Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
2771 | 1ckx RC | 4596 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 1H MET 1 1H MET 1 20.374 4.764 -3.684
2 2H MET 1 2H MET 1 18.933 5.331 -4.384
3 3H MET 1 3H MET 1 20.202 6.411 -4.051
4 HA MET 1 HA MET 1 19.876 6.263 -1.729
5 1HB MET 1 1HB MET 1 17.865 6.956 -3.649
6 2HB MET 1 2HB MET 1 17.062 6.319 -2.213
7 1HG MET 1 1HG MET 1 19.127 7.971 -1.245
8 2HG MET 1 2HG MET 1 18.390 8.867 -2.574
9 1HE MET 1 1HE MET 1 18.517 8.183 0.875
10 2HE MET 1 2HE MET 1 18.256 9.887 0.512
11 3HE MET 1 3HE MET 1 17.099 9.022 1.520
12 HA PRO 2 HA PRO 2 18.834 2.041 -0.640
13 1HB PRO 2 1HB PRO 2 19.565 2.260 1.989
14 2HB PRO 2 2HB PRO 2 20.739 2.037 0.676
15 1HG PRO 2 1HG PRO 2 19.984 4.512 2.140
16 2HG PRO 2 2HG PRO 2 21.567 3.990 1.545
17 1HD PRO 2 1HD PRO 2 20.002 5.851 0.289
18 2HD PRO 2 2HD PRO 2 21.206 4.843 -0.543
19 H GLY 3 H GLY 3 16.524 3.009 -0.990
20 1HA GLY 3 1HA GLY 3 15.172 3.167 1.674
21 2HA GLY 3 2HA GLY 3 14.683 4.207 0.334
22 H THR 4 H THR 4 15.682 0.927 -0.283
23 HA THR 4 HA THR 4 13.343 0.260 -1.729
24 HB THR 4 HB THR 4 15.767 -0.908 -1.376
25 HG1 THR 4 HG1 THR 4 14.531 -1.343 -3.130
26 1HG2 THR 4 1HG2 THR 4 13.798 -2.585 0.203
27 2HG2 THR 4 2HG2 THR 4 15.350 -3.175 -0.390
28 3HG2 THR 4 3HG2 THR 4 15.299 -1.872 0.795
29 H ILE 5 H ILE 5 14.242 -0.580 1.612
30 HA ILE 5 HA ILE 5 11.761 -1.909 2.209
31 HB ILE 5 HB ILE 5 13.813 -0.613 4.023
32 1HG1 ILE 5 1HG1 ILE 5 14.724 -2.468 2.750
33 2HG1 ILE 5 2HG1 ILE 5 14.437 -3.023 4.400
34 1HG2 ILE 5 1HG2 ILE 5 11.174 -1.602 4.592
35 2HG2 ILE 5 2HG2 ILE 5 12.363 -2.679 5.326
36 3HG2 ILE 5 3HG2 ILE 5 12.372 -0.959 5.715
37 1HD1 ILE 5 1HD1 ILE 5 12.014 -3.513 3.145
38 2HD1 ILE 5 2HD1 ILE 5 13.198 -3.911 1.899
39 3HD1 ILE 5 3HD1 ILE 5 13.262 -4.717 3.467
40 H LYS 6 H LYS 6 12.909 1.410 2.892
41 HA LYS 6 HA LYS 6 10.762 2.422 4.329
42 1HB LYS 6 1HB LYS 6 12.649 3.845 3.788
43 2HB LYS 6 2HB LYS 6 12.287 3.743 2.065
44 1HG LYS 6 1HG LYS 6 11.406 5.843 2.799
45 2HG LYS 6 2HG LYS 6 10.018 4.771 2.611
46 1HD LYS 6 1HD LYS 6 10.440 4.211 5.135
47 2HD LYS 6 2HD LYS 6 11.334 5.732 5.138
48 1HE LYS 6 1HE LYS 6 9.379 6.968 4.420
49 2HE LYS 6 2HE LYS 6 8.470 5.466 4.155
50 1HZ LYS 6 1HZ LYS 6 9.733 5.910 6.767
51 2HZ LYS 6 2HZ LYS 6 8.291 6.739 6.423
52 3HZ LYS 6 3HZ LYS 6 8.323 5.043 6.385
53 H GLU 7 H GLU 7 10.903 1.686 0.887
54 HA GLU 7 HA GLU 7 8.373 2.890 0.214
55 1HB GLU 7 1HB GLU 7 9.629 0.487 -1.137
56 2HB GLU 7 2HB GLU 7 8.536 1.674 -1.847
57 1HG GLU 7 1HG GLU 7 10.636 3.204 -0.829
58 2HG GLU 7 2HG GLU 7 11.430 1.796 -1.532
59 H ASN 8 H ASN 8 9.314 -0.451 1.055
60 HA ASN 8 HA ASN 8 6.757 -1.628 0.878
61 1HB ASN 8 1HB ASN 8 8.571 -3.098 1.203
62 2HB ASN 8 2HB ASN 8 9.133 -2.204 2.607
63 1HD2 ASN 8 2HD2 ASN 8 5.903 -3.557 1.732
64 2HD2 ASN 8 1HD2 ASN 8 5.713 -4.423 3.181
65 H ILE 9 H ILE 9 7.943 0.720 3.079
66 HA ILE 9 HA ILE 9 5.911 0.115 5.137
67 HB ILE 9 HB ILE 9 7.611 2.594 5.091
68 1HG1 ILE 9 1HG1 ILE 9 9.073 0.640 4.550
69 2HG1 ILE 9 2HG1 ILE 9 9.431 1.345 6.119
70 1HG2 ILE 9 1HG2 ILE 9 5.758 1.939 6.823
71 2HG2 ILE 9 2HG2 ILE 9 6.973 0.816 7.434
72 3HG2 ILE 9 3HG2 ILE 9 7.304 2.548 7.415
73 1HD1 ILE 9 1HD1 ILE 9 7.392 -0.611 6.497
74 2HD1 ILE 9 2HD1 ILE 9 8.671 -1.345 5.531
75 3HD1 ILE 9 3HD1 ILE 9 9.048 -0.639 7.103
76 H ILE 10 H ILE 10 6.191 1.924 2.263
77 HA ILE 10 HA ILE 10 3.826 3.600 3.045
78 HB ILE 10 HB ILE 10 6.214 4.537 2.170
79 1HG1 ILE 10 1HG1 ILE 10 4.396 5.948 2.939
80 2HG1 ILE 10 2HG1 ILE 10 4.932 6.548 1.369
81 1HG2 ILE 10 1HG2 ILE 10 5.955 3.279 0.003
82 2HG2 ILE 10 2HG2 ILE 10 4.576 4.315 -0.363
83 3HG2 ILE 10 3HG2 ILE 10 6.185 5.017 -0.190
84 1HD1 ILE 10 1HD1 ILE 10 3.046 4.716 0.616
85 2HD1 ILE 10 2HD1 ILE 10 2.363 5.308 2.131
86 3HD1 ILE 10 3HD1 ILE 10 2.724 6.438 0.826
87 H PHE 11 H PHE 11 5.353 1.609 0.626
88 HA PHE 11 HA PHE 11 3.455 1.591 -1.418
89 1HB PHE 11 1HB PHE 11 5.792 0.300 -0.828
90 2HB PHE 11 2HB PHE 11 4.629 -1.008 -0.701
91 HD1 PHE 11 HD1 PHE 11 5.263 1.960 -2.886
92 HD2 PHE 11 HD2 PHE 11 4.224 -2.195 -2.642
93 HE1 PHE 11 HE1 PHE 11 5.156 1.845 -5.367
94 HE2 PHE 11 HE2 PHE 11 4.114 -2.319 -5.123
95 HZ PHE 11 HZ PHE 11 4.581 -0.296 -6.485
96 H GLY 12 H GLY 12 3.446 -0.052 1.707
97 1HA GLY 12 1HA GLY 12 1.123 -1.702 1.112
98 2HA GLY 12 2HA GLY 12 1.806 -1.421 2.716
99 H VAL 13 H VAL 13 1.709 1.394 2.739
100 HA VAL 13 HA VAL 13 -0.946 1.891 3.631
101 HB VAL 13 HB VAL 13 1.234 3.793 2.716
102 1HG1 VAL 13 1HG1 VAL 13 -1.543 4.249 3.663
103 2HG1 VAL 13 2HG1 VAL 13 -0.296 5.256 4.399
104 3HG1 VAL 13 3HG1 VAL 13 -0.517 5.265 2.650
105 1HG2 VAL 13 1HG2 VAL 13 1.177 2.144 4.900
106 2HG2 VAL 13 2HG2 VAL 13 2.042 3.680 4.843
107 3HG2 VAL 13 3HG2 VAL 13 0.429 3.602 5.553
108 H SER 14 H SER 14 0.423 1.799 0.480
109 HA SER 14 HA SER 14 -1.836 3.337 -0.691
110 1HB SER 14 1HB SER 14 0.737 3.466 -1.365
111 2HB SER 14 2HB SER 14 0.311 2.074 -2.356
112 HG SER 14 HG SER 14 -0.692 4.710 -2.424
113 H TYR 15 H TYR 15 -0.205 0.175 -1.111
114 HA TYR 15 HA TYR 15 -2.179 -0.964 -2.823
115 1HB TYR 15 1HB TYR 15 0.216 -1.794 -1.858
116 2HB TYR 15 2HB TYR 15 -0.870 -2.779 -0.885
117 HD1 TYR 15 HD1 TYR 15 -1.304 -1.529 -4.381
118 HD2 TYR 15 HD2 TYR 15 -0.734 -4.937 -1.830
119 HE1 TYR 15 HE1 TYR 15 -1.670 -3.038 -6.315
120 HE2 TYR 15 HE2 TYR 15 -1.100 -6.446 -3.763
121 HH TYR 15 HH TYR 15 -2.094 -5.191 -6.911
122 H ASP 16 H ASP 16 -1.773 -1.280 0.725
123 HA ASP 16 HA ASP 16 -4.052 -2.817 1.270
124 1HB ASP 16 1HB ASP 16 -3.166 -0.433 2.925
125 2HB ASP 16 2HB ASP 16 -4.025 -1.863 3.495
126 H GLU 17 H GLU 17 -3.778 0.471 0.202
127 HA GLU 17 HA GLU 17 -6.599 1.096 0.786
128 1HB GLU 17 1HB GLU 17 -4.682 2.791 0.895
129 2HB GLU 17 2HB GLU 17 -4.656 2.725 -0.867
130 1HG GLU 17 1HG GLU 17 -6.150 4.458 -0.607
131 2HG GLU 17 2HG GLU 17 -7.286 3.111 -0.528
132 H TYR 18 H TYR 18 -4.639 -0.140 -1.808
133 HA TYR 18 HA TYR 18 -6.711 0.419 -3.839
134 1HB TYR 18 1HB TYR 18 -3.952 -0.770 -3.865
135 2HB TYR 18 2HB TYR 18 -5.043 -1.082 -5.216
136 HD1 TYR 18 HD1 TYR 18 -6.553 1.359 -5.525
137 HD2 TYR 18 HD2 TYR 18 -2.404 0.857 -4.533
138 HE1 TYR 18 HE1 TYR 18 -6.062 3.610 -6.443
139 HE2 TYR 18 HE2 TYR 18 -1.913 3.108 -5.452
140 HH TYR 18 HH TYR 18 -4.462 5.303 -6.391
141 H ARG 19 H ARG 19 -5.615 -2.204 -1.796
142 HA ARG 19 HA ARG 19 -7.350 -4.130 -3.237
143 1HB ARG 19 1HB ARG 19 -5.394 -4.459 -0.944
144 2HB ARG 19 2HB ARG 19 -6.386 -5.773 -1.581
145 1HG ARG 19 1HG ARG 19 -5.401 -5.153 -3.884
146 2HG ARG 19 2HG ARG 19 -4.197 -4.234 -2.979
147 1HD ARG 19 1HD ARG 19 -3.173 -6.334 -3.215
148 2HD ARG 19 2HD ARG 19 -3.897 -6.433 -1.610
149 HE ARG 19 HE ARG 19 -5.875 -7.431 -3.252
150 1HH1 ARG 19 1HH1 ARG 19 -3.880 -8.326 -5.203
151 2HH1 ARG 19 2HH1 ARG 19 -3.385 -9.869 -4.592
152 1HH2 ARG 19 1HH2 ARG 19 -4.663 -9.316 -1.415
153 2HH2 ARG 19 2HH2 ARG 19 -3.832 -10.432 -2.448
154 H TYR 20 H TYR 20 -7.667 -1.861 -0.810
155 HA TYR 20 HA TYR 20 -9.505 -3.463 0.857
156 1HB TYR 20 1HB TYR 20 -8.048 -1.859 1.993
157 2HB TYR 20 2HB TYR 20 -8.682 -0.547 0.999
158 HD1 TYR 20 HD1 TYR 20 -11.033 0.204 1.250
159 HD2 TYR 20 HD2 TYR 20 -9.316 -2.760 3.843
160 HE1 TYR 20 HE1 TYR 20 -12.899 0.523 2.850
161 HE2 TYR 20 HE2 TYR 20 -11.184 -2.440 5.443
162 HH TYR 20 HH TYR 20 -13.823 -1.480 5.019
163 H ARG 21 H ARG 21 -9.626 -0.740 -1.431
164 HA ARG 21 HA ARG 21 -12.485 -0.356 -1.160
165 1HB ARG 21 1HB ARG 21 -10.310 0.819 -2.658
166 2HB ARG 21 2HB ARG 21 -11.693 0.532 -3.717
167 1HG ARG 21 1HG ARG 21 -13.155 1.643 -2.018
168 2HG ARG 21 2HG ARG 21 -11.708 2.039 -1.093
169 1HD ARG 21 1HD ARG 21 -11.215 3.778 -2.447
170 2HD ARG 21 2HD ARG 21 -11.437 2.796 -3.895
171 HE ARG 21 HE ARG 21 -13.892 3.286 -3.693
172 1HH1 ARG 21 1HH1 ARG 21 -11.488 5.547 -3.021
173 2HH1 ARG 21 2HH1 ARG 21 -12.560 6.756 -2.397
174 1HH2 ARG 21 1HH2 ARG 21 -15.342 4.687 -2.433
175 2HH2 ARG 21 2HH2 ARG 21 -14.743 6.270 -2.068
176 H SER 22 H SER 22 -10.462 -2.469 -3.045
177 HA SER 22 HA SER 22 -12.437 -3.159 -5.037
178 1HB SER 22 1HB SER 22 -10.324 -3.792 -5.735
179 2HB SER 22 2HB SER 22 -9.825 -4.289 -4.121
180 HG SER 22 HG SER 22 -10.509 -6.224 -4.553
181 H VAL 23 H VAL 23 -11.243 -5.043 -2.228
182 HA VAL 23 HA VAL 23 -13.221 -7.070 -2.372
183 HB VAL 23 HB VAL 23 -11.771 -5.979 0.057
184 1HG1 VAL 23 1HG1 VAL 23 -13.957 -7.524 0.205
185 2HG1 VAL 23 2HG1 VAL 23 -12.770 -8.786 -0.125
186 3HG1 VAL 23 3HG1 VAL 23 -12.585 -7.748 1.289
187 1HG2 VAL 23 1HG2 VAL 23 -11.163 -8.097 -2.005
188 2HG2 VAL 23 2HG2 VAL 23 -10.133 -6.777 -1.450
189 3HG2 VAL 23 3HG2 VAL 23 -10.440 -8.159 -0.398
190 H ILE 24 H ILE 24 -13.307 -3.890 -0.822
191 HA ILE 24 HA ILE 24 -16.043 -4.473 0.183
192 HB ILE 24 HB ILE 24 -14.103 -2.200 0.696
193 1HG1 ILE 24 1HG1 ILE 24 -14.229 -3.088 3.017
194 2HG1 ILE 24 2HG1 ILE 24 -15.295 -4.373 2.450
195 1HG2 ILE 24 1HG2 ILE 24 -17.023 -2.499 1.324
196 2HG2 ILE 24 2HG2 ILE 24 -15.975 -1.686 2.486
197 3HG2 ILE 24 3HG2 ILE 24 -16.128 -1.057 0.846
198 1HD1 ILE 24 1HD1 ILE 24 -12.751 -4.049 0.956
199 2HD1 ILE 24 2HD1 ILE 24 -12.604 -4.650 2.607
200 3HD1 ILE 24 3HD1 ILE 24 -13.595 -5.521 1.436
201 H LYS 25 H LYS 25 -15.059 -3.817 -2.705
202 HA LYS 25 HA LYS 25 -16.194 -1.282 -3.423
203 1HB LYS 25 1HB LYS 25 -14.661 -2.466 -4.921
204 2HB LYS 25 2HB LYS 25 -15.811 -3.794 -5.080
205 1HG LYS 25 1HG LYS 25 -17.111 -1.276 -5.658
206 2HG LYS 25 2HG LYS 25 -15.677 -1.469 -6.669
207 1HD LYS 25 1HD LYS 25 -17.600 -3.758 -6.325
208 2HD LYS 25 2HD LYS 25 -17.940 -2.482 -7.495
209 1HE LYS 25 1HE LYS 25 -15.176 -3.314 -7.733
210 2HE LYS 25 2HE LYS 25 -16.258 -4.712 -7.891
211 1HZ LYS 25 1HZ LYS 25 -17.659 -3.028 -9.280
212 2HZ LYS 25 2HZ LYS 25 -16.163 -2.250 -9.491
213 3HZ LYS 25 3HZ LYS 25 -16.361 -3.854 -10.003
214 H ALA 26 H ALA 26 -18.304 -0.848 -2.909
215 HA ALA 26 HA ALA 26 -20.644 -1.029 -2.957
216 1HB ALA 26 1HB ALA 26 -20.220 -1.558 -5.371
217 2HB ALA 26 2HB ALA 26 -20.133 -3.266 -4.941
218 3HB ALA 26 3HB ALA 26 -21.641 -2.377 -4.722
Start of MODEL 2
1 1H MET 1 1H MET 1 18.861 4.439 -4.114
2 2H MET 1 2H MET 1 19.116 5.888 -4.964
3 3H MET 1 3H MET 1 19.774 5.688 -3.414
4 HA MET 1 HA MET 1 17.873 7.074 -3.155
5 1HB MET 1 1HB MET 1 17.140 5.706 -5.461
6 2HB MET 1 2HB MET 1 15.964 5.151 -4.270
7 1HG MET 1 1HG MET 1 15.167 7.326 -3.858
8 2HG MET 1 2HG MET 1 16.609 8.081 -4.535
9 1HE MET 1 1HE MET 1 13.360 6.635 -4.775
10 2HE MET 1 2HE MET 1 13.032 8.239 -5.423
11 3HE MET 1 3HE MET 1 12.774 6.819 -6.433
12 HA PRO 2 HA PRO 2 17.600 3.881 0.107
13 1HB PRO 2 1HB PRO 2 18.072 5.613 2.170
14 2HB PRO 2 2HB PRO 2 19.374 4.861 1.227
15 1HG PRO 2 1HG PRO 2 18.259 7.609 1.061
16 2HG PRO 2 2HG PRO 2 19.925 7.049 0.853
17 1HD PRO 2 1HD PRO 2 18.230 7.696 -1.214
18 2HD PRO 2 2HD PRO 2 19.630 6.614 -1.362
19 H GLY 3 H GLY 3 15.237 4.245 -0.810
20 1HA GLY 3 1HA GLY 3 13.657 5.633 1.317
21 2HA GLY 3 2HA GLY 3 13.197 5.737 -0.383
22 H THR 4 H THR 4 14.524 2.722 0.512
23 HA THR 4 HA THR 4 12.141 1.291 -0.143
24 HB THR 4 HB THR 4 14.789 0.637 0.191
25 HG1 THR 4 HG1 THR 4 12.416 -0.755 -0.184
26 1HG2 THR 4 1HG2 THR 4 13.257 -0.688 2.446
27 2HG2 THR 4 2HG2 THR 4 14.888 -1.113 1.929
28 3HG2 THR 4 3HG2 THR 4 14.572 0.471 2.637
29 H ILE 5 H ILE 5 13.626 2.054 3.002
30 HA ILE 5 HA ILE 5 11.863 0.728 4.718
31 HB ILE 5 HB ILE 5 13.099 3.479 5.052
32 1HG1 ILE 5 1HG1 ILE 5 13.956 0.690 5.883
33 2HG1 ILE 5 2HG1 ILE 5 14.777 1.754 4.739
34 1HG2 ILE 5 1HG2 ILE 5 11.075 2.779 6.553
35 2HG2 ILE 5 2HG2 ILE 5 12.231 1.677 7.301
36 3HG2 ILE 5 3HG2 ILE 5 12.527 3.415 7.325
37 1HD1 ILE 5 1HD1 ILE 5 14.786 3.423 6.795
38 2HD1 ILE 5 2HD1 ILE 5 14.637 1.933 7.726
39 3HD1 ILE 5 3HD1 ILE 5 16.019 2.170 6.655
40 H LYS 6 H LYS 6 11.351 3.737 2.940
41 HA LYS 6 HA LYS 6 8.781 4.243 4.266
42 1HB LYS 6 1HB LYS 6 9.664 5.564 1.709
43 2HB LYS 6 2HB LYS 6 8.711 6.237 3.032
44 1HG LYS 6 1HG LYS 6 10.741 6.067 4.500
45 2HG LYS 6 2HG LYS 6 11.668 5.575 3.083
46 1HD LYS 6 1HD LYS 6 11.705 7.679 2.217
47 2HD LYS 6 2HD LYS 6 10.047 8.018 2.715
48 1HE LYS 6 1HE LYS 6 12.098 7.762 4.877
49 2HE LYS 6 2HE LYS 6 12.105 9.243 3.900
50 1HZ LYS 6 1HZ LYS 6 9.639 8.084 5.072
51 2HZ LYS 6 2HZ LYS 6 10.554 9.276 5.856
52 3HZ LYS 6 3HZ LYS 6 9.827 9.614 4.358
53 H GLU 7 H GLU 7 9.928 2.583 1.428
54 HA GLU 7 HA GLU 7 7.257 2.493 0.195
55 1HB GLU 7 1HB GLU 7 9.680 0.871 -0.599
56 2HB GLU 7 2HB GLU 7 8.305 1.332 -1.600
57 1HG GLU 7 1HG GLU 7 9.499 3.700 -0.479
58 2HG GLU 7 2HG GLU 7 10.744 2.737 -1.276
59 H ASN 8 H ASN 8 9.523 0.183 1.718
60 HA ASN 8 HA ASN 8 7.882 -2.116 1.530
61 1HB ASN 8 1HB ASN 8 10.172 -2.354 2.213
62 2HB ASN 8 2HB ASN 8 9.901 -1.318 3.606
63 1HD2 ASN 8 2HD2 ASN 8 9.608 -2.468 5.520
64 2HD2 ASN 8 1HD2 ASN 8 8.941 -4.025 5.628
65 H ILE 9 H ILE 9 7.426 0.732 3.339
66 HA ILE 9 HA ILE 9 5.591 -0.627 5.254
67 HB ILE 9 HB ILE 9 6.633 2.210 5.192
68 1HG1 ILE 9 1HG1 ILE 9 7.379 -0.227 6.830
69 2HG1 ILE 9 2HG1 ILE 9 8.405 0.621 5.673
70 1HG2 ILE 9 1HG2 ILE 9 4.430 1.003 6.578
71 2HG2 ILE 9 2HG2 ILE 9 5.692 1.376 7.752
72 3HG2 ILE 9 3HG2 ILE 9 5.039 2.651 6.724
73 1HD1 ILE 9 1HD1 ILE 9 8.210 2.674 7.065
74 2HD1 ILE 9 2HD1 ILE 9 7.296 1.743 8.252
75 3HD1 ILE 9 3HD1 ILE 9 8.982 1.339 7.922
76 H ILE 10 H ILE 10 5.562 0.958 2.302
77 HA ILE 10 HA ILE 10 2.703 1.756 2.694
78 HB ILE 10 HB ILE 10 4.730 3.477 2.078
79 1HG1 ILE 10 1HG1 ILE 10 2.564 4.274 2.652
80 2HG1 ILE 10 2HG1 ILE 10 2.875 4.899 1.033
81 1HG2 ILE 10 1HG2 ILE 10 3.584 2.534 -0.565
82 2HG2 ILE 10 2HG2 ILE 10 4.521 4.013 -0.351
83 3HG2 ILE 10 3HG2 ILE 10 5.271 2.444 -0.057
84 1HD1 ILE 10 1HD1 ILE 10 1.734 2.598 0.318
85 2HD1 ILE 10 2HD1 ILE 10 0.984 2.757 1.907
86 3HD1 ILE 10 3HD1 ILE 10 0.765 4.022 0.698
87 H PHE 11 H PHE 11 5.141 0.596 0.421
88 HA PHE 11 HA PHE 11 3.596 -0.166 -1.757
89 1HB PHE 11 1HB PHE 11 5.857 -0.609 -2.047
90 2HB PHE 11 2HB PHE 11 6.046 -1.254 -0.421
91 HD1 PHE 11 HD1 PHE 11 5.107 -3.531 0.123
92 HD2 PHE 11 HD2 PHE 11 5.407 -2.023 -3.881
93 HE1 PHE 11 HE1 PHE 11 4.876 -5.844 -0.763
94 HE2 PHE 11 HE2 PHE 11 5.176 -4.333 -4.776
95 HZ PHE 11 HZ PHE 11 4.911 -6.242 -3.214
96 H GLY 12 H GLY 12 3.890 -1.736 1.399
97 1HA GLY 12 1HA GLY 12 2.268 -4.038 0.657
98 2HA GLY 12 2HA GLY 12 2.737 -3.590 2.300
99 H VAL 13 H VAL 13 1.700 -1.081 2.581
100 HA VAL 13 HA VAL 13 -1.064 -1.557 3.096
101 HB VAL 13 HB VAL 13 0.558 0.990 2.876
102 1HG1 VAL 13 1HG1 VAL 13 -2.339 0.625 2.956
103 2HG1 VAL 13 2HG1 VAL 13 -1.747 1.563 4.327
104 3HG1 VAL 13 3HG1 VAL 13 -1.403 2.094 2.681
105 1HG2 VAL 13 1HG2 VAL 13 0.567 -0.927 4.800
106 2HG2 VAL 13 2HG2 VAL 13 0.864 0.779 5.135
107 3HG2 VAL 13 3HG2 VAL 13 -0.743 0.095 5.389
108 H SER 14 H SER 14 0.598 0.039 0.394
109 HA SER 14 HA SER 14 -1.690 1.022 -0.963
110 1HB SER 14 1HB SER 14 1.013 1.000 -1.463
111 2HB SER 14 2HB SER 14 0.414 -0.102 -2.698
112 HG SER 14 HG SER 14 0.033 2.617 -2.376
113 H TYR 15 H TYR 15 0.019 -2.091 -1.376
114 HA TYR 15 HA TYR 15 -1.874 -3.195 -3.221
115 1HB TYR 15 1HB TYR 15 0.532 -4.001 -2.304
116 2HB TYR 15 2HB TYR 15 -0.508 -5.035 -1.327
117 HD1 TYR 15 HD1 TYR 15 -0.931 -3.728 -4.808
118 HD2 TYR 15 HD2 TYR 15 -0.447 -7.174 -2.292
119 HE1 TYR 15 HE1 TYR 15 -1.294 -5.206 -6.766
120 HE2 TYR 15 HE2 TYR 15 -0.809 -8.654 -4.249
121 HH TYR 15 HH TYR 15 -0.421 -8.196 -6.993
122 H ASP 16 H ASP 16 -1.491 -3.762 0.300
123 HA ASP 16 HA ASP 16 -3.797 -5.319 0.701
124 1HB ASP 16 1HB ASP 16 -2.347 -3.322 2.431
125 2HB ASP 16 2HB ASP 16 -3.839 -4.070 3.004
126 H GLU 17 H GLU 17 -3.463 -1.963 -0.069
127 HA GLU 17 HA GLU 17 -6.316 -1.426 0.546
128 1HB GLU 17 1HB GLU 17 -4.215 0.153 1.006
129 2HB GLU 17 2HB GLU 17 -4.510 0.628 -0.666
130 1HG GLU 17 1HG GLU 17 -6.990 0.879 0.072
131 2HG GLU 17 2HG GLU 17 -6.339 0.892 1.712
132 H TYR 18 H TYR 18 -4.164 -2.094 -2.106
133 HA TYR 18 HA TYR 18 -5.894 -0.965 -4.164
134 1HB TYR 18 1HB TYR 18 -3.278 -1.977 -4.066
135 2HB TYR 18 2HB TYR 18 -4.161 -3.098 -5.102
136 HD1 TYR 18 HD1 TYR 18 -4.283 0.614 -4.514
137 HD2 TYR 18 HD2 TYR 18 -3.929 -2.585 -7.360
138 HE1 TYR 18 HE1 TYR 18 -4.218 2.265 -6.363
139 HE2 TYR 18 HE2 TYR 18 -3.865 -0.932 -9.208
140 HH TYR 18 HH TYR 18 -3.126 2.081 -8.955
141 H ARG 19 H ARG 19 -5.566 -4.072 -2.555
142 HA ARG 19 HA ARG 19 -7.678 -5.187 -4.345
143 1HB ARG 19 1HB ARG 19 -5.476 -6.388 -2.717
144 2HB ARG 19 2HB ARG 19 -6.946 -7.335 -2.947
145 1HG ARG 19 1HG ARG 19 -6.357 -6.241 -5.473
146 2HG ARG 19 2HG ARG 19 -4.815 -6.805 -4.831
147 1HD ARG 19 1HD ARG 19 -7.108 -8.638 -4.432
148 2HD ARG 19 2HD ARG 19 -6.585 -8.428 -6.103
149 HE ARG 19 HE ARG 19 -4.425 -8.983 -4.186
150 1HH1 ARG 19 1HH1 ARG 19 -7.024 -10.649 -5.556
151 2HH1 ARG 19 2HH1 ARG 19 -6.064 -11.913 -6.249
152 1HH2 ARG 19 1HH2 ARG 19 -3.040 -10.405 -5.472
153 2HH2 ARG 19 2HH2 ARG 19 -3.809 -11.775 -6.202
154 H TYR 20 H TYR 20 -7.654 -3.412 -1.698
155 HA TYR 20 HA TYR 20 -9.773 -5.024 -0.331
156 1HB TYR 20 1HB TYR 20 -7.783 -4.714 1.091
157 2HB TYR 20 2HB TYR 20 -7.889 -2.968 0.865
158 HD1 TYR 20 HD1 TYR 20 -9.482 -5.922 2.409
159 HD2 TYR 20 HD2 TYR 20 -9.597 -1.649 1.974
160 HE1 TYR 20 HE1 TYR 20 -11.094 -5.774 4.287
161 HE2 TYR 20 HE2 TYR 20 -11.210 -1.501 3.853
162 HH TYR 20 HH TYR 20 -12.745 -2.811 5.061
163 H ARG 21 H ARG 21 -8.726 -1.757 -1.276
164 HA ARG 21 HA ARG 21 -11.241 -0.518 -0.494
165 1HB ARG 21 1HB ARG 21 -8.805 0.503 -0.953
166 2HB ARG 21 2HB ARG 21 -9.493 0.738 -2.561
167 1HG ARG 21 1HG ARG 21 -11.445 1.886 -1.521
168 2HG ARG 21 2HG ARG 21 -10.666 1.728 0.052
169 1HD ARG 21 1HD ARG 21 -9.436 3.569 -0.341
170 2HD ARG 21 2HD ARG 21 -8.780 2.841 -1.807
171 HE ARG 21 HE ARG 21 -10.770 3.778 -3.011
172 1HH1 ARG 21 1HH2 ARG 21 -8.994 5.945 -1.668
173 2HH1 ARG 21 2HH2 ARG 21 -10.219 7.013 -1.069
174 1HH2 ARG 21 1HH1 ARG 21 -12.787 4.715 -1.464
175 2HH2 ARG 21 2HH1 ARG 21 -12.365 6.315 -0.950
176 H SER 22 H SER 22 -9.823 -1.632 -3.561
177 HA SER 22 HA SER 22 -11.800 -0.737 -5.344
178 1HB SER 22 1HB SER 22 -9.695 -1.911 -6.003
179 2HB SER 22 2HB SER 22 -10.396 -3.423 -5.434
180 HG SER 22 HG SER 22 -11.568 -3.512 -7.179
181 H VAL 23 H VAL 23 -11.871 -3.485 -3.128
182 HA VAL 23 HA VAL 23 -14.512 -4.326 -4.175
183 HB VAL 23 HB VAL 23 -12.861 -6.063 -3.577
184 1HG1 VAL 23 1HG1 VAL 23 -11.713 -4.791 -1.792
185 2HG1 VAL 23 2HG1 VAL 23 -13.146 -4.941 -0.774
186 3HG1 VAL 23 3HG1 VAL 23 -12.227 -6.378 -1.220
187 1HG2 VAL 23 1HG2 VAL 23 -15.554 -5.839 -2.576
188 2HG2 VAL 23 2HG2 VAL 23 -14.701 -7.285 -3.116
189 3HG2 VAL 23 3HG2 VAL 23 -14.582 -6.769 -1.435
190 H ILE 24 H ILE 24 -13.052 -3.013 -1.218
191 HA ILE 24 HA ILE 24 -15.708 -2.808 0.037
192 HB ILE 24 HB ILE 24 -13.177 -3.213 1.045
193 1HG1 ILE 24 1HG1 ILE 24 -14.297 -2.930 3.250
194 2HG1 ILE 24 2HG1 ILE 24 -15.654 -2.152 2.432
195 1HG2 ILE 24 1HG2 ILE 24 -12.748 -0.725 0.683
196 2HG2 ILE 24 2HG2 ILE 24 -13.970 -0.425 1.918
197 3HG2 ILE 24 3HG2 ILE 24 -12.501 -1.311 2.327
198 1HD1 ILE 24 1HD1 ILE 24 -15.200 -4.520 0.993
199 2HD1 ILE 24 2HD1 ILE 24 -15.060 -4.981 2.690
200 3HD1 ILE 24 3HD1 ILE 24 -16.530 -4.201 2.106
201 H LYS 25 H LYS 25 -14.477 -1.100 -2.344
202 HA LYS 25 HA LYS 25 -14.468 1.614 -1.415
203 1HB LYS 25 1HB LYS 25 -14.067 0.316 -3.865
204 2HB LYS 25 2HB LYS 25 -15.486 1.333 -4.129
205 1HG LYS 25 1HG LYS 25 -14.173 3.235 -3.058
206 2HG LYS 25 2HG LYS 25 -12.750 2.197 -3.163
207 1HD LYS 25 1HD LYS 25 -12.937 3.727 -5.116
208 2HD LYS 25 2HD LYS 25 -13.011 2.030 -5.590
209 1HE LYS 25 1HE LYS 25 -15.125 2.255 -6.396
210 2HE LYS 25 2HE LYS 25 -15.654 3.149 -4.956
211 1HZ LYS 25 1HZ LYS 25 -13.887 4.315 -7.036
212 2HZ LYS 25 2HZ LYS 25 -15.577 4.494 -7.054
213 3HZ LYS 25 3HZ LYS 25 -14.672 5.129 -5.768
214 H ALA 26 H ALA 26 -16.336 3.027 -2.828
215 HA ALA 26 HA ALA 26 -18.610 3.633 -2.892
216 1HB ALA 26 1HB ALA 26 -18.716 1.042 -3.525
217 2HB ALA 26 2HB ALA 26 -19.473 0.935 -1.936
218 3HB ALA 26 3HB ALA 26 -20.181 1.962 -3.183
Start of MODEL 3
1 1H MET 1 1H MET 1 20.854 2.087 -1.328
2 2H MET 1 2H MET 1 21.994 2.787 -2.369
3 3H MET 1 3H MET 1 21.889 3.307 -0.756
4 HA MET 1 HA MET 1 20.751 4.991 -1.826
5 1HB MET 1 1HB MET 1 20.374 2.743 -3.712
6 2HB MET 1 2HB MET 1 19.052 3.910 -3.682
7 1HG MET 1 1HG MET 1 20.298 5.504 -4.693
8 2HG MET 1 2HG MET 1 21.687 5.187 -3.654
9 1HE MET 1 1HE MET 1 22.101 6.176 -6.070
10 2HE MET 1 2HE MET 1 23.622 5.288 -6.020
11 3HE MET 1 3HE MET 1 22.591 5.177 -7.445
12 HA PRO 2 HA PRO 2 17.304 4.248 0.830
13 1HB PRO 2 1HB PRO 2 16.020 6.636 0.460
14 2HB PRO 2 2HB PRO 2 17.491 6.473 1.439
15 1HG PRO 2 1HG PRO 2 17.172 7.473 -1.343
16 2HG PRO 2 2HG PRO 2 18.248 8.038 -0.056
17 1HD PRO 2 1HD PRO 2 19.059 6.456 -2.135
18 2HD PRO 2 2HD PRO 2 19.857 6.492 -0.547
19 H GLY 3 H GLY 3 14.877 4.152 0.667
20 1HA GLY 3 1HA GLY 3 12.906 4.369 -0.869
21 2HA GLY 3 2HA GLY 3 13.977 3.847 -2.172
22 H THR 4 H THR 4 14.174 2.397 1.002
23 HA THR 4 HA THR 4 12.971 -0.084 -0.149
24 HB THR 4 HB THR 4 15.573 0.298 0.784
25 HG1 THR 4 HG1 THR 4 15.439 -1.437 -0.367
26 1HG2 THR 4 1HG2 THR 4 14.674 0.293 3.125
27 2HG2 THR 4 2HG2 THR 4 14.052 -1.333 2.839
28 3HG2 THR 4 3HG2 THR 4 15.790 -1.035 2.802
29 H ILE 5 H ILE 5 13.448 1.787 2.842
30 HA ILE 5 HA ILE 5 11.312 0.261 4.188
31 HB ILE 5 HB ILE 5 13.166 2.493 5.039
32 1HG1 ILE 5 1HG1 ILE 5 12.922 0.089 6.686
33 2HG1 ILE 5 2HG1 ILE 5 13.381 -0.286 5.025
34 1HG2 ILE 5 1HG2 ILE 5 10.727 1.381 6.435
35 2HG2 ILE 5 2HG2 ILE 5 12.056 2.115 7.333
36 3HG2 ILE 5 3HG2 ILE 5 11.151 3.070 6.159
37 1HD1 ILE 5 1HD1 ILE 5 14.806 2.036 6.113
38 2HD1 ILE 5 2HD1 ILE 5 15.120 0.548 7.007
39 3HD1 ILE 5 3HD1 ILE 5 15.441 0.621 5.275
40 H LYS 6 H LYS 6 11.919 3.691 3.348
41 HA LYS 6 HA LYS 6 9.482 4.802 4.068
42 1HB LYS 6 1HB LYS 6 11.519 5.910 2.910
43 2HB LYS 6 2HB LYS 6 10.728 5.457 1.399
44 1HG LYS 6 1HG LYS 6 8.762 6.627 3.117
45 2HG LYS 6 2HG LYS 6 10.162 7.699 3.071
46 1HD LYS 6 1HD LYS 6 8.848 6.534 0.601
47 2HD LYS 6 2HD LYS 6 8.489 8.138 1.242
48 1HE LYS 6 1HE LYS 6 10.675 8.939 0.785
49 2HE LYS 6 2HE LYS 6 11.325 7.298 0.599
50 1HZ LYS 6 1HZ LYS 6 9.071 7.848 -1.105
51 2HZ LYS 6 2HZ LYS 6 10.409 8.842 -1.433
52 3HZ LYS 6 3HZ LYS 6 10.575 7.156 -1.488
53 H GLU 7 H GLU 7 10.115 2.556 1.484
54 HA GLU 7 HA GLU 7 7.383 2.965 0.382
55 1HB GLU 7 1HB GLU 7 9.561 1.079 -0.570
56 2HB GLU 7 2HB GLU 7 8.089 1.518 -1.435
57 1HG GLU 7 1HG GLU 7 9.563 3.885 -0.633
58 2HG GLU 7 2HG GLU 7 10.571 2.811 -1.604
59 H ASN 8 H ASN 8 9.439 0.363 1.699
60 HA ASN 8 HA ASN 8 7.532 -1.702 1.708
61 1HB ASN 8 1HB ASN 8 9.761 -2.273 2.259
62 2HB ASN 8 2HB ASN 8 9.814 -1.080 3.548
63 1HD2 ASN 8 2HD2 ASN 8 7.639 -3.830 2.687
64 2HD2 ASN 8 1HD2 ASN 8 7.594 -4.472 4.259
65 H ILE 9 H ILE 9 7.608 1.194 3.551
66 HA ILE 9 HA ILE 9 5.653 0.104 5.517
67 HB ILE 9 HB ILE 9 6.899 2.845 5.549
68 1HG1 ILE 9 1HG1 ILE 9 8.567 0.861 5.403
69 2HG1 ILE 9 2HG1 ILE 9 8.777 2.026 6.700
70 1HG2 ILE 9 1HG2 ILE 9 5.421 1.076 7.469
71 2HG2 ILE 9 2HG2 ILE 9 6.592 2.231 8.103
72 3HG2 ILE 9 3HG2 ILE 9 5.217 2.799 7.156
73 1HD1 ILE 9 1HD1 ILE 9 7.292 -0.601 6.971
74 2HD1 ILE 9 2HD1 ILE 9 8.953 -0.329 7.499
75 3HD1 ILE 9 3HD1 ILE 9 7.627 0.544 8.269
76 H ILE 10 H ILE 10 5.762 1.771 2.594
77 HA ILE 10 HA ILE 10 3.075 2.971 3.156
78 HB ILE 10 HB ILE 10 5.314 4.425 2.539
79 1HG1 ILE 10 1HG1 ILE 10 3.289 5.440 3.309
80 2HG1 ILE 10 2HG1 ILE 10 3.641 6.175 1.746
81 1HG2 ILE 10 1HG2 ILE 10 3.901 3.823 -0.074
82 2HG2 ILE 10 2HG2 ILE 10 5.006 5.175 0.163
83 3HG2 ILE 10 3HG2 ILE 10 5.596 3.520 0.307
84 1HD1 ILE 10 1HD1 ILE 10 2.140 4.350 0.734
85 2HD1 ILE 10 2HD1 ILE 10 1.600 4.042 2.384
86 3HD1 ILE 10 3HD1 ILE 10 1.331 5.623 1.648
87 H PHE 11 H PHE 11 5.216 1.719 0.619
88 HA PHE 11 HA PHE 11 3.380 1.316 -1.436
89 1HB PHE 11 1HB PHE 11 5.531 0.746 -2.057
90 2HB PHE 11 2HB PHE 11 5.884 -0.030 -0.520
91 HD1 PHE 11 HD1 PHE 11 4.268 -0.437 -3.798
92 HD2 PHE 11 HD2 PHE 11 5.373 -2.346 -0.117
93 HE1 PHE 11 HE1 PHE 11 3.769 -2.655 -4.807
94 HE2 PHE 11 HE2 PHE 11 4.875 -4.568 -1.119
95 HZ PHE 11 HZ PHE 11 4.072 -4.720 -3.462
96 H GLY 12 H GLY 12 3.814 -0.518 1.549
97 1HA GLY 12 1HA GLY 12 1.993 -2.654 0.746
98 2HA GLY 12 2HA GLY 12 2.643 -2.405 2.368
99 H VAL 13 H VAL 13 1.797 0.167 2.932
100 HA VAL 13 HA VAL 13 -0.882 -0.206 3.781
101 HB VAL 13 HB VAL 13 0.626 2.382 3.290
102 1HG1 VAL 13 1HG1 VAL 13 -2.045 2.206 3.642
103 2HG1 VAL 13 2HG1 VAL 13 -1.529 2.160 5.328
104 3HG1 VAL 13 3HG1 VAL 13 -1.083 3.527 4.306
105 1HG2 VAL 13 1HG2 VAL 13 1.639 0.702 4.898
106 2HG2 VAL 13 2HG2 VAL 13 1.226 2.255 5.624
107 3HG2 VAL 13 3HG2 VAL 13 0.177 0.859 5.872
108 H SER 14 H SER 14 0.430 0.942 0.752
109 HA SER 14 HA SER 14 -2.092 2.084 -0.184
110 1HB SER 14 1HB SER 14 0.368 2.613 -0.959
111 2HB SER 14 2HB SER 14 0.128 1.230 -2.023
112 HG SER 14 HG SER 14 -1.112 3.731 -1.994
113 H TYR 15 H TYR 15 -0.185 -0.817 -1.092
114 HA TYR 15 HA TYR 15 -2.155 -1.949 -2.806
115 1HB TYR 15 1HB TYR 15 0.373 -2.648 -2.085
116 2HB TYR 15 2HB TYR 15 -0.556 -3.839 -1.177
117 HD1 TYR 15 HD1 TYR 15 0.080 -2.466 -4.570
118 HD2 TYR 15 HD2 TYR 15 -1.704 -5.628 -2.273
119 HE1 TYR 15 HE1 TYR 15 -0.272 -3.774 -6.646
120 HE2 TYR 15 HE2 TYR 15 -2.055 -6.937 -4.349
121 HH TYR 15 HH TYR 15 -0.775 -5.838 -7.455
122 H ASP 16 H ASP 16 -1.444 -2.706 0.618
123 HA ASP 16 HA ASP 16 -3.526 -4.484 1.147
124 1HB ASP 16 1HB ASP 16 -1.699 -3.266 2.711
125 2HB ASP 16 2HB ASP 16 -3.117 -2.317 3.156
126 H GLU 17 H GLU 17 -3.669 -1.069 0.495
127 HA GLU 17 HA GLU 17 -6.532 -0.933 1.247
128 1HB GLU 17 1HB GLU 17 -4.578 0.914 1.519
129 2HB GLU 17 2HB GLU 17 -5.180 1.365 -0.076
130 1HG GLU 17 1HG GLU 17 -7.490 0.910 1.434
131 2HG GLU 17 2HG GLU 17 -6.408 1.766 2.532
132 H TYR 18 H TYR 18 -4.470 -1.285 -1.538
133 HA TYR 18 HA TYR 18 -6.544 -0.472 -3.446
134 1HB TYR 18 1HB TYR 18 -3.793 -0.732 -3.587
135 2HB TYR 18 2HB TYR 18 -4.365 -2.136 -4.490
136 HD1 TYR 18 HD1 TYR 18 -4.365 1.550 -4.308
137 HD2 TYR 18 HD2 TYR 18 -5.640 -1.890 -6.543
138 HE1 TYR 18 HE1 TYR 18 -4.928 3.008 -6.234
139 HE2 TYR 18 HE2 TYR 18 -6.204 -0.433 -8.468
140 HH TYR 18 HH TYR 18 -5.739 3.102 -8.292
141 H ARG 19 H ARG 19 -5.501 -3.411 -1.878
142 HA ARG 19 HA ARG 19 -7.202 -5.026 -3.709
143 1HB ARG 19 1HB ARG 19 -4.776 -5.528 -2.257
144 2HB ARG 19 2HB ARG 19 -6.020 -6.647 -1.694
145 1HG ARG 19 1HG ARG 19 -6.047 -6.311 -4.600
146 2HG ARG 19 2HG ARG 19 -4.511 -6.941 -4.006
147 1HD ARG 19 1HD ARG 19 -5.419 -8.945 -3.494
148 2HD ARG 19 2HD ARG 19 -6.799 -8.194 -2.691
149 HE ARG 19 HE ARG 19 -7.927 -8.086 -4.864
150 1HH1 ARG 19 1HH1 ARG 19 -4.698 -9.065 -5.286
151 2HH1 ARG 19 2HH1 ARG 19 -5.048 -10.223 -6.526
152 1HH2 ARG 19 1HH2 ARG 19 -8.487 -9.877 -6.250
153 2HH2 ARG 19 2HH2 ARG 19 -7.193 -10.684 -7.070
154 H TYR 20 H TYR 20 -7.423 -3.372 -0.787
155 HA TYR 20 HA TYR 20 -9.485 -5.256 0.265
156 1HB TYR 20 1HB TYR 20 -7.750 -4.667 1.885
157 2HB TYR 20 2HB TYR 20 -8.046 -2.949 1.612
158 HD1 TYR 20 HD1 TYR 20 -10.011 -6.053 2.418
159 HD2 TYR 20 HD2 TYR 20 -9.420 -1.859 3.140
160 HE1 TYR 20 HE1 TYR 20 -11.817 -6.091 4.118
161 HE2 TYR 20 HE2 TYR 20 -11.226 -1.897 4.839
162 HH TYR 20 HH TYR 20 -12.763 -3.123 5.859
163 H ARG 21 H ARG 21 -8.974 -1.995 -0.945
164 HA ARG 21 HA ARG 21 -11.745 -1.216 -0.270
165 1HB ARG 21 1HB ARG 21 -9.434 0.240 -0.477
166 2HB ARG 21 2HB ARG 21 -10.176 0.538 -2.052
167 1HG ARG 21 1HG ARG 21 -12.357 0.908 -0.617
168 2HG ARG 21 2HG ARG 21 -11.205 1.205 0.683
169 1HD ARG 21 1HD ARG 21 -10.205 3.029 -0.480
170 2HD ARG 21 2HD ARG 21 -10.994 2.590 -1.996
171 HE ARG 21 HE ARG 21 -12.735 3.989 -1.268
172 1HH1 ARG 21 1HH1 ARG 21 -10.841 4.090 1.361
173 2HH1 ARG 21 2HH1 ARG 21 -12.091 3.980 2.555
174 1HH2 ARG 21 1HH2 ARG 21 -14.554 3.101 0.278
175 2HH2 ARG 21 2HH2 ARG 21 -14.194 3.424 1.942
176 H SER 22 H SER 22 -9.748 -1.758 -3.157
177 HA SER 22 HA SER 22 -11.593 -1.170 -5.168
178 1HB SER 22 1HB SER 22 -9.296 -1.842 -5.672
179 2HB SER 22 2HB SER 22 -9.613 -3.466 -5.071
180 HG SER 22 HG SER 22 -11.157 -2.294 -7.128
181 H VAL 23 H VAL 23 -11.710 -3.757 -2.855
182 HA VAL 23 HA VAL 23 -13.719 -5.241 -4.445
183 HB VAL 23 HB VAL 23 -11.959 -6.454 -3.131
184 1HG1 VAL 23 1HG1 VAL 23 -11.910 -4.880 -1.212
185 2HG1 VAL 23 2HG1 VAL 23 -13.531 -5.407 -0.757
186 3HG1 VAL 23 3HG1 VAL 23 -12.183 -6.542 -0.690
187 1HG2 VAL 23 1HG2 VAL 23 -14.517 -7.166 -3.585
188 2HG2 VAL 23 2HG2 VAL 23 -13.396 -8.201 -2.701
189 3HG2 VAL 23 3HG2 VAL 23 -14.537 -7.183 -1.822
190 H ILE 24 H ILE 24 -13.500 -3.433 -1.382
191 HA ILE 24 HA ILE 24 -16.334 -3.766 -0.800
192 HB ILE 24 HB ILE 24 -14.488 -1.669 0.360
193 1HG1 ILE 24 1HG1 ILE 24 -13.407 -3.904 0.441
194 2HG1 ILE 24 2HG1 ILE 24 -13.867 -3.346 2.050
195 1HG2 ILE 24 1HG2 ILE 24 -17.189 -2.633 0.876
196 2HG2 ILE 24 2HG2 ILE 24 -16.166 -2.776 2.305
197 3HG2 ILE 24 3HG2 ILE 24 -16.370 -1.209 1.519
198 1HD1 ILE 24 1HD1 ILE 24 -16.007 -4.829 0.704
199 2HD1 ILE 24 2HD1 ILE 24 -14.549 -5.793 0.945
200 3HD1 ILE 24 3HD1 ILE 24 -15.345 -5.038 2.326
201 H LYS 25 H LYS 25 -14.394 -1.448 -2.562
202 HA LYS 25 HA LYS 25 -16.155 0.777 -2.547
203 1HB LYS 25 1HB LYS 25 -13.851 0.788 -3.517
204 2HB LYS 25 2HB LYS 25 -14.450 -0.174 -4.868
205 1HG LYS 25 1HG LYS 25 -15.730 1.573 -5.723
206 2HG LYS 25 2HG LYS 25 -15.856 2.381 -4.162
207 1HD LYS 25 1HD LYS 25 -13.182 2.501 -4.499
208 2HD LYS 25 2HD LYS 25 -13.686 2.507 -6.190
209 1HE LYS 25 1HE LYS 25 -15.265 4.393 -5.658
210 2HE LYS 25 2HE LYS 25 -14.567 4.450 -4.027
211 1HZ LYS 25 1HZ LYS 25 -12.367 4.688 -5.031
212 2HZ LYS 25 2HZ LYS 25 -13.066 4.709 -6.579
213 3HZ LYS 25 3HZ LYS 25 -13.390 5.965 -5.488
214 H ALA 26 H ALA 26 -15.948 -1.857 -4.974
215 HA ALA 26 HA ALA 26 -17.535 -2.505 -6.595
216 1HB ALA 26 1HB ALA 26 -18.616 -2.701 -3.949
217 2HB ALA 26 2HB ALA 26 -19.910 -2.210 -5.042
218 3HB ALA 26 3HB ALA 26 -18.999 -3.687 -5.360
Start of MODEL 4
1 1H MET 1 1H MET 1 21.962 1.686 0.489
2 2H MET 1 2H MET 1 21.565 1.792 -1.161
3 3H MET 1 3H MET 1 23.032 2.437 -0.592
4 HA MET 1 HA MET 1 21.916 4.164 0.601
5 1HB MET 1 1HB MET 1 21.594 3.579 -2.252
6 2HB MET 1 2HB MET 1 20.396 4.728 -1.658
7 1HG MET 1 1HG MET 1 22.693 5.635 -0.450
8 2HG MET 1 2HG MET 1 23.300 5.062 -2.004
9 1HE MET 1 1HE MET 1 24.015 7.523 -1.800
10 2HE MET 1 2HE MET 1 23.072 8.873 -2.427
11 3HE MET 1 3HE MET 1 22.868 8.351 -0.750
12 HA PRO 2 HA PRO 2 17.940 2.990 2.152
13 1HB PRO 2 1HB PRO 2 17.330 5.362 3.373
14 2HB PRO 2 2HB PRO 2 18.492 4.202 4.047
15 1HG PRO 2 1HG PRO 2 18.989 6.710 2.525
16 2HG PRO 2 2HG PRO 2 19.865 6.038 3.909
17 1HD PRO 2 1HD PRO 2 20.747 5.858 1.334
18 2HD PRO 2 2HD PRO 2 21.151 4.674 2.597
19 H GLY 3 H GLY 3 15.723 4.583 2.327
20 1HA GLY 3 1HA GLY 3 14.303 6.093 1.059
21 2HA GLY 3 2HA GLY 3 15.390 5.905 -0.318
22 H THR 4 H THR 4 15.394 2.895 0.379
23 HA THR 4 HA THR 4 13.163 2.235 -1.402
24 HB THR 4 HB THR 4 15.655 1.145 -0.955
25 HG1 THR 4 HG1 THR 4 13.834 0.911 -2.643
26 1HG2 THR 4 1HG2 THR 4 14.908 0.059 1.133
27 2HG2 THR 4 2HG2 THR 4 13.617 -0.751 0.246
28 3HG2 THR 4 3HG2 THR 4 15.304 -1.135 -0.103
29 H ILE 5 H ILE 5 14.061 1.669 1.975
30 HA ILE 5 HA ILE 5 11.882 0.011 2.716
31 HB ILE 5 HB ILE 5 13.223 2.126 4.428
32 1HG1 ILE 5 1HG1 ILE 5 14.152 -0.611 4.762
33 2HG1 ILE 5 2HG1 ILE 5 14.406 -0.051 3.109
34 1HG2 ILE 5 1HG2 ILE 5 11.056 0.857 5.157
35 2HG2 ILE 5 2HG2 ILE 5 12.136 -0.524 5.352
36 3HG2 ILE 5 3HG2 ILE 5 12.409 0.949 6.283
37 1HD1 ILE 5 1HD1 ILE 5 15.084 2.049 4.973
38 2HD1 ILE 5 2HD1 ILE 5 15.965 0.577 5.379
39 3HD1 ILE 5 3HD1 ILE 5 16.106 1.272 3.765
40 H LYS 6 H LYS 6 12.180 3.566 2.928
41 HA LYS 6 HA LYS 6 9.639 4.150 3.962
42 1HB LYS 6 1HB LYS 6 11.203 5.676 1.860
43 2HB LYS 6 2HB LYS 6 9.840 6.328 2.771
44 1HG LYS 6 1HG LYS 6 11.045 6.005 4.871
45 2HG LYS 6 2HG LYS 6 12.388 5.251 4.012
46 1HD LYS 6 1HD LYS 6 12.896 7.304 2.855
47 2HD LYS 6 2HD LYS 6 11.433 8.072 3.470
48 1HE LYS 6 1HE LYS 6 13.128 8.892 4.913
49 2HE LYS 6 2HE LYS 6 12.439 7.538 5.831
50 1HZ LYS 6 1HZ LYS 6 14.124 6.124 4.573
51 2HZ LYS 6 2HZ LYS 6 14.909 7.585 4.205
52 3HZ LYS 6 3HZ LYS 6 14.719 7.105 5.822
53 H GLU 7 H GLU 7 10.510 2.992 0.797
54 HA GLU 7 HA GLU 7 7.833 3.620 -0.297
55 1HB GLU 7 1HB GLU 7 10.110 2.099 -1.599
56 2HB GLU 7 2HB GLU 7 8.703 2.797 -2.401
57 1HG GLU 7 1HG GLU 7 9.969 4.851 -0.858
58 2HG GLU 7 2HG GLU 7 11.198 4.055 -1.842
59 H ASN 8 H ASN 8 9.842 0.729 0.360
60 HA ASN 8 HA ASN 8 7.837 -1.178 -0.340
61 1HB ASN 8 1HB ASN 8 10.403 -1.441 0.202
62 2HB ASN 8 2HB ASN 8 9.798 -1.728 1.827
63 1HD2 ASN 8 2HD2 ASN 8 9.981 -3.067 -1.416
64 2HD2 ASN 8 1HD2 ASN 8 9.267 -4.562 -1.043
65 H ILE 9 H ILE 9 8.010 1.006 2.242
66 HA ILE 9 HA ILE 9 6.260 -0.658 3.984
67 HB ILE 9 HB ILE 9 7.697 1.965 4.449
68 1HG1 ILE 9 1HG1 ILE 9 8.076 -0.872 5.431
69 2HG1 ILE 9 2HG1 ILE 9 9.215 0.106 4.503
70 1HG2 ILE 9 1HG2 ILE 9 5.849 0.357 6.237
71 2HG2 ILE 9 2HG2 ILE 9 6.907 1.644 6.820
72 3HG2 ILE 9 3HG2 ILE 9 5.612 2.014 5.682
73 1HD1 ILE 9 1HD1 ILE 9 8.974 1.767 6.531
74 2HD1 ILE 9 2HD1 ILE 9 8.456 0.316 7.392
75 3HD1 ILE 9 3HD1 ILE 9 10.055 0.380 6.650
76 H ILE 10 H ILE 10 6.118 1.788 1.640
77 HA ILE 10 HA ILE 10 3.461 2.710 2.657
78 HB ILE 10 HB ILE 10 5.524 4.292 1.999
79 1HG1 ILE 10 1HG1 ILE 10 3.509 5.194 2.898
80 2HG1 ILE 10 2HG1 ILE 10 3.760 6.033 1.367
81 1HG2 ILE 10 1HG2 ILE 10 4.082 3.817 -0.618
82 2HG2 ILE 10 2HG2 ILE 10 5.110 5.213 -0.305
83 3HG2 ILE 10 3HG2 ILE 10 5.801 3.592 -0.286
84 1HD1 ILE 10 1HD1 ILE 10 2.267 4.274 0.293
85 2HD1 ILE 10 2HD1 ILE 10 1.864 3.741 1.925
86 3HD1 ILE 10 3HD1 ILE 10 1.453 5.375 1.404
87 H PHE 11 H PHE 11 5.190 1.840 -0.309
88 HA PHE 11 HA PHE 11 3.100 1.643 -2.119
89 1HB PHE 11 1HB PHE 11 5.035 1.108 -3.180
90 2HB PHE 11 2HB PHE 11 5.762 0.467 -1.719
91 HD1 PHE 11 HD1 PHE 11 5.194 -1.864 -0.960
92 HD2 PHE 11 HD2 PHE 11 4.073 -0.337 -4.811
93 HE1 PHE 11 HE1 PHE 11 4.831 -4.183 -1.772
94 HE2 PHE 11 HE2 PHE 11 3.709 -2.654 -5.629
95 HZ PHE 11 HZ PHE 11 4.090 -4.577 -4.106
96 H GLY 12 H GLY 12 4.048 -0.645 0.421
97 1HA GLY 12 1HA GLY 12 2.121 -2.673 -0.316
98 2HA GLY 12 2HA GLY 12 2.957 -2.565 1.236
99 H VAL 13 H VAL 13 2.100 0.087 1.912
100 HA VAL 13 HA VAL 13 -0.417 -0.489 3.150
101 HB VAL 13 HB VAL 13 0.939 2.177 2.632
102 1HG1 VAL 13 1HG1 VAL 13 -1.573 1.389 4.007
103 2HG1 VAL 13 2HG1 VAL 13 -0.542 2.530 4.872
104 3HG1 VAL 13 3HG1 VAL 13 -1.132 2.925 3.258
105 1HG2 VAL 13 1HG2 VAL 13 2.176 0.413 3.998
106 2HG2 VAL 13 2HG2 VAL 13 1.868 1.935 4.833
107 3HG2 VAL 13 3HG2 VAL 13 0.864 0.526 5.171
108 H SER 14 H SER 14 0.436 1.486 0.301
109 HA SER 14 HA SER 14 -2.147 2.428 -0.339
110 1HB SER 14 1HB SER 14 0.123 2.940 -1.483
111 2HB SER 14 2HB SER 14 -0.193 1.502 -2.449
112 HG SER 14 HG SER 14 -1.035 3.309 -3.490
113 H TYR 15 H TYR 15 -0.641 -0.709 -0.947
114 HA TYR 15 HA TYR 15 -2.769 -1.704 -2.641
115 1HB TYR 15 1HB TYR 15 -0.267 -2.563 -2.113
116 2HB TYR 15 2HB TYR 15 -1.166 -3.612 -1.018
117 HD1 TYR 15 HD1 TYR 15 -0.602 -2.682 -4.540
118 HD2 TYR 15 HD2 TYR 15 -2.753 -5.256 -1.860
119 HE1 TYR 15 HE1 TYR 15 -1.273 -4.113 -6.453
120 HE2 TYR 15 HE2 TYR 15 -3.425 -6.688 -3.770
121 HH TYR 15 HH TYR 15 -2.888 -5.725 -7.065
122 H ASP 16 H ASP 16 -1.863 -2.620 0.711
123 HA ASP 16 HA ASP 16 -4.133 -4.081 1.380
124 1HB ASP 16 1HB ASP 16 -2.658 -2.081 3.124
125 2HB ASP 16 2HB ASP 16 -3.775 -3.306 3.725
126 H GLU 17 H GLU 17 -3.827 -0.649 0.865
127 HA GLU 17 HA GLU 17 -6.561 -0.151 1.899
128 1HB GLU 17 1HB GLU 17 -4.222 1.397 1.798
129 2HB GLU 17 2HB GLU 17 -5.288 2.110 0.586
130 1HG GLU 17 1HG GLU 17 -6.182 3.205 2.373
131 2HG GLU 17 2HG GLU 17 -7.049 1.690 2.624
132 H TYR 18 H TYR 18 -4.840 -0.653 -1.082
133 HA TYR 18 HA TYR 18 -6.957 0.544 -2.735
134 1HB TYR 18 1HB TYR 18 -4.653 0.611 -3.550
135 2HB TYR 18 2HB TYR 18 -4.546 -1.148 -3.465
136 HD1 TYR 18 HD1 TYR 18 -6.942 1.400 -4.852
137 HD2 TYR 18 HD2 TYR 18 -4.776 -2.254 -5.495
138 HE1 TYR 18 HE1 TYR 18 -7.909 1.227 -7.131
139 HE2 TYR 18 HE2 TYR 18 -5.742 -2.425 -7.772
140 HH TYR 18 HH TYR 18 -6.902 -1.342 -9.361
141 H ARG 19 H ARG 19 -5.703 -2.777 -2.200
142 HA ARG 19 HA ARG 19 -7.739 -4.090 -3.703
143 1HB ARG 19 1HB ARG 19 -5.574 -4.853 -1.964
144 2HB ARG 19 2HB ARG 19 -7.016 -5.773 -1.532
145 1HG ARG 19 1HG ARG 19 -6.749 -5.591 -4.414
146 2HG ARG 19 2HG ARG 19 -5.289 -6.273 -3.696
147 1HD ARG 19 1HD ARG 19 -6.789 -7.834 -2.377
148 2HD ARG 19 2HD ARG 19 -8.134 -7.258 -3.361
149 HE ARG 19 HE ARG 19 -7.377 -8.803 -4.959
150 1HH1 ARG 19 1HH1 ARG 19 -5.107 -6.965 -5.698
151 2HH1 ARG 19 2HH1 ARG 19 -3.735 -8.005 -5.511
152 1HH2 ARG 19 1HH2 ARG 19 -5.448 -10.370 -3.643
153 2HH2 ARG 19 2HH2 ARG 19 -3.927 -9.930 -4.345
154 H TYR 20 H TYR 20 -7.609 -3.036 -0.326
155 HA TYR 20 HA TYR 20 -9.970 -4.325 0.595
156 1HB TYR 20 1HB TYR 20 -8.558 -3.291 2.222
157 2HB TYR 20 2HB TYR 20 -8.621 -1.736 1.392
158 HD1 TYR 20 HD1 TYR 20 -10.620 -0.318 1.512
159 HD2 TYR 20 HD2 TYR 20 -10.422 -4.072 3.591
160 HE1 TYR 20 HE1 TYR 20 -12.606 0.320 2.853
161 HE2 TYR 20 HE2 TYR 20 -12.407 -3.432 4.933
162 HH TYR 20 HH TYR 20 -14.173 -1.966 5.017
163 H ARG 21 H ARG 21 -9.495 -1.359 -1.260
164 HA ARG 21 HA ARG 21 -12.202 -0.402 -1.020
165 1HB ARG 21 1HB ARG 21 -9.839 0.548 -2.146
166 2HB ARG 21 2HB ARG 21 -10.889 0.283 -3.539
167 1HG ARG 21 1HG ARG 21 -12.421 1.864 -2.862
168 2HG ARG 21 2HG ARG 21 -12.089 1.608 -1.150
169 1HD ARG 21 1HD ARG 21 -9.797 2.663 -1.586
170 2HD ARG 21 2HD ARG 21 -10.444 3.171 -3.147
171 HE ARG 21 HE ARG 21 -11.001 4.446 -0.645
172 1HH1 ARG 21 1HH2 ARG 21 -11.432 5.882 -3.157
173 2HH1 ARG 21 2HH2 ARG 21 -13.158 5.944 -3.295
174 1HH2 ARG 21 1HH1 ARG 21 -13.699 3.417 -0.985
175 2HH2 ARG 21 2HH1 ARG 21 -14.440 4.550 -2.065
176 H SER 22 H SER 22 -10.635 -2.759 -3.087
177 HA SER 22 HA SER 22 -12.907 -2.892 -4.947
178 1HB SER 22 1HB SER 22 -10.908 -3.447 -6.030
179 2HB SER 22 2HB SER 22 -10.290 -4.342 -4.644
180 HG SER 22 HG SER 22 -11.625 -5.260 -6.747
181 H VAL 23 H VAL 23 -12.037 -4.262 -1.922
182 HA VAL 23 HA VAL 23 -13.565 -6.727 -2.211
183 HB VAL 23 HB VAL 23 -12.613 -5.298 0.291
184 1HG1 VAL 23 1HG1 VAL 23 -14.152 -7.744 -0.208
185 2HG1 VAL 23 2HG1 VAL 23 -12.710 -8.022 0.768
186 3HG1 VAL 23 3HG1 VAL 23 -13.919 -6.852 1.296
187 1HG2 VAL 23 1HG2 VAL 23 -10.941 -6.131 -1.577
188 2HG2 VAL 23 2HG2 VAL 23 -10.611 -6.488 0.120
189 3HG2 VAL 23 3HG2 VAL 23 -11.320 -7.724 -0.921
190 H ILE 24 H ILE 24 -14.177 -3.468 -1.003
191 HA ILE 24 HA ILE 24 -16.975 -4.273 -0.346
192 HB ILE 24 HB ILE 24 -15.350 -1.825 0.405
193 1HG1 ILE 24 1HG1 ILE 24 -15.826 -2.742 2.724
194 2HG1 ILE 24 2HG1 ILE 24 -16.445 -4.196 1.942
195 1HG2 ILE 24 1HG2 ILE 24 -18.241 -2.287 0.312
196 2HG2 ILE 24 2HG2 ILE 24 -17.675 -1.834 1.920
197 3HG2 ILE 24 3HG2 ILE 24 -17.353 -0.781 0.542
198 1HD1 ILE 24 1HD1 ILE 24 -13.862 -3.431 0.846
199 2HD1 ILE 24 2HD1 ILE 24 -13.772 -3.671 2.591
200 3HD1 ILE 24 3HD1 ILE 24 -14.362 -4.968 1.553
201 H LYS 25 H LYS 25 -15.021 -2.393 -2.510
202 HA LYS 25 HA LYS 25 -15.594 -0.876 -4.223
203 1HB LYS 25 1HB LYS 25 -16.097 -3.017 -5.250
204 2HB LYS 25 2HB LYS 25 -17.678 -3.057 -4.473
205 1HG LYS 25 1HG LYS 25 -18.113 -2.294 -6.680
206 2HG LYS 25 2HG LYS 25 -18.137 -0.832 -5.691
207 1HD LYS 25 1HD LYS 25 -15.937 -0.213 -6.380
208 2HD LYS 25 2HD LYS 25 -15.636 -1.800 -7.088
209 1HE LYS 25 1HE LYS 25 -17.971 -0.861 -8.361
210 2HE LYS 25 2HE LYS 25 -16.854 0.520 -8.323
211 1HZ LYS 25 1HZ LYS 25 -16.083 -2.235 -9.127
212 2HZ LYS 25 2HZ LYS 25 -16.460 -0.995 -10.225
213 3HZ LYS 25 3HZ LYS 25 -15.113 -0.842 -9.205
214 H ALA 26 H ALA 26 -18.958 -1.789 -3.955
215 HA ALA 26 HA ALA 26 -19.818 0.937 -3.731
216 1HB ALA 26 1HB ALA 26 -21.163 -1.047 -4.621
217 2HB ALA 26 2HB ALA 26 -21.448 -1.487 -2.938
218 3HB ALA 26 3HB ALA 26 -22.035 0.057 -3.557
Start of MODEL 5
1 1H MET 1 1H MET 1 20.111 0.749 2.204
2 2H MET 1 2H MET 1 20.736 -0.562 1.323
3 3H MET 1 3H MET 1 21.270 1.014 0.991
4 HA MET 1 HA MET 1 19.764 0.941 -0.672
5 1HB MET 1 1HB MET 1 18.941 -1.377 0.997
6 2HB MET 1 2HB MET 1 17.703 -0.722 -0.077
7 1HG MET 1 1HG MET 1 20.002 -0.784 -1.655
8 2HG MET 1 2HG MET 1 20.075 -2.285 -0.733
9 1HE MET 1 1HE MET 1 17.945 -3.225 0.012
10 2HE MET 1 2HE MET 1 16.414 -3.269 -0.872
11 3HE MET 1 3HE MET 1 17.700 -4.402 -1.275
12 HA PRO 2 HA PRO 2 17.244 3.524 2.254
13 1HB PRO 2 1HB PRO 2 18.261 5.955 1.534
14 2HB PRO 2 2HB PRO 2 18.978 4.950 2.809
15 1HG PRO 2 1HG PRO 2 19.878 5.399 0.026
16 2HG PRO 2 2HG PRO 2 20.826 5.085 1.485
17 1HD PRO 2 1HD PRO 2 20.234 3.220 -0.488
18 2HD PRO 2 2HD PRO 2 20.780 2.841 1.158
19 H GLY 3 H GLY 3 15.690 5.323 1.538
20 1HA GLY 3 1HA GLY 3 14.070 6.088 0.021
21 2HA GLY 3 2HA GLY 3 15.351 6.052 -1.193
22 H THR 4 H THR 4 14.839 3.064 0.385
23 HA THR 4 HA THR 4 13.246 2.106 -1.955
24 HB THR 4 HB THR 4 15.838 1.352 -1.199
25 HG1 THR 4 HG1 THR 4 13.916 -0.034 -2.751
26 1HG2 THR 4 1HG2 THR 4 13.827 -0.758 -0.370
27 2HG2 THR 4 2HG2 THR 4 15.524 -1.104 -0.702
28 3HG2 THR 4 3HG2 THR 4 15.086 -0.032 0.629
29 H ILE 5 H ILE 5 14.008 1.463 1.472
30 HA ILE 5 HA ILE 5 11.771 -0.306 1.878
31 HB ILE 5 HB ILE 5 13.223 1.365 3.950
32 1HG1 ILE 5 1HG1 ILE 5 14.758 0.007 2.501
33 2HG1 ILE 5 2HG1 ILE 5 14.749 -0.519 4.183
34 1HG2 ILE 5 1HG2 ILE 5 11.028 -0.428 4.101
35 2HG2 ILE 5 2HG2 ILE 5 12.421 -1.275 4.771
36 3HG2 ILE 5 3HG2 ILE 5 11.931 0.282 5.439
37 1HD1 ILE 5 1HD1 ILE 5 12.699 -2.009 3.097
38 2HD1 ILE 5 2HD1 ILE 5 13.863 -1.948 1.773
39 3HD1 ILE 5 3HD1 ILE 5 14.347 -2.586 3.344
40 H LYS 6 H LYS 6 12.270 3.174 2.550
41 HA LYS 6 HA LYS 6 9.877 3.792 3.822
42 1HB LYS 6 1HB LYS 6 11.873 5.294 2.748
43 2HB LYS 6 2HB LYS 6 10.577 5.625 1.599
44 1HG LYS 6 1HG LYS 6 9.343 5.748 4.110
45 2HG LYS 6 2HG LYS 6 10.888 6.568 4.330
46 1HD LYS 6 1HD LYS 6 9.791 7.372 1.809
47 2HD LYS 6 2HD LYS 6 8.549 7.567 3.045
48 1HE LYS 6 1HE LYS 6 9.926 9.016 4.352
49 2HE LYS 6 2HE LYS 6 11.381 8.578 3.434
50 1HZ LYS 6 1HZ LYS 6 8.980 9.814 2.200
51 2HZ LYS 6 2HZ LYS 6 10.319 10.716 2.730
52 3HZ LYS 6 3HZ LYS 6 10.503 9.577 1.486
53 H GLU 7 H GLU 7 10.410 3.037 0.424
54 HA GLU 7 HA GLU 7 7.754 3.739 -0.467
55 1HB GLU 7 1HB GLU 7 9.746 1.761 -1.621
56 2HB GLU 7 2HB GLU 7 8.308 2.357 -2.449
57 1HG GLU 7 1HG GLU 7 10.016 4.488 -1.357
58 2HG GLU 7 2HG GLU 7 10.795 3.517 -2.606
59 H ASN 8 H ASN 8 9.242 0.522 0.098
60 HA ASN 8 HA ASN 8 6.861 -0.979 -0.075
61 1HB ASN 8 1HB ASN 8 9.029 -2.066 0.012
62 2HB ASN 8 2HB ASN 8 9.282 -1.460 1.642
63 1HD2 ASN 8 2HD2 ASN 8 8.361 -2.641 3.384
64 2HD2 ASN 8 1HD2 ASN 8 7.400 -4.024 3.170
65 H ILE 9 H ILE 9 7.895 1.219 2.359
66 HA ILE 9 HA ILE 9 6.012 0.124 4.370
67 HB ILE 9 HB ILE 9 7.746 2.596 4.547
68 1HG1 ILE 9 1HG1 ILE 9 8.865 0.272 4.056
69 2HG1 ILE 9 2HG1 ILE 9 9.515 1.295 5.331
70 1HG2 ILE 9 1HG2 ILE 9 5.993 1.065 6.402
71 2HG2 ILE 9 2HG2 ILE 9 7.515 1.661 7.063
72 3HG2 ILE 9 3HG2 ILE 9 6.355 2.791 6.363
73 1HD1 ILE 9 1HD1 ILE 9 7.434 -0.828 5.876
74 2HD1 ILE 9 2HD1 ILE 9 9.163 -1.172 5.930
75 3HD1 ILE 9 3HD1 ILE 9 8.462 0.005 7.041
76 H ILE 10 H ILE 10 6.007 2.321 1.791
77 HA ILE 10 HA ILE 10 3.661 3.773 2.965
78 HB ILE 10 HB ILE 10 5.929 4.911 2.010
79 1HG1 ILE 10 1HG1 ILE 10 4.205 6.160 3.121
80 2HG1 ILE 10 2HG1 ILE 10 4.483 6.945 1.566
81 1HG2 ILE 10 1HG2 ILE 10 5.480 3.929 -0.276
82 2HG2 ILE 10 2HG2 ILE 10 4.059 4.970 -0.367
83 3HG2 ILE 10 3HG2 ILE 10 5.667 5.683 -0.251
84 1HD1 ILE 10 1HD1 ILE 10 2.588 5.296 0.747
85 2HD1 ILE 10 2HD1 ILE 10 2.157 5.276 2.457
86 3HD1 ILE 10 3HD1 ILE 10 2.162 6.798 1.567
87 H PHE 11 H PHE 11 5.026 2.155 0.193
88 HA PHE 11 HA PHE 11 2.859 2.306 -1.603
89 1HB PHE 11 1HB PHE 11 5.381 1.128 -1.455
90 2HB PHE 11 2HB PHE 11 4.282 -0.230 -1.603
91 HD1 PHE 11 HD1 PHE 11 5.151 3.070 -3.081
92 HD2 PHE 11 HD2 PHE 11 3.289 -0.750 -3.681
93 HE1 PHE 11 HE1 PHE 11 4.888 3.579 -5.500
94 HE2 PHE 11 HE2 PHE 11 3.022 -0.246 -6.102
95 HZ PHE 11 HZ PHE 11 3.823 1.920 -7.009
96 H GLY 12 H GLY 12 3.445 0.297 1.220
97 1HA GLY 12 1HA GLY 12 1.284 -1.576 0.681
98 2HA GLY 12 2HA GLY 12 2.120 -1.381 2.226
99 H VAL 13 H VAL 13 1.685 1.315 2.726
100 HA VAL 13 HA VAL 13 -0.879 1.366 3.908
101 HB VAL 13 HB VAL 13 1.101 3.497 3.121
102 1HG1 VAL 13 1HG1 VAL 13 -1.771 3.869 3.799
103 2HG1 VAL 13 2HG1 VAL 13 -0.624 4.919 4.632
104 3HG1 VAL 13 3HG1 VAL 13 -0.689 4.908 2.870
105 1HG2 VAL 13 1HG2 VAL 13 0.012 2.305 5.670
106 2HG2 VAL 13 2HG2 VAL 13 1.685 2.379 5.120
107 3HG2 VAL 13 3HG2 VAL 13 0.875 3.842 5.678
108 H SER 14 H SER 14 0.130 1.938 0.640
109 HA SER 14 HA SER 14 -2.481 3.143 -0.084
110 1HB SER 14 1HB SER 14 -0.057 3.758 -1.019
111 2HB SER 14 2HB SER 14 -0.408 2.433 -2.124
112 HG SER 14 HG SER 14 -2.482 3.567 -2.451
113 H TYR 15 H TYR 15 -0.480 0.291 -0.842
114 HA TYR 15 HA TYR 15 -2.420 -0.976 -2.542
115 1HB TYR 15 1HB TYR 15 0.139 -1.500 -2.030
116 2HB TYR 15 2HB TYR 15 -0.564 -2.611 -0.860
117 HD1 TYR 15 HD1 TYR 15 -1.700 -1.538 -4.269
118 HD2 TYR 15 HD2 TYR 15 -0.442 -4.774 -1.740
119 HE1 TYR 15 HE1 TYR 15 -2.194 -3.151 -6.087
120 HE2 TYR 15 HE2 TYR 15 -0.937 -6.386 -3.557
121 HH TYR 15 HH TYR 15 -2.064 -6.623 -5.546
122 H ASP 16 H ASP 16 -1.525 -1.676 0.859
123 HA ASP 16 HA ASP 16 -3.580 -3.489 1.453
124 1HB ASP 16 1HB ASP 16 -2.464 -1.300 3.241
125 2HB ASP 16 2HB ASP 16 -3.402 -2.684 3.802
126 H GLU 17 H GLU 17 -3.715 -0.076 0.860
127 HA GLU 17 HA GLU 17 -6.488 0.151 1.862
128 1HB GLU 17 1HB GLU 17 -4.714 1.996 2.095
129 2HB GLU 17 2HB GLU 17 -4.903 2.247 0.360
130 1HG GLU 17 1HG GLU 17 -7.364 2.160 2.065
131 2HG GLU 17 2HG GLU 17 -6.377 3.622 2.081
132 H TYR 18 H TYR 18 -4.709 -0.329 -1.096
133 HA TYR 18 HA TYR 18 -6.943 0.413 -2.838
134 1HB TYR 18 1HB TYR 18 -4.214 0.079 -3.201
135 2HB TYR 18 2HB TYR 18 -4.898 -1.340 -3.996
136 HD1 TYR 18 HD1 TYR 18 -5.411 2.366 -3.721
137 HD2 TYR 18 HD2 TYR 18 -5.713 -1.146 -6.177
138 HE1 TYR 18 HE1 TYR 18 -6.096 3.771 -5.646
139 HE2 TYR 18 HE2 TYR 18 -6.397 0.259 -8.102
140 HH TYR 18 HH TYR 18 -6.730 2.323 -8.844
141 H ARG 19 H ARG 19 -5.446 -2.623 -1.716
142 HA ARG 19 HA ARG 19 -7.232 -4.347 -3.174
143 1HB ARG 19 1HB ARG 19 -5.712 -4.907 -0.608
144 2HB ARG 19 2HB ARG 19 -6.402 -6.118 -1.689
145 1HG ARG 19 1HG ARG 19 -4.866 -5.615 -3.419
146 2HG ARG 19 2HG ARG 19 -4.407 -4.081 -2.679
147 1HD ARG 19 1HD ARG 19 -2.751 -5.105 -1.559
148 2HD ARG 19 2HD ARG 19 -3.926 -6.160 -0.778
149 HE ARG 19 HE ARG 19 -3.325 -7.052 -3.468
150 1HH1 ARG 19 1HH1 ARG 19 -1.777 -6.661 -0.438
151 2HH1 ARG 19 2HH1 ARG 19 -1.032 -8.224 -0.454
152 1HH2 ARG 19 1HH2 ARG 19 -2.562 -9.215 -3.405
153 2HH2 ARG 19 2HH2 ARG 19 -1.479 -9.671 -2.133
154 H TYR 20 H TYR 20 -7.585 -2.497 -0.274
155 HA TYR 20 HA TYR 20 -9.717 -4.116 0.872
156 1HB TYR 20 1HB TYR 20 -8.465 -2.714 2.375
157 2HB TYR 20 2HB TYR 20 -8.779 -1.283 1.391
158 HD1 TYR 20 HD1 TYR 20 -10.684 -4.026 3.110
159 HD2 TYR 20 HD2 TYR 20 -10.502 0.135 2.056
160 HE1 TYR 20 HE1 TYR 20 -12.783 -3.617 4.365
161 HE2 TYR 20 HE2 TYR 20 -12.601 0.543 3.312
162 HH TYR 20 HH TYR 20 -13.825 -0.598 5.269
163 H ARG 21 H ARG 21 -9.522 -1.410 -1.370
164 HA ARG 21 HA ARG 21 -12.433 -0.983 -1.302
165 1HB ARG 21 1HB ARG 21 -10.284 0.628 -1.943
166 2HB ARG 21 2HB ARG 21 -10.937 0.216 -3.529
167 1HG ARG 21 1HG ARG 21 -13.161 0.966 -2.844
168 2HG ARG 21 2HG ARG 21 -12.569 1.303 -1.218
169 1HD ARG 21 1HD ARG 21 -10.852 2.622 -3.091
170 2HD ARG 21 2HD ARG 21 -12.522 3.027 -3.487
171 HE ARG 21 HE ARG 21 -11.169 3.628 -0.910
172 1HH1 ARG 21 1HH1 ARG 21 -14.054 2.982 -0.483
173 2HH1 ARG 21 2HH1 ARG 21 -14.810 4.528 -0.675
174 1HH2 ARG 21 1HH2 ARG 21 -12.078 5.966 -2.251
175 2HH2 ARG 21 2HH2 ARG 21 -13.691 6.218 -1.674
176 H SER 22 H SER 22 -10.013 -2.357 -3.513
177 HA SER 22 HA SER 22 -11.892 -2.936 -5.621
178 1HB SER 22 1HB SER 22 -9.461 -2.831 -6.023
179 2HB SER 22 2HB SER 22 -9.225 -4.233 -4.984
180 HG SER 22 HG SER 22 -9.637 -4.301 -7.513
181 H VAL 23 H VAL 23 -10.827 -4.701 -2.754
182 HA VAL 23 HA VAL 23 -12.064 -7.206 -3.548
183 HB VAL 23 HB VAL 23 -10.200 -6.967 -1.852
184 1HG1 VAL 23 1HG1 VAL 23 -11.280 -5.001 -0.694
185 2HG1 VAL 23 2HG1 VAL 23 -12.465 -6.121 -0.026
186 3HG1 VAL 23 3HG1 VAL 23 -10.763 -6.284 0.399
187 1HG2 VAL 23 1HG2 VAL 23 -12.741 -8.490 -1.444
188 2HG2 VAL 23 2HG2 VAL 23 -11.114 -9.092 -1.762
189 3HG2 VAL 23 3HG2 VAL 23 -11.545 -8.526 -0.148
190 H ILE 24 H ILE 24 -13.018 -4.564 -1.334
191 HA ILE 24 HA ILE 24 -15.812 -5.607 -1.531
192 HB ILE 24 HB ILE 24 -14.430 -4.320 0.839
193 1HG1 ILE 24 1HG1 ILE 24 -15.848 -6.796 1.309
194 2HG1 ILE 24 2HG1 ILE 24 -14.693 -7.002 -0.009
195 1HG2 ILE 24 1HG2 ILE 24 -17.309 -4.719 0.148
196 2HG2 ILE 24 2HG2 ILE 24 -16.822 -5.043 1.812
197 3HG2 ILE 24 3HG2 ILE 24 -16.553 -3.448 1.108
198 1HD1 ILE 24 1HD1 ILE 24 -13.130 -5.624 1.670
199 2HD1 ILE 24 2HD1 ILE 24 -14.202 -6.362 2.860
200 3HD1 ILE 24 3HD1 ILE 24 -13.272 -7.380 1.759
201 H LYS 25 H LYS 25 -14.799 -3.790 -3.386
202 HA LYS 25 HA LYS 25 -14.942 -1.065 -2.907
203 1HB LYS 25 1HB LYS 25 -15.153 -2.767 -5.177
204 2HB LYS 25 2HB LYS 25 -16.474 -1.605 -5.273
205 1HG LYS 25 1HG LYS 25 -14.153 -0.191 -4.414
206 2HG LYS 25 2HG LYS 25 -13.696 -1.172 -5.808
207 1HD LYS 25 1HD LYS 25 -16.274 -0.005 -6.297
208 2HD LYS 25 2HD LYS 25 -15.153 1.266 -5.808
209 1HE LYS 25 1HE LYS 25 -13.833 1.008 -7.680
210 2HE LYS 25 2HE LYS 25 -14.135 -0.739 -7.775
211 1HZ LYS 25 1HZ LYS 25 -16.215 1.319 -8.275
212 2HZ LYS 25 2HZ LYS 25 -15.306 0.592 -9.511
213 3HZ LYS 25 3HZ LYS 25 -16.334 -0.353 -8.550
214 H ALA 26 H ALA 26 -17.583 -3.379 -2.911
215 HA ALA 26 HA ALA 26 -19.321 -1.419 -1.612
216 1HB ALA 26 1HB ALA 26 -19.445 -1.705 -4.450
217 2HB ALA 26 2HB ALA 26 -20.899 -2.438 -3.773
218 3HB ALA 26 3HB ALA 26 -20.507 -0.758 -3.407
Start of MODEL 6
1 1H MET 1 1H MET 1 20.147 6.219 -4.219
2 2H MET 1 2H MET 1 19.920 5.187 -5.545
3 3H MET 1 3H MET 1 20.128 6.855 -5.795
4 HA MET 1 HA MET 1 18.007 7.385 -5.095
5 1HB MET 1 1HB MET 1 18.314 4.813 -6.579
6 2HB MET 1 2HB MET 1 16.684 5.258 -6.071
7 1HG MET 1 1HG MET 1 17.299 7.601 -7.073
8 2HG MET 1 2HG MET 1 18.537 6.700 -7.948
9 1HE MET 1 1HE MET 1 16.839 8.125 -9.756
10 2HE MET 1 2HE MET 1 15.215 7.563 -10.141
11 3HE MET 1 3HE MET 1 15.543 8.329 -8.582
12 HA PRO 2 HA PRO 2 17.599 5.170 -1.136
13 1HB PRO 2 1HB PRO 2 16.520 7.305 0.193
14 2HB PRO 2 2HB PRO 2 18.267 7.092 -0.032
15 1HG PRO 2 1HG PRO 2 16.368 8.840 -1.513
16 2HG PRO 2 2HG PRO 2 18.040 9.151 -1.018
17 1HD PRO 2 1HD PRO 2 17.315 8.457 -3.560
18 2HD PRO 2 2HD PRO 2 18.914 8.117 -2.860
19 H GLY 3 H GLY 3 15.441 5.364 0.395
20 1HA GLY 3 1HA GLY 3 13.053 5.358 0.495
21 2HA GLY 3 2HA GLY 3 13.002 5.691 -1.236
22 H THR 4 H THR 4 14.449 3.085 0.755
23 HA THR 4 HA THR 4 13.207 1.148 -1.148
24 HB THR 4 HB THR 4 15.837 1.374 -0.470
25 HG1 THR 4 HG1 THR 4 15.808 -0.983 -1.062
26 1HG2 THR 4 1HG2 THR 4 14.644 -0.697 1.394
27 2HG2 THR 4 2HG2 THR 4 16.361 -0.572 1.014
28 3HG2 THR 4 3HG2 THR 4 15.549 0.745 1.857
29 H ILE 5 H ILE 5 13.956 1.593 2.310
30 HA ILE 5 HA ILE 5 12.057 -0.515 3.063
31 HB ILE 5 HB ILE 5 13.593 1.477 4.758
32 1HG1 ILE 5 1HG1 ILE 5 14.108 -1.463 4.212
33 2HG1 ILE 5 2HG1 ILE 5 14.981 -0.141 3.438
34 1HG2 ILE 5 1HG2 ILE 5 11.525 0.551 5.824
35 2HG2 ILE 5 2HG2 ILE 5 12.158 -1.072 5.559
36 3HG2 ILE 5 3HG2 ILE 5 13.004 0.039 6.635
37 1HD1 ILE 5 1HD1 ILE 5 14.812 -0.407 6.444
38 2HD1 ILE 5 2HD1 ILE 5 16.090 -1.179 5.504
39 3HD1 ILE 5 3HD1 ILE 5 15.931 0.576 5.500
40 H LYS 6 H LYS 6 12.257 3.039 3.416
41 HA LYS 6 HA LYS 6 9.872 3.522 4.781
42 1HB LYS 6 1HB LYS 6 11.637 5.189 3.815
43 2HB LYS 6 2HB LYS 6 10.603 5.196 2.387
44 1HG LYS 6 1HG LYS 6 8.657 5.709 3.951
45 2HG LYS 6 2HG LYS 6 9.861 5.992 5.209
46 1HD LYS 6 1HD LYS 6 10.079 7.371 2.540
47 2HD LYS 6 2HD LYS 6 9.049 8.029 3.812
48 1HE LYS 6 1HE LYS 6 11.313 7.545 5.245
49 2HE LYS 6 2HE LYS 6 12.010 7.929 3.658
50 1HZ LYS 6 1HZ LYS 6 10.273 9.805 3.656
51 2HZ LYS 6 2HZ LYS 6 10.219 9.570 5.334
52 3HZ LYS 6 3HZ LYS 6 11.678 10.011 4.586
53 H GLU 7 H GLU 7 10.333 2.745 1.361
54 HA GLU 7 HA GLU 7 7.466 3.003 0.787
55 1HB GLU 7 1HB GLU 7 8.038 2.441 -1.454
56 2HB GLU 7 2HB GLU 7 9.363 3.434 -0.861
57 1HG GLU 7 1HG GLU 7 10.744 1.499 -0.463
58 2HG GLU 7 2HG GLU 7 9.398 0.410 -0.799
59 H ASN 8 H ASN 8 9.815 0.427 1.376
60 HA ASN 8 HA ASN 8 8.001 -1.738 0.819
61 1HB ASN 8 1HB ASN 8 10.378 -2.164 0.841
62 2HB ASN 8 2HB ASN 8 10.489 -1.595 2.499
63 1HD2 ASN 8 2HD2 ASN 8 10.495 -3.251 4.025
64 2HD2 ASN 8 1HD2 ASN 8 9.778 -4.774 3.808
65 H ILE 9 H ILE 9 8.022 0.595 3.222
66 HA ILE 9 HA ILE 9 6.701 -1.204 5.209
67 HB ILE 9 HB ILE 9 7.822 1.595 5.459
68 1HG1 ILE 9 1HG1 ILE 9 8.635 -1.111 6.550
69 2HG1 ILE 9 2HG1 ILE 9 9.534 -0.126 5.398
70 1HG2 ILE 9 1HG2 ILE 9 6.225 -0.137 7.348
71 2HG2 ILE 9 2HG2 ILE 9 7.326 1.101 7.951
72 3HG2 ILE 9 3HG2 ILE 9 5.964 1.555 6.930
73 1HD1 ILE 9 1HD1 ILE 9 9.736 1.658 7.099
74 2HD1 ILE 9 2HD1 ILE 9 8.890 0.631 8.256
75 3HD1 ILE 9 3HD1 ILE 9 10.473 0.149 7.641
76 H ILE 10 H ILE 10 6.056 1.070 2.792
77 HA ILE 10 HA ILE 10 3.392 1.717 3.984
78 HB ILE 10 HB ILE 10 5.252 3.436 2.893
79 1HG1 ILE 10 1HG1 ILE 10 3.356 4.082 4.284
80 2HG1 ILE 10 2HG1 ILE 10 3.364 5.061 2.817
81 1HG2 ILE 10 1HG2 ILE 10 4.893 2.539 0.618
82 2HG2 ILE 10 2HG2 ILE 10 3.173 2.903 0.749
83 3HG2 ILE 10 3HG2 ILE 10 4.353 4.213 0.738
84 1HD1 ILE 10 1HD1 ILE 10 1.817 3.138 1.887
85 2HD1 ILE 10 2HD1 ILE 10 1.516 2.830 3.596
86 3HD1 ILE 10 3HD1 ILE 10 1.131 4.405 2.904
87 H PHE 11 H PHE 11 5.035 0.711 1.013
88 HA PHE 11 HA PHE 11 2.947 0.156 -0.693
89 1HB PHE 11 1HB PHE 11 4.890 -0.465 -1.698
90 2HB PHE 11 2HB PHE 11 5.650 -0.880 -0.173
91 HD1 PHE 11 HD1 PHE 11 3.249 -2.126 -2.728
92 HD2 PHE 11 HD2 PHE 11 5.855 -3.118 0.534
93 HE1 PHE 11 HE1 PHE 11 2.928 -4.543 -3.213
94 HE2 PHE 11 HE2 PHE 11 5.538 -5.535 0.055
95 HZ PHE 11 HZ PHE 11 4.074 -6.246 -1.819
96 H GLY 12 H GLY 12 3.854 -1.535 2.251
97 1HA GLY 12 1HA GLY 12 1.989 -3.748 1.790
98 2HA GLY 12 2HA GLY 12 2.910 -3.459 3.268
99 H VAL 13 H VAL 13 2.053 -0.717 3.607
100 HA VAL 13 HA VAL 13 -0.523 -1.231 4.893
101 HB VAL 13 HB VAL 13 1.071 1.337 4.622
102 1HG1 VAL 13 1HG1 VAL 13 -1.558 0.713 5.724
103 2HG1 VAL 13 2HG1 VAL 13 -0.480 1.398 6.941
104 3HG1 VAL 13 3HG1 VAL 13 -0.804 2.285 5.450
105 1HG2 VAL 13 1HG2 VAL 13 1.166 -0.993 6.482
106 2HG2 VAL 13 2HG2 VAL 13 2.469 0.068 5.941
107 3HG2 VAL 13 3HG2 VAL 13 1.352 0.611 7.194
108 H SER 14 H SER 14 0.605 0.129 1.906
109 HA SER 14 HA SER 14 -1.928 1.532 1.366
110 1HB SER 14 1HB SER 14 0.546 2.076 0.519
111 2HB SER 14 2HB SER 14 0.082 0.983 -0.782
112 HG SER 14 HG SER 14 -1.718 2.971 0.021
113 H TYR 15 H TYR 15 -0.223 -1.394 0.267
114 HA TYR 15 HA TYR 15 -2.124 -2.181 -1.712
115 1HB TYR 15 1HB TYR 15 0.243 -3.168 -1.000
116 2HB TYR 15 2HB TYR 15 -0.759 -4.251 -0.040
117 HD1 TYR 15 HD1 TYR 15 -1.256 -2.695 -3.420
118 HD2 TYR 15 HD2 TYR 15 -0.913 -6.309 -1.126
119 HE1 TYR 15 HE1 TYR 15 -1.777 -4.030 -5.445
120 HE2 TYR 15 HE2 TYR 15 -1.433 -7.644 -3.149
121 HH TYR 15 HH TYR 15 -2.865 -6.892 -5.528
122 H ASP 16 H ASP 16 -1.769 -3.308 1.665
123 HA ASP 16 HA ASP 16 -4.117 -4.837 1.835
124 1HB ASP 16 1HB ASP 16 -2.386 -3.410 3.742
125 2HB ASP 16 2HB ASP 16 -4.055 -3.570 4.291
126 H GLU 17 H GLU 17 -3.701 -1.405 1.598
127 HA GLU 17 HA GLU 17 -6.535 -0.876 2.277
128 1HB GLU 17 1HB GLU 17 -4.093 0.638 2.336
129 2HB GLU 17 2HB GLU 17 -5.236 1.450 1.267
130 1HG GLU 17 1HG GLU 17 -5.996 0.468 4.026
131 2HG GLU 17 2HG GLU 17 -5.390 2.098 3.727
132 H TYR 18 H TYR 18 -4.427 -1.294 -0.459
133 HA TYR 18 HA TYR 18 -6.168 0.035 -2.382
134 1HB TYR 18 1HB TYR 18 -3.828 -1.865 -2.644
135 2HB TYR 18 2HB TYR 18 -4.719 -1.271 -4.044
136 HD1 TYR 18 HD1 TYR 18 -4.768 1.118 -1.401
137 HD2 TYR 18 HD2 TYR 18 -2.308 -0.389 -4.583
138 HE1 TYR 18 HE1 TYR 18 -3.436 3.209 -1.361
139 HE2 TYR 18 HE2 TYR 18 -0.975 1.701 -4.544
140 HH TYR 18 HH TYR 18 -0.453 3.519 -3.041
141 H ARG 19 H ARG 19 -5.333 -3.423 -1.904
142 HA ARG 19 HA ARG 19 -7.391 -4.428 -3.590
143 1HB ARG 19 1HB ARG 19 -5.647 -5.547 -1.453
144 2HB ARG 19 2HB ARG 19 -7.099 -6.466 -1.854
145 1HG ARG 19 1HG ARG 19 -5.952 -5.624 -4.311
146 2HG ARG 19 2HG ARG 19 -4.642 -6.278 -3.330
147 1HD ARG 19 1HD ARG 19 -5.446 -8.396 -3.463
148 2HD ARG 19 2HD ARG 19 -7.111 -7.870 -3.211
149 HE ARG 19 HE ARG 19 -5.724 -7.836 -5.859
150 1HH1 ARG 19 1HH1 ARG 19 -8.206 -9.310 -4.271
151 2HH1 ARG 19 2HH1 ARG 19 -9.456 -8.867 -5.384
152 1HH2 ARG 19 1HH2 ARG 19 -7.474 -6.618 -7.128
153 2HH2 ARG 19 2HH2 ARG 19 -9.043 -7.342 -7.000
154 H TYR 20 H TYR 20 -7.526 -3.059 -0.434
155 HA TYR 20 HA TYR 20 -10.017 -4.360 0.357
156 1HB TYR 20 1HB TYR 20 -8.449 -3.519 2.057
157 2HB TYR 20 2HB TYR 20 -8.635 -1.881 1.430
158 HD1 TYR 20 HD1 TYR 20 -10.939 -4.704 2.351
159 HD2 TYR 20 HD2 TYR 20 -10.010 -0.527 2.716
160 HE1 TYR 20 HE1 TYR 20 -12.938 -4.385 3.786
161 HE2 TYR 20 HE2 TYR 20 -12.006 -0.208 4.150
162 HH TYR 20 HH TYR 20 -13.415 -2.072 5.775
163 H ARG 21 H ARG 21 -9.220 -0.957 -0.436
164 HA ARG 21 HA ARG 21 -11.818 0.041 -0.650
165 1HB ARG 21 1HB ARG 21 -9.777 1.429 -0.876
166 2HB ARG 21 2HB ARG 21 -9.474 0.709 -2.458
167 1HG ARG 21 1HG ARG 21 -12.186 1.632 -2.383
168 2HG ARG 21 2HG ARG 21 -11.131 2.939 -1.849
169 1HD ARG 21 1HD ARG 21 -10.595 1.313 -4.344
170 2HD ARG 21 2HD ARG 21 -11.512 2.819 -4.359
171 HE ARG 21 HE ARG 21 -9.127 3.428 -3.031
172 1HH1 ARG 21 1HH2 ARG 21 -9.977 4.685 -5.631
173 2HH1 ARG 21 2HH2 ARG 21 -8.685 4.221 -6.688
174 1HH2 ARG 21 1HH1 ARG 21 -7.502 1.730 -4.588
175 2HH2 ARG 21 2HH1 ARG 21 -7.284 2.550 -6.098
176 H SER 22 H SER 22 -9.965 -1.811 -3.030
177 HA SER 22 HA SER 22 -11.706 -1.552 -5.246
178 1HB SER 22 1HB SER 22 -9.450 -2.667 -5.263
179 2HB SER 22 2HB SER 22 -10.185 -4.055 -4.465
180 HG SER 22 HG SER 22 -11.179 -4.573 -6.269
181 H VAL 23 H VAL 23 -11.840 -3.828 -2.505
182 HA VAL 23 HA VAL 23 -14.153 -5.237 -3.538
183 HB VAL 23 HB VAL 23 -12.429 -6.006 -1.746
184 1HG1 VAL 23 1HG1 VAL 23 -13.428 -3.839 -0.366
185 2HG1 VAL 23 2HG1 VAL 23 -14.320 -5.182 0.345
186 3HG1 VAL 23 3HG1 VAL 23 -12.557 -5.186 0.361
187 1HG2 VAL 23 1HG2 VAL 23 -14.475 -7.249 -2.490
188 2HG2 VAL 23 2HG2 VAL 23 -14.072 -7.529 -0.796
189 3HG2 VAL 23 3HG2 VAL 23 -15.385 -6.431 -1.221
190 H ILE 24 H ILE 24 -13.666 -2.354 -1.640
191 HA ILE 24 HA ILE 24 -16.533 -2.204 -0.921
192 HB ILE 24 HB ILE 24 -14.476 -0.052 -0.433
193 1HG1 ILE 24 1HG1 ILE 24 -13.423 -2.093 0.352
194 2HG1 ILE 24 2HG1 ILE 24 -14.039 -1.222 1.757
195 1HG2 ILE 24 1HG2 ILE 24 -17.068 0.049 0.032
196 2HG2 ILE 24 2HG2 ILE 24 -16.655 -0.943 1.430
197 3HG2 ILE 24 3HG2 ILE 24 -15.937 0.656 1.240
198 1HD1 ILE 24 1HD1 ILE 24 -16.114 -2.636 1.640
199 2HD1 ILE 24 2HD1 ILE 24 -15.341 -3.580 0.366
200 3HD1 ILE 24 3HD1 ILE 24 -14.651 -3.557 1.990
201 H LYS 25 H LYS 25 -14.826 -1.613 -3.656
202 HA LYS 25 HA LYS 25 -16.006 0.998 -4.326
203 1HB LYS 25 1HB LYS 25 -13.708 -0.056 -5.120
204 2HB LYS 25 2HB LYS 25 -14.723 -0.788 -6.363
205 1HG LYS 25 1HG LYS 25 -15.002 2.145 -5.795
206 2HG LYS 25 2HG LYS 25 -13.646 1.585 -6.773
207 1HD LYS 25 1HD LYS 25 -15.198 0.459 -8.312
208 2HD LYS 25 2HD LYS 25 -16.565 0.979 -7.327
209 1HE LYS 25 1HE LYS 25 -16.605 2.977 -8.391
210 2HE LYS 25 2HE LYS 25 -14.905 3.262 -7.970
211 1HZ LYS 25 1HZ LYS 25 -14.288 1.728 -9.783
212 2HZ LYS 25 2HZ LYS 25 -15.923 1.637 -10.241
213 3HZ LYS 25 3HZ LYS 25 -15.094 3.114 -10.347
214 H ALA 26 H ALA 26 -16.326 -2.382 -5.447
215 HA ALA 26 HA ALA 26 -18.052 -3.410 -6.664
216 1HB ALA 26 1HB ALA 26 -19.152 -2.388 -4.438
217 2HB ALA 26 2HB ALA 26 -20.023 -1.425 -5.631
218 3HB ALA 26 3HB ALA 26 -20.121 -3.185 -5.677
Start of MODEL 7
1 1H MET 1 1H MET 1 16.744 0.419 -5.279
2 2H MET 1 2H MET 1 17.323 0.521 -6.873
3 3H MET 1 3H MET 1 18.322 0.972 -5.580
4 HA MET 1 HA MET 1 17.579 3.003 -6.473
5 1HB MET 1 1HB MET 1 15.409 1.241 -7.172
6 2HB MET 1 2HB MET 1 14.755 2.699 -6.424
7 1HG MET 1 1HG MET 1 15.304 3.977 -8.204
8 2HG MET 1 2HG MET 1 16.922 3.283 -8.298
9 1HE MET 1 1HE MET 1 17.001 3.537 -10.578
10 2HE MET 1 2HE MET 1 17.589 1.870 -10.504
11 3HE MET 1 3HE MET 1 16.449 2.352 -11.759
12 HA PRO 2 HA PRO 2 16.767 4.126 -2.278
13 1HB PRO 2 1HB PRO 2 16.713 6.839 -2.635
14 2HB PRO 2 2HB PRO 2 18.216 5.895 -2.640
15 1HG PRO 2 1HG PRO 2 16.655 6.978 -4.927
16 2HG PRO 2 2HG PRO 2 18.408 6.848 -4.714
17 1HD PRO 2 1HD PRO 2 16.922 5.130 -6.242
18 2HD PRO 2 2HD PRO 2 18.470 4.699 -5.483
19 H GLY 3 H GLY 3 15.044 5.332 -1.042
20 1HA GLY 3 1HA GLY 3 12.832 6.087 -0.716
21 2HA GLY 3 2HA GLY 3 12.688 6.285 -2.463
22 H THR 4 H THR 4 13.487 3.364 -0.583
23 HA THR 4 HA THR 4 11.027 2.113 -1.737
24 HB THR 4 HB THR 4 13.598 1.431 -2.382
25 HG1 THR 4 HG1 THR 4 11.256 -0.140 -2.228
26 1HG2 THR 4 1HG2 THR 4 12.726 -0.431 -0.156
27 2HG2 THR 4 2HG2 THR 4 14.049 -0.755 -1.275
28 3HG2 THR 4 3HG2 THR 4 14.153 0.605 -0.155
29 H ILE 5 H ILE 5 13.379 1.955 0.931
30 HA ILE 5 HA ILE 5 11.923 0.211 2.625
31 HB ILE 5 HB ILE 5 13.796 2.502 3.277
32 1HG1 ILE 5 1HG1 ILE 5 14.906 0.026 3.964
33 2HG1 ILE 5 2HG1 ILE 5 14.097 -0.268 2.424
34 1HG2 ILE 5 1HG2 ILE 5 12.366 0.520 5.031
35 2HG2 ILE 5 2HG2 ILE 5 13.963 1.113 5.489
36 3HG2 ILE 5 3HG2 ILE 5 12.625 2.244 5.290
37 1HD1 ILE 5 1HD1 ILE 5 16.032 2.006 2.953
38 2HD1 ILE 5 2HD1 ILE 5 16.442 0.508 2.118
39 3HD1 ILE 5 3HD1 ILE 5 15.271 1.622 1.409
40 H LYS 6 H LYS 6 11.928 3.785 2.560
41 HA LYS 6 HA LYS 6 10.033 4.297 4.543
42 1HB LYS 6 1HB LYS 6 11.300 5.915 2.885
43 2HB LYS 6 2HB LYS 6 9.826 5.763 1.928
44 1HG LYS 6 1HG LYS 6 9.268 6.209 4.763
45 2HG LYS 6 2HG LYS 6 10.208 7.521 4.047
46 1HD LYS 6 1HD LYS 6 8.522 8.135 2.614
47 2HD LYS 6 2HD LYS 6 7.921 6.485 2.449
48 1HE LYS 6 1HE LYS 6 6.718 6.589 4.486
49 2HE LYS 6 2HE LYS 6 7.635 7.999 5.051
50 1HZ LYS 6 1HZ LYS 6 5.887 7.961 2.649
51 2HZ LYS 6 2HZ LYS 6 5.447 8.619 4.149
52 3HZ LYS 6 3HZ LYS 6 6.723 9.306 3.263
53 H GLU 7 H GLU 7 9.526 3.150 1.245
54 HA GLU 7 HA GLU 7 6.637 3.309 1.345
55 1HB GLU 7 1HB GLU 7 8.206 1.330 -0.316
56 2HB GLU 7 2HB GLU 7 6.669 2.107 -0.695
57 1HG GLU 7 1HG GLU 7 8.277 4.287 -0.367
58 2HG GLU 7 2HG GLU 7 9.426 3.122 -1.026
59 H ASN 8 H ASN 8 9.002 0.702 1.906
60 HA ASN 8 HA ASN 8 7.265 -1.416 2.454
61 1HB ASN 8 1HB ASN 8 9.595 -1.868 2.473
62 2HB ASN 8 2HB ASN 8 9.882 -0.641 3.698
63 1HD2 ASN 8 2HD2 ASN 8 7.628 -3.451 3.451
64 2HD2 ASN 8 1HD2 ASN 8 8.018 -4.081 4.978
65 H ILE 9 H ILE 9 7.745 1.519 4.225
66 HA ILE 9 HA ILE 9 6.413 0.431 6.638
67 HB ILE 9 HB ILE 9 7.327 3.268 6.142
68 1HG1 ILE 9 1HG1 ILE 9 8.823 0.816 7.089
69 2HG1 ILE 9 2HG1 ILE 9 9.280 1.945 5.813
70 1HG2 ILE 9 1HG2 ILE 9 5.732 2.498 8.084
71 2HG2 ILE 9 2HG2 ILE 9 7.205 1.816 8.774
72 3HG2 ILE 9 3HG2 ILE 9 7.101 3.547 8.457
73 1HD1 ILE 9 1HD1 ILE 9 8.980 3.544 8.081
74 2HD1 ILE 9 2HD1 ILE 9 9.792 2.093 8.670
75 3HD1 ILE 9 3HD1 ILE 9 10.503 3.031 7.355
76 H ILE 10 H ILE 10 5.596 2.004 3.721
77 HA ILE 10 HA ILE 10 2.924 2.692 4.884
78 HB ILE 10 HB ILE 10 4.741 4.513 3.808
79 1HG1 ILE 10 1HG1 ILE 10 2.986 5.189 5.273
80 2HG1 ILE 10 2HG1 ILE 10 2.672 6.018 3.748
81 1HG2 ILE 10 1HG2 ILE 10 2.651 3.813 1.729
82 2HG2 ILE 10 2HG2 ILE 10 3.551 5.330 1.742
83 3HG2 ILE 10 3HG2 ILE 10 4.403 3.802 1.526
84 1HD1 ILE 10 1HD1 ILE 10 1.186 3.991 3.162
85 2HD1 ILE 10 2HD1 ILE 10 1.280 3.587 4.876
86 3HD1 ILE 10 3HD1 ILE 10 0.568 5.119 4.370
87 H PHE 11 H PHE 11 4.642 1.986 1.854
88 HA PHE 11 HA PHE 11 2.532 1.240 0.212
89 1HB PHE 11 1HB PHE 11 4.538 1.136 -0.898
90 2HB PHE 11 2HB PHE 11 5.399 0.513 0.502
91 HD1 PHE 11 HD1 PHE 11 2.827 -0.497 -2.019
92 HD2 PHE 11 HD2 PHE 11 6.011 -1.732 0.580
93 HE1 PHE 11 HE1 PHE 11 2.709 -2.789 -2.971
94 HE2 PHE 11 HE2 PHE 11 5.898 -4.026 -0.368
95 HZ PHE 11 HZ PHE 11 4.246 -4.553 -2.144
96 H GLY 12 H GLY 12 3.871 -0.454 2.978
97 1HA GLY 12 1HA GLY 12 2.450 -2.950 2.402
98 2HA GLY 12 2HA GLY 12 3.335 -2.580 3.884
99 H VAL 13 H VAL 13 1.966 -0.064 4.366
100 HA VAL 13 HA VAL 13 -0.417 -1.126 5.686
101 HB VAL 13 HB VAL 13 0.777 1.655 5.508
102 1HG1 VAL 13 1HG1 VAL 13 -1.891 0.870 6.202
103 2HG1 VAL 13 2HG1 VAL 13 -1.065 1.394 7.669
104 3HG1 VAL 13 3HG1 VAL 13 -1.169 2.477 6.282
105 1HG2 VAL 13 1HG2 VAL 13 1.884 -0.259 6.850
106 2HG2 VAL 13 2HG2 VAL 13 1.571 1.253 7.703
107 3HG2 VAL 13 3HG2 VAL 13 0.496 -0.127 7.930
108 H SER 14 H SER 14 0.337 0.639 2.775
109 HA SER 14 HA SER 14 -2.405 1.544 2.322
110 1HB SER 14 1HB SER 14 -0.032 2.395 1.352
111 2HB SER 14 2HB SER 14 -0.506 1.315 0.043
112 HG SER 14 HG SER 14 -1.264 3.588 -0.030
113 H TYR 15 H TYR 15 -0.431 -1.234 1.465
114 HA TYR 15 HA TYR 15 -2.202 -2.263 -0.576
115 1HB TYR 15 1HB TYR 15 0.297 -2.914 0.211
116 2HB TYR 15 2HB TYR 15 -0.605 -4.164 1.063
117 HD1 TYR 15 HD1 TYR 15 -0.054 -2.641 -2.299
118 HD2 TYR 15 HD2 TYR 15 -1.523 -6.022 -0.094
119 HE1 TYR 15 HE1 TYR 15 -0.295 -3.915 -4.414
120 HE2 TYR 15 HE2 TYR 15 -1.764 -7.295 -2.209
121 HH TYR 15 HH TYR 15 -2.114 -6.456 -4.830
122 H ASP 16 H ASP 16 -1.699 -3.165 2.855
123 HA ASP 16 HA ASP 16 -3.787 -5.044 3.078
124 1HB ASP 16 1HB ASP 16 -2.094 -3.620 4.868
125 2HB ASP 16 2HB ASP 16 -3.747 -3.405 5.444
126 H GLU 17 H GLU 17 -3.891 -1.578 2.805
127 HA GLU 17 HA GLU 17 -6.811 -1.556 3.381
128 1HB GLU 17 1HB GLU 17 -4.745 0.257 3.955
129 2HB GLU 17 2HB GLU 17 -5.650 1.009 2.641
130 1HG GLU 17 1HG GLU 17 -7.345 -0.213 4.717
131 2HG GLU 17 2HG GLU 17 -6.361 1.133 5.292
132 H TYR 18 H TYR 18 -4.539 -1.573 0.802
133 HA TYR 18 HA TYR 18 -6.385 -0.336 -1.136
134 1HB TYR 18 1HB TYR 18 -3.932 0.001 -1.331
135 2HB TYR 18 2HB TYR 18 -3.727 -1.734 -1.572
136 HD1 TYR 18 HD1 TYR 18 -6.482 0.410 -2.873
137 HD2 TYR 18 HD2 TYR 18 -2.935 -1.825 -3.812
138 HE1 TYR 18 HE1 TYR 18 -6.942 0.695 -5.294
139 HE2 TYR 18 HE2 TYR 18 -3.396 -1.540 -6.231
140 HH TYR 18 HH TYR 18 -6.177 -0.836 -7.500
141 H ARG 19 H ARG 19 -4.805 -3.538 -0.787
142 HA ARG 19 HA ARG 19 -6.146 -4.926 -2.791
143 1HB ARG 19 1HB ARG 19 -4.661 -5.615 -0.458
144 2HB ARG 19 2HB ARG 19 -6.124 -6.601 -0.461
145 1HG ARG 19 1HG ARG 19 -5.097 -6.484 -3.136
146 2HG ARG 19 2HG ARG 19 -3.786 -6.947 -2.049
147 1HD ARG 19 1HD ARG 19 -4.666 -9.037 -2.247
148 2HD ARG 19 2HD ARG 19 -5.845 -8.459 -1.069
149 HE ARG 19 HE ARG 19 -6.921 -7.687 -3.500
150 1HH1 ARG 19 1HH1 ARG 19 -5.175 -10.318 -4.003
151 2HH1 ARG 19 2HH1 ARG 19 -6.467 -11.468 -4.095
152 1HH2 ARG 19 1HH2 ARG 19 -8.845 -9.297 -2.814
153 2HH2 ARG 19 2HH2 ARG 19 -8.542 -10.891 -3.420
154 H TYR 20 H TYR 20 -7.425 -3.691 0.205
155 HA TYR 20 HA TYR 20 -9.914 -5.247 -0.010
156 1HB TYR 20 1HB TYR 20 -9.300 -4.821 2.233
157 2HB TYR 20 2HB TYR 20 -8.877 -3.145 1.893
158 HD1 TYR 20 HD1 TYR 20 -10.641 -1.443 1.551
159 HD2 TYR 20 HD2 TYR 20 -11.594 -5.493 2.619
160 HE1 TYR 20 HE1 TYR 20 -12.935 -0.738 2.176
161 HE2 TYR 20 HE2 TYR 20 -13.889 -4.788 3.244
162 HH TYR 20 HH TYR 20 -15.397 -2.413 2.322
163 H ARG 21 H ARG 21 -8.741 -1.992 -0.718
164 HA ARG 21 HA ARG 21 -11.414 -1.005 -1.396
165 1HB ARG 21 1HB ARG 21 -9.166 0.276 -0.636
166 2HB ARG 21 2HB ARG 21 -8.993 0.411 -2.387
167 1HG ARG 21 1HG ARG 21 -11.052 1.557 -2.619
168 2HG ARG 21 2HG ARG 21 -11.585 1.086 -1.005
169 1HD ARG 21 1HD ARG 21 -10.785 3.058 -0.262
170 2HD ARG 21 2HD ARG 21 -9.166 2.441 -0.589
171 HE ARG 21 HE ARG 21 -10.750 3.961 -2.623
172 1HH1 ARG 21 1HH1 ARG 21 -7.846 2.396 -2.136
173 2HH1 ARG 21 2HH1 ARG 21 -6.837 3.731 -2.581
174 1HH2 ARG 21 1HH2 ARG 21 -9.452 6.004 -2.719
175 2HH2 ARG 21 2HH2 ARG 21 -7.746 5.773 -2.909
176 H SER 22 H SER 22 -8.811 -2.619 -3.016
177 HA SER 22 HA SER 22 -9.476 -1.813 -5.707
178 1HB SER 22 1HB SER 22 -7.323 -2.980 -4.819
179 2HB SER 22 2HB SER 22 -8.241 -4.471 -5.012
180 HG SER 22 HG SER 22 -8.498 -3.990 -7.183
181 H VAL 23 H VAL 23 -10.762 -4.167 -3.483
182 HA VAL 23 HA VAL 23 -12.239 -5.590 -5.600
183 HB VAL 23 HB VAL 23 -12.624 -5.903 -2.621
184 1HG1 VAL 23 1HG1 VAL 23 -12.967 -7.691 -5.044
185 2HG1 VAL 23 2HG1 VAL 23 -13.066 -8.276 -3.383
186 3HG1 VAL 23 3HG1 VAL 23 -14.232 -7.091 -3.971
187 1HG2 VAL 23 1HG2 VAL 23 -10.215 -6.335 -4.151
188 2HG2 VAL 23 2HG2 VAL 23 -10.490 -6.605 -2.430
189 3HG2 VAL 23 3HG2 VAL 23 -10.847 -7.884 -3.592
190 H ILE 24 H ILE 24 -12.686 -2.918 -3.473
191 HA ILE 24 HA ILE 24 -15.485 -2.660 -4.437
192 HB ILE 24 HB ILE 24 -14.645 -2.432 -1.530
193 1HG1 ILE 24 1HG1 ILE 24 -16.703 -4.202 -1.608
194 2HG1 ILE 24 2HG1 ILE 24 -15.956 -4.532 -3.172
195 1HG2 ILE 24 1HG2 ILE 24 -16.846 -1.288 -3.039
196 2HG2 ILE 24 2HG2 ILE 24 -17.439 -2.374 -1.783
197 3HG2 ILE 24 3HG2 ILE 24 -16.393 -1.019 -1.357
198 1HD1 ILE 24 1HD1 ILE 24 -13.724 -4.497 -1.735
199 2HD1 ILE 24 2HD1 ILE 24 -14.832 -4.890 -0.420
200 3HD1 ILE 24 3HD1 ILE 24 -14.716 -5.952 -1.824
201 H LYS 25 H LYS 25 -13.098 -1.279 -5.250
202 HA LYS 25 HA LYS 25 -12.605 1.174 -3.958
203 1HB LYS 25 1HB LYS 25 -11.426 0.189 -6.015
204 2HB LYS 25 2HB LYS 25 -12.736 0.889 -6.966
205 1HG LYS 25 1HG LYS 25 -12.208 3.117 -6.162
206 2HG LYS 25 2HG LYS 25 -11.009 2.471 -5.042
207 1HD LYS 25 1HD LYS 25 -9.729 1.578 -6.996
208 2HD LYS 25 2HD LYS 25 -10.884 2.369 -8.070
209 1HE LYS 25 1HE LYS 25 -9.388 3.913 -5.934
210 2HE LYS 25 2HE LYS 25 -8.739 3.695 -7.572
211 1HZ LYS 25 1HZ LYS 25 -11.541 4.433 -7.416
212 2HZ LYS 25 2HZ LYS 25 -10.451 5.639 -6.922
213 3HZ LYS 25 3HZ LYS 25 -10.337 4.974 -8.481
214 H ALA 26 H ALA 26 -14.608 0.974 -6.916
215 HA ALA 26 HA ALA 26 -15.912 3.437 -6.585
216 1HB ALA 26 1HB ALA 26 -16.915 0.865 -7.833
217 2HB ALA 26 2HB ALA 26 -17.766 2.404 -7.961
218 3HB ALA 26 3HB ALA 26 -16.155 2.226 -8.657
Start of MODEL 8
1 1H MET 1 1H MET 1 16.894 4.438 -6.981
2 2H MET 1 2H MET 1 15.817 3.359 -7.726
3 3H MET 1 3H MET 1 16.182 4.842 -8.471
4 HA MET 1 HA MET 1 14.940 6.076 -6.941
5 1HB MET 1 1HB MET 1 13.890 3.582 -8.097
6 2HB MET 1 2HB MET 1 12.893 4.227 -6.792
7 1HG MET 1 1HG MET 1 12.451 6.214 -7.929
8 2HG MET 1 2HG MET 1 13.902 6.085 -8.923
9 1HE MET 1 1HE MET 1 14.238 5.344 -10.730
10 2HE MET 1 2HE MET 1 13.761 3.715 -11.205
11 3HE MET 1 3HE MET 1 13.014 5.121 -11.978
12 HA PRO 2 HA PRO 2 15.928 4.209 -2.910
13 1HB PRO 2 1HB PRO 2 16.213 6.603 -1.614
14 2HB PRO 2 2HB PRO 2 17.515 5.856 -2.561
15 1HG PRO 2 1HG PRO 2 15.686 8.084 -3.285
16 2HG PRO 2 2HG PRO 2 17.396 7.850 -3.679
17 1HD PRO 2 1HD PRO 2 15.334 7.377 -5.428
18 2HD PRO 2 2HD PRO 2 16.929 6.599 -5.528
19 H GLY 3 H GLY 3 13.396 3.874 -3.509
20 1HA GLY 3 1HA GLY 3 11.887 5.291 -1.355
21 2HA GLY 3 2HA GLY 3 11.169 5.083 -2.955
22 H THR 4 H THR 4 13.200 2.700 -1.335
23 HA THR 4 HA THR 4 10.926 0.796 -1.479
24 HB THR 4 HB THR 4 13.673 0.606 -2.095
25 HG1 THR 4 HG1 THR 4 11.701 -1.403 -1.764
26 1HG2 THR 4 1HG2 THR 4 12.968 -1.117 0.302
27 2HG2 THR 4 2HG2 THR 4 14.399 -1.324 -0.707
28 3HG2 THR 4 3HG2 THR 4 14.201 0.143 0.252
29 H ILE 5 H ILE 5 13.235 2.196 0.806
30 HA ILE 5 HA ILE 5 12.597 0.639 3.084
31 HB ILE 5 HB ILE 5 13.168 3.608 3.167
32 1HG1 ILE 5 1HG1 ILE 5 15.582 2.169 3.391
33 2HG1 ILE 5 2HG1 ILE 5 14.752 1.478 1.996
34 1HG2 ILE 5 1HG2 ILE 5 12.629 2.346 5.280
35 2HG2 ILE 5 2HG2 ILE 5 14.041 1.336 4.974
36 3HG2 ILE 5 3HG2 ILE 5 14.240 3.064 5.268
37 1HD1 ILE 5 1HD1 ILE 5 14.834 4.460 2.290
38 2HD1 ILE 5 2HD1 ILE 5 16.274 3.623 1.711
39 3HD1 ILE 5 3HD1 ILE 5 14.756 3.484 0.823
40 H LYS 6 H LYS 6 11.147 3.709 1.979
41 HA LYS 6 HA LYS 6 9.206 3.950 4.026
42 1HB LYS 6 1HB LYS 6 9.586 5.784 2.488
43 2HB LYS 6 2HB LYS 6 9.094 4.792 1.115
44 1HG LYS 6 1HG LYS 6 6.831 4.790 1.768
45 2HG LYS 6 2HG LYS 6 7.215 5.257 3.426
46 1HD LYS 6 1HD LYS 6 8.085 7.456 2.472
47 2HD LYS 6 2HD LYS 6 7.344 6.982 0.943
48 1HE LYS 6 1HE LYS 6 5.427 6.578 3.053
49 2HE LYS 6 2HE LYS 6 6.063 8.232 3.150
50 1HZ LYS 6 1HZ LYS 6 5.722 8.455 0.758
51 2HZ LYS 6 2HZ LYS 6 5.061 6.894 0.692
52 3HZ LYS 6 3HZ LYS 6 4.257 8.118 1.551
53 H GLU 7 H GLU 7 9.163 2.082 1.014
54 HA GLU 7 HA GLU 7 6.417 1.307 1.107
55 1HB GLU 7 1HB GLU 7 8.718 -0.379 0.079
56 2HB GLU 7 2HB GLU 7 7.029 -0.459 -0.421
57 1HG GLU 7 1HG GLU 7 8.280 2.209 -0.664
58 2HG GLU 7 2HG GLU 7 8.931 0.976 -1.744
59 H ASN 8 H ASN 8 9.332 -0.384 2.336
60 HA ASN 8 HA ASN 8 8.050 -2.596 3.483
61 1HB ASN 8 1HB ASN 8 10.478 -2.391 3.464
62 2HB ASN 8 2HB ASN 8 10.375 -1.034 4.576
63 1HD2 ASN 8 2HD2 ASN 8 9.584 -4.526 4.345
64 2HD2 ASN 8 1HD2 ASN 8 9.708 -4.821 6.012
65 H ILE 9 H ILE 9 7.876 0.730 4.379
66 HA ILE 9 HA ILE 9 6.597 0.017 6.978
67 HB ILE 9 HB ILE 9 7.570 2.700 5.992
68 1HG1 ILE 9 1HG1 ILE 9 8.834 0.636 7.818
69 2HG1 ILE 9 2HG1 ILE 9 9.430 1.140 6.235
70 1HG2 ILE 9 1HG2 ILE 9 6.311 1.673 8.511
71 2HG2 ILE 9 2HG2 ILE 9 7.516 2.953 8.635
72 3HG2 ILE 9 3HG2 ILE 9 6.055 3.207 7.682
73 1HD1 ILE 9 1HD1 ILE 9 8.990 3.162 8.411
74 2HD1 ILE 9 2HD1 ILE 9 10.480 2.218 8.351
75 3HD1 ILE 9 3HD1 ILE 9 10.043 3.264 6.999
76 H ILE 10 H ILE 10 5.823 0.888 3.807
77 HA ILE 10 HA ILE 10 3.153 1.890 4.730
78 HB ILE 10 HB ILE 10 5.022 3.380 3.330
79 1HG1 ILE 10 1HG1 ILE 10 3.180 4.364 4.493
80 2HG1 ILE 10 2HG1 ILE 10 3.011 4.840 2.803
81 1HG2 ILE 10 1HG2 ILE 10 4.694 1.991 1.304
82 2HG2 ILE 10 2HG2 ILE 10 2.973 2.371 1.336
83 3HG2 ILE 10 3HG2 ILE 10 4.153 3.650 1.052
84 1HD1 ILE 10 1HD1 ILE 10 1.611 2.539 2.738
85 2HD1 ILE 10 2HD1 ILE 10 1.343 2.983 4.423
86 3HD1 ILE 10 3HD1 ILE 10 0.866 4.088 3.134
87 H PHE 11 H PHE 11 5.004 0.247 2.252
88 HA PHE 11 HA PHE 11 3.062 -0.677 0.520
89 1HB PHE 11 1HB PHE 11 5.713 -1.088 0.911
90 2HB PHE 11 2HB PHE 11 5.074 -2.645 1.411
91 HD1 PHE 11 HD1 PHE 11 3.849 -0.232 -1.146
92 HD2 PHE 11 HD2 PHE 11 5.494 -4.115 -0.362
93 HE1 PHE 11 HE1 PHE 11 3.534 -0.843 -3.537
94 HE2 PHE 11 HE2 PHE 11 5.184 -4.735 -2.751
95 HZ PHE 11 HZ PHE 11 4.203 -3.096 -4.336
96 H GLY 12 H GLY 12 3.761 -1.748 3.803
97 1HA GLY 12 1HA GLY 12 1.936 -4.046 3.598
98 2HA GLY 12 2HA GLY 12 2.794 -3.531 5.052
99 H VAL 13 H VAL 13 1.996 -0.862 5.195
100 HA VAL 13 HA VAL 13 -0.665 -1.133 6.315
101 HB VAL 13 HB VAL 13 1.012 1.338 5.768
102 1HG1 VAL 13 1HG1 VAL 13 -1.511 1.645 6.065
103 2HG1 VAL 13 2HG1 VAL 13 -1.289 1.042 7.708
104 3HG1 VAL 13 3HG1 VAL 13 -0.485 2.527 7.196
105 1HG2 VAL 13 1HG2 VAL 13 1.386 -0.766 7.598
106 2HG2 VAL 13 2HG2 VAL 13 2.166 0.815 7.636
107 3HG2 VAL 13 3HG2 VAL 13 0.676 0.545 8.540
108 H SER 14 H SER 14 0.618 -0.287 3.225
109 HA SER 14 HA SER 14 -1.782 1.143 2.328
110 1HB SER 14 1HB SER 14 0.866 0.981 1.447
111 2HB SER 14 2HB SER 14 -0.048 0.114 0.217
112 HG SER 14 HG SER 14 -0.095 2.790 0.950
113 H TYR 15 H TYR 15 -0.246 -2.019 1.640
114 HA TYR 15 HA TYR 15 -2.187 -3.054 -0.122
115 1HB TYR 15 1HB TYR 15 0.051 -4.060 0.918
116 2HB TYR 15 2HB TYR 15 -1.090 -4.848 2.000
117 HD1 TYR 15 HD1 TYR 15 -0.526 -4.192 -1.653
118 HD2 TYR 15 HD2 TYR 15 -2.127 -6.829 1.338
119 HE1 TYR 15 HE1 TYR 15 -1.062 -5.860 -3.408
120 HE2 TYR 15 HE2 TYR 15 -2.662 -8.496 -0.417
121 HH TYR 15 HH TYR 15 -1.727 -9.026 -2.792
122 H ASP 16 H ASP 16 -2.052 -3.290 3.427
123 HA ASP 16 HA ASP 16 -4.486 -4.662 3.836
124 1HB ASP 16 1HB ASP 16 -2.927 -4.201 5.674
125 2HB ASP 16 2HB ASP 16 -3.239 -2.471 5.529
126 H GLU 17 H GLU 17 -3.912 -1.461 2.692
127 HA GLU 17 HA GLU 17 -6.823 -0.839 2.968
128 1HB GLU 17 1HB GLU 17 -4.635 0.645 3.857
129 2HB GLU 17 2HB GLU 17 -5.096 1.435 2.350
130 1HG GLU 17 1HG GLU 17 -6.793 2.431 3.441
131 2HG GLU 17 2HG GLU 17 -7.509 0.840 3.703
132 H TYR 18 H TYR 18 -4.547 -1.858 0.783
133 HA TYR 18 HA TYR 18 -5.705 -0.259 -1.456
134 1HB TYR 18 1HB TYR 18 -3.127 -0.615 -1.006
135 2HB TYR 18 2HB TYR 18 -3.412 -2.161 -1.805
136 HD1 TYR 18 HD1 TYR 18 -4.261 1.473 -2.238
137 HD2 TYR 18 HD2 TYR 18 -3.221 -2.243 -4.123
138 HE1 TYR 18 HE1 TYR 18 -4.223 2.603 -4.444
139 HE2 TYR 18 HE2 TYR 18 -3.182 -1.114 -6.330
140 HH TYR 18 HH TYR 18 -2.886 1.169 -7.221
141 H ARG 19 H ARG 19 -4.666 -3.648 -0.881
142 HA ARG 19 HA ARG 19 -6.003 -4.834 -3.030
143 1HB ARG 19 1HB ARG 19 -4.624 -5.772 -0.832
144 2HB ARG 19 2HB ARG 19 -6.256 -6.384 -0.546
145 1HG ARG 19 1HG ARG 19 -5.723 -6.757 -3.306
146 2HG ARG 19 2HG ARG 19 -4.295 -7.319 -2.435
147 1HD ARG 19 1HD ARG 19 -6.010 -8.519 -0.879
148 2HD ARG 19 2HD ARG 19 -7.138 -8.283 -2.213
149 HE ARG 19 HE ARG 19 -4.691 -9.436 -3.189
150 1HH1 ARG 19 1HH1 ARG 19 -7.747 -10.017 -1.721
151 2HH1 ARG 19 2HH1 ARG 19 -7.695 -11.729 -1.973
152 1HH2 ARG 19 1HH2 ARG 19 -4.525 -11.698 -3.376
153 2HH2 ARG 19 2HH2 ARG 19 -5.873 -12.681 -2.910
154 H TYR 20 H TYR 20 -7.337 -3.638 -0.007
155 HA TYR 20 HA TYR 20 -9.939 -4.884 -0.373
156 1HB TYR 20 1HB TYR 20 -9.292 -4.268 1.868
157 2HB TYR 20 2HB TYR 20 -8.992 -2.599 1.379
158 HD1 TYR 20 HD1 TYR 20 -11.733 -5.164 1.287
159 HD2 TYR 20 HD2 TYR 20 -10.674 -1.025 1.731
160 HE1 TYR 20 HE1 TYR 20 -14.108 -4.604 1.731
161 HE2 TYR 20 HE2 TYR 20 -13.048 -0.465 2.173
162 HH TYR 20 HH TYR 20 -15.187 -1.263 2.002
163 H ARG 21 H ARG 21 -8.685 -1.567 -0.828
164 HA ARG 21 HA ARG 21 -11.163 -0.576 -1.941
165 1HB ARG 21 1HB ARG 21 -8.341 0.437 -1.766
166 2HB ARG 21 2HB ARG 21 -9.486 1.249 -2.834
167 1HG ARG 21 1HG ARG 21 -11.041 1.068 -0.661
168 2HG ARG 21 2HG ARG 21 -9.471 1.070 0.143
169 1HD ARG 21 1HD ARG 21 -10.711 3.198 -1.580
170 2HD ARG 21 2HD ARG 21 -9.948 3.357 0.002
171 HE ARG 21 HE ARG 21 -8.514 3.116 -2.589
172 1HH1 ARG 21 1HH1 ARG 21 -7.490 1.851 0.147
173 2HH1 ARG 21 2HH1 ARG 21 -6.304 3.042 0.561
174 1HH2 ARG 21 1HH2 ARG 21 -7.432 5.357 -1.763
175 2HH2 ARG 21 2HH2 ARG 21 -6.270 5.027 -0.522
176 H SER 22 H SER 22 -8.223 -1.983 -3.310
177 HA SER 22 HA SER 22 -8.684 -1.339 -6.038
178 1HB SER 22 1HB SER 22 -6.577 -2.272 -5.614
179 2HB SER 22 2HB SER 22 -7.243 -3.572 -4.630
180 HG SER 22 HG SER 22 -6.617 -3.671 -7.158
181 H VAL 23 H VAL 23 -10.433 -3.390 -3.929
182 HA VAL 23 HA VAL 23 -11.609 -4.920 -6.192
183 HB VAL 23 HB VAL 23 -12.073 -5.195 -3.206
184 1HG1 VAL 23 1HG1 VAL 23 -13.262 -6.412 -5.607
185 2HG1 VAL 23 2HG1 VAL 23 -12.687 -7.588 -4.424
186 3HG1 VAL 23 3HG1 VAL 23 -13.869 -6.368 -3.952
187 1HG2 VAL 23 1HG2 VAL 23 -9.727 -5.712 -4.269
188 2HG2 VAL 23 2HG2 VAL 23 -10.458 -6.891 -3.181
189 3HG2 VAL 23 3HG2 VAL 23 -10.543 -7.131 -4.926
190 H ILE 24 H ILE 24 -12.523 -2.681 -3.580
191 HA ILE 24 HA ILE 24 -15.083 -2.211 -5.058
192 HB ILE 24 HB ILE 24 -14.706 -1.895 -2.072
193 1HG1 ILE 24 1HG1 ILE 24 -16.246 -4.075 -2.240
194 2HG1 ILE 24 2HG1 ILE 24 -15.342 -4.293 -3.740
195 1HG2 ILE 24 1HG2 ILE 24 -16.822 -1.362 -4.002
196 2HG2 ILE 24 2HG2 ILE 24 -17.363 -2.464 -2.735
197 3HG2 ILE 24 3HG2 ILE 24 -16.709 -0.882 -2.309
198 1HD1 ILE 24 1HD1 ILE 24 -13.317 -3.642 -2.055
199 2HD1 ILE 24 2HD1 ILE 24 -14.409 -4.453 -0.931
200 3HD1 ILE 24 3HD1 ILE 24 -13.825 -5.303 -2.362
201 H LYS 25 H LYS 25 -12.589 -0.783 -5.463
202 HA LYS 25 HA LYS 25 -12.428 1.648 -4.003
203 1HB LYS 25 1HB LYS 25 -10.677 0.930 -5.581
204 2HB LYS 25 2HB LYS 25 -11.792 1.160 -6.929
205 1HG LYS 25 1HG LYS 25 -11.973 3.578 -5.641
206 2HG LYS 25 2HG LYS 25 -10.278 3.162 -5.387
207 1HD LYS 25 1HD LYS 25 -9.784 3.199 -7.650
208 2HD LYS 25 2HD LYS 25 -11.433 2.785 -8.122
209 1HE LYS 25 1HE LYS 25 -12.211 4.999 -7.800
210 2HE LYS 25 2HE LYS 25 -10.804 5.439 -6.813
211 1HZ LYS 25 1HZ LYS 25 -10.232 4.405 -9.467
212 2HZ LYS 25 2HZ LYS 25 -10.955 5.942 -9.422
213 3HZ LYS 25 3HZ LYS 25 -9.487 5.667 -8.612
214 H ALA 26 H ALA 26 -14.114 3.037 -3.733
215 HA ALA 26 HA ALA 26 -15.943 4.411 -4.256
216 1HB ALA 26 1HB ALA 26 -14.164 5.049 -6.072
217 2HB ALA 26 2HB ALA 26 -15.221 4.157 -7.165
218 3HB ALA 26 3HB ALA 26 -15.837 5.562 -6.295
Start of MODEL 9
1 1H MET 1 1H MET 1 17.120 -3.396 4.491
2 2H MET 1 2H MET 1 15.645 -4.148 4.121
3 3H MET 1 3H MET 1 17.105 -4.838 3.594
4 HA MET 1 HA MET 1 17.437 -3.246 1.951
5 1HB MET 1 1HB MET 1 15.149 -4.771 2.141
6 2HB MET 1 2HB MET 1 14.496 -3.170 1.792
7 1HG MET 1 1HG MET 1 16.145 -3.002 -0.111
8 2HG MET 1 2HG MET 1 16.555 -4.694 0.176
9 1HE MET 1 1HE MET 1 16.037 -5.873 -1.654
10 2HE MET 1 2HE MET 1 15.022 -6.752 -0.512
11 3HE MET 1 3HE MET 1 14.422 -6.390 -2.136
12 HA PRO 2 HA PRO 2 16.452 0.669 4.089
13 1HB PRO 2 1HB PRO 2 18.732 1.945 3.273
14 2HB PRO 2 2HB PRO 2 18.672 0.892 4.701
15 1HG PRO 2 1HG PRO 2 19.700 0.321 1.970
16 2HG PRO 2 2HG PRO 2 20.321 -0.202 3.543
17 1HD PRO 2 1HD PRO 2 18.849 -1.797 1.876
18 2HD PRO 2 2HD PRO 2 18.925 -2.005 3.639
19 H GLY 3 H GLY 3 16.395 2.962 3.052
20 1HA GLY 3 1HA GLY 3 15.509 4.308 1.340
21 2HA GLY 3 2HA GLY 3 16.630 3.442 0.289
22 H THR 4 H THR 4 14.050 1.856 2.077
23 HA THR 4 HA THR 4 12.491 1.576 -0.438
24 HB THR 4 HB THR 4 14.155 -0.429 0.618
25 HG1 THR 4 HG1 THR 4 13.114 0.001 -1.532
26 1HG2 THR 4 1HG2 THR 4 11.240 -1.003 1.202
27 2HG2 THR 4 2HG2 THR 4 12.488 -2.246 1.110
28 3HG2 THR 4 3HG2 THR 4 12.575 -0.999 2.354
29 H ILE 5 H ILE 5 12.625 1.277 3.078
30 HA ILE 5 HA ILE 5 9.925 0.654 3.611
31 HB ILE 5 HB ILE 5 11.640 2.554 5.233
32 1HG1 ILE 5 1HG1 ILE 5 11.602 -0.285 5.996
33 2HG1 ILE 5 2HG1 ILE 5 12.383 0.014 4.443
34 1HG2 ILE 5 1HG2 ILE 5 9.151 0.974 5.687
35 2HG2 ILE 5 2HG2 ILE 5 10.297 1.075 7.024
36 3HG2 ILE 5 3HG2 ILE 5 9.617 2.547 6.332
37 1HD1 ILE 5 1HD1 ILE 5 13.780 1.773 5.513
38 2HD1 ILE 5 2HD1 ILE 5 13.043 1.384 7.067
39 3HD1 ILE 5 3HD1 ILE 5 14.037 0.186 6.238
40 H LYS 6 H LYS 6 11.440 3.884 3.401
41 HA LYS 6 HA LYS 6 9.246 5.515 3.832
42 1HB LYS 6 1HB LYS 6 10.318 7.192 2.510
43 2HB LYS 6 2HB LYS 6 11.615 6.224 3.208
44 1HG LYS 6 1HG LYS 6 11.753 4.914 1.113
45 2HG LYS 6 2HG LYS 6 10.481 5.918 0.414
46 1HD LYS 6 1HD LYS 6 11.853 7.880 0.503
47 2HD LYS 6 2HD LYS 6 13.058 7.069 1.504
48 1HE LYS 6 1HE LYS 6 12.452 5.786 -1.117
49 2HE LYS 6 2HE LYS 6 13.364 7.309 -1.163
50 1HZ LYS 6 1HZ LYS 6 14.738 6.337 0.692
51 2HZ LYS 6 2HZ LYS 6 14.014 4.841 0.345
52 3HZ LYS 6 3HZ LYS 6 14.959 5.623 -0.830
53 H GLU 7 H GLU 7 9.852 3.465 1.077
54 HA GLU 7 HA GLU 7 7.625 4.622 -0.469
55 1HB GLU 7 1HB GLU 7 9.145 2.059 -1.022
56 2HB GLU 7 2HB GLU 7 8.201 3.014 -2.163
57 1HG GLU 7 1HG GLU 7 10.360 4.474 -0.759
58 2HG GLU 7 2HG GLU 7 10.892 3.240 -1.899
59 H ASN 8 H ASN 8 8.332 1.490 1.116
60 HA ASN 8 HA ASN 8 5.803 0.300 0.628
61 1HB ASN 8 1HB ASN 8 8.001 -0.693 1.636
62 2HB ASN 8 2HB ASN 8 7.287 -0.197 3.163
63 1HD2 ASN 8 2HD2 ASN 8 5.178 -1.178 3.766
64 2HD2 ASN 8 1HD2 ASN 8 4.693 -2.647 3.068
65 H ILE 9 H ILE 9 6.636 2.926 2.632
66 HA ILE 9 HA ILE 9 4.324 2.541 4.442
67 HB ILE 9 HB ILE 9 6.290 4.839 4.264
68 1HG1 ILE 9 1HG1 ILE 9 7.237 2.514 4.735
69 2HG1 ILE 9 2HG1 ILE 9 7.562 3.743 5.949
70 1HG2 ILE 9 1HG2 ILE 9 3.852 4.547 5.669
71 2HG2 ILE 9 2HG2 ILE 9 5.130 4.336 6.865
72 3HG2 ILE 9 3HG2 ILE 9 5.068 5.803 5.889
73 1HD1 ILE 9 1HD1 ILE 9 5.140 1.970 6.177
74 2HD1 ILE 9 2HD1 ILE 9 6.715 1.410 6.741
75 3HD1 ILE 9 3HD1 ILE 9 5.985 2.850 7.452
76 H ILE 10 H ILE 10 5.078 4.017 1.466
77 HA ILE 10 HA ILE 10 2.606 5.697 1.673
78 HB ILE 10 HB ILE 10 5.221 6.476 0.953
79 1HG1 ILE 10 1HG1 ILE 10 3.661 8.003 1.915
80 2HG1 ILE 10 2HG1 ILE 10 3.980 8.616 0.291
81 1HG2 ILE 10 1HG2 ILE 10 3.433 6.224 -1.478
82 2HG2 ILE 10 2HG2 ILE 10 4.789 7.349 -1.396
83 3HG2 ILE 10 3HG2 ILE 10 5.076 5.614 -1.278
84 1HD1 ILE 10 1HD1 ILE 10 1.885 6.839 -0.106
85 2HD1 ILE 10 2HD1 ILE 10 1.484 7.597 1.436
86 3HD1 ILE 10 3HD1 ILE 10 1.735 8.594 0.002
87 H PHE 11 H PHE 11 4.612 3.919 -0.683
88 HA PHE 11 HA PHE 11 2.759 3.568 -2.723
89 1HB PHE 11 1HB PHE 11 4.761 2.604 -3.289
90 2HB PHE 11 2HB PHE 11 5.095 2.094 -1.642
91 HD1 PHE 11 HD1 PHE 11 3.297 1.238 -4.751
92 HD2 PHE 11 HD2 PHE 11 4.437 -0.063 -0.822
93 HE1 PHE 11 HE1 PHE 11 2.585 -1.076 -5.316
94 HE2 PHE 11 HE2 PHE 11 3.728 -2.378 -1.381
95 HZ PHE 11 HZ PHE 11 2.801 -2.882 -3.627
96 H GLY 12 H GLY 12 2.842 2.151 0.472
97 1HA GLY 12 1HA GLY 12 0.844 0.101 -0.083
98 2HA GLY 12 2HA GLY 12 1.397 0.600 1.520
99 H VAL 13 H VAL 13 0.861 3.314 1.447
100 HA VAL 13 HA VAL 13 -1.870 3.484 2.143
101 HB VAL 13 HB VAL 13 0.051 5.607 1.143
102 1HG1 VAL 13 1HG1 VAL 13 -2.717 5.863 2.346
103 2HG1 VAL 13 2HG1 VAL 13 -1.572 7.200 2.232
104 3HG1 VAL 13 3HG1 VAL 13 -2.184 6.436 0.765
105 1HG2 VAL 13 1HG2 VAL 13 0.348 4.250 3.374
106 2HG2 VAL 13 2HG2 VAL 13 0.546 6.002 3.390
107 3HG2 VAL 13 3HG2 VAL 13 -0.962 5.280 3.953
108 H SER 14 H SER 14 -0.332 3.406 -0.936
109 HA SER 14 HA SER 14 -2.800 4.364 -2.296
110 1HB SER 14 1HB SER 14 -0.231 5.038 -2.802
111 2HB SER 14 2HB SER 14 -0.366 3.631 -3.852
112 HG SER 14 HG SER 14 -1.079 5.326 -5.046
113 H TYR 15 H TYR 15 -0.425 1.684 -2.474
114 HA TYR 15 HA TYR 15 -2.107 0.085 -4.210
115 1HB TYR 15 1HB TYR 15 0.518 0.000 -3.469
116 2HB TYR 15 2HB TYR 15 -0.143 -1.330 -2.523
117 HD1 TYR 15 HD1 TYR 15 -1.072 0.010 -5.896
118 HD2 TYR 15 HD2 TYR 15 0.399 -3.327 -3.627
119 HE1 TYR 15 HE1 TYR 15 -1.136 -1.403 -7.932
120 HE2 TYR 15 HE2 TYR 15 0.335 -4.741 -5.664
121 HH TYR 15 HH TYR 15 -0.703 -3.392 -8.802
122 H ASP 16 H ASP 16 -1.146 -0.423 -0.781
123 HA ASP 16 HA ASP 16 -2.968 -2.479 -0.209
124 1HB ASP 16 1HB ASP 16 -1.988 -0.220 1.560
125 2HB ASP 16 2HB ASP 16 -2.936 -1.579 2.162
126 H GLU 17 H GLU 17 -3.557 0.867 -0.851
127 HA GLU 17 HA GLU 17 -6.330 0.696 0.190
128 1HB GLU 17 1HB GLU 17 -4.501 2.777 0.107
129 2HB GLU 17 2HB GLU 17 -5.556 3.131 -1.260
130 1HG GLU 17 1HG GLU 17 -6.651 4.186 0.534
131 2HG GLU 17 2HG GLU 17 -7.502 2.647 0.396
132 H TYR 18 H TYR 18 -4.536 0.360 -2.739
133 HA TYR 18 HA TYR 18 -6.957 0.863 -4.393
134 1HB TYR 18 1HB TYR 18 -4.055 0.913 -4.841
135 2HB TYR 18 2HB TYR 18 -4.953 0.115 -6.132
136 HD1 TYR 18 HD1 TYR 18 -6.181 2.854 -3.930
137 HD2 TYR 18 HD2 TYR 18 -4.837 1.756 -7.860
138 HE1 TYR 18 HE1 TYR 18 -6.905 5.063 -4.796
139 HE2 TYR 18 HE2 TYR 18 -5.560 3.965 -8.725
140 HH TYR 18 HH TYR 18 -6.504 5.906 -8.241
141 H ARG 19 H ARG 19 -4.629 -1.751 -3.672
142 HA ARG 19 HA ARG 19 -6.253 -3.627 -5.284
143 1HB ARG 19 1HB ARG 19 -3.513 -3.504 -4.374
144 2HB ARG 19 2HB ARG 19 -4.239 -5.044 -3.914
145 1HG ARG 19 1HG ARG 19 -4.991 -4.263 -6.619
146 2HG ARG 19 2HG ARG 19 -3.241 -4.388 -6.437
147 1HD ARG 19 1HD ARG 19 -4.148 -6.610 -5.067
148 2HD ARG 19 2HD ARG 19 -5.273 -6.504 -6.422
149 HE ARG 19 HE ARG 19 -2.603 -6.165 -7.394
150 1HH1 ARG 19 1HH1 ARG 19 -2.846 -8.547 -5.307
151 2HH1 ARG 19 2HH1 ARG 19 -2.945 -9.869 -6.422
152 1HH2 ARG 19 1HH2 ARG 19 -3.545 -7.848 -9.175
153 2HH2 ARG 19 2HH2 ARG 19 -3.337 -9.473 -8.613
154 H TYR 20 H TYR 20 -6.343 -2.473 -2.142
155 HA TYR 20 HA TYR 20 -7.183 -5.069 -0.972
156 1HB TYR 20 1HB TYR 20 -5.687 -3.452 0.281
157 2HB TYR 20 2HB TYR 20 -7.069 -2.361 0.376
158 HD1 TYR 20 HD1 TYR 20 -6.633 -6.073 0.768
159 HD2 TYR 20 HD2 TYR 20 -8.047 -2.398 2.483
160 HE1 TYR 20 HE1 TYR 20 -7.479 -7.317 2.739
161 HE2 TYR 20 HE2 TYR 20 -8.891 -3.643 4.454
162 HH TYR 20 HH TYR 20 -9.187 -7.023 4.505
163 H ARG 21 H ARG 21 -8.538 -1.784 -0.620
164 HA ARG 21 HA ARG 21 -11.159 -2.493 -0.045
165 1HB ARG 21 1HB ARG 21 -9.812 -0.131 -0.826
166 2HB ARG 21 2HB ARG 21 -11.200 -0.286 -1.904
167 1HG ARG 21 1HG ARG 21 -12.736 -0.148 -0.175
168 2HG ARG 21 2HG ARG 21 -11.607 -0.791 1.017
169 1HD ARG 21 1HD ARG 21 -11.199 1.327 1.664
170 2HD ARG 21 2HD ARG 21 -10.430 1.591 0.098
171 HE ARG 21 HE ARG 21 -12.974 2.049 -0.591
172 1HH1 ARG 21 1HH1 ARG 21 -13.571 2.219 2.406
173 2HH1 ARG 21 2HH1 ARG 21 -13.493 3.931 2.659
174 1HH2 ARG 21 1HH2 ARG 21 -11.876 4.563 -0.341
175 2HH2 ARG 21 2HH2 ARG 21 -12.535 5.259 1.101
176 H SER 22 H SER 22 -9.537 -2.549 -3.160
177 HA SER 22 HA SER 22 -11.838 -2.821 -4.826
178 1HB SER 22 1HB SER 22 -9.387 -2.456 -5.523
179 2HB SER 22 2HB SER 22 -9.197 -4.198 -5.339
180 HG SER 22 HG SER 22 -10.520 -4.531 -7.005
181 H VAL 23 H VAL 23 -10.513 -4.965 -2.504
182 HA VAL 23 HA VAL 23 -12.024 -7.245 -3.720
183 HB VAL 23 HB VAL 23 -9.865 -7.452 -1.610
184 1HG1 VAL 23 1HG1 VAL 23 -11.481 -9.331 -3.276
185 2HG1 VAL 23 2HG1 VAL 23 -9.806 -9.771 -2.944
186 3HG1 VAL 23 3HG1 VAL 23 -10.926 -9.500 -1.610
187 1HG2 VAL 23 1HG2 VAL 23 -9.678 -7.003 -4.524
188 2HG2 VAL 23 2HG2 VAL 23 -8.466 -6.753 -3.267
189 3HG2 VAL 23 3HG2 VAL 23 -8.729 -8.365 -3.929
190 H ILE 24 H ILE 24 -11.730 -5.139 -0.981
191 HA ILE 24 HA ILE 24 -13.519 -6.860 0.645
192 HB ILE 24 HB ILE 24 -11.891 -4.386 1.230
193 1HG1 ILE 24 1HG1 ILE 24 -10.814 -5.852 2.848
194 2HG1 ILE 24 2HG1 ILE 24 -11.995 -7.124 2.534
195 1HG2 ILE 24 1HG2 ILE 24 -14.108 -4.136 2.314
196 2HG2 ILE 24 2HG2 ILE 24 -13.916 -5.726 3.050
197 3HG2 ILE 24 3HG2 ILE 24 -12.834 -4.410 3.502
198 1HD1 ILE 24 1HD1 ILE 24 -10.299 -5.997 0.308
199 2HD1 ILE 24 2HD1 ILE 24 -9.701 -7.296 1.342
200 3HD1 ILE 24 3HD1 ILE 24 -11.151 -7.541 0.368
201 H LYS 25 H LYS 25 -13.506 -3.851 -1.171
202 HA LYS 25 HA LYS 25 -16.450 -3.727 -0.810
203 1HB LYS 25 1HB LYS 25 -15.373 -2.195 0.875
204 2HB LYS 25 2HB LYS 25 -14.676 -1.293 -0.471
205 1HG LYS 25 1HG LYS 25 -16.590 -0.095 -0.498
206 2HG LYS 25 2HG LYS 25 -17.364 -1.536 -1.158
207 1HD LYS 25 1HD LYS 25 -18.608 -1.702 0.706
208 2HD LYS 25 2HD LYS 25 -17.136 -1.918 1.652
209 1HE LYS 25 1HE LYS 25 -16.901 0.623 1.657
210 2HE LYS 25 2HE LYS 25 -18.549 0.684 1.004
211 1HZ LYS 25 1HZ LYS 25 -18.606 -1.174 3.050
212 2HZ LYS 25 2HZ LYS 25 -17.711 0.132 3.663
213 3HZ LYS 25 3HZ LYS 25 -19.283 0.380 3.070
214 H ALA 26 H ALA 26 -17.497 -3.047 -2.671
215 HA ALA 26 HA ALA 26 -15.804 -2.694 -5.060
216 1HB ALA 26 1HB ALA 26 -18.027 -4.102 -4.811
217 2HB ALA 26 2HB ALA 26 -18.801 -2.547 -5.120
218 3HB ALA 26 3HB ALA 26 -17.693 -3.232 -6.310
Start of MODEL 10
1 1H MET 1 1H MET 1 18.720 0.105 -1.450
2 2H MET 1 2H MET 1 19.146 -0.605 -2.935
3 3H MET 1 3H MET 1 20.159 0.560 -2.233
4 HA MET 1 HA MET 1 19.089 1.845 -3.797
5 1HB MET 1 1HB MET 1 16.907 -0.156 -3.229
6 2HB MET 1 2HB MET 1 16.542 1.328 -4.111
7 1HG MET 1 1HG MET 1 18.711 0.594 -5.490
8 2HG MET 1 2HG MET 1 18.215 -1.004 -4.932
9 1HE MET 1 1HE MET 1 18.554 -0.687 -7.602
10 2HE MET 1 2HE MET 1 17.152 -0.552 -8.672
11 3HE MET 1 3HE MET 1 17.979 0.898 -8.110
12 HA PRO 2 HA PRO 2 17.766 4.475 -0.473
13 1HB PRO 2 1HB PRO 2 17.608 6.786 -1.928
14 2HB PRO 2 2HB PRO 2 19.149 6.087 -1.392
15 1HG PRO 2 1HG PRO 2 17.855 5.994 -4.064
16 2HG PRO 2 2HG PRO 2 19.569 6.119 -3.642
17 1HD PRO 2 1HD PRO 2 18.341 3.803 -4.464
18 2HD PRO 2 2HD PRO 2 19.820 3.859 -3.482
19 H GLY 3 H GLY 3 15.781 5.553 0.144
20 1HA GLY 3 1HA GLY 3 13.448 5.811 0.141
21 2HA GLY 3 2HA GLY 3 13.633 6.220 -1.565
22 H THR 4 H THR 4 14.113 3.185 0.276
23 HA THR 4 HA THR 4 12.214 1.899 -1.641
24 HB THR 4 HB THR 4 14.961 1.344 -1.235
25 HG1 THR 4 HG1 THR 4 12.848 -0.021 -2.521
26 1HG2 THR 4 1HG2 THR 4 13.178 -0.829 -0.105
27 2HG2 THR 4 2HG2 THR 4 14.856 -1.076 -0.590
28 3HG2 THR 4 3HG2 THR 4 14.473 0.021 0.738
29 H ILE 5 H ILE 5 13.469 2.025 1.656
30 HA ILE 5 HA ILE 5 11.494 0.091 2.642
31 HB ILE 5 HB ILE 5 13.513 1.885 4.014
32 1HG1 ILE 5 1HG1 ILE 5 13.374 -1.131 3.923
33 2HG1 ILE 5 2HG1 ILE 5 14.193 -0.203 2.668
34 1HG2 ILE 5 1HG2 ILE 5 11.531 1.577 5.457
35 2HG2 ILE 5 2HG2 ILE 5 11.641 -0.169 5.233
36 3HG2 ILE 5 3HG2 ILE 5 12.920 0.693 6.090
37 1HD1 ILE 5 1HD1 ILE 5 15.456 0.947 4.606
38 2HD1 ILE 5 2HD1 ILE 5 14.870 -0.384 5.604
39 3HD1 ILE 5 3HD1 ILE 5 15.909 -0.712 4.217
40 H LYS 6 H LYS 6 12.030 3.607 2.868
41 HA LYS 6 HA LYS 6 9.954 4.354 4.562
42 1HB LYS 6 1HB LYS 6 11.643 5.821 3.209
43 2HB LYS 6 2HB LYS 6 10.377 5.849 1.982
44 1HG LYS 6 1HG LYS 6 9.832 7.730 3.254
45 2HG LYS 6 2HG LYS 6 8.825 6.492 4.005
46 1HD LYS 6 1HD LYS 6 10.322 6.226 5.829
47 2HD LYS 6 2HD LYS 6 11.613 7.094 4.997
48 1HE LYS 6 1HE LYS 6 9.165 8.697 5.272
49 2HE LYS 6 2HE LYS 6 9.880 8.236 6.829
50 1HZ LYS 6 1HZ LYS 6 11.807 8.970 4.811
51 2HZ LYS 6 2HZ LYS 6 10.786 10.244 5.268
52 3HZ LYS 6 3HZ LYS 6 11.712 9.439 6.441
53 H GLU 7 H GLU 7 9.749 3.294 1.207
54 HA GLU 7 HA GLU 7 6.848 3.814 1.129
55 1HB GLU 7 1HB GLU 7 6.952 3.122 -1.150
56 2HB GLU 7 2HB GLU 7 8.436 4.023 -0.859
57 1HG GLU 7 1HG GLU 7 9.700 1.974 -0.574
58 2HG GLU 7 2HG GLU 7 8.229 1.010 -0.681
59 H ASN 8 H ASN 8 9.066 1.045 1.343
60 HA ASN 8 HA ASN 8 7.160 -1.034 1.202
61 1HB ASN 8 1HB ASN 8 9.741 -1.155 1.446
62 2HB ASN 8 2HB ASN 8 9.411 -1.076 3.171
63 1HD2 ASN 8 2HD2 ASN 8 8.866 -3.046 0.260
64 2HD2 ASN 8 1HD2 ASN 8 8.441 -4.462 1.094
65 H ILE 9 H ILE 9 7.593 1.456 3.522
66 HA ILE 9 HA ILE 9 6.017 0.004 5.585
67 HB ILE 9 HB ILE 9 7.241 2.771 5.709
68 1HG1 ILE 9 1HG1 ILE 9 8.811 0.745 5.286
69 2HG1 ILE 9 2HG1 ILE 9 9.191 1.825 6.623
70 1HG2 ILE 9 1HG2 ILE 9 5.708 1.047 7.558
71 2HG2 ILE 9 2HG2 ILE 9 7.155 1.778 8.252
72 3HG2 ILE 9 3HG2 ILE 9 5.900 2.800 7.550
73 1HD1 ILE 9 1HD1 ILE 9 7.354 -0.330 7.387
74 2HD1 ILE 9 2HD1 ILE 9 8.913 -0.926 6.816
75 3HD1 ILE 9 3HD1 ILE 9 8.843 0.202 8.169
76 H ILE 10 H ILE 10 5.628 2.265 3.028
77 HA ILE 10 HA ILE 10 2.929 2.966 4.125
78 HB ILE 10 HB ILE 10 4.912 4.788 3.676
79 1HG1 ILE 10 1HG1 ILE 10 2.900 5.356 4.827
80 2HG1 ILE 10 2HG1 ILE 10 2.987 6.450 3.446
81 1HG2 ILE 10 1HG2 ILE 10 3.322 4.591 1.105
82 2HG2 ILE 10 2HG2 ILE 10 4.238 6.020 1.577
83 3HG2 ILE 10 3HG2 ILE 10 5.074 4.495 1.292
84 1HD1 ILE 10 1HD1 ILE 10 1.626 4.519 2.246
85 2HD1 ILE 10 2HD1 ILE 10 1.171 4.110 3.900
86 3HD1 ILE 10 3HD1 ILE 10 0.796 5.707 3.250
87 H PHE 11 H PHE 11 4.818 2.673 1.137
88 HA PHE 11 HA PHE 11 2.728 2.436 -0.713
89 1HB PHE 11 1HB PHE 11 4.803 2.510 -1.726
90 2HB PHE 11 2HB PHE 11 5.554 1.500 -0.501
91 HD1 PHE 11 HD1 PHE 11 2.969 1.298 -3.190
92 HD2 PHE 11 HD2 PHE 11 6.094 -0.692 -1.028
93 HE1 PHE 11 HE1 PHE 11 2.734 -0.676 -4.682
94 HE2 PHE 11 HE2 PHE 11 5.865 -2.670 -2.516
95 HZ PHE 11 HZ PHE 11 4.185 -2.662 -4.342
96 H GLY 12 H GLY 12 3.901 0.171 1.687
97 1HA GLY 12 1HA GLY 12 2.431 -2.106 0.567
98 2HA GLY 12 2HA GLY 12 3.288 -2.083 2.109
99 H VAL 13 H VAL 13 2.029 0.239 3.199
100 HA VAL 13 HA VAL 13 -0.403 -0.962 4.219
101 HB VAL 13 HB VAL 13 0.870 1.766 4.544
102 1HG1 VAL 13 1HG1 VAL 13 -1.879 0.918 5.091
103 2HG1 VAL 13 2HG1 VAL 13 -1.052 1.513 6.531
104 3HG1 VAL 13 3HG1 VAL 13 -1.184 2.538 5.101
105 1HG2 VAL 13 1HG2 VAL 13 1.530 -0.603 5.671
106 2HG2 VAL 13 2HG2 VAL 13 1.699 0.934 6.518
107 3HG2 VAL 13 3HG2 VAL 13 0.284 -0.080 6.803
108 H SER 14 H SER 14 0.374 1.438 1.761
109 HA SER 14 HA SER 14 -2.300 2.427 1.380
110 1HB SER 14 1HB SER 14 -0.109 3.438 0.496
111 2HB SER 14 2HB SER 14 -0.188 2.223 -0.776
112 HG SER 14 HG SER 14 -1.294 3.881 -1.615
113 H TYR 15 H TYR 15 -0.468 -0.267 -0.024
114 HA TYR 15 HA TYR 15 -2.401 -1.028 -1.988
115 1HB TYR 15 1HB TYR 15 0.077 -1.897 -1.390
116 2HB TYR 15 2HB TYR 15 -0.860 -3.165 -0.603
117 HD1 TYR 15 HD1 TYR 15 -0.882 -1.217 -3.818
118 HD2 TYR 15 HD2 TYR 15 -1.440 -5.014 -1.890
119 HE1 TYR 15 HE1 TYR 15 -1.309 -2.274 -6.022
120 HE2 TYR 15 HE2 TYR 15 -1.867 -6.070 -4.092
121 HH TYR 15 HH TYR 15 -1.015 -5.137 -6.774
122 H ASP 16 H ASP 16 -1.823 -2.350 1.294
123 HA ASP 16 HA ASP 16 -3.978 -4.114 1.451
124 1HB ASP 16 1HB ASP 16 -2.843 -2.254 3.557
125 2HB ASP 16 2HB ASP 16 -4.066 -3.472 3.920
126 H GLU 17 H GLU 17 -3.975 -0.614 1.519
127 HA GLU 17 HA GLU 17 -6.867 -0.503 2.122
128 1HB GLU 17 1HB GLU 17 -4.769 1.230 2.630
129 2HB GLU 17 2HB GLU 17 -5.558 1.976 1.240
130 1HG GLU 17 1HG GLU 17 -7.458 2.463 2.409
131 2HG GLU 17 2HG GLU 17 -7.378 0.973 3.353
132 H TYR 18 H TYR 18 -4.646 -0.313 -0.580
133 HA TYR 18 HA TYR 18 -6.542 0.836 -2.453
134 1HB TYR 18 1HB TYR 18 -3.815 0.250 -2.484
135 2HB TYR 18 2HB TYR 18 -4.501 -0.887 -3.645
136 HD1 TYR 18 HD1 TYR 18 -6.703 0.475 -4.874
137 HD2 TYR 18 HD2 TYR 18 -2.922 2.084 -3.621
138 HE1 TYR 18 HE1 TYR 18 -6.931 2.303 -6.534
139 HE2 TYR 18 HE2 TYR 18 -3.149 3.913 -5.281
140 HH TYR 18 HH TYR 18 -4.324 4.378 -7.351
141 H ARG 19 H ARG 19 -5.599 -2.446 -1.520
142 HA ARG 19 HA ARG 19 -7.276 -3.710 -3.543
143 1HB ARG 19 1HB ARG 19 -5.557 -4.603 -1.281
144 2HB ARG 19 2HB ARG 19 -6.865 -5.687 -1.755
145 1HG ARG 19 1HG ARG 19 -5.929 -5.098 -4.200
146 2HG ARG 19 2HG ARG 19 -4.443 -4.859 -3.281
147 1HD ARG 19 1HD ARG 19 -6.085 -7.363 -3.585
148 2HD ARG 19 2HD ARG 19 -4.351 -7.143 -3.818
149 HE ARG 19 HE ARG 19 -4.827 -6.578 -1.113
150 1HH1 ARG 19 1HH1 ARG 19 -6.926 -8.733 -1.488
151 2HH1 ARG 19 2HH1 ARG 19 -6.029 -10.160 -1.091
152 1HH2 ARG 19 1HH2 ARG 19 -2.936 -8.616 -1.385
153 2HH2 ARG 19 2HH2 ARG 19 -3.768 -10.094 -1.037
154 H TYR 20 H TYR 20 -7.521 -3.095 -0.042
155 HA TYR 20 HA TYR 20 -9.940 -4.382 0.522
156 1HB TYR 20 1HB TYR 20 -8.737 -3.300 2.305
157 2HB TYR 20 2HB TYR 20 -8.868 -1.728 1.518
158 HD1 TYR 20 HD1 TYR 20 -11.222 -0.759 1.145
159 HD2 TYR 20 HD2 TYR 20 -10.411 -4.040 3.794
160 HE1 TYR 20 HE1 TYR 20 -13.377 -0.356 2.302
161 HE2 TYR 20 HE2 TYR 20 -12.566 -3.638 4.952
162 HH TYR 20 HH TYR 20 -14.546 -0.824 4.221
163 H ARG 21 H ARG 21 -9.359 -1.523 -1.390
164 HA ARG 21 HA ARG 21 -12.142 -0.648 -1.407
165 1HB ARG 21 1HB ARG 21 -9.629 0.368 -2.310
166 2HB ARG 21 2HB ARG 21 -10.715 0.307 -3.699
167 1HG ARG 21 1HG ARG 21 -12.264 1.756 -2.720
168 2HG ARG 21 2HG ARG 21 -11.709 1.404 -1.083
169 1HD ARG 21 1HD ARG 21 -11.040 3.686 -2.102
170 2HD ARG 21 2HD ARG 21 -9.771 2.737 -1.328
171 HE ARG 21 HE ARG 21 -9.893 2.076 -4.116
172 1HH1 ARG 21 1HH2 ARG 21 -10.013 4.989 -4.450
173 2HH1 ARG 21 2HH2 ARG 21 -8.350 5.468 -4.365
174 1HH2 ARG 21 1HH1 ARG 21 -7.294 2.504 -2.908
175 2HH2 ARG 21 2HH1 ARG 21 -6.810 4.062 -3.491
176 H SER 22 H SER 22 -9.998 -2.216 -3.807
177 HA SER 22 HA SER 22 -12.101 -2.679 -5.715
178 1HB SER 22 1HB SER 22 -9.685 -2.716 -6.304
179 2HB SER 22 2HB SER 22 -9.489 -4.181 -5.348
180 HG SER 22 HG SER 22 -11.192 -3.829 -7.598
181 H VAL 23 H VAL 23 -11.378 -4.127 -2.722
182 HA VAL 23 HA VAL 23 -12.560 -6.736 -3.431
183 HB VAL 23 HB VAL 23 -11.772 -5.727 -0.686
184 1HG1 VAL 23 1HG1 VAL 23 -12.301 -8.433 -1.925
185 2HG1 VAL 23 2HG1 VAL 23 -11.383 -8.260 -0.428
186 3HG1 VAL 23 3HG1 VAL 23 -13.060 -7.717 -0.502
187 1HG2 VAL 23 1HG2 VAL 23 -10.095 -6.108 -2.931
188 2HG2 VAL 23 2HG2 VAL 23 -9.596 -5.918 -1.250
189 3HG2 VAL 23 3HG2 VAL 23 -9.872 -7.530 -1.912
190 H ILE 24 H ILE 24 -13.515 -3.696 -2.023
191 HA ILE 24 HA ILE 24 -16.198 -4.889 -1.444
192 HB ILE 24 HB ILE 24 -14.669 -2.713 -0.004
193 1HG1 ILE 24 1HG1 ILE 24 -15.367 -4.173 1.961
194 2HG1 ILE 24 2HG1 ILE 24 -15.938 -5.351 0.779
195 1HG2 ILE 24 1HG2 ILE 24 -17.627 -3.364 0.071
196 2HG2 ILE 24 2HG2 ILE 24 -16.805 -2.472 1.351
197 3HG2 ILE 24 3HG2 ILE 24 -16.878 -1.806 -0.280
198 1HD1 ILE 24 1HD1 ILE 24 -13.272 -4.452 0.097
199 2HD1 ILE 24 2HD1 ILE 24 -13.311 -5.070 1.749
200 3HD1 ILE 24 3HD1 ILE 24 -13.845 -6.091 0.414
201 H LYS 25 H LYS 25 -14.543 -2.953 -3.550
202 HA LYS 25 HA LYS 25 -17.040 -1.472 -4.244
203 1HB LYS 25 1HB LYS 25 -15.038 -0.136 -3.100
204 2HB LYS 25 2HB LYS 25 -14.393 -0.170 -4.741
205 1HG LYS 25 1HG LYS 25 -17.204 0.491 -4.809
206 2HG LYS 25 2HG LYS 25 -16.354 1.585 -3.716
207 1HD LYS 25 1HD LYS 25 -15.195 0.953 -6.419
208 2HD LYS 25 2HD LYS 25 -16.452 2.179 -6.257
209 1HE LYS 25 1HE LYS 25 -14.651 2.750 -4.181
210 2HE LYS 25 2HE LYS 25 -13.631 2.373 -5.584
211 1HZ LYS 25 1HZ LYS 25 -15.390 3.769 -6.845
212 2HZ LYS 25 2HZ LYS 25 -15.725 4.425 -5.314
213 3HZ LYS 25 3HZ LYS 25 -14.169 4.566 -5.973
214 H ALA 26 H ALA 26 -17.069 -3.476 -5.698
215 HA ALA 26 HA ALA 26 -15.994 -2.716 -8.315
216 1HB ALA 26 1HB ALA 26 -14.358 -4.300 -6.778
217 2HB ALA 26 2HB ALA 26 -15.274 -5.503 -7.685
218 3HB ALA 26 3HB ALA 26 -14.350 -4.268 -8.540
Start of MODEL 11
1 1H MET 1 1H MET 1 17.784 -0.177 -6.196
2 2H MET 1 2H MET 1 16.744 -1.508 -6.344
3 3H MET 1 3H MET 1 17.346 -0.744 -7.737
4 HA MET 1 HA MET 1 15.993 1.122 -7.474
5 1HB MET 1 1HB MET 1 14.979 -1.579 -7.260
6 2HB MET 1 2HB MET 1 13.863 -0.457 -6.480
7 1HG MET 1 1HG MET 1 13.089 0.013 -8.548
8 2HG MET 1 2HG MET 1 14.608 0.870 -8.812
9 1HE MET 1 1HE MET 1 15.580 0.804 -10.459
10 2HE MET 1 2HE MET 1 16.508 -0.545 -11.111
11 3HE MET 1 3HE MET 1 14.980 -0.090 -11.862
12 HA PRO 2 HA PRO 2 16.278 2.033 -3.010
13 1HB PRO 2 1HB PRO 2 16.620 4.726 -3.360
14 2HB PRO 2 2HB PRO 2 17.958 3.562 -3.448
15 1HG PRO 2 1HG PRO 2 16.445 4.876 -5.649
16 2HG PRO 2 2HG PRO 2 18.172 4.507 -5.531
17 1HD PRO 2 1HD PRO 2 16.411 3.015 -6.983
18 2HD PRO 2 2HD PRO 2 17.896 2.355 -6.261
19 H GLY 3 H GLY 3 14.996 3.919 -1.805
20 1HA GLY 3 1HA GLY 3 12.972 5.095 -1.459
21 2HA GLY 3 2HA GLY 3 12.563 4.821 -3.154
22 H THR 4 H THR 4 13.239 2.623 -0.407
23 HA THR 4 HA THR 4 10.519 1.477 -0.782
24 HB THR 4 HB THR 4 12.787 0.247 -1.787
25 HG1 THR 4 HG1 THR 4 10.314 -0.800 -0.907
26 1HG2 THR 4 1HG2 THR 4 13.527 -0.233 0.566
27 2HG2 THR 4 2HG2 THR 4 12.059 -1.188 0.780
28 3HG2 THR 4 3HG2 THR 4 13.269 -1.682 -0.405
29 H ILE 5 H ILE 5 13.453 1.605 1.214
30 HA ILE 5 HA ILE 5 12.561 0.399 3.563
31 HB ILE 5 HB ILE 5 14.194 2.945 3.308
32 1HG1 ILE 5 1HG1 ILE 5 15.098 0.954 2.106
33 2HG1 ILE 5 2HG1 ILE 5 16.117 1.434 3.464
34 1HG2 ILE 5 1HG2 ILE 5 13.116 1.667 5.608
35 2HG2 ILE 5 2HG2 ILE 5 14.843 1.312 5.582
36 3HG2 ILE 5 3HG2 ILE 5 14.287 2.985 5.556
37 1HD1 ILE 5 1HD1 ILE 5 14.510 -0.274 4.762
38 2HD1 ILE 5 2HD1 ILE 5 14.393 -0.977 3.149
39 3HD1 ILE 5 3HD1 ILE 5 15.966 -0.815 3.929
40 H LYS 6 H LYS 6 11.795 3.623 2.331
41 HA LYS 6 HA LYS 6 10.274 4.373 4.707
42 1HB LYS 6 1HB LYS 6 11.208 5.662 2.323
43 2HB LYS 6 2HB LYS 6 9.465 5.908 2.443
44 1HG LYS 6 1HG LYS 6 9.865 6.561 4.882
45 2HG LYS 6 2HG LYS 6 11.582 6.619 4.481
46 1HD LYS 6 1HD LYS 6 10.984 8.201 2.594
47 2HD LYS 6 2HD LYS 6 9.357 8.275 3.268
48 1HE LYS 6 1HE LYS 6 11.924 9.056 4.697
49 2HE LYS 6 2HE LYS 6 10.637 10.154 4.157
50 1HZ LYS 6 1HZ LYS 6 9.086 8.725 5.503
51 2HZ LYS 6 2HZ LYS 6 10.462 8.008 6.199
52 3HZ LYS 6 3HZ LYS 6 10.167 9.669 6.406
53 H GLU 7 H GLU 7 9.382 3.514 1.347
54 HA GLU 7 HA GLU 7 6.573 3.474 1.782
55 1HB GLU 7 1HB GLU 7 8.125 1.679 -0.104
56 2HB GLU 7 2HB GLU 7 6.437 2.170 -0.254
57 1HG GLU 7 1HG GLU 7 8.122 4.500 0.024
58 2HG GLU 7 2HG GLU 7 8.695 3.495 -1.308
59 H ASN 8 H ASN 8 9.019 0.908 2.122
60 HA ASN 8 HA ASN 8 7.415 -1.291 2.667
61 1HB ASN 8 1HB ASN 8 9.975 -1.111 2.699
62 2HB ASN 8 2HB ASN 8 9.779 -0.631 4.378
63 1HD2 ASN 8 2HD2 ASN 8 8.919 -3.281 2.114
64 2HD2 ASN 8 1HD2 ASN 8 8.876 -4.491 3.304
65 H ILE 9 H ILE 9 7.800 1.595 4.557
66 HA ILE 9 HA ILE 9 6.430 0.358 6.882
67 HB ILE 9 HB ILE 9 7.234 3.241 6.777
68 1HG1 ILE 9 1HG1 ILE 9 9.140 1.958 5.827
69 2HG1 ILE 9 2HG1 ILE 9 9.518 2.624 7.412
70 1HG2 ILE 9 1HG2 ILE 9 6.031 2.088 8.719
71 2HG2 ILE 9 2HG2 ILE 9 7.521 1.180 8.973
72 3HG2 ILE 9 3HG2 ILE 9 7.522 2.937 9.129
73 1HD1 ILE 9 1HD1 ILE 9 8.290 -0.033 7.550
74 2HD1 ILE 9 2HD1 ILE 9 9.830 -0.023 6.689
75 3HD1 ILE 9 3HD1 ILE 9 9.743 0.573 8.346
76 H ILE 10 H ILE 10 5.747 2.244 4.095
77 HA ILE 10 HA ILE 10 3.087 2.953 5.274
78 HB ILE 10 HB ILE 10 4.947 4.759 4.382
79 1HG1 ILE 10 1HG1 ILE 10 2.918 5.248 5.676
80 2HG1 ILE 10 2HG1 ILE 10 3.055 6.352 4.307
81 1HG2 ILE 10 1HG2 ILE 10 3.098 4.146 2.060
82 2HG2 ILE 10 2HG2 ILE 10 3.994 5.656 2.221
83 3HG2 ILE 10 3HG2 ILE 10 4.861 4.130 2.057
84 1HD1 ILE 10 1HD1 ILE 10 1.618 4.521 3.068
85 2HD1 ILE 10 2HD1 ILE 10 1.163 4.057 4.708
86 3HD1 ILE 10 3HD1 ILE 10 0.830 5.688 4.128
87 H PHE 11 H PHE 11 4.760 2.282 2.203
88 HA PHE 11 HA PHE 11 2.676 1.773 0.489
89 1HB PHE 11 1HB PHE 11 4.639 1.370 -0.591
90 2HB PHE 11 2HB PHE 11 5.431 0.799 0.865
91 HD1 PHE 11 HD1 PHE 11 4.879 -1.551 1.711
92 HD2 PHE 11 HD2 PHE 11 3.879 -0.158 -2.224
93 HE1 PHE 11 HE1 PHE 11 4.632 -3.899 0.945
94 HE2 PHE 11 HE2 PHE 11 3.631 -2.506 -2.996
95 HZ PHE 11 HZ PHE 11 4.009 -4.376 -1.409
96 H GLY 12 H GLY 12 3.736 -0.179 3.219
97 1HA GLY 12 1HA GLY 12 2.012 -2.443 2.571
98 2HA GLY 12 2HA GLY 12 2.864 -2.196 4.099
99 H VAL 13 H VAL 13 1.881 0.280 4.861
100 HA VAL 13 HA VAL 13 -0.695 -0.411 5.950
101 HB VAL 13 HB VAL 13 0.793 2.230 5.811
102 1HG1 VAL 13 1HG1 VAL 13 -1.758 1.429 7.227
103 2HG1 VAL 13 2HG1 VAL 13 -0.793 2.819 7.722
104 3HG1 VAL 13 3HG1 VAL 13 -1.515 2.776 6.114
105 1HG2 VAL 13 1HG2 VAL 13 1.412 -0.030 7.229
106 2HG2 VAL 13 2HG2 VAL 13 1.823 1.606 7.745
107 3HG2 VAL 13 3HG2 VAL 13 0.374 0.821 8.374
108 H SER 14 H SER 14 0.389 1.433 3.160
109 HA SER 14 HA SER 14 -2.250 2.531 2.576
110 1HB SER 14 1HB SER 14 0.403 2.930 1.640
111 2HB SER 14 2HB SER 14 -0.555 2.423 0.252
112 HG SER 14 HG SER 14 -0.638 4.739 1.723
113 H TYR 15 H TYR 15 -0.381 -0.306 1.652
114 HA TYR 15 HA TYR 15 -1.991 -1.151 -0.555
115 1HB TYR 15 1HB TYR 15 0.278 -2.080 0.603
116 2HB TYR 15 2HB TYR 15 -0.882 -3.253 1.219
117 HD1 TYR 15 HD1 TYR 15 -0.750 -1.402 -2.034
118 HD2 TYR 15 HD2 TYR 15 -0.632 -5.210 -0.048
119 HE1 TYR 15 HE1 TYR 15 -0.758 -2.551 -4.233
120 HE2 TYR 15 HE2 TYR 15 -0.640 -6.357 -2.247
121 HH TYR 15 HH TYR 15 -1.553 -5.000 -5.023
122 H ASP 16 H ASP 16 -2.090 -2.135 2.890
123 HA ASP 16 HA ASP 16 -4.362 -3.786 2.767
124 1HB ASP 16 1HB ASP 16 -3.032 -2.168 4.855
125 2HB ASP 16 2HB ASP 16 -4.738 -2.502 5.158
126 H GLU 17 H GLU 17 -4.085 -0.356 2.401
127 HA GLU 17 HA GLU 17 -7.028 0.001 2.629
128 1HB GLU 17 1HB GLU 17 -5.227 1.593 3.668
129 2HB GLU 17 2HB GLU 17 -5.070 2.206 2.022
130 1HG GLU 17 1HG GLU 17 -7.392 2.822 1.941
131 2HG GLU 17 2HG GLU 17 -7.727 1.980 3.454
132 H TYR 18 H TYR 18 -4.522 -0.412 0.296
133 HA TYR 18 HA TYR 18 -6.102 0.866 -1.860
134 1HB TYR 18 1HB TYR 18 -3.333 0.217 -1.442
135 2HB TYR 18 2HB TYR 18 -3.891 -0.573 -2.917
136 HD1 TYR 18 HD1 TYR 18 -4.217 2.728 -1.153
137 HD2 TYR 18 HD2 TYR 18 -3.846 0.652 -4.895
138 HE1 TYR 18 HE1 TYR 18 -4.134 4.899 -2.349
139 HE2 TYR 18 HE2 TYR 18 -3.764 2.822 -6.091
140 HH TYR 18 HH TYR 18 -4.109 5.048 -5.885
141 H ARG 19 H ARG 19 -4.702 -2.370 -1.213
142 HA ARG 19 HA ARG 19 -5.976 -3.728 -3.340
143 1HB ARG 19 1HB ARG 19 -4.606 -4.448 -0.864
144 2HB ARG 19 2HB ARG 19 -5.897 -5.581 -1.264
145 1HG ARG 19 1HG ARG 19 -4.657 -5.097 -3.712
146 2HG ARG 19 2HG ARG 19 -3.316 -5.185 -2.569
147 1HD ARG 19 1HD ARG 19 -5.033 -7.266 -1.809
148 2HD ARG 19 2HD ARG 19 -5.014 -7.323 -3.571
149 HE ARG 19 HE ARG 19 -2.370 -7.099 -2.295
150 1HH1 ARG 19 1HH1 ARG 19 -4.859 -9.355 -2.841
151 2HH1 ARG 19 2HH1 ARG 19 -3.822 -10.570 -3.509
152 1HH2 ARG 19 1HH2 ARG 19 -1.005 -8.549 -3.496
153 2HH2 ARG 19 2HH2 ARG 19 -1.639 -10.115 -3.877
154 H TYR 20 H TYR 20 -7.277 -2.607 -0.301
155 HA TYR 20 HA TYR 20 -9.584 -4.332 -0.243
156 1HB TYR 20 1HB TYR 20 -8.861 -3.126 1.759
157 2HB TYR 20 2HB TYR 20 -9.154 -1.581 0.959
158 HD1 TYR 20 HD1 TYR 20 -10.779 -4.665 2.242
159 HD2 TYR 20 HD2 TYR 20 -11.362 -0.673 0.768
160 HE1 TYR 20 HE1 TYR 20 -13.156 -4.753 2.942
161 HE2 TYR 20 HE2 TYR 20 -13.739 -0.761 1.469
162 HH TYR 20 HH TYR 20 -15.104 -3.698 2.965
163 H ARG 21 H ARG 21 -9.070 -1.026 -1.494
164 HA ARG 21 HA ARG 21 -11.798 -0.746 -2.424
165 1HB ARG 21 1HB ARG 21 -9.289 0.801 -2.570
166 2HB ARG 21 2HB ARG 21 -10.358 1.011 -3.958
167 1HG ARG 21 1HG ARG 21 -12.186 1.181 -1.990
168 2HG ARG 21 2HG ARG 21 -10.776 1.772 -1.112
169 1HD ARG 21 1HD ARG 21 -10.670 3.024 -3.634
170 2HD ARG 21 2HD ARG 21 -12.357 3.120 -3.129
171 HE ARG 21 HE ARG 21 -10.142 4.050 -1.346
172 1HH1 ARG 21 1HH2 ARG 21 -11.139 6.134 -3.195
173 2HH1 ARG 21 2HH2 ARG 21 -12.429 6.861 -2.297
174 1HH2 ARG 21 1HH1 ARG 21 -12.694 4.235 -0.046
175 2HH2 ARG 21 2HH1 ARG 21 -13.309 5.786 -0.512
176 H SER 22 H SER 22 -8.798 -1.921 -3.868
177 HA SER 22 HA SER 22 -9.861 -2.024 -6.568
178 1HB SER 22 1HB SER 22 -7.410 -1.928 -5.996
179 2HB SER 22 2HB SER 22 -7.535 -3.587 -5.417
180 HG SER 22 HG SER 22 -7.060 -2.857 -7.841
181 H VAL 23 H VAL 23 -10.588 -3.839 -3.847
182 HA VAL 23 HA VAL 23 -11.145 -6.277 -5.483
183 HB VAL 23 HB VAL 23 -11.084 -5.953 -2.467
184 1HG1 VAL 23 1HG1 VAL 23 -12.194 -7.971 -4.185
185 2HG1 VAL 23 2HG1 VAL 23 -10.803 -8.647 -3.334
186 3HG1 VAL 23 3HG1 VAL 23 -12.137 -7.941 -2.422
187 1HG2 VAL 23 1HG2 VAL 23 -8.939 -5.998 -4.190
188 2HG2 VAL 23 2HG2 VAL 23 -8.889 -6.552 -2.516
189 3HG2 VAL 23 3HG2 VAL 23 -9.142 -7.711 -3.821
190 H ILE 24 H ILE 24 -12.644 -3.820 -3.438
191 HA ILE 24 HA ILE 24 -15.291 -5.104 -3.950
192 HB ILE 24 HB ILE 24 -14.399 -3.067 -1.894
193 1HG1 ILE 24 1HG1 ILE 24 -15.261 -4.884 -0.352
194 2HG1 ILE 24 2HG1 ILE 24 -15.419 -5.919 -1.772
195 1HG2 ILE 24 1HG2 ILE 24 -17.172 -4.112 -2.539
196 2HG2 ILE 24 2HG2 ILE 24 -16.764 -3.207 -1.082
197 3HG2 ILE 24 3HG2 ILE 24 -16.623 -2.441 -2.665
198 1HD1 ILE 24 1HD1 ILE 24 -12.809 -4.634 -1.684
199 2HD1 ILE 24 2HD1 ILE 24 -13.113 -5.572 -0.222
200 3HD1 ILE 24 3HD1 ILE 24 -13.204 -6.349 -1.802
201 H LYS 25 H LYS 25 -13.310 -2.433 -4.823
202 HA LYS 25 HA LYS 25 -15.568 -1.343 -6.417
203 1HB LYS 25 1HB LYS 25 -15.063 -0.086 -4.141
204 2HB LYS 25 2HB LYS 25 -13.731 0.603 -5.069
205 1HG LYS 25 1HG LYS 25 -15.133 1.979 -6.167
206 2HG LYS 25 2HG LYS 25 -16.152 0.621 -6.648
207 1HD LYS 25 1HD LYS 25 -16.288 1.712 -3.844
208 2HD LYS 25 2HD LYS 25 -17.196 2.478 -5.148
209 1HE LYS 25 1HE LYS 25 -17.747 -0.213 -5.532
210 2HE LYS 25 2HE LYS 25 -17.732 -0.051 -3.764
211 1HZ LYS 25 1HZ LYS 25 -19.155 1.786 -5.616
212 2HZ LYS 25 2HZ LYS 25 -19.902 0.536 -4.746
213 3HZ LYS 25 3HZ LYS 25 -19.189 1.837 -3.919
214 H ALA 26 H ALA 26 -14.565 -2.108 -8.319
215 HA ALA 26 HA ALA 26 -11.928 -0.837 -8.949
216 1HB ALA 26 1HB ALA 26 -12.502 -3.552 -8.880
217 2HB ALA 26 2HB ALA 26 -12.650 -3.153 -10.592
218 3HB ALA 26 3HB ALA 26 -11.148 -2.812 -9.734
Start of MODEL 12
1 1H MET 1 1H MET 1 15.667 1.986 -6.678
2 2H MET 1 2H MET 1 14.658 1.846 -8.038
3 3H MET 1 3H MET 1 15.833 3.069 -7.977
4 HA MET 1 HA MET 1 14.067 4.336 -7.352
5 1HB MET 1 1HB MET 1 12.568 2.436 -7.802
6 2HB MET 1 2HB MET 1 12.973 1.733 -6.236
7 1HG MET 1 1HG MET 1 12.212 4.342 -5.619
8 2HG MET 1 2HG MET 1 11.071 3.851 -6.872
9 1HE MET 1 1HE MET 1 10.917 4.618 -3.825
10 2HE MET 1 2HE MET 1 9.312 4.243 -4.449
11 3HE MET 1 3HE MET 1 9.888 3.475 -2.965
12 HA PRO 2 HA PRO 2 16.059 4.842 -3.372
13 1HB PRO 2 1HB PRO 2 15.423 7.490 -3.085
14 2HB PRO 2 2HB PRO 2 16.758 6.921 -4.109
15 1HG PRO 2 1HG PRO 2 14.031 7.816 -4.877
16 2HG PRO 2 2HG PRO 2 15.575 8.050 -5.709
17 1HD PRO 2 1HD PRO 2 13.701 6.179 -6.432
18 2HD PRO 2 2HD PRO 2 15.435 6.050 -6.797
19 H GLY 3 H GLY 3 15.163 5.983 -1.230
20 1HA GLY 3 1HA GLY 3 13.536 5.833 0.461
21 2HA GLY 3 2HA GLY 3 12.417 6.402 -0.779
22 H THR 4 H THR 4 14.252 3.347 -0.586
23 HA THR 4 HA THR 4 11.820 1.866 -1.278
24 HB THR 4 HB THR 4 14.462 1.460 -1.818
25 HG1 THR 4 HG1 THR 4 12.829 0.463 -2.922
26 1HG2 THR 4 1HG2 THR 4 13.751 -0.389 0.476
27 2HG2 THR 4 2HG2 THR 4 15.104 -0.652 -0.623
28 3HG2 THR 4 3HG2 THR 4 15.081 0.768 0.422
29 H ILE 5 H ILE 5 14.077 1.930 1.484
30 HA ILE 5 HA ILE 5 12.754 0.077 3.141
31 HB ILE 5 HB ILE 5 14.134 2.633 4.014
32 1HG1 ILE 5 1HG1 ILE 5 15.666 1.412 2.636
33 2HG1 ILE 5 2HG1 ILE 5 16.092 1.012 4.301
34 1HG2 ILE 5 1HG2 ILE 5 12.704 0.757 5.507
35 2HG2 ILE 5 2HG2 ILE 5 14.388 0.269 5.702
36 3HG2 ILE 5 3HG2 ILE 5 13.888 1.905 6.136
37 1HD1 ILE 5 1HD1 ILE 5 14.712 -1.053 4.128
38 2HD1 ILE 5 2HD1 ILE 5 14.385 -0.668 2.439
39 3HD1 ILE 5 3HD1 ILE 5 16.031 -1.032 2.956
40 H LYS 6 H LYS 6 12.098 3.532 2.676
41 HA LYS 6 HA LYS 6 10.118 3.796 4.711
42 1HB LYS 6 1HB LYS 6 10.123 5.266 2.064
43 2HB LYS 6 2HB LYS 6 9.482 5.831 3.608
44 1HG LYS 6 1HG LYS 6 12.387 5.379 2.878
45 2HG LYS 6 2HG LYS 6 11.613 6.908 3.302
46 1HD LYS 6 1HD LYS 6 11.204 6.112 5.576
47 2HD LYS 6 2HD LYS 6 11.868 4.529 5.167
48 1HE LYS 6 1HE LYS 6 13.613 5.790 6.295
49 2HE LYS 6 2HE LYS 6 14.044 5.715 4.575
50 1HZ LYS 6 1HZ LYS 6 12.452 7.911 5.784
51 2HZ LYS 6 2HZ LYS 6 14.132 7.997 5.536
52 3HZ LYS 6 3HZ LYS 6 13.086 7.847 4.209
53 H GLU 7 H GLU 7 9.738 3.143 1.208
54 HA GLU 7 HA GLU 7 6.905 2.768 1.375
55 1HB GLU 7 1HB GLU 7 7.047 1.841 -0.841
56 2HB GLU 7 2HB GLU 7 8.203 3.162 -0.727
57 1HG GLU 7 1HG GLU 7 9.978 1.796 -1.033
58 2HG GLU 7 2HG GLU 7 9.332 0.570 0.050
59 H ASN 8 H ASN 8 9.628 0.637 1.997
60 HA ASN 8 HA ASN 8 8.154 -1.819 1.976
61 1HB ASN 8 1HB ASN 8 10.569 -1.891 2.018
62 2HB ASN 8 2HB ASN 8 10.593 -0.994 3.528
63 1HD2 ASN 8 1HD2 ASN 8 9.644 -2.116 5.476
64 2HD2 ASN 8 2HD2 ASN 8 9.647 -3.813 5.530
65 H ILE 9 H ILE 9 7.969 0.926 3.945
66 HA ILE 9 HA ILE 9 6.762 -0.641 6.189
67 HB ILE 9 HB ILE 9 7.761 2.211 6.086
68 1HG1 ILE 9 1HG1 ILE 9 8.821 -0.322 7.362
69 2HG1 ILE 9 2HG1 ILE 9 9.566 0.580 6.043
70 1HG2 ILE 9 1HG2 ILE 9 6.173 0.647 8.061
71 2HG2 ILE 9 2HG2 ILE 9 7.484 1.630 8.712
72 3HG2 ILE 9 3HG2 ILE 9 6.201 2.385 7.767
73 1HD1 ILE 9 1HD1 ILE 9 9.023 1.743 8.778
74 2HD1 ILE 9 2HD1 ILE 9 10.574 1.061 8.289
75 3HD1 ILE 9 3HD1 ILE 9 9.938 2.487 7.468
76 H ILE 10 H ILE 10 5.971 1.209 3.482
77 HA ILE 10 HA ILE 10 3.264 1.774 4.645
78 HB ILE 10 HB ILE 10 5.006 3.721 3.886
79 1HG1 ILE 10 1HG1 ILE 10 2.852 4.063 5.005
80 2HG1 ILE 10 2HG1 ILE 10 3.009 5.172 3.641
81 1HG2 ILE 10 1HG2 ILE 10 5.059 2.932 1.537
82 2HG2 ILE 10 2HG2 ILE 10 3.316 3.174 1.429
83 3HG2 ILE 10 3HG2 ILE 10 4.386 4.556 1.667
84 1HD1 ILE 10 1HD1 ILE 10 1.750 3.468 2.248
85 2HD1 ILE 10 2HD1 ILE 10 1.419 2.598 3.745
86 3HD1 ILE 10 3HD1 ILE 10 0.799 4.234 3.519
87 H PHE 11 H PHE 11 5.180 1.080 1.800
88 HA PHE 11 HA PHE 11 3.292 0.576 -0.156
89 1HB PHE 11 1HB PHE 11 5.879 0.288 -0.123
90 2HB PHE 11 2HB PHE 11 5.530 -1.366 0.375
91 HD1 PHE 11 HD1 PHE 11 4.138 -2.824 -1.075
92 HD2 PHE 11 HD2 PHE 11 5.521 1.037 -2.323
93 HE1 PHE 11 HE1 PHE 11 3.657 -3.425 -3.444
94 HE2 PHE 11 HE2 PHE 11 5.044 0.449 -4.696
95 HZ PHE 11 HZ PHE 11 4.112 -1.785 -5.252
96 H GLY 12 H GLY 12 4.053 -1.349 2.693
97 1HA GLY 12 1HA GLY 12 2.324 -3.571 1.858
98 2HA GLY 12 2HA GLY 12 3.151 -3.428 3.412
99 H VAL 13 H VAL 13 2.244 -1.053 4.406
100 HA VAL 13 HA VAL 13 -0.396 -1.706 5.321
101 HB VAL 13 HB VAL 13 1.257 0.826 5.475
102 1HG1 VAL 13 1HG1 VAL 13 -1.594 0.347 6.115
103 2HG1 VAL 13 2HG1 VAL 13 -0.657 1.123 7.392
104 3HG1 VAL 13 3HG1 VAL 13 -0.751 1.862 5.794
105 1HG2 VAL 13 1HG2 VAL 13 1.618 -1.475 6.799
106 2HG2 VAL 13 2HG2 VAL 13 1.866 0.088 7.580
107 3HG2 VAL 13 3HG2 VAL 13 0.355 -0.789 7.822
108 H SER 14 H SER 14 0.830 0.404 2.768
109 HA SER 14 HA SER 14 -1.652 1.710 2.166
110 1HB SER 14 1HB SER 14 0.924 1.950 1.259
111 2HB SER 14 2HB SER 14 0.146 1.164 -0.111
112 HG SER 14 HG SER 14 -0.063 3.710 0.765
113 H TYR 15 H TYR 15 -0.102 -1.219 0.843
114 HA TYR 15 HA TYR 15 -2.083 -1.848 -1.091
115 1HB TYR 15 1HB TYR 15 0.247 -2.999 -0.354
116 2HB TYR 15 2HB TYR 15 -0.877 -4.097 0.441
117 HD1 TYR 15 HD1 TYR 15 -3.075 -4.560 -1.161
118 HD2 TYR 15 HD2 TYR 15 0.914 -3.667 -2.480
119 HE1 TYR 15 HE1 TYR 15 -3.547 -5.660 -3.332
120 HE2 TYR 15 HE2 TYR 15 0.442 -4.770 -4.651
121 HH TYR 15 HH TYR 15 -1.011 -6.011 -5.803
122 H ASP 16 H ASP 16 -1.769 -2.995 2.282
123 HA ASP 16 HA ASP 16 -4.095 -4.507 2.503
124 1HB ASP 16 1HB ASP 16 -2.644 -2.700 4.411
125 2HB ASP 16 2HB ASP 16 -4.194 -3.387 4.901
126 H GLU 17 H GLU 17 -3.748 -1.029 2.257
127 HA GLU 17 HA GLU 17 -6.648 -0.604 2.698
128 1HB GLU 17 1HB GLU 17 -4.621 0.963 3.427
129 2HB GLU 17 2HB GLU 17 -4.800 1.569 1.780
130 1HG GLU 17 1HG GLU 17 -6.548 2.813 2.447
131 2HG GLU 17 2HG GLU 17 -7.415 1.336 2.869
132 H TYR 18 H TYR 18 -4.273 -0.839 0.152
133 HA TYR 18 HA TYR 18 -5.852 0.386 -1.932
134 1HB TYR 18 1HB TYR 18 -3.317 -0.144 -1.911
135 2HB TYR 18 2HB TYR 18 -3.791 -1.778 -2.368
136 HD1 TYR 18 HD1 TYR 18 -6.323 0.123 -3.708
137 HD2 TYR 18 HD2 TYR 18 -2.129 -0.615 -4.284
138 HE1 TYR 18 HE1 TYR 18 -6.520 0.839 -6.072
139 HE2 TYR 18 HE2 TYR 18 -2.330 0.100 -6.650
140 HH TYR 18 HH TYR 18 -3.783 1.449 -8.044
141 H ARG 19 H ARG 19 -5.360 -2.987 -0.880
142 HA ARG 19 HA ARG 19 -7.123 -4.117 -2.867
143 1HB ARG 19 1HB ARG 19 -5.448 -5.078 -0.769
144 2HB ARG 19 2HB ARG 19 -7.064 -5.731 -0.495
145 1HG ARG 19 1HG ARG 19 -6.705 -5.977 -3.248
146 2HG ARG 19 2HG ARG 19 -5.131 -6.402 -2.576
147 1HD ARG 19 1HD ARG 19 -7.640 -7.544 -1.372
148 2HD ARG 19 2HD ARG 19 -6.943 -8.271 -2.819
149 HE ARG 19 HE ARG 19 -5.285 -7.911 -0.360
150 1HH1 ARG 19 1HH1 ARG 19 -4.948 -9.283 -3.266
151 2HH1 ARG 19 2HH1 ARG 19 -4.787 -10.925 -2.738
152 1HH2 ARG 19 1HH2 ARG 19 -5.820 -10.261 0.504
153 2HH2 ARG 19 2HH2 ARG 19 -5.280 -11.478 -0.603
154 H TYR 20 H TYR 20 -7.589 -2.698 0.298
155 HA TYR 20 HA TYR 20 -10.287 -3.714 0.664
156 1HB TYR 20 1HB TYR 20 -9.046 -3.062 2.628
157 2HB TYR 20 2HB TYR 20 -8.740 -1.456 1.966
158 HD1 TYR 20 HD1 TYR 20 -11.720 -3.685 2.497
159 HD2 TYR 20 HD2 TYR 20 -10.032 0.246 2.876
160 HE1 TYR 20 HE1 TYR 20 -13.839 -2.871 3.494
161 HE2 TYR 20 HE2 TYR 20 -12.152 1.060 3.872
162 HH TYR 20 HH TYR 20 -14.110 0.362 4.848
163 H ARG 21 H ARG 21 -8.915 -1.312 -1.309
164 HA ARG 21 HA ARG 21 -11.457 0.232 -1.435
165 1HB ARG 21 1HB ARG 21 -9.017 1.250 -1.308
166 2HB ARG 21 2HB ARG 21 -9.022 0.932 -3.043
167 1HG ARG 21 1HG ARG 21 -11.181 2.189 -3.216
168 2HG ARG 21 2HG ARG 21 -11.029 2.608 -1.509
169 1HD ARG 21 1HD ARG 21 -9.465 4.194 -1.923
170 2HD ARG 21 2HD ARG 21 -8.598 3.162 -3.061
171 HE ARG 21 HE ARG 21 -10.965 4.841 -3.773
172 1HH1 ARG 21 1HH1 ARG 21 -9.030 2.332 -4.894
173 2HH1 ARG 21 2HH1 ARG 21 -8.624 3.086 -6.400
174 1HH2 ARG 21 1HH2 ARG 21 -10.071 6.126 -5.569
175 2HH2 ARG 21 2HH2 ARG 21 -9.211 5.237 -6.780
176 H SER 22 H SER 22 -9.167 -1.524 -3.536
177 HA SER 22 HA SER 22 -10.827 -1.268 -5.895
178 1HB SER 22 1HB SER 22 -8.405 -1.701 -6.054
179 2HB SER 22 2HB SER 22 -8.624 -3.254 -5.253
180 HG SER 22 HG SER 22 -9.154 -2.486 -7.846
181 H VAL 23 H VAL 23 -10.446 -3.728 -3.372
182 HA VAL 23 HA VAL 23 -12.064 -5.745 -4.591
183 HB VAL 23 HB VAL 23 -11.531 -5.122 -1.671
184 1HG1 VAL 23 1HG1 VAL 23 -13.636 -6.459 -2.092
185 2HG1 VAL 23 2HG1 VAL 23 -12.630 -7.679 -2.871
186 3HG1 VAL 23 3HG1 VAL 23 -12.406 -7.314 -1.161
187 1HG2 VAL 23 1HG2 VAL 23 -9.609 -5.769 -3.235
188 2HG2 VAL 23 2HG2 VAL 23 -9.834 -6.801 -1.823
189 3HG2 VAL 23 3HG2 VAL 23 -10.403 -7.335 -3.403
190 H ILE 24 H ILE 24 -12.908 -3.200 -2.219
191 HA ILE 24 HA ILE 24 -15.776 -3.811 -2.610
192 HB ILE 24 HB ILE 24 -14.374 -1.805 -0.815
193 1HG1 ILE 24 1HG1 ILE 24 -15.188 -3.427 0.962
194 2HG1 ILE 24 2HG1 ILE 24 -15.582 -4.544 -0.344
195 1HG2 ILE 24 1HG2 ILE 24 -17.184 -2.207 -1.553
196 2HG2 ILE 24 2HG2 ILE 24 -16.912 -2.286 0.187
197 3HG2 ILE 24 3HG2 ILE 24 -16.428 -0.851 -0.717
198 1HD1 ILE 24 1HD1 ILE 24 -12.839 -3.327 -0.219
199 2HD1 ILE 24 2HD1 ILE 24 -13.231 -4.700 0.818
200 3HD1 ILE 24 3HD1 ILE 24 -13.346 -4.857 -0.935
201 H LYS 25 H LYS 25 -13.657 -2.227 -4.430
202 HA LYS 25 HA LYS 25 -14.504 0.412 -4.793
203 1HB LYS 25 1HB LYS 25 -12.958 -1.452 -6.246
204 2HB LYS 25 2HB LYS 25 -14.172 -0.846 -7.372
205 1HG LYS 25 1HG LYS 25 -13.565 1.485 -6.704
206 2HG LYS 25 2HG LYS 25 -12.271 0.824 -5.703
207 1HD LYS 25 1HD LYS 25 -10.940 0.820 -7.517
208 2HD LYS 25 2HD LYS 25 -11.996 -0.398 -8.235
209 1HE LYS 25 1HE LYS 25 -11.899 1.456 -9.791
210 2HE LYS 25 2HE LYS 25 -13.488 1.539 -9.002
211 1HZ LYS 25 1HZ LYS 25 -11.058 2.972 -8.070
212 2HZ LYS 25 2HZ LYS 25 -12.311 3.688 -8.960
213 3HZ LYS 25 3HZ LYS 25 -12.615 3.087 -7.400
214 H ALA 26 H ALA 26 -16.177 1.390 -6.016
215 HA ALA 26 HA ALA 26 -18.372 -0.463 -6.857
216 1HB ALA 26 1HB ALA 26 -18.448 2.061 -5.232
217 2HB ALA 26 2HB ALA 26 -19.829 1.649 -6.251
218 3HB ALA 26 3HB ALA 26 -19.312 0.545 -4.976
Start of MODEL 13
1 1H MET 1 1H MET 1 12.622 2.383 -8.384
2 2H MET 1 2H MET 1 12.051 3.247 -9.732
3 3H MET 1 3H MET 1 13.722 3.055 -9.488
4 HA MET 1 HA MET 1 13.438 5.192 -8.716
5 1HB MET 1 1HB MET 1 11.054 5.213 -9.150
6 2HB MET 1 2HB MET 1 10.755 4.110 -7.805
7 1HG MET 1 1HG MET 1 11.894 5.939 -6.346
8 2HG MET 1 2HG MET 1 11.580 7.006 -7.715
9 1HE MET 1 1HE MET 1 9.290 6.674 -9.021
10 2HE MET 1 2HE MET 1 8.841 5.022 -8.577
11 3HE MET 1 3HE MET 1 7.741 6.358 -8.244
12 HA PRO 2 HA PRO 2 15.207 4.025 -4.845
13 1HB PRO 2 1HB PRO 2 15.776 6.538 -3.915
14 2HB PRO 2 2HB PRO 2 16.720 5.741 -5.188
15 1HG PRO 2 1HG PRO 2 14.615 7.828 -5.420
16 2HG PRO 2 2HG PRO 2 16.113 7.626 -6.342
17 1HD PRO 2 1HD PRO 2 13.647 6.919 -7.283
18 2HD PRO 2 2HD PRO 2 15.163 6.158 -7.814
19 H GLY 3 H GLY 3 14.893 4.682 -2.429
20 1HA GLY 3 1HA GLY 3 13.471 5.153 -0.606
21 2HA GLY 3 2HA GLY 3 12.419 6.035 -1.717
22 H THR 4 H THR 4 13.419 2.666 -1.034
23 HA THR 4 HA THR 4 10.599 1.869 -1.626
24 HB THR 4 HB THR 4 13.009 0.955 -2.778
25 HG1 THR 4 HG1 THR 4 11.611 -0.096 -4.027
26 1HG2 THR 4 1HG2 THR 4 13.243 -0.480 -0.704
27 2HG2 THR 4 2HG2 THR 4 11.742 -1.278 -1.171
28 3HG2 THR 4 3HG2 THR 4 13.157 -1.382 -2.217
29 H ILE 5 H ILE 5 13.389 1.375 0.499
30 HA ILE 5 HA ILE 5 12.302 -0.581 2.223
31 HB ILE 5 HB ILE 5 14.143 1.745 2.853
32 1HG1 ILE 5 1HG1 ILE 5 14.962 0.096 1.175
33 2HG1 ILE 5 2HG1 ILE 5 15.901 0.043 2.667
34 1HG2 ILE 5 1HG2 ILE 5 12.778 -0.019 4.622
35 2HG2 ILE 5 2HG2 ILE 5 14.470 -0.516 4.588
36 3HG2 ILE 5 3HG2 ILE 5 14.046 1.141 5.017
37 1HD1 ILE 5 1HD1 ILE 5 14.339 -1.829 3.425
38 2HD1 ILE 5 2HD1 ILE 5 13.750 -1.881 1.763
39 3HD1 ILE 5 3HD1 ILE 5 15.442 -2.235 2.110
40 H LYS 6 H LYS 6 12.038 2.974 2.400
41 HA LYS 6 HA LYS 6 10.441 3.053 4.762
42 1HB LYS 6 1HB LYS 6 9.929 5.318 4.159
43 2HB LYS 6 2HB LYS 6 11.575 5.019 3.599
44 1HG LYS 6 1HG LYS 6 10.733 4.554 1.334
45 2HG LYS 6 2HG LYS 6 9.080 4.829 1.885
46 1HD LYS 6 1HD LYS 6 11.222 6.930 2.220
47 2HD LYS 6 2HD LYS 6 10.280 6.803 0.735
48 1HE LYS 6 1HE LYS 6 8.569 6.695 3.103
49 2HE LYS 6 2HE LYS 6 9.506 8.201 3.020
50 1HZ LYS 6 1HZ LYS 6 8.082 7.041 0.691
51 2HZ LYS 6 2HZ LYS 6 7.387 8.209 1.705
52 3HZ LYS 6 3HZ LYS 6 8.783 8.584 0.813
53 H GLU 7 H GLU 7 9.596 2.628 1.354
54 HA GLU 7 HA GLU 7 6.739 2.800 1.768
55 1HB GLU 7 1HB GLU 7 8.258 1.360 -0.431
56 2HB GLU 7 2HB GLU 7 6.566 1.854 -0.478
57 1HG GLU 7 1HG GLU 7 8.190 4.121 0.226
58 2HG GLU 7 2HG GLU 7 8.832 3.382 -1.241
59 H ASN 8 H ASN 8 8.977 0.039 1.367
60 HA ASN 8 HA ASN 8 7.184 -2.071 1.665
61 1HB ASN 8 1HB ASN 8 9.468 -2.584 1.240
62 2HB ASN 8 2HB ASN 8 9.983 -1.746 2.696
63 1HD2 ASN 8 2HD2 ASN 8 8.077 -4.593 1.627
64 2HD2 ASN 8 1HD2 ASN 8 8.352 -5.499 3.036
65 H ILE 9 H ILE 9 8.147 0.278 4.030
66 HA ILE 9 HA ILE 9 7.065 -1.322 6.271
67 HB ILE 9 HB ILE 9 8.196 1.485 6.237
68 1HG1 ILE 9 1HG1 ILE 9 9.417 -1.223 6.827
69 2HG1 ILE 9 2HG1 ILE 9 9.911 -0.076 5.581
70 1HG2 ILE 9 1HG2 ILE 9 6.692 0.130 8.193
71 2HG2 ILE 9 2HG2 ILE 9 8.368 0.000 8.724
72 3HG2 ILE 9 3HG2 ILE 9 7.659 1.587 8.426
73 1HD1 ILE 9 1HD1 ILE 9 10.052 1.485 7.809
74 2HD1 ILE 9 2HD1 ILE 9 10.499 -0.087 8.471
75 3HD1 ILE 9 3HD1 ILE 9 11.421 0.602 7.135
76 H ILE 10 H ILE 10 5.956 0.942 3.975
77 HA ILE 10 HA ILE 10 3.571 1.511 5.700
78 HB ILE 10 HB ILE 10 5.279 3.400 4.681
79 1HG1 ILE 10 1HG1 ILE 10 3.657 3.946 6.337
80 2HG1 ILE 10 2HG1 ILE 10 3.273 4.969 4.951
81 1HG2 ILE 10 1HG2 ILE 10 3.026 3.065 2.681
82 2HG2 ILE 10 2HG2 ILE 10 4.017 4.518 2.819
83 3HG2 ILE 10 3HG2 ILE 10 4.758 2.987 2.355
84 1HD1 ILE 10 1HD1 ILE 10 1.777 2.818 4.321
85 2HD1 ILE 10 2HD1 ILE 10 1.771 2.662 6.079
86 3HD1 ILE 10 3HD1 ILE 10 1.168 4.137 5.323
87 H PHE 11 H PHE 11 4.692 1.116 2.362
88 HA PHE 11 HA PHE 11 2.324 0.808 0.978
89 1HB PHE 11 1HB PHE 11 4.134 0.559 -0.411
90 2HB PHE 11 2HB PHE 11 5.070 -0.309 0.796
91 HD1 PHE 11 HD1 PHE 11 1.728 -0.965 -0.758
92 HD2 PHE 11 HD2 PHE 11 5.727 -2.360 -0.055
93 HE1 PHE 11 HE1 PHE 11 1.169 -3.115 -1.871
94 HE2 PHE 11 HE2 PHE 11 5.173 -4.512 -1.166
95 HZ PHE 11 HZ PHE 11 2.894 -4.890 -2.073
96 H GLY 12 H GLY 12 3.872 -1.474 3.193
97 1HA GLY 12 1HA GLY 12 2.020 -3.646 2.687
98 2HA GLY 12 2HA GLY 12 3.095 -3.516 4.083
99 H VAL 13 H VAL 13 2.343 -1.342 5.409
100 HA VAL 13 HA VAL 13 -0.092 -2.038 6.707
101 HB VAL 13 HB VAL 13 1.452 0.573 6.608
102 1HG1 VAL 13 1HG1 VAL 13 -1.025 -0.222 8.131
103 2HG1 VAL 13 2HG1 VAL 13 0.091 0.981 8.777
104 3HG1 VAL 13 3HG1 VAL 13 -0.714 1.263 7.233
105 1HG2 VAL 13 1HG2 VAL 13 1.598 -1.926 8.154
106 2HG2 VAL 13 2HG2 VAL 13 2.820 -0.676 7.923
107 3HG2 VAL 13 3HG2 VAL 13 1.576 -0.475 9.157
108 H SER 14 H SER 14 0.637 0.472 4.282
109 HA SER 14 HA SER 14 -2.033 1.458 4.020
110 1HB SER 14 1HB SER 14 0.416 2.094 2.906
111 2HB SER 14 2HB SER 14 -0.448 1.402 1.536
112 HG SER 14 HG SER 14 -0.676 3.798 2.277
113 H TYR 15 H TYR 15 -0.418 -1.396 2.893
114 HA TYR 15 HA TYR 15 -2.118 -2.121 0.718
115 1HB TYR 15 1HB TYR 15 0.089 -3.221 1.629
116 2HB TYR 15 2HB TYR 15 -1.009 -4.158 2.635
117 HD1 TYR 15 HD1 TYR 15 -0.629 -3.062 -0.937
118 HD2 TYR 15 HD2 TYR 15 -1.881 -6.139 1.786
119 HE1 TYR 15 HE1 TYR 15 -1.132 -4.553 -2.852
120 HE2 TYR 15 HE2 TYR 15 -2.386 -7.630 -0.130
121 HH TYR 15 HH TYR 15 -2.992 -7.284 -2.615
122 H ASP 16 H ASP 16 -2.190 -3.214 4.118
123 HA ASP 16 HA ASP 16 -4.581 -4.645 4.099
124 1HB ASP 16 1HB ASP 16 -3.406 -2.810 6.193
125 2HB ASP 16 2HB ASP 16 -4.904 -3.696 6.482
126 H GLU 17 H GLU 17 -4.102 -1.197 3.841
127 HA GLU 17 HA GLU 17 -7.023 -0.697 4.011
128 1HB GLU 17 1HB GLU 17 -5.001 0.803 4.948
129 2HB GLU 17 2HB GLU 17 -5.089 1.470 3.317
130 1HG GLU 17 1HG GLU 17 -7.370 1.279 5.306
131 2HG GLU 17 2HG GLU 17 -6.553 2.755 4.789
132 H TYR 18 H TYR 18 -4.404 -0.991 1.734
133 HA TYR 18 HA TYR 18 -5.824 0.245 -0.491
134 1HB TYR 18 1HB TYR 18 -3.255 -0.109 -0.196
135 2HB TYR 18 2HB TYR 18 -3.575 -1.742 -0.786
136 HD1 TYR 18 HD1 TYR 18 -4.839 -1.998 -3.008
137 HD2 TYR 18 HD2 TYR 18 -3.102 1.706 -1.697
138 HE1 TYR 18 HE1 TYR 18 -4.904 -1.142 -5.336
139 HE2 TYR 18 HE2 TYR 18 -3.168 2.562 -4.023
140 HH TYR 18 HH TYR 18 -4.146 2.199 -6.086
141 H ARG 19 H ARG 19 -5.248 -3.069 0.668
142 HA ARG 19 HA ARG 19 -6.329 -4.583 -1.401
143 1HB ARG 19 1HB ARG 19 -5.986 -4.904 1.466
144 2HB ARG 19 2HB ARG 19 -7.487 -5.661 0.930
145 1HG ARG 19 1HG ARG 19 -5.745 -6.426 -1.048
146 2HG ARG 19 2HG ARG 19 -4.696 -6.422 0.370
147 1HD ARG 19 1HD ARG 19 -5.556 -8.537 0.617
148 2HD ARG 19 2HD ARG 19 -6.841 -7.649 1.436
149 HE ARG 19 HE ARG 19 -8.266 -8.326 -0.303
150 1HH1 ARG 19 1HH1 ARG 19 -5.082 -9.179 -1.084
151 2HH1 ARG 19 2HH1 ARG 19 -5.374 -9.356 -2.782
152 1HH2 ARG 19 1HH2 ARG 19 -8.619 -8.145 -2.620
153 2HH2 ARG 19 2HH2 ARG 19 -7.375 -8.767 -3.652
154 H TYR 20 H TYR 20 -8.011 -2.633 1.016
155 HA TYR 20 HA TYR 20 -10.679 -3.416 0.231
156 1HB TYR 20 1HB TYR 20 -10.542 -2.413 2.361
157 2HB TYR 20 2HB TYR 20 -9.505 -1.111 1.784
158 HD1 TYR 20 HD1 TYR 20 -10.495 0.613 0.178
159 HD2 TYR 20 HD2 TYR 20 -12.896 -2.169 2.402
160 HE1 TYR 20 HE1 TYR 20 -12.490 2.038 -0.192
161 HE2 TYR 20 HE2 TYR 20 -14.891 -0.743 2.032
162 HH TYR 20 HH TYR 20 -15.662 0.962 0.450
163 H ARG 21 H ARG 21 -8.536 -0.722 -0.665
164 HA ARG 21 HA ARG 21 -10.412 0.551 -2.441
165 1HB ARG 21 1HB ARG 21 -7.617 0.862 -1.669
166 2HB ARG 21 2HB ARG 21 -7.854 1.143 -3.395
167 1HG ARG 21 1HG ARG 21 -9.704 2.707 -2.864
168 2HG ARG 21 2HG ARG 21 -9.387 2.473 -1.145
169 1HD ARG 21 1HD ARG 21 -7.248 3.496 -1.287
170 2HD ARG 21 2HD ARG 21 -7.223 3.384 -3.047
171 HE ARG 21 HE ARG 21 -8.396 5.421 -3.105
172 1HH1 ARG 21 1HH2 ARG 21 -7.472 6.016 -0.309
173 2HH1 ARG 21 2HH2 ARG 21 -8.969 6.338 0.502
174 1HH2 ARG 21 1HH1 ARG 21 -10.926 4.891 -1.968
175 2HH2 ARG 21 2HH1 ARG 21 -10.923 5.698 -0.435
176 H SER 22 H SER 22 -8.190 -2.115 -2.765
177 HA SER 22 HA SER 22 -8.271 -2.149 -5.685
178 1HB SER 22 1HB SER 22 -6.382 -3.060 -4.216
179 2HB SER 22 2HB SER 22 -7.443 -4.422 -3.871
180 HG SER 22 HG SER 22 -7.130 -5.150 -5.829
181 H VAL 23 H VAL 23 -9.773 -4.065 -3.067
182 HA VAL 23 HA VAL 23 -11.146 -5.916 -4.718
183 HB VAL 23 HB VAL 23 -12.123 -4.740 -2.099
184 1HG1 VAL 23 1HG1 VAL 23 -12.716 -7.321 -3.575
185 2HG1 VAL 23 2HG1 VAL 23 -13.202 -7.007 -1.909
186 3HG1 VAL 23 3HG1 VAL 23 -13.851 -6.020 -3.218
187 1HG2 VAL 23 1HG2 VAL 23 -9.756 -6.184 -2.645
188 2HG2 VAL 23 2HG2 VAL 23 -10.465 -5.859 -1.063
189 3HG2 VAL 23 3HG2 VAL 23 -10.876 -7.341 -1.925
190 H ILE 24 H ILE 24 -12.204 -2.726 -3.511
191 HA ILE 24 HA ILE 24 -14.612 -2.903 -5.231
192 HB ILE 24 HB ILE 24 -13.700 -0.830 -3.215
193 1HG1 ILE 24 1HG1 ILE 24 -15.817 -1.709 -2.061
194 2HG1 ILE 24 2HG1 ILE 24 -15.768 -3.041 -3.216
195 1HG2 ILE 24 1HG2 ILE 24 -15.968 -0.908 -5.172
196 2HG2 ILE 24 2HG2 ILE 24 -16.249 -0.194 -3.583
197 3HG2 ILE 24 3HG2 ILE 24 -14.998 0.466 -4.637
198 1HD1 ILE 24 1HD1 ILE 24 -13.248 -2.393 -1.752
199 2HD1 ILE 24 2HD1 ILE 24 -14.532 -3.197 -0.849
200 3HD1 ILE 24 3HD1 ILE 24 -13.861 -3.955 -2.294
201 H LYS 25 H LYS 25 -11.427 -1.716 -5.368
202 HA LYS 25 HA LYS 25 -10.368 -0.150 -6.781
203 1HB LYS 25 1HB LYS 25 -10.701 -1.922 -8.360
204 2HB LYS 25 2HB LYS 25 -12.407 -1.515 -8.549
205 1HG LYS 25 1HG LYS 25 -11.909 -0.053 -10.184
206 2HG LYS 25 2HG LYS 25 -10.819 0.817 -9.103
207 1HD LYS 25 1HD LYS 25 -9.230 0.129 -10.596
208 2HD LYS 25 2HD LYS 25 -9.297 -1.360 -9.653
209 1HE LYS 25 1HE LYS 25 -9.877 -2.430 -11.570
210 2HE LYS 25 2HE LYS 25 -11.420 -1.553 -11.509
211 1HZ LYS 25 1HZ LYS 25 -10.041 0.387 -12.440
212 2HZ LYS 25 2HZ LYS 25 -8.927 -0.809 -12.903
213 3HZ LYS 25 3HZ LYS 25 -10.511 -0.848 -13.507
214 H ALA 26 H ALA 26 -11.177 1.770 -5.673
215 HA ALA 26 HA ALA 26 -12.081 3.940 -5.838
216 1HB ALA 26 1HB ALA 26 -12.182 2.947 -8.500
217 2HB ALA 26 2HB ALA 26 -13.747 3.690 -8.167
218 3HB ALA 26 3HB ALA 26 -12.266 4.629 -7.972