181
36 H ASP 159 HN ASP 159 2.931 0.079 -9.208
37 HA ASP 159 HA ASP 159 1.365 -1.459 -9.806
38 1HB ASP 159 HB2 ASP 159 0.466 -0.571 -7.201
39 2HB ASP 159 HB1 ASP 159 -0.900 -0.976 -8.235
40 H VAL 160 HN VAL 160 -0.355 1.535 -8.923
41 HA VAL 160 HA VAL 160 -1.481 3.030 -10.243
42 HB VAL 160 HB VAL 160 -1.121 1.028 -12.464
43 1HG1 VAL 160 HG11 VAL 160 -2.608 3.565 -12.278
44 2HG1 VAL 160 HG12 VAL 160 -2.864 2.174 -13.333
45 3HG1 VAL 160 HG13 VAL 160 -1.612 3.355 -13.719
46 1HG2 VAL 160 HG21 VAL 160 0.522 3.250 -11.450
47 2HG2 VAL 160 HG22 VAL 160 0.339 3.161 -13.202
48 3HG2 VAL 160 HG23 VAL 160 0.997 1.788 -12.312
49 H PHE 161 HN PHE 161 -2.352 -0.299 -11.179
50 HA PHE 161 HA PHE 161 -5.154 0.271 -11.079
51 1HB PHE 161 HB2 PHE 161 -5.498 -1.907 -11.837
52 2HB PHE 161 HB1 PHE 161 -3.930 -1.498 -12.518
53 HD1 PHE 161 HD1 PHE 161 -2.180 -1.911 -10.155
54 HD2 PHE 161 HD2 PHE 161 -5.441 -4.209 -11.639
55 HE1 PHE 161 HE1 PHE 161 -1.221 -3.929 -9.128
56 HE2 PHE 161 HE2 PHE 161 -4.487 -6.231 -10.613
57 HZ PHE 161 HZ PHE 161 -2.375 -6.092 -9.356
58 H PHE 162 HN PHE 162 -4.003 0.986 -8.655
59 HA PHE 162 HA PHE 162 -5.725 -0.241 -6.830
60 1HB PHE 162 HB2 PHE 162 -4.558 -1.833 -5.797
61 2HB PHE 162 HB1 PHE 162 -3.510 -1.814 -7.215
62 HD1 PHE 162 HD1 PHE 162 -3.429 -1.969 -3.827
63 HD2 PHE 162 HD2 PHE 162 -1.745 0.324 -6.993
64 HE1 PHE 162 HE1 PHE 162 -1.529 -1.375 -2.382
65 HE2 PHE 162 HE2 PHE 162 0.159 0.920 -5.553
66 HZ PHE 162 HZ PHE 162 0.268 0.070 -3.244
67 H LEU 163 HN LEU 163 -3.148 1.886 -7.626
68 HA LEU 163 HA LEU 163 -2.626 3.150 -5.211
69 1HB LEU 163 HB2 LEU 163 -1.608 3.531 -7.554
70 2HB LEU 163 HB1 LEU 163 -2.975 4.590 -7.841
71 HG LEU 163 HG LEU 163 -0.978 4.971 -5.616
72 1HD1 LEU 163 HD11 LEU 163 -0.569 7.038 -7.294
73 2HD1 LEU 163 HD12 LEU 163 -0.954 5.763 -8.450
74 3HD1 LEU 163 HD13 LEU 163 0.380 5.551 -7.317
75 1HD2 LEU 163 HD21 LEU 163 -3.235 6.649 -6.685
76 2HD2 LEU 163 HD22 LEU 163 -1.991 7.255 -5.590
77 3HD2 LEU 163 HD23 LEU 163 -3.068 5.959 -5.073
78 H PHE 164 HN PHE 164 -5.038 3.827 -7.691
79 HA PHE 164 HA PHE 164 -7.106 4.756 -7.654
80 1HB PHE 164 HB2 PHE 164 -7.188 2.826 -5.920
81 2HB PHE 164 HB1 PHE 164 -7.258 4.123 -4.727
82 HD1 PHE 164 HD1 PHE 164 -9.400 4.204 -3.889
83 HD2 PHE 164 HD2 PHE 164 -8.834 3.779 -8.086
84 HE1 PHE 164 HE1 PHE 164 -11.829 4.396 -4.233
85 HE2 PHE 164 HE2 PHE 164 -11.263 3.971 -8.436
86 HZ PHE 164 HZ PHE 164 -12.763 4.280 -6.508
87 H LEU 165 HN LEU 165 -4.958 5.871 -5.137
88 HA LEU 165 HA LEU 165 -5.476 8.588 -5.586
89 1HB LEU 165 HB2 LEU 165 -7.484 7.436 -4.091
90 2HB LEU 165 HB1 LEU 165 -6.423 8.110 -2.864
91 HG LEU 165 HG LEU 165 -6.567 10.300 -4.188
92 1HD1 LEU 165 HD11 LEU 165 -7.534 9.217 -6.217
93 2HD1 LEU 165 HD12 LEU 165 -8.439 10.612 -5.629
94 3HD1 LEU 165 HD13 LEU 165 -9.029 8.981 -5.310
95 1HD2 LEU 165 HD21 LEU 165 -8.416 11.001 -2.939
96 2HD2 LEU 165 HD22 LEU 165 -7.752 9.653 -2.016
97 3HD2 LEU 165 HD23 LEU 165 -9.184 9.415 -3.017
98 H LEU 166 HN LEU 166 -4.402 6.066 -3.437
99 HA LEU 166 HA LEU 166 -1.923 7.442 -2.936
100 1HB LEU 166 HB2 LEU 166 -4.044 7.780 -1.135
101 2HB LEU 166 HB1 LEU 166 -2.995 6.586 -0.384
102 HG LEU 166 HG LEU 166 -1.205 8.512 -1.201
103 1HD1 LEU 166 HD11 LEU 166 -3.353 10.100 0.109
104 2HD1 LEU 166 HD12 LEU 166 -3.428 9.847 -1.636
105 3HD1 LEU 166 HD13 LEU 166 -2.019 10.628 -0.917
106 1HD2 LEU 166 HD21 LEU 166 -2.510 7.756 1.352
107 2HD2 LEU 166 HD22 LEU 166 -1.555 9.238 1.329
108 3HD2 LEU 166 HD23 LEU 166 -0.810 7.701 0.887
109 HA PRO 167 HA PRO 167 -1.218 3.000 -3.063
110 1HB PRO 167 HB2 PRO 167 1.353 3.065 -3.804
111 2HB PRO 167 HB1 PRO 167 0.049 3.469 -4.937
112 1HG PRO 167 HG2 PRO 167 1.896 5.279 -3.440
113 2HG PRO 167 HG1 PRO 167 1.285 5.420 -5.098
114 1HD PRO 167 HD2 PRO 167 0.274 6.779 -2.899
115 2HD PRO 167 HD1 PRO 167 -0.596 6.510 -4.419
116 HA PRO 168 HA PRO 168 0.501 3.074 1.179
117 1HB PRO 168 HB2 PRO 168 -0.463 0.632 1.878
118 2HB PRO 168 HB1 PRO 168 -1.455 2.104 1.919
119 1HG PRO 168 HG2 PRO 168 -1.311 -0.026 -0.190
120 2HG PRO 168 HG1 PRO 168 -2.740 0.764 0.504
121 1HD PRO 168 HD2 PRO 168 -1.719 1.487 -1.886
122 2HD PRO 168 HD1 PRO 168 -2.473 2.661 -0.788
123 H ILE 169 HN ILE 169 2.407 2.796 -0.555
124 HA ILE 169 HA ILE 169 3.440 0.150 -0.853
125 HB ILE 169 HB ILE 169 3.858 2.201 -2.348
126 1HG1 ILE 169 HG12 ILE 169 4.916 -0.028 -2.618
127 2HG1 ILE 169 HG11 ILE 169 5.970 1.292 -3.117
128 1HG2 ILE 169 HG21 ILE 169 4.641 3.696 -0.572
129 2HG2 ILE 169 HG22 ILE 169 5.826 3.521 -1.867
130 3HG2 ILE 169 HG23 ILE 169 6.052 2.664 -0.341
131 1HD1 ILE 169 HD11 ILE 169 7.456 0.077 -1.921
132 2HD1 ILE 169 HD12 ILE 169 6.222 -0.592 -0.852
133 3HD1 ILE 169 HD13 ILE 169 6.801 1.055 -0.608
134 H ILE 170 HN ILE 170 4.222 2.899 1.205
135 HA ILE 170 HA ILE 170 6.408 1.628 2.524
136 HB ILE 170 HB ILE 170 4.822 3.973 3.553
137 1HG1 ILE 170 HG12 ILE 170 7.057 5.026 2.359
138 2HG1 ILE 170 HG11 ILE 170 6.624 3.734 1.243
139 1HG2 ILE 170 HG21 ILE 170 6.484 4.318 5.042
140 2HG2 ILE 170 HG22 ILE 170 7.737 3.755 3.937
141 3HG2 ILE 170 HG23 ILE 170 6.748 2.590 4.815
142 1HD1 ILE 170 HD11 ILE 170 5.351 5.349 0.339
143 2HD1 ILE 170 HD12 ILE 170 5.249 6.263 1.844
144 3HD1 ILE 170 HD13 ILE 170 4.216 4.856 1.595
145 H LEU 171 HN LEU 171 3.039 2.290 3.484
146 HA LEU 171 HA LEU 171 3.256 1.087 6.039
147 1HB LEU 171 HB2 LEU 171 1.439 2.519 5.822
148 2HB LEU 171 HB1 LEU 171 0.992 1.885 4.252
149 HG LEU 171 HG LEU 171 0.732 -0.075 6.414
150 1HD1 LEU 171 HD11 LEU 171 -1.564 1.219 6.919
151 2HD1 LEU 171 HD12 LEU 171 -0.491 2.596 6.666
152 3HD1 LEU 171 HD13 LEU 171 -0.111 1.396 7.902
153 1HD2 LEU 171 HD21 LEU 171 -0.677 0.796 3.971
154 2HD2 LEU 171 HD22 LEU 171 -1.674 0.089 5.242
155 3HD2 LEU 171 HD23 LEU 171 -0.327 -0.827 4.565
156 H ASP 172 HN ASP 172 1.752 -0.085 3.047
157 HA ASP 172 HA ASP 172 1.475 -2.756 4.011
158 1HB ASP 172 HB2 ASP 172 0.297 -1.296 2.004
159 2HB ASP 172 HB1 ASP 172 1.352 -2.393 1.101
160 H ALA 173 HN ALA 173 4.231 -1.199 3.291
161 HA ALA 173 HA ALA 173 5.501 -3.022 1.503
162 1HB ALA 173 HB1 ALA 173 7.497 -1.802 3.043
163 2HB ALA 173 HB2 ALA 173 6.215 -0.603 2.892
164 3HB ALA 173 HB3 ALA 173 6.929 -1.313 1.446
165 H GLY 174 HN GLY 174 6.064 -2.358 4.944
166 1HA GLY 174 HA2 GLY 174 6.801 -5.198 5.297
167 2HA GLY 174 HA1 GLY 174 7.458 -3.864 6.266
168 H TYR 175 HN TYR 175 4.487 -2.844 6.010
169 HA TYR 175 HA TYR 175 2.595 -2.843 7.240
170 1HB TYR 175 HB2 TYR 175 3.403 -5.710 7.396
171 2HB TYR 175 HB1 TYR 175 2.162 -5.145 8.508
172 HD1 TYR 175 HD1 TYR 175 2.864 -6.285 5.201
173 HD2 TYR 175 HD2 TYR 175 0.110 -3.987 7.489
174 HE1 TYR 175 HE1 TYR 175 1.181 -6.549 3.428
175 HE2 TYR 175 HE2 TYR 175 -1.580 -4.245 5.722
176 HH TYR 175 HH TYR 175 -1.180 -6.439 3.098
177 H PHE 176 HN PHE 176 5.199 -4.553 8.992
178 HA PHE 176 HA PHE 176 4.383 -3.271 11.470
179 1HB PHE 176 HB2 PHE 176 5.853 -5.666 10.741
180 2HB PHE 176 HB1 PHE 176 6.738 -4.712 11.940
181 HD1 PHE 176 HD1 PHE 176 3.071 -5.176 11.508
182 HD2 PHE 176 HD2 PHE 176 6.503 -5.879 13.923
183 HE1 PHE 176 HE1 PHE 176 1.631 -6.086 13.284
184 HE2 PHE 176 HE2 PHE 176 5.070 -6.792 15.701
185 HZ PHE 176 HZ PHE 176 2.630 -6.896 15.383
186 H LEU 177 HN LEU 177 6.359 -2.538 8.875
187 HA LEU 177 HA LEU 177 8.697 -1.520 9.911
188 1HB LEU 177 HB2 LEU 177 6.975 -0.801 7.593
189 2HB LEU 177 HB1 LEU 177 8.243 0.324 8.042
190 HG LEU 177 HG LEU 177 8.610 -2.568 7.256
191 1HD1 LEU 177 HD11 LEU 177 9.140 -1.870 5.189
192 2HD1 LEU 177 HD12 LEU 177 9.946 -0.415 5.773
193 3HD1 LEU 177 HD13 LEU 177 8.190 -0.448 5.620
194 1HD2 LEU 177 HD21 LEU 177 10.510 -0.518 8.339
195 2HD2 LEU 177 HD22 LEU 177 11.072 -1.811 7.280
196 3HD2 LEU 177 HD23 LEU 177 10.300 -2.203 8.816
197 HA PRO 178 HA PRO 178 6.108 2.680 10.671
198 1HB PRO 178 HB2 PRO 178 3.692 1.186 11.609
199 2HB PRO 178 HB1 PRO 178 3.799 2.759 10.807
200 1HG PRO 178 HG2 PRO 178 3.034 0.620 9.446
201 2HG PRO 178 HG1 PRO 178 4.130 1.805 8.710
202 1HD PRO 178 HD2 PRO 178 4.730 -0.900 9.824
203 2HD PRO 178 HD1 PRO 178 5.432 -0.076 8.418
204 H LEU 179 HN LEU 179 4.984 3.318 12.932
205 HA LEU 179 HA LEU 179 5.001 3.251 15.221
206 1HB LEU 179 HB2 LEU 179 6.514 0.659 15.187
207 2HB LEU 179 HB1 LEU 179 5.459 1.294 16.434
208 HG LEU 179 HG LEU 179 4.062 0.853 13.910
209 1HD1 LEU 179 HD11 LEU 179 4.066 -1.713 14.511
210 2HD1 LEU 179 HD12 LEU 179 5.685 -1.334 15.102
211 3HD1 LEU 179 HD13 LEU 179 5.265 -1.022 13.418
212 1HD2 LEU 179 HD21 LEU 179 3.462 -0.508 16.497
213 2HD2 LEU 179 HD22 LEU 179 2.359 0.150 15.288
214 3HD2 LEU 179 HD23 LEU 179 3.242 1.237 16.361
215 H ARG 180 HN ARG 180 6.492 5.004 14.651
216 HA ARG 180 HA ARG 180 8.362 6.210 15.149
217 1HB ARG 180 HB2 ARG 180 9.444 3.774 16.570
218 2HB ARG 180 HB1 ARG 180 9.863 5.469 16.846
219 1HG ARG 180 HG2 ARG 180 7.772 5.909 17.867
220 2HG ARG 180 HG1 ARG 180 7.114 4.356 17.348
221 1HD ARG 180 HD2 ARG 180 9.563 4.320 19.019
222 2HD ARG 180 HD1 ARG 180 8.049 4.764 19.807
223 HE ARG 180 HE ARG 180 7.386 2.512 18.490
224 1HH1 ARG 180 1HH1 ARG 180 10.020 3.285 20.645
225 2HH1 ARG 180 2HH1 ARG 180 10.163 1.670 21.251
226 1HH2 ARG 180 1HH2 ARG 180 7.569 0.389 19.289
227 2HH2 ARG 180 2HH2 ARG 180 8.772 0.024 20.482
228 1HG HSL 181 HG1 HSL 181 11.025 3.805 9.166
229 2HG HSL 181 HG2 HSL 181 9.385 4.292 8.486
230 H HSL 181 HN HSL 181 8.265 5.428 12.692
231 HA HSL 181 HA HSL 181 11.026 4.272 12.033
232 1HB HSL 181 HB1 HSL 181 9.671 2.740 10.834
233 2HB HSL 181 HB2 HSL 181 8.308 3.965 10.628
Start of MODEL 57
1 1H PHE 155 HT1 PHE 155 17.462 16.225 3.737
2 2H PHE 155 HT2 PHE 155 16.645 17.234 2.615
3 3H PHE 155 HT3 PHE 155 16.330 15.548 2.644
4 HA PHE 155 HA PHE 155 15.613 15.894 5.003
5 1HB PHE 155 HB2 PHE 155 15.410 18.733 3.971
6 2HB PHE 155 HB1 PHE 155 14.914 18.154 5.558
7 HD1 PHE 155 HD1 PHE 155 17.175 16.483 6.350
8 HD2 PHE 155 HD2 PHE 155 17.117 20.243 4.357
9 HE1 PHE 155 HE1 PHE 155 19.416 16.980 7.234
10 HE2 PHE 155 HE2 PHE 155 19.360 20.747 5.236
11 HZ PHE 155 HZ PHE 155 20.512 19.113 6.676
12 H LEU 156 HN LEU 156 13.398 15.673 5.270
13 HA LEU 156 HA LEU 156 11.509 16.519 3.316
14 1HB LEU 156 HB2 LEU 156 10.846 14.347 2.495
15 2HB LEU 156 HB1 LEU 156 12.536 14.636 2.135
16 HG LEU 156 HG LEU 156 12.991 13.279 4.301
17 1HD1 LEU 156 HD11 LEU 156 10.971 12.928 5.319
18 2HD1 LEU 156 HD12 LEU 156 11.114 11.447 4.371
19 3HD1 LEU 156 HD13 LEU 156 10.102 12.771 3.793
20 1HD2 LEU 156 HD21 LEU 156 11.913 11.845 1.879
21 2HD2 LEU 156 HD22 LEU 156 13.116 11.256 3.027
22 3HD2 LEU 156 HD23 LEU 156 13.503 12.604 1.958
23 H GLN 157 HN GLN 157 9.433 14.847 3.751
24 HA GLN 157 HA GLN 157 9.072 14.072 6.451
25 1HB GLN 157 HB2 GLN 157 8.655 16.852 5.860
26 2HB GLN 157 HB1 GLN 157 7.120 16.113 6.290
27 1HG GLN 157 HG2 GLN 157 9.639 16.148 7.931
28 2HG GLN 157 HG1 GLN 157 8.135 17.007 8.261
29 1HE2 GLN 157 HE21 GLN 157 9.889 14.141 8.685
30 2HE2 GLN 157 HE22 GLN 157 8.664 13.222 9.484
31 H SER 158 HN SER 158 8.246 12.227 5.497
32 HA SER 158 HA SER 158 6.631 10.841 4.697
33 1HB SER 158 HB2 SER 158 5.264 12.553 6.231
34 2HB SER 158 HB1 SER 158 4.561 12.985 4.663
35 HG SER 158 HG SER 158 4.601 10.435 5.906
36 H ASP 159 HN ASP 159 8.263 12.413 2.925
37 HA ASP 159 HA ASP 159 8.512 12.546 0.657
38 1HB ASP 159 HB2 ASP 159 6.350 10.852 0.849
39 2HB ASP 159 HB1 ASP 159 5.710 12.172 -0.126
40 H VAL 160 HN VAL 160 5.370 13.863 1.716
41 HA VAL 160 HA VAL 160 4.482 15.952 1.585
42 HB VAL 160 HB VAL 160 7.247 16.786 0.695
43 1HG1 VAL 160 HG11 VAL 160 4.745 18.300 1.223
44 2HG1 VAL 160 HG12 VAL 160 6.016 18.596 0.038
45 3HG1 VAL 160 HG13 VAL 160 6.273 19.016 1.732
46 1HG2 VAL 160 HG21 VAL 160 7.419 17.619 3.048
47 2HG2 VAL 160 HG22 VAL 160 7.373 15.863 2.887
48 3HG2 VAL 160 HG23 VAL 160 5.931 16.740 3.402
49 H PHE 161 HN PHE 161 6.771 15.645 -1.107
50 HA PHE 161 HA PHE 161 4.973 16.817 -3.003
51 1HB PHE 161 HB2 PHE 161 7.597 15.373 -3.433
52 2HB PHE 161 HB1 PHE 161 6.733 16.307 -4.650
53 HD1 PHE 161 HD1 PHE 161 9.033 16.408 -1.896
54 HD2 PHE 161 HD2 PHE 161 6.449 18.773 -4.312
55 HE1 PHE 161 HE1 PHE 161 10.218 18.439 -1.167
56 HE2 PHE 161 HE2 PHE 161 7.628 20.808 -3.587
57 HZ PHE 161 HZ PHE 161 9.516 20.642 -2.015
58 H PHE 162 HN PHE 162 4.635 14.052 -1.535
59 HA PHE 162 HA PHE 162 3.103 12.840 -3.601
60 1HB PHE 162 HB2 PHE 162 5.831 11.856 -3.046
61 2HB PHE 162 HB1 PHE 162 4.576 10.616 -3.083
62 HD1 PHE 162 HD1 PHE 162 7.027 11.668 -5.006
63 HD2 PHE 162 HD2 PHE 162 2.776 11.540 -5.150
64 HE1 PHE 162 HE1 PHE 162 7.113 11.660 -7.466
65 HE2 PHE 162 HE2 PHE 162 2.854 11.531 -7.610
66 HZ PHE 162 HZ PHE 162 5.026 11.592 -8.771
67 H LEU 163 HN LEU 163 3.324 13.742 -0.633
68 HA LEU 163 HA LEU 163 2.713 11.468 0.951
69 1HB LEU 163 HB2 LEU 163 3.475 13.409 2.091
70 2HB LEU 163 HB1 LEU 163 2.322 14.439 1.272
71 HG LEU 163 HG LEU 163 0.658 12.755 2.625
72 1HD1 LEU 163 HD11 LEU 163 2.966 12.001 3.699
73 2HD1 LEU 163 HD12 LEU 163 1.468 12.079 4.629
74 3HD1 LEU 163 HD13 LEU 163 2.637 13.397 4.728
75 1HD2 LEU 163 HD21 LEU 163 1.777 15.238 3.882
76 2HD2 LEU 163 HD22 LEU 163 0.130 14.611 3.953
77 3HD2 LEU 163 HD23 LEU 163 0.748 15.296 2.450
78 H PHE 164 HN PHE 164 0.919 13.860 -0.874
79 HA PHE 164 HA PHE 164 -1.298 14.060 -1.419
80 1HB PHE 164 HB2 PHE 164 -0.372 11.426 -2.090
81 2HB PHE 164 HB1 PHE 164 -2.074 11.343 -1.642
82 HD1 PHE 164 HD1 PHE 164 -3.107 13.892 -2.606
83 HD2 PHE 164 HD2 PHE 164 -0.309 11.228 -4.390
84 HE1 PHE 164 HE1 PHE 164 -3.737 14.728 -4.833
85 HE2 PHE 164 HE2 PHE 164 -0.933 12.060 -6.621
86 HZ PHE 164 HZ PHE 164 -2.649 13.812 -6.844
87 H LEU 165 HN LEU 165 -0.650 13.834 1.413
88 HA LEU 165 HA LEU 165 -1.997 14.106 3.281
89 1HB LEU 165 HB2 LEU 165 -3.971 13.770 1.466
90 2HB LEU 165 HB1 LEU 165 -4.144 12.282 2.388
91 HG LEU 165 HG LEU 165 -3.909 14.440 4.238
92 1HD1 LEU 165 HD11 LEU 165 -4.838 15.527 1.957
93 2HD1 LEU 165 HD12 LEU 165 -5.309 16.070 3.567
94 3HD1 LEU 165 HD13 LEU 165 -6.347 14.960 2.672
95 1HD2 LEU 165 HD21 LEU 165 -6.110 12.553 3.439
96 2HD2 LEU 165 HD22 LEU 165 -6.266 13.698 4.771
97 3HD2 LEU 165 HD23 LEU 165 -5.027 12.444 4.827
98 H LEU 166 HN LEU 166 -1.547 11.036 1.657
99 HA LEU 166 HA LEU 166 -0.602 9.849 4.085
100 1HB LEU 166 HB2 LEU 166 -3.337 9.670 3.535
101 2HB LEU 166 HB1 LEU 166 -2.681 8.111 3.061
102 HG LEU 166 HG LEU 166 -1.576 8.786 5.602
103 1HD1 LEU 166 HD11 LEU 166 -3.891 10.147 5.416
104 2HD1 LEU 166 HD12 LEU 166 -3.269 9.466 6.919
105 3HD1 LEU 166 HD13 LEU 166 -4.487 8.590 5.991
106 1HD2 LEU 166 HD21 LEU 166 -2.732 6.722 6.281
107 2HD2 LEU 166 HD22 LEU 166 -1.849 6.530 4.766
108 3HD2 LEU 166 HD23 LEU 166 -3.602 6.722 4.747
109 HA PRO 167 HA PRO 167 1.344 8.319 0.182
110 1HB PRO 167 HB2 PRO 167 3.827 8.075 1.299
111 2HB PRO 167 HB1 PRO 167 3.227 9.562 0.539
112 1HG PRO 167 HG2 PRO 167 3.343 8.823 3.440
113 2HG PRO 167 HG1 PRO 167 3.717 10.373 2.662
114 1HD PRO 167 HD2 PRO 167 1.382 9.942 3.932
115 2HD PRO 167 HD1 PRO 167 1.490 10.962 2.486
116 HA PRO 168 HA PRO 168 0.860 4.208 2.025
117 1HB PRO 168 HB2 PRO 168 0.247 2.931 -0.272
118 2HB PRO 168 HB1 PRO 168 -0.937 3.933 0.589
119 1HG PRO 168 HG2 PRO 168 0.753 4.616 -1.790
120 2HG PRO 168 HG1 PRO 168 -0.968 4.942 -1.510
121 1HD PRO 168 HD2 PRO 168 0.981 6.795 -1.133
122 2HD PRO 168 HD1 PRO 168 -0.530 6.782 -0.207
123 H ILE 169 HN ILE 169 1.593 2.039 0.461
124 HA ILE 169 HA ILE 169 3.339 0.835 -0.401
125 HB ILE 169 HB ILE 169 3.969 3.338 -1.351
126 1HG1 ILE 169 HG12 ILE 169 4.088 1.163 -2.530
127 2HG1 ILE 169 HG11 ILE 169 5.501 2.172 -2.830
128 1HG2 ILE 169 HG21 ILE 169 6.446 2.330 0.039
129 2HG2 ILE 169 HG22 ILE 169 5.481 3.694 0.599
130 3HG2 ILE 169 HG23 ILE 169 6.294 3.772 -0.963
131 1HD1 ILE 169 HD11 ILE 169 6.349 0.730 -0.709
132 2HD1 ILE 169 HD12 ILE 169 6.622 0.285 -2.394
133 3HD1 ILE 169 HD13 ILE 169 5.280 -0.429 -1.498
134 H ILE 170 HN ILE 170 4.132 3.211 2.074
135 HA ILE 170 HA ILE 170 6.241 1.710 3.252
136 HB ILE 170 HB ILE 170 4.639 3.897 4.566
137 1HG1 ILE 170 HG12 ILE 170 6.878 5.139 3.650
138 2HG1 ILE 170 HG11 ILE 170 6.578 3.997 2.342
139 1HG2 ILE 170 HG21 ILE 170 5.996 2.956 6.190
140 2HG2 ILE 170 HG22 ILE 170 6.983 4.287 5.586
141 3HG2 ILE 170 HG23 ILE 170 7.307 2.637 5.053
142 1HD1 ILE 170 HD11 ILE 170 5.093 6.397 3.136
143 2HD1 ILE 170 HD12 ILE 170 4.100 5.005 2.702
144 3HD1 ILE 170 HD13 ILE 170 5.279 5.641 1.553
145 H LEU 171 HN LEU 171 2.808 2.220 3.997
146 HA LEU 171 HA LEU 171 2.770 0.747 6.406
147 1HB LEU 171 HB2 LEU 171 0.432 0.895 4.525
148 2HB LEU 171 HB1 LEU 171 0.422 0.846 6.278
149 HG LEU 171 HG LEU 171 1.176 3.183 4.526
150 1HD1 LEU 171 HD11 LEU 171 -0.712 4.267 5.556
151 2HD1 LEU 171 HD12 LEU 171 -0.999 2.865 6.585
152 3HD1 LEU 171 HD13 LEU 171 -1.233 2.742 4.842
153 1HD2 LEU 171 HD21 LEU 171 2.710 3.279 6.314
154 2HD2 LEU 171 HD22 LEU 171 1.494 2.776 7.488
155 3HD2 LEU 171 HD23 LEU 171 1.399 4.375 6.751
156 H ASP 172 HN ASP 172 1.814 -0.137 3.114
157 HA ASP 172 HA ASP 172 1.564 -2.918 3.723
158 1HB ASP 172 HB2 ASP 172 1.061 -1.170 1.444
159 2HB ASP 172 HB1 ASP 172 1.783 -2.711 0.958
160 H ALA 173 HN ALA 173 4.245 -1.032 3.534
161 HA ALA 173 HA ALA 173 5.943 -2.620 1.891
162 1HB ALA 173 HB1 ALA 173 6.140 -0.163 3.256
163 2HB ALA 173 HB2 ALA 173 7.285 -0.868 2.119
164 3HB ALA 173 HB3 ALA 173 7.448 -1.185 3.846
165 H GLY 174 HN GLY 174 6.435 -1.977 5.354
166 1HA GLY 174 HA2 GLY 174 7.288 -4.773 5.682
167 2HA GLY 174 HA1 GLY 174 7.657 -3.431 6.784
168 H TYR 175 HN TYR 175 4.543 -2.964 6.024
169 HA TYR 175 HA TYR 175 2.523 -3.386 6.954
170 1HB TYR 175 HB2 TYR 175 3.512 -5.864 6.701
171 2HB TYR 175 HB1 TYR 175 3.452 -5.781 8.459
172 HD1 TYR 175 HD1 TYR 175 0.988 -4.136 8.813
173 HD2 TYR 175 HD2 TYR 175 1.809 -7.385 6.190
174 HE1 TYR 175 HE1 TYR 175 -1.407 -4.688 8.756
175 HE2 TYR 175 HE2 TYR 175 -0.584 -7.945 6.125
176 HH TYR 175 HH TYR 175 -2.648 -7.424 7.960
177 H PHE 176 HN PHE 176 4.960 -4.496 9.309
178 HA PHE 176 HA PHE 176 3.712 -2.734 11.306
179 1HB PHE 176 HB2 PHE 176 4.598 -4.171 13.017
180 2HB PHE 176 HB1 PHE 176 3.797 -5.188 11.812
181 HD1 PHE 176 HD1 PHE 176 5.170 -6.486 10.200
182 HD2 PHE 176 HD2 PHE 176 6.902 -4.385 13.471
183 HE1 PHE 176 HE1 PHE 176 7.226 -7.816 9.961
184 HE2 PHE 176 HE2 PHE 176 8.961 -5.711 13.237
185 HZ PHE 176 HZ PHE 176 9.125 -7.429 11.481
186 H LEU 177 HN LEU 177 6.528 -3.200 9.428
187 HA LEU 177 HA LEU 177 8.542 -2.180 11.022
188 1HB LEU 177 HB2 LEU 177 8.162 -1.798 8.058
189 2HB LEU 177 HB1 LEU 177 9.656 -1.512 8.929
190 HG LEU 177 HG LEU 177 8.272 -4.164 8.538
191 1HD1 LEU 177 HD11 LEU 177 11.080 -3.708 7.753
192 2HD1 LEU 177 HD12 LEU 177 9.854 -2.882 6.790
193 3HD1 LEU 177 HD13 LEU 177 9.811 -4.639 6.957
194 1HD2 LEU 177 HD21 LEU 177 10.637 -4.814 9.619
195 2HD2 LEU 177 HD22 LEU 177 9.166 -4.600 10.568
196 3HD2 LEU 177 HD23 LEU 177 10.342 -3.290 10.456
197 HA PRO 178 HA PRO 178 7.262 2.263 9.432
198 1HB PRO 178 HB2 PRO 178 4.345 1.909 9.118
199 2HB PRO 178 HB1 PRO 178 5.498 2.738 8.068
200 1HG PRO 178 HG2 PRO 178 4.427 0.400 7.353
201 2HG PRO 178 HG1 PRO 178 6.121 0.783 6.988
202 1HD PRO 178 HD2 PRO 178 4.996 -0.918 9.190
203 2HD PRO 178 HD1 PRO 178 6.384 -1.230 8.127
204 H LEU 179 HN LEU 179 7.692 1.775 11.880
205 HA LEU 179 HA LEU 179 5.355 2.711 13.403
206 1HB LEU 179 HB2 LEU 179 7.295 0.585 13.927
207 2HB LEU 179 HB1 LEU 179 7.084 1.676 15.283
208 HG LEU 179 HG LEU 179 4.722 1.198 15.379
209 1HD1 LEU 179 HD11 LEU 179 4.291 -0.933 13.655
210 2HD1 LEU 179 HD12 LEU 179 5.164 0.251 12.682
211 3HD1 LEU 179 HD13 LEU 179 3.664 0.707 13.487
212 1HD2 LEU 179 HD21 LEU 179 6.710 -0.977 15.445
213 2HD2 LEU 179 HD22 LEU 179 5.018 -1.474 15.440
214 3HD2 LEU 179 HD23 LEU 179 5.616 -0.397 16.701
215 H ARG 180 HN ARG 180 8.507 3.394 12.391
216 HA ARG 180 HA ARG 180 8.509 5.877 13.887
217 1HB ARG 180 HB2 ARG 180 10.533 3.692 14.236
218 2HB ARG 180 HB1 ARG 180 11.064 5.377 14.320
219 1HG ARG 180 HG2 ARG 180 10.628 4.986 16.518
220 2HG ARG 180 HG1 ARG 180 9.046 5.571 15.998
221 1HD ARG 180 HD2 ARG 180 8.919 2.869 15.482
222 2HD ARG 180 HD1 ARG 180 9.840 2.947 16.982
223 HE ARG 180 HE ARG 180 7.588 4.619 17.183
224 1HH1 ARG 180 1HH1 ARG 180 8.425 1.233 17.077
225 2HH1 ARG 180 2HH1 ARG 180 7.047 0.735 18.001
226 1HH2 ARG 180 1HH2 ARG 180 5.776 3.967 18.398
227 2HH2 ARG 180 2HH2 ARG 180 5.543 2.287 18.750
228 1HG HSL 181 HG1 HSL 181 7.487 6.307 7.088
229 2HG HSL 181 HG2 HSL 181 6.528 5.908 8.607
230 H HSL 181 HN HSL 181 7.840 5.721 11.390
231 HA HSL 181 HA HSL 181 10.317 6.503 9.772
232 1HB HSL 181 HB1 HSL 181 9.493 5.392 7.918
233 2HB HSL 181 HB2 HSL 181 8.393 4.495 9.102
Start of MODEL 58
1 1H PHE 155 HT1 PHE 155 4.728 6.783 -11.285
2 2H PHE 155 HT2 PHE 155 4.585 5.215 -10.603
3 3H PHE 155 HT3 PHE 155 6.052 5.698 -11.351
4 HA PHE 155 HA PHE 155 4.884 6.951 -8.960
5 1HB PHE 155 HB2 PHE 155 6.868 5.757 -7.866
6 2HB PHE 155 HB1 PHE 155 5.490 4.760 -8.315
7 HD1 PHE 155 HD1 PHE 155 5.674 3.069 -9.981
8 HD2 PHE 155 HD2 PHE 155 8.939 5.682 -9.189
9 HE1 PHE 155 HE1 PHE 155 7.157 1.606 -11.289
10 HE2 PHE 155 HE2 PHE 155 10.428 4.223 -10.495
11 HZ PHE 155 HZ PHE 155 9.539 2.182 -11.548
12 H LEU 156 HN LEU 156 6.639 8.140 -7.775
13 HA LEU 156 HA LEU 156 8.159 9.830 -7.694
14 1HB LEU 156 HB2 LEU 156 9.286 8.077 -9.843
15 2HB LEU 156 HB1 LEU 156 10.040 9.620 -9.492
16 HG LEU 156 HG LEU 156 9.661 7.356 -7.530
17 1HD1 LEU 156 HD11 LEU 156 12.247 7.525 -7.625
18 2HD1 LEU 156 HD12 LEU 156 11.966 8.294 -9.187
19 3HD1 LEU 156 HD13 LEU 156 11.388 6.653 -8.895
20 1HD2 LEU 156 HD21 LEU 156 11.192 8.782 -6.121
21 2HD2 LEU 156 HD22 LEU 156 9.543 9.380 -6.308
22 3HD2 LEU 156 HD23 LEU 156 10.855 10.103 -7.240
23 H GLN 157 HN GLN 157 9.310 11.533 -9.242
24 HA GLN 157 HA GLN 157 9.180 13.108 -10.898
25 1HB GLN 157 HB2 GLN 157 8.059 11.237 -12.293
26 2HB GLN 157 HB1 GLN 157 6.544 12.002 -11.836
27 1HG GLN 157 HG2 GLN 157 6.780 13.399 -13.530
28 2HG GLN 157 HG1 GLN 157 8.215 14.063 -12.750
29 1HE2 GLN 157 HE21 GLN 157 7.480 13.559 -15.605
30 2HE2 GLN 157 HE22 GLN 157 8.801 12.647 -16.244
31 H SER 158 HN SER 158 8.516 13.615 -8.394
32 HA SER 158 HA SER 158 6.729 15.815 -8.652
33 1HB SER 158 HB2 SER 158 5.008 14.156 -8.325
34 2HB SER 158 HB1 SER 158 5.886 13.453 -6.956
35 HG SER 158 HG SER 158 5.338 15.144 -5.716
36 H ASP 159 HN ASP 159 9.448 15.395 -7.974
37 HA ASP 159 HA ASP 159 10.951 16.397 -6.571
38 1HB ASP 159 HB2 ASP 159 8.644 17.680 -5.832
39 2HB ASP 159 HB1 ASP 159 9.143 16.932 -4.317
40 H VAL 160 HN VAL 160 8.510 14.344 -5.047
41 HA VAL 160 HA VAL 160 8.807 12.331 -3.992
42 HB VAL 160 HB VAL 160 11.326 12.596 -4.979
43 1HG1 VAL 160 HG11 VAL 160 12.967 12.393 -3.276
44 2HG1 VAL 160 HG12 VAL 160 11.741 12.304 -2.011
45 3HG1 VAL 160 HG13 VAL 160 12.003 13.815 -2.880
46 1HG2 VAL 160 HG21 VAL 160 10.985 10.431 -3.000
47 2HG2 VAL 160 HG22 VAL 160 11.421 10.356 -4.707
48 3HG2 VAL 160 HG23 VAL 160 9.736 10.576 -4.236
49 H PHE 161 HN PHE 161 10.508 15.155 -2.691
50 HA PHE 161 HA PHE 161 10.261 14.407 0.034
51 1HB PHE 161 HB2 PHE 161 11.279 16.657 -1.468
52 2HB PHE 161 HB1 PHE 161 10.354 17.214 -0.077
53 HD1 PHE 161 HD1 PHE 161 11.206 17.029 2.112
54 HD2 PHE 161 HD2 PHE 161 13.208 15.117 -1.121
55 HE1 PHE 161 HE1 PHE 161 13.130 16.575 3.577
56 HE2 PHE 161 HE2 PHE 161 15.136 14.659 0.339
57 HZ PHE 161 HZ PHE 161 15.098 15.388 2.691
58 H PHE 162 HN PHE 162 8.149 15.915 -2.247
59 HA PHE 162 HA PHE 162 6.332 17.141 -0.453
60 1HB PHE 162 HB2 PHE 162 6.520 16.536 -3.297
61 2HB PHE 162 HB1 PHE 162 4.866 16.490 -2.685
62 HD1 PHE 162 HD1 PHE 162 3.817 18.423 -3.392
63 HD2 PHE 162 HD2 PHE 162 7.756 18.669 -1.798
64 HE1 PHE 162 HE1 PHE 162 3.708 20.878 -3.510
65 HE2 PHE 162 HE2 PHE 162 7.653 21.124 -1.913
66 HZ PHE 162 HZ PHE 162 5.628 22.232 -2.769
67 H LEU 163 HN LEU 163 6.002 14.176 -2.382
68 HA LEU 163 HA LEU 163 3.721 13.209 -1.012
69 1HB LEU 163 HB2 LEU 163 5.739 12.065 -2.893
70 2HB LEU 163 HB1 LEU 163 4.624 10.985 -2.077
71 HG LEU 163 HG LEU 163 3.691 13.330 -3.723
72 1HD1 LEU 163 HD11 LEU 163 4.585 10.630 -4.556
73 2HD1 LEU 163 HD12 LEU 163 4.655 12.166 -5.419
74 3HD1 LEU 163 HD13 LEU 163 3.133 11.282 -5.314
75 1HD2 LEU 163 HD21 LEU 163 2.409 11.027 -2.343
76 2HD2 LEU 163 HD22 LEU 163 1.700 11.606 -3.850
77 3HD2 LEU 163 HD23 LEU 163 1.876 12.703 -2.481
78 H PHE 164 HN PHE 164 6.825 13.588 -0.032
79 HA PHE 164 HA PHE 164 7.303 11.210 1.440
80 1HB PHE 164 HB2 PHE 164 8.783 13.343 0.577
81 2HB PHE 164 HB1 PHE 164 8.648 13.679 2.299
82 HD1 PHE 164 HD1 PHE 164 10.660 13.153 3.289
83 HD2 PHE 164 HD2 PHE 164 8.998 10.470 0.434
84 HE1 PHE 164 HE1 PHE 164 12.466 11.547 3.753
85 HE2 PHE 164 HE2 PHE 164 10.800 8.859 0.894
86 HZ PHE 164 HZ PHE 164 12.536 9.396 2.555
87 H LEU 165 HN LEU 165 5.186 13.773 1.935
88 HA LEU 165 HA LEU 165 5.376 14.148 4.730
89 1HB LEU 165 HB2 LEU 165 3.795 15.135 2.634
90 2HB LEU 165 HB1 LEU 165 2.672 14.397 3.763
91 HG LEU 165 HG LEU 165 2.931 16.770 4.234
92 1HD1 LEU 165 HD11 LEU 165 2.426 15.839 6.231
93 2HD1 LEU 165 HD12 LEU 165 4.055 16.385 6.630
94 3HD1 LEU 165 HD13 LEU 165 3.775 14.706 6.171
95 1HD2 LEU 165 HD21 LEU 165 5.139 17.573 5.120
96 2HD2 LEU 165 HD22 LEU 165 5.103 17.236 3.389
97 3HD2 LEU 165 HD23 LEU 165 5.850 16.084 4.497
98 H LEU 166 HN LEU 166 3.730 11.818 2.698
99 HA LEU 166 HA LEU 166 3.392 10.020 4.906
100 1HB LEU 166 HB2 LEU 166 1.361 11.847 4.525
101 2HB LEU 166 HB1 LEU 166 0.789 10.446 3.636
102 HG LEU 166 HG LEU 166 1.518 9.239 5.930
103 1HD1 LEU 166 HD11 LEU 166 0.542 11.955 6.790
104 2HD1 LEU 166 HD12 LEU 166 2.209 11.398 6.927
105 3HD1 LEU 166 HD13 LEU 166 0.931 10.586 7.831
106 1HD2 LEU 166 HD21 LEU 166 -1.009 10.419 4.932
107 2HD2 LEU 166 HD22 LEU 166 -0.984 9.853 6.602
108 3HD2 LEU 166 HD23 LEU 166 -0.602 8.740 5.287
109 HA PRO 167 HA PRO 167 3.949 8.417 0.502
110 1HB PRO 167 HB2 PRO 167 6.020 6.749 1.193
111 2HB PRO 167 HB1 PRO 167 6.214 8.390 0.549
112 1HG PRO 167 HG2 PRO 167 6.315 7.441 3.386
113 2HG PRO 167 HG1 PRO 167 7.338 8.636 2.566
114 1HD PRO 167 HD2 PRO 167 5.348 9.381 4.204
115 2HD PRO 167 HD1 PRO 167 5.741 10.306 2.741
116 HA PRO 168 HA PRO 168 1.571 4.917 2.138
117 1HB PRO 168 HB2 PRO 168 -0.024 4.634 0.003
118 2HB PRO 168 HB1 PRO 168 -0.269 5.949 1.171
119 1HG PRO 168 HG2 PRO 168 1.116 6.019 -1.494
120 2HG PRO 168 HG1 PRO 168 -0.066 7.160 -0.823
121 1HD PRO 168 HD2 PRO 168 2.621 7.587 -0.778
122 2HD PRO 168 HD1 PRO 168 1.521 8.230 0.455
123 H ILE 169 HN ILE 169 3.535 3.654 1.982
124 HA ILE 169 HA ILE 169 3.420 1.654 -0.096
125 HB ILE 169 HB ILE 169 4.801 3.585 -1.048
126 1HG1 ILE 169 HG12 ILE 169 4.848 1.214 -1.862
127 2HG1 ILE 169 HG11 ILE 169 6.344 2.098 -2.139
128 1HG2 ILE 169 HG21 ILE 169 6.820 2.586 0.974
129 2HG2 ILE 169 HG22 ILE 169 6.013 4.153 1.003
130 3HG2 ILE 169 HG23 ILE 169 7.125 3.762 -0.309
131 1HD1 ILE 169 HD11 ILE 169 7.320 0.285 -1.287
132 2HD1 ILE 169 HD12 ILE 169 5.832 -0.278 -0.525
133 3HD1 ILE 169 HD13 ILE 169 6.827 0.938 0.275
134 H ILE 170 HN ILE 170 5.248 3.090 2.498
135 HA ILE 170 HA ILE 170 6.729 0.850 3.267
136 HB ILE 170 HB ILE 170 7.204 2.117 5.268
137 1HG1 ILE 170 HG12 ILE 170 5.042 3.909 4.225
138 2HG1 ILE 170 HG11 ILE 170 5.081 3.065 5.765
139 1HG2 ILE 170 HG21 ILE 170 7.240 3.812 2.790
140 2HG2 ILE 170 HG22 ILE 170 8.443 2.597 3.223
141 3HG2 ILE 170 HG23 ILE 170 8.255 4.045 4.213
142 1HD1 ILE 170 HD11 ILE 170 7.018 4.487 6.414
143 2HD1 ILE 170 HD12 ILE 170 5.514 5.373 6.160
144 3HD1 ILE 170 HD13 ILE 170 6.773 5.402 4.925
145 H LEU 171 HN LEU 171 3.662 2.152 4.321
146 HA LEU 171 HA LEU 171 3.291 0.488 6.556
147 1HB LEU 171 HB2 LEU 171 0.717 0.854 5.548
148 2HB LEU 171 HB1 LEU 171 1.503 1.803 6.784
149 HG LEU 171 HG LEU 171 0.459 3.215 5.098
150 1HD1 LEU 171 HD11 LEU 171 2.035 4.676 5.576
151 2HD1 LEU 171 HD12 LEU 171 3.045 4.010 4.294
152 3HD1 LEU 171 HD13 LEU 171 3.166 3.372 5.933
153 1HD2 LEU 171 HD21 LEU 171 0.713 1.588 3.223
154 2HD2 LEU 171 HD22 LEU 171 2.397 2.092 3.089
155 3HD2 LEU 171 HD23 LEU 171 1.103 3.256 2.820
156 H ASP 172 HN ASP 172 1.995 0.159 3.270
157 HA ASP 172 HA ASP 172 1.216 -2.565 3.687
158 1HB ASP 172 HB2 ASP 172 0.446 -0.596 1.922
159 2HB ASP 172 HB1 ASP 172 1.424 -1.663 0.901
160 H ALA 173 HN ALA 173 4.180 -1.157 3.258
161 HA ALA 173 HA ALA 173 5.346 -2.923 1.355
162 1HB ALA 173 HB1 ALA 173 6.582 -0.995 1.540
163 2HB ALA 173 HB2 ALA 173 7.512 -2.090 2.562
164 3HB ALA 173 HB3 ALA 173 6.408 -0.930 3.293
165 H GLY 174 HN GLY 174 6.020 -2.584 4.830
166 1HA GLY 174 HA2 GLY 174 6.512 -5.496 4.938
167 2HA GLY 174 HA1 GLY 174 7.263 -4.302 6.014
168 H TYR 175 HN TYR 175 4.449 -2.990 5.995
169 HA TYR 175 HA TYR 175 2.497 -3.069 7.166
170 1HB TYR 175 HB2 TYR 175 2.830 -5.703 6.532
171 2HB TYR 175 HB1 TYR 175 2.818 -5.772 8.291
172 HD1 TYR 175 HD1 TYR 175 0.824 -5.552 5.342
173 HD2 TYR 175 HD2 TYR 175 0.849 -4.654 9.501
174 HE1 TYR 175 HE1 TYR 175 -1.632 -5.420 5.322
175 HE2 TYR 175 HE2 TYR 175 -1.606 -4.522 9.493
176 HH TYR 175 HH TYR 175 -3.418 -4.032 7.734
177 H PHE 176 HN PHE 176 5.558 -3.711 8.475
178 HA PHE 176 HA PHE 176 4.590 -3.017 11.167
179 1HB PHE 176 HB2 PHE 176 6.623 -4.997 10.259
180 2HB PHE 176 HB1 PHE 176 6.948 -4.122 11.762
181 HD1 PHE 176 HD1 PHE 176 6.060 -7.145 10.862
182 HD2 PHE 176 HD2 PHE 176 4.307 -3.879 12.953
183 HE1 PHE 176 HE1 PHE 176 4.601 -8.712 12.074
184 HE2 PHE 176 HE2 PHE 176 2.844 -5.441 14.171
185 HZ PHE 176 HZ PHE 176 2.991 -7.859 13.733
186 H LEU 177 HN LEU 177 6.477 -2.046 8.527
187 HA LEU 177 HA LEU 177 8.615 -0.709 9.672
188 1HB LEU 177 HB2 LEU 177 6.986 -0.059 7.224
189 2HB LEU 177 HB1 LEU 177 8.442 0.814 7.661
190 HG LEU 177 HG LEU 177 8.371 -2.161 7.171
191 1HD1 LEU 177 HD11 LEU 177 7.761 -0.639 5.195
192 2HD1 LEU 177 HD12 LEU 177 9.048 -1.825 4.971
193 3HD1 LEU 177 HD13 LEU 177 9.449 -0.131 5.252
194 1HD2 LEU 177 HD21 LEU 177 10.234 -0.740 8.505
195 2HD2 LEU 177 HD22 LEU 177 10.834 -0.576 6.854
196 3HD2 LEU 177 HD23 LEU 177 10.593 -2.179 7.550
197 HA PRO 178 HA PRO 178 5.528 3.160 9.952
198 1HB PRO 178 HB2 PRO 178 3.189 1.586 10.908
199 2HB PRO 178 HB1 PRO 178 3.238 3.019 9.875
200 1HG PRO 178 HG2 PRO 178 2.743 0.625 8.834
201 2HG PRO 178 HG1 PRO 178 3.767 1.792 7.976
202 1HD PRO 178 HD2 PRO 178 4.554 -0.624 9.553
203 2HD PRO 178 HD1 PRO 178 5.233 0.004 8.037
204 H LEU 179 HN LEU 179 7.261 2.942 11.657
205 HA LEU 179 HA LEU 179 6.047 2.470 14.297
206 1HB LEU 179 HB2 LEU 179 8.471 2.260 15.074
207 2HB LEU 179 HB1 LEU 179 7.788 0.925 14.169
208 HG LEU 179 HG LEU 179 9.046 2.709 12.324
209 1HD1 LEU 179 HD11 LEU 179 10.956 1.746 14.430
210 2HD1 LEU 179 HD12 LEU 179 10.288 3.377 14.435
211 3HD1 LEU 179 HD13 LEU 179 11.269 2.830 13.074
212 1HD2 LEU 179 HD21 LEU 179 10.283 0.123 13.082
213 2HD2 LEU 179 HD22 LEU 179 9.909 0.779 11.487
214 3HD2 LEU 179 HD23 LEU 179 8.626 0.086 12.478
215 H ARG 180 HN ARG 180 7.078 4.815 12.211
216 HA ARG 180 HA ARG 180 7.021 6.831 14.285
217 1HB ARG 180 HB2 ARG 180 9.102 7.897 13.600
218 2HB ARG 180 HB1 ARG 180 9.421 6.234 14.110
219 1HG ARG 180 HG2 ARG 180 8.950 6.763 11.222
220 2HG ARG 180 HG1 ARG 180 10.494 7.241 11.929
221 1HD ARG 180 HD2 ARG 180 11.204 5.126 12.042
222 2HD ARG 180 HD1 ARG 180 9.682 4.572 12.738
223 HE ARG 180 HE ARG 180 9.005 3.910 10.654
224 1HH1 ARG 180 1HH1 ARG 180 11.775 6.006 10.333
225 2HH1 ARG 180 2HH1 ARG 180 11.953 5.718 8.635
226 1HH2 ARG 180 1HH2 ARG 180 9.234 3.532 8.422
227 2HH2 ARG 180 2HH2 ARG 180 10.510 4.313 7.549
228 1HG HSL 181 HG1 HSL 181 2.054 6.247 9.420
229 2HG HSL 181 HG2 HSL 181 2.638 5.331 10.904
230 H HSL 181 HN HSL 181 5.140 6.112 12.471
231 HA HSL 181 HA HSL 181 5.203 8.364 10.397
232 1HB HSL 181 HB1 HSL 181 4.212 6.983 8.821
233 2HB HSL 181 HB2 HSL 181 4.787 5.581 9.880
Start of MODEL 59
1 1H PHE 155 HT1 PHE 155 -7.547 11.465 -16.843
2 2H PHE 155 HT2 PHE 155 -8.359 10.503 -15.677
3 3H PHE 155 HT3 PHE 155 -7.025 9.861 -16.543
4 HA PHE 155 HA PHE 155 -6.886 12.167 -14.729
5 1HB PHE 155 HB2 PHE 155 -7.399 9.575 -14.015
6 2HB PHE 155 HB1 PHE 155 -5.642 9.625 -13.944
7 HD1 PHE 155 HD1 PHE 155 -8.588 11.642 -12.864
8 HD2 PHE 155 HD2 PHE 155 -4.666 10.259 -11.966
9 HE1 PHE 155 HE1 PHE 155 -8.718 12.720 -10.656
10 HE2 PHE 155 HE2 PHE 155 -4.788 11.333 -9.756
11 HZ PHE 155 HZ PHE 155 -6.816 12.566 -9.099
12 H LEU 156 HN LEU 156 -4.341 11.294 -13.778
13 HA LEU 156 HA LEU 156 -2.554 10.891 -15.951
14 1HB LEU 156 HB2 LEU 156 -1.496 13.037 -16.009
15 2HB LEU 156 HB1 LEU 156 -3.211 13.256 -16.298
16 HG LEU 156 HG LEU 156 -3.185 13.664 -13.650
17 1HD1 LEU 156 HD11 LEU 156 -1.005 15.302 -13.646
18 2HD1 LEU 156 HD12 LEU 156 -0.402 13.895 -14.521
19 3HD1 LEU 156 HD13 LEU 156 -1.076 13.705 -12.903
20 1HD2 LEU 156 HD21 LEU 156 -2.662 15.580 -15.901
21 2HD2 LEU 156 HD22 LEU 156 -2.904 16.128 -14.243
22 3HD2 LEU 156 HD23 LEU 156 -4.180 15.238 -15.072
23 H GLN 157 HN GLN 157 -0.237 11.950 -14.951
24 HA GLN 157 HA GLN 157 1.355 11.804 -13.319
25 1HB GLN 157 HB2 GLN 157 -0.960 12.039 -11.797
26 2HB GLN 157 HB1 GLN 157 -0.203 10.576 -11.184
27 1HG GLN 157 HG2 GLN 157 1.900 12.342 -11.370
28 2HG GLN 157 HG1 GLN 157 0.557 13.356 -10.842
29 1HE2 GLN 157 HE21 GLN 157 1.642 10.042 -10.162
30 2HE2 GLN 157 HE22 GLN 157 1.601 10.200 -8.442
31 H SER 158 HN SER 158 2.180 10.159 -14.693
32 HA SER 158 HA SER 158 2.919 8.078 -15.235
33 1HB SER 158 HB2 SER 158 3.266 6.589 -13.093
34 2HB SER 158 HB1 SER 158 4.240 8.050 -13.331
35 HG SER 158 HG SER 158 1.861 7.881 -11.783
36 H ASP 159 HN ASP 159 0.352 8.216 -15.897
37 HA ASP 159 HA ASP 159 -1.358 6.854 -16.546
38 1HB ASP 159 HB2 ASP 159 0.642 5.047 -15.934
39 2HB ASP 159 HB1 ASP 159 -0.709 4.491 -14.951
40 H VAL 160 HN VAL 160 -0.492 6.218 -13.150
41 HA VAL 160 HA VAL 160 -1.683 6.815 -11.260
42 HB VAL 160 HB VAL 160 -3.272 8.119 -13.004
43 1HG1 VAL 160 HG11 VAL 160 -5.189 6.162 -11.773
44 2HG1 VAL 160 HG12 VAL 160 -4.535 5.932 -13.394
45 3HG1 VAL 160 HG13 VAL 160 -5.493 7.366 -13.026
46 1HG2 VAL 160 HG21 VAL 160 -3.116 9.065 -10.932
47 2HG2 VAL 160 HG22 VAL 160 -3.476 7.556 -10.092
48 3HG2 VAL 160 HG23 VAL 160 -4.773 8.465 -10.867
49 H PHE 161 HN PHE 161 -3.078 4.589 -13.620
50 HA PHE 161 HA PHE 161 -4.359 2.920 -11.702
51 1HB PHE 161 HB2 PHE 161 -3.446 2.200 -14.495
52 2HB PHE 161 HB1 PHE 161 -4.651 1.349 -13.534
53 HD1 PHE 161 HD1 PHE 161 -3.946 4.389 -15.466
54 HD2 PHE 161 HD2 PHE 161 -6.887 2.170 -13.336
55 HE1 PHE 161 HE1 PHE 161 -5.709 5.816 -16.421
56 HE2 PHE 161 HE2 PHE 161 -8.655 3.591 -14.288
57 HZ PHE 161 HZ PHE 161 -8.067 5.417 -15.832
58 H PHE 162 HN PHE 162 -1.163 3.106 -13.042
59 HA PHE 162 HA PHE 162 -0.222 0.540 -12.297
60 1HB PHE 162 HB2 PHE 162 0.892 3.085 -13.247
61 2HB PHE 162 HB1 PHE 162 2.002 2.094 -12.300
62 HD1 PHE 162 HD1 PHE 162 2.504 -0.237 -13.059
63 HD2 PHE 162 HD2 PHE 162 0.359 2.536 -15.472
64 HE1 PHE 162 HE1 PHE 162 2.972 -1.610 -15.047
65 HE2 PHE 162 HE2 PHE 162 0.823 1.168 -17.464
66 HZ PHE 162 HZ PHE 162 2.131 -0.908 -17.253
67 H LEU 163 HN LEU 163 0.412 3.732 -10.865
68 HA LEU 163 HA LEU 163 1.595 2.740 -8.489
69 1HB LEU 163 HB2 LEU 163 0.459 5.351 -9.383
70 2HB LEU 163 HB1 LEU 163 0.870 5.131 -7.693
71 HG LEU 163 HG LEU 163 2.953 4.457 -9.708
72 1HD1 LEU 163 HD11 LEU 163 3.411 6.553 -10.394
73 2HD1 LEU 163 HD12 LEU 163 2.888 7.281 -8.875
74 3HD1 LEU 163 HD13 LEU 163 1.694 6.807 -10.083
75 1HD2 LEU 163 HD21 LEU 163 4.418 4.896 -7.993
76 2HD2 LEU 163 HD22 LEU 163 3.013 4.323 -7.094
77 3HD2 LEU 163 HD23 LEU 163 3.336 6.053 -7.218
78 H PHE 164 HN PHE 164 -1.468 2.526 -9.592
79 HA PHE 164 HA PHE 164 -3.029 3.032 -7.281
80 1HB PHE 164 HB2 PHE 164 -3.535 2.751 -9.916
81 2HB PHE 164 HB1 PHE 164 -3.973 1.140 -9.360
82 HD1 PHE 164 HD1 PHE 164 -4.534 4.698 -8.366
83 HD2 PHE 164 HD2 PHE 164 -6.157 0.784 -8.769
84 HE1 PHE 164 HE1 PHE 164 -6.731 5.537 -7.639
85 HE2 PHE 164 HE2 PHE 164 -8.355 1.616 -8.044
86 HZ PHE 164 HZ PHE 164 -8.645 3.996 -7.477
87 H LEU 165 HN LEU 165 -1.064 0.406 -8.321
88 HA LEU 165 HA LEU 165 -2.383 -1.746 -7.056
89 1HB LEU 165 HB2 LEU 165 -0.106 -1.411 -8.604
90 2HB LEU 165 HB1 LEU 165 0.520 -1.951 -7.055
91 HG LEU 165 HG LEU 165 0.192 -3.857 -8.497
92 1HD1 LEU 165 HD11 LEU 165 -1.769 -4.967 -7.109
93 2HD1 LEU 165 HD12 LEU 165 -1.546 -3.529 -6.114
94 3HD1 LEU 165 HD13 LEU 165 -0.194 -4.628 -6.391
95 1HD2 LEU 165 HD21 LEU 165 -2.742 -3.598 -8.611
96 2HD2 LEU 165 HD22 LEU 165 -1.608 -4.239 -9.800
97 3HD2 LEU 165 HD23 LEU 165 -1.826 -2.496 -9.638
98 H LEU 166 HN LEU 166 -0.077 0.648 -5.955
99 HA LEU 166 HA LEU 166 -0.727 0.146 -3.213
100 1HB LEU 166 HB2 LEU 166 1.604 -1.078 -4.449
101 2HB LEU 166 HB1 LEU 166 2.046 -0.058 -3.087
102 HG LEU 166 HG LEU 166 0.152 -2.408 -3.040
103 1HD1 LEU 166 HD11 LEU 166 1.784 -3.528 -1.778
104 2HD1 LEU 166 HD12 LEU 166 2.717 -2.055 -1.518
105 3HD1 LEU 166 HD13 LEU 166 2.663 -2.793 -3.118
106 1HD2 LEU 166 HD21 LEU 166 0.180 -1.969 -0.554
107 2HD2 LEU 166 HD22 LEU 166 -0.753 -0.836 -1.528
108 3HD2 LEU 166 HD23 LEU 166 0.842 -0.380 -0.930
109 HA PRO 167 HA PRO 167 0.082 4.575 -4.646
110 1HB PRO 167 HB2 PRO 167 -1.325 5.131 -2.171
111 2HB PRO 167 HB1 PRO 167 -1.781 5.544 -3.833
112 1HG PRO 167 HG2 PRO 167 -2.683 3.319 -2.164
113 2HG PRO 167 HG1 PRO 167 -3.372 3.942 -3.669
114 1HD PRO 167 HD2 PRO 167 -2.126 1.530 -3.483
115 2HD PRO 167 HD1 PRO 167 -2.141 2.501 -4.970
116 HA PRO 168 HA PRO 168 2.360 5.231 -0.583
117 1HB PRO 168 HB2 PRO 168 1.907 3.758 1.576
118 2HB PRO 168 HB1 PRO 168 0.720 4.952 1.017
119 1HG PRO 168 HG2 PRO 168 0.690 1.982 0.725
120 2HG PRO 168 HG1 PRO 168 -0.645 3.093 1.067
121 1HD PRO 168 HD2 PRO 168 0.022 2.054 -1.447
122 2HD PRO 168 HD1 PRO 168 -1.041 3.439 -1.136
123 H ILE 169 HN ILE 169 1.985 1.674 -0.552
124 HA ILE 169 HA ILE 169 3.472 0.015 -1.024
125 HB ILE 169 HB ILE 169 4.647 2.119 -2.349
126 1HG1 ILE 169 HG12 ILE 169 6.340 -0.089 -2.745
127 2HG1 ILE 169 HG11 ILE 169 4.775 -0.764 -2.305
128 1HG2 ILE 169 HG21 ILE 169 6.138 2.563 -0.436
129 2HG2 ILE 169 HG22 ILE 169 7.020 2.077 -1.882
130 3HG2 ILE 169 HG23 ILE 169 6.771 0.923 -0.573
131 1HD1 ILE 169 HD11 ILE 169 5.114 -0.476 -4.740
132 2HD1 ILE 169 HD12 ILE 169 5.184 1.267 -4.481
133 3HD1 ILE 169 HD13 ILE 169 3.707 0.379 -4.110
134 H ILE 170 HN ILE 170 4.776 2.609 1.010
135 HA ILE 170 HA ILE 170 6.429 0.892 2.565
136 HB ILE 170 HB ILE 170 5.428 3.576 3.473
137 1HG1 ILE 170 HG12 ILE 170 7.777 4.183 2.276
138 2HG1 ILE 170 HG11 ILE 170 7.200 2.919 1.195
139 1HG2 ILE 170 HG21 ILE 170 6.701 2.388 5.113
140 2HG2 ILE 170 HG22 ILE 170 7.708 3.683 4.468
141 3HG2 ILE 170 HG23 ILE 170 7.965 2.022 3.938
142 1HD1 ILE 170 HD11 ILE 170 6.235 5.656 1.586
143 2HD1 ILE 170 HD12 ILE 170 4.972 4.433 1.441
144 3HD1 ILE 170 HD13 ILE 170 6.174 4.617 0.164
145 H LEU 171 HN LEU 171 3.294 2.450 3.154
146 HA LEU 171 HA LEU 171 2.929 1.395 5.760
147 1HB LEU 171 HB2 LEU 171 1.075 2.538 3.707
148 2HB LEU 171 HB1 LEU 171 0.496 1.992 5.267
149 HG LEU 171 HG LEU 171 2.708 3.768 5.675
150 1HD1 LEU 171 HD11 LEU 171 2.448 5.005 3.782
151 2HD1 LEU 171 HD12 LEU 171 1.248 5.794 4.806
152 3HD1 LEU 171 HD13 LEU 171 0.741 4.597 3.613
153 1HD2 LEU 171 HD21 LEU 171 -0.239 3.990 6.275
154 2HD2 LEU 171 HD22 LEU 171 1.015 5.033 6.945
155 3HD2 LEU 171 HD23 LEU 171 1.002 3.311 7.328
156 H ASP 172 HN ASP 172 3.036 -0.212 2.948
157 HA ASP 172 HA ASP 172 1.576 -2.474 4.029
158 1HB ASP 172 HB2 ASP 172 0.357 -0.873 2.143
159 2HB ASP 172 HB1 ASP 172 1.084 -2.149 1.156
160 H ALA 173 HN ALA 173 4.395 -1.471 3.202
161 HA ALA 173 HA ALA 173 5.212 -3.406 1.221
162 1HB ALA 173 HB1 ALA 173 6.707 -1.717 1.026
163 2HB ALA 173 HB2 ALA 173 7.536 -2.554 2.338
164 3HB ALA 173 HB3 ALA 173 6.478 -1.187 2.693
165 H GLY 174 HN GLY 174 5.595 -2.827 4.681
166 1HA GLY 174 HA2 GLY 174 6.075 -5.728 5.034
167 2HA GLY 174 HA1 GLY 174 7.040 -4.522 5.907
168 H TYR 175 HN TYR 175 4.527 -2.819 6.101
169 HA TYR 175 HA TYR 175 2.791 -2.448 7.498
170 1HB TYR 175 HB2 TYR 175 1.934 -4.655 6.702
171 2HB TYR 175 HB1 TYR 175 2.789 -5.429 8.032
172 HD1 TYR 175 HD1 TYR 175 1.435 -6.042 9.786
173 HD2 TYR 175 HD2 TYR 175 0.503 -2.488 7.639
174 HE1 TYR 175 HE1 TYR 175 -0.501 -5.669 11.256
175 HE2 TYR 175 HE2 TYR 175 -1.435 -2.105 9.105
176 HH TYR 175 HH TYR 175 -2.975 -3.870 10.619
177 H PHE 176 HN PHE 176 5.702 -3.876 8.446
178 HA PHE 176 HA PHE 176 5.188 -3.510 11.292
179 1HB PHE 176 HB2 PHE 176 6.415 -5.551 10.319
180 2HB PHE 176 HB1 PHE 176 7.774 -4.451 10.054
181 HD1 PHE 176 HD1 PHE 176 5.372 -4.811 12.889
182 HD2 PHE 176 HD2 PHE 176 9.417 -4.961 11.576
183 HE1 PHE 176 HE1 PHE 176 6.108 -5.175 15.208
184 HE2 PHE 176 HE2 PHE 176 10.160 -5.326 13.892
185 HZ PHE 176 HZ PHE 176 8.505 -5.434 15.713
186 H LEU 177 HN LEU 177 6.196 -1.727 8.673
187 HA LEU 177 HA LEU 177 8.400 -0.292 9.414
188 1HB LEU 177 HB2 LEU 177 6.063 0.178 7.726
189 2HB LEU 177 HB1 LEU 177 6.762 1.656 8.361
190 HG LEU 177 HG LEU 177 7.586 0.898 6.091
191 1HD1 LEU 177 HD11 LEU 177 10.081 1.193 6.913
192 2HD1 LEU 177 HD12 LEU 177 9.274 1.634 8.418
193 3HD1 LEU 177 HD13 LEU 177 8.930 2.529 6.937
194 1HD2 LEU 177 HD21 LEU 177 9.488 -0.933 7.404
195 2HD2 LEU 177 HD22 LEU 177 8.769 -1.000 5.794
196 3HD2 LEU 177 HD23 LEU 177 7.844 -1.536 7.197
197 HA PRO 178 HA PRO 178 5.407 2.716 11.947
198 1HB PRO 178 HB2 PRO 178 3.355 0.671 12.644
199 2HB PRO 178 HB1 PRO 178 3.150 2.387 12.268
200 1HG PRO 178 HG2 PRO 178 2.463 0.535 10.499
201 2HG PRO 178 HG1 PRO 178 3.273 2.024 9.972
202 1HD PRO 178 HD2 PRO 178 4.407 -0.725 10.335
203 2HD PRO 178 HD1 PRO 178 4.713 0.462 9.051
204 H LEU 179 HN LEU 179 4.198 1.976 14.363
205 HA LEU 179 HA LEU 179 4.539 1.049 16.425
206 1HB LEU 179 HB2 LEU 179 5.322 -1.001 15.060
207 2HB LEU 179 HB1 LEU 179 6.942 -0.445 15.431
208 HG LEU 179 HG LEU 179 6.200 -0.512 17.894
209 1HD1 LEU 179 HD11 LEU 179 4.283 -1.558 18.504
210 2HD1 LEU 179 HD12 LEU 179 4.270 -2.606 17.085
211 3HD1 LEU 179 HD13 LEU 179 3.746 -0.928 16.946
212 1HD2 LEU 179 HD21 LEU 179 7.806 -2.068 17.234
213 2HD2 LEU 179 HD22 LEU 179 6.692 -2.901 16.150
214 3HD2 LEU 179 HD23 LEU 179 6.511 -3.062 17.897
215 H ARG 180 HN ARG 180 6.724 2.845 14.650
216 HA ARG 180 HA ARG 180 7.839 4.007 17.048
217 1HB ARG 180 HB2 ARG 180 10.177 3.908 15.927
218 2HB ARG 180 HB1 ARG 180 9.593 2.483 16.793
219 1HG ARG 180 HG2 ARG 180 8.740 2.296 14.087
220 2HG ARG 180 HG1 ARG 180 10.458 2.695 14.103
221 1HD ARG 180 HD2 ARG 180 11.043 0.738 15.136
222 2HD ARG 180 HD1 ARG 180 9.488 0.575 15.950
223 HE ARG 180 HE ARG 180 8.687 -0.576 14.135
224 1HH1 ARG 180 1HH1 ARG 180 11.694 0.974 13.272
225 2HH1 ARG 180 2HH1 ARG 180 11.823 0.158 11.750
226 1HH2 ARG 180 1HH2 ARG 180 8.857 -1.649 12.133
227 2HH2 ARG 180 2HH2 ARG 180 10.212 -1.330 11.103
228 1HG HSL 181 HG1 HSL 181 5.400 8.111 11.764
229 2HG HSL 181 HG2 HSL 181 3.877 7.082 11.863
230 H HSL 181 HN HSL 181 5.959 4.668 14.987
231 HA HSL 181 HA HSL 181 7.358 7.045 13.656
232 1HB HSL 181 HB1 HSL 181 6.480 5.970 11.735
233 2HB HSL 181 HB2 HSL 181 5.116 5.173 12.692
Start of MODEL 60
1 1H PHE 155 HT1 PHE 155 -5.346 1.917 -1.676
2 2H PHE 155 HT2 PHE 155 -4.747 1.281 -0.199
3 3H PHE 155 HT3 PHE 155 -6.434 1.503 -0.419
4 HA PHE 155 HA PHE 155 -5.658 -0.798 -0.608
5 1HB PHE 155 HB2 PHE 155 -7.551 0.663 -2.005
6 2HB PHE 155 HB1 PHE 155 -6.744 -0.275 -3.255
7 HD1 PHE 155 HD1 PHE 155 -7.531 -2.381 -3.706
8 HD2 PHE 155 HD2 PHE 155 -8.194 -0.715 0.152
9 HE1 PHE 155 HE1 PHE 155 -8.870 -4.352 -3.090
10 HE2 PHE 155 HE2 PHE 155 -9.532 -2.683 0.777
11 HZ PHE 155 HZ PHE 155 -9.872 -4.505 -0.846
12 H LEU 156 HN LEU 156 -5.460 -1.954 -3.156
13 HA LEU 156 HA LEU 156 -3.131 -0.999 -4.504
14 1HB LEU 156 HB2 LEU 156 -2.983 -3.399 -2.703
15 2HB LEU 156 HB1 LEU 156 -1.882 -3.184 -4.051
16 HG LEU 156 HG LEU 156 -2.155 -1.383 -1.646
17 1HD1 LEU 156 HD11 LEU 156 -0.960 -3.489 -1.261
18 2HD1 LEU 156 HD12 LEU 156 0.108 -2.088 -1.156
19 3HD1 LEU 156 HD13 LEU 156 0.125 -3.105 -2.596
20 1HD2 LEU 156 HD21 LEU 156 -0.249 -0.157 -2.644
21 2HD2 LEU 156 HD22 LEU 156 -1.733 -0.022 -3.587
22 3HD2 LEU 156 HD23 LEU 156 -0.449 -1.109 -4.114
23 H GLN 157 HN GLN 157 -5.950 -1.953 -4.990
24 HA GLN 157 HA GLN 157 -5.714 -4.380 -6.493
25 1HB GLN 157 HB2 GLN 157 -7.822 -3.383 -5.362
26 2HB GLN 157 HB1 GLN 157 -7.945 -2.391 -6.808
27 1HG GLN 157 HG2 GLN 157 -7.568 -4.974 -7.758
28 2HG GLN 157 HG1 GLN 157 -8.672 -5.150 -6.395
29 1HE2 GLN 157 HE21 GLN 157 -8.147 -3.290 -9.352
30 2HE2 GLN 157 HE22 GLN 157 -9.819 -3.064 -9.719
31 H SER 158 HN SER 158 -5.371 -0.989 -7.111
32 HA SER 158 HA SER 158 -5.573 -1.197 -9.954
33 1HB SER 158 HB2 SER 158 -5.322 0.918 -8.000
34 2HB SER 158 HB1 SER 158 -4.244 1.187 -9.379
35 HG SER 158 HG SER 158 -7.053 0.923 -9.344
36 H ASP 159 HN ASP 159 -3.337 -2.524 -8.104
37 HA ASP 159 HA ASP 159 -1.306 -3.419 -8.629
38 1HB ASP 159 HB2 ASP 159 -2.161 -2.647 -11.107
39 2HB ASP 159 HB1 ASP 159 -0.667 -1.728 -10.940
40 H VAL 160 HN VAL 160 -1.947 -0.222 -7.951
41 HA VAL 160 HA VAL 160 -0.762 1.247 -6.669
42 HB VAL 160 HB VAL 160 0.819 -1.013 -6.374
43 1HG1 VAL 160 HG11 VAL 160 2.417 -0.349 -8.048
44 2HG1 VAL 160 HG12 VAL 160 3.145 -0.171 -6.454
45 3HG1 VAL 160 HG13 VAL 160 2.572 1.251 -7.322
46 1HG2 VAL 160 HG21 VAL 160 1.764 1.427 -5.025
47 2HG2 VAL 160 HG22 VAL 160 1.245 -0.119 -4.353
48 3HG2 VAL 160 HG23 VAL 160 0.045 1.067 -4.864
49 H PHE 161 HN PHE 161 1.179 0.058 -9.413
50 HA PHE 161 HA PHE 161 2.091 2.701 -10.077
51 1HB PHE 161 HB2 PHE 161 2.296 0.130 -11.660
52 2HB PHE 161 HB1 PHE 161 3.181 1.618 -11.983
53 HD1 PHE 161 HD1 PHE 161 3.284 -1.511 -10.389
54 HD2 PHE 161 HD2 PHE 161 4.642 2.504 -10.006
55 HE1 PHE 161 HE1 PHE 161 5.087 -2.267 -8.895
56 HE2 PHE 161 HE2 PHE 161 6.448 1.755 -8.512
57 HZ PHE 161 HZ PHE 161 6.672 -0.633 -7.955
58 H PHE 162 HN PHE 162 -0.786 2.401 -10.042
59 HA PHE 162 HA PHE 162 -1.393 3.640 -12.530
60 1HB PHE 162 HB2 PHE 162 -2.329 0.822 -12.051
61 2HB PHE 162 HB1 PHE 162 -3.216 1.938 -13.094
62 HD1 PHE 162 HD1 PHE 162 -0.586 -0.436 -12.903
63 HD2 PHE 162 HD2 PHE 162 -1.903 3.006 -15.030
64 HE1 PHE 162 HE1 PHE 162 0.888 -1.037 -14.778
65 HE2 PHE 162 HE2 PHE 162 -0.431 2.411 -16.911
66 HZ PHE 162 HZ PHE 162 0.967 0.387 -16.785
67 H LEU 163 HN LEU 163 -2.238 2.591 -9.356
68 HA LEU 163 HA LEU 163 -4.953 3.261 -9.293
69 1HB LEU 163 HB2 LEU 163 -3.843 2.083 -7.457
70 2HB LEU 163 HB1 LEU 163 -2.853 3.490 -7.129
71 HG LEU 163 HG LEU 163 -4.710 4.725 -6.298
72 1HD1 LEU 163 HD11 LEU 163 -6.297 2.636 -7.683
73 2HD1 LEU 163 HD12 LEU 163 -6.558 4.377 -7.578
74 3HD1 LEU 163 HD13 LEU 163 -6.968 3.341 -6.211
75 1HD2 LEU 163 HD21 LEU 163 -3.988 3.452 -4.533
76 2HD2 LEU 163 HD22 LEU 163 -4.418 1.929 -5.312
77 3HD2 LEU 163 HD23 LEU 163 -5.678 2.954 -4.624
78 H PHE 164 HN PHE 164 -2.014 5.133 -8.903
79 HA PHE 164 HA PHE 164 -1.557 7.336 -9.072
80 1HB PHE 164 HB2 PHE 164 -2.474 8.216 -10.911
81 2HB PHE 164 HB1 PHE 164 -3.483 6.775 -10.985
82 HD1 PHE 164 HD1 PHE 164 -5.793 6.974 -10.886
83 HD2 PHE 164 HD2 PHE 164 -3.373 10.219 -9.576
84 HE1 PHE 164 HE1 PHE 164 -7.802 8.379 -10.670
85 HE2 PHE 164 HE2 PHE 164 -5.377 11.629 -9.354
86 HZ PHE 164 HZ PHE 164 -7.595 10.710 -9.901
87 H LEU 165 HN LEU 165 -4.521 6.426 -7.495
88 HA LEU 165 HA LEU 165 -5.131 8.929 -6.329
89 1HB LEU 165 HB2 LEU 165 -6.034 6.160 -6.058
90 2HB LEU 165 HB1 LEU 165 -6.111 7.071 -4.561
91 HG LEU 165 HG LEU 165 -7.547 8.729 -5.586
92 1HD1 LEU 165 HD11 LEU 165 -6.736 7.343 -8.063
93 2HD1 LEU 165 HD12 LEU 165 -7.093 9.046 -7.776
94 3HD1 LEU 165 HD13 LEU 165 -8.410 7.890 -7.978
95 1HD2 LEU 165 HD21 LEU 165 -8.802 6.201 -6.507
96 2HD2 LEU 165 HD22 LEU 165 -9.461 7.495 -5.507
97 3HD2 LEU 165 HD23 LEU 165 -8.340 6.326 -4.810
98 H LEU 166 HN LEU 166 -3.910 6.015 -4.679
99 HA LEU 166 HA LEU 166 -1.821 7.464 -3.355
100 1HB LEU 166 HB2 LEU 166 -4.396 7.455 -2.174
101 2HB LEU 166 HB1 LEU 166 -3.399 6.369 -1.225
102 HG LEU 166 HG LEU 166 -2.229 9.016 -1.876
103 1HD1 LEU 166 HD11 LEU 166 -3.473 9.771 0.319
104 2HD1 LEU 166 HD12 LEU 166 -4.690 8.630 -0.252
105 3HD1 LEU 166 HD13 LEU 166 -4.207 9.986 -1.270
106 1HD2 LEU 166 HD21 LEU 166 -1.603 8.734 0.592
107 2HD2 LEU 166 HD22 LEU 166 -0.867 7.635 -0.573
108 3HD2 LEU 166 HD23 LEU 166 -2.215 7.090 0.424
109 HA PRO 167 HA PRO 167 -0.935 3.025 -3.566
110 1HB PRO 167 HB2 PRO 167 1.641 3.200 -4.206
111 2HB PRO 167 HB1 PRO 167 0.373 3.559 -5.394
112 1HG PRO 167 HG2 PRO 167 2.088 5.434 -3.822
113 2HG PRO 167 HG1 PRO 167 1.538 5.558 -5.501
114 1HD PRO 167 HD2 PRO 167 0.385 6.850 -3.314
115 2HD PRO 167 HD1 PRO 167 -0.390 6.599 -4.891
116 HA PRO 168 HA PRO 168 0.561 3.368 0.786
117 1HB PRO 168 HB2 PRO 168 -0.494 0.961 1.523
118 2HB PRO 168 HB1 PRO 168 -1.433 2.468 1.510
119 1HG PRO 168 HG2 PRO 168 -1.288 0.311 -0.577
120 2HG PRO 168 HG1 PRO 168 -2.721 1.119 0.091
121 1HD PRO 168 HD2 PRO 168 -1.712 1.843 -2.271
122 2HD PRO 168 HD1 PRO 168 -2.351 3.054 -1.141
123 H ILE 169 HN ILE 169 2.626 3.055 -0.578
124 HA ILE 169 HA ILE 169 3.566 0.377 -0.949
125 HB ILE 169 HB ILE 169 4.228 2.611 -2.171
126 1HG1 ILE 169 HG12 ILE 169 6.499 1.505 -2.682
127 2HG1 ILE 169 HG11 ILE 169 5.987 0.249 -1.560
128 1HG2 ILE 169 HG21 ILE 169 5.138 3.557 0.004
129 2HG2 ILE 169 HG22 ILE 169 6.163 3.701 -1.425
130 3HG2 ILE 169 HG23 ILE 169 6.498 2.457 -0.220
131 1HD1 ILE 169 HD11 ILE 169 5.519 -0.394 -3.841
132 2HD1 ILE 169 HD12 ILE 169 4.561 1.068 -4.079
133 3HD1 ILE 169 HD13 ILE 169 4.015 -0.170 -2.947
134 H ILE 170 HN ILE 170 4.028 2.889 1.443
135 HA ILE 170 HA ILE 170 6.124 1.581 2.864
136 HB ILE 170 HB ILE 170 4.323 3.665 4.056
137 1HG1 ILE 170 HG12 ILE 170 4.885 4.561 1.905
138 2HG1 ILE 170 HG11 ILE 170 5.915 5.351 3.092
139 1HG2 ILE 170 HG21 ILE 170 7.288 3.325 4.381
140 2HG2 ILE 170 HG22 ILE 170 6.126 2.447 5.374
141 3HG2 ILE 170 HG23 ILE 170 6.161 4.209 5.411
142 1HD1 ILE 170 HD11 ILE 170 7.810 4.289 2.342
143 2HD1 ILE 170 HD12 ILE 170 6.906 4.531 0.847
144 3HD1 ILE 170 HD13 ILE 170 6.908 2.951 1.630
145 H LEU 171 HN LEU 171 2.654 2.050 3.613
146 HA LEU 171 HA LEU 171 2.718 0.513 5.985
147 1HB LEU 171 HB2 LEU 171 0.464 1.223 4.106
148 2HB LEU 171 HB1 LEU 171 0.215 0.324 5.591
149 HG LEU 171 HG LEU 171 -0.338 2.597 6.033
150 1HD1 LEU 171 HD11 LEU 171 1.007 1.361 7.742
151 2HD1 LEU 171 HD12 LEU 171 1.106 3.117 7.850
152 3HD1 LEU 171 HD13 LEU 171 2.433 2.202 7.136
153 1HD2 LEU 171 HD21 LEU 171 1.180 3.352 4.039
154 2HD2 LEU 171 HD22 LEU 171 2.382 3.579 5.310
155 3HD2 LEU 171 HD23 LEU 171 0.851 4.450 5.380
156 H ASP 172 HN ASP 172 1.766 -0.250 2.677
157 HA ASP 172 HA ASP 172 1.379 -3.036 3.197
158 1HB ASP 172 HB2 ASP 172 0.415 -1.457 1.280
159 2HB ASP 172 HB1 ASP 172 1.843 -2.051 0.421
160 H ALA 173 HN ALA 173 4.136 -1.194 3.010
161 HA ALA 173 HA ALA 173 5.808 -2.915 1.464
162 1HB ALA 173 HB1 ALA 173 7.070 -1.080 1.575
163 2HB ALA 173 HB2 ALA 173 7.448 -1.511 3.242
164 3HB ALA 173 HB3 ALA 173 6.103 -0.427 2.895
165 H GLY 174 HN GLY 174 5.956 -2.134 4.921
166 1HA GLY 174 HA2 GLY 174 6.594 -4.973 5.451
167 2HA GLY 174 HA1 GLY 174 7.382 -3.633 6.306
168 H TYR 175 HN TYR 175 4.436 -2.465 5.989
169 HA TYR 175 HA TYR 175 2.712 -2.058 7.348
170 1HB TYR 175 HB2 TYR 175 1.864 -4.343 8.518
171 2HB TYR 175 HB1 TYR 175 1.484 -3.874 6.868
172 HD1 TYR 175 HD1 TYR 175 2.905 -4.823 4.992
173 HD2 TYR 175 HD2 TYR 175 3.045 -6.323 8.972
174 HE1 TYR 175 HE1 TYR 175 3.908 -6.910 4.164
175 HE2 TYR 175 HE2 TYR 175 4.050 -8.413 8.153
176 HH TYR 175 HH TYR 175 5.216 -8.759 4.938
177 H PHE 176 HN PHE 176 4.824 -4.378 9.057
178 HA PHE 176 HA PHE 176 4.248 -3.044 11.574
179 1HB PHE 176 HB2 PHE 176 4.278 -5.400 11.775
180 2HB PHE 176 HB1 PHE 176 5.758 -5.545 10.820
181 HD1 PHE 176 HD1 PHE 176 7.673 -6.048 11.959
182 HD2 PHE 176 HD2 PHE 176 4.603 -3.895 13.972
183 HE1 PHE 176 HE1 PHE 176 9.005 -6.091 14.028
184 HE2 PHE 176 HE2 PHE 176 5.930 -3.934 16.044
185 HZ PHE 176 HZ PHE 176 8.134 -5.033 16.073
186 H LEU 177 HN LEU 177 6.361 -2.575 9.053
187 HA LEU 177 HA LEU 177 8.848 -2.150 10.179
188 1HB LEU 177 HB2 LEU 177 7.385 -0.932 7.880
189 2HB LEU 177 HB1 LEU 177 8.898 -0.208 8.391
190 HG LEU 177 HG LEU 177 8.628 -3.121 7.673
191 1HD1 LEU 177 HD11 LEU 177 9.680 -2.488 5.522
192 2HD1 LEU 177 HD12 LEU 177 9.435 -0.792 5.939
193 3HD1 LEU 177 HD13 LEU 177 8.045 -1.855 5.714
194 1HD2 LEU 177 HD21 LEU 177 11.100 -2.879 7.365
195 2HD2 LEU 177 HD22 LEU 177 10.543 -2.704 9.029
196 3HD2 LEU 177 HD23 LEU 177 10.971 -1.275 8.087
197 HA PRO 178 HA PRO 178 7.161 2.516 11.021
198 1HB PRO 178 HB2 PRO 178 4.522 1.426 11.928
199 2HB PRO 178 HB1 PRO 178 4.906 3.004 11.226
200 1HG PRO 178 HG2 PRO 178 3.777 1.122 9.743
201 2HG PRO 178 HG1 PRO 178 5.055 2.150 9.070
202 1HD PRO 178 HD2 PRO 178 5.170 -0.694 9.935
203 2HD PRO 178 HD1 PRO 178 6.056 0.132 8.640
204 H LEU 179 HN LEU 179 8.833 1.770 12.551
205 HA LEU 179 HA LEU 179 7.843 0.797 15.122
206 1HB LEU 179 HB2 LEU 179 10.062 0.119 13.786
207 2HB LEU 179 HB1 LEU 179 10.709 1.463 14.707
208 HG LEU 179 HG LEU 179 11.070 -0.747 15.777
209 1HD1 LEU 179 HD11 LEU 179 11.068 1.261 17.129
210 2HD1 LEU 179 HD12 LEU 179 10.322 -0.069 18.016
211 3HD1 LEU 179 HD13 LEU 179 9.313 1.180 17.286
212 1HD2 LEU 179 HD21 LEU 179 8.265 -0.892 16.668
213 2HD2 LEU 179 HD22 LEU 179 9.413 -2.181 16.308
214 3HD2 LEU 179 HD23 LEU 179 8.569 -1.360 14.995
215 H ARG 180 HN ARG 180 10.065 3.352 14.020
216 HA ARG 180 HA ARG 180 9.496 4.915 16.402
217 1HB ARG 180 HB2 ARG 180 11.243 6.406 15.628
218 2HB ARG 180 HB1 ARG 180 11.814 4.738 15.521
219 1HG ARG 180 HG2 ARG 180 10.566 5.927 13.103
220 2HG ARG 180 HG1 ARG 180 12.172 6.489 13.568
221 1HD ARG 180 HD2 ARG 180 13.002 4.706 12.536
222 2HD ARG 180 HD1 ARG 180 12.289 3.717 13.810
223 HE ARG 180 HE ARG 180 10.232 4.004 12.118
224 1HH1 ARG 180 1HH1 ARG 180 13.562 3.098 11.578
225 2HH1 ARG 180 2HH1 ARG 180 13.200 2.109 10.205
226 1HH2 ARG 180 1HH2 ARG 180 9.756 2.703 10.313
227 2HH2 ARG 180 2HH2 ARG 180 11.038 1.884 9.486
228 1HG HSL 181 HG1 HSL 181 3.678 4.825 12.483
229 2HG HSL 181 HG2 HSL 181 4.740 3.685 13.462
230 H HSL 181 HN HSL 181 7.308 4.386 14.733
231 HA HSL 181 HA HSL 181 6.679 7.159 13.590
232 1HB HSL 181 HB1 HSL 181 5.476 6.221 11.835
233 2HB HSL 181 HB2 HSL 181 6.487 4.708 12.159
Start of MODEL 61
1 1H PHE 155 HT1 PHE 155 9.536 4.801 -10.310
2 2H PHE 155 HT2 PHE 155 8.887 6.249 -10.965
3 3H PHE 155 HT3 PHE 155 9.101 4.870 -11.966
4 HA PHE 155 HA PHE 155 7.334 4.944 -9.619
5 1HB PHE 155 HB2 PHE 155 5.549 5.045 -11.474
6 2HB PHE 155 HB1 PHE 155 6.399 6.534 -11.080
7 HD1 PHE 155 HD1 PHE 155 7.359 7.774 -12.771
8 HD2 PHE 155 HD2 PHE 155 6.536 3.651 -13.434
9 HE1 PHE 155 HE1 PHE 155 8.013 8.027 -15.129
10 HE2 PHE 155 HE2 PHE 155 7.189 3.896 -15.793
11 HZ PHE 155 HZ PHE 155 7.929 6.087 -16.644
12 H LEU 156 HN LEU 156 6.198 3.068 -9.310
13 HA LEU 156 HA LEU 156 6.132 0.950 -11.212
14 1HB LEU 156 HB2 LEU 156 7.976 0.787 -8.844
15 2HB LEU 156 HB1 LEU 156 7.309 -0.655 -9.583
16 HG LEU 156 HG LEU 156 9.166 1.352 -10.851
17 1HD1 LEU 156 HD11 LEU 156 10.423 -0.893 -11.201
18 2HD1 LEU 156 HD12 LEU 156 9.403 -1.458 -9.878
19 3HD1 LEU 156 HD13 LEU 156 10.485 -0.088 -9.634
20 1HD2 LEU 156 HD21 LEU 156 7.781 -1.010 -12.118
21 2HD2 LEU 156 HD22 LEU 156 9.044 -0.034 -12.867
22 3HD2 LEU 156 HD23 LEU 156 7.483 0.688 -12.485
23 H GLN 157 HN GLN 157 5.429 -1.177 -9.861
24 HA GLN 157 HA GLN 157 3.915 -2.184 -8.475
25 1HB GLN 157 HB2 GLN 157 4.744 -0.401 -6.788
26 2HB GLN 157 HB1 GLN 157 3.258 0.452 -7.186
27 1HG GLN 157 HG2 GLN 157 2.750 -0.772 -5.269
28 2HG GLN 157 HG1 GLN 157 2.047 -1.701 -6.592
29 1HE2 GLN 157 HE21 GLN 157 5.172 -1.431 -4.921
30 2HE2 GLN 157 HE22 GLN 157 5.430 -3.132 -4.770
31 H SER 158 HN SER 158 2.992 -2.059 -10.767
32 HA SER 158 HA SER 158 1.177 -1.896 -12.123
33 1HB SER 158 HB2 SER 158 0.196 -2.610 -9.713
34 2HB SER 158 HB1 SER 158 -0.651 -1.071 -9.936
35 HG SER 158 HG SER 158 -1.858 -1.984 -11.388
36 H ASP 159 HN ASP 159 2.590 0.203 -12.500
37 HA ASP 159 HA ASP 159 2.491 2.306 -13.378
38 1HB ASP 159 HB2 ASP 159 -0.177 1.492 -13.443
39 2HB ASP 159 HB1 ASP 159 -0.218 3.058 -12.640
40 H VAL 160 HN VAL 160 0.380 2.230 -10.504
41 HA VAL 160 HA VAL 160 0.669 3.172 -8.439
42 HB VAL 160 HB VAL 160 3.274 3.269 -9.338
43 1HG1 VAL 160 HG11 VAL 160 2.525 6.063 -8.484
44 2HG1 VAL 160 HG12 VAL 160 3.024 5.583 -10.105
45 3HG1 VAL 160 HG13 VAL 160 4.159 5.462 -8.762
46 1HG2 VAL 160 HG21 VAL 160 2.667 2.548 -7.155
47 2HG2 VAL 160 HG22 VAL 160 2.069 4.150 -6.726
48 3HG2 VAL 160 HG23 VAL 160 3.796 3.891 -6.971
49 H PHE 161 HN PHE 161 1.382 5.346 -11.153
50 HA PHE 161 HA PHE 161 0.114 7.600 -9.925
51 1HB PHE 161 HB2 PHE 161 1.978 7.835 -11.535
52 2HB PHE 161 HB1 PHE 161 0.942 7.194 -12.806
53 HD1 PHE 161 HD1 PHE 161 0.648 8.939 -14.294
54 HD2 PHE 161 HD2 PHE 161 0.170 9.655 -10.126
55 HE1 PHE 161 HE1 PHE 161 -0.163 11.210 -14.781
56 HE2 PHE 161 HE2 PHE 161 -0.644 11.928 -10.606
57 HZ PHE 161 HZ PHE 161 -0.811 12.707 -12.936
58 H PHE 162 HN PHE 162 -1.498 5.086 -10.406
59 HA PHE 162 HA PHE 162 -3.902 6.378 -11.176
60 1HB PHE 162 HB2 PHE 162 -2.512 4.654 -13.177
61 2HB PHE 162 HB1 PHE 162 -4.275 4.615 -13.082
62 HD1 PHE 162 HD1 PHE 162 -1.572 6.128 -14.660
63 HD2 PHE 162 HD2 PHE 162 -5.377 7.038 -12.986
64 HE1 PHE 162 HE1 PHE 162 -1.692 8.158 -16.046
65 HE2 PHE 162 HE2 PHE 162 -5.504 9.069 -14.368
66 HZ PHE 162 HZ PHE 162 -3.661 9.631 -15.902
67 H LEU 163 HN LEU 163 -2.199 3.767 -9.822
68 HA LEU 163 HA LEU 163 -4.188 1.778 -9.823
69 1HB LEU 163 HB2 LEU 163 -1.622 2.054 -8.780
70 2HB LEU 163 HB1 LEU 163 -2.633 1.911 -7.356
71 HG LEU 163 HG LEU 163 -2.360 -0.079 -9.605
72 1HD1 LEU 163 HD11 LEU 163 -0.595 0.031 -7.822
73 2HD1 LEU 163 HD12 LEU 163 -1.423 -1.519 -7.966
74 3HD1 LEU 163 HD13 LEU 163 -1.844 -0.413 -6.659
75 1HD2 LEU 163 HD21 LEU 163 -3.911 -1.047 -7.403
76 2HD2 LEU 163 HD22 LEU 163 -4.344 -0.943 -9.109
77 3HD2 LEU 163 HD23 LEU 163 -4.650 0.424 -8.038
78 H PHE 164 HN PHE 164 -3.367 4.354 -7.551
79 HA PHE 164 HA PHE 164 -4.560 5.425 -5.943
80 1HB PHE 164 HB2 PHE 164 -6.060 5.423 -8.200
81 2HB PHE 164 HB1 PHE 164 -7.177 4.649 -7.076
82 HD1 PHE 164 HD1 PHE 164 -4.687 7.357 -6.514
83 HD2 PHE 164 HD2 PHE 164 -8.790 6.227 -6.575
84 HE1 PHE 164 HE1 PHE 164 -5.304 9.564 -5.615
85 HE2 PHE 164 HE2 PHE 164 -9.414 8.432 -5.677
86 HZ PHE 164 HZ PHE 164 -7.670 10.103 -5.197
87 H LEU 165 HN LEU 165 -4.654 2.145 -6.211
88 HA LEU 165 HA LEU 165 -6.717 1.458 -4.384
89 1HB LEU 165 HB2 LEU 165 -4.718 0.090 -5.922
90 2HB LEU 165 HB1 LEU 165 -4.708 -0.505 -4.267
91 HG LEU 165 HG LEU 165 -6.163 -1.844 -5.734
92 1HD1 LEU 165 HD11 LEU 165 -7.217 -0.357 -3.393
93 2HD1 LEU 165 HD12 LEU 165 -6.913 -2.081 -3.598
94 3HD1 LEU 165 HD13 LEU 165 -8.342 -1.347 -4.322
95 1HD2 LEU 165 HD21 LEU 165 -7.390 0.822 -6.250
96 2HD2 LEU 165 HD22 LEU 165 -8.412 -0.615 -6.279
97 3HD2 LEU 165 HD23 LEU 165 -7.032 -0.492 -7.371
98 H LEU 166 HN LEU 166 -3.279 2.158 -4.083
99 HA LEU 166 HA LEU 166 -3.624 2.544 -1.250
100 1HB LEU 166 HB2 LEU 166 -2.273 0.778 -0.486
101 2HB LEU 166 HB1 LEU 166 -3.395 0.083 -1.646
102 HG LEU 166 HG LEU 166 -1.451 -1.003 -2.172
103 1HD1 LEU 166 HD11 LEU 166 -0.487 0.064 -4.238
104 2HD1 LEU 166 HD12 LEU 166 -1.560 1.424 -3.934
105 3HD1 LEU 166 HD13 LEU 166 -2.233 -0.176 -4.225
106 1HD2 LEU 166 HD21 LEU 166 0.443 -0.375 -1.224
107 2HD2 LEU 166 HD22 LEU 166 -0.178 1.253 -0.948
108 3HD2 LEU 166 HD23 LEU 166 0.620 0.859 -2.470
109 HA PRO 167 HA PRO 167 -0.504 5.421 -2.891
110 1HB PRO 167 HB2 PRO 167 -0.929 7.284 -0.913
111 2HB PRO 167 HB1 PRO 167 -1.779 7.238 -2.467
112 1HG PRO 167 HG2 PRO 167 -2.684 6.361 0.219
113 2HG PRO 167 HG1 PRO 167 -3.620 7.028 -1.125
114 1HD PRO 167 HD2 PRO 167 -3.575 4.369 -0.442
115 2HD PRO 167 HD1 PRO 167 -3.954 4.976 -2.064
116 HA PRO 168 HA PRO 168 1.907 4.993 1.148
117 1HB PRO 168 HB2 PRO 168 0.953 3.738 3.245
118 2HB PRO 168 HB1 PRO 168 0.256 5.303 2.771
119 1HG PRO 168 HG2 PRO 168 -0.798 2.541 2.278
120 2HG PRO 168 HG1 PRO 168 -1.668 3.987 2.824
121 1HD PRO 168 HD2 PRO 168 -1.522 3.092 0.189
122 2HD PRO 168 HD1 PRO 168 -1.966 4.729 0.699
123 H ILE 169 HN ILE 169 3.202 3.678 -0.202
124 HA ILE 169 HA ILE 169 2.892 0.834 -0.321
125 HB ILE 169 HB ILE 169 4.080 2.523 -1.962
126 1HG1 ILE 169 HG12 ILE 169 5.502 -0.086 -1.695
127 2HG1 ILE 169 HG11 ILE 169 3.761 -0.108 -1.957
128 1HG2 ILE 169 HG21 ILE 169 6.522 1.490 -0.582
129 2HG2 ILE 169 HG22 ILE 169 5.799 3.030 -0.118
130 3HG2 ILE 169 HG23 ILE 169 6.376 2.788 -1.766
131 1HD1 ILE 169 HD11 ILE 169 4.141 0.099 -4.122
132 2HD1 ILE 169 HD12 ILE 169 5.870 0.289 -3.837
133 3HD1 ILE 169 HD13 ILE 169 4.813 1.701 -3.823
134 H ILE 170 HN ILE 170 4.758 3.068 1.579
135 HA ILE 170 HA ILE 170 6.579 1.226 2.710
136 HB ILE 170 HB ILE 170 5.620 3.838 3.882
137 1HG1 ILE 170 HG12 ILE 170 8.081 4.340 2.831
138 2HG1 ILE 170 HG11 ILE 170 7.449 3.184 1.663
139 1HG2 ILE 170 HG21 ILE 170 6.738 2.733 5.603
140 2HG2 ILE 170 HG22 ILE 170 7.989 3.745 4.879
141 3HG2 ILE 170 HG23 ILE 170 7.922 2.023 4.506
142 1HD1 ILE 170 HD11 ILE 170 6.847 5.963 1.983
143 2HD1 ILE 170 HD12 ILE 170 5.377 5.000 2.130
144 3HD1 ILE 170 HD13 ILE 170 6.386 4.857 0.690
145 H LEU 171 HN LEU 171 3.344 2.278 3.645
146 HA LEU 171 HA LEU 171 3.367 1.109 6.233
147 1HB LEU 171 HB2 LEU 171 1.292 2.133 4.364
148 2HB LEU 171 HB1 LEU 171 0.757 1.030 5.617
149 HG LEU 171 HG LEU 171 2.223 2.774 7.092
150 1HD1 LEU 171 HD11 LEU 171 2.550 4.124 4.967
151 2HD1 LEU 171 HD12 LEU 171 1.935 4.992 6.373
152 3HD1 LEU 171 HD13 LEU 171 0.835 4.518 5.079
153 1HD2 LEU 171 HD21 LEU 171 0.177 2.386 7.978
154 2HD2 LEU 171 HD22 LEU 171 -0.639 2.474 6.417
155 3HD2 LEU 171 HD23 LEU 171 -0.174 3.955 7.254
156 H ASP 172 HN ASP 172 1.799 0.043 3.235
157 HA ASP 172 HA ASP 172 1.436 -2.633 4.186
158 1HB ASP 172 HB2 ASP 172 0.723 -3.040 1.768
159 2HB ASP 172 HB1 ASP 172 -0.235 -1.878 2.695
160 H ALA 173 HN ALA 173 4.200 -1.144 3.360
161 HA ALA 173 HA ALA 173 5.346 -2.975 1.501
162 1HB ALA 173 HB1 ALA 173 6.638 -1.129 1.426
163 2HB ALA 173 HB2 ALA 173 7.501 -1.905 2.755
164 3HB ALA 173 HB3 ALA 173 6.274 -0.685 3.093
165 H GLY 174 HN GLY 174 6.233 -2.370 4.892
166 1HA GLY 174 HA2 GLY 174 6.898 -5.232 5.153
167 2HA GLY 174 HA1 GLY 174 7.539 -3.932 6.177
168 H TYR 175 HN TYR 175 4.590 -2.900 5.998
169 HA TYR 175 HA TYR 175 2.667 -3.018 7.178
170 1HB TYR 175 HB2 TYR 175 1.751 -5.055 7.142
171 2HB TYR 175 HB1 TYR 175 3.322 -5.722 6.719
172 HD1 TYR 175 HD1 TYR 175 1.240 -4.770 9.658
173 HD2 TYR 175 HD2 TYR 175 4.365 -7.235 8.156
174 HE1 TYR 175 HE1 TYR 175 1.268 -6.015 11.777
175 HE2 TYR 175 HE2 TYR 175 4.400 -8.489 10.271
176 HH TYR 175 HH TYR 175 2.717 -7.417 13.069
177 H PHE 176 HN PHE 176 5.262 -4.716 8.979
178 HA PHE 176 HA PHE 176 4.383 -3.401 11.425
179 1HB PHE 176 HB2 PHE 176 5.012 -5.881 11.256
180 2HB PHE 176 HB1 PHE 176 6.689 -5.326 11.178
181 HD1 PHE 176 HD1 PHE 176 3.663 -5.454 13.278
182 HD2 PHE 176 HD2 PHE 176 7.823 -4.575 13.119
183 HE1 PHE 176 HE1 PHE 176 3.730 -5.350 15.735
184 HE2 PHE 176 HE2 PHE 176 7.899 -4.471 15.576
185 HZ PHE 176 HZ PHE 176 5.850 -4.859 16.887
186 H LEU 177 HN LEU 177 5.906 -2.086 9.100
187 HA LEU 177 HA LEU 177 8.375 -1.299 10.410
188 1HB LEU 177 HB2 LEU 177 7.355 -0.043 7.895
189 2HB LEU 177 HB1 LEU 177 9.009 -0.286 8.417
190 HG LEU 177 HG LEU 177 7.121 -2.388 7.365
191 1HD1 LEU 177 HD11 LEU 177 8.918 -2.597 5.635
192 2HD1 LEU 177 HD12 LEU 177 9.643 -1.135 6.302
193 3HD1 LEU 177 HD13 LEU 177 8.027 -1.076 5.597
194 1HD2 LEU 177 HD21 LEU 177 9.826 -2.621 8.651
195 2HD2 LEU 177 HD22 LEU 177 9.213 -3.836 7.529
196 3HD2 LEU 177 HD23 LEU 177 8.345 -3.503 9.028
197 HA PRO 178 HA PRO 178 5.875 2.937 10.200
198 1HB PRO 178 HB2 PRO 178 3.146 1.817 10.524
199 2HB PRO 178 HB1 PRO 178 3.695 3.179 9.541
200 1HG PRO 178 HG2 PRO 178 3.034 0.859 8.409
201 2HG PRO 178 HG1 PRO 178 4.399 1.815 7.805
202 1HD PRO 178 HD2 PRO 178 4.411 -0.642 9.511
203 2HD PRO 178 HD1 PRO 178 5.496 -0.188 8.182
204 H LEU 179 HN LEU 179 5.133 0.095 12.069
205 HA LEU 179 HA LEU 179 4.070 1.350 14.362
206 1HB LEU 179 HB2 LEU 179 5.377 -1.296 13.837
207 2HB LEU 179 HB1 LEU 179 5.012 -0.808 15.482
208 HG LEU 179 HG LEU 179 3.262 -2.248 14.541
209 1HD1 LEU 179 HD11 LEU 179 2.313 0.584 14.944
210 2HD1 LEU 179 HD12 LEU 179 2.717 -0.543 16.239
211 3HD1 LEU 179 HD13 LEU 179 1.366 -0.889 15.158
212 1HD2 LEU 179 HD21 LEU 179 1.986 -1.689 12.665
213 2HD2 LEU 179 HD22 LEU 179 3.642 -1.327 12.179
214 3HD2 LEU 179 HD23 LEU 179 2.559 -0.021 12.659
215 H ARG 180 HN ARG 180 7.340 0.042 13.807
216 HA ARG 180 HA ARG 180 8.350 1.564 16.067
217 1HB ARG 180 HB2 ARG 180 9.634 -0.434 14.200
218 2HB ARG 180 HB1 ARG 180 10.522 0.416 15.472
219 1HG ARG 180 HG2 ARG 180 8.228 -1.504 15.820
220 2HG ARG 180 HG1 ARG 180 9.916 -1.755 16.272
221 1HD ARG 180 HD2 ARG 180 9.102 -1.143 18.304
222 2HD ARG 180 HD1 ARG 180 9.468 0.459 17.667
223 HE ARG 180 HE ARG 180 6.796 -0.446 17.097
224 1HH1 ARG 180 1HH1 ARG 180 8.842 1.195 19.400
225 2HH1 ARG 180 2HH1 ARG 180 7.534 2.060 20.133
226 1HH2 ARG 180 1HH2 ARG 180 5.073 0.691 18.063
227 2HH2 ARG 180 2HH2 ARG 180 5.395 1.775 19.376
228 1HG HSL 181 HG1 HSL 181 6.912 5.769 10.510
229 2HG HSL 181 HG2 HSL 181 6.062 4.566 11.612
230 H HSL 181 HN HSL 181 7.315 2.922 13.686
231 HA HSL 181 HA HSL 181 9.851 4.397 12.795
232 1HB HSL 181 HB1 HSL 181 9.012 4.679 10.649
233 2HB HSL 181 HB2 HSL 181 7.972 3.208 11.045
Start of MODEL 62
1 1H PHE 155 HT1 PHE 155 17.724 3.866 -0.354
2 2H PHE 155 HT2 PHE 155 19.086 4.909 -0.403
3 3H PHE 155 HT3 PHE 155 19.302 3.207 -0.456
4 HA PHE 155 HA PHE 155 19.603 4.160 -2.601
5 1HB PHE 155 HB2 PHE 155 17.904 2.753 -3.767
6 2HB PHE 155 HB1 PHE 155 18.711 1.914 -2.445
7 HD1 PHE 155 HD1 PHE 155 15.584 3.573 -3.473
8 HD2 PHE 155 HD2 PHE 155 17.503 1.116 -0.575
9 HE1 PHE 155 HE1 PHE 155 13.396 3.035 -2.486
10 HE2 PHE 155 HE2 PHE 155 15.317 0.573 0.417
11 HZ PHE 155 HZ PHE 155 13.260 1.533 -0.539
12 H LEU 156 HN LEU 156 18.027 4.681 -4.587
13 HA LEU 156 HA LEU 156 15.860 6.438 -4.022
14 1HB LEU 156 HB2 LEU 156 18.562 7.558 -4.640
15 2HB LEU 156 HB1 LEU 156 17.133 8.384 -5.225
16 HG LEU 156 HG LEU 156 16.532 7.998 -2.580
17 1HD1 LEU 156 HD11 LEU 156 19.132 7.348 -2.583
18 2HD1 LEU 156 HD12 LEU 156 18.333 8.143 -1.226
19 3HD1 LEU 156 HD13 LEU 156 19.262 9.096 -2.383
20 1HD2 LEU 156 HD21 LEU 156 17.676 10.290 -4.124
21 2HD2 LEU 156 HD22 LEU 156 17.316 10.451 -2.405
22 3HD2 LEU 156 HD23 LEU 156 16.029 10.048 -3.541
23 H GLN 157 HN GLN 157 14.621 6.838 -5.816
24 HA GLN 157 HA GLN 157 15.561 6.631 -8.479
25 1HB GLN 157 HB2 GLN 157 15.667 4.243 -7.909
26 2HB GLN 157 HB1 GLN 157 13.970 4.276 -7.449
27 1HG GLN 157 HG2 GLN 157 13.280 4.073 -9.555
28 2HG GLN 157 HG1 GLN 157 14.434 5.269 -10.143
29 1HE2 GLN 157 HE21 GLN 157 16.298 4.609 -11.074
30 2HE2 GLN 157 HE22 GLN 157 16.720 2.954 -11.330
31 H SER 158 HN SER 158 14.379 8.654 -8.291
32 HA SER 158 HA SER 158 12.573 10.005 -8.600
33 1HB SER 158 HB2 SER 158 11.781 7.508 -10.086
34 2HB SER 158 HB1 SER 158 10.716 8.922 -10.037
35 HG SER 158 HG SER 158 13.004 8.512 -11.463
36 H ASP 159 HN ASP 159 12.360 9.717 -6.179
37 HA ASP 159 HA ASP 159 10.930 9.739 -4.401
38 1HB ASP 159 HB2 ASP 159 9.175 9.771 -6.640
39 2HB ASP 159 HB1 ASP 159 8.518 8.630 -5.472
40 H VAL 160 HN VAL 160 10.032 6.974 -6.457
41 HA VAL 160 HA VAL 160 10.428 4.733 -6.124
42 HB VAL 160 HB VAL 160 12.080 5.664 -4.174
43 1HG1 VAL 160 HG11 VAL 160 10.243 5.649 -2.501
44 2HG1 VAL 160 HG12 VAL 160 11.589 4.593 -2.075
45 3HG1 VAL 160 HG13 VAL 160 10.102 3.906 -2.728
46 1HG2 VAL 160 HG21 VAL 160 11.879 3.444 -5.670
47 2HG2 VAL 160 HG22 VAL 160 11.581 2.761 -4.072
48 3HG2 VAL 160 HG23 VAL 160 13.070 3.651 -4.387
49 H PHE 161 HN PHE 161 8.770 6.456 -3.493
50 HA PHE 161 HA PHE 161 6.973 4.328 -2.911
51 1HB PHE 161 HB2 PHE 161 6.483 7.251 -2.347
52 2HB PHE 161 HB1 PHE 161 5.870 5.860 -1.459
53 HD1 PHE 161 HD1 PHE 161 8.200 4.233 -0.998
54 HD2 PHE 161 HD2 PHE 161 7.817 8.470 -0.929
55 HE1 PHE 161 HE1 PHE 161 10.112 4.377 0.544
56 HE2 PHE 161 HE2 PHE 161 9.727 8.623 0.612
57 HZ PHE 161 HZ PHE 161 10.879 6.575 1.350
58 H PHE 162 HN PHE 162 6.907 7.069 -5.068
59 HA PHE 162 HA PHE 162 4.158 6.981 -5.743
60 1HB PHE 162 HB2 PHE 162 6.341 8.596 -6.277
61 2HB PHE 162 HB1 PHE 162 5.887 7.948 -7.851
62 HD1 PHE 162 HD1 PHE 162 3.098 7.863 -7.979
63 HD2 PHE 162 HD2 PHE 162 5.515 10.705 -5.931
64 HE1 PHE 162 HE1 PHE 162 1.282 9.515 -8.136
65 HE2 PHE 162 HE2 PHE 162 3.703 12.362 -6.084
66 HZ PHE 162 HZ PHE 162 1.583 11.768 -7.189
67 H LEU 163 HN LEU 163 7.012 5.992 -7.605
68 HA LEU 163 HA LEU 163 5.569 4.593 -9.603
69 1HB LEU 163 HB2 LEU 163 8.419 4.682 -8.704
70 2HB LEU 163 HB1 LEU 163 7.917 3.513 -9.909
71 HG LEU 163 HG LEU 163 7.468 6.473 -10.242
72 1HD1 LEU 163 HD11 LEU 163 9.865 4.800 -10.888
73 2HD1 LEU 163 HD12 LEU 163 9.786 6.392 -10.132
74 3HD1 LEU 163 HD13 LEU 163 9.458 6.216 -11.857
75 1HD2 LEU 163 HD21 LEU 163 7.510 4.174 -12.193
76 2HD2 LEU 163 HD22 LEU 163 7.276 5.872 -12.609
77 3HD2 LEU 163 HD23 LEU 163 6.078 5.033 -11.623
78 H PHE 164 HN PHE 164 5.980 3.954 -6.428
79 HA PHE 164 HA PHE 164 6.435 1.145 -6.434
80 1HB PHE 164 HB2 PHE 164 6.427 3.255 -4.586
81 2HB PHE 164 HB1 PHE 164 5.156 2.160 -4.050
82 HD1 PHE 164 HD1 PHE 164 5.863 0.788 -2.361
83 HD2 PHE 164 HD2 PHE 164 8.551 1.680 -5.538
84 HE1 PHE 164 HE1 PHE 164 7.548 -0.692 -1.347
85 HE2 PHE 164 HE2 PHE 164 10.239 0.204 -4.528
86 HZ PHE 164 HZ PHE 164 9.739 -0.985 -2.430
87 H LEU 165 HN LEU 165 3.929 2.589 -7.745
88 HA LEU 165 HA LEU 165 1.950 1.630 -8.444
89 1HB LEU 165 HB2 LEU 165 2.922 -0.492 -7.088
90 2HB LEU 165 HB1 LEU 165 1.555 -0.069 -6.063
91 HG LEU 165 HG LEU 165 0.981 -1.791 -7.723
92 1HD1 LEU 165 HD11 LEU 165 -0.635 0.002 -6.880
93 2HD1 LEU 165 HD12 LEU 165 -1.094 -0.897 -8.327
94 3HD1 LEU 165 HD13 LEU 165 -0.449 0.738 -8.472
95 1HD2 LEU 165 HD21 LEU 165 2.592 -0.483 -9.435
96 2HD2 LEU 165 HD22 LEU 165 1.024 0.130 -9.961
97 3HD2 LEU 165 HD23 LEU 165 1.332 -1.607 -9.946
98 H LEU 166 HN LEU 166 2.565 2.719 -5.200
99 HA LEU 166 HA LEU 166 0.138 4.246 -5.246
100 1HB LEU 166 HB2 LEU 166 0.108 1.649 -4.131
101 2HB LEU 166 HB1 LEU 166 0.017 2.782 -2.788
102 HG LEU 166 HG LEU 166 -1.797 3.425 -5.006
103 1HD1 LEU 166 HD11 LEU 166 -2.036 1.081 -5.252
104 2HD1 LEU 166 HD12 LEU 166 -3.415 1.635 -4.302
105 3HD1 LEU 166 HD13 LEU 166 -2.062 0.831 -3.506
106 1HD2 LEU 166 HD21 LEU 166 -2.040 4.648 -3.011
107 2HD2 LEU 166 HD22 LEU 166 -1.983 3.192 -2.016
108 3HD2 LEU 166 HD23 LEU 166 -3.390 3.514 -3.031
109 HA PRO 167 HA PRO 167 2.816 7.020 -3.056
110 1HB PRO 167 HB2 PRO 167 0.640 8.277 -1.728
111 2HB PRO 167 HB1 PRO 167 1.520 8.848 -3.154
112 1HG PRO 167 HG2 PRO 167 -1.091 7.516 -2.972
113 2HG PRO 167 HG1 PRO 167 -0.420 8.508 -4.272
114 1HD PRO 167 HD2 PRO 167 -0.749 5.803 -4.436
115 2HD PRO 167 HD1 PRO 167 0.473 6.706 -5.351
116 HA PRO 168 HA PRO 168 1.534 5.835 1.338
117 1HB PRO 168 HB2 PRO 168 -0.668 4.497 1.865
118 2HB PRO 168 HB1 PRO 168 -0.758 6.192 1.341
119 1HG PRO 168 HG2 PRO 168 -1.181 3.700 -0.272
120 2HG PRO 168 HG1 PRO 168 -2.172 5.170 -0.213
121 1HD PRO 168 HD2 PRO 168 -0.252 4.662 -2.124
122 2HD PRO 168 HD1 PRO 168 -0.812 6.281 -1.670
123 H ILE 169 HN ILE 169 3.419 4.507 0.584
124 HA ILE 169 HA ILE 169 3.050 1.684 0.291
125 HB ILE 169 HB ILE 169 5.005 2.496 -0.732
126 1HG1 ILE 169 HG12 ILE 169 5.855 1.214 1.875
127 2HG1 ILE 169 HG11 ILE 169 5.411 0.377 0.393
128 1HG2 ILE 169 HG21 ILE 169 5.915 4.402 -0.088
129 2HG2 ILE 169 HG22 ILE 169 6.663 3.559 1.268
130 3HG2 ILE 169 HG23 ILE 169 5.085 4.321 1.467
131 1HD1 ILE 169 HD11 ILE 169 7.364 1.715 -0.648
132 2HD1 ILE 169 HD12 ILE 169 7.711 0.305 0.355
133 3HD1 ILE 169 HD13 ILE 169 7.878 1.927 1.025
134 H ILE 170 HN ILE 170 5.257 2.938 2.731
135 HA ILE 170 HA ILE 170 5.675 1.991 4.816
136 HB ILE 170 HB ILE 170 3.053 3.438 5.171
137 1HG1 ILE 170 HG12 ILE 170 5.730 4.723 5.533
138 2HG1 ILE 170 HG11 ILE 170 5.079 4.552 3.906
139 1HG2 ILE 170 HG21 ILE 170 4.472 2.049 7.050
140 2HG2 ILE 170 HG22 ILE 170 3.373 3.384 7.385
141 3HG2 ILE 170 HG23 ILE 170 5.104 3.683 7.237
142 1HD1 ILE 170 HD11 ILE 170 3.223 5.911 4.402
143 2HD1 ILE 170 HD12 ILE 170 4.628 6.737 5.076
144 3HD1 ILE 170 HD13 ILE 170 3.539 5.840 6.136
145 H LEU 171 HN LEU 171 2.180 1.775 4.369
146 HA LEU 171 HA LEU 171 1.860 -0.426 6.135
147 1HB LEU 171 HB2 LEU 171 -0.042 0.285 3.916
148 2HB LEU 171 HB1 LEU 171 -0.409 -0.469 5.455
149 HG LEU 171 HG LEU 171 0.391 2.404 5.001
150 1HD1 LEU 171 HD11 LEU 171 -1.849 2.292 4.469
151 2HD1 LEU 171 HD12 LEU 171 -1.905 2.649 6.196
152 3HD1 LEU 171 HD13 LEU 171 -2.169 1.000 5.627
153 1HD2 LEU 171 HD21 LEU 171 -0.521 1.902 7.651
154 2HD2 LEU 171 HD22 LEU 171 1.037 2.532 7.120
155 3HD2 LEU 171 HD23 LEU 171 0.803 0.793 7.295
156 H ASP 172 HN ASP 172 2.068 -0.215 2.604
157 HA ASP 172 HA ASP 172 1.702 -3.020 2.208
158 1HB ASP 172 HB2 ASP 172 1.481 -0.859 0.579
159 2HB ASP 172 HB1 ASP 172 3.067 -1.474 0.088
160 H ALA 173 HN ALA 173 4.360 -1.104 3.151
161 HA ALA 173 HA ALA 173 6.398 -2.758 2.013
162 1HB ALA 173 HB1 ALA 173 7.805 -1.478 3.818
163 2HB ALA 173 HB2 ALA 173 6.358 -0.476 3.934
164 3HB ALA 173 HB3 ALA 173 7.199 -0.635 2.391
165 H GLY 174 HN GLY 174 6.405 -2.064 5.471
166 1HA GLY 174 HA2 GLY 174 6.584 -4.970 5.942
167 2HA GLY 174 HA1 GLY 174 7.269 -3.717 6.994
168 H TYR 175 HN TYR 175 4.508 -2.338 6.283
169 HA TYR 175 HA TYR 175 2.471 -2.081 7.238
170 1HB TYR 175 HB2 TYR 175 2.014 -4.386 6.566
171 2HB TYR 175 HB1 TYR 175 2.813 -4.989 8.014
172 HD1 TYR 175 HD1 TYR 175 1.451 -5.646 9.750
173 HD2 TYR 175 HD2 TYR 175 0.076 -2.597 7.120
174 HE1 TYR 175 HE1 TYR 175 -0.686 -5.571 10.964
175 HE2 TYR 175 HE2 TYR 175 -2.064 -2.513 8.327
176 HH TYR 175 HH TYR 175 -2.533 -3.909 11.337
177 H PHE 176 HN PHE 176 4.322 -4.211 9.408
178 HA PHE 176 HA PHE 176 3.781 -2.321 11.594
179 1HB PHE 176 HB2 PHE 176 2.954 -4.620 11.954
180 2HB PHE 176 HB1 PHE 176 4.600 -5.234 11.748
181 HD1 PHE 176 HD1 PHE 176 5.291 -6.060 13.780
182 HD2 PHE 176 HD2 PHE 176 3.275 -2.314 13.653
183 HE1 PHE 176 HE1 PHE 176 5.701 -5.761 16.188
184 HE2 PHE 176 HE2 PHE 176 3.681 -2.009 16.059
185 HZ PHE 176 HZ PHE 176 4.897 -3.733 17.331
186 H LEU 177 HN LEU 177 6.051 -2.636 9.409
187 HA LEU 177 HA LEU 177 8.361 -2.752 11.168
188 1HB LEU 177 HB2 LEU 177 8.178 -2.466 8.175
189 2HB LEU 177 HB1 LEU 177 9.677 -2.546 9.074
190 HG LEU 177 HG LEU 177 7.607 -4.728 8.838
191 1HD1 LEU 177 HD11 LEU 177 9.170 -5.888 7.529
192 2HD1 LEU 177 HD12 LEU 177 10.479 -4.789 7.965
193 3HD1 LEU 177 HD13 LEU 177 9.184 -4.240 6.901
194 1HD2 LEU 177 HD21 LEU 177 9.608 -5.980 10.010
195 2HD2 LEU 177 HD22 LEU 177 8.379 -5.136 10.951
196 3HD2 LEU 177 HD23 LEU 177 9.938 -4.370 10.650
197 HA PRO 178 HA PRO 178 8.748 1.751 9.542
198 1HB PRO 178 HB2 PRO 178 6.223 2.481 8.304
199 2HB PRO 178 HB1 PRO 178 7.842 2.488 7.603
200 1HG PRO 178 HG2 PRO 178 5.906 0.748 6.830
201 2HG PRO 178 HG1 PRO 178 7.634 0.356 6.776
202 1HD PRO 178 HD2 PRO 178 5.584 -0.398 8.833
203 2HD PRO 178 HD1 PRO 178 6.857 -1.393 8.097
204 H LEU 179 HN LEU 179 5.200 1.659 9.809
205 HA LEU 179 HA LEU 179 3.763 2.431 11.392
206 1HB LEU 179 HB2 LEU 179 5.834 1.363 12.863
207 2HB LEU 179 HB1 LEU 179 5.725 2.996 13.490
208 HG LEU 179 HG LEU 179 3.210 2.517 13.772
209 1HD1 LEU 179 HD11 LEU 179 2.402 0.414 13.591
210 2HD1 LEU 179 HD12 LEU 179 3.931 -0.333 14.054
211 3HD1 LEU 179 HD13 LEU 179 3.705 0.268 12.412
212 1HD2 LEU 179 HD21 LEU 179 3.918 0.973 15.849
213 2HD2 LEU 179 HD22 LEU 179 4.189 2.715 15.800
214 3HD2 LEU 179 HD23 LEU 179 5.501 1.607 15.398
215 H ARG 180 HN ARG 180 4.079 4.239 9.703
216 HA ARG 180 HA ARG 180 4.068 6.467 9.251
217 1HB ARG 180 HB2 ARG 180 3.905 6.557 12.265
218 2HB ARG 180 HB1 ARG 180 3.845 8.013 11.264
219 1HG ARG 180 HG2 ARG 180 1.904 5.708 11.198
220 2HG ARG 180 HG1 ARG 180 1.614 7.314 11.867
221 1HD ARG 180 HD2 ARG 180 0.902 7.981 9.873
222 2HD ARG 180 HD1 ARG 180 2.514 7.691 9.225
223 HE ARG 180 HE ARG 180 1.748 5.758 8.248
224 1HH1 ARG 180 1HH1 ARG 180 -0.628 6.913 10.531
225 2HH1 ARG 180 2HH1 ARG 180 -1.847 5.796 10.017
226 1HH2 ARG 180 1HH2 ARG 180 0.145 4.289 7.572
227 2HH2 ARG 180 2HH2 ARG 180 -1.408 4.307 8.337
228 1HG HSL 181 HG1 HSL 181 11.090 6.276 9.432
229 2HG HSL 181 HG2 HSL 181 10.905 4.670 8.550
230 H HSL 181 HN HSL 181 6.457 5.263 8.979
231 HA HSL 181 HA HSL 181 8.462 7.301 10.084
232 1HB HSL 181 HB1 HSL 181 9.453 5.303 10.891
233 2HB HSL 181 HB2 HSL 181 8.727 4.284 9.533
Start of MODEL 63
1 1H PHE 155 HT1 PHE 155 -0.934 9.230 7.710
2 2H PHE 155 HT2 PHE 155 -2.647 9.159 7.780
3 3H PHE 155 HT3 PHE 155 -1.866 10.590 7.243
4 HA PHE 155 HA PHE 155 -1.215 9.659 5.278
5 1HB PHE 155 HB2 PHE 155 -1.774 7.091 5.007
6 2HB PHE 155 HB1 PHE 155 -0.273 7.612 5.762
7 HD1 PHE 155 HD1 PHE 155 0.328 6.304 7.535
8 HD2 PHE 155 HD2 PHE 155 -3.797 7.137 6.912
9 HE1 PHE 155 HE1 PHE 155 -0.234 5.005 9.547
10 HE2 PHE 155 HE2 PHE 155 -4.368 5.842 8.923
11 HZ PHE 155 HZ PHE 155 -2.585 4.772 10.244
12 H LEU 156 HN LEU 156 -2.523 9.130 3.455
13 HA LEU 156 HA LEU 156 -4.419 9.348 2.233
14 1HB LEU 156 HB2 LEU 156 -6.018 7.749 2.607
15 2HB LEU 156 HB1 LEU 156 -4.670 7.101 3.516
16 HG LEU 156 HG LEU 156 -6.157 8.710 5.295
17 1HD1 LEU 156 HD11 LEU 156 -8.152 8.674 4.165
18 2HD1 LEU 156 HD12 LEU 156 -8.285 7.203 5.131
19 3HD1 LEU 156 HD13 LEU 156 -7.829 7.104 3.430
20 1HD2 LEU 156 HD21 LEU 156 -4.827 6.376 5.373
21 2HD2 LEU 156 HD22 LEU 156 -6.490 5.787 5.385
22 3HD2 LEU 156 HD23 LEU 156 -5.942 6.908 6.631
23 H GLN 157 HN GLN 157 -6.961 9.865 2.554
24 HA GLN 157 HA GLN 157 -7.640 11.630 4.662
25 1HB GLN 157 HB2 GLN 157 -6.486 12.786 2.176
26 2HB GLN 157 HB1 GLN 157 -7.861 13.609 2.895
27 1HG GLN 157 HG2 GLN 157 -6.145 13.098 5.023
28 2HG GLN 157 HG1 GLN 157 -5.094 13.595 3.698
29 1HE2 GLN 157 HE21 GLN 157 -4.590 15.518 4.784
30 2HE2 GLN 157 HE22 GLN 157 -5.707 16.834 4.865
31 H SER 158 HN SER 158 -8.232 11.322 1.152
32 HA SER 158 HA SER 158 -10.825 10.230 1.577
33 1HB SER 158 HB2 SER 158 -11.450 12.509 2.069
34 2HB SER 158 HB1 SER 158 -10.629 13.090 0.610
35 HG SER 158 HG SER 158 -12.343 12.614 -0.495
36 H ASP 159 HN ASP 159 -8.394 9.677 0.119
37 HA ASP 159 HA ASP 159 -9.568 8.813 -2.324
38 1HB ASP 159 HB2 ASP 159 -7.841 11.233 -2.315
39 2HB ASP 159 HB1 ASP 159 -7.557 10.052 -3.590
40 H VAL 160 HN VAL 160 -6.448 9.646 -0.882
41 HA VAL 160 HA VAL 160 -4.593 8.436 -0.418
42 HB VAL 160 HB VAL 160 -6.656 6.713 0.191
43 1HG1 VAL 160 HG11 VAL 160 -4.702 5.211 -1.548
44 2HG1 VAL 160 HG12 VAL 160 -6.429 5.417 -1.836
45 3HG1 VAL 160 HG13 VAL 160 -5.873 4.468 -0.461
46 1HG2 VAL 160 HG21 VAL 160 -3.888 5.772 0.670
47 2HG2 VAL 160 HG22 VAL 160 -5.237 5.956 1.792
48 3HG2 VAL 160 HG23 VAL 160 -4.327 7.373 1.267
49 H PHE 161 HN PHE 161 -6.336 6.836 -3.089
50 HA PHE 161 HA PHE 161 -3.938 6.067 -4.419
51 1HB PHE 161 HB2 PHE 161 -6.547 5.253 -4.546
52 2HB PHE 161 HB1 PHE 161 -6.381 6.166 -6.042
53 HD1 PHE 161 HD1 PHE 161 -3.954 4.012 -4.219
54 HD2 PHE 161 HD2 PHE 161 -6.239 4.628 -7.754
55 HE1 PHE 161 HE1 PHE 161 -2.845 2.081 -5.265
56 HE2 PHE 161 HE2 PHE 161 -5.135 2.697 -8.808
57 HZ PHE 161 HZ PHE 161 -3.436 1.421 -7.563
58 H PHE 162 HN PHE 162 -5.122 9.083 -4.033
59 HA PHE 162 HA PHE 162 -3.606 10.103 -6.191
60 1HB PHE 162 HB2 PHE 162 -5.109 10.197 -7.819
61 2HB PHE 162 HB1 PHE 162 -6.333 9.492 -6.762
62 HD1 PHE 162 HD1 PHE 162 -5.442 12.286 -8.701
63 HD2 PHE 162 HD2 PHE 162 -7.517 11.182 -5.158
64 HE1 PHE 162 HE1 PHE 162 -6.701 14.398 -8.786
65 HE2 PHE 162 HE2 PHE 162 -8.782 13.290 -5.234
66 HZ PHE 162 HZ PHE 162 -8.374 14.903 -7.051
67 H LEU 163 HN LEU 163 -4.571 10.394 -3.185
68 HA LEU 163 HA LEU 163 -5.318 13.112 -2.926
69 1HB LEU 163 HB2 LEU 163 -5.532 11.387 -1.128
70 2HB LEU 163 HB1 LEU 163 -3.786 11.392 -0.965
71 HG LEU 163 HG LEU 163 -4.107 13.947 -0.514
72 1HD1 LEU 163 HD11 LEU 163 -6.470 14.036 -1.075
73 2HD1 LEU 163 HD12 LEU 163 -6.221 14.441 0.623
74 3HD1 LEU 163 HD13 LEU 163 -6.828 12.847 0.175
75 1HD2 LEU 163 HD21 LEU 163 -4.875 11.838 1.501
76 2HD2 LEU 163 HD22 LEU 163 -4.333 13.474 1.875
77 3HD2 LEU 163 HD23 LEU 163 -3.233 12.338 1.095
78 H PHE 164 HN PHE 164 -2.334 11.369 -3.259
79 HA PHE 164 HA PHE 164 -0.190 11.977 -3.646
80 1HB PHE 164 HB2 PHE 164 -1.563 13.209 -5.466
81 2HB PHE 164 HB1 PHE 164 -1.173 14.664 -4.546
82 HD1 PHE 164 HD1 PHE 164 1.145 15.427 -4.352
83 HD2 PHE 164 HD2 PHE 164 0.100 12.063 -6.738
84 HE1 PHE 164 HE1 PHE 164 3.326 15.556 -5.483
85 HE2 PHE 164 HE2 PHE 164 2.279 12.186 -7.874
86 HZ PHE 164 HZ PHE 164 3.897 13.934 -7.246
87 H LEU 165 HN LEU 165 -1.788 13.203 -1.140
88 HA LEU 165 HA LEU 165 -0.178 15.429 -0.388
89 1HB LEU 165 HB2 LEU 165 -2.476 14.185 0.579
90 2HB LEU 165 HB1 LEU 165 -1.292 13.989 1.858
91 HG LEU 165 HG LEU 165 -2.596 15.993 2.236
92 1HD1 LEU 165 HD11 LEU 165 -0.543 17.677 1.829
93 2HD1 LEU 165 HD12 LEU 165 0.290 16.133 1.656
94 3HD1 LEU 165 HD13 LEU 165 -0.592 16.496 3.138
95 1HD2 LEU 165 HD21 LEU 165 -1.872 16.555 -0.601
96 2HD2 LEU 165 HD22 LEU 165 -2.126 17.903 0.508
97 3HD2 LEU 165 HD23 LEU 165 -3.419 16.739 0.225
98 H LEU 166 HN LEU 166 -0.142 11.985 0.349
99 HA LEU 166 HA LEU 166 2.680 12.039 0.872
100 1HB LEU 166 HB2 LEU 166 1.020 12.554 3.023
101 2HB LEU 166 HB1 LEU 166 1.337 10.834 3.166
102 HG LEU 166 HG LEU 166 3.845 11.592 2.847
103 1HD1 LEU 166 HD11 LEU 166 2.383 14.093 3.408
104 2HD1 LEU 166 HD12 LEU 166 3.916 13.832 2.574
105 3HD1 LEU 166 HD13 LEU 166 3.857 13.823 4.338
106 1HD2 LEU 166 HD21 LEU 166 2.364 11.999 5.442
107 2HD2 LEU 166 HD22 LEU 166 4.081 11.647 5.252
108 3HD2 LEU 166 HD23 LEU 166 2.879 10.440 4.801
109 HA PRO 167 HA PRO 167 2.017 8.045 -0.988
110 1HB PRO 167 HB2 PRO 167 4.438 6.943 -0.209
111 2HB PRO 167 HB1 PRO 167 4.178 7.919 -1.666
112 1HG PRO 167 HG2 PRO 167 5.268 8.731 0.996
113 2HG PRO 167 HG1 PRO 167 5.774 9.237 -0.628
114 1HD PRO 167 HD2 PRO 167 4.280 10.826 0.931
115 2HD PRO 167 HD1 PRO 167 4.038 10.762 -0.828
116 HA PRO 168 HA PRO 168 0.780 5.914 2.788
117 1HB PRO 168 HB2 PRO 168 -1.214 4.497 1.745
118 2HB PRO 168 HB1 PRO 168 -1.351 6.259 1.921
119 1HG PRO 168 HG2 PRO 168 -0.718 4.639 -0.518
120 2HG PRO 168 HG1 PRO 168 -1.781 6.048 -0.357
121 1HD PRO 168 HD2 PRO 168 0.828 6.128 -1.275
122 2HD PRO 168 HD1 PRO 168 -0.054 7.513 -0.603
123 H ILE 169 HN ILE 169 3.004 4.927 0.958
124 HA ILE 169 HA ILE 169 2.563 2.114 0.690
125 HB ILE 169 HB ILE 169 5.103 2.098 0.288
126 1HG1 ILE 169 HG12 ILE 169 4.799 5.027 -0.203
127 2HG1 ILE 169 HG11 ILE 169 5.147 4.481 1.434
128 1HG2 ILE 169 HG21 ILE 169 3.145 2.205 -1.401
129 2HG2 ILE 169 HG22 ILE 169 4.779 2.566 -1.958
130 3HG2 ILE 169 HG23 ILE 169 3.651 3.880 -1.626
131 1HD1 ILE 169 HD11 ILE 169 7.275 4.712 0.751
132 2HD1 ILE 169 HD12 ILE 169 6.861 4.535 -0.954
133 3HD1 ILE 169 HD13 ILE 169 7.013 3.107 0.070
134 H ILE 170 HN ILE 170 5.622 2.646 2.017
135 HA ILE 170 HA ILE 170 6.621 1.590 3.790
136 HB ILE 170 HB ILE 170 4.757 3.454 5.246
137 1HG1 ILE 170 HG12 ILE 170 7.126 4.805 4.871
138 2HG1 ILE 170 HG11 ILE 170 6.924 3.967 3.336
139 1HG2 ILE 170 HG21 ILE 170 6.539 1.716 6.307
140 2HG2 ILE 170 HG22 ILE 170 6.095 3.253 7.049
141 3HG2 ILE 170 HG23 ILE 170 7.562 3.135 6.079
142 1HD1 ILE 170 HD11 ILE 170 5.115 5.980 4.617
143 2HD1 ILE 170 HD12 ILE 170 4.570 4.927 3.312
144 3HD1 ILE 170 HD13 ILE 170 5.906 6.047 3.043
145 H LEU 171 HN LEU 171 3.255 2.025 4.775
146 HA LEU 171 HA LEU 171 3.238 -0.133 6.598
147 1HB LEU 171 HB2 LEU 171 0.611 0.383 5.473
148 2HB LEU 171 HB1 LEU 171 1.174 0.555 7.120
149 HG LEU 171 HG LEU 171 1.509 2.633 4.951
150 1HD1 LEU 171 HD11 LEU 171 -0.205 3.094 7.311
151 2HD1 LEU 171 HD12 LEU 171 -0.829 2.001 6.075
152 3HD1 LEU 171 HD13 LEU 171 -0.382 3.653 5.647
153 1HD2 LEU 171 HD21 LEU 171 2.215 2.585 7.874
154 2HD2 LEU 171 HD22 LEU 171 2.037 4.081 6.958
155 3HD2 LEU 171 HD23 LEU 171 3.273 2.910 6.502
156 H ASP 172 HN ASP 172 2.169 0.105 3.231
157 HA ASP 172 HA ASP 172 1.247 -2.585 3.089
158 1HB ASP 172 HB2 ASP 172 1.145 -2.192 0.651
159 2HB ASP 172 HB1 ASP 172 0.376 -0.886 1.565
160 H ALA 173 HN ALA 173 4.333 -1.260 3.210
161 HA ALA 173 HA ALA 173 5.631 -3.130 1.470
162 1HB ALA 173 HB1 ALA 173 7.641 -2.092 2.061
163 2HB ALA 173 HB2 ALA 173 7.008 -1.548 3.615
164 3HB ALA 173 HB3 ALA 173 6.452 -0.792 2.121
165 H GLY 174 HN GLY 174 5.857 -2.617 4.998
166 1HA GLY 174 HA2 GLY 174 6.351 -5.523 5.266
167 2HA GLY 174 HA1 GLY 174 7.042 -4.294 6.341
168 H TYR 175 HN TYR 175 4.340 -2.877 6.218
169 HA TYR 175 HA TYR 175 2.328 -2.866 7.297
170 1HB TYR 175 HB2 TYR 175 2.417 -5.416 6.495
171 2HB TYR 175 HB1 TYR 175 2.527 -5.681 8.231
172 HD1 TYR 175 HD1 TYR 175 0.282 -6.743 6.678
173 HD2 TYR 175 HD2 TYR 175 0.754 -2.928 8.503
174 HE1 TYR 175 HE1 TYR 175 -2.161 -6.530 6.853
175 HE2 TYR 175 HE2 TYR 175 -1.687 -2.705 8.682
176 HH TYR 175 HH TYR 175 -3.696 -3.580 7.673
177 H PHE 176 HN PHE 176 5.276 -3.704 8.696
178 HA PHE 176 HA PHE 176 4.299 -2.839 11.318
179 1HB PHE 176 HB2 PHE 176 5.193 -5.460 10.720
180 2HB PHE 176 HB1 PHE 176 6.468 -4.691 11.677
181 HD1 PHE 176 HD1 PHE 176 4.960 -2.975 13.482
182 HD2 PHE 176 HD2 PHE 176 4.117 -6.924 12.139
183 HE1 PHE 176 HE1 PHE 176 3.671 -3.393 15.534
184 HE2 PHE 176 HE2 PHE 176 2.824 -7.349 14.188
185 HZ PHE 176 HZ PHE 176 2.600 -5.583 15.889
186 H LEU 177 HN LEU 177 6.129 -2.013 8.839
187 HA LEU 177 HA LEU 177 8.581 -1.324 10.198
188 1HB LEU 177 HB2 LEU 177 7.574 -0.656 7.434
189 2HB LEU 177 HB1 LEU 177 9.164 -0.237 8.041
190 HG LEU 177 HG LEU 177 8.119 -3.046 7.681
191 1HD1 LEU 177 HD11 LEU 177 9.261 -3.186 5.706
192 2HD1 LEU 177 HD12 LEU 177 10.395 -1.907 6.141
193 3HD1 LEU 177 HD13 LEU 177 8.750 -1.498 5.651
194 1HD2 LEU 177 HD21 LEU 177 10.758 -3.336 7.930
195 2HD2 LEU 177 HD22 LEU 177 9.660 -3.393 9.308
196 3HD2 LEU 177 HD23 LEU 177 10.542 -1.909 8.944
197 HA PRO 178 HA PRO 178 6.439 3.088 9.364
198 1HB PRO 178 HB2 PRO 178 3.719 2.184 10.161
199 2HB PRO 178 HB1 PRO 178 4.200 3.382 8.955
200 1HG PRO 178 HG2 PRO 178 3.327 0.967 8.228
201 2HG PRO 178 HG1 PRO 178 4.629 1.781 7.342
202 1HD PRO 178 HD2 PRO 178 4.774 -0.482 9.275
203 2HD PRO 178 HD1 PRO 178 5.754 -0.162 7.831
204 H LEU 179 HN LEU 179 4.857 4.307 11.107
205 HA LEU 179 HA LEU 179 4.410 4.832 13.283
206 1HB LEU 179 HB2 LEU 179 5.836 2.351 14.203
207 2HB LEU 179 HB1 LEU 179 4.622 3.284 15.056
208 HG LEU 179 HG LEU 179 3.707 2.125 12.509
209 1HD1 LEU 179 HD11 LEU 179 3.359 -0.109 13.687
210 2HD1 LEU 179 HD12 LEU 179 4.635 0.408 14.790
211 3HD1 LEU 179 HD13 LEU 179 4.974 0.237 13.067
212 1HD2 LEU 179 HD21 LEU 179 2.173 3.264 13.971
213 2HD2 LEU 179 HD22 LEU 179 2.628 2.226 15.322
214 3HD2 LEU 179 HD23 LEU 179 1.769 1.548 13.940
215 H ARG 180 HN ARG 180 7.407 4.297 11.914
216 HA ARG 180 HA ARG 180 8.644 6.235 13.680
217 1HB ARG 180 HB2 ARG 180 9.634 3.413 13.321
218 2HB ARG 180 HB1 ARG 180 10.758 4.729 13.682
219 1HG ARG 180 HG2 ARG 180 9.979 4.992 15.812
220 2HG ARG 180 HG1 ARG 180 8.365 4.402 15.414
221 1HD ARG 180 HD2 ARG 180 10.510 2.424 15.105
222 2HD ARG 180 HD1 ARG 180 10.251 2.978 16.758
223 HE ARG 180 HE ARG 180 7.836 2.232 15.380
224 1HH1 ARG 180 1HH1 ARG 180 10.497 1.090 17.329
225 2HH1 ARG 180 2HH1 ARG 180 9.632 -0.287 17.923
226 1HH2 ARG 180 1HH2 ARG 180 6.699 0.422 16.162
227 2HH2 ARG 180 2HH2 ARG 180 7.477 -0.667 17.261
228 1HG HSL 181 HG1 HSL 181 9.162 6.897 6.588
229 2HG HSL 181 HG2 HSL 181 7.339 6.647 6.562
230 H HSL 181 HN HSL 181 7.570 6.076 10.990
231 HA HSL 181 HA HSL 181 10.093 6.634 9.345
232 1HB HSL 181 HB1 HSL 181 9.104 4.958 7.995
233 2HB HSL 181 HB2 HSL 181 7.403 5.342 8.602
Start of MODEL 64
1 1H PHE 155 HT1 PHE 155 -5.980 -1.069 -3.856
2 2H PHE 155 HT2 PHE 155 -7.285 -1.756 -2.976
3 3H PHE 155 HT3 PHE 155 -6.489 -0.355 -2.384
4 HA PHE 155 HA PHE 155 -8.299 -0.641 -4.665
5 1HB PHE 155 HB2 PHE 155 -8.177 1.322 -2.366
6 2HB PHE 155 HB1 PHE 155 -9.493 1.132 -3.521
7 HD1 PHE 155 HD1 PHE 155 -8.923 0.702 -0.285
8 HD2 PHE 155 HD2 PHE 155 -9.961 -1.689 -3.648
9 HE1 PHE 155 HE1 PHE 155 -9.993 -0.931 1.212
10 HE2 PHE 155 HE2 PHE 155 -11.035 -3.327 -2.158
11 HZ PHE 155 HZ PHE 155 -11.052 -2.948 0.276
12 H LEU 156 HN LEU 156 -8.481 1.120 -6.116
13 HA LEU 156 HA LEU 156 -6.659 3.303 -6.069
14 1HB LEU 156 HB2 LEU 156 -5.435 2.707 -8.099
15 2HB LEU 156 HB1 LEU 156 -5.136 1.576 -6.794
16 HG LEU 156 HG LEU 156 -6.950 0.120 -7.907
17 1HD1 LEU 156 HD11 LEU 156 -7.960 1.420 -9.511
18 2HD1 LEU 156 HD12 LEU 156 -6.776 0.540 -10.477
19 3HD1 LEU 156 HD13 LEU 156 -6.450 2.201 -9.983
20 1HD2 LEU 156 HD21 LEU 156 -4.485 -0.310 -7.837
21 2HD2 LEU 156 HD22 LEU 156 -4.364 0.497 -9.401
22 3HD2 LEU 156 HD23 LEU 156 -5.314 -0.980 -9.242
23 H GLN 157 HN GLN 157 -6.653 4.212 -8.556
24 HA GLN 157 HA GLN 157 -9.051 3.838 -10.010
25 1HB GLN 157 HB2 GLN 157 -9.123 5.736 -7.812
26 2HB GLN 157 HB1 GLN 157 -9.477 6.513 -9.349
27 1HG GLN 157 HG2 GLN 157 -10.861 3.980 -8.572
28 2HG GLN 157 HG1 GLN 157 -11.410 5.538 -7.954
29 1HE2 GLN 157 HE21 GLN 157 -12.205 3.372 -10.106
30 2HE2 GLN 157 HE22 GLN 157 -12.776 4.357 -11.405
31 H SER 158 HN SER 158 -7.557 6.988 -9.423
32 HA SER 158 HA SER 158 -6.947 7.259 -12.214
33 1HB SER 158 HB2 SER 158 -6.902 8.991 -9.824
34 2HB SER 158 HB1 SER 158 -5.681 9.371 -11.050
35 HG SER 158 HG SER 158 -7.211 10.212 -12.197
36 H ASP 159 HN ASP 159 -5.605 5.131 -11.818
37 HA ASP 159 HA ASP 159 -3.539 4.247 -12.239
38 1HB ASP 159 HB2 ASP 159 -3.067 6.829 -12.877
39 2HB ASP 159 HB1 ASP 159 -1.985 6.652 -11.498
40 H VAL 160 HN VAL 160 -3.658 6.467 -9.461
41 HA VAL 160 HA VAL 160 -3.349 6.025 -7.237
42 HB VAL 160 HB VAL 160 -3.649 3.439 -8.213
43 1HG1 VAL 160 HG11 VAL 160 -1.238 3.082 -8.237
44 2HG1 VAL 160 HG12 VAL 160 -2.014 2.083 -7.009
45 3HG1 VAL 160 HG13 VAL 160 -1.146 3.543 -6.537
46 1HG2 VAL 160 HG21 VAL 160 -3.883 2.869 -5.767
47 2HG2 VAL 160 HG22 VAL 160 -4.856 4.224 -6.341
48 3HG2 VAL 160 HG23 VAL 160 -3.380 4.525 -5.423
49 H PHE 161 HN PHE 161 -0.823 4.681 -9.333
50 HA PHE 161 HA PHE 161 1.309 5.385 -7.560
51 1HB PHE 161 HB2 PHE 161 1.097 4.154 -10.269
52 2HB PHE 161 HB1 PHE 161 2.635 4.867 -9.803
53 HD1 PHE 161 HD1 PHE 161 3.492 2.523 -10.148
54 HD2 PHE 161 HD2 PHE 161 0.741 3.534 -7.061
55 HE1 PHE 161 HE1 PHE 161 4.082 0.458 -8.949
56 HE2 PHE 161 HE2 PHE 161 1.327 1.470 -5.858
57 HZ PHE 161 HZ PHE 161 2.999 -0.070 -6.801
58 H PHE 162 HN PHE 162 -0.499 7.518 -8.551
59 HA PHE 162 HA PHE 162 1.498 9.487 -9.080
60 1HB PHE 162 HB2 PHE 162 -0.452 8.720 -11.248
61 2HB PHE 162 HB1 PHE 162 0.328 10.304 -11.186
62 HD1 PHE 162 HD1 PHE 162 0.578 6.990 -12.373
63 HD2 PHE 162 HD2 PHE 162 2.922 10.283 -11.042
64 HE1 PHE 162 HE1 PHE 162 2.536 6.063 -13.540
65 HE2 PHE 162 HE2 PHE 162 4.884 9.362 -12.208
66 HZ PHE 162 HZ PHE 162 4.692 7.250 -13.459
67 H LEU 163 HN LEU 163 -1.390 8.539 -7.794
68 HA LEU 163 HA LEU 163 -2.981 10.869 -7.998
69 1HB LEU 163 HB2 LEU 163 -2.954 8.392 -6.463
70 2HB LEU 163 HB1 LEU 163 -3.489 9.754 -5.497
71 HG LEU 163 HG LEU 163 -5.274 8.410 -6.659
72 1HD1 LEU 163 HD11 LEU 163 -6.603 10.383 -7.210
73 2HD1 LEU 163 HD12 LEU 163 -5.138 11.365 -7.212
74 3HD1 LEU 163 HD13 LEU 163 -5.693 10.612 -5.717
75 1HD2 LEU 163 HD21 LEU 163 -5.313 8.165 -8.867
76 2HD2 LEU 163 HD22 LEU 163 -3.689 8.851 -8.896
77 3HD2 LEU 163 HD23 LEU 163 -5.091 9.895 -9.125
78 H PHE 164 HN PHE 164 -0.425 9.744 -5.932
79 HA PHE 164 HA PHE 164 1.007 10.806 -4.520
80 1HB PHE 164 HB2 PHE 164 0.844 12.515 -6.479
81 2HB PHE 164 HB1 PHE 164 -0.108 13.468 -5.346
82 HD1 PHE 164 HD1 PHE 164 2.197 14.717 -6.372
83 HD2 PHE 164 HD2 PHE 164 1.944 11.935 -3.157
84 HE1 PHE 164 HE1 PHE 164 4.266 15.638 -5.416
85 HE2 PHE 164 HE2 PHE 164 4.012 12.855 -2.197
86 HZ PHE 164 HZ PHE 164 5.176 14.708 -3.326
87 H LEU 165 HN LEU 165 -2.113 10.532 -4.010
88 HA LEU 165 HA LEU 165 -2.686 12.433 -1.987
89 1HB LEU 165 HB2 LEU 165 -3.953 10.088 -3.136
90 2HB LEU 165 HB1 LEU 165 -4.188 10.172 -1.398
91 HG LEU 165 HG LEU 165 -6.018 11.224 -2.715
92 1HD1 LEU 165 HD11 LEU 165 -4.419 12.613 -0.649
93 2HD1 LEU 165 HD12 LEU 165 -6.099 12.077 -0.618
94 3HD1 LEU 165 HD13 LEU 165 -5.662 13.558 -1.470
95 1HD2 LEU 165 HD21 LEU 165 -4.352 12.116 -4.454
96 2HD2 LEU 165 HD22 LEU 165 -4.107 13.452 -3.328
97 3HD2 LEU 165 HD23 LEU 165 -5.709 13.145 -3.999
98 H LEU 166 HN LEU 166 -1.852 8.980 -1.799
99 HA LEU 166 HA LEU 166 -0.135 9.390 0.442
100 1HB LEU 166 HB2 LEU 166 -1.527 9.038 2.141
101 2HB LEU 166 HB1 LEU 166 -2.861 9.087 1.006
102 HG LEU 166 HG LEU 166 -2.609 6.596 0.734
103 1HD1 LEU 166 HD11 LEU 166 -1.228 6.314 3.291
104 2HD1 LEU 166 HD12 LEU 166 -0.206 6.950 2.002
105 3HD1 LEU 166 HD13 LEU 166 -1.035 5.408 1.790
106 1HD2 LEU 166 HD21 LEU 166 -4.129 6.274 2.361
107 2HD2 LEU 166 HD22 LEU 166 -4.025 8.027 2.525
108 3HD2 LEU 166 HD23 LEU 166 -3.104 6.985 3.608
109 HA PRO 167 HA PRO 167 1.072 5.740 -1.915
110 1HB PRO 167 HB2 PRO 167 3.686 5.818 -1.349
111 2HB PRO 167 HB1 PRO 167 2.943 6.922 -2.522
112 1HG PRO 167 HG2 PRO 167 3.723 7.422 0.325
113 2HG PRO 167 HG1 PRO 167 3.906 8.478 -1.087
114 1HD PRO 167 HD2 PRO 167 1.886 8.711 0.763
115 2HD PRO 167 HD1 PRO 167 1.766 9.270 -0.917
116 HA PRO 168 HA PRO 168 1.045 3.159 1.819
117 1HB PRO 168 HB2 PRO 168 -0.271 1.103 0.771
118 2HB PRO 168 HB1 PRO 168 -1.113 2.633 1.096
119 1HG PRO 168 HG2 PRO 168 0.004 1.604 -1.498
120 2HG PRO 168 HG1 PRO 168 -1.586 2.324 -1.182
121 1HD PRO 168 HD2 PRO 168 0.538 3.709 -2.203
122 2HD PRO 168 HD1 PRO 168 -0.760 4.461 -1.254
123 H ILE 169 HN ILE 169 3.365 3.362 0.001
124 HA ILE 169 HA ILE 169 4.102 0.716 -0.792
125 HB ILE 169 HB ILE 169 4.911 2.964 -1.761
126 1HG1 ILE 169 HG12 ILE 169 7.094 0.957 -1.248
127 2HG1 ILE 169 HG11 ILE 169 5.713 0.576 -2.272
128 1HG2 ILE 169 HG21 ILE 169 5.707 3.901 0.367
129 2HG2 ILE 169 HG22 ILE 169 6.966 3.855 -0.867
130 3HG2 ILE 169 HG23 ILE 169 6.956 2.656 0.425
131 1HD1 ILE 169 HD11 ILE 169 8.091 1.842 -3.005
132 2HD1 ILE 169 HD12 ILE 169 6.845 3.091 -3.047
133 3HD1 ILE 169 HD13 ILE 169 6.644 1.612 -3.986
134 H ILE 170 HN ILE 170 4.970 2.842 1.871
135 HA ILE 170 HA ILE 170 6.829 1.023 3.058
136 HB ILE 170 HB ILE 170 5.526 3.402 4.375
137 1HG1 ILE 170 HG12 ILE 170 8.027 4.221 3.597
138 2HG1 ILE 170 HG11 ILE 170 7.527 3.233 2.229
139 1HG2 ILE 170 HG21 ILE 170 8.303 2.629 4.977
140 2HG2 ILE 170 HG22 ILE 170 7.058 1.504 5.518
141 3HG2 ILE 170 HG23 ILE 170 7.018 3.184 6.049
142 1HD1 ILE 170 HD11 ILE 170 5.309 4.684 2.539
143 2HD1 ILE 170 HD12 ILE 170 6.668 5.198 1.541
144 3HD1 ILE 170 HD13 ILE 170 6.492 5.823 3.181
145 H LEU 171 HN LEU 171 3.578 2.155 4.032
146 HA LEU 171 HA LEU 171 3.397 0.442 6.269
147 1HB LEU 171 HB2 LEU 171 1.661 1.788 6.628
148 2HB LEU 171 HB1 LEU 171 1.784 2.419 5.001
149 HG LEU 171 HG LEU 171 0.333 -0.158 5.363
150 1HD1 LEU 171 HD11 LEU 171 -1.188 2.356 5.806
151 2HD1 LEU 171 HD12 LEU 171 -0.319 1.643 7.164
152 3HD1 LEU 171 HD13 LEU 171 -1.551 0.707 6.316
153 1HD2 LEU 171 HD21 LEU 171 -0.928 1.902 3.789
154 2HD2 LEU 171 HD22 LEU 171 -0.359 0.307 3.301
155 3HD2 LEU 171 HD23 LEU 171 0.751 1.677 3.300
156 H ASP 172 HN ASP 172 2.006 0.173 3.023
157 HA ASP 172 HA ASP 172 1.068 -2.490 3.442
158 1HB ASP 172 HB2 ASP 172 0.396 -0.555 1.670
159 2HB ASP 172 HB1 ASP 172 1.441 -1.561 0.659
160 H ALA 173 HN ALA 173 4.149 -1.371 3.147
161 HA ALA 173 HA ALA 173 5.227 -3.236 1.279
162 1HB ALA 173 HB1 ALA 173 7.273 -2.538 3.057
163 2HB ALA 173 HB2 ALA 173 6.238 -1.115 2.944
164 3HB ALA 173 HB3 ALA 173 6.931 -1.817 1.485
165 H GLY 174 HN GLY 174 5.814 -2.968 4.759
166 1HA GLY 174 HA2 GLY 174 5.684 -5.917 4.949
167 2HA GLY 174 HA1 GLY 174 6.855 -4.942 5.857
168 H TYR 175 HN TYR 175 4.388 -2.966 5.956
169 HA TYR 175 HA TYR 175 2.723 -2.414 7.375
170 1HB TYR 175 HB2 TYR 175 1.442 -4.309 6.907
171 2HB TYR 175 HB1 TYR 175 2.616 -5.408 7.615
172 HD1 TYR 175 HD1 TYR 175 2.415 -6.106 9.852
173 HD2 TYR 175 HD2 TYR 175 0.077 -2.835 8.460
174 HE1 TYR 175 HE1 TYR 175 1.127 -6.145 11.945
175 HE2 TYR 175 HE2 TYR 175 -1.218 -2.865 10.551
176 HH TYR 175 HH TYR 175 -0.245 -4.490 13.294
177 H PHE 176 HN PHE 176 5.525 -4.079 8.457
178 HA PHE 176 HA PHE 176 5.059 -3.331 11.243
179 1HB PHE 176 HB2 PHE 176 6.201 -5.573 10.134
180 2HB PHE 176 HB1 PHE 176 7.619 -4.611 10.576
181 HD1 PHE 176 HD1 PHE 176 5.528 -7.102 11.685
182 HD2 PHE 176 HD2 PHE 176 7.305 -3.476 13.027
183 HE1 PHE 176 HE1 PHE 176 5.306 -7.860 14.015
184 HE2 PHE 176 HE2 PHE 176 7.086 -4.227 15.358
185 HZ PHE 176 HZ PHE 176 6.085 -6.422 15.855
186 H LEU 177 HN LEU 177 5.722 -1.497 8.910
187 HA LEU 177 HA LEU 177 8.339 -0.479 9.606
188 1HB LEU 177 HB2 LEU 177 6.279 0.380 7.592
189 2HB LEU 177 HB1 LEU 177 7.772 1.258 7.864
190 HG LEU 177 HG LEU 177 8.114 -0.123 5.973
191 1HD1 LEU 177 HD11 LEU 177 9.367 -1.650 8.234
192 2HD1 LEU 177 HD12 LEU 177 9.914 -0.050 7.734
193 3HD1 LEU 177 HD13 LEU 177 9.997 -1.403 6.606
194 1HD2 LEU 177 HD21 LEU 177 7.547 -2.377 5.776
195 2HD2 LEU 177 HD22 LEU 177 6.176 -1.666 6.627
196 3HD2 LEU 177 HD23 LEU 177 7.389 -2.583 7.520
197 HA PRO 178 HA PRO 178 5.399 3.238 10.914
198 1HB PRO 178 HB2 PRO 178 3.052 1.645 11.802
199 2HB PRO 178 HB1 PRO 178 3.109 3.196 10.961
200 1HG PRO 178 HG2 PRO 178 2.412 0.972 9.674
201 2HG PRO 178 HG1 PRO 178 3.412 2.207 8.887
202 1HD PRO 178 HD2 PRO 178 4.229 -0.412 10.088
203 2HD PRO 178 HD1 PRO 178 4.782 0.361 8.590
204 H LEU 179 HN LEU 179 3.967 0.665 12.902
205 HA LEU 179 HA LEU 179 4.136 0.217 15.120
206 1HB LEU 179 HB2 LEU 179 6.685 -0.041 13.970
207 2HB LEU 179 HB1 LEU 179 6.936 0.802 15.487
208 HG LEU 179 HG LEU 179 7.151 -1.680 15.640
209 1HD1 LEU 179 HD11 LEU 179 6.337 -1.725 17.768
210 2HD1 LEU 179 HD12 LEU 179 4.817 -0.950 17.323
211 3HD1 LEU 179 HD13 LEU 179 6.286 0.013 17.474
212 1HD2 LEU 179 HD21 LEU 179 5.272 -2.103 14.006
213 2HD2 LEU 179 HD22 LEU 179 4.160 -1.729 15.323
214 3HD2 LEU 179 HD23 LEU 179 5.265 -3.094 15.465
215 H ARG 180 HN ARG 180 3.144 2.640 14.796
216 HA ARG 180 HA ARG 180 2.721 4.580 15.921
217 1HB ARG 180 HB2 ARG 180 4.751 3.485 17.883
218 2HB ARG 180 HB1 ARG 180 3.693 4.871 18.178
219 1HG ARG 180 HG2 ARG 180 2.453 2.279 17.412
220 2HG ARG 180 HG1 ARG 180 3.090 2.464 19.048
221 1HD ARG 180 HD2 ARG 180 1.480 3.924 19.649
222 2HD ARG 180 HD1 ARG 180 1.446 4.699 18.066
223 HE ARG 180 HE ARG 180 0.310 2.302 17.583
224 1HH1 ARG 180 1HH1 ARG 180 -0.290 4.765 19.982
225 2HH1 ARG 180 2HH1 ARG 180 -1.976 4.400 20.117
226 1HH2 ARG 180 1HH2 ARG 180 -1.909 1.819 17.761
227 2HH2 ARG 180 2HH2 ARG 180 -2.896 2.727 18.857
228 1HG HSL 181 HG1 HSL 181 8.126 7.277 12.283
229 2HG HSL 181 HG2 HSL 181 7.559 6.210 10.895
230 H HSL 181 HN HSL 181 4.437 4.655 13.770
231 HA HSL 181 HA HSL 181 6.496 6.767 14.603
232 1HB HSL 181 HB1 HSL 181 7.933 5.224 13.515
233 2HB HSL 181 HB2 HSL 181 6.584 4.600 12.422
Start of MODEL 65
1 1H PHE 155 HT1 PHE 155 2.294 8.239 -17.603
2 2H PHE 155 HT2 PHE 155 1.038 9.348 -17.232
3 3H PHE 155 HT3 PHE 155 1.454 8.113 -16.115
4 HA PHE 155 HA PHE 155 3.306 10.220 -16.988
5 1HB PHE 155 HB2 PHE 155 1.466 10.093 -14.586
6 2HB PHE 155 HB1 PHE 155 2.762 11.268 -14.787
7 HD1 PHE 155 HD1 PHE 155 -0.504 11.290 -14.679
8 HD2 PHE 155 HD2 PHE 155 2.513 12.021 -17.590
9 HE1 PHE 155 HE1 PHE 155 -2.044 12.773 -15.898
10 HE2 PHE 155 HE2 PHE 155 0.979 13.506 -18.814
11 HZ PHE 155 HZ PHE 155 -1.302 13.884 -17.967
12 H LEU 156 HN LEU 156 5.259 10.175 -15.909
13 HA LEU 156 HA LEU 156 6.047 7.652 -14.839
14 1HB LEU 156 HB2 LEU 156 8.258 8.547 -14.776
15 2HB LEU 156 HB1 LEU 156 7.502 9.087 -16.260
16 HG LEU 156 HG LEU 156 7.250 10.955 -14.003
17 1HD1 LEU 156 HD11 LEU 156 9.905 11.000 -15.309
18 2HD1 LEU 156 HD12 LEU 156 9.648 9.807 -14.037
19 3HD1 LEU 156 HD13 LEU 156 9.423 11.522 -13.695
20 1HD2 LEU 156 HD21 LEU 156 6.862 11.062 -16.693
21 2HD2 LEU 156 HD22 LEU 156 8.459 11.793 -16.537
22 3HD2 LEU 156 HD23 LEU 156 7.090 12.467 -15.652
23 H GLN 157 HN GLN 157 7.911 8.418 -12.878
24 HA GLN 157 HA GLN 157 8.164 9.077 -10.696
25 1HB GLN 157 HB2 GLN 157 6.290 10.867 -11.461
26 2HB GLN 157 HB1 GLN 157 5.364 9.944 -10.286
27 1HG GLN 157 HG2 GLN 157 7.692 10.358 -8.941
28 2HG GLN 157 HG1 GLN 157 7.559 11.835 -9.894
29 1HE2 GLN 157 HE21 GLN 157 6.105 9.878 -7.412
30 2HE2 GLN 157 HE22 GLN 157 5.026 11.086 -6.810
31 H SER 158 HN SER 158 8.270 6.750 -10.522
32 HA SER 158 HA SER 158 7.821 4.830 -9.394
33 1HB SER 158 HB2 SER 158 7.231 6.425 -7.539
34 2HB SER 158 HB1 SER 158 5.544 6.319 -8.069
35 HG SER 158 HG SER 158 5.550 4.691 -6.714
36 H ASP 159 HN ASP 159 6.596 5.392 -11.956
37 HA ASP 159 HA ASP 159 5.257 4.235 -13.399
38 1HB ASP 159 HB2 ASP 159 5.506 2.449 -11.360
39 2HB ASP 159 HB1 ASP 159 3.763 2.701 -11.372
40 H VAL 160 HN VAL 160 3.638 5.145 -10.375
41 HA VAL 160 HA VAL 160 1.942 6.653 -10.051
42 HB VAL 160 HB VAL 160 1.524 6.487 -13.030
43 1HG1 VAL 160 HG11 VAL 160 -0.589 7.054 -12.297
44 2HG1 VAL 160 HG12 VAL 160 0.159 8.640 -12.480
45 3HG1 VAL 160 HG13 VAL 160 0.021 7.911 -10.880
46 1HG2 VAL 160 HG21 VAL 160 2.713 8.638 -11.289
47 2HG2 VAL 160 HG22 VAL 160 2.399 8.787 -13.018
48 3HG2 VAL 160 HG23 VAL 160 3.580 7.614 -12.433
49 H PHE 161 HN PHE 161 1.275 4.037 -12.373
50 HA PHE 161 HA PHE 161 -1.405 3.629 -11.535
51 1HB PHE 161 HB2 PHE 161 0.400 1.567 -12.812
52 2HB PHE 161 HB1 PHE 161 -1.358 1.644 -12.878
53 HD1 PHE 161 HD1 PHE 161 -1.841 4.444 -13.544
54 HD2 PHE 161 HD2 PHE 161 1.124 1.759 -14.999
55 HE1 PHE 161 HE1 PHE 161 -1.710 5.729 -15.639
56 HE2 PHE 161 HE2 PHE 161 1.260 3.040 -17.095
57 HZ PHE 161 HZ PHE 161 -0.157 5.028 -17.417
58 H PHE 162 HN PHE 162 1.682 2.472 -10.442
59 HA PHE 162 HA PHE 162 0.774 0.312 -8.835
60 1HB PHE 162 HB2 PHE 162 3.119 0.767 -9.692
61 2HB PHE 162 HB1 PHE 162 3.246 1.964 -8.403
62 HD1 PHE 162 HD1 PHE 162 1.672 -1.406 -8.361
63 HD2 PHE 162 HD2 PHE 162 4.806 1.087 -6.920
64 HE1 PHE 162 HE1 PHE 162 2.352 -3.174 -6.791
65 HE2 PHE 162 HE2 PHE 162 5.492 -0.677 -5.349
66 HZ PHE 162 HZ PHE 162 4.264 -2.811 -5.283
67 H LEU 163 HN LEU 163 1.985 3.540 -7.939
68 HA LEU 163 HA LEU 163 1.141 3.404 -5.235
69 1HB LEU 163 HB2 LEU 163 2.884 4.946 -6.325
70 2HB LEU 163 HB1 LEU 163 1.519 5.927 -6.823
71 HG LEU 163 HG LEU 163 0.886 6.187 -4.428
72 1HD1 LEU 163 HD11 LEU 163 2.557 4.053 -4.007
73 2HD1 LEU 163 HD12 LEU 163 1.911 5.118 -2.759
74 3HD1 LEU 163 HD13 LEU 163 3.514 5.418 -3.429
75 1HD2 LEU 163 HD21 LEU 163 3.719 7.083 -4.703
76 2HD2 LEU 163 HD22 LEU 163 2.318 7.955 -4.083
77 3HD2 LEU 163 HD23 LEU 163 2.499 7.697 -5.818
78 H PHE 164 HN PHE 164 -0.582 3.561 -8.013
79 HA PHE 164 HA PHE 164 -2.646 5.394 -7.343
80 1HB PHE 164 HB2 PHE 164 -1.776 3.973 -9.590
81 2HB PHE 164 HB1 PHE 164 -3.380 3.331 -9.247
82 HD1 PHE 164 HD1 PHE 164 -1.832 5.546 -11.260
83 HD2 PHE 164 HD2 PHE 164 -5.000 5.463 -8.420
84 HE1 PHE 164 HE1 PHE 164 -2.852 7.505 -12.346
85 HE2 PHE 164 HE2 PHE 164 -6.026 7.419 -9.502
86 HZ PHE 164 HZ PHE 164 -4.952 8.442 -11.468
87 H LEU 165 HN LEU 165 -2.234 1.879 -7.161
88 HA LEU 165 HA LEU 165 -4.868 1.272 -6.342
89 1HB LEU 165 HB2 LEU 165 -2.545 -0.165 -6.919
90 2HB LEU 165 HB1 LEU 165 -2.898 -0.534 -5.237
91 HG LEU 165 HG LEU 165 -5.184 -1.229 -5.905
92 1HD1 LEU 165 HD11 LEU 165 -5.235 -1.751 -8.500
93 2HD1 LEU 165 HD12 LEU 165 -4.190 -0.330 -8.550
94 3HD1 LEU 165 HD13 LEU 165 -5.802 -0.216 -7.843
95 1HD2 LEU 165 HD21 LEU 165 -3.116 -2.754 -5.803
96 2HD2 LEU 165 HD22 LEU 165 -3.203 -2.746 -7.565
97 3HD2 LEU 165 HD23 LEU 165 -4.559 -3.355 -6.618
98 H LEU 166 HN LEU 166 -1.964 2.193 -4.614
99 HA LEU 166 HA LEU 166 -3.509 2.834 -2.279
100 1HB LEU 166 HB2 LEU 166 -2.917 1.155 -0.886
101 2HB LEU 166 HB1 LEU 166 -2.776 0.270 -2.396
102 HG LEU 166 HG LEU 166 -0.431 1.595 -1.031
103 1HD1 LEU 166 HD11 LEU 166 -1.264 -1.298 -0.920
104 2HD1 LEU 166 HD12 LEU 166 -1.431 -0.142 0.402
105 3HD1 LEU 166 HD13 LEU 166 0.172 -0.583 -0.187
106 1HD2 LEU 166 HD21 LEU 166 0.862 0.754 -2.676
107 2HD2 LEU 166 HD22 LEU 166 -0.641 0.809 -3.597
108 3HD2 LEU 166 HD23 LEU 166 -0.120 -0.701 -2.850
109 HA PRO 167 HA PRO 167 -0.243 5.874 -2.479
110 1HB PRO 167 HB2 PRO 167 -1.013 7.234 -0.206
111 2HB PRO 167 HB1 PRO 167 -1.635 7.529 -1.838
112 1HG PRO 167 HG2 PRO 167 -2.857 6.038 0.419
113 2HG PRO 167 HG1 PRO 167 -3.631 6.985 -0.858
114 1HD PRO 167 HD2 PRO 167 -3.575 4.253 -0.816
115 2HD PRO 167 HD1 PRO 167 -3.699 5.215 -2.301
116 HA PRO 168 HA PRO 168 1.688 4.686 1.654
117 1HB PRO 168 HB2 PRO 168 0.599 2.921 3.270
118 2HB PRO 168 HB1 PRO 168 -0.129 4.531 3.093
119 1HG PRO 168 HG2 PRO 168 -0.967 1.935 1.854
120 2HG PRO 168 HG1 PRO 168 -1.969 3.188 2.611
121 1HD PRO 168 HD2 PRO 168 -1.499 2.938 -0.114
122 2HD PRO 168 HD1 PRO 168 -2.065 4.406 0.696
123 H ILE 169 HN ILE 169 3.205 3.797 0.182
124 HA ILE 169 HA ILE 169 3.192 1.030 -0.553
125 HB ILE 169 HB ILE 169 5.382 1.440 -1.475
126 1HG1 ILE 169 HG12 ILE 169 5.240 4.099 -0.046
127 2HG1 ILE 169 HG11 ILE 169 6.313 2.766 0.371
128 1HG2 ILE 169 HG21 ILE 169 3.090 2.677 -2.297
129 2HG2 ILE 169 HG22 ILE 169 4.593 2.606 -3.217
130 3HG2 ILE 169 HG23 ILE 169 4.234 4.017 -2.223
131 1HD1 ILE 169 HD11 ILE 169 7.084 4.841 -1.106
132 2HD1 ILE 169 HD12 ILE 169 6.476 3.804 -2.397
133 3HD1 ILE 169 HD13 ILE 169 7.745 3.221 -1.321
134 H ILE 170 HN ILE 170 4.852 3.027 1.735
135 HA ILE 170 HA ILE 170 6.611 1.114 2.772
136 HB ILE 170 HB ILE 170 7.035 2.756 4.490
137 1HG1 ILE 170 HG12 ILE 170 4.524 3.924 3.404
138 2HG1 ILE 170 HG11 ILE 170 4.985 3.666 5.078
139 1HG2 ILE 170 HG21 ILE 170 6.747 4.073 1.810
140 2HG2 ILE 170 HG22 ILE 170 8.040 2.952 2.235
141 3HG2 ILE 170 HG23 ILE 170 7.896 4.492 3.081
142 1HD1 ILE 170 HD11 ILE 170 5.285 5.887 5.067
143 2HD1 ILE 170 HD12 ILE 170 5.468 5.955 3.314
144 3HD1 ILE 170 HD13 ILE 170 6.835 5.485 4.326
145 H LEU 171 HN LEU 171 3.474 2.312 3.868
146 HA LEU 171 HA LEU 171 3.424 0.940 6.326
147 1HB LEU 171 HB2 LEU 171 1.775 2.721 5.111
148 2HB LEU 171 HB1 LEU 171 0.856 1.244 4.891
149 HG LEU 171 HG LEU 171 1.818 2.281 7.559
150 1HD1 LEU 171 HD11 LEU 171 0.061 3.659 6.346
151 2HD1 LEU 171 HD12 LEU 171 -0.352 3.085 7.962
152 3HD1 LEU 171 HD13 LEU 171 -1.007 2.270 6.542
153 1HD2 LEU 171 HD21 LEU 171 1.399 -0.247 7.127
154 2HD2 LEU 171 HD22 LEU 171 -0.302 0.217 7.132
155 3HD2 LEU 171 HD23 LEU 171 0.697 0.518 8.553
156 H ASP 172 HN ASP 172 1.876 0.127 3.238
157 HA ASP 172 HA ASP 172 1.298 -2.559 4.028
158 1HB ASP 172 HB2 ASP 172 0.138 -0.986 2.239
159 2HB ASP 172 HB1 ASP 172 1.319 -1.736 1.155
160 H ALA 173 HN ALA 173 4.167 -1.113 3.254
161 HA ALA 173 HA ALA 173 5.291 -3.065 1.507
162 1HB ALA 173 HB1 ALA 173 7.459 -1.933 2.668
163 2HB ALA 173 HB2 ALA 173 6.245 -0.684 2.924
164 3HB ALA 173 HB3 ALA 173 6.594 -1.248 1.293
165 H GLY 174 HN GLY 174 6.378 -2.227 4.781
166 1HA GLY 174 HA2 GLY 174 7.035 -5.058 5.227
167 2HA GLY 174 HA1 GLY 174 7.677 -3.682 6.145
168 H TYR 175 HN TYR 175 4.483 -3.072 5.783
169 HA TYR 175 HA TYR 175 2.710 -3.019 7.124
170 1HB TYR 175 HB2 TYR 175 2.647 -5.468 8.441
171 2HB TYR 175 HB1 TYR 175 1.868 -5.046 6.926
172 HD1 TYR 175 HD1 TYR 175 3.326 -5.339 4.777
173 HD2 TYR 175 HD2 TYR 175 4.123 -7.261 8.489
174 HE1 TYR 175 HE1 TYR 175 4.651 -7.045 3.603
175 HE2 TYR 175 HE2 TYR 175 5.452 -8.971 7.324
176 HH TYR 175 HH TYR 175 5.466 -9.268 3.892
177 H PHE 176 HN PHE 176 5.317 -4.649 8.958
178 HA PHE 176 HA PHE 176 4.416 -3.280 11.368
179 1HB PHE 176 HB2 PHE 176 6.169 -5.611 10.779
180 2HB PHE 176 HB1 PHE 176 6.527 -4.678 12.239
181 HD1 PHE 176 HD1 PHE 176 3.855 -3.924 13.157
182 HD2 PHE 176 HD2 PHE 176 5.255 -7.596 11.521
183 HE1 PHE 176 HE1 PHE 176 2.080 -5.133 14.359
184 HE2 PHE 176 HE2 PHE 176 3.482 -8.810 12.721
185 HZ PHE 176 HZ PHE 176 1.892 -7.578 14.141
186 H LEU 177 HN LEU 177 5.874 -2.014 8.998
187 HA LEU 177 HA LEU 177 8.386 -1.173 10.153
188 1HB LEU 177 HB2 LEU 177 6.967 -0.720 7.571
189 2HB LEU 177 HB1 LEU 177 8.194 0.434 8.059
190 HG LEU 177 HG LEU 177 8.664 -2.532 7.777
191 1HD1 LEU 177 HD11 LEU 177 10.076 -1.620 5.791
192 2HD1 LEU 177 HD12 LEU 177 8.955 -0.260 5.864
193 3HD1 LEU 177 HD13 LEU 177 8.345 -1.892 5.589
194 1HD2 LEU 177 HD21 LEU 177 10.091 -0.749 9.247
195 2HD2 LEU 177 HD22 LEU 177 10.899 -0.633 7.684
196 3HD2 LEU 177 HD23 LEU 177 10.766 -2.193 8.494
197 HA PRO 178 HA PRO 178 5.803 2.994 10.300
198 1HB PRO 178 HB2 PRO 178 3.067 1.904 10.574
199 2HB PRO 178 HB1 PRO 178 3.647 3.252 9.591
200 1HG PRO 178 HG2 PRO 178 2.930 0.945 8.466
201 2HG PRO 178 HG1 PRO 178 4.321 1.865 7.860
202 1HD PRO 178 HD2 PRO 178 4.279 -0.549 9.639
203 2HD PRO 178 HD1 PRO 178 5.325 -0.198 8.248
204 H LEU 179 HN LEU 179 7.031 1.903 12.315
205 HA LEU 179 HA LEU 179 5.204 1.453 14.536
206 1HB LEU 179 HB2 LEU 179 8.085 1.007 14.031
207 2HB LEU 179 HB1 LEU 179 7.643 1.386 15.684
208 HG LEU 179 HG LEU 179 6.612 -0.927 14.040
209 1HD1 LEU 179 HD11 LEU 179 8.053 -2.266 15.145
210 2HD1 LEU 179 HD12 LEU 179 7.983 -1.309 16.624
211 3HD1 LEU 179 HD13 LEU 179 8.987 -0.776 15.276
212 1HD2 LEU 179 HD21 LEU 179 5.665 -1.542 16.381
213 2HD2 LEU 179 HD22 LEU 179 4.783 -0.412 15.353
214 3HD2 LEU 179 HD23 LEU 179 5.774 0.192 16.681
215 H ARG 180 HN ARG 180 6.441 4.079 13.032
216 HA ARG 180 HA ARG 180 5.943 5.784 15.319
217 1HB ARG 180 HB2 ARG 180 8.094 7.089 14.753
218 2HB ARG 180 HB1 ARG 180 8.255 5.602 15.694
219 1HG ARG 180 HG2 ARG 180 8.439 5.254 12.783
220 2HG ARG 180 HG1 ARG 180 9.730 6.213 13.510
221 1HD ARG 180 HD2 ARG 180 10.685 4.399 14.376
222 2HD ARG 180 HD1 ARG 180 9.166 3.873 15.099
223 HE ARG 180 HE ARG 180 8.928 3.237 12.454
224 1HH1 ARG 180 1HH1 ARG 180 11.222 2.484 14.974
225 2HH1 ARG 180 2HH1 ARG 180 11.634 0.939 14.309
226 1HH2 ARG 180 1HH2 ARG 180 9.468 1.205 11.579
227 2HH2 ARG 180 2HH2 ARG 180 10.640 0.213 12.382
228 1HG HSL 181 HG1 HSL 181 1.808 5.778 9.709
229 2HG HSL 181 HG2 HSL 181 2.213 4.688 11.135
230 H HSL 181 HN HSL 181 4.393 5.291 13.151
231 HA HSL 181 HA HSL 181 4.684 7.815 11.442
232 1HB HSL 181 HB1 HSL 181 3.989 6.666 9.553
233 2HB HSL 181 HB2 HSL 181 4.473 5.140 10.475
Start of MODEL 66
1 1H PHE 155 HT1 PHE 155 -4.371 15.753 -3.903
2 2H PHE 155 HT2 PHE 155 -5.358 15.461 -2.528
3 3H PHE 155 HT3 PHE 155 -4.482 16.931 -2.663
4 HA PHE 155 HA PHE 155 -6.702 17.368 -3.163
5 1HB PHE 155 HB2 PHE 155 -4.574 17.506 -5.149
6 2HB PHE 155 HB1 PHE 155 -6.181 17.608 -5.856
7 HD1 PHE 155 HD1 PHE 155 -6.419 19.826 -6.479
8 HD2 PHE 155 HD2 PHE 155 -4.957 18.896 -2.592
9 HE1 PHE 155 HE1 PHE 155 -6.541 22.206 -5.868
10 HE2 PHE 155 HE2 PHE 155 -5.078 21.274 -1.974
11 HZ PHE 155 HZ PHE 155 -5.870 22.933 -3.614
12 H LEU 156 HN LEU 156 -5.734 14.331 -4.100
13 HA LEU 156 HA LEU 156 -6.779 12.537 -4.935
14 1HB LEU 156 HB2 LEU 156 -8.969 12.182 -4.351
15 2HB LEU 156 HB1 LEU 156 -8.506 13.448 -3.237
16 HG LEU 156 HG LEU 156 -9.610 14.620 -5.611
17 1HD1 LEU 156 HD11 LEU 156 -11.630 13.631 -5.902
18 2HD1 LEU 156 HD12 LEU 156 -11.698 13.032 -4.245
19 3HD1 LEU 156 HD13 LEU 156 -10.694 12.210 -5.440
20 1HD2 LEU 156 HD21 LEU 156 -10.701 15.941 -4.113
21 2HD2 LEU 156 HD22 LEU 156 -9.431 15.316 -3.063
22 3HD2 LEU 156 HD23 LEU 156 -11.043 14.602 -3.017
23 H GLN 157 HN GLN 157 -7.338 11.691 -6.902
24 HA GLN 157 HA GLN 157 -8.739 13.122 -8.900
25 1HB GLN 157 HB2 GLN 157 -6.033 13.837 -8.666
26 2HB GLN 157 HB1 GLN 157 -6.122 12.794 -10.077
27 1HG GLN 157 HG2 GLN 157 -7.724 15.295 -9.594
28 2HG GLN 157 HG1 GLN 157 -6.379 15.105 -10.718
29 1HE2 GLN 157 HE21 GLN 157 -7.005 14.938 -12.736
30 2HE2 GLN 157 HE22 GLN 157 -8.454 14.186 -13.303
31 H SER 158 HN SER 158 -9.660 10.952 -8.509
32 HA SER 158 HA SER 158 -10.264 8.998 -9.502
33 1HB SER 158 HB2 SER 158 -9.471 8.389 -11.570
34 2HB SER 158 HB1 SER 158 -8.916 10.070 -11.529
35 HG SER 158 HG SER 158 -7.471 7.757 -11.559
36 H ASP 159 HN ASP 159 -6.757 9.140 -8.894
37 HA ASP 159 HA ASP 159 -6.630 6.387 -8.148
38 1HB ASP 159 HB2 ASP 159 -4.657 8.576 -7.476
39 2HB ASP 159 HB1 ASP 159 -4.347 6.843 -7.510
40 H VAL 160 HN VAL 160 -6.370 9.402 -6.299
41 HA VAL 160 HA VAL 160 -7.012 9.943 -4.193
42 HB VAL 160 HB VAL 160 -8.870 7.982 -4.892
43 1HG1 VAL 160 HG11 VAL 160 -7.715 7.347 -2.180
44 2HG1 VAL 160 HG12 VAL 160 -7.878 6.263 -3.562
45 3HG1 VAL 160 HG13 VAL 160 -9.314 6.836 -2.717
46 1HG2 VAL 160 HG21 VAL 160 -9.852 9.859 -4.141
47 2HG2 VAL 160 HG22 VAL 160 -8.624 10.139 -2.906
48 3HG2 VAL 160 HG23 VAL 160 -9.910 8.966 -2.622
49 H PHE 161 HN PHE 161 -6.167 6.461 -4.243
50 HA PHE 161 HA PHE 161 -4.640 6.676 -1.825
51 1HB PHE 161 HB2 PHE 161 -5.581 4.565 -3.549
52 2HB PHE 161 HB1 PHE 161 -3.864 4.346 -3.235
53 HD1 PHE 161 HD1 PHE 161 -3.513 2.783 -1.603
54 HD2 PHE 161 HD2 PHE 161 -6.751 5.510 -1.173
55 HE1 PHE 161 HE1 PHE 161 -4.041 1.802 0.591
56 HE2 PHE 161 HE2 PHE 161 -7.285 4.535 1.022
57 HZ PHE 161 HZ PHE 161 -5.929 2.679 1.907
58 H PHE 162 HN PHE 162 -3.735 8.651 -3.377
59 HA PHE 162 HA PHE 162 -0.980 8.069 -3.705
60 1HB PHE 162 HB2 PHE 162 -2.369 7.297 -5.837
61 2HB PHE 162 HB1 PHE 162 -2.170 9.000 -6.241
62 HD1 PHE 162 HD1 PHE 162 -0.532 5.779 -5.920
63 HD2 PHE 162 HD2 PHE 162 0.076 9.937 -6.590
64 HE1 PHE 162 HE1 PHE 162 1.728 5.307 -6.769
65 HE2 PHE 162 HE2 PHE 162 2.338 9.472 -7.442
66 HZ PHE 162 HZ PHE 162 3.166 7.155 -7.532
67 H LEU 163 HN LEU 163 -3.399 10.238 -5.054
68 HA LEU 163 HA LEU 163 -1.823 12.586 -4.797
69 1HB LEU 163 HB2 LEU 163 -4.757 12.080 -5.221
70 2HB LEU 163 HB1 LEU 163 -4.090 13.700 -5.145
71 HG LEU 163 HG LEU 163 -4.239 11.893 -7.369
72 1HD1 LEU 163 HD11 LEU 163 -4.034 13.828 -8.622
73 2HD1 LEU 163 HD12 LEU 163 -3.000 14.614 -7.428
74 3HD1 LEU 163 HD13 LEU 163 -4.724 14.417 -7.111
75 1HD2 LEU 163 HD21 LEU 163 -1.463 12.874 -6.716
76 2HD2 LEU 163 HD22 LEU 163 -1.967 12.178 -8.256
77 3HD2 LEU 163 HD23 LEU 163 -1.989 11.191 -6.794
78 H PHE 164 HN PHE 164 -3.262 10.646 -2.577
79 HA PHE 164 HA PHE 164 -4.267 12.569 -0.718
80 1HB PHE 164 HB2 PHE 164 -4.197 9.710 -1.073
81 2HB PHE 164 HB1 PHE 164 -3.695 10.113 0.568
82 HD1 PHE 164 HD1 PHE 164 -6.375 10.878 -1.901
83 HD2 PHE 164 HD2 PHE 164 -5.294 10.458 2.193
84 HE1 PHE 164 HE1 PHE 164 -8.730 11.181 -1.251
85 HE2 PHE 164 HE2 PHE 164 -7.646 10.757 2.850
86 HZ PHE 164 HZ PHE 164 -9.368 11.118 1.126
87 H LEU 165 HN LEU 165 -1.868 13.532 -1.301
88 HA LEU 165 HA LEU 165 -0.103 14.468 -0.193
89 1HB LEU 165 HB2 LEU 165 -1.435 13.256 1.913
90 2HB LEU 165 HB1 LEU 165 0.188 12.591 2.004
91 HG LEU 165 HG LEU 165 0.088 14.521 3.416
92 1HD1 LEU 165 HD11 LEU 165 1.579 14.919 0.842
93 2HD1 LEU 165 HD12 LEU 165 2.193 14.383 2.406
94 3HD1 LEU 165 HD13 LEU 165 1.709 16.063 2.178
95 1HD2 LEU 165 HD21 LEU 165 -0.956 16.469 2.944
96 2HD2 LEU 165 HD22 LEU 165 -1.844 15.460 1.804
97 3HD2 LEU 165 HD23 LEU 165 -0.485 16.436 1.245
98 H LEU 166 HN LEU 166 -0.192 10.914 0.071
99 HA LEU 166 HA LEU 166 2.078 10.618 -1.619
100 1HB LEU 166 HB2 LEU 166 2.589 11.110 1.120
101 2HB LEU 166 HB1 LEU 166 2.942 9.414 0.835
102 HG LEU 166 HG LEU 166 4.235 10.494 -1.267
103 1HD1 LEU 166 HD11 LEU 166 5.493 12.454 0.038
104 2HD1 LEU 166 HD12 LEU 166 3.879 12.650 0.722
105 3HD1 LEU 166 HD13 LEU 166 4.113 12.739 -1.023
106 1HD2 LEU 166 HD21 LEU 166 5.383 10.314 1.514
107 2HD2 LEU 166 HD22 LEU 166 6.267 10.200 -0.008
108 3HD2 LEU 166 HD23 LEU 166 5.119 8.939 0.443
109 HA PRO 167 HA PRO 167 0.419 6.504 -1.701
110 1HB PRO 167 HB2 PRO 167 2.377 5.158 -2.909
111 2HB PRO 167 HB1 PRO 167 1.533 6.478 -3.743
112 1HG PRO 167 HG2 PRO 167 4.228 6.459 -2.453
113 2HG PRO 167 HG1 PRO 167 3.699 7.266 -3.939
114 1HD PRO 167 HD2 PRO 167 3.952 8.465 -1.425
115 2HD PRO 167 HD1 PRO 167 3.055 9.127 -2.805
116 HA PRO 168 HA PRO 168 2.201 4.854 2.155
117 1HB PRO 168 HB2 PRO 168 0.108 3.225 2.747
118 2HB PRO 168 HB1 PRO 168 0.106 4.966 3.088
119 1HG PRO 168 HG2 PRO 168 -1.127 3.480 0.797
120 2HG PRO 168 HG1 PRO 168 -1.804 4.800 1.768
121 1HD PRO 168 HD2 PRO 168 -0.736 5.204 -0.683
122 2HD PRO 168 HD1 PRO 168 -0.640 6.419 0.609
123 H ILE 169 HN ILE 169 3.467 3.872 0.063
124 HA ILE 169 HA ILE 169 2.888 1.107 -0.457
125 HB ILE 169 HB ILE 169 4.075 2.806 -1.999
126 1HG1 ILE 169 HG12 ILE 169 5.567 0.223 -1.892
127 2HG1 ILE 169 HG11 ILE 169 3.823 0.176 -2.129
128 1HG2 ILE 169 HG21 ILE 169 6.485 2.863 -1.892
129 2HG2 ILE 169 HG22 ILE 169 6.472 1.837 -0.458
130 3HG2 ILE 169 HG23 ILE 169 5.801 3.467 -0.382
131 1HD1 ILE 169 HD11 ILE 169 4.302 0.361 -4.293
132 2HD1 ILE 169 HD12 ILE 169 5.947 0.913 -3.976
133 3HD1 ILE 169 HD13 ILE 169 4.609 2.061 -3.944
134 H ILE 170 HN ILE 170 5.242 2.891 1.441
135 HA ILE 170 HA ILE 170 6.743 0.662 2.323
136 HB ILE 170 HB ILE 170 6.489 3.287 3.780
137 1HG1 ILE 170 HG12 ILE 170 8.795 3.357 2.196
138 2HG1 ILE 170 HG11 ILE 170 7.538 2.741 1.128
139 1HG2 ILE 170 HG21 ILE 170 9.036 1.801 3.581
140 2HG2 ILE 170 HG22 ILE 170 7.770 1.079 4.575
141 3HG2 ILE 170 HG23 ILE 170 8.350 2.707 4.929
142 1HD1 ILE 170 HD11 ILE 170 6.159 4.678 1.606
143 2HD1 ILE 170 HD12 ILE 170 7.744 5.168 1.005
144 3HD1 ILE 170 HD13 ILE 170 7.379 5.284 2.727
145 H LEU 171 HN LEU 171 3.850 2.238 3.518
146 HA LEU 171 HA LEU 171 3.854 1.115 6.115
147 1HB LEU 171 HB2 LEU 171 2.377 2.888 5.885
148 2HB LEU 171 HB1 LEU 171 1.806 2.347 4.320
149 HG LEU 171 HG LEU 171 0.564 0.511 5.460
150 1HD1 LEU 171 HD11 LEU 171 0.996 1.963 8.035
151 2HD1 LEU 171 HD12 LEU 171 2.127 0.711 7.517
152 3HD1 LEU 171 HD13 LEU 171 0.424 0.318 7.757
153 1HD2 LEU 171 HD21 LEU 171 -0.907 2.371 6.785
154 2HD2 LEU 171 HD22 LEU 171 -0.975 2.092 5.045
155 3HD2 LEU 171 HD23 LEU 171 0.032 3.387 5.691
156 H ASP 172 HN ASP 172 1.880 0.252 3.300
157 HA ASP 172 HA ASP 172 1.274 -2.349 4.327
158 1HB ASP 172 HB2 ASP 172 0.482 -0.710 2.009
159 2HB ASP 172 HB1 ASP 172 0.521 -2.454 1.704
160 H ALA 173 HN ALA 173 4.098 -1.223 3.171
161 HA ALA 173 HA ALA 173 4.799 -3.182 1.229
162 1HB ALA 173 HB1 ALA 173 6.231 -1.423 1.036
163 2HB ALA 173 HB2 ALA 173 7.195 -2.429 2.115
164 3HB ALA 173 HB3 ALA 173 6.239 -1.102 2.769
165 H GLY 174 HN GLY 174 5.987 -2.692 4.550
166 1HA GLY 174 HA2 GLY 174 6.348 -5.618 4.763
167 2HA GLY 174 HA1 GLY 174 7.282 -4.412 5.672
168 H TYR 175 HN TYR 175 4.531 -2.961 5.856
169 HA TYR 175 HA TYR 175 2.796 -2.767 7.292
170 1HB TYR 175 HB2 TYR 175 1.992 -4.927 6.654
171 2HB TYR 175 HB1 TYR 175 3.227 -5.743 7.604
172 HD1 TYR 175 HD1 TYR 175 0.007 -4.013 7.705
173 HD2 TYR 175 HD2 TYR 175 3.019 -5.920 10.025
174 HE1 TYR 175 HE1 TYR 175 -1.545 -4.134 9.609
175 HE2 TYR 175 HE2 TYR 175 1.476 -6.049 11.936
176 HH TYR 175 HH TYR 175 -0.521 -4.958 12.764
177 H PHE 176 HN PHE 176 5.871 -3.861 8.277
178 HA PHE 176 HA PHE 176 5.299 -3.437 11.104
179 1HB PHE 176 HB2 PHE 176 7.212 -4.628 11.599
180 2HB PHE 176 HB1 PHE 176 6.762 -5.368 10.058
181 HD1 PHE 176 HD1 PHE 176 7.717 -3.466 8.088
182 HD2 PHE 176 HD2 PHE 176 9.500 -4.691 11.752
183 HE1 PHE 176 HE1 PHE 176 9.937 -2.917 7.184
184 HE2 PHE 176 HE2 PHE 176 11.725 -4.143 10.855
185 HZ PHE 176 HZ PHE 176 11.945 -3.255 8.569
186 H LEU 177 HN LEU 177 5.695 -1.409 8.727
187 HA LEU 177 HA LEU 177 7.935 0.156 9.509
188 1HB LEU 177 HB2 LEU 177 7.486 0.726 7.383
189 2HB LEU 177 HB1 LEU 177 5.791 0.307 7.521
190 HG LEU 177 HG LEU 177 5.362 2.488 8.611
191 1HD1 LEU 177 HD11 LEU 177 7.970 2.552 9.218
192 2HD1 LEU 177 HD12 LEU 177 6.962 3.997 9.127
193 3HD1 LEU 177 HD13 LEU 177 7.984 3.546 7.762
194 1HD2 LEU 177 HD21 LEU 177 6.279 3.798 6.422
195 2HD2 LEU 177 HD22 LEU 177 4.817 2.812 6.455
196 3HD2 LEU 177 HD23 LEU 177 6.330 2.127 5.861
197 HA PRO 178 HA PRO 178 4.438 2.963 11.506
198 1HB PRO 178 HB2 PRO 178 2.393 0.890 12.053
199 2HB PRO 178 HB1 PRO 178 2.189 2.546 11.470
200 1HG PRO 178 HG2 PRO 178 1.855 0.469 9.835
201 2HG PRO 178 HG1 PRO 178 2.629 1.963 9.271
202 1HD PRO 178 HD2 PRO 178 3.883 -0.640 10.059
203 2HD PRO 178 HD1 PRO 178 4.280 0.437 8.706
204 H LEU 179 HN LEU 179 4.290 -0.440 12.599
205 HA LEU 179 HA LEU 179 4.318 0.241 15.352
206 1HB LEU 179 HB2 LEU 179 3.891 -2.066 13.860
207 2HB LEU 179 HB1 LEU 179 5.339 -2.418 14.785
208 HG LEU 179 HG LEU 179 3.735 -1.373 16.721
209 1HD1 LEU 179 HD11 LEU 179 1.528 -2.405 16.469
210 2HD1 LEU 179 HD12 LEU 179 1.949 -2.891 14.827
211 3HD1 LEU 179 HD13 LEU 179 1.824 -1.180 15.236
212 1HD2 LEU 179 HD21 LEU 179 3.381 -4.257 16.173
213 2HD2 LEU 179 HD22 LEU 179 3.896 -3.433 17.645
214 3HD2 LEU 179 HD23 LEU 179 5.038 -3.672 16.322
215 H ARG 180 HN ARG 180 6.761 0.319 13.064
216 HA ARG 180 HA ARG 180 8.764 0.638 15.147
217 1HB ARG 180 HB2 ARG 180 8.833 -1.488 13.032
218 2HB ARG 180 HB1 ARG 180 10.347 -0.743 13.558
219 1HG ARG 180 HG2 ARG 180 10.380 -1.930 15.435
220 2HG ARG 180 HG1 ARG 180 8.701 -1.536 15.805
221 1HD ARG 180 HD2 ARG 180 9.659 -3.708 13.943
222 2HD ARG 180 HD1 ARG 180 8.987 -3.938 15.557
223 HE ARG 180 HE ARG 180 7.249 -2.536 13.736
224 1HH1 ARG 180 1HH1 ARG 180 8.237 -5.657 14.945
225 2HH1 ARG 180 2HH1 ARG 180 6.753 -6.435 14.506
226 1HH2 ARG 180 1HH2 ARG 180 5.297 -3.558 13.159
227 2HH2 ARG 180 2HH2 ARG 180 5.085 -5.243 13.493
228 1HG HSL 181 HG1 HSL 181 7.107 6.586 12.343
229 2HG HSL 181 HG2 HSL 181 6.582 5.419 13.665
230 H HSL 181 HN HSL 181 7.822 2.735 14.155
231 HA HSL 181 HA HSL 181 9.627 3.601 11.837
232 1HB HSL 181 HB1 HSL 181 7.921 4.880 10.926
233 2HB HSL 181 HB2 HSL 181 6.789 3.798 11.907
Start of MODEL 67
1 1H PHE 155 HT1 PHE 155 5.603 12.534 -14.332
2 2H PHE 155 HT2 PHE 155 5.644 11.616 -15.781
3 3H PHE 155 HT3 PHE 155 7.108 12.082 -15.016
4 HA PHE 155 HA PHE 155 6.765 9.844 -14.544
5 1HB PHE 155 HB2 PHE 155 6.406 11.900 -12.442
6 2HB PHE 155 HB1 PHE 155 6.081 10.237 -11.963
7 HD1 PHE 155 HD1 PHE 155 8.424 12.472 -11.479
8 HD2 PHE 155 HD2 PHE 155 8.058 8.730 -13.473
9 HE1 PHE 155 HE1 PHE 155 10.837 12.090 -11.196
10 HE2 PHE 155 HE2 PHE 155 10.471 8.341 -13.193
11 HZ PHE 155 HZ PHE 155 11.864 10.021 -12.053
12 H LEU 156 HN LEU 156 5.441 8.111 -14.188
13 HA LEU 156 HA LEU 156 2.764 8.366 -13.252
14 1HB LEU 156 HB2 LEU 156 1.596 7.748 -15.256
15 2HB LEU 156 HB1 LEU 156 2.538 9.195 -15.568
16 HG LEU 156 HG LEU 156 3.810 6.604 -16.252
17 1HD1 LEU 156 HD11 LEU 156 2.640 6.424 -18.356
18 2HD1 LEU 156 HD12 LEU 156 1.629 7.810 -17.947
19 3HD1 LEU 156 HD13 LEU 156 1.489 6.312 -17.025
20 1HD2 LEU 156 HD21 LEU 156 4.698 9.024 -16.549
21 2HD2 LEU 156 HD22 LEU 156 3.631 9.056 -17.953
22 3HD2 LEU 156 HD23 LEU 156 4.917 7.853 -17.850
23 H GLN 157 HN GLN 157 5.282 6.770 -12.882
24 HA GLN 157 HA GLN 157 4.624 4.092 -13.677
25 1HB GLN 157 HB2 GLN 157 6.652 4.825 -11.580
26 2HB GLN 157 HB1 GLN 157 6.654 3.448 -12.672
27 1HG GLN 157 HG2 GLN 157 6.809 5.336 -14.503
28 2HG GLN 157 HG1 GLN 157 7.474 6.259 -13.156
29 1HE2 GLN 157 HE21 GLN 157 7.970 3.666 -15.373
30 2HE2 GLN 157 HE22 GLN 157 9.616 3.342 -14.961
31 H SER 158 HN SER 158 4.648 5.963 -10.686
32 HA SER 158 HA SER 158 3.548 3.799 -9.168
33 1HB SER 158 HB2 SER 158 3.356 6.270 -7.742
34 2HB SER 158 HB1 SER 158 4.459 4.913 -7.462
35 HG SER 158 HG SER 158 5.933 5.841 -8.829
36 H ASP 159 HN ASP 159 1.832 4.462 -11.305
37 HA ASP 159 HA ASP 159 -0.420 4.584 -11.641
38 1HB ASP 159 HB2 ASP 159 -0.258 4.109 -8.906
39 2HB ASP 159 HB1 ASP 159 -1.298 5.524 -9.034
40 H VAL 160 HN VAL 160 1.383 7.167 -10.296
41 HA VAL 160 HA VAL 160 1.434 9.351 -10.975
42 HB VAL 160 HB VAL 160 -1.334 8.906 -12.059
43 1HG1 VAL 160 HG11 VAL 160 -0.721 10.992 -13.396
44 2HG1 VAL 160 HG12 VAL 160 0.569 11.219 -12.215
45 3HG1 VAL 160 HG13 VAL 160 -1.114 11.215 -11.692
46 1HG2 VAL 160 HG21 VAL 160 0.999 9.270 -13.841
47 2HG2 VAL 160 HG22 VAL 160 -0.468 8.321 -14.076
48 3HG2 VAL 160 HG23 VAL 160 0.823 7.709 -13.042
49 H PHE 161 HN PHE 161 -1.827 8.392 -9.866
50 HA PHE 161 HA PHE 161 -2.260 10.765 -8.383
51 1HB PHE 161 HB2 PHE 161 -4.069 9.262 -9.201
52 2HB PHE 161 HB1 PHE 161 -3.577 8.069 -8.004
53 HD1 PHE 161 HD1 PHE 161 -5.709 10.788 -8.672
54 HD2 PHE 161 HD2 PHE 161 -3.541 8.902 -5.534
55 HE1 PHE 161 HE1 PHE 161 -7.186 11.853 -7.018
56 HE2 PHE 161 HE2 PHE 161 -5.015 9.962 -3.873
57 HZ PHE 161 HZ PHE 161 -6.840 11.440 -4.615
58 H PHE 162 HN PHE 162 -0.916 7.639 -7.578
59 HA PHE 162 HA PHE 162 -0.857 7.964 -4.762
60 1HB PHE 162 HB2 PHE 162 0.188 6.127 -6.772
61 2HB PHE 162 HB1 PHE 162 1.194 6.259 -5.332
62 HD1 PHE 162 HD1 PHE 162 -2.504 6.360 -5.740
63 HD2 PHE 162 HD2 PHE 162 0.855 4.319 -4.107
64 HE1 PHE 162 HE1 PHE 162 -4.017 4.822 -4.558
65 HE2 PHE 162 HE2 PHE 162 -0.654 2.777 -2.923
66 HZ PHE 162 HZ PHE 162 -3.093 3.027 -3.148
67 H LEU 163 HN LEU 163 1.739 8.138 -7.184
68 HA LEU 163 HA LEU 163 3.697 9.223 -5.448
69 1HB LEU 163 HB2 LEU 163 4.054 8.060 -7.674
70 2HB LEU 163 HB1 LEU 163 3.546 9.556 -8.434
71 HG LEU 163 HG LEU 163 5.446 10.734 -7.511
72 1HD1 LEU 163 HD11 LEU 163 5.718 9.754 -5.380
73 2HD1 LEU 163 HD12 LEU 163 7.196 9.400 -6.274
74 3HD1 LEU 163 HD13 LEU 163 5.970 8.149 -6.067
75 1HD2 LEU 163 HD21 LEU 163 6.726 8.235 -8.484
76 2HD2 LEU 163 HD22 LEU 163 7.008 9.912 -8.955
77 3HD2 LEU 163 HD23 LEU 163 5.586 9.055 -9.550
78 H PHE 164 HN PHE 164 0.904 10.501 -6.550
79 HA PHE 164 HA PHE 164 1.627 13.144 -7.236
80 1HB PHE 164 HB2 PHE 164 -0.591 11.595 -7.492
81 2HB PHE 164 HB1 PHE 164 -1.070 12.610 -6.139
82 HD1 PHE 164 HD1 PHE 164 -2.472 12.620 -8.757
83 HD2 PHE 164 HD2 PHE 164 0.810 14.938 -7.354
84 HE1 PHE 164 HE1 PHE 164 -3.085 14.423 -10.312
85 HE2 PHE 164 HE2 PHE 164 0.202 16.745 -8.907
86 HZ PHE 164 HZ PHE 164 -1.747 16.489 -10.389
87 H LEU 165 HN LEU 165 -0.523 12.351 -4.505
88 HA LEU 165 HA LEU 165 0.379 14.611 -3.023
89 1HB LEU 165 HB2 LEU 165 -0.946 12.453 -1.509
90 2HB LEU 165 HB1 LEU 165 -1.295 14.171 -1.563
91 HG LEU 165 HG LEU 165 -2.126 13.405 -4.045
92 1HD1 LEU 165 HD11 LEU 165 -3.323 11.252 -2.420
93 2HD1 LEU 165 HD12 LEU 165 -1.666 10.996 -2.967
94 3HD1 LEU 165 HD13 LEU 165 -2.945 11.304 -4.142
95 1HD2 LEU 165 HD21 LEU 165 -3.620 13.568 -1.440
96 2HD2 LEU 165 HD22 LEU 165 -4.425 13.393 -2.999
97 3HD2 LEU 165 HD23 LEU 165 -3.436 14.816 -2.671
98 H LEU 166 HN LEU 166 0.460 11.182 -2.144
99 HA LEU 166 HA LEU 166 3.224 11.249 -1.415
100 1HB LEU 166 HB2 LEU 166 2.653 12.313 0.550
101 2HB LEU 166 HB1 LEU 166 1.069 11.563 0.617
102 HG LEU 166 HG LEU 166 3.339 9.708 0.964
103 1HD1 LEU 166 HD11 LEU 166 2.742 11.850 2.995
104 2HD1 LEU 166 HD12 LEU 166 4.275 11.552 2.176
105 3HD1 LEU 166 HD13 LEU 166 3.651 10.378 3.335
106 1HD2 LEU 166 HD21 LEU 166 1.753 9.202 3.001
107 2HD2 LEU 166 HD22 LEU 166 1.330 8.688 1.367
108 3HD2 LEU 166 HD23 LEU 166 0.602 10.142 2.049
109 HA PRO 167 HA PRO 167 2.432 6.972 -2.352
110 1HB PRO 167 HB2 PRO 167 4.776 5.912 -1.470
111 2HB PRO 167 HB1 PRO 167 4.614 6.779 -3.009
112 1HG PRO 167 HG2 PRO 167 5.647 7.764 -0.375
113 2HG PRO 167 HG1 PRO 167 6.274 8.062 -2.006
114 1HD PRO 167 HD2 PRO 167 4.775 9.879 -0.675
115 2HD PRO 167 HD1 PRO 167 4.718 9.709 -2.441
116 HA PRO 168 HA PRO 168 1.166 5.767 1.818
117 1HB PRO 168 HB2 PRO 168 -0.935 4.296 1.128
118 2HB PRO 168 HB1 PRO 168 -0.971 6.063 0.951
119 1HG PRO 168 HG2 PRO 168 -0.464 3.965 -1.135
120 2HG PRO 168 HG1 PRO 168 -1.499 5.402 -1.229
121 1HD PRO 168 HD2 PRO 168 1.056 5.269 -2.232
122 2HD PRO 168 HD1 PRO 168 0.261 6.775 -1.730
123 H ILE 169 HN ILE 169 3.131 4.214 -0.087
124 HA ILE 169 HA ILE 169 2.510 1.474 0.412
125 HB ILE 169 HB ILE 169 3.821 1.935 -1.514
126 1HG1 ILE 169 HG12 ILE 169 6.142 0.867 -0.179
127 2HG1 ILE 169 HG11 ILE 169 4.681 0.143 0.485
128 1HG2 ILE 169 HG21 ILE 169 5.101 3.744 -1.530
129 2HG2 ILE 169 HG22 ILE 169 6.330 2.785 -0.707
130 3HG2 ILE 169 HG23 ILE 169 5.209 3.772 0.230
131 1HD1 ILE 169 HD11 ILE 169 4.415 0.178 -2.328
132 2HD1 ILE 169 HD12 ILE 169 4.582 -1.211 -1.253
133 3HD1 ILE 169 HD13 ILE 169 6.017 -0.450 -1.942
134 H ILE 170 HN ILE 170 5.770 2.178 1.284
135 HA ILE 170 HA ILE 170 6.909 1.473 3.152
136 HB ILE 170 HB ILE 170 5.178 3.612 4.382
137 1HG1 ILE 170 HG12 ILE 170 7.784 4.117 2.971
138 2HG1 ILE 170 HG11 ILE 170 6.267 4.111 2.078
139 1HG2 ILE 170 HG21 ILE 170 7.199 4.084 5.704
140 2HG2 ILE 170 HG22 ILE 170 8.003 2.714 4.937
141 3HG2 ILE 170 HG23 ILE 170 6.594 2.448 5.965
142 1HD1 ILE 170 HD11 ILE 170 6.715 5.836 4.491
143 2HD1 ILE 170 HD12 ILE 170 5.443 5.960 3.276
144 3HD1 ILE 170 HD13 ILE 170 7.109 6.354 2.852
145 H LEU 171 HN LEU 171 3.661 2.210 4.309
146 HA LEU 171 HA LEU 171 3.750 0.406 6.489
147 1HB LEU 171 HB2 LEU 171 1.063 0.967 5.467
148 2HB LEU 171 HB1 LEU 171 1.737 1.234 7.059
149 HG LEU 171 HG LEU 171 1.934 3.069 4.670
150 1HD1 LEU 171 HD11 LEU 171 -0.110 2.823 6.378
151 2HD1 LEU 171 HD12 LEU 171 0.371 4.360 5.661
152 3HD1 LEU 171 HD13 LEU 171 0.899 3.943 7.292
153 1HD2 LEU 171 HD21 LEU 171 3.909 2.761 6.542
154 2HD2 LEU 171 HD22 LEU 171 2.927 4.047 7.242
155 3HD2 LEU 171 HD23 LEU 171 3.597 4.231 5.621
156 H ASP 172 HN ASP 172 2.083 0.181 3.351
157 HA ASP 172 HA ASP 172 1.219 -2.495 3.786
158 1HB ASP 172 HB2 ASP 172 0.513 -0.516 2.031
159 2HB ASP 172 HB1 ASP 172 1.429 -1.612 0.987
160 H ALA 173 HN ALA 173 4.226 -1.198 3.047
161 HA ALA 173 HA ALA 173 5.150 -3.279 1.311
162 1HB ALA 173 HB1 ALA 173 6.029 -0.788 1.775
163 2HB ALA 173 HB2 ALA 173 7.044 -2.064 1.101
164 3HB ALA 173 HB3 ALA 173 7.123 -1.691 2.823
165 H GLY 174 HN GLY 174 5.827 -2.408 4.703
166 1HA GLY 174 HA2 GLY 174 6.690 -5.207 5.126
167 2HA GLY 174 HA1 GLY 174 7.331 -3.822 6.027
168 H TYR 175 HN TYR 175 4.357 -2.862 5.966
169 HA TYR 175 HA TYR 175 2.516 -2.954 7.288
170 1HB TYR 175 HB2 TYR 175 2.213 -5.261 6.665
171 2HB TYR 175 HB1 TYR 175 3.447 -5.784 7.804
172 HD1 TYR 175 HD1 TYR 175 2.233 -7.223 9.206
173 HD2 TYR 175 HD2 TYR 175 0.733 -3.322 8.409
174 HE1 TYR 175 HE1 TYR 175 0.515 -7.536 10.936
175 HE2 TYR 175 HE2 TYR 175 -0.989 -3.625 10.138
176 HH TYR 175 HH TYR 175 -0.881 -5.879 12.466
177 H PHE 176 HN PHE 176 5.394 -4.372 8.846
178 HA PHE 176 HA PHE 176 4.587 -3.228 11.399
179 1HB PHE 176 HB2 PHE 176 5.390 -5.485 11.510
180 2HB PHE 176 HB1 PHE 176 6.845 -5.072 10.596
181 HD1 PHE 176 HD1 PHE 176 5.119 -4.637 13.835
182 HD2 PHE 176 HD2 PHE 176 8.764 -4.236 11.675
183 HE1 PHE 176 HE1 PHE 176 6.320 -4.232 15.944
184 HE2 PHE 176 HE2 PHE 176 9.972 -3.831 13.780
185 HZ PHE 176 HZ PHE 176 8.750 -3.829 15.918
186 H LEU 177 HN LEU 177 6.102 -2.047 8.754
187 HA LEU 177 HA LEU 177 8.389 -0.796 9.893
188 1HB LEU 177 HB2 LEU 177 6.829 -0.094 7.407
189 2HB LEU 177 HB1 LEU 177 8.392 0.571 7.837
190 HG LEU 177 HG LEU 177 7.798 -2.313 7.182
191 1HD1 LEU 177 HD11 LEU 177 7.853 -1.207 5.148
192 2HD1 LEU 177 HD12 LEU 177 9.528 -1.721 5.355
193 3HD1 LEU 177 HD13 LEU 177 9.070 -0.052 5.693
194 1HD2 LEU 177 HD21 LEU 177 9.496 -2.497 8.736
195 2HD2 LEU 177 HD22 LEU 177 10.220 -0.954 8.282
196 3HD2 LEU 177 HD23 LEU 177 10.395 -2.354 7.224
197 HA PRO 178 HA PRO 178 5.191 3.046 9.887
198 1HB PRO 178 HB2 PRO 178 2.981 1.368 10.987
199 2HB PRO 178 HB1 PRO 178 2.900 2.798 9.951
200 1HG PRO 178 HG2 PRO 178 2.518 0.372 8.933
201 2HG PRO 178 HG1 PRO 178 3.426 1.601 8.036
202 1HD PRO 178 HD2 PRO 178 4.420 -0.791 9.510
203 2HD PRO 178 HD1 PRO 178 5.042 -0.034 8.032
204 H LEU 179 HN LEU 179 5.515 0.339 12.079
205 HA LEU 179 HA LEU 179 4.870 1.690 14.476
206 1HB LEU 179 HB2 LEU 179 5.804 -0.897 13.698
207 2HB LEU 179 HB1 LEU 179 6.812 -0.313 15.009
208 HG LEU 179 HG LEU 179 4.727 0.108 16.332
209 1HD1 LEU 179 HD11 LEU 179 3.379 0.006 14.054
210 2HD1 LEU 179 HD12 LEU 179 2.646 -0.435 15.596
211 3HD1 LEU 179 HD13 LEU 179 3.235 -1.692 14.509
212 1HD2 LEU 179 HD21 LEU 179 4.643 -2.762 15.620
213 2HD2 LEU 179 HD22 LEU 179 4.783 -1.987 17.198
214 3HD2 LEU 179 HD23 LEU 179 6.194 -2.111 16.148
215 H ARG 180 HN ARG 180 8.065 0.737 13.233
216 HA ARG 180 HA ARG 180 9.327 2.710 14.958
217 1HB ARG 180 HB2 ARG 180 11.457 1.714 14.014
218 2HB ARG 180 HB1 ARG 180 10.446 0.623 14.965
219 1HG ARG 180 HG2 ARG 180 10.019 0.673 12.029
220 2HG ARG 180 HG1 ARG 180 11.509 -0.058 12.621
221 1HD ARG 180 HD2 ARG 180 8.710 -0.979 12.865
222 2HD ARG 180 HD1 ARG 180 10.194 -1.904 12.680
223 HE ARG 180 HE ARG 180 8.879 -1.239 15.124
224 1HH1 ARG 180 1HH1 ARG 180 12.005 -1.856 13.699
225 2HH1 ARG 180 2HH1 ARG 180 12.716 -2.390 15.185
226 1HH2 ARG 180 1HH2 ARG 180 9.814 -1.941 17.080
227 2HH2 ARG 180 2HH2 ARG 180 11.473 -2.439 17.104
228 1HG HSL 181 HG1 HSL 181 6.186 7.069 10.799
229 2HG HSL 181 HG2 HSL 181 5.957 5.974 12.260
230 H HSL 181 HN HSL 181 7.848 4.141 13.396
231 HA HSL 181 HA HSL 181 9.690 5.203 11.187
232 1HB HSL 181 HB1 HSL 181 7.871 5.705 9.823
233 2HB HSL 181 HB2 HSL 181 7.020 4.380 10.786
Start of MODEL 68
1 1H PHE 155 HT1 PHE 155 -9.004 -1.754 10.250
2 2H PHE 155 HT2 PHE 155 -8.934 -3.400 9.768
3 3H PHE 155 HT3 PHE 155 -9.373 -2.992 11.376
4 HA PHE 155 HA PHE 155 -11.225 -3.653 9.939
5 1HB PHE 155 HB2 PHE 155 -12.619 -1.688 10.674
6 2HB PHE 155 HB1 PHE 155 -11.631 -2.398 11.946
7 HD1 PHE 155 HD1 PHE 155 -12.413 0.570 10.100
8 HD2 PHE 155 HD2 PHE 155 -9.474 -1.260 12.573
9 HE1 PHE 155 HE1 PHE 155 -11.434 2.779 10.563
10 HE2 PHE 155 HE2 PHE 155 -8.489 0.946 13.043
11 HZ PHE 155 HZ PHE 155 -9.470 2.969 12.036
12 H LEU 156 HN LEU 156 -12.805 -2.823 8.390
13 HA LEU 156 HA LEU 156 -13.401 -2.029 6.350
14 1HB LEU 156 HB2 LEU 156 -11.587 0.129 7.335
15 2HB LEU 156 HB1 LEU 156 -12.184 0.189 5.688
16 HG LEU 156 HG LEU 156 -14.190 -0.214 7.840
17 1HD1 LEU 156 HD11 LEU 156 -13.976 1.762 8.852
18 2HD1 LEU 156 HD12 LEU 156 -13.633 2.603 7.340
19 3HD1 LEU 156 HD13 LEU 156 -12.337 1.774 8.204
20 1HD2 LEU 156 HD21 LEU 156 -14.687 -0.121 5.378
21 2HD2 LEU 156 HD22 LEU 156 -14.216 1.578 5.421
22 3HD2 LEU 156 HD23 LEU 156 -15.591 1.020 6.374
23 H GLN 157 HN GLN 157 -10.057 -0.884 6.210
24 HA GLN 157 HA GLN 157 -9.051 -3.077 4.726
25 1HB GLN 157 HB2 GLN 157 -8.744 -1.806 2.563
26 2HB GLN 157 HB1 GLN 157 -10.389 -2.324 2.906
27 1HG GLN 157 HG2 GLN 157 -11.147 -0.204 3.214
28 2HG GLN 157 HG1 GLN 157 -9.589 0.390 3.787
29 1HE2 GLN 157 HE21 GLN 157 -7.868 -0.152 1.857
30 2HE2 GLN 157 HE22 GLN 157 -8.312 0.610 0.372
31 H SER 158 HN SER 158 -7.446 -2.743 6.335
32 HA SER 158 HA SER 158 -5.494 -1.943 7.185
33 1HB SER 158 HB2 SER 158 -3.841 -1.206 5.628
34 2HB SER 158 HB1 SER 158 -4.858 -2.366 4.755
35 HG SER 158 HG SER 158 -4.358 -0.318 3.654
36 H ASP 159 HN ASP 159 -7.016 -0.565 8.469
37 HA ASP 159 HA ASP 159 -7.268 1.400 9.605
38 1HB ASP 159 HB2 ASP 159 -4.878 1.835 8.169
39 2HB ASP 159 HB1 ASP 159 -5.866 3.271 7.915
40 H VAL 160 HN VAL 160 -7.056 2.170 6.133
41 HA VAL 160 HA VAL 160 -8.739 2.748 4.675
42 HB VAL 160 HB VAL 160 -10.348 1.939 6.714
43 1HG1 VAL 160 HG11 VAL 160 -10.322 4.209 7.737
44 2HG1 VAL 160 HG12 VAL 160 -11.932 3.662 7.278
45 3HG1 VAL 160 HG13 VAL 160 -11.080 4.834 6.274
46 1HG2 VAL 160 HG21 VAL 160 -12.234 2.747 5.086
47 2HG2 VAL 160 HG22 VAL 160 -11.092 1.494 4.596
48 3HG2 VAL 160 HG23 VAL 160 -10.869 3.156 4.047
49 H PHE 161 HN PHE 161 -8.469 4.710 7.631
50 HA PHE 161 HA PHE 161 -8.934 7.187 6.296
51 1HB PHE 161 HB2 PHE 161 -7.546 6.694 8.941
52 2HB PHE 161 HB1 PHE 161 -8.211 8.226 8.382
53 HD1 PHE 161 HD1 PHE 161 -10.788 7.264 7.236
54 HD2 PHE 161 HD2 PHE 161 -8.797 6.274 10.865
55 HE1 PHE 161 HE1 PHE 161 -12.951 6.702 8.265
56 HE2 PHE 161 HE2 PHE 161 -10.956 5.709 11.900
57 HZ PHE 161 HZ PHE 161 -13.037 5.923 10.599
58 H PHE 162 HN PHE 162 -6.140 5.242 6.997
59 HA PHE 162 HA PHE 162 -4.129 7.164 6.451
60 1HB PHE 162 HB2 PHE 162 -4.340 4.275 6.880
61 2HB PHE 162 HB1 PHE 162 -2.990 4.760 5.853
62 HD1 PHE 162 HD1 PHE 162 -1.074 5.810 6.764
63 HD2 PHE 162 HD2 PHE 162 -4.508 5.163 9.193
64 HE1 PHE 162 HE1 PHE 162 0.235 6.398 8.763
65 HE2 PHE 162 HE2 PHE 162 -3.206 5.751 11.196
66 HZ PHE 162 HZ PHE 162 -0.831 6.368 10.983
67 H LEU 163 HN LEU 163 -5.308 4.416 4.516
68 HA LEU 163 HA LEU 163 -3.990 5.176 2.124
69 1HB LEU 163 HB2 LEU 163 -4.920 2.891 2.756
70 2HB LEU 163 HB1 LEU 163 -6.499 3.529 2.341
71 HG LEU 163 HG LEU 163 -5.156 4.112 0.073
72 1HD1 LEU 163 HD11 LEU 163 -3.219 3.044 -0.081
73 2HD1 LEU 163 HD12 LEU 163 -4.089 1.513 0.017
74 3HD1 LEU 163 HD13 LEU 163 -3.474 2.273 1.484
75 1HD2 LEU 163 HD21 LEU 163 -7.078 3.023 -0.368
76 2HD2 LEU 163 HD22 LEU 163 -6.883 1.908 0.984
77 3HD2 LEU 163 HD23 LEU 163 -6.015 1.626 -0.524
78 H PHE 164 HN PHE 164 -6.446 6.585 3.765
79 HA PHE 164 HA PHE 164 -8.196 7.391 1.678
80 1HB PHE 164 HB2 PHE 164 -8.210 7.341 4.443
81 2HB PHE 164 HB1 PHE 164 -8.106 9.060 4.079
82 HD1 PHE 164 HD1 PHE 164 -10.028 6.037 3.036
83 HD2 PHE 164 HD2 PHE 164 -10.058 10.232 3.751
84 HE1 PHE 164 HE1 PHE 164 -12.449 6.090 2.601
85 HE2 PHE 164 HE2 PHE 164 -12.479 10.293 3.317
86 HZ PHE 164 HZ PHE 164 -13.678 8.220 2.742
87 H LEU 165 HN LEU 165 -5.835 9.169 3.685
88 HA LEU 165 HA LEU 165 -5.941 11.546 2.168
89 1HB LEU 165 HB2 LEU 165 -4.616 10.618 4.490
90 2HB LEU 165 HB1 LEU 165 -3.385 11.253 3.413
91 HG LEU 165 HG LEU 165 -4.066 13.017 4.876
92 1HD1 LEU 165 HD11 LEU 165 -3.803 13.420 2.347
93 2HD1 LEU 165 HD12 LEU 165 -4.536 14.687 3.330
94 3HD1 LEU 165 HD13 LEU 165 -5.553 13.630 2.350
95 1HD2 LEU 165 HD21 LEU 165 -6.308 11.916 5.376
96 2HD2 LEU 165 HD22 LEU 165 -6.903 12.734 3.931
97 3HD2 LEU 165 HD23 LEU 165 -6.282 13.677 5.285
98 H LEU 166 HN LEU 166 -3.547 8.934 2.261
99 HA LEU 166 HA LEU 166 -2.986 9.212 -0.543
100 1HB LEU 166 HB2 LEU 166 -1.493 10.885 -0.118
101 2HB LEU 166 HB1 LEU 166 -1.219 10.367 1.535
102 HG LEU 166 HG LEU 166 -0.141 8.601 -0.591
103 1HD1 LEU 166 HD11 LEU 166 0.743 10.374 -1.681
104 2HD1 LEU 166 HD12 LEU 166 1.941 10.265 -0.391
105 3HD1 LEU 166 HD13 LEU 166 0.627 11.437 -0.279
106 1HD2 LEU 166 HD21 LEU 166 1.671 8.358 0.989
107 2HD2 LEU 166 HD22 LEU 166 0.129 8.154 1.822
108 3HD2 LEU 166 HD23 LEU 166 1.023 9.667 1.979
109 HA PRO 167 HA PRO 167 -2.236 4.903 0.053
110 1HB PRO 167 HB2 PRO 167 -0.537 4.430 -2.051
111 2HB PRO 167 HB1 PRO 167 -2.302 4.539 -2.187
112 1HG PRO 167 HG2 PRO 167 -0.221 6.612 -2.764
113 2HG PRO 167 HG1 PRO 167 -1.703 6.231 -3.661
114 1HD PRO 167 HD2 PRO 167 -1.545 8.353 -2.011
115 2HD PRO 167 HD1 PRO 167 -3.044 7.419 -2.195
116 HA PRO 168 HA PRO 168 1.774 5.088 2.101
117 1HB PRO 168 HB2 PRO 168 1.195 3.474 4.110
118 2HB PRO 168 HB1 PRO 168 0.389 5.050 3.989
119 1HG PRO 168 HG2 PRO 168 -0.643 2.333 3.260
120 2HG PRO 168 HG1 PRO 168 -1.477 3.661 4.084
121 1HD PRO 168 HD2 PRO 168 -1.644 3.070 1.365
122 2HD PRO 168 HD1 PRO 168 -2.097 4.611 2.117
123 H ILE 169 HN ILE 169 2.981 4.040 0.471
124 HA ILE 169 HA ILE 169 2.789 1.243 -0.044
125 HB ILE 169 HB ILE 169 3.765 3.157 -1.523
126 1HG1 ILE 169 HG12 ILE 169 5.394 0.643 -1.572
127 2HG1 ILE 169 HG11 ILE 169 3.660 0.566 -1.866
128 1HG2 ILE 169 HG21 ILE 169 6.256 2.290 -0.068
129 2HG2 ILE 169 HG22 ILE 169 5.491 3.875 0.044
130 3HG2 ILE 169 HG23 ILE 169 6.190 3.339 -1.484
131 1HD1 ILE 169 HD11 ILE 169 4.547 0.723 -3.990
132 2HD1 ILE 169 HD12 ILE 169 5.795 1.867 -3.495
133 3HD1 ILE 169 HD13 ILE 169 4.117 2.394 -3.627
134 H ILE 170 HN ILE 170 4.837 3.254 1.946
135 HA ILE 170 HA ILE 170 6.665 1.241 2.742
136 HB ILE 170 HB ILE 170 5.993 3.771 4.243
137 1HG1 ILE 170 HG12 ILE 170 8.381 3.765 2.537
138 2HG1 ILE 170 HG11 ILE 170 6.873 3.648 1.637
139 1HG2 ILE 170 HG21 ILE 170 8.304 3.570 5.065
140 2HG2 ILE 170 HG22 ILE 170 8.459 2.038 4.206
141 3HG2 ILE 170 HG23 ILE 170 7.304 2.193 5.530
142 1HD1 ILE 170 HD11 ILE 170 7.677 5.959 1.934
143 2HD1 ILE 170 HD12 ILE 170 7.478 5.772 3.676
144 3HD1 ILE 170 HD13 ILE 170 6.073 5.686 2.614
145 H LEU 171 HN LEU 171 3.552 2.308 3.942
146 HA LEU 171 HA LEU 171 3.702 1.058 6.487
147 1HB LEU 171 HB2 LEU 171 2.027 2.783 5.931
148 2HB LEU 171 HB1 LEU 171 1.280 1.682 4.789
149 HG LEU 171 HG LEU 171 1.284 0.254 7.170
150 1HD1 LEU 171 HD11 LEU 171 0.024 2.792 7.969
151 2HD1 LEU 171 HD12 LEU 171 1.787 2.759 8.011
152 3HD1 LEU 171 HD13 LEU 171 0.862 1.580 8.940
153 1HD2 LEU 171 HD21 LEU 171 -0.613 -0.023 5.960
154 2HD2 LEU 171 HD22 LEU 171 -0.697 1.676 5.494
155 3HD2 LEU 171 HD23 LEU 171 -1.218 1.176 7.103
156 H ASP 172 HN ASP 172 1.900 0.110 3.575
157 HA ASP 172 HA ASP 172 1.603 -2.600 4.463
158 1HB ASP 172 HB2 ASP 172 0.692 -0.961 2.185
159 2HB ASP 172 HB1 ASP 172 0.970 -2.667 1.803
160 H ALA 173 HN ALA 173 4.285 -1.049 3.455
161 HA ALA 173 HA ALA 173 5.307 -2.822 1.479
162 1HB ALA 173 HB1 ALA 173 6.384 -0.609 3.116
163 2HB ALA 173 HB2 ALA 173 6.506 -0.897 1.381
164 3HB ALA 173 HB3 ALA 173 7.547 -1.779 2.498
165 H GLY 174 HN GLY 174 5.768 -2.428 4.957
166 1HA GLY 174 HA2 GLY 174 6.722 -5.224 5.093
167 2HA GLY 174 HA1 GLY 174 7.419 -3.932 6.089
168 H TYR 175 HN TYR 175 4.289 -3.118 5.924
169 HA TYR 175 HA TYR 175 2.472 -3.268 7.247
170 1HB TYR 175 HB2 TYR 175 3.581 -6.027 7.504
171 2HB TYR 175 HB1 TYR 175 2.231 -5.538 8.520
172 HD1 TYR 175 HD1 TYR 175 3.230 -6.723 5.302
173 HD2 TYR 175 HD2 TYR 175 0.131 -4.655 7.355
174 HE1 TYR 175 HE1 TYR 175 1.686 -7.216 3.453
175 HE2 TYR 175 HE2 TYR 175 -1.422 -5.143 5.513
176 HH TYR 175 HH TYR 175 -0.682 -7.379 3.025
177 H PHE 176 HN PHE 176 5.306 -4.645 8.947
178 HA PHE 176 HA PHE 176 4.430 -3.320 11.395
179 1HB PHE 176 HB2 PHE 176 6.215 -5.584 10.746
180 2HB PHE 176 HB1 PHE 176 6.737 -4.568 12.097
181 HD1 PHE 176 HD1 PHE 176 6.346 -5.850 13.986
182 HD2 PHE 176 HD2 PHE 176 3.298 -5.512 11.036
183 HE1 PHE 176 HE1 PHE 176 4.780 -7.027 15.475
184 HE2 PHE 176 HE2 PHE 176 1.725 -6.688 12.519
185 HZ PHE 176 HZ PHE 176 2.466 -7.447 14.742
186 H LEU 177 HN LEU 177 5.947 -2.281 8.793
187 HA LEU 177 HA LEU 177 8.247 -1.021 10.018
188 1HB LEU 177 HB2 LEU 177 7.103 -0.864 7.235
189 2HB LEU 177 HB1 LEU 177 8.555 -0.026 7.748
190 HG LEU 177 HG LEU 177 8.178 -3.022 7.685
191 1HD1 LEU 177 HD11 LEU 177 9.628 -1.101 5.887
192 2HD1 LEU 177 HD12 LEU 177 8.391 -2.282 5.460
193 3HD1 LEU 177 HD13 LEU 177 9.999 -2.824 5.938
194 1HD2 LEU 177 HD21 LEU 177 10.488 -1.294 8.539
195 2HD2 LEU 177 HD22 LEU 177 10.665 -2.995 8.107
196 3HD2 LEU 177 HD23 LEU 177 9.650 -2.533 9.473
197 HA PRO 178 HA PRO 178 4.857 2.589 8.982
198 1HB PRO 178 HB2 PRO 178 3.161 1.305 11.088
199 2HB PRO 178 HB1 PRO 178 2.681 2.331 9.730
200 1HG PRO 178 HG2 PRO 178 2.367 -0.294 9.583
201 2HG PRO 178 HG1 PRO 178 2.947 0.618 8.178
202 1HD PRO 178 HD2 PRO 178 4.446 -1.152 10.038
203 2HD PRO 178 HD1 PRO 178 4.698 -0.867 8.306
204 H LEU 179 HN LEU 179 6.084 0.959 11.803
205 HA LEU 179 HA LEU 179 5.718 2.693 13.859
206 1HB LEU 179 HB2 LEU 179 7.815 0.800 13.093
207 2HB LEU 179 HB1 LEU 179 8.383 2.076 14.153
208 HG LEU 179 HG LEU 179 6.091 1.282 15.428
209 1HD1 LEU 179 HD11 LEU 179 6.674 -1.316 15.477
210 2HD1 LEU 179 HD12 LEU 179 7.112 -0.973 13.804
211 3HD1 LEU 179 HD13 LEU 179 5.479 -0.631 14.377
212 1HD2 LEU 179 HD21 LEU 179 7.676 -0.002 16.914
213 2HD2 LEU 179 HD22 LEU 179 8.106 1.680 16.603
214 3HD2 LEU 179 HD23 LEU 179 8.944 0.383 15.750
215 H ARG 180 HN ARG 180 7.754 3.121 11.089
216 HA ARG 180 HA ARG 180 8.211 5.898 11.870
217 1HB ARG 180 HB2 ARG 180 10.566 4.729 10.593
218 2HB ARG 180 HB1 ARG 180 10.452 5.758 12.021
219 1HG ARG 180 HG2 ARG 180 11.357 3.859 12.908
220 2HG ARG 180 HG1 ARG 180 9.640 3.557 13.171
221 1HD ARG 180 HD2 ARG 180 9.585 2.242 11.081
222 2HD ARG 180 HD1 ARG 180 11.322 2.498 10.904
223 HE ARG 180 HE ARG 180 10.498 1.288 13.399
224 1HH1 ARG 180 1HH1 ARG 180 11.575 0.742 10.121
225 2HH1 ARG 180 2HH1 ARG 180 12.159 -0.854 10.449
226 1HH2 ARG 180 1HH2 ARG 180 11.267 -0.811 13.827
227 2HH2 ARG 180 2HH2 ARG 180 11.983 -1.736 12.550
228 1HG HSL 181 HG1 HSL 181 4.932 5.661 5.731
229 2HG HSL 181 HG2 HSL 181 3.495 5.368 6.842
230 H HSL 181 HN HSL 181 6.303 5.438 10.273
231 HA HSL 181 HA HSL 181 7.355 5.819 7.422
232 1HB HSL 181 HB1 HSL 181 5.949 3.956 7.061
233 2HB HSL 181 HB2 HSL 181 4.896 4.347 8.525
Start of MODEL 69
1 1H PHE 155 HT1 PHE 155 -3.712 13.562 -2.103
2 2H PHE 155 HT2 PHE 155 -3.779 12.333 -3.299
3 3H PHE 155 HT3 PHE 155 -5.152 12.659 -2.322
4 HA PHE 155 HA PHE 155 -5.173 14.915 -3.260
5 1HB PHE 155 HB2 PHE 155 -2.826 13.744 -4.583
6 2HB PHE 155 HB1 PHE 155 -3.919 14.599 -5.664
7 HD1 PHE 155 HD1 PHE 155 -2.448 16.390 -6.192
8 HD2 PHE 155 HD2 PHE 155 -3.405 15.519 -2.136
9 HE1 PHE 155 HE1 PHE 155 -1.459 18.535 -5.501
10 HE2 PHE 155 HE2 PHE 155 -2.417 17.662 -1.440
11 HZ PHE 155 HZ PHE 155 -1.444 19.172 -3.123
12 H LEU 156 HN LEU 156 -4.558 12.536 -5.800
13 HA LEU 156 HA LEU 156 -7.268 11.708 -5.991
14 1HB LEU 156 HB2 LEU 156 -7.652 12.706 -8.228
15 2HB LEU 156 HB1 LEU 156 -7.576 13.868 -6.920
16 HG LEU 156 HG LEU 156 -4.978 13.528 -8.089
17 1HD1 LEU 156 HD11 LEU 156 -5.266 13.896 -10.300
18 2HD1 LEU 156 HD12 LEU 156 -6.754 14.814 -10.064
19 3HD1 LEU 156 HD13 LEU 156 -6.787 13.052 -10.006
20 1HD2 LEU 156 HD21 LEU 156 -5.648 16.067 -8.602
21 2HD2 LEU 156 HD22 LEU 156 -5.142 15.506 -7.009
22 3HD2 LEU 156 HD23 LEU 156 -6.857 15.688 -7.376
23 H GLN 157 HN GLN 157 -4.074 11.931 -7.472
24 HA GLN 157 HA GLN 157 -2.876 10.487 -8.766
25 1HB GLN 157 HB2 GLN 157 -3.581 9.099 -6.645
26 2HB GLN 157 HB1 GLN 157 -4.567 8.216 -7.800
27 1HG GLN 157 HG2 GLN 157 -1.721 8.652 -8.488
28 2HG GLN 157 HG1 GLN 157 -2.084 7.510 -7.197
29 1HE2 GLN 157 HE21 GLN 157 -4.285 6.256 -7.970
30 2HE2 GLN 157 HE22 GLN 157 -4.053 5.430 -9.469
31 H SER 158 HN SER 158 -5.446 11.598 -9.790
32 HA SER 158 HA SER 158 -6.877 11.394 -11.544
33 1HB SER 158 HB2 SER 158 -4.337 10.116 -12.507
34 2HB SER 158 HB1 SER 158 -5.762 10.150 -13.559
35 HG SER 158 HG SER 158 -4.450 12.381 -12.389
36 H ASP 159 HN ASP 159 -7.252 9.501 -9.510
37 HA ASP 159 HA ASP 159 -8.909 7.615 -10.877
38 1HB ASP 159 HB2 ASP 159 -6.287 6.769 -9.768
39 2HB ASP 159 HB1 ASP 159 -7.666 5.725 -9.439
40 H VAL 160 HN VAL 160 -7.214 8.044 -7.798
41 HA VAL 160 HA VAL 160 -7.964 8.361 -5.685
42 HB VAL 160 HB VAL 160 -10.079 9.462 -7.279
43 1HG1 VAL 160 HG11 VAL 160 -11.048 7.876 -4.910
44 2HG1 VAL 160 HG12 VAL 160 -11.619 7.804 -6.577
45 3HG1 VAL 160 HG13 VAL 160 -11.939 9.233 -5.597
46 1HG2 VAL 160 HG21 VAL 160 -9.958 10.097 -4.406
47 2HG2 VAL 160 HG22 VAL 160 -9.895 11.161 -5.812
48 3HG2 VAL 160 HG23 VAL 160 -8.452 10.286 -5.303
49 H PHE 161 HN PHE 161 -10.452 6.496 -7.490
50 HA PHE 161 HA PHE 161 -10.829 4.654 -5.334
51 1HB PHE 161 HB2 PHE 161 -11.592 4.500 -8.261
52 2HB PHE 161 HB1 PHE 161 -12.078 3.317 -7.051
53 HD1 PHE 161 HD1 PHE 161 -13.329 5.850 -8.885
54 HD2 PHE 161 HD2 PHE 161 -12.969 4.720 -4.798
55 HE1 PHE 161 HE1 PHE 161 -15.293 7.227 -8.334
56 HE2 PHE 161 HE2 PHE 161 -14.933 6.093 -4.240
57 HZ PHE 161 HZ PHE 161 -16.097 7.349 -6.010
58 H PHE 162 HN PHE 162 -8.229 4.822 -5.559
59 HA PHE 162 HA PHE 162 -7.334 2.190 -6.177
60 1HB PHE 162 HB2 PHE 162 -7.288 4.092 -8.221
61 2HB PHE 162 HB1 PHE 162 -5.629 3.996 -7.636
62 HD1 PHE 162 HD1 PHE 162 -8.384 2.114 -9.180
63 HD2 PHE 162 HD2 PHE 162 -4.295 2.045 -8.003
64 HE1 PHE 162 HE1 PHE 162 -8.046 0.060 -10.490
65 HE2 PHE 162 HE2 PHE 162 -3.948 -0.009 -9.314
66 HZ PHE 162 HZ PHE 162 -5.825 -1.004 -10.559
67 H LEU 163 HN LEU 163 -5.827 5.397 -6.209
68 HA LEU 163 HA LEU 163 -3.708 4.679 -4.460
69 1HB LEU 163 HB2 LEU 163 -3.609 6.525 -6.130
70 2HB LEU 163 HB1 LEU 163 -4.768 7.427 -5.164
71 HG LEU 163 HG LEU 163 -2.870 6.975 -3.299
72 1HD1 LEU 163 HD11 LEU 163 -1.596 5.982 -5.469
73 2HD1 LEU 163 HD12 LEU 163 -0.783 6.676 -4.067
74 3HD1 LEU 163 HD13 LEU 163 -1.057 7.661 -5.503
75 1HD2 LEU 163 HD21 LEU 163 -2.298 9.244 -5.104
76 2HD2 LEU 163 HD22 LEU 163 -2.560 9.215 -3.359
77 3HD2 LEU 163 HD23 LEU 163 -3.936 9.132 -4.458
78 H PHE 164 HN PHE 164 -6.948 5.491 -4.016
79 HA PHE 164 HA PHE 164 -6.699 6.638 -1.400
80 1HB PHE 164 HB2 PHE 164 -8.467 7.138 -3.173
81 2HB PHE 164 HB1 PHE 164 -9.205 5.610 -2.711
82 HD1 PHE 164 HD1 PHE 164 -11.107 5.996 -1.464
83 HD2 PHE 164 HD2 PHE 164 -7.669 8.406 -0.771
84 HE1 PHE 164 HE1 PHE 164 -12.281 7.137 0.373
85 HE2 PHE 164 HE2 PHE 164 -8.836 9.551 1.067
86 HZ PHE 164 HZ PHE 164 -11.145 8.918 1.641
87 H LEU 165 HN LEU 165 -7.435 3.499 -2.799
88 HA LEU 165 HA LEU 165 -8.440 2.275 -0.467
89 1HB LEU 165 HB2 LEU 165 -7.967 1.514 -3.113
90 2HB LEU 165 HB1 LEU 165 -6.985 0.427 -2.148
91 HG LEU 165 HG LEU 165 -9.692 0.717 -1.095
92 1HD1 LEU 165 HD11 LEU 165 -10.702 0.806 -3.114
93 2HD1 LEU 165 HD12 LEU 165 -10.396 -0.930 -3.083
94 3HD1 LEU 165 HD13 LEU 165 -9.309 0.141 -3.966
95 1HD2 LEU 165 HD21 LEU 165 -8.294 -1.015 -0.280
96 2HD2 LEU 165 HD22 LEU 165 -7.912 -1.569 -1.910
97 3HD2 LEU 165 HD23 LEU 165 -9.537 -1.792 -1.261
98 H LEU 166 HN LEU 166 -5.341 1.466 -1.980
99 HA LEU 166 HA LEU 166 -4.212 1.066 0.693
100 1HB LEU 166 HB2 LEU 166 -4.289 -0.603 -1.474
101 2HB LEU 166 HB1 LEU 166 -2.685 0.095 -1.613
102 HG LEU 166 HG LEU 166 -2.536 -1.967 -0.381
103 1HD1 LEU 166 HD11 LEU 166 -2.306 -0.089 1.880
104 2HD1 LEU 166 HD12 LEU 166 -1.431 0.351 0.413
105 3HD1 LEU 166 HD13 LEU 166 -1.118 -1.198 1.196
106 1HD2 LEU 166 HD21 LEU 166 -3.733 -1.788 2.000
107 2HD2 LEU 166 HD22 LEU 166 -4.509 -2.515 0.593
108 3HD2 LEU 166 HD23 LEU 166 -4.878 -0.851 1.042
109 HA PRO 167 HA PRO 167 -2.161 4.900 -1.079
110 1HB PRO 167 HB2 PRO 167 -2.307 6.331 1.261
111 2HB PRO 167 HB1 PRO 167 -3.490 6.422 -0.058
112 1HG PRO 167 HG2 PRO 167 -3.626 4.936 2.519
113 2HG PRO 167 HG1 PRO 167 -4.914 5.752 1.620
114 1HD PRO 167 HD2 PRO 167 -4.583 3.055 1.619
115 2HD PRO 167 HD1 PRO 167 -5.279 3.951 0.256
116 HA PRO 168 HA PRO 168 1.104 4.112 2.234
117 1HB PRO 168 HB2 PRO 168 0.780 2.326 4.136
118 2HB PRO 168 HB1 PRO 168 -0.146 3.842 4.177
119 1HG PRO 168 HG2 PRO 168 -1.026 1.111 3.318
120 2HG PRO 168 HG1 PRO 168 -1.885 2.302 4.314
121 1HD PRO 168 HD2 PRO 168 -2.228 1.930 1.572
122 2HD PRO 168 HD1 PRO 168 -2.718 3.361 2.490
123 H ILE 169 HN ILE 169 2.055 3.266 0.255
124 HA ILE 169 HA ILE 169 2.139 0.435 -0.206
125 HB ILE 169 HB ILE 169 2.392 2.334 -1.935
126 1HG1 ILE 169 HG12 ILE 169 4.036 0.868 -3.270
127 2HG1 ILE 169 HG11 ILE 169 4.051 -0.172 -1.849
128 1HG2 ILE 169 HG21 ILE 169 4.645 3.042 -2.442
129 2HG2 ILE 169 HG22 ILE 169 5.268 2.111 -1.080
130 3HG2 ILE 169 HG23 ILE 169 4.222 3.503 -0.793
131 1HD1 ILE 169 HD11 ILE 169 1.360 0.270 -2.373
132 2HD1 ILE 169 HD12 ILE 169 2.285 -1.194 -2.704
133 3HD1 ILE 169 HD13 ILE 169 2.103 0.036 -3.955
134 H ILE 170 HN ILE 170 4.345 2.856 1.083
135 HA ILE 170 HA ILE 170 6.504 1.045 1.548
136 HB ILE 170 HB ILE 170 6.057 3.733 2.848
137 1HG1 ILE 170 HG12 ILE 170 7.909 3.524 0.562
138 2HG1 ILE 170 HG11 ILE 170 6.207 3.337 0.155
139 1HG2 ILE 170 HG21 ILE 170 8.673 2.380 2.265
140 2HG2 ILE 170 HG22 ILE 170 7.800 2.137 3.778
141 3HG2 ILE 170 HG23 ILE 170 8.358 3.748 3.330
142 1HD1 ILE 170 HD11 ILE 170 7.634 5.711 0.552
143 2HD1 ILE 170 HD12 ILE 170 6.529 5.562 1.918
144 3HD1 ILE 170 HD13 ILE 170 5.905 5.521 0.270
145 H LEU 171 HN LEU 171 3.991 2.496 3.591
146 HA LEU 171 HA LEU 171 4.877 1.324 6.014
147 1HB LEU 171 HB2 LEU 171 2.439 2.715 5.063
148 2HB LEU 171 HB1 LEU 171 2.237 1.675 6.459
149 HG LEU 171 HG LEU 171 2.672 4.098 6.968
150 1HD1 LEU 171 HD11 LEU 171 4.118 1.776 8.062
151 2HD1 LEU 171 HD12 LEU 171 3.050 2.932 8.858
152 3HD1 LEU 171 HD13 LEU 171 4.729 3.362 8.534
153 1HD2 LEU 171 HD21 LEU 171 4.826 5.027 6.687
154 2HD2 LEU 171 HD22 LEU 171 4.391 4.327 5.128
155 3HD2 LEU 171 HD23 LEU 171 5.512 3.478 6.193
156 H ASP 172 HN ASP 172 2.206 0.489 3.833
157 HA ASP 172 HA ASP 172 1.724 -2.037 5.080
158 1HB ASP 172 HB2 ASP 172 0.130 -0.461 3.669
159 2HB ASP 172 HB1 ASP 172 0.742 -1.434 2.323
160 H ALA 173 HN ALA 173 4.323 -1.142 3.371
161 HA ALA 173 HA ALA 173 4.515 -3.187 1.400
162 1HB ALA 173 HB1 ALA 173 6.012 -0.929 2.125
163 2HB ALA 173 HB2 ALA 173 6.302 -2.016 0.770
164 3HB ALA 173 HB3 ALA 173 7.095 -2.306 2.318
165 H GLY 174 HN GLY 174 5.978 -2.731 4.605
166 1HA GLY 174 HA2 GLY 174 6.547 -5.628 4.697
167 2HA GLY 174 HA1 GLY 174 7.355 -4.394 5.685
168 H TYR 175 HN TYR 175 4.574 -3.132 5.943
169 HA TYR 175 HA TYR 175 2.751 -3.190 7.284
170 1HB TYR 175 HB2 TYR 175 2.608 -5.627 6.493
171 2HB TYR 175 HB1 TYR 175 3.368 -6.045 8.026
172 HD1 TYR 175 HD1 TYR 175 0.778 -3.477 7.262
173 HD2 TYR 175 HD2 TYR 175 1.714 -7.105 9.279
174 HE1 TYR 175 HE1 TYR 175 -1.421 -3.428 8.359
175 HE2 TYR 175 HE2 TYR 175 -0.484 -7.066 10.381
176 HH TYR 175 HH TYR 175 -2.927 -5.783 9.574
177 H PHE 176 HN PHE 176 5.902 -3.866 8.303
178 HA PHE 176 HA PHE 176 5.231 -3.612 11.136
179 1HB PHE 176 HB2 PHE 176 6.820 -5.377 10.559
180 2HB PHE 176 HB1 PHE 176 7.874 -4.192 9.773
181 HD1 PHE 176 HD1 PHE 176 6.572 -5.388 13.000
182 HD2 PHE 176 HD2 PHE 176 9.328 -2.801 11.044
183 HE1 PHE 176 HE1 PHE 176 7.729 -5.010 15.138
184 HE2 PHE 176 HE2 PHE 176 10.490 -2.420 13.178
185 HZ PHE 176 HZ PHE 176 9.692 -3.525 15.229
186 H LEU 177 HN LEU 177 5.813 -1.630 8.576
187 HA LEU 177 HA LEU 177 7.643 0.253 9.557
188 1HB LEU 177 HB2 LEU 177 5.547 0.208 7.465
189 2HB LEU 177 HB1 LEU 177 6.123 1.779 7.986
190 HG LEU 177 HG LEU 177 7.230 0.609 5.953
191 1HD1 LEU 177 HD11 LEU 177 9.482 1.552 6.709
192 2HD1 LEU 177 HD12 LEU 177 8.646 1.998 8.196
193 3HD1 LEU 177 HD13 LEU 177 8.107 2.655 6.650
194 1HD2 LEU 177 HD21 LEU 177 8.914 -0.945 6.338
195 2HD2 LEU 177 HD22 LEU 177 7.607 -1.494 7.387
196 3HD2 LEU 177 HD23 LEU 177 8.968 -0.601 8.067
197 HA PRO 178 HA PRO 178 3.607 2.599 11.122
198 1HB PRO 178 HB2 PRO 178 1.958 0.237 11.821
199 2HB PRO 178 HB1 PRO 178 1.478 1.767 11.079
200 1HG PRO 178 HG2 PRO 178 1.596 -0.479 9.642
201 2HG PRO 178 HG1 PRO 178 2.089 1.079 8.953
202 1HD PRO 178 HD2 PRO 178 3.787 -1.158 9.990
203 2HD PRO 178 HD1 PRO 178 4.023 -0.133 8.560
204 H LEU 179 HN LEU 179 5.496 2.622 12.617
205 HA LEU 179 HA LEU 179 5.172 0.946 14.993
206 1HB LEU 179 HB2 LEU 179 7.362 2.816 14.101
207 2HB LEU 179 HB1 LEU 179 7.343 2.048 15.677
208 HG LEU 179 HG LEU 179 7.052 0.198 13.405
209 1HD1 LEU 179 HD11 LEU 179 9.716 0.380 13.319
210 2HD1 LEU 179 HD12 LEU 179 9.325 2.075 13.610
211 3HD1 LEU 179 HD13 LEU 179 8.658 1.246 12.205
212 1HD2 LEU 179 HD21 LEU 179 7.999 -1.261 14.836
213 2HD2 LEU 179 HD22 LEU 179 7.546 -0.060 16.045
214 3HD2 LEU 179 HD23 LEU 179 9.190 -0.093 15.406
215 H ARG 180 HN ARG 180 5.553 4.377 14.146
216 HA ARG 180 HA ARG 180 4.612 5.186 16.772
217 1HB ARG 180 HB2 ARG 180 4.970 7.503 15.872
218 2HB ARG 180 HB1 ARG 180 6.415 6.485 15.879
219 1HG ARG 180 HG2 ARG 180 5.128 6.138 13.378
220 2HG ARG 180 HG1 ARG 180 5.214 7.870 13.707
221 1HD ARG 180 HD2 ARG 180 7.185 6.979 12.486
222 2HD ARG 180 HD1 ARG 180 7.588 7.757 14.013
223 HE ARG 180 HE ARG 180 7.674 4.882 13.444
224 1HH1 ARG 180 1HH1 ARG 180 8.289 7.525 15.650
225 2HH1 ARG 180 2HH1 ARG 180 9.323 6.587 16.673
226 1HH2 ARG 180 1HH2 ARG 180 9.031 3.658 14.795
227 2HH2 ARG 180 2HH2 ARG 180 9.743 4.396 16.191
228 1HG HSL 181 HG1 HSL 181 -1.189 4.776 12.449
229 2HG HSL 181 HG2 HSL 181 -0.458 3.299 11.630
230 H HSL 181 HN HSL 181 3.094 3.885 14.331
231 HA HSL 181 HA HSL 181 0.680 5.771 14.432
232 1HB HSL 181 HB1 HSL 181 1.003 5.678 12.086
233 2HB HSL 181 HB2 HSL 181 1.792 4.011 12.167
Start of MODEL 70
1 1H PHE 155 HT1 PHE 155 -14.110 6.910 -5.797
2 2H PHE 155 HT2 PHE 155 -12.851 5.764 -5.572
3 3H PHE 155 HT3 PHE 155 -13.261 6.851 -4.309
4 HA PHE 155 HA PHE 155 -15.327 5.845 -3.989
5 1HB PHE 155 HB2 PHE 155 -15.570 5.424 -6.499
6 2HB PHE 155 HB1 PHE 155 -14.652 3.945 -6.233
7 HD1 PHE 155 HD1 PHE 155 -17.459 5.659 -4.466
8 HD2 PHE 155 HD2 PHE 155 -15.978 2.083 -6.234
9 HE1 PHE 155 HE1 PHE 155 -19.531 4.494 -3.833
10 HE2 PHE 155 HE2 PHE 155 -18.047 0.911 -5.606
11 HZ PHE 155 HZ PHE 155 -19.828 2.116 -4.404
12 H LEU 156 HN LEU 156 -12.872 3.619 -5.304
13 HA LEU 156 HA LEU 156 -11.979 2.835 -2.723
14 1HB LEU 156 HB2 LEU 156 -12.729 0.518 -2.820
15 2HB LEU 156 HB1 LEU 156 -14.080 1.632 -2.773
16 HG LEU 156 HG LEU 156 -13.816 1.296 -5.447
17 1HD1 LEU 156 HD11 LEU 156 -12.980 -0.692 -6.076
18 2HD1 LEU 156 HD12 LEU 156 -13.593 -1.520 -4.644
19 3HD1 LEU 156 HD13 LEU 156 -12.095 -0.595 -4.554
20 1HD2 LEU 156 HD21 LEU 156 -15.789 1.019 -3.778
21 2HD2 LEU 156 HD22 LEU 156 -15.398 -0.697 -3.881
22 3HD2 LEU 156 HD23 LEU 156 -15.842 0.195 -5.337
23 H GLN 157 HN GLN 157 -9.879 2.724 -3.112
24 HA GLN 157 HA GLN 157 -8.820 1.976 -5.679
25 1HB GLN 157 HB2 GLN 157 -7.864 3.727 -4.058
26 2HB GLN 157 HB1 GLN 157 -7.209 2.359 -3.168
27 1HG GLN 157 HG2 GLN 157 -5.604 3.405 -4.734
28 2HG GLN 157 HG1 GLN 157 -5.881 1.690 -5.034
29 1HE2 GLN 157 HE21 GLN 157 -6.777 4.929 -6.090
30 2HE2 GLN 157 HE22 GLN 157 -7.124 4.498 -7.727
31 H SER 158 HN SER 158 -10.306 -0.002 -3.964
32 HA SER 158 HA SER 158 -10.265 -2.250 -3.778
33 1HB SER 158 HB2 SER 158 -8.688 -3.549 -4.865
34 2HB SER 158 HB1 SER 158 -8.470 -2.009 -5.712
35 HG SER 158 HG SER 158 -6.629 -3.358 -4.490
36 H ASP 159 HN ASP 159 -10.049 -0.691 -1.628
37 HA ASP 159 HA ASP 159 -8.747 -2.431 0.263
38 1HB ASP 159 HB2 ASP 159 -7.923 0.474 0.197
39 2HB ASP 159 HB1 ASP 159 -7.368 -0.756 1.323
40 H VAL 160 HN VAL 160 -9.879 0.920 0.102
41 HA VAL 160 HA VAL 160 -11.351 2.131 1.298
42 HB VAL 160 HB VAL 160 -12.983 0.760 0.101
43 1HG1 VAL 160 HG11 VAL 160 -12.826 -1.058 2.494
44 2HG1 VAL 160 HG12 VAL 160 -12.486 -1.459 0.810
45 3HG1 VAL 160 HG13 VAL 160 -14.133 -1.089 1.314
46 1HG2 VAL 160 HG21 VAL 160 -14.719 1.668 1.209
47 2HG2 VAL 160 HG22 VAL 160 -13.439 2.420 2.160
48 3HG2 VAL 160 HG23 VAL 160 -14.242 0.967 2.755
49 H PHE 161 HN PHE 161 -11.001 -1.038 2.895
50 HA PHE 161 HA PHE 161 -11.456 0.044 5.480
51 1HB PHE 161 HB2 PHE 161 -10.614 -2.621 4.419
52 2HB PHE 161 HB1 PHE 161 -10.424 -2.277 6.135
53 HD1 PHE 161 HD1 PHE 161 -12.355 -1.978 7.567
54 HD2 PHE 161 HD2 PHE 161 -12.800 -2.852 3.425
55 HE1 PHE 161 HE1 PHE 161 -14.718 -2.551 7.945
56 HE2 PHE 161 HE2 PHE 161 -15.164 -3.426 3.797
57 HZ PHE 161 HZ PHE 161 -16.125 -3.276 6.060
58 H PHE 162 HN PHE 162 -8.935 0.517 3.467
59 HA PHE 162 HA PHE 162 -7.269 1.472 5.531
60 1HB PHE 162 HB2 PHE 162 -5.534 -0.044 5.628
61 2HB PHE 162 HB1 PHE 162 -6.925 -1.115 5.459
62 HD1 PHE 162 HD1 PHE 162 -3.978 0.282 3.786
63 HD2 PHE 162 HD2 PHE 162 -7.250 -2.422 3.476
64 HE1 PHE 162 HE1 PHE 162 -2.917 -0.770 1.833
65 HE2 PHE 162 HE2 PHE 162 -6.194 -3.478 1.521
66 HZ PHE 162 HZ PHE 162 -4.025 -2.653 0.698
67 H LEU 163 HN LEU 163 -8.457 1.930 2.692
68 HA LEU 163 HA LEU 163 -6.244 2.492 1.008
69 1HB LEU 163 HB2 LEU 163 -8.392 2.264 -0.009
70 2HB LEU 163 HB1 LEU 163 -9.104 3.449 1.067
71 HG LEU 163 HG LEU 163 -7.824 5.230 -0.029
72 1HD1 LEU 163 HD11 LEU 163 -6.555 2.914 -1.343
73 2HD1 LEU 163 HD12 LEU 163 -5.882 4.482 -0.901
74 3HD1 LEU 163 HD13 LEU 163 -6.863 4.323 -2.357
75 1HD2 LEU 163 HD21 LEU 163 -9.727 5.330 -1.188
76 2HD2 LEU 163 HD22 LEU 163 -9.838 3.574 -1.313
77 3HD2 LEU 163 HD23 LEU 163 -8.865 4.480 -2.472
78 H PHE 164 HN PHE 164 -7.986 4.180 3.497
79 HA PHE 164 HA PHE 164 -7.736 6.213 4.500
80 1HB PHE 164 HB2 PHE 164 -5.196 4.892 4.368
81 2HB PHE 164 HB1 PHE 164 -4.942 6.631 4.247
82 HD1 PHE 164 HD1 PHE 164 -5.282 3.950 6.453
83 HD2 PHE 164 HD2 PHE 164 -6.335 8.048 5.995
84 HE1 PHE 164 HE1 PHE 164 -5.555 4.148 8.890
85 HE2 PHE 164 HE2 PHE 164 -6.608 8.254 8.431
86 HZ PHE 164 HZ PHE 164 -6.218 6.303 9.883
87 H LEU 165 HN LEU 165 -8.202 6.235 1.625
88 HA LEU 165 HA LEU 165 -8.608 7.998 0.168
89 1HB LEU 165 HB2 LEU 165 -7.654 9.434 2.265
90 2HB LEU 165 HB1 LEU 165 -6.381 9.704 1.081
91 HG LEU 165 HG LEU 165 -9.314 10.358 0.755
92 1HD1 LEU 165 HD11 LEU 165 -8.809 12.508 1.202
93 2HD1 LEU 165 HD12 LEU 165 -7.206 12.397 0.473
94 3HD1 LEU 165 HD13 LEU 165 -7.478 11.783 2.103
95 1HD2 LEU 165 HD21 LEU 165 -8.508 11.420 -1.385
96 2HD2 LEU 165 HD22 LEU 165 -8.555 9.657 -1.376
97 3HD2 LEU 165 HD23 LEU 165 -7.018 10.499 -1.184
98 H LEU 166 HN LEU 166 -5.497 6.743 0.957
99 HA LEU 166 HA LEU 166 -4.818 6.502 -1.821
100 1HB LEU 166 HB2 LEU 166 -3.396 8.212 -2.001
101 2HB LEU 166 HB1 LEU 166 -4.012 8.794 -0.463
102 HG LEU 166 HG LEU 166 -2.184 7.318 0.602
103 1HD1 LEU 166 HD11 LEU 166 -1.809 6.348 -1.855
104 2HD1 LEU 166 HD12 LEU 166 -0.521 6.432 -0.652
105 3HD1 LEU 166 HD13 LEU 166 -0.647 7.674 -1.898
106 1HD2 LEU 166 HD21 LEU 166 -0.454 9.098 0.136
107 2HD2 LEU 166 HD22 LEU 166 -2.007 9.670 0.744
108 3HD2 LEU 166 HD23 LEU 166 -1.622 9.819 -0.971
109 HA PRO 167 HA PRO 167 -3.206 2.826 0.056
110 1HB PRO 167 HB2 PRO 167 -1.785 1.871 -2.068
111 2HB PRO 167 HB1 PRO 167 -3.548 1.744 -1.926
112 1HG PRO 167 HG2 PRO 167 -1.906 3.731 -3.454
113 2HG PRO 167 HG1 PRO 167 -3.385 2.885 -3.948
114 1HD PRO 167 HD2 PRO 167 -3.413 5.440 -3.081
115 2HD PRO 167 HD1 PRO 167 -4.751 4.320 -2.758
116 HA PRO 168 HA PRO 168 0.915 4.335 1.101
117 1HB PRO 168 HB2 PRO 168 1.077 3.216 3.510
118 2HB PRO 168 HB1 PRO 168 -0.031 4.574 3.220
119 1HG PRO 168 HG2 PRO 168 -0.624 1.648 3.405
120 2HG PRO 168 HG1 PRO 168 -1.545 3.021 4.042
121 1HD PRO 168 HD2 PRO 168 -2.086 1.679 1.667
122 2HD PRO 168 HD1 PRO 168 -2.668 3.303 2.081
123 H ILE 169 HN ILE 169 2.059 3.160 -0.440
124 HA ILE 169 HA ILE 169 2.398 0.368 -0.463
125 HB ILE 169 HB ILE 169 4.475 0.910 -1.832
126 1HG1 ILE 169 HG12 ILE 169 3.370 3.696 -1.902
127 2HG1 ILE 169 HG11 ILE 169 4.558 3.242 -0.685
128 1HG2 ILE 169 HG21 ILE 169 2.785 0.394 -3.241
129 2HG2 ILE 169 HG22 ILE 169 2.857 2.118 -3.604
130 3HG2 ILE 169 HG23 ILE 169 1.658 1.507 -2.466
131 1HD1 ILE 169 HD11 ILE 169 4.925 3.095 -3.669
132 2HD1 ILE 169 HD12 ILE 169 6.115 2.604 -2.463
133 3HD1 ILE 169 HD13 ILE 169 5.626 4.294 -2.584
134 H ILE 170 HN ILE 170 4.108 2.928 1.148
135 HA ILE 170 HA ILE 170 6.360 1.377 1.944
136 HB ILE 170 HB ILE 170 5.345 3.945 3.157
137 1HG1 ILE 170 HG12 ILE 170 5.658 4.549 0.933
138 2HG1 ILE 170 HG11 ILE 170 7.235 4.892 1.633
139 1HG2 ILE 170 HG21 ILE 170 8.040 4.017 3.373
140 2HG2 ILE 170 HG22 ILE 170 7.741 2.287 3.547
141 3HG2 ILE 170 HG23 ILE 170 6.959 3.431 4.637
142 1HD1 ILE 170 HD11 ILE 170 7.784 3.816 -0.322
143 2HD1 ILE 170 HD12 ILE 170 6.418 2.706 -0.222
144 3HD1 ILE 170 HD13 ILE 170 7.812 2.488 0.838
145 H LEU 171 HN LEU 171 3.317 2.342 3.488
146 HA LEU 171 HA LEU 171 3.917 1.223 6.029
147 1HB LEU 171 HB2 LEU 171 1.216 1.688 4.751
148 2HB LEU 171 HB1 LEU 171 1.507 1.390 6.454
149 HG LEU 171 HG LEU 171 2.383 3.820 4.892
150 1HD1 LEU 171 HD11 LEU 171 0.502 3.725 7.227
151 2HD1 LEU 171 HD12 LEU 171 -0.064 3.530 5.568
152 3HD1 LEU 171 HD13 LEU 171 0.747 5.019 6.054
153 1HD2 LEU 171 HD21 LEU 171 3.180 4.680 7.037
154 2HD2 LEU 171 HD22 LEU 171 4.046 3.218 6.571
155 3HD2 LEU 171 HD23 LEU 171 2.787 3.141 7.804
156 H ASP 172 HN ASP 172 1.878 0.070 3.354
157 HA ASP 172 HA ASP 172 1.606 -2.555 4.450
158 1HB ASP 172 HB2 ASP 172 0.533 -3.117 2.308
159 2HB ASP 172 HB1 ASP 172 -0.145 -1.641 3.012
160 H ALA 173 HN ALA 173 4.251 -1.096 3.166
161 HA ALA 173 HA ALA 173 5.157 -3.079 1.356
162 1HB ALA 173 HB1 ALA 173 6.115 -0.581 2.353
163 2HB ALA 173 HB2 ALA 173 6.646 -1.480 0.932
164 3HB ALA 173 HB3 ALA 173 7.397 -1.783 2.499
165 H GLY 174 HN GLY 174 5.653 -2.401 4.770
166 1HA GLY 174 HA2 GLY 174 6.784 -5.115 5.102
167 2HA GLY 174 HA1 GLY 174 7.313 -3.721 6.065
168 H TYR 175 HN TYR 175 4.454 -2.763 6.116
169 HA TYR 175 HA TYR 175 2.559 -2.968 7.336
170 1HB TYR 175 HB2 TYR 175 3.035 -5.575 6.623
171 2HB TYR 175 HB1 TYR 175 2.992 -5.676 8.381
172 HD1 TYR 175 HD1 TYR 175 1.040 -3.444 6.128
173 HD2 TYR 175 HD2 TYR 175 0.953 -6.726 8.833
174 HE1 TYR 175 HE1 TYR 175 -1.417 -3.425 6.062
175 HE2 TYR 175 HE2 TYR 175 -1.507 -6.717 8.774
176 HH TYR 175 HH TYR 175 -3.303 -4.156 7.339
177 H PHE 176 HN PHE 176 5.436 -4.407 8.798
178 HA PHE 176 HA PHE 176 4.580 -3.520 11.436
179 1HB PHE 176 HB2 PHE 176 6.839 -5.236 10.430
180 2HB PHE 176 HB1 PHE 176 6.777 -4.665 12.104
181 HD1 PHE 176 HD1 PHE 176 6.472 -7.510 10.531
182 HD2 PHE 176 HD2 PHE 176 3.929 -4.897 12.724
183 HE1 PHE 176 HE1 PHE 176 5.023 -9.412 11.106
184 HE2 PHE 176 HE2 PHE 176 2.474 -6.795 13.304
185 HZ PHE 176 HZ PHE 176 3.020 -9.055 12.495
186 H LEU 177 HN LEU 177 6.241 -2.266 8.832
187 HA LEU 177 HA LEU 177 8.454 -0.983 9.886
188 1HB LEU 177 HB2 LEU 177 8.531 -0.513 7.711
189 2HB LEU 177 HB1 LEU 177 6.814 -0.794 7.522
190 HG LEU 177 HG LEU 177 6.412 1.551 8.304
191 1HD1 LEU 177 HD11 LEU 177 9.203 2.286 7.692
192 2HD1 LEU 177 HD12 LEU 177 8.927 1.496 9.245
193 3HD1 LEU 177 HD13 LEU 177 8.068 2.985 8.849
194 1HD2 LEU 177 HD21 LEU 177 7.819 2.393 6.092
195 2HD2 LEU 177 HD22 LEU 177 6.193 1.710 6.087
196 3HD2 LEU 177 HD23 LEU 177 7.586 0.671 5.789
197 HA PRO 178 HA PRO 178 5.375 2.729 10.951
198 1HB PRO 178 HB2 PRO 178 3.029 1.082 11.722
199 2HB PRO 178 HB1 PRO 178 3.091 2.622 10.859
200 1HG PRO 178 HG2 PRO 178 2.528 0.359 9.571
201 2HG PRO 178 HG1 PRO 178 3.534 1.612 8.820
202 1HD PRO 178 HD2 PRO 178 4.356 -0.968 10.094
203 2HD PRO 178 HD1 PRO 178 4.980 -0.188 8.625
204 H LEU 179 HN LEU 179 7.206 1.963 12.508
205 HA LEU 179 HA LEU 179 6.011 1.249 15.102
206 1HB LEU 179 HB2 LEU 179 8.123 0.048 13.782
207 2HB LEU 179 HB1 LEU 179 8.922 1.092 14.942
208 HG LEU 179 HG LEU 179 6.830 -0.282 16.304
209 1HD1 LEU 179 HD11 LEU 179 8.303 -1.910 14.323
210 2HD1 LEU 179 HD12 LEU 179 6.693 -2.132 15.008
211 3HD1 LEU 179 HD13 LEU 179 8.119 -2.586 15.941
212 1HD2 LEU 179 HD21 LEU 179 9.830 -0.571 16.419
213 2HD2 LEU 179 HD22 LEU 179 8.691 -1.132 17.644
214 3HD2 LEU 179 HD23 LEU 179 8.862 0.594 17.324
215 H ARG 180 HN ARG 180 7.166 3.784 13.345
216 HA ARG 180 HA ARG 180 7.485 5.432 15.719
217 1HB ARG 180 HB2 ARG 180 9.605 5.055 13.605
218 2HB ARG 180 HB1 ARG 180 9.507 6.541 14.555
219 1HG ARG 180 HG2 ARG 180 10.298 5.556 16.424
220 2HG ARG 180 HG1 ARG 180 9.508 4.015 16.083
221 1HD ARG 180 HD2 ARG 180 11.839 4.976 14.456
222 2HD ARG 180 HD1 ARG 180 12.073 4.116 15.977
223 HE ARG 180 HE ARG 180 10.309 2.727 14.214
224 1HH1 ARG 180 1HH1 ARG 180 13.674 3.354 14.896
225 2HH1 ARG 180 2HH1 ARG 180 14.225 1.882 14.170
226 1HH2 ARG 180 1HH2 ARG 180 11.032 0.790 13.259
227 2HH2 ARG 180 2HH2 ARG 180 12.725 0.426 13.240
228 1HG HSL 181 HG1 HSL 181 2.016 5.974 11.393
229 2HG HSL 181 HG2 HSL 181 2.706 4.791 12.621
230 H HSL 181 HN HSL 181 5.358 5.139 14.003
231 HA HSL 181 HA HSL 181 5.394 7.736 12.379
232 1HB HSL 181 HB1 HSL 181 4.135 6.750 10.698
233 2HB HSL 181 HB2 HSL 181 4.735 5.144 11.388
Start of MODEL 71
1 1H PHE 155 HT1 PHE 155 4.864 7.826 -12.384
2 2H PHE 155 HT2 PHE 155 4.157 7.952 -13.942
3 3H PHE 155 HT3 PHE 155 5.863 8.012 -13.764
4 HA PHE 155 HA PHE 155 4.828 5.888 -14.576
5 1HB PHE 155 HB2 PHE 155 6.544 4.616 -13.415
6 2HB PHE 155 HB1 PHE 155 7.167 6.217 -13.806
7 HD1 PHE 155 HD1 PHE 155 6.907 3.794 -11.306
8 HD2 PHE 155 HD2 PHE 155 6.823 8.009 -11.890
9 HE1 PHE 155 HE1 PHE 155 7.508 4.130 -8.944
10 HE2 PHE 155 HE2 PHE 155 7.426 8.352 -9.529
11 HZ PHE 155 HZ PHE 155 7.769 6.410 -8.053
12 H LEU 156 HN LEU 156 4.301 3.715 -13.606
13 HA LEU 156 HA LEU 156 1.968 3.969 -11.996
14 1HB LEU 156 HB2 LEU 156 3.418 1.700 -13.287
15 2HB LEU 156 HB1 LEU 156 2.199 1.355 -12.074
16 HG LEU 156 HG LEU 156 0.812 3.046 -13.656
17 1HD1 LEU 156 HD11 LEU 156 2.905 3.033 -15.172
18 2HD1 LEU 156 HD12 LEU 156 1.312 2.849 -15.908
19 3HD1 LEU 156 HD13 LEU 156 2.338 1.435 -15.660
20 1HD2 LEU 156 HD21 LEU 156 0.611 0.465 -12.903
21 2HD2 LEU 156 HD22 LEU 156 0.859 0.270 -14.639
22 3HD2 LEU 156 HD23 LEU 156 -0.485 1.244 -14.043
23 H GLN 157 HN GLN 157 1.624 2.469 -10.089
24 HA GLN 157 HA GLN 157 3.803 1.622 -8.510
25 1HB GLN 157 HB2 GLN 157 3.422 4.372 -8.400
26 2HB GLN 157 HB1 GLN 157 2.596 3.779 -6.966
27 1HG GLN 157 HG2 GLN 157 4.780 2.434 -6.580
28 2HG GLN 157 HG1 GLN 157 5.484 3.610 -7.688
29 1HE2 GLN 157 HE21 GLN 157 6.809 4.361 -5.992
30 2HE2 GLN 157 HE22 GLN 157 6.184 5.401 -4.763
31 H SER 158 HN SER 158 2.608 -0.203 -8.192
32 HA SER 158 HA SER 158 1.117 -1.590 -7.189
33 1HB SER 158 HB2 SER 158 1.093 0.812 -5.433
34 2HB SER 158 HB1 SER 158 -0.230 -0.349 -5.228
35 HG SER 158 HG SER 158 1.403 -1.976 -4.984
36 H ASP 159 HN ASP 159 -0.008 -1.537 -9.210
37 HA ASP 159 HA ASP 159 -1.815 -1.474 -10.532
38 1HB ASP 159 HB2 ASP 159 -4.045 -1.360 -9.492
39 2HB ASP 159 HB1 ASP 159 -2.980 -2.498 -8.679
40 H VAL 160 HN VAL 160 -2.195 1.215 -8.228
41 HA VAL 160 HA VAL 160 -2.390 3.460 -8.572
42 HB VAL 160 HB VAL 160 -1.553 2.627 -11.323
43 1HG1 VAL 160 HG11 VAL 160 -2.922 5.200 -10.644
44 2HG1 VAL 160 HG12 VAL 160 -3.139 4.158 -12.050
45 3HG1 VAL 160 HG13 VAL 160 -1.684 5.141 -11.899
46 1HG2 VAL 160 HG21 VAL 160 -0.467 4.882 -9.691
47 2HG2 VAL 160 HG22 VAL 160 0.348 3.874 -10.886
48 3HG2 VAL 160 HG23 VAL 160 -0.055 3.212 -9.302
49 H PHE 161 HN PHE 161 -3.847 1.836 -11.382
50 HA PHE 161 HA PHE 161 -6.237 3.405 -11.216
51 1HB PHE 161 HB2 PHE 161 -5.911 0.815 -12.733
52 2HB PHE 161 HB1 PHE 161 -7.008 2.146 -13.085
53 HD1 PHE 161 HD1 PHE 161 -5.959 4.383 -13.759
54 HD2 PHE 161 HD2 PHE 161 -3.838 0.693 -13.767
55 HE1 PHE 161 HE1 PHE 161 -4.300 5.344 -15.301
56 HE2 PHE 161 HE2 PHE 161 -2.175 1.648 -15.308
57 HZ PHE 161 HZ PHE 161 -2.405 3.976 -16.077
58 H PHE 162 HN PHE 162 -5.971 2.484 -8.747
59 HA PHE 162 HA PHE 162 -8.319 0.966 -8.325
60 1HB PHE 162 HB2 PHE 162 -5.791 -0.443 -8.434
61 2HB PHE 162 HB1 PHE 162 -6.632 -0.666 -6.900
62 HD1 PHE 162 HD1 PHE 162 -6.057 -2.387 -9.647
63 HD2 PHE 162 HD2 PHE 162 -9.420 -0.711 -7.651
64 HE1 PHE 162 HE1 PHE 162 -7.512 -4.073 -10.693
65 HE2 PHE 162 HE2 PHE 162 -10.882 -2.394 -8.693
66 HZ PHE 162 HZ PHE 162 -9.928 -4.079 -10.216
67 H LEU 163 HN LEU 163 -5.236 2.027 -6.899
68 HA LEU 163 HA LEU 163 -6.092 2.105 -4.226
69 1HB LEU 163 HB2 LEU 163 -4.043 3.677 -5.778
70 2HB LEU 163 HB1 LEU 163 -4.364 4.041 -4.095
71 HG LEU 163 HG LEU 163 -3.067 2.366 -3.393
72 1HD1 LEU 163 HD11 LEU 163 -4.451 0.626 -5.422
73 2HD1 LEU 163 HD12 LEU 163 -4.747 0.703 -3.686
74 3HD1 LEU 163 HD13 LEU 163 -3.229 0.042 -4.293
75 1HD2 LEU 163 HD21 LEU 163 -2.424 2.159 -6.327
76 2HD2 LEU 163 HD22 LEU 163 -1.479 1.406 -5.042
77 3HD2 LEU 163 HD23 LEU 163 -1.614 3.161 -5.124
78 H PHE 164 HN PHE 164 -6.047 4.556 -6.756
79 HA PHE 164 HA PHE 164 -7.180 6.524 -7.012
80 1HB PHE 164 HB2 PHE 164 -8.815 4.357 -7.032
81 2HB PHE 164 HB1 PHE 164 -9.599 5.346 -5.797
82 HD1 PHE 164 HD1 PHE 164 -10.221 4.492 -8.868
83 HD2 PHE 164 HD2 PHE 164 -9.131 8.063 -6.825
84 HE1 PHE 164 HE1 PHE 164 -11.304 5.826 -10.630
85 HE2 PHE 164 HE2 PHE 164 -10.212 9.404 -8.583
86 HZ PHE 164 HZ PHE 164 -11.301 8.285 -10.488
87 H LEU 165 HN LEU 165 -5.744 6.541 -4.587
88 HA LEU 165 HA LEU 165 -6.970 8.691 -3.253
89 1HB LEU 165 HB2 LEU 165 -7.627 6.028 -2.269
90 2HB LEU 165 HB1 LEU 165 -6.913 7.048 -1.034
91 HG LEU 165 HG LEU 165 -9.103 8.243 -2.638
92 1HD1 LEU 165 HD11 LEU 165 -9.748 6.341 -0.405
93 2HD1 LEU 165 HD12 LEU 165 -9.776 5.853 -2.100
94 3HD1 LEU 165 HD13 LEU 165 -10.851 7.130 -1.532
95 1HD2 LEU 165 HD21 LEU 165 -7.680 9.074 -0.518
96 2HD2 LEU 165 HD22 LEU 165 -9.029 8.298 0.311
97 3HD2 LEU 165 HD23 LEU 165 -9.333 9.595 -0.844
98 H LEU 166 HN LEU 166 -4.980 5.892 -2.304
99 HA LEU 166 HA LEU 166 -2.594 7.477 -2.223
100 1HB LEU 166 HB2 LEU 166 -2.869 8.225 -0.131
101 2HB LEU 166 HB1 LEU 166 -4.206 7.135 0.170
102 HG LEU 166 HG LEU 166 -2.565 5.334 0.692
103 1HD1 LEU 166 HD11 LEU 166 -0.339 5.576 0.524
104 2HD1 LEU 166 HD12 LEU 166 -0.375 7.256 1.061
105 3HD1 LEU 166 HD13 LEU 166 -0.752 6.858 -0.616
106 1HD2 LEU 166 HD21 LEU 166 -2.538 5.941 2.857
107 2HD2 LEU 166 HD22 LEU 166 -3.501 7.306 2.289
108 3HD2 LEU 166 HD23 LEU 166 -1.763 7.491 2.522
109 HA PRO 167 HA PRO 167 -1.364 3.268 -3.160
110 1HB PRO 167 HB2 PRO 167 1.281 3.789 -3.538
111 2HB PRO 167 HB1 PRO 167 0.039 4.116 -4.761
112 1HG PRO 167 HG2 PRO 167 1.338 5.996 -2.824
113 2HG PRO 167 HG1 PRO 167 0.954 6.243 -4.537
114 1HD PRO 167 HD2 PRO 167 -0.585 7.242 -2.555
115 2HD PRO 167 HD1 PRO 167 -1.266 6.706 -4.105
116 HA PRO 168 HA PRO 168 0.088 2.529 1.081
117 1HB PRO 168 HB2 PRO 168 -0.811 0.013 1.297
118 2HB PRO 168 HB1 PRO 168 -1.920 1.398 1.359
119 1HG PRO 168 HG2 PRO 168 -1.269 -0.402 -0.954
120 2HG PRO 168 HG1 PRO 168 -2.857 0.147 -0.384
121 1HD PRO 168 HD2 PRO 168 -1.547 1.301 -2.468
122 2HD PRO 168 HD1 PRO 168 -2.647 2.198 -1.402
123 H ILE 169 HN ILE 169 2.085 2.585 -0.715
124 HA ILE 169 HA ILE 169 3.292 0.002 -1.109
125 HB ILE 169 HB ILE 169 3.534 2.045 -2.624
126 1HG1 ILE 169 HG12 ILE 169 6.283 1.143 -2.125
127 2HG1 ILE 169 HG11 ILE 169 5.110 -0.165 -2.233
128 1HG2 ILE 169 HG21 ILE 169 5.624 2.796 -0.579
129 2HG2 ILE 169 HG22 ILE 169 4.119 3.664 -0.882
130 3HG2 ILE 169 HG23 ILE 169 5.355 3.582 -2.136
131 1HD1 ILE 169 HD11 ILE 169 6.054 1.717 -4.307
132 2HD1 ILE 169 HD12 ILE 169 4.373 1.190 -4.387
133 3HD1 ILE 169 HD13 ILE 169 5.673 -0.002 -4.417
134 H ILE 170 HN ILE 170 3.904 2.803 0.905
135 HA ILE 170 HA ILE 170 6.233 1.753 2.123
136 HB ILE 170 HB ILE 170 6.126 3.713 3.576
137 1HG1 ILE 170 HG12 ILE 170 3.406 3.836 2.401
138 2HG1 ILE 170 HG11 ILE 170 3.935 4.222 4.031
139 1HG2 ILE 170 HG21 ILE 170 6.905 3.627 1.082
140 2HG2 ILE 170 HG22 ILE 170 6.816 5.166 1.938
141 3HG2 ILE 170 HG23 ILE 170 5.526 4.695 0.832
142 1HD1 ILE 170 HD11 ILE 170 3.755 5.930 1.633
143 2HD1 ILE 170 HD12 ILE 170 5.116 6.223 2.715
144 3HD1 ILE 170 HD13 ILE 170 3.465 6.316 3.329
145 H LEU 171 HN LEU 171 2.963 2.344 3.505
146 HA LEU 171 HA LEU 171 3.648 1.159 5.988
147 1HB LEU 171 HB2 LEU 171 1.364 1.323 6.569
148 2HB LEU 171 HB1 LEU 171 1.742 2.736 5.612
149 HG LEU 171 HG LEU 171 0.416 0.327 4.401
150 1HD1 LEU 171 HD11 LEU 171 -0.798 2.582 5.950
151 2HD1 LEU 171 HD12 LEU 171 -1.107 0.852 6.083
152 3HD1 LEU 171 HD13 LEU 171 -1.693 1.747 4.682
153 1HD2 LEU 171 HD21 LEU 171 0.952 1.600 2.613
154 2HD2 LEU 171 HD22 LEU 171 1.099 3.072 3.572
155 3HD2 LEU 171 HD23 LEU 171 -0.494 2.490 3.090
156 H ASP 172 HN ASP 172 1.860 -0.016 3.201
157 HA ASP 172 HA ASP 172 1.588 -2.674 4.207
158 1HB ASP 172 HB2 ASP 172 0.361 -1.224 2.214
159 2HB ASP 172 HB1 ASP 172 1.355 -2.369 1.301
160 H ALA 173 HN ALA 173 4.305 -1.118 3.262
161 HA ALA 173 HA ALA 173 5.481 -3.039 1.517
162 1HB ALA 173 HB1 ALA 173 6.998 -1.430 1.281
163 2HB ALA 173 HB2 ALA 173 7.487 -1.618 2.965
164 3HB ALA 173 HB3 ALA 173 6.192 -0.501 2.542
165 H GLY 174 HN GLY 174 5.957 -2.223 4.937
166 1HA GLY 174 HA2 GLY 174 6.995 -4.955 5.382
167 2HA GLY 174 HA1 GLY 174 7.457 -3.539 6.345
168 H TYR 175 HN TYR 175 4.504 -2.715 6.120
169 HA TYR 175 HA TYR 175 2.576 -2.901 7.290
170 1HB TYR 175 HB2 TYR 175 2.717 -5.317 6.473
171 2HB TYR 175 HB1 TYR 175 3.375 -5.710 8.056
172 HD1 TYR 175 HD1 TYR 175 1.159 -7.230 7.555
173 HD2 TYR 175 HD2 TYR 175 1.172 -3.129 8.696
174 HE1 TYR 175 HE1 TYR 175 -1.122 -7.472 8.437
175 HE2 TYR 175 HE2 TYR 175 -1.108 -3.363 9.581
176 HH TYR 175 HH TYR 175 -3.123 -5.820 8.848
177 H PHE 176 HN PHE 176 5.115 -4.691 9.070
178 HA PHE 176 HA PHE 176 4.247 -3.414 11.543
179 1HB PHE 176 HB2 PHE 176 4.651 -5.799 11.664
180 2HB PHE 176 HB1 PHE 176 6.278 -5.593 10.999
181 HD1 PHE 176 HD1 PHE 176 8.095 -5.237 12.407
182 HD2 PHE 176 HD2 PHE 176 4.149 -4.750 13.924
183 HE1 PHE 176 HE1 PHE 176 9.001 -5.022 14.685
184 HE2 PHE 176 HE2 PHE 176 5.047 -4.534 16.204
185 HZ PHE 176 HZ PHE 176 7.476 -4.669 16.586
186 H LEU 177 HN LEU 177 6.170 -2.521 9.082
187 HA LEU 177 HA LEU 177 8.568 -1.724 10.321
188 1HB LEU 177 HB2 LEU 177 9.044 -1.355 8.186
189 2HB LEU 177 HB1 LEU 177 7.356 -1.520 7.753
190 HG LEU 177 HG LEU 177 7.092 0.933 8.331
191 1HD1 LEU 177 HD11 LEU 177 8.839 2.242 8.884
192 2HD1 LEU 177 HD12 LEU 177 9.973 1.337 7.880
193 3HD1 LEU 177 HD13 LEU 177 9.520 0.723 9.469
194 1HD2 LEU 177 HD21 LEU 177 7.877 1.661 6.184
195 2HD2 LEU 177 HD22 LEU 177 7.253 0.018 6.029
196 3HD2 LEU 177 HD23 LEU 177 8.994 0.298 6.083
197 HA PRO 178 HA PRO 178 6.126 2.614 10.660
198 1HB PRO 178 HB2 PRO 178 3.580 1.286 11.486
199 2HB PRO 178 HB1 PRO 178 3.827 2.800 10.606
200 1HG PRO 178 HG2 PRO 178 3.059 0.606 9.320
201 2HG PRO 178 HG1 PRO 178 4.237 1.716 8.594
202 1HD PRO 178 HD2 PRO 178 4.673 -0.949 9.858
203 2HD PRO 178 HD1 PRO 178 5.508 -0.201 8.483
204 H LEU 179 HN LEU 179 7.670 2.440 12.391
205 HA LEU 179 HA LEU 179 6.540 1.554 14.958
206 1HB LEU 179 HB2 LEU 179 9.249 1.542 13.801
207 2HB LEU 179 HB1 LEU 179 9.170 2.042 15.479
208 HG LEU 179 HG LEU 179 7.592 -0.252 15.378
209 1HD1 LEU 179 HD11 LEU 179 9.092 -1.924 14.369
210 2HD1 LEU 179 HD12 LEU 179 10.085 -0.616 13.726
211 3HD1 LEU 179 HD13 LEU 179 8.420 -0.809 13.179
212 1HD2 LEU 179 HD21 LEU 179 9.110 -1.092 16.911
213 2HD2 LEU 179 HD22 LEU 179 9.351 0.650 17.050
214 3HD2 LEU 179 HD23 LEU 179 10.488 -0.327 16.121
215 H ARG 180 HN ARG 180 9.108 3.888 14.236
216 HA ARG 180 HA ARG 180 7.913 5.761 16.109
217 1HB ARG 180 HB2 ARG 180 9.983 7.084 15.733
218 2HB ARG 180 HB1 ARG 180 10.300 5.433 16.279
219 1HG ARG 180 HG2 ARG 180 10.349 5.179 13.548
220 2HG ARG 180 HG1 ARG 180 11.054 6.775 13.800
221 1HD ARG 180 HD2 ARG 180 12.684 4.856 13.776
222 2HD ARG 180 HD1 ARG 180 12.759 5.904 15.191
223 HE ARG 180 HE ARG 180 11.084 3.576 15.507
224 1HH1 ARG 180 1HH1 ARG 180 14.304 4.883 15.845
225 2HH1 ARG 180 2HH1 ARG 180 14.785 3.721 17.034
226 1HH2 ARG 180 1HH2 ARG 180 11.718 2.047 17.070
227 2HH2 ARG 180 2HH2 ARG 180 13.319 2.110 17.729
228 1HG HSL 181 HG1 HSL 181 4.760 7.651 10.031
229 2HG HSL 181 HG2 HSL 181 4.044 5.954 10.015
230 H HSL 181 HN HSL 181 6.456 5.186 13.736
231 HA HSL 181 HA HSL 181 6.553 7.893 12.300
232 1HB HSL 181 HB1 HSL 181 6.797 6.451 10.432
233 2HB HSL 181 HB2 HSL 181 5.913 5.064 11.268
Start of MODEL 72
1 1H PHE 155 HT1 PHE 155 -7.781 11.879 -14.531
2 2H PHE 155 HT2 PHE 155 -9.405 12.424 -14.431
3 3H PHE 155 HT3 PHE 155 -9.069 10.749 -14.589
4 HA PHE 155 HA PHE 155 -8.413 12.482 -12.303
5 1HB PHE 155 HB2 PHE 155 -10.564 10.507 -12.945
6 2HB PHE 155 HB1 PHE 155 -9.992 10.610 -11.285
7 HD1 PHE 155 HD1 PHE 155 -12.668 11.452 -12.966
8 HD2 PHE 155 HD2 PHE 155 -9.508 13.463 -10.948
9 HE1 PHE 155 HE1 PHE 155 -14.145 13.381 -12.585
10 HE2 PHE 155 HE2 PHE 155 -10.979 15.397 -10.562
11 HZ PHE 155 HZ PHE 155 -13.302 15.357 -11.380
12 H LEU 156 HN LEU 156 -6.923 11.721 -10.923
13 HA LEU 156 HA LEU 156 -5.176 10.480 -10.153
14 1HB LEU 156 HB2 LEU 156 -7.228 8.334 -10.622
15 2HB LEU 156 HB1 LEU 156 -5.743 8.090 -9.725
16 HG LEU 156 HG LEU 156 -6.761 10.224 -8.408
17 1HD1 LEU 156 HD11 LEU 156 -9.147 9.823 -8.045
18 2HD1 LEU 156 HD12 LEU 156 -9.123 8.577 -9.294
19 3HD1 LEU 156 HD13 LEU 156 -8.805 10.259 -9.720
20 1HD2 LEU 156 HD21 LEU 156 -7.538 7.382 -7.797
21 2HD2 LEU 156 HD22 LEU 156 -7.318 8.710 -6.657
22 3HD2 LEU 156 HD23 LEU 156 -5.928 8.042 -7.512
23 H GLN 157 HN GLN 157 -5.406 10.888 -13.110
24 HA GLN 157 HA GLN 157 -4.367 8.534 -14.356
25 1HB GLN 157 HB2 GLN 157 -5.489 10.907 -15.239
26 2HB GLN 157 HB1 GLN 157 -3.810 11.039 -15.741
27 1HG GLN 157 HG2 GLN 157 -4.477 8.470 -16.459
28 2HG GLN 157 HG1 GLN 157 -5.950 9.379 -16.787
29 1HE2 GLN 157 HE21 GLN 157 -2.458 9.924 -17.125
30 2HE2 GLN 157 HE22 GLN 157 -2.531 10.484 -18.758
31 H SER 158 HN SER 158 -2.974 10.722 -12.257
32 HA SER 158 HA SER 158 -0.409 10.966 -13.451
33 1HB SER 158 HB2 SER 158 0.252 12.120 -11.516
34 2HB SER 158 HB1 SER 158 -1.471 12.495 -11.677
35 HG SER 158 HG SER 158 -0.204 11.303 -9.651
36 H ASP 159 HN ASP 159 -1.764 8.942 -10.991
37 HA ASP 159 HA ASP 159 -0.033 6.769 -11.549
38 1HB ASP 159 HB2 ASP 159 1.164 8.640 -9.928
39 2HB ASP 159 HB1 ASP 159 0.452 7.540 -8.752
40 H VAL 160 HN VAL 160 -2.202 8.410 -9.383
41 HA VAL 160 HA VAL 160 -4.246 7.690 -8.604
42 HB VAL 160 HB VAL 160 -3.841 5.639 -10.275
43 1HG1 VAL 160 HG11 VAL 160 -3.703 3.537 -9.278
44 2HG1 VAL 160 HG12 VAL 160 -4.092 4.162 -7.676
45 3HG1 VAL 160 HG13 VAL 160 -2.510 4.477 -8.385
46 1HG2 VAL 160 HG21 VAL 160 -6.001 4.665 -9.117
47 2HG2 VAL 160 HG22 VAL 160 -6.027 6.207 -9.971
48 3HG2 VAL 160 HG23 VAL 160 -5.907 6.175 -8.212
49 H PHE 161 HN PHE 161 -1.366 5.857 -7.653
50 HA PHE 161 HA PHE 161 -2.297 5.331 -5.004
51 1HB PHE 161 HB2 PHE 161 0.543 5.306 -6.050
52 2HB PHE 161 HB1 PHE 161 -0.033 4.546 -4.570
53 HD1 PHE 161 HD1 PHE 161 0.704 4.045 -7.968
54 HD2 PHE 161 HD2 PHE 161 -1.953 2.799 -4.887
55 HE1 PHE 161 HE1 PHE 161 0.224 1.982 -9.222
56 HE2 PHE 161 HE2 PHE 161 -2.438 0.734 -6.133
57 HZ PHE 161 HZ PHE 161 -1.348 0.323 -8.304
58 H PHE 162 HN PHE 162 -0.294 7.796 -6.488
59 HA PHE 162 HA PHE 162 0.503 9.079 -4.073
60 1HB PHE 162 HB2 PHE 162 1.014 9.280 -6.841
61 2HB PHE 162 HB1 PHE 162 0.502 10.869 -6.280
62 HD1 PHE 162 HD1 PHE 162 1.696 11.799 -4.191
63 HD2 PHE 162 HD2 PHE 162 3.209 8.596 -6.550
64 HE1 PHE 162 HE1 PHE 162 3.950 12.204 -3.289
65 HE2 PHE 162 HE2 PHE 162 5.465 8.994 -5.651
66 HZ PHE 162 HZ PHE 162 5.837 10.800 -4.019
67 H LEU 163 HN LEU 163 -1.805 9.920 -6.614
68 HA LEU 163 HA LEU 163 -2.940 12.147 -5.280
69 1HB LEU 163 HB2 LEU 163 -3.764 10.402 -7.570
70 2HB LEU 163 HB1 LEU 163 -4.870 11.606 -6.938
71 HG LEU 163 HG LEU 163 -2.158 12.121 -8.159
72 1HD1 LEU 163 HD11 LEU 163 -3.820 13.563 -9.627
73 2HD1 LEU 163 HD12 LEU 163 -4.964 12.325 -9.106
74 3HD1 LEU 163 HD13 LEU 163 -3.503 11.864 -9.979
75 1HD2 LEU 163 HD21 LEU 163 -2.278 13.772 -6.545
76 2HD2 LEU 163 HD22 LEU 163 -4.035 13.883 -6.641
77 3HD2 LEU 163 HD23 LEU 163 -3.038 14.554 -7.931
78 H PHE 164 HN PHE 164 -2.980 8.956 -4.596
79 HA PHE 164 HA PHE 164 -5.669 8.580 -3.712
80 1HB PHE 164 HB2 PHE 164 -3.380 7.022 -4.257
81 2HB PHE 164 HB1 PHE 164 -3.759 6.760 -2.558
82 HD1 PHE 164 HD1 PHE 164 -4.626 4.602 -2.512
83 HD2 PHE 164 HD2 PHE 164 -6.103 7.386 -5.372
84 HE1 PHE 164 HE1 PHE 164 -6.392 3.010 -3.144
85 HE2 PHE 164 HE2 PHE 164 -7.872 5.799 -6.008
86 HZ PHE 164 HZ PHE 164 -8.018 3.608 -4.893
87 H LEU 165 HN LEU 165 -3.806 10.775 -2.588
88 HA LEU 165 HA LEU 165 -3.998 11.928 -0.587
89 1HB LEU 165 HB2 LEU 165 -5.681 9.899 0.025
90 2HB LEU 165 HB1 LEU 165 -4.346 9.541 1.119
91 HG LEU 165 HG LEU 165 -5.304 12.346 1.096
92 1HD1 LEU 165 HD11 LEU 165 -7.461 11.616 1.153
93 2HD1 LEU 165 HD12 LEU 165 -7.055 11.453 2.862
94 3HD1 LEU 165 HD13 LEU 165 -7.029 10.037 1.811
95 1HD2 LEU 165 HD21 LEU 165 -5.166 11.599 3.658
96 2HD2 LEU 165 HD22 LEU 165 -3.755 12.105 2.730
97 3HD2 LEU 165 HD23 LEU 165 -4.094 10.389 2.953
98 H LEU 166 HN LEU 166 -2.446 8.769 -0.688
99 HA LEU 166 HA LEU 166 0.068 9.899 0.090
100 1HB LEU 166 HB2 LEU 166 -1.705 8.558 2.034
101 2HB LEU 166 HB1 LEU 166 -0.022 8.043 2.068
102 HG LEU 166 HG LEU 166 -1.126 10.798 2.597
103 1HD1 LEU 166 HD11 LEU 166 0.777 9.479 4.412
104 2HD1 LEU 166 HD12 LEU 166 -0.822 8.744 4.297
105 3HD1 LEU 166 HD13 LEU 166 -0.661 10.436 4.767
106 1HD2 LEU 166 HD21 LEU 166 0.865 11.080 1.234
107 2HD2 LEU 166 HD22 LEU 166 1.763 9.990 2.289
108 3HD2 LEU 166 HD23 LEU 166 1.193 11.541 2.903
109 HA PRO 167 HA PRO 167 1.466 6.150 -1.825
110 1HB PRO 167 HB2 PRO 167 3.901 5.783 -0.782
111 2HB PRO 167 HB1 PRO 167 3.527 7.211 -1.767
112 1HG PRO 167 HG2 PRO 167 3.770 6.958 1.198
113 2HG PRO 167 HG1 PRO 167 4.267 8.289 0.139
114 1HD PRO 167 HD2 PRO 167 1.922 8.194 1.646
115 2HD PRO 167 HD1 PRO 167 2.227 9.285 0.281
116 HA PRO 168 HA PRO 168 0.278 3.009 1.205
117 1HB PRO 168 HB2 PRO 168 -0.533 1.141 -0.542
118 2HB PRO 168 HB1 PRO 168 -1.501 2.591 -0.204
119 1HG PRO 168 HG2 PRO 168 0.324 2.021 -2.511
120 2HG PRO 168 HG1 PRO 168 -1.282 2.771 -2.514
121 1HD PRO 168 HD2 PRO 168 1.062 4.184 -2.629
122 2HD PRO 168 HD1 PRO 168 -0.451 4.835 -1.968
123 H ILE 169 HN ILE 169 3.012 3.235 -0.506
124 HA ILE 169 HA ILE 169 3.875 0.505 -0.628
125 HB ILE 169 HB ILE 169 4.674 2.697 -1.905
126 1HG1 ILE 169 HG12 ILE 169 6.484 0.378 -1.205
127 2HG1 ILE 169 HG11 ILE 169 5.271 0.387 -2.482
128 1HG2 ILE 169 HG21 ILE 169 6.602 3.713 -1.126
129 2HG2 ILE 169 HG22 ILE 169 6.940 2.417 0.021
130 3HG2 ILE 169 HG23 ILE 169 5.619 3.544 0.330
131 1HD1 ILE 169 HD11 ILE 169 7.958 1.605 -2.402
132 2HD1 ILE 169 HD12 ILE 169 6.697 2.501 -3.249
133 3HD1 ILE 169 HD13 ILE 169 7.086 0.853 -3.737
134 H ILE 170 HN ILE 170 4.049 3.068 1.679
135 HA ILE 170 HA ILE 170 6.151 2.047 3.284
136 HB ILE 170 HB ILE 170 3.965 4.002 3.995
137 1HG1 ILE 170 HG12 ILE 170 6.779 4.837 3.557
138 2HG1 ILE 170 HG11 ILE 170 5.870 4.356 2.128
139 1HG2 ILE 170 HG21 ILE 170 4.820 3.162 6.039
140 2HG2 ILE 170 HG22 ILE 170 5.606 4.717 5.772
141 3HG2 ILE 170 HG23 ILE 170 6.481 3.221 5.449
142 1HD1 ILE 170 HD11 ILE 170 5.310 6.602 4.029
143 2HD1 ILE 170 HD12 ILE 170 4.090 5.991 2.913
144 3HD1 ILE 170 HD13 ILE 170 5.593 6.670 2.290
145 H LEU 171 HN LEU 171 2.629 2.181 4.025
146 HA LEU 171 HA LEU 171 2.869 0.523 6.296
147 1HB LEU 171 HB2 LEU 171 0.502 0.427 6.340
148 2HB LEU 171 HB1 LEU 171 0.940 2.031 5.799
149 HG LEU 171 HG LEU 171 0.157 -0.132 3.866
150 1HD1 LEU 171 HD11 LEU 171 -1.803 1.932 4.666
151 2HD1 LEU 171 HD12 LEU 171 -1.547 0.586 5.776
152 3HD1 LEU 171 HD13 LEU 171 -2.057 0.275 4.116
153 1HD2 LEU 171 HD21 LEU 171 -0.613 2.174 2.770
154 2HD2 LEU 171 HD22 LEU 171 1.008 1.516 2.562
155 3HD2 LEU 171 HD23 LEU 171 0.715 2.769 3.765
156 H ASP 172 HN ASP 172 1.887 -0.147 2.999
157 HA ASP 172 HA ASP 172 1.595 -2.953 3.382
158 1HB ASP 172 HB2 ASP 172 1.974 -1.473 0.770
159 2HB ASP 172 HB1 ASP 172 1.286 -3.088 0.989
160 H ALA 173 HN ALA 173 4.334 -1.113 3.435
161 HA ALA 173 HA ALA 173 6.058 -2.691 1.808
162 1HB ALA 173 HB1 ALA 173 7.529 -1.408 3.889
163 2HB ALA 173 HB2 ALA 173 6.292 -0.301 3.298
164 3HB ALA 173 HB3 ALA 173 7.453 -1.001 2.175
165 H GLY 174 HN GLY 174 5.996 -2.254 5.337
166 1HA GLY 174 HA2 GLY 174 6.695 -5.115 5.626
167 2HA GLY 174 HA1 GLY 174 7.336 -3.847 6.687
168 H TYR 175 HN TYR 175 4.389 -2.745 6.231
169 HA TYR 175 HA TYR 175 2.412 -2.742 7.324
170 1HB TYR 175 HB2 TYR 175 2.174 -5.076 6.624
171 2HB TYR 175 HB1 TYR 175 3.122 -5.605 8.009
172 HD1 TYR 175 HD1 TYR 175 0.470 -3.007 7.984
173 HD2 TYR 175 HD2 TYR 175 1.571 -6.946 9.155
174 HE1 TYR 175 HE1 TYR 175 -1.584 -3.176 9.326
175 HE2 TYR 175 HE2 TYR 175 -0.480 -7.126 10.499
176 HH TYR 175 HH TYR 175 -2.649 -6.154 10.691
177 H PHE 176 HN PHE 176 4.614 -4.705 9.315
178 HA PHE 176 HA PHE 176 3.914 -3.037 11.623
179 1HB PHE 176 HB2 PHE 176 3.798 -5.632 11.619
180 2HB PHE 176 HB1 PHE 176 5.559 -5.551 11.773
181 HD1 PHE 176 HD1 PHE 176 6.589 -4.910 13.818
182 HD2 PHE 176 HD2 PHE 176 2.357 -4.742 13.397
183 HE1 PHE 176 HE1 PHE 176 6.363 -4.618 16.250
184 HE2 PHE 176 HE2 PHE 176 2.124 -4.449 15.829
185 HZ PHE 176 HZ PHE 176 4.128 -4.386 17.259
186 H LEU 177 HN LEU 177 5.927 -2.544 9.330
187 HA LEU 177 HA LEU 177 8.392 -2.314 10.860
188 1HB LEU 177 HB2 LEU 177 7.744 -1.923 7.951
189 2HB LEU 177 HB1 LEU 177 9.292 -1.461 8.631
190 HG LEU 177 HG LEU 177 8.127 -4.239 8.484
191 1HD1 LEU 177 HD11 LEU 177 9.381 -2.933 6.533
192 2HD1 LEU 177 HD12 LEU 177 9.600 -4.662 6.811
193 3HD1 LEU 177 HD13 LEU 177 10.793 -3.513 7.417
194 1HD2 LEU 177 HD21 LEU 177 10.517 -3.181 9.963
195 2HD2 LEU 177 HD22 LEU 177 10.414 -4.861 9.437
196 3HD2 LEU 177 HD23 LEU 177 9.217 -4.214 10.559
197 HA PRO 178 HA PRO 178 7.534 2.288 9.772
198 1HB PRO 178 HB2 PRO 178 4.718 2.530 9.068
199 2HB PRO 178 HB1 PRO 178 6.140 3.002 8.141
200 1HG PRO 178 HG2 PRO 178 4.514 0.935 7.436
201 2HG PRO 178 HG1 PRO 178 6.235 1.011 7.024
202 1HD PRO 178 HD2 PRO 178 4.873 -0.511 9.213
203 2HD PRO 178 HD1 PRO 178 6.204 -1.011 8.151
204 H LEU 179 HN LEU 179 4.099 1.898 10.509
205 HA LEU 179 HA LEU 179 2.892 2.532 12.325
206 1HB LEU 179 HB2 LEU 179 5.181 1.193 13.763
207 2HB LEU 179 HB1 LEU 179 3.625 1.577 14.473
208 HG LEU 179 HG LEU 179 4.188 -0.439 12.302
209 1HD1 LEU 179 HD11 LEU 179 4.622 -1.579 14.219
210 2HD1 LEU 179 HD12 LEU 179 2.872 -1.790 14.165
211 3HD1 LEU 179 HD13 LEU 179 3.579 -0.550 15.202
212 1HD2 LEU 179 HD21 LEU 179 1.779 -0.913 12.341
213 2HD2 LEU 179 HD22 LEU 179 2.121 0.721 11.772
214 3HD2 LEU 179 HD23 LEU 179 1.534 0.464 13.416
215 H ARG 180 HN ARG 180 4.209 4.628 11.360
216 HA ARG 180 HA ARG 180 4.842 6.757 11.878
217 1HB ARG 180 HB2 ARG 180 4.240 5.900 14.719
218 2HB ARG 180 HB1 ARG 180 4.482 7.566 14.178
219 1HG ARG 180 HG2 ARG 180 2.383 5.960 12.826
220 2HG ARG 180 HG1 ARG 180 2.075 6.510 14.474
221 1HD ARG 180 HD2 ARG 180 1.228 8.241 13.183
222 2HD ARG 180 HD1 ARG 180 2.842 8.814 13.601
223 HE ARG 180 HE ARG 180 2.720 7.392 11.104
224 1HH1 ARG 180 1HH1 ARG 180 2.366 10.499 12.654
225 2HH1 ARG 180 2HH1 ARG 180 2.691 11.398 11.210
226 1HH2 ARG 180 1HH2 ARG 180 3.148 8.574 9.202
227 2HH2 ARG 180 2HH2 ARG 180 3.133 10.305 9.250
228 1HG HSL 181 HG1 HSL 181 11.331 4.156 12.702
229 2HG HSL 181 HG2 HSL 181 10.919 3.071 11.273
230 H HSL 181 HN HSL 181 6.818 4.953 11.398
231 HA HSL 181 HA HSL 181 9.010 5.732 13.395
232 1HB HSL 181 HB1 HSL 181 9.208 3.374 13.502
233 2HB HSL 181 HB2 HSL 181 8.553 3.148 11.792
Start of MODEL 73
1 1H PHE 155 HT1 PHE 155 -8.936 9.019 5.799
2 2H PHE 155 HT2 PHE 155 -8.408 9.627 4.283
3 3H PHE 155 HT3 PHE 155 -7.623 8.273 4.990
4 HA PHE 155 HA PHE 155 -9.848 7.153 4.895
5 1HB PHE 155 HB2 PHE 155 -10.291 9.274 2.788
6 2HB PHE 155 HB1 PHE 155 -11.422 8.031 3.312
7 HD1 PHE 155 HD1 PHE 155 -11.224 8.231 6.232
8 HD2 PHE 155 HD2 PHE 155 -11.335 11.282 3.268
9 HE1 PHE 155 HE1 PHE 155 -12.175 9.791 7.880
10 HE2 PHE 155 HE2 PHE 155 -12.286 12.848 4.910
11 HZ PHE 155 HZ PHE 155 -12.707 12.104 7.219
12 H LEU 156 HN LEU 156 -9.947 5.528 3.342
13 HA LEU 156 HA LEU 156 -8.511 5.676 0.878
14 1HB LEU 156 HB2 LEU 156 -7.429 3.994 3.135
15 2HB LEU 156 HB1 LEU 156 -6.992 3.751 1.455
16 HG LEU 156 HG LEU 156 -6.428 6.220 3.098
17 1HD1 LEU 156 HD11 LEU 156 -5.118 3.886 3.251
18 2HD1 LEU 156 HD12 LEU 156 -4.334 5.457 3.435
19 3HD1 LEU 156 HD13 LEU 156 -4.272 4.616 1.886
20 1HD2 LEU 156 HD21 LEU 156 -6.898 6.673 0.693
21 2HD2 LEU 156 HD22 LEU 156 -5.566 5.597 0.279
22 3HD2 LEU 156 HD23 LEU 156 -5.255 7.074 1.191
23 H GLN 157 HN GLN 157 -10.667 5.121 0.221
24 HA GLN 157 HA GLN 157 -10.996 2.301 -0.114
25 1HB GLN 157 HB2 GLN 157 -11.918 2.870 2.224
26 2HB GLN 157 HB1 GLN 157 -13.253 3.622 1.362
27 1HG GLN 157 HG2 GLN 157 -14.081 1.524 1.750
28 2HG GLN 157 HG1 GLN 157 -13.395 1.332 0.138
29 1HE2 GLN 157 HE21 GLN 157 -12.090 1.284 3.440
30 2HE2 GLN 157 HE22 GLN 157 -11.280 -0.234 3.281
31 H SER 158 HN SER 158 -11.177 5.182 -1.462
32 HA SER 158 HA SER 158 -13.726 5.004 -2.763
33 1HB SER 158 HB2 SER 158 -13.151 7.232 -2.615
34 2HB SER 158 HB1 SER 158 -11.429 6.897 -2.858
35 HG SER 158 HG SER 158 -11.789 6.674 -5.030
36 H ASP 159 HN ASP 159 -10.462 4.206 -3.380
37 HA ASP 159 HA ASP 159 -11.091 2.321 -5.399
38 1HB ASP 159 HB2 ASP 159 -10.695 4.975 -6.309
39 2HB ASP 159 HB1 ASP 159 -9.235 4.082 -6.722
40 H VAL 160 HN VAL 160 -8.760 4.377 -3.821
41 HA VAL 160 HA VAL 160 -6.736 4.020 -2.888
42 HB VAL 160 HB VAL 160 -8.134 1.777 -2.250
43 1HG1 VAL 160 HG11 VAL 160 -6.598 -0.142 -2.463
44 2HG1 VAL 160 HG12 VAL 160 -5.575 0.817 -3.529
45 3HG1 VAL 160 HG13 VAL 160 -7.216 0.403 -4.019
46 1HG2 VAL 160 HG21 VAL 160 -5.906 1.307 -0.868
47 2HG2 VAL 160 HG22 VAL 160 -6.987 2.654 -0.512
48 3HG2 VAL 160 HG23 VAL 160 -5.527 2.924 -1.464
49 H PHE 161 HN PHE 161 -7.171 1.631 -5.510
50 HA PHE 161 HA PHE 161 -4.424 1.669 -6.252
51 1HB PHE 161 HB2 PHE 161 -6.901 0.597 -7.596
52 2HB PHE 161 HB1 PHE 161 -5.302 0.473 -8.323
53 HD1 PHE 161 HD1 PHE 161 -7.612 -0.926 -5.971
54 HD2 PHE 161 HD2 PHE 161 -3.503 -0.770 -7.067
55 HE1 PHE 161 HE1 PHE 161 -7.195 -2.981 -4.682
56 HE2 PHE 161 HE2 PHE 161 -3.079 -2.824 -5.781
57 HZ PHE 161 HZ PHE 161 -4.925 -3.932 -4.587
58 H PHE 162 HN PHE 162 -6.701 4.014 -6.566
59 HA PHE 162 HA PHE 162 -5.172 5.449 -8.522
60 1HB PHE 162 HB2 PHE 162 -8.072 4.939 -9.196
61 2HB PHE 162 HB1 PHE 162 -6.857 5.752 -10.185
62 HD1 PHE 162 HD1 PHE 162 -5.228 4.488 -11.437
63 HD2 PHE 162 HD2 PHE 162 -8.139 2.530 -9.029
64 HE1 PHE 162 HE1 PHE 162 -4.716 2.359 -12.559
65 HE2 PHE 162 HE2 PHE 162 -7.633 0.397 -10.146
66 HZ PHE 162 HZ PHE 162 -5.919 0.309 -11.913
67 H LEU 163 HN LEU 163 -6.542 5.482 -5.717
68 HA LEU 163 HA LEU 163 -8.301 7.714 -5.750
69 1HB LEU 163 HB2 LEU 163 -7.288 5.854 -3.846
70 2HB LEU 163 HB1 LEU 163 -6.973 7.464 -3.232
71 HG LEU 163 HG LEU 163 -9.643 6.287 -3.969
72 1HD1 LEU 163 HD11 LEU 163 -8.236 6.935 -1.426
73 2HD1 LEU 163 HD12 LEU 163 -9.227 5.537 -1.843
74 3HD1 LEU 163 HD13 LEU 163 -9.992 7.088 -1.497
75 1HD2 LEU 163 HD21 LEU 163 -10.227 8.659 -2.810
76 2HD2 LEU 163 HD22 LEU 163 -10.170 8.393 -4.552
77 3HD2 LEU 163 HD23 LEU 163 -8.778 9.084 -3.721
78 H PHE 164 HN PHE 164 -4.874 7.224 -5.293
79 HA PHE 164 HA PHE 164 -3.088 8.626 -5.399
80 1HB PHE 164 HB2 PHE 164 -4.461 9.505 -7.388
81 2HB PHE 164 HB1 PHE 164 -4.915 10.832 -6.323
82 HD1 PHE 164 HD1 PHE 164 -3.684 12.753 -6.509
83 HD2 PHE 164 HD2 PHE 164 -1.810 9.023 -7.344
84 HE1 PHE 164 HE1 PHE 164 -1.606 13.932 -7.094
85 HE2 PHE 164 HE2 PHE 164 0.272 10.196 -7.930
86 HZ PHE 164 HZ PHE 164 0.376 12.654 -7.805
87 H LEU 165 HN LEU 165 -5.373 8.813 -3.172
88 HA LEU 165 HA LEU 165 -4.999 11.362 -1.981
89 1HB LEU 165 HB2 LEU 165 -5.714 8.801 -0.555
90 2HB LEU 165 HB1 LEU 165 -6.035 10.437 -0.017
91 HG LEU 165 HG LEU 165 -7.337 9.040 -2.354
92 1HD1 LEU 165 HD11 LEU 165 -8.690 10.140 0.079
93 2HD1 LEU 165 HD12 LEU 165 -8.011 8.513 0.069
94 3HD1 LEU 165 HD13 LEU 165 -9.279 8.947 -1.077
95 1HD2 LEU 165 HD21 LEU 165 -7.179 11.260 -3.054
96 2HD2 LEU 165 HD22 LEU 165 -7.433 11.887 -1.426
97 3HD2 LEU 165 HD23 LEU 165 -8.775 11.160 -2.309
98 H LEU 166 HN LEU 166 -3.614 8.174 -1.334
99 HA LEU 166 HA LEU 166 -1.138 9.330 -0.454
100 1HB LEU 166 HB2 LEU 166 -1.873 9.598 1.657
101 2HB LEU 166 HB1 LEU 166 -3.252 8.539 1.408
102 HG LEU 166 HG LEU 166 -0.527 7.336 1.734
103 1HD1 LEU 166 HD11 LEU 166 -2.242 7.974 4.107
104 2HD1 LEU 166 HD12 LEU 166 -0.991 9.086 3.549
105 3HD1 LEU 166 HD13 LEU 166 -0.558 7.455 4.061
106 1HD2 LEU 166 HD21 LEU 166 -2.401 5.883 3.135
107 2HD2 LEU 166 HD22 LEU 166 -1.832 5.541 1.502
108 3HD2 LEU 166 HD23 LEU 166 -3.307 6.476 1.743
109 HA PRO 167 HA PRO 167 -0.062 5.359 -2.203
110 1HB PRO 167 HB2 PRO 167 2.617 5.497 -1.826
111 2HB PRO 167 HB1 PRO 167 1.779 6.409 -3.097
112 1HG PRO 167 HG2 PRO 167 2.709 7.330 -0.400
113 2HG PRO 167 HG1 PRO 167 2.835 8.149 -1.968
114 1HD PRO 167 HD2 PRO 167 0.925 8.762 -0.145
115 2HD PRO 167 HD1 PRO 167 0.657 8.896 -1.895
116 HA PRO 168 HA PRO 168 0.151 3.191 1.762
117 1HB PRO 168 HB2 PRO 168 -0.886 0.866 0.932
118 2HB PRO 168 HB1 PRO 168 -1.898 2.308 1.151
119 1HG PRO 168 HG2 PRO 168 -0.756 1.158 -1.371
120 2HG PRO 168 HG1 PRO 168 -2.383 1.797 -1.070
121 1HD PRO 168 HD2 PRO 168 -0.379 3.218 -2.290
122 2HD PRO 168 HD1 PRO 168 -1.720 3.965 -1.398
123 H ILE 169 HN ILE 169 2.514 3.430 0.070
124 HA ILE 169 HA ILE 169 3.598 0.805 -0.343
125 HB ILE 169 HB ILE 169 4.183 3.084 -1.511
126 1HG1 ILE 169 HG12 ILE 169 6.290 1.030 -0.810
127 2HG1 ILE 169 HG11 ILE 169 5.110 0.890 -2.111
128 1HG2 ILE 169 HG21 ILE 169 4.943 4.027 0.749
129 2HG2 ILE 169 HG22 ILE 169 5.958 4.325 -0.662
130 3HG2 ILE 169 HG23 ILE 169 6.404 3.071 0.495
131 1HD1 ILE 169 HD11 ILE 169 6.128 2.622 -3.343
132 2HD1 ILE 169 HD12 ILE 169 7.434 1.579 -2.780
133 3HD1 ILE 169 HD13 ILE 169 7.120 3.114 -1.972
134 H ILE 170 HN ILE 170 3.747 3.272 2.093
135 HA ILE 170 HA ILE 170 5.878 2.179 3.619
136 HB ILE 170 HB ILE 170 3.724 3.995 4.674
137 1HG1 ILE 170 HG12 ILE 170 4.440 5.042 2.651
138 2HG1 ILE 170 HG11 ILE 170 5.261 5.867 3.972
139 1HG2 ILE 170 HG21 ILE 170 6.514 4.390 5.457
140 2HG2 ILE 170 HG22 ILE 170 5.833 2.837 5.943
141 3HG2 ILE 170 HG23 ILE 170 5.051 4.337 6.442
142 1HD1 ILE 170 HD11 ILE 170 6.532 3.670 2.368
143 2HD1 ILE 170 HD12 ILE 170 7.310 4.800 3.477
144 3HD1 ILE 170 HD13 ILE 170 6.653 5.378 1.946
145 H LEU 171 HN LEU 171 2.333 2.043 3.940
146 HA LEU 171 HA LEU 171 2.344 0.508 6.326
147 1HB LEU 171 HB2 LEU 171 0.211 0.562 4.183
148 2HB LEU 171 HB1 LEU 171 0.005 0.044 5.844
149 HG LEU 171 HG LEU 171 -0.924 2.136 5.935
150 1HD1 LEU 171 HD11 LEU 171 1.218 1.885 7.398
151 2HD1 LEU 171 HD12 LEU 171 0.407 3.446 7.277
152 3HD1 LEU 171 HD13 LEU 171 1.861 3.131 6.328
153 1HD2 LEU 171 HD21 LEU 171 0.462 2.525 3.516
154 2HD2 LEU 171 HD22 LEU 171 0.891 3.869 4.573
155 3HD2 LEU 171 HD23 LEU 171 -0.802 3.531 4.220
156 H ASP 172 HN ASP 172 1.850 -0.358 2.937
157 HA ASP 172 HA ASP 172 1.961 -3.170 3.403
158 1HB ASP 172 HB2 ASP 172 0.803 -1.888 1.467
159 2HB ASP 172 HB1 ASP 172 2.408 -1.888 0.719
160 H ALA 173 HN ALA 173 4.350 -0.923 3.612
161 HA ALA 173 HA ALA 173 6.435 -2.185 2.133
162 1HB ALA 173 HB1 ALA 173 7.497 -0.670 4.304
163 2HB ALA 173 HB2 ALA 173 6.131 0.205 3.617
164 3HB ALA 173 HB3 ALA 173 7.477 -0.275 2.586
165 H GLY 174 HN GLY 174 5.701 -1.943 5.599
166 1HA GLY 174 HA2 GLY 174 7.052 -4.549 5.991
167 2HA GLY 174 HA1 GLY 174 7.191 -3.220 7.159
168 H TYR 175 HN TYR 175 4.374 -2.456 6.675
169 HA TYR 175 HA TYR 175 2.269 -2.894 7.321
170 1HB TYR 175 HB2 TYR 175 3.068 -5.373 6.506
171 2HB TYR 175 HB1 TYR 175 2.673 -5.684 8.194
172 HD1 TYR 175 HD1 TYR 175 1.119 -3.518 5.568
173 HD2 TYR 175 HD2 TYR 175 0.609 -6.701 8.346
174 HE1 TYR 175 HE1 TYR 175 -1.267 -3.641 4.982
175 HE2 TYR 175 HE2 TYR 175 -1.778 -6.832 7.767
176 HH TYR 175 HH TYR 175 -3.095 -5.389 5.061
177 H PHE 176 HN PHE 176 5.000 -3.422 9.270
178 HA PHE 176 HA PHE 176 3.425 -3.525 11.735
179 1HB PHE 176 HB2 PHE 176 5.351 -5.047 11.595
180 2HB PHE 176 HB1 PHE 176 6.424 -3.674 11.293
181 HD1 PHE 176 HD1 PHE 176 3.658 -3.966 13.761
182 HD2 PHE 176 HD2 PHE 176 7.857 -3.684 13.121
183 HE1 PHE 176 HE1 PHE 176 4.007 -3.710 16.183
184 HE2 PHE 176 HE2 PHE 176 8.213 -3.430 15.542
185 HZ PHE 176 HZ PHE 176 6.287 -3.443 17.077
186 H LEU 177 HN LEU 177 3.077 -1.273 10.257
187 HA LEU 177 HA LEU 177 3.099 0.974 10.302
188 1HB LEU 177 HB2 LEU 177 3.838 0.300 13.131
189 2HB LEU 177 HB1 LEU 177 3.785 1.973 12.607
190 HG LEU 177 HG LEU 177 1.390 0.337 12.008
191 1HD1 LEU 177 HD11 LEU 177 0.697 1.094 14.465
192 2HD1 LEU 177 HD12 LEU 177 2.413 0.803 14.746
193 3HD1 LEU 177 HD13 LEU 177 1.391 -0.489 14.119
194 1HD2 LEU 177 HD21 LEU 177 0.435 2.561 13.019
195 2HD2 LEU 177 HD22 LEU 177 1.095 2.524 11.384
196 3HD2 LEU 177 HD23 LEU 177 2.069 3.151 12.713
197 HA PRO 178 HA PRO 178 7.880 0.464 9.621
198 1HB PRO 178 HB2 PRO 178 6.617 1.413 7.060
199 2HB PRO 178 HB1 PRO 178 8.079 0.442 7.286
200 1HG PRO 178 HG2 PRO 178 5.821 -0.725 6.629
201 2HG PRO 178 HG1 PRO 178 6.849 -1.455 7.874
202 1HD PRO 178 HD2 PRO 178 4.283 0.025 8.158
203 2HD PRO 178 HD1 PRO 178 4.940 -1.304 9.131
204 H LEU 179 HN LEU 179 5.925 2.943 7.941
205 HA LEU 179 HA LEU 179 6.094 5.211 7.875
206 1HB LEU 179 HB2 LEU 179 6.575 4.526 10.733
207 2HB LEU 179 HB1 LEU 179 6.907 6.170 10.224
208 HG LEU 179 HG LEU 179 4.644 5.892 11.178
209 1HD1 LEU 179 HD11 LEU 179 5.073 7.687 9.602
210 2HD1 LEU 179 HD12 LEU 179 3.443 7.052 9.383
211 3HD1 LEU 179 HD13 LEU 179 4.721 6.610 8.251
212 1HD2 LEU 179 HD21 LEU 179 2.952 4.652 10.014
213 2HD2 LEU 179 HD22 LEU 179 4.306 3.573 10.346
214 3HD2 LEU 179 HD23 LEU 179 4.081 4.231 8.726
215 H ARG 180 HN ARG 180 8.116 4.143 6.605
216 HA ARG 180 HA ARG 180 10.211 4.531 5.807
217 1HB ARG 180 HB2 ARG 180 9.955 6.973 7.576
218 2HB ARG 180 HB1 ARG 180 11.335 6.682 6.510
219 1HG ARG 180 HG2 ARG 180 8.510 6.759 5.493
220 2HG ARG 180 HG1 ARG 180 9.504 8.210 5.647
221 1HD ARG 180 HD2 ARG 180 9.960 7.634 3.480
222 2HD ARG 180 HD1 ARG 180 11.244 6.760 4.312
223 HE ARG 180 HE ARG 180 9.159 4.992 4.176
224 1HH1 ARG 180 1HH1 ARG 180 11.010 6.826 1.854
225 2HH1 ARG 180 2HH1 ARG 180 10.820 5.657 0.592
226 1HH2 ARG 180 1HH2 ARG 180 8.908 3.453 2.517
227 2HH2 ARG 180 2HH2 ARG 180 9.627 3.741 0.968
228 1HG HSL 181 HG1 HSL 181 11.110 -0.682 10.129
229 2HG HSL 181 HG2 HSL 181 10.025 -0.126 8.750
230 H HSL 181 HN HSL 181 10.161 2.551 7.435
231 HA HSL 181 HA HSL 181 12.481 2.948 9.397
232 1HB HSL 181 HB1 HSL 181 11.503 1.509 10.930
233 2HB HSL 181 HB2 HSL 181 9.924 1.891 10.053
Start of MODEL 74
1 1H PHE 155 HT1 PHE 155 -2.552 -8.918 -3.436
2 2H PHE 155 HT2 PHE 155 -1.360 -9.026 -2.206
3 3H PHE 155 HT3 PHE 155 -1.333 -7.720 -3.318
4 HA PHE 155 HA PHE 155 -2.290 -7.485 -0.933
5 1HB PHE 155 HB2 PHE 155 -3.446 -5.556 -1.737
6 2HB PHE 155 HB1 PHE 155 -2.083 -5.809 -2.821
7 HD1 PHE 155 HD1 PHE 155 -5.367 -4.877 -2.760
8 HD2 PHE 155 HD2 PHE 155 -2.776 -7.541 -4.833
9 HE1 PHE 155 HE1 PHE 155 -6.907 -4.874 -4.679
10 HE2 PHE 155 HE2 PHE 155 -4.311 -7.543 -6.757
11 HZ PHE 155 HZ PHE 155 -6.379 -6.208 -6.682
12 H LEU 156 HN LEU 156 -3.959 -8.032 0.334
13 HA LEU 156 HA LEU 156 -6.547 -8.644 -0.654
14 1HB LEU 156 HB2 LEU 156 -6.683 -10.965 -0.161
15 2HB LEU 156 HB1 LEU 156 -5.303 -10.727 -1.214
16 HG LEU 156 HG LEU 156 -4.019 -10.637 1.124
17 1HD1 LEU 156 HD11 LEU 156 -5.141 -12.638 2.407
18 2HD1 LEU 156 HD12 LEU 156 -6.609 -11.998 1.668
19 3HD1 LEU 156 HD13 LEU 156 -5.631 -10.972 2.715
20 1HD2 LEU 156 HD21 LEU 156 -3.152 -12.197 -0.265
21 2HD2 LEU 156 HD22 LEU 156 -4.735 -12.818 -0.735
22 3HD2 LEU 156 HD23 LEU 156 -4.021 -13.296 0.805
23 H GLN 157 HN GLN 157 -4.255 -8.898 2.015
24 HA GLN 157 HA GLN 157 -6.247 -9.015 4.050
25 1HB GLN 157 HB2 GLN 157 -4.200 -8.273 5.501
26 2HB GLN 157 HB1 GLN 157 -4.245 -9.885 4.805
27 1HG GLN 157 HG2 GLN 157 -2.054 -8.664 4.644
28 2HG GLN 157 HG1 GLN 157 -2.684 -9.323 3.137
29 1HE2 GLN 157 HE21 GLN 157 -1.851 -6.481 4.892
30 2HE2 GLN 157 HE22 GLN 157 -2.103 -5.350 3.610
31 H SER 158 HN SER 158 -5.048 -6.529 2.096
32 HA SER 158 HA SER 158 -5.379 -4.388 3.957
33 1HB SER 158 HB2 SER 158 -3.934 -4.522 1.755
34 2HB SER 158 HB1 SER 158 -5.425 -3.933 1.000
35 HG SER 158 HG SER 158 -5.337 -2.259 2.716
36 H ASP 159 HN ASP 159 -7.618 -6.357 2.642
37 HA ASP 159 HA ASP 159 -9.901 -6.238 2.681
38 1HB ASP 159 HB2 ASP 159 -9.275 -4.017 4.155
39 2HB ASP 159 HB1 ASP 159 -10.173 -3.314 2.813
40 H VAL 160 HN VAL 160 -7.894 -4.350 0.645
41 HA VAL 160 HA VAL 160 -7.973 -4.130 -1.621
42 HB VAL 160 HB VAL 160 -9.999 -5.970 -1.295
43 1HG1 VAL 160 HG11 VAL 160 -11.844 -5.256 -2.732
44 2HG1 VAL 160 HG12 VAL 160 -11.150 -3.639 -2.829
45 3HG1 VAL 160 HG13 VAL 160 -11.735 -4.257 -1.285
46 1HG2 VAL 160 HG21 VAL 160 -8.603 -4.742 -3.609
47 2HG2 VAL 160 HG22 VAL 160 -9.957 -5.824 -3.932
48 3HG2 VAL 160 HG23 VAL 160 -8.567 -6.401 -3.012
49 H PHE 161 HN PHE 161 -10.958 -3.031 0.001
50 HA PHE 161 HA PHE 161 -11.295 -0.756 -1.664
51 1HB PHE 161 HB2 PHE 161 -12.352 -1.177 1.137
52 2HB PHE 161 HB1 PHE 161 -12.977 -0.051 -0.063
53 HD1 PHE 161 HD1 PHE 161 -13.317 -3.256 1.354
54 HD2 PHE 161 HD2 PHE 161 -13.787 -1.121 -2.298
55 HE1 PHE 161 HE1 PHE 161 -14.862 -4.991 0.542
56 HE2 PHE 161 HE2 PHE 161 -15.332 -2.851 -3.116
57 HZ PHE 161 HZ PHE 161 -15.872 -4.789 -1.695
58 H PHE 162 HN PHE 162 -9.573 -1.375 1.294
59 HA PHE 162 HA PHE 162 -9.059 1.308 2.050
60 1HB PHE 162 HB2 PHE 162 -8.702 -1.141 3.163
61 2HB PHE 162 HB1 PHE 162 -7.048 -0.724 2.720
62 HD1 PHE 162 HD1 PHE 162 -7.069 2.193 3.152
63 HD2 PHE 162 HD2 PHE 162 -8.734 -0.953 5.482
64 HE1 PHE 162 HE1 PHE 162 -6.878 3.591 5.169
65 HE2 PHE 162 HE2 PHE 162 -8.549 0.438 7.502
66 HZ PHE 162 HZ PHE 162 -7.620 2.714 7.347
67 H LEU 163 HN LEU 163 -6.934 -1.139 0.594
68 HA LEU 163 HA LEU 163 -4.854 0.662 -0.090
69 1HB LEU 163 HB2 LEU 163 -4.770 -1.885 0.165
70 2HB LEU 163 HB1 LEU 163 -5.454 -1.954 -1.448
71 HG LEU 163 HG LEU 163 -3.341 -0.328 -1.898
72 1HD1 LEU 163 HD11 LEU 163 -1.486 -0.819 -0.629
73 2HD1 LEU 163 HD12 LEU 163 -2.155 -2.344 -0.047
74 3HD1 LEU 163 HD13 LEU 163 -2.756 -0.815 0.595
75 1HD2 LEU 163 HD21 LEU 163 -2.171 -2.391 -2.692
76 2HD2 LEU 163 HD22 LEU 163 -3.834 -2.226 -3.253
77 3HD2 LEU 163 HD23 LEU 163 -3.454 -3.336 -1.937
78 H PHE 164 HN PHE 164 -7.903 0.362 -1.252
79 HA PHE 164 HA PHE 164 -7.492 0.700 -4.048
80 1HB PHE 164 HB2 PHE 164 -9.603 0.069 -2.299
81 2HB PHE 164 HB1 PHE 164 -10.081 1.558 -3.113
82 HD1 PHE 164 HD1 PHE 164 -10.733 -1.691 -3.280
83 HD2 PHE 164 HD2 PHE 164 -9.046 1.315 -5.775
84 HE1 PHE 164 HE1 PHE 164 -11.382 -2.984 -5.268
85 HE2 PHE 164 HE2 PHE 164 -9.695 0.028 -7.769
86 HZ PHE 164 HZ PHE 164 -10.863 -2.124 -7.518
87 H LEU 165 HN LEU 165 -8.345 2.851 -1.348
88 HA LEU 165 HA LEU 165 -8.757 5.171 -2.911
89 1HB LEU 165 HB2 LEU 165 -7.677 5.360 -0.132
90 2HB LEU 165 HB1 LEU 165 -8.880 6.357 -0.926
91 HG LEU 165 HG LEU 165 -9.935 3.712 -0.723
92 1HD1 LEU 165 HD11 LEU 165 -9.691 3.072 1.442
93 2HD1 LEU 165 HD12 LEU 165 -9.435 4.718 2.019
94 3HD1 LEU 165 HD13 LEU 165 -8.127 3.853 1.213
95 1HD2 LEU 165 HD21 LEU 165 -11.781 4.805 0.040
96 2HD2 LEU 165 HD22 LEU 165 -10.936 6.160 -0.709
97 3HD2 LEU 165 HD23 LEU 165 -10.848 5.922 1.036
98 H LEU 166 HN LEU 166 -5.969 4.097 -1.005
99 HA LEU 166 HA LEU 166 -4.129 5.294 -2.864
100 1HB LEU 166 HB2 LEU 166 -4.387 7.298 -1.793
101 2HB LEU 166 HB1 LEU 166 -4.852 6.551 -0.276
102 HG LEU 166 HG LEU 166 -2.522 6.033 0.219
103 1HD1 LEU 166 HD11 LEU 166 -0.739 6.421 -1.204
104 2HD1 LEU 166 HD12 LEU 166 -1.650 7.550 -2.206
105 3HD1 LEU 166 HD13 LEU 166 -1.981 5.820 -2.303
106 1HD2 LEU 166 HD21 LEU 166 -1.724 8.257 0.603
107 2HD2 LEU 166 HD22 LEU 166 -3.476 8.256 0.805
108 3HD2 LEU 166 HD23 LEU 166 -2.759 8.901 -0.672
109 HA PRO 167 HA PRO 167 -2.360 1.561 -0.987
110 1HB PRO 167 HB2 PRO 167 -0.448 1.195 -2.884
111 2HB PRO 167 HB1 PRO 167 -2.131 0.669 -3.075
112 1HG PRO 167 HG2 PRO 167 -0.779 3.123 -4.132
113 2HG PRO 167 HG1 PRO 167 -1.924 2.039 -4.943
114 1HD PRO 167 HD2 PRO 167 -2.674 4.417 -3.900
115 2HD PRO 167 HD1 PRO 167 -3.755 3.009 -3.929
116 HA PRO 168 HA PRO 168 1.038 3.914 0.870
117 1HB PRO 168 HB2 PRO 168 1.029 2.673 3.228
118 2HB PRO 168 HB1 PRO 168 -0.277 3.798 2.800
119 1HG PRO 168 HG2 PRO 168 -0.249 0.802 2.702
120 2HG PRO 168 HG1 PRO 168 -1.520 1.886 3.295
121 1HD PRO 168 HD2 PRO 168 -1.501 0.731 0.800
122 2HD PRO 168 HD1 PRO 168 -2.358 2.231 1.198
123 H ILE 169 HN ILE 169 2.582 3.025 -0.576
124 HA ILE 169 HA ILE 169 3.485 0.408 -0.678
125 HB ILE 169 HB ILE 169 5.707 1.477 -1.410
126 1HG1 ILE 169 HG12 ILE 169 4.106 3.974 -1.730
127 2HG1 ILE 169 HG11 ILE 169 4.878 3.659 -0.179
128 1HG2 ILE 169 HG21 ILE 169 3.482 0.806 -2.753
129 2HG2 ILE 169 HG22 ILE 169 4.923 1.462 -3.530
130 3HG2 ILE 169 HG23 ILE 169 3.566 2.523 -3.149
131 1HD1 ILE 169 HD11 ILE 169 7.030 3.690 -1.137
132 2HD1 ILE 169 HD12 ILE 169 6.171 5.076 -1.811
133 3HD1 ILE 169 HD13 ILE 169 6.382 3.615 -2.776
134 H ILE 170 HN ILE 170 4.248 2.915 1.580
135 HA ILE 170 HA ILE 170 6.517 1.603 2.739
136 HB ILE 170 HB ILE 170 4.853 3.902 3.773
137 1HG1 ILE 170 HG12 ILE 170 7.373 4.832 3.080
138 2HG1 ILE 170 HG11 ILE 170 6.987 3.690 1.797
139 1HG2 ILE 170 HG21 ILE 170 7.527 2.873 4.715
140 2HG2 ILE 170 HG22 ILE 170 6.002 2.774 5.595
141 3HG2 ILE 170 HG23 ILE 170 6.739 4.345 5.281
142 1HD1 ILE 170 HD11 ILE 170 6.181 5.700 0.992
143 2HD1 ILE 170 HD12 ILE 170 5.573 6.204 2.570
144 3HD1 ILE 170 HD13 ILE 170 4.741 4.937 1.667
145 H LEU 171 HN LEU 171 3.146 2.171 3.738
146 HA LEU 171 HA LEU 171 3.337 0.650 6.127
147 1HB LEU 171 HB2 LEU 171 0.833 1.233 4.549
148 2HB LEU 171 HB1 LEU 171 0.945 0.845 6.254
149 HG LEU 171 HG LEU 171 1.891 3.381 4.924
150 1HD1 LEU 171 HD11 LEU 171 -0.371 3.672 5.168
151 2HD1 LEU 171 HD12 LEU 171 0.207 4.251 6.731
152 3HD1 LEU 171 HD13 LEU 171 -0.464 2.627 6.585
153 1HD2 LEU 171 HD21 LEU 171 2.525 2.172 7.534
154 2HD2 LEU 171 HD22 LEU 171 2.063 3.874 7.568
155 3HD2 LEU 171 HD23 LEU 171 3.424 3.349 6.576
156 H ASP 172 HN ASP 172 1.811 -0.072 2.988
157 HA ASP 172 HA ASP 172 1.339 -2.801 3.648
158 1HB ASP 172 HB2 ASP 172 0.672 -3.095 1.336
159 2HB ASP 172 HB1 ASP 172 -0.045 -1.615 1.985
160 H ALA 173 HN ALA 173 4.207 -1.285 3.102
161 HA ALA 173 HA ALA 173 5.430 -3.100 1.312
162 1HB ALA 173 HB1 ALA 173 7.456 -2.081 2.946
163 2HB ALA 173 HB2 ALA 173 6.244 -0.803 2.858
164 3HB ALA 173 HB3 ALA 173 6.942 -1.458 1.378
165 H GLY 174 HN GLY 174 5.634 -2.656 4.812
166 1HA GLY 174 HA2 GLY 174 6.148 -5.552 5.109
167 2HA GLY 174 HA1 GLY 174 7.016 -4.341 6.072
168 H TYR 175 HN TYR 175 4.452 -2.721 6.155
169 HA TYR 175 HA TYR 175 2.560 -2.485 7.385
170 1HB TYR 175 HB2 TYR 175 2.448 -5.153 6.745
171 2HB TYR 175 HB1 TYR 175 2.417 -5.197 8.504
172 HD1 TYR 175 HD1 TYR 175 0.815 -3.124 9.435
173 HD2 TYR 175 HD2 TYR 175 0.357 -5.278 5.794
174 HE1 TYR 175 HE1 TYR 175 -1.578 -2.556 9.406
175 HE2 TYR 175 HE2 TYR 175 -2.036 -4.715 5.755
176 HH TYR 175 HH TYR 175 -3.456 -2.633 6.875
177 H PHE 176 HN PHE 176 5.306 -4.188 8.734
178 HA PHE 176 HA PHE 176 4.625 -3.291 11.428
179 1HB PHE 176 HB2 PHE 176 5.824 -5.615 10.453
180 2HB PHE 176 HB1 PHE 176 7.155 -4.708 11.184
181 HD1 PHE 176 HD1 PHE 176 5.363 -7.338 11.919
182 HD2 PHE 176 HD2 PHE 176 5.840 -3.389 13.434
183 HE1 PHE 176 HE1 PHE 176 4.659 -8.112 14.147
184 HE2 PHE 176 HE2 PHE 176 5.137 -4.156 15.664
185 HZ PHE 176 HZ PHE 176 4.546 -6.519 16.023
186 H LEU 177 HN LEU 177 6.333 -2.205 8.759
187 HA LEU 177 HA LEU 177 8.688 -1.157 9.761
188 1HB LEU 177 HB2 LEU 177 6.920 0.240 7.760
189 2HB LEU 177 HB1 LEU 177 8.655 0.397 7.935
190 HG LEU 177 HG LEU 177 7.176 -2.049 6.968
191 1HD1 LEU 177 HD11 LEU 177 9.187 -0.488 5.408
192 2HD1 LEU 177 HD12 LEU 177 7.514 0.064 5.491
193 3HD1 LEU 177 HD13 LEU 177 7.885 -1.531 4.837
194 1HD2 LEU 177 HD21 LEU 177 8.968 -3.083 7.890
195 2HD2 LEU 177 HD22 LEU 177 9.955 -1.621 7.881
196 3HD2 LEU 177 HD23 LEU 177 9.742 -2.551 6.398
197 HA PRO 178 HA PRO 178 5.910 2.874 10.813
198 1HB PRO 178 HB2 PRO 178 3.744 1.181 11.991
199 2HB PRO 178 HB1 PRO 178 3.639 2.772 11.229
200 1HG PRO 178 HG2 PRO 178 2.885 0.599 9.903
201 2HG PRO 178 HG1 PRO 178 3.770 1.898 9.081
202 1HD PRO 178 HD2 PRO 178 4.726 -0.780 9.971
203 2HD PRO 178 HD1 PRO 178 5.206 0.180 8.559
204 H LEU 179 HN LEU 179 7.781 2.773 12.180
205 HA LEU 179 HA LEU 179 7.105 2.168 14.965
206 1HB LEU 179 HB2 LEU 179 9.569 1.266 13.491
207 2HB LEU 179 HB1 LEU 179 9.507 1.381 15.239
208 HG LEU 179 HG LEU 179 7.489 -0.270 13.758
209 1HD1 LEU 179 HD11 LEU 179 9.233 -1.447 12.940
210 2HD1 LEU 179 HD12 LEU 179 9.243 -2.131 14.564
211 3HD1 LEU 179 HD13 LEU 179 10.359 -0.831 14.148
212 1HD2 LEU 179 HD21 LEU 179 6.955 0.071 16.038
213 2HD2 LEU 179 HD22 LEU 179 8.616 -0.231 16.546
214 3HD2 LEU 179 HD23 LEU 179 7.631 -1.554 15.925
215 H ARG 180 HN ARG 180 9.689 3.448 12.909
216 HA ARG 180 HA ARG 180 10.010 5.688 14.776
217 1HB ARG 180 HB2 ARG 180 11.877 4.557 12.679
218 2HB ARG 180 HB1 ARG 180 12.217 6.001 13.639
219 1HG ARG 180 HG2 ARG 180 13.375 4.144 14.606
220 2HG ARG 180 HG1 ARG 180 12.065 4.604 15.691
221 1HD ARG 180 HD2 ARG 180 10.827 2.744 14.164
222 2HD ARG 180 HD1 ARG 180 12.470 2.140 14.124
223 HE ARG 180 HE ARG 180 11.976 1.260 16.147
224 1HH1 ARG 180 1HH1 ARG 180 10.324 4.342 16.006
225 2HH1 ARG 180 2HH1 ARG 180 9.782 4.251 17.641
226 1HH2 ARG 180 1HH2 ARG 180 11.246 1.156 18.280
227 2HH2 ARG 180 2HH2 ARG 180 10.296 2.452 18.927
228 1HG HSL 181 HG1 HSL 181 6.268 7.987 9.166
229 2HG HSL 181 HG2 HSL 181 5.078 6.614 9.460
230 H HSL 181 HN HSL 181 7.877 5.356 12.791
231 HA HSL 181 HA HSL 181 8.444 7.791 11.019
232 1HB HSL 181 HB1 HSL 181 7.866 6.199 9.349
233 2HB HSL 181 HB2 HSL 181 6.787 5.243 10.504
Start of MODEL 75
1 1H PHE 155 HT1 PHE 155 2.277 12.146 -4.595
2 2H PHE 155 HT2 PHE 155 0.609 12.518 -4.759
3 3H PHE 155 HT3 PHE 155 1.480 13.055 -3.380
4 HA PHE 155 HA PHE 155 1.174 14.855 -4.825
5 1HB PHE 155 HB2 PHE 155 3.513 14.060 -3.732
6 2HB PHE 155 HB1 PHE 155 3.990 14.203 -5.421
7 HD1 PHE 155 HD1 PHE 155 3.333 15.946 -2.374
8 HD2 PHE 155 HD2 PHE 155 3.552 16.408 -6.599
9 HE1 PHE 155 HE1 PHE 155 3.570 18.379 -2.092
10 HE2 PHE 155 HE2 PHE 155 3.792 18.842 -6.324
11 HZ PHE 155 HZ PHE 155 3.800 19.830 -4.068
12 H LEU 156 HN LEU 156 1.530 11.975 -6.416
13 HA LEU 156 HA LEU 156 1.339 11.353 -8.568
14 1HB LEU 156 HB2 LEU 156 0.396 14.180 -8.692
15 2HB LEU 156 HB1 LEU 156 0.622 13.285 -10.182
16 HG LEU 156 HG LEU 156 -1.162 12.376 -7.924
17 1HD1 LEU 156 HD11 LEU 156 -2.326 13.300 -10.467
18 2HD1 LEU 156 HD12 LEU 156 -1.662 14.555 -9.420
19 3HD1 LEU 156 HD13 LEU 156 -2.916 13.474 -8.814
20 1HD2 LEU 156 HD21 LEU 156 -1.504 11.438 -10.702
21 2HD2 LEU 156 HD22 LEU 156 -1.688 10.571 -9.177
22 3HD2 LEU 156 HD23 LEU 156 -0.080 10.848 -9.845
23 H GLN 157 HN GLN 157 3.717 11.099 -8.348
24 HA GLN 157 HA GLN 157 5.031 12.154 -10.622
25 1HB GLN 157 HB2 GLN 157 5.132 13.872 -8.461
26 2HB GLN 157 HB1 GLN 157 6.651 12.994 -8.335
27 1HG GLN 157 HG2 GLN 157 7.406 14.565 -9.732
28 2HG GLN 157 HG1 GLN 157 6.626 13.584 -10.973
29 1HE2 GLN 157 HE21 GLN 157 5.910 15.049 -12.381
30 2HE2 GLN 157 HE22 GLN 157 4.859 16.366 -12.001
31 H SER 158 HN SER 158 4.465 9.623 -9.507
32 HA SER 158 HA SER 158 7.037 8.406 -9.737
33 1HB SER 158 HB2 SER 158 7.371 8.852 -7.444
34 2HB SER 158 HB1 SER 158 5.678 8.511 -7.045
35 HG SER 158 HG SER 158 6.565 6.656 -6.488
36 H ASP 159 HN ASP 159 6.038 7.317 -11.430
37 HA ASP 159 HA ASP 159 5.036 5.512 -12.393
38 1HB ASP 159 HB2 ASP 159 5.168 4.756 -9.596
39 2HB ASP 159 HB1 ASP 159 3.713 4.116 -10.353
40 H VAL 160 HN VAL 160 3.021 6.572 -9.654
41 HA VAL 160 HA VAL 160 1.034 7.710 -9.684
42 HB VAL 160 HB VAL 160 1.649 8.041 -12.312
43 1HG1 VAL 160 HG11 VAL 160 -0.984 6.566 -12.293
44 2HG1 VAL 160 HG12 VAL 160 0.519 5.966 -12.992
45 3HG1 VAL 160 HG13 VAL 160 -0.259 7.392 -13.672
46 1HG2 VAL 160 HG21 VAL 160 -0.561 8.881 -10.549
47 2HG2 VAL 160 HG22 VAL 160 -0.767 9.191 -12.273
48 3HG2 VAL 160 HG23 VAL 160 0.632 9.844 -11.420
49 H PHE 161 HN PHE 161 1.036 4.706 -11.631
50 HA PHE 161 HA PHE 161 -1.558 3.930 -10.746
51 1HB PHE 161 HB2 PHE 161 -1.300 2.049 -12.054
52 2HB PHE 161 HB1 PHE 161 -0.138 3.126 -12.818
53 HD1 PHE 161 HD1 PHE 161 -0.612 -0.113 -11.809
54 HD2 PHE 161 HD2 PHE 161 2.280 2.999 -11.550
55 HE1 PHE 161 HE1 PHE 161 1.154 -1.790 -11.461
56 HE2 PHE 161 HE2 PHE 161 4.052 1.327 -11.200
57 HZ PHE 161 HZ PHE 161 3.490 -1.070 -11.156
58 H PHE 162 HN PHE 162 1.660 3.501 -9.544
59 HA PHE 162 HA PHE 162 1.115 1.417 -7.688
60 1HB PHE 162 HB2 PHE 162 3.341 2.617 -8.689
61 2HB PHE 162 HB1 PHE 162 3.282 3.284 -7.058
62 HD1 PHE 162 HD1 PHE 162 5.039 1.039 -8.699
63 HD2 PHE 162 HD2 PHE 162 2.258 1.078 -5.479
64 HE1 PHE 162 HE1 PHE 162 6.036 -1.031 -7.819
65 HE2 PHE 162 HE2 PHE 162 3.250 -0.992 -4.593
66 HZ PHE 162 HZ PHE 162 5.141 -2.048 -5.762
67 H LEU 163 HN LEU 163 1.862 4.845 -7.156
68 HA LEU 163 HA LEU 163 1.018 4.888 -4.456
69 1HB LEU 163 HB2 LEU 163 1.637 6.948 -6.534
70 2HB LEU 163 HB1 LEU 163 0.933 7.442 -5.004
71 HG LEU 163 HG LEU 163 3.563 6.005 -5.372
72 1HD1 LEU 163 HD11 LEU 163 3.396 8.470 -5.963
73 2HD1 LEU 163 HD12 LEU 163 4.615 8.016 -4.773
74 3HD1 LEU 163 HD13 LEU 163 3.101 8.750 -4.247
75 1HD2 LEU 163 HD21 LEU 163 2.980 5.205 -3.325
76 2HD2 LEU 163 HD22 LEU 163 1.884 6.545 -2.989
77 3HD2 LEU 163 HD23 LEU 163 3.626 6.769 -2.828
78 H PHE 164 HN PHE 164 -0.700 4.578 -7.243
79 HA PHE 164 HA PHE 164 -2.968 6.201 -6.674
80 1HB PHE 164 HB2 PHE 164 -2.856 5.833 -8.921
81 2HB PHE 164 HB1 PHE 164 -2.076 4.267 -8.725
82 HD1 PHE 164 HD1 PHE 164 -5.174 6.023 -9.289
83 HD2 PHE 164 HD2 PHE 164 -3.491 2.269 -8.199
84 HE1 PHE 164 HE1 PHE 164 -7.305 4.917 -9.825
85 HE2 PHE 164 HE2 PHE 164 -5.619 1.156 -8.734
86 HZ PHE 164 HZ PHE 164 -7.530 2.480 -9.549
87 H LEU 165 HN LEU 165 -2.176 2.751 -6.378
88 HA LEU 165 HA LEU 165 -4.709 1.918 -5.452
89 1HB LEU 165 HB2 LEU 165 -2.346 0.672 -6.129
90 2HB LEU 165 HB1 LEU 165 -2.448 0.399 -4.399
91 HG LEU 165 HG LEU 165 -3.419 -1.442 -5.748
92 1HD1 LEU 165 HD11 LEU 165 -4.282 -0.453 -3.410
93 2HD1 LEU 165 HD12 LEU 165 -4.978 -1.881 -4.177
94 3HD1 LEU 165 HD13 LEU 165 -5.763 -0.312 -4.358
95 1HD2 LEU 165 HD21 LEU 165 -4.314 0.197 -7.504
96 2HD2 LEU 165 HD22 LEU 165 -5.678 0.417 -6.411
97 3HD2 LEU 165 HD23 LEU 165 -5.326 -1.181 -7.070
98 H LEU 166 HN LEU 166 -1.772 2.955 -3.782
99 HA LEU 166 HA LEU 166 -3.293 3.767 -1.490
100 1HB LEU 166 HB2 LEU 166 -2.421 1.136 -1.534
101 2HB LEU 166 HB1 LEU 166 -1.211 1.958 -0.565
102 HG LEU 166 HG LEU 166 -2.972 2.796 0.933
103 1HD1 LEU 166 HD11 LEU 166 -4.781 1.252 -0.909
104 2HD1 LEU 166 HD12 LEU 166 -4.846 2.969 -0.513
105 3HD1 LEU 166 HD13 LEU 166 -5.250 1.767 0.711
106 1HD2 LEU 166 HD21 LEU 166 -2.249 0.932 1.956
107 2HD2 LEU 166 HD22 LEU 166 -2.387 -0.047 0.496
108 3HD2 LEU 166 HD23 LEU 166 -3.816 0.277 1.478
109 HA PRO 167 HA PRO 167 0.108 6.636 -1.687
110 1HB PRO 167 HB2 PRO 167 -0.491 8.012 0.606
111 2HB PRO 167 HB1 PRO 167 -1.252 8.297 -0.969
112 1HG PRO 167 HG2 PRO 167 -2.260 6.756 1.378
113 2HG PRO 167 HG1 PRO 167 -3.145 7.800 0.253
114 1HD PRO 167 HD2 PRO 167 -3.208 5.091 0.107
115 2HD PRO 167 HD1 PRO 167 -3.363 6.136 -1.319
116 HA PRO 168 HA PRO 168 2.198 5.263 2.308
117 1HB PRO 168 HB2 PRO 168 1.133 3.510 3.940
118 2HB PRO 168 HB1 PRO 168 0.421 5.131 3.814
119 1HG PRO 168 HG2 PRO 168 -0.511 2.559 2.604
120 2HG PRO 168 HG1 PRO 168 -1.461 3.849 3.363
121 1HD PRO 168 HD2 PRO 168 -0.993 3.534 0.618
122 2HD PRO 168 HD1 PRO 168 -1.618 4.989 1.409
123 H ILE 169 HN ILE 169 3.747 4.354 1.048
124 HA ILE 169 HA ILE 169 3.637 1.744 -0.092
125 HB ILE 169 HB ILE 169 5.056 3.645 -0.918
126 1HG1 ILE 169 HG12 ILE 169 6.514 1.073 -0.283
127 2HG1 ILE 169 HG11 ILE 169 5.422 1.318 -1.643
128 1HG2 ILE 169 HG21 ILE 169 5.890 4.391 1.275
129 2HG2 ILE 169 HG22 ILE 169 7.204 4.077 0.141
130 3HG2 ILE 169 HG23 ILE 169 6.837 2.908 1.415
131 1HD1 ILE 169 HD11 ILE 169 7.304 3.357 -1.851
132 2HD1 ILE 169 HD12 ILE 169 7.189 1.899 -2.837
133 3HD1 ILE 169 HD13 ILE 169 8.221 1.918 -1.407
134 H ILE 170 HN ILE 170 5.234 3.136 2.676
135 HA ILE 170 HA ILE 170 6.634 0.834 3.458
136 HB ILE 170 HB ILE 170 6.408 2.338 5.758
137 1HG1 ILE 170 HG12 ILE 170 6.933 4.652 5.007
138 2HG1 ILE 170 HG11 ILE 170 6.477 4.180 3.375
139 1HG2 ILE 170 HG21 ILE 170 8.377 1.318 4.323
140 2HG2 ILE 170 HG22 ILE 170 8.651 2.548 5.557
141 3HG2 ILE 170 HG23 ILE 170 8.561 3.009 3.857
142 1HD1 ILE 170 HD11 ILE 170 4.334 4.534 3.814
143 2HD1 ILE 170 HD12 ILE 170 4.831 5.217 5.362
144 3HD1 ILE 170 HD13 ILE 170 4.399 3.511 5.250
145 H LEU 171 HN LEU 171 3.425 2.022 4.260
146 HA LEU 171 HA LEU 171 3.015 0.312 6.501
147 1HB LEU 171 HB2 LEU 171 1.234 1.846 4.656
148 2HB LEU 171 HB1 LEU 171 0.520 0.611 5.670
149 HG LEU 171 HG LEU 171 2.264 2.586 7.025
150 1HD1 LEU 171 HD11 LEU 171 0.044 3.990 7.193
151 2HD1 LEU 171 HD12 LEU 171 -0.252 3.284 5.604
152 3HD1 LEU 171 HD13 LEU 171 1.196 4.251 5.884
153 1HD2 LEU 171 HD21 LEU 171 -0.463 1.827 7.914
154 2HD2 LEU 171 HD22 LEU 171 1.012 2.064 8.853
155 3HD2 LEU 171 HD23 LEU 171 0.785 0.579 7.928
156 H ASP 172 HN ASP 172 1.938 0.124 3.139
157 HA ASP 172 HA ASP 172 1.180 -2.627 3.317
158 1HB ASP 172 HB2 ASP 172 1.659 -1.051 0.783
159 2HB ASP 172 HB1 ASP 172 0.617 -2.464 1.003
160 H ALA 173 HN ALA 173 4.157 -1.154 3.224
161 HA ALA 173 HA ALA 173 5.528 -2.846 1.388
162 1HB ALA 173 HB1 ALA 173 6.391 -0.932 3.510
163 2HB ALA 173 HB2 ALA 173 6.654 -0.858 1.768
164 3HB ALA 173 HB3 ALA 173 7.563 -2.005 2.751
165 H GLY 174 HN GLY 174 5.909 -2.567 4.909
166 1HA GLY 174 HA2 GLY 174 6.223 -5.506 5.030
167 2HA GLY 174 HA1 GLY 174 7.202 -4.392 6.002
168 H TYR 175 HN TYR 175 4.252 -2.998 5.885
169 HA TYR 175 HA TYR 175 2.465 -2.819 7.258
170 1HB TYR 175 HB2 TYR 175 1.829 -5.063 6.819
171 2HB TYR 175 HB1 TYR 175 3.141 -5.712 7.793
172 HD1 TYR 175 HD1 TYR 175 2.905 -6.001 10.149
173 HD2 TYR 175 HD2 TYR 175 -0.142 -4.033 7.926
174 HE1 TYR 175 HE1 TYR 175 1.403 -6.153 12.089
175 HE2 TYR 175 HE2 TYR 175 -1.655 -4.178 9.861
176 HH TYR 175 HH TYR 175 -0.918 -6.089 12.633
177 H PHE 176 HN PHE 176 5.092 -4.578 8.944
178 HA PHE 176 HA PHE 176 4.537 -3.045 11.356
179 1HB PHE 176 HB2 PHE 176 5.269 -5.647 11.006
180 2HB PHE 176 HB1 PHE 176 6.833 -4.897 11.351
181 HD1 PHE 176 HD1 PHE 176 6.099 -2.815 13.270
182 HD2 PHE 176 HD2 PHE 176 4.721 -6.825 12.916
183 HE1 PHE 176 HE1 PHE 176 5.585 -2.846 15.676
184 HE2 PHE 176 HE2 PHE 176 4.204 -6.864 15.322
185 HZ PHE 176 HZ PHE 176 4.636 -4.873 16.705
186 H LEU 177 HN LEU 177 5.718 -1.819 8.919
187 HA LEU 177 HA LEU 177 8.423 -1.165 9.774
188 1HB LEU 177 HB2 LEU 177 6.844 -0.826 7.283
189 2HB LEU 177 HB1 LEU 177 8.087 0.368 7.603
190 HG LEU 177 HG LEU 177 8.475 -2.610 7.313
191 1HD1 LEU 177 HD11 LEU 177 8.166 -1.551 5.191
192 2HD1 LEU 177 HD12 LEU 177 9.884 -1.899 5.389
193 3HD1 LEU 177 HD13 LEU 177 9.285 -0.256 5.618
194 1HD2 LEU 177 HD21 LEU 177 10.962 -1.698 7.345
195 2HD2 LEU 177 HD22 LEU 177 10.126 -2.175 8.823
196 3HD2 LEU 177 HD23 LEU 177 10.235 -0.471 8.381
197 HA PRO 178 HA PRO 178 6.113 3.209 9.752
198 1HB PRO 178 HB2 PRO 178 3.418 2.174 10.470
199 2HB PRO 178 HB1 PRO 178 3.862 3.531 9.429
200 1HG PRO 178 HG2 PRO 178 2.999 1.247 8.380
201 2HG PRO 178 HG1 PRO 178 4.314 2.157 7.613
202 1HD PRO 178 HD2 PRO 178 4.442 -0.317 9.286
203 2HD PRO 178 HD1 PRO 178 5.385 0.127 7.851
204 H LEU 179 HN LEU 179 5.629 0.465 11.822
205 HA LEU 179 HA LEU 179 4.924 1.897 14.175
206 1HB LEU 179 HB2 LEU 179 4.871 -0.712 13.478
207 2HB LEU 179 HB1 LEU 179 6.322 -0.689 14.460
208 HG LEU 179 HG LEU 179 4.273 -1.317 15.716
209 1HD1 LEU 179 HD11 LEU 179 4.931 -0.252 17.640
210 2HD1 LEU 179 HD12 LEU 179 5.196 1.290 16.827
211 3HD1 LEU 179 HD13 LEU 179 6.355 -0.024 16.624
212 1HD2 LEU 179 HD21 LEU 179 3.355 1.484 15.807
213 2HD2 LEU 179 HD22 LEU 179 2.433 -0.018 15.864
214 3HD2 LEU 179 HD23 LEU 179 3.013 0.603 14.319
215 H ARG 180 HN ARG 180 7.774 1.869 12.483
216 HA ARG 180 HA ARG 180 9.215 2.949 14.762
217 1HB ARG 180 HB2 ARG 180 11.263 1.579 14.071
218 2HB ARG 180 HB1 ARG 180 9.991 0.730 14.956
219 1HG ARG 180 HG2 ARG 180 9.979 0.703 11.972
220 2HG ARG 180 HG1 ARG 180 11.089 -0.348 12.853
221 1HD ARG 180 HD2 ARG 180 8.084 -0.308 12.944
222 2HD ARG 180 HD1 ARG 180 9.146 -1.630 12.463
223 HE ARG 180 HE ARG 180 8.303 -0.994 15.107
224 1HH1 ARG 180 1HH1 ARG 180 10.962 -2.301 13.265
225 2HH1 ARG 180 2HH1 ARG 180 11.572 -3.247 14.581
226 1HH2 ARG 180 1HH2 ARG 180 9.105 -2.234 16.840
227 2HH2 ARG 180 2HH2 ARG 180 10.518 -3.210 16.611
228 1HG HSL 181 HG1 HSL 181 7.477 7.698 10.203
229 2HG HSL 181 HG2 HSL 181 6.808 6.759 11.637
230 H HSL 181 HN HSL 181 8.229 4.560 13.056
231 HA HSL 181 HA HSL 181 10.442 5.231 11.047
232 1HB HSL 181 HB1 HSL 181 8.877 5.931 9.483
233 2HB HSL 181 HB2 HSL 181 7.690 4.879 10.429
Start of MODEL 76
1 1H PHE 155 HT1 PHE 155 -12.545 -5.063 -10.787
2 2H PHE 155 HT2 PHE 155 -11.186 -4.128 -10.313
3 3H PHE 155 HT3 PHE 155 -10.992 -5.785 -10.716
4 HA PHE 155 HA PHE 155 -11.651 -5.334 -12.958
5 1HB PHE 155 HB2 PHE 155 -11.852 -2.526 -11.861
6 2HB PHE 155 HB1 PHE 155 -11.734 -2.864 -13.585
7 HD1 PHE 155 HD1 PHE 155 -13.856 -3.032 -10.622
8 HD2 PHE 155 HD2 PHE 155 -13.571 -3.898 -14.779
9 HE1 PHE 155 HE1 PHE 155 -16.295 -3.335 -10.722
10 HE2 PHE 155 HE2 PHE 155 -16.010 -4.203 -14.886
11 HZ PHE 155 HZ PHE 155 -17.376 -3.922 -12.856
12 H LEU 156 HN LEU 156 -9.854 -2.555 -11.692
13 HA LEU 156 HA LEU 156 -7.294 -3.696 -12.039
14 1HB LEU 156 HB2 LEU 156 -8.562 -2.409 -14.316
15 2HB LEU 156 HB1 LEU 156 -7.048 -1.644 -13.903
16 HG LEU 156 HG LEU 156 -7.556 -4.194 -15.228
17 1HD1 LEU 156 HD11 LEU 156 -4.984 -3.680 -15.656
18 2HD1 LEU 156 HD12 LEU 156 -5.489 -2.078 -15.116
19 3HD1 LEU 156 HD13 LEU 156 -6.275 -2.829 -16.505
20 1HD2 LEU 156 HD21 LEU 156 -5.545 -5.305 -14.249
21 2HD2 LEU 156 HD22 LEU 156 -6.929 -5.214 -13.160
22 3HD2 LEU 156 HD23 LEU 156 -5.576 -4.102 -12.959
23 H GLN 157 HN GLN 157 -5.845 -1.341 -12.582
24 HA GLN 157 HA GLN 157 -5.325 0.767 -11.789
25 1HB GLN 157 HB2 GLN 157 -7.884 0.869 -11.125
26 2HB GLN 157 HB1 GLN 157 -7.245 0.602 -9.509
27 1HG GLN 157 HG2 GLN 157 -6.017 2.605 -9.548
28 2HG GLN 157 HG1 GLN 157 -6.219 2.785 -11.290
29 1HE2 GLN 157 HE21 GLN 157 -8.628 1.975 -8.845
30 2HE2 GLN 157 HE22 GLN 157 -9.627 3.359 -9.111
31 H SER 158 HN SER 158 -3.412 -0.307 -11.297
32 HA SER 158 HA SER 158 -1.663 -0.641 -9.897
33 1HB SER 158 HB2 SER 158 -3.015 0.987 -8.376
34 2HB SER 158 HB1 SER 158 -3.380 -0.485 -7.460
35 HG SER 158 HG SER 158 -1.536 0.117 -6.553
36 H ASP 159 HN ASP 159 -4.408 -2.035 -8.286
37 HA ASP 159 HA ASP 159 -3.665 -4.718 -8.924
38 1HB ASP 159 HB2 ASP 159 -2.874 -3.548 -6.317
39 2HB ASP 159 HB1 ASP 159 -3.566 -5.167 -6.275
40 H VAL 160 HN VAL 160 -5.770 -2.434 -7.402
41 HA VAL 160 HA VAL 160 -7.934 -2.453 -6.842
42 HB VAL 160 HB VAL 160 -9.181 -3.270 -8.447
43 1HG1 VAL 160 HG11 VAL 160 -8.282 -4.215 -10.337
44 2HG1 VAL 160 HG12 VAL 160 -7.163 -5.228 -9.430
45 3HG1 VAL 160 HG13 VAL 160 -6.869 -3.495 -9.569
46 1HG2 VAL 160 HG21 VAL 160 -8.468 -6.074 -7.608
47 2HG2 VAL 160 HG22 VAL 160 -9.835 -5.599 -8.615
48 3HG2 VAL 160 HG23 VAL 160 -9.772 -5.102 -6.925
49 H PHE 161 HN PHE 161 -6.729 -5.802 -6.545
50 HA PHE 161 HA PHE 161 -8.349 -6.397 -4.290
51 1HB PHE 161 HB2 PHE 161 -7.261 -8.030 -5.960
52 2HB PHE 161 HB1 PHE 161 -5.802 -7.838 -4.992
53 HD1 PHE 161 HD1 PHE 161 -9.391 -8.140 -4.036
54 HD2 PHE 161 HD2 PHE 161 -5.471 -9.779 -3.804
55 HE1 PHE 161 HE1 PHE 161 -10.206 -9.860 -2.478
56 HE2 PHE 161 HE2 PHE 161 -6.279 -11.503 -2.245
57 HZ PHE 161 HZ PHE 161 -8.651 -11.544 -1.581
58 H PHE 162 HN PHE 162 -5.902 -4.260 -4.480
59 HA PHE 162 HA PHE 162 -5.517 -4.169 -1.662
60 1HB PHE 162 HB2 PHE 162 -3.502 -5.496 -3.350
61 2HB PHE 162 HB1 PHE 162 -2.863 -4.264 -2.257
62 HD1 PHE 162 HD1 PHE 162 -2.979 -7.557 -2.464
63 HD2 PHE 162 HD2 PHE 162 -4.483 -4.519 0.110
64 HE1 PHE 162 HE1 PHE 162 -3.045 -9.169 -0.605
65 HE2 PHE 162 HE2 PHE 162 -4.551 -6.126 1.973
66 HZ PHE 162 HZ PHE 162 -3.831 -8.453 1.616
67 H LEU 163 HN LEU 163 -6.010 -2.618 -4.360
68 HA LEU 163 HA LEU 163 -4.042 -0.571 -4.400
69 1HB LEU 163 HB2 LEU 163 -5.257 -0.825 -6.391
70 2HB LEU 163 HB1 LEU 163 -6.795 -0.899 -5.554
71 HG LEU 163 HG LEU 163 -6.536 1.538 -5.017
72 1HD1 LEU 163 HD11 LEU 163 -3.970 1.058 -6.298
73 2HD1 LEU 163 HD12 LEU 163 -4.487 2.372 -5.243
74 3HD1 LEU 163 HD13 LEU 163 -4.835 2.441 -6.969
75 1HD2 LEU 163 HD21 LEU 163 -6.406 1.484 -7.945
76 2HD2 LEU 163 HD22 LEU 163 -7.689 2.047 -6.874
77 3HD2 LEU 163 HD23 LEU 163 -7.533 0.328 -7.237
78 H PHE 164 HN PHE 164 -7.041 -1.131 -2.723
79 HA PHE 164 HA PHE 164 -8.195 0.036 -1.134
80 1HB PHE 164 HB2 PHE 164 -5.555 -0.343 -0.323
81 2HB PHE 164 HB1 PHE 164 -5.884 1.346 0.056
82 HD1 PHE 164 HD1 PHE 164 -5.585 -1.470 1.691
83 HD2 PHE 164 HD2 PHE 164 -8.701 1.292 0.810
84 HE1 PHE 164 HE1 PHE 164 -6.777 -2.170 3.727
85 HE2 PHE 164 HE2 PHE 164 -9.898 0.597 2.844
86 HZ PHE 164 HZ PHE 164 -8.936 -1.136 4.305
87 H LEU 165 HN LEU 165 -7.786 1.402 -3.646
88 HA LEU 165 HA LEU 165 -8.561 3.427 -4.451
89 1HB LEU 165 HB2 LEU 165 -9.124 3.774 -1.805
90 2HB LEU 165 HB1 LEU 165 -7.930 5.035 -2.070
91 HG LEU 165 HG LEU 165 -10.099 5.994 -2.373
92 1HD1 LEU 165 HD11 LEU 165 -8.443 6.814 -3.910
93 2HD1 LEU 165 HD12 LEU 165 -9.994 6.707 -4.741
94 3HD1 LEU 165 HD13 LEU 165 -8.758 5.482 -5.022
95 1HD2 LEU 165 HD21 LEU 165 -11.382 4.939 -4.475
96 2HD2 LEU 165 HD22 LEU 165 -11.678 4.435 -2.811
97 3HD2 LEU 165 HD23 LEU 165 -10.611 3.484 -3.843
98 H LEU 166 HN LEU 166 -5.682 3.117 -2.537
99 HA LEU 166 HA LEU 166 -4.091 4.405 -4.544
100 1HB LEU 166 HB2 LEU 166 -5.157 5.977 -2.477
101 2HB LEU 166 HB1 LEU 166 -3.486 5.692 -2.021
102 HG LEU 166 HG LEU 166 -3.832 7.798 -3.283
103 1HD1 LEU 166 HD11 LEU 166 -1.828 5.873 -3.599
104 2HD1 LEU 166 HD12 LEU 166 -1.723 7.602 -3.932
105 3HD1 LEU 166 HD13 LEU 166 -2.168 6.482 -5.219
106 1HD2 LEU 166 HD21 LEU 166 -5.627 7.001 -4.756
107 2HD2 LEU 166 HD22 LEU 166 -4.468 5.971 -5.596
108 3HD2 LEU 166 HD23 LEU 166 -4.298 7.724 -5.661
109 HA PRO 167 HA PRO 167 -1.506 1.293 -2.638
110 1HB PRO 167 HB2 PRO 167 0.652 1.524 -4.238
111 2HB PRO 167 HB1 PRO 167 -0.862 0.784 -4.796
112 1HG PRO 167 HG2 PRO 167 0.181 3.553 -5.261
113 2HG PRO 167 HG1 PRO 167 -0.601 2.446 -6.403
114 1HD PRO 167 HD2 PRO 167 -1.907 4.493 -5.159
115 2HD PRO 167 HD1 PRO 167 -2.706 3.004 -5.689
116 HA PRO 168 HA PRO 168 0.649 4.306 0.027
117 1HB PRO 168 HB2 PRO 168 1.179 2.481 2.010
118 2HB PRO 168 HB1 PRO 168 -0.330 3.404 1.881
119 1HG PRO 168 HG2 PRO 168 0.254 0.592 1.055
120 2HG PRO 168 HG1 PRO 168 -1.199 1.260 1.820
121 1HD PRO 168 HD2 PRO 168 -1.082 0.700 -0.820
122 2HD PRO 168 HD1 PRO 168 -2.041 2.047 -0.176
123 H ILE 169 HN ILE 169 1.816 0.934 -0.054
124 HA ILE 169 HA ILE 169 3.808 0.063 -0.767
125 HB ILE 169 HB ILE 169 3.857 2.421 -2.132
126 1HG1 ILE 169 HG12 ILE 169 6.082 0.380 -1.965
127 2HG1 ILE 169 HG11 ILE 169 4.612 0.219 -2.922
128 1HG2 ILE 169 HG21 ILE 169 5.798 3.656 -1.757
129 2HG2 ILE 169 HG22 ILE 169 6.510 2.409 -0.734
130 3HG2 ILE 169 HG23 ILE 169 5.164 3.377 -0.136
131 1HD1 ILE 169 HD11 ILE 169 6.998 1.930 -3.378
132 2HD1 ILE 169 HD12 ILE 169 5.430 2.469 -3.979
133 3HD1 ILE 169 HD13 ILE 169 6.094 0.924 -4.508
134 H ILE 170 HN ILE 170 3.822 2.793 1.437
135 HA ILE 170 HA ILE 170 6.258 2.022 2.745
136 HB ILE 170 HB ILE 170 4.166 3.953 3.740
137 1HG1 ILE 170 HG12 ILE 170 6.114 5.535 2.735
138 2HG1 ILE 170 HG11 ILE 170 6.205 4.187 1.605
139 1HG2 ILE 170 HG21 ILE 170 5.883 4.862 5.108
140 2HG2 ILE 170 HG22 ILE 170 7.120 3.887 4.315
141 3HG2 ILE 170 HG23 ILE 170 5.910 3.114 5.340
142 1HD1 ILE 170 HD11 ILE 170 4.258 6.303 1.801
143 2HD1 ILE 170 HD12 ILE 170 3.496 4.713 1.818
144 3HD1 ILE 170 HD13 ILE 170 4.563 5.165 0.489
145 H LEU 171 HN LEU 171 2.866 2.236 3.841
146 HA LEU 171 HA LEU 171 3.316 0.736 6.208
147 1HB LEU 171 HB2 LEU 171 0.796 1.420 4.696
148 2HB LEU 171 HB1 LEU 171 0.792 0.553 6.220
149 HG LEU 171 HG LEU 171 0.301 2.845 6.678
150 1HD1 LEU 171 HD11 LEU 171 2.003 3.395 8.254
151 2HD1 LEU 171 HD12 LEU 171 3.198 2.436 7.383
152 3HD1 LEU 171 HD13 LEU 171 1.861 1.637 8.209
153 1HD2 LEU 171 HD21 LEU 171 2.899 3.728 5.479
154 2HD2 LEU 171 HD22 LEU 171 1.476 4.686 5.884
155 3HD2 LEU 171 HD23 LEU 171 1.442 3.602 4.494
156 H ASP 172 HN ASP 172 1.910 -0.058 3.067
157 HA ASP 172 HA ASP 172 1.480 -2.806 3.670
158 1HB ASP 172 HB2 ASP 172 1.287 -1.097 1.226
159 2HB ASP 172 HB1 ASP 172 1.337 -2.855 1.030
160 H ALA 173 HN ALA 173 4.327 -1.199 3.307
161 HA ALA 173 HA ALA 173 5.715 -2.978 1.565
162 1HB ALA 173 HB1 ALA 173 7.553 -1.745 3.332
163 2HB ALA 173 HB2 ALA 173 6.307 -0.561 2.947
164 3HB ALA 173 HB3 ALA 173 7.212 -1.338 1.651
165 H GLY 174 HN GLY 174 6.022 -2.401 5.059
166 1HA GLY 174 HA2 GLY 174 6.705 -5.262 5.388
167 2HA GLY 174 HA1 GLY 174 7.379 -3.965 6.392
168 H TYR 175 HN TYR 175 4.450 -2.838 6.097
169 HA TYR 175 HA TYR 175 2.500 -2.874 7.245
170 1HB TYR 175 HB2 TYR 175 3.134 -5.617 6.967
171 2HB TYR 175 HB1 TYR 175 2.605 -5.386 8.630
172 HD1 TYR 175 HD1 TYR 175 1.616 -4.891 5.094
173 HD2 TYR 175 HD2 TYR 175 0.322 -5.061 9.143
174 HE1 TYR 175 HE1 TYR 175 -0.724 -4.890 4.339
175 HE2 TYR 175 HE2 TYR 175 -2.022 -5.061 8.400
176 HH TYR 175 HH TYR 175 -2.912 -5.523 5.122
177 H PHE 176 HN PHE 176 4.967 -4.603 9.188
178 HA PHE 176 HA PHE 176 4.114 -3.093 11.532
179 1HB PHE 176 HB2 PHE 176 5.391 -4.644 12.839
180 2HB PHE 176 HB1 PHE 176 4.481 -5.575 11.642
181 HD1 PHE 176 HD1 PHE 176 5.677 -6.422 9.606
182 HD2 PHE 176 HD2 PHE 176 7.729 -4.744 12.935
183 HE1 PHE 176 HE1 PHE 176 7.764 -7.484 8.849
184 HE2 PHE 176 HE2 PHE 176 9.821 -5.802 12.184
185 HZ PHE 176 HZ PHE 176 9.840 -7.173 10.139
186 H LEU 177 HN LEU 177 6.459 -2.878 9.104
187 HA LEU 177 HA LEU 177 8.728 -1.971 10.392
188 1HB LEU 177 HB2 LEU 177 7.517 -1.186 7.752
189 2HB LEU 177 HB1 LEU 177 9.063 -0.559 8.293
190 HG LEU 177 HG LEU 177 8.450 -3.491 7.929
191 1HD1 LEU 177 HD11 LEU 177 9.763 -3.362 5.898
192 2HD1 LEU 177 HD12 LEU 177 10.003 -1.631 6.134
193 3HD1 LEU 177 HD13 LEU 177 8.390 -2.260 5.801
194 1HD2 LEU 177 HD21 LEU 177 10.488 -3.936 8.742
195 2HD2 LEU 177 HD22 LEU 177 10.415 -2.318 9.440
196 3HD2 LEU 177 HD23 LEU 177 11.224 -2.575 7.894
197 HA PRO 178 HA PRO 178 6.665 2.515 10.210
198 1HB PRO 178 HB2 PRO 178 3.896 1.658 10.851
199 2HB PRO 178 HB1 PRO 178 4.457 2.938 9.771
200 1HG PRO 178 HG2 PRO 178 3.477 0.657 8.797
201 2HG PRO 178 HG1 PRO 178 4.849 1.471 8.020
202 1HD PRO 178 HD2 PRO 178 4.827 -0.936 9.793
203 2HD PRO 178 HD1 PRO 178 5.808 -0.604 8.352
204 H LEU 179 HN LEU 179 4.744 3.316 12.117
205 HA LEU 179 HA LEU 179 4.350 3.531 14.349
206 1HB LEU 179 HB2 LEU 179 4.961 0.770 14.086
207 2HB LEU 179 HB1 LEU 179 5.828 1.360 15.490
208 HG LEU 179 HG LEU 179 2.902 1.933 15.147
209 1HD1 LEU 179 HD11 LEU 179 4.200 -0.595 16.100
210 2HD1 LEU 179 HD12 LEU 179 2.856 -0.392 14.975
211 3HD1 LEU 179 HD13 LEU 179 2.620 -0.089 16.696
212 1HD2 LEU 179 HD21 LEU 179 3.325 1.617 17.770
213 2HD2 LEU 179 HD22 LEU 179 3.540 3.158 16.940
214 3HD2 LEU 179 HD23 LEU 179 4.937 2.137 17.280
215 H ARG 180 HN ARG 180 5.912 5.285 13.792
216 HA ARG 180 HA ARG 180 7.608 6.649 14.467
217 1HB ARG 180 HB2 ARG 180 8.255 4.591 16.580
218 2HB ARG 180 HB1 ARG 180 8.601 6.326 16.612
219 1HG ARG 180 HG2 ARG 180 5.801 5.237 16.552
220 2HG ARG 180 HG1 ARG 180 6.688 5.504 18.054
221 1HD ARG 180 HD2 ARG 180 6.827 7.830 17.672
222 2HD ARG 180 HD1 ARG 180 6.330 7.659 15.990
223 HE ARG 180 HE ARG 180 4.161 7.743 16.683
224 1HH1 ARG 180 1HH1 ARG 180 6.147 6.856 19.411
225 2HH1 ARG 180 2HH1 ARG 180 4.836 6.902 20.541
226 1HH2 ARG 180 1HH2 ARG 180 2.435 7.805 18.166
227 2HH2 ARG 180 2HH2 ARG 180 2.727 7.441 19.835
228 1HG HSL 181 HG1 HSL 181 11.687 2.882 10.143
229 2HG HSL 181 HG2 HSL 181 10.218 2.882 9.032
230 H HSL 181 HN HSL 181 8.059 5.081 12.312
231 HA HSL 181 HA HSL 181 10.980 4.207 12.628
232 1HB HSL 181 HB1 HSL 181 10.068 2.195 11.772
233 2HB HSL 181 HB2 HSL 181 8.699 3.075 10.904
Start of MODEL 77
1 1H PHE 155 HT1 PHE 155 1.211 8.793 -5.967
2 2H PHE 155 HT2 PHE 155 2.310 10.107 -5.857
3 3H PHE 155 HT3 PHE 155 2.082 9.061 -4.515
4 HA PHE 155 HA PHE 155 4.104 8.537 -5.546
5 1HB PHE 155 HB2 PHE 155 2.578 6.746 -4.671
6 2HB PHE 155 HB1 PHE 155 2.014 6.505 -6.319
7 HD1 PHE 155 HD1 PHE 155 4.986 6.309 -4.132
8 HD2 PHE 155 HD2 PHE 155 3.217 5.173 -7.831
9 HE1 PHE 155 HE1 PHE 155 6.830 4.728 -4.524
10 HE2 PHE 155 HE2 PHE 155 5.059 3.589 -8.230
11 HZ PHE 155 HZ PHE 155 6.867 3.366 -6.575
12 H LEU 156 HN LEU 156 1.780 9.556 -7.685
13 HA LEU 156 HA LEU 156 1.790 10.040 -9.877
14 1HB LEU 156 HB2 LEU 156 4.703 9.689 -9.333
15 2HB LEU 156 HB1 LEU 156 4.158 9.906 -10.986
16 HG LEU 156 HG LEU 156 3.220 11.864 -8.953
17 1HD1 LEU 156 HD11 LEU 156 5.470 11.877 -8.314
18 2HD1 LEU 156 HD12 LEU 156 5.334 13.192 -9.482
19 3HD1 LEU 156 HD13 LEU 156 6.034 11.648 -9.970
20 1HD2 LEU 156 HD21 LEU 156 2.348 12.330 -11.032
21 2HD2 LEU 156 HD22 LEU 156 3.797 11.786 -11.879
22 3HD2 LEU 156 HD23 LEU 156 3.800 13.332 -11.029
23 H GLN 157 HN GLN 157 0.847 7.604 -9.392
24 HA GLN 157 HA GLN 157 2.185 5.565 -10.907
25 1HB GLN 157 HB2 GLN 157 0.714 5.116 -8.932
26 2HB GLN 157 HB1 GLN 157 -0.667 5.581 -9.916
27 1HG GLN 157 HG2 GLN 157 1.018 3.580 -11.189
28 2HG GLN 157 HG1 GLN 157 0.352 3.047 -9.646
29 1HE2 GLN 157 HE21 GLN 157 -0.229 2.175 -12.387
30 2HE2 GLN 157 HE22 GLN 157 -1.931 2.387 -12.598
31 H SER 158 HN SER 158 1.153 8.199 -12.146
32 HA SER 158 HA SER 158 0.585 8.781 -14.264
33 1HB SER 158 HB2 SER 158 1.352 6.253 -14.715
34 2HB SER 158 HB1 SER 158 -0.379 6.072 -15.042
35 HG SER 158 HG SER 158 0.168 6.812 -16.936
36 H ASP 159 HN ASP 159 -1.613 6.167 -13.254
37 HA ASP 159 HA ASP 159 -3.922 7.675 -14.091
38 1HB ASP 159 HB2 ASP 159 -3.439 5.004 -13.797
39 2HB ASP 159 HB1 ASP 159 -4.335 5.348 -12.321
40 H VAL 160 HN VAL 160 -2.557 6.570 -11.024
41 HA VAL 160 HA VAL 160 -2.524 7.575 -8.975
42 HB VAL 160 HB VAL 160 -3.174 9.744 -10.520
43 1HG1 VAL 160 HG11 VAL 160 -5.582 9.432 -10.143
44 2HG1 VAL 160 HG12 VAL 160 -4.998 10.934 -9.430
45 3HG1 VAL 160 HG13 VAL 160 -5.319 9.536 -8.404
46 1HG2 VAL 160 HG21 VAL 160 -2.225 10.930 -8.842
47 2HG2 VAL 160 HG22 VAL 160 -1.809 9.312 -8.277
48 3HG2 VAL 160 HG23 VAL 160 -3.197 10.157 -7.591
49 H PHE 161 HN PHE 161 -5.770 7.520 -10.473
50 HA PHE 161 HA PHE 161 -7.162 7.063 -8.056
51 1HB PHE 161 HB2 PHE 161 -7.883 6.526 -10.937
52 2HB PHE 161 HB1 PHE 161 -8.993 6.217 -9.606
53 HD1 PHE 161 HD1 PHE 161 -7.110 8.850 -11.379
54 HD2 PHE 161 HD2 PHE 161 -10.202 7.969 -8.592
55 HE1 PHE 161 HE1 PHE 161 -7.841 11.199 -11.453
56 HE2 PHE 161 HE2 PHE 161 -10.939 10.315 -8.661
57 HZ PHE 161 HZ PHE 161 -9.758 11.933 -10.093
58 H PHE 162 HN PHE 162 -5.441 4.993 -10.222
59 HA PHE 162 HA PHE 162 -6.555 2.511 -9.349
60 1HB PHE 162 HB2 PHE 162 -5.019 3.294 -11.435
61 2HB PHE 162 HB1 PHE 162 -3.803 2.558 -10.394
62 HD1 PHE 162 HD1 PHE 162 -6.538 1.981 -12.663
63 HD2 PHE 162 HD2 PHE 162 -4.071 0.169 -9.707
64 HE1 PHE 162 HE1 PHE 162 -7.204 -0.243 -13.477
65 HE2 PHE 162 HE2 PHE 162 -4.731 -2.060 -10.515
66 HZ PHE 162 HZ PHE 162 -6.300 -2.267 -12.403
67 H LEU 163 HN LEU 163 -3.306 3.883 -8.929
68 HA LEU 163 HA LEU 163 -2.563 2.165 -6.803
69 1HB LEU 163 HB2 LEU 163 -1.080 3.520 -8.393
70 2HB LEU 163 HB1 LEU 163 -1.403 4.882 -7.334
71 HG LEU 163 HG LEU 163 -0.492 3.453 -5.437
72 1HD1 LEU 163 HD11 LEU 163 -0.685 1.293 -6.568
73 2HD1 LEU 163 HD12 LEU 163 0.969 1.609 -6.047
74 3HD1 LEU 163 HD13 LEU 163 0.528 1.802 -7.744
75 1HD2 LEU 163 HD21 LEU 163 1.553 4.380 -5.717
76 2HD2 LEU 163 HD22 LEU 163 0.720 5.227 -7.020
77 3HD2 LEU 163 HD23 LEU 163 1.708 3.810 -7.379
78 H PHE 164 HN PHE 164 -4.748 4.608 -6.894
79 HA PHE 164 HA PHE 164 -4.264 5.952 -4.452
80 1HB PHE 164 HB2 PHE 164 -5.586 7.195 -5.864
81 2HB PHE 164 HB1 PHE 164 -6.438 5.783 -6.478
82 HD1 PHE 164 HD1 PHE 164 -6.444 8.487 -4.093
83 HD2 PHE 164 HD2 PHE 164 -8.257 4.770 -5.093
84 HE1 PHE 164 HE1 PHE 164 -8.345 9.026 -2.628
85 HE2 PHE 164 HE2 PHE 164 -10.164 5.302 -3.632
86 HZ PHE 164 HZ PHE 164 -10.209 7.433 -2.397
87 H LEU 165 HN LEU 165 -5.458 2.863 -5.201
88 HA LEU 165 HA LEU 165 -7.300 2.469 -3.079
89 1HB LEU 165 HB2 LEU 165 -6.382 0.991 -5.236
90 2HB LEU 165 HB1 LEU 165 -5.768 0.113 -3.836
91 HG LEU 165 HG LEU 165 -7.978 -0.697 -4.681
92 1HD1 LEU 165 HD11 LEU 165 -8.427 0.387 -1.943
93 2HD1 LEU 165 HD12 LEU 165 -7.086 -0.724 -2.221
94 3HD1 LEU 165 HD13 LEU 165 -8.737 -1.226 -2.584
95 1HD2 LEU 165 HD21 LEU 165 -9.302 1.651 -3.429
96 2HD2 LEU 165 HD22 LEU 165 -9.872 0.576 -4.706
97 3HD2 LEU 165 HD23 LEU 165 -8.677 1.822 -5.070
98 H LEU 166 HN LEU 166 -3.873 2.633 -3.243
99 HA LEU 166 HA LEU 166 -3.671 2.072 -0.413
100 1HB LEU 166 HB2 LEU 166 -3.627 -0.118 -1.609
101 2HB LEU 166 HB1 LEU 166 -2.186 0.418 -2.446
102 HG LEU 166 HG LEU 166 -2.242 -1.031 -0.094
103 1HD1 LEU 166 HD11 LEU 166 0.149 0.622 -0.675
104 2HD1 LEU 166 HD12 LEU 166 -0.440 -0.451 -1.945
105 3HD1 LEU 166 HD13 LEU 166 0.011 -1.109 -0.372
106 1HD2 LEU 166 HD21 LEU 166 -1.512 0.295 1.692
107 2HD2 LEU 166 HD22 LEU 166 -2.877 1.184 1.019
108 3HD2 LEU 166 HD23 LEU 166 -1.227 1.692 0.655
109 HA PRO 167 HA PRO 167 -0.922 5.469 -2.362
110 1HB PRO 167 HB2 PRO 167 -1.291 6.794 0.142
111 2HB PRO 167 HB1 PRO 167 -1.878 7.286 -1.454
112 1HG PRO 167 HG2 PRO 167 -3.298 5.896 0.722
113 2HG PRO 167 HG1 PRO 167 -3.945 6.849 -0.619
114 1HD PRO 167 HD2 PRO 167 -4.182 4.159 -0.495
115 2HD PRO 167 HD1 PRO 167 -4.036 5.037 -2.031
116 HA PRO 168 HA PRO 168 1.883 4.770 1.364
117 1HB PRO 168 HB2 PRO 168 1.083 3.473 3.523
118 2HB PRO 168 HB1 PRO 168 0.533 5.130 3.191
119 1HG PRO 168 HG2 PRO 168 -0.898 2.540 2.678
120 2HG PRO 168 HG1 PRO 168 -1.503 4.005 3.480
121 1HD PRO 168 HD2 PRO 168 -1.941 3.447 0.846
122 2HD PRO 168 HD1 PRO 168 -1.855 5.093 1.494
123 H ILE 169 HN ILE 169 2.837 3.463 -0.231
124 HA ILE 169 HA ILE 169 2.489 0.625 -0.318
125 HB ILE 169 HB ILE 169 4.649 0.732 -1.680
126 1HG1 ILE 169 HG12 ILE 169 4.053 3.677 -1.769
127 2HG1 ILE 169 HG11 ILE 169 5.205 3.011 -0.616
128 1HG2 ILE 169 HG21 ILE 169 3.267 2.189 -3.482
129 2HG2 ILE 169 HG22 ILE 169 1.981 1.778 -2.346
130 3HG2 ILE 169 HG23 ILE 169 2.927 0.500 -3.110
131 1HD1 ILE 169 HD11 ILE 169 5.396 2.666 -3.600
132 2HD1 ILE 169 HD12 ILE 169 6.599 2.210 -2.393
133 3HD1 ILE 169 HD13 ILE 169 6.237 3.913 -2.679
134 H ILE 170 HN ILE 170 4.673 2.831 1.258
135 HA ILE 170 HA ILE 170 6.625 0.936 2.040
136 HB ILE 170 HB ILE 170 5.982 3.621 3.256
137 1HG1 ILE 170 HG12 ILE 170 8.348 3.737 1.743
138 2HG1 ILE 170 HG11 ILE 170 7.197 2.850 0.749
139 1HG2 ILE 170 HG21 ILE 170 8.737 2.850 3.448
140 2HG2 ILE 170 HG22 ILE 170 7.718 1.597 4.157
141 3HG2 ILE 170 HG23 ILE 170 7.603 3.259 4.735
142 1HD1 ILE 170 HD11 ILE 170 6.925 5.083 0.144
143 2HD1 ILE 170 HD12 ILE 170 6.982 5.639 1.817
144 3HD1 ILE 170 HD13 ILE 170 5.575 4.751 1.230
145 H LEU 171 HN LEU 171 3.799 2.324 3.694
146 HA LEU 171 HA LEU 171 4.252 0.980 6.154
147 1HB LEU 171 HB2 LEU 171 2.703 2.528 6.647
148 2HB LEU 171 HB1 LEU 171 2.204 2.673 4.975
149 HG LEU 171 HG LEU 171 0.732 0.696 5.276
150 1HD1 LEU 171 HD11 LEU 171 0.709 -0.568 7.115
151 2HD1 LEU 171 HD12 LEU 171 0.759 0.831 8.188
152 3HD1 LEU 171 HD13 LEU 171 2.253 0.192 7.500
153 1HD2 LEU 171 HD21 LEU 171 -0.074 3.023 5.548
154 2HD2 LEU 171 HD22 LEU 171 0.218 2.887 7.281
155 3HD2 LEU 171 HD23 LEU 171 -0.982 1.853 6.505
156 H ASP 172 HN ASP 172 2.093 0.335 3.428
157 HA ASP 172 HA ASP 172 1.331 -2.256 4.365
158 1HB ASP 172 HB2 ASP 172 0.706 -0.524 2.056
159 2HB ASP 172 HB1 ASP 172 0.626 -2.263 1.736
160 H ALA 173 HN ALA 173 4.212 -1.206 3.171
161 HA ALA 173 HA ALA 173 4.808 -3.236 1.264
162 1HB ALA 173 HB1 ALA 173 6.123 -0.949 2.347
163 2HB ALA 173 HB2 ALA 173 6.525 -1.872 0.901
164 3HB ALA 173 HB3 ALA 173 7.207 -2.334 2.460
165 H GLY 174 HN GLY 174 5.977 -2.696 4.585
166 1HA GLY 174 HA2 GLY 174 6.425 -5.608 4.813
167 2HA GLY 174 HA1 GLY 174 7.269 -4.368 5.765
168 H TYR 175 HN TYR 175 4.570 -2.952 5.960
169 HA TYR 175 HA TYR 175 2.737 -2.873 7.302
170 1HB TYR 175 HB2 TYR 175 2.430 -5.288 6.503
171 2HB TYR 175 HB1 TYR 175 3.171 -5.770 8.025
172 HD1 TYR 175 HD1 TYR 175 0.228 -4.192 6.483
173 HD2 TYR 175 HD2 TYR 175 1.968 -5.605 10.100
174 HE1 TYR 175 HE1 TYR 175 -1.965 -4.053 7.585
175 HE2 TYR 175 HE2 TYR 175 -0.222 -5.469 11.211
176 HH TYR 175 HH TYR 175 -2.559 -5.425 10.678
177 H PHE 176 HN PHE 176 5.832 -3.752 8.319
178 HA PHE 176 HA PHE 176 5.200 -3.487 11.158
179 1HB PHE 176 HB2 PHE 176 6.684 -5.229 11.053
180 2HB PHE 176 HB1 PHE 176 7.459 -4.619 9.587
181 HD1 PHE 176 HD1 PHE 176 7.241 -4.133 13.256
182 HD2 PHE 176 HD2 PHE 176 9.469 -3.435 9.700
183 HE1 PHE 176 HE1 PHE 176 9.125 -3.304 14.604
184 HE2 PHE 176 HE2 PHE 176 11.359 -2.607 11.040
185 HZ PHE 176 HZ PHE 176 11.188 -2.541 13.496
186 H LEU 177 HN LEU 177 6.088 -1.582 8.544
187 HA LEU 177 HA LEU 177 7.982 0.175 9.489
188 1HB LEU 177 HB2 LEU 177 7.538 0.687 7.341
189 2HB LEU 177 HB1 LEU 177 5.849 0.243 7.473
190 HG LEU 177 HG LEU 177 5.352 2.413 8.506
191 1HD1 LEU 177 HD11 LEU 177 6.900 3.924 9.140
192 2HD1 LEU 177 HD12 LEU 177 7.979 3.546 7.798
193 3HD1 LEU 177 HD13 LEU 177 7.945 2.505 9.222
194 1HD2 LEU 177 HD21 LEU 177 6.365 2.027 5.806
195 2HD2 LEU 177 HD22 LEU 177 6.456 3.706 6.340
196 3HD2 LEU 177 HD23 LEU 177 4.911 2.854 6.365
197 HA PRO 178 HA PRO 178 4.396 2.829 11.474
198 1HB PRO 178 HB2 PRO 178 2.324 0.790 11.960
199 2HB PRO 178 HB1 PRO 178 2.165 2.419 11.298
200 1HG PRO 178 HG2 PRO 178 1.886 0.247 9.751
201 2HG PRO 178 HG1 PRO 178 2.638 1.734 9.143
202 1HD PRO 178 HD2 PRO 178 3.935 -0.802 10.068
203 2HD PRO 178 HD1 PRO 178 4.334 0.224 8.674
204 H LEU 179 HN LEU 179 5.998 2.667 13.117
205 HA LEU 179 HA LEU 179 5.864 0.541 15.065
206 1HB LEU 179 HB2 LEU 179 7.454 3.109 15.025
207 2HB LEU 179 HB1 LEU 179 7.601 1.875 16.259
208 HG LEU 179 HG LEU 179 9.367 1.280 14.965
209 1HD1 LEU 179 HD11 LEU 179 7.234 -0.043 13.305
210 2HD1 LEU 179 HD12 LEU 179 7.709 -0.590 14.912
211 3HD1 LEU 179 HD13 LEU 179 8.881 -0.604 13.595
212 1HD2 LEU 179 HD21 LEU 179 9.641 2.760 13.298
213 2HD2 LEU 179 HD22 LEU 179 7.927 2.778 12.888
214 3HD2 LEU 179 HD23 LEU 179 8.959 1.473 12.304
215 H ARG 180 HN ARG 180 5.793 4.066 15.542
216 HA ARG 180 HA ARG 180 4.139 3.733 17.898
217 1HB ARG 180 HB2 ARG 180 5.003 6.353 16.680
218 2HB ARG 180 HB1 ARG 180 4.573 6.017 18.361
219 1HG ARG 180 HG2 ARG 180 6.703 5.667 18.833
220 2HG ARG 180 HG1 ARG 180 6.750 4.336 17.676
221 1HD ARG 180 HD2 ARG 180 7.265 7.250 17.091
222 2HD ARG 180 HD1 ARG 180 8.469 5.966 17.157
223 HE ARG 180 HE ARG 180 7.627 5.102 15.129
224 1HH1 ARG 180 1HH1 ARG 180 6.037 8.070 16.078
225 2HH1 ARG 180 2HH1 ARG 180 5.410 8.379 14.495
226 1HH2 ARG 180 1HH2 ARG 180 6.793 5.514 13.057
227 2HH2 ARG 180 2HH2 ARG 180 5.836 6.930 12.784
228 1HG HSL 181 HG1 HSL 181 -0.504 4.697 12.492
229 2HG HSL 181 HG2 HSL 181 0.478 3.547 11.442
230 H HSL 181 HN HSL 181 3.314 3.297 14.966
231 HA HSL 181 HA HSL 181 0.795 5.043 15.020
232 1HB HSL 181 HB1 HSL 181 1.665 5.652 12.896
233 2HB HSL 181 HB2 HSL 181 2.512 4.026 12.673
Start of MODEL 78
1 1H PHE 155 HT1 PHE 155 -2.329 5.149 -11.780
2 2H PHE 155 HT2 PHE 155 -2.482 6.436 -12.904
3 3H PHE 155 HT3 PHE 155 -3.388 6.455 -11.447
4 HA PHE 155 HA PHE 155 -1.435 7.932 -11.510
5 1HB PHE 155 HB2 PHE 155 -0.610 6.808 -9.227
6 2HB PHE 155 HB1 PHE 155 -2.162 7.627 -9.360
7 HD1 PHE 155 HD1 PHE 155 -4.102 6.515 -8.770
8 HD2 PHE 155 HD2 PHE 155 -0.604 4.261 -9.659
9 HE1 PHE 155 HE1 PHE 155 -5.248 4.460 -8.051
10 HE2 PHE 155 HE2 PHE 155 -1.744 2.204 -8.945
11 HZ PHE 155 HZ PHE 155 -4.070 2.299 -8.139
12 H LEU 156 HN LEU 156 0.610 8.153 -12.110
13 HA LEU 156 HA LEU 156 2.086 5.918 -13.083
14 1HB LEU 156 HB2 LEU 156 3.863 7.635 -13.507
15 2HB LEU 156 HB1 LEU 156 2.320 7.942 -14.279
16 HG LEU 156 HG LEU 156 2.667 9.213 -11.647
17 1HD1 LEU 156 HD11 LEU 156 4.103 10.466 -13.950
18 2HD1 LEU 156 HD12 LEU 156 4.932 9.327 -12.889
19 3HD1 LEU 156 HD13 LEU 156 4.241 10.808 -12.226
20 1HD2 LEU 156 HD21 LEU 156 0.885 9.428 -13.662
21 2HD2 LEU 156 HD22 LEU 156 1.983 10.748 -14.064
22 3HD2 LEU 156 HD23 LEU 156 1.199 10.704 -12.485
23 H GLN 157 HN GLN 157 4.270 5.369 -12.424
24 HA GLN 157 HA GLN 157 5.370 6.223 -9.967
25 1HB GLN 157 HB2 GLN 157 3.560 4.998 -8.949
26 2HB GLN 157 HB1 GLN 157 3.893 3.589 -9.945
27 1HG GLN 157 HG2 GLN 157 5.257 2.805 -8.396
28 2HG GLN 157 HG1 GLN 157 6.266 4.244 -8.539
29 1HE2 GLN 157 HE21 GLN 157 5.302 2.513 -6.242
30 2HE2 GLN 157 HE22 GLN 157 4.699 3.649 -5.088
31 H SER 158 HN SER 158 5.427 2.827 -10.813
32 HA SER 158 HA SER 158 7.679 3.039 -12.564
33 1HB SER 158 HB2 SER 158 9.355 2.030 -11.156
34 2HB SER 158 HB1 SER 158 8.702 3.440 -10.303
35 HG SER 158 HG SER 158 8.143 0.699 -9.850
36 H ASP 159 HN ASP 159 4.972 1.692 -12.104
37 HA ASP 159 HA ASP 159 5.572 -0.709 -13.484
38 1HB ASP 159 HB2 ASP 159 6.106 -1.174 -10.966
39 2HB ASP 159 HB1 ASP 159 4.356 -1.233 -10.792
40 H VAL 160 HN VAL 160 3.278 0.942 -11.388
41 HA VAL 160 HA VAL 160 1.181 1.727 -11.852
42 HB VAL 160 HB VAL 160 1.961 1.127 -14.416
43 1HG1 VAL 160 HG11 VAL 160 0.964 -1.104 -14.343
44 2HG1 VAL 160 HG12 VAL 160 0.123 -0.065 -15.490
45 3HG1 VAL 160 HG13 VAL 160 -0.594 -0.399 -13.915
46 1HG2 VAL 160 HG21 VAL 160 -0.628 2.216 -13.348
47 2HG2 VAL 160 HG22 VAL 160 -0.200 2.254 -15.058
48 3HG2 VAL 160 HG23 VAL 160 0.796 3.110 -13.880
49 H PHE 161 HN PHE 161 1.622 -1.729 -12.642
50 HA PHE 161 HA PHE 161 -0.922 -2.498 -11.615
51 1HB PHE 161 HB2 PHE 161 1.446 -3.838 -12.723
52 2HB PHE 161 HB1 PHE 161 0.606 -4.780 -11.497
53 HD1 PHE 161 HD1 PHE 161 -0.759 -2.443 -14.049
54 HD2 PHE 161 HD2 PHE 161 -0.489 -6.456 -12.656
55 HE1 PHE 161 HE1 PHE 161 -2.423 -3.133 -15.725
56 HE2 PHE 161 HE2 PHE 161 -2.151 -7.153 -14.331
57 HZ PHE 161 HZ PHE 161 -3.121 -5.491 -15.867
58 H PHE 162 HN PHE 162 2.244 -2.087 -10.266
59 HA PHE 162 HA PHE 162 1.827 -3.489 -7.826
60 1HB PHE 162 HB2 PHE 162 3.898 -2.100 -9.147
61 2HB PHE 162 HB1 PHE 162 3.737 -1.405 -7.537
62 HD1 PHE 162 HD1 PHE 162 3.390 -4.885 -8.831
63 HD2 PHE 162 HD2 PHE 162 5.411 -2.234 -6.185
64 HE1 PHE 162 HE1 PHE 162 4.646 -6.783 -7.895
65 HE2 PHE 162 HE2 PHE 162 6.670 -4.128 -5.245
66 HZ PHE 162 HZ PHE 162 6.289 -6.406 -6.101
67 H LEU 163 HN LEU 163 2.110 -0.004 -8.495
68 HA LEU 163 HA LEU 163 1.136 0.831 -5.973
69 1HB LEU 163 HB2 LEU 163 2.525 2.210 -7.522
70 2HB LEU 163 HB1 LEU 163 1.140 2.344 -8.592
71 HG LEU 163 HG LEU 163 -0.091 3.439 -6.661
72 1HD1 LEU 163 HD11 LEU 163 1.026 4.162 -4.771
73 2HD1 LEU 163 HD12 LEU 163 2.615 3.985 -5.516
74 3HD1 LEU 163 HD13 LEU 163 1.709 2.555 -5.021
75 1HD2 LEU 163 HD21 LEU 163 1.371 4.496 -8.647
76 2HD2 LEU 163 HD22 LEU 163 2.228 5.165 -7.258
77 3HD2 LEU 163 HD23 LEU 163 0.502 5.468 -7.460
78 H PHE 164 HN PHE 164 -0.365 -0.634 -8.520
79 HA PHE 164 HA PHE 164 -2.890 0.694 -8.458
80 1HB PHE 164 HB2 PHE 164 -2.502 -0.252 -10.516
81 2HB PHE 164 HB1 PHE 164 -1.630 -1.622 -9.836
82 HD1 PHE 164 HD1 PHE 164 -5.097 -0.281 -9.409
83 HD2 PHE 164 HD2 PHE 164 -2.637 -3.597 -10.439
84 HE1 PHE 164 HE1 PHE 164 -7.103 -1.676 -9.695
85 HE2 PHE 164 HE2 PHE 164 -4.639 -4.998 -10.728
86 HZ PHE 164 HZ PHE 164 -6.876 -4.037 -10.355
87 H LEU 165 HN LEU 165 -1.458 -2.210 -7.069
88 HA LEU 165 HA LEU 165 -3.831 -3.323 -6.016
89 1HB LEU 165 HB2 LEU 165 -1.132 -4.018 -6.112
90 2HB LEU 165 HB1 LEU 165 -1.495 -3.880 -4.401
91 HG LEU 165 HG LEU 165 -2.886 -5.669 -6.398
92 1HD1 LEU 165 HD11 LEU 165 -1.704 -7.408 -5.557
93 2HD1 LEU 165 HD12 LEU 165 -1.563 -6.686 -3.955
94 3HD1 LEU 165 HD13 LEU 165 -0.520 -6.132 -5.266
95 1HD2 LEU 165 HD21 LEU 165 -3.511 -4.983 -3.548
96 2HD2 LEU 165 HD22 LEU 165 -3.963 -6.544 -4.233
97 3HD2 LEU 165 HD23 LEU 165 -4.595 -5.055 -4.938
98 H LEU 166 HN LEU 166 -1.411 -1.129 -4.679
99 HA LEU 166 HA LEU 166 -3.323 -0.083 -2.796
100 1HB LEU 166 HB2 LEU 166 -1.456 -2.136 -2.028
101 2HB LEU 166 HB1 LEU 166 -1.092 -0.655 -1.161
102 HG LEU 166 HG LEU 166 -2.529 -1.745 0.288
103 1HD1 LEU 166 HD11 LEU 166 -4.613 -0.280 -1.285
104 2HD1 LEU 166 HD12 LEU 166 -3.325 0.583 -0.447
105 3HD1 LEU 166 HD13 LEU 166 -4.440 -0.434 0.463
106 1HD2 LEU 166 HD21 LEU 166 -3.195 -3.296 -1.837
107 2HD2 LEU 166 HD22 LEU 166 -4.702 -2.423 -1.558
108 3HD2 LEU 166 HD23 LEU 166 -3.976 -3.367 -0.257
109 HA PRO 167 HA PRO 167 -0.828 3.397 -4.101
110 1HB PRO 167 HB2 PRO 167 -2.001 5.181 -2.312
111 2HB PRO 167 HB1 PRO 167 -2.533 4.857 -3.970
112 1HG PRO 167 HG2 PRO 167 -3.624 3.864 -1.400
113 2HG PRO 167 HG1 PRO 167 -4.450 4.175 -2.933
114 1HD PRO 167 HD2 PRO 167 -3.858 1.675 -2.031
115 2HD PRO 167 HD1 PRO 167 -3.992 2.087 -3.750
116 HA PRO 168 HA PRO 168 1.197 4.084 0.103
117 1HB PRO 168 HB2 PRO 168 0.329 2.944 2.306
118 2HB PRO 168 HB1 PRO 168 -0.638 4.220 1.539
119 1HG PRO 168 HG2 PRO 168 -1.028 1.257 1.480
120 2HG PRO 168 HG1 PRO 168 -2.236 2.545 1.632
121 1HD PRO 168 HD2 PRO 168 -1.489 1.238 -0.735
122 2HD PRO 168 HD1 PRO 168 -2.427 2.734 -0.617
123 H ILE 169 HN ILE 169 2.976 3.045 -0.710
124 HA ILE 169 HA ILE 169 3.350 0.221 -0.623
125 HB ILE 169 HB ILE 169 4.431 2.017 -2.174
126 1HG1 ILE 169 HG12 ILE 169 6.097 -0.275 -1.120
127 2HG1 ILE 169 HG11 ILE 169 4.768 -0.450 -2.263
128 1HG2 ILE 169 HG21 ILE 169 5.492 3.272 -0.331
129 2HG2 ILE 169 HG22 ILE 169 6.638 2.736 -1.558
130 3HG2 ILE 169 HG23 ILE 169 6.529 1.880 -0.021
131 1HD1 ILE 169 HD11 ILE 169 5.956 0.440 -3.991
132 2HD1 ILE 169 HD12 ILE 169 7.257 -0.316 -3.070
133 3HD1 ILE 169 HD13 ILE 169 6.975 1.420 -2.935
134 H ILE 170 HN ILE 170 4.484 2.913 1.349
135 HA ILE 170 HA ILE 170 6.247 1.377 2.963
136 HB ILE 170 HB ILE 170 4.945 3.983 3.737
137 1HG1 ILE 170 HG12 ILE 170 7.502 4.522 2.766
138 2HG1 ILE 170 HG11 ILE 170 6.834 3.380 1.605
139 1HG2 ILE 170 HG21 ILE 170 6.065 3.460 5.623
140 2HG2 ILE 170 HG22 ILE 170 7.452 4.066 4.719
141 3HG2 ILE 170 HG23 ILE 170 7.140 2.331 4.800
142 1HD1 ILE 170 HD11 ILE 170 6.483 5.834 1.129
143 2HD1 ILE 170 HD12 ILE 170 5.349 5.834 2.480
144 3HD1 ILE 170 HD13 ILE 170 5.048 4.810 1.076
145 H LEU 171 HN LEU 171 2.904 2.477 3.437
146 HA LEU 171 HA LEU 171 2.645 1.445 6.070
147 1HB LEU 171 HB2 LEU 171 0.773 2.391 3.964
148 2HB LEU 171 HB1 LEU 171 0.123 1.554 5.356
149 HG LEU 171 HG LEU 171 1.862 3.516 6.386
150 1HD1 LEU 171 HD11 LEU 171 -0.048 4.782 4.442
151 2HD1 LEU 171 HD12 LEU 171 1.656 4.519 4.074
152 3HD1 LEU 171 HD13 LEU 171 1.197 5.561 5.420
153 1HD2 LEU 171 HD21 LEU 171 -0.199 2.663 7.413
154 2HD2 LEU 171 HD22 LEU 171 -1.147 3.521 6.197
155 3HD2 LEU 171 HD23 LEU 171 -0.168 4.426 7.351
156 H ASP 172 HN ASP 172 3.030 -0.164 3.252
157 HA ASP 172 HA ASP 172 1.969 -2.620 4.388
158 1HB ASP 172 HB2 ASP 172 1.278 -1.638 1.606
159 2HB ASP 172 HB1 ASP 172 0.934 -3.262 2.219
160 H ALA 173 HN ALA 173 4.590 -1.210 3.613
161 HA ALA 173 HA ALA 173 5.745 -2.977 1.644
162 1HB ALA 173 HB1 ALA 173 7.884 -1.758 2.740
163 2HB ALA 173 HB2 ALA 173 6.623 -0.598 3.161
164 3HB ALA 173 HB3 ALA 173 6.895 -1.030 1.473
165 H GLY 174 HN GLY 174 5.749 -2.470 5.115
166 1HA GLY 174 HA2 GLY 174 6.840 -5.194 5.456
167 2HA GLY 174 HA1 GLY 174 7.510 -3.841 6.387
168 H TYR 175 HN TYR 175 4.290 -3.263 5.935
169 HA TYR 175 HA TYR 175 2.506 -3.153 7.264
170 1HB TYR 175 HB2 TYR 175 2.292 -5.519 8.623
171 2HB TYR 175 HB1 TYR 175 1.708 -5.220 6.993
172 HD1 TYR 175 HD1 TYR 175 3.857 -7.207 9.020
173 HD2 TYR 175 HD2 TYR 175 3.304 -5.770 5.054
174 HE1 TYR 175 HE1 TYR 175 5.307 -9.003 8.172
175 HE2 TYR 175 HE2 TYR 175 4.753 -7.562 4.196
176 HH TYR 175 HH TYR 175 6.481 -9.052 4.948
177 H PHE 176 HN PHE 176 4.884 -4.948 9.190
178 HA PHE 176 HA PHE 176 4.140 -3.334 11.511
179 1HB PHE 176 HB2 PHE 176 5.588 -5.939 11.148
180 2HB PHE 176 HB1 PHE 176 5.752 -5.028 12.658
181 HD1 PHE 176 HD1 PHE 176 3.108 -3.988 13.133
182 HD2 PHE 176 HD2 PHE 176 4.271 -7.773 11.572
183 HE1 PHE 176 HE1 PHE 176 1.002 -4.966 13.946
184 HE2 PHE 176 HE2 PHE 176 2.167 -8.758 12.382
185 HZ PHE 176 HZ PHE 176 0.529 -7.354 13.572
186 H LEU 177 HN LEU 177 5.840 -2.412 9.198
187 HA LEU 177 HA LEU 177 8.415 -2.000 10.491
188 1HB LEU 177 HB2 LEU 177 7.369 -1.571 7.725
189 2HB LEU 177 HB1 LEU 177 8.798 -0.700 8.247
190 HG LEU 177 HG LEU 177 8.457 -3.691 8.069
191 1HD1 LEU 177 HD11 LEU 177 10.111 -3.593 6.360
192 2HD1 LEU 177 HD12 LEU 177 10.414 -1.883 6.666
193 3HD1 LEU 177 HD13 LEU 177 8.878 -2.396 5.965
194 1HD2 LEU 177 HD21 LEU 177 10.624 -2.024 9.309
195 2HD2 LEU 177 HD22 LEU 177 10.937 -3.644 8.688
196 3HD2 LEU 177 HD23 LEU 177 9.769 -3.409 9.988
197 HA PRO 178 HA PRO 178 6.754 2.587 9.799
198 1HB PRO 178 HB2 PRO 178 3.853 1.996 10.058
199 2HB PRO 178 HB1 PRO 178 4.675 3.164 9.018
200 1HG PRO 178 HG2 PRO 178 3.664 0.923 8.003
201 2HG PRO 178 HG1 PRO 178 5.214 1.564 7.426
202 1HD PRO 178 HD2 PRO 178 4.680 -0.711 9.294
203 2HD PRO 178 HD1 PRO 178 5.895 -0.568 8.009
204 H LEU 179 HN LEU 179 4.683 3.695 11.338
205 HA LEU 179 HA LEU 179 4.032 4.164 13.457
206 1HB LEU 179 HB2 LEU 179 4.456 1.275 13.545
207 2HB LEU 179 HB1 LEU 179 4.729 2.049 15.093
208 HG LEU 179 HG LEU 179 2.424 1.227 14.844
209 1HD1 LEU 179 HD11 LEU 179 1.305 3.230 15.597
210 2HD1 LEU 179 HD12 LEU 179 2.581 4.237 14.912
211 3HD1 LEU 179 HD13 LEU 179 2.934 3.172 16.272
212 1HD2 LEU 179 HD21 LEU 179 1.709 3.366 12.944
213 2HD2 LEU 179 HD22 LEU 179 1.058 1.736 13.120
214 3HD2 LEU 179 HD23 LEU 179 2.583 1.990 12.270
215 H ARG 180 HN ARG 180 5.955 5.576 13.055
216 HA ARG 180 HA ARG 180 7.749 6.691 13.905
217 1HB ARG 180 HB2 ARG 180 7.597 4.866 16.303
218 2HB ARG 180 HB1 ARG 180 8.229 6.515 16.228
219 1HG ARG 180 HG2 ARG 180 5.534 6.593 15.369
220 2HG ARG 180 HG1 ARG 180 5.596 5.628 16.845
221 1HD ARG 180 HD2 ARG 180 6.555 7.391 18.079
222 2HD ARG 180 HD1 ARG 180 6.960 8.297 16.621
223 HE ARG 180 HE ARG 180 4.204 8.019 16.648
224 1HH1 ARG 180 1HH1 ARG 180 6.659 9.506 18.634
225 2HH1 ARG 180 2HH1 ARG 180 5.611 10.756 19.214
226 1HH2 ARG 180 1HH2 ARG 180 2.823 9.663 17.411
227 2HH2 ARG 180 2HH2 ARG 180 3.433 10.845 18.520
228 1HG HSL 181 HG1 HSL 181 11.898 2.052 10.754
229 2HG HSL 181 HG2 HSL 181 10.806 2.376 9.308
230 H HSL 181 HN HSL 181 8.441 5.072 12.020
231 HA HSL 181 HA HSL 181 10.898 3.546 13.034
232 1HB HSL 181 HB1 HSL 181 9.798 1.791 11.885
233 2HB HSL 181 HB2 HSL 181 8.940 2.953 10.738
Start of MODEL 79
1 1H PHE 155 HT1 PHE 155 -9.771 6.210 -7.749
2 2H PHE 155 HT2 PHE 155 -11.419 6.515 -8.122
3 3H PHE 155 HT3 PHE 155 -10.699 5.021 -8.565
4 HA PHE 155 HA PHE 155 -11.925 4.511 -6.729
5 1HB PHE 155 HB2 PHE 155 -9.184 5.184 -5.645
6 2HB PHE 155 HB1 PHE 155 -10.252 3.887 -5.116
7 HD1 PHE 155 HD1 PHE 155 -7.505 4.720 -7.151
8 HD2 PHE 155 HD2 PHE 155 -10.870 2.125 -6.935
9 HE1 PHE 155 HE1 PHE 155 -6.417 3.185 -8.736
10 HE2 PHE 155 HE2 PHE 155 -9.790 0.584 -8.519
11 HZ PHE 155 HZ PHE 155 -7.560 1.114 -9.422
12 H LEU 156 HN LEU 156 -12.853 5.012 -4.730
13 HA LEU 156 HA LEU 156 -12.248 7.438 -3.347
14 1HB LEU 156 HB2 LEU 156 -14.868 7.207 -4.831
15 2HB LEU 156 HB1 LEU 156 -14.513 8.426 -3.624
16 HG LEU 156 HG LEU 156 -13.075 8.127 -6.263
17 1HD1 LEU 156 HD11 LEU 156 -15.581 9.001 -6.012
18 2HD1 LEU 156 HD12 LEU 156 -14.438 9.682 -7.170
19 3HD1 LEU 156 HD13 LEU 156 -14.723 10.493 -5.630
20 1HD2 LEU 156 HD21 LEU 156 -11.836 9.103 -4.231
21 2HD2 LEU 156 HD22 LEU 156 -12.935 10.472 -4.399
22 3HD2 LEU 156 HD23 LEU 156 -11.855 10.040 -5.725
23 H GLN 157 HN GLN 157 -11.955 5.639 -1.821
24 HA GLN 157 HA GLN 157 -14.166 5.422 -0.067
25 1HB GLN 157 HB2 GLN 157 -14.841 3.771 -1.815
26 2HB GLN 157 HB1 GLN 157 -13.388 2.850 -1.447
27 1HG GLN 157 HG2 GLN 157 -14.870 1.730 -0.152
28 2HG GLN 157 HG1 GLN 157 -14.367 2.964 1.002
29 1HE2 GLN 157 HE21 GLN 157 -16.856 2.081 -1.316
30 2HE2 GLN 157 HE22 GLN 157 -18.123 3.002 -0.589
31 H SER 158 HN SER 158 -11.045 4.133 -1.071
32 HA SER 158 HA SER 158 -10.361 3.123 1.512
33 1HB SER 158 HB2 SER 158 -8.196 3.812 -0.405
34 2HB SER 158 HB1 SER 158 -8.463 2.324 0.520
35 HG SER 158 HG SER 158 -9.490 1.521 -1.126
36 H ASP 159 HN ASP 159 -11.166 5.347 2.345
37 HA ASP 159 HA ASP 159 -10.582 7.101 3.687
38 1HB ASP 159 HB2 ASP 159 -8.261 5.693 3.646
39 2HB ASP 159 HB1 ASP 159 -7.735 7.197 2.895
40 H VAL 160 HN VAL 160 -8.491 7.209 0.805
41 HA VAL 160 HA VAL 160 -8.603 8.595 -1.025
42 HB VAL 160 HB VAL 160 -11.066 9.139 -0.021
43 1HG1 VAL 160 HG11 VAL 160 -9.766 11.848 -0.151
44 2HG1 VAL 160 HG12 VAL 160 -10.041 10.998 1.368
45 3HG1 VAL 160 HG13 VAL 160 -11.408 11.445 0.349
46 1HG2 VAL 160 HG21 VAL 160 -11.330 10.606 -2.048
47 2HG2 VAL 160 HG22 VAL 160 -10.631 9.015 -2.348
48 3HG2 VAL 160 HG23 VAL 160 -9.592 10.440 -2.298
49 H PHE 161 HN PHE 161 -8.439 10.071 2.191
50 HA PHE 161 HA PHE 161 -6.928 12.332 1.434
51 1HB PHE 161 HB2 PHE 161 -8.153 12.097 3.590
52 2HB PHE 161 HB1 PHE 161 -6.950 10.921 4.110
53 HD1 PHE 161 HD1 PHE 161 -5.314 11.695 5.506
54 HD2 PHE 161 HD2 PHE 161 -7.025 14.369 2.671
55 HE1 PHE 161 HE1 PHE 161 -3.915 13.516 6.386
56 HE2 PHE 161 HE2 PHE 161 -5.627 16.195 3.545
57 HZ PHE 161 HZ PHE 161 -4.070 15.771 5.406
58 H PHE 162 HN PHE 162 -6.109 9.033 2.016
59 HA PHE 162 HA PHE 162 -3.332 9.317 2.508
60 1HB PHE 162 HB2 PHE 162 -5.254 7.256 2.295
61 2HB PHE 162 HB1 PHE 162 -3.926 6.854 1.209
62 HD1 PHE 162 HD1 PHE 162 -1.612 7.914 2.655
63 HD2 PHE 162 HD2 PHE 162 -5.025 5.827 4.107
64 HE1 PHE 162 HE1 PHE 162 -0.297 7.103 4.569
65 HE2 PHE 162 HE2 PHE 162 -3.716 5.012 6.024
66 HZ PHE 162 HZ PHE 162 -1.348 5.650 6.257
67 H LEU 163 HN LEU 163 -5.000 8.069 -0.370
68 HA LEU 163 HA LEU 163 -2.785 8.206 -2.110
69 1HB LEU 163 HB2 LEU 163 -4.706 6.806 -2.557
70 2HB LEU 163 HB1 LEU 163 -5.746 8.217 -2.647
71 HG LEU 163 HG LEU 163 -5.019 7.128 -4.810
72 1HD1 LEU 163 HD11 LEU 163 -4.245 9.858 -5.254
73 2HD1 LEU 163 HD12 LEU 163 -5.622 9.751 -4.158
74 3HD1 LEU 163 HD13 LEU 163 -5.707 9.008 -5.754
75 1HD2 LEU 163 HD21 LEU 163 -2.453 8.498 -4.082
76 2HD2 LEU 163 HD22 LEU 163 -2.859 7.981 -5.718
77 3HD2 LEU 163 HD23 LEU 163 -2.698 6.787 -4.430
78 H PHE 164 HN PHE 164 -4.962 10.468 -0.888
79 HA PHE 164 HA PHE 164 -4.848 12.440 -2.916
80 1HB PHE 164 HB2 PHE 164 -6.722 12.536 -1.523
81 2HB PHE 164 HB1 PHE 164 -5.765 12.291 -0.067
82 HD1 PHE 164 HD1 PHE 164 -6.961 14.730 -2.517
83 HD2 PHE 164 HD2 PHE 164 -4.638 14.152 1.002
84 HE1 PHE 164 HE1 PHE 164 -6.964 17.159 -2.121
85 HE2 PHE 164 HE2 PHE 164 -4.639 16.579 1.406
86 HZ PHE 164 HZ PHE 164 -5.802 18.086 -0.156
87 H LEU 165 HN LEU 165 -3.491 12.419 0.396
88 HA LEU 165 HA LEU 165 -1.825 14.654 -0.013
89 1HB LEU 165 HB2 LEU 165 -2.390 12.808 2.100
90 2HB LEU 165 HB1 LEU 165 -0.653 13.013 1.964
91 HG LEU 165 HG LEU 165 -2.568 15.331 2.200
92 1HD1 LEU 165 HD11 LEU 165 -0.901 14.267 4.450
93 2HD1 LEU 165 HD12 LEU 165 -2.534 13.669 4.161
94 3HD1 LEU 165 HD13 LEU 165 -2.269 15.379 4.506
95 1HD2 LEU 165 HD21 LEU 165 0.397 14.998 2.175
96 2HD2 LEU 165 HD22 LEU 165 -0.322 16.310 3.110
97 3HD2 LEU 165 HD23 LEU 165 -0.608 16.205 1.373
98 H LEU 166 HN LEU 166 -0.860 11.250 0.387
99 HA LEU 166 HA LEU 166 0.960 11.381 -1.823
100 1HB LEU 166 HB2 LEU 166 1.895 12.182 0.723
101 2HB LEU 166 HB1 LEU 166 2.592 10.604 0.405
102 HG LEU 166 HG LEU 166 2.788 12.444 -1.868
103 1HD1 LEU 166 HD11 LEU 166 4.142 14.066 -1.008
104 2HD1 LEU 166 HD12 LEU 166 4.661 13.071 0.352
105 3HD1 LEU 166 HD13 LEU 166 3.064 13.817 0.365
106 1HD2 LEU 166 HD21 LEU 166 5.172 11.282 -0.590
107 2HD2 LEU 166 HD22 LEU 166 4.667 11.270 -2.279
108 3HD2 LEU 166 HD23 LEU 166 3.960 10.126 -1.138
109 HA PRO 167 HA PRO 167 -0.100 7.068 -1.625
110 1HB PRO 167 HB2 PRO 167 1.688 6.127 -3.445
111 2HB PRO 167 HB1 PRO 167 0.217 7.007 -3.901
112 1HG PRO 167 HG2 PRO 167 3.031 8.007 -3.665
113 2HG PRO 167 HG1 PRO 167 1.826 8.343 -4.921
114 1HD PRO 167 HD2 PRO 167 2.359 10.080 -2.918
115 2HD PRO 167 HD1 PRO 167 0.744 9.923 -3.637
116 HA PRO 168 HA PRO 168 3.155 6.025 1.366
117 1HB PRO 168 HB2 PRO 168 1.753 4.060 2.626
118 2HB PRO 168 HB1 PRO 168 1.522 5.787 2.961
119 1HG PRO 168 HG2 PRO 168 -0.088 3.967 1.203
120 2HG PRO 168 HG1 PRO 168 -0.649 5.176 2.373
121 1HD PRO 168 HD2 PRO 168 -0.577 5.670 -0.279
122 2HD PRO 168 HD1 PRO 168 -0.272 6.937 0.926
123 H ILE 169 HN ILE 169 1.585 2.924 1.168
124 HA ILE 169 HA ILE 169 2.104 0.968 0.110
125 HB ILE 169 HB ILE 169 2.928 2.760 -1.782
126 1HG1 ILE 169 HG12 ILE 169 3.303 -0.237 -1.922
127 2HG1 ILE 169 HG11 ILE 169 1.753 0.584 -2.078
128 1HG2 ILE 169 HG21 ILE 169 5.118 2.381 -2.489
129 2HG2 ILE 169 HG22 ILE 169 5.297 0.948 -1.478
130 3HG2 ILE 169 HG23 ILE 169 5.267 2.549 -0.740
131 1HD1 ILE 169 HD11 ILE 169 2.576 1.741 -4.068
132 2HD1 ILE 169 HD12 ILE 169 2.640 -0.012 -4.249
133 3HD1 ILE 169 HD13 ILE 169 4.115 0.895 -3.915
134 H ILE 170 HN ILE 170 4.732 2.980 1.273
135 HA ILE 170 HA ILE 170 6.559 0.853 1.740
136 HB ILE 170 HB ILE 170 6.539 3.611 2.962
137 1HG1 ILE 170 HG12 ILE 170 8.441 3.684 1.025
138 2HG1 ILE 170 HG11 ILE 170 7.256 2.617 0.277
139 1HG2 ILE 170 HG21 ILE 170 8.296 2.897 4.119
140 2HG2 ILE 170 HG22 ILE 170 9.155 2.678 2.595
141 3HG2 ILE 170 HG23 ILE 170 8.257 1.335 3.302
142 1HD1 ILE 170 HD11 ILE 170 7.191 5.482 0.671
143 2HD1 ILE 170 HD12 ILE 170 5.731 4.689 1.264
144 3HD1 ILE 170 HD13 ILE 170 6.240 4.463 -0.410
145 H LEU 171 HN LEU 171 4.108 2.497 3.668
146 HA LEU 171 HA LEU 171 4.869 1.412 6.175
147 1HB LEU 171 HB2 LEU 171 2.293 2.530 5.095
148 2HB LEU 171 HB1 LEU 171 2.383 1.858 6.712
149 HG LEU 171 HG LEU 171 4.129 4.122 5.750
150 1HD1 LEU 171 HD11 LEU 171 1.462 4.348 6.012
151 2HD1 LEU 171 HD12 LEU 171 2.596 5.649 6.379
152 3HD1 LEU 171 HD13 LEU 171 1.961 4.638 7.678
153 1HD2 LEU 171 HD21 LEU 171 4.550 2.480 7.843
154 2HD2 LEU 171 HD22 LEU 171 3.526 3.698 8.603
155 3HD2 LEU 171 HD23 LEU 171 5.030 4.177 7.817
156 H ASP 172 HN ASP 172 2.211 0.536 3.990
157 HA ASP 172 HA ASP 172 1.778 -1.990 5.252
158 1HB ASP 172 HB2 ASP 172 0.596 -0.491 2.968
159 2HB ASP 172 HB1 ASP 172 0.406 -2.251 2.967
160 H ALA 173 HN ALA 173 4.307 -1.025 3.444
161 HA ALA 173 HA ALA 173 4.488 -3.093 1.500
162 1HB ALA 173 HB1 ALA 173 6.219 -0.936 2.480
163 2HB ALA 173 HB2 ALA 173 5.951 -1.518 0.839
164 3HB ALA 173 HB3 ALA 173 7.074 -2.365 1.903
165 H GLY 174 HN GLY 174 6.098 -2.546 4.637
166 1HA GLY 174 HA2 GLY 174 6.809 -5.404 4.719
167 2HA GLY 174 HA1 GLY 174 7.488 -4.132 5.754
168 H TYR 175 HN TYR 175 4.606 -3.106 5.955
169 HA TYR 175 HA TYR 175 2.765 -3.328 7.252
170 1HB TYR 175 HB2 TYR 175 2.849 -5.756 6.381
171 2HB TYR 175 HB1 TYR 175 3.552 -6.153 7.946
172 HD1 TYR 175 HD1 TYR 175 0.642 -4.223 6.599
173 HD2 TYR 175 HD2 TYR 175 2.098 -6.902 9.566
174 HE1 TYR 175 HE1 TYR 175 -1.615 -4.371 7.565
175 HE2 TYR 175 HE2 TYR 175 -0.155 -7.058 10.539
176 HH TYR 175 HH TYR 175 -2.908 -6.068 8.973
177 H PHE 176 HN PHE 176 5.932 -3.868 8.335
178 HA PHE 176 HA PHE 176 5.181 -3.686 11.155
179 1HB PHE 176 HB2 PHE 176 7.264 -5.020 9.770
180 2HB PHE 176 HB1 PHE 176 8.027 -3.758 10.749
181 HD1 PHE 176 HD1 PHE 176 9.018 -4.884 12.508
182 HD2 PHE 176 HD2 PHE 176 5.000 -5.807 11.454
183 HE1 PHE 176 HE1 PHE 176 8.830 -6.317 14.499
184 HE2 PHE 176 HE2 PHE 176 4.803 -7.242 13.443
185 HZ PHE 176 HZ PHE 176 6.720 -7.498 14.970
186 H LEU 177 HN LEU 177 5.998 -1.702 8.575
187 HA LEU 177 HA LEU 177 7.642 0.208 9.821
188 1HB LEU 177 HB2 LEU 177 5.920 0.175 7.392
189 2HB LEU 177 HB1 LEU 177 6.509 1.719 7.977
190 HG LEU 177 HG LEU 177 8.133 -0.622 6.998
191 1HD1 LEU 177 HD11 LEU 177 7.086 1.644 5.734
192 2HD1 LEU 177 HD12 LEU 177 8.279 0.511 5.099
193 3HD1 LEU 177 HD13 LEU 177 8.807 1.965 5.947
194 1HD2 LEU 177 HD21 LEU 177 8.967 1.758 8.616
195 2HD2 LEU 177 HD22 LEU 177 10.078 1.004 7.472
196 3HD2 LEU 177 HD23 LEU 177 9.419 0.063 8.809
197 HA PRO 178 HA PRO 178 3.253 2.551 10.408
198 1HB PRO 178 HB2 PRO 178 1.911 0.013 11.238
199 2HB PRO 178 HB1 PRO 178 1.227 1.446 10.460
200 1HG PRO 178 HG2 PRO 178 1.720 -0.758 9.052
201 2HG PRO 178 HG1 PRO 178 2.016 0.848 8.364
202 1HD PRO 178 HD2 PRO 178 3.955 -1.175 9.358
203 2HD PRO 178 HD1 PRO 178 4.137 0.030 8.068
204 H LEU 179 HN LEU 179 4.604 3.300 12.109
205 HA LEU 179 HA LEU 179 4.420 1.808 14.637
206 1HB LEU 179 HB2 LEU 179 6.588 3.015 13.405
207 2HB LEU 179 HB1 LEU 179 6.118 4.189 14.618
208 HG LEU 179 HG LEU 179 7.786 2.800 15.588
209 1HD1 LEU 179 HD11 LEU 179 5.356 3.173 16.731
210 2HD1 LEU 179 HD12 LEU 179 6.749 2.466 17.549
211 3HD1 LEU 179 HD13 LEU 179 5.520 1.420 16.837
212 1HD2 LEU 179 HD21 LEU 179 7.476 0.333 15.747
213 2HD2 LEU 179 HD22 LEU 179 7.743 0.921 14.106
214 3HD2 LEU 179 HD23 LEU 179 6.119 0.481 14.631
215 H ARG 180 HN ARG 180 4.097 5.031 13.229
216 HA ARG 180 HA ARG 180 2.687 6.015 15.576
217 1HB ARG 180 HB2 ARG 180 3.713 7.266 13.038
218 2HB ARG 180 HB1 ARG 180 2.570 8.128 14.074
219 1HG ARG 180 HG2 ARG 180 4.896 8.754 14.511
220 2HG ARG 180 HG1 ARG 180 4.122 8.034 15.921
221 1HD ARG 180 HD2 ARG 180 5.528 6.147 14.158
222 2HD ARG 180 HD1 ARG 180 6.559 7.324 14.969
223 HE ARG 180 HE ARG 180 5.283 5.084 16.157
224 1HH1 ARG 180 1HH1 ARG 180 6.214 8.386 16.792
225 2HH1 ARG 180 2HH1 ARG 180 6.348 8.150 18.502
226 1HH2 ARG 180 1HH2 ARG 180 5.459 4.770 18.404
227 2HH2 ARG 180 2HH2 ARG 180 5.919 6.096 19.418
228 1HG HSL 181 HG1 HSL 181 -2.107 3.430 10.747
229 2HG HSL 181 HG2 HSL 181 -0.881 2.140 10.278
230 H HSL 181 HN HSL 181 1.915 4.029 13.218
231 HA HSL 181 HA HSL 181 -0.892 5.169 12.761
232 1HB HSL 181 HB1 HSL 181 -0.220 4.885 10.507
233 2HB HSL 181 HB2 HSL 181 0.975 3.543 10.933
Start of MODEL 80
1 1H PHE 155 HT1 PHE 155 4.220 0.961 -7.015
2 2H PHE 155 HT2 PHE 155 2.952 1.582 -6.040
3 3H PHE 155 HT3 PHE 155 4.088 0.482 -5.374
4 HA PHE 155 HA PHE 155 4.554 2.665 -4.641
5 1HB PHE 155 HB2 PHE 155 6.901 2.789 -5.525
6 2HB PHE 155 HB1 PHE 155 6.430 1.193 -4.954
7 HD1 PHE 155 HD1 PHE 155 6.985 3.240 -7.974
8 HD2 PHE 155 HD2 PHE 155 6.426 -0.671 -6.394
9 HE1 PHE 155 HE1 PHE 155 7.642 2.275 -10.140
10 HE2 PHE 155 HE2 PHE 155 7.082 -1.643 -8.557
11 HZ PHE 155 HZ PHE 155 7.693 -0.170 -10.433
12 H LEU 156 HN LEU 156 4.501 4.812 -4.980
13 HA LEU 156 HA LEU 156 3.461 5.807 -7.431
14 1HB LEU 156 HB2 LEU 156 3.633 8.016 -6.360
15 2HB LEU 156 HB1 LEU 156 2.815 6.839 -5.352
16 HG LEU 156 HG LEU 156 5.719 7.132 -4.891
17 1HD1 LEU 156 HD11 LEU 156 3.743 9.296 -4.192
18 2HD1 LEU 156 HD12 LEU 156 5.182 9.448 -5.201
19 3HD1 LEU 156 HD13 LEU 156 5.345 9.136 -3.473
20 1HD2 LEU 156 HD21 LEU 156 3.271 6.414 -3.427
21 2HD2 LEU 156 HD22 LEU 156 4.477 7.303 -2.497
22 3HD2 LEU 156 HD23 LEU 156 4.910 5.784 -3.280
23 H GLN 157 HN GLN 157 4.551 7.958 -8.290
24 HA GLN 157 HA GLN 157 7.381 8.080 -8.267
25 1HB GLN 157 HB2 GLN 157 7.885 7.315 -10.497
26 2HB GLN 157 HB1 GLN 157 7.089 6.021 -9.615
27 1HG GLN 157 HG2 GLN 157 5.912 5.852 -11.522
28 2HG GLN 157 HG1 GLN 157 4.950 7.125 -10.773
29 1HE2 GLN 157 HE21 GLN 157 4.278 8.112 -12.615
30 2HE2 GLN 157 HE22 GLN 157 5.337 8.923 -13.714
31 H SER 158 HN SER 158 4.401 8.842 -10.022
32 HA SER 158 HA SER 158 5.044 11.616 -9.997
33 1HB SER 158 HB2 SER 158 6.312 10.461 -12.022
34 2HB SER 158 HB1 SER 158 4.726 10.623 -12.794
35 HG SER 158 HG SER 158 6.014 12.788 -11.503
36 H ASP 159 HN ASP 159 2.918 10.051 -9.061
37 HA ASP 159 HA ASP 159 0.730 11.552 -10.113
38 1HB ASP 159 HB2 ASP 159 1.030 8.669 -10.838
39 2HB ASP 159 HB1 ASP 159 -0.581 9.283 -10.473
40 H VAL 160 HN VAL 160 1.392 8.514 -8.441
41 HA VAL 160 HA VAL 160 0.674 7.591 -6.516
42 HB VAL 160 HB VAL 160 2.164 9.336 -5.604
43 1HG1 VAL 160 HG11 VAL 160 1.020 11.352 -6.260
44 2HG1 VAL 160 HG12 VAL 160 1.174 11.309 -4.507
45 3HG1 VAL 160 HG13 VAL 160 -0.370 10.930 -5.261
46 1HG2 VAL 160 HG21 VAL 160 1.511 9.051 -3.355
47 2HG2 VAL 160 HG22 VAL 160 0.934 7.625 -4.218
48 3HG2 VAL 160 HG23 VAL 160 -0.192 8.913 -3.789
49 H PHE 161 HN PHE 161 -1.151 10.618 -6.967
50 HA PHE 161 HA PHE 161 -3.459 9.609 -5.651
51 1HB PHE 161 HB2 PHE 161 -2.636 12.100 -6.144
52 2HB PHE 161 HB1 PHE 161 -3.685 11.893 -7.541
53 HD1 PHE 161 HD1 PHE 161 -6.093 11.430 -7.218
54 HD2 PHE 161 HD2 PHE 161 -3.522 12.389 -3.965
55 HE1 PHE 161 HE1 PHE 161 -8.055 11.954 -5.827
56 HE2 PHE 161 HE2 PHE 161 -5.478 12.914 -2.568
57 HZ PHE 161 HZ PHE 161 -7.748 12.697 -3.498
58 H PHE 162 HN PHE 162 -2.148 8.805 -8.575
59 HA PHE 162 HA PHE 162 -4.540 7.520 -9.414
60 1HB PHE 162 HB2 PHE 162 -3.650 10.001 -10.816
61 2HB PHE 162 HB1 PHE 162 -4.366 8.690 -11.759
62 HD1 PHE 162 HD1 PHE 162 -5.202 11.692 -10.677
63 HD2 PHE 162 HD2 PHE 162 -6.460 7.674 -10.060
64 HE1 PHE 162 HE1 PHE 162 -7.449 12.492 -10.073
65 HE2 PHE 162 HE2 PHE 162 -8.709 8.467 -9.457
66 HZ PHE 162 HZ PHE 162 -9.207 10.879 -9.463
67 H LEU 163 HN LEU 163 -1.451 7.238 -9.009
68 HA LEU 163 HA LEU 163 -0.506 6.312 -11.538
69 1HB LEU 163 HB2 LEU 163 0.847 6.996 -9.421
70 2HB LEU 163 HB1 LEU 163 0.572 5.341 -8.912
71 HG LEU 163 HG LEU 163 1.556 4.762 -11.278
72 1HD1 LEU 163 HD11 LEU 163 3.202 6.327 -12.064
73 2HD1 LEU 163 HD12 LEU 163 2.839 7.435 -10.741
74 3HD1 LEU 163 HD13 LEU 163 1.634 7.132 -11.993
75 1HD2 LEU 163 HD21 LEU 163 3.369 4.076 -10.149
76 2HD2 LEU 163 HD22 LEU 163 2.507 4.683 -8.735
77 3HD2 LEU 163 HD23 LEU 163 3.720 5.688 -9.528
78 H PHE 164 HN PHE 164 -2.264 4.972 -8.868
79 HA PHE 164 HA PHE 164 -3.440 3.049 -8.612
80 1HB PHE 164 HB2 PHE 164 -3.985 3.598 -11.066
81 2HB PHE 164 HB1 PHE 164 -2.840 2.321 -11.465
82 HD1 PHE 164 HD1 PHE 164 -5.374 2.546 -8.747
83 HD2 PHE 164 HD2 PHE 164 -4.076 0.550 -12.274
84 HE1 PHE 164 HE1 PHE 164 -7.148 0.869 -8.446
85 HE2 PHE 164 HE2 PHE 164 -5.849 -1.131 -11.980
86 HZ PHE 164 HZ PHE 164 -7.388 -0.972 -10.064
87 H LEU 165 HN LEU 165 -0.222 3.125 -8.969
88 HA LEU 165 HA LEU 165 0.430 0.392 -9.390
89 1HB LEU 165 HB2 LEU 165 1.848 2.832 -8.574
90 2HB LEU 165 HB1 LEU 165 2.513 1.347 -7.918
91 HG LEU 165 HG LEU 165 3.584 2.078 -10.040
92 1HD1 LEU 165 HD11 LEU 165 3.430 -0.140 -11.158
93 2HD1 LEU 165 HD12 LEU 165 2.127 -0.558 -10.045
94 3HD1 LEU 165 HD13 LEU 165 3.745 -0.228 -9.425
95 1HD2 LEU 165 HD21 LEU 165 1.219 2.819 -10.922
96 2HD2 LEU 165 HD22 LEU 165 1.179 1.167 -11.539
97 3HD2 LEU 165 HD23 LEU 165 2.470 2.262 -12.033
98 H LEU 166 HN LEU 166 0.675 2.318 -6.406
99 HA LEU 166 HA LEU 166 -0.589 0.286 -4.834
100 1HB LEU 166 HB2 LEU 166 2.139 0.010 -5.276
101 2HB LEU 166 HB1 LEU 166 2.043 0.766 -3.696
102 HG LEU 166 HG LEU 166 0.251 -1.547 -4.111
103 1HD1 LEU 166 HD11 LEU 166 3.187 -2.026 -3.688
104 2HD1 LEU 166 HD12 LEU 166 2.417 -2.149 -5.269
105 3HD1 LEU 166 HD13 LEU 166 1.912 -3.213 -3.955
106 1HD2 LEU 166 HD21 LEU 166 1.736 -0.208 -1.951
107 2HD2 LEU 166 HD22 LEU 166 1.610 -1.963 -1.817
108 3HD2 LEU 166 HD23 LEU 166 0.151 -0.981 -1.935
109 HA PRO 167 HA PRO 167 -1.619 4.538 -3.421
110 1HB PRO 167 HB2 PRO 167 -3.156 3.145 -1.412
111 2HB PRO 167 HB1 PRO 167 -3.728 4.151 -2.752
112 1HG PRO 167 HG2 PRO 167 -3.553 1.237 -2.558
113 2HG PRO 167 HG1 PRO 167 -4.455 2.234 -3.709
114 1HD PRO 167 HD2 PRO 167 -2.273 0.766 -4.393
115 2HD PRO 167 HD1 PRO 167 -2.727 2.270 -5.219
116 HA PRO 168 HA PRO 168 0.056 3.647 0.868
117 1HB PRO 168 HB2 PRO 168 0.490 1.181 1.760
118 2HB PRO 168 HB1 PRO 168 -1.148 1.848 1.617
119 1HG PRO 168 HG2 PRO 168 0.262 -0.092 -0.162
120 2HG PRO 168 HG1 PRO 168 -1.433 -0.059 0.349
121 1HD PRO 168 HD2 PRO 168 -0.432 0.917 -2.069
122 2HD PRO 168 HD1 PRO 168 -2.020 1.288 -1.373
123 H ILE 169 HN ILE 169 1.809 0.687 0.343
124 HA ILE 169 HA ILE 169 3.947 0.247 -0.386
125 HB ILE 169 HB ILE 169 3.625 2.589 -1.708
126 1HG1 ILE 169 HG12 ILE 169 5.964 0.751 -1.349
127 2HG1 ILE 169 HG11 ILE 169 4.887 0.927 -2.729
128 1HG2 ILE 169 HG21 ILE 169 5.222 4.214 -1.151
129 2HG2 ILE 169 HG22 ILE 169 6.059 3.138 -0.033
130 3HG2 ILE 169 HG23 ILE 169 4.477 3.788 0.388
131 1HD1 ILE 169 HD11 ILE 169 7.008 2.896 -1.899
132 2HD1 ILE 169 HD12 ILE 169 5.952 3.035 -3.305
133 3HD1 ILE 169 HD13 ILE 169 7.134 1.730 -3.215
134 H ILE 170 HN ILE 170 3.404 2.930 1.830
135 HA ILE 170 HA ILE 170 5.830 2.492 3.302
136 HB ILE 170 HB ILE 170 3.443 4.054 4.270
137 1HG1 ILE 170 HG12 ILE 170 5.065 5.959 3.232
138 2HG1 ILE 170 HG11 ILE 170 5.343 4.656 2.080
139 1HG2 ILE 170 HG21 ILE 170 6.346 4.627 4.756
140 2HG2 ILE 170 HG22 ILE 170 5.449 3.481 5.753
141 3HG2 ILE 170 HG23 ILE 170 4.942 5.169 5.674
142 1HD1 ILE 170 HD11 ILE 170 3.542 5.427 1.034
143 2HD1 ILE 170 HD12 ILE 170 3.037 6.385 2.426
144 3HD1 ILE 170 HD13 ILE 170 2.612 4.675 2.330
145 H LEU 171 HN LEU 171 2.366 2.122 4.065
146 HA LEU 171 HA LEU 171 2.822 0.687 6.476
147 1HB LEU 171 HB2 LEU 171 0.400 0.950 4.694
148 2HB LEU 171 HB1 LEU 171 0.383 0.047 6.197
149 HG LEU 171 HG LEU 171 -0.567 2.227 6.567
150 1HD1 LEU 171 HD11 LEU 171 2.164 2.436 7.766
151 2HD1 LEU 171 HD12 LEU 171 1.079 1.125 8.230
152 3HD1 LEU 171 HD13 LEU 171 0.595 2.803 8.485
153 1HD2 LEU 171 HD21 LEU 171 0.485 4.263 6.065
154 2HD2 LEU 171 HD22 LEU 171 0.719 3.266 4.630
155 3HD2 LEU 171 HD23 LEU 171 2.041 3.486 5.777
156 H ASP 172 HN ASP 172 1.996 -0.238 3.178
157 HA ASP 172 HA ASP 172 1.993 -3.043 3.686
158 1HB ASP 172 HB2 ASP 172 2.058 -1.436 1.127
159 2HB ASP 172 HB1 ASP 172 1.976 -3.204 1.168
160 H ALA 173 HN ALA 173 4.508 -0.913 3.696
161 HA ALA 173 HA ALA 173 6.423 -2.344 2.145
162 1HB ALA 173 HB1 ALA 173 7.621 -0.498 2.462
163 2HB ALA 173 HB2 ALA 173 7.683 -0.799 4.197
164 3HB ALA 173 HB3 ALA 173 6.347 0.120 3.511
165 H GLY 174 HN GLY 174 5.644 -2.107 5.577
166 1HA GLY 174 HA2 GLY 174 7.093 -4.648 6.025
167 2HA GLY 174 HA1 GLY 174 7.172 -3.307 7.184
168 H TYR 175 HN TYR 175 4.344 -2.625 6.679
169 HA TYR 175 HA TYR 175 2.242 -3.135 7.300
170 1HB TYR 175 HB2 TYR 175 2.709 -5.412 6.295
171 2HB TYR 175 HB1 TYR 175 3.145 -5.951 7.913
172 HD1 TYR 175 HD1 TYR 175 0.392 -4.908 5.731
173 HD2 TYR 175 HD2 TYR 175 1.454 -6.256 9.623
174 HE1 TYR 175 HE1 TYR 175 -1.972 -5.387 6.203
175 HE2 TYR 175 HE2 TYR 175 -0.907 -6.741 10.106
176 HH TYR 175 HH TYR 175 -3.168 -5.907 9.255
177 H PHE 176 HN PHE 176 4.965 -3.490 9.270
178 HA PHE 176 HA PHE 176 3.377 -3.689 11.717
179 1HB PHE 176 HB2 PHE 176 5.396 -4.115 12.887
180 2HB PHE 176 HB1 PHE 176 5.536 -5.023 11.375
181 HD1 PHE 176 HD1 PHE 176 7.052 -2.630 13.521
182 HD2 PHE 176 HD2 PHE 176 6.852 -3.915 9.469
183 HE1 PHE 176 HE1 PHE 176 9.194 -1.511 13.065
184 HE2 PHE 176 HE2 PHE 176 8.993 -2.797 9.006
185 HZ PHE 176 HZ PHE 176 10.168 -1.593 10.804
186 H LEU 177 HN LEU 177 3.051 -1.452 10.080
187 HA LEU 177 HA LEU 177 2.851 0.781 10.176
188 1HB LEU 177 HB2 LEU 177 3.466 0.066 12.989
189 2HB LEU 177 HB1 LEU 177 3.673 1.751 12.549
190 HG LEU 177 HG LEU 177 1.115 0.221 12.096
191 1HD1 LEU 177 HD11 LEU 177 0.506 1.923 14.071
192 2HD1 LEU 177 HD12 LEU 177 2.183 1.576 14.492
193 3HD1 LEU 177 HD13 LEU 177 1.017 0.259 14.352
194 1HD2 LEU 177 HD21 LEU 177 1.033 2.034 10.674
195 2HD2 LEU 177 HD22 LEU 177 1.986 3.056 11.750
196 3HD2 LEU 177 HD23 LEU 177 0.303 2.694 12.138
197 HA PRO 178 HA PRO 178 7.647 0.538 9.430
198 1HB PRO 178 HB2 PRO 178 6.291 1.432 6.897
199 2HB PRO 178 HB1 PRO 178 7.803 0.536 7.093
200 1HG PRO 178 HG2 PRO 178 5.575 -0.729 6.473
201 2HG PRO 178 HG1 PRO 178 6.691 -1.431 7.660
202 1HD PRO 178 HD2 PRO 178 4.047 -0.141 8.070
203 2HD PRO 178 HD1 PRO 178 4.853 -1.407 9.018
204 H LEU 179 HN LEU 179 5.641 2.925 7.694
205 HA LEU 179 HA LEU 179 5.690 5.195 7.637
206 1HB LEU 179 HB2 LEU 179 6.127 4.562 10.519
207 2HB LEU 179 HB1 LEU 179 6.322 6.221 9.987
208 HG LEU 179 HG LEU 179 4.093 5.956 10.825
209 1HD1 LEU 179 HD11 LEU 179 4.501 7.277 8.704
210 2HD1 LEU 179 HD12 LEU 179 2.839 6.770 9.004
211 3HD1 LEU 179 HD13 LEU 179 3.829 5.899 7.832
212 1HD2 LEU 179 HD21 LEU 179 3.805 3.683 8.864
213 2HD2 LEU 179 HD22 LEU 179 2.526 4.332 9.890
214 3HD2 LEU 179 HD23 LEU 179 3.919 3.531 10.617
215 H ARG 180 HN ARG 180 7.850 4.223 6.479
216 HA ARG 180 HA ARG 180 9.934 4.808 5.763
217 1HB ARG 180 HB2 ARG 180 9.804 7.128 7.690
218 2HB ARG 180 HB1 ARG 180 10.754 7.007 6.203
219 1HG ARG 180 HG2 ARG 180 7.774 6.858 6.079
220 2HG ARG 180 HG1 ARG 180 8.571 8.422 6.260
221 1HD ARG 180 HD2 ARG 180 8.044 7.664 3.893
222 2HD ARG 180 HD1 ARG 180 9.688 8.211 4.206
223 HE ARG 180 HE ARG 180 8.824 5.456 3.727
224 1HH1 ARG 180 1HH1 ARG 180 11.425 7.712 4.342
225 2HH1 ARG 180 2HH1 ARG 180 12.660 6.612 3.831
226 1HH2 ARG 180 1HH2 ARG 180 10.453 4.015 3.065
227 2HH2 ARG 180 2HH2 ARG 180 12.110 4.516 3.109
228 1HG HSL 181 HG1 HSL 181 12.297 1.063 11.248
229 2HG HSL 181 HG2 HSL 181 10.890 -0.068 10.884
230 H HSL 181 HN HSL 181 9.723 2.855 7.661
231 HA HSL 181 HA HSL 181 12.165 3.333 9.452
232 1HB HSL 181 HB1 HSL 181 10.582 2.734 11.110
233 2HB HSL 181 HB2 HSL 181 9.583 1.730 9.927
Start of MODEL 81
1 1H PHE 155 HT1 PHE 155 -1.631 6.930 -0.225
2 2H PHE 155 HT2 PHE 155 -0.964 6.436 1.277
3 3H PHE 155 HT3 PHE 155 0.044 7.132 0.075
4 HA PHE 155 HA PHE 155 -2.087 8.433 1.627
5 1HB PHE 155 HB2 PHE 155 0.868 8.312 1.682
6 2HB PHE 155 HB1 PHE 155 0.164 9.909 1.907
7 HD1 PHE 155 HD1 PHE 155 -2.211 9.433 3.458
8 HD2 PHE 155 HD2 PHE 155 1.598 7.555 3.720
9 HE1 PHE 155 HE1 PHE 155 -2.638 8.908 5.825
10 HE2 PHE 155 HE2 PHE 155 1.179 7.026 6.086
11 HZ PHE 155 HZ PHE 155 -0.941 7.703 7.140
12 H LEU 156 HN LEU 156 -2.853 10.351 0.916
13 HA LEU 156 HA LEU 156 -2.527 11.013 -1.836
14 1HB LEU 156 HB2 LEU 156 -3.913 12.531 0.374
15 2HB LEU 156 HB1 LEU 156 -4.068 12.862 -1.341
16 HG LEU 156 HG LEU 156 -5.011 10.386 0.106
17 1HD1 LEU 156 HD11 LEU 156 -6.340 12.827 -0.974
18 2HD1 LEU 156 HD12 LEU 156 -6.626 11.962 0.536
19 3HD1 LEU 156 HD13 LEU 156 -7.206 11.291 -0.989
20 1HD2 LEU 156 HD21 LEU 156 -6.034 9.902 -2.186
21 2HD2 LEU 156 HD22 LEU 156 -4.310 9.598 -1.982
22 3HD2 LEU 156 HD23 LEU 156 -4.854 11.052 -2.816
23 H GLN 157 HN GLN 157 -0.150 11.306 -1.653
24 HA GLN 157 HA GLN 157 0.501 14.068 -1.677
25 1HB GLN 157 HB2 GLN 157 0.541 13.178 0.847
26 2HB GLN 157 HB1 GLN 157 2.152 12.664 0.361
27 1HG GLN 157 HG2 GLN 157 2.918 14.802 0.125
28 2HG GLN 157 HG1 GLN 157 1.317 15.456 -0.223
29 1HE2 GLN 157 HE21 GLN 157 -0.213 14.822 1.799
30 2HE2 GLN 157 HE22 GLN 157 0.402 15.410 3.301
31 H SER 158 HN SER 158 0.641 11.817 -3.390
32 HA SER 158 HA SER 158 3.298 12.124 -4.382
33 1HB SER 158 HB2 SER 158 4.027 10.446 -2.916
34 2HB SER 158 HB1 SER 158 2.497 9.558 -3.023
35 HG SER 158 HG SER 158 4.735 9.373 -4.573
36 H ASP 159 HN ASP 159 2.126 12.859 -6.162
37 HA ASP 159 HA ASP 159 1.299 12.628 -8.273
38 1HB ASP 159 HB2 ASP 159 2.103 9.927 -7.635
39 2HB ASP 159 HB1 ASP 159 0.609 9.912 -8.567
40 H VAL 160 HN VAL 160 -0.322 10.208 -6.219
41 HA VAL 160 HA VAL 160 -2.475 9.961 -5.551
42 HB VAL 160 HB VAL 160 -2.831 12.797 -6.514
43 1HG1 VAL 160 HG11 VAL 160 -4.640 10.863 -5.198
44 2HG1 VAL 160 HG12 VAL 160 -5.007 12.194 -6.296
45 3HG1 VAL 160 HG13 VAL 160 -4.671 12.521 -4.595
46 1HG2 VAL 160 HG21 VAL 160 -1.819 11.606 -3.991
47 2HG2 VAL 160 HG22 VAL 160 -2.813 13.059 -3.885
48 3HG2 VAL 160 HG23 VAL 160 -1.323 13.078 -4.827
49 H PHE 161 HN PHE 161 -2.443 11.805 -8.610
50 HA PHE 161 HA PHE 161 -4.778 10.541 -9.618
51 1HB PHE 161 HB2 PHE 161 -3.308 12.780 -10.301
52 2HB PHE 161 HB1 PHE 161 -3.015 11.682 -11.645
53 HD1 PHE 161 HD1 PHE 161 -5.620 13.459 -9.744
54 HD2 PHE 161 HD2 PHE 161 -4.709 11.180 -13.220
55 HE1 PHE 161 HE1 PHE 161 -7.808 14.050 -10.700
56 HE2 PHE 161 HE2 PHE 161 -6.895 11.768 -14.184
57 HZ PHE 161 HZ PHE 161 -8.448 13.205 -12.923
58 H PHE 162 HN PHE 162 -1.960 9.134 -9.006
59 HA PHE 162 HA PHE 162 -2.422 7.011 -10.862
60 1HB PHE 162 HB2 PHE 162 0.386 7.913 -11.054
61 2HB PHE 162 HB1 PHE 162 -0.655 7.169 -12.267
62 HD1 PHE 162 HD1 PHE 162 0.006 10.374 -10.511
63 HD2 PHE 162 HD2 PHE 162 -1.619 8.460 -13.947
64 HE1 PHE 162 HE1 PHE 162 -0.296 12.567 -11.584
65 HE2 PHE 162 HE2 PHE 162 -1.925 10.649 -15.026
66 HZ PHE 162 HZ PHE 162 -1.264 12.707 -13.845
67 H LEU 163 HN LEU 163 -1.554 8.065 -7.900
68 HA LEU 163 HA LEU 163 0.505 6.238 -7.166
69 1HB LEU 163 HB2 LEU 163 -0.238 8.351 -5.947
70 2HB LEU 163 HB1 LEU 163 -1.583 7.398 -5.353
71 HG LEU 163 HG LEU 163 -0.112 5.931 -4.149
72 1HD1 LEU 163 HD11 LEU 163 1.725 5.676 -5.609
73 2HD1 LEU 163 HD12 LEU 163 2.365 6.420 -4.143
74 3HD1 LEU 163 HD13 LEU 163 2.085 7.402 -5.581
75 1HD2 LEU 163 HD21 LEU 163 -0.360 7.540 -2.612
76 2HD2 LEU 163 HD22 LEU 163 -0.003 8.830 -3.762
77 3HD2 LEU 163 HD23 LEU 163 1.313 7.948 -2.987
78 H PHE 164 HN PHE 164 -2.571 5.751 -8.151
79 HA PHE 164 HA PHE 164 -3.564 3.822 -6.347
80 1HB PHE 164 HB2 PHE 164 -4.216 4.790 -9.075
81 2HB PHE 164 HB1 PHE 164 -4.844 3.203 -8.627
82 HD1 PHE 164 HD1 PHE 164 -5.573 3.436 -5.873
83 HD2 PHE 164 HD2 PHE 164 -5.919 6.323 -8.979
84 HE1 PHE 164 HE1 PHE 164 -7.423 4.514 -4.660
85 HE2 PHE 164 HE2 PHE 164 -7.770 7.406 -7.773
86 HZ PHE 164 HZ PHE 164 -8.523 6.501 -5.610
87 H LEU 165 HN LEU 165 -1.013 3.633 -8.575
88 HA LEU 165 HA LEU 165 -1.280 0.955 -9.466
89 1HB LEU 165 HB2 LEU 165 1.376 2.252 -8.940
90 2HB LEU 165 HB1 LEU 165 0.948 1.099 -10.191
91 HG LEU 165 HG LEU 165 -0.519 3.625 -10.414
92 1HD1 LEU 165 HD11 LEU 165 1.508 4.599 -9.579
93 2HD1 LEU 165 HD12 LEU 165 1.435 4.857 -11.323
94 3HD1 LEU 165 HD13 LEU 165 2.484 3.604 -10.659
95 1HD2 LEU 165 HD21 LEU 165 -0.274 3.255 -12.670
96 2HD2 LEU 165 HD22 LEU 165 -0.199 1.608 -12.045
97 3HD2 LEU 165 HD23 LEU 165 1.285 2.454 -12.481
98 H LEU 166 HN LEU 166 -0.015 2.461 -6.589
99 HA LEU 166 HA LEU 166 -0.039 -0.035 -5.168
100 1HB LEU 166 HB2 LEU 166 2.306 0.724 -6.486
101 2HB LEU 166 HB1 LEU 166 2.583 1.140 -4.799
102 HG LEU 166 HG LEU 166 3.424 -1.072 -5.164
103 1HD1 LEU 166 HD11 LEU 166 0.779 -1.499 -3.812
104 2HD1 LEU 166 HD12 LEU 166 2.058 -0.533 -3.077
105 3HD1 LEU 166 HD13 LEU 166 2.340 -2.235 -3.445
106 1HD2 LEU 166 HD21 LEU 166 0.687 -1.914 -6.092
107 2HD2 LEU 166 HD22 LEU 166 2.177 -2.858 -6.106
108 3HD2 LEU 166 HD23 LEU 166 1.994 -1.483 -7.195
109 HA PRO 167 HA PRO 167 -1.121 3.963 -2.925
110 1HB PRO 167 HB2 PRO 167 -3.101 2.535 -1.510
111 2HB PRO 167 HB1 PRO 167 -3.344 3.707 -2.816
112 1HG PRO 167 HG2 PRO 167 -3.396 0.760 -2.894
113 2HG PRO 167 HG1 PRO 167 -4.174 1.932 -3.965
114 1HD PRO 167 HD2 PRO 167 -2.003 0.447 -4.679
115 2HD PRO 167 HD1 PRO 167 -2.368 2.042 -5.362
116 HA PRO 168 HA PRO 168 -0.071 1.649 1.032
117 1HB PRO 168 HB2 PRO 168 0.173 -0.971 1.150
118 2HB PRO 168 HB1 PRO 168 -1.429 -0.229 0.957
119 1HG PRO 168 HG2 PRO 168 0.318 -1.517 -1.107
120 2HG PRO 168 HG1 PRO 168 -1.431 -1.673 -0.866
121 1HD PRO 168 HD2 PRO 168 -0.198 0.043 -2.676
122 2HD PRO 168 HD1 PRO 168 -1.863 0.193 -2.090
123 H ILE 169 HN ILE 169 1.881 2.829 0.223
124 HA ILE 169 HA ILE 169 4.147 1.297 -0.656
125 HB ILE 169 HB ILE 169 3.819 4.163 0.216
126 1HG1 ILE 169 HG12 ILE 169 2.915 3.482 -1.996
127 2HG1 ILE 169 HG11 ILE 169 4.210 4.669 -2.118
128 1HG2 ILE 169 HG21 ILE 169 6.192 4.398 -0.748
129 2HG2 ILE 169 HG22 ILE 169 6.326 2.665 -0.449
130 3HG2 ILE 169 HG23 ILE 169 6.008 3.769 0.891
131 1HD1 ILE 169 HD11 ILE 169 4.547 1.708 -2.525
132 2HD1 ILE 169 HD12 ILE 169 5.775 2.953 -2.756
133 3HD1 ILE 169 HD13 ILE 169 4.362 2.900 -3.811
134 H ILE 170 HN ILE 170 4.028 3.502 2.095
135 HA ILE 170 HA ILE 170 5.994 2.055 3.546
136 HB ILE 170 HB ILE 170 4.200 4.286 4.494
137 1HG1 ILE 170 HG12 ILE 170 6.699 5.355 4.105
138 2HG1 ILE 170 HG11 ILE 170 6.568 4.225 2.760
139 1HG2 ILE 170 HG21 ILE 170 5.908 4.659 6.202
140 2HG2 ILE 170 HG22 ILE 170 6.807 3.263 5.609
141 3HG2 ILE 170 HG23 ILE 170 5.213 3.043 6.331
142 1HD1 ILE 170 HD11 ILE 170 5.487 5.833 1.687
143 2HD1 ILE 170 HD12 ILE 170 5.305 6.792 3.156
144 3HD1 ILE 170 HD13 ILE 170 4.133 5.530 2.776
145 H LEU 171 HN LEU 171 2.493 2.137 3.580
146 HA LEU 171 HA LEU 171 2.110 0.946 6.119
147 1HB LEU 171 HB2 LEU 171 0.278 2.041 4.967
148 2HB LEU 171 HB1 LEU 171 0.397 0.913 3.630
149 HG LEU 171 HG LEU 171 -0.178 -0.911 5.343
150 1HD1 LEU 171 HD11 LEU 171 0.089 0.090 7.417
151 2HD1 LEU 171 HD12 LEU 171 -1.660 0.114 7.188
152 3HD1 LEU 171 HD13 LEU 171 -0.714 1.577 6.916
153 1HD2 LEU 171 HD21 LEU 171 -2.297 -0.815 4.594
154 2HD2 LEU 171 HD22 LEU 171 -1.690 0.525 3.621
155 3HD2 LEU 171 HD23 LEU 171 -2.526 0.847 5.140
156 H ASP 172 HN ASP 172 1.740 -0.512 2.910
157 HA ASP 172 HA ASP 172 2.051 -3.171 3.934
158 1HB ASP 172 HB2 ASP 172 0.551 -2.681 2.034
159 2HB ASP 172 HB1 ASP 172 1.956 -2.210 1.065
160 H ALA 173 HN ALA 173 4.304 -0.902 3.701
161 HA ALA 173 HA ALA 173 6.337 -2.147 2.144
162 1HB ALA 173 HB1 ALA 173 6.131 0.178 3.926
163 2HB ALA 173 HB2 ALA 173 6.981 -0.002 2.393
164 3HB ALA 173 HB3 ALA 173 7.718 -0.586 3.884
165 H GLY 174 HN GLY 174 5.698 -1.854 5.603
166 1HA GLY 174 HA2 GLY 174 7.265 -4.321 6.065
167 2HA GLY 174 HA1 GLY 174 7.259 -2.961 7.206
168 H TYR 175 HN TYR 175 4.412 -2.447 6.681
169 HA TYR 175 HA TYR 175 2.340 -3.032 7.292
170 1HB TYR 175 HB2 TYR 175 3.504 -5.554 6.726
171 2HB TYR 175 HB1 TYR 175 2.624 -5.729 8.241
172 HD1 TYR 175 HD1 TYR 175 2.175 -6.680 5.170
173 HD2 TYR 175 HD2 TYR 175 0.371 -3.858 7.794
174 HE1 TYR 175 HE1 TYR 175 0.069 -6.867 3.914
175 HE2 TYR 175 HE2 TYR 175 -1.741 -4.038 6.546
176 HH TYR 175 HH TYR 175 -2.881 -5.559 5.066
177 H PHE 176 HN PHE 176 5.059 -3.700 9.342
178 HA PHE 176 HA PHE 176 3.405 -3.696 11.748
179 1HB PHE 176 HB2 PHE 176 6.217 -4.414 11.101
180 2HB PHE 176 HB1 PHE 176 5.935 -3.722 12.704
181 HD1 PHE 176 HD1 PHE 176 3.770 -5.984 10.693
182 HD2 PHE 176 HD2 PHE 176 6.183 -5.499 14.165
183 HE1 PHE 176 HE1 PHE 176 3.034 -8.186 11.508
184 HE2 PHE 176 HE2 PHE 176 5.452 -7.701 14.986
185 HZ PHE 176 HZ PHE 176 3.876 -9.048 13.656
186 H LEU 177 HN LEU 177 3.053 -1.426 10.442
187 HA LEU 177 HA LEU 177 3.160 0.820 10.505
188 1HB LEU 177 HB2 LEU 177 4.010 0.095 13.297
189 2HB LEU 177 HB1 LEU 177 3.915 1.771 12.793
190 HG LEU 177 HG LEU 177 1.519 0.085 12.314
191 1HD1 LEU 177 HD11 LEU 177 2.360 1.032 15.048
192 2HD1 LEU 177 HD12 LEU 177 2.099 -0.635 14.534
193 3HD1 LEU 177 HD13 LEU 177 0.738 0.484 14.626
194 1HD2 LEU 177 HD21 LEU 177 2.037 2.685 11.940
195 2HD2 LEU 177 HD22 LEU 177 1.424 2.747 13.593
196 3HD2 LEU 177 HD23 LEU 177 0.427 2.066 12.308
197 HA PRO 178 HA PRO 178 7.749 0.586 9.565
198 1HB PRO 178 HB2 PRO 178 6.732 1.188 6.854
199 2HB PRO 178 HB1 PRO 178 7.882 -0.050 7.370
200 1HG PRO 178 HG2 PRO 178 5.423 -0.704 6.607
201 2HG PRO 178 HG1 PRO 178 6.188 -1.526 7.980
202 1HD PRO 178 HD2 PRO 178 4.192 0.717 7.986
203 2HD PRO 178 HD1 PRO 178 4.190 -0.787 8.933
204 H LEU 179 HN LEU 179 5.211 2.846 9.396
205 HA LEU 179 HA LEU 179 6.464 5.033 8.166
206 1HB LEU 179 HB2 LEU 179 3.992 4.625 8.993
207 2HB LEU 179 HB1 LEU 179 4.572 5.437 10.435
208 HG LEU 179 HG LEU 179 4.521 6.566 7.637
209 1HD1 LEU 179 HD11 LEU 179 2.378 6.395 9.008
210 2HD1 LEU 179 HD12 LEU 179 2.811 7.983 8.375
211 3HD1 LEU 179 HD13 LEU 179 3.105 7.600 10.071
212 1HD2 LEU 179 HD21 LEU 179 5.526 7.805 10.197
213 2HD2 LEU 179 HD22 LEU 179 5.357 8.630 8.648
214 3HD2 LEU 179 HD23 LEU 179 6.516 7.313 8.823
215 H ARG 180 HN ARG 180 6.045 4.359 11.635
216 HA ARG 180 HA ARG 180 8.064 6.340 12.285
217 1HB ARG 180 HB2 ARG 180 7.442 6.033 14.574
218 2HB ARG 180 HB1 ARG 180 5.958 6.100 13.619
219 1HG ARG 180 HG2 ARG 180 7.172 3.450 14.279
220 2HG ARG 180 HG1 ARG 180 6.249 4.320 15.503
221 1HD ARG 180 HD2 ARG 180 5.336 3.152 12.908
222 2HD ARG 180 HD1 ARG 180 4.635 2.993 14.516
223 HE ARG 180 HE ARG 180 4.086 5.040 12.586
224 1HH1 ARG 180 1HH1 ARG 180 4.136 4.282 15.993
225 2HH1 ARG 180 2HH1 ARG 180 2.964 5.489 16.408
226 1HH2 ARG 180 1HH2 ARG 180 2.543 6.631 13.131
227 2HH2 ARG 180 2HH2 ARG 180 2.060 6.821 14.784
228 1HG HSL 181 HG1 HSL 181 12.112 0.608 11.179
229 2HG HSL 181 HG2 HSL 181 11.450 0.620 9.462
230 H HSL 181 HN HSL 181 8.897 4.095 10.738
231 HA HSL 181 HA HSL 181 10.811 2.718 12.695
232 1HB HSL 181 HB1 HSL 181 9.791 0.803 11.747
233 2HB HSL 181 HB2 HSL 181 9.395 1.678 10.172
Start of MODEL 82
1 1H PHE 155 HT1 PHE 155 -9.326 -7.785 -7.722
2 2H PHE 155 HT2 PHE 155 -7.802 -7.530 -6.976
3 3H PHE 155 HT3 PHE 155 -9.161 -7.976 -6.027
4 HA PHE 155 HA PHE 155 -9.218 -10.099 -6.879
5 1HB PHE 155 HB2 PHE 155 -8.519 -8.976 -9.212
6 2HB PHE 155 HB1 PHE 155 -6.956 -9.646 -8.758
7 HD1 PHE 155 HD1 PHE 155 -10.382 -10.406 -9.758
8 HD2 PHE 155 HD2 PHE 155 -6.620 -12.040 -8.622
9 HE1 PHE 155 HE1 PHE 155 -11.089 -12.608 -10.601
10 HE2 PHE 155 HE2 PHE 155 -7.319 -14.245 -9.463
11 HZ PHE 155 HZ PHE 155 -9.556 -14.530 -10.453
12 H LEU 156 HN LEU 156 -7.663 -11.845 -6.473
13 HA LEU 156 HA LEU 156 -5.892 -11.148 -4.356
14 1HB LEU 156 HB2 LEU 156 -5.378 -13.585 -4.329
15 2HB LEU 156 HB1 LEU 156 -7.080 -13.198 -4.171
16 HG LEU 156 HG LEU 156 -6.169 -13.718 -6.922
17 1HD1 LEU 156 HD11 LEU 156 -6.602 -16.151 -5.288
18 2HD1 LEU 156 HD12 LEU 156 -5.020 -15.377 -5.201
19 3HD1 LEU 156 HD13 LEU 156 -5.650 -15.923 -6.755
20 1HD2 LEU 156 HD21 LEU 156 -8.569 -13.458 -5.691
21 2HD2 LEU 156 HD22 LEU 156 -8.392 -15.213 -5.719
22 3HD2 LEU 156 HD23 LEU 156 -8.320 -14.295 -7.224
23 H GLN 157 HN GLN 157 -3.657 -11.311 -4.263
24 HA GLN 157 HA GLN 157 -2.044 -12.194 -6.419
25 1HB GLN 157 HB2 GLN 157 -3.070 -9.873 -7.121
26 2HB GLN 157 HB1 GLN 157 -1.826 -9.231 -6.058
27 1HG GLN 157 HG2 GLN 157 -0.922 -9.215 -8.229
28 2HG GLN 157 HG1 GLN 157 -0.157 -10.562 -7.387
29 1HE2 GLN 157 HE21 GLN 157 -1.182 -9.738 -10.271
30 2HE2 GLN 157 HE22 GLN 157 -1.783 -11.243 -10.869
31 H SER 158 HN SER 158 -1.912 -12.940 -3.893
32 HA SER 158 HA SER 158 -0.359 -13.349 -2.284
33 1HB SER 158 HB2 SER 158 1.845 -12.755 -2.575
34 2HB SER 158 HB1 SER 158 1.246 -12.480 -4.218
35 HG SER 158 HG SER 158 1.108 -10.294 -3.771
36 H ASP 159 HN ASP 159 -2.154 -10.671 -2.611
37 HA ASP 159 HA ASP 159 -1.989 -10.016 0.156
38 1HB ASP 159 HB2 ASP 159 -1.601 -7.551 -0.379
39 2HB ASP 159 HB1 ASP 159 -0.209 -8.620 -0.464
40 H VAL 160 HN VAL 160 -3.201 -9.260 -3.052
41 HA VAL 160 HA VAL 160 -5.360 -9.080 -3.783
42 HB VAL 160 HB VAL 160 -5.840 -10.177 -1.334
43 1HG1 VAL 160 HG11 VAL 160 -6.094 -7.822 -0.409
44 2HG1 VAL 160 HG12 VAL 160 -7.410 -8.949 -0.090
45 3HG1 VAL 160 HG13 VAL 160 -7.581 -7.730 -1.349
46 1HG2 VAL 160 HG21 VAL 160 -7.441 -9.463 -3.691
47 2HG2 VAL 160 HG22 VAL 160 -8.365 -9.844 -2.238
48 3HG2 VAL 160 HG23 VAL 160 -7.223 -11.018 -2.890
49 H PHE 161 HN PHE 161 -4.434 -6.951 -1.089
50 HA PHE 161 HA PHE 161 -6.077 -4.776 -1.866
51 1HB PHE 161 HB2 PHE 161 -3.634 -4.999 -0.121
52 2HB PHE 161 HB1 PHE 161 -4.400 -3.446 -0.441
53 HD1 PHE 161 HD1 PHE 161 -4.521 -6.499 1.454
54 HD2 PHE 161 HD2 PHE 161 -6.777 -3.097 0.252
55 HE1 PHE 161 HE1 PHE 161 -6.124 -6.924 3.272
56 HE2 PHE 161 HE2 PHE 161 -8.383 -3.515 2.068
57 HZ PHE 161 HZ PHE 161 -8.057 -5.431 3.581
58 H PHE 162 HN PHE 162 -2.913 -5.851 -2.803
59 HA PHE 162 HA PHE 162 -2.008 -3.482 -4.072
60 1HB PHE 162 HB2 PHE 162 -0.428 -5.152 -3.464
61 2HB PHE 162 HB1 PHE 162 -1.323 -6.398 -4.332
62 HD1 PHE 162 HD1 PHE 162 0.615 -7.133 -5.560
63 HD2 PHE 162 HD2 PHE 162 -0.720 -3.100 -5.813
64 HE1 PHE 162 HE1 PHE 162 2.041 -6.789 -7.534
65 HE2 PHE 162 HE2 PHE 162 0.706 -2.750 -7.789
66 HZ PHE 162 HZ PHE 162 2.088 -4.595 -8.650
67 H LEU 163 HN LEU 163 -3.136 -6.541 -5.481
68 HA LEU 163 HA LEU 163 -3.513 -5.512 -8.097
69 1HB LEU 163 HB2 LEU 163 -3.193 -7.929 -7.356
70 2HB LEU 163 HB1 LEU 163 -4.884 -7.901 -6.889
71 HG LEU 163 HG LEU 163 -5.563 -7.528 -9.183
72 1HD1 LEU 163 HD11 LEU 163 -3.860 -6.132 -10.041
73 2HD1 LEU 163 HD12 LEU 163 -3.797 -7.622 -10.983
74 3HD1 LEU 163 HD13 LEU 163 -2.610 -7.333 -9.711
75 1HD2 LEU 163 HD21 LEU 163 -3.527 -9.684 -9.463
76 2HD2 LEU 163 HD22 LEU 163 -5.223 -9.663 -9.947
77 3HD2 LEU 163 HD23 LEU 163 -4.793 -9.854 -8.248
78 H PHE 164 HN PHE 164 -5.137 -4.919 -5.317
79 HA PHE 164 HA PHE 164 -7.841 -4.957 -6.180
80 1HB PHE 164 HB2 PHE 164 -6.423 -4.686 -3.777
81 2HB PHE 164 HB1 PHE 164 -7.314 -3.178 -3.964
82 HD1 PHE 164 HD1 PHE 164 -9.796 -3.928 -5.183
83 HD2 PHE 164 HD2 PHE 164 -7.530 -6.002 -2.241
84 HE1 PHE 164 HE1 PHE 164 -11.847 -5.029 -4.385
85 HE2 PHE 164 HE2 PHE 164 -9.574 -7.109 -1.437
86 HZ PHE 164 HZ PHE 164 -11.737 -6.622 -2.510
87 H LEU 165 HN LEU 165 -5.319 -2.469 -5.999
88 HA LEU 165 HA LEU 165 -6.549 -0.878 -7.973
89 1HB LEU 165 HB2 LEU 165 -7.502 -0.477 -5.301
90 2HB LEU 165 HB1 LEU 165 -6.674 0.968 -5.853
91 HG LEU 165 HG LEU 165 -9.000 -0.386 -7.221
92 1HD1 LEU 165 HD11 LEU 165 -8.925 2.381 -6.069
93 2HD1 LEU 165 HD12 LEU 165 -9.365 0.981 -5.089
94 3HD1 LEU 165 HD13 LEU 165 -10.323 1.399 -6.509
95 1HD2 LEU 165 HD21 LEU 165 -8.009 0.507 -9.048
96 2HD2 LEU 165 HD22 LEU 165 -7.075 1.671 -8.110
97 3HD2 LEU 165 HD23 LEU 165 -8.777 1.980 -8.454
98 H LEU 166 HN LEU 166 -4.467 -0.743 -5.094
99 HA LEU 166 HA LEU 166 -2.290 0.251 -6.700
100 1HB LEU 166 HB2 LEU 166 -3.961 2.144 -5.661
101 2HB LEU 166 HB1 LEU 166 -2.758 2.013 -4.393
102 HG LEU 166 HG LEU 166 -2.346 3.814 -6.100
103 1HD1 LEU 166 HD11 LEU 166 0.107 2.767 -6.522
104 2HD1 LEU 166 HD12 LEU 166 -0.455 1.759 -5.190
105 3HD1 LEU 166 HD13 LEU 166 -0.408 3.513 -5.009
106 1HD2 LEU 166 HD21 LEU 166 -1.422 1.619 -7.918
107 2HD2 LEU 166 HD22 LEU 166 -1.697 3.323 -8.280
108 3HD2 LEU 166 HD23 LEU 166 -3.067 2.247 -8.008
109 HA PRO 167 HA PRO 167 -0.163 -2.297 -3.739
110 1HB PRO 167 HB2 PRO 167 2.355 -1.222 -4.167
111 2HB PRO 167 HB1 PRO 167 1.620 -2.512 -5.137
112 1HG PRO 167 HG2 PRO 167 1.774 0.426 -5.682
113 2HG PRO 167 HG1 PRO 167 1.965 -0.936 -6.802
114 1HD PRO 167 HD2 PRO 167 -0.304 0.478 -6.713
115 2HD PRO 167 HD1 PRO 167 -0.326 -1.279 -6.971
116 HA PRO 168 HA PRO 168 -0.235 0.721 -0.364
117 1HB PRO 168 HB2 PRO 168 -0.010 -1.128 1.632
118 2HB PRO 168 HB1 PRO 168 -1.545 -0.736 0.833
119 1HG PRO 168 HG2 PRO 168 0.315 -3.032 0.351
120 2HG PRO 168 HG1 PRO 168 -1.457 -3.020 0.424
121 1HD PRO 168 HD2 PRO 168 -0.103 -3.062 -1.916
122 2HD PRO 168 HD1 PRO 168 -1.666 -2.238 -1.737
123 H ILE 169 HN ILE 169 1.859 1.451 -1.121
124 HA ILE 169 HA ILE 169 4.273 0.147 -0.415
125 HB ILE 169 HB ILE 169 5.281 2.470 -0.797
126 1HG1 ILE 169 HG12 ILE 169 2.729 3.138 -2.173
127 2HG1 ILE 169 HG11 ILE 169 2.821 3.403 -0.436
128 1HG2 ILE 169 HG21 ILE 169 5.558 1.907 -2.962
129 2HG2 ILE 169 HG22 ILE 169 3.826 1.743 -3.251
130 3HG2 ILE 169 HG23 ILE 169 4.717 0.436 -2.470
131 1HD1 ILE 169 HD11 ILE 169 5.160 4.457 -1.705
132 2HD1 ILE 169 HD12 ILE 169 3.937 5.287 -0.742
133 3HD1 ILE 169 HD13 ILE 169 3.709 5.092 -2.480
134 H ILE 170 HN ILE 170 2.260 2.499 1.189
135 HA ILE 170 HA ILE 170 4.164 3.165 3.219
136 HB ILE 170 HB ILE 170 1.180 3.629 3.155
137 1HG1 ILE 170 HG12 ILE 170 2.425 6.054 2.775
138 2HG1 ILE 170 HG11 ILE 170 3.453 4.956 1.862
139 1HG2 ILE 170 HG21 ILE 170 3.285 4.285 5.110
140 2HG2 ILE 170 HG22 ILE 170 1.549 4.069 5.337
141 3HG2 ILE 170 HG23 ILE 170 2.174 5.595 4.711
142 1HD1 ILE 170 HD11 ILE 170 2.013 5.112 0.195
143 2HD1 ILE 170 HD12 ILE 170 0.883 6.026 1.195
144 3HD1 ILE 170 HD13 ILE 170 0.832 4.263 1.192
145 H LEU 171 HN LEU 171 1.109 1.312 3.245
146 HA LEU 171 HA LEU 171 1.426 0.394 5.908
147 1HB LEU 171 HB2 LEU 171 -0.213 -0.780 3.658
148 2HB LEU 171 HB1 LEU 171 -0.373 -1.193 5.355
149 HG LEU 171 HG LEU 171 -0.779 1.622 4.381
150 1HD1 LEU 171 HD11 LEU 171 -2.276 -0.369 3.384
151 2HD1 LEU 171 HD12 LEU 171 -2.905 1.241 3.729
152 3HD1 LEU 171 HD13 LEU 171 -3.143 -0.065 4.889
153 1HD2 LEU 171 HD21 LEU 171 -1.533 2.065 6.464
154 2HD2 LEU 171 HD22 LEU 171 -0.516 0.686 6.884
155 3HD2 LEU 171 HD23 LEU 171 -2.252 0.466 6.662
156 H ASP 172 HN ASP 172 1.874 -1.236 2.785
157 HA ASP 172 HA ASP 172 3.024 -3.571 3.951
158 1HB ASP 172 HB2 ASP 172 1.774 -3.285 1.673
159 2HB ASP 172 HB1 ASP 172 3.375 -2.845 1.061
160 H ALA 173 HN ALA 173 4.306 -0.590 3.880
161 HA ALA 173 HA ALA 173 6.886 -1.057 2.772
162 1HB ALA 173 HB1 ALA 173 5.514 1.141 3.885
163 2HB ALA 173 HB2 ALA 173 7.100 1.139 3.117
164 3HB ALA 173 HB3 ALA 173 6.965 0.914 4.860
165 H GLY 174 HN GLY 174 5.688 -0.801 6.097
166 1HA GLY 174 HA2 GLY 174 7.656 -2.836 6.904
167 2HA GLY 174 HA1 GLY 174 7.456 -1.348 7.852
168 H TYR 175 HN TYR 175 4.841 -2.928 6.222
169 HA TYR 175 HA TYR 175 2.970 -3.964 6.906
170 1HB TYR 175 HB2 TYR 175 4.126 -5.701 7.975
171 2HB TYR 175 HB1 TYR 175 4.764 -4.633 9.216
172 HD1 TYR 175 HD1 TYR 175 1.425 -5.770 7.963
173 HD2 TYR 175 HD2 TYR 175 3.869 -4.862 11.324
174 HE1 TYR 175 HE1 TYR 175 -0.404 -6.440 9.466
175 HE2 TYR 175 HE2 TYR 175 2.049 -5.529 12.836
176 HH TYR 175 HH TYR 175 0.057 -6.877 12.835
177 H PHE 176 HN PHE 176 4.239 -2.608 9.874
178 HA PHE 176 HA PHE 176 2.278 -0.484 9.841
179 1HB PHE 176 HB2 PHE 176 0.993 -2.278 10.866
180 2HB PHE 176 HB1 PHE 176 2.292 -2.578 12.028
181 HD1 PHE 176 HD1 PHE 176 0.845 0.660 10.903
182 HD2 PHE 176 HD2 PHE 176 1.334 -2.118 14.089
183 HE1 PHE 176 HE1 PHE 176 -0.184 2.267 12.457
184 HE2 PHE 176 HE2 PHE 176 0.305 -0.517 15.648
185 HZ PHE 176 HZ PHE 176 -0.456 1.679 14.833
186 H LEU 177 HN LEU 177 5.337 -1.524 10.415
187 HA LEU 177 HA LEU 177 5.953 0.843 11.946
188 1HB LEU 177 HB2 LEU 177 7.469 -1.255 13.132
189 2HB LEU 177 HB1 LEU 177 6.347 -0.142 13.884
190 HG LEU 177 HG LEU 177 5.224 -2.514 12.448
191 1HD1 LEU 177 HD11 LEU 177 5.819 -2.897 15.311
192 2HD1 LEU 177 HD12 LEU 177 7.214 -2.967 14.235
193 3HD1 LEU 177 HD13 LEU 177 5.846 -4.050 13.977
194 1HD2 LEU 177 HD21 LEU 177 4.206 -1.708 15.062
195 2HD2 LEU 177 HD22 LEU 177 3.364 -1.909 13.525
196 3HD2 LEU 177 HD23 LEU 177 4.208 -0.398 13.879
197 HA PRO 178 HA PRO 178 10.246 -1.465 10.600
198 1HB PRO 178 HB2 PRO 178 8.729 -2.954 8.485
199 2HB PRO 178 HB1 PRO 178 10.250 -3.377 9.278
200 1HG PRO 178 HG2 PRO 178 7.881 -4.449 10.006
201 2HG PRO 178 HG1 PRO 178 9.201 -4.174 11.153
202 1HD PRO 178 HD2 PRO 178 6.616 -2.840 10.976
203 2HD PRO 178 HD1 PRO 178 7.819 -2.785 12.269
204 H LEU 179 HN LEU 179 11.397 -1.207 8.481
205 HA LEU 179 HA LEU 179 11.803 -0.200 6.456
206 1HB LEU 179 HB2 LEU 179 9.085 -0.230 6.359
207 2HB LEU 179 HB1 LEU 179 9.400 1.498 6.389
208 HG LEU 179 HG LEU 179 9.164 0.565 4.099
209 1HD1 LEU 179 HD11 LEU 179 10.602 2.584 4.770
210 2HD1 LEU 179 HD12 LEU 179 10.847 1.878 3.172
211 3HD1 LEU 179 HD13 LEU 179 11.979 1.521 4.476
212 1HD2 LEU 179 HD21 LEU 179 10.578 -1.548 4.981
213 2HD2 LEU 179 HD22 LEU 179 11.861 -0.625 4.198
214 3HD2 LEU 179 HD23 LEU 179 10.437 -1.109 3.278
215 H ARG 180 HN ARG 180 10.670 1.420 9.253
216 HA ARG 180 HA ARG 180 12.675 3.476 8.906
217 1HB ARG 180 HB2 ARG 180 10.497 4.966 9.819
218 2HB ARG 180 HB1 ARG 180 11.239 5.053 8.221
219 1HG ARG 180 HG2 ARG 180 8.968 4.791 7.800
220 2HG ARG 180 HG1 ARG 180 9.639 3.178 7.566
221 1HD ARG 180 HD2 ARG 180 9.011 2.784 10.025
222 2HD ARG 180 HD1 ARG 180 8.014 4.229 9.855
223 HE ARG 180 HE ARG 180 7.611 2.151 7.867
224 1HH1 ARG 180 1HH1 ARG 180 6.544 3.577 10.874
225 2HH1 ARG 180 2HH1 ARG 180 4.954 2.902 10.771
226 1HH2 ARG 180 1HH2 ARG 180 5.520 1.262 7.739
227 2HH2 ARG 180 2HH2 ARG 180 4.374 1.587 8.995
228 1HG HSL 181 HG1 HSL 181 12.741 0.086 15.048
229 2HG HSL 181 HG2 HSL 181 13.259 -1.332 13.994
230 H HSL 181 HN HSL 181 12.776 1.338 10.472
231 HA HSL 181 HA HSL 181 12.201 2.379 13.292
232 1HB HSL 181 HB1 HSL 181 11.035 0.321 13.386
233 2HB HSL 181 HB2 HSL 181 12.088 -0.439 12.072
Start of MODEL 83
1 1H PHE 155 HT1 PHE 155 16.129 11.140 1.175
2 2H PHE 155 HT2 PHE 155 14.605 11.769 0.701
3 3H PHE 155 HT3 PHE 155 15.750 11.300 -0.489
4 HA PHE 155 HA PHE 155 15.618 9.030 0.534
5 1HB PHE 155 HB2 PHE 155 13.547 10.557 1.979
6 2HB PHE 155 HB1 PHE 155 13.044 8.974 1.398
7 HD1 PHE 155 HD1 PHE 155 16.077 10.434 3.021
8 HD2 PHE 155 HD2 PHE 155 13.198 7.301 2.943
9 HE1 PHE 155 HE1 PHE 155 17.178 9.380 4.952
10 HE2 PHE 155 HE2 PHE 155 14.294 6.242 4.874
11 HZ PHE 155 HZ PHE 155 16.287 7.281 5.881
12 H LEU 156 HN LEU 156 14.085 7.498 -0.477
13 HA LEU 156 HA LEU 156 12.180 8.424 -2.372
14 1HB LEU 156 HB2 LEU 156 13.307 7.829 -4.401
15 2HB LEU 156 HB1 LEU 156 14.294 8.983 -3.524
16 HG LEU 156 HG LEU 156 14.803 6.021 -3.381
17 1HD1 LEU 156 HD11 LEU 156 16.513 7.688 -5.105
18 2HD1 LEU 156 HD12 LEU 156 14.906 7.317 -5.730
19 3HD1 LEU 156 HD13 LEU 156 16.003 6.009 -5.287
20 1HD2 LEU 156 HD21 LEU 156 17.114 7.661 -3.158
21 2HD2 LEU 156 HD22 LEU 156 16.387 6.609 -1.945
22 3HD2 LEU 156 HD23 LEU 156 15.878 8.292 -2.069
23 H GLN 157 HN GLN 157 10.702 6.882 -2.599
24 HA GLN 157 HA GLN 157 11.300 4.131 -2.935
25 1HB GLN 157 HB2 GLN 157 11.733 4.467 -0.464
26 2HB GLN 157 HB1 GLN 157 10.017 4.808 -0.289
27 1HG GLN 157 HG2 GLN 157 10.671 2.482 0.279
28 2HG GLN 157 HG1 GLN 157 9.430 2.604 -0.966
29 1HE2 GLN 157 HE21 GLN 157 9.708 1.380 -2.682
30 2HE2 GLN 157 HE22 GLN 157 11.209 0.734 -3.243
31 H SER 158 HN SER 158 9.630 6.354 -4.000
32 HA SER 158 HA SER 158 7.318 4.819 -4.603
33 1HB SER 158 HB2 SER 158 7.028 6.079 -2.227
34 2HB SER 158 HB1 SER 158 6.453 7.345 -3.325
35 HG SER 158 HG SER 158 5.532 4.668 -3.446
36 H ASP 159 HN ASP 159 9.433 6.204 -5.985
37 HA ASP 159 HA ASP 159 9.619 7.283 -7.987
38 1HB ASP 159 HB2 ASP 159 6.922 6.716 -7.921
39 2HB ASP 159 HB1 ASP 159 6.950 8.463 -8.147
40 H VAL 160 HN VAL 160 8.817 8.690 -5.075
41 HA VAL 160 HA VAL 160 9.632 10.647 -4.201
42 HB VAL 160 HB VAL 160 10.892 10.781 -6.602
43 1HG1 VAL 160 HG11 VAL 160 8.940 11.998 -7.595
44 2HG1 VAL 160 HG12 VAL 160 10.469 12.871 -7.685
45 3HG1 VAL 160 HG13 VAL 160 9.269 13.319 -6.474
46 1HG2 VAL 160 HG21 VAL 160 12.280 12.249 -5.557
47 2HG2 VAL 160 HG22 VAL 160 11.346 11.706 -4.162
48 3HG2 VAL 160 HG23 VAL 160 10.958 13.239 -4.942
49 H PHE 161 HN PHE 161 7.410 10.943 -6.963
50 HA PHE 161 HA PHE 161 6.095 13.264 -5.986
51 1HB PHE 161 HB2 PHE 161 5.391 11.174 -8.032
52 2HB PHE 161 HB1 PHE 161 4.239 12.429 -7.589
53 HD1 PHE 161 HD1 PHE 161 4.977 14.854 -7.840
54 HD2 PHE 161 HD2 PHE 161 7.045 11.584 -9.612
55 HE1 PHE 161 HE1 PHE 161 6.042 16.396 -9.434
56 HE2 PHE 161 HE2 PHE 161 8.115 13.120 -11.208
57 HZ PHE 161 HZ PHE 161 7.614 15.530 -11.121
58 H PHE 162 HN PHE 162 5.554 9.822 -5.641
59 HA PHE 162 HA PHE 162 3.056 10.026 -4.274
60 1HB PHE 162 HB2 PHE 162 4.637 8.029 -5.386
61 2HB PHE 162 HB1 PHE 162 4.549 7.642 -3.670
62 HD1 PHE 162 HD1 PHE 162 3.297 6.398 -6.368
63 HD2 PHE 162 HD2 PHE 162 1.810 8.621 -3.057
64 HE1 PHE 162 HE1 PHE 162 1.065 5.426 -6.723
65 HE2 PHE 162 HE2 PHE 162 -0.425 7.650 -3.406
66 HZ PHE 162 HZ PHE 162 -0.798 6.052 -5.240
67 H LEU 163 HN LEU 163 6.386 9.350 -3.238
68 HA LEU 163 HA LEU 163 5.859 9.277 -0.454
69 1HB LEU 163 HB2 LEU 163 7.979 8.641 -1.966
70 2HB LEU 163 HB1 LEU 163 8.487 10.232 -1.431
71 HG LEU 163 HG LEU 163 7.572 8.154 0.516
72 1HD1 LEU 163 HD11 LEU 163 10.471 8.567 0.003
73 2HD1 LEU 163 HD12 LEU 163 9.565 7.505 -1.074
74 3HD1 LEU 163 HD13 LEU 163 9.628 7.162 0.655
75 1HD2 LEU 163 HD21 LEU 163 7.676 10.185 1.600
76 2HD2 LEU 163 HD22 LEU 163 9.050 10.742 0.644
77 3HD2 LEU 163 HD23 LEU 163 9.284 9.526 1.901
78 H PHE 164 HN PHE 164 5.597 11.685 -2.592
79 HA PHE 164 HA PHE 164 6.649 13.921 -1.206
80 1HB PHE 164 HB2 PHE 164 5.871 13.373 -3.748
81 2HB PHE 164 HB1 PHE 164 4.483 14.289 -3.178
82 HD1 PHE 164 HD1 PHE 164 4.585 16.403 -4.084
83 HD2 PHE 164 HD2 PHE 164 8.132 14.660 -2.506
84 HE1 PHE 164 HE1 PHE 164 5.795 18.506 -4.492
85 HE2 PHE 164 HE2 PHE 164 9.349 16.760 -2.911
86 HZ PHE 164 HZ PHE 164 8.180 18.686 -3.906
87 H LEU 165 HN LEU 165 3.231 13.351 -2.115
88 HA LEU 165 HA LEU 165 2.262 15.026 -0.039
89 1HB LEU 165 HB2 LEU 165 0.415 12.963 -1.076
90 2HB LEU 165 HB1 LEU 165 0.171 14.680 -0.854
91 HG LEU 165 HG LEU 165 0.015 14.459 -3.140
92 1HD1 LEU 165 HD11 LEU 165 2.738 14.881 -3.738
93 2HD1 LEU 165 HD12 LEU 165 2.423 15.629 -2.174
94 3HD1 LEU 165 HD13 LEU 165 1.453 16.075 -3.574
95 1HD2 LEU 165 HD21 LEU 165 1.793 12.175 -2.733
96 2HD2 LEU 165 HD22 LEU 165 2.082 13.063 -4.229
97 3HD2 LEU 165 HD23 LEU 165 0.481 12.407 -3.889
98 H LEU 166 HN LEU 166 1.652 11.550 -0.476
99 HA LEU 166 HA LEU 166 2.373 10.935 2.232
100 1HB LEU 166 HB2 LEU 166 -0.330 11.675 1.573
101 2HB LEU 166 HB1 LEU 166 -0.280 10.007 2.120
102 HG LEU 166 HG LEU 166 0.769 12.389 3.654
103 1HD1 LEU 166 HD11 LEU 166 -1.690 12.276 3.498
104 2HD1 LEU 166 HD12 LEU 166 -1.095 12.027 5.140
105 3HD1 LEU 166 HD13 LEU 166 -1.635 10.650 4.179
106 1HD2 LEU 166 HD21 LEU 166 0.372 9.738 4.909
107 2HD2 LEU 166 HD22 LEU 166 1.569 10.988 5.248
108 3HD2 LEU 166 HD23 LEU 166 1.772 9.928 3.853
109 HA PRO 167 HA PRO 167 2.914 7.389 -0.605
110 1HB PRO 167 HB2 PRO 167 4.879 6.210 0.856
111 2HB PRO 167 HB1 PRO 167 5.178 7.511 -0.311
112 1HG PRO 167 HG2 PRO 167 4.914 7.658 2.671
113 2HG PRO 167 HG1 PRO 167 6.079 8.471 1.612
114 1HD PRO 167 HD2 PRO 167 3.908 9.734 2.600
115 2HD PRO 167 HD1 PRO 167 4.573 10.108 0.997
116 HA PRO 168 HA PRO 168 0.299 4.949 2.199
117 1HB PRO 168 HB2 PRO 168 -0.983 3.570 0.295
118 2HB PRO 168 HB1 PRO 168 -1.391 5.260 0.658
119 1HG PRO 168 HG2 PRO 168 0.321 4.156 -1.549
120 2HG PRO 168 HG1 PRO 168 -0.929 5.412 -1.631
121 1HD PRO 168 HD2 PRO 168 1.729 5.968 -1.505
122 2HD PRO 168 HD1 PRO 168 0.484 7.041 -0.836
123 H ILE 169 HN ILE 169 2.741 4.041 -0.032
124 HA ILE 169 HA ILE 169 2.515 1.223 0.265
125 HB ILE 169 HB ILE 169 3.638 2.031 -1.670
126 1HG1 ILE 169 HG12 ILE 169 6.146 1.147 -0.561
127 2HG1 ILE 169 HG11 ILE 169 4.827 0.183 0.095
128 1HG2 ILE 169 HG21 ILE 169 6.070 3.112 -0.888
129 2HG2 ILE 169 HG22 ILE 169 4.883 3.860 0.181
130 3HG2 ILE 169 HG23 ILE 169 4.691 3.975 -1.568
131 1HD1 ILE 169 HD11 ILE 169 5.347 -1.016 -1.771
132 2HD1 ILE 169 HD12 ILE 169 5.805 0.412 -2.699
133 3HD1 ILE 169 HD13 ILE 169 4.101 0.050 -2.419
134 H ILE 170 HN ILE 170 5.703 2.273 1.036
135 HA ILE 170 HA ILE 170 6.954 1.375 2.807
136 HB ILE 170 HB ILE 170 5.424 3.657 4.046
137 1HG1 ILE 170 HG12 ILE 170 8.035 4.193 2.799
138 2HG1 ILE 170 HG11 ILE 170 6.768 3.756 1.658
139 1HG2 ILE 170 HG21 ILE 170 6.755 2.573 5.688
140 2HG2 ILE 170 HG22 ILE 170 7.619 4.033 5.207
141 3HG2 ILE 170 HG23 ILE 170 8.132 2.463 4.591
142 1HD1 ILE 170 HD11 ILE 170 6.724 6.093 1.804
143 2HD1 ILE 170 HD12 ILE 170 6.836 6.068 3.563
144 3HD1 ILE 170 HD13 ILE 170 5.355 5.537 2.765
145 H LEU 171 HN LEU 171 3.834 2.303 4.188
146 HA LEU 171 HA LEU 171 4.032 0.598 6.422
147 1HB LEU 171 HB2 LEU 171 1.464 0.966 6.489
148 2HB LEU 171 HB1 LEU 171 2.548 2.307 6.791
149 HG LEU 171 HG LEU 171 1.612 1.971 3.987
150 1HD1 LEU 171 HD11 LEU 171 -0.169 2.773 6.267
151 2HD1 LEU 171 HD12 LEU 171 -0.460 1.553 5.028
152 3HD1 LEU 171 HD13 LEU 171 -0.462 3.264 4.598
153 1HD2 LEU 171 HD21 LEU 171 1.453 4.527 5.438
154 2HD2 LEU 171 HD22 LEU 171 2.108 4.164 3.842
155 3HD2 LEU 171 HD23 LEU 171 3.069 3.839 5.283
156 H ASP 172 HN ASP 172 2.110 0.232 3.439
157 HA ASP 172 HA ASP 172 1.246 -2.395 4.141
158 1HB ASP 172 HB2 ASP 172 0.355 -2.481 1.832
159 2HB ASP 172 HB1 ASP 172 -0.138 -1.017 2.695
160 H ALA 173 HN ALA 173 4.158 -1.180 2.968
161 HA ALA 173 HA ALA 173 4.881 -3.396 1.304
162 1HB ALA 173 HB1 ALA 173 6.734 -2.211 0.797
163 2HB ALA 173 HB2 ALA 173 7.030 -1.755 2.474
164 3HB ALA 173 HB3 ALA 173 5.828 -0.883 1.524
165 H GLY 174 HN GLY 174 5.988 -2.270 4.504
166 1HA GLY 174 HA2 GLY 174 7.033 -4.971 5.024
167 2HA GLY 174 HA1 GLY 174 7.439 -3.506 5.937
168 H TYR 175 HN TYR 175 4.523 -2.773 5.968
169 HA TYR 175 HA TYR 175 2.628 -3.130 7.182
170 1HB TYR 175 HB2 TYR 175 2.945 -5.564 6.458
171 2HB TYR 175 HB1 TYR 175 3.680 -5.821 8.037
172 HD1 TYR 175 HD1 TYR 175 2.345 -5.945 10.017
173 HD2 TYR 175 HD2 TYR 175 0.552 -4.956 6.287
174 HE1 TYR 175 HE1 TYR 175 0.119 -6.288 11.003
175 HE2 TYR 175 HE2 TYR 175 -1.679 -5.295 7.264
176 HH TYR 175 HH TYR 175 -2.406 -5.238 10.264
177 H PHE 176 HN PHE 176 5.648 -4.178 8.706
178 HA PHE 176 HA PHE 176 4.686 -3.269 11.302
179 1HB PHE 176 HB2 PHE 176 7.025 -4.882 10.353
180 2HB PHE 176 HB1 PHE 176 7.088 -4.102 11.942
181 HD1 PHE 176 HD1 PHE 176 4.707 -6.160 9.925
182 HD2 PHE 176 HD2 PHE 176 6.447 -5.380 13.730
183 HE1 PHE 176 HE1 PHE 176 3.444 -8.041 10.884
184 HE2 PHE 176 HE2 PHE 176 5.187 -7.260 14.696
185 HZ PHE 176 HZ PHE 176 3.683 -8.593 13.272
186 H LEU 177 HN LEU 177 6.256 -1.963 8.654
187 HA LEU 177 HA LEU 177 8.286 -0.399 9.731
188 1HB LEU 177 HB2 LEU 177 6.471 -0.078 7.372
189 2HB LEU 177 HB1 LEU 177 7.584 1.206 7.801
190 HG LEU 177 HG LEU 177 8.438 -1.630 7.232
191 1HD1 LEU 177 HD11 LEU 177 9.383 -0.241 5.151
192 2HD1 LEU 177 HD12 LEU 177 7.896 0.660 5.446
193 3HD1 LEU 177 HD13 LEU 177 7.829 -1.074 5.127
194 1HD2 LEU 177 HD21 LEU 177 9.870 0.933 7.812
195 2HD2 LEU 177 HD22 LEU 177 10.637 -0.323 6.841
196 3HD2 LEU 177 HD23 LEU 177 10.130 -0.672 8.494
197 HA PRO 178 HA PRO 178 4.629 2.983 10.257
198 1HB PRO 178 HB2 PRO 178 2.800 0.944 11.451
199 2HB PRO 178 HB1 PRO 178 2.411 2.410 10.543
200 1HG PRO 178 HG2 PRO 178 2.259 0.023 9.382
201 2HG PRO 178 HG1 PRO 178 2.883 1.427 8.496
202 1HD PRO 178 HD2 PRO 178 4.349 -0.890 9.652
203 2HD PRO 178 HD1 PRO 178 4.708 0.065 8.202
204 H LEU 179 HN LEU 179 6.236 3.557 11.770
205 HA LEU 179 HA LEU 179 6.025 2.371 14.440
206 1HB LEU 179 HB2 LEU 179 8.073 4.303 13.347
207 2HB LEU 179 HB1 LEU 179 8.120 3.538 14.924
208 HG LEU 179 HG LEU 179 7.916 1.492 12.938
209 1HD1 LEU 179 HD11 LEU 179 9.875 1.839 11.628
210 2HD1 LEU 179 HD12 LEU 179 10.268 3.320 12.500
211 3HD1 LEU 179 HD13 LEU 179 8.854 3.266 11.447
212 1HD2 LEU 179 HD21 LEU 179 10.098 2.333 14.841
213 2HD2 LEU 179 HD22 LEU 179 10.100 0.828 13.920
214 3HD2 LEU 179 HD23 LEU 179 8.842 1.125 15.120
215 H ARG 180 HN ARG 180 6.686 5.675 13.286
216 HA ARG 180 HA ARG 180 5.090 6.726 15.489
217 1HB ARG 180 HB2 ARG 180 5.959 8.960 14.238
218 2HB ARG 180 HB1 ARG 180 6.886 8.105 15.474
219 1HG ARG 180 HG2 ARG 180 8.284 8.680 13.582
220 2HG ARG 180 HG1 ARG 180 8.126 6.929 13.724
221 1HD ARG 180 HD2 ARG 180 6.042 7.594 12.064
222 2HD ARG 180 HD1 ARG 180 7.300 8.725 11.574
223 HE ARG 180 HE ARG 180 7.244 5.904 11.114
224 1HH1 ARG 180 1HH1 ARG 180 9.352 8.644 11.588
225 2HH1 ARG 180 2HH1 ARG 180 10.680 7.928 10.738
226 1HH2 ARG 180 1HH2 ARG 180 8.988 4.959 9.999
227 2HH2 ARG 180 2HH2 ARG 180 10.474 5.835 9.834
228 1HG HSL 181 HG1 HSL 181 0.656 6.417 9.861
229 2HG HSL 181 HG2 HSL 181 1.215 4.688 9.568
230 H HSL 181 HN HSL 181 4.039 5.334 13.035
231 HA HSL 181 HA HSL 181 2.142 7.539 12.064
232 1HB HSL 181 HB1 HSL 181 3.019 6.824 9.976
233 2HB HSL 181 HB2 HSL 181 3.364 5.123 10.599
Start of MODEL 84
1 1H PHE 155 HT1 PHE 155 6.297 -5.387 -4.626
2 2H PHE 155 HT2 PHE 155 7.041 -6.729 -5.397
3 3H PHE 155 HT3 PHE 155 5.347 -6.490 -5.532
4 HA PHE 155 HA PHE 155 7.444 -4.714 -6.588
5 1HB PHE 155 HB2 PHE 155 5.698 -5.838 -8.566
6 2HB PHE 155 HB1 PHE 155 7.441 -6.007 -8.418
7 HD1 PHE 155 HD1 PHE 155 4.195 -7.490 -7.502
8 HD2 PHE 155 HD2 PHE 155 8.417 -8.007 -7.613
9 HE1 PHE 155 HE1 PHE 155 3.912 -9.878 -6.986
10 HE2 PHE 155 HE2 PHE 155 8.142 -10.397 -7.098
11 HZ PHE 155 HZ PHE 155 5.887 -11.336 -6.783
12 H LEU 156 HN LEU 156 4.085 -5.538 -7.388
13 HA LEU 156 HA LEU 156 3.036 -3.020 -6.577
14 1HB LEU 156 HB2 LEU 156 2.511 -2.152 -8.781
15 2HB LEU 156 HB1 LEU 156 4.243 -2.344 -8.591
16 HG LEU 156 HG LEU 156 3.667 -4.705 -9.741
17 1HD1 LEU 156 HD11 LEU 156 1.858 -2.892 -11.266
18 2HD1 LEU 156 HD12 LEU 156 1.234 -3.783 -9.877
19 3HD1 LEU 156 HD13 LEU 156 1.931 -4.654 -11.244
20 1HD2 LEU 156 HD21 LEU 156 4.211 -3.499 -11.937
21 2HD2 LEU 156 HD22 LEU 156 5.385 -3.402 -10.626
22 3HD2 LEU 156 HD23 LEU 156 4.313 -2.039 -10.951
23 H GLN 157 HN GLN 157 0.922 -3.300 -6.144
24 HA GLN 157 HA GLN 157 -0.334 -5.789 -6.690
25 1HB GLN 157 HB2 GLN 157 -0.714 -3.935 -4.788
26 2HB GLN 157 HB1 GLN 157 -2.000 -3.467 -5.891
27 1HG GLN 157 HG2 GLN 157 -2.861 -5.779 -5.809
28 2HG GLN 157 HG1 GLN 157 -1.619 -6.167 -4.621
29 1HE2 GLN 157 HE21 GLN 157 -4.527 -6.249 -4.389
30 2HE2 GLN 157 HE22 GLN 157 -4.929 -5.219 -3.061
31 H SER 158 HN SER 158 -0.796 -2.513 -7.896
32 HA SER 158 HA SER 158 -1.587 -3.433 -10.470
33 1HB SER 158 HB2 SER 158 -3.694 -3.632 -8.931
34 2HB SER 158 HB1 SER 158 -3.746 -1.870 -9.083
35 HG SER 158 HG SER 158 -4.620 -2.171 -10.957
36 H ASP 159 HN ASP 159 0.477 -1.948 -9.834
37 HA ASP 159 HA ASP 159 1.521 -0.102 -10.738
38 1HB ASP 159 HB2 ASP 159 -0.864 0.166 -11.985
39 2HB ASP 159 HB1 ASP 159 -0.884 1.600 -10.961
40 H VAL 160 HN VAL 160 -0.832 0.013 -8.195
41 HA VAL 160 HA VAL 160 -0.802 1.015 -6.153
42 HB VAL 160 HB VAL 160 1.989 1.865 -6.944
43 1HG1 VAL 160 HG11 VAL 160 0.410 2.268 -4.444
44 2HG1 VAL 160 HG12 VAL 160 1.522 3.367 -5.262
45 3HG1 VAL 160 HG13 VAL 160 2.150 2.002 -4.337
46 1HG2 VAL 160 HG21 VAL 160 1.891 -0.498 -6.817
47 2HG2 VAL 160 HG22 VAL 160 0.914 -0.448 -5.349
48 3HG2 VAL 160 HG23 VAL 160 2.605 0.054 -5.301
49 H PHE 161 HN PHE 161 0.788 3.193 -8.485
50 HA PHE 161 HA PHE 161 -0.334 5.556 -7.364
51 1HB PHE 161 HB2 PHE 161 1.024 5.059 -10.019
52 2HB PHE 161 HB1 PHE 161 0.581 6.651 -9.411
53 HD1 PHE 161 HD1 PHE 161 2.818 3.778 -8.975
54 HD2 PHE 161 HD2 PHE 161 1.839 7.707 -7.666
55 HE1 PHE 161 HE1 PHE 161 4.966 3.911 -7.782
56 HE2 PHE 161 HE2 PHE 161 3.985 7.847 -6.471
57 HZ PHE 161 HZ PHE 161 5.553 5.949 -6.529
58 H PHE 162 HN PHE 162 -1.819 3.144 -8.908
59 HA PHE 162 HA PHE 162 -4.146 4.642 -9.521
60 1HB PHE 162 HB2 PHE 162 -2.273 4.081 -11.676
61 2HB PHE 162 HB1 PHE 162 -3.849 3.348 -11.965
62 HD1 PHE 162 HD1 PHE 162 -4.060 6.344 -9.998
63 HD2 PHE 162 HD2 PHE 162 -3.766 4.879 -13.987
64 HE1 PHE 162 HE1 PHE 162 -4.912 8.485 -10.846
65 HE2 PHE 162 HE2 PHE 162 -4.620 7.022 -14.837
66 HZ PHE 162 HZ PHE 162 -5.192 8.829 -13.267
67 H LEU 163 HN LEU 163 -2.899 2.167 -8.157
68 HA LEU 163 HA LEU 163 -4.192 -0.100 -9.257
69 1HB LEU 163 HB2 LEU 163 -2.576 -0.846 -7.851
70 2HB LEU 163 HB1 LEU 163 -2.666 0.577 -6.835
71 HG LEU 163 HG LEU 163 -4.785 -0.450 -5.835
72 1HD1 LEU 163 HD11 LEU 163 -5.104 -2.113 -7.657
73 2HD1 LEU 163 HD12 LEU 163 -5.082 -2.819 -6.040
74 3HD1 LEU 163 HD13 LEU 163 -3.664 -2.954 -7.080
75 1HD2 LEU 163 HD21 LEU 163 -2.009 -1.510 -5.477
76 2HD2 LEU 163 HD22 LEU 163 -3.345 -2.143 -4.514
77 3HD2 LEU 163 HD23 LEU 163 -2.935 -0.428 -4.437
78 H PHE 164 HN PHE 164 -5.206 2.601 -7.482
79 HA PHE 164 HA PHE 164 -7.118 3.176 -6.391
80 1HB PHE 164 HB2 PHE 164 -9.145 2.739 -7.620
81 2HB PHE 164 HB1 PHE 164 -7.839 3.003 -8.768
82 HD1 PHE 164 HD1 PHE 164 -10.271 0.627 -7.476
83 HD2 PHE 164 HD2 PHE 164 -6.953 1.146 -10.088
84 HE1 PHE 164 HE1 PHE 164 -10.837 -1.481 -8.609
85 HE2 PHE 164 HE2 PHE 164 -7.509 -0.963 -11.222
86 HZ PHE 164 HZ PHE 164 -9.455 -2.280 -10.484
87 H LEU 165 HN LEU 165 -5.974 1.587 -4.782
88 HA LEU 165 HA LEU 165 -8.061 0.228 -3.394
89 1HB LEU 165 HB2 LEU 165 -6.895 -1.302 -5.348
90 2HB LEU 165 HB1 LEU 165 -5.956 -1.734 -3.926
91 HG LEU 165 HG LEU 165 -8.336 -2.053 -2.839
92 1HD1 LEU 165 HD11 LEU 165 -8.929 -2.536 -5.753
93 2HD1 LEU 165 HD12 LEU 165 -9.545 -1.182 -4.805
94 3HD1 LEU 165 HD13 LEU 165 -10.008 -2.832 -4.390
95 1HD2 LEU 165 HD21 LEU 165 -7.095 -3.957 -2.817
96 2HD2 LEU 165 HD22 LEU 165 -6.687 -3.845 -4.529
97 3HD2 LEU 165 HD23 LEU 165 -8.279 -4.425 -4.038
98 H LEU 166 HN LEU 166 -4.783 1.242 -3.717
99 HA LEU 166 HA LEU 166 -4.477 1.255 -0.846
100 1HB LEU 166 HB2 LEU 166 -3.642 -0.965 -2.213
101 2HB LEU 166 HB1 LEU 166 -2.175 0.001 -2.162
102 HG LEU 166 HG LEU 166 -2.257 0.076 0.267
103 1HD1 LEU 166 HD11 LEU 166 -4.517 0.128 0.831
104 2HD1 LEU 166 HD12 LEU 166 -3.985 -1.463 1.375
105 3HD1 LEU 166 HD13 LEU 166 -4.888 -1.303 -0.131
106 1HD2 LEU 166 HD21 LEU 166 -2.576 -2.681 -0.906
107 2HD2 LEU 166 HD22 LEU 166 -1.988 -2.359 0.725
108 3HD2 LEU 166 HD23 LEU 166 -1.076 -1.783 -0.671
109 HA PRO 167 HA PRO 167 -2.634 4.961 -2.784
110 1HB PRO 167 HB2 PRO 167 -2.828 6.469 -0.496
111 2HB PRO 167 HB1 PRO 167 -4.088 6.340 -1.736
112 1HG PRO 167 HG2 PRO 167 -3.861 4.960 0.897
113 2HG PRO 167 HG1 PRO 167 -5.301 5.571 0.066
114 1HD PRO 167 HD2 PRO 167 -4.636 2.942 0.129
115 2HD PRO 167 HD1 PRO 167 -5.513 3.683 -1.224
116 HA PRO 168 HA PRO 168 0.924 4.777 0.292
117 1HB PRO 168 HB2 PRO 168 0.987 3.067 2.289
118 2HB PRO 168 HB1 PRO 168 -0.145 4.435 2.336
119 1HG PRO 168 HG2 PRO 168 -0.673 1.564 1.687
120 2HG PRO 168 HG1 PRO 168 -1.641 2.693 2.652
121 1HD PRO 168 HD2 PRO 168 -2.022 2.080 -0.052
122 2HD PRO 168 HD1 PRO 168 -2.734 3.447 0.818
123 H ILE 169 HN ILE 169 2.592 2.894 1.207
124 HA ILE 169 HA ILE 169 2.711 0.525 -0.364
125 HB ILE 169 HB ILE 169 3.329 2.424 -1.987
126 1HG1 ILE 169 HG12 ILE 169 5.365 0.219 -1.657
127 2HG1 ILE 169 HG11 ILE 169 3.741 -0.052 -2.279
128 1HG2 ILE 169 HG21 ILE 169 5.931 2.279 -0.482
129 2HG2 ILE 169 HG22 ILE 169 4.806 3.637 -0.447
130 3HG2 ILE 169 HG23 ILE 169 5.616 3.200 -1.951
131 1HD1 ILE 169 HD11 ILE 169 4.271 1.631 -4.069
132 2HD1 ILE 169 HD12 ILE 169 5.172 0.117 -4.143
133 3HD1 ILE 169 HD13 ILE 169 5.944 1.572 -3.513
134 H ILE 170 HN ILE 170 4.524 2.951 1.409
135 HA ILE 170 HA ILE 170 6.594 1.224 2.299
136 HB ILE 170 HB ILE 170 5.750 3.721 3.742
137 1HG1 ILE 170 HG12 ILE 170 7.734 4.483 1.961
138 2HG1 ILE 170 HG11 ILE 170 6.689 3.452 0.988
139 1HG2 ILE 170 HG21 ILE 170 7.554 3.220 4.937
140 2HG2 ILE 170 HG22 ILE 170 8.522 3.560 3.504
141 3HG2 ILE 170 HG23 ILE 170 7.992 1.912 3.838
142 1HD1 ILE 170 HD11 ILE 170 6.264 6.027 1.183
143 2HD1 ILE 170 HD12 ILE 170 5.440 5.559 2.670
144 3HD1 ILE 170 HD13 ILE 170 4.920 4.887 1.125
145 H LEU 171 HN LEU 171 3.610 2.431 3.822
146 HA LEU 171 HA LEU 171 4.023 1.137 6.302
147 1HB LEU 171 HB2 LEU 171 1.407 1.881 4.982
148 2HB LEU 171 HB1 LEU 171 1.628 1.502 6.679
149 HG LEU 171 HG LEU 171 3.402 3.560 6.338
150 1HD1 LEU 171 HD11 LEU 171 1.049 4.733 5.035
151 2HD1 LEU 171 HD12 LEU 171 2.013 3.666 4.013
152 3HD1 LEU 171 HD13 LEU 171 2.766 5.058 4.793
153 1HD2 LEU 171 HD21 LEU 171 0.639 3.291 7.386
154 2HD2 LEU 171 HD22 LEU 171 1.298 4.919 7.220
155 3HD2 LEU 171 HD23 LEU 171 2.132 3.727 8.219
156 H ASP 172 HN ASP 172 2.072 0.278 3.478
157 HA ASP 172 HA ASP 172 1.485 -2.354 4.436
158 1HB ASP 172 HB2 ASP 172 1.065 -1.021 1.756
159 2HB ASP 172 HB1 ASP 172 0.547 -2.673 2.118
160 H ALA 173 HN ALA 173 4.317 -1.097 3.382
161 HA ALA 173 HA ALA 173 5.167 -3.072 1.510
162 1HB ALA 173 HB1 ALA 173 6.208 -0.668 2.554
163 2HB ALA 173 HB2 ALA 173 6.863 -1.654 1.249
164 3HB ALA 173 HB3 ALA 173 7.386 -1.929 2.910
165 H GLY 174 HN GLY 174 6.162 -2.434 4.867
166 1HA GLY 174 HA2 GLY 174 6.853 -5.286 5.140
167 2HA GLY 174 HA1 GLY 174 7.460 -3.975 6.171
168 H TYR 175 HN TYR 175 4.638 -2.853 6.146
169 HA TYR 175 HA TYR 175 2.696 -2.974 7.312
170 1HB TYR 175 HB2 TYR 175 2.910 -5.508 6.505
171 2HB TYR 175 HB1 TYR 175 3.144 -5.778 8.229
172 HD1 TYR 175 HD1 TYR 175 1.354 -4.670 9.792
173 HD2 TYR 175 HD2 TYR 175 0.755 -5.451 5.652
174 HE1 TYR 175 HE1 TYR 175 -1.081 -4.595 10.134
175 HE2 TYR 175 HE2 TYR 175 -1.680 -5.379 5.984
176 HH TYR 175 HH TYR 175 -3.111 -5.357 9.105
177 H PHE 176 HN PHE 176 5.518 -4.496 8.816
178 HA PHE 176 HA PHE 176 4.630 -3.663 11.461
179 1HB PHE 176 HB2 PHE 176 6.032 -5.862 10.584
180 2HB PHE 176 HB1 PHE 176 7.320 -4.826 11.215
181 HD1 PHE 176 HD1 PHE 176 7.068 -3.949 13.592
182 HD2 PHE 176 HD2 PHE 176 4.718 -7.129 12.017
183 HE1 PHE 176 HE1 PHE 176 6.535 -4.685 15.880
184 HE2 PHE 176 HE2 PHE 176 4.180 -7.869 14.301
185 HZ PHE 176 HZ PHE 176 5.090 -6.647 16.235
186 H LEU 177 HN LEU 177 6.056 -2.168 8.953
187 HA LEU 177 HA LEU 177 8.229 -0.846 10.281
188 1HB LEU 177 HB2 LEU 177 8.756 -0.758 8.102
189 2HB LEU 177 HB1 LEU 177 7.091 -0.950 7.594
190 HG LEU 177 HG LEU 177 6.718 1.465 7.955
191 1HD1 LEU 177 HD11 LEU 177 8.864 1.399 9.580
192 2HD1 LEU 177 HD12 LEU 177 8.236 2.873 8.843
193 3HD1 LEU 177 HD13 LEU 177 9.603 2.035 8.110
194 1HD2 LEU 177 HD21 LEU 177 8.515 0.292 5.980
195 2HD2 LEU 177 HD22 LEU 177 8.737 2.030 6.182
196 3HD2 LEU 177 HD23 LEU 177 7.150 1.387 5.764
197 HA PRO 178 HA PRO 178 4.744 2.768 9.870
198 1HB PRO 178 HB2 PRO 178 2.699 0.872 10.963
199 2HB PRO 178 HB1 PRO 178 2.478 2.297 9.941
200 1HG PRO 178 HG2 PRO 178 2.409 -0.156 8.901
201 2HG PRO 178 HG1 PRO 178 3.152 1.193 8.024
202 1HD PRO 178 HD2 PRO 178 4.429 -1.107 9.384
203 2HD PRO 178 HD1 PRO 178 5.012 -0.140 8.017
204 H LEU 179 HN LEU 179 3.785 0.415 12.385
205 HA LEU 179 HA LEU 179 3.900 0.497 14.655
206 1HB LEU 179 HB2 LEU 179 6.409 1.779 13.755
207 2HB LEU 179 HB1 LEU 179 5.942 2.102 15.414
208 HG LEU 179 HG LEU 179 6.278 -0.661 14.247
209 1HD1 LEU 179 HD11 LEU 179 8.310 -0.671 15.758
210 2HD1 LEU 179 HD12 LEU 179 8.143 1.082 15.832
211 3HD1 LEU 179 HD13 LEU 179 8.434 0.290 14.284
212 1HD2 LEU 179 HD21 LEU 179 4.786 0.015 16.383
213 2HD2 LEU 179 HD22 LEU 179 6.363 -0.169 17.151
214 3HD2 LEU 179 HD23 LEU 179 5.662 -1.510 16.244
215 H ARG 180 HN ARG 180 1.922 1.916 13.924
216 HA ARG 180 HA ARG 180 0.497 3.577 14.567
217 1HB ARG 180 HB2 ARG 180 2.675 4.575 16.409
218 2HB ARG 180 HB1 ARG 180 0.935 4.863 16.539
219 1HG ARG 180 HG2 ARG 180 0.563 2.905 17.568
220 2HG ARG 180 HG1 ARG 180 1.723 2.035 16.562
221 1HD ARG 180 HD2 ARG 180 3.559 2.841 17.873
222 2HD ARG 180 HD1 ARG 180 2.499 3.917 18.783
223 HE ARG 180 HE ARG 180 2.900 1.103 19.213
224 1HH1 ARG 180 1HH1 ARG 180 0.717 3.787 19.672
225 2HH1 ARG 180 2HH1 ARG 180 -0.093 3.060 21.018
226 1HH2 ARG 180 1HH2 ARG 180 1.840 0.148 20.988
227 2HH2 ARG 180 2HH2 ARG 180 0.545 0.994 21.766
228 1HG HSL 181 HG1 HSL 181 3.584 7.353 9.510
229 2HG HSL 181 HG2 HSL 181 3.598 5.782 8.550
230 H HSL 181 HN HSL 181 1.835 3.861 12.243
231 HA HSL 181 HA HSL 181 2.534 6.844 12.147
232 1HB HSL 181 HB1 HSL 181 4.523 5.944 11.217
233 2HB HSL 181 HB2 HSL 181 3.653 4.449 10.574
Start of MODEL 85
1 1H PHE 155 HT1 PHE 155 7.615 9.018 -7.052
2 2H PHE 155 HT2 PHE 155 8.289 7.571 -6.422
3 3H PHE 155 HT3 PHE 155 6.826 8.193 -5.774
4 HA PHE 155 HA PHE 155 7.257 7.131 -8.481
5 1HB PHE 155 HB2 PHE 155 6.785 5.869 -6.035
6 2HB PHE 155 HB1 PHE 155 5.223 5.893 -6.842
7 HD1 PHE 155 HD1 PHE 155 4.815 3.795 -7.688
8 HD2 PHE 155 HD2 PHE 155 8.689 5.494 -8.146
9 HE1 PHE 155 HE1 PHE 155 5.495 1.865 -9.055
10 HE2 PHE 155 HE2 PHE 155 9.376 3.567 -9.515
11 HZ PHE 155 HZ PHE 155 7.778 1.750 -9.970
12 H LEU 156 HN LEU 156 4.589 6.337 -8.747
13 HA LEU 156 HA LEU 156 2.809 8.521 -8.319
14 1HB LEU 156 HB2 LEU 156 3.957 8.038 -11.058
15 2HB LEU 156 HB1 LEU 156 2.406 8.820 -10.825
16 HG LEU 156 HG LEU 156 5.101 9.830 -9.925
17 1HD1 LEU 156 HD11 LEU 156 4.181 11.801 -11.362
18 2HD1 LEU 156 HD12 LEU 156 3.173 10.545 -12.081
19 3HD1 LEU 156 HD13 LEU 156 4.931 10.408 -12.140
20 1HD2 LEU 156 HD21 LEU 156 3.935 11.757 -9.017
21 2HD2 LEU 156 HD22 LEU 156 3.389 10.284 -8.217
22 3HD2 LEU 156 HD23 LEU 156 2.381 11.043 -9.448
23 H GLN 157 HN GLN 157 1.374 7.081 -7.502
24 HA GLN 157 HA GLN 157 0.667 4.671 -8.913
25 1HB GLN 157 HB2 GLN 157 -1.268 4.899 -7.010
26 2HB GLN 157 HB1 GLN 157 0.289 4.129 -6.761
27 1HG GLN 157 HG2 GLN 157 1.175 6.189 -5.820
28 2HG GLN 157 HG1 GLN 157 -0.369 6.992 -6.103
29 1HE2 GLN 157 HE21 GLN 157 -2.203 5.259 -5.267
30 2HE2 GLN 157 HE22 GLN 157 -2.003 4.889 -3.592
31 H SER 158 HN SER 158 0.214 7.319 -10.177
32 HA SER 158 HA SER 158 -1.258 8.171 -11.650
33 1HB SER 158 HB2 SER 158 -2.960 6.863 -12.524
34 2HB SER 158 HB1 SER 158 -1.933 5.624 -11.783
35 HG SER 158 HG SER 158 -4.436 6.577 -11.004
36 H ASP 159 HN ASP 159 -1.042 9.356 -9.269
37 HA ASP 159 HA ASP 159 -3.555 10.705 -9.029
38 1HB ASP 159 HB2 ASP 159 -2.853 8.614 -7.112
39 2HB ASP 159 HB1 ASP 159 -3.151 10.169 -6.341
40 H VAL 160 HN VAL 160 -0.667 10.099 -7.052
41 HA VAL 160 HA VAL 160 1.114 11.458 -6.575
42 HB VAL 160 HB VAL 160 0.204 12.780 -8.755
43 1HG1 VAL 160 HG11 VAL 160 -1.250 14.183 -7.166
44 2HG1 VAL 160 HG12 VAL 160 -0.271 15.034 -8.359
45 3HG1 VAL 160 HG13 VAL 160 0.262 14.949 -6.680
46 1HG2 VAL 160 HG21 VAL 160 2.249 14.240 -7.210
47 2HG2 VAL 160 HG22 VAL 160 2.305 13.596 -8.851
48 3HG2 VAL 160 HG23 VAL 160 2.543 12.520 -7.473
49 H PHE 161 HN PHE 161 -2.147 12.714 -6.025
50 HA PHE 161 HA PHE 161 -1.487 14.372 -3.834
51 1HB PHE 161 HB2 PHE 161 -3.607 14.549 -5.103
52 2HB PHE 161 HB1 PHE 161 -4.120 13.003 -4.434
53 HD1 PHE 161 HD1 PHE 161 -3.545 16.543 -3.735
54 HD2 PHE 161 HD2 PHE 161 -4.822 12.814 -2.133
55 HE1 PHE 161 HE1 PHE 161 -4.503 17.711 -1.793
56 HE2 PHE 161 HE2 PHE 161 -5.784 13.974 -0.188
57 HZ PHE 161 HZ PHE 161 -5.625 16.426 -0.016
58 H PHE 162 HN PHE 162 -2.032 10.971 -4.167
59 HA PHE 162 HA PHE 162 -2.544 10.349 -1.442
60 1HB PHE 162 HB2 PHE 162 -2.763 8.987 -3.721
61 2HB PHE 162 HB1 PHE 162 -1.175 8.406 -3.219
62 HD1 PHE 162 HD1 PHE 162 -1.693 8.459 -0.223
63 HD2 PHE 162 HD2 PHE 162 -3.985 6.980 -3.490
64 HE1 PHE 162 HE1 PHE 162 -2.764 6.826 1.273
65 HE2 PHE 162 HE2 PHE 162 -5.061 5.345 -1.999
66 HZ PHE 162 HZ PHE 162 -4.451 5.267 0.386
67 H LEU 163 HN LEU 163 0.347 9.774 -3.437
68 HA LEU 163 HA LEU 163 2.069 9.221 -1.253
69 1HB LEU 163 HB2 LEU 163 2.398 8.532 -3.654
70 2HB LEU 163 HB1 LEU 163 2.823 10.196 -4.006
71 HG LEU 163 HG LEU 163 4.577 9.733 -2.033
72 1HD1 LEU 163 HD11 LEU 163 4.180 7.531 -1.474
73 2HD1 LEU 163 HD12 LEU 163 5.497 7.382 -2.637
74 3HD1 LEU 163 HD13 LEU 163 3.837 7.059 -3.139
75 1HD2 LEU 163 HD21 LEU 163 5.069 10.533 -4.308
76 2HD2 LEU 163 HD22 LEU 163 4.985 8.873 -4.894
77 3HD2 LEU 163 HD23 LEU 163 6.242 9.340 -3.749
78 H PHE 164 HN PHE 164 0.636 12.016 -2.225
79 HA PHE 164 HA PHE 164 2.735 13.896 -1.822
80 1HB PHE 164 HB2 PHE 164 0.037 13.841 -2.764
81 2HB PHE 164 HB1 PHE 164 0.178 15.101 -1.540
82 HD1 PHE 164 HD1 PHE 164 2.672 13.931 -4.040
83 HD2 PHE 164 HD2 PHE 164 0.161 17.098 -2.709
84 HE1 PHE 164 HE1 PHE 164 3.693 15.432 -5.701
85 HE2 PHE 164 HE2 PHE 164 1.176 18.606 -4.368
86 HZ PHE 164 HZ PHE 164 2.943 17.773 -5.866
87 H LEU 165 HN LEU 165 -0.285 13.270 -0.010
88 HA LEU 165 HA LEU 165 0.469 14.800 2.247
89 1HB LEU 165 HB2 LEU 165 -1.364 12.513 2.681
90 2HB LEU 165 HB1 LEU 165 -1.519 14.189 3.178
91 HG LEU 165 HG LEU 165 -2.157 13.026 0.469
92 1HD1 LEU 165 HD11 LEU 165 -4.343 13.276 0.998
93 2HD1 LEU 165 HD12 LEU 165 -4.051 14.676 2.029
94 3HD1 LEU 165 HD13 LEU 165 -3.716 13.054 2.631
95 1HD2 LEU 165 HD21 LEU 165 -1.069 15.511 0.842
96 2HD2 LEU 165 HD22 LEU 165 -2.798 15.842 0.921
97 3HD2 LEU 165 HD23 LEU 165 -2.116 15.045 -0.497
98 H LEU 166 HN LEU 166 0.412 11.302 1.692
99 HA LEU 166 HA LEU 166 2.736 10.904 3.324
100 1HB LEU 166 HB2 LEU 166 1.331 10.994 5.166
101 2HB LEU 166 HB1 LEU 166 -0.018 10.283 4.302
102 HG LEU 166 HG LEU 166 1.082 8.889 6.144
103 1HD1 LEU 166 HD11 LEU 166 0.255 7.035 5.176
104 2HD1 LEU 166 HD12 LEU 166 1.188 7.258 3.697
105 3HD1 LEU 166 HD13 LEU 166 -0.299 8.174 3.948
106 1HD2 LEU 166 HD21 LEU 166 3.145 7.958 5.876
107 2HD2 LEU 166 HD22 LEU 166 3.410 9.497 5.056
108 3HD2 LEU 166 HD23 LEU 166 3.081 8.041 4.116
109 HA PRO 167 HA PRO 167 2.976 7.785 0.097
110 1HB PRO 167 HB2 PRO 167 5.001 6.347 1.385
111 2HB PRO 167 HB1 PRO 167 5.238 7.661 0.218
112 1HG PRO 167 HG2 PRO 167 5.299 7.734 3.201
113 2HG PRO 167 HG1 PRO 167 6.295 8.621 2.033
114 1HD PRO 167 HD2 PRO 167 4.298 9.822 3.335
115 2HD PRO 167 HD1 PRO 167 4.637 10.201 1.634
116 HA PRO 168 HA PRO 168 0.382 4.872 2.375
117 1HB PRO 168 HB2 PRO 168 -0.668 3.640 0.210
118 2HB PRO 168 HB1 PRO 168 -1.230 5.223 0.781
119 1HG PRO 168 HG2 PRO 168 0.652 4.572 -1.455
120 2HG PRO 168 HG1 PRO 168 -0.660 5.762 -1.408
121 1HD PRO 168 HD2 PRO 168 1.954 6.427 -1.070
122 2HD PRO 168 HD1 PRO 168 0.623 7.320 -0.306
123 H ILE 169 HN ILE 169 3.159 4.332 0.543
124 HA ILE 169 HA ILE 169 3.013 1.491 0.378
125 HB ILE 169 HB ILE 169 4.435 2.589 -1.177
126 1HG1 ILE 169 HG12 ILE 169 6.734 1.616 0.266
127 2HG1 ILE 169 HG11 ILE 169 5.364 0.536 0.512
128 1HG2 ILE 169 HG21 ILE 169 6.623 3.614 0.158
129 2HG2 ILE 169 HG22 ILE 169 5.246 4.149 1.121
130 3HG2 ILE 169 HG23 ILE 169 5.323 4.536 -0.599
131 1HD1 ILE 169 HD11 ILE 169 5.084 0.411 -1.939
132 2HD1 ILE 169 HD12 ILE 169 6.635 -0.209 -1.374
133 3HD1 ILE 169 HD13 ILE 169 6.543 1.386 -2.120
134 H ILE 170 HN ILE 170 5.950 2.479 1.887
135 HA ILE 170 HA ILE 170 6.897 1.370 3.719
136 HB ILE 170 HB ILE 170 5.027 3.341 5.015
137 1HG1 ILE 170 HG12 ILE 170 7.467 4.607 4.523
138 2HG1 ILE 170 HG11 ILE 170 7.107 3.756 3.024
139 1HG2 ILE 170 HG21 ILE 170 7.021 3.664 6.511
140 2HG2 ILE 170 HG22 ILE 170 7.740 2.253 5.734
141 3HG2 ILE 170 HG23 ILE 170 6.232 2.092 6.636
142 1HD1 ILE 170 HD11 ILE 170 5.363 5.765 4.424
143 2HD1 ILE 170 HD12 ILE 170 4.886 4.842 3.000
144 3HD1 ILE 170 HD13 ILE 170 6.231 5.979 2.904
145 H LEU 171 HN LEU 171 3.539 1.999 4.622
146 HA LEU 171 HA LEU 171 3.409 -0.081 6.540
147 1HB LEU 171 HB2 LEU 171 0.984 0.326 6.537
148 2HB LEU 171 HB1 LEU 171 1.918 1.798 6.704
149 HG LEU 171 HG LEU 171 1.535 1.859 4.052
150 1HD1 LEU 171 HD11 LEU 171 0.096 0.315 3.362
151 2HD1 LEU 171 HD12 LEU 171 -1.147 1.164 4.279
152 3HD1 LEU 171 HD13 LEU 171 -0.270 -0.178 5.014
153 1HD2 LEU 171 HD21 LEU 171 -0.738 3.059 4.802
154 2HD2 LEU 171 HD22 LEU 171 0.857 3.765 5.058
155 3HD2 LEU 171 HD23 LEU 171 0.047 2.915 6.374
156 H ASP 172 HN ASP 172 2.101 0.148 3.246
157 HA ASP 172 HA ASP 172 1.093 -2.508 3.221
158 1HB ASP 172 HB2 ASP 172 0.735 -0.319 1.624
159 2HB ASP 172 HB1 ASP 172 1.792 -1.314 0.614
160 H ALA 173 HN ALA 173 4.222 -1.269 3.048
161 HA ALA 173 HA ALA 173 5.324 -3.243 1.294
162 1HB ALA 173 HB1 ALA 173 6.721 -1.468 1.231
163 2HB ALA 173 HB2 ALA 173 7.486 -2.307 2.582
164 3HB ALA 173 HB3 ALA 173 6.357 -0.987 2.888
165 H GLY 174 HN GLY 174 5.815 -2.602 4.778
166 1HA GLY 174 HA2 GLY 174 6.309 -5.500 5.111
167 2HA GLY 174 HA1 GLY 174 7.049 -4.238 6.113
168 H TYR 175 HN TYR 175 4.401 -2.794 6.153
169 HA TYR 175 HA TYR 175 2.452 -2.733 7.345
170 1HB TYR 175 HB2 TYR 175 2.500 -5.332 6.555
171 2HB TYR 175 HB1 TYR 175 2.538 -5.522 8.305
172 HD1 TYR 175 HD1 TYR 175 0.546 -4.493 5.432
173 HD2 TYR 175 HD2 TYR 175 0.654 -4.743 9.679
174 HE1 TYR 175 HE1 TYR 175 -1.887 -4.142 5.509
175 HE2 TYR 175 HE2 TYR 175 -1.778 -4.393 9.767
176 HH TYR 175 HH TYR 175 -3.598 -3.418 7.015
177 H PHE 176 HN PHE 176 5.446 -3.703 8.562
178 HA PHE 176 HA PHE 176 4.602 -3.017 11.293
179 1HB PHE 176 HB2 PHE 176 5.321 -5.445 10.896
180 2HB PHE 176 HB1 PHE 176 6.953 -4.801 10.658
181 HD1 PHE 176 HD1 PHE 176 4.270 -5.400 13.077
182 HD2 PHE 176 HD2 PHE 176 8.219 -3.918 12.508
183 HE1 PHE 176 HE1 PHE 176 4.628 -5.432 15.511
184 HE2 PHE 176 HE2 PHE 176 8.584 -3.949 14.942
185 HZ PHE 176 HZ PHE 176 6.788 -4.706 16.446
186 H LEU 177 HN LEU 177 6.115 -1.825 8.702
187 HA LEU 177 HA LEU 177 8.547 -0.847 9.845
188 1HB LEU 177 HB2 LEU 177 7.139 0.252 7.422
189 2HB LEU 177 HB1 LEU 177 8.844 0.356 7.813
190 HG LEU 177 HG LEU 177 7.404 -2.213 7.151
191 1HD1 LEU 177 HD11 LEU 177 8.070 -2.035 4.971
192 2HD1 LEU 177 HD12 LEU 177 9.405 -0.946 5.351
193 3HD1 LEU 177 HD13 LEU 177 7.748 -0.341 5.339
194 1HD2 LEU 177 HD21 LEU 177 9.214 -2.972 8.291
195 2HD2 LEU 177 HD22 LEU 177 10.159 -1.516 7.985
196 3HD2 LEU 177 HD23 LEU 177 9.981 -2.734 6.721
197 HA PRO 178 HA PRO 178 6.009 3.225 10.184
198 1HB PRO 178 HB2 PRO 178 3.188 2.542 10.128
199 2HB PRO 178 HB1 PRO 178 4.087 3.623 9.066
200 1HG PRO 178 HG2 PRO 178 3.043 1.229 8.262
201 2HG PRO 178 HG1 PRO 178 4.451 1.996 7.508
202 1HD PRO 178 HD2 PRO 178 4.344 -0.236 9.499
203 2HD PRO 178 HD1 PRO 178 5.405 -0.032 8.089
204 H LEU 179 HN LEU 179 3.224 1.449 11.442
205 HA LEU 179 HA LEU 179 2.399 1.312 13.555
206 1HB LEU 179 HB2 LEU 179 5.169 0.275 13.653
207 2HB LEU 179 HB1 LEU 179 4.409 0.605 15.200
208 HG LEU 179 HG LEU 179 2.986 -1.053 13.150
209 1HD1 LEU 179 HD11 LEU 179 5.466 -1.777 13.899
210 2HD1 LEU 179 HD12 LEU 179 4.171 -2.918 13.544
211 3HD1 LEU 179 HD13 LEU 179 4.524 -2.478 15.215
212 1HD2 LEU 179 HD21 LEU 179 2.202 -0.072 15.545
213 2HD2 LEU 179 HD22 LEU 179 2.854 -1.638 16.028
214 3HD2 LEU 179 HD23 LEU 179 1.569 -1.552 14.823
215 H ARG 180 HN ARG 180 2.727 3.861 12.936
216 HA ARG 180 HA ARG 180 2.766 5.938 13.890
217 1HB ARG 180 HB2 ARG 180 3.549 4.548 16.463
218 2HB ARG 180 HB1 ARG 180 2.873 6.173 16.295
219 1HG ARG 180 HG2 ARG 180 1.466 3.579 15.685
220 2HG ARG 180 HG1 ARG 180 1.191 4.624 17.080
221 1HD ARG 180 HD2 ARG 180 0.358 6.379 15.681
222 2HD ARG 180 HD1 ARG 180 0.817 5.501 14.222
223 HE ARG 180 HE ARG 180 -1.037 4.076 15.892
224 1HH1 ARG 180 1HH1 ARG 180 -0.715 6.445 13.351
225 2HH1 ARG 180 2HH1 ARG 180 -2.308 6.175 12.725
226 1HH2 ARG 180 1HH2 ARG 180 -3.132 3.718 15.071
227 2HH2 ARG 180 2HH2 ARG 180 -3.680 4.628 13.702
228 1HG HSL 181 HG1 HSL 181 9.595 5.828 12.139
229 2HG HSL 181 HG2 HSL 181 9.001 4.948 10.636
230 H HSL 181 HN HSL 181 4.891 5.123 12.418
231 HA HSL 181 HA HSL 181 7.307 6.294 13.899
232 1HB HSL 181 HB1 HSL 181 8.228 4.212 13.262
233 2HB HSL 181 HB2 HSL 181 7.093 4.045 11.816
Start of MODEL 86
1 1H PHE 155 HT1 PHE 155 -15.598 -2.923 -7.858
2 2H PHE 155 HT2 PHE 155 -14.307 -2.100 -8.635
3 3H PHE 155 HT3 PHE 155 -15.392 -1.237 -7.624
4 HA PHE 155 HA PHE 155 -13.524 -1.499 -6.357
5 1HB PHE 155 HB2 PHE 155 -15.401 -3.784 -5.704
6 2HB PHE 155 HB1 PHE 155 -14.281 -3.020 -4.582
7 HD1 PHE 155 HD1 PHE 155 -14.661 -0.177 -5.194
8 HD2 PHE 155 HD2 PHE 155 -17.506 -3.325 -4.868
9 HE1 PHE 155 HE1 PHE 155 -16.394 1.459 -4.580
10 HE2 PHE 155 HE2 PHE 155 -19.245 -1.695 -4.255
11 HZ PHE 155 HZ PHE 155 -18.689 0.699 -4.111
12 H LEU 156 HN LEU 156 -11.755 -2.738 -5.566
13 HA LEU 156 HA LEU 156 -9.964 -4.115 -5.828
14 1HB LEU 156 HB2 LEU 156 -12.268 -5.950 -6.403
15 2HB LEU 156 HB1 LEU 156 -10.616 -6.528 -6.519
16 HG LEU 156 HG LEU 156 -11.969 -5.433 -4.054
17 1HD1 LEU 156 HD11 LEU 156 -10.744 -8.108 -4.100
18 2HD1 LEU 156 HD12 LEU 156 -12.195 -7.913 -5.084
19 3HD1 LEU 156 HD13 LEU 156 -12.245 -7.555 -3.358
20 1HD2 LEU 156 HD21 LEU 156 -9.819 -6.149 -2.943
21 2HD2 LEU 156 HD22 LEU 156 -9.722 -4.698 -3.941
22 3HD2 LEU 156 HD23 LEU 156 -9.113 -6.234 -4.557
23 H GLN 157 HN GLN 157 -9.512 -2.608 -7.673
24 HA GLN 157 HA GLN 157 -9.934 -3.584 -10.341
25 1HB GLN 157 HB2 GLN 157 -9.715 -1.129 -9.557
26 2HB GLN 157 HB1 GLN 157 -7.982 -1.424 -9.605
27 1HG GLN 157 HG2 GLN 157 -8.859 -0.364 -11.649
28 2HG GLN 157 HG1 GLN 157 -8.069 -1.912 -11.948
29 1HE2 GLN 157 HE21 GLN 157 -9.329 -3.709 -12.496
30 2HE2 GLN 157 HE22 GLN 157 -10.939 -3.539 -13.099
31 H SER 158 HN SER 158 -8.305 -5.145 -8.298
32 HA SER 158 HA SER 158 -6.636 -6.662 -8.447
33 1HB SER 158 HB2 SER 158 -7.181 -6.359 -11.040
34 2HB SER 158 HB1 SER 158 -5.577 -5.607 -11.030
35 HG SER 158 HG SER 158 -6.127 -8.173 -9.951
36 H ASP 159 HN ASP 159 -6.297 -4.423 -7.001
37 HA ASP 159 HA ASP 159 -3.430 -4.180 -6.939
38 1HB ASP 159 HB2 ASP 159 -5.130 -1.722 -7.429
39 2HB ASP 159 HB1 ASP 159 -3.415 -1.706 -7.030
40 H VAL 160 HN VAL 160 -6.305 -2.430 -5.782
41 HA VAL 160 HA VAL 160 -7.234 -2.366 -3.685
42 HB VAL 160 HB VAL 160 -5.648 -4.540 -3.330
43 1HG1 VAL 160 HG11 VAL 160 -3.803 -2.986 -2.525
44 2HG1 VAL 160 HG12 VAL 160 -4.222 -4.334 -1.470
45 3HG1 VAL 160 HG13 VAL 160 -4.803 -2.712 -1.099
46 1HG2 VAL 160 HG21 VAL 160 -7.930 -3.847 -2.371
47 2HG2 VAL 160 HG22 VAL 160 -7.008 -3.284 -0.977
48 3HG2 VAL 160 HG23 VAL 160 -6.941 -4.981 -1.452
49 H PHE 161 HN PHE 161 -3.789 -1.597 -3.972
50 HA PHE 161 HA PHE 161 -3.782 0.374 -1.918
51 1HB PHE 161 HB2 PHE 161 -1.838 0.529 -4.177
52 2HB PHE 161 HB1 PHE 161 -1.567 0.733 -2.453
53 HD1 PHE 161 HD1 PHE 161 -1.814 -1.418 -1.004
54 HD2 PHE 161 HD2 PHE 161 -1.181 -1.418 -5.213
55 HE1 PHE 161 HE1 PHE 161 -0.960 -3.723 -0.875
56 HE2 PHE 161 HE2 PHE 161 -0.325 -3.721 -5.089
57 HZ PHE 161 HZ PHE 161 -0.214 -4.877 -2.917
58 H PHE 162 HN PHE 162 -4.387 0.421 -5.353
59 HA PHE 162 HA PHE 162 -4.319 3.230 -5.736
60 1HB PHE 162 HB2 PHE 162 -4.413 1.083 -7.348
61 2HB PHE 162 HB1 PHE 162 -6.101 1.587 -7.415
62 HD1 PHE 162 HD1 PHE 162 -6.142 4.391 -7.511
63 HD2 PHE 162 HD2 PHE 162 -3.245 1.769 -9.196
64 HE1 PHE 162 HE1 PHE 162 -5.561 6.108 -9.174
65 HE2 PHE 162 HE2 PHE 162 -2.657 3.483 -10.862
66 HZ PHE 162 HZ PHE 162 -3.815 5.656 -10.852
67 H LEU 163 HN LEU 163 -7.016 0.953 -5.408
68 HA LEU 163 HA LEU 163 -9.052 2.931 -5.318
69 1HB LEU 163 HB2 LEU 163 -9.206 0.381 -5.810
70 2HB LEU 163 HB1 LEU 163 -9.294 0.217 -4.066
71 HG LEU 163 HG LEU 163 -11.328 1.535 -3.998
72 1HD1 LEU 163 HD11 LEU 163 -12.404 2.143 -6.207
73 2HD1 LEU 163 HD12 LEU 163 -10.823 1.879 -6.941
74 3HD1 LEU 163 HD13 LEU 163 -11.027 3.127 -5.711
75 1HD2 LEU 163 HD21 LEU 163 -12.715 -0.131 -4.694
76 2HD2 LEU 163 HD22 LEU 163 -11.180 -0.996 -4.782
77 3HD2 LEU 163 HD23 LEU 163 -11.895 -0.320 -6.245
78 H PHE 164 HN PHE 164 -6.645 2.157 -3.255
79 HA PHE 164 HA PHE 164 -7.913 2.394 -0.717
80 1HB PHE 164 HB2 PHE 164 -5.506 1.487 -1.708
81 2HB PHE 164 HB1 PHE 164 -5.046 2.994 -0.921
82 HD1 PHE 164 HD1 PHE 164 -3.930 2.359 1.004
83 HD2 PHE 164 HD2 PHE 164 -7.649 0.524 0.057
84 HE1 PHE 164 HE1 PHE 164 -3.922 1.229 3.187
85 HE2 PHE 164 HE2 PHE 164 -7.650 -0.611 2.241
86 HZ PHE 164 HZ PHE 164 -5.784 -0.259 3.810
87 H LEU 165 HN LEU 165 -7.302 4.604 -3.135
88 HA LEU 165 HA LEU 165 -7.680 6.870 -3.161
89 1HB LEU 165 HB2 LEU 165 -8.473 6.300 -0.587
90 2HB LEU 165 HB1 LEU 165 -7.163 7.447 -0.345
91 HG LEU 165 HG LEU 165 -9.172 8.707 -0.409
92 1HD1 LEU 165 HD11 LEU 165 -8.149 9.002 -3.211
93 2HD1 LEU 165 HD12 LEU 165 -7.177 9.472 -1.817
94 3HD1 LEU 165 HD13 LEU 165 -8.735 10.245 -2.108
95 1HD2 LEU 165 HD21 LEU 165 -10.616 8.562 -2.535
96 2HD2 LEU 165 HD22 LEU 165 -10.784 7.298 -1.316
97 3HD2 LEU 165 HD23 LEU 165 -9.839 6.997 -2.776
98 H LEU 166 HN LEU 166 -5.058 5.299 -1.607
99 HA LEU 166 HA LEU 166 -3.167 7.096 -2.747
100 1HB LEU 166 HB2 LEU 166 -4.233 7.971 -0.387
101 2HB LEU 166 HB1 LEU 166 -2.820 7.091 0.174
102 HG LEU 166 HG LEU 166 -1.343 8.497 -1.110
103 1HD1 LEU 166 HD11 LEU 166 -2.538 8.897 -3.107
104 2HD1 LEU 166 HD12 LEU 166 -2.324 10.471 -2.344
105 3HD1 LEU 166 HD13 LEU 166 -3.879 9.647 -2.242
106 1HD2 LEU 166 HD21 LEU 166 -3.387 10.220 0.286
107 2HD2 LEU 166 HD22 LEU 166 -1.691 10.610 -0.001
108 3HD2 LEU 166 HD23 LEU 166 -2.121 9.298 1.097
109 HA PRO 167 HA PRO 167 -0.859 3.330 -2.274
110 1HB PRO 167 HB2 PRO 167 1.594 4.202 -2.979
111 2HB PRO 167 HB1 PRO 167 0.283 3.999 -4.157
112 1HG PRO 167 HG2 PRO 167 1.270 6.494 -2.827
113 2HG PRO 167 HG1 PRO 167 0.809 6.235 -4.518
114 1HD PRO 167 HD2 PRO 167 -0.831 7.406 -2.682
115 2HD PRO 167 HD1 PRO 167 -1.431 6.484 -4.075
116 HA PRO 168 HA PRO 168 0.623 4.199 1.946
117 1HB PRO 168 HB2 PRO 168 0.456 1.644 2.823
118 2HB PRO 168 HB1 PRO 168 -0.958 2.711 2.709
119 1HG PRO 168 HG2 PRO 168 -0.028 0.584 0.814
120 2HG PRO 168 HG1 PRO 168 -1.669 0.930 1.388
121 1HD PRO 168 HD2 PRO 168 -0.759 1.744 -1.030
122 2HD PRO 168 HD1 PRO 168 -1.955 2.664 -0.096
123 H ILE 169 HN ILE 169 1.825 2.110 -0.495
124 HA ILE 169 HA ILE 169 3.738 0.861 -0.755
125 HB ILE 169 HB ILE 169 4.366 2.858 -1.775
126 1HG1 ILE 169 HG12 ILE 169 6.565 2.248 0.193
127 2HG1 ILE 169 HG11 ILE 169 6.252 1.348 -1.287
128 1HG2 ILE 169 HG21 ILE 169 4.783 4.894 -0.854
129 2HG2 ILE 169 HG22 ILE 169 5.320 4.211 0.677
130 3HG2 ILE 169 HG23 ILE 169 3.604 4.248 0.282
131 1HD1 ILE 169 HD11 ILE 169 6.603 3.552 -2.504
132 2HD1 ILE 169 HD12 ILE 169 8.022 2.779 -1.798
133 3HD1 ILE 169 HD13 ILE 169 7.267 4.148 -0.983
134 H ILE 170 HN ILE 170 4.437 2.999 1.910
135 HA ILE 170 HA ILE 170 6.349 1.339 3.171
136 HB ILE 170 HB ILE 170 4.830 3.295 4.824
137 1HG1 ILE 170 HG12 ILE 170 6.621 4.974 3.687
138 2HG1 ILE 170 HG11 ILE 170 6.218 3.974 2.297
139 1HG2 ILE 170 HG21 ILE 170 7.376 3.882 5.240
140 2HG2 ILE 170 HG22 ILE 170 7.597 2.254 4.601
141 3HG2 ILE 170 HG23 ILE 170 6.591 2.512 6.026
142 1HD1 ILE 170 HD11 ILE 170 4.119 4.805 2.143
143 2HD1 ILE 170 HD12 ILE 170 4.863 6.175 2.968
144 3HD1 ILE 170 HD13 ILE 170 3.948 4.982 3.889
145 H LEU 171 HN LEU 171 2.925 2.017 3.911
146 HA LEU 171 HA LEU 171 2.786 0.284 6.143
147 1HB LEU 171 HB2 LEU 171 1.106 2.118 5.028
148 2HB LEU 171 HB1 LEU 171 0.331 0.621 4.542
149 HG LEU 171 HG LEU 171 -0.673 1.354 6.586
150 1HD1 LEU 171 HD11 LEU 171 -0.097 -1.097 6.248
151 2HD1 LEU 171 HD12 LEU 171 -0.452 -0.583 7.898
152 3HD1 LEU 171 HD13 LEU 171 1.219 -0.835 7.394
153 1HD2 LEU 171 HD21 LEU 171 1.469 2.685 7.205
154 2HD2 LEU 171 HD22 LEU 171 1.936 1.201 8.039
155 3HD2 LEU 171 HD23 LEU 171 0.449 2.036 8.490
156 H ASP 172 HN ASP 172 1.825 -0.109 2.760
157 HA ASP 172 HA ASP 172 1.225 -2.889 3.036
158 1HB ASP 172 HB2 ASP 172 1.200 -0.888 0.868
159 2HB ASP 172 HB1 ASP 172 1.554 -2.542 0.350
160 H ALA 173 HN ALA 173 4.112 -1.220 3.001
161 HA ALA 173 HA ALA 173 5.686 -2.971 1.395
162 1HB ALA 173 HB1 ALA 173 7.429 -1.791 3.189
163 2HB ALA 173 HB2 ALA 173 6.137 -0.607 3.011
164 3HB ALA 173 HB3 ALA 173 7.006 -1.182 1.590
165 H GLY 174 HN GLY 174 6.017 -2.335 4.864
166 1HA GLY 174 HA2 GLY 174 6.430 -5.233 5.285
167 2HA GLY 174 HA1 GLY 174 7.231 -3.966 6.234
168 H TYR 175 HN TYR 175 4.559 -2.465 6.100
169 HA TYR 175 HA TYR 175 2.643 -2.235 7.291
170 1HB TYR 175 HB2 TYR 175 2.212 -4.616 6.536
171 2HB TYR 175 HB1 TYR 175 2.876 -5.143 8.078
172 HD1 TYR 175 HD1 TYR 175 1.668 -4.724 10.162
173 HD2 TYR 175 HD2 TYR 175 0.035 -3.575 6.405
174 HE1 TYR 175 HE1 TYR 175 -0.539 -4.447 11.212
175 HE2 TYR 175 HE2 TYR 175 -2.176 -3.294 7.446
176 HH TYR 175 HH TYR 175 -2.826 -2.791 10.279
177 H PHE 176 HN PHE 176 5.091 -4.225 8.947
178 HA PHE 176 HA PHE 176 4.389 -2.990 11.489
179 1HB PHE 176 HB2 PHE 176 5.984 -4.609 12.461
180 2HB PHE 176 HB1 PHE 176 4.734 -5.399 11.490
181 HD1 PHE 176 HD1 PHE 176 5.292 -6.693 9.603
182 HD2 PHE 176 HD2 PHE 176 8.275 -4.340 11.521
183 HE1 PHE 176 HE1 PHE 176 7.032 -7.827 8.282
184 HE2 PHE 176 HE2 PHE 176 10.019 -5.469 10.204
185 HZ PHE 176 HZ PHE 176 9.398 -7.215 8.581
186 H LEU 177 HN LEU 177 6.570 -2.491 8.936
187 HA LEU 177 HA LEU 177 8.924 -1.702 10.099
188 1HB LEU 177 HB2 LEU 177 7.531 -0.249 7.851
189 2HB LEU 177 HB1 LEU 177 9.242 -0.185 8.224
190 HG LEU 177 HG LEU 177 8.010 -2.832 7.610
191 1HD1 LEU 177 HD11 LEU 177 8.187 -2.530 5.270
192 2HD1 LEU 177 HD12 LEU 177 8.951 -0.953 5.459
193 3HD1 LEU 177 HD13 LEU 177 7.251 -1.164 5.876
194 1HD2 LEU 177 HD21 LEU 177 10.624 -1.951 6.553
195 2HD2 LEU 177 HD22 LEU 177 10.143 -3.495 7.258
196 3HD2 LEU 177 HD23 LEU 177 10.501 -2.122 8.305
197 HA PRO 178 HA PRO 178 6.919 2.679 10.921
198 1HB PRO 178 HB2 PRO 178 4.097 1.946 11.364
199 2HB PRO 178 HB1 PRO 178 4.776 3.275 10.421
200 1HG PRO 178 HG2 PRO 178 3.628 1.166 9.236
201 2HG PRO 178 HG1 PRO 178 5.042 1.970 8.529
202 1HD PRO 178 HD2 PRO 178 4.901 -0.575 10.107
203 2HD PRO 178 HD1 PRO 178 5.832 -0.213 8.639
204 H LEU 179 HN LEU 179 5.739 -0.283 12.379
205 HA LEU 179 HA LEU 179 5.355 0.873 14.977
206 1HB LEU 179 HB2 LEU 179 5.276 -1.901 13.859
207 2HB LEU 179 HB1 LEU 179 5.311 -1.665 15.595
208 HG LEU 179 HG LEU 179 3.234 -0.418 15.518
209 1HD1 LEU 179 HD11 LEU 179 3.247 0.779 13.531
210 2HD1 LEU 179 HD12 LEU 179 2.007 -0.443 13.250
211 3HD1 LEU 179 HD13 LEU 179 3.616 -0.645 12.558
212 1HD2 LEU 179 HD21 LEU 179 2.503 -2.692 13.791
213 2HD2 LEU 179 HD22 LEU 179 1.920 -2.248 15.395
214 3HD2 LEU 179 HD23 LEU 179 3.464 -3.082 15.217
215 H ARG 180 HN ARG 180 8.073 0.030 13.253
216 HA ARG 180 HA ARG 180 9.717 0.184 15.634
217 1HB ARG 180 HB2 ARG 180 11.111 -1.794 14.594
218 2HB ARG 180 HB1 ARG 180 9.747 -2.121 15.667
219 1HG ARG 180 HG2 ARG 180 9.195 -1.956 12.757
220 2HG ARG 180 HG1 ARG 180 10.076 -3.367 13.348
221 1HD ARG 180 HD2 ARG 180 7.331 -2.418 14.131
222 2HD ARG 180 HD1 ARG 180 7.783 -3.949 13.386
223 HE ARG 180 HE ARG 180 7.870 -3.287 16.181
224 1HH1 ARG 180 1HH1 ARG 180 9.172 -5.357 13.690
225 2HH1 ARG 180 2HH1 ARG 180 9.634 -6.608 14.795
226 1HH2 ARG 180 1HH2 ARG 180 8.476 -4.933 17.636
227 2HH2 ARG 180 2HH2 ARG 180 9.239 -6.367 17.035
228 1HG HSL 181 HG1 HSL 181 10.288 5.812 11.946
229 2HG HSL 181 HG2 HSL 181 9.269 5.050 13.275
230 H HSL 181 HN HSL 181 9.600 2.245 14.272
231 HA HSL 181 HA HSL 181 11.884 2.221 12.233
232 1HB HSL 181 HB1 HSL 181 10.764 3.749 10.894
233 2HB HSL 181 HB2 HSL 181 9.243 3.175 11.772
Start of MODEL 87
1 1H PHE 155 HT1 PHE 155 -1.554 -7.158 -6.511
2 2H PHE 155 HT2 PHE 155 -2.819 -6.217 -5.832
3 3H PHE 155 HT3 PHE 155 -3.175 -7.707 -6.606
4 HA PHE 155 HA PHE 155 -1.657 -8.729 -4.896
5 1HB PHE 155 HB2 PHE 155 -1.826 -5.919 -4.080
6 2HB PHE 155 HB1 PHE 155 -2.168 -7.057 -2.783
7 HD1 PHE 155 HD1 PHE 155 -0.298 -6.965 -1.418
8 HD2 PHE 155 HD2 PHE 155 0.207 -7.380 -5.624
9 HE1 PHE 155 HE1 PHE 155 2.115 -7.317 -1.090
10 HE2 PHE 155 HE2 PHE 155 2.620 -7.735 -5.303
11 HZ PHE 155 HZ PHE 155 3.577 -7.704 -3.034
12 H LEU 156 HN LEU 156 -2.802 -9.028 -2.534
13 HA LEU 156 HA LEU 156 -5.630 -8.751 -2.527
14 1HB LEU 156 HB2 LEU 156 -6.265 -11.045 -2.774
15 2HB LEU 156 HB1 LEU 156 -5.333 -10.571 -4.179
16 HG LEU 156 HG LEU 156 -3.488 -11.644 -2.360
17 1HD1 LEU 156 HD11 LEU 156 -4.686 -13.034 -1.087
18 2HD1 LEU 156 HD12 LEU 156 -4.819 -14.027 -2.537
19 3HD1 LEU 156 HD13 LEU 156 -6.109 -12.900 -2.119
20 1HD2 LEU 156 HD21 LEU 156 -3.403 -11.726 -4.818
21 2HD2 LEU 156 HD22 LEU 156 -4.713 -12.906 -4.806
22 3HD2 LEU 156 HD23 LEU 156 -3.157 -13.310 -4.083
23 H GLN 157 HN GLN 157 -4.229 -7.829 -0.606
24 HA GLN 157 HA GLN 157 -4.946 -9.344 1.678
25 1HB GLN 157 HB2 GLN 157 -2.345 -9.242 2.421
26 2HB GLN 157 HB1 GLN 157 -3.110 -10.670 1.737
27 1HG GLN 157 HG2 GLN 157 -2.194 -10.258 -0.398
28 2HG GLN 157 HG1 GLN 157 -1.703 -8.625 0.047
29 1HE2 GLN 157 HE21 GLN 157 -0.288 -11.157 -0.893
30 2HE2 GLN 157 HE22 GLN 157 1.042 -11.310 0.199
31 H SER 158 HN SER 158 -2.873 -6.779 0.398
32 HA SER 158 HA SER 158 -2.912 -5.268 2.832
33 1HB SER 158 HB2 SER 158 -2.057 -3.426 1.162
34 2HB SER 158 HB1 SER 158 -1.015 -4.798 1.577
35 HG SER 158 HG SER 158 -2.695 -4.646 -0.710
36 H ASP 159 HN ASP 159 -5.454 -5.694 2.629
37 HA ASP 159 HA ASP 159 -7.473 -4.657 2.693
38 1HB ASP 159 HB2 ASP 159 -5.600 -2.455 2.568
39 2HB ASP 159 HB1 ASP 159 -7.087 -2.060 1.712
40 H VAL 160 HN VAL 160 -5.609 -3.661 -0.169
41 HA VAL 160 HA VAL 160 -6.015 -4.059 -2.384
42 HB VAL 160 HB VAL 160 -8.751 -4.969 -1.510
43 1HG1 VAL 160 HG11 VAL 160 -7.502 -4.635 -4.177
44 2HG1 VAL 160 HG12 VAL 160 -9.183 -4.434 -3.681
45 3HG1 VAL 160 HG13 VAL 160 -8.519 -6.052 -3.916
46 1HG2 VAL 160 HG21 VAL 160 -6.436 -6.269 -1.066
47 2HG2 VAL 160 HG22 VAL 160 -6.834 -6.870 -2.676
48 3HG2 VAL 160 HG23 VAL 160 -7.977 -7.079 -1.350
49 H PHE 161 HN PHE 161 -8.860 -2.732 -0.673
50 HA PHE 161 HA PHE 161 -9.499 -0.894 -2.746
51 1HB PHE 161 HB2 PHE 161 -11.340 -0.480 -1.509
52 2HB PHE 161 HB1 PHE 161 -10.785 -1.796 -0.484
53 HD1 PHE 161 HD1 PHE 161 -11.536 1.693 -0.684
54 HD2 PHE 161 HD2 PHE 161 -9.377 -1.222 1.543
55 HE1 PHE 161 HE1 PHE 161 -11.418 3.243 1.224
56 HE2 PHE 161 HE2 PHE 161 -9.255 0.323 3.453
57 HZ PHE 161 HZ PHE 161 -10.276 2.558 3.296
58 H PHE 162 HN PHE 162 -7.267 -0.905 -0.140
59 HA PHE 162 HA PHE 162 -6.855 1.899 0.112
60 1HB PHE 162 HB2 PHE 162 -6.057 -0.401 1.413
61 2HB PHE 162 HB1 PHE 162 -4.565 0.234 0.725
62 HD1 PHE 162 HD1 PHE 162 -3.764 2.473 1.367
63 HD2 PHE 162 HD2 PHE 162 -7.159 0.697 3.218
64 HE1 PHE 162 HE1 PHE 162 -3.611 4.104 3.204
65 HE2 PHE 162 HE2 PHE 162 -7.012 2.323 5.058
66 HZ PHE 162 HZ PHE 162 -5.237 4.031 5.052
67 H LEU 163 HN LEU 163 -5.061 -0.705 -1.512
68 HA LEU 163 HA LEU 163 -3.138 0.965 -2.763
69 1HB LEU 163 HB2 LEU 163 -3.433 -1.714 -2.456
70 2HB LEU 163 HB1 LEU 163 -3.932 -1.532 -4.128
71 HG LEU 163 HG LEU 163 -1.375 -0.319 -3.190
72 1HD1 LEU 163 HD11 LEU 163 -0.502 -2.610 -4.280
73 2HD1 LEU 163 HD12 LEU 163 -1.980 -3.187 -3.509
74 3HD1 LEU 163 HD13 LEU 163 -0.736 -2.389 -2.547
75 1HD2 LEU 163 HD21 LEU 163 -0.761 -0.827 -5.570
76 2HD2 LEU 163 HD22 LEU 163 -2.058 0.351 -5.359
77 3HD2 LEU 163 HD23 LEU 163 -2.439 -1.308 -5.823
78 H PHE 164 HN PHE 164 -6.361 0.693 -3.138
79 HA PHE 164 HA PHE 164 -6.674 0.958 -5.955
80 1HB PHE 164 HB2 PHE 164 -8.246 0.208 -3.856
81 2HB PHE 164 HB1 PHE 164 -8.820 1.850 -4.134
82 HD1 PHE 164 HD1 PHE 164 -10.023 -1.102 -4.623
83 HD2 PHE 164 HD2 PHE 164 -8.528 2.030 -7.085
84 HE1 PHE 164 HE1 PHE 164 -11.423 -1.900 -6.480
85 HE2 PHE 164 HE2 PHE 164 -9.925 1.237 -8.948
86 HZ PHE 164 HZ PHE 164 -11.376 -0.729 -8.646
87 H LEU 165 HN LEU 165 -7.475 3.166 -3.264
88 HA LEU 165 HA LEU 165 -7.696 5.458 -4.915
89 1HB LEU 165 HB2 LEU 165 -6.933 5.834 -2.074
90 2HB LEU 165 HB1 LEU 165 -8.183 6.629 -3.016
91 HG LEU 165 HG LEU 165 -9.218 4.120 -2.835
92 1HD1 LEU 165 HD11 LEU 165 -7.269 3.540 -1.323
93 2HD1 LEU 165 HD12 LEU 165 -8.881 3.202 -0.692
94 3HD1 LEU 165 HD13 LEU 165 -7.995 4.623 -0.135
95 1HD2 LEU 165 HD21 LEU 165 -10.874 5.129 -1.660
96 2HD2 LEU 165 HD22 LEU 165 -10.001 6.578 -2.159
97 3HD2 LEU 165 HD23 LEU 165 -9.756 5.916 -0.543
98 H LEU 166 HN LEU 166 -5.146 4.251 -2.795
99 HA LEU 166 HA LEU 166 -3.114 5.511 -4.384
100 1HB LEU 166 HB2 LEU 166 -3.568 7.452 -3.199
101 2HB LEU 166 HB1 LEU 166 -3.977 6.585 -1.732
102 HG LEU 166 HG LEU 166 -1.835 7.970 -1.723
103 1HD1 LEU 166 HD11 LEU 166 -1.094 5.195 -1.025
104 2HD1 LEU 166 HD12 LEU 166 -2.553 5.848 -0.281
105 3HD1 LEU 166 HD13 LEU 166 -1.010 6.672 -0.066
106 1HD2 LEU 166 HD21 LEU 166 -1.221 6.880 -4.035
107 2HD2 LEU 166 HD22 LEU 166 -0.496 5.645 -3.006
108 3HD2 LEU 166 HD23 LEU 166 0.029 7.324 -2.874
109 HA PRO 167 HA PRO 167 -1.304 1.673 -2.942
110 1HB PRO 167 HB2 PRO 167 1.284 2.332 -3.729
111 2HB PRO 167 HB1 PRO 167 0.065 1.537 -4.742
112 1HG PRO 167 HG2 PRO 167 0.847 4.419 -4.614
113 2HG PRO 167 HG1 PRO 167 0.423 3.430 -6.024
114 1HD PRO 167 HD2 PRO 167 -1.314 5.175 -4.987
115 2HD PRO 167 HD1 PRO 167 -1.859 3.604 -5.612
116 HA PRO 168 HA PRO 168 0.353 3.325 0.915
117 1HB PRO 168 HB2 PRO 168 -0.127 1.171 2.429
118 2HB PRO 168 HB1 PRO 168 -1.452 2.220 1.883
119 1HG PRO 168 HG2 PRO 168 -0.571 -0.434 0.825
120 2HG PRO 168 HG1 PRO 168 -2.212 0.201 1.044
121 1HD PRO 168 HD2 PRO 168 -0.815 0.169 -1.354
122 2HD PRO 168 HD1 PRO 168 -2.201 1.217 -0.997
123 H ILE 169 HN ILE 169 2.504 3.402 0.189
124 HA ILE 169 HA ILE 169 4.136 1.113 -0.175
125 HB ILE 169 HB ILE 169 4.480 3.549 -0.996
126 1HG1 ILE 169 HG12 ILE 169 7.072 3.130 -0.786
127 2HG1 ILE 169 HG11 ILE 169 6.556 1.584 -0.122
128 1HG2 ILE 169 HG21 ILE 169 5.935 4.931 0.327
129 2HG2 ILE 169 HG22 ILE 169 5.998 3.710 1.597
130 3HG2 ILE 169 HG23 ILE 169 4.486 4.552 1.258
131 1HD1 ILE 169 HD11 ILE 169 6.504 2.565 -2.874
132 2HD1 ILE 169 HD12 ILE 169 5.038 1.731 -2.363
133 3HD1 ILE 169 HD13 ILE 169 6.600 0.918 -2.252
134 H ILE 170 HN ILE 170 3.610 3.290 2.523
135 HA ILE 170 HA ILE 170 5.595 2.175 4.228
136 HB ILE 170 HB ILE 170 3.153 3.710 5.110
137 1HG1 ILE 170 HG12 ILE 170 5.451 5.387 4.921
138 2HG1 ILE 170 HG11 ILE 170 5.250 4.573 3.373
139 1HG2 ILE 170 HG21 ILE 170 4.556 2.572 6.833
140 2HG2 ILE 170 HG22 ILE 170 4.457 4.323 7.014
141 3HG2 ILE 170 HG23 ILE 170 5.905 3.589 6.326
142 1HD1 ILE 170 HD11 ILE 170 3.367 6.418 4.782
143 2HD1 ILE 170 HD12 ILE 170 2.808 5.321 3.520
144 3HD1 ILE 170 HD13 ILE 170 4.033 6.536 3.154
145 H LEU 171 HN LEU 171 2.055 1.823 4.052
146 HA LEU 171 HA LEU 171 1.863 -0.038 6.180
147 1HB LEU 171 HB2 LEU 171 0.047 1.361 4.791
148 2HB LEU 171 HB1 LEU 171 -0.076 -0.160 3.927
149 HG LEU 171 HG LEU 171 -0.244 -0.200 6.902
150 1HD1 LEU 171 HD11 LEU 171 -2.605 0.271 6.864
151 2HD1 LEU 171 HD12 LEU 171 -2.565 0.513 5.118
152 3HD1 LEU 171 HD13 LEU 171 -1.726 1.640 6.186
153 1HD2 LEU 171 HD21 LEU 171 -1.865 -1.741 4.906
154 2HD2 LEU 171 HD22 LEU 171 -1.463 -2.161 6.572
155 3HD2 LEU 171 HD23 LEU 171 -0.220 -2.222 5.322
156 H ASP 172 HN ASP 172 1.915 -0.405 2.669
157 HA ASP 172 HA ASP 172 2.066 -3.259 2.747
158 1HB ASP 172 HB2 ASP 172 1.088 -1.885 0.853
159 2HB ASP 172 HB1 ASP 172 2.751 -1.478 0.404
160 H ALA 173 HN ALA 173 4.315 -0.914 3.479
161 HA ALA 173 HA ALA 173 6.624 -2.029 2.227
162 1HB ALA 173 HB1 ALA 173 6.056 0.166 4.055
163 2HB ALA 173 HB2 ALA 173 7.301 0.021 2.816
164 3HB ALA 173 HB3 ALA 173 7.570 -0.661 4.420
165 H GLY 174 HN GLY 174 5.846 -1.754 5.665
166 1HA GLY 174 HA2 GLY 174 6.892 -4.495 6.072
167 2HA GLY 174 HA1 GLY 174 7.211 -3.168 7.209
168 H TYR 175 HN TYR 175 4.387 -2.209 6.599
169 HA TYR 175 HA TYR 175 2.271 -2.436 7.308
170 1HB TYR 175 HB2 TYR 175 2.345 -4.760 6.472
171 2HB TYR 175 HB1 TYR 175 2.986 -5.288 8.024
172 HD1 TYR 175 HD1 TYR 175 1.294 -6.709 8.804
173 HD2 TYR 175 HD2 TYR 175 0.279 -2.814 7.425
174 HE1 TYR 175 HE1 TYR 175 -0.992 -7.010 9.656
175 HE2 TYR 175 HE2 TYR 175 -2.012 -3.105 8.273
176 HH TYR 175 HH TYR 175 -3.260 -6.094 9.206
177 H PHE 176 HN PHE 176 4.851 -3.534 9.426
178 HA PHE 176 HA PHE 176 3.260 -2.937 11.793
179 1HB PHE 176 HB2 PHE 176 5.020 -4.888 11.461
180 2HB PHE 176 HB1 PHE 176 6.171 -3.626 11.926
181 HD1 PHE 176 HD1 PHE 176 4.492 -6.293 13.176
182 HD2 PHE 176 HD2 PHE 176 5.084 -2.165 14.023
183 HE1 PHE 176 HE1 PHE 176 3.977 -6.710 15.546
184 HE2 PHE 176 HE2 PHE 176 4.570 -2.574 16.395
185 HZ PHE 176 HZ PHE 176 4.017 -4.849 17.159
186 H LEU 177 HN LEU 177 3.229 -0.702 10.671
187 HA LEU 177 HA LEU 177 3.908 1.458 10.505
188 1HB LEU 177 HB2 LEU 177 4.797 0.801 13.314
189 2HB LEU 177 HB1 LEU 177 4.622 2.428 12.682
190 HG LEU 177 HG LEU 177 2.213 0.779 12.388
191 1HD1 LEU 177 HD11 LEU 177 3.274 0.046 14.601
192 2HD1 LEU 177 HD12 LEU 177 1.600 0.600 14.630
193 3HD1 LEU 177 HD13 LEU 177 2.891 1.672 15.168
194 1HD2 LEU 177 HD21 LEU 177 2.348 3.358 13.864
195 2HD2 LEU 177 HD22 LEU 177 1.136 2.767 12.728
196 3HD2 LEU 177 HD23 LEU 177 2.688 3.360 12.134
197 HA PRO 178 HA PRO 178 8.406 0.275 9.794
198 1HB PRO 178 HB2 PRO 178 7.671 0.367 6.953
199 2HB PRO 178 HB1 PRO 178 8.461 -0.926 7.861
200 1HG PRO 178 HG2 PRO 178 5.953 -1.154 6.957
201 2HG PRO 178 HG1 PRO 178 6.444 -1.864 8.502
202 1HD PRO 178 HD2 PRO 178 5.009 0.717 7.963
203 2HD PRO 178 HD1 PRO 178 4.625 -0.556 9.142
204 H LEU 179 HN LEU 179 10.016 1.550 8.696
205 HA LEU 179 HA LEU 179 9.741 3.739 7.113
206 1HB LEU 179 HB2 LEU 179 8.725 4.284 9.766
207 2HB LEU 179 HB1 LEU 179 10.083 5.332 9.401
208 HG LEU 179 HG LEU 179 7.666 5.043 7.618
209 1HD1 LEU 179 HD11 LEU 179 8.283 7.216 9.612
210 2HD1 LEU 179 HD12 LEU 179 7.056 5.966 9.812
211 3HD1 LEU 179 HD13 LEU 179 6.903 7.154 8.517
212 1HD2 LEU 179 HD21 LEU 179 10.096 5.948 6.922
213 2HD2 LEU 179 HD22 LEU 179 9.400 7.432 7.574
214 3HD2 LEU 179 HD23 LEU 179 8.594 6.586 6.253
215 H ARG 180 HN ARG 180 11.238 2.409 9.937
216 HA ARG 180 HA ARG 180 13.879 2.868 8.817
217 1HB ARG 180 HB2 ARG 180 14.648 3.544 11.197
218 2HB ARG 180 HB1 ARG 180 13.879 4.775 10.187
219 1HG ARG 180 HG2 ARG 180 12.040 3.239 11.884
220 2HG ARG 180 HG1 ARG 180 13.205 4.240 12.754
221 1HD ARG 180 HD2 ARG 180 12.329 6.190 11.961
222 2HD ARG 180 HD1 ARG 180 11.799 5.461 10.445
223 HE ARG 180 HE ARG 180 9.787 4.949 11.423
224 1HH1 ARG 180 1HH1 ARG 180 12.059 5.888 13.902
225 2HH1 ARG 180 2HH1 ARG 180 10.862 5.953 15.149
226 1HH2 ARG 180 1HH2 ARG 180 8.213 5.035 13.064
227 2HH2 ARG 180 2HH2 ARG 180 8.679 5.467 14.675
228 1HG HSL 181 HG1 HSL 181 11.960 -3.635 10.893
229 2HG HSL 181 HG2 HSL 181 10.579 -3.397 9.700
230 H HSL 181 HN HSL 181 12.124 0.702 8.991
231 HA HSL 181 HA HSL 181 13.532 -1.151 10.975
232 1HB HSL 181 HB1 HSL 181 11.285 -1.469 11.657
233 2HB HSL 181 HB2 HSL 181 10.619 -0.994 9.999
Start of MODEL 88
1 1H PHE 155 HT1 PHE 155 8.730 16.259 -2.682
2 2H PHE 155 HT2 PHE 155 8.988 16.644 -4.334
3 3H PHE 155 HT3 PHE 155 10.101 15.638 -3.502
4 HA PHE 155 HA PHE 155 8.873 14.200 -4.755
5 1HB PHE 155 HB2 PHE 155 8.825 14.163 -1.998
6 2HB PHE 155 HB1 PHE 155 7.144 13.878 -2.426
7 HD1 PHE 155 HD1 PHE 155 10.486 12.771 -3.672
8 HD2 PHE 155 HD2 PHE 155 6.548 11.672 -2.491
9 HE1 PHE 155 HE1 PHE 155 11.015 10.410 -4.121
10 HE2 PHE 155 HE2 PHE 155 7.070 9.308 -2.938
11 HZ PHE 155 HZ PHE 155 9.306 8.675 -3.755
12 H LEU 156 HN LEU 156 6.924 13.510 -5.724
13 HA LEU 156 HA LEU 156 4.451 14.821 -5.260
14 1HB LEU 156 HB2 LEU 156 4.234 16.020 -7.329
15 2HB LEU 156 HB1 LEU 156 5.656 16.583 -6.476
16 HG LEU 156 HG LEU 156 6.793 14.731 -8.068
17 1HD1 LEU 156 HD11 LEU 156 4.680 15.930 -9.826
18 2HD1 LEU 156 HD12 LEU 156 4.495 14.340 -9.085
19 3HD1 LEU 156 HD13 LEU 156 5.826 14.645 -10.202
20 1HD2 LEU 156 HD21 LEU 156 7.023 17.363 -7.739
21 2HD2 LEU 156 HD22 LEU 156 6.290 17.354 -9.342
22 3HD2 LEU 156 HD23 LEU 156 7.806 16.500 -9.061
23 H GLN 157 HN GLN 157 6.407 12.949 -7.543
24 HA GLN 157 HA GLN 157 6.007 10.943 -8.547
25 1HB GLN 157 HB2 GLN 157 3.295 10.878 -7.237
26 2HB GLN 157 HB1 GLN 157 4.247 9.522 -7.826
27 1HG GLN 157 HG2 GLN 157 5.415 11.207 -5.682
28 2HG GLN 157 HG1 GLN 157 4.090 10.124 -5.261
29 1HE2 GLN 157 HE21 GLN 157 7.402 10.398 -5.782
30 2HE2 GLN 157 HE22 GLN 157 7.802 8.717 -5.757
31 H SER 158 HN SER 158 5.890 12.650 -10.305
32 HA SER 158 HA SER 158 5.088 13.152 -12.368
33 1HB SER 158 HB2 SER 158 4.028 10.720 -11.995
34 2HB SER 158 HB1 SER 158 2.532 11.670 -12.012
35 HG SER 158 HG SER 158 4.537 11.622 -14.026
36 H ASP 159 HN ASP 159 2.260 12.868 -10.230
37 HA ASP 159 HA ASP 159 1.872 15.718 -10.234
38 1HB ASP 159 HB2 ASP 159 -0.012 13.920 -11.753
39 2HB ASP 159 HB1 ASP 159 -0.488 15.511 -11.167
40 H VAL 160 HN VAL 160 1.910 13.083 -8.498
41 HA VAL 160 HA VAL 160 1.228 12.725 -6.350
42 HB VAL 160 HB VAL 160 0.387 15.331 -6.669
43 1HG1 VAL 160 HG11 VAL 160 -1.890 14.585 -7.250
44 2HG1 VAL 160 HG12 VAL 160 -1.847 15.507 -5.748
45 3HG1 VAL 160 HG13 VAL 160 -1.994 13.750 -5.701
46 1HG2 VAL 160 HG21 VAL 160 0.452 13.416 -4.383
47 2HG2 VAL 160 HG22 VAL 160 -0.174 15.046 -4.137
48 3HG2 VAL 160 HG23 VAL 160 1.477 14.812 -4.712
49 H PHE 161 HN PHE 161 -1.427 13.261 -8.670
50 HA PHE 161 HA PHE 161 -3.235 11.474 -7.452
51 1HB PHE 161 HB2 PHE 161 -3.124 12.177 -10.388
52 2HB PHE 161 HB1 PHE 161 -4.527 11.637 -9.473
53 HD1 PHE 161 HD1 PHE 161 -2.391 14.449 -10.318
54 HD2 PHE 161 HD2 PHE 161 -5.624 13.138 -7.881
55 HE1 PHE 161 HE1 PHE 161 -2.970 16.791 -9.834
56 HE2 PHE 161 HE2 PHE 161 -6.209 15.477 -7.393
57 HZ PHE 161 HZ PHE 161 -4.882 17.307 -8.370
58 H PHE 162 HN PHE 162 -0.512 10.994 -9.504
59 HA PHE 162 HA PHE 162 -1.154 8.432 -10.535
60 1HB PHE 162 HB2 PHE 162 1.122 10.243 -10.448
61 2HB PHE 162 HB1 PHE 162 1.594 8.544 -10.403
62 HD1 PHE 162 HD1 PHE 162 0.535 7.013 -12.201
63 HD2 PHE 162 HD2 PHE 162 0.668 11.257 -12.477
64 HE1 PHE 162 HE1 PHE 162 0.213 6.861 -14.637
65 HE2 PHE 162 HE2 PHE 162 0.349 11.113 -14.913
66 HZ PHE 162 HZ PHE 162 0.119 8.913 -15.995
67 H LEU 163 HN LEU 163 1.131 9.388 -7.985
68 HA LEU 163 HA LEU 163 1.588 6.798 -6.961
69 1HB LEU 163 HB2 LEU 163 3.120 8.553 -6.499
70 2HB LEU 163 HB1 LEU 163 1.864 9.542 -5.779
71 HG LEU 163 HG LEU 163 3.514 8.397 -4.255
72 1HD1 LEU 163 HD11 LEU 163 0.855 9.094 -3.920
73 2HD1 LEU 163 HD12 LEU 163 2.067 8.883 -2.657
74 3HD1 LEU 163 HD13 LEU 163 1.031 7.532 -3.118
75 1HD2 LEU 163 HD21 LEU 163 3.727 6.212 -4.907
76 2HD2 LEU 163 HD22 LEU 163 2.003 6.032 -5.222
77 3HD2 LEU 163 HD23 LEU 163 2.596 6.067 -3.564
78 H PHE 164 HN PHE 164 -0.978 8.934 -6.777
79 HA PHE 164 HA PHE 164 -2.098 8.318 -4.274
80 1HB PHE 164 HB2 PHE 164 -2.577 10.063 -6.397
81 2HB PHE 164 HB1 PHE 164 -4.027 9.069 -6.309
82 HD1 PHE 164 HD1 PHE 164 -2.360 11.892 -4.990
83 HD2 PHE 164 HD2 PHE 164 -5.105 8.806 -3.966
84 HE1 PHE 164 HE1 PHE 164 -3.181 13.252 -3.111
85 HE2 PHE 164 HE2 PHE 164 -5.932 10.161 -2.085
86 HZ PHE 164 HZ PHE 164 -4.969 12.386 -1.656
87 H LEU 165 HN LEU 165 -1.865 6.494 -7.128
88 HA LEU 165 HA LEU 165 -4.310 5.076 -7.093
89 1HB LEU 165 HB2 LEU 165 -2.091 5.105 -8.704
90 2HB LEU 165 HB1 LEU 165 -1.931 3.551 -7.893
91 HG LEU 165 HG LEU 165 -4.086 2.837 -8.726
92 1HD1 LEU 165 HD11 LEU 165 -4.307 5.682 -9.627
93 2HD1 LEU 165 HD12 LEU 165 -5.468 4.699 -8.735
94 3HD1 LEU 165 HD13 LEU 165 -5.199 4.405 -10.453
95 1HD2 LEU 165 HD21 LEU 165 -1.880 3.017 -10.209
96 2HD2 LEU 165 HD22 LEU 165 -2.942 4.037 -11.181
97 3HD2 LEU 165 HD23 LEU 165 -3.396 2.368 -10.838
98 H LEU 166 HN LEU 166 -1.312 4.774 -5.358
99 HA LEU 166 HA LEU 166 -2.493 3.011 -3.424
100 1HB LEU 166 HB2 LEU 166 -1.978 1.230 -4.762
101 2HB LEU 166 HB1 LEU 166 -0.654 2.062 -5.554
102 HG LEU 166 HG LEU 166 -0.137 1.420 -2.728
103 1HD1 LEU 166 HD11 LEU 166 -0.649 -0.766 -4.732
104 2HD1 LEU 166 HD12 LEU 166 -1.396 -0.552 -3.149
105 3HD1 LEU 166 HD13 LEU 166 0.309 -0.989 -3.268
106 1HD2 LEU 166 HD21 LEU 166 1.376 2.171 -4.798
107 2HD2 LEU 166 HD22 LEU 166 1.533 0.422 -4.957
108 3HD2 LEU 166 HD23 LEU 166 2.000 1.216 -3.454
109 HA PRO 167 HA PRO 167 0.723 5.968 -1.906
110 1HB PRO 167 HB2 PRO 167 -0.704 6.805 0.256
111 2HB PRO 167 HB1 PRO 167 -0.795 7.553 -1.349
112 1HG PRO 167 HG2 PRO 167 -2.658 5.629 -0.039
113 2HG PRO 167 HG1 PRO 167 -3.018 6.997 -1.102
114 1HD PRO 167 HD2 PRO 167 -3.030 4.392 -1.926
115 2HD PRO 167 HD1 PRO 167 -2.699 5.763 -3.002
116 HA PRO 168 HA PRO 168 0.947 3.415 2.043
117 1HB PRO 168 HB2 PRO 168 -0.582 1.311 2.439
118 2HB PRO 168 HB1 PRO 168 -1.263 2.945 2.565
119 1HG PRO 168 HG2 PRO 168 -1.438 1.004 0.286
120 2HG PRO 168 HG1 PRO 168 -2.724 1.986 1.016
121 1HD PRO 168 HD2 PRO 168 -1.305 2.681 -1.251
122 2HD PRO 168 HD1 PRO 168 -2.161 3.823 -0.202
123 H ILE 169 HN ILE 169 2.401 3.045 -0.277
124 HA ILE 169 HA ILE 169 2.803 0.252 -0.818
125 HB ILE 169 HB ILE 169 3.246 2.268 -2.384
126 1HG1 ILE 169 HG12 ILE 169 5.255 0.021 -2.142
127 2HG1 ILE 169 HG11 ILE 169 3.699 -0.074 -2.961
128 1HG2 ILE 169 HG21 ILE 169 4.736 3.456 -0.817
129 2HG2 ILE 169 HG22 ILE 169 5.475 3.165 -2.391
130 3HG2 ILE 169 HG23 ILE 169 5.920 2.163 -1.010
131 1HD1 ILE 169 HD11 ILE 169 6.218 1.241 -3.810
132 2HD1 ILE 169 HD12 ILE 169 4.687 1.944 -4.332
133 3HD1 ILE 169 HD13 ILE 169 5.073 0.272 -4.738
134 H ILE 170 HN ILE 170 4.439 2.752 1.013
135 HA ILE 170 HA ILE 170 6.641 1.112 1.817
136 HB ILE 170 HB ILE 170 5.822 3.615 3.254
137 1HG1 ILE 170 HG12 ILE 170 7.567 4.497 1.332
138 2HG1 ILE 170 HG11 ILE 170 6.604 3.332 0.429
139 1HG2 ILE 170 HG21 ILE 170 8.035 1.875 3.357
140 2HG2 ILE 170 HG22 ILE 170 7.811 3.401 4.211
141 3HG2 ILE 170 HG23 ILE 170 8.604 3.380 2.635
142 1HD1 ILE 170 HD11 ILE 170 5.316 5.152 0.093
143 2HD1 ILE 170 HD12 ILE 170 5.848 5.940 1.579
144 3HD1 ILE 170 HD13 ILE 170 4.635 4.661 1.644
145 H LEU 171 HN LEU 171 3.816 2.432 3.565
146 HA LEU 171 HA LEU 171 4.397 1.111 5.991
147 1HB LEU 171 HB2 LEU 171 2.851 2.601 6.591
148 2HB LEU 171 HB1 LEU 171 2.332 2.816 4.934
149 HG LEU 171 HG LEU 171 1.322 0.416 6.382
150 1HD1 LEU 171 HD11 LEU 171 0.225 3.182 6.848
151 2HD1 LEU 171 HD12 LEU 171 1.132 2.237 8.029
152 3HD1 LEU 171 HD13 LEU 171 -0.436 1.666 7.459
153 1HD2 LEU 171 HD21 LEU 171 -0.599 2.022 4.970
154 2HD2 LEU 171 HD22 LEU 171 -0.071 0.370 4.649
155 3HD2 LEU 171 HD23 LEU 171 0.812 1.729 3.955
156 H ASP 172 HN ASP 172 2.068 0.338 3.427
157 HA ASP 172 HA ASP 172 1.419 -2.213 4.533
158 1HB ASP 172 HB2 ASP 172 0.143 -0.567 2.802
159 2HB ASP 172 HB1 ASP 172 0.853 -1.728 1.670
160 H ALA 173 HN ALA 173 4.244 -1.265 3.243
161 HA ALA 173 HA ALA 173 4.758 -3.289 1.314
162 1HB ALA 173 HB1 ALA 173 7.130 -2.367 2.702
163 2HB ALA 173 HB2 ALA 173 6.093 -1.029 2.217
164 3HB ALA 173 HB3 ALA 173 6.670 -2.176 1.011
165 H GLY 174 HN GLY 174 5.956 -2.858 4.649
166 1HA GLY 174 HA2 GLY 174 6.211 -5.800 4.830
167 2HA GLY 174 HA1 GLY 174 7.174 -4.642 5.769
168 H TYR 175 HN TYR 175 4.533 -3.051 5.963
169 HA TYR 175 HA TYR 175 2.768 -2.812 7.361
170 1HB TYR 175 HB2 TYR 175 2.221 -5.176 6.575
171 2HB TYR 175 HB1 TYR 175 2.984 -5.744 8.057
172 HD1 TYR 175 HD1 TYR 175 0.080 -4.049 6.625
173 HD2 TYR 175 HD2 TYR 175 1.942 -5.344 10.224
174 HE1 TYR 175 HE1 TYR 175 -2.037 -3.722 7.832
175 HE2 TYR 175 HE2 TYR 175 -0.171 -5.022 11.441
176 HH TYR 175 HH TYR 175 -2.529 -4.876 11.028
177 H PHE 176 HN PHE 176 5.793 -3.978 8.316
178 HA PHE 176 HA PHE 176 5.260 -3.618 11.164
179 1HB PHE 176 HB2 PHE 176 6.530 -5.620 10.416
180 2HB PHE 176 HB1 PHE 176 7.778 -4.553 9.759
181 HD1 PHE 176 HD1 PHE 176 9.501 -3.757 11.116
182 HD2 PHE 176 HD2 PHE 176 6.088 -5.566 12.902
183 HE1 PHE 176 HE1 PHE 176 10.648 -3.763 13.292
184 HE2 PHE 176 HE2 PHE 176 7.228 -5.573 15.082
185 HZ PHE 176 HZ PHE 176 9.512 -4.671 15.280
186 H LEU 177 HN LEU 177 5.468 -1.498 8.968
187 HA LEU 177 HA LEU 177 7.823 -0.006 9.663
188 1HB LEU 177 HB2 LEU 177 5.796 0.081 7.619
189 2HB LEU 177 HB1 LEU 177 6.027 1.676 8.309
190 HG LEU 177 HG LEU 177 8.083 -0.048 6.937
191 1HD1 LEU 177 HD11 LEU 177 7.520 1.144 5.156
192 2HD1 LEU 177 HD12 LEU 177 8.027 2.607 5.997
193 3HD1 LEU 177 HD13 LEU 177 6.353 2.065 6.104
194 1HD2 LEU 177 HD21 LEU 177 8.418 2.229 8.816
195 2HD2 LEU 177 HD22 LEU 177 9.467 2.159 7.400
196 3HD2 LEU 177 HD23 LEU 177 9.445 0.821 8.549
197 HA PRO 178 HA PRO 178 4.249 2.900 11.519
198 1HB PRO 178 HB2 PRO 178 2.467 0.630 12.291
199 2HB PRO 178 HB1 PRO 178 2.047 2.273 11.796
200 1HG PRO 178 HG2 PRO 178 1.764 0.239 10.109
201 2HG PRO 178 HG1 PRO 178 2.354 1.814 9.544
202 1HD PRO 178 HD2 PRO 178 3.860 -0.715 10.030
203 2HD PRO 178 HD1 PRO 178 4.112 0.531 8.790
204 H LEU 179 HN LEU 179 3.787 -0.224 13.171
205 HA LEU 179 HA LEU 179 4.383 -0.954 15.236
206 1HB LEU 179 HB2 LEU 179 6.675 0.994 15.012
207 2HB LEU 179 HB1 LEU 179 6.585 -0.411 16.059
208 HG LEU 179 HG LEU 179 6.757 -0.443 13.044
209 1HD1 LEU 179 HD11 LEU 179 8.923 -1.620 13.557
210 2HD1 LEU 179 HD12 LEU 179 8.721 -1.089 15.227
211 3HD1 LEU 179 HD13 LEU 179 8.879 0.102 13.935
212 1HD2 LEU 179 HD21 LEU 179 5.378 -2.271 14.266
213 2HD2 LEU 179 HD22 LEU 179 6.954 -2.861 14.792
214 3HD2 LEU 179 HD23 LEU 179 6.583 -2.748 13.071
215 H ARG 180 HN ARG 180 2.362 0.621 15.466
216 HA ARG 180 HA ARG 180 1.191 1.961 16.884
217 1HB ARG 180 HB2 ARG 180 3.658 1.711 18.620
218 2HB ARG 180 HB1 ARG 180 2.078 2.299 19.154
219 1HG ARG 180 HG2 ARG 180 2.643 -0.472 18.109
220 2HG ARG 180 HG1 ARG 180 2.493 -0.027 19.811
221 1HD ARG 180 HD2 ARG 180 0.332 -0.553 19.564
222 2HD ARG 180 HD1 ARG 180 0.197 1.004 18.750
223 HE ARG 180 HE ARG 180 -0.251 -0.132 16.832
224 1HH1 ARG 180 1HH1 ARG 180 1.547 -2.251 18.944
225 2HH1 ARG 180 2HH1 ARG 180 1.454 -3.605 17.870
226 1HH2 ARG 180 1HH2 ARG 180 -0.373 -1.914 15.418
227 2HH2 ARG 180 2HH2 ARG 180 0.366 -3.415 15.869
228 1HG HSL 181 HG1 HSL 181 4.222 7.444 13.677
229 2HG HSL 181 HG2 HSL 181 3.997 6.455 12.141
230 H HSL 181 HN HSL 181 2.364 3.198 14.783
231 HA HSL 181 HA HSL 181 3.339 5.862 15.946
232 1HB HSL 181 HB1 HSL 181 5.151 5.391 14.495
233 2HB HSL 181 HB2 HSL 181 4.104 4.372 13.367
Start of MODEL 89
1 1H PHE 155 HT1 PHE 155 -3.109 -4.816 -16.668
2 2H PHE 155 HT2 PHE 155 -2.146 -4.089 -15.447
3 3H PHE 155 HT3 PHE 155 -1.711 -3.922 -17.098
4 HA PHE 155 HA PHE 155 -3.905 -2.817 -17.416
5 1HB PHE 155 HB2 PHE 155 -3.660 -2.649 -14.403
6 2HB PHE 155 HB1 PHE 155 -4.886 -1.853 -15.385
7 HD1 PHE 155 HD1 PHE 155 -3.840 -4.944 -13.816
8 HD2 PHE 155 HD2 PHE 155 -6.626 -3.186 -16.510
9 HE1 PHE 155 HE1 PHE 155 -5.285 -6.925 -13.609
10 HE2 PHE 155 HE2 PHE 155 -8.077 -5.162 -16.306
11 HZ PHE 155 HZ PHE 155 -7.407 -7.035 -14.854
12 H LEU 156 HN LEU 156 -4.030 -0.372 -16.846
13 HA LEU 156 HA LEU 156 -1.607 0.888 -16.016
14 1HB LEU 156 HB2 LEU 156 -2.382 0.927 -18.931
15 2HB LEU 156 HB1 LEU 156 -1.252 2.056 -18.213
16 HG LEU 156 HG LEU 156 -0.875 -0.933 -18.404
17 1HD1 LEU 156 HD11 LEU 156 -0.657 0.769 -20.442
18 2HD1 LEU 156 HD12 LEU 156 0.420 -0.610 -20.231
19 3HD1 LEU 156 HD13 LEU 156 0.936 0.996 -19.721
20 1HD2 LEU 156 HD21 LEU 156 1.066 1.164 -17.448
21 2HD2 LEU 156 HD22 LEU 156 1.307 -0.583 -17.481
22 3HD2 LEU 156 HD23 LEU 156 0.126 0.124 -16.379
23 H GLN 157 HN GLN 157 -3.276 1.764 -14.601
24 HA GLN 157 HA GLN 157 -4.148 4.307 -15.470
25 1HB GLN 157 HB2 GLN 157 -5.962 2.153 -15.959
26 2HB GLN 157 HB1 GLN 157 -6.645 3.184 -14.709
27 1HG GLN 157 HG2 GLN 157 -7.010 4.886 -16.127
28 2HG GLN 157 HG1 GLN 157 -5.521 4.597 -17.026
29 1HE2 GLN 157 HE21 GLN 157 -8.305 2.511 -16.362
30 2HE2 GLN 157 HE22 GLN 157 -8.694 2.207 -18.018
31 H SER 158 HN SER 158 -4.581 1.714 -13.109
32 HA SER 158 HA SER 158 -5.355 3.494 -11.003
33 1HB SER 158 HB2 SER 158 -4.521 1.311 -9.655
34 2HB SER 158 HB1 SER 158 -6.101 1.399 -10.453
35 HG SER 158 HG SER 158 -3.764 0.062 -11.253
36 H ASP 159 HN ASP 159 -3.383 4.865 -11.816
37 HA ASP 159 HA ASP 159 -1.479 5.920 -11.142
38 1HB ASP 159 HB2 ASP 159 -2.230 4.420 -8.848
39 2HB ASP 159 HB1 ASP 159 -0.493 4.216 -9.056
40 H VAL 160 HN VAL 160 -1.019 2.431 -10.654
41 HA VAL 160 HA VAL 160 0.336 0.908 -11.651
42 HB VAL 160 HB VAL 160 1.132 3.161 -13.496
43 1HG1 VAL 160 HG11 VAL 160 2.809 1.712 -13.943
44 2HG1 VAL 160 HG12 VAL 160 1.568 0.924 -14.917
45 3HG1 VAL 160 HG13 VAL 160 1.929 0.328 -13.296
46 1HG2 VAL 160 HG21 VAL 160 -1.327 2.336 -13.410
47 2HG2 VAL 160 HG22 VAL 160 -0.692 0.913 -14.239
48 3HG2 VAL 160 HG23 VAL 160 -0.527 2.509 -14.972
49 H PHE 161 HN PHE 161 2.037 4.002 -11.864
50 HA PHE 161 HA PHE 161 4.436 2.873 -10.736
51 1HB PHE 161 HB2 PHE 161 3.669 5.615 -11.712
52 2HB PHE 161 HB1 PHE 161 5.188 5.337 -10.867
53 HD1 PHE 161 HD1 PHE 161 3.207 3.970 -13.713
54 HD2 PHE 161 HD2 PHE 161 7.054 4.825 -12.107
55 HE1 PHE 161 HE1 PHE 161 4.243 3.253 -15.826
56 HE2 PHE 161 HE2 PHE 161 8.098 4.111 -14.219
57 HZ PHE 161 HZ PHE 161 6.691 3.323 -16.081
58 H PHE 162 HN PHE 162 2.149 2.754 -8.983
59 HA PHE 162 HA PHE 162 3.329 3.775 -6.631
60 1HB PHE 162 HB2 PHE 162 1.173 5.369 -7.892
61 2HB PHE 162 HB1 PHE 162 1.115 5.159 -6.139
62 HD1 PHE 162 HD1 PHE 162 2.095 7.352 -8.557
63 HD2 PHE 162 HD2 PHE 162 3.648 5.429 -5.091
64 HE1 PHE 162 HE1 PHE 162 3.735 9.167 -8.288
65 HE2 PHE 162 HE2 PHE 162 5.290 7.241 -4.817
66 HZ PHE 162 HZ PHE 162 5.335 9.114 -6.416
67 H LEU 163 HN LEU 163 0.623 2.258 -8.243
68 HA LEU 163 HA LEU 163 -0.908 1.554 -6.016
69 1HB LEU 163 HB2 LEU 163 -1.241 1.142 -8.614
70 2HB LEU 163 HB1 LEU 163 -0.538 -0.416 -8.223
71 HG LEU 163 HG LEU 163 -3.035 -0.367 -8.239
72 1HD1 LEU 163 HD11 LEU 163 -1.736 -1.066 -5.612
73 2HD1 LEU 163 HD12 LEU 163 -1.796 -2.096 -7.043
74 3HD1 LEU 163 HD13 LEU 163 -3.284 -1.675 -6.196
75 1HD2 LEU 163 HD21 LEU 163 -3.079 1.947 -7.142
76 2HD2 LEU 163 HD22 LEU 163 -2.848 1.083 -5.623
77 3HD2 LEU 163 HD23 LEU 163 -4.272 0.761 -6.613
78 H PHE 164 HN PHE 164 1.767 -0.101 -7.603
79 HA PHE 164 HA PHE 164 3.092 -1.853 -6.947
80 1HB PHE 164 HB2 PHE 164 3.476 0.396 -5.458
81 2HB PHE 164 HB1 PHE 164 3.225 -0.808 -4.195
82 HD1 PHE 164 HD1 PHE 164 5.091 -1.855 -3.377
83 HD2 PHE 164 HD2 PHE 164 5.110 -0.466 -7.400
84 HE1 PHE 164 HE1 PHE 164 7.426 -2.589 -3.616
85 HE2 PHE 164 HE2 PHE 164 7.445 -1.200 -7.646
86 HZ PHE 164 HZ PHE 164 8.607 -2.263 -5.753
87 H LEU 165 HN LEU 165 0.358 -2.533 -6.727
88 HA LEU 165 HA LEU 165 -0.703 -4.475 -6.032
89 1HB LEU 165 HB2 LEU 165 1.724 -4.958 -4.931
90 2HB LEU 165 HB1 LEU 165 0.756 -4.739 -3.478
91 HG LEU 165 HG LEU 165 0.278 -6.769 -5.665
92 1HD1 LEU 165 HD11 LEU 165 2.096 -6.918 -3.688
93 2HD1 LEU 165 HD12 LEU 165 1.244 -8.317 -4.340
94 3HD1 LEU 165 HD13 LEU 165 0.680 -7.555 -2.853
95 1HD2 LEU 165 HD21 LEU 165 -1.470 -7.594 -4.024
96 2HD2 LEU 165 HD22 LEU 165 -1.859 -6.121 -4.913
97 3HD2 LEU 165 HD23 LEU 165 -1.326 -6.024 -3.235
98 H LEU 166 HN LEU 166 0.135 -1.869 -3.889
99 HA LEU 166 HA LEU 166 -2.587 -1.634 -2.999
100 1HB LEU 166 HB2 LEU 166 -0.868 -3.221 -1.507
101 2HB LEU 166 HB1 LEU 166 -0.805 -1.675 -0.680
102 HG LEU 166 HG LEU 166 -2.521 -3.490 0.069
103 1HD1 LEU 166 HD11 LEU 166 -2.362 -1.240 1.000
104 2HD1 LEU 166 HD12 LEU 166 -4.037 -1.772 0.856
105 3HD1 LEU 166 HD13 LEU 166 -3.372 -0.628 -0.309
106 1HD2 LEU 166 HD21 LEU 166 -4.474 -2.180 -1.695
107 2HD2 LEU 166 HD22 LEU 166 -4.398 -3.843 -1.114
108 3HD2 LEU 166 HD23 LEU 166 -3.404 -3.340 -2.476
109 HA PRO 167 HA PRO 167 -1.655 2.671 -3.448
110 1HB PRO 167 HB2 PRO 167 -3.071 3.280 -1.003
111 2HB PRO 167 HB1 PRO 167 -3.551 3.602 -2.678
112 1HG PRO 167 HG2 PRO 167 -4.349 1.411 -0.899
113 2HG PRO 167 HG1 PRO 167 -5.111 1.983 -2.390
114 1HD PRO 167 HD2 PRO 167 -3.816 -0.389 -2.218
115 2HD PRO 167 HD1 PRO 167 -3.873 0.566 -3.715
116 HA PRO 168 HA PRO 168 0.612 3.426 0.609
117 1HB PRO 168 HB2 PRO 168 0.279 1.902 2.746
118 2HB PRO 168 HB1 PRO 168 -0.997 3.021 2.223
119 1HG PRO 168 HG2 PRO 168 -0.815 0.062 1.859
120 2HG PRO 168 HG1 PRO 168 -2.224 1.061 2.259
121 1HD PRO 168 HD2 PRO 168 -1.526 0.148 -0.286
122 2HD PRO 168 HD1 PRO 168 -2.681 1.442 0.068
123 H ILE 169 HN ILE 169 2.474 2.968 -0.414
124 HA ILE 169 HA ILE 169 3.577 0.371 -0.758
125 HB ILE 169 HB ILE 169 4.155 2.997 -1.638
126 1HG1 ILE 169 HG12 ILE 169 6.068 1.114 -2.645
127 2HG1 ILE 169 HG11 ILE 169 4.508 0.314 -2.474
128 1HG2 ILE 169 HG21 ILE 169 6.585 3.151 -1.396
129 2HG2 ILE 169 HG22 ILE 169 6.574 1.738 -0.343
130 3HG2 ILE 169 HG23 ILE 169 5.779 3.228 0.172
131 1HD1 ILE 169 HD11 ILE 169 4.679 2.981 -3.800
132 2HD1 ILE 169 HD12 ILE 169 3.487 1.696 -4.006
133 3HD1 ILE 169 HD13 ILE 169 5.105 1.515 -4.685
134 H ILE 170 HN ILE 170 4.265 3.034 1.433
135 HA ILE 170 HA ILE 170 6.348 1.707 2.812
136 HB ILE 170 HB ILE 170 6.250 3.598 4.346
137 1HG1 ILE 170 HG12 ILE 170 3.664 3.960 2.978
138 2HG1 ILE 170 HG11 ILE 170 4.108 4.316 4.638
139 1HG2 ILE 170 HG21 ILE 170 7.130 5.148 2.848
140 2HG2 ILE 170 HG22 ILE 170 6.027 4.661 1.561
141 3HG2 ILE 170 HG23 ILE 170 7.355 3.601 2.032
142 1HD1 ILE 170 HD11 ILE 170 4.320 6.008 2.207
143 2HD1 ILE 170 HD12 ILE 170 5.473 6.255 3.521
144 3HD1 ILE 170 HD13 ILE 170 3.741 6.417 3.822
145 H LEU 171 HN LEU 171 2.943 2.334 3.590
146 HA LEU 171 HA LEU 171 3.043 1.205 6.184
147 1HB LEU 171 HB2 LEU 171 1.090 2.410 4.526
148 2HB LEU 171 HB1 LEU 171 0.459 0.839 4.979
149 HG LEU 171 HG LEU 171 -0.333 2.456 6.558
150 1HD1 LEU 171 HD11 LEU 171 1.825 1.249 8.179
151 2HD1 LEU 171 HD12 LEU 171 0.797 0.146 7.264
152 3HD1 LEU 171 HD13 LEU 171 0.080 1.255 8.432
153 1HD2 LEU 171 HD21 LEU 171 1.900 3.865 6.044
154 2HD2 LEU 171 HD22 LEU 171 2.331 3.161 7.603
155 3HD2 LEU 171 HD23 LEU 171 0.872 4.141 7.451
156 H ASP 172 HN ASP 172 1.792 -0.096 3.128
157 HA ASP 172 HA ASP 172 1.582 -2.764 4.134
158 1HB ASP 172 HB2 ASP 172 0.516 -1.372 1.972
159 2HB ASP 172 HB1 ASP 172 1.607 -2.550 1.228
160 H ALA 173 HN ALA 173 4.279 -1.057 3.518
161 HA ALA 173 HA ALA 173 5.751 -2.823 1.841
162 1HB ALA 173 HB1 ALA 173 6.209 -0.327 3.127
163 2HB ALA 173 HB2 ALA 173 7.162 -1.103 1.864
164 3HB ALA 173 HB3 ALA 173 7.522 -1.419 3.561
165 H GLY 174 HN GLY 174 6.474 -2.056 5.234
166 1HA GLY 174 HA2 GLY 174 7.283 -4.849 5.633
167 2HA GLY 174 HA1 GLY 174 7.666 -3.483 6.699
168 H TYR 175 HN TYR 175 4.664 -2.781 6.166
169 HA TYR 175 HA TYR 175 2.655 -3.059 7.158
170 1HB TYR 175 HB2 TYR 175 3.690 -5.746 6.952
171 2HB TYR 175 HB1 TYR 175 2.760 -5.570 8.436
172 HD1 TYR 175 HD1 TYR 175 2.315 -7.005 5.552
173 HD2 TYR 175 HD2 TYR 175 0.684 -3.645 7.588
174 HE1 TYR 175 HE1 TYR 175 0.232 -7.244 4.266
175 HE2 TYR 175 HE2 TYR 175 -1.403 -3.874 6.309
176 HH TYR 175 HH TYR 175 -2.364 -6.470 4.808
177 H PHE 176 HN PHE 176 5.054 -4.727 9.208
178 HA PHE 176 HA PHE 176 3.987 -3.312 11.532
179 1HB PHE 176 HB2 PHE 176 5.566 -4.889 12.784
180 2HB PHE 176 HB1 PHE 176 4.177 -5.620 11.970
181 HD1 PHE 176 HD1 PHE 176 4.468 -7.056 10.068
182 HD2 PHE 176 HD2 PHE 176 7.817 -5.206 11.929
183 HE1 PHE 176 HE1 PHE 176 5.976 -8.575 8.854
184 HE2 PHE 176 HE2 PHE 176 9.332 -6.719 10.717
185 HZ PHE 176 HZ PHE 176 8.412 -8.406 9.177
186 H LEU 177 HN LEU 177 6.375 -2.867 9.261
187 HA LEU 177 HA LEU 177 8.504 -1.960 10.917
188 1HB LEU 177 HB2 LEU 177 7.890 -1.469 8.007
189 2HB LEU 177 HB1 LEU 177 9.350 -0.913 8.801
190 HG LEU 177 HG LEU 177 8.504 -3.780 8.393
191 1HD1 LEU 177 HD11 LEU 177 9.447 -2.445 6.449
192 2HD1 LEU 177 HD12 LEU 177 10.284 -3.943 6.862
193 3HD1 LEU 177 HD13 LEU 177 10.959 -2.390 7.356
194 1HD2 LEU 177 HD21 LEU 177 10.828 -4.224 9.327
195 2HD2 LEU 177 HD22 LEU 177 9.578 -3.761 10.481
196 3HD2 LEU 177 HD23 LEU 177 10.771 -2.576 9.952
197 HA PRO 178 HA PRO 178 6.606 2.413 9.762
198 1HB PRO 178 HB2 PRO 178 3.745 1.680 9.605
199 2HB PRO 178 HB1 PRO 178 4.684 2.765 8.576
200 1HG PRO 178 HG2 PRO 178 3.892 0.370 7.698
201 2HG PRO 178 HG1 PRO 178 5.472 1.039 7.250
202 1HD PRO 178 HD2 PRO 178 4.802 -1.040 9.299
203 2HD PRO 178 HD1 PRO 178 6.148 -0.990 8.143
204 H LEU 179 HN LEU 179 4.040 3.240 10.874
205 HA LEU 179 HA LEU 179 2.922 3.541 12.841
206 1HB LEU 179 HB2 LEU 179 3.899 0.963 13.188
207 2HB LEU 179 HB1 LEU 179 4.487 1.827 14.596
208 HG LEU 179 HG LEU 179 2.234 2.450 15.220
209 1HD1 LEU 179 HD11 LEU 179 0.905 2.798 13.424
210 2HD1 LEU 179 HD12 LEU 179 0.432 1.130 13.750
211 3HD1 LEU 179 HD13 LEU 179 1.623 1.481 12.496
212 1HD2 LEU 179 HD21 LEU 179 3.116 0.241 15.909
213 2HD2 LEU 179 HD22 LEU 179 2.322 -0.478 14.508
214 3HD2 LEU 179 HD23 LEU 179 1.358 0.277 15.777
215 H ARG 180 HN ARG 180 4.113 5.558 12.524
216 HA ARG 180 HA ARG 180 5.214 7.339 13.429
217 1HB ARG 180 HB2 ARG 180 5.799 5.610 15.835
218 2HB ARG 180 HB1 ARG 180 5.688 7.374 15.765
219 1HG ARG 180 HG2 ARG 180 3.294 5.757 15.040
220 2HG ARG 180 HG1 ARG 180 3.736 5.912 16.742
221 1HD ARG 180 HD2 ARG 180 2.345 7.714 16.501
222 2HD ARG 180 HD1 ARG 180 3.903 8.459 16.145
223 HE ARG 180 HE ARG 180 3.160 7.829 13.707
224 1HH1 ARG 180 1HH1 ARG 180 1.204 9.164 16.279
225 2HH1 ARG 180 2HH1 ARG 180 0.123 9.975 15.198
226 1HH2 ARG 180 1HH2 ARG 180 1.737 8.900 12.293
227 2HH2 ARG 180 2HH2 ARG 180 0.424 9.827 12.939
228 1HG HSL 181 HG1 HSL 181 11.018 4.929 10.394
229 2HG HSL 181 HG2 HSL 181 9.928 4.797 8.916
230 H HSL 181 HN HSL 181 6.580 6.203 11.566
231 HA HSL 181 HA HSL 181 9.421 5.827 12.653
232 1HB HSL 181 HB1 HSL 181 9.195 3.794 11.460
233 2HB HSL 181 HB2 HSL 181 7.958 4.509 10.292
Start of MODEL 90
1 1H PHE 155 HT1 PHE 155 -7.643 -0.306 -6.221
2 2H PHE 155 HT2 PHE 155 -6.704 -1.621 -6.799
3 3H PHE 155 HT3 PHE 155 -6.800 -1.307 -5.114
4 HA PHE 155 HA PHE 155 -9.255 -1.652 -5.361
5 1HB PHE 155 HB2 PHE 155 -8.184 -2.395 -8.032
6 2HB PHE 155 HB1 PHE 155 -9.435 -3.434 -7.357
7 HD1 PHE 155 HD1 PHE 155 -11.688 -2.632 -7.043
8 HD2 PHE 155 HD2 PHE 155 -8.666 -0.105 -8.651
9 HE1 PHE 155 HE1 PHE 155 -13.418 -1.051 -7.796
10 HE2 PHE 155 HE2 PHE 155 -10.389 1.481 -9.406
11 HZ PHE 155 HZ PHE 155 -12.767 1.009 -8.978
12 H LEU 156 HN LEU 156 -9.730 -3.236 -4.046
13 HA LEU 156 HA LEU 156 -9.427 -4.934 -2.579
14 1HB LEU 156 HB2 LEU 156 -9.224 -7.128 -3.649
15 2HB LEU 156 HB1 LEU 156 -10.394 -6.088 -4.434
16 HG LEU 156 HG LEU 156 -8.626 -5.577 -6.167
17 1HD1 LEU 156 HD11 LEU 156 -7.120 -7.343 -4.401
18 2HD1 LEU 156 HD12 LEU 156 -6.552 -6.201 -5.616
19 3HD1 LEU 156 HD13 LEU 156 -7.058 -7.820 -6.098
20 1HD2 LEU 156 HD21 LEU 156 -10.499 -7.132 -6.514
21 2HD2 LEU 156 HD22 LEU 156 -9.490 -8.450 -5.916
22 3HD2 LEU 156 HD23 LEU 156 -9.048 -7.605 -7.400
23 H GLN 157 HN GLN 157 -8.038 -6.007 -1.275
24 HA GLN 157 HA GLN 157 -5.383 -6.700 -1.920
25 1HB GLN 157 HB2 GLN 157 -4.983 -4.311 -1.922
26 2HB GLN 157 HB1 GLN 157 -5.742 -4.151 -0.348
27 1HG GLN 157 HG2 GLN 157 -3.564 -4.135 0.282
28 2HG GLN 157 HG1 GLN 157 -3.862 -5.872 0.344
29 1HE2 GLN 157 HE21 GLN 157 -1.756 -3.589 -0.682
30 2HE2 GLN 157 HE22 GLN 157 -0.968 -4.461 -1.949
31 H SER 158 HN SER 158 -6.500 -5.204 1.035
32 HA SER 158 HA SER 158 -7.300 -7.571 2.345
33 1HB SER 158 HB2 SER 158 -4.509 -6.544 2.915
34 2HB SER 158 HB1 SER 158 -5.409 -7.569 4.046
35 HG SER 158 HG SER 158 -5.152 -9.245 2.754
36 H ASP 159 HN ASP 159 -5.914 -4.379 2.570
37 HA ASP 159 HA ASP 159 -7.346 -3.745 5.017
38 1HB ASP 159 HB2 ASP 159 -5.641 -2.023 3.203
39 2HB ASP 159 HB1 ASP 159 -6.314 -1.503 4.745
40 H VAL 160 HN VAL 160 -7.296 -2.599 1.666
41 HA VAL 160 HA VAL 160 -8.962 -1.911 0.289
42 HB VAL 160 HB VAL 160 -10.410 -3.405 2.091
43 1HG1 VAL 160 HG11 VAL 160 -12.467 -2.153 2.554
44 2HG1 VAL 160 HG12 VAL 160 -11.709 -0.684 1.944
45 3HG1 VAL 160 HG13 VAL 160 -11.083 -1.461 3.396
46 1HG2 VAL 160 HG21 VAL 160 -11.817 -3.723 0.338
47 2HG2 VAL 160 HG22 VAL 160 -10.487 -2.941 -0.515
48 3HG2 VAL 160 HG23 VAL 160 -11.907 -2.004 -0.050
49 H PHE 161 HN PHE 161 -9.390 -0.599 3.589
50 HA PHE 161 HA PHE 161 -10.219 1.966 2.679
51 1HB PHE 161 HB2 PHE 161 -10.736 1.075 4.942
52 2HB PHE 161 HB1 PHE 161 -9.030 1.204 5.357
53 HD1 PHE 161 HD1 PHE 161 -8.236 3.142 6.333
54 HD2 PHE 161 HD2 PHE 161 -11.894 3.256 4.161
55 HE1 PHE 161 HE1 PHE 161 -8.589 5.465 7.059
56 HE2 PHE 161 HE2 PHE 161 -12.254 5.581 4.882
57 HZ PHE 161 HZ PHE 161 -10.600 6.689 6.331
58 H PHE 162 HN PHE 162 -7.169 0.453 3.287
59 HA PHE 162 HA PHE 162 -5.540 2.767 3.452
60 1HB PHE 162 HB2 PHE 162 -5.253 -0.066 3.475
61 2HB PHE 162 HB1 PHE 162 -4.081 0.615 2.351
62 HD1 PHE 162 HD1 PHE 162 -2.816 2.757 3.313
63 HD2 PHE 162 HD2 PHE 162 -4.616 -0.298 5.664
64 HE1 PHE 162 HE1 PHE 162 -1.358 3.358 5.203
65 HE2 PHE 162 HE2 PHE 162 -3.162 0.296 7.558
66 HZ PHE 162 HZ PHE 162 -1.532 2.127 7.329
67 H LEU 163 HN LEU 163 -5.930 0.404 0.823
68 HA LEU 163 HA LEU 163 -4.630 1.967 -1.150
69 1HB LEU 163 HB2 LEU 163 -6.353 -0.464 -1.118
70 2HB LEU 163 HB1 LEU 163 -6.116 0.354 -2.649
71 HG LEU 163 HG LEU 163 -3.898 -0.724 -0.906
72 1HD1 LEU 163 HD11 LEU 163 -3.865 -2.627 -2.136
73 2HD1 LEU 163 HD12 LEU 163 -4.487 -1.836 -3.585
74 3HD1 LEU 163 HD13 LEU 163 -5.585 -2.265 -2.274
75 1HD2 LEU 163 HD21 LEU 163 -3.735 1.296 -2.740
76 2HD2 LEU 163 HD22 LEU 163 -3.372 -0.122 -3.722
77 3HD2 LEU 163 HD23 LEU 163 -2.409 0.226 -2.286
78 H PHE 164 HN PHE 164 -7.490 2.398 0.402
79 HA PHE 164 HA PHE 164 -9.168 3.309 -1.701
80 1HB PHE 164 HB2 PHE 164 -9.396 2.651 1.014
81 2HB PHE 164 HB1 PHE 164 -9.807 4.362 0.919
82 HD1 PHE 164 HD1 PHE 164 -11.290 1.358 1.113
83 HD2 PHE 164 HD2 PHE 164 -11.250 4.738 -1.471
84 HE1 PHE 164 HE1 PHE 164 -13.544 0.772 0.320
85 HE2 PHE 164 HE2 PHE 164 -13.505 4.160 -2.269
86 HZ PHE 164 HZ PHE 164 -14.653 2.175 -1.372
87 H LEU 165 HN LEU 165 -7.713 5.071 1.049
88 HA LEU 165 HA LEU 165 -8.135 7.623 -0.088
89 1HB LEU 165 HB2 LEU 165 -7.055 6.550 2.329
90 2HB LEU 165 HB1 LEU 165 -5.943 7.753 1.699
91 HG LEU 165 HG LEU 165 -8.418 8.986 1.483
92 1HD1 LEU 165 HD11 LEU 165 -9.687 7.573 2.788
93 2HD1 LEU 165 HD12 LEU 165 -9.134 8.760 3.971
94 3HD1 LEU 165 HD13 LEU 165 -8.343 7.186 3.864
95 1HD2 LEU 165 HD21 LEU 165 -7.552 10.142 3.658
96 2HD2 LEU 165 HD22 LEU 165 -6.657 10.309 2.148
97 3HD2 LEU 165 HD23 LEU 165 -6.114 9.161 3.371
98 H LEU 166 HN LEU 166 -5.150 5.733 0.319
99 HA LEU 166 HA LEU 166 -4.142 6.581 -2.230
100 1HB LEU 166 HB2 LEU 166 -3.664 8.299 -0.134
101 2HB LEU 166 HB1 LEU 166 -2.211 7.316 -0.155
102 HG LEU 166 HG LEU 166 -1.755 7.939 -2.448
103 1HD1 LEU 166 HD11 LEU 166 -4.428 9.297 -2.282
104 2HD1 LEU 166 HD12 LEU 166 -3.875 8.095 -3.449
105 3HD1 LEU 166 HD13 LEU 166 -3.219 9.731 -3.491
106 1HD2 LEU 166 HD21 LEU 166 -1.357 10.330 -2.150
107 2HD2 LEU 166 HD22 LEU 166 -0.950 9.425 -0.692
108 3HD2 LEU 166 HD23 LEU 166 -2.453 10.343 -0.768
109 HA PRO 167 HA PRO 167 -2.234 2.611 -1.911
110 1HB PRO 167 HB2 PRO 167 0.016 3.113 -3.449
111 2HB PRO 167 HB1 PRO 167 -1.571 2.626 -4.073
112 1HG PRO 167 HG2 PRO 167 -0.359 5.354 -3.888
113 2HG PRO 167 HG1 PRO 167 -1.353 4.653 -5.178
114 1HD PRO 167 HD2 PRO 167 -2.386 6.381 -3.414
115 2HD PRO 167 HD1 PRO 167 -3.331 5.001 -4.010
116 HA PRO 168 HA PRO 168 0.756 3.650 1.345
117 1HB PRO 168 HB2 PRO 168 0.291 1.520 2.880
118 2HB PRO 168 HB1 PRO 168 -0.897 2.837 2.776
119 1HG PRO 168 HG2 PRO 168 -0.866 0.200 1.340
120 2HG PRO 168 HG1 PRO 168 -2.211 0.994 2.180
121 1HD PRO 168 HD2 PRO 168 -1.842 1.100 -0.522
122 2HD PRO 168 HD1 PRO 168 -2.656 2.377 0.403
123 H ILE 169 HN ILE 169 2.497 3.287 -0.205
124 HA ILE 169 HA ILE 169 3.384 0.664 -0.845
125 HB ILE 169 HB ILE 169 5.493 1.824 -1.570
126 1HG1 ILE 169 HG12 ILE 169 4.234 3.954 -0.067
127 2HG1 ILE 169 HG11 ILE 169 5.884 3.833 -0.653
128 1HG2 ILE 169 HG21 ILE 169 3.713 1.343 -3.133
129 2HG2 ILE 169 HG22 ILE 169 4.417 2.919 -3.499
130 3HG2 ILE 169 HG23 ILE 169 2.865 2.817 -2.665
131 1HD1 ILE 169 HD11 ILE 169 3.540 4.791 -2.279
132 2HD1 ILE 169 HD12 ILE 169 5.228 4.758 -2.787
133 3HD1 ILE 169 HD13 ILE 169 4.722 5.828 -1.479
134 H ILE 170 HN ILE 170 4.258 3.023 1.596
135 HA ILE 170 HA ILE 170 6.449 1.474 2.625
136 HB ILE 170 HB ILE 170 5.117 3.815 3.968
137 1HG1 ILE 170 HG12 ILE 170 5.635 4.706 1.863
138 2HG1 ILE 170 HG11 ILE 170 7.044 5.107 2.839
139 1HG2 ILE 170 HG21 ILE 170 7.106 4.061 5.182
140 2HG2 ILE 170 HG22 ILE 170 8.002 3.005 4.090
141 3HG2 ILE 170 HG23 ILE 170 6.794 2.325 5.179
142 1HD1 ILE 170 HD11 ILE 170 8.181 3.112 1.886
143 2HD1 ILE 170 HD12 ILE 170 7.782 4.356 0.701
144 3HD1 ILE 170 HD13 ILE 170 6.795 2.897 0.815
145 H LEU 171 HN LEU 171 3.143 2.246 3.679
146 HA LEU 171 HA LEU 171 3.284 0.873 6.144
147 1HB LEU 171 HB2 LEU 171 1.272 2.215 4.561
148 2HB LEU 171 HB1 LEU 171 0.625 0.733 5.238
149 HG LEU 171 HG LEU 171 0.221 2.739 6.645
150 1HD1 LEU 171 HD11 LEU 171 1.905 0.521 7.785
151 2HD1 LEU 171 HD12 LEU 171 0.145 0.611 7.707
152 3HD1 LEU 171 HD13 LEU 171 1.039 1.702 8.766
153 1HD2 LEU 171 HD21 LEU 171 2.101 3.669 7.921
154 2HD2 LEU 171 HD22 LEU 171 2.275 3.950 6.188
155 3HD2 LEU 171 HD23 LEU 171 3.218 2.684 6.976
156 H ASP 172 HN ASP 172 1.762 -0.076 3.084
157 HA ASP 172 HA ASP 172 1.442 -2.798 3.874
158 1HB ASP 172 HB2 ASP 172 0.431 -1.153 1.833
159 2HB ASP 172 HB1 ASP 172 1.337 -2.428 1.007
160 H ALA 173 HN ALA 173 4.198 -1.180 3.226
161 HA ALA 173 HA ALA 173 5.502 -2.927 1.395
162 1HB ALA 173 HB1 ALA 173 7.006 -1.286 1.424
163 2HB ALA 173 HB2 ALA 173 7.398 -1.658 3.103
164 3HB ALA 173 HB3 ALA 173 6.120 -0.502 2.730
165 H GLY 174 HN GLY 174 5.735 -2.446 4.899
166 1HA GLY 174 HA2 GLY 174 6.506 -5.287 5.166
167 2HA GLY 174 HA1 GLY 174 7.294 -4.012 6.114
168 H TYR 175 HN TYR 175 4.340 -2.837 6.006
169 HA TYR 175 HA TYR 175 2.515 -2.772 7.330
170 1HB TYR 175 HB2 TYR 175 1.823 -4.929 6.787
171 2HB TYR 175 HB1 TYR 175 3.223 -5.684 7.535
172 HD1 TYR 175 HD1 TYR 175 2.406 -7.165 9.123
173 HD2 TYR 175 HD2 TYR 175 0.755 -3.249 8.915
174 HE1 TYR 175 HE1 TYR 175 1.083 -7.621 11.146
175 HE2 TYR 175 HE2 TYR 175 -0.572 -3.694 10.937
176 HH TYR 175 HH TYR 175 0.025 -6.172 13.018
177 H PHE 176 HN PHE 176 5.094 -4.621 9.000
178 HA PHE 176 HA PHE 176 4.419 -3.270 11.487
179 1HB PHE 176 HB2 PHE 176 6.079 -4.806 12.499
180 2HB PHE 176 HB1 PHE 176 4.816 -5.663 11.604
181 HD1 PHE 176 HD1 PHE 176 8.354 -4.681 11.627
182 HD2 PHE 176 HD2 PHE 176 5.326 -6.900 9.621
183 HE1 PHE 176 HE1 PHE 176 10.079 -5.838 10.310
184 HE2 PHE 176 HE2 PHE 176 7.047 -8.061 8.300
185 HZ PHE 176 HZ PHE 176 9.426 -7.531 8.645
186 H LEU 177 HN LEU 177 6.039 -2.224 8.961
187 HA LEU 177 HA LEU 177 8.575 -1.504 10.049
188 1HB LEU 177 HB2 LEU 177 7.215 -0.034 7.811
189 2HB LEU 177 HB1 LEU 177 8.930 -0.267 8.080
190 HG LEU 177 HG LEU 177 6.966 -2.389 7.213
191 1HD1 LEU 177 HD11 LEU 177 7.519 -0.778 5.458
192 2HD1 LEU 177 HD12 LEU 177 8.216 -2.363 5.123
193 3HD1 LEU 177 HD13 LEU 177 9.237 -1.064 5.738
194 1HD2 LEU 177 HD21 LEU 177 9.383 -3.476 6.809
195 2HD2 LEU 177 HD22 LEU 177 8.448 -3.714 8.285
196 3HD2 LEU 177 HD23 LEU 177 9.730 -2.505 8.240
197 HA PRO 178 HA PRO 178 6.066 2.840 10.427
198 1HB PRO 178 HB2 PRO 178 3.723 1.350 11.564
199 2HB PRO 178 HB1 PRO 178 3.761 2.908 10.726
200 1HG PRO 178 HG2 PRO 178 2.984 0.725 9.442
201 2HG PRO 178 HG1 PRO 178 4.018 1.919 8.635
202 1HD PRO 178 HD2 PRO 178 4.709 -0.767 9.709
203 2HD PRO 178 HD1 PRO 178 5.392 0.105 8.324
204 H LEU 179 HN LEU 179 5.996 -0.038 12.441
205 HA LEU 179 HA LEU 179 6.097 1.454 14.913
206 1HB LEU 179 HB2 LEU 179 6.084 -1.424 14.140
207 2HB LEU 179 HB1 LEU 179 6.736 -1.000 15.712
208 HG LEU 179 HG LEU 179 4.373 0.362 15.737
209 1HD1 LEU 179 HD11 LEU 179 3.670 -2.276 14.504
210 2HD1 LEU 179 HD12 LEU 179 3.888 -0.830 13.517
211 3HD1 LEU 179 HD13 LEU 179 2.646 -0.865 14.770
212 1HD2 LEU 179 HD21 LEU 179 3.586 -1.873 16.924
213 2HD2 LEU 179 HD22 LEU 179 4.798 -0.813 17.641
214 3HD2 LEU 179 HD23 LEU 179 5.299 -2.262 16.769
215 H ARG 180 HN ARG 180 8.297 -0.753 13.195
216 HA ARG 180 HA ARG 180 10.544 0.173 14.787
217 1HB ARG 180 HB2 ARG 180 10.315 -1.896 12.593
218 2HB ARG 180 HB1 ARG 180 11.827 -1.502 13.421
219 1HG ARG 180 HG2 ARG 180 11.200 -3.273 14.680
220 2HG ARG 180 HG1 ARG 180 10.321 -2.017 15.553
221 1HD ARG 180 HD2 ARG 180 8.560 -2.712 13.567
222 2HD ARG 180 HD1 ARG 180 9.319 -4.254 13.965
223 HE ARG 180 HE ARG 180 8.448 -2.746 16.258
224 1HH1 ARG 180 1HH1 ARG 180 7.523 -5.083 13.835
225 2HH1 ARG 180 2HH1 ARG 180 6.238 -5.746 14.787
226 1HH2 ARG 180 1HH2 ARG 180 6.760 -3.618 17.510
227 2HH2 ARG 180 2HH2 ARG 180 5.803 -4.915 16.874
228 1HG HSL 181 HG1 HSL 181 8.569 5.504 10.629
229 2HG HSL 181 HG2 HSL 181 7.917 4.514 12.036
230 H HSL 181 HN HSL 181 9.249 2.133 13.227
231 HA HSL 181 HA HSL 181 11.392 2.783 11.136
232 1HB HSL 181 HB1 HSL 181 9.808 3.708 9.714
233 2HB HSL 181 HB2 HSL 181 8.595 2.673 10.643
Start of MODEL 91
1 1H PHE 155 HT1 PHE 155 -3.493 1.787 -13.283
2 2H PHE 155 HT2 PHE 155 -3.449 3.503 -13.302
3 3H PHE 155 HT3 PHE 155 -2.004 2.602 -13.518
4 HA PHE 155 HA PHE 155 -2.932 1.669 -15.540
5 1HB PHE 155 HB2 PHE 155 -5.144 3.563 -14.777
6 2HB PHE 155 HB1 PHE 155 -4.905 3.060 -16.446
7 HD1 PHE 155 HD1 PHE 155 -5.477 1.737 -13.026
8 HD2 PHE 155 HD2 PHE 155 -5.807 1.063 -17.215
9 HE1 PHE 155 HE1 PHE 155 -6.784 -0.302 -12.592
10 HE2 PHE 155 HE2 PHE 155 -7.116 -0.977 -16.788
11 HZ PHE 155 HZ PHE 155 -7.606 -1.662 -14.474
12 H LEU 156 HN LEU 156 -3.943 5.033 -15.539
13 HA LEU 156 HA LEU 156 -1.411 6.129 -16.163
14 1HB LEU 156 HB2 LEU 156 -3.254 5.314 -18.361
15 2HB LEU 156 HB1 LEU 156 -2.347 6.802 -18.548
16 HG LEU 156 HG LEU 156 -1.335 3.983 -18.412
17 1HD1 LEU 156 HD11 LEU 156 -0.244 6.016 -20.245
18 2HD1 LEU 156 HD12 LEU 156 -1.922 5.540 -20.508
19 3HD1 LEU 156 HD13 LEU 156 -0.646 4.322 -20.530
20 1HD2 LEU 156 HD21 LEU 156 0.041 5.088 -16.809
21 2HD2 LEU 156 HD22 LEU 156 0.228 6.496 -17.854
22 3HD2 LEU 156 HD23 LEU 156 0.966 4.958 -18.306
23 H GLN 157 HN GLN 157 -3.385 6.775 -14.330
24 HA GLN 157 HA GLN 157 -3.735 9.536 -14.863
25 1HB GLN 157 HB2 GLN 157 -5.609 8.447 -16.213
26 2HB GLN 157 HB1 GLN 157 -6.323 8.001 -14.670
27 1HG GLN 157 HG2 GLN 157 -7.184 10.022 -14.395
28 2HG GLN 157 HG1 GLN 157 -5.632 10.797 -14.710
29 1HE2 GLN 157 HE21 GLN 157 -5.078 10.305 -17.238
30 2HE2 GLN 157 HE22 GLN 157 -6.302 10.908 -18.297
31 H SER 158 HN SER 158 -2.436 8.446 -12.886
32 HA SER 158 HA SER 158 -3.769 9.415 -10.560
33 1HB SER 158 HB2 SER 158 -2.987 6.507 -10.398
34 2HB SER 158 HB1 SER 158 -4.013 7.443 -9.297
35 HG SER 158 HG SER 158 -4.636 6.210 -11.709
36 H ASP 159 HN ASP 159 -1.718 10.588 -11.327
37 HA ASP 159 HA ASP 159 0.338 11.315 -10.651
38 1HB ASP 159 HB2 ASP 159 -0.355 9.531 -8.579
39 2HB ASP 159 HB1 ASP 159 1.280 9.091 -9.066
40 H VAL 160 HN VAL 160 0.429 7.757 -10.886
41 HA VAL 160 HA VAL 160 1.533 6.349 -12.281
42 HB VAL 160 HB VAL 160 2.144 8.834 -13.884
43 1HG1 VAL 160 HG11 VAL 160 3.666 7.449 -14.820
44 2HG1 VAL 160 HG12 VAL 160 2.249 6.831 -15.669
45 3HG1 VAL 160 HG13 VAL 160 2.856 5.994 -14.240
46 1HG2 VAL 160 HG21 VAL 160 0.351 7.834 -15.383
47 2HG2 VAL 160 HG22 VAL 160 -0.190 8.570 -13.874
48 3HG2 VAL 160 HG23 VAL 160 -0.072 6.815 -14.007
49 H PHE 161 HN PHE 161 3.416 9.374 -12.115
50 HA PHE 161 HA PHE 161 5.900 7.980 -11.867
51 1HB PHE 161 HB2 PHE 161 5.556 10.285 -12.886
52 2HB PHE 161 HB1 PHE 161 5.415 10.889 -11.238
53 HD1 PHE 161 HD1 PHE 161 7.318 11.359 -9.963
54 HD2 PHE 161 HD2 PHE 161 7.693 9.125 -13.565
55 HE1 PHE 161 HE1 PHE 161 9.767 11.546 -9.818
56 HE2 PHE 161 HE2 PHE 161 10.142 9.307 -13.427
57 HZ PHE 161 HZ PHE 161 11.183 10.519 -11.552
58 H PHE 162 HN PHE 162 3.704 7.635 -9.757
59 HA PHE 162 HA PHE 162 5.454 7.454 -7.529
60 1HB PHE 162 HB2 PHE 162 3.458 9.684 -7.609
61 2HB PHE 162 HB1 PHE 162 3.886 8.923 -6.075
62 HD1 PHE 162 HD1 PHE 162 6.428 8.779 -5.553
63 HD2 PHE 162 HD2 PHE 162 4.717 11.447 -8.393
64 HE1 PHE 162 HE1 PHE 162 8.414 10.221 -5.390
65 HE2 PHE 162 HE2 PHE 162 6.700 12.893 -8.236
66 HZ PHE 162 HZ PHE 162 8.553 12.281 -6.733
67 H LEU 163 HN LEU 163 2.421 6.900 -9.049
68 HA LEU 163 HA LEU 163 0.947 5.863 -6.900
69 1HB LEU 163 HB2 LEU 163 0.431 6.262 -9.517
70 2HB LEU 163 HB1 LEU 163 0.690 4.526 -9.530
71 HG LEU 163 HG LEU 163 -1.686 5.170 -9.287
72 1HD1 LEU 163 HD11 LEU 163 -0.445 3.699 -6.972
73 2HD1 LEU 163 HD12 LEU 163 -0.989 3.008 -8.500
74 3HD1 LEU 163 HD13 LEU 163 -2.163 3.681 -7.369
75 1HD2 LEU 163 HD21 LEU 163 -2.502 6.455 -7.605
76 2HD2 LEU 163 HD22 LEU 163 -0.883 7.148 -7.696
77 3HD2 LEU 163 HD23 LEU 163 -1.259 5.944 -6.464
78 H PHE 164 HN PHE 164 3.278 4.437 -9.104
79 HA PHE 164 HA PHE 164 4.377 2.439 -9.119
80 1HB PHE 164 HB2 PHE 164 4.893 3.807 -6.803
81 2HB PHE 164 HB1 PHE 164 4.414 2.225 -6.186
82 HD1 PHE 164 HD1 PHE 164 6.865 4.041 -8.222
83 HD2 PHE 164 HD2 PHE 164 5.783 0.289 -6.532
84 HE1 PHE 164 HE1 PHE 164 9.114 3.175 -8.715
85 HE2 PHE 164 HE2 PHE 164 8.031 -0.584 -7.021
86 HZ PHE 164 HZ PHE 164 9.699 0.860 -8.114
87 H LEU 165 HN LEU 165 1.462 2.278 -9.066
88 HA LEU 165 HA LEU 165 0.022 0.488 -9.255
89 1HB LEU 165 HB2 LEU 165 2.352 -0.872 -8.759
90 2HB LEU 165 HB1 LEU 165 1.353 -1.330 -7.385
91 HG LEU 165 HG LEU 165 1.090 -2.978 -9.112
92 1HD1 LEU 165 HD11 LEU 165 -1.328 -1.179 -9.039
93 2HD1 LEU 165 HD12 LEU 165 -0.909 -2.395 -7.833
94 3HD1 LEU 165 HD13 LEU 165 -1.314 -2.887 -9.477
95 1HD2 LEU 165 HD21 LEU 165 0.202 -0.762 -10.953
96 2HD2 LEU 165 HD22 LEU 165 0.366 -2.473 -11.344
97 3HD2 LEU 165 HD23 LEU 165 1.799 -1.509 -10.988
98 H LEU 166 HN LEU 166 1.324 1.660 -6.277
99 HA LEU 166 HA LEU 166 -1.281 1.659 -5.102
100 1HB LEU 166 HB2 LEU 166 -1.115 -0.044 -3.637
101 2HB LEU 166 HB1 LEU 166 0.037 -0.660 -4.813
102 HG LEU 166 HG LEU 166 0.864 0.949 -2.394
103 1HD1 LEU 166 HD11 LEU 166 1.026 -2.037 -2.631
104 2HD1 LEU 166 HD12 LEU 166 -0.354 -1.231 -1.887
105 3HD1 LEU 166 HD13 LEU 166 1.259 -1.027 -1.204
106 1HD2 LEU 166 HD21 LEU 166 2.904 0.837 -3.263
107 2HD2 LEU 166 HD22 LEU 166 2.225 0.099 -4.713
108 3HD2 LEU 166 HD23 LEU 166 2.788 -0.919 -3.387
109 HA PRO 167 HA PRO 167 0.706 5.450 -3.766
110 1HB PRO 167 HB2 PRO 167 -1.370 5.877 -1.859
111 2HB PRO 167 HB1 PRO 167 -1.147 6.667 -3.426
112 1HG PRO 167 HG2 PRO 167 -2.969 4.503 -2.669
113 2HG PRO 167 HG1 PRO 167 -3.024 5.583 -4.067
114 1HD PRO 167 HD2 PRO 167 -2.381 2.920 -4.188
115 2HD PRO 167 HD1 PRO 167 -1.871 4.126 -5.383
116 HA PRO 168 HA PRO 168 1.193 4.051 0.718
117 1HB PRO 168 HB2 PRO 168 -0.208 2.078 1.762
118 2HB PRO 168 HB1 PRO 168 -1.003 3.616 1.359
119 1HG PRO 168 HG2 PRO 168 -1.024 1.024 -0.139
120 2HG PRO 168 HG1 PRO 168 -2.357 2.152 0.166
121 1HD PRO 168 HD2 PRO 168 -0.803 2.044 -2.157
122 2HD PRO 168 HD1 PRO 168 -1.840 3.394 -1.665
123 H ILE 169 HN ILE 169 3.199 3.371 -0.419
124 HA ILE 169 HA ILE 169 3.662 0.571 -0.856
125 HB ILE 169 HB ILE 169 4.788 2.566 -2.045
126 1HG1 ILE 169 HG12 ILE 169 7.070 1.010 -1.757
127 2HG1 ILE 169 HG11 ILE 169 5.759 -0.092 -1.352
128 1HG2 ILE 169 HG21 ILE 169 5.576 3.696 -0.021
129 2HG2 ILE 169 HG22 ILE 169 6.897 3.314 -1.124
130 3HG2 ILE 169 HG23 ILE 169 6.640 2.330 0.315
131 1HD1 ILE 169 HD11 ILE 169 5.666 1.575 -3.832
132 2HD1 ILE 169 HD12 ILE 169 4.802 0.084 -3.461
133 3HD1 ILE 169 HD13 ILE 169 6.536 0.042 -3.783
134 H ILE 170 HN ILE 170 4.689 2.939 1.561
135 HA ILE 170 HA ILE 170 6.217 1.093 3.105
136 HB ILE 170 HB ILE 170 5.056 3.670 4.142
137 1HG1 ILE 170 HG12 ILE 170 7.684 4.153 3.285
138 2HG1 ILE 170 HG11 ILE 170 6.918 3.291 1.956
139 1HG2 ILE 170 HG21 ILE 170 6.071 2.646 5.924
140 2HG2 ILE 170 HG22 ILE 170 7.420 3.574 5.269
141 3HG2 ILE 170 HG23 ILE 170 7.283 1.851 4.920
142 1HD1 ILE 170 HD11 ILE 170 6.755 5.999 2.506
143 2HD1 ILE 170 HD12 ILE 170 5.191 5.351 2.999
144 3HD1 ILE 170 HD13 ILE 170 5.776 5.090 1.356
145 H LEU 171 HN LEU 171 2.934 2.364 3.313
146 HA LEU 171 HA LEU 171 2.288 1.191 5.816
147 1HB LEU 171 HB2 LEU 171 1.093 3.093 4.710
148 2HB LEU 171 HB1 LEU 171 0.435 1.934 3.570
149 HG LEU 171 HG LEU 171 -0.058 1.200 6.357
150 1HD1 LEU 171 HD11 LEU 171 -0.467 3.319 7.034
151 2HD1 LEU 171 HD12 LEU 171 -2.010 3.018 6.236
152 3HD1 LEU 171 HD13 LEU 171 -0.742 3.909 5.395
153 1HD2 LEU 171 HD21 LEU 171 -2.062 1.708 4.183
154 2HD2 LEU 171 HD22 LEU 171 -2.157 0.581 5.536
155 3HD2 LEU 171 HD23 LEU 171 -1.056 0.259 4.197
156 H ASP 172 HN ASP 172 2.970 -0.259 2.981
157 HA ASP 172 HA ASP 172 1.695 -2.732 3.794
158 1HB ASP 172 HB2 ASP 172 0.908 -1.161 1.434
159 2HB ASP 172 HB1 ASP 172 1.284 -2.853 1.080
160 H ALA 173 HN ALA 173 4.416 -1.339 3.360
161 HA ALA 173 HA ALA 173 5.711 -3.031 1.414
162 1HB ALA 173 HB1 ALA 173 6.557 -0.807 3.202
163 2HB ALA 173 HB2 ALA 173 6.827 -1.028 1.472
164 3HB ALA 173 HB3 ALA 173 7.786 -1.938 2.640
165 H GLY 174 HN GLY 174 5.614 -2.586 4.917
166 1HA GLY 174 HA2 GLY 174 6.330 -5.424 5.244
167 2HA GLY 174 HA1 GLY 174 7.292 -4.205 6.096
168 H TYR 175 HN TYR 175 4.226 -3.010 5.948
169 HA TYR 175 HA TYR 175 2.600 -2.618 7.429
170 1HB TYR 175 HB2 TYR 175 1.573 -4.574 8.544
171 2HB TYR 175 HB1 TYR 175 1.824 -4.809 6.821
172 HD1 TYR 175 HD1 TYR 175 3.262 -6.540 6.012
173 HD2 TYR 175 HD2 TYR 175 2.985 -5.764 10.187
174 HE1 TYR 175 HE1 TYR 175 4.426 -8.655 6.477
175 HE2 TYR 175 HE2 TYR 175 4.153 -7.875 10.663
176 HH TYR 175 HH TYR 175 5.957 -9.414 8.925
177 H PHE 176 HN PHE 176 5.000 -4.683 9.083
178 HA PHE 176 HA PHE 176 4.496 -3.218 11.542
179 1HB PHE 176 HB2 PHE 176 5.705 -4.910 12.676
180 2HB PHE 176 HB1 PHE 176 4.731 -5.741 11.459
181 HD1 PHE 176 HD1 PHE 176 6.998 -7.028 12.796
182 HD2 PHE 176 HD2 PHE 176 6.907 -4.635 9.278
183 HE1 PHE 176 HE1 PHE 176 9.016 -8.165 11.974
184 HE2 PHE 176 HE2 PHE 176 8.923 -5.770 8.449
185 HZ PHE 176 HZ PHE 176 9.982 -7.538 9.797
186 H LEU 177 HN LEU 177 6.113 -2.299 9.013
187 HA LEU 177 HA LEU 177 8.744 -1.829 10.013
188 1HB LEU 177 HB2 LEU 177 7.419 -0.229 7.839
189 2HB LEU 177 HB1 LEU 177 9.126 -0.544 8.066
190 HG LEU 177 HG LEU 177 7.163 -2.728 7.408
191 1HD1 LEU 177 HD11 LEU 177 6.973 -1.236 5.585
192 2HD1 LEU 177 HD12 LEU 177 8.092 -2.500 5.076
193 3HD1 LEU 177 HD13 LEU 177 8.708 -0.922 5.567
194 1HD2 LEU 177 HD21 LEU 177 9.471 -3.559 6.419
195 2HD2 LEU 177 HD22 LEU 177 9.043 -3.809 8.111
196 3HD2 LEU 177 HD23 LEU 177 10.111 -2.481 7.660
197 HA PRO 178 HA PRO 178 6.701 2.701 10.593
198 1HB PRO 178 HB2 PRO 178 4.134 1.506 11.570
199 2HB PRO 178 HB1 PRO 178 4.414 3.051 10.754
200 1HG PRO 178 HG2 PRO 178 3.414 1.009 9.405
201 2HG PRO 178 HG1 PRO 178 4.651 2.044 8.665
202 1HD PRO 178 HD2 PRO 178 4.911 -0.701 9.809
203 2HD PRO 178 HD1 PRO 178 5.721 0.019 8.406
204 H LEU 179 HN LEU 179 6.259 -0.241 12.441
205 HA LEU 179 HA LEU 179 6.113 0.953 15.007
206 1HB LEU 179 HB2 LEU 179 6.788 -1.806 14.032
207 2HB LEU 179 HB1 LEU 179 6.895 -1.394 15.733
208 HG LEU 179 HG LEU 179 4.768 -2.512 15.106
209 1HD1 LEU 179 HD11 LEU 179 4.394 -1.418 17.047
210 2HD1 LEU 179 HD12 LEU 179 3.340 -0.443 16.022
211 3HD1 LEU 179 HD13 LEU 179 4.962 0.127 16.414
212 1HD2 LEU 179 HD21 LEU 179 3.141 -1.430 13.765
213 2HD2 LEU 179 HD22 LEU 179 4.646 -1.400 12.849
214 3HD2 LEU 179 HD23 LEU 179 4.093 0.052 13.684
215 H ARG 180 HN ARG 180 8.797 -0.830 13.475
216 HA ARG 180 HA ARG 180 10.668 0.320 15.371
217 1HB ARG 180 HB2 ARG 180 11.034 -1.653 13.106
218 2HB ARG 180 HB1 ARG 180 12.339 -1.110 14.168
219 1HG ARG 180 HG2 ARG 180 11.824 -2.774 15.533
220 2HG ARG 180 HG1 ARG 180 10.300 -1.957 15.880
221 1HD ARG 180 HD2 ARG 180 9.937 -3.258 13.421
222 2HD ARG 180 HD1 ARG 180 10.779 -4.411 14.455
223 HE ARG 180 HE ARG 180 8.068 -3.629 14.658
224 1HH1 ARG 180 1HH1 ARG 180 10.838 -4.432 16.623
225 2HH1 ARG 180 2HH1 ARG 180 9.886 -4.985 17.960
226 1HH2 ARG 180 1HH2 ARG 180 6.814 -4.357 16.415
227 2HH2 ARG 180 2HH2 ARG 180 7.602 -4.942 17.842
228 1HG HSL 181 HG1 HSL 181 10.690 5.594 10.699
229 2HG HSL 181 HG2 HSL 181 8.988 5.937 11.311
230 H HSL 181 HN HSL 181 9.476 2.289 13.910
231 HA HSL 181 HA HSL 181 11.697 3.212 12.008
232 1HB HSL 181 HB1 HSL 181 9.843 3.356 10.537
233 2HB HSL 181 HB2 HSL 181 8.649 3.619 11.918
Start of MODEL 92
1 1H PHE 155 HT1 PHE 155 -6.808 10.786 -8.554
2 2H PHE 155 HT2 PHE 155 -6.141 11.409 -10.008
3 3H PHE 155 HT3 PHE 155 -7.647 11.997 -9.431
4 HA PHE 155 HA PHE 155 -5.847 13.527 -9.034
5 1HB PHE 155 HB2 PHE 155 -7.162 12.208 -6.649
6 2HB PHE 155 HB1 PHE 155 -6.333 13.760 -6.574
7 HD1 PHE 155 HD1 PHE 155 -9.434 12.432 -6.581
8 HD2 PHE 155 HD2 PHE 155 -7.155 15.286 -8.763
9 HE1 PHE 155 HE1 PHE 155 -11.510 13.566 -7.258
10 HE2 PHE 155 HE2 PHE 155 -9.225 16.426 -9.444
11 HZ PHE 155 HZ PHE 155 -11.408 15.567 -8.690
12 H LEU 156 HN LEU 156 -3.933 14.036 -7.901
13 HA LEU 156 HA LEU 156 -2.048 11.908 -7.794
14 1HB LEU 156 HB2 LEU 156 -1.867 14.824 -7.056
15 2HB LEU 156 HB1 LEU 156 -0.506 13.727 -6.955
16 HG LEU 156 HG LEU 156 -1.157 15.292 -9.121
17 1HD1 LEU 156 HD11 LEU 156 0.625 12.977 -8.629
18 2HD1 LEU 156 HD12 LEU 156 1.014 14.640 -9.066
19 3HD1 LEU 156 HD13 LEU 156 0.426 13.520 -10.295
20 1HD2 LEU 156 HD21 LEU 156 -2.062 12.472 -9.691
21 2HD2 LEU 156 HD22 LEU 156 -1.725 13.690 -10.921
22 3HD2 LEU 156 HD23 LEU 156 -3.038 13.939 -9.772
23 H GLN 157 HN GLN 157 -4.121 13.406 -5.496
24 HA GLN 157 HA GLN 157 -4.464 13.100 -3.276
25 1HB GLN 157 HB2 GLN 157 -3.978 10.617 -4.317
26 2HB GLN 157 HB1 GLN 157 -2.799 10.699 -3.014
27 1HG GLN 157 HG2 GLN 157 -5.286 11.666 -2.035
28 2HG GLN 157 HG1 GLN 157 -5.566 10.137 -2.865
29 1HE2 GLN 157 HE21 GLN 157 -2.843 11.344 -0.942
30 2HE2 GLN 157 HE22 GLN 157 -2.857 10.055 0.207
31 H SER 158 HN SER 158 -1.869 14.341 -4.332
32 HA SER 158 HA SER 158 -0.171 15.497 -3.351
33 1HB SER 158 HB2 SER 158 -0.235 15.961 -1.107
34 2HB SER 158 HB1 SER 158 -1.860 15.278 -1.283
35 HG SER 158 HG SER 158 -1.280 13.659 -0.075
36 H ASP 159 HN ASP 159 -0.446 12.134 -3.359
37 HA ASP 159 HA ASP 159 2.141 11.524 -2.268
38 1HB ASP 159 HB2 ASP 159 -0.079 9.996 -3.521
39 2HB ASP 159 HB1 ASP 159 1.534 9.292 -3.619
40 H VAL 160 HN VAL 160 0.757 11.073 -5.501
41 HA VAL 160 HA VAL 160 1.616 11.075 -7.579
42 HB VAL 160 HB VAL 160 2.000 13.476 -7.009
43 1HG1 VAL 160 HG11 VAL 160 4.504 14.080 -6.898
44 2HG1 VAL 160 HG12 VAL 160 4.715 12.446 -6.285
45 3HG1 VAL 160 HG13 VAL 160 3.683 13.584 -5.420
46 1HG2 VAL 160 HG21 VAL 160 4.156 12.605 -8.874
47 2HG2 VAL 160 HG22 VAL 160 2.981 13.909 -9.042
48 3HG2 VAL 160 HG23 VAL 160 2.474 12.232 -9.249
49 H PHE 161 HN PHE 161 4.245 10.876 -5.187
50 HA PHE 161 HA PHE 161 6.027 9.550 -6.939
51 1HB PHE 161 HB2 PHE 161 6.062 10.537 -4.238
52 2HB PHE 161 HB1 PHE 161 6.728 8.908 -4.285
53 HD1 PHE 161 HD1 PHE 161 7.383 12.348 -4.805
54 HD2 PHE 161 HD2 PHE 161 8.536 8.449 -6.060
55 HE1 PHE 161 HE1 PHE 161 9.515 13.252 -5.637
56 HE2 PHE 161 HE2 PHE 161 10.671 9.344 -6.893
57 HZ PHE 161 HZ PHE 161 11.163 11.749 -6.682
58 H PHE 162 HN PHE 162 3.293 8.507 -5.191
59 HA PHE 162 HA PHE 162 3.655 5.824 -6.123
60 1HB PHE 162 HB2 PHE 162 3.529 6.224 -3.135
61 2HB PHE 162 HB1 PHE 162 3.614 4.688 -4.002
62 HD1 PHE 162 HD1 PHE 162 5.475 7.517 -2.708
63 HD2 PHE 162 HD2 PHE 162 5.703 4.019 -5.119
64 HE1 PHE 162 HE1 PHE 162 7.931 7.584 -2.566
65 HE2 PHE 162 HE2 PHE 162 8.159 4.077 -4.980
66 HZ PHE 162 HZ PHE 162 9.276 5.862 -3.702
67 H LEU 163 HN LEU 163 1.697 8.158 -6.053
68 HA LEU 163 HA LEU 163 -0.639 7.302 -4.681
69 1HB LEU 163 HB2 LEU 163 -0.403 9.577 -5.417
70 2HB LEU 163 HB1 LEU 163 -0.252 9.063 -7.086
71 HG LEU 163 HG LEU 163 -2.458 10.026 -6.335
72 1HD1 LEU 163 HD11 LEU 163 -3.351 7.573 -7.475
73 2HD1 LEU 163 HD12 LEU 163 -1.825 8.062 -8.210
74 3HD1 LEU 163 HD13 LEU 163 -3.202 9.162 -8.224
75 1HD2 LEU 163 HD21 LEU 163 -4.038 8.278 -5.415
76 2HD2 LEU 163 HD22 LEU 163 -2.879 8.973 -4.282
77 3HD2 LEU 163 HD23 LEU 163 -2.594 7.373 -4.963
78 H PHE 164 HN PHE 164 0.982 6.334 -7.466
79 HA PHE 164 HA PHE 164 -1.128 5.263 -9.011
80 1HB PHE 164 HB2 PHE 164 1.852 4.852 -8.931
81 2HB PHE 164 HB1 PHE 164 0.830 3.963 -10.060
82 HD1 PHE 164 HD1 PHE 164 2.659 6.942 -9.493
83 HD2 PHE 164 HD2 PHE 164 -0.685 5.369 -11.604
84 HE1 PHE 164 HE1 PHE 164 2.762 8.835 -11.060
85 HE2 PHE 164 HE2 PHE 164 -0.587 7.259 -13.176
86 HZ PHE 164 HZ PHE 164 1.138 8.996 -12.905
87 H LEU 165 HN LEU 165 1.467 3.433 -7.356
88 HA LEU 165 HA LEU 165 0.083 0.989 -7.496
89 1HB LEU 165 HB2 LEU 165 2.010 1.345 -5.268
90 2HB LEU 165 HB1 LEU 165 1.822 0.018 -6.388
91 HG LEU 165 HG LEU 165 3.872 0.844 -7.012
92 1HD1 LEU 165 HD11 LEU 165 3.551 1.283 -9.171
93 2HD1 LEU 165 HD12 LEU 165 2.674 2.774 -8.832
94 3HD1 LEU 165 HD13 LEU 165 1.828 1.227 -8.800
95 1HD2 LEU 165 HD21 LEU 165 2.946 3.239 -5.753
96 2HD2 LEU 165 HD22 LEU 165 3.665 3.632 -7.315
97 3HD2 LEU 165 HD23 LEU 165 4.595 2.734 -6.116
98 H LEU 166 HN LEU 166 0.931 2.623 -4.459
99 HA LEU 166 HA LEU 166 -1.762 2.471 -3.460
100 1HB LEU 166 HB2 LEU 166 0.005 0.283 -3.142
101 2HB LEU 166 HB1 LEU 166 -0.111 1.063 -1.576
102 HG LEU 166 HG LEU 166 -1.711 -0.806 -1.870
103 1HD1 LEU 166 HD11 LEU 166 -3.772 0.549 -1.217
104 2HD1 LEU 166 HD12 LEU 166 -2.739 1.966 -1.389
105 3HD1 LEU 166 HD13 LEU 166 -2.330 0.716 -0.215
106 1HD2 LEU 166 HD21 LEU 166 -3.650 -0.525 -3.312
107 2HD2 LEU 166 HD22 LEU 166 -2.158 -0.522 -4.254
108 3HD2 LEU 166 HD23 LEU 166 -2.992 0.995 -3.919
109 HA PRO 167 HA PRO 167 -0.147 6.261 -1.626
110 1HB PRO 167 HB2 PRO 167 -1.969 5.772 0.587
111 2HB PRO 167 HB1 PRO 167 -2.007 7.061 -0.627
112 1HG PRO 167 HG2 PRO 167 -3.540 4.591 -0.521
113 2HG PRO 167 HG1 PRO 167 -3.762 5.997 -1.570
114 1HD PRO 167 HD2 PRO 167 -2.906 3.552 -2.448
115 2HD PRO 167 HD1 PRO 167 -2.516 5.081 -3.256
116 HA PRO 168 HA PRO 168 1.324 4.169 2.365
117 1HB PRO 168 HB2 PRO 168 0.148 2.031 3.368
118 2HB PRO 168 HB1 PRO 168 -0.713 3.585 3.357
119 1HG PRO 168 HG2 PRO 168 -1.026 1.235 1.530
120 2HG PRO 168 HG1 PRO 168 -2.274 2.274 2.241
121 1HD PRO 168 HD2 PRO 168 -1.184 2.535 -0.325
122 2HD PRO 168 HD1 PRO 168 -2.123 3.766 0.539
123 H ILE 169 HN ILE 169 2.918 3.693 0.507
124 HA ILE 169 HA ILE 169 3.268 0.974 -0.302
125 HB ILE 169 HB ILE 169 4.037 3.121 -1.507
126 1HG1 ILE 169 HG12 ILE 169 6.260 1.721 -2.159
127 2HG1 ILE 169 HG11 ILE 169 5.336 0.471 -1.331
128 1HG2 ILE 169 HG21 ILE 169 6.312 3.834 -1.091
129 2HG2 ILE 169 HG22 ILE 169 6.446 2.691 0.245
130 3HG2 ILE 169 HG23 ILE 169 5.327 4.049 0.355
131 1HD1 ILE 169 HD11 ILE 169 3.852 2.052 -3.317
132 2HD1 ILE 169 HD12 ILE 169 3.818 0.321 -2.980
133 3HD1 ILE 169 HD13 ILE 169 5.124 1.006 -3.948
134 H ILE 170 HN ILE 170 4.860 3.087 2.026
135 HA ILE 170 HA ILE 170 6.779 1.166 2.884
136 HB ILE 170 HB ILE 170 5.853 3.597 4.412
137 1HG1 ILE 170 HG12 ILE 170 8.258 4.204 3.134
138 2HG1 ILE 170 HG11 ILE 170 7.305 3.386 1.901
139 1HG2 ILE 170 HG21 ILE 170 8.494 3.328 4.914
140 2HG2 ILE 170 HG22 ILE 170 8.027 1.639 4.715
141 3HG2 ILE 170 HG23 ILE 170 7.221 2.640 5.922
142 1HD1 ILE 170 HD11 ILE 170 6.296 5.705 3.521
143 2HD1 ILE 170 HD12 ILE 170 5.549 4.978 2.099
144 3HD1 ILE 170 HD13 ILE 170 7.068 5.861 1.943
145 H LEU 171 HN LEU 171 3.664 2.279 4.171
146 HA LEU 171 HA LEU 171 3.758 0.742 6.542
147 1HB LEU 171 HB2 LEU 171 2.209 2.571 6.379
148 2HB LEU 171 HB1 LEU 171 1.448 1.872 4.963
149 HG LEU 171 HG LEU 171 1.359 0.161 7.352
150 1HD1 LEU 171 HD11 LEU 171 -0.737 1.706 7.989
151 2HD1 LEU 171 HD12 LEU 171 0.382 2.944 7.420
152 3HD1 LEU 171 HD13 LEU 171 0.852 1.870 8.736
153 1HD2 LEU 171 HD21 LEU 171 0.085 -0.626 5.600
154 2HD2 LEU 171 HD22 LEU 171 -0.441 0.986 5.116
155 3HD2 LEU 171 HD23 LEU 171 -1.120 0.232 6.559
156 H ASP 172 HN ASP 172 2.028 0.219 3.495
157 HA ASP 172 HA ASP 172 1.373 -2.493 4.115
158 1HB ASP 172 HB2 ASP 172 0.376 -0.627 2.363
159 2HB ASP 172 HB1 ASP 172 1.259 -1.716 1.283
160 H ALA 173 HN ALA 173 4.285 -1.163 3.392
161 HA ALA 173 HA ALA 173 5.251 -2.964 1.404
162 1HB ALA 173 HB1 ALA 173 7.456 -2.068 2.862
163 2HB ALA 173 HB2 ALA 173 6.295 -0.745 2.918
164 3HB ALA 173 HB3 ALA 173 6.821 -1.387 1.364
165 H GLY 174 HN GLY 174 5.885 -2.657 4.888
166 1HA GLY 174 HA2 GLY 174 6.398 -5.571 4.965
167 2HA GLY 174 HA1 GLY 174 7.290 -4.402 5.958
168 H TYR 175 HN TYR 175 4.275 -3.195 5.882
169 HA TYR 175 HA TYR 175 2.461 -3.181 7.233
170 1HB TYR 175 HB2 TYR 175 2.129 -5.526 6.727
171 2HB TYR 175 HB1 TYR 175 3.341 -5.997 7.912
172 HD1 TYR 175 HD1 TYR 175 0.017 -4.369 7.578
173 HD2 TYR 175 HD2 TYR 175 2.739 -6.403 10.138
174 HE1 TYR 175 HE1 TYR 175 -1.732 -4.532 9.299
175 HE2 TYR 175 HE2 TYR 175 0.998 -6.572 11.864
176 HH TYR 175 HH TYR 175 -1.397 -6.514 12.079
177 H PHE 176 HN PHE 176 5.367 -4.534 8.794
178 HA PHE 176 HA PHE 176 4.629 -3.236 11.301
179 1HB PHE 176 HB2 PHE 176 5.821 -5.649 10.789
180 2HB PHE 176 HB1 PHE 176 7.219 -4.632 11.165
181 HD1 PHE 176 HD1 PHE 176 5.743 -7.038 12.664
182 HD2 PHE 176 HD2 PHE 176 5.932 -2.818 13.178
183 HE1 PHE 176 HE1 PHE 176 5.287 -7.315 15.066
184 HE2 PHE 176 HE2 PHE 176 5.475 -3.087 15.580
185 HZ PHE 176 HZ PHE 176 5.154 -5.337 16.528
186 H LEU 177 HN LEU 177 5.755 -1.997 8.668
187 HA LEU 177 HA LEU 177 8.224 -0.800 9.561
188 1HB LEU 177 HB2 LEU 177 6.545 -0.164 7.136
189 2HB LEU 177 HB1 LEU 177 8.189 0.374 7.427
190 HG LEU 177 HG LEU 177 7.275 -2.455 6.914
191 1HD1 LEU 177 HD11 LEU 177 7.897 -2.159 4.796
192 2HD1 LEU 177 HD12 LEU 177 9.384 -1.330 5.259
193 3HD1 LEU 177 HD13 LEU 177 7.871 -0.430 5.144
194 1HD2 LEU 177 HD21 LEU 177 9.658 -1.436 8.241
195 2HD2 LEU 177 HD22 LEU 177 10.026 -2.442 6.841
196 3HD2 LEU 177 HD23 LEU 177 9.027 -3.080 8.147
197 HA PRO 178 HA PRO 178 4.877 2.982 9.463
198 1HB PRO 178 HB2 PRO 178 3.085 1.309 11.189
199 2HB PRO 178 HB1 PRO 178 2.671 2.642 10.102
200 1HG PRO 178 HG2 PRO 178 2.278 0.136 9.339
201 2HG PRO 178 HG1 PRO 178 2.916 1.332 8.196
202 1HD PRO 178 HD2 PRO 178 4.316 -0.889 9.594
203 2HD PRO 178 HD1 PRO 178 4.627 -0.193 7.993
204 H LEU 179 HN LEU 179 5.784 0.656 11.934
205 HA LEU 179 HA LEU 179 5.553 2.306 14.188
206 1HB LEU 179 HB2 LEU 179 6.132 -0.262 13.895
207 2HB LEU 179 HB1 LEU 179 7.777 0.332 14.022
208 HG LEU 179 HG LEU 179 5.872 1.242 16.105
209 1HD1 LEU 179 HD11 LEU 179 6.979 -1.561 16.044
210 2HD1 LEU 179 HD12 LEU 179 5.280 -1.116 15.872
211 3HD1 LEU 179 HD13 LEU 179 6.124 -0.809 17.390
212 1HD2 LEU 179 HD21 LEU 179 8.528 0.095 16.702
213 2HD2 LEU 179 HD22 LEU 179 7.748 1.546 17.332
214 3HD2 LEU 179 HD23 LEU 179 8.505 1.573 15.739
215 H ARG 180 HN ARG 180 7.697 2.487 11.561
216 HA ARG 180 HA ARG 180 9.178 4.618 12.883
217 1HB ARG 180 HB2 ARG 180 10.406 2.131 11.710
218 2HB ARG 180 HB1 ARG 180 11.304 3.652 11.753
219 1HG ARG 180 HG2 ARG 180 11.574 3.588 14.006
220 2HG ARG 180 HG1 ARG 180 10.053 2.737 14.279
221 1HD ARG 180 HD2 ARG 180 11.843 1.075 12.773
222 2HD ARG 180 HD1 ARG 180 12.653 1.662 14.225
223 HE ARG 180 HE ARG 180 10.236 0.812 15.129
224 1HH1 ARG 180 1HH1 ARG 180 12.773 -0.671 13.245
225 2HH1 ARG 180 2HH1 ARG 180 12.445 -2.268 13.831
226 1HH2 ARG 180 1HH2 ARG 180 9.803 -1.286 15.899
227 2HH2 ARG 180 2HH2 ARG 180 10.758 -2.617 15.338
228 1HG HSL 181 HG1 HSL 181 6.309 6.510 6.743
229 2HG HSL 181 HG2 HSL 181 4.712 6.299 7.632
230 H HSL 181 HN HSL 181 7.131 4.926 11.153
231 HA HSL 181 HA HSL 181 8.478 5.737 8.522
232 1HB HSL 181 HB1 HSL 181 6.759 4.346 7.668
233 2HB HSL 181 HB2 HSL 181 5.664 4.648 9.123
Start of MODEL 93
1 1H PHE 155 HT1 PHE 155 -1.600 14.006 -2.119
2 2H PHE 155 HT2 PHE 155 -2.837 15.143 -2.472
3 3H PHE 155 HT3 PHE 155 -2.841 14.302 -0.976
4 HA PHE 155 HA PHE 155 -2.086 16.464 -0.591
5 1HB PHE 155 HB2 PHE 155 0.354 14.703 -0.687
6 2HB PHE 155 HB1 PHE 155 -0.037 15.943 0.500
7 HD1 PHE 155 HD1 PHE 155 -2.510 15.442 1.594
8 HD2 PHE 155 HD2 PHE 155 0.257 12.570 0.111
9 HE1 PHE 155 HE1 PHE 155 -3.515 13.729 3.047
10 HE2 PHE 155 HE2 PHE 155 -0.745 10.851 1.560
11 HZ PHE 155 HZ PHE 155 -2.633 11.431 3.031
12 H LEU 156 HN LEU 156 -1.223 15.295 -3.580
13 HA LEU 156 HA LEU 156 -0.445 16.334 -5.423
14 1HB LEU 156 HB2 LEU 156 -0.649 18.580 -3.563
15 2HB LEU 156 HB1 LEU 156 0.576 18.795 -4.795
16 HG LEU 156 HG LEU 156 -2.361 18.279 -5.249
17 1HD1 LEU 156 HD11 LEU 156 -2.607 20.481 -5.665
18 2HD1 LEU 156 HD12 LEU 156 -0.990 20.643 -6.351
19 3HD1 LEU 156 HD13 LEU 156 -1.207 20.618 -4.601
20 1HD2 LEU 156 HD21 LEU 156 -0.010 18.152 -7.059
21 2HD2 LEU 156 HD22 LEU 156 -1.490 18.889 -7.674
22 3HD2 LEU 156 HD23 LEU 156 -1.512 17.227 -7.084
23 H GLN 157 HN GLN 157 1.556 16.859 -2.536
24 HA GLN 157 HA GLN 157 4.007 16.960 -3.973
25 1HB GLN 157 HB2 GLN 157 3.674 16.228 -1.066
26 2HB GLN 157 HB1 GLN 157 5.078 16.947 -1.842
27 1HG GLN 157 HG2 GLN 157 3.871 19.012 -2.192
28 2HG GLN 157 HG1 GLN 157 2.407 18.297 -1.517
29 1HE2 GLN 157 HE21 GLN 157 2.498 17.604 0.727
30 2HE2 GLN 157 HE22 GLN 157 3.486 18.487 1.837
31 H SER 158 HN SER 158 1.903 14.448 -3.110
32 HA SER 158 HA SER 158 3.884 12.397 -2.854
33 1HB SER 158 HB2 SER 158 1.666 10.962 -3.214
34 2HB SER 158 HB1 SER 158 2.025 11.762 -1.674
35 HG SER 158 HG SER 158 0.365 13.010 -1.973
36 H ASP 159 HN ASP 159 3.898 13.976 -5.366
37 HA ASP 159 HA ASP 159 4.522 13.509 -7.511
38 1HB ASP 159 HB2 ASP 159 4.707 11.003 -6.351
39 2HB ASP 159 HB1 ASP 159 3.617 10.741 -7.708
40 H VAL 160 HN VAL 160 1.417 12.578 -6.272
41 HA VAL 160 HA VAL 160 -0.664 13.065 -7.059
42 HB VAL 160 HB VAL 160 0.704 13.861 -9.619
43 1HG1 VAL 160 HG11 VAL 160 -1.517 13.353 -10.195
44 2HG1 VAL 160 HG12 VAL 160 -1.497 15.102 -9.964
45 3HG1 VAL 160 HG13 VAL 160 -2.148 14.055 -8.705
46 1HG2 VAL 160 HG21 VAL 160 1.411 15.549 -8.302
47 2HG2 VAL 160 HG22 VAL 160 0.156 15.271 -7.095
48 3HG2 VAL 160 HG23 VAL 160 -0.222 16.158 -8.571
49 H PHE 161 HN PHE 161 1.363 11.604 -9.614
50 HA PHE 161 HA PHE 161 -0.702 9.937 -10.611
51 1HB PHE 161 HB2 PHE 161 1.288 10.554 -11.935
52 2HB PHE 161 HB1 PHE 161 2.299 9.613 -10.844
53 HD1 PHE 161 HD1 PHE 161 0.192 9.550 -13.740
54 HD2 PHE 161 HD2 PHE 161 1.935 7.122 -10.709
55 HE1 PHE 161 HE1 PHE 161 -0.182 7.553 -15.128
56 HE2 PHE 161 HE2 PHE 161 1.563 5.121 -12.092
57 HZ PHE 161 HZ PHE 161 0.503 5.335 -14.305
58 H PHE 162 HN PHE 162 1.777 9.549 -8.175
59 HA PHE 162 HA PHE 162 1.318 6.748 -7.763
60 1HB PHE 162 HB2 PHE 162 3.102 8.798 -6.804
61 2HB PHE 162 HB1 PHE 162 2.559 7.737 -5.506
62 HD1 PHE 162 HD1 PHE 162 5.294 8.181 -7.250
63 HD2 PHE 162 HD2 PHE 162 2.320 5.164 -6.856
64 HE1 PHE 162 HE1 PHE 162 6.925 6.486 -7.970
65 HE2 PHE 162 HE2 PHE 162 3.946 3.462 -7.573
66 HZ PHE 162 HZ PHE 162 6.252 4.122 -8.132
67 H LEU 163 HN LEU 163 0.455 9.728 -6.046
68 HA LEU 163 HA LEU 163 -0.893 8.520 -3.877
69 1HB LEU 163 HB2 LEU 163 -0.159 10.903 -3.990
70 2HB LEU 163 HB1 LEU 163 -1.427 11.197 -5.164
71 HG LEU 163 HG LEU 163 -2.884 10.157 -3.134
72 1HD1 LEU 163 HD11 LEU 163 -0.444 10.468 -1.932
73 2HD1 LEU 163 HD12 LEU 163 -1.997 10.412 -1.098
74 3HD1 LEU 163 HD13 LEU 163 -1.271 11.966 -1.510
75 1HD2 LEU 163 HD21 LEU 163 -3.294 12.597 -2.517
76 2HD2 LEU 163 HD22 LEU 163 -3.569 12.132 -4.196
77 3HD2 LEU 163 HD23 LEU 163 -2.093 12.986 -3.749
78 H PHE 164 HN PHE 164 -1.506 8.434 -7.065
79 HA PHE 164 HA PHE 164 -4.327 8.654 -7.187
80 1HB PHE 164 HB2 PHE 164 -2.166 8.591 -8.925
81 2HB PHE 164 HB1 PHE 164 -2.999 7.073 -9.254
82 HD1 PHE 164 HD1 PHE 164 -2.632 9.715 -10.948
83 HD2 PHE 164 HD2 PHE 164 -5.821 8.054 -8.672
84 HE1 PHE 164 HE1 PHE 164 -4.254 10.917 -12.352
85 HE2 PHE 164 HE2 PHE 164 -7.450 9.252 -10.074
86 HZ PHE 164 HZ PHE 164 -6.667 10.685 -11.917
87 H LEU 165 HN LEU 165 -2.226 5.839 -7.826
88 HA LEU 165 HA LEU 165 -4.307 3.953 -7.416
89 1HB LEU 165 HB2 LEU 165 -2.056 2.460 -7.035
90 2HB LEU 165 HB1 LEU 165 -2.788 2.801 -8.594
91 HG LEU 165 HG LEU 165 -0.764 4.728 -7.564
92 1HD1 LEU 165 HD11 LEU 165 0.858 3.100 -8.907
93 2HD1 LEU 165 HD12 LEU 165 -0.240 1.896 -8.233
94 3HD1 LEU 165 HD13 LEU 165 0.632 2.992 -7.162
95 1HD2 LEU 165 HD21 LEU 165 -0.436 5.215 -9.794
96 2HD2 LEU 165 HD22 LEU 165 -2.149 4.794 -9.772
97 3HD2 LEU 165 HD23 LEU 165 -0.959 3.617 -10.329
98 H LEU 166 HN LEU 166 -1.293 4.185 -5.550
99 HA LEU 166 HA LEU 166 -2.685 4.202 -3.031
100 1HB LEU 166 HB2 LEU 166 -2.961 1.910 -3.391
101 2HB LEU 166 HB1 LEU 166 -1.390 1.743 -4.149
102 HG LEU 166 HG LEU 166 -0.502 2.332 -1.737
103 1HD1 LEU 166 HD11 LEU 166 -2.684 2.844 -0.780
104 2HD1 LEU 166 HD12 LEU 166 -1.956 1.453 0.020
105 3HD1 LEU 166 HD13 LEU 166 -3.243 1.216 -1.162
106 1HD2 LEU 166 HD21 LEU 166 -0.752 -0.160 -1.180
107 2HD2 LEU 166 HD22 LEU 166 0.095 0.278 -2.664
108 3HD2 LEU 166 HD23 LEU 166 -1.575 -0.282 -2.734
109 HA PRO 167 HA PRO 167 1.363 6.308 -2.840
110 1HB PRO 167 HB2 PRO 167 0.636 7.950 -0.766
111 2HB PRO 167 HB1 PRO 167 0.411 8.324 -2.483
112 1HG PRO 167 HG2 PRO 167 -1.553 7.350 -0.475
113 2HG PRO 167 HG1 PRO 167 -1.790 8.445 -1.845
114 1HD PRO 167 HD2 PRO 167 -2.551 5.818 -1.848
115 2HD PRO 167 HD1 PRO 167 -2.143 6.730 -3.313
116 HA PRO 168 HA PRO 168 1.989 4.818 1.584
117 1HB PRO 168 HB2 PRO 168 0.154 3.457 2.890
118 2HB PRO 168 HB1 PRO 168 -0.056 5.199 2.611
119 1HG PRO 168 HG2 PRO 168 -1.287 2.893 1.147
120 2HG PRO 168 HG1 PRO 168 -2.053 4.384 1.725
121 1HD PRO 168 HD2 PRO 168 -1.128 3.968 -0.857
122 2HD PRO 168 HD1 PRO 168 -1.408 5.551 -0.116
123 H ILE 169 HN ILE 169 2.912 3.488 -0.506
124 HA ILE 169 HA ILE 169 2.364 0.672 -0.448
125 HB ILE 169 HB ILE 169 3.314 2.206 -2.367
126 1HG1 ILE 169 HG12 ILE 169 2.700 -0.195 -2.532
127 2HG1 ILE 169 HG11 ILE 169 4.095 0.224 -3.520
128 1HG2 ILE 169 HG21 ILE 169 5.906 1.059 -1.408
129 2HG2 ILE 169 HG22 ILE 169 5.381 2.674 -0.930
130 3HG2 ILE 169 HG23 ILE 169 5.623 2.294 -2.636
131 1HD1 ILE 169 HD11 ILE 169 4.994 -1.603 -2.604
132 2HD1 ILE 169 HD12 ILE 169 3.876 -1.593 -1.241
133 3HD1 ILE 169 HD13 ILE 169 5.299 -0.552 -1.221
134 H ILE 170 HN ILE 170 4.723 2.818 0.934
135 HA ILE 170 HA ILE 170 6.591 0.872 1.795
136 HB ILE 170 HB ILE 170 6.119 3.614 2.965
137 1HG1 ILE 170 HG12 ILE 170 8.331 3.768 1.320
138 2HG1 ILE 170 HG11 ILE 170 7.235 2.739 0.402
139 1HG2 ILE 170 HG21 ILE 170 8.134 1.516 3.388
140 2HG2 ILE 170 HG22 ILE 170 7.615 2.826 4.449
141 3HG2 ILE 170 HG23 ILE 170 8.777 3.143 3.162
142 1HD1 ILE 170 HD11 ILE 170 7.235 5.520 0.550
143 2HD1 ILE 170 HD12 ILE 170 5.827 5.000 1.476
144 3HD1 ILE 170 HD13 ILE 170 6.020 4.486 -0.200
145 H LEU 171 HN LEU 171 3.786 2.373 3.354
146 HA LEU 171 HA LEU 171 4.254 1.295 5.932
147 1HB LEU 171 HB2 LEU 171 1.591 1.994 4.684
148 2HB LEU 171 HB1 LEU 171 1.937 1.849 6.397
149 HG LEU 171 HG LEU 171 3.746 3.762 5.567
150 1HD1 LEU 171 HD11 LEU 171 2.811 5.216 4.065
151 2HD1 LEU 171 HD12 LEU 171 1.169 4.651 4.371
152 3HD1 LEU 171 HD13 LEU 171 2.273 3.673 3.403
153 1HD2 LEU 171 HD21 LEU 171 2.433 3.783 7.626
154 2HD2 LEU 171 HD22 LEU 171 0.982 4.169 6.701
155 3HD2 LEU 171 HD23 LEU 171 2.313 5.324 6.775
156 H ASP 172 HN ASP 172 1.929 0.314 3.433
157 HA ASP 172 HA ASP 172 1.437 -2.229 4.632
158 1HB ASP 172 HB2 ASP 172 0.199 -2.674 2.479
159 2HB ASP 172 HB1 ASP 172 -0.352 -1.254 3.380
160 H ALA 173 HN ALA 173 4.148 -1.172 3.156
161 HA ALA 173 HA ALA 173 4.663 -3.246 1.283
162 1HB ALA 173 HB1 ALA 173 6.022 -0.917 2.252
163 2HB ALA 173 HB2 ALA 173 6.292 -1.822 0.765
164 3HB ALA 173 HB3 ALA 173 7.127 -2.290 2.247
165 H GLY 174 HN GLY 174 6.007 -2.595 4.521
166 1HA GLY 174 HA2 GLY 174 6.598 -5.477 4.775
167 2HA GLY 174 HA1 GLY 174 7.384 -4.183 5.701
168 H TYR 175 HN TYR 175 4.626 -2.918 5.923
169 HA TYR 175 HA TYR 175 2.832 -2.878 7.301
170 1HB TYR 175 HB2 TYR 175 2.468 -5.236 6.479
171 2HB TYR 175 HB1 TYR 175 3.359 -5.800 7.887
172 HD1 TYR 175 HD1 TYR 175 0.209 -4.457 6.667
173 HD2 TYR 175 HD2 TYR 175 2.412 -5.515 10.150
174 HE1 TYR 175 HE1 TYR 175 -1.867 -4.424 7.983
175 HE2 TYR 175 HE2 TYR 175 0.341 -5.484 11.474
176 HH TYR 175 HH TYR 175 -2.549 -5.737 10.376
177 H PHE 176 HN PHE 176 5.949 -3.725 8.295
178 HA PHE 176 HA PHE 176 5.320 -3.526 11.138
179 1HB PHE 176 HB2 PHE 176 7.637 -4.161 11.526
180 2HB PHE 176 HB1 PHE 176 6.898 -5.286 10.377
181 HD1 PHE 176 HD1 PHE 176 9.105 -2.319 10.625
182 HD2 PHE 176 HD2 PHE 176 7.837 -5.626 8.265
183 HE1 PHE 176 HE1 PHE 176 10.927 -1.876 9.032
184 HE2 PHE 176 HE2 PHE 176 9.659 -5.190 6.669
185 HZ PHE 176 HZ PHE 176 11.207 -3.313 7.051
186 H LEU 177 HN LEU 177 5.889 -1.472 8.628
187 HA LEU 177 HA LEU 177 7.773 0.357 9.484
188 1HB LEU 177 HB2 LEU 177 5.494 0.352 7.659
189 2HB LEU 177 HB1 LEU 177 5.819 1.932 8.343
190 HG LEU 177 HG LEU 177 6.917 1.397 6.123
191 1HD1 LEU 177 HD11 LEU 177 8.203 2.507 8.542
192 2HD1 LEU 177 HD12 LEU 177 7.842 3.271 6.993
193 3HD1 LEU 177 HD13 LEU 177 9.242 2.211 7.149
194 1HD2 LEU 177 HD21 LEU 177 7.608 -0.938 7.110
195 2HD2 LEU 177 HD22 LEU 177 9.019 -0.038 7.666
196 3HD2 LEU 177 HD23 LEU 177 8.637 -0.105 5.946
197 HA PRO 178 HA PRO 178 4.102 2.647 11.846
198 1HB PRO 178 HB2 PRO 178 2.432 0.259 12.426
199 2HB PRO 178 HB1 PRO 178 1.936 1.901 12.004
200 1HG PRO 178 HG2 PRO 178 1.737 -0.070 10.232
201 2HG PRO 178 HG1 PRO 178 2.259 1.550 9.730
202 1HD PRO 178 HD2 PRO 178 3.898 -0.912 10.199
203 2HD PRO 178 HD1 PRO 178 4.038 0.309 8.917
204 H LEU 179 HN LEU 179 4.756 -0.752 12.643
205 HA LEU 179 HA LEU 179 4.746 -0.456 15.441
206 1HB LEU 179 HB2 LEU 179 5.967 -2.467 13.577
207 2HB LEU 179 HB1 LEU 179 6.235 -2.565 15.307
208 HG LEU 179 HG LEU 179 3.412 -2.320 14.497
209 1HD1 LEU 179 HD11 LEU 179 3.619 -4.964 14.173
210 2HD1 LEU 179 HD12 LEU 179 5.162 -4.470 13.477
211 3HD1 LEU 179 HD13 LEU 179 3.655 -3.825 12.827
212 1HD2 LEU 179 HD21 LEU 179 4.696 -2.891 16.795
213 2HD2 LEU 179 HD22 LEU 179 4.396 -4.522 16.190
214 3HD2 LEU 179 HD23 LEU 179 3.048 -3.410 16.436
215 H ARG 180 HN ARG 180 7.505 -0.683 13.195
216 HA ARG 180 HA ARG 180 9.311 0.258 15.262
217 1HB ARG 180 HB2 ARG 180 9.662 -0.774 12.460
218 2HB ARG 180 HB1 ARG 180 10.990 0.045 13.294
219 1HG ARG 180 HG2 ARG 180 9.565 -2.453 14.196
220 2HG ARG 180 HG1 ARG 180 11.201 -2.344 13.544
221 1HD ARG 180 HD2 ARG 180 11.823 -2.245 15.697
222 2HD ARG 180 HD1 ARG 180 11.317 -0.560 15.594
223 HE ARG 180 HE ARG 180 9.064 -2.029 16.253
224 1HH1 ARG 180 1HH1 ARG 180 12.185 -1.341 17.655
225 2HH1 ARG 180 2HH1 ARG 180 11.624 -1.488 19.286
226 1HH2 ARG 180 1HH2 ARG 180 8.323 -2.221 18.399
227 2HH2 ARG 180 2HH2 ARG 180 9.431 -1.988 19.709
228 1HG HSL 181 HG1 HSL 181 5.379 5.822 14.363
229 2HG HSL 181 HG2 HSL 181 5.399 4.136 15.100
230 H HSL 181 HN HSL 181 7.464 2.151 14.880
231 HA HSL 181 HA HSL 181 8.897 4.316 13.248
232 1HB HSL 181 HB1 HSL 181 6.871 5.260 12.602
233 2HB HSL 181 HB2 HSL 181 6.201 3.566 12.890
Start of MODEL 94
1 1H PHE 155 HT1 PHE 155 -14.135 -2.796 -8.379
2 2H PHE 155 HT2 PHE 155 -13.629 -3.121 -6.771
3 3H PHE 155 HT3 PHE 155 -12.478 -2.668 -7.960
4 HA PHE 155 HA PHE 155 -13.602 -0.539 -8.180
5 1HB PHE 155 HB2 PHE 155 -15.042 -1.402 -5.666
6 2HB PHE 155 HB1 PHE 155 -15.282 0.084 -6.580
7 HD1 PHE 155 HD1 PHE 155 -16.576 -3.080 -5.937
8 HD2 PHE 155 HD2 PHE 155 -15.941 -0.334 -9.126
9 HE1 PHE 155 HE1 PHE 155 -18.365 -4.171 -7.228
10 HE2 PHE 155 HE2 PHE 155 -17.729 -1.419 -10.423
11 HZ PHE 155 HZ PHE 155 -18.943 -3.340 -9.473
12 H LEU 156 HN LEU 156 -12.458 1.104 -7.263
13 HA LEU 156 HA LEU 156 -10.746 2.077 -6.118
14 1HB LEU 156 HB2 LEU 156 -12.347 0.703 -3.998
15 2HB LEU 156 HB1 LEU 156 -10.860 1.525 -3.563
16 HG LEU 156 HG LEU 156 -13.045 2.927 -5.079
17 1HD1 LEU 156 HD11 LEU 156 -14.025 2.039 -3.027
18 2HD1 LEU 156 HD12 LEU 156 -13.863 3.794 -2.956
19 3HD1 LEU 156 HD13 LEU 156 -12.722 2.766 -2.087
20 1HD2 LEU 156 HD21 LEU 156 -11.925 4.871 -4.580
21 2HD2 LEU 156 HD22 LEU 156 -10.580 3.747 -4.783
22 3HD2 LEU 156 HD23 LEU 156 -11.133 4.179 -3.165
23 H GLN 157 HN GLN 157 -9.630 0.191 -7.484
24 HA GLN 157 HA GLN 157 -7.714 -1.033 -7.623
25 1HB GLN 157 HB2 GLN 157 -7.094 0.520 -5.605
26 2HB GLN 157 HB1 GLN 157 -7.319 -0.942 -4.656
27 1HG GLN 157 HG2 GLN 157 -5.727 -1.835 -6.675
28 2HG GLN 157 HG1 GLN 157 -5.153 -0.182 -6.463
29 1HE2 GLN 157 HE21 GLN 157 -5.452 -3.322 -5.035
30 2HE2 GLN 157 HE22 GLN 157 -4.411 -3.038 -3.686
31 H SER 158 HN SER 158 -10.388 -2.142 -7.019
32 HA SER 158 HA SER 158 -11.386 -4.127 -6.533
33 1HB SER 158 HB2 SER 158 -9.314 -4.680 -8.140
34 2HB SER 158 HB1 SER 158 -8.811 -5.608 -6.718
35 HG SER 158 HG SER 158 -10.959 -5.999 -8.441
36 H ASP 159 HN ASP 159 -10.728 -2.712 -4.281
37 HA ASP 159 HA ASP 159 -10.653 -4.798 -2.321
38 1HB ASP 159 HB2 ASP 159 -8.267 -3.061 -2.769
39 2HB ASP 159 HB1 ASP 159 -8.700 -3.468 -1.112
40 H VAL 160 HN VAL 160 -10.029 -1.305 -2.617
41 HA VAL 160 HA VAL 160 -10.962 0.509 -1.733
42 HB VAL 160 HB VAL 160 -13.128 0.593 -1.974
43 1HG1 VAL 160 HG11 VAL 160 -14.292 -1.096 -2.973
44 2HG1 VAL 160 HG12 VAL 160 -13.608 -2.337 -1.928
45 3HG1 VAL 160 HG13 VAL 160 -12.630 -1.629 -3.214
46 1HG2 VAL 160 HG21 VAL 160 -14.736 -0.275 -0.393
47 2HG2 VAL 160 HG22 VAL 160 -13.329 0.344 0.469
48 3HG2 VAL 160 HG23 VAL 160 -13.537 -1.394 0.252
49 H PHE 161 HN PHE 161 -11.754 -2.228 0.415
50 HA PHE 161 HA PHE 161 -11.194 -0.681 2.758
51 1HB PHE 161 HB2 PHE 161 -11.692 -2.640 3.998
52 2HB PHE 161 HB1 PHE 161 -12.783 -2.674 2.622
53 HD1 PHE 161 HD1 PHE 161 -10.425 -3.595 0.701
54 HD2 PHE 161 HD2 PHE 161 -12.008 -5.000 4.394
55 HE1 PHE 161 HE1 PHE 161 -9.659 -5.867 0.161
56 HE2 PHE 161 HE2 PHE 161 -11.241 -7.275 3.860
57 HZ PHE 161 HZ PHE 161 -10.065 -7.711 1.742
58 H PHE 162 HN PHE 162 -9.085 -0.316 1.162
59 HA PHE 162 HA PHE 162 -6.915 -1.260 2.706
60 1HB PHE 162 HB2 PHE 162 -7.425 -2.496 0.051
61 2HB PHE 162 HB1 PHE 162 -5.762 -2.195 0.556
62 HD1 PHE 162 HD1 PHE 162 -5.845 -2.775 3.408
63 HD2 PHE 162 HD2 PHE 162 -7.719 -4.788 0.162
64 HE1 PHE 162 HE1 PHE 162 -5.852 -4.862 4.711
65 HE2 PHE 162 HE2 PHE 162 -7.731 -6.879 1.459
66 HZ PHE 162 HZ PHE 162 -6.796 -6.917 3.737
67 H LEU 163 HN LEU 163 -8.105 0.453 -0.113
68 HA LEU 163 HA LEU 163 -5.729 1.713 -0.892
69 1HB LEU 163 HB2 LEU 163 -8.634 2.401 -1.112
70 2HB LEU 163 HB1 LEU 163 -7.445 3.623 -1.516
71 HG LEU 163 HG LEU 163 -7.802 0.939 -2.847
72 1HD1 LEU 163 HD11 LEU 163 -9.382 2.844 -3.381
73 2HD1 LEU 163 HD12 LEU 163 -8.503 2.148 -4.744
74 3HD1 LEU 163 HD13 LEU 163 -7.985 3.685 -4.052
75 1HD2 LEU 163 HD21 LEU 163 -5.642 3.010 -3.125
76 2HD2 LEU 163 HD22 LEU 163 -6.018 1.859 -4.407
77 3HD2 LEU 163 HD23 LEU 163 -5.474 1.279 -2.833
78 H PHE 164 HN PHE 164 -8.027 2.325 1.650
79 HA PHE 164 HA PHE 164 -8.090 3.815 3.377
80 1HB PHE 164 HB2 PHE 164 -5.921 2.214 3.526
81 2HB PHE 164 HB1 PHE 164 -5.135 3.795 3.561
82 HD1 PHE 164 HD1 PHE 164 -5.171 5.132 5.499
83 HD2 PHE 164 HD2 PHE 164 -7.640 1.674 5.260
84 HE1 PHE 164 HE1 PHE 164 -5.681 5.335 7.898
85 HE2 PHE 164 HE2 PHE 164 -8.156 1.870 7.658
86 HZ PHE 164 HZ PHE 164 -7.175 3.703 8.980
87 H LEU 165 HN LEU 165 -8.123 5.153 0.917
88 HA LEU 165 HA LEU 165 -8.181 7.390 0.341
89 1HB LEU 165 HB2 LEU 165 -7.362 7.645 2.926
90 2HB LEU 165 HB1 LEU 165 -5.964 8.271 2.063
91 HG LEU 165 HG LEU 165 -8.441 9.388 1.032
92 1HD1 LEU 165 HD11 LEU 165 -7.856 9.682 3.968
93 2HD1 LEU 165 HD12 LEU 165 -9.356 9.152 3.207
94 3HD1 LEU 165 HD13 LEU 165 -8.834 10.829 3.052
95 1HD2 LEU 165 HD21 LEU 165 -7.185 11.267 0.861
96 2HD2 LEU 165 HD22 LEU 165 -5.871 10.101 1.016
97 3HD2 LEU 165 HD23 LEU 165 -6.402 11.022 2.423
98 H LEU 166 HN LEU 166 -5.213 5.646 0.854
99 HA LEU 166 HA LEU 166 -4.271 6.357 -1.760
100 1HB LEU 166 HB2 LEU 166 -3.530 7.979 0.402
101 2HB LEU 166 HB1 LEU 166 -2.133 6.959 0.093
102 HG LEU 166 HG LEU 166 -2.638 7.736 -2.424
103 1HD1 LEU 166 HD11 LEU 166 -3.100 10.263 -2.179
104 2HD1 LEU 166 HD12 LEU 166 -3.839 9.818 -0.641
105 3HD1 LEU 166 HD13 LEU 166 -4.462 9.144 -2.147
106 1HD2 LEU 166 HD21 LEU 166 -1.096 9.798 -1.677
107 2HD2 LEU 166 HD22 LEU 166 -0.497 8.146 -1.820
108 3HD2 LEU 166 HD23 LEU 166 -0.950 8.787 -0.240
109 HA PRO 167 HA PRO 167 -2.836 2.175 -1.403
110 1HB PRO 167 HB2 PRO 167 -0.669 2.469 -3.161
111 2HB PRO 167 HB1 PRO 167 -2.317 1.987 -3.599
112 1HG PRO 167 HG2 PRO 167 -1.013 4.665 -3.763
113 2HG PRO 167 HG1 PRO 167 -2.197 3.920 -4.852
114 1HD PRO 167 HD2 PRO 167 -2.915 5.832 -3.123
115 2HD PRO 167 HD1 PRO 167 -3.989 4.459 -3.472
116 HA PRO 168 HA PRO 168 0.412 3.156 1.631
117 1HB PRO 168 HB2 PRO 168 0.094 0.908 3.102
118 2HB PRO 168 HB1 PRO 168 -0.999 2.300 3.246
119 1HG PRO 168 HG2 PRO 168 -1.365 -0.246 1.703
120 2HG PRO 168 HG1 PRO 168 -2.523 0.608 2.741
121 1HD PRO 168 HD2 PRO 168 -2.554 0.817 0.041
122 2HD PRO 168 HD1 PRO 168 -3.039 2.150 1.107
123 H ILE 169 HN ILE 169 1.915 2.850 -0.181
124 HA ILE 169 HA ILE 169 2.856 0.229 -0.852
125 HB ILE 169 HB ILE 169 2.993 2.342 -2.299
126 1HG1 ILE 169 HG12 ILE 169 4.070 0.149 -2.814
127 2HG1 ILE 169 HG11 ILE 169 4.936 1.532 -3.471
128 1HG2 ILE 169 HG21 ILE 169 4.018 3.808 -0.629
129 2HG2 ILE 169 HG22 ILE 169 5.007 3.697 -2.085
130 3HG2 ILE 169 HG23 ILE 169 5.472 2.807 -0.634
131 1HD1 ILE 169 HD11 ILE 169 6.160 1.208 -1.064
132 2HD1 ILE 169 HD12 ILE 169 6.733 0.547 -2.595
133 3HD1 ILE 169 HD13 ILE 169 5.774 -0.455 -1.505
134 H ILE 170 HN ILE 170 4.045 2.877 1.113
135 HA ILE 170 HA ILE 170 6.394 1.506 1.963
136 HB ILE 170 HB ILE 170 6.773 3.455 3.367
137 1HG1 ILE 170 HG12 ILE 170 3.933 3.915 2.691
138 2HG1 ILE 170 HG11 ILE 170 4.795 4.259 4.182
139 1HG2 ILE 170 HG21 ILE 170 7.299 4.904 1.633
140 2HG2 ILE 170 HG22 ILE 170 5.858 4.476 0.712
141 3HG2 ILE 170 HG23 ILE 170 7.200 3.339 0.828
142 1HD1 ILE 170 HD11 ILE 170 4.377 6.377 3.475
143 2HD1 ILE 170 HD12 ILE 170 4.417 5.931 1.767
144 3HD1 ILE 170 HD13 ILE 170 5.925 6.108 2.669
145 H LEU 171 HN LEU 171 3.325 2.402 3.508
146 HA LEU 171 HA LEU 171 3.975 1.314 6.041
147 1HB LEU 171 HB2 LEU 171 1.178 1.534 4.967
148 2HB LEU 171 HB1 LEU 171 1.721 1.679 6.628
149 HG LEU 171 HG LEU 171 2.132 3.689 4.415
150 1HD1 LEU 171 HD11 LEU 171 0.826 4.415 6.947
151 2HD1 LEU 171 HD12 LEU 171 -0.078 3.308 5.915
152 3HD1 LEU 171 HD13 LEU 171 0.434 4.874 5.290
153 1HD2 LEU 171 HD21 LEU 171 3.380 5.020 5.889
154 2HD2 LEU 171 HD22 LEU 171 4.061 3.402 6.057
155 3HD2 LEU 171 HD23 LEU 171 2.956 4.025 7.282
156 H ASP 172 HN ASP 172 1.888 0.107 3.433
157 HA ASP 172 HA ASP 172 1.655 -2.496 4.590
158 1HB ASP 172 HB2 ASP 172 0.195 -1.084 2.749
159 2HB ASP 172 HB1 ASP 172 1.045 -2.248 1.722
160 H ALA 173 HN ALA 173 4.303 -1.125 3.342
161 HA ALA 173 HA ALA 173 5.177 -3.081 1.460
162 1HB ALA 173 HB1 ALA 173 6.730 -1.541 1.070
163 2HB ALA 173 HB2 ALA 173 7.400 -1.780 2.684
164 3HB ALA 173 HB3 ALA 173 6.122 -0.594 2.426
165 H GLY 174 HN GLY 174 5.844 -2.406 4.865
166 1HA GLY 174 HA2 GLY 174 6.836 -5.179 5.152
167 2HA GLY 174 HA1 GLY 174 7.515 -3.810 6.056
168 H TYR 175 HN TYR 175 4.329 -3.171 5.843
169 HA TYR 175 HA TYR 175 2.613 -3.105 7.259
170 1HB TYR 175 HB2 TYR 175 2.377 -5.496 8.539
171 2HB TYR 175 HB1 TYR 175 1.764 -5.134 6.933
172 HD1 TYR 175 HD1 TYR 175 3.283 -5.703 4.938
173 HD2 TYR 175 HD2 TYR 175 3.892 -7.239 8.859
174 HE1 TYR 175 HE1 TYR 175 4.632 -7.535 4.005
175 HE2 TYR 175 HE2 TYR 175 5.246 -9.074 7.936
176 HH TYR 175 HH TYR 175 6.264 -9.128 4.632
177 H PHE 176 HN PHE 176 5.324 -4.733 8.944
178 HA PHE 176 HA PHE 176 4.459 -3.537 11.446
179 1HB PHE 176 HB2 PHE 176 6.216 -4.871 12.479
180 2HB PHE 176 HB1 PHE 176 5.239 -5.884 11.407
181 HD1 PHE 176 HD1 PHE 176 8.449 -4.045 11.654
182 HD2 PHE 176 HD2 PHE 176 6.227 -7.072 9.650
183 HE1 PHE 176 HE1 PHE 176 10.490 -4.762 10.481
184 HE2 PHE 176 HE2 PHE 176 8.264 -7.795 8.474
185 HZ PHE 176 HZ PHE 176 10.399 -6.639 8.890
186 H LEU 177 HN LEU 177 5.905 -2.233 8.946
187 HA LEU 177 HA LEU 177 8.323 -1.171 9.992
188 1HB LEU 177 HB2 LEU 177 8.510 -0.809 7.801
189 2HB LEU 177 HB1 LEU 177 6.786 -0.998 7.554
190 HG LEU 177 HG LEU 177 6.489 1.393 8.205
191 1HD1 LEU 177 HD11 LEU 177 8.863 2.598 7.801
192 2HD1 LEU 177 HD12 LEU 177 9.390 1.131 8.627
193 3HD1 LEU 177 HD13 LEU 177 8.220 2.204 9.394
194 1HD2 LEU 177 HD21 LEU 177 6.579 1.885 6.035
195 2HD2 LEU 177 HD22 LEU 177 7.303 0.296 5.792
196 3HD2 LEU 177 HD23 LEU 177 8.333 1.713 5.995
197 HA PRO 178 HA PRO 178 5.534 2.785 10.776
198 1HB PRO 178 HB2 PRO 178 2.901 1.471 11.137
199 2HB PRO 178 HB1 PRO 178 3.302 2.976 10.305
200 1HG PRO 178 HG2 PRO 178 2.648 0.787 8.931
201 2HG PRO 178 HG1 PRO 178 3.915 1.885 8.352
202 1HD PRO 178 HD2 PRO 178 4.187 -0.752 9.745
203 2HD PRO 178 HD1 PRO 178 5.109 -0.104 8.373
204 H LEU 179 HN LEU 179 6.939 2.094 12.622
205 HA LEU 179 HA LEU 179 5.517 0.902 14.873
206 1HB LEU 179 HB2 LEU 179 8.126 0.737 14.001
207 2HB LEU 179 HB1 LEU 179 8.242 1.843 15.356
208 HG LEU 179 HG LEU 179 8.659 -0.369 16.164
209 1HD1 LEU 179 HD11 LEU 179 5.823 0.068 16.996
210 2HD1 LEU 179 HD12 LEU 179 7.060 1.255 17.409
211 3HD1 LEU 179 HD13 LEU 179 7.216 -0.411 17.966
212 1HD2 LEU 179 HD21 LEU 179 7.132 -1.272 14.151
213 2HD2 LEU 179 HD22 LEU 179 5.991 -1.431 15.487
214 3HD2 LEU 179 HD23 LEU 179 7.554 -2.244 15.561
215 H ARG 180 HN ARG 180 7.659 3.732 14.488
216 HA ARG 180 HA ARG 180 6.385 5.020 16.753
217 1HB ARG 180 HB2 ARG 180 8.503 6.213 14.968
218 2HB ARG 180 HB1 ARG 180 8.126 6.630 16.644
219 1HG ARG 180 HG2 ARG 180 9.803 5.296 17.224
220 2HG ARG 180 HG1 ARG 180 8.774 3.941 16.756
221 1HD ARG 180 HD2 ARG 180 9.795 4.766 14.351
222 2HD ARG 180 HD1 ARG 180 11.146 5.042 15.451
223 HE ARG 180 HE ARG 180 10.113 2.496 15.957
224 1HH1 ARG 180 1HH1 ARG 180 11.794 4.213 13.428
225 2HH1 ARG 180 2HH1 ARG 180 12.573 2.796 12.810
226 1HH2 ARG 180 1HH2 ARG 180 11.138 0.631 15.151
227 2HH2 ARG 180 2HH2 ARG 180 12.201 0.761 13.790
228 1HG HSL 181 HG1 HSL 181 2.683 7.258 10.987
229 2HG HSL 181 HG2 HSL 181 2.704 5.540 10.325
230 H HSL 181 HN HSL 181 5.177 4.492 13.957
231 HA HSL 181 HA HSL 181 4.188 7.348 13.444
232 1HB HSL 181 HB1 HSL 181 5.027 6.827 11.287
233 2HB HSL 181 HB2 HSL 181 4.748 5.017 11.516
Start of MODEL 95
1 1H PHE 155 HT1 PHE 155 4.313 6.964 -13.372
2 2H PHE 155 HT2 PHE 155 3.892 5.430 -12.729
3 3H PHE 155 HT3 PHE 155 3.639 6.849 -11.800
4 HA PHE 155 HA PHE 155 2.268 6.056 -14.267
5 1HB PHE 155 HB2 PHE 155 1.838 5.316 -11.670
6 2HB PHE 155 HB1 PHE 155 0.778 6.709 -11.832
7 HD1 PHE 155 HD1 PHE 155 0.239 3.607 -11.488
8 HD2 PHE 155 HD2 PHE 155 0.072 6.332 -14.754
9 HE1 PHE 155 HE1 PHE 155 -1.443 2.184 -12.585
10 HE2 PHE 155 HE2 PHE 155 -1.610 4.915 -15.855
11 HZ PHE 155 HZ PHE 155 -2.369 2.837 -14.772
12 H LEU 156 HN LEU 156 3.565 8.638 -12.636
13 HA LEU 156 HA LEU 156 3.384 10.866 -12.879
14 1HB LEU 156 HB2 LEU 156 2.031 9.837 -15.288
15 2HB LEU 156 HB1 LEU 156 1.654 11.494 -14.858
16 HG LEU 156 HG LEU 156 4.439 10.425 -15.313
17 1HD1 LEU 156 HD11 LEU 156 4.085 12.186 -17.282
18 2HD1 LEU 156 HD12 LEU 156 2.420 11.629 -17.110
19 3HD1 LEU 156 HD13 LEU 156 3.705 10.471 -17.456
20 1HD2 LEU 156 HD21 LEU 156 3.344 12.997 -14.359
21 2HD2 LEU 156 HD22 LEU 156 4.647 13.085 -15.543
22 3HD2 LEU 156 HD23 LEU 156 4.894 12.226 -14.022
23 H GLN 157 HN GLN 157 2.415 11.770 -11.177
24 HA GLN 157 HA GLN 157 -0.317 12.491 -11.260
25 1HB GLN 157 HB2 GLN 157 -0.149 9.969 -10.462
26 2HB GLN 157 HB1 GLN 157 0.172 10.741 -8.918
27 1HG GLN 157 HG2 GLN 157 -2.119 11.860 -10.336
28 2HG GLN 157 HG1 GLN 157 -2.294 10.155 -9.920
29 1HE2 GLN 157 HE21 GLN 157 -2.028 9.555 -7.687
30 2HE2 GLN 157 HE22 GLN 157 -2.417 10.688 -6.442
31 H SER 158 HN SER 158 1.726 11.647 -8.550
32 HA SER 158 HA SER 158 2.665 14.246 -8.031
33 1HB SER 158 HB2 SER 158 0.439 14.819 -7.345
34 2HB SER 158 HB1 SER 158 0.274 13.313 -6.426
35 HG SER 158 HG SER 158 1.515 14.113 -4.858
36 H ASP 159 HN ASP 159 1.832 11.065 -6.883
37 HA ASP 159 HA ASP 159 3.766 11.050 -4.757
38 1HB ASP 159 HB2 ASP 159 1.791 9.167 -5.891
39 2HB ASP 159 HB1 ASP 159 3.222 8.421 -5.187
40 H VAL 160 HN VAL 160 3.503 9.293 -7.844
41 HA VAL 160 HA VAL 160 5.041 8.461 -9.278
42 HB VAL 160 HB VAL 160 5.949 10.987 -8.668
43 1HG1 VAL 160 HG11 VAL 160 7.658 10.191 -7.145
44 2HG1 VAL 160 HG12 VAL 160 8.401 10.845 -8.603
45 3HG1 VAL 160 HG13 VAL 160 8.286 9.101 -8.382
46 1HG2 VAL 160 HG21 VAL 160 7.399 10.650 -10.713
47 2HG2 VAL 160 HG22 VAL 160 5.687 10.268 -10.893
48 3HG2 VAL 160 HG23 VAL 160 6.864 8.970 -10.695
49 H PHE 161 HN PHE 161 6.621 8.947 -6.116
50 HA PHE 161 HA PHE 161 8.338 6.699 -6.404
51 1HB PHE 161 HB2 PHE 161 7.718 8.675 -4.276
52 2HB PHE 161 HB1 PHE 161 8.391 7.133 -3.755
53 HD1 PHE 161 HD1 PHE 161 10.656 6.524 -4.273
54 HD2 PHE 161 HD2 PHE 161 9.012 10.196 -5.661
55 HE1 PHE 161 HE1 PHE 161 12.915 7.318 -4.836
56 HE2 PHE 161 HE2 PHE 161 11.268 10.996 -6.228
57 HZ PHE 161 HZ PHE 161 13.224 9.556 -5.816
58 H PHE 162 HN PHE 162 5.090 6.800 -6.038
59 HA PHE 162 HA PHE 162 4.960 4.083 -5.180
60 1HB PHE 162 HB2 PHE 162 3.139 5.651 -3.516
61 2HB PHE 162 HB1 PHE 162 4.143 4.262 -3.101
62 HD1 PHE 162 HD1 PHE 162 6.223 4.546 -2.009
63 HD2 PHE 162 HD2 PHE 162 4.103 7.933 -3.470
64 HE1 PHE 162 HE1 PHE 162 7.743 6.028 -0.765
65 HE2 PHE 162 HE2 PHE 162 5.619 9.422 -2.231
66 HZ PHE 162 HZ PHE 162 7.442 8.470 -0.876
67 H LEU 163 HN LEU 163 4.081 6.204 -7.294
68 HA LEU 163 HA LEU 163 1.239 6.070 -7.369
69 1HB LEU 163 HB2 LEU 163 3.413 7.013 -9.092
70 2HB LEU 163 HB1 LEU 163 2.071 6.333 -9.992
71 HG LEU 163 HG LEU 163 1.746 8.500 -7.929
72 1HD1 LEU 163 HD11 LEU 163 3.175 8.916 -10.117
73 2HD1 LEU 163 HD12 LEU 163 2.033 10.113 -9.515
74 3HD1 LEU 163 HD13 LEU 163 1.573 9.048 -10.840
75 1HD2 LEU 163 HD21 LEU 163 -0.125 7.945 -10.182
76 2HD2 LEU 163 HD22 LEU 163 -0.447 8.643 -8.594
77 3HD2 LEU 163 HD23 LEU 163 -0.167 6.909 -8.756
78 H PHE 164 HN PHE 164 3.690 3.866 -7.775
79 HA PHE 164 HA PHE 164 2.528 2.186 -9.788
80 1HB PHE 164 HB2 PHE 164 4.891 2.125 -7.985
81 2HB PHE 164 HB1 PHE 164 4.313 0.578 -8.598
82 HD1 PHE 164 HD1 PHE 164 5.742 3.829 -9.521
83 HD2 PHE 164 HD2 PHE 164 4.559 -0.020 -10.901
84 HE1 PHE 164 HE1 PHE 164 6.947 4.219 -11.632
85 HE2 PHE 164 HE2 PHE 164 5.762 0.364 -13.013
86 HZ PHE 164 HZ PHE 164 6.958 2.485 -13.380
87 H LEU 165 HN LEU 165 3.503 1.001 -6.602
88 HA LEU 165 HA LEU 165 1.389 -0.883 -6.511
89 1HB LEU 165 HB2 LEU 165 3.748 -0.311 -5.027
90 2HB LEU 165 HB1 LEU 165 2.413 -0.457 -3.900
91 HG LEU 165 HG LEU 165 2.014 -2.642 -5.491
92 1HD1 LEU 165 HD11 LEU 165 3.980 -2.497 -6.766
93 2HD1 LEU 165 HD12 LEU 165 4.315 -3.717 -5.536
94 3HD1 LEU 165 HD13 LEU 165 4.961 -2.085 -5.360
95 1HD2 LEU 165 HD21 LEU 165 1.842 -3.057 -3.258
96 2HD2 LEU 165 HD22 LEU 165 3.306 -2.156 -2.863
97 3HD2 LEU 165 HD23 LEU 165 3.427 -3.773 -3.557
98 H LEU 166 HN LEU 166 2.054 1.765 -4.232
99 HA LEU 166 HA LEU 166 -0.678 2.650 -4.270
100 1HB LEU 166 HB2 LEU 166 0.073 0.607 -2.456
101 2HB LEU 166 HB1 LEU 166 -0.140 2.068 -1.518
102 HG LEU 166 HG LEU 166 -2.349 1.890 -3.289
103 1HD1 LEU 166 HD11 LEU 166 -3.263 -0.218 -2.986
104 2HD1 LEU 166 HD12 LEU 166 -2.184 -0.605 -1.645
105 3HD1 LEU 166 HD13 LEU 166 -1.562 -0.568 -3.295
106 1HD2 LEU 166 HD21 LEU 166 -1.845 1.843 -0.364
107 2HD2 LEU 166 HD22 LEU 166 -3.439 1.351 -0.936
108 3HD2 LEU 166 HD23 LEU 166 -2.817 2.953 -1.329
109 HA PRO 167 HA PRO 167 0.809 6.642 -3.261
110 1HB PRO 167 HB2 PRO 167 -0.634 6.849 -0.769
111 2HB PRO 167 HB1 PRO 167 -0.939 7.678 -2.303
112 1HG PRO 167 HG2 PRO 167 -2.228 5.293 -1.193
113 2HG PRO 167 HG1 PRO 167 -2.765 6.353 -2.504
114 1HD PRO 167 HD2 PRO 167 -1.905 3.809 -2.914
115 2HD PRO 167 HD1 PRO 167 -1.704 5.100 -4.117
116 HA PRO 168 HA PRO 168 2.891 6.019 0.878
117 1HB PRO 168 HB2 PRO 168 2.165 4.107 2.586
118 2HB PRO 168 HB1 PRO 168 1.225 5.598 2.380
119 1HG PRO 168 HG2 PRO 168 0.672 2.859 1.332
120 2HG PRO 168 HG1 PRO 168 -0.451 4.070 1.970
121 1HD PRO 168 HD2 PRO 168 0.066 3.605 -0.727
122 2HD PRO 168 HD1 PRO 168 -0.694 5.055 -0.053
123 H ILE 169 HN ILE 169 2.118 2.556 0.348
124 HA ILE 169 HA ILE 169 3.397 0.848 -0.463
125 HB ILE 169 HB ILE 169 4.631 2.990 -1.654
126 1HG1 ILE 169 HG12 ILE 169 6.001 0.449 -2.157
127 2HG1 ILE 169 HG11 ILE 169 4.246 0.310 -2.151
128 1HG2 ILE 169 HG21 ILE 169 6.293 3.002 0.242
129 2HG2 ILE 169 HG22 ILE 169 6.985 2.858 -1.373
130 3HG2 ILE 169 HG23 ILE 169 6.849 1.435 -0.343
131 1HD1 ILE 169 HD11 ILE 169 4.028 1.432 -4.078
132 2HD1 ILE 169 HD12 ILE 169 5.716 0.976 -4.306
133 3HD1 ILE 169 HD13 ILE 169 5.311 2.574 -3.682
134 H ILE 170 HN ILE 170 4.936 3.038 1.828
135 HA ILE 170 HA ILE 170 6.720 1.131 2.926
136 HB ILE 170 HB ILE 170 5.695 3.651 4.224
137 1HG1 ILE 170 HG12 ILE 170 8.149 4.289 3.243
138 2HG1 ILE 170 HG11 ILE 170 7.566 3.201 1.987
139 1HG2 ILE 170 HG21 ILE 170 7.824 1.701 4.853
140 2HG2 ILE 170 HG22 ILE 170 6.853 2.709 5.926
141 3HG2 ILE 170 HG23 ILE 170 8.227 3.404 5.066
142 1HD1 ILE 170 HD11 ILE 170 5.411 4.842 2.424
143 2HD1 ILE 170 HD12 ILE 170 6.588 4.997 1.119
144 3HD1 ILE 170 HD13 ILE 170 6.789 5.928 2.604
145 H LEU 171 HN LEU 171 3.487 2.262 3.834
146 HA LEU 171 HA LEU 171 3.354 0.897 6.309
147 1HB LEU 171 HB2 LEU 171 1.237 1.869 4.395
148 2HB LEU 171 HB1 LEU 171 0.833 1.062 5.896
149 HG LEU 171 HG LEU 171 0.740 3.582 5.936
150 1HD1 LEU 171 HD11 LEU 171 0.911 3.342 8.130
151 2HD1 LEU 171 HD12 LEU 171 2.660 3.151 8.022
152 3HD1 LEU 171 HD13 LEU 171 1.608 1.745 7.865
153 1HD2 LEU 171 HD21 LEU 171 2.762 3.975 4.595
154 2HD2 LEU 171 HD22 LEU 171 3.744 3.318 5.905
155 3HD2 LEU 171 HD23 LEU 171 2.823 4.802 6.151
156 H ASP 172 HN ASP 172 1.853 0.111 3.198
157 HA ASP 172 HA ASP 172 1.299 -2.590 3.934
158 1HB ASP 172 HB2 ASP 172 -0.089 -1.243 2.338
159 2HB ASP 172 HB1 ASP 172 1.234 -1.366 1.169
160 H ALA 173 HN ALA 173 4.197 -1.235 3.349
161 HA ALA 173 HA ALA 173 5.324 -3.016 1.432
162 1HB ALA 173 HB1 ALA 173 6.903 -1.448 1.527
163 2HB ALA 173 HB2 ALA 173 7.391 -2.099 3.092
164 3HB ALA 173 HB3 ALA 173 6.218 -0.785 3.011
165 H GLY 174 HN GLY 174 6.098 -2.674 4.876
166 1HA GLY 174 HA2 GLY 174 6.460 -5.603 5.017
167 2HA GLY 174 HA1 GLY 174 7.282 -4.428 6.063
168 H TYR 175 HN TYR 175 4.546 -2.980 6.048
169 HA TYR 175 HA TYR 175 2.634 -2.883 7.257
170 1HB TYR 175 HB2 TYR 175 2.205 -5.204 6.468
171 2HB TYR 175 HB1 TYR 175 3.066 -5.814 7.877
172 HD1 TYR 175 HD1 TYR 175 -0.018 -4.267 6.675
173 HD2 TYR 175 HD2 TYR 175 2.086 -5.650 10.105
174 HE1 TYR 175 HE1 TYR 175 -2.105 -4.203 7.974
175 HE2 TYR 175 HE2 TYR 175 0.005 -5.590 11.413
176 HH TYR 175 HH TYR 175 -2.746 -5.729 10.502
177 H PHE 176 HN PHE 176 5.620 -3.906 8.559
178 HA PHE 176 HA PHE 176 4.729 -3.315 11.292
179 1HB PHE 176 HB2 PHE 176 7.090 -4.860 10.225
180 2HB PHE 176 HB1 PHE 176 6.969 -4.358 11.917
181 HD1 PHE 176 HD1 PHE 176 6.875 -7.158 10.237
182 HD2 PHE 176 HD2 PHE 176 4.140 -4.803 12.493
183 HE1 PHE 176 HE1 PHE 176 5.551 -9.172 10.729
184 HE2 PHE 176 HE2 PHE 176 2.812 -6.814 12.989
185 HZ PHE 176 HZ PHE 176 3.517 -9.002 12.106
186 H LEU 177 HN LEU 177 6.691 -2.209 8.685
187 HA LEU 177 HA LEU 177 8.662 -0.722 9.865
188 1HB LEU 177 HB2 LEU 177 6.997 0.228 7.538
189 2HB LEU 177 HB1 LEU 177 8.644 0.693 7.916
190 HG LEU 177 HG LEU 177 7.723 -2.038 7.017
191 1HD1 LEU 177 HD11 LEU 177 8.918 -1.581 4.997
192 2HD1 LEU 177 HD12 LEU 177 9.511 -0.047 5.636
193 3HD1 LEU 177 HD13 LEU 177 7.794 -0.253 5.286
194 1HD2 LEU 177 HD21 LEU 177 10.490 -1.051 7.697
195 2HD2 LEU 177 HD22 LEU 177 10.098 -2.620 6.995
196 3HD2 LEU 177 HD23 LEU 177 9.548 -2.220 8.621
197 HA PRO 178 HA PRO 178 5.430 2.928 10.406
198 1HB PRO 178 HB2 PRO 178 2.991 1.361 10.979
199 2HB PRO 178 HB1 PRO 178 3.193 2.802 9.981
200 1HG PRO 178 HG2 PRO 178 2.760 0.408 8.876
201 2HG PRO 178 HG1 PRO 178 3.851 1.588 8.124
202 1HD PRO 178 HD2 PRO 178 4.512 -0.829 9.764
203 2HD PRO 178 HD1 PRO 178 5.287 -0.227 8.284
204 H LEU 179 HN LEU 179 7.038 2.347 12.218
205 HA LEU 179 HA LEU 179 5.934 1.171 14.597
206 1HB LEU 179 HB2 LEU 179 8.382 2.882 14.635
207 2HB LEU 179 HB1 LEU 179 8.030 1.428 15.548
208 HG LEU 179 HG LEU 179 8.102 0.550 12.913
209 1HD1 LEU 179 HD11 LEU 179 10.356 2.495 13.388
210 2HD1 LEU 179 HD12 LEU 179 9.054 2.688 12.213
211 3HD1 LEU 179 HD13 LEU 179 10.218 1.375 12.033
212 1HD2 LEU 179 HD21 LEU 179 10.397 -0.324 13.662
213 2HD2 LEU 179 HD22 LEU 179 8.979 -0.804 14.596
214 3HD2 LEU 179 HD23 LEU 179 10.042 0.467 15.197
215 H ARG 180 HN ARG 180 7.280 4.420 14.022
216 HA ARG 180 HA ARG 180 5.644 5.484 16.170
217 1HB ARG 180 HB2 ARG 180 6.912 7.515 15.933
218 2HB ARG 180 HB1 ARG 180 8.032 6.150 15.906
219 1HG ARG 180 HG2 ARG 180 7.026 7.247 13.320
220 2HG ARG 180 HG1 ARG 180 8.259 8.138 14.209
221 1HD ARG 180 HD2 ARG 180 8.413 5.459 12.906
222 2HD ARG 180 HD1 ARG 180 9.542 6.808 12.837
223 HE ARG 180 HE ARG 180 9.486 4.690 14.781
224 1HH1 ARG 180 1HH1 ARG 180 10.512 7.964 14.141
225 2HH1 ARG 180 2HH1 ARG 180 11.776 7.930 15.323
226 1HH2 ARG 180 1HH2 ARG 180 11.147 4.645 16.336
227 2HH2 ARG 180 2HH2 ARG 180 12.138 6.046 16.570
228 1HG HSL 181 HG1 HSL 181 1.179 3.901 11.030
229 2HG HSL 181 HG2 HSL 181 2.303 3.087 12.238
230 H HSL 181 HN HSL 181 4.171 4.450 14.058
231 HA HSL 181 HA HSL 181 2.979 6.969 12.781
232 1HB HSL 181 HB1 HSL 181 2.535 5.830 10.805
233 2HB HSL 181 HB2 HSL 181 3.876 4.686 11.356
Start of MODEL 96
1 1H PHE 155 HT1 PHE 155 5.894 -8.180 -7.461
2 2H PHE 155 HT2 PHE 155 5.055 -6.718 -7.784
3 3H PHE 155 HT3 PHE 155 5.063 -7.979 -8.947
4 HA PHE 155 HA PHE 155 3.761 -9.351 -7.626
5 1HB PHE 155 HB2 PHE 155 3.002 -8.393 -5.356
6 2HB PHE 155 HB1 PHE 155 4.638 -9.033 -5.468
7 HD1 PHE 155 HD1 PHE 155 6.248 -7.815 -4.405
8 HD2 PHE 155 HD2 PHE 155 2.910 -5.776 -6.081
9 HE1 PHE 155 HE1 PHE 155 7.144 -5.677 -3.578
10 HE2 PHE 155 HE2 PHE 155 3.799 -3.635 -5.258
11 HZ PHE 155 HZ PHE 155 5.919 -3.584 -4.005
12 H LEU 156 HN LEU 156 1.444 -8.702 -6.619
13 HA LEU 156 HA LEU 156 0.330 -6.265 -7.566
14 1HB LEU 156 HB2 LEU 156 -1.052 -7.103 -9.329
15 2HB LEU 156 HB1 LEU 156 0.612 -7.522 -9.687
16 HG LEU 156 HG LEU 156 -1.079 -9.547 -8.300
17 1HD1 LEU 156 HD11 LEU 156 -2.649 -9.284 -9.907
18 2HD1 LEU 156 HD12 LEU 156 -1.513 -10.259 -10.840
19 3HD1 LEU 156 HD13 LEU 156 -1.531 -8.506 -11.029
20 1HD2 LEU 156 HD21 LEU 156 0.685 -10.189 -10.574
21 2HD2 LEU 156 HD22 LEU 156 0.482 -11.007 -9.025
22 3HD2 LEU 156 HD23 LEU 156 1.478 -9.556 -9.131
23 H GLN 157 HN GLN 157 -2.142 -6.353 -7.414
24 HA GLN 157 HA GLN 157 -3.361 -8.393 -5.873
25 1HB GLN 157 HB2 GLN 157 -1.970 -6.297 -4.425
26 2HB GLN 157 HB1 GLN 157 -3.681 -6.329 -4.023
27 1HG GLN 157 HG2 GLN 157 -1.729 -8.607 -3.802
28 2HG GLN 157 HG1 GLN 157 -2.468 -7.705 -2.479
29 1HE2 GLN 157 HE21 GLN 157 -2.753 -10.292 -2.284
30 2HE2 GLN 157 HE22 GLN 157 -4.339 -10.818 -2.723
31 H SER 158 HN SER 158 -3.935 -4.938 -5.385
32 HA SER 158 HA SER 158 -6.640 -5.225 -6.311
33 1HB SER 158 HB2 SER 158 -5.889 -3.738 -4.394
34 2HB SER 158 HB1 SER 158 -5.233 -2.640 -5.620
35 HG SER 158 HG SER 158 -7.918 -3.520 -5.701
36 H ASP 159 HN ASP 159 -5.271 -5.932 -8.460
37 HA ASP 159 HA ASP 159 -5.249 -5.561 -10.709
38 1HB ASP 159 HB2 ASP 159 -7.194 -3.885 -9.976
39 2HB ASP 159 HB1 ASP 159 -6.006 -2.694 -10.501
40 H VAL 160 HN VAL 160 -3.865 -3.076 -8.638
41 HA VAL 160 HA VAL 160 -1.758 -2.214 -8.593
42 HB VAL 160 HB VAL 160 -1.325 -3.692 -11.185
43 1HG1 VAL 160 HG11 VAL 160 0.392 -2.233 -11.343
44 2HG1 VAL 160 HG12 VAL 160 1.144 -3.324 -10.181
45 3HG1 VAL 160 HG13 VAL 160 0.359 -1.847 -9.623
46 1HG2 VAL 160 HG21 VAL 160 -0.286 -5.402 -9.955
47 2HG2 VAL 160 HG22 VAL 160 -1.773 -5.043 -9.079
48 3HG2 VAL 160 HG23 VAL 160 -0.231 -4.423 -8.489
49 H PHE 161 HN PHE 161 -2.973 -2.297 -11.949
50 HA PHE 161 HA PHE 161 -2.094 0.373 -12.473
51 1HB PHE 161 HB2 PHE 161 -3.571 -1.733 -13.956
52 2HB PHE 161 HB1 PHE 161 -3.825 -0.070 -14.476
53 HD1 PHE 161 HD1 PHE 161 -1.069 -2.437 -13.644
54 HD2 PHE 161 HD2 PHE 161 -2.376 0.851 -16.010
55 HE1 PHE 161 HE1 PHE 161 1.041 -2.512 -14.907
56 HE2 PHE 161 HE2 PHE 161 -0.270 0.780 -17.279
57 HZ PHE 161 HZ PHE 161 1.442 -0.903 -16.728
58 H PHE 162 HN PHE 162 -3.719 0.225 -10.159
59 HA PHE 162 HA PHE 162 -5.542 2.344 -10.673
60 1HB PHE 162 HB2 PHE 162 -6.667 -0.349 -9.940
61 2HB PHE 162 HB1 PHE 162 -7.547 1.170 -9.785
62 HD1 PHE 162 HD1 PHE 162 -8.036 2.504 -11.850
63 HD2 PHE 162 HD2 PHE 162 -6.543 -1.478 -11.993
64 HE1 PHE 162 HE1 PHE 162 -8.788 2.310 -14.185
65 HE2 PHE 162 HE2 PHE 162 -7.292 -1.680 -14.329
66 HZ PHE 162 HZ PHE 162 -8.415 0.217 -15.428
67 H LEU 163 HN LEU 163 -4.052 0.044 -8.529
68 HA LEU 163 HA LEU 163 -5.041 0.996 -6.059
69 1HB LEU 163 HB2 LEU 163 -3.750 -1.134 -6.476
70 2HB LEU 163 HB1 LEU 163 -2.312 -0.143 -6.622
71 HG LEU 163 HG LEU 163 -3.090 0.696 -4.219
72 1HD1 LEU 163 HD11 LEU 163 -4.252 -0.835 -2.937
73 2HD1 LEU 163 HD12 LEU 163 -3.948 -2.162 -4.058
74 3HD1 LEU 163 HD13 LEU 163 -5.110 -0.904 -4.476
75 1HD2 LEU 163 HD21 LEU 163 -1.754 -1.429 -3.373
76 2HD2 LEU 163 HD22 LEU 163 -0.966 -0.123 -4.258
77 3HD2 LEU 163 HD23 LEU 163 -1.431 -1.602 -5.099
78 H PHE 164 HN PHE 164 -3.410 2.524 -8.395
79 HA PHE 164 HA PHE 164 -1.430 4.034 -7.094
80 1HB PHE 164 HB2 PHE 164 -1.411 3.755 -9.478
81 2HB PHE 164 HB1 PHE 164 -3.037 4.415 -9.626
82 HD1 PHE 164 HD1 PHE 164 -2.740 6.267 -11.012
83 HD2 PHE 164 HD2 PHE 164 -0.163 5.739 -7.667
84 HE1 PHE 164 HE1 PHE 164 -1.787 8.502 -11.399
85 HE2 PHE 164 HE2 PHE 164 0.794 7.974 -8.047
86 HZ PHE 164 HZ PHE 164 -0.018 9.359 -9.914
87 H LEU 165 HN LEU 165 -4.810 4.162 -6.847
88 HA LEU 165 HA LEU 165 -5.251 6.942 -6.627
89 1HB LEU 165 HB2 LEU 165 -6.803 4.651 -6.469
90 2HB LEU 165 HB1 LEU 165 -6.895 5.325 -4.850
91 HG LEU 165 HG LEU 165 -7.582 7.513 -5.923
92 1HD1 LEU 165 HD11 LEU 165 -8.725 6.928 -8.240
93 2HD1 LEU 165 HD12 LEU 165 -7.394 5.773 -8.319
94 3HD1 LEU 165 HD13 LEU 165 -7.058 7.495 -8.137
95 1HD2 LEU 165 HD21 LEU 165 -9.800 6.950 -5.800
96 2HD2 LEU 165 HD22 LEU 165 -9.073 5.583 -4.958
97 3HD2 LEU 165 HD23 LEU 165 -9.574 5.418 -6.641
98 H LEU 166 HN LEU 166 -4.061 4.505 -4.439
99 HA LEU 166 HA LEU 166 -3.070 6.500 -2.622
100 1HB LEU 166 HB2 LEU 166 -5.642 5.512 -2.172
101 2HB LEU 166 HB1 LEU 166 -4.627 4.593 -1.072
102 HG LEU 166 HG LEU 166 -3.765 6.709 -0.122
103 1HD1 LEU 166 HD11 LEU 166 -3.962 8.251 -1.889
104 2HD1 LEU 166 HD12 LEU 166 -5.122 8.779 -0.670
105 3HD1 LEU 166 HD13 LEU 166 -5.679 7.912 -2.100
106 1HD2 LEU 166 HD21 LEU 166 -5.501 5.775 1.124
107 2HD2 LEU 166 HD22 LEU 166 -6.710 6.145 -0.106
108 3HD2 LEU 166 HD23 LEU 166 -6.017 7.441 0.868
109 HA PRO 167 HA PRO 167 -0.754 2.459 -3.285
110 1HB PRO 167 HB2 PRO 167 1.661 3.737 -3.617
111 2HB PRO 167 HB1 PRO 167 0.574 3.256 -4.933
112 1HG PRO 167 HG2 PRO 167 0.892 5.926 -3.616
113 2HG PRO 167 HG1 PRO 167 0.677 5.542 -5.335
114 1HD PRO 167 HD2 PRO 167 -1.358 6.442 -3.845
115 2HD PRO 167 HD1 PRO 167 -1.608 5.211 -5.100
116 HA PRO 168 HA PRO 168 0.488 2.965 1.058
117 1HB PRO 168 HB2 PRO 168 0.086 0.424 1.771
118 2HB PRO 168 HB1 PRO 168 -1.291 1.510 1.492
119 1HG PRO 168 HG2 PRO 168 -0.088 -0.528 -0.365
120 2HG PRO 168 HG1 PRO 168 -1.797 -0.255 0.029
121 1HD PRO 168 HD2 PRO 168 -0.596 0.735 -2.207
122 2HD PRO 168 HD1 PRO 168 -1.961 1.537 -1.404
123 H ILE 169 HN ILE 169 2.666 3.365 0.237
124 HA ILE 169 HA ILE 169 4.346 1.243 -0.622
125 HB ILE 169 HB ILE 169 4.854 3.467 -1.319
126 1HG1 ILE 169 HG12 ILE 169 7.239 3.624 -0.732
127 2HG1 ILE 169 HG11 ILE 169 6.976 2.492 0.592
128 1HG2 ILE 169 HG21 ILE 169 5.112 5.313 -0.038
129 2HG2 ILE 169 HG22 ILE 169 5.743 4.407 1.335
130 3HG2 ILE 169 HG23 ILE 169 4.013 4.403 0.997
131 1HD1 ILE 169 HD11 ILE 169 7.948 1.654 -1.656
132 2HD1 ILE 169 HD12 ILE 169 6.269 1.703 -2.194
133 3HD1 ILE 169 HD13 ILE 169 6.727 0.695 -0.820
134 H ILE 170 HN ILE 170 4.585 3.189 2.329
135 HA ILE 170 HA ILE 170 6.364 1.372 3.599
136 HB ILE 170 HB ILE 170 4.779 3.556 4.940
137 1HG1 ILE 170 HG12 ILE 170 7.414 4.425 4.394
138 2HG1 ILE 170 HG11 ILE 170 6.791 3.757 2.889
139 1HG2 ILE 170 HG21 ILE 170 6.183 3.354 6.717
140 2HG2 ILE 170 HG22 ILE 170 7.539 2.813 5.727
141 3HG2 ILE 170 HG23 ILE 170 6.243 1.690 6.136
142 1HD1 ILE 170 HD11 ILE 170 5.742 6.047 4.500
143 2HD1 ILE 170 HD12 ILE 170 4.735 5.215 3.315
144 3HD1 ILE 170 HD13 ILE 170 6.225 6.008 2.805
145 H LEU 171 HN LEU 171 2.898 2.033 3.893
146 HA LEU 171 HA LEU 171 2.438 0.385 6.140
147 1HB LEU 171 HB2 LEU 171 0.919 2.120 4.729
148 2HB LEU 171 HB1 LEU 171 0.301 0.603 4.102
149 HG LEU 171 HG LEU 171 -0.100 -0.095 6.500
150 1HD1 LEU 171 HD11 LEU 171 0.105 1.368 8.246
151 2HD1 LEU 171 HD12 LEU 171 -0.040 2.791 7.215
152 3HD1 LEU 171 HD13 LEU 171 1.468 1.876 7.248
153 1HD2 LEU 171 HD21 LEU 171 -1.998 0.477 5.260
154 2HD2 LEU 171 HD22 LEU 171 -1.553 2.182 5.195
155 3HD2 LEU 171 HD23 LEU 171 -2.109 1.472 6.711
156 H ASP 172 HN ASP 172 1.706 -0.216 2.729
157 HA ASP 172 HA ASP 172 1.359 -3.021 3.114
158 1HB ASP 172 HB2 ASP 172 0.376 -1.404 1.274
159 2HB ASP 172 HB1 ASP 172 1.843 -1.867 0.401
160 H ALA 173 HN ALA 173 4.117 -1.229 3.171
161 HA ALA 173 HA ALA 173 5.834 -2.756 1.500
162 1HB ALA 173 HB1 ALA 173 6.102 -0.562 3.373
163 2HB ALA 173 HB2 ALA 173 7.089 -0.968 1.969
164 3HB ALA 173 HB3 ALA 173 7.423 -1.719 3.530
165 H GLY 174 HN GLY 174 5.865 -2.487 5.022
166 1HA GLY 174 HA2 GLY 174 6.182 -5.420 5.208
167 2HA GLY 174 HA1 GLY 174 7.149 -4.312 6.198
168 H TYR 175 HN TYR 175 4.393 -2.707 6.027
169 HA TYR 175 HA TYR 175 2.543 -2.403 7.280
170 1HB TYR 175 HB2 TYR 175 2.158 -4.854 6.662
171 2HB TYR 175 HB1 TYR 175 2.787 -5.247 8.259
172 HD1 TYR 175 HD1 TYR 175 -0.091 -4.274 6.382
173 HD2 TYR 175 HD2 TYR 175 1.603 -4.221 10.284
174 HE1 TYR 175 HE1 TYR 175 -2.327 -3.920 7.340
175 HE2 TYR 175 HE2 TYR 175 -0.629 -3.868 11.254
176 HH TYR 175 HH TYR 175 -2.943 -4.174 10.711
177 H PHE 176 HN PHE 176 4.783 -4.530 9.111
178 HA PHE 176 HA PHE 176 4.282 -2.916 11.485
179 1HB PHE 176 HB2 PHE 176 4.987 -4.700 12.762
180 2HB PHE 176 HB1 PHE 176 4.353 -5.540 11.343
181 HD1 PHE 176 HD1 PHE 176 6.908 -5.587 13.605
182 HD2 PHE 176 HD2 PHE 176 6.293 -5.679 9.396
183 HE1 PHE 176 HE1 PHE 176 9.079 -6.705 13.316
184 HE2 PHE 176 HE2 PHE 176 8.462 -6.798 9.099
185 HZ PHE 176 HZ PHE 176 9.859 -7.313 11.060
186 H LEU 177 HN LEU 177 6.087 -2.187 9.070
187 HA LEU 177 HA LEU 177 8.694 -1.977 10.296
188 1HB LEU 177 HB2 LEU 177 7.908 -0.450 7.846
189 2HB LEU 177 HB1 LEU 177 9.465 -1.125 8.278
190 HG LEU 177 HG LEU 177 7.049 -2.676 7.354
191 1HD1 LEU 177 HD11 LEU 177 8.601 -3.233 5.455
192 2HD1 LEU 177 HD12 LEU 177 9.664 -1.959 6.053
193 3HD1 LEU 177 HD13 LEU 177 8.035 -1.564 5.507
194 1HD2 LEU 177 HD21 LEU 177 8.120 -4.112 8.849
195 2HD2 LEU 177 HD22 LEU 177 9.725 -3.534 8.401
196 3HD2 LEU 177 HD23 LEU 177 8.809 -4.544 7.283
197 HA PRO 178 HA PRO 178 7.188 2.768 10.122
198 1HB PRO 178 HB2 PRO 178 4.378 2.065 10.864
199 2HB PRO 178 HB1 PRO 178 4.979 3.415 9.893
200 1HG PRO 178 HG2 PRO 178 3.844 1.326 8.717
201 2HG PRO 178 HG1 PRO 178 5.278 2.090 8.005
202 1HD PRO 178 HD2 PRO 178 5.046 -0.473 9.518
203 2HD PRO 178 HD1 PRO 178 6.092 -0.062 8.144
204 H LEU 179 HN LEU 179 6.678 4.081 12.040
205 HA LEU 179 HA LEU 179 6.493 4.495 14.281
206 1HB LEU 179 HB2 LEU 179 5.156 2.109 14.100
207 2HB LEU 179 HB1 LEU 179 6.443 1.720 15.225
208 HG LEU 179 HG LEU 179 5.696 3.814 16.518
209 1HD1 LEU 179 HD11 LEU 179 3.058 3.927 16.066
210 2HD1 LEU 179 HD12 LEU 179 3.625 3.615 14.425
211 3HD1 LEU 179 HD13 LEU 179 4.218 5.020 15.310
212 1HD2 LEU 179 HD21 LEU 179 3.560 2.383 17.278
213 2HD2 LEU 179 HD22 LEU 179 5.215 1.956 17.715
214 3HD2 LEU 179 HD23 LEU 179 4.426 1.152 16.357
215 H ARG 180 HN ARG 180 8.776 2.555 12.785
216 HA ARG 180 HA ARG 180 10.799 3.333 14.699
217 1HB ARG 180 HB2 ARG 180 11.739 0.945 14.656
218 2HB ARG 180 HB1 ARG 180 10.340 1.244 15.693
219 1HG ARG 180 HG2 ARG 180 9.083 0.486 13.445
220 2HG ARG 180 HG1 ARG 180 10.590 -0.413 13.265
221 1HD ARG 180 HD2 ARG 180 8.786 -1.665 14.438
222 2HD ARG 180 HD1 ARG 180 10.270 -1.499 15.371
223 HE ARG 180 HE ARG 180 7.745 -0.082 15.861
224 1HH1 ARG 180 1HH1 ARG 180 10.974 -0.936 16.900
225 2HH1 ARG 180 2HH1 ARG 180 10.729 -0.380 18.520
226 1HH2 ARG 180 1HH2 ARG 180 7.433 0.649 17.990
227 2HH2 ARG 180 2HH2 ARG 180 8.723 0.518 19.138
228 1HG HSL 181 HG1 HSL 181 11.886 4.192 7.711
229 2HG HSL 181 HG2 HSL 181 10.264 5.063 7.730
230 H HSL 181 HN HSL 181 9.975 4.044 12.057
231 HA HSL 181 HA HSL 181 12.403 3.163 10.411
232 1HB HSL 181 HB1 HSL 181 10.673 2.525 8.928
233 2HB HSL 181 HB2 HSL 181 9.492 3.764 9.622
Start of MODEL 97
1 1H PHE 155 HT1 PHE 155 8.296 0.704 -10.407
2 2H PHE 155 HT2 PHE 155 9.557 0.742 -9.243
3 3H PHE 155 HT3 PHE 155 9.671 1.695 -10.666
4 HA PHE 155 HA PHE 155 7.599 2.009 -8.605
5 1HB PHE 155 HB2 PHE 155 10.203 2.494 -8.182
6 2HB PHE 155 HB1 PHE 155 9.770 3.994 -8.996
7 HD1 PHE 155 HD1 PHE 155 8.299 1.787 -6.363
8 HD2 PHE 155 HD2 PHE 155 9.270 5.738 -7.611
9 HE1 PHE 155 HE1 PHE 155 7.410 2.670 -4.245
10 HE2 PHE 155 HE2 PHE 155 8.381 6.628 -5.496
11 HZ PHE 155 HZ PHE 155 7.451 5.094 -3.810
12 H LEU 156 HN LEU 156 6.628 4.167 -8.752
13 HA LEU 156 HA LEU 156 5.438 5.735 -9.861
14 1HB LEU 156 HB2 LEU 156 6.580 7.089 -11.300
15 2HB LEU 156 HB1 LEU 156 7.897 6.258 -10.503
16 HG LEU 156 HG LEU 156 7.223 4.763 -12.812
17 1HD1 LEU 156 HD11 LEU 156 7.630 6.392 -14.574
18 2HD1 LEU 156 HD12 LEU 156 7.655 7.687 -13.377
19 3HD1 LEU 156 HD13 LEU 156 6.166 6.789 -13.674
20 1HD2 LEU 156 HD21 LEU 156 9.605 6.544 -12.606
21 2HD2 LEU 156 HD22 LEU 156 9.482 4.904 -13.245
22 3HD2 LEU 156 HD23 LEU 156 9.422 5.180 -11.503
23 H GLN 157 HN GLN 157 3.653 5.654 -11.060
24 HA GLN 157 HA GLN 157 3.444 4.396 -13.578
25 1HB GLN 157 HB2 GLN 157 2.031 2.492 -12.998
26 2HB GLN 157 HB1 GLN 157 3.615 2.343 -12.251
27 1HG GLN 157 HG2 GLN 157 1.202 3.404 -10.807
28 2HG GLN 157 HG1 GLN 157 1.663 1.704 -10.815
29 1HE2 GLN 157 HE21 GLN 157 1.510 3.765 -8.663
30 2HE2 GLN 157 HE22 GLN 157 3.057 3.719 -7.896
31 H SER 158 HN SER 158 1.732 5.365 -10.637
32 HA SER 158 HA SER 158 -0.712 5.952 -12.028
33 1HB SER 158 HB2 SER 158 -0.833 5.258 -9.713
34 2HB SER 158 HB1 SER 158 0.207 6.604 -9.217
35 HG SER 158 HG SER 158 -2.401 6.782 -10.333
36 H ASP 159 HN ASP 159 1.082 7.306 -13.455
37 HA ASP 159 HA ASP 159 1.335 9.352 -14.423
38 1HB ASP 159 HB2 ASP 159 -0.999 9.674 -13.004
39 2HB ASP 159 HB1 ASP 159 0.005 10.984 -12.388
40 H VAL 160 HN VAL 160 1.934 8.995 -11.002
41 HA VAL 160 HA VAL 160 3.914 9.408 -9.903
42 HB VAL 160 HB VAL 160 4.811 10.033 -12.366
43 1HG1 VAL 160 HG11 VAL 160 5.253 12.607 -10.879
44 2HG1 VAL 160 HG12 VAL 160 3.923 12.409 -12.020
45 3HG1 VAL 160 HG13 VAL 160 5.589 12.239 -12.571
46 1HG2 VAL 160 HG21 VAL 160 6.552 10.981 -10.181
47 2HG2 VAL 160 HG22 VAL 160 6.856 9.791 -11.445
48 3HG2 VAL 160 HG23 VAL 160 5.911 9.345 -10.026
49 H PHE 161 HN PHE 161 2.101 12.113 -11.286
50 HA PHE 161 HA PHE 161 2.682 13.939 -9.184
51 1HB PHE 161 HB2 PHE 161 1.908 14.672 -11.410
52 2HB PHE 161 HB1 PHE 161 0.350 13.910 -11.112
53 HD1 PHE 161 HD1 PHE 161 -1.331 15.005 -9.878
54 HD2 PHE 161 HD2 PHE 161 2.604 16.622 -10.015
55 HE1 PHE 161 HE1 PHE 161 -2.153 17.082 -8.845
56 HE2 PHE 161 HE2 PHE 161 1.789 18.701 -8.982
57 HZ PHE 161 HZ PHE 161 -0.592 18.933 -8.395
58 H PHE 162 HN PHE 162 0.335 11.434 -9.661
59 HA PHE 162 HA PHE 162 -1.530 12.181 -7.671
60 1HB PHE 162 HB2 PHE 162 -1.516 10.369 -9.633
61 2HB PHE 162 HB1 PHE 162 -1.084 9.320 -8.282
62 HD1 PHE 162 HD1 PHE 162 -3.428 12.207 -8.576
63 HD2 PHE 162 HD2 PHE 162 -2.928 8.076 -7.684
64 HE1 PHE 162 HE1 PHE 162 -5.799 12.062 -7.936
65 HE2 PHE 162 HE2 PHE 162 -5.299 7.923 -7.045
66 HZ PHE 162 HZ PHE 162 -6.738 9.918 -7.170
67 H LEU 163 HN LEU 163 0.904 9.603 -7.663
68 HA LEU 163 HA LEU 163 0.740 9.083 -4.881
69 1HB LEU 163 HB2 LEU 163 2.747 8.486 -7.021
70 2HB LEU 163 HB1 LEU 163 3.026 8.007 -5.358
71 HG LEU 163 HG LEU 163 0.849 7.043 -7.208
72 1HD1 LEU 163 HD11 LEU 163 1.991 4.844 -6.211
73 2HD1 LEU 163 HD12 LEU 163 3.368 5.945 -6.122
74 3HD1 LEU 163 HD13 LEU 163 2.570 5.652 -7.668
75 1HD2 LEU 163 HD21 LEU 163 -0.452 6.844 -5.406
76 2HD2 LEU 163 HD22 LEU 163 0.873 7.207 -4.301
77 3HD2 LEU 163 HD23 LEU 163 0.647 5.563 -4.896
78 H PHE 164 HN PHE 164 1.813 11.715 -6.463
79 HA PHE 164 HA PHE 164 4.220 12.369 -5.128
80 1HB PHE 164 HB2 PHE 164 2.970 13.233 -7.350
81 2HB PHE 164 HB1 PHE 164 2.472 14.497 -6.231
82 HD1 PHE 164 HD1 PHE 164 4.248 15.794 -4.999
83 HD2 PHE 164 HD2 PHE 164 5.122 13.236 -8.285
84 HE1 PHE 164 HE1 PHE 164 6.404 16.937 -5.309
85 HE2 PHE 164 HE2 PHE 164 7.281 14.373 -8.601
86 HZ PHE 164 HZ PHE 164 7.924 16.226 -7.111
87 H LEU 165 HN LEU 165 0.806 12.988 -4.514
88 HA LEU 165 HA LEU 165 1.153 14.992 -2.541
89 1HB LEU 165 HB2 LEU 165 -1.137 13.085 -2.386
90 2HB LEU 165 HB1 LEU 165 -1.112 14.817 -2.123
91 HG LEU 165 HG LEU 165 -1.086 13.387 -4.777
92 1HD1 LEU 165 HD11 LEU 165 -3.283 13.490 -3.979
93 2HD1 LEU 165 HD12 LEU 165 -3.136 14.873 -5.063
94 3HD1 LEU 165 HD13 LEU 165 -3.060 15.110 -3.317
95 1HD2 LEU 165 HD21 LEU 165 -0.296 16.142 -4.045
96 2HD2 LEU 165 HD22 LEU 165 -1.322 15.954 -5.467
97 3HD2 LEU 165 HD23 LEU 165 0.232 15.126 -5.387
98 H LEU 166 HN LEU 166 0.740 11.482 -2.351
99 HA LEU 166 HA LEU 166 2.251 11.358 0.090
100 1HB LEU 166 HB2 LEU 166 -0.531 11.719 0.252
101 2HB LEU 166 HB1 LEU 166 -0.255 10.021 0.606
102 HG LEU 166 HG LEU 166 -0.265 11.179 2.684
103 1HD1 LEU 166 HD11 LEU 166 2.663 10.874 2.141
104 2HD1 LEU 166 HD12 LEU 166 1.590 9.475 2.160
105 3HD1 LEU 166 HD13 LEU 166 1.753 10.481 3.601
106 1HD2 LEU 166 HD21 LEU 166 1.973 12.967 1.814
107 2HD2 LEU 166 HD22 LEU 166 0.857 13.155 3.167
108 3HD2 LEU 166 HD23 LEU 166 0.292 13.411 1.515
109 HA PRO 167 HA PRO 167 2.631 7.706 -2.697
110 1HB PRO 167 HB2 PRO 167 5.247 7.244 -2.065
111 2HB PRO 167 HB1 PRO 167 4.717 8.349 -3.347
112 1HG PRO 167 HG2 PRO 167 5.561 8.966 -0.539
113 2HG PRO 167 HG1 PRO 167 5.965 9.816 -2.043
114 1HD PRO 167 HD2 PRO 167 4.075 10.727 -0.355
115 2HD PRO 167 HD1 PRO 167 3.933 10.917 -2.115
116 HA PRO 168 HA PRO 168 2.005 5.109 0.978
117 1HB PRO 168 HB2 PRO 168 0.457 3.273 -0.234
118 2HB PRO 168 HB1 PRO 168 -0.173 4.875 0.187
119 1HG PRO 168 HG2 PRO 168 0.833 3.874 -2.455
120 2HG PRO 168 HG1 PRO 168 -0.634 4.804 -2.101
121 1HD PRO 168 HD2 PRO 168 1.663 5.933 -3.025
122 2HD PRO 168 HD1 PRO 168 0.508 6.795 -1.988
123 H ILE 169 HN ILE 169 1.706 2.259 0.168
124 HA ILE 169 HA ILE 169 2.920 0.441 -0.601
125 HB ILE 169 HB ILE 169 4.100 2.365 -2.132
126 1HG1 ILE 169 HG12 ILE 169 3.660 0.090 -2.843
127 2HG1 ILE 169 HG11 ILE 169 5.342 0.487 -3.184
128 1HG2 ILE 169 HG21 ILE 169 5.780 2.705 -0.212
129 2HG2 ILE 169 HG22 ILE 169 6.443 2.444 -1.828
130 3HG2 ILE 169 HG23 ILE 169 6.419 1.123 -0.661
131 1HD1 ILE 169 HD11 ILE 169 5.291 -1.716 -2.325
132 2HD1 ILE 169 HD12 ILE 169 4.272 -1.236 -0.969
133 3HD1 ILE 169 HD13 ILE 169 5.945 -0.683 -1.054
134 H ILE 170 HN ILE 170 4.569 2.912 1.236
135 HA ILE 170 HA ILE 170 6.470 1.254 2.433
136 HB ILE 170 HB ILE 170 6.805 3.145 3.949
137 1HG1 ILE 170 HG12 ILE 170 4.174 3.743 3.152
138 2HG1 ILE 170 HG11 ILE 170 5.163 4.609 4.315
139 1HG2 ILE 170 HG21 ILE 170 7.895 2.945 1.731
140 2HG2 ILE 170 HG22 ILE 170 7.724 4.606 2.298
141 3HG2 ILE 170 HG23 ILE 170 6.622 3.974 1.074
142 1HD1 ILE 170 HD11 ILE 170 4.860 5.149 1.375
143 2HD1 ILE 170 HD12 ILE 170 6.091 5.915 2.380
144 3HD1 ILE 170 HD13 ILE 170 4.381 6.180 2.724
145 H LEU 171 HN LEU 171 3.287 2.332 3.508
146 HA LEU 171 HA LEU 171 3.497 1.280 6.132
147 1HB LEU 171 HB2 LEU 171 0.966 1.627 4.521
148 2HB LEU 171 HB1 LEU 171 1.109 1.570 6.268
149 HG LEU 171 HG LEU 171 2.132 3.770 4.472
150 1HD1 LEU 171 HD11 LEU 171 0.287 4.962 4.970
151 2HD1 LEU 171 HD12 LEU 171 0.162 4.294 6.597
152 3HD1 LEU 171 HD13 LEU 171 -0.424 3.366 5.216
153 1HD2 LEU 171 HD21 LEU 171 2.788 4.919 6.485
154 2HD2 LEU 171 HD22 LEU 171 3.576 3.342 6.442
155 3HD2 LEU 171 HD23 LEU 171 2.176 3.599 7.483
156 H ASP 172 HN ASP 172 1.850 0.082 3.233
157 HA ASP 172 HA ASP 172 1.429 -2.530 4.322
158 1HB ASP 172 HB2 ASP 172 1.115 -1.496 1.494
159 2HB ASP 172 HB1 ASP 172 0.570 -3.078 2.069
160 H ALA 173 HN ALA 173 4.202 -1.084 3.303
161 HA ALA 173 HA ALA 173 5.308 -3.108 1.627
162 1HB ALA 173 HB1 ALA 173 6.584 -1.284 1.292
163 2HB ALA 173 HB2 ALA 173 7.493 -1.889 2.678
164 3HB ALA 173 HB3 ALA 173 6.267 -0.643 2.904
165 H GLY 174 HN GLY 174 6.522 -2.106 4.809
166 1HA GLY 174 HA2 GLY 174 7.334 -4.851 5.360
167 2HA GLY 174 HA1 GLY 174 7.704 -3.420 6.343
168 H TYR 175 HN TYR 175 4.707 -2.765 6.008
169 HA TYR 175 HA TYR 175 2.762 -3.037 7.128
170 1HB TYR 175 HB2 TYR 175 2.836 -5.370 6.319
171 2HB TYR 175 HB1 TYR 175 3.786 -5.826 7.728
172 HD1 TYR 175 HD1 TYR 175 0.524 -5.557 6.391
173 HD2 TYR 175 HD2 TYR 175 2.692 -5.341 10.045
174 HE1 TYR 175 HE1 TYR 175 -1.549 -5.996 7.639
175 HE2 TYR 175 HE2 TYR 175 0.625 -5.779 11.304
176 HH TYR 175 HH TYR 175 -1.566 -6.786 10.955
177 H PHE 176 HN PHE 176 5.315 -4.721 8.982
178 HA PHE 176 HA PHE 176 4.338 -3.460 11.419
179 1HB PHE 176 HB2 PHE 176 5.601 -5.041 12.627
180 2HB PHE 176 HB1 PHE 176 4.959 -5.937 11.247
181 HD1 PHE 176 HD1 PHE 176 7.135 -4.517 9.361
182 HD2 PHE 176 HD2 PHE 176 7.269 -6.790 12.957
183 HE1 PHE 176 HE1 PHE 176 9.409 -5.262 8.800
184 HE2 PHE 176 HE2 PHE 176 9.545 -7.536 12.402
185 HZ PHE 176 HZ PHE 176 10.618 -6.772 10.323
186 H LEU 177 HN LEU 177 5.974 -2.178 9.127
187 HA LEU 177 HA LEU 177 8.394 -1.368 10.474
188 1HB LEU 177 HB2 LEU 177 7.166 -0.831 7.807
189 2HB LEU 177 HB1 LEU 177 8.399 0.262 8.405
190 HG LEU 177 HG LEU 177 8.708 -2.699 7.910
191 1HD1 LEU 177 HD11 LEU 177 9.793 -2.192 5.990
192 2HD1 LEU 177 HD12 LEU 177 10.416 -0.663 6.613
193 3HD1 LEU 177 HD13 LEU 177 8.746 -0.775 6.057
194 1HD2 LEU 177 HD21 LEU 177 10.171 -2.492 9.630
195 2HD2 LEU 177 HD22 LEU 177 10.353 -0.751 9.415
196 3HD2 LEU 177 HD23 LEU 177 11.203 -1.865 8.345
197 HA PRO 178 HA PRO 178 5.916 2.783 10.653
198 1HB PRO 178 HB2 PRO 178 3.107 2.038 10.352
199 2HB PRO 178 HB1 PRO 178 4.044 3.233 9.452
200 1HG PRO 178 HG2 PRO 178 3.168 0.926 8.343
201 2HG PRO 178 HG1 PRO 178 4.672 1.721 7.842
202 1HD PRO 178 HD2 PRO 178 4.285 -0.625 9.667
203 2HD PRO 178 HD1 PRO 178 5.498 -0.377 8.394
204 H LEU 179 HN LEU 179 6.475 2.570 12.839
205 HA LEU 179 HA LEU 179 4.743 1.132 14.651
206 1HB LEU 179 HB2 LEU 179 7.238 2.774 15.000
207 2HB LEU 179 HB1 LEU 179 6.307 2.226 16.380
208 HG LEU 179 HG LEU 179 8.056 0.667 16.128
209 1HD1 LEU 179 HD11 LEU 179 6.927 -1.356 15.902
210 2HD1 LEU 179 HD12 LEU 179 5.842 -0.722 14.664
211 3HD1 LEU 179 HD13 LEU 179 5.654 -0.217 16.343
212 1HD2 LEU 179 HD21 LEU 179 9.008 0.022 14.193
213 2HD2 LEU 179 HD22 LEU 179 8.207 1.458 13.557
214 3HD2 LEU 179 HD23 LEU 179 7.462 -0.128 13.357
215 H ARG 180 HN ARG 180 5.987 4.451 14.870
216 HA ARG 180 HA ARG 180 3.497 5.282 16.124
217 1HB ARG 180 HB2 ARG 180 6.174 6.613 15.728
218 2HB ARG 180 HB1 ARG 180 4.770 7.491 16.350
219 1HG ARG 180 HG2 ARG 180 4.938 6.557 18.376
220 2HG ARG 180 HG1 ARG 180 5.300 4.960 17.718
221 1HD ARG 180 HD2 ARG 180 7.488 6.776 17.250
222 2HD ARG 180 HD1 ARG 180 7.071 6.732 18.963
223 HE ARG 180 HE ARG 180 7.281 4.130 17.761
224 1HH1 ARG 180 1HH1 ARG 180 9.051 6.724 19.285
225 2HH1 ARG 180 2HH1 ARG 180 10.335 5.698 19.827
226 1HH2 ARG 180 1HH2 ARG 180 8.969 2.777 18.480
227 2HH2 ARG 180 2HH2 ARG 180 10.288 3.458 19.370
228 1HG HSL 181 HG1 HSL 181 2.654 6.610 9.104
229 2HG HSL 181 HG2 HSL 181 3.253 4.897 8.802
230 H HSL 181 HN HSL 181 3.844 4.543 13.227
231 HA HSL 181 HA HSL 181 2.787 7.135 11.980
232 1HB HSL 181 HB1 HSL 181 4.590 6.720 10.508
233 2HB HSL 181 HB2 HSL 181 4.562 4.905 10.832
Start of MODEL 98
1 1H PHE 155 HT1 PHE 155 3.484 12.537 -10.563
2 2H PHE 155 HT2 PHE 155 3.933 10.907 -10.266
3 3H PHE 155 HT3 PHE 155 4.718 11.804 -11.500
4 HA PHE 155 HA PHE 155 6.004 11.518 -9.448
5 1HB PHE 155 HB2 PHE 155 5.921 13.521 -11.229
6 2HB PHE 155 HB1 PHE 155 5.497 14.430 -9.784
7 HD1 PHE 155 HD1 PHE 155 8.080 14.167 -11.742
8 HD2 PHE 155 HD2 PHE 155 7.119 13.105 -7.735
9 HE1 PHE 155 HE1 PHE 155 10.461 14.311 -11.138
10 HE2 PHE 155 HE2 PHE 155 9.498 13.248 -7.123
11 HZ PHE 155 HZ PHE 155 11.172 13.852 -8.824
12 H LEU 156 HN LEU 156 3.872 14.314 -8.951
13 HA LEU 156 HA LEU 156 2.705 13.346 -6.575
14 1HB LEU 156 HB2 LEU 156 5.225 14.905 -6.404
15 2HB LEU 156 HB1 LEU 156 3.962 15.309 -5.257
16 HG LEU 156 HG LEU 156 5.601 12.823 -5.480
17 1HD1 LEU 156 HD11 LEU 156 4.905 14.854 -3.440
18 2HD1 LEU 156 HD12 LEU 156 6.454 14.091 -3.803
19 3HD1 LEU 156 HD13 LEU 156 5.230 13.211 -2.887
20 1HD2 LEU 156 HD21 LEU 156 3.409 11.889 -5.594
21 2HD2 LEU 156 HD22 LEU 156 2.822 12.968 -4.329
22 3HD2 LEU 156 HD23 LEU 156 3.984 11.701 -3.937
23 H GLN 157 HN GLN 157 0.943 14.158 -7.877
24 HA GLN 157 HA GLN 157 0.132 16.752 -7.079
25 1HB GLN 157 HB2 GLN 157 -0.056 17.754 -9.352
26 2HB GLN 157 HB1 GLN 157 1.606 17.536 -8.819
27 1HG GLN 157 HG2 GLN 157 1.556 15.348 -10.128
28 2HG GLN 157 HG1 GLN 157 0.077 15.968 -10.864
29 1HE2 GLN 157 HE21 GLN 157 3.411 15.874 -11.042
30 2HE2 GLN 157 HE22 GLN 157 3.651 17.144 -12.187
31 H SER 158 HN SER 158 -1.375 15.050 -6.380
32 HA SER 158 HA SER 158 -3.737 15.136 -7.964
33 1HB SER 158 HB2 SER 158 -2.183 12.558 -7.783
34 2HB SER 158 HB1 SER 158 -3.944 12.552 -7.974
35 HG SER 158 HG SER 158 -2.147 12.794 -9.863
36 H ASP 159 HN ASP 159 -3.223 16.111 -5.513
37 HA ASP 159 HA ASP 159 -4.249 16.259 -3.478
38 1HB ASP 159 HB2 ASP 159 -5.938 14.505 -4.821
39 2HB ASP 159 HB1 ASP 159 -5.515 13.635 -3.350
40 H VAL 160 HN VAL 160 -3.380 12.859 -4.101
41 HA VAL 160 HA VAL 160 -1.905 11.460 -3.101
42 HB VAL 160 HB VAL 160 -0.645 13.909 -2.895
43 1HG1 VAL 160 HG11 VAL 160 0.429 13.967 -0.707
44 2HG1 VAL 160 HG12 VAL 160 -0.563 12.611 -0.171
45 3HG1 VAL 160 HG13 VAL 160 -1.316 14.159 -0.551
46 1HG2 VAL 160 HG21 VAL 160 0.068 11.402 -3.423
47 2HG2 VAL 160 HG22 VAL 160 0.775 11.550 -1.814
48 3HG2 VAL 160 HG23 VAL 160 1.242 12.674 -3.088
49 H PHE 161 HN PHE 161 -3.249 13.805 -0.792
50 HA PHE 161 HA PHE 161 -3.246 11.989 1.396
51 1HB PHE 161 HB2 PHE 161 -4.005 14.769 0.912
52 2HB PHE 161 HB1 PHE 161 -5.072 13.951 2.050
53 HD1 PHE 161 HD1 PHE 161 -1.426 13.487 1.513
54 HD2 PHE 161 HD2 PHE 161 -4.509 14.847 4.112
55 HE1 PHE 161 HE1 PHE 161 0.232 13.817 3.301
56 HE2 PHE 161 HE2 PHE 161 -2.856 15.181 5.904
57 HZ PHE 161 HZ PHE 161 -0.482 14.666 5.499
58 H PHE 162 HN PHE 162 -5.078 11.913 -1.325
59 HA PHE 162 HA PHE 162 -6.981 10.140 -0.168
60 1HB PHE 162 HB2 PHE 162 -7.774 12.947 -0.735
61 2HB PHE 162 HB1 PHE 162 -8.908 11.672 -1.192
62 HD1 PHE 162 HD1 PHE 162 -8.905 9.751 0.829
63 HD2 PHE 162 HD2 PHE 162 -8.350 13.950 1.238
64 HE1 PHE 162 HE1 PHE 162 -9.712 9.626 3.149
65 HE2 PHE 162 HE2 PHE 162 -9.155 13.834 3.561
66 HZ PHE 162 HZ PHE 162 -9.838 11.670 4.518
67 H LEU 163 HN LEU 163 -5.046 10.762 -2.568
68 HA LEU 163 HA LEU 163 -6.627 10.503 -4.903
69 1HB LEU 163 HB2 LEU 163 -4.095 11.144 -4.551
70 2HB LEU 163 HB1 LEU 163 -3.846 9.417 -4.709
71 HG LEU 163 HG LEU 163 -4.950 11.316 -6.754
72 1HD1 LEU 163 HD11 LEU 163 -2.475 11.043 -6.450
73 2HD1 LEU 163 HD12 LEU 163 -3.082 10.655 -8.061
74 3HD1 LEU 163 HD13 LEU 163 -2.675 9.360 -6.936
75 1HD2 LEU 163 HD21 LEU 163 -6.372 9.527 -7.089
76 2HD2 LEU 163 HD22 LEU 163 -5.167 8.344 -6.585
77 3HD2 LEU 163 HD23 LEU 163 -5.024 9.135 -8.155
78 H PHE 164 HN PHE 164 -5.082 8.326 -2.668
79 HA PHE 164 HA PHE 164 -5.425 6.133 -2.172
80 1HB PHE 164 HB2 PHE 164 -7.839 6.755 -2.535
81 2HB PHE 164 HB1 PHE 164 -7.673 6.165 -4.186
82 HD1 PHE 164 HD1 PHE 164 -9.034 4.290 -4.268
83 HD2 PHE 164 HD2 PHE 164 -6.291 4.738 -1.046
84 HE1 PHE 164 HE1 PHE 164 -9.558 2.008 -3.511
85 HE2 PHE 164 HE2 PHE 164 -6.809 2.456 -0.283
86 HZ PHE 164 HZ PHE 164 -8.444 1.089 -1.516
87 H LEU 165 HN LEU 165 -4.277 7.227 -5.021
88 HA LEU 165 HA LEU 165 -4.238 4.876 -6.613
89 1HB LEU 165 HB2 LEU 165 -3.429 7.518 -6.927
90 2HB LEU 165 HB1 LEU 165 -1.936 6.600 -6.997
91 HG LEU 165 HG LEU 165 -3.429 5.124 -8.676
92 1HD1 LEU 165 HD11 LEU 165 -4.324 7.828 -9.502
93 2HD1 LEU 165 HD12 LEU 165 -5.230 7.011 -8.229
94 3HD1 LEU 165 HD13 LEU 165 -5.048 6.249 -9.808
95 1HD2 LEU 165 HD21 LEU 165 -1.557 7.380 -8.998
96 2HD2 LEU 165 HD22 LEU 165 -2.478 6.925 -10.431
97 3HD2 LEU 165 HD23 LEU 165 -1.469 5.731 -9.615
98 H LEU 166 HN LEU 166 -1.729 6.412 -4.622
99 HA LEU 166 HA LEU 166 -0.777 3.863 -3.695
100 1HB LEU 166 HB2 LEU 166 0.371 5.050 -6.028
101 2HB LEU 166 HB1 LEU 166 1.558 5.105 -4.739
102 HG LEU 166 HG LEU 166 0.728 2.539 -4.507
103 1HD1 LEU 166 HD11 LEU 166 0.989 2.468 -7.390
104 2HD1 LEU 166 HD12 LEU 166 -0.460 3.333 -6.881
105 3HD1 LEU 166 HD13 LEU 166 -0.187 1.677 -6.340
106 1HD2 LEU 166 HD21 LEU 166 3.036 3.283 -4.629
107 2HD2 LEU 166 HD22 LEU 166 2.865 3.596 -6.356
108 3HD2 LEU 166 HD23 LEU 166 2.765 1.945 -5.744
109 HA PRO 167 HA PRO 167 -0.104 7.855 -1.142
110 1HB PRO 167 HB2 PRO 167 -1.856 6.462 0.775
111 2HB PRO 167 HB1 PRO 167 -1.885 8.149 0.236
112 1HG PRO 167 HG2 PRO 167 -3.741 6.372 -0.555
113 2HG PRO 167 HG1 PRO 167 -3.173 7.677 -1.610
114 1HD PRO 167 HD2 PRO 167 -2.493 4.771 -1.651
115 2HD PRO 167 HD1 PRO 167 -2.715 5.902 -2.997
116 HA PRO 168 HA PRO 168 1.621 4.881 2.068
117 1HB PRO 168 HB2 PRO 168 0.758 2.384 2.330
118 2HB PRO 168 HB1 PRO 168 -0.245 3.759 2.833
119 1HG PRO 168 HG2 PRO 168 -0.451 2.074 0.375
120 2HG PRO 168 HG1 PRO 168 -1.736 2.734 1.397
121 1HD PRO 168 HD2 PRO 168 -0.802 3.851 -0.989
122 2HD PRO 168 HD1 PRO 168 -1.792 4.670 0.231
123 H ILE 169 HN ILE 169 1.324 1.767 0.581
124 HA ILE 169 HA ILE 169 2.672 0.540 -0.792
125 HB ILE 169 HB ILE 169 3.173 3.081 -1.774
126 1HG1 ILE 169 HG12 ILE 169 4.124 1.904 -3.698
127 2HG1 ILE 169 HG11 ILE 169 4.363 0.466 -2.713
128 1HG2 ILE 169 HG21 ILE 169 5.210 3.386 -0.519
129 2HG2 ILE 169 HG22 ILE 169 5.620 3.123 -2.210
130 3HG2 ILE 169 HG23 ILE 169 5.819 1.818 -1.043
131 1HD1 ILE 169 HD11 ILE 169 1.628 1.610 -2.965
132 2HD1 ILE 169 HD12 ILE 169 2.134 -0.059 -2.698
133 3HD1 ILE 169 HD13 ILE 169 2.304 0.670 -4.295
134 H ILE 170 HN ILE 170 4.577 2.865 1.085
135 HA ILE 170 HA ILE 170 6.529 0.875 1.748
136 HB ILE 170 HB ILE 170 7.135 2.939 3.399
137 1HG1 ILE 170 HG12 ILE 170 6.929 4.995 2.006
138 2HG1 ILE 170 HG11 ILE 170 5.850 4.100 0.949
139 1HG2 ILE 170 HG21 ILE 170 8.078 3.176 0.614
140 2HG2 ILE 170 HG22 ILE 170 8.351 1.640 1.438
141 3HG2 ILE 170 HG23 ILE 170 8.992 3.134 2.122
142 1HD1 ILE 170 HD11 ILE 170 5.078 5.630 3.059
143 2HD1 ILE 170 HD12 ILE 170 5.081 4.010 3.759
144 3HD1 ILE 170 HD13 ILE 170 4.112 4.350 2.325
145 H LEU 171 HN LEU 171 3.774 2.383 3.261
146 HA LEU 171 HA LEU 171 4.278 1.513 5.916
147 1HB LEU 171 HB2 LEU 171 2.614 3.289 5.109
148 2HB LEU 171 HB1 LEU 171 1.555 1.953 4.700
149 HG LEU 171 HG LEU 171 1.023 2.994 6.882
150 1HD1 LEU 171 HD11 LEU 171 0.601 0.981 8.009
151 2HD1 LEU 171 HD12 LEU 171 2.018 0.195 7.313
152 3HD1 LEU 171 HD13 LEU 171 0.620 0.551 6.298
153 1HD2 LEU 171 HD21 LEU 171 3.541 3.385 7.346
154 2HD2 LEU 171 HD22 LEU 171 3.503 1.746 7.996
155 3HD2 LEU 171 HD23 LEU 171 2.468 2.994 8.690
156 H ASP 172 HN ASP 172 1.931 0.331 3.533
157 HA ASP 172 HA ASP 172 1.595 -2.174 4.871
158 1HB ASP 172 HB2 ASP 172 0.606 -1.122 2.215
159 2HB ASP 172 HB1 ASP 172 0.210 -2.732 2.835
160 H ALA 173 HN ALA 173 4.210 -1.138 3.313
161 HA ALA 173 HA ALA 173 4.686 -3.186 1.395
162 1HB ALA 173 HB1 ALA 173 6.089 -0.882 2.418
163 2HB ALA 173 HB2 ALA 173 6.272 -1.705 0.871
164 3HB ALA 173 HB3 ALA 173 7.174 -2.264 2.280
165 H GLY 174 HN GLY 174 6.107 -2.564 4.601
166 1HA GLY 174 HA2 GLY 174 6.701 -5.444 4.827
167 2HA GLY 174 HA1 GLY 174 7.473 -4.155 5.772
168 H TYR 175 HN TYR 175 4.629 -2.972 5.922
169 HA TYR 175 HA TYR 175 2.853 -2.941 7.314
170 1HB TYR 175 HB2 TYR 175 3.421 -5.844 7.113
171 2HB TYR 175 HB1 TYR 175 2.441 -5.337 8.483
172 HD1 TYR 175 HD1 TYR 175 0.816 -3.189 7.406
173 HD2 TYR 175 HD2 TYR 175 1.997 -6.847 5.583
174 HE1 TYR 175 HE1 TYR 175 -1.168 -3.100 5.956
175 HE2 TYR 175 HE2 TYR 175 0.016 -6.768 4.128
176 HH TYR 175 HH TYR 175 -2.298 -5.702 4.223
177 H PHE 176 HN PHE 176 5.960 -3.789 8.335
178 HA PHE 176 HA PHE 176 5.307 -3.605 11.172
179 1HB PHE 176 HB2 PHE 176 7.439 -4.809 9.622
180 2HB PHE 176 HB1 PHE 176 8.096 -3.753 10.881
181 HD1 PHE 176 HD1 PHE 176 6.266 -6.823 10.175
182 HD2 PHE 176 HD2 PHE 176 7.696 -4.232 13.232
183 HE1 PHE 176 HE1 PHE 176 5.893 -8.593 11.843
184 HE2 PHE 176 HE2 PHE 176 7.326 -5.997 14.906
185 HZ PHE 176 HZ PHE 176 6.423 -8.181 14.212
186 H LEU 177 HN LEU 177 6.126 -1.620 8.598
187 HA LEU 177 HA LEU 177 7.875 0.250 9.637
188 1HB LEU 177 HB2 LEU 177 7.463 0.580 7.413
189 2HB LEU 177 HB1 LEU 177 5.747 0.267 7.569
190 HG LEU 177 HG LEU 177 5.325 2.472 8.364
191 1HD1 LEU 177 HD11 LEU 177 7.746 3.854 8.191
192 2HD1 LEU 177 HD12 LEU 177 8.106 2.392 9.110
193 3HD1 LEU 177 HD13 LEU 177 6.829 3.482 9.651
194 1HD2 LEU 177 HD21 LEU 177 6.207 1.931 5.846
195 2HD2 LEU 177 HD22 LEU 177 7.250 3.276 6.308
196 3HD2 LEU 177 HD23 LEU 177 5.497 3.461 6.359
197 HA PRO 178 HA PRO 178 3.780 2.475 11.362
198 1HB PRO 178 HB2 PRO 178 2.432 -0.029 12.232
199 2HB PRO 178 HB1 PRO 178 1.738 1.456 11.573
200 1HG PRO 178 HG2 PRO 178 1.898 -0.737 10.080
201 2HG PRO 178 HG1 PRO 178 2.215 0.863 9.382
202 1HD PRO 178 HD2 PRO 178 4.149 -1.262 10.204
203 2HD PRO 178 HD1 PRO 178 4.191 -0.186 8.793
204 H LEU 179 HN LEU 179 5.898 2.567 12.639
205 HA LEU 179 HA LEU 179 5.768 1.071 15.154
206 1HB LEU 179 HB2 LEU 179 7.891 2.628 13.739
207 2HB LEU 179 HB1 LEU 179 7.995 2.445 15.480
208 HG LEU 179 HG LEU 179 7.858 0.157 13.515
209 1HD1 LEU 179 HD11 LEU 179 10.235 1.064 15.117
210 2HD1 LEU 179 HD12 LEU 179 9.951 1.561 13.449
211 3HD1 LEU 179 HD13 LEU 179 10.182 -0.145 13.834
212 1HD2 LEU 179 HD21 LEU 179 8.277 0.257 16.498
213 2HD2 LEU 179 HD22 LEU 179 8.550 -1.173 15.502
214 3HD2 LEU 179 HD23 LEU 179 6.932 -0.483 15.631
215 H ARG 180 HN ARG 180 6.059 4.393 13.959
216 HA ARG 180 HA ARG 180 5.386 5.476 16.565
217 1HB ARG 180 HB2 ARG 180 6.052 7.547 15.755
218 2HB ARG 180 HB1 ARG 180 7.078 6.449 14.829
219 1HG ARG 180 HG2 ARG 180 4.608 7.895 13.890
220 2HG ARG 180 HG1 ARG 180 6.269 8.116 13.344
221 1HD ARG 180 HD2 ARG 180 4.808 5.507 13.039
222 2HD ARG 180 HD1 ARG 180 4.716 6.784 11.831
223 HE ARG 180 HE ARG 180 6.948 5.041 12.351
224 1HH1 ARG 180 1HH1 ARG 180 5.938 8.090 10.984
225 2HH1 ARG 180 2HH1 ARG 180 7.300 8.206 9.921
226 1HH2 ARG 180 1HH2 ARG 180 8.738 5.193 10.951
227 2HH2 ARG 180 2HH2 ARG 180 8.889 6.561 9.902
228 1HG HSL 181 HG1 HSL 181 -0.092 2.261 13.214
229 2HG HSL 181 HG2 HSL 181 1.626 1.836 13.715
230 H HSL 181 HN HSL 181 3.574 3.766 14.938
231 HA HSL 181 HA HSL 181 1.192 5.679 14.702
232 1HB HSL 181 HB1 HSL 181 0.400 4.542 12.839
233 2HB HSL 181 HB2 HSL 181 2.133 3.931 12.654
Start of MODEL 99
1 1H PHE 155 HT1 PHE 155 -12.365 4.057 -7.809
2 2H PHE 155 HT2 PHE 155 -12.175 5.024 -9.214
3 3H PHE 155 HT3 PHE 155 -10.845 4.765 -8.161
4 HA PHE 155 HA PHE 155 -12.204 2.780 -9.842
5 1HB PHE 155 HB2 PHE 155 -10.411 4.598 -10.618
6 2HB PHE 155 HB1 PHE 155 -9.300 3.406 -9.954
7 HD1 PHE 155 HD1 PHE 155 -8.707 1.512 -11.183
8 HD2 PHE 155 HD2 PHE 155 -12.042 3.852 -12.407
9 HE1 PHE 155 HE1 PHE 155 -8.837 0.225 -13.276
10 HE2 PHE 155 HE2 PHE 155 -12.180 2.569 -14.501
11 HZ PHE 155 HZ PHE 155 -10.576 0.752 -14.938
12 H LEU 156 HN LEU 156 -10.809 3.272 -6.876
13 HA LEU 156 HA LEU 156 -10.079 1.889 -5.260
14 1HB LEU 156 HB2 LEU 156 -11.440 0.028 -7.119
15 2HB LEU 156 HB1 LEU 156 -10.379 -0.686 -5.919
16 HG LEU 156 HG LEU 156 -12.791 1.048 -5.381
17 1HD1 LEU 156 HD11 LEU 156 -13.875 -0.864 -4.647
18 2HD1 LEU 156 HD12 LEU 156 -12.373 -1.772 -4.472
19 3HD1 LEU 156 HD13 LEU 156 -13.013 -1.427 -6.079
20 1HD2 LEU 156 HD21 LEU 156 -10.592 0.069 -3.615
21 2HD2 LEU 156 HD22 LEU 156 -12.226 0.225 -2.973
22 3HD2 LEU 156 HD23 LEU 156 -11.403 1.636 -3.638
23 H GLN 157 HN GLN 157 -8.306 0.470 -4.672
24 HA GLN 157 HA GLN 157 -6.527 -0.589 -6.610
25 1HB GLN 157 HB2 GLN 157 -6.079 1.816 -6.963
26 2HB GLN 157 HB1 GLN 157 -5.643 1.970 -5.266
27 1HG GLN 157 HG2 GLN 157 -3.556 1.536 -5.853
28 2HG GLN 157 HG1 GLN 157 -4.068 -0.115 -6.204
29 1HE2 GLN 157 HE21 GLN 157 -4.238 3.086 -7.736
30 2HE2 GLN 157 HE22 GLN 157 -3.764 2.548 -9.307
31 H SER 158 HN SER 158 -6.143 1.065 -3.471
32 HA SER 158 HA SER 158 -4.572 -1.111 -2.434
33 1HB SER 158 HB2 SER 158 -5.304 1.613 -1.570
34 2HB SER 158 HB1 SER 158 -5.058 0.445 -0.261
35 HG SER 158 HG SER 158 -2.993 0.104 -0.962
36 H ASP 159 HN ASP 159 -7.491 -1.534 -3.128
37 HA ASP 159 HA ASP 159 -9.088 -2.962 -2.362
38 1HB ASP 159 HB2 ASP 159 -7.037 -3.848 -0.957
39 2HB ASP 159 HB1 ASP 159 -7.920 -3.111 0.378
40 H VAL 160 HN VAL 160 -8.476 0.064 -1.236
41 HA VAL 160 HA VAL 160 -9.922 1.669 -0.505
42 HB VAL 160 HB VAL 160 -11.718 -0.362 -1.135
43 1HG1 VAL 160 HG11 VAL 160 -13.432 -0.232 0.644
44 2HG1 VAL 160 HG12 VAL 160 -12.261 0.584 1.677
45 3HG1 VAL 160 HG13 VAL 160 -11.970 -1.074 1.150
46 1HG2 VAL 160 HG21 VAL 160 -11.720 2.110 -1.657
47 2HG2 VAL 160 HG22 VAL 160 -12.508 2.343 -0.096
48 3HG2 VAL 160 HG23 VAL 160 -13.294 1.376 -1.344
49 H PHE 161 HN PHE 161 -10.101 -1.268 1.508
50 HA PHE 161 HA PHE 161 -10.079 0.235 3.954
51 1HB PHE 161 HB2 PHE 161 -9.732 -2.726 3.441
52 2HB PHE 161 HB1 PHE 161 -9.913 -1.993 5.031
53 HD1 PHE 161 HD1 PHE 161 -11.622 -3.969 3.021
54 HD2 PHE 161 HD2 PHE 161 -12.033 -0.072 4.678
55 HE1 PHE 161 HE1 PHE 161 -14.068 -4.146 2.818
56 HE2 PHE 161 HE2 PHE 161 -14.480 -0.241 4.480
57 HZ PHE 161 HZ PHE 161 -15.500 -2.280 3.549
58 H PHE 162 HN PHE 162 -7.841 0.750 2.193
59 HA PHE 162 HA PHE 162 -5.737 0.598 4.087
60 1HB PHE 162 HB2 PHE 162 -5.813 -1.385 1.870
61 2HB PHE 162 HB1 PHE 162 -4.255 -0.659 2.281
62 HD1 PHE 162 HD1 PHE 162 -5.914 -3.519 2.712
63 HD2 PHE 162 HD2 PHE 162 -4.233 -0.435 5.113
64 HE1 PHE 162 HE1 PHE 162 -5.667 -5.109 4.574
65 HE2 PHE 162 HE2 PHE 162 -3.981 -2.017 6.979
66 HZ PHE 162 HZ PHE 162 -4.699 -4.358 6.712
67 H LEU 163 HN LEU 163 -7.049 1.629 1.078
68 HA LEU 163 HA LEU 163 -4.800 2.841 -0.085
69 1HB LEU 163 HB2 LEU 163 -7.010 2.553 -1.202
70 2HB LEU 163 HB1 LEU 163 -7.666 3.805 -0.164
71 HG LEU 163 HG LEU 163 -5.917 5.362 -1.157
72 1HD1 LEU 163 HD11 LEU 163 -5.695 3.084 -3.118
73 2HD1 LEU 163 HD12 LEU 163 -4.415 3.719 -2.085
74 3HD1 LEU 163 HD13 LEU 163 -5.075 4.713 -3.385
75 1HD2 LEU 163 HD21 LEU 163 -7.274 5.860 -3.079
76 2HD2 LEU 163 HD22 LEU 163 -8.324 5.357 -1.755
77 3HD2 LEU 163 HD23 LEU 163 -7.960 4.235 -3.066
78 H PHE 164 HN PHE 164 -6.963 3.782 2.477
79 HA PHE 164 HA PHE 164 -7.022 5.577 3.893
80 1HB PHE 164 HB2 PHE 164 -4.972 4.192 4.500
81 2HB PHE 164 HB1 PHE 164 -4.018 5.420 3.672
82 HD1 PHE 164 HD1 PHE 164 -6.542 5.032 6.379
83 HD2 PHE 164 HD2 PHE 164 -3.276 7.278 4.829
84 HE1 PHE 164 HE1 PHE 164 -6.505 6.388 8.432
85 HE2 PHE 164 HE2 PHE 164 -3.232 8.637 6.879
86 HZ PHE 164 HZ PHE 164 -4.848 8.192 8.685
87 H LEU 165 HN LEU 165 -7.229 6.387 1.179
88 HA LEU 165 HA LEU 165 -7.457 8.448 0.164
89 1HB LEU 165 HB2 LEU 165 -6.617 9.261 2.650
90 2HB LEU 165 HB1 LEU 165 -5.345 9.874 1.599
91 HG LEU 165 HG LEU 165 -6.956 11.140 0.313
92 1HD1 LEU 165 HD11 LEU 165 -8.911 9.932 0.202
93 2HD1 LEU 165 HD12 LEU 165 -9.350 11.208 1.336
94 3HD1 LEU 165 HD13 LEU 165 -8.933 9.602 1.934
95 1HD2 LEU 165 HD21 LEU 165 -7.880 11.816 3.031
96 2HD2 LEU 165 HD22 LEU 165 -7.126 12.829 1.800
97 3HD2 LEU 165 HD23 LEU 165 -6.133 11.763 2.794
98 H LEU 166 HN LEU 166 -4.402 7.001 0.916
99 HA LEU 166 HA LEU 166 -3.494 7.440 -1.766
100 1HB LEU 166 HB2 LEU 166 -1.863 8.977 -1.407
101 2HB LEU 166 HB1 LEU 166 -2.963 9.463 -0.128
102 HG LEU 166 HG LEU 166 -0.741 9.495 0.740
103 1HD1 LEU 166 HD11 LEU 166 -1.710 8.814 2.611
104 2HD1 LEU 166 HD12 LEU 166 -1.094 7.203 2.246
105 3HD1 LEU 166 HD13 LEU 166 -2.726 7.656 1.755
106 1HD2 LEU 166 HD21 LEU 166 0.891 8.025 0.300
107 2HD2 LEU 166 HD22 LEU 166 -0.148 7.536 -1.038
108 3HD2 LEU 166 HD23 LEU 166 -0.176 6.631 0.475
109 HA PRO 167 HA PRO 167 -1.999 3.372 -0.931
110 1HB PRO 167 HB2 PRO 167 0.059 3.378 -2.810
111 2HB PRO 167 HB1 PRO 167 -1.626 2.914 -3.111
112 1HG PRO 167 HG2 PRO 167 -0.244 5.507 -3.648
113 2HG PRO 167 HG1 PRO 167 -1.478 4.671 -4.607
114 1HD PRO 167 HD2 PRO 167 -2.091 6.795 -3.091
115 2HD PRO 167 HD1 PRO 167 -3.214 5.429 -3.262
116 HA PRO 168 HA PRO 168 1.571 4.431 1.597
117 1HB PRO 168 HB2 PRO 168 1.123 2.689 3.532
118 2HB PRO 168 HB1 PRO 168 0.001 4.045 3.294
119 1HG PRO 168 HG2 PRO 168 -0.291 1.180 2.488
120 2HG PRO 168 HG1 PRO 168 -1.505 2.285 3.158
121 1HD PRO 168 HD2 PRO 168 -1.131 1.694 0.450
122 2HD PRO 168 HD1 PRO 168 -2.053 3.065 1.096
123 H ILE 169 HN ILE 169 3.322 3.780 0.482
124 HA ILE 169 HA ILE 169 3.827 1.142 -0.429
125 HB ILE 169 HB ILE 169 4.837 3.343 -1.283
126 1HG1 ILE 169 HG12 ILE 169 5.480 1.057 -2.046
127 2HG1 ILE 169 HG11 ILE 169 6.798 2.221 -2.138
128 1HG2 ILE 169 HG21 ILE 169 6.973 4.015 -0.309
129 2HG2 ILE 169 HG22 ILE 169 6.787 2.808 0.965
130 3HG2 ILE 169 HG23 ILE 169 5.666 4.166 0.866
131 1HD1 ILE 169 HD11 ILE 169 7.205 1.177 0.324
132 2HD1 ILE 169 HD12 ILE 169 7.971 0.594 -1.154
133 3HD1 ILE 169 HD13 ILE 169 6.531 -0.211 -0.531
134 H ILE 170 HN ILE 170 4.935 3.000 2.316
135 HA ILE 170 HA ILE 170 6.717 1.049 3.311
136 HB ILE 170 HB ILE 170 6.904 2.497 5.250
137 1HG1 ILE 170 HG12 ILE 170 4.421 3.602 4.086
138 2HG1 ILE 170 HG11 ILE 170 4.870 3.406 5.772
139 1HG2 ILE 170 HG21 ILE 170 6.857 4.314 2.890
140 2HG2 ILE 170 HG22 ILE 170 7.953 2.933 2.918
141 3HG2 ILE 170 HG23 ILE 170 8.063 4.171 4.169
142 1HD1 ILE 170 HD11 ILE 170 6.575 5.345 5.109
143 2HD1 ILE 170 HD12 ILE 170 4.931 5.662 5.660
144 3HD1 ILE 170 HD13 ILE 170 5.300 5.675 3.935
145 H LEU 171 HN LEU 171 3.445 2.059 4.327
146 HA LEU 171 HA LEU 171 3.306 0.208 6.481
147 1HB LEU 171 HB2 LEU 171 1.825 2.190 6.278
148 2HB LEU 171 HB1 LEU 171 1.048 1.443 4.895
149 HG LEU 171 HG LEU 171 0.357 -0.445 6.406
150 1HD1 LEU 171 HD11 LEU 171 1.958 -0.181 8.178
151 2HD1 LEU 171 HD12 LEU 171 0.337 0.056 8.831
152 3HD1 LEU 171 HD13 LEU 171 1.375 1.447 8.518
153 1HD2 LEU 171 HD21 LEU 171 -0.615 2.342 6.500
154 2HD2 LEU 171 HD22 LEU 171 -1.237 1.250 7.738
155 3HD2 LEU 171 HD23 LEU 171 -1.450 0.861 6.030
156 H ASP 172 HN ASP 172 2.079 0.196 3.171
157 HA ASP 172 HA ASP 172 1.135 -2.497 3.285
158 1HB ASP 172 HB2 ASP 172 0.451 -0.512 1.686
159 2HB ASP 172 HB1 ASP 172 1.770 -1.144 0.690
160 H ALA 173 HN ALA 173 4.214 -1.229 3.214
161 HA ALA 173 HA ALA 173 5.459 -3.018 1.381
162 1HB ALA 173 HB1 ALA 173 7.385 -2.221 3.251
163 2HB ALA 173 HB2 ALA 173 6.282 -0.857 3.089
164 3HB ALA 173 HB3 ALA 173 7.078 -1.519 1.664
165 H GLY 174 HN GLY 174 5.914 -2.763 4.893
166 1HA GLY 174 HA2 GLY 174 5.989 -5.719 5.017
167 2HA GLY 174 HA1 GLY 174 6.994 -4.667 6.034
168 H TYR 175 HN TYR 175 4.441 -2.875 6.104
169 HA TYR 175 HA TYR 175 2.568 -2.596 7.368
170 1HB TYR 175 HB2 TYR 175 2.084 -5.025 6.681
171 2HB TYR 175 HB1 TYR 175 2.718 -5.468 8.262
172 HD1 TYR 175 HD1 TYR 175 1.349 -5.368 10.166
173 HD2 TYR 175 HD2 TYR 175 0.102 -3.423 6.594
174 HE1 TYR 175 HE1 TYR 175 -0.855 -4.946 11.172
175 HE2 TYR 175 HE2 TYR 175 -2.105 -2.996 7.590
176 HH TYR 175 HH TYR 175 -3.470 -4.372 9.700
177 H PHE 176 HN PHE 176 5.210 -4.448 8.787
178 HA PHE 176 HA PHE 176 4.640 -3.292 11.405
179 1HB PHE 176 HB2 PHE 176 6.518 -4.839 12.131
180 2HB PHE 176 HB1 PHE 176 5.058 -5.625 11.512
181 HD1 PHE 176 HD1 PHE 176 5.219 -7.188 9.814
182 HD2 PHE 176 HD2 PHE 176 8.444 -4.490 10.466
183 HE1 PHE 176 HE1 PHE 176 6.575 -8.420 8.172
184 HE2 PHE 176 HE2 PHE 176 9.807 -5.717 8.825
185 HZ PHE 176 HZ PHE 176 8.872 -7.684 7.674
186 H LEU 177 HN LEU 177 5.675 -1.704 9.144
187 HA LEU 177 HA LEU 177 8.360 -1.038 10.105
188 1HB LEU 177 HB2 LEU 177 6.937 -0.670 7.521
189 2HB LEU 177 HB1 LEU 177 8.150 0.517 7.958
190 HG LEU 177 HG LEU 177 8.575 -2.450 7.618
191 1HD1 LEU 177 HD11 LEU 177 8.491 -1.550 5.482
192 2HD1 LEU 177 HD12 LEU 177 10.211 -1.496 5.867
193 3HD1 LEU 177 HD13 LEU 177 9.236 -0.032 5.985
194 1HD2 LEU 177 HD21 LEU 177 11.043 -1.565 7.833
195 2HD2 LEU 177 HD22 LEU 177 10.106 -2.006 9.261
196 3HD2 LEU 177 HD23 LEU 177 10.271 -0.311 8.804
197 HA PRO 178 HA PRO 178 6.121 3.191 10.348
198 1HB PRO 178 HB2 PRO 178 3.295 2.834 9.838
199 2HB PRO 178 HB1 PRO 178 4.462 3.809 8.944
200 1HG PRO 178 HG2 PRO 178 3.285 1.565 7.933
201 2HG PRO 178 HG1 PRO 178 4.881 2.144 7.430
202 1HD PRO 178 HD2 PRO 178 4.180 -0.030 9.371
203 2HD PRO 178 HD1 PRO 178 5.437 -0.002 8.117
204 H LEU 179 HN LEU 179 4.269 0.394 11.397
205 HA LEU 179 HA LEU 179 2.920 1.639 13.548
206 1HB LEU 179 HB2 LEU 179 3.457 -1.142 12.678
207 2HB LEU 179 HB1 LEU 179 3.051 -0.916 14.368
208 HG LEU 179 HG LEU 179 1.102 -1.475 12.932
209 1HD1 LEU 179 HD11 LEU 179 -0.379 -0.020 14.010
210 2HD1 LEU 179 HD12 LEU 179 0.792 1.300 14.030
211 3HD1 LEU 179 HD13 LEU 179 1.021 -0.098 15.081
212 1HD2 LEU 179 HD21 LEU 179 1.103 1.291 11.849
213 2HD2 LEU 179 HD22 LEU 179 0.389 -0.183 11.193
214 3HD2 LEU 179 HD23 LEU 179 2.127 0.089 11.062
215 H ARG 180 HN ARG 180 5.702 -0.586 13.616
216 HA ARG 180 HA ARG 180 6.375 0.365 16.285
217 1HB ARG 180 HB2 ARG 180 8.297 -1.419 15.875
218 2HB ARG 180 HB1 ARG 180 6.671 -1.900 16.361
219 1HG ARG 180 HG2 ARG 180 7.344 -1.737 13.458
220 2HG ARG 180 HG1 ARG 180 7.912 -3.113 14.402
221 1HD ARG 180 HD2 ARG 180 5.195 -2.420 13.501
222 2HD ARG 180 HD1 ARG 180 5.924 -3.994 13.796
223 HE ARG 180 HE ARG 180 4.375 -2.424 15.641
224 1HH1 ARG 180 1HH1 ARG 180 6.770 -4.944 15.330
225 2HH1 ARG 180 2HH1 ARG 180 6.407 -5.652 16.867
226 1HH2 ARG 180 1HH2 ARG 180 3.895 -3.355 17.664
227 2HH2 ARG 180 2HH2 ARG 180 4.774 -4.750 18.193
228 1HG HSL 181 HG1 HSL 181 7.867 5.898 12.501
229 2HG HSL 181 HG2 HSL 181 6.459 4.948 13.212
230 H HSL 181 HN HSL 181 6.597 2.409 14.615
231 HA HSL 181 HA HSL 181 9.610 2.721 14.142
232 1HB HSL 181 HB1 HSL 181 9.245 3.986 12.226
233 2HB HSL 181 HB2 HSL 181 7.623 3.108 12.168
Start of MODEL 100
1 1H PHE 155 HT1 PHE 155 11.366 2.245 -1.246
2 2H PHE 155 HT2 PHE 155 9.988 2.675 -2.174
3 3H PHE 155 HT3 PHE 155 10.256 3.404 -0.644
4 HA PHE 155 HA PHE 155 10.946 5.018 -2.031
5 1HB PHE 155 HB2 PHE 155 13.060 3.282 -0.955
6 2HB PHE 155 HB1 PHE 155 13.596 4.400 -2.204
7 HD1 PHE 155 HD1 PHE 155 14.784 6.055 -1.123
8 HD2 PHE 155 HD2 PHE 155 11.035 4.818 0.466
9 HE1 PHE 155 HE1 PHE 155 14.897 7.863 0.542
10 HE2 PHE 155 HE2 PHE 155 11.140 6.624 2.132
11 HZ PHE 155 HZ PHE 155 13.073 8.150 2.172
12 H LEU 156 HN LEU 156 11.200 5.698 -4.083
13 HA LEU 156 HA LEU 156 12.515 4.175 -6.086
14 1HB LEU 156 HB2 LEU 156 9.521 4.281 -6.017
15 2HB LEU 156 HB1 LEU 156 10.373 4.144 -7.543
16 HG LEU 156 HG LEU 156 10.323 2.165 -5.274
17 1HD1 LEU 156 HD11 LEU 156 9.763 0.780 -7.488
18 2HD1 LEU 156 HD12 LEU 156 9.154 2.362 -7.978
19 3HD1 LEU 156 HD13 LEU 156 8.531 1.588 -6.520
20 1HD2 LEU 156 HD21 LEU 156 11.871 0.806 -6.639
21 2HD2 LEU 156 HD22 LEU 156 12.610 2.290 -6.038
22 3HD2 LEU 156 HD23 LEU 156 12.089 2.184 -7.718
23 H GLN 157 HN GLN 157 12.135 5.226 -8.320
24 HA GLN 157 HA GLN 157 12.580 7.080 -9.575
25 1HB GLN 157 HB2 GLN 157 10.083 7.167 -9.232
26 2HB GLN 157 HB1 GLN 157 10.366 8.331 -7.946
27 1HG GLN 157 HG2 GLN 157 9.738 9.336 -10.125
28 2HG GLN 157 HG1 GLN 157 11.272 9.914 -9.478
29 1HE2 GLN 157 HE21 GLN 157 12.143 10.519 -11.414
30 2HE2 GLN 157 HE22 GLN 157 12.583 9.398 -12.653
31 H SER 158 HN SER 158 13.989 6.808 -7.011
32 HA SER 158 HA SER 158 15.255 7.973 -5.530
33 1HB SER 158 HB2 SER 158 16.413 10.007 -6.796
34 2HB SER 158 HB1 SER 158 16.805 8.327 -7.199
35 HG SER 158 HG SER 158 15.238 10.187 -8.604
36 H ASP 159 HN ASP 159 12.707 8.581 -5.045
37 HA ASP 159 HA ASP 159 12.934 11.123 -3.779
38 1HB ASP 159 HB2 ASP 159 12.057 11.340 -6.345
39 2HB ASP 159 HB1 ASP 159 10.530 11.117 -5.497
40 H VAL 160 HN VAL 160 10.332 9.091 -5.050
41 HA VAL 160 HA VAL 160 8.720 7.843 -4.074
42 HB VAL 160 HB VAL 160 10.759 7.224 -2.511
43 1HG1 VAL 160 HG11 VAL 160 9.052 7.937 -0.245
44 2HG1 VAL 160 HG12 VAL 160 9.813 9.321 -1.019
45 3HG1 VAL 160 HG13 VAL 160 10.805 8.001 -0.409
46 1HG2 VAL 160 HG21 VAL 160 9.120 5.629 -2.922
47 2HG2 VAL 160 HG22 VAL 160 7.852 6.593 -2.164
48 3HG2 VAL 160 HG23 VAL 160 9.084 5.818 -1.168
49 H PHE 161 HN PHE 161 9.624 10.796 -2.412
50 HA PHE 161 HA PHE 161 7.063 11.202 -1.206
51 1HB PHE 161 HB2 PHE 161 9.659 12.432 -1.102
52 2HB PHE 161 HB1 PHE 161 8.438 13.668 -1.390
53 HD1 PHE 161 HD1 PHE 161 8.169 14.787 0.611
54 HD2 PHE 161 HD2 PHE 161 8.273 10.533 0.609
55 HE1 PHE 161 HE1 PHE 161 7.597 14.776 3.005
56 HE2 PHE 161 HE2 PHE 161 7.699 10.514 3.003
57 HZ PHE 161 HZ PHE 161 7.361 12.637 4.203
58 H PHE 162 HN PHE 162 7.519 10.927 -4.257
59 HA PHE 162 HA PHE 162 5.472 12.757 -5.002
60 1HB PHE 162 HB2 PHE 162 8.296 13.238 -5.881
61 2HB PHE 162 HB1 PHE 162 6.938 13.707 -6.908
62 HD1 PHE 162 HD1 PHE 162 8.988 14.600 -4.114
63 HD2 PHE 162 HD2 PHE 162 5.214 15.295 -5.956
64 HE1 PHE 162 HE1 PHE 162 8.766 16.703 -2.858
65 HE2 PHE 162 HE2 PHE 162 4.986 17.400 -4.702
66 HZ PHE 162 HZ PHE 162 6.763 18.107 -3.151
67 H LEU 163 HN LEU 163 6.966 9.861 -5.321
68 HA LEU 163 HA LEU 163 6.767 9.349 -8.095
69 1HB LEU 163 HB2 LEU 163 7.794 7.986 -6.013
70 2HB LEU 163 HB1 LEU 163 6.254 7.162 -6.151
71 HG LEU 163 HG LEU 163 8.517 7.250 -8.098
72 1HD1 LEU 163 HD11 LEU 163 6.874 4.858 -7.506
73 2HD1 LEU 163 HD12 LEU 163 7.946 5.457 -6.241
74 3HD1 LEU 163 HD13 LEU 163 8.605 4.998 -7.812
75 1HD2 LEU 163 HD21 LEU 163 5.619 6.936 -8.703
76 2HD2 LEU 163 HD22 LEU 163 6.794 5.967 -9.592
77 3HD2 LEU 163 HD23 LEU 163 6.885 7.728 -9.640
78 H PHE 164 HN PHE 164 4.648 8.925 -5.334
79 HA PHE 164 HA PHE 164 2.397 8.697 -5.127
80 1HB PHE 164 HB2 PHE 164 2.796 10.586 -7.079
81 2HB PHE 164 HB1 PHE 164 1.713 9.446 -7.880
82 HD1 PHE 164 HD1 PHE 164 0.050 8.548 -5.616
83 HD2 PHE 164 HD2 PHE 164 1.472 12.428 -6.633
84 HE1 PHE 164 HE1 PHE 164 -1.864 9.553 -4.442
85 HE2 PHE 164 HE2 PHE 164 -0.439 13.440 -5.460
86 HZ PHE 164 HZ PHE 164 -2.110 12.003 -4.362
87 H LEU 165 HN LEU 165 4.177 6.676 -6.861
88 HA LEU 165 HA LEU 165 2.290 5.259 -8.435
89 1HB LEU 165 HB2 LEU 165 5.010 5.172 -8.104
90 2HB LEU 165 HB1 LEU 165 4.494 3.686 -7.322
91 HG LEU 165 HG LEU 165 3.083 3.633 -9.686
92 1HD1 LEU 165 HD11 LEU 165 4.215 4.528 -11.413
93 2HD1 LEU 165 HD12 LEU 165 5.791 4.230 -10.678
94 3HD1 LEU 165 HD13 LEU 165 4.831 5.622 -10.174
95 1HD2 LEU 165 HD21 LEU 165 5.799 2.429 -9.620
96 2HD2 LEU 165 HD22 LEU 165 4.255 1.715 -10.081
97 3HD2 LEU 165 HD23 LEU 165 4.642 1.954 -8.377
98 H LEU 166 HN LEU 166 3.122 5.247 -5.068
99 HA LEU 166 HA LEU 166 0.913 3.506 -4.476
100 1HB LEU 166 HB2 LEU 166 3.375 2.330 -4.939
101 2HB LEU 166 HB1 LEU 166 3.310 2.455 -3.189
102 HG LEU 166 HG LEU 166 0.830 1.433 -3.774
103 1HD1 LEU 166 HD11 LEU 166 1.507 -0.569 -5.252
104 2HD1 LEU 166 HD12 LEU 166 2.799 0.487 -5.821
105 3HD1 LEU 166 HD13 LEU 166 1.114 0.964 -6.029
106 1HD2 LEU 166 HD21 LEU 166 3.064 -0.484 -3.384
107 2HD2 LEU 166 HD22 LEU 166 1.521 -0.354 -2.540
108 3HD2 LEU 166 HD23 LEU 166 2.829 0.769 -2.166
109 HA PRO 167 HA PRO 167 1.644 7.084 -1.537
110 1HB PRO 167 HB2 PRO 167 -1.048 6.427 -0.715
111 2HB PRO 167 HB1 PRO 167 -0.448 7.911 -1.469
112 1HG PRO 167 HG2 PRO 167 -1.845 5.658 -2.684
113 2HG PRO 167 HG1 PRO 167 -1.526 7.267 -3.347
114 1HD PRO 167 HD2 PRO 167 -0.337 4.975 -4.250
115 2HD PRO 167 HD1 PRO 167 0.392 6.587 -4.387
116 HA PRO 168 HA PRO 168 0.758 4.039 1.963
117 1HB PRO 168 HB2 PRO 168 -0.608 1.807 1.600
118 2HB PRO 168 HB1 PRO 168 -1.429 3.381 1.541
119 1HG PRO 168 HG2 PRO 168 -0.549 1.624 -0.721
120 2HG PRO 168 HG1 PRO 168 -2.074 2.504 -0.518
121 1HD PRO 168 HD2 PRO 168 0.104 3.402 -1.988
122 2HD PRO 168 HD1 PRO 168 -1.194 4.431 -1.356
123 H ILE 169 HN ILE 169 3.095 3.968 0.713
124 HA ILE 169 HA ILE 169 3.973 1.327 0.004
125 HB ILE 169 HB ILE 169 4.905 3.677 -0.696
126 1HG1 ILE 169 HG12 ILE 169 5.705 1.467 -1.490
127 2HG1 ILE 169 HG11 ILE 169 7.009 2.638 -1.320
128 1HG2 ILE 169 HG21 ILE 169 6.639 4.588 0.555
129 2HG2 ILE 169 HG22 ILE 169 6.833 3.128 1.524
130 3HG2 ILE 169 HG23 ILE 169 5.430 4.167 1.770
131 1HD1 ILE 169 HD11 ILE 169 6.551 0.110 0.072
132 2HD1 ILE 169 HD12 ILE 169 7.046 1.444 1.115
133 3HD1 ILE 169 HD13 ILE 169 8.051 0.976 -0.257
134 H ILE 170 HN ILE 170 3.999 3.344 2.815
135 HA ILE 170 HA ILE 170 5.861 1.913 4.382
136 HB ILE 170 HB ILE 170 3.589 3.600 5.409
137 1HG1 ILE 170 HG12 ILE 170 4.679 4.951 3.771
138 2HG1 ILE 170 HG11 ILE 170 5.255 5.485 5.345
139 1HG2 ILE 170 HG21 ILE 170 5.867 2.295 6.624
140 2HG2 ILE 170 HG22 ILE 170 4.459 3.041 7.377
141 3HG2 ILE 170 HG23 ILE 170 5.854 4.029 6.945
142 1HD1 ILE 170 HD11 ILE 170 6.788 4.807 3.146
143 2HD1 ILE 170 HD12 ILE 170 6.963 3.439 4.244
144 3HD1 ILE 170 HD13 ILE 170 7.355 5.066 4.795
145 H LEU 171 HN LEU 171 2.292 1.881 4.326
146 HA LEU 171 HA LEU 171 2.029 -0.086 6.348
147 1HB LEU 171 HB2 LEU 171 0.062 0.306 4.105
148 2HB LEU 171 HB1 LEU 171 -0.256 -0.202 5.753
149 HG LEU 171 HG LEU 171 0.504 2.569 4.833
150 1HD1 LEU 171 HD11 LEU 171 -1.663 3.156 5.077
151 2HD1 LEU 171 HD12 LEU 171 -1.939 2.017 6.395
152 3HD1 LEU 171 HD13 LEU 171 -1.923 1.447 4.725
153 1HD2 LEU 171 HD21 LEU 171 0.187 1.433 7.602
154 2HD2 LEU 171 HD22 LEU 171 0.117 3.160 7.246
155 3HD2 LEU 171 HD23 LEU 171 1.591 2.251 6.918
156 H ASP 172 HN ASP 172 2.000 -0.224 2.827
157 HA ASP 172 HA ASP 172 1.888 -3.085 2.719
158 1HB ASP 172 HB2 ASP 172 2.115 -0.873 0.727
159 2HB ASP 172 HB1 ASP 172 2.615 -2.497 0.233
160 H ALA 173 HN ALA 173 4.327 -0.969 3.531
161 HA ALA 173 HA ALA 173 6.524 -2.188 2.181
162 1HB ALA 173 HB1 ALA 173 6.141 -0.020 4.066
163 2HB ALA 173 HB2 ALA 173 7.392 -0.244 2.846
164 3HB ALA 173 HB3 ALA 173 7.573 -0.978 4.440
165 H GLY 174 HN GLY 174 5.860 -2.019 5.658
166 1HA GLY 174 HA2 GLY 174 6.724 -4.844 5.895
167 2HA GLY 174 HA1 GLY 174 7.142 -3.603 7.095
168 H TYR 175 HN TYR 175 4.383 -2.436 6.580
169 HA TYR 175 HA TYR 175 2.271 -2.562 7.321
170 1HB TYR 175 HB2 TYR 175 2.274 -4.880 6.355
171 2HB TYR 175 HB1 TYR 175 2.766 -5.482 7.933
172 HD1 TYR 175 HD1 TYR 175 0.948 -6.746 8.659
173 HD2 TYR 175 HD2 TYR 175 0.273 -2.839 7.118
174 HE1 TYR 175 HE1 TYR 175 -1.407 -6.888 9.350
175 HE2 TYR 175 HE2 TYR 175 -2.084 -2.969 7.804
176 HH TYR 175 HH TYR 175 -3.316 -4.595 9.863
177 H PHE 176 HN PHE 176 4.977 -3.322 9.199
178 HA PHE 176 HA PHE 176 3.504 -3.249 11.721
179 1HB PHE 176 HB2 PHE 176 5.419 -4.867 11.352
180 2HB PHE 176 HB1 PHE 176 6.499 -3.465 11.317
181 HD1 PHE 176 HD1 PHE 176 4.062 -5.281 13.440
182 HD2 PHE 176 HD2 PHE 176 7.310 -2.536 13.298
183 HE1 PHE 176 HE1 PHE 176 4.232 -5.363 15.893
184 HE2 PHE 176 HE2 PHE 176 7.488 -2.614 15.751
185 HZ PHE 176 HZ PHE 176 5.948 -4.029 17.052
186 H LEU 177 HN LEU 177 3.197 -1.006 10.269
187 HA LEU 177 HA LEU 177 3.391 1.234 10.231
188 1HB LEU 177 HB2 LEU 177 4.195 0.604 13.059
189 2HB LEU 177 HB1 LEU 177 4.130 2.258 12.482
190 HG LEU 177 HG LEU 177 1.707 0.610 12.036
191 1HD1 LEU 177 HD11 LEU 177 2.817 1.229 14.718
192 2HD1 LEU 177 HD12 LEU 177 1.829 -0.132 14.185
193 3HD1 LEU 177 HD13 LEU 177 1.084 1.441 14.470
194 1HD2 LEU 177 HD21 LEU 177 2.434 3.446 12.552
195 2HD2 LEU 177 HD22 LEU 177 0.823 2.897 13.014
196 3HD2 LEU 177 HD23 LEU 177 1.356 2.756 11.338
197 HA PRO 178 HA PRO 178 8.081 0.812 9.607
198 1HB PRO 178 HB2 PRO 178 7.287 0.895 6.758
199 2HB PRO 178 HB1 PRO 178 8.422 -0.188 7.575
200 1HG PRO 178 HG2 PRO 178 6.062 -1.057 6.741
201 2HG PRO 178 HG1 PRO 178 6.721 -1.604 8.293
202 1HD PRO 178 HD2 PRO 178 4.667 0.519 7.745
203 2HD PRO 178 HD1 PRO 178 4.634 -0.794 8.940
204 H LEU 179 HN LEU 179 6.934 3.106 10.431
205 HA LEU 179 HA LEU 179 7.338 5.087 8.307
206 1HB LEU 179 HB2 LEU 179 5.843 5.064 10.885
207 2HB LEU 179 HB1 LEU 179 6.462 6.597 10.303
208 HG LEU 179 HG LEU 179 4.749 4.836 8.571
209 1HD1 LEU 179 HD11 LEU 179 3.023 6.720 9.365
210 2HD1 LEU 179 HD12 LEU 179 3.967 6.549 10.845
211 3HD1 LEU 179 HD13 LEU 179 3.159 5.146 10.148
212 1HD2 LEU 179 HD21 LEU 179 6.209 6.950 7.874
213 2HD2 LEU 179 HD22 LEU 179 4.770 7.795 8.444
214 3HD2 LEU 179 HD23 LEU 179 4.639 6.603 7.150
215 H ARG 180 HN ARG 180 7.991 4.944 11.810
216 HA ARG 180 HA ARG 180 10.353 6.593 11.444
217 1HB ARG 180 HB2 ARG 180 9.199 5.406 13.979
218 2HB ARG 180 HB1 ARG 180 10.460 6.641 13.882
219 1HG ARG 180 HG2 ARG 180 8.860 8.165 14.021
220 2HG ARG 180 HG1 ARG 180 8.330 7.672 12.411
221 1HD ARG 180 HD2 ARG 180 7.183 5.756 13.955
222 2HD ARG 180 HD1 ARG 180 7.139 7.141 15.045
223 HE ARG 180 HE ARG 180 6.184 7.718 12.395
224 1HH1 ARG 180 1HH1 ARG 180 5.310 6.528 15.557
225 2HH1 ARG 180 2HH1 ARG 180 3.632 6.921 15.378
226 1HH2 ARG 180 1HH2 ARG 180 3.979 8.235 12.158
227 2HH2 ARG 180 2HH2 ARG 180 2.876 7.889 13.448
228 1HG HSL 181 HG1 HSL 181 12.024 0.491 8.508
229 2HG HSL 181 HG2 HSL 181 10.930 1.949 8.244
230 H HSL 181 HN HSL 181 10.550 4.190 10.116
231 HA HSL 181 HA HSL 181 12.607 2.646 11.784
232 1HB HSL 181 HB1 HSL 181 11.917 0.624 10.871
233 2HB HSL 181 HB2 HSL 181 10.331 1.504 10.535
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