NMR Restraints Grid
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NMR Restraints Grid |
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Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
24393 |
2k2d   |
15701 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H ASN 33 H ASN 33 -1.427 14.805 5.319
2 HA ASN 33 HA ASN 33 -3.717 15.573 3.811
3 HB2 ASN 33 1HB ASN 33 -2.272 17.248 4.860
4 HB3 ASN 33 2HB ASN 33 -0.916 16.733 3.864
5 HD21 ASN 33 2HD2 ASN 33 -4.021 18.354 3.869
6 HD22 ASN 33 1HD2 ASN 33 -3.800 19.198 2.377
7 H MET 34 H MET 34 -0.463 14.448 2.929
8 HA MET 34 HA MET 34 -1.323 13.983 0.198
9 HB2 MET 34 1HB MET 34 0.985 14.782 0.634
10 HB3 MET 34 2HB MET 34 1.310 13.311 1.541
11 HG2 MET 34 1HG MET 34 0.953 11.984 -0.470
12 HG3 MET 34 2HG MET 34 0.606 13.451 -1.382
13 HE1 MET 34 3HE MET 34 4.041 12.365 -2.834
14 HE2 MET 34 1HE MET 34 2.376 12.826 -3.196
15 HE3 MET 34 2HE MET 34 2.707 11.325 -2.330
16 H THR 35 H THR 35 -2.916 12.434 0.383
17 HA THR 35 HA THR 35 -2.152 9.848 1.520
18 HB THR 35 HB THR 35 -4.630 9.338 0.829
19 HG1 THR 35 HG1 THR 35 -5.613 11.008 0.044
20 HG21 THR 35 3HG2 THR 35 -3.822 9.310 3.116
21 HG22 THR 35 1HG2 THR 35 -5.402 10.096 3.030
22 HG23 THR 35 2HG2 THR 35 -3.939 11.067 3.204
23 H VAL 36 H VAL 36 -1.470 8.291 0.261
24 HA VAL 36 HA VAL 36 -2.320 8.265 -2.554
25 HB VAL 36 HB VAL 36 -0.321 6.897 -3.066
26 HG11 VAL 36 1HG1 VAL 36 -0.226 9.283 -3.468
27 HG12 VAL 36 2HG1 VAL 36 1.347 8.691 -2.936
28 HG13 VAL 36 3HG1 VAL 36 0.308 9.566 -1.811
29 HG21 VAL 36 3HG2 VAL 36 0.099 5.935 -0.856
30 HG22 VAL 36 1HG2 VAL 36 0.559 7.524 -0.244
31 HG23 VAL 36 2HG2 VAL 36 1.536 6.738 -1.486
32 H ASP 37 H ASP 37 -3.138 6.364 -3.365
33 HA ASP 37 HA ASP 37 -3.941 4.407 -1.361
34 HB2 ASP 37 1HB ASP 37 -5.635 5.404 -2.892
35 HB3 ASP 37 2HB ASP 37 -4.783 4.690 -4.254
36 H ILE 38 H ILE 38 -2.863 2.566 -1.149
37 HA ILE 38 HA ILE 38 -1.052 1.708 -3.321
38 HB ILE 38 HB ILE 38 0.342 0.618 -1.567
39 HG12 ILE 38 1HG1 ILE 38 -1.116 2.321 0.454
40 HG13 ILE 38 2HG1 ILE 38 -1.569 0.649 0.158
41 HG21 ILE 38 1HG2 ILE 38 1.420 2.687 -0.789
42 HG22 ILE 38 2HG2 ILE 38 0.015 3.605 -1.335
43 HG23 ILE 38 3HG2 ILE 38 1.011 2.737 -2.504
44 HD11 ILE 38 3HD1 ILE 38 1.118 1.606 1.109
45 HD12 ILE 38 1HD1 ILE 38 0.662 -0.073 0.819
46 HD13 ILE 38 2HD1 ILE 38 -0.131 0.849 2.099
47 H LEU 39 H LEU 39 -0.892 -0.483 -3.788
48 HA LEU 39 HA LEU 39 -3.072 -2.157 -2.729
49 HG LEU 39 HG LEU 39 -4.622 -2.009 -4.695
50 HB2 LEU 39 1HB LEU 39 -2.251 -1.575 -5.401
51 HB3 LEU 39 2HB LEU 39 -1.899 -3.263 -5.096
52 HD11 LEU 39 1HD1 LEU 39 -5.240 -3.124 -6.785
53 HD12 LEU 39 2HD1 LEU 39 -3.563 -3.620 -7.016
54 HD13 LEU 39 3HD1 LEU 39 -3.989 -1.908 -7.040
55 HD21 LEU 39 3HD2 LEU 39 -4.256 -4.022 -3.371
56 HD22 LEU 39 1HD2 LEU 39 -3.739 -4.891 -4.816
57 HD23 LEU 39 2HD2 LEU 39 -5.404 -4.327 -4.675
58 H CYS 40 H CYS 40 -2.563 -4.371 -2.275
59 HA CYS 40 HA CYS 40 0.189 -4.600 -1.326
60 HB2 CYS 40 1HB CYS 40 -2.049 -5.100 -0.010
61 HB3 CYS 40 2HB CYS 40 -1.872 -6.670 -0.783
62 H ASN 41 H ASN 41 1.520 -6.319 -1.783
63 HA ASN 41 HA ASN 41 0.943 -7.649 -4.294
64 HB2 ASN 41 1HB ASN 41 3.429 -7.527 -2.578
65 HB3 ASN 41 2HB ASN 41 3.321 -8.467 -4.058
66 HD21 ASN 41 2HD2 ASN 41 4.949 -7.319 -5.038
67 HD22 ASN 41 1HD2 ASN 41 4.743 -5.694 -5.595
68 H ASP 42 H ASP 42 1.131 -8.460 -0.861
69 HA ASP 42 HA ASP 42 1.081 -11.296 -1.550
70 HB2 ASP 42 1HB ASP 42 1.573 -11.768 0.781
71 HB3 ASP 42 2HB ASP 42 2.731 -10.618 0.134
72 H CYS 43 H CYS 43 -0.962 -8.947 0.252
73 HA CYS 43 HA CYS 43 -2.944 -11.097 0.418
74 HB2 CYS 43 1HB CYS 43 -4.010 -10.052 2.237
75 HB3 CYS 43 2HB CYS 43 -2.289 -9.942 2.551
76 H ASN 44 H ASN 44 -2.220 -8.649 -1.562
77 HA ASN 44 HA ASN 44 -3.200 -7.558 -3.252
78 HB2 ASN 44 1HB ASN 44 -4.959 -9.973 -3.012
79 HB3 ASN 44 2HB ASN 44 -5.129 -8.810 -4.321
80 HD21 ASN 44 2HD2 ASN 44 -4.518 -10.112 -5.912
81 HD22 ASN 44 1HD2 ASN 44 -2.925 -10.746 -6.118
82 H GLY 45 H GLY 45 -4.100 -6.618 -0.651
83 HA2 GLY 45 1HA GLY 45 -6.710 -5.512 -1.440
84 HA3 GLY 45 2HA GLY 45 -6.219 -5.754 0.235
85 H ARG 46 H ARG 46 -7.074 -3.281 -1.091
86 HA ARG 46 HA ARG 46 -4.537 -1.831 -1.093
87 HE ARG 46 HE ARG 46 -9.855 -0.466 -3.801
88 HB2 ARG 46 1HB ARG 46 -5.620 -0.049 -2.356
89 HB3 ARG 46 2HB ARG 46 -5.658 -1.585 -3.194
90 HG2 ARG 46 1HG ARG 46 -8.007 -1.844 -2.652
91 HG3 ARG 46 2HG ARG 46 -7.972 -0.329 -1.736
92 HD2 ARG 46 1HD ARG 46 -7.252 0.848 -3.779
93 HD3 ARG 46 2HD ARG 46 -7.395 -0.659 -4.676
94 HH11 ARG 46 1HH1 ARG 46 -7.798 2.161 -4.905
95 HH12 ARG 46 2HH1 ARG 46 -9.115 3.059 -5.603
96 HH21 ARG 46 1HH2 ARG 46 -11.580 0.733 -4.733
97 HH22 ARG 46 2HH2 ARG 46 -11.253 2.256 -5.496
98 H SER 47 H SER 47 -4.209 -0.008 -0.023
99 HA SER 47 HA SER 47 -6.119 0.704 2.091
100 HG SER 47 HG SER 47 -5.295 -1.223 3.079
101 HB2 SER 47 1HB SER 47 -3.109 0.383 2.380
102 HB3 SER 47 2HB SER 47 -4.203 0.945 3.644
103 H THR 48 H THR 48 -6.610 2.861 1.919
104 HA THR 48 HA THR 48 -4.733 4.614 0.559
105 HB THR 48 HB THR 48 -7.280 5.500 1.927
106 HG1 THR 48 HG1 THR 48 -6.883 4.134 -0.512
107 HG21 THR 48 3HG2 THR 48 -5.708 6.594 -0.415
108 HG22 THR 48 1HG2 THR 48 -5.719 7.261 1.220
109 HG23 THR 48 2HG2 THR 48 -7.188 7.290 0.245
110 H VAL 49 H VAL 49 -3.070 5.189 1.647
111 HA VAL 49 HA VAL 49 -3.278 5.996 4.470
112 HB VAL 49 HB VAL 49 -0.919 5.130 4.763
113 HG11 VAL 49 1HG1 VAL 49 -1.550 2.781 5.059
114 HG12 VAL 49 2HG1 VAL 49 -3.011 3.062 4.111
115 HG13 VAL 49 3HG1 VAL 49 -2.793 3.880 5.658
116 HG21 VAL 49 3HG2 VAL 49 -0.266 4.973 2.419
117 HG22 VAL 49 1HG2 VAL 49 -1.472 3.713 2.152
118 HG23 VAL 49 2HG2 VAL 49 -0.098 3.408 3.216
119 H GLN 50 H GLN 50 -1.176 7.375 5.010
120 HA GLN 50 HA GLN 50 -0.847 9.366 2.976
121 HB2 GLN 50 1HB GLN 50 0.760 10.420 4.451
122 HB3 GLN 50 2HB GLN 50 -0.653 9.939 5.375
123 HG2 GLN 50 1HG GLN 50 0.498 8.120 6.366
124 HG3 GLN 50 2HG GLN 50 1.851 8.284 5.250
125 HE21 GLN 50 2HE2 GLN 50 0.267 10.980 6.843
126 HE22 GLN 50 1HE2 GLN 50 1.607 11.407 7.845
127 H PHE 51 H PHE 51 1.150 9.900 1.914
128 HA PHE 51 HA PHE 51 2.665 7.590 1.132
129 HD1 PHE 51 HD2 PHE 51 3.259 7.213 -1.278
130 HD2 PHE 51 HD1 PHE 51 5.450 10.663 -0.108
131 HE1 PHE 51 HE2 PHE 51 5.193 6.408 -2.559
132 HE2 PHE 51 HE1 PHE 51 7.393 9.858 -1.381
133 HZ PHE 51 HZ PHE 51 7.264 7.731 -2.608
134 HB2 PHE 51 1HB PHE 51 2.164 9.429 -0.467
135 HB3 PHE 51 2HB PHE 51 3.208 10.496 0.474
136 H HIS 52 H HIS 52 4.075 6.768 2.401
137 HA HIS 52 HA HIS 52 5.779 8.505 4.048
138 HD1 HIS 52 HD1 HIS 52 6.525 5.135 6.700
139 HD2 HIS 52 HD2 HIS 52 5.451 9.153 6.767
140 HE1 HIS 52 HE1 HIS 52 7.609 6.089 8.757
141 HE2 HIS 52 HE2 HIS 52 6.927 8.518 8.798
142 HB2 HIS 52 1HB HIS 52 3.941 7.063 5.207
143 HB3 HIS 52 2HB HIS 52 4.998 5.703 4.850
144 H ILE 53 H ILE 53 7.726 8.466 3.265
145 HA ILE 53 HA ILE 53 8.628 6.601 1.322
146 HB ILE 53 HB ILE 53 10.315 8.593 2.864
147 HG12 ILE 53 1HG1 ILE 53 8.870 9.058 0.246
148 HG13 ILE 53 2HG1 ILE 53 8.233 9.568 1.802
149 HG21 ILE 53 1HG2 ILE 53 11.619 6.997 1.549
150 HG22 ILE 53 2HG2 ILE 53 11.713 8.611 0.843
151 HG23 ILE 53 3HG2 ILE 53 10.671 7.389 0.113
152 HD11 ILE 53 3HD1 ILE 53 10.164 11.027 2.116
153 HD12 ILE 53 1HD1 ILE 53 9.292 11.411 0.631
154 HD13 ILE 53 2HD1 ILE 53 10.807 10.510 0.557
155 H LEU 54 H LEU 54 9.045 6.861 4.799
156 HA LEU 54 HA LEU 54 11.151 4.893 4.936
157 HG LEU 54 HG LEU 54 10.811 7.855 6.107
158 HB2 LEU 54 1HB LEU 54 9.462 6.091 7.132
159 HB3 LEU 54 2HB LEU 54 10.893 5.110 7.371
160 HD11 LEU 54 1HD1 LEU 54 10.457 7.900 8.504
161 HD12 LEU 54 2HD1 LEU 54 12.059 8.522 8.107
162 HD13 LEU 54 3HD1 LEU 54 11.882 6.890 8.752
163 HD21 LEU 54 3HD2 LEU 54 13.172 6.063 6.693
164 HD22 LEU 54 1HD2 LEU 54 13.256 7.730 6.123
165 HD23 LEU 54 2HD2 LEU 54 12.559 6.480 5.092
166 H GLY 55 H GLY 55 7.911 4.547 4.325
167 HA2 GLY 55 1HA GLY 55 7.549 2.034 4.004
168 HA3 GLY 55 2HA GLY 55 7.762 1.972 5.745
169 H MET 56 H MET 56 5.548 2.028 3.330
170 HA MET 56 HA MET 56 3.432 3.208 4.983
171 HB2 MET 56 1HB MET 56 3.470 2.273 2.107
172 HB3 MET 56 2HB MET 56 2.005 2.787 2.933
173 HG2 MET 56 1HG MET 56 2.850 4.993 3.210
174 HG3 MET 56 2HG MET 56 4.443 4.516 2.634
175 HE1 MET 56 3HE MET 56 3.919 4.038 -1.168
176 HE2 MET 56 1HE MET 56 3.988 2.809 0.097
177 HE3 MET 56 2HE MET 56 5.088 4.187 0.143
178 H LYS 57 H LYS 57 2.582 1.872 6.424
179 HA LYS 57 HA LYS 57 2.885 -0.971 6.153
180 HB2 LYS 57 1HB LYS 57 3.216 0.062 8.346
181 HB3 LYS 57 2HB LYS 57 1.556 0.644 8.340
182 HG2 LYS 57 1HG LYS 57 0.738 -1.659 8.351
183 HG3 LYS 57 2HG LYS 57 2.394 -2.255 8.337
184 HD2 LYS 57 1HD LYS 57 1.373 -0.454 10.514
185 HD3 LYS 57 2HD LYS 57 1.156 -2.205 10.576
186 HE2 LYS 57 1HE LYS 57 3.694 -2.321 10.181
187 HE3 LYS 57 2HE LYS 57 3.701 -0.615 10.626
188 HZ1 LYS 57 3HZ LYS 57 4.154 -2.033 12.523
189 HZ2 LYS 57 1HZ LYS 57 2.680 -2.841 12.303
190 HZ3 LYS 57 2HZ LYS 57 2.693 -1.203 12.741
191 H CYS 58 H CYS 58 1.557 -2.235 5.161
192 HA CYS 58 HA CYS 58 -1.184 -1.688 4.613
193 HB2 CYS 58 1HB CYS 58 0.096 -3.231 3.231
194 HB3 CYS 58 2HB CYS 58 0.398 -4.263 4.611
195 H LYS 59 H LYS 59 -2.777 -1.729 6.022
196 HA LYS 59 HA LYS 59 -2.377 -2.596 8.733
197 HB2 LYS 59 1HB LYS 59 -4.880 -1.575 7.378
198 HB3 LYS 59 2HB LYS 59 -4.605 -1.677 9.110
199 HG2 LYS 59 1HG LYS 59 -3.019 0.055 9.068
200 HG3 LYS 59 2HG LYS 59 -2.886 -0.007 7.307
201 HD2 LYS 59 1HD LYS 59 -5.204 0.754 7.111
202 HD3 LYS 59 2HD LYS 59 -5.332 0.812 8.870
203 HE2 LYS 59 1HE LYS 59 -3.717 2.567 8.997
204 HE3 LYS 59 2HE LYS 59 -3.330 2.410 7.283
205 HZ1 LYS 59 3HZ LYS 59 -5.994 3.204 8.325
206 HZ2 LYS 59 1HZ LYS 59 -5.498 3.193 6.706
207 HZ3 LYS 59 2HZ LYS 59 -4.816 4.301 7.795
208 H ILE 60 H ILE 60 -3.181 -4.286 6.035
209 HA ILE 60 HA ILE 60 -5.297 -5.931 7.157
210 HB ILE 60 HB ILE 60 -3.988 -6.329 4.457
211 HG12 ILE 60 1HG1 ILE 60 -6.450 -4.630 4.825
212 HG13 ILE 60 2HG1 ILE 60 -4.852 -3.903 4.925
213 HG21 ILE 60 1HG2 ILE 60 -5.486 -8.092 5.217
214 HG22 ILE 60 2HG2 ILE 60 -6.203 -7.220 3.861
215 HG23 ILE 60 3HG2 ILE 60 -6.761 -6.906 5.505
216 HD11 ILE 60 3HD1 ILE 60 -5.940 -5.408 2.554
217 HD12 ILE 60 1HD1 ILE 60 -4.366 -4.620 2.658
218 HD13 ILE 60 2HD1 ILE 60 -5.841 -3.653 2.705
219 H CYS 61 H CYS 61 -1.828 -6.121 6.466
220 HA CYS 61 HA CYS 61 -1.777 -8.822 7.580
221 HB2 CYS 61 1HB CYS 61 -0.536 -9.789 5.752
222 HB3 CYS 61 2HB CYS 61 -2.029 -9.094 5.124
223 H GLU 62 H GLU 62 -0.454 -5.828 7.691
224 HA GLU 62 HA GLU 62 1.316 -4.937 8.810
225 HB2 GLU 62 1HB GLU 62 1.787 -7.807 9.605
226 HB3 GLU 62 2HB GLU 62 2.877 -6.519 10.091
227 HG2 GLU 62 1HG GLU 62 -0.059 -6.627 10.719
228 HG3 GLU 62 2HG GLU 62 1.235 -7.105 11.819
229 H SER 63 H SER 63 1.576 -5.927 5.967
230 HA SER 63 HA SER 63 4.482 -6.285 5.880
231 HG SER 63 HG SER 63 5.037 -7.856 3.641
232 HB2 SER 63 1HB SER 63 3.274 -8.123 4.848
233 HB3 SER 63 2HB SER 63 2.375 -7.005 3.830
234 H TYR 64 H TYR 64 5.751 -5.047 4.608
235 HA TYR 64 HA TYR 64 4.609 -2.518 3.670
236 HD1 TYR 64 HD1 TYR 64 5.826 -0.176 4.961
237 HD2 TYR 64 HD2 TYR 64 7.197 -3.886 6.517
238 HE1 TYR 64 HE1 TYR 64 5.567 0.695 7.245
239 HE2 TYR 64 HE2 TYR 64 6.937 -3.029 8.805
240 HH TYR 64 HH TYR 64 6.928 -0.742 9.926
241 HB2 TYR 64 1HB TYR 64 7.474 -3.355 4.173
242 HB3 TYR 64 2HB TYR 64 6.999 -1.785 3.541
243 H ASN 65 H ASN 65 5.121 -5.463 2.392
244 HA ASN 65 HA ASN 65 6.311 -4.753 -0.135
245 HB2 ASN 65 1HB ASN 65 6.542 -7.022 0.850
246 HB3 ASN 65 2HB ASN 65 4.808 -7.258 0.685
247 HD21 ASN 65 2HD2 ASN 65 5.133 -9.068 -0.599
248 HD22 ASN 65 1HD2 ASN 65 5.645 -8.943 -2.250
249 H THR 66 H THR 66 5.100 -3.125 -0.937
250 HA THR 66 HA THR 66 2.408 -3.747 -1.874
251 HB THR 66 HB THR 66 1.775 -1.332 -1.193
252 HG1 THR 66 HG1 THR 66 4.167 -1.726 0.207
253 HG21 THR 66 3HG2 THR 66 0.989 -2.029 1.015
254 HG22 THR 66 1HG2 THR 66 2.069 -3.424 0.966
255 HG23 THR 66 2HG2 THR 66 0.735 -3.299 -0.182
256 H ALA 67 H ALA 67 1.745 -2.554 -3.619
257 HA ALA 67 HA ALA 67 3.750 -0.921 -5.025
258 HB1 ALA 67 3HB ALA 67 2.550 -1.540 -7.083
259 HB2 ALA 67 1HB ALA 67 1.416 -2.503 -6.135
260 HB3 ALA 67 2HB ALA 67 3.112 -2.975 -6.226
261 H GLN 68 H GLN 68 2.319 0.683 -6.606
262 HA GLN 68 HA GLN 68 0.434 1.970 -4.772
263 HB2 GLN 68 1HB GLN 68 2.299 3.296 -5.905
264 HB3 GLN 68 2HB GLN 68 1.391 3.111 -7.399
265 HG2 GLN 68 1HG GLN 68 -0.538 4.220 -6.333
266 HG3 GLN 68 2HG GLN 68 0.434 4.471 -4.888
267 HE21 GLN 68 2HE2 GLN 68 0.272 6.676 -4.985
268 HE22 GLN 68 1HE2 GLN 68 1.079 7.635 -6.176
269 H ALA 69 H ALA 69 -1.685 1.972 -5.071
270 HA ALA 69 HA ALA 69 -2.807 0.509 -7.325
271 HB1 ALA 69 3HB ALA 69 -3.555 -0.016 -5.052
272 HB2 ALA 69 1HB ALA 69 -4.881 0.533 -6.077
273 HB3 ALA 69 2HB ALA 69 -4.174 1.628 -4.887
274 H GLY 70 H GLY 70 -2.100 3.697 -6.633
275 HA2 GLY 70 1HA GLY 70 -4.285 4.853 -8.160
276 HA3 GLY 70 2HA GLY 70 -2.912 5.714 -7.480
277 H GLY 71 H GLY 71 -2.876 2.886 -9.608
278 HA2 GLY 71 1HA GLY 71 -0.967 4.048 -11.399
279 HA3 GLY 71 2HA GLY 71 -1.752 2.486 -11.574
280 H ARG 72 H ARG 72 -1.330 5.253 -13.074
281 HA ARG 72 HA ARG 72 -4.014 6.103 -13.656
282 HE ARG 72 HE ARG 72 0.145 8.579 -11.724
283 HB2 ARG 72 1HB ARG 72 -1.465 6.927 -15.060
284 HB3 ARG 72 2HB ARG 72 -2.974 7.827 -14.961
285 HG2 ARG 72 1HG ARG 72 -2.656 8.269 -12.650
286 HG3 ARG 72 2HG ARG 72 -1.293 7.155 -12.561
287 HD2 ARG 72 1HD ARG 72 -0.302 8.743 -14.407
288 HD3 ARG 72 2HD ARG 72 -1.440 9.898 -13.713
289 HH11 ARG 72 1HH1 ARG 72 0.120 11.277 -13.974
290 HH12 ARG 72 2HH1 ARG 72 1.373 12.136 -13.132
291 HH21 ARG 72 1HH2 ARG 72 1.777 9.701 -10.639
292 HH22 ARG 72 2HH2 ARG 72 2.307 11.242 -11.231
293 H ARG 73 H ARG 73 -5.238 5.655 -15.404
294 HA ARG 73 HA ARG 73 -4.382 3.508 -17.142
295 HE ARG 73 HE ARG 73 -8.104 2.770 -20.528
296 HB2 ARG 73 1HB ARG 73 -6.677 3.541 -16.241
297 HB3 ARG 73 2HB ARG 73 -6.985 5.052 -17.088
298 HG2 ARG 73 1HG ARG 73 -6.387 3.739 -19.222
299 HG3 ARG 73 2HG ARG 73 -6.610 2.301 -18.223
300 HD2 ARG 73 1HD ARG 73 -8.868 2.866 -17.774
301 HD3 ARG 73 2HD ARG 73 -8.660 4.471 -18.470
302 HH11 ARG 73 1HH1 ARG 73 -10.869 3.146 -18.384
303 HH12 ARG 73 2HH1 ARG 73 -12.018 2.698 -19.605
304 HH21 ARG 73 1HH2 ARG 73 -9.617 2.212 -22.113
305 HH22 ARG 73 2HH2 ARG 73 -11.311 2.166 -21.719
306 H ILE 74 H ILE 74 -3.378 3.812 -18.976
307 HA ILE 74 HA ILE 74 -3.929 6.257 -20.496
308 HB ILE 74 HB ILE 74 -1.602 6.224 -19.768
309 HG12 ILE 74 1HG1 ILE 74 -1.643 5.549 -22.716
310 HG13 ILE 74 2HG1 ILE 74 -2.171 7.092 -22.058
311 HG21 ILE 74 1HG2 ILE 74 -1.263 3.869 -19.411
312 HG22 ILE 74 2HG2 ILE 74 -0.014 4.494 -20.490
313 HG23 ILE 74 3HG2 ILE 74 -1.359 3.557 -21.144
314 HD11 ILE 74 3HD1 ILE 74 0.608 5.950 -21.834
315 HD12 ILE 74 1HD1 ILE 74 0.072 7.508 -21.205
316 HD13 ILE 74 2HD1 ILE 74 0.093 7.220 -22.945
317 H SER 75 H SER 75 -4.471 6.090 -22.641
318 HA SER 75 HA SER 75 -5.411 3.488 -23.509
319 HG SER 75 HG SER 75 -6.996 5.307 -26.210
320 HB2 SER 75 1HB SER 75 -6.881 5.458 -23.720
321 HB3 SER 75 2HB SER 75 -5.701 6.223 -24.780
322 H LEU 76 H LEU 76 -4.041 2.205 -24.506
323 HA LEU 76 HA LEU 76 -2.699 3.193 -26.877
324 HG LEU 76 HG LEU 76 -1.312 0.305 -24.944
325 HB2 LEU 76 1HB LEU 76 -0.552 2.286 -26.422
326 HB3 LEU 76 2HB LEU 76 -0.974 3.298 -25.063
327 HD11 LEU 76 1HD1 LEU 76 0.905 0.184 -23.936
328 HD12 LEU 76 2HD1 LEU 76 1.148 1.902 -24.256
329 HD13 LEU 76 3HD1 LEU 76 0.988 0.769 -25.598
330 HD21 LEU 76 3HD2 LEU 76 -1.049 0.668 -22.537
331 HD22 LEU 76 1HD2 LEU 76 -2.395 1.614 -23.176
332 HD23 LEU 76 2HD2 LEU 76 -0.858 2.400 -22.814
333 H ASP 77 H ASP 77 -2.685 1.755 -28.506
334 HA ASP 77 HA ASP 77 -4.254 -0.662 -28.080
335 HB2 ASP 77 1HB ASP 77 -4.898 0.850 -29.906
336 HB3 ASP 77 2HB ASP 77 -3.308 0.658 -30.636
337 H GLN 78 H GLN 78 -3.247 -2.469 -27.628
338 HA GLN 78 HA GLN 78 -0.680 -3.025 -28.918
339 HB2 GLN 78 1HB GLN 78 0.098 -4.085 -26.787
340 HB3 GLN 78 2HB GLN 78 -0.079 -2.341 -26.705
341 HG2 GLN 78 1HG GLN 78 -2.237 -2.638 -25.539
342 HG3 GLN 78 2HG GLN 78 -2.001 -4.385 -25.595
343 HE21 GLN 78 2HE2 GLN 78 -1.016 -1.409 -24.167
344 HE22 GLN 78 1HE2 GLN 78 -0.090 -2.083 -22.873
345 H GLN 79 H GLN 79 -0.683 -4.859 -29.996
346 HA GLN 79 HA GLN 79 -2.631 -6.916 -29.226
347 HB2 GLN 79 1HB GLN 79 -2.839 -5.861 -31.525
348 HB3 GLN 79 2HB GLN 79 -1.325 -6.656 -31.931
349 HG2 GLN 79 1HG GLN 79 -2.337 -8.830 -31.496
350 HG3 GLN 79 2HG GLN 79 -3.848 -8.047 -31.050
351 HE21 GLN 79 2HE2 GLN 79 -5.131 -7.119 -32.648
352 HE22 GLN 79 1HE2 GLN 79 -4.925 -7.497 -34.322
Start of MODEL 2
1 H ASN 33 H ASN 33 -0.330 16.755 4.710
2 HA ASN 33 HA ASN 33 0.020 13.984 5.572
3 HB2 ASN 33 1HB ASN 33 -0.993 15.433 7.444
4 HB3 ASN 33 2HB ASN 33 -2.432 15.526 6.428
5 HD21 ASN 33 2HD2 ASN 33 -0.445 13.504 8.413
6 HD22 ASN 33 1HD2 ASN 33 -1.534 12.161 8.492
7 H MET 34 H MET 34 -0.118 13.257 3.506
8 HA MET 34 HA MET 34 -2.688 13.651 2.128
9 HB2 MET 34 1HB MET 34 -0.769 14.570 0.872
10 HB3 MET 34 2HB MET 34 0.012 12.997 0.922
11 HG2 MET 34 1HG MET 34 -1.841 12.056 -0.393
12 HG3 MET 34 2HG MET 34 -2.576 13.655 -0.472
13 HE1 MET 34 3HE MET 34 0.366 11.356 -1.651
14 HE2 MET 34 1HE MET 34 1.244 12.606 -0.769
15 HE3 MET 34 2HE MET 34 1.398 12.493 -2.521
16 H THR 35 H THR 35 -3.944 11.887 2.248
17 HA THR 35 HA THR 35 -2.662 9.318 2.778
18 HB THR 35 HB THR 35 -5.065 8.578 3.263
19 HG1 THR 35 HG1 THR 35 -6.202 10.283 2.341
20 HG21 THR 35 3HG2 THR 35 -3.430 8.990 5.025
21 HG22 THR 35 1HG2 THR 35 -5.023 9.566 5.515
22 HG23 THR 35 2HG2 THR 35 -3.795 10.716 4.980
23 H VAL 36 H VAL 36 -2.488 7.808 1.333
24 HA VAL 36 HA VAL 36 -4.083 7.934 -1.139
25 HB VAL 36 HB VAL 36 -2.196 6.767 -2.273
26 HG11 VAL 36 1HG1 VAL 36 -1.459 9.404 -1.005
27 HG12 VAL 36 2HG1 VAL 36 -2.409 9.177 -2.474
28 HG13 VAL 36 3HG1 VAL 36 -0.708 8.712 -2.446
29 HG21 VAL 36 3HG2 VAL 36 -0.670 7.321 0.278
30 HG22 VAL 36 1HG2 VAL 36 0.028 6.719 -1.226
31 HG23 VAL 36 2HG2 VAL 36 -1.128 5.731 -0.332
32 H ASP 37 H ASP 37 -4.587 5.863 -2.097
33 HA ASP 37 HA ASP 37 -4.882 3.720 -0.121
34 HB2 ASP 37 1HB ASP 37 -6.234 4.320 -2.732
35 HB3 ASP 37 2HB ASP 37 -6.303 2.705 -2.031
36 H ILE 38 H ILE 38 -3.654 2.021 -0.139
37 HA ILE 38 HA ILE 38 -2.166 1.355 -2.605
38 HB ILE 38 HB ILE 38 -0.445 0.283 -1.142
39 HG12 ILE 38 1HG1 ILE 38 -1.523 1.916 1.152
40 HG13 ILE 38 2HG1 ILE 38 -2.076 0.266 0.891
41 HG21 ILE 38 1HG2 ILE 38 -0.869 3.243 -0.807
42 HG22 ILE 38 2HG2 ILE 38 -0.066 2.436 -2.154
43 HG23 ILE 38 3HG2 ILE 38 0.655 2.394 -0.545
44 HD11 ILE 38 3HD1 ILE 38 -0.337 0.179 2.481
45 HD12 ILE 38 1HD1 ILE 38 0.707 1.196 1.486
46 HD13 ILE 38 2HD1 ILE 38 0.316 -0.437 0.962
47 H LEU 39 H LEU 39 -2.364 -0.635 -3.391
48 HA LEU 39 HA LEU 39 -4.010 -2.549 -1.880
49 HG LEU 39 HG LEU 39 -6.066 -3.098 -3.040
50 HB2 LEU 39 1HB LEU 39 -4.626 -1.369 -4.208
51 HB3 LEU 39 2HB LEU 39 -3.677 -2.697 -4.838
52 HD11 LEU 39 1HD1 LEU 39 -7.330 -3.587 -5.080
53 HD12 LEU 39 2HD1 LEU 39 -5.950 -3.074 -6.053
54 HD13 LEU 39 3HD1 LEU 39 -6.785 -1.911 -5.024
55 HD21 LEU 39 3HD2 LEU 39 -4.633 -4.953 -4.941
56 HD22 LEU 39 1HD2 LEU 39 -6.066 -5.345 -3.990
57 HD23 LEU 39 2HD2 LEU 39 -4.540 -4.994 -3.179
58 H CYS 40 H CYS 40 -3.001 -4.364 -1.276
59 HA CYS 40 HA CYS 40 -0.256 -4.812 -1.781
60 HB2 CYS 40 1HB CYS 40 -2.393 -6.250 -0.352
61 HB3 CYS 40 2HB CYS 40 -1.005 -7.198 -0.860
62 H ASN 41 H ASN 41 0.818 -6.366 -2.798
63 HA ASN 41 HA ASN 41 -0.522 -7.769 -4.978
64 HB2 ASN 41 1HB ASN 41 2.410 -7.578 -4.238
65 HB3 ASN 41 2HB ASN 41 1.768 -8.316 -5.700
66 HD21 ASN 41 2HD2 ASN 41 3.588 -5.982 -5.202
67 HD22 ASN 41 1HD2 ASN 41 2.880 -4.679 -6.098
68 H ASP 42 H ASP 42 0.162 -8.293 -1.761
69 HA ASP 42 HA ASP 42 0.621 -11.166 -2.065
70 HB2 ASP 42 1HB ASP 42 1.269 -10.942 0.438
71 HB3 ASP 42 2HB ASP 42 2.396 -10.369 -0.789
72 H CYS 43 H CYS 43 -1.163 -8.982 0.191
73 HA CYS 43 HA CYS 43 -2.951 -11.195 0.774
74 HB2 CYS 43 1HB CYS 43 -3.805 -9.949 2.616
75 HB3 CYS 43 2HB CYS 43 -2.072 -9.662 2.607
76 H ASN 44 H ASN 44 -2.748 -8.780 -1.469
77 HA ASN 44 HA ASN 44 -4.088 -7.781 -2.979
78 HB2 ASN 44 1HB ASN 44 -5.809 -10.204 -2.407
79 HB3 ASN 44 2HB ASN 44 -6.089 -9.090 -3.742
80 HD21 ASN 44 2HD2 ASN 44 -4.639 -9.049 -5.467
81 HD22 ASN 44 1HD2 ASN 44 -3.523 -10.346 -5.741
82 H GLY 45 H GLY 45 -4.327 -6.853 -0.326
83 HA2 GLY 45 1HA GLY 45 -7.098 -5.878 -0.317
84 HA3 GLY 45 2HA GLY 45 -6.226 -6.262 1.162
85 H ARG 46 H ARG 46 -7.442 -3.780 0.318
86 HA ARG 46 HA ARG 46 -5.134 -2.066 -0.231
87 HE ARG 46 HE ARG 46 -8.688 1.113 -0.536
88 HB2 ARG 46 1HB ARG 46 -6.822 -0.306 -0.712
89 HB3 ARG 46 2HB ARG 46 -6.955 -1.714 -1.750
90 HG2 ARG 46 1HG ARG 46 -8.835 -2.525 -0.432
91 HG3 ARG 46 2HG ARG 46 -8.702 -1.123 0.632
92 HD2 ARG 46 1HD ARG 46 -9.064 -0.825 -2.320
93 HD3 ARG 46 2HD ARG 46 -10.441 -1.075 -1.256
94 HH11 ARG 46 1HH1 ARG 46 -11.581 0.110 -2.266
95 HH12 ARG 46 2HH1 ARG 46 -12.226 1.720 -2.337
96 HH21 ARG 46 1HH2 ARG 46 -9.571 3.195 -0.636
97 HH22 ARG 46 2HH2 ARG 46 -11.103 3.450 -1.424
98 H SER 47 H SER 47 -4.876 -0.101 0.890
99 HA SER 47 HA SER 47 -6.038 0.127 3.561
100 HG SER 47 HG SER 47 -4.737 -1.753 4.246
101 HB2 SER 47 1HB SER 47 -3.050 0.155 3.011
102 HB3 SER 47 2HB SER 47 -3.815 0.445 4.571
103 H THR 48 H THR 48 -6.639 2.242 3.855
104 HA THR 48 HA THR 48 -5.413 4.291 2.189
105 HB THR 48 HB THR 48 -7.368 4.848 4.416
106 HG1 THR 48 HG1 THR 48 -7.854 3.847 1.795
107 HG21 THR 48 3HG2 THR 48 -6.263 6.762 3.383
108 HG22 THR 48 1HG2 THR 48 -7.973 6.734 2.941
109 HG23 THR 48 2HG2 THR 48 -6.748 6.204 1.782
110 H VAL 49 H VAL 49 -3.544 5.009 2.747
111 HA VAL 49 HA VAL 49 -2.810 5.247 5.589
112 HB VAL 49 HB VAL 49 -0.499 4.486 4.949
113 HG11 VAL 49 1HG1 VAL 49 -2.691 2.465 4.507
114 HG12 VAL 49 2HG1 VAL 49 -2.026 2.959 6.066
115 HG13 VAL 49 3HG1 VAL 49 -1.014 2.098 4.905
116 HG21 VAL 49 3HG2 VAL 49 -0.239 3.157 2.888
117 HG22 VAL 49 1HG2 VAL 49 -0.582 4.857 2.559
118 HG23 VAL 49 2HG2 VAL 49 -1.858 3.653 2.388
119 H GLN 50 H GLN 50 -1.039 6.780 5.968
120 HA GLN 50 HA GLN 50 -1.085 9.030 4.185
121 HB2 GLN 50 1HB GLN 50 -0.664 8.883 6.816
122 HB3 GLN 50 2HB GLN 50 1.009 8.729 6.307
123 HG2 GLN 50 1HG GLN 50 -0.732 10.989 5.371
124 HG3 GLN 50 2HG GLN 50 0.137 11.054 6.901
125 HE21 GLN 50 2HE2 GLN 50 2.479 9.653 5.916
126 HE22 GLN 50 1HE2 GLN 50 3.301 10.744 4.859
127 H PHE 51 H PHE 51 0.417 9.587 2.672
128 HA PHE 51 HA PHE 51 1.854 7.524 1.408
129 HD1 PHE 51 HD2 PHE 51 1.840 7.531 -1.232
130 HD2 PHE 51 HD1 PHE 51 4.090 10.937 -0.048
131 HE1 PHE 51 HE2 PHE 51 3.421 7.119 -3.070
132 HE2 PHE 51 HE1 PHE 51 5.683 10.525 -1.877
133 HZ PHE 51 HZ PHE 51 5.346 8.616 -3.391
134 HB2 PHE 51 1HB PHE 51 0.874 9.424 0.203
135 HB3 PHE 51 2HB PHE 51 2.023 10.512 0.973
136 H HIS 52 H HIS 52 3.559 6.642 2.161
137 HA HIS 52 HA HIS 52 5.603 8.230 3.509
138 HD1 HIS 52 HD1 HIS 52 7.187 4.092 4.603
139 HD2 HIS 52 HD2 HIS 52 6.837 8.035 5.837
140 HE1 HIS 52 HE1 HIS 52 9.067 4.460 6.218
141 HE2 HIS 52 HE2 HIS 52 8.924 6.894 6.835
142 HB2 HIS 52 1HB HIS 52 4.522 6.247 4.685
143 HB3 HIS 52 2HB HIS 52 5.307 5.213 3.502
144 H ILE 53 H ILE 53 7.379 8.681 2.414
145 HA ILE 53 HA ILE 53 7.675 7.912 -0.292
146 HB ILE 53 HB ILE 53 9.454 9.476 1.581
147 HG12 ILE 53 1HG1 ILE 53 8.893 11.270 -0.228
148 HG13 ILE 53 2HG1 ILE 53 7.577 10.190 -0.654
149 HG21 ILE 53 1HG2 ILE 53 10.959 8.407 0.002
150 HG22 ILE 53 2HG2 ILE 53 10.857 10.140 -0.308
151 HG23 ILE 53 3HG2 ILE 53 9.994 9.005 -1.349
152 HD11 ILE 53 3HD1 ILE 53 8.011 11.476 2.037
153 HD12 ILE 53 1HD1 ILE 53 6.687 10.393 1.613
154 HD13 ILE 53 2HD1 ILE 53 6.826 11.966 0.825
155 H LEU 54 H LEU 54 9.041 6.704 2.685
156 HA LEU 54 HA LEU 54 10.908 4.949 1.316
157 HG LEU 54 HG LEU 54 12.757 5.791 4.414
158 HB2 LEU 54 1HB LEU 54 10.266 5.340 4.236
159 HB3 LEU 54 2HB LEU 54 11.348 4.088 3.671
160 HD11 LEU 54 1HD1 LEU 54 12.494 6.222 1.451
161 HD12 LEU 54 2HD1 LEU 54 13.452 4.975 2.251
162 HD13 LEU 54 3HD1 LEU 54 13.881 6.677 2.442
163 HD21 LEU 54 3HD2 LEU 54 11.051 7.799 2.961
164 HD22 LEU 54 1HD2 LEU 54 12.548 8.159 3.824
165 HD23 LEU 54 2HD2 LEU 54 11.142 7.560 4.706
166 H GLY 55 H GLY 55 7.730 4.788 1.424
167 HA2 GLY 55 1HA GLY 55 6.835 2.717 0.473
168 HA3 GLY 55 2HA GLY 55 7.749 1.851 1.695
169 H MET 56 H MET 56 4.768 2.778 0.845
170 HA MET 56 HA MET 56 3.636 3.411 3.402
171 HB2 MET 56 1HB MET 56 2.398 2.524 0.792
172 HB3 MET 56 2HB MET 56 1.458 2.877 2.229
173 HG2 MET 56 1HG MET 56 1.312 4.787 0.909
174 HG3 MET 56 2HG MET 56 2.471 5.190 2.167
175 HE1 MET 56 3HE MET 56 3.606 4.316 -2.238
176 HE2 MET 56 1HE MET 56 1.944 4.380 -1.656
177 HE3 MET 56 2HE MET 56 3.001 3.059 -1.160
178 H LYS 57 H LYS 57 2.664 2.058 4.868
179 HA LYS 57 HA LYS 57 3.061 -0.815 4.397
180 HB2 LYS 57 1HB LYS 57 4.394 0.090 6.229
181 HB3 LYS 57 2HB LYS 57 2.949 0.713 7.006
182 HG2 LYS 57 1HG LYS 57 2.163 -1.495 7.472
183 HG3 LYS 57 2HG LYS 57 3.441 -2.216 6.496
184 HD2 LYS 57 1HD LYS 57 3.959 -2.419 8.863
185 HD3 LYS 57 2HD LYS 57 5.116 -1.356 8.069
186 HE2 LYS 57 1HE LYS 57 4.472 -0.454 10.232
187 HE3 LYS 57 2HE LYS 57 3.913 0.595 8.933
188 HZ1 LYS 57 3HZ LYS 57 1.707 -0.263 9.174
189 HZ2 LYS 57 1HZ LYS 57 2.249 0.245 10.695
190 HZ3 LYS 57 2HZ LYS 57 2.208 -1.409 10.316
191 H CYS 58 H CYS 58 1.400 -2.033 4.164
192 HA CYS 58 HA CYS 58 -1.297 -1.130 4.388
193 HB2 CYS 58 1HB CYS 58 -1.018 -2.631 2.688
194 HB3 CYS 58 2HB CYS 58 0.167 -3.573 3.549
195 H LYS 59 H LYS 59 -2.758 -1.419 6.001
196 HA LYS 59 HA LYS 59 -1.750 -2.096 8.601
197 HB2 LYS 59 1HB LYS 59 -4.276 -0.959 7.532
198 HB3 LYS 59 2HB LYS 59 -4.358 -1.749 9.094
199 HG2 LYS 59 1HG LYS 59 -4.074 0.643 9.340
200 HG3 LYS 59 2HG LYS 59 -2.675 -0.221 9.971
201 HD2 LYS 59 1HD LYS 59 -1.335 0.402 8.152
202 HD3 LYS 59 2HD LYS 59 -2.724 0.892 7.184
203 HE2 LYS 59 1HE LYS 59 -1.835 2.265 9.715
204 HE3 LYS 59 2HE LYS 59 -1.392 2.791 8.093
205 HZ1 LYS 59 3HZ LYS 59 -3.230 4.084 8.740
206 HZ2 LYS 59 1HZ LYS 59 -4.094 2.740 9.309
207 HZ3 LYS 59 2HZ LYS 59 -3.844 2.945 7.648
208 H ILE 60 H ILE 60 -3.318 -3.900 6.165
209 HA ILE 60 HA ILE 60 -4.744 -5.742 7.817
210 HB ILE 60 HB ILE 60 -3.863 -6.036 4.928
211 HG12 ILE 60 1HG1 ILE 60 -6.555 -5.184 6.018
212 HG13 ILE 60 2HG1 ILE 60 -5.335 -4.068 5.420
213 HG21 ILE 60 1HG2 ILE 60 -5.632 -7.723 4.733
214 HG22 ILE 60 2HG2 ILE 60 -5.965 -7.576 6.459
215 HG23 ILE 60 3HG2 ILE 60 -4.410 -8.203 5.909
216 HD11 ILE 60 3HD1 ILE 60 -6.721 -6.195 3.806
217 HD12 ILE 60 1HD1 ILE 60 -5.507 -5.070 3.202
218 HD13 ILE 60 2HD1 ILE 60 -7.066 -4.466 3.766
219 H CYS 61 H CYS 61 -1.542 -5.776 6.265
220 HA CYS 61 HA CYS 61 -0.975 -8.293 7.671
221 HB2 CYS 61 1HB CYS 61 -0.202 -9.394 5.698
222 HB3 CYS 61 2HB CYS 61 -1.783 -8.696 5.320
223 H GLU 62 H GLU 62 0.007 -5.209 7.020
224 HA GLU 62 HA GLU 62 1.823 -3.988 7.564
225 HB2 GLU 62 1HB GLU 62 2.829 -6.538 8.833
226 HB3 GLU 62 2HB GLU 62 3.577 -4.959 9.036
227 HG2 GLU 62 1HG GLU 62 0.754 -5.650 9.822
228 HG3 GLU 62 2HG GLU 62 2.132 -5.626 10.928
229 H SER 63 H SER 63 1.731 -5.526 5.026
230 HA SER 63 HA SER 63 4.558 -5.857 4.405
231 HG SER 63 HG SER 63 3.404 -7.322 1.273
232 HB2 SER 63 1HB SER 63 3.015 -7.645 3.693
233 HB3 SER 63 2HB SER 63 2.090 -6.477 2.754
234 H TYR 64 H TYR 64 5.559 -4.790 2.785
235 HA TYR 64 HA TYR 64 4.488 -2.151 2.115
236 HD1 TYR 64 HD2 TYR 64 7.015 -3.793 4.488
237 HD2 TYR 64 HD1 TYR 64 6.655 0.120 2.877
238 HE1 TYR 64 HE2 TYR 64 7.351 -2.840 6.737
239 HE2 TYR 64 HE1 TYR 64 6.988 1.081 5.104
240 HH TYR 64 HH TYR 64 6.754 0.494 7.404
241 HB2 TYR 64 1HB TYR 64 7.279 -3.311 2.035
242 HB3 TYR 64 2HB TYR 64 6.879 -1.710 1.426
243 H ASN 65 H ASN 65 4.786 -5.201 0.766
244 HA ASN 65 HA ASN 65 5.385 -4.504 -1.952
245 HB2 ASN 65 1HB ASN 65 5.889 -6.730 -1.039
246 HB3 ASN 65 2HB ASN 65 4.177 -7.014 -0.764
247 HD21 ASN 65 2HD2 ASN 65 3.957 -8.759 -2.045
248 HD22 ASN 65 1HD2 ASN 65 4.163 -8.738 -3.760
249 H THR 66 H THR 66 3.978 -3.001 -2.696
250 HA THR 66 HA THR 66 1.167 -3.728 -2.969
251 HB THR 66 HB THR 66 0.535 -1.353 -2.256
252 HG1 THR 66 HG1 THR 66 3.195 -1.509 -1.323
253 HG21 THR 66 3HG2 THR 66 -0.003 -3.295 -0.860
254 HG22 THR 66 1HG2 THR 66 0.386 -1.886 0.115
255 HG23 THR 66 2HG2 THR 66 1.574 -3.170 -0.082
256 H ALA 67 H ALA 67 0.017 -2.132 -4.250
257 HA ALA 67 HA ALA 67 1.639 -0.557 -6.137
258 HB1 ALA 67 3HB ALA 67 -0.031 -1.122 -7.872
259 HB2 ALA 67 1HB ALA 67 -0.850 -2.189 -6.730
260 HB3 ALA 67 2HB ALA 67 0.786 -2.566 -7.272
261 H GLN 68 H GLN 68 0.654 1.497 -6.624
262 HA GLN 68 HA GLN 68 -1.125 2.373 -4.537
263 HB2 GLN 68 1HB GLN 68 0.763 3.774 -5.435
264 HB3 GLN 68 2HB GLN 68 -0.178 3.984 -6.907
265 HG2 GLN 68 1HG GLN 68 -1.935 5.085 -5.669
266 HG3 GLN 68 2HG GLN 68 -1.096 4.782 -4.152
267 HE21 GLN 68 2HE2 GLN 68 -1.961 7.276 -5.369
268 HE22 GLN 68 1HE2 GLN 68 -0.537 8.259 -5.507
269 H ALA 69 H ALA 69 -3.206 2.141 -4.608
270 HA ALA 69 HA ALA 69 -4.622 1.493 -7.026
271 HB1 ALA 69 3HB ALA 69 -6.559 1.222 -5.555
272 HB2 ALA 69 1HB ALA 69 -5.638 1.899 -4.211
273 HB3 ALA 69 2HB ALA 69 -5.156 0.359 -4.924
274 H GLY 70 H GLY 70 -5.105 3.050 -8.387
275 HA2 GLY 70 1HA GLY 70 -6.381 4.992 -8.986
276 HA3 GLY 70 2HA GLY 70 -6.108 5.626 -7.367
277 H GLY 71 H GLY 71 -3.261 4.291 -8.227
278 HA2 GLY 71 1HA GLY 71 -2.054 6.868 -8.785
279 HA3 GLY 71 2HA GLY 71 -1.214 5.357 -8.468
280 H ARG 72 H ARG 72 -0.536 7.195 -10.499
281 HA ARG 72 HA ARG 72 -1.663 6.369 -13.008
282 HE ARG 72 HE ARG 72 -1.688 9.703 -15.075
283 HB2 ARG 72 1HB ARG 72 0.760 8.091 -12.453
284 HB3 ARG 72 2HB ARG 72 -0.041 7.911 -14.006
285 HG2 ARG 72 1HG ARG 72 -1.256 9.116 -11.527
286 HG3 ARG 72 2HG ARG 72 -0.644 10.003 -12.922
287 HD2 ARG 72 1HD ARG 72 -2.883 7.989 -13.035
288 HD3 ARG 72 2HD ARG 72 -3.123 9.728 -12.882
289 HH11 ARG 72 1HH1 ARG 72 -4.224 7.441 -14.205
290 HH12 ARG 72 2HH1 ARG 72 -4.724 7.184 -15.843
291 HH21 ARG 72 1HH2 ARG 72 -2.346 9.366 -17.210
292 HH22 ARG 72 2HH2 ARG 72 -3.662 8.279 -17.551
293 H ARG 73 H ARG 73 -0.620 5.338 -14.701
294 HA ARG 73 HA ARG 73 1.626 3.617 -13.903
295 HE ARG 73 HE ARG 73 0.391 0.750 -13.162
296 HB2 ARG 73 1HB ARG 73 -0.436 2.334 -14.030
297 HB3 ARG 73 2HB ARG 73 -0.777 2.975 -15.627
298 HG2 ARG 73 1HG ARG 73 -0.007 0.683 -15.767
299 HG3 ARG 73 2HG ARG 73 1.158 1.768 -16.524
300 HD2 ARG 73 1HD ARG 73 2.220 0.013 -15.164
301 HD3 ARG 73 2HD ARG 73 2.597 1.638 -14.600
302 HH11 ARG 73 1HH1 ARG 73 3.744 -0.189 -13.559
303 HH12 ARG 73 2HH1 ARG 73 3.907 -0.742 -11.920
304 HH21 ARG 73 1HH2 ARG 73 0.595 0.034 -11.037
305 HH22 ARG 73 2HH2 ARG 73 2.106 -0.628 -10.484
306 H ILE 74 H ILE 74 3.395 4.247 -14.940
307 HA ILE 74 HA ILE 74 3.253 5.265 -17.657
308 HB ILE 74 HB ILE 74 5.735 5.401 -17.546
309 HG12 ILE 74 1HG1 ILE 74 5.444 4.666 -14.622
310 HG13 ILE 74 2HG1 ILE 74 5.982 3.528 -15.850
311 HG21 ILE 74 1HG2 ILE 74 5.791 7.258 -15.935
312 HG22 ILE 74 2HG2 ILE 74 4.216 6.754 -15.323
313 HG23 ILE 74 3HG2 ILE 74 4.377 7.315 -16.990
314 HD11 ILE 74 3HD1 ILE 74 7.865 4.437 -14.645
315 HD12 ILE 74 1HD1 ILE 74 7.365 6.079 -15.055
316 HD13 ILE 74 2HD1 ILE 74 7.902 4.978 -16.323
317 H SER 75 H SER 75 4.464 4.299 -19.387
318 HA SER 75 HA SER 75 4.780 2.638 -20.875
319 HG SER 75 HG SER 75 7.286 2.499 -20.386
320 HB2 SER 75 1HB SER 75 5.752 1.061 -18.480
321 HB3 SER 75 2HB SER 75 6.047 0.653 -20.172
322 H LEU 76 H LEU 76 2.480 2.600 -21.156
323 HA LEU 76 HA LEU 76 1.297 0.057 -20.263
324 HG LEU 76 HG LEU 76 -1.459 0.479 -21.342
325 HB2 LEU 76 1HB LEU 76 0.143 2.036 -19.322
326 HB3 LEU 76 2HB LEU 76 -0.158 2.612 -20.951
327 HD11 LEU 76 1HD1 LEU 76 -1.220 0.296 -18.345
328 HD12 LEU 76 2HD1 LEU 76 -0.563 -0.841 -19.522
329 HD13 LEU 76 3HD1 LEU 76 -2.309 -0.664 -19.345
330 HD21 LEU 76 3HD2 LEU 76 -3.454 1.337 -20.232
331 HD22 LEU 76 1HD2 LEU 76 -2.522 2.639 -20.972
332 HD23 LEU 76 2HD2 LEU 76 -2.450 2.382 -19.228
333 H ASP 77 H ASP 77 1.656 -1.248 -21.903
334 HA ASP 77 HA ASP 77 1.015 -0.386 -24.628
335 HB2 ASP 77 1HB ASP 77 2.099 -2.506 -25.327
336 HB3 ASP 77 2HB ASP 77 3.180 -1.473 -24.398
337 H GLN 78 H GLN 78 -0.609 -1.541 -22.120
338 HA GLN 78 HA GLN 78 -2.092 -3.701 -23.376
339 HB2 GLN 78 1HB GLN 78 -2.561 -2.367 -20.700
340 HB3 GLN 78 2HB GLN 78 -3.196 -3.915 -21.237
341 HG2 GLN 78 1HG GLN 78 -1.057 -4.921 -21.137
342 HG3 GLN 78 2HG GLN 78 -0.263 -3.368 -20.910
343 HE21 GLN 78 2HE2 GLN 78 0.711 -3.891 -19.006
344 HE22 GLN 78 1HE2 GLN 78 -0.154 -4.166 -17.534
345 H GLN 79 H GLN 79 -4.095 -3.486 -24.258
346 HA GLN 79 HA GLN 79 -5.154 -0.777 -24.424
347 HB2 GLN 79 1HB GLN 79 -6.608 -1.717 -26.259
348 HB3 GLN 79 2HB GLN 79 -4.884 -1.714 -26.576
349 HG2 GLN 79 1HG GLN 79 -4.811 -4.112 -26.001
350 HG3 GLN 79 2HG GLN 79 -6.559 -4.091 -25.792
351 HE21 GLN 79 2HE2 GLN 79 -4.975 -5.647 -27.627
352 HE22 GLN 79 1HE2 GLN 79 -5.515 -5.239 -29.220
Start of MODEL 3
1 H ASN 33 H ASN 33 -1.403 14.158 5.672
2 HA ASN 33 HA ASN 33 0.553 15.526 3.954
3 HB2 ASN 33 1HB ASN 33 0.499 12.709 5.068
4 HB3 ASN 33 2HB ASN 33 1.658 13.244 3.855
5 HD21 ASN 33 2HD2 ASN 33 3.245 14.756 4.427
6 HD22 ASN 33 1HD2 ASN 33 3.671 15.028 6.082
7 H MET 34 H MET 34 1.080 13.956 1.930
8 HA MET 34 HA MET 34 -1.365 13.769 0.449
9 HB2 MET 34 1HB MET 34 0.027 12.948 -1.408
10 HB3 MET 34 2HB MET 34 0.648 14.435 -0.716
11 HG2 MET 34 1HG MET 34 2.329 13.127 0.517
12 HG3 MET 34 2HG MET 34 1.731 11.663 -0.247
13 HE1 MET 34 3HE MET 34 1.994 11.107 -2.819
14 HE2 MET 34 1HE MET 34 2.677 12.222 -4.002
15 HE3 MET 34 2HE MET 34 1.138 12.596 -3.219
16 H THR 35 H THR 35 -2.663 12.104 0.220
17 HA THR 35 HA THR 35 -1.867 9.567 1.416
18 HB THR 35 HB THR 35 -4.402 9.057 1.027
19 HG1 THR 35 HG1 THR 35 -5.399 11.353 1.443
20 HG21 THR 35 3HG2 THR 35 -3.322 9.270 3.207
21 HG22 THR 35 1HG2 THR 35 -4.915 10.036 3.215
22 HG23 THR 35 2HG2 THR 35 -3.459 11.025 3.116
23 H VAL 36 H VAL 36 -1.439 7.886 0.306
24 HA VAL 36 HA VAL 36 -1.928 7.857 -2.596
25 HB VAL 36 HB VAL 36 0.197 6.623 -2.842
26 HG11 VAL 36 1HG1 VAL 36 0.519 9.254 -1.390
27 HG12 VAL 36 2HG1 VAL 36 0.237 9.040 -3.118
28 HG13 VAL 36 3HG1 VAL 36 1.743 8.477 -2.395
29 HG21 VAL 36 3HG2 VAL 36 1.807 6.496 -0.991
30 HG22 VAL 36 1HG2 VAL 36 0.338 5.586 -0.632
31 HG23 VAL 36 2HG2 VAL 36 0.601 7.167 0.109
32 H ASP 37 H ASP 37 -2.149 5.713 -3.536
33 HA ASP 37 HA ASP 37 -3.231 3.792 -1.592
34 HB2 ASP 37 1HB ASP 37 -4.855 4.634 -3.240
35 HB3 ASP 37 2HB ASP 37 -3.824 4.063 -4.544
36 H ILE 38 H ILE 38 -2.192 1.954 -1.298
37 HA ILE 38 HA ILE 38 -0.207 1.103 -3.313
38 HB ILE 38 HB ILE 38 1.038 0.072 -1.313
39 HG12 ILE 38 1HG1 ILE 38 -0.172 2.288 0.304
40 HG13 ILE 38 2HG1 ILE 38 -1.015 0.747 0.198
41 HG21 ILE 38 1HG2 ILE 38 1.004 3.064 -1.687
42 HG22 ILE 38 2HG2 ILE 38 1.949 1.895 -2.609
43 HG23 ILE 38 3HG2 ILE 38 2.289 2.149 -0.897
44 HD11 ILE 38 3HD1 ILE 38 1.704 1.297 1.316
45 HD12 ILE 38 1HD1 ILE 38 1.109 -0.327 0.974
46 HD13 ILE 38 2HD1 ILE 38 0.277 0.684 2.154
47 H LEU 39 H LEU 39 -0.262 -0.970 -3.933
48 HA LEU 39 HA LEU 39 -2.311 -2.679 -2.701
49 HG LEU 39 HG LEU 39 -3.928 -3.609 -4.206
50 HB2 LEU 39 1HB LEU 39 -2.353 -1.788 -5.201
51 HB3 LEU 39 2HB LEU 39 -1.239 -3.110 -5.466
52 HD11 LEU 39 1HD1 LEU 39 -3.303 -3.430 -7.152
53 HD12 LEU 39 2HD1 LEU 39 -4.364 -2.359 -6.235
54 HD13 LEU 39 3HD1 LEU 39 -4.800 -4.053 -6.455
55 HD21 LEU 39 3HD2 LEU 39 -3.669 -5.806 -5.211
56 HD22 LEU 39 1HD2 LEU 39 -2.275 -5.433 -4.197
57 HD23 LEU 39 2HD2 LEU 39 -2.147 -5.313 -5.954
58 H CYS 40 H CYS 40 -1.650 -4.499 -1.768
59 HA CYS 40 HA CYS 40 1.106 -5.111 -1.483
60 HB2 CYS 40 1HB CYS 40 -1.423 -6.401 -0.616
61 HB3 CYS 40 2HB CYS 40 0.051 -7.343 -0.580
62 H ASN 41 H ASN 41 2.356 -6.595 -2.322
63 HA ASN 41 HA ASN 41 1.408 -8.290 -4.466
64 HB2 ASN 41 1HB ASN 41 4.100 -8.187 -3.075
65 HB3 ASN 41 2HB ASN 41 3.740 -9.095 -4.539
66 HD21 ASN 41 2HD2 ASN 41 5.641 -6.903 -3.957
67 HD22 ASN 41 1HD2 ASN 41 5.325 -5.696 -5.159
68 H ASP 42 H ASP 42 1.690 -8.408 -1.046
69 HA ASP 42 HA ASP 42 2.020 -11.286 -0.918
70 HB2 ASP 42 1HB ASP 42 2.243 -10.951 1.519
71 HB3 ASP 42 2HB ASP 42 3.385 -9.982 0.601
72 H CYS 43 H CYS 43 -0.458 -8.898 0.175
73 HA CYS 43 HA CYS 43 -2.218 -11.186 0.690
74 HB2 CYS 43 1HB CYS 43 -3.467 -9.906 2.225
75 HB3 CYS 43 2HB CYS 43 -1.795 -9.451 2.521
76 H ASN 44 H ASN 44 -1.568 -9.173 -1.757
77 HA ASN 44 HA ASN 44 -2.562 -8.389 -3.623
78 HB2 ASN 44 1HB ASN 44 -4.392 -10.693 -2.973
79 HB3 ASN 44 2HB ASN 44 -4.620 -9.708 -4.416
80 HD21 ASN 44 2HD2 ASN 44 -2.656 -12.081 -2.839
81 HD22 ASN 44 1HD2 ASN 44 -1.664 -12.474 -4.202
82 H GLY 45 H GLY 45 -3.277 -7.035 -1.187
83 HA2 GLY 45 1HA GLY 45 -5.864 -5.915 -2.015
84 HA3 GLY 45 2HA GLY 45 -5.537 -6.268 -0.324
85 H ARG 46 H ARG 46 -6.124 -3.751 -1.804
86 HA ARG 46 HA ARG 46 -3.640 -2.281 -1.313
87 HE ARG 46 HE ARG 46 -8.555 -1.325 -4.834
88 HB2 ARG 46 1HB ARG 46 -4.620 -0.492 -2.711
89 HB3 ARG 46 2HB ARG 46 -4.389 -2.004 -3.567
90 HG2 ARG 46 1HG ARG 46 -6.800 -2.476 -3.270
91 HG3 ARG 46 2HG ARG 46 -6.974 -0.877 -2.540
92 HD2 ARG 46 1HD ARG 46 -5.990 0.090 -4.626
93 HD3 ARG 46 2HD ARG 46 -6.074 -1.519 -5.342
94 HH11 ARG 46 1HH1 ARG 46 -6.523 1.454 -5.539
95 HH12 ARG 46 2HH1 ARG 46 -7.817 2.372 -6.252
96 HH21 ARG 46 1HH2 ARG 46 -10.254 -0.121 -5.734
97 HH22 ARG 46 2HH2 ARG 46 -9.953 1.474 -6.354
98 H SER 47 H SER 47 -3.686 -0.264 -0.298
99 HA SER 47 HA SER 47 -6.056 0.417 1.266
100 HG SER 47 HG SER 47 -5.554 -1.561 2.371
101 HB2 SER 47 1HB SER 47 -3.301 0.058 2.488
102 HB3 SER 47 2HB SER 47 -4.737 0.648 3.329
103 H THR 48 H THR 48 -6.255 2.604 1.608
104 HA THR 48 HA THR 48 -4.262 4.279 0.282
105 HB THR 48 HB THR 48 -6.949 5.153 1.368
106 HG1 THR 48 HG1 THR 48 -6.281 3.667 -0.868
107 HG21 THR 48 3HG2 THR 48 -5.156 6.334 -0.770
108 HG22 THR 48 1HG2 THR 48 -5.336 6.961 0.869
109 HG23 THR 48 2HG2 THR 48 -6.707 6.987 -0.239
110 H VAL 49 H VAL 49 -2.691 4.899 1.496
111 HA VAL 49 HA VAL 49 -3.148 5.738 4.278
112 HB VAL 49 HB VAL 49 -0.919 4.800 4.878
113 HG11 VAL 49 1HG1 VAL 49 -2.915 2.806 3.826
114 HG12 VAL 49 2HG1 VAL 49 -2.900 3.543 5.429
115 HG13 VAL 49 3HG1 VAL 49 -1.610 2.437 4.954
116 HG21 VAL 49 3HG2 VAL 49 0.088 4.725 2.647
117 HG22 VAL 49 1HG2 VAL 49 -1.044 3.460 2.170
118 HG23 VAL 49 2HG2 VAL 49 0.155 3.144 3.425
119 H GLN 50 H GLN 50 -1.100 7.067 5.020
120 HA GLN 50 HA GLN 50 -0.632 9.089 3.034
121 HB2 GLN 50 1HB GLN 50 0.692 10.222 4.728
122 HB3 GLN 50 2HB GLN 50 -0.822 9.666 5.421
123 HG2 GLN 50 1HG GLN 50 0.368 7.737 6.396
124 HG3 GLN 50 2HG GLN 50 1.880 8.376 5.763
125 HE21 GLN 50 2HE2 GLN 50 1.084 11.162 6.340
126 HE22 GLN 50 1HE2 GLN 50 1.244 11.343 8.051
127 H PHE 51 H PHE 51 1.391 9.688 2.131
128 HA PHE 51 HA PHE 51 3.050 7.512 1.340
129 HD1 PHE 51 HD2 PHE 51 4.084 7.432 -1.030
130 HD2 PHE 51 HD1 PHE 51 5.660 11.010 0.649
131 HE1 PHE 51 HE2 PHE 51 6.214 7.033 -2.191
132 HE2 PHE 51 HE1 PHE 51 7.794 10.616 -0.508
133 HZ PHE 51 HZ PHE 51 8.072 8.625 -1.928
134 HB2 PHE 51 1HB PHE 51 2.632 9.407 -0.145
135 HB3 PHE 51 2HB PHE 51 3.428 10.498 0.984
136 H HIS 52 H HIS 52 4.445 6.586 2.567
137 HA HIS 52 HA HIS 52 5.781 8.103 4.701
138 HD1 HIS 52 HD1 HIS 52 5.920 4.088 6.876
139 HD2 HIS 52 HD2 HIS 52 5.757 8.222 7.231
140 HE1 HIS 52 HE1 HIS 52 6.868 4.603 9.141
141 HE2 HIS 52 HE2 HIS 52 6.787 7.116 9.339
142 HB2 HIS 52 1HB HIS 52 3.979 6.367 5.321
143 HB3 HIS 52 2HB HIS 52 5.133 5.150 4.797
144 H ILE 53 H ILE 53 7.853 8.271 4.470
145 HA ILE 53 HA ILE 53 9.290 7.005 2.364
146 HB ILE 53 HB ILE 53 10.168 8.835 4.618
147 HG12 ILE 53 1HG1 ILE 53 10.678 10.299 2.497
148 HG13 ILE 53 2HG1 ILE 53 9.545 9.216 1.703
149 HG21 ILE 53 1HG2 ILE 53 12.100 7.481 4.073
150 HG22 ILE 53 2HG2 ILE 53 12.326 9.126 3.477
151 HG23 ILE 53 3HG2 ILE 53 11.896 7.832 2.356
152 HD11 ILE 53 3HD1 ILE 53 7.820 9.867 3.327
153 HD12 ILE 53 1HD1 ILE 53 8.438 11.241 2.408
154 HD13 ILE 53 2HD1 ILE 53 8.965 10.984 4.072
155 H LEU 54 H LEU 54 8.842 6.329 5.741
156 HA LEU 54 HA LEU 54 11.071 4.474 5.866
157 HG LEU 54 HG LEU 54 10.342 7.116 7.507
158 HB2 LEU 54 1HB LEU 54 8.977 5.130 7.930
159 HB3 LEU 54 2HB LEU 54 10.421 4.177 8.206
160 HD11 LEU 54 1HD1 LEU 54 9.598 6.677 9.767
161 HD12 LEU 54 2HD1 LEU 54 11.196 7.425 9.779
162 HD13 LEU 54 3HD1 LEU 54 11.031 5.693 10.067
163 HD21 LEU 54 3HD2 LEU 54 12.685 5.302 8.093
164 HD22 LEU 54 1HD2 LEU 54 12.765 7.061 7.975
165 HD23 LEU 54 2HD2 LEU 54 12.326 6.103 6.561
166 H GLY 55 H GLY 55 8.450 4.077 4.235
167 HA2 GLY 55 1HA GLY 55 7.982 1.837 3.417
168 HA3 GLY 55 2HA GLY 55 8.073 1.274 5.081
169 H MET 56 H MET 56 5.966 1.759 2.692
170 HA MET 56 HA MET 56 3.895 3.064 4.261
171 HB2 MET 56 1HB MET 56 4.075 2.206 1.388
172 HB3 MET 56 2HB MET 56 2.551 2.720 2.106
173 HG2 MET 56 1HG MET 56 3.461 4.872 2.629
174 HG3 MET 56 2HG MET 56 5.064 4.373 2.095
175 HE1 MET 56 3HE MET 56 5.851 4.261 -0.306
176 HE2 MET 56 1HE MET 56 4.810 4.332 -1.729
177 HE3 MET 56 2HE MET 56 4.724 2.945 -0.643
178 H LYS 57 H LYS 57 2.273 2.121 5.229
179 HA LYS 57 HA LYS 57 2.391 -0.811 5.380
180 HB2 LYS 57 1HB LYS 57 2.917 0.548 7.410
181 HB3 LYS 57 2HB LYS 57 1.276 1.172 7.376
182 HG2 LYS 57 1HG LYS 57 0.413 -1.098 7.701
183 HG3 LYS 57 2HG LYS 57 2.066 -1.711 7.751
184 HD2 LYS 57 1HD LYS 57 1.316 -1.489 10.002
185 HD3 LYS 57 2HD LYS 57 2.478 -0.198 9.702
186 HE2 LYS 57 1HE LYS 57 0.592 1.359 9.314
187 HE3 LYS 57 2HE LYS 57 -0.531 0.059 9.712
188 HZ1 LYS 57 3HZ LYS 57 -0.155 1.480 11.618
189 HZ2 LYS 57 1HZ LYS 57 1.516 1.210 11.532
190 HZ3 LYS 57 2HZ LYS 57 0.472 -0.063 11.919
191 H CYS 58 H CYS 58 0.867 -1.755 4.214
192 HA CYS 58 HA CYS 58 -1.717 -0.737 3.666
193 HB2 CYS 58 1HB CYS 58 -1.198 -2.346 2.157
194 HB3 CYS 58 2HB CYS 58 -0.207 -3.233 3.283
195 H LYS 59 H LYS 59 -3.688 -1.081 4.681
196 HA LYS 59 HA LYS 59 -3.467 -1.420 7.529
197 HB2 LYS 59 1HB LYS 59 -5.793 -0.713 5.755
198 HB3 LYS 59 2HB LYS 59 -5.879 -0.763 7.507
199 HG2 LYS 59 1HG LYS 59 -4.176 0.998 7.621
200 HG3 LYS 59 2HG LYS 59 -4.147 1.061 5.858
201 HD2 LYS 59 1HD LYS 59 -5.561 2.832 6.684
202 HD3 LYS 59 2HD LYS 59 -6.562 1.621 5.882
203 HE2 LYS 59 1HE LYS 59 -7.108 0.650 8.082
204 HE3 LYS 59 2HE LYS 59 -6.150 1.905 8.861
205 HZ1 LYS 59 3HZ LYS 59 -8.587 2.326 7.225
206 HZ2 LYS 59 1HZ LYS 59 -7.660 3.561 7.925
207 HZ3 LYS 59 2HZ LYS 59 -8.484 2.451 8.909
208 H ILE 60 H ILE 60 -4.170 -3.530 5.009
209 HA ILE 60 HA ILE 60 -6.184 -5.095 6.352
210 HB ILE 60 HB ILE 60 -4.636 -5.895 3.877
211 HG12 ILE 60 1HG1 ILE 60 -7.255 -4.369 3.907
212 HG13 ILE 60 2HG1 ILE 60 -5.695 -3.581 3.709
213 HG21 ILE 60 1HG2 ILE 60 -7.391 -6.621 4.884
214 HG22 ILE 60 2HG2 ILE 60 -5.970 -7.667 4.879
215 HG23 ILE 60 3HG2 ILE 60 -6.692 -7.153 3.354
216 HD11 ILE 60 3HD1 ILE 60 -6.885 -5.646 1.874
217 HD12 ILE 60 1HD1 ILE 60 -5.306 -4.885 1.675
218 HD13 ILE 60 2HD1 ILE 60 -6.774 -3.911 1.568
219 H CYS 61 H CYS 61 -2.701 -5.235 5.881
220 HA CYS 61 HA CYS 61 -2.610 -7.642 7.559
221 HB2 CYS 61 1HB CYS 61 -1.081 -8.771 6.086
222 HB3 CYS 61 2HB CYS 61 -2.489 -8.285 5.152
223 H GLU 62 H GLU 62 -1.352 -4.586 6.820
224 HA GLU 62 HA GLU 62 0.183 -3.254 7.723
225 HB2 GLU 62 1HB GLU 62 0.339 -5.410 9.814
226 HB3 GLU 62 2HB GLU 62 1.263 -3.914 9.909
227 HG2 GLU 62 1HG GLU 62 -0.782 -2.613 9.873
228 HG3 GLU 62 2HG GLU 62 -1.742 -4.084 9.721
229 H SER 63 H SER 63 0.950 -5.230 5.704
230 HA SER 63 HA SER 63 3.800 -5.520 6.259
231 HG SER 63 HG SER 63 3.040 -7.762 6.344
232 HB2 SER 63 1HB SER 63 2.184 -6.557 3.921
233 HB3 SER 63 2HB SER 63 3.876 -6.923 4.258
234 H TYR 64 H TYR 64 5.350 -4.808 4.766
235 HA TYR 64 HA TYR 64 4.584 -2.305 3.436
236 HD1 TYR 64 HD1 TYR 64 5.222 -0.327 5.197
237 HD2 TYR 64 HD2 TYR 64 7.336 -3.764 6.541
238 HE1 TYR 64 HE1 TYR 64 4.806 0.334 7.523
239 HE2 TYR 64 HE2 TYR 64 6.920 -3.108 8.874
240 HH TYR 64 HH TYR 64 6.436 -0.994 10.127
241 HB2 TYR 64 1HB TYR 64 7.348 -3.236 4.253
242 HB3 TYR 64 2HB TYR 64 6.889 -1.623 3.718
243 H ASN 65 H ASN 65 4.955 -5.416 2.610
244 HA ASN 65 HA ASN 65 6.506 -5.183 0.194
245 HB2 ASN 65 1HB ASN 65 6.248 -7.321 1.524
246 HB3 ASN 65 2HB ASN 65 4.569 -7.374 1.016
247 HD21 ASN 65 2HD2 ASN 65 6.744 -9.271 0.598
248 HD22 ASN 65 1HD2 ASN 65 6.851 -9.506 -1.115
249 H THR 66 H THR 66 5.480 -3.395 -0.805
250 HA THR 66 HA THR 66 2.870 -3.972 -2.000
251 HB THR 66 HB THR 66 2.233 -1.553 -1.580
252 HG1 THR 66 HG1 THR 66 4.302 -1.787 0.372
253 HG21 THR 66 3HG2 THR 66 2.438 -3.366 0.821
254 HG22 THR 66 1HG2 THR 66 1.158 -3.385 -0.389
255 HG23 THR 66 2HG2 THR 66 1.353 -1.986 0.662
256 H ALA 67 H ALA 67 2.345 -2.757 -3.781
257 HA ALA 67 HA ALA 67 4.463 -1.136 -5.029
258 HB1 ALA 67 3HB ALA 67 2.551 -3.067 -6.367
259 HB2 ALA 67 1HB ALA 67 4.301 -3.250 -6.231
260 HB3 ALA 67 2HB ALA 67 3.623 -1.957 -7.223
261 H GLN 68 H GLN 68 3.741 0.862 -5.694
262 HA GLN 68 HA GLN 68 1.260 1.753 -4.622
263 HB2 GLN 68 1HB GLN 68 3.327 3.139 -4.782
264 HB3 GLN 68 2HB GLN 68 3.095 3.214 -6.520
265 HG2 GLN 68 1HG GLN 68 0.948 4.340 -6.177
266 HG3 GLN 68 2HG GLN 68 1.210 4.298 -4.435
267 HE21 GLN 68 2HE2 GLN 68 1.165 6.514 -4.258
268 HE22 GLN 68 1HE2 GLN 68 2.447 7.529 -4.828
269 H ALA 69 H ALA 69 -0.660 1.551 -5.471
270 HA ALA 69 HA ALA 69 -0.993 1.014 -8.319
271 HB1 ALA 69 3HB ALA 69 -3.012 0.898 -6.078
272 HB2 ALA 69 1HB ALA 69 -2.104 -0.474 -6.715
273 HB3 ALA 69 2HB ALA 69 -3.270 0.364 -7.739
274 H GLY 70 H GLY 70 -2.385 3.134 -5.818
275 HA2 GLY 70 1HA GLY 70 -3.086 5.316 -5.908
276 HA3 GLY 70 2HA GLY 70 -2.344 5.436 -7.498
277 H GLY 71 H GLY 71 -3.729 6.097 -8.905
278 HA2 GLY 71 1HA GLY 71 -6.328 4.718 -9.084
279 HA3 GLY 71 2HA GLY 71 -6.166 6.446 -9.407
280 H ARG 72 H ARG 72 -6.974 4.174 -11.189
281 HA ARG 72 HA ARG 72 -4.781 3.658 -12.953
282 HE ARG 72 HE ARG 72 -5.690 -0.874 -12.007
283 HB2 ARG 72 1HB ARG 72 -7.741 3.176 -13.270
284 HB3 ARG 72 2HB ARG 72 -6.532 2.649 -14.430
285 HG2 ARG 72 1HG ARG 72 -6.704 1.765 -11.554
286 HG3 ARG 72 2HG ARG 72 -7.240 0.836 -12.954
287 HD2 ARG 72 1HD ARG 72 -4.942 0.818 -13.806
288 HD3 ARG 72 2HD ARG 72 -4.414 1.736 -12.399
289 HH11 ARG 72 1HH1 ARG 72 -2.836 1.147 -11.768
290 HH12 ARG 72 2HH1 ARG 72 -1.935 -0.022 -10.850
291 HH21 ARG 72 1HH2 ARG 72 -4.525 -2.389 -10.793
292 HH22 ARG 72 2HH2 ARG 72 -2.899 -2.036 -10.288
293 H ARG 73 H ARG 73 -4.218 4.564 -14.821
294 HA ARG 73 HA ARG 73 -5.181 7.197 -15.390
295 HE ARG 73 HE ARG 73 -3.443 9.111 -19.525
296 HB2 ARG 73 1HB ARG 73 -2.799 6.565 -15.689
297 HB3 ARG 73 2HB ARG 73 -3.260 5.495 -17.002
298 HG2 ARG 73 1HG ARG 73 -4.192 8.253 -17.343
299 HG3 ARG 73 2HG ARG 73 -2.438 8.089 -17.275
300 HD2 ARG 73 1HD ARG 73 -2.475 6.487 -19.092
301 HD3 ARG 73 2HD ARG 73 -4.236 6.499 -19.113
302 HH11 ARG 73 1HH1 ARG 73 -3.068 6.047 -21.206
303 HH12 ARG 73 2HH1 ARG 73 -2.917 6.783 -22.769
304 HH21 ARG 73 1HH2 ARG 73 -3.266 10.055 -21.596
305 HH22 ARG 73 2HH2 ARG 73 -3.037 9.045 -22.988
306 H ILE 74 H ILE 74 -6.984 7.566 -16.326
307 HA ILE 74 HA ILE 74 -8.118 5.627 -18.187
308 HB ILE 74 HB ILE 74 -9.632 6.096 -16.447
309 HG12 ILE 74 1HG1 ILE 74 -10.538 7.882 -18.717
310 HG13 ILE 74 2HG1 ILE 74 -10.644 6.127 -18.724
311 HG21 ILE 74 1HG2 ILE 74 -10.318 8.330 -15.726
312 HG22 ILE 74 2HG2 ILE 74 -9.166 9.041 -16.858
313 HG23 ILE 74 3HG2 ILE 74 -8.588 8.056 -15.513
314 HD11 ILE 74 3HD1 ILE 74 -12.786 7.108 -18.185
315 HD12 ILE 74 1HD1 ILE 74 -12.070 7.990 -16.835
316 HD13 ILE 74 2HD1 ILE 74 -12.157 6.229 -16.792
317 H SER 75 H SER 75 -7.861 5.911 -20.250
318 HA SER 75 HA SER 75 -7.102 8.505 -21.314
319 HG SER 75 HG SER 75 -7.015 7.359 -24.321
320 HB2 SER 75 1HB SER 75 -5.957 6.337 -21.948
321 HB3 SER 75 2HB SER 75 -7.426 5.896 -22.813
322 H LEU 76 H LEU 76 -8.802 9.813 -21.437
323 HA LEU 76 HA LEU 76 -11.430 8.802 -22.165
324 HG LEU 76 HG LEU 76 -12.834 11.514 -22.344
325 HB2 LEU 76 1HB LEU 76 -11.056 10.317 -20.223
326 HB3 LEU 76 2HB LEU 76 -10.550 11.571 -21.335
327 HD11 LEU 76 1HD1 LEU 76 -13.448 9.734 -19.988
328 HD12 LEU 76 2HD1 LEU 76 -13.477 9.258 -21.687
329 HD13 LEU 76 3HD1 LEU 76 -14.634 10.446 -21.084
330 HD21 LEU 76 3HD2 LEU 76 -12.712 12.104 -19.386
331 HD22 LEU 76 1HD2 LEU 76 -13.879 12.761 -20.533
332 HD23 LEU 76 2HD2 LEU 76 -12.172 13.184 -20.671
333 H ASP 77 H ASP 77 -12.219 8.916 -24.177
334 HA ASP 77 HA ASP 77 -11.194 10.967 -26.000
335 HB2 ASP 77 1HB ASP 77 -10.750 9.365 -27.774
336 HB3 ASP 77 2HB ASP 77 -9.816 8.952 -26.346
337 H GLN 78 H GLN 78 -13.788 10.471 -24.622
338 HA GLN 78 HA GLN 78 -15.730 9.602 -26.500
339 HB2 GLN 78 1HB GLN 78 -15.967 11.309 -24.025
340 HB3 GLN 78 2HB GLN 78 -17.349 10.781 -24.973
341 HG2 GLN 78 1HG GLN 78 -16.928 8.498 -24.462
342 HG3 GLN 78 2HG GLN 78 -15.371 8.891 -23.736
343 HE21 GLN 78 2HE2 GLN 78 -17.679 7.509 -22.607
344 HE22 GLN 78 1HE2 GLN 78 -18.115 8.394 -21.191
345 H GLN 79 H GLN 79 -14.355 12.761 -25.798
346 HA GLN 79 HA GLN 79 -15.919 13.919 -27.988
347 HB2 GLN 79 1HB GLN 79 -14.214 15.203 -25.844
348 HB3 GLN 79 2HB GLN 79 -14.866 16.097 -27.209
349 HG2 GLN 79 1HG GLN 79 -16.496 14.623 -25.148
350 HG3 GLN 79 2HG GLN 79 -16.195 16.357 -25.161
351 HE21 GLN 79 2HE2 GLN 79 -16.467 16.609 -28.069
352 HE22 GLN 79 1HE2 GLN 79 -18.153 16.435 -28.417
Start of MODEL 4
1 H ASN 33 H ASN 33 -2.352 17.328 7.030
2 HA ASN 33 HA ASN 33 -2.493 14.420 7.331
3 HB2 ASN 33 1HB ASN 33 -4.786 14.500 6.257
4 HB3 ASN 33 2HB ASN 33 -4.686 15.089 7.904
5 HD21 ASN 33 2HD2 ASN 33 -4.911 17.336 8.282
6 HD22 ASN 33 1HD2 ASN 33 -5.677 18.369 7.124
7 H MET 34 H MET 34 -0.999 13.809 5.949
8 HA MET 34 HA MET 34 -1.403 14.574 3.130
9 HB2 MET 34 1HB MET 34 0.824 15.233 4.310
10 HB3 MET 34 2HB MET 34 1.204 13.521 4.224
11 HG2 MET 34 1HG MET 34 0.483 15.143 1.805
12 HG3 MET 34 2HG MET 34 2.129 14.992 2.396
13 HE1 MET 34 3HE MET 34 2.139 12.781 -0.834
14 HE2 MET 34 1HE MET 34 2.963 14.073 0.039
15 HE3 MET 34 2HE MET 34 1.320 14.318 -0.554
16 H THR 35 H THR 35 -2.516 12.975 2.259
17 HA THR 35 HA THR 35 -1.980 10.236 3.184
18 HB THR 35 HB THR 35 -4.367 9.759 2.514
19 HG1 THR 35 HG1 THR 35 -4.277 12.215 1.582
20 HG21 THR 35 3HG2 THR 35 -5.303 10.660 4.591
21 HG22 THR 35 1HG2 THR 35 -3.909 11.723 4.758
22 HG23 THR 35 2HG2 THR 35 -3.697 9.972 4.846
23 H VAL 36 H VAL 36 -1.263 8.873 1.736
24 HA VAL 36 HA VAL 36 -1.973 9.267 -1.095
25 HB VAL 36 HB VAL 36 0.081 8.002 -1.707
26 HG11 VAL 36 1HG1 VAL 36 0.605 10.503 -0.103
27 HG12 VAL 36 2HG1 VAL 36 0.115 10.427 -1.795
28 HG13 VAL 36 3HG1 VAL 36 1.690 9.806 -1.306
29 HG21 VAL 36 3HG2 VAL 36 1.902 7.707 -0.088
30 HG22 VAL 36 1HG2 VAL 36 0.477 6.781 0.379
31 HG23 VAL 36 2HG2 VAL 36 0.855 8.292 1.206
32 H ASP 37 H ASP 37 -2.721 7.481 -2.201
33 HA ASP 37 HA ASP 37 -3.509 5.206 -0.551
34 HB2 ASP 37 1HB ASP 37 -4.891 6.558 -2.446
35 HB3 ASP 37 2HB ASP 37 -4.225 5.231 -3.400
36 H ILE 38 H ILE 38 -2.560 3.257 -0.707
37 HA ILE 38 HA ILE 38 -0.610 2.868 -2.896
38 HB ILE 38 HB ILE 38 0.649 1.343 -1.350
39 HG12 ILE 38 1HG1 ILE 38 -0.658 2.738 0.971
40 HG13 ILE 38 2HG1 ILE 38 -1.389 1.282 0.304
41 HG21 ILE 38 1HG2 ILE 38 0.470 4.251 -0.586
42 HG22 ILE 38 2HG2 ILE 38 1.472 3.546 -1.856
43 HG23 ILE 38 3HG2 ILE 38 1.796 3.167 -0.165
44 HD11 ILE 38 3HD1 ILE 38 1.369 1.545 1.456
45 HD12 ILE 38 1HD1 ILE 38 0.724 0.090 0.695
46 HD13 ILE 38 2HD1 ILE 38 -0.009 0.712 2.177
47 H LEU 39 H LEU 39 -0.753 1.019 -4.054
48 HA LEU 39 HA LEU 39 -2.936 -0.811 -3.301
49 HG LEU 39 HG LEU 39 -4.728 -0.855 -4.928
50 HB2 LEU 39 1HB LEU 39 -2.814 0.693 -5.543
51 HB3 LEU 39 2HB LEU 39 -1.947 -0.720 -6.105
52 HD11 LEU 39 1HD1 LEU 39 -4.751 0.564 -6.895
53 HD12 LEU 39 2HD1 LEU 39 -5.532 -0.983 -7.225
54 HD13 LEU 39 3HD1 LEU 39 -3.898 -0.676 -7.815
55 HD21 LEU 39 3HD2 LEU 39 -4.844 -3.010 -6.041
56 HD22 LEU 39 1HD2 LEU 39 -3.485 -2.970 -4.917
57 HD23 LEU 39 2HD2 LEU 39 -3.201 -2.804 -6.650
58 H CYS 40 H CYS 40 -2.450 -2.822 -2.948
59 HA CYS 40 HA CYS 40 0.214 -3.689 -2.616
60 HB2 CYS 40 1HB CYS 40 -2.290 -4.461 -1.764
61 HB3 CYS 40 2HB CYS 40 -1.756 -5.806 -2.760
62 H ASN 41 H ASN 41 1.401 -5.228 -3.630
63 HA ASN 41 HA ASN 41 0.677 -5.815 -6.390
64 HB2 ASN 41 1HB ASN 41 3.223 -6.536 -4.929
65 HB3 ASN 41 2HB ASN 41 2.970 -6.516 -6.667
66 HD21 ASN 41 2HD2 ASN 41 5.006 -5.177 -5.153
67 HD22 ASN 41 1HD2 ASN 41 4.827 -3.480 -5.465
68 H ASP 42 H ASP 42 0.641 -7.275 -3.285
69 HA ASP 42 HA ASP 42 0.622 -9.968 -4.410
70 HB2 ASP 42 1HB ASP 42 0.815 -10.722 -2.016
71 HB3 ASP 42 2HB ASP 42 2.186 -9.830 -2.653
72 H CYS 43 H CYS 43 -1.368 -8.093 -2.060
73 HA CYS 43 HA CYS 43 -3.422 -10.139 -2.348
74 HB2 CYS 43 1HB CYS 43 -4.414 -9.396 -0.344
75 HB3 CYS 43 2HB CYS 43 -2.688 -9.307 -0.060
76 H ASN 44 H ASN 44 -2.704 -7.471 -4.025
77 HA ASN 44 HA ASN 44 -3.728 -5.817 -5.160
78 HB2 ASN 44 1HB ASN 44 -5.552 -8.163 -5.446
79 HB3 ASN 44 2HB ASN 44 -5.936 -6.636 -6.235
80 HD21 ASN 44 2HD2 ASN 44 -5.641 -7.286 -8.238
81 HD22 ASN 44 1HD2 ASN 44 -4.122 -7.743 -8.914
82 H GLY 45 H GLY 45 -4.046 -5.356 -2.518
83 HA2 GLY 45 1HA GLY 45 -6.710 -4.124 -2.414
84 HA3 GLY 45 2HA GLY 45 -5.964 -4.860 -1.003
85 H ARG 46 H ARG 46 -6.741 -2.028 -2.109
86 HA ARG 46 HA ARG 46 -4.192 -0.726 -1.573
87 HE ARG 46 HE ARG 46 -7.006 3.011 -2.970
88 HB2 ARG 46 1HB ARG 46 -5.345 1.345 -2.354
89 HB3 ARG 46 2HB ARG 46 -5.169 0.080 -3.551
90 HG2 ARG 46 1HG ARG 46 -7.533 -0.563 -3.136
91 HG3 ARG 46 2HG ARG 46 -7.678 0.846 -2.079
92 HD2 ARG 46 1HD ARG 46 -6.652 1.108 -4.870
93 HD3 ARG 46 2HD ARG 46 -8.385 1.058 -4.556
94 HH11 ARG 46 1HH1 ARG 46 -8.349 2.420 -6.162
95 HH12 ARG 46 2HH1 ARG 46 -8.630 4.104 -6.485
96 HH21 ARG 46 1HH2 ARG 46 -7.406 5.218 -3.418
97 HH22 ARG 46 2HH2 ARG 46 -8.136 5.668 -4.931
98 H SER 47 H SER 47 -4.050 1.087 -0.215
99 HA SER 47 HA SER 47 -6.000 1.217 1.964
100 HG SER 47 HG SER 47 -5.062 -0.955 2.114
101 HB2 SER 47 1HB SER 47 -3.015 0.811 2.381
102 HB3 SER 47 2HB SER 47 -4.223 1.016 3.651
103 H THR 48 H THR 48 -6.498 3.315 2.232
104 HA THR 48 HA THR 48 -4.731 5.391 1.290
105 HB THR 48 HB THR 48 -7.127 5.926 3.029
106 HG1 THR 48 HG1 THR 48 -7.119 5.108 0.289
107 HG21 THR 48 3HG2 THR 48 -5.737 7.812 2.303
108 HG22 THR 48 1HG2 THR 48 -7.335 7.883 1.558
109 HG23 THR 48 2HG2 THR 48 -5.947 7.327 0.619
110 H VAL 49 H VAL 49 -3.027 5.910 2.411
111 HA VAL 49 HA VAL 49 -3.101 5.825 5.353
112 HB VAL 49 HB VAL 49 -0.730 4.968 5.296
113 HG11 VAL 49 1HG1 VAL 49 -2.562 3.468 5.824
114 HG12 VAL 49 2HG1 VAL 49 -1.324 2.623 4.894
115 HG13 VAL 49 3HG1 VAL 49 -2.817 3.146 4.110
116 HG21 VAL 49 3HG2 VAL 49 0.042 3.797 3.275
117 HG22 VAL 49 1HG2 VAL 49 -0.157 5.529 3.002
118 HG23 VAL 49 2HG2 VAL 49 -1.368 4.398 2.401
119 H GLN 50 H GLN 50 -1.119 6.959 6.258
120 HA GLN 50 HA GLN 50 -0.703 9.476 4.863
121 HB2 GLN 50 1HB GLN 50 0.173 8.467 7.581
122 HB3 GLN 50 2HB GLN 50 0.742 9.988 6.914
123 HG2 GLN 50 1HG GLN 50 -0.999 10.587 8.331
124 HG3 GLN 50 2HG GLN 50 -1.731 10.621 6.733
125 HE21 GLN 50 2HE2 GLN 50 -3.339 9.151 6.231
126 HE22 GLN 50 1HE2 GLN 50 -4.089 8.139 7.418
127 H PHE 51 H PHE 51 1.369 10.189 4.152
128 HA PHE 51 HA PHE 51 2.972 8.132 3.022
129 HD1 PHE 51 HD2 PHE 51 4.054 8.544 0.605
130 HD2 PHE 51 HD1 PHE 51 5.975 11.202 3.310
131 HE1 PHE 51 HE2 PHE 51 6.219 8.038 -0.439
132 HE2 PHE 51 HE1 PHE 51 8.144 10.696 2.275
133 HZ PHE 51 HZ PHE 51 8.269 9.110 0.400
134 HB2 PHE 51 1HB PHE 51 2.791 10.319 1.909
135 HB3 PHE 51 2HB PHE 51 3.622 11.084 3.262
136 H HIS 52 H HIS 52 4.398 6.959 3.929
137 HA HIS 52 HA HIS 52 5.724 7.865 6.384
138 HD1 HIS 52 HD1 HIS 52 6.203 3.334 7.156
139 HD2 HIS 52 HD2 HIS 52 6.017 7.186 8.688
140 HE1 HIS 52 HE1 HIS 52 7.179 3.182 9.467
141 HE2 HIS 52 HE2 HIS 52 6.906 5.496 10.433
142 HB2 HIS 52 1HB HIS 52 4.178 5.775 6.346
143 HB3 HIS 52 2HB HIS 52 5.475 4.994 5.455
144 H ILE 53 H ILE 53 7.831 8.202 6.304
145 HA ILE 53 HA ILE 53 9.364 8.060 3.936
146 HB ILE 53 HB ILE 53 9.993 8.679 6.804
147 HG12 ILE 53 1HG1 ILE 53 10.946 10.771 5.677
148 HG13 ILE 53 2HG1 ILE 53 10.200 10.185 4.199
149 HG21 ILE 53 1HG2 ILE 53 12.167 8.372 4.736
150 HG22 ILE 53 2HG2 ILE 53 11.944 7.383 6.176
151 HG23 ILE 53 3HG2 ILE 53 12.363 9.087 6.338
152 HD11 ILE 53 3HD1 ILE 53 8.770 10.893 6.752
153 HD12 ILE 53 1HD1 ILE 53 8.005 10.289 5.283
154 HD13 ILE 53 2HD1 ILE 53 8.819 11.854 5.275
155 H LEU 54 H LEU 54 9.011 5.867 6.629
156 HA LEU 54 HA LEU 54 11.121 4.096 5.738
157 HG LEU 54 HG LEU 54 11.250 3.852 9.444
158 HB2 LEU 54 1HB LEU 54 9.171 3.952 8.035
159 HB3 LEU 54 2HB LEU 54 10.300 2.670 7.667
160 HD11 LEU 54 1HD1 LEU 54 12.578 4.859 6.941
161 HD12 LEU 54 2HD1 LEU 54 12.878 3.324 7.760
162 HD13 LEU 54 3HD1 LEU 54 13.296 4.842 8.553
163 HD21 LEU 54 3HD2 LEU 54 10.729 6.436 7.984
164 HD22 LEU 54 1HD2 LEU 54 11.597 6.272 9.512
165 HD23 LEU 54 2HD2 LEU 54 9.888 5.850 9.421
166 H GLY 55 H GLY 55 8.332 4.628 4.359
167 HA2 GLY 55 1HA GLY 55 7.535 3.218 2.619
168 HA3 GLY 55 2HA GLY 55 7.994 1.818 3.582
169 H MET 56 H MET 56 5.424 2.984 2.301
170 HA MET 56 HA MET 56 3.662 3.292 4.557
171 HB2 MET 56 1HB MET 56 3.177 3.110 1.583
172 HB3 MET 56 2HB MET 56 1.865 3.195 2.748
173 HG2 MET 56 1HG MET 56 2.163 5.376 1.956
174 HG3 MET 56 2HG MET 56 2.881 5.353 3.560
175 HE1 MET 56 3HE MET 56 3.535 5.493 -0.300
176 HE2 MET 56 1HE MET 56 4.375 4.007 0.141
177 HE3 MET 56 2HE MET 56 5.297 5.421 -0.379
178 H LYS 57 H LYS 57 1.999 1.881 5.163
179 HA LYS 57 HA LYS 57 2.648 -0.916 4.570
180 HB2 LYS 57 1HB LYS 57 3.155 -0.063 6.888
181 HB3 LYS 57 2HB LYS 57 1.429 0.161 7.120
182 HG2 LYS 57 1HG LYS 57 2.278 -1.913 8.130
183 HG3 LYS 57 2HG LYS 57 1.044 -2.207 6.907
184 HD2 LYS 57 1HD LYS 57 2.831 -3.815 6.674
185 HD3 LYS 57 2HD LYS 57 2.809 -2.744 5.277
186 HE2 LYS 57 1HE LYS 57 5.086 -3.060 5.886
187 HE3 LYS 57 2HE LYS 57 4.645 -1.429 6.388
188 HZ1 LYS 57 3HZ LYS 57 4.701 -3.792 8.186
189 HZ2 LYS 57 1HZ LYS 57 4.416 -2.186 8.643
190 HZ3 LYS 57 2HZ LYS 57 5.941 -2.643 8.068
191 H CYS 58 H CYS 58 1.201 -2.093 3.639
192 HA CYS 58 HA CYS 58 -1.451 -1.303 3.053
193 HB2 CYS 58 1HB CYS 58 -0.355 -2.907 1.638
194 HB3 CYS 58 2HB CYS 58 -0.045 -3.980 2.993
195 H LYS 59 H LYS 59 -3.222 -1.371 4.279
196 HA LYS 59 HA LYS 59 -2.987 -2.279 7.033
197 HB2 LYS 59 1HB LYS 59 -5.176 -0.768 5.592
198 HB3 LYS 59 2HB LYS 59 -5.148 -1.096 7.318
199 HG2 LYS 59 1HG LYS 59 -3.058 0.505 5.853
200 HG3 LYS 59 2HG LYS 59 -4.425 1.193 6.729
201 HD2 LYS 59 1HD LYS 59 -3.633 0.245 8.796
202 HD3 LYS 59 2HD LYS 59 -2.324 -0.587 7.955
203 HE2 LYS 59 1HE LYS 59 -1.338 1.542 7.338
204 HE3 LYS 59 2HE LYS 59 -2.681 2.403 8.093
205 HZ1 LYS 59 3HZ LYS 59 -0.672 2.286 9.485
206 HZ2 LYS 59 1HZ LYS 59 -0.828 0.599 9.543
207 HZ3 LYS 59 2HZ LYS 59 -2.027 1.585 10.220
208 H ILE 60 H ILE 60 -3.530 -4.075 4.567
209 HA ILE 60 HA ILE 60 -5.926 -5.418 5.608
210 HB ILE 60 HB ILE 60 -4.909 -5.647 2.761
211 HG12 ILE 60 1HG1 ILE 60 -7.175 -3.885 3.741
212 HG13 ILE 60 2HG1 ILE 60 -5.569 -3.281 3.362
213 HG21 ILE 60 1HG2 ILE 60 -7.572 -6.298 4.033
214 HG22 ILE 60 2HG2 ILE 60 -6.351 -7.468 3.530
215 HG23 ILE 60 3HG2 ILE 60 -7.175 -6.481 2.323
216 HD11 ILE 60 3HD1 ILE 60 -7.472 -4.585 1.429
217 HD12 ILE 60 1HD1 ILE 60 -5.862 -3.982 1.040
218 HD13 ILE 60 2HD1 ILE 60 -7.124 -2.860 1.550
219 H CYS 61 H CYS 61 -2.660 -5.971 4.236
220 HA CYS 61 HA CYS 61 -2.767 -8.630 5.492
221 HB2 CYS 61 1HB CYS 61 -1.539 -9.616 3.689
222 HB3 CYS 61 2HB CYS 61 -2.909 -8.758 2.999
223 H GLU 62 H GLU 62 -1.335 -5.696 5.585
224 HA GLU 62 HA GLU 62 0.513 -4.763 6.428
225 HB2 GLU 62 1HB GLU 62 0.438 -7.330 7.972
226 HB3 GLU 62 2HB GLU 62 1.723 -6.163 8.233
227 HG2 GLU 62 1HG GLU 62 0.074 -5.799 9.894
228 HG3 GLU 62 2HG GLU 62 -0.039 -4.468 8.749
229 H SER 63 H SER 63 1.109 -5.388 3.995
230 HA SER 63 HA SER 63 3.801 -6.535 4.148
231 HG SER 63 HG SER 63 1.801 -6.690 0.620
232 HB2 SER 63 1HB SER 63 3.623 -7.085 1.777
233 HB3 SER 63 2HB SER 63 2.303 -7.825 2.674
234 H TYR 64 H TYR 64 5.449 -5.542 2.978
235 HA TYR 64 HA TYR 64 5.171 -2.678 2.520
236 HD1 TYR 64 HD1 TYR 64 7.010 -0.921 3.277
237 HD2 TYR 64 HD2 TYR 64 9.162 -3.730 0.918
238 HE1 TYR 64 HE1 TYR 64 8.399 0.896 2.381
239 HE2 TYR 64 HE2 TYR 64 10.559 -1.920 0.018
240 HH TYR 64 HH TYR 64 10.559 1.238 1.352
241 HB2 TYR 64 1HB TYR 64 7.119 -3.505 3.774
242 HB3 TYR 64 2HB TYR 64 7.584 -4.520 2.419
243 H ASN 65 H ASN 65 4.952 -5.555 0.794
244 HA ASN 65 HA ASN 65 5.911 -4.734 -1.765
245 HB2 ASN 65 1HB ASN 65 5.729 -7.108 -0.942
246 HB3 ASN 65 2HB ASN 65 3.982 -6.970 -1.096
247 HD21 ASN 65 2HD2 ASN 65 3.668 -8.469 -2.600
248 HD22 ASN 65 1HD2 ASN 65 4.284 -8.390 -4.217
249 H THR 66 H THR 66 4.901 -2.742 -2.014
250 HA THR 66 HA THR 66 2.182 -2.782 -3.055
251 HB THR 66 HB THR 66 1.787 -0.558 -1.807
252 HG1 THR 66 HG1 THR 66 4.134 -1.422 -0.624
253 HG21 THR 66 3HG2 THR 66 0.488 -2.522 -1.259
254 HG22 THR 66 1HG2 THR 66 0.916 -1.653 0.214
255 HG23 THR 66 2HG2 THR 66 1.783 -3.125 -0.224
256 H ALA 67 H ALA 67 1.797 -1.152 -4.508
257 HA ALA 67 HA ALA 67 4.015 0.669 -5.182
258 HB1 ALA 67 3HB ALA 67 2.931 0.882 -7.392
259 HB2 ALA 67 1HB ALA 67 1.691 -0.269 -6.889
260 HB3 ALA 67 2HB ALA 67 3.368 -0.791 -7.047
261 H GLN 68 H GLN 68 2.934 2.833 -6.145
262 HA GLN 68 HA GLN 68 0.937 3.691 -4.199
263 HB2 GLN 68 1HB GLN 68 2.905 5.138 -4.807
264 HB3 GLN 68 2HB GLN 68 2.229 5.299 -6.419
265 HG2 GLN 68 1HG GLN 68 0.240 6.378 -5.479
266 HG3 GLN 68 2HG GLN 68 0.921 6.214 -3.864
267 HE21 GLN 68 2HE2 GLN 68 0.850 8.439 -3.569
268 HE22 GLN 68 1HE2 GLN 68 1.979 9.503 -4.334
269 H ALA 69 H ALA 69 -1.176 3.986 -4.658
270 HA ALA 69 HA ALA 69 -2.196 2.865 -7.106
271 HB1 ALA 69 3HB ALA 69 -4.388 3.133 -6.105
272 HB2 ALA 69 1HB ALA 69 -3.708 4.121 -4.810
273 HB3 ALA 69 2HB ALA 69 -3.278 2.416 -4.938
274 H GLY 70 H GLY 70 -1.739 4.158 -8.770
275 HA2 GLY 70 1HA GLY 70 -2.707 6.927 -8.755
276 HA3 GLY 70 2HA GLY 70 -1.672 6.202 -9.978
277 H GLY 71 H GLY 71 -3.265 3.799 -10.147
278 HA2 GLY 71 1HA GLY 71 -5.936 4.612 -10.923
279 HA3 GLY 71 2HA GLY 71 -4.903 4.043 -12.234
280 H ARG 72 H ARG 72 -4.521 1.929 -12.486
281 HA ARG 72 HA ARG 72 -5.623 0.088 -10.469
282 HE ARG 72 HE ARG 72 -9.800 1.285 -12.736
283 HB2 ARG 72 1HB ARG 72 -5.679 -0.217 -13.487
284 HB3 ARG 72 2HB ARG 72 -6.074 -1.508 -12.366
285 HG2 ARG 72 1HG ARG 72 -8.153 -0.742 -12.939
286 HG3 ARG 72 2HG ARG 72 -7.849 0.171 -11.463
287 HD2 ARG 72 1HD ARG 72 -7.024 2.050 -12.935
288 HD3 ARG 72 2HD ARG 72 -7.637 1.144 -14.315
289 HH11 ARG 72 1HH1 ARG 72 -7.553 3.774 -13.790
290 HH12 ARG 72 2HH1 ARG 72 -8.740 5.038 -13.737
291 HH21 ARG 72 1HH2 ARG 72 -11.343 2.957 -12.675
292 HH22 ARG 72 2HH2 ARG 72 -10.877 4.571 -13.109
293 H ARG 73 H ARG 73 -4.309 -1.523 -9.825
294 HA ARG 73 HA ARG 73 -1.574 -1.526 -10.829
295 HE ARG 73 HE ARG 73 1.835 -3.458 -8.039
296 HB2 ARG 73 1HB ARG 73 -2.426 -1.645 -8.313
297 HB3 ARG 73 2HB ARG 73 -2.497 -3.364 -8.658
298 HG2 ARG 73 1HG ARG 73 -0.021 -1.713 -9.069
299 HG3 ARG 73 2HG ARG 73 -0.394 -2.519 -7.551
300 HD2 ARG 73 1HD ARG 73 -0.378 -4.685 -8.708
301 HD3 ARG 73 2HD ARG 73 -0.033 -3.865 -10.230
302 HH11 ARG 73 1HH1 ARG 73 1.143 -5.141 -11.047
303 HH12 ARG 73 2HH1 ARG 73 2.802 -5.567 -11.320
304 HH21 ARG 73 1HH2 ARG 73 3.990 -4.016 -8.420
305 HH22 ARG 73 2HH2 ARG 73 4.415 -4.920 -9.841
306 H ILE 74 H ILE 74 -2.010 -2.391 -12.845
307 HA ILE 74 HA ILE 74 -2.398 -5.306 -12.857
308 HB ILE 74 HB ILE 74 -3.365 -5.049 -15.186
309 HG12 ILE 74 1HG1 ILE 74 -3.888 -2.192 -14.325
310 HG13 ILE 74 2HG1 ILE 74 -2.634 -2.659 -15.467
311 HG21 ILE 74 1HG2 ILE 74 -5.643 -4.608 -14.376
312 HG22 ILE 74 2HG2 ILE 74 -4.973 -3.977 -12.870
313 HG23 ILE 74 3HG2 ILE 74 -4.741 -5.671 -13.297
314 HD11 ILE 74 3HD1 ILE 74 -4.340 -3.537 -16.974
315 HD12 ILE 74 1HD1 ILE 74 -4.604 -1.831 -16.614
316 HD13 ILE 74 2HD1 ILE 74 -5.593 -3.063 -15.828
317 H SER 75 H SER 75 -1.333 -6.395 -14.624
318 HA SER 75 HA SER 75 1.013 -4.906 -15.609
319 HG SER 75 HG SER 75 0.856 -6.562 -13.209
320 HB2 SER 75 1HB SER 75 0.762 -7.889 -15.130
321 HB3 SER 75 2HB SER 75 2.213 -7.036 -15.657
322 H LEU 76 H LEU 76 -1.021 -4.396 -17.101
323 HA LEU 76 HA LEU 76 -1.337 -6.377 -19.205
324 HG LEU 76 HG LEU 76 -3.296 -6.131 -20.582
325 HB2 LEU 76 1HB LEU 76 -3.226 -4.899 -18.258
326 HB3 LEU 76 2HB LEU 76 -2.504 -3.594 -19.175
327 HD11 LEU 76 1HD1 LEU 76 -5.142 -3.864 -19.863
328 HD12 LEU 76 2HD1 LEU 76 -5.228 -5.518 -19.254
329 HD13 LEU 76 3HD1 LEU 76 -5.517 -5.190 -20.964
330 HD21 LEU 76 3HD2 LEU 76 -3.676 -4.627 -22.465
331 HD22 LEU 76 1HD2 LEU 76 -2.036 -4.442 -21.843
332 HD23 LEU 76 2HD2 LEU 76 -3.266 -3.238 -21.458
333 H ASP 77 H ASP 77 0.436 -6.518 -20.353
334 HA ASP 77 HA ASP 77 1.810 -4.082 -21.210
335 HB2 ASP 77 1HB ASP 77 2.649 -6.978 -21.140
336 HB3 ASP 77 2HB ASP 77 3.567 -5.766 -22.033
337 H GLN 78 H GLN 78 0.856 -3.269 -22.902
338 HA GLN 78 HA GLN 78 0.205 -5.043 -25.152
339 HB2 GLN 78 1HB GLN 78 -1.687 -3.728 -24.248
340 HB3 GLN 78 2HB GLN 78 -0.804 -2.243 -24.559
341 HG2 GLN 78 1HG GLN 78 -2.456 -2.558 -26.266
342 HG3 GLN 78 2HG GLN 78 -0.860 -2.775 -26.981
343 HE21 GLN 78 2HE2 GLN 78 -0.248 -4.802 -27.712
344 HE22 GLN 78 1HE2 GLN 78 -1.379 -6.095 -27.912
345 H GLN 79 H GLN 79 1.481 -1.773 -24.489
346 HA GLN 79 HA GLN 79 3.129 -2.048 -26.917
347 HB2 GLN 79 1HB GLN 79 1.843 0.465 -25.818
348 HB3 GLN 79 2HB GLN 79 3.003 0.431 -27.138
349 HG2 GLN 79 1HG GLN 79 1.473 -0.906 -28.475
350 HG3 GLN 79 2HG GLN 79 0.303 -0.906 -27.156
351 HE21 GLN 79 2HE2 GLN 79 1.825 0.944 -29.644
352 HE22 GLN 79 1HE2 GLN 79 0.733 2.287 -29.600
Start of MODEL 5
1 H ASN 33 H ASN 33 0.290 12.673 9.070
2 HA ASN 33 HA ASN 33 0.868 15.354 8.367
3 HB2 ASN 33 1HB ASN 33 2.551 12.874 7.943
4 HB3 ASN 33 2HB ASN 33 3.139 14.530 7.877
5 HD21 ASN 33 2HD2 ASN 33 3.384 15.690 9.771
6 HD22 ASN 33 1HD2 ASN 33 3.392 14.925 11.322
7 H MET 34 H MET 34 0.952 12.388 6.441
8 HA MET 34 HA MET 34 -0.048 13.783 4.108
9 HB2 MET 34 1HB MET 34 2.403 14.016 3.882
10 HB3 MET 34 2HB MET 34 2.597 12.284 4.105
11 HG2 MET 34 1HG MET 34 1.376 11.896 2.002
12 HG3 MET 34 2HG MET 34 1.240 13.641 1.777
13 HE1 MET 34 3HE MET 34 2.306 13.215 -0.651
14 HE2 MET 34 1HE MET 34 2.558 11.503 -0.316
15 HE3 MET 34 2HE MET 34 3.894 12.490 -0.909
16 H THR 35 H THR 35 -1.659 12.480 3.387
17 HA THR 35 HA THR 35 -1.421 9.602 3.930
18 HB THR 35 HB THR 35 -3.951 9.656 3.361
19 HG1 THR 35 HG1 THR 35 -4.556 11.621 2.843
20 HG21 THR 35 3HG2 THR 35 -3.048 9.123 5.555
21 HG22 THR 35 1HG2 THR 35 -4.500 10.122 5.696
22 HG23 THR 35 2HG2 THR 35 -2.906 10.841 5.922
23 H VAL 36 H VAL 36 -1.130 8.274 2.336
24 HA VAL 36 HA VAL 36 -2.001 9.041 -0.366
25 HB VAL 36 HB VAL 36 -0.148 7.739 -1.331
26 HG11 VAL 36 1HG1 VAL 36 0.168 10.121 -1.067
27 HG12 VAL 36 2HG1 VAL 36 1.694 9.276 -0.807
28 HG13 VAL 36 3HG1 VAL 36 0.778 9.889 0.570
29 HG21 VAL 36 3HG2 VAL 36 0.296 6.155 0.475
30 HG22 VAL 36 1HG2 VAL 36 0.900 7.461 1.495
31 HG23 VAL 36 2HG2 VAL 36 1.766 7.017 0.022
32 H ASP 37 H ASP 37 -2.951 7.417 -1.592
33 HA ASP 37 HA ASP 37 -3.731 5.027 -0.088
34 HB2 ASP 37 1HB ASP 37 -5.479 6.409 -1.250
35 HB3 ASP 37 2HB ASP 37 -4.732 5.981 -2.787
36 H ILE 38 H ILE 38 -2.923 3.080 -0.588
37 HA ILE 38 HA ILE 38 -1.155 2.884 -2.913
38 HB ILE 38 HB ILE 38 0.291 1.381 -1.325
39 HG12 ILE 38 1HG1 ILE 38 0.376 2.786 0.942
40 HG13 ILE 38 2HG1 ILE 38 -1.328 3.022 0.581
41 HG21 ILE 38 1HG2 ILE 38 1.132 3.291 -2.482
42 HG22 ILE 38 2HG2 ILE 38 1.684 3.346 -0.809
43 HG23 ILE 38 3HG2 ILE 38 0.360 4.386 -1.333
44 HD11 ILE 38 3HD1 ILE 38 0.046 0.374 0.946
45 HD12 ILE 38 1HD1 ILE 38 -1.665 0.603 0.588
46 HD13 ILE 38 2HD1 ILE 38 -0.997 1.179 2.117
47 H LEU 39 H LEU 39 -0.895 0.895 -3.850
48 HA LEU 39 HA LEU 39 -2.819 -1.182 -3.044
49 HG LEU 39 HG LEU 39 -4.263 0.060 -4.913
50 HB2 LEU 39 1HB LEU 39 -1.875 -0.188 -5.676
51 HB3 LEU 39 2HB LEU 39 -2.076 -1.922 -5.538
52 HD11 LEU 39 1HD1 LEU 39 -3.759 -1.495 -7.449
53 HD12 LEU 39 2HD1 LEU 39 -3.603 0.251 -7.253
54 HD13 LEU 39 3HD1 LEU 39 -5.184 -0.514 -7.102
55 HD21 LEU 39 3HD2 LEU 39 -4.301 -2.915 -5.422
56 HD22 LEU 39 1HD2 LEU 39 -5.718 -1.898 -5.164
57 HD23 LEU 39 2HD2 LEU 39 -4.545 -2.120 -3.865
58 H CYS 40 H CYS 40 -2.115 -3.120 -2.574
59 HA CYS 40 HA CYS 40 0.625 -3.486 -1.907
60 HB2 CYS 40 1HB CYS 40 -1.822 -4.596 -1.202
61 HB3 CYS 40 2HB CYS 40 -0.965 -5.902 -2.012
62 H ASN 41 H ASN 41 2.155 -4.800 -2.799
63 HA ASN 41 HA ASN 41 1.634 -5.774 -5.512
64 HB2 ASN 41 1HB ASN 41 4.262 -5.622 -4.009
65 HB3 ASN 41 2HB ASN 41 4.058 -5.973 -5.718
66 HD21 ASN 41 2HD2 ASN 41 5.613 -3.884 -4.457
67 HD22 ASN 41 1HD2 ASN 41 5.009 -2.385 -5.082
68 H ASP 42 H ASP 42 1.078 -7.014 -2.638
69 HA ASP 42 HA ASP 42 1.897 -9.725 -3.378
70 HB2 ASP 42 1HB ASP 42 2.046 -10.191 -0.862
71 HB3 ASP 42 2HB ASP 42 3.351 -9.272 -1.594
72 H CYS 43 H CYS 43 -0.420 -8.055 -1.147
73 HA CYS 43 HA CYS 43 -2.278 -10.254 -1.660
74 HB2 CYS 43 1HB CYS 43 -3.516 -9.637 0.245
75 HB3 CYS 43 2HB CYS 43 -1.846 -9.373 0.710
76 H ASN 44 H ASN 44 -1.550 -7.375 -2.993
77 HA ASN 44 HA ASN 44 -2.419 -5.965 -4.480
78 HB2 ASN 44 1HB ASN 44 -4.126 -8.393 -4.988
79 HB3 ASN 44 2HB ASN 44 -4.135 -6.969 -6.021
80 HD21 ASN 44 2HD2 ASN 44 -3.335 -8.029 -7.757
81 HD22 ASN 44 1HD2 ASN 44 -1.706 -8.581 -7.878
82 H GLY 45 H GLY 45 -3.568 -5.723 -1.797
83 HA2 GLY 45 1HA GLY 45 -6.178 -4.545 -2.494
84 HA3 GLY 45 2HA GLY 45 -5.753 -5.122 -0.885
85 H ARG 46 H ARG 46 -6.735 -2.491 -1.636
86 HA ARG 46 HA ARG 46 -4.365 -0.808 -1.384
87 HE ARG 46 HE ARG 46 -8.880 0.339 -4.147
88 HB2 ARG 46 1HB ARG 46 -5.677 1.048 -2.066
89 HB3 ARG 46 2HB ARG 46 -6.092 -0.283 -3.129
90 HG2 ARG 46 1HG ARG 46 -8.184 -0.583 -2.094
91 HG3 ARG 46 2HG ARG 46 -7.740 0.447 -0.735
92 HD2 ARG 46 1HD ARG 46 -9.114 1.807 -2.028
93 HD3 ARG 46 2HD ARG 46 -7.485 2.299 -2.478
94 HH11 ARG 46 1HH1 ARG 46 -7.403 3.507 -3.821
95 HH12 ARG 46 2HH1 ARG 46 -7.770 3.971 -5.457
96 HH21 ARG 46 1HH2 ARG 46 -9.314 0.958 -6.310
97 HH22 ARG 46 2HH2 ARG 46 -8.815 2.529 -6.860
98 H SER 47 H SER 47 -4.203 0.879 0.114
99 HA SER 47 HA SER 47 -6.047 0.962 2.363
100 HG SER 47 HG SER 47 -5.152 -1.224 2.591
101 HB2 SER 47 1HB SER 47 -3.073 0.459 2.732
102 HB3 SER 47 2HB SER 47 -4.206 0.828 4.032
103 H THR 48 H THR 48 -6.463 3.080 2.761
104 HA THR 48 HA THR 48 -4.622 5.127 1.823
105 HB THR 48 HB THR 48 -7.025 5.696 3.549
106 HG1 THR 48 HG1 THR 48 -6.961 4.744 0.889
107 HG21 THR 48 3HG2 THR 48 -5.551 7.555 2.912
108 HG22 THR 48 1HG2 THR 48 -7.133 7.717 2.147
109 HG23 THR 48 2HG2 THR 48 -5.754 7.139 1.212
110 H VAL 49 H VAL 49 -2.890 5.532 3.023
111 HA VAL 49 HA VAL 49 -3.060 5.598 5.941
112 HB VAL 49 HB VAL 49 -0.916 4.256 6.108
113 HG11 VAL 49 1HG1 VAL 49 -3.029 3.342 6.842
114 HG12 VAL 49 2HG1 VAL 49 -2.054 2.084 6.079
115 HG13 VAL 49 3HG1 VAL 49 -3.398 2.815 5.201
116 HG21 VAL 49 3HG2 VAL 49 -0.463 2.624 4.318
117 HG22 VAL 49 1HG2 VAL 49 -0.241 4.288 3.775
118 HG23 VAL 49 2HG2 VAL 49 -1.694 3.399 3.317
119 H GLN 50 H GLN 50 -0.758 6.193 6.795
120 HA GLN 50 HA GLN 50 -0.044 8.662 5.552
121 HB2 GLN 50 1HB GLN 50 1.266 7.159 7.831
122 HB3 GLN 50 2HB GLN 50 1.627 8.819 7.366
123 HG2 GLN 50 1HG GLN 50 -0.650 9.477 7.891
124 HG3 GLN 50 2HG GLN 50 -1.047 7.812 8.309
125 HE21 GLN 50 2HE2 GLN 50 0.695 10.654 9.245
126 HE22 GLN 50 1HE2 GLN 50 0.962 10.198 10.888
127 H PHE 51 H PHE 51 1.682 9.180 4.365
128 HA PHE 51 HA PHE 51 3.031 7.174 2.886
129 HD1 PHE 51 HD2 PHE 51 3.509 7.687 0.305
130 HD2 PHE 51 HD1 PHE 51 5.888 10.420 2.530
131 HE1 PHE 51 HE2 PHE 51 5.352 7.370 -1.289
132 HE2 PHE 51 HE1 PHE 51 7.737 10.110 0.939
133 HZ PHE 51 HZ PHE 51 7.471 8.580 -0.971
134 HB2 PHE 51 1HB PHE 51 2.531 9.395 1.933
135 HB3 PHE 51 2HB PHE 51 3.635 10.138 3.084
136 H HIS 52 H HIS 52 4.701 6.105 3.337
137 HA HIS 52 HA HIS 52 6.551 6.968 5.443
138 HD1 HIS 52 HD1 HIS 52 6.972 2.689 6.415
139 HD2 HIS 52 HD2 HIS 52 6.669 6.428 8.199
140 HE1 HIS 52 HE1 HIS 52 8.353 2.548 8.510
141 HE2 HIS 52 HE2 HIS 52 8.014 4.765 9.658
142 HB2 HIS 52 1HB HIS 52 4.691 5.354 6.189
143 HB3 HIS 52 2HB HIS 52 5.473 4.149 5.180
144 H ILE 53 H ILE 53 8.579 6.850 4.727
145 HA ILE 53 HA ILE 53 9.116 6.096 2.042
146 HB ILE 53 HB ILE 53 10.865 7.106 4.282
147 HG12 ILE 53 1HG1 ILE 53 11.195 8.949 2.459
148 HG13 ILE 53 2HG1 ILE 53 9.743 8.263 1.748
149 HG21 ILE 53 1HG2 ILE 53 11.841 6.465 1.504
150 HG22 ILE 53 2HG2 ILE 53 12.309 5.636 2.987
151 HG23 ILE 53 3HG2 ILE 53 12.753 7.326 2.748
152 HD11 ILE 53 3HD1 ILE 53 8.511 8.752 3.800
153 HD12 ILE 53 1HD1 ILE 53 9.240 10.204 3.115
154 HD13 ILE 53 2HD1 ILE 53 9.974 9.429 4.517
155 H LEU 54 H LEU 54 9.472 4.468 5.090
156 HA LEU 54 HA LEU 54 11.064 2.303 3.970
157 HG LEU 54 HG LEU 54 12.401 2.591 7.408
158 HB2 LEU 54 1HB LEU 54 9.970 2.815 6.734
159 HB3 LEU 54 2HB LEU 54 10.781 1.328 6.304
160 HD11 LEU 54 1HD1 LEU 54 14.088 3.143 5.739
161 HD12 LEU 54 2HD1 LEU 54 12.861 3.064 4.474
162 HD13 LEU 54 3HD1 LEU 54 13.282 1.615 5.389
163 HD21 LEU 54 3HD2 LEU 54 12.953 4.921 6.930
164 HD22 LEU 54 1HD2 LEU 54 11.283 4.738 7.468
165 HD23 LEU 54 2HD2 LEU 54 11.635 4.993 5.758
166 H GLY 55 H GLY 55 8.353 2.821 2.952
167 HA2 GLY 55 1HA GLY 55 6.931 1.213 1.963
168 HA3 GLY 55 2HA GLY 55 7.261 0.125 3.306
169 H MET 56 H MET 56 4.808 1.581 1.982
170 HA MET 56 HA MET 56 3.603 2.838 4.274
171 HB2 MET 56 1HB MET 56 2.741 2.258 1.482
172 HB3 MET 56 2HB MET 56 1.494 2.508 2.691
173 HG2 MET 56 1HG MET 56 1.853 4.569 1.609
174 HG3 MET 56 2HG MET 56 2.551 4.708 3.218
175 HE1 MET 56 3HE MET 56 3.255 4.518 -0.641
176 HE2 MET 56 1HE MET 56 4.002 3.022 -0.088
177 HE3 MET 56 2HE MET 56 5.011 4.343 -0.684
178 H LYS 57 H LYS 57 2.239 1.981 5.708
179 HA LYS 57 HA LYS 57 2.131 -0.849 5.977
180 HB2 LYS 57 1HB LYS 57 2.259 0.487 7.979
181 HB3 LYS 57 2HB LYS 57 0.804 1.370 7.550
182 HG2 LYS 57 1HG LYS 57 0.246 -0.164 9.282
183 HG3 LYS 57 2HG LYS 57 -0.481 -0.756 7.794
184 HD2 LYS 57 1HD LYS 57 0.393 -2.693 8.656
185 HD3 LYS 57 2HD LYS 57 1.728 -2.160 7.633
186 HE2 LYS 57 1HE LYS 57 2.620 -2.853 9.751
187 HE3 LYS 57 2HE LYS 57 2.757 -1.099 9.638
188 HZ1 LYS 57 3HZ LYS 57 0.794 -0.883 11.019
189 HZ2 LYS 57 1HZ LYS 57 1.970 -1.811 11.816
190 HZ3 LYS 57 2HZ LYS 57 0.629 -2.570 11.103
191 H CYS 58 H CYS 58 0.937 -1.997 4.646
192 HA CYS 58 HA CYS 58 -1.749 -1.271 3.888
193 HB2 CYS 58 1HB CYS 58 -0.573 -2.582 2.313
194 HB3 CYS 58 2HB CYS 58 -0.002 -3.696 3.537
195 H LYS 59 H LYS 59 -3.525 -1.660 5.093
196 HA LYS 59 HA LYS 59 -3.115 -2.785 7.723
197 HB2 LYS 59 1HB LYS 59 -5.601 -1.608 6.474
198 HB3 LYS 59 2HB LYS 59 -5.395 -2.011 8.175
199 HG2 LYS 59 1HG LYS 59 -3.633 -0.349 8.379
200 HG3 LYS 59 2HG LYS 59 -3.779 0.034 6.663
201 HD2 LYS 59 1HD LYS 59 -5.989 0.340 8.689
202 HD3 LYS 59 2HD LYS 59 -4.946 1.649 8.138
203 HE2 LYS 59 1HE LYS 59 -5.777 1.441 5.893
204 HE3 LYS 59 2HE LYS 59 -6.690 -0.006 6.317
205 HZ1 LYS 59 3HZ LYS 59 -8.134 1.906 6.230
206 HZ2 LYS 59 1HZ LYS 59 -7.181 2.731 7.366
207 HZ3 LYS 59 2HZ LYS 59 -8.035 1.339 7.820
208 H ILE 60 H ILE 60 -3.788 -4.191 4.860
209 HA ILE 60 HA ILE 60 -5.822 -6.056 5.771
210 HB ILE 60 HB ILE 60 -4.415 -5.965 3.083
211 HG12 ILE 60 1HG1 ILE 60 -7.105 -4.780 3.827
212 HG13 ILE 60 2HG1 ILE 60 -5.625 -3.842 3.684
213 HG21 ILE 60 1HG2 ILE 60 -5.511 -8.108 3.554
214 HG22 ILE 60 2HG2 ILE 60 -6.356 -7.233 2.276
215 HG23 ILE 60 3HG2 ILE 60 -7.018 -7.265 3.910
216 HD11 ILE 60 3HD1 ILE 60 -6.999 -3.623 1.703
217 HD12 ILE 60 1HD1 ILE 60 -6.969 -5.372 1.475
218 HD13 ILE 60 2HD1 ILE 60 -5.482 -4.438 1.322
219 H CYS 61 H CYS 61 -2.346 -5.971 5.195
220 HA CYS 61 HA CYS 61 -2.152 -8.700 6.207
221 HB2 CYS 61 1HB CYS 61 -0.762 -9.501 4.432
222 HB3 CYS 61 2HB CYS 61 -2.219 -8.829 3.713
223 H GLU 62 H GLU 62 -1.126 -5.624 6.412
224 HA GLU 62 HA GLU 62 0.472 -4.496 7.514
225 HB2 GLU 62 1HB GLU 62 1.305 -7.162 8.658
226 HB3 GLU 62 2HB GLU 62 1.729 -5.579 9.289
227 HG2 GLU 62 1HG GLU 62 -1.038 -6.771 9.166
228 HG3 GLU 62 2HG GLU 62 -0.041 -6.596 10.606
229 H SER 63 H SER 63 1.092 -5.796 4.874
230 HA SER 63 HA SER 63 3.993 -5.970 4.938
231 HG SER 63 HG SER 63 3.720 -6.850 1.394
232 HB2 SER 63 1HB SER 63 2.786 -7.576 3.526
233 HB3 SER 63 2HB SER 63 2.030 -6.255 2.639
234 H TYR 64 H TYR 64 5.338 -4.604 3.827
235 HA TYR 64 HA TYR 64 4.271 -1.902 3.471
236 HD1 TYR 64 HD1 TYR 64 4.915 -0.319 5.479
237 HD2 TYR 64 HD2 TYR 64 7.172 -3.885 5.975
238 HE1 TYR 64 HE1 TYR 64 4.505 -0.232 7.897
239 HE2 TYR 64 HE2 TYR 64 6.768 -3.810 8.391
240 HH TYR 64 HH TYR 64 6.243 -2.125 10.103
241 HB2 TYR 64 1HB TYR 64 7.120 -2.846 3.885
242 HB3 TYR 64 2HB TYR 64 6.606 -1.169 3.752
243 H ASN 65 H ASN 65 5.049 -4.524 1.606
244 HA ASN 65 HA ASN 65 6.355 -3.215 -0.598
245 HB2 ASN 65 1HB ASN 65 6.644 -5.649 -0.089
246 HB3 ASN 65 2HB ASN 65 4.960 -5.903 -0.536
247 HD21 ASN 65 2HD2 ASN 65 5.515 -7.319 -2.169
248 HD22 ASN 65 1HD2 ASN 65 6.232 -6.783 -3.655
249 H THR 66 H THR 66 5.137 -1.534 -1.248
250 HA THR 66 HA THR 66 2.519 -2.070 -2.449
251 HB THR 66 HB THR 66 1.632 0.039 -1.339
252 HG1 THR 66 HG1 THR 66 3.916 -0.433 0.309
253 HG21 THR 66 3HG2 THR 66 1.026 -1.092 0.788
254 HG22 THR 66 1HG2 THR 66 2.183 -2.365 0.403
255 HG23 THR 66 2HG2 THR 66 0.780 -2.105 -0.634
256 H ALA 67 H ALA 67 2.032 -0.762 -4.116
257 HA ALA 67 HA ALA 67 3.879 1.455 -4.761
258 HB1 ALA 67 3HB ALA 67 2.281 -0.306 -6.641
259 HB2 ALA 67 1HB ALA 67 4.026 -0.345 -6.399
260 HB3 ALA 67 2HB ALA 67 3.271 1.072 -7.127
261 H GLN 68 H GLN 68 2.863 3.413 -5.533
262 HA GLN 68 HA GLN 68 0.526 4.007 -4.066
263 HB2 GLN 68 1HB GLN 68 2.387 5.594 -4.649
264 HB3 GLN 68 2HB GLN 68 1.692 5.705 -6.258
265 HG2 GLN 68 1HG GLN 68 -0.331 6.661 -5.375
266 HG3 GLN 68 2HG GLN 68 0.231 6.427 -3.725
267 HE21 GLN 68 2HE2 GLN 68 0.002 8.617 -3.282
268 HE22 GLN 68 1HE2 GLN 68 1.134 9.790 -3.871
269 H ALA 69 H ALA 69 -1.564 4.111 -4.541
270 HA ALA 69 HA ALA 69 -2.353 2.574 -6.879
271 HB1 ALA 69 3HB ALA 69 -3.944 3.440 -4.471
272 HB2 ALA 69 1HB ALA 69 -3.076 1.910 -4.639
273 HB3 ALA 69 2HB ALA 69 -4.442 2.274 -5.693
274 H GLY 70 H GLY 70 -4.722 3.078 -7.544
275 HA2 GLY 70 1HA GLY 70 -5.944 5.509 -7.600
276 HA3 GLY 70 2HA GLY 70 -4.746 5.607 -8.890
277 H GLY 71 H GLY 71 -6.848 5.833 -10.149
278 HA2 GLY 71 1HA GLY 71 -8.132 3.253 -10.687
279 HA3 GLY 71 2HA GLY 71 -8.681 4.820 -11.262
280 H ARG 72 H ARG 72 -5.875 2.652 -11.562
281 HA ARG 72 HA ARG 72 -5.623 3.495 -14.375
282 HE ARG 72 HE ARG 72 -1.516 1.325 -13.121
283 HB2 ARG 72 1HB ARG 72 -3.756 4.244 -12.940
284 HB3 ARG 72 2HB ARG 72 -3.447 2.578 -12.478
285 HG2 ARG 72 1HG ARG 72 -2.999 2.086 -14.895
286 HG3 ARG 72 2HG ARG 72 -3.091 3.823 -15.197
287 HD2 ARG 72 1HD ARG 72 -0.783 3.177 -14.933
288 HD3 ARG 72 2HD ARG 72 -1.275 4.164 -13.560
289 HH11 ARG 72 1HH1 ARG 72 0.669 4.073 -12.902
290 HH12 ARG 72 2HH1 ARG 72 1.678 3.320 -11.708
291 HH21 ARG 72 1HH2 ARG 72 -0.195 0.370 -11.550
292 HH22 ARG 72 2HH2 ARG 72 1.183 1.232 -10.941
293 H ARG 73 H ARG 73 -6.592 1.903 -15.494
294 HA ARG 73 HA ARG 73 -5.662 -0.852 -15.026
295 HE ARG 73 HE ARG 73 -9.096 -1.503 -18.283
296 HB2 ARG 73 1HB ARG 73 -8.197 -0.216 -15.200
297 HB3 ARG 73 2HB ARG 73 -7.883 -0.082 -16.921
298 HG2 ARG 73 1HG ARG 73 -7.165 -2.587 -15.446
299 HG3 ARG 73 2HG ARG 73 -8.824 -2.287 -15.946
300 HD2 ARG 73 1HD ARG 73 -6.468 -2.267 -17.826
301 HD3 ARG 73 2HD ARG 73 -7.468 -3.685 -17.517
302 HH11 ARG 73 1HH1 ARG 73 -6.781 -3.758 -19.675
303 HH12 ARG 73 2HH1 ARG 73 -7.534 -3.747 -21.242
304 HH21 ARG 73 1HH2 ARG 73 -10.068 -1.499 -20.335
305 HH22 ARG 73 2HH2 ARG 73 -9.397 -2.466 -21.612
306 H ILE 74 H ILE 74 -4.305 -1.736 -16.481
307 HA ILE 74 HA ILE 74 -3.112 0.029 -18.386
308 HB ILE 74 HB ILE 74 -1.591 -1.902 -18.909
309 HG12 ILE 74 1HG1 ILE 74 -2.925 -3.244 -16.535
310 HG13 ILE 74 2HG1 ILE 74 -3.238 -3.700 -18.203
311 HG21 ILE 74 1HG2 ILE 74 -1.856 -1.017 -16.036
312 HG22 ILE 74 2HG2 ILE 74 -1.004 -0.169 -17.329
313 HG23 ILE 74 3HG2 ILE 74 -0.413 -1.730 -16.758
314 HD11 ILE 74 3HD1 ILE 74 -1.651 -5.215 -17.182
315 HD12 ILE 74 1HD1 ILE 74 -0.587 -3.862 -16.791
316 HD13 ILE 74 2HD1 ILE 74 -0.879 -4.294 -18.474
317 H SER 75 H SER 75 -3.882 0.449 -20.236
318 HA SER 75 HA SER 75 -5.173 -1.657 -21.836
319 HG SER 75 HG SER 75 -6.556 -0.353 -20.267
320 HB2 SER 75 1HB SER 75 -5.541 1.347 -22.057
321 HB3 SER 75 2HB SER 75 -6.460 0.105 -22.907
322 H LEU 76 H LEU 76 -3.598 -2.438 -23.094
323 HA LEU 76 HA LEU 76 -1.516 -0.659 -24.057
324 HG LEU 76 HG LEU 76 -2.234 -3.964 -25.550
325 HB2 LEU 76 1HB LEU 76 -0.237 -2.569 -24.598
326 HB3 LEU 76 2HB LEU 76 -0.967 -2.893 -23.043
327 HD11 LEU 76 1HD1 LEU 76 0.018 -5.238 -24.010
328 HD12 LEU 76 2HD1 LEU 76 0.106 -4.608 -25.654
329 HD13 LEU 76 3HD1 LEU 76 -0.913 -6.003 -25.300
330 HD21 LEU 76 3HD2 LEU 76 -2.146 -4.949 -22.692
331 HD22 LEU 76 1HD2 LEU 76 -2.982 -5.744 -24.028
332 HD23 LEU 76 2HD2 LEU 76 -3.512 -4.154 -23.478
333 H ASP 77 H ASP 77 -0.997 -0.376 -26.216
334 HA ASP 77 HA ASP 77 -3.126 -1.033 -28.120
335 HB2 ASP 77 1HB ASP 77 -2.268 0.701 -29.532
336 HB3 ASP 77 2HB ASP 77 -2.327 1.354 -27.901
337 H GLN 78 H GLN 78 -2.555 -1.909 -30.188
338 HA GLN 78 HA GLN 78 0.027 -3.066 -30.629
339 HB2 GLN 78 1HB GLN 78 -0.709 -5.422 -30.600
340 HB3 GLN 78 2HB GLN 78 -0.827 -4.696 -29.005
341 HG2 GLN 78 1HG GLN 78 -3.186 -4.532 -29.149
342 HG3 GLN 78 2HG GLN 78 -3.173 -4.939 -30.865
343 HE21 GLN 78 2HE2 GLN 78 -2.832 -7.047 -31.498
344 HE22 GLN 78 1HE2 GLN 78 -3.020 -8.378 -30.405
345 H GLN 79 H GLN 79 -0.029 -4.461 -32.640
346 HA GLN 79 HA GLN 79 -2.063 -3.511 -34.487
347 HB2 GLN 79 1HB GLN 79 -0.685 -4.799 -36.214
348 HB3 GLN 79 2HB GLN 79 0.017 -3.351 -35.519
349 HG2 GLN 79 1HG GLN 79 1.808 -4.764 -35.533
350 HG3 GLN 79 2HG GLN 79 1.193 -5.032 -33.909
351 HE21 GLN 79 2HE2 GLN 79 2.218 -7.017 -33.802
352 HE22 GLN 79 1HE2 GLN 79 1.632 -8.408 -34.651
Start of MODEL 6
1 H ASN 33 H ASN 33 -1.171 13.775 7.744
2 HA ASN 33 HA ASN 33 -1.214 16.429 6.695
3 HB2 ASN 33 1HB ASN 33 0.553 15.627 8.242
4 HB3 ASN 33 2HB ASN 33 1.126 14.516 7.000
5 HD21 ASN 33 2HD2 ASN 33 0.958 17.811 8.045
6 HD22 ASN 33 1HD2 ASN 33 2.127 18.448 6.935
7 H MET 34 H MET 34 0.291 13.485 5.350
8 HA MET 34 HA MET 34 -0.690 14.286 2.704
9 HB2 MET 34 1HB MET 34 1.705 14.837 2.834
10 HB3 MET 34 2HB MET 34 2.063 13.199 3.356
11 HG2 MET 34 1HG MET 34 1.216 12.374 1.172
12 HG3 MET 34 2HG MET 34 1.024 14.051 0.662
13 HE1 MET 34 3HE MET 34 2.543 13.359 -1.475
14 HE2 MET 34 1HE MET 34 2.768 11.739 -0.818
15 HE3 MET 34 2HE MET 34 4.166 12.688 -1.324
16 H THR 35 H THR 35 -2.358 12.794 2.716
17 HA THR 35 HA THR 35 -1.738 10.031 3.376
18 HB THR 35 HB THR 35 -4.246 9.737 2.780
19 HG1 THR 35 HG1 THR 35 -4.272 11.993 1.894
20 HG21 THR 35 3HG2 THR 35 -3.386 11.326 5.195
21 HG22 THR 35 1HG2 THR 35 -3.342 9.566 5.029
22 HG23 THR 35 2HG2 THR 35 -4.887 10.414 5.045
23 H VAL 36 H VAL 36 -1.273 8.562 1.966
24 HA VAL 36 HA VAL 36 -1.742 9.085 -0.893
25 HB VAL 36 HB VAL 36 0.331 7.840 -1.393
26 HG11 VAL 36 1HG1 VAL 36 0.453 10.260 -1.236
27 HG12 VAL 36 2HG1 VAL 36 1.948 9.531 -0.654
28 HG13 VAL 36 3HG1 VAL 36 0.765 10.155 0.497
29 HG21 VAL 36 3HG2 VAL 36 0.462 6.421 0.608
30 HG22 VAL 36 1HG2 VAL 36 0.821 7.835 1.596
31 HG23 VAL 36 2HG2 VAL 36 1.965 7.309 0.359
32 H ASP 37 H ASP 37 -2.226 7.277 -2.185
33 HA ASP 37 HA ASP 37 -3.326 5.026 -0.673
34 HB2 ASP 37 1HB ASP 37 -4.915 6.237 -2.086
35 HB3 ASP 37 2HB ASP 37 -3.892 5.964 -3.492
36 H ILE 38 H ILE 38 -2.360 3.138 -0.751
37 HA ILE 38 HA ILE 38 -0.414 2.601 -2.901
38 HB ILE 38 HB ILE 38 0.692 1.046 -1.203
39 HG12 ILE 38 1HG1 ILE 38 -0.467 2.837 0.914
40 HG13 ILE 38 2HG1 ILE 38 -1.366 1.417 0.400
41 HG21 ILE 38 1HG2 ILE 38 1.725 3.097 -1.960
42 HG22 ILE 38 2HG2 ILE 38 2.028 2.865 -0.238
43 HG23 ILE 38 3HG2 ILE 38 0.812 4.029 -0.771
44 HD11 ILE 38 3HD1 ILE 38 -0.099 0.894 2.355
45 HD12 ILE 38 1HD1 ILE 38 1.379 1.481 1.592
46 HD13 ILE 38 2HD1 ILE 38 0.586 0.031 0.967
47 H LEU 39 H LEU 39 -0.645 0.769 -4.033
48 HA LEU 39 HA LEU 39 -2.893 -0.972 -3.276
49 HG LEU 39 HG LEU 39 -4.665 -0.999 -4.980
50 HB2 LEU 39 1HB LEU 39 -2.689 0.530 -5.504
51 HB3 LEU 39 2HB LEU 39 -1.844 -0.892 -6.067
52 HD11 LEU 39 1HD1 LEU 39 -4.605 0.507 -6.882
53 HD12 LEU 39 2HD1 LEU 39 -5.400 -1.008 -7.312
54 HD13 LEU 39 3HD1 LEU 39 -3.743 -0.702 -7.834
55 HD21 LEU 39 3HD2 LEU 39 -3.500 -3.150 -5.035
56 HD22 LEU 39 1HD2 LEU 39 -3.115 -2.900 -6.739
57 HD23 LEU 39 2HD2 LEU 39 -4.794 -3.091 -6.232
58 H CYS 40 H CYS 40 -2.546 -3.062 -3.014
59 HA CYS 40 HA CYS 40 0.159 -3.963 -2.727
60 HB2 CYS 40 1HB CYS 40 -2.221 -4.579 -1.524
61 HB3 CYS 40 2HB CYS 40 -1.930 -5.987 -2.534
62 H ASN 41 H ASN 41 1.261 -5.373 -3.851
63 HA ASN 41 HA ASN 41 0.311 -6.088 -6.477
64 HB2 ASN 41 1HB ASN 41 2.956 -6.494 -5.089
65 HB3 ASN 41 2HB ASN 41 2.634 -7.012 -6.739
66 HD21 ASN 41 2HD2 ASN 41 4.509 -5.004 -5.642
67 HD22 ASN 41 1HD2 ASN 41 4.159 -3.550 -6.516
68 H ASP 42 H ASP 42 0.238 -7.662 -3.441
69 HA ASP 42 HA ASP 42 0.076 -10.286 -4.774
70 HB2 ASP 42 1HB ASP 42 1.005 -9.644 -1.978
71 HB3 ASP 42 2HB ASP 42 0.608 -11.275 -2.507
72 H CYS 43 H CYS 43 -1.331 -8.486 -1.965
73 HA CYS 43 HA CYS 43 -3.399 -10.518 -1.818
74 HB2 CYS 43 1HB CYS 43 -4.050 -9.732 0.280
75 HB3 CYS 43 2HB CYS 43 -2.314 -9.527 0.258
76 H ASN 44 H ASN 44 -3.044 -7.914 -3.690
77 HA ASN 44 HA ASN 44 -4.344 -6.674 -5.041
78 HB2 ASN 44 1HB ASN 44 -6.216 -9.017 -4.670
79 HB3 ASN 44 2HB ASN 44 -6.436 -7.762 -5.876
80 HD21 ASN 44 2HD2 ASN 44 -5.031 -7.647 -7.639
81 HD22 ASN 44 1HD2 ASN 44 -4.012 -8.981 -8.069
82 H GLY 45 H GLY 45 -4.577 -4.924 -3.676
83 HA2 GLY 45 1HA GLY 45 -7.044 -3.878 -3.184
84 HA3 GLY 45 2HA GLY 45 -6.659 -4.779 -1.718
85 H ARG 46 H ARG 46 -6.993 -1.938 -1.969
86 HA ARG 46 HA ARG 46 -4.231 -1.036 -1.549
87 HE ARG 46 HE ARG 46 -9.093 1.285 -4.317
88 HB2 ARG 46 1HB ARG 46 -5.011 1.200 -2.338
89 HB3 ARG 46 2HB ARG 46 -4.976 -0.053 -3.560
90 HG2 ARG 46 1HG ARG 46 -7.447 -0.336 -3.169
91 HG3 ARG 46 2HG ARG 46 -7.368 1.132 -2.192
92 HD2 ARG 46 1HD ARG 46 -6.366 2.291 -4.145
93 HD3 ARG 46 2HD ARG 46 -6.651 0.840 -5.101
94 HH11 ARG 46 1HH1 ARG 46 -6.733 3.737 -5.121
95 HH12 ARG 46 2HH1 ARG 46 -7.902 4.812 -5.822
96 HH21 ARG 46 1HH2 ARG 46 -10.627 2.694 -5.199
97 HH22 ARG 46 2HH2 ARG 46 -10.124 4.212 -5.870
98 H SER 47 H SER 47 -3.899 0.742 -0.174
99 HA SER 47 HA SER 47 -5.914 1.145 1.920
100 HG SER 47 HG SER 47 -5.220 -1.020 2.815
101 HB2 SER 47 1HB SER 47 -2.959 0.651 2.419
102 HB3 SER 47 2HB SER 47 -4.187 0.953 3.648
103 H THR 48 H THR 48 -6.299 3.304 2.031
104 HA THR 48 HA THR 48 -4.207 5.163 1.229
105 HB THR 48 HB THR 48 -6.955 5.849 2.303
106 HG1 THR 48 HG1 THR 48 -6.118 4.907 -0.169
107 HG21 THR 48 3HG2 THR 48 -5.322 7.693 2.350
108 HG22 THR 48 1HG2 THR 48 -6.577 7.989 1.148
109 HG23 THR 48 2HG2 THR 48 -4.981 7.436 0.640
110 H VAL 49 H VAL 49 -2.721 5.610 2.585
111 HA VAL 49 HA VAL 49 -3.248 5.747 5.480
112 HB VAL 49 HB VAL 49 -0.968 4.722 5.825
113 HG11 VAL 49 1HG1 VAL 49 -1.668 2.415 5.508
114 HG12 VAL 49 2HG1 VAL 49 -2.945 2.942 4.411
115 HG13 VAL 49 3HG1 VAL 49 -3.004 3.394 6.114
116 HG21 VAL 49 3HG2 VAL 49 -1.219 3.996 2.904
117 HG22 VAL 49 1HG2 VAL 49 0.016 3.394 4.011
118 HG23 VAL 49 2HG2 VAL 49 -0.040 5.109 3.599
119 H GLN 50 H GLN 50 -1.297 6.866 6.596
120 HA GLN 50 HA GLN 50 -0.663 9.285 5.182
121 HB2 GLN 50 1HB GLN 50 0.377 8.253 7.833
122 HB3 GLN 50 2HB GLN 50 0.662 9.865 7.192
123 HG2 GLN 50 1HG GLN 50 -1.776 10.255 7.208
124 HG3 GLN 50 2HG GLN 50 -1.993 8.680 7.963
125 HE21 GLN 50 2HE2 GLN 50 0.633 10.922 8.677
126 HE22 GLN 50 1HE2 GLN 50 0.137 11.260 10.299
127 H PHE 51 H PHE 51 1.215 9.871 4.234
128 HA PHE 51 HA PHE 51 2.905 7.858 3.197
129 HD1 PHE 51 HD2 PHE 51 3.654 8.079 0.750
130 HD2 PHE 51 HD1 PHE 51 5.574 11.277 2.793
131 HE1 PHE 51 HE2 PHE 51 5.685 7.702 -0.579
132 HE2 PHE 51 HE1 PHE 51 7.608 10.905 1.463
133 HZ PHE 51 HZ PHE 51 7.663 9.116 -0.221
134 HB2 PHE 51 1HB PHE 51 2.393 9.975 2.009
135 HB3 PHE 51 2HB PHE 51 3.336 10.854 3.206
136 H HIS 52 H HIS 52 4.543 6.931 4.028
137 HA HIS 52 HA HIS 52 5.950 8.153 6.295
138 HD1 HIS 52 HD1 HIS 52 6.899 3.974 7.633
139 HD2 HIS 52 HD2 HIS 52 5.836 7.795 8.878
140 HE1 HIS 52 HE1 HIS 52 7.871 4.224 9.937
141 HE2 HIS 52 HE2 HIS 52 7.309 6.578 10.631
142 HB2 HIS 52 1HB HIS 52 4.379 6.105 6.675
143 HB3 HIS 52 2HB HIS 52 5.651 5.178 5.893
144 H ILE 53 H ILE 53 8.072 8.388 6.020
145 HA ILE 53 HA ILE 53 9.326 7.908 3.527
146 HB ILE 53 HB ILE 53 10.543 8.596 6.214
147 HG12 ILE 53 1HG1 ILE 53 8.912 10.263 5.485
148 HG13 ILE 53 2HG1 ILE 53 10.537 10.930 5.428
149 HG21 ILE 53 1HG2 ILE 53 11.798 8.873 3.482
150 HG22 ILE 53 2HG2 ILE 53 12.267 7.727 4.738
151 HG23 ILE 53 3HG2 ILE 53 12.487 9.458 4.997
152 HD11 ILE 53 3HD1 ILE 53 10.566 10.609 3.008
153 HD12 ILE 53 1HD1 ILE 53 9.229 11.640 3.519
154 HD13 ILE 53 2HD1 ILE 53 8.929 9.957 3.077
155 H LEU 54 H LEU 54 9.318 6.162 6.582
156 HA LEU 54 HA LEU 54 11.385 4.319 5.765
157 HG LEU 54 HG LEU 54 11.807 4.689 9.433
158 HB2 LEU 54 1HB LEU 54 9.597 4.299 8.201
159 HB3 LEU 54 2HB LEU 54 10.917 3.186 7.926
160 HD11 LEU 54 1HD1 LEU 54 13.466 6.054 8.273
161 HD12 LEU 54 2HD1 LEU 54 12.596 5.808 6.757
162 HD13 LEU 54 3HD1 LEU 54 13.331 4.435 7.586
163 HD21 LEU 54 3HD2 LEU 54 10.009 6.302 9.476
164 HD22 LEU 54 1HD2 LEU 54 10.535 6.968 7.927
165 HD23 LEU 54 2HD2 LEU 54 11.564 7.125 9.352
166 H GLY 55 H GLY 55 8.104 4.554 5.101
167 HA2 GLY 55 1HA GLY 55 7.544 2.796 3.382
168 HA3 GLY 55 2HA GLY 55 7.923 1.645 4.653
169 H MET 56 H MET 56 5.445 2.693 3.028
170 HA MET 56 HA MET 56 3.573 3.107 5.217
171 HB2 MET 56 1HB MET 56 3.157 2.882 2.228
172 HB3 MET 56 2HB MET 56 1.843 3.057 3.380
173 HG2 MET 56 1HG MET 56 2.156 5.195 2.586
174 HG3 MET 56 2HG MET 56 3.022 5.206 4.115
175 HE1 MET 56 3HE MET 56 5.076 5.016 -0.028
176 HE2 MET 56 1HE MET 56 3.328 5.100 0.196
177 HE3 MET 56 2HE MET 56 4.206 3.641 0.654
178 H LYS 57 H LYS 57 2.275 1.579 6.069
179 HA LYS 57 HA LYS 57 2.781 -1.158 5.193
180 HB2 LYS 57 1HB LYS 57 3.100 -0.503 7.600
181 HB3 LYS 57 2HB LYS 57 1.363 -0.248 7.709
182 HG2 LYS 57 1HG LYS 57 1.017 -2.617 7.088
183 HG3 LYS 57 2HG LYS 57 2.762 -2.846 7.093
184 HD2 LYS 57 1HD LYS 57 1.929 -3.642 9.174
185 HD3 LYS 57 2HD LYS 57 2.760 -2.118 9.491
186 HE2 LYS 57 1HE LYS 57 0.654 -0.945 9.596
187 HE3 LYS 57 2HE LYS 57 -0.220 -2.403 9.129
188 HZ1 LYS 57 3HZ LYS 57 1.391 -2.139 11.604
189 HZ2 LYS 57 1HZ LYS 57 0.407 -3.448 11.171
190 HZ3 LYS 57 2HZ LYS 57 -0.290 -1.942 11.528
191 H CYS 58 H CYS 58 1.373 -2.288 4.097
192 HA CYS 58 HA CYS 58 -1.218 -1.412 3.363
193 HB2 CYS 58 1HB CYS 58 -0.008 -2.963 1.964
194 HB3 CYS 58 2HB CYS 58 0.131 -4.118 3.275
195 H LYS 59 H LYS 59 -3.122 -1.586 4.402
196 HA LYS 59 HA LYS 59 -3.092 -2.756 7.065
197 HB2 LYS 59 1HB LYS 59 -5.053 -0.959 5.649
198 HB3 LYS 59 2HB LYS 59 -5.347 -1.632 7.246
199 HG2 LYS 59 1HG LYS 59 -3.261 -0.543 8.036
200 HG3 LYS 59 2HG LYS 59 -3.113 0.228 6.455
201 HD2 LYS 59 1HD LYS 59 -5.233 1.360 6.786
202 HD3 LYS 59 2HD LYS 59 -5.460 0.526 8.324
203 HE2 LYS 59 1HE LYS 59 -3.177 2.402 7.709
204 HE3 LYS 59 2HE LYS 59 -4.645 2.869 8.565
205 HZ1 LYS 59 3HZ LYS 59 -2.790 0.740 9.483
206 HZ2 LYS 59 1HZ LYS 59 -4.103 1.381 10.333
207 HZ3 LYS 59 2HZ LYS 59 -2.741 2.340 10.036
208 H ILE 60 H ILE 60 -3.214 -4.470 4.652
209 HA ILE 60 HA ILE 60 -5.668 -5.939 5.347
210 HB ILE 60 HB ILE 60 -4.282 -6.100 2.656
211 HG12 ILE 60 1HG1 ILE 60 -6.835 -4.585 3.280
212 HG13 ILE 60 2HG1 ILE 60 -5.264 -3.813 3.123
213 HG21 ILE 60 1HG2 ILE 60 -6.999 -7.046 3.597
214 HG22 ILE 60 2HG2 ILE 60 -5.599 -8.063 3.257
215 HG23 ILE 60 3HG2 ILE 60 -6.381 -7.177 1.949
216 HD11 ILE 60 3HD1 ILE 60 -6.707 -5.335 0.972
217 HD12 ILE 60 1HD1 ILE 60 -5.132 -4.564 0.808
218 HD13 ILE 60 2HD1 ILE 60 -6.568 -3.580 1.095
219 H CYS 61 H CYS 61 -2.248 -6.200 4.361
220 HA CYS 61 HA CYS 61 -2.165 -8.881 5.590
221 HB2 CYS 61 1HB CYS 61 -0.548 -9.605 3.888
222 HB3 CYS 61 2HB CYS 61 -2.042 -9.067 3.132
223 H GLU 62 H GLU 62 -1.155 -5.822 5.936
224 HA GLU 62 HA GLU 62 0.388 -4.696 7.100
225 HB2 GLU 62 1HB GLU 62 0.749 -7.368 8.415
226 HB3 GLU 62 2HB GLU 62 1.512 -5.887 8.985
227 HG2 GLU 62 1HG GLU 62 -0.810 -4.894 9.085
228 HG3 GLU 62 2HG GLU 62 -1.416 -6.536 8.859
229 H SER 63 H SER 63 1.349 -5.852 4.578
230 HA SER 63 HA SER 63 4.225 -5.961 5.187
231 HG SER 63 HG SER 63 4.985 -8.326 2.916
232 HB2 SER 63 1HB SER 63 3.323 -8.063 4.230
233 HB3 SER 63 2HB SER 63 2.765 -7.171 2.816
234 H TYR 64 H TYR 64 5.637 -5.030 3.500
235 HA TYR 64 HA TYR 64 4.534 -2.508 2.483
236 HD1 TYR 64 HD1 TYR 64 5.349 -0.324 2.393
237 HD2 TYR 64 HD2 TYR 64 9.160 -2.198 2.175
238 HE1 TYR 64 HE1 TYR 64 6.254 1.657 1.263
239 HE2 TYR 64 HE2 TYR 64 10.076 -0.215 1.049
240 HH TYR 64 HH TYR 64 8.372 2.748 0.888
241 HB2 TYR 64 1HB TYR 64 6.422 -2.381 4.062
242 HB3 TYR 64 2HB TYR 64 7.390 -3.401 3.015
243 H ASN 65 H ASN 65 4.203 -5.148 1.175
244 HA ASN 65 HA ASN 65 5.735 -4.949 -1.288
245 HB2 ASN 65 1HB ASN 65 4.578 -7.015 -1.921
246 HB3 ASN 65 2HB ASN 65 5.260 -7.143 -0.308
247 HD21 ASN 65 2HD2 ASN 65 3.095 -8.552 -1.704
248 HD22 ASN 65 1HD2 ASN 65 1.734 -8.457 -0.636
249 H THR 66 H THR 66 4.224 -2.692 -0.810
250 HA THR 66 HA THR 66 1.991 -2.839 -2.715
251 HB THR 66 HB THR 66 1.231 -0.724 -1.575
252 HG1 THR 66 HG1 THR 66 3.350 -0.408 -0.524
253 HG21 THR 66 3HG2 THR 66 1.354 -3.224 0.097
254 HG22 THR 66 1HG2 THR 66 0.136 -2.843 -1.120
255 HG23 THR 66 2HG2 THR 66 0.247 -1.875 0.352
256 H ALA 67 H ALA 67 1.838 -1.349 -4.285
257 HA ALA 67 HA ALA 67 4.155 0.405 -4.740
258 HB1 ALA 67 3HB ALA 67 2.144 -0.717 -6.696
259 HB2 ALA 67 1HB ALA 67 3.814 -1.250 -6.504
260 HB3 ALA 67 2HB ALA 67 3.469 0.371 -7.112
261 H GLN 68 H GLN 68 3.798 2.602 -4.907
262 HA GLN 68 HA GLN 68 1.381 3.665 -3.862
263 HB2 GLN 68 1HB GLN 68 3.615 4.761 -3.651
264 HB3 GLN 68 2HB GLN 68 3.558 5.124 -5.367
265 HG2 GLN 68 1HG GLN 68 1.511 6.466 -4.975
266 HG3 GLN 68 2HG GLN 68 1.693 6.181 -3.248
267 HE21 GLN 68 2HE2 GLN 68 1.903 8.365 -2.824
268 HE22 GLN 68 1HE2 GLN 68 3.331 9.259 -3.220
269 H ALA 69 H ALA 69 -0.470 3.939 -4.869
270 HA ALA 69 HA ALA 69 -0.622 3.588 -7.737
271 HB1 ALA 69 3HB ALA 69 -3.023 3.396 -7.377
272 HB2 ALA 69 1HB ALA 69 -2.821 3.874 -5.691
273 HB3 ALA 69 2HB ALA 69 -2.138 2.353 -6.265
274 H GLY 70 H GLY 70 0.033 5.399 -8.721
275 HA2 GLY 70 1HA GLY 70 -1.682 7.768 -8.359
276 HA3 GLY 70 2HA GLY 70 0.063 7.935 -8.511
277 H GLY 71 H GLY 71 -2.309 5.924 -10.193
278 HA2 GLY 71 1HA GLY 71 -2.302 7.307 -12.633
279 HA3 GLY 71 2HA GLY 71 -1.066 6.063 -12.698
280 H ARG 72 H ARG 72 -1.698 4.223 -13.539
281 HA ARG 72 HA ARG 72 -4.440 3.309 -13.044
282 HE ARG 72 HE ARG 72 -1.146 2.538 -18.001
283 HB2 ARG 72 1HB ARG 72 -4.616 2.474 -15.333
284 HB3 ARG 72 2HB ARG 72 -4.329 4.206 -15.336
285 HG2 ARG 72 1HG ARG 72 -2.037 3.883 -15.964
286 HG3 ARG 72 2HG ARG 72 -2.189 2.135 -15.784
287 HD2 ARG 72 1HD ARG 72 -3.894 2.160 -17.586
288 HD3 ARG 72 2HD ARG 72 -3.583 3.879 -17.803
289 HH11 ARG 72 1HH1 ARG 72 -4.161 2.796 -19.786
290 HH12 ARG 72 2HH1 ARG 72 -3.411 2.434 -21.312
291 HH21 ARG 72 1HH2 ARG 72 -0.195 2.051 -19.984
292 HH22 ARG 72 2HH2 ARG 72 -1.165 2.005 -21.424
293 H ARG 73 H ARG 73 -4.738 0.995 -13.238
294 HA ARG 73 HA ARG 73 -2.275 -0.586 -13.275
295 HE ARG 73 HE ARG 73 -7.298 -1.449 -10.354
296 HB2 ARG 73 1HB ARG 73 -3.079 -2.021 -11.446
297 HB3 ARG 73 2HB ARG 73 -2.841 -0.369 -10.914
298 HG2 ARG 73 1HG ARG 73 -4.822 -0.694 -9.920
299 HG3 ARG 73 2HG ARG 73 -5.453 -0.292 -11.515
300 HD2 ARG 73 1HD ARG 73 -5.453 -2.739 -12.044
301 HD3 ARG 73 2HD ARG 73 -5.027 -3.045 -10.361
302 HH11 ARG 73 1HH1 ARG 73 -6.409 -4.670 -11.451
303 HH12 ARG 73 2HH1 ARG 73 -8.005 -5.311 -11.215
304 HH21 ARG 73 1HH2 ARG 73 -9.366 -2.302 -10.059
305 HH22 ARG 73 2HH2 ARG 73 -9.688 -3.967 -10.442
306 H ILE 74 H ILE 74 -2.515 -2.704 -14.082
307 HA ILE 74 HA ILE 74 -4.544 -2.906 -16.100
308 HB ILE 74 HB ILE 74 -2.362 -4.834 -15.277
309 HG12 ILE 74 1HG1 ILE 74 -1.483 -2.802 -16.237
310 HG13 ILE 74 2HG1 ILE 74 -1.294 -4.116 -17.389
311 HG21 ILE 74 1HG2 ILE 74 -4.168 -6.116 -16.294
312 HG22 ILE 74 2HG2 ILE 74 -2.764 -6.057 -17.361
313 HG23 ILE 74 3HG2 ILE 74 -4.165 -5.037 -17.690
314 HD11 ILE 74 3HD1 ILE 74 -3.393 -1.957 -17.483
315 HD12 ILE 74 1HD1 ILE 74 -3.242 -3.283 -18.636
316 HD13 ILE 74 2HD1 ILE 74 -1.962 -2.075 -18.509
317 H SER 75 H SER 75 -6.442 -3.847 -15.986
318 HA SER 75 HA SER 75 -7.160 -5.432 -13.652
319 HG SER 75 HG SER 75 -10.482 -5.402 -14.917
320 HB2 SER 75 1HB SER 75 -8.671 -3.619 -14.504
321 HB3 SER 75 2HB SER 75 -8.880 -4.549 -15.986
322 H LEU 76 H LEU 76 -6.267 -7.426 -13.885
323 HA LEU 76 HA LEU 76 -7.229 -8.944 -16.205
324 HG LEU 76 HG LEU 76 -5.475 -11.511 -15.663
325 HB2 LEU 76 1HB LEU 76 -4.787 -8.636 -16.322
326 HB3 LEU 76 2HB LEU 76 -4.617 -9.391 -14.749
327 HD11 LEU 76 1HD1 LEU 76 -5.749 -11.805 -18.077
328 HD12 LEU 76 2HD1 LEU 76 -5.500 -10.076 -18.319
329 HD13 LEU 76 3HD1 LEU 76 -6.914 -10.648 -17.434
330 HD21 LEU 76 3HD2 LEU 76 -3.194 -10.336 -17.234
331 HD22 LEU 76 1HD2 LEU 76 -3.543 -12.054 -17.045
332 HD23 LEU 76 2HD2 LEU 76 -3.086 -11.089 -15.642
333 H ASP 77 H ASP 77 -8.972 -9.744 -15.336
334 HA ASP 77 HA ASP 77 -8.609 -11.718 -13.181
335 HB2 ASP 77 1HB ASP 77 -9.924 -9.704 -12.466
336 HB3 ASP 77 2HB ASP 77 -11.103 -10.069 -13.715
337 H GLN 78 H GLN 78 -9.123 -11.207 -16.353
338 HA GLN 78 HA GLN 78 -11.163 -13.087 -17.018
339 HB2 GLN 78 1HB GLN 78 -8.922 -12.036 -18.764
340 HB3 GLN 78 2HB GLN 78 -10.425 -12.765 -19.309
341 HG2 GLN 78 1HG GLN 78 -11.685 -10.896 -18.399
342 HG3 GLN 78 2HG GLN 78 -10.193 -10.164 -17.811
343 HE21 GLN 78 2HE2 GLN 78 -8.751 -9.263 -19.301
344 HE22 GLN 78 1HE2 GLN 78 -9.217 -8.899 -20.928
345 H GLN 79 H GLN 79 -7.626 -13.126 -17.394
346 HA GLN 79 HA GLN 79 -7.700 -16.055 -17.298
347 HB2 GLN 79 1HB GLN 79 -5.552 -14.241 -18.403
348 HB3 GLN 79 2HB GLN 79 -5.464 -15.994 -18.335
349 HG2 GLN 79 1HG GLN 79 -7.567 -16.016 -19.737
350 HG3 GLN 79 2HG GLN 79 -7.299 -14.296 -19.993
351 HE21 GLN 79 2HE2 GLN 79 -7.017 -14.546 -22.198
352 HE22 GLN 79 1HE2 GLN 79 -5.595 -15.268 -22.875
Start of MODEL 7
1 H ASN 33 H ASN 33 -2.117 16.176 5.388
2 HA ASN 33 HA ASN 33 0.235 14.459 4.997
3 HB2 ASN 33 1HB ASN 33 -2.482 13.878 6.189
4 HB3 ASN 33 2HB ASN 33 -1.291 12.628 5.845
5 HD21 ASN 33 2HD2 ASN 33 -2.205 15.226 7.923
6 HD22 ASN 33 1HD2 ASN 33 -0.971 14.986 9.113
7 H MET 34 H MET 34 0.549 13.889 2.976
8 HA MET 34 HA MET 34 -1.579 13.641 1.067
9 HB2 MET 34 1HB MET 34 0.671 14.392 0.393
10 HB3 MET 34 2HB MET 34 1.334 12.834 0.864
11 HG2 MET 34 1HG MET 34 -0.028 11.745 -0.858
12 HG3 MET 34 2HG MET 34 -0.664 13.316 -1.337
13 HE1 MET 34 3HE MET 34 3.748 12.036 -1.851
14 HE2 MET 34 1HE MET 34 2.493 10.997 -1.176
15 HE3 MET 34 2HE MET 34 3.048 12.410 -0.276
16 H THR 35 H THR 35 -2.898 11.958 0.996
17 HA THR 35 HA THR 35 -2.007 9.383 2.014
18 HB THR 35 HB THR 35 -4.425 8.712 1.480
19 HG1 THR 35 HG1 THR 35 -5.877 10.351 1.130
20 HG21 THR 35 3HG2 THR 35 -5.264 9.753 3.551
21 HG22 THR 35 1HG2 THR 35 -3.868 10.832 3.558
22 HG23 THR 35 2HG2 THR 35 -3.640 9.092 3.745
23 H VAL 36 H VAL 36 -1.357 7.803 0.782
24 HA VAL 36 HA VAL 36 -1.879 7.921 -2.108
25 HB VAL 36 HB VAL 36 0.346 6.837 -2.472
26 HG11 VAL 36 1HG1 VAL 36 0.061 9.221 -2.837
27 HG12 VAL 36 2HG1 VAL 36 1.668 8.879 -2.195
28 HG13 VAL 36 3HG1 VAL 36 0.419 9.541 -1.140
29 HG21 VAL 36 3HG2 VAL 36 2.059 6.990 -0.712
30 HG22 VAL 36 1HG2 VAL 36 0.742 5.910 -0.251
31 HG23 VAL 36 2HG2 VAL 36 0.830 7.536 0.430
32 H ASP 37 H ASP 37 -2.234 5.999 -3.158
33 HA ASP 37 HA ASP 37 -3.113 3.807 -1.471
34 HB2 ASP 37 1HB ASP 37 -3.643 4.673 -4.227
35 HB3 ASP 37 2HB ASP 37 -3.523 2.927 -4.025
36 H ILE 38 H ILE 38 -2.135 1.954 -1.216
37 HA ILE 38 HA ILE 38 0.141 1.247 -2.940
38 HB ILE 38 HB ILE 38 1.107 0.133 -0.827
39 HG12 ILE 38 1HG1 ILE 38 -0.258 2.322 0.687
40 HG13 ILE 38 2HG1 ILE 38 -1.128 0.818 0.407
41 HG21 ILE 38 1HG2 ILE 38 1.146 3.124 -1.131
42 HG22 ILE 38 2HG2 ILE 38 2.183 1.962 -1.958
43 HG23 ILE 38 3HG2 ILE 38 2.312 2.171 -0.212
44 HD11 ILE 38 3HD1 ILE 38 -0.111 0.609 2.502
45 HD12 ILE 38 1HD1 ILE 38 1.427 1.227 1.895
46 HD13 ILE 38 2HD1 ILE 38 0.857 -0.357 1.385
47 H LEU 39 H LEU 39 -0.017 -0.730 -3.772
48 HA LEU 39 HA LEU 39 -2.122 -2.487 -2.711
49 HG LEU 39 HG LEU 39 -3.718 -3.269 -4.274
50 HB2 LEU 39 1HB LEU 39 -2.137 -1.371 -5.102
51 HB3 LEU 39 2HB LEU 39 -1.036 -2.673 -5.503
52 HD11 LEU 39 1HD1 LEU 39 -4.645 -3.447 -6.526
53 HD12 LEU 39 2HD1 LEU 39 -3.141 -2.818 -7.201
54 HD13 LEU 39 3HD1 LEU 39 -4.140 -1.794 -6.170
55 HD21 LEU 39 3HD2 LEU 39 -1.923 -4.781 -6.171
56 HD22 LEU 39 1HD2 LEU 39 -3.475 -5.339 -5.547
57 HD23 LEU 39 2HD2 LEU 39 -2.119 -5.096 -4.447
58 H CYS 40 H CYS 40 -1.449 -4.281 -1.774
59 HA CYS 40 HA CYS 40 1.247 -4.917 -1.378
60 HB2 CYS 40 1HB CYS 40 -1.314 -6.243 -0.760
61 HB3 CYS 40 2HB CYS 40 0.109 -7.267 -0.777
62 H ASN 41 H ASN 41 2.632 -6.329 -2.163
63 HA ASN 41 HA ASN 41 1.998 -7.822 -4.566
64 HB2 ASN 41 1HB ASN 41 4.545 -7.825 -2.915
65 HB3 ASN 41 2HB ASN 41 4.360 -8.465 -4.535
66 HD21 ASN 41 2HD2 ASN 41 4.202 -7.028 -6.280
67 HD22 ASN 41 1HD2 ASN 41 4.665 -5.370 -6.138
68 H ASP 42 H ASP 42 1.698 -8.289 -1.237
69 HA ASP 42 HA ASP 42 1.968 -11.191 -1.398
70 HB2 ASP 42 1HB ASP 42 1.804 -11.091 1.127
71 HB3 ASP 42 2HB ASP 42 3.228 -10.339 0.416
72 H CYS 43 H CYS 43 -0.443 -8.827 -0.059
73 HA CYS 43 HA CYS 43 -2.394 -11.009 -0.069
74 HB2 CYS 43 1HB CYS 43 -3.655 -9.887 1.556
75 HB3 CYS 43 2HB CYS 43 -1.992 -9.547 2.002
76 H ASN 44 H ASN 44 -1.492 -8.751 -2.213
77 HA ASN 44 HA ASN 44 -2.339 -7.510 -3.882
78 HB2 ASN 44 1HB ASN 44 -4.152 -9.894 -3.842
79 HB3 ASN 44 2HB ASN 44 -4.299 -8.646 -5.076
80 HD21 ASN 44 2HD2 ASN 44 -3.652 -9.823 -6.752
81 HD22 ASN 44 1HD2 ASN 44 -2.063 -10.470 -6.948
82 H GLY 45 H GLY 45 -3.291 -6.679 -1.287
83 HA2 GLY 45 1HA GLY 45 -5.849 -5.454 -2.079
84 HA3 GLY 45 2HA GLY 45 -5.413 -5.819 -0.408
85 H ARG 46 H ARG 46 -6.010 -3.302 -2.077
86 HA ARG 46 HA ARG 46 -3.557 -1.819 -1.562
87 HE ARG 46 HE ARG 46 -8.756 -0.376 -4.655
88 HB2 ARG 46 1HB ARG 46 -4.580 0.009 -2.818
89 HB3 ARG 46 2HB ARG 46 -4.574 -1.476 -3.746
90 HG2 ARG 46 1HG ARG 46 -6.892 -1.784 -3.467
91 HG3 ARG 46 2HG ARG 46 -6.973 -0.551 -2.206
92 HD2 ARG 46 1HD ARG 46 -6.354 1.155 -3.869
93 HD3 ARG 46 2HD ARG 46 -6.361 -0.090 -5.123
94 HH11 ARG 46 1HH1 ARG 46 -7.249 2.606 -3.534
95 HH12 ARG 46 2HH1 ARG 46 -8.740 3.497 -3.555
96 HH21 ARG 46 1HH2 ARG 46 -10.690 0.783 -4.650
97 HH22 ARG 46 2HH2 ARG 46 -10.704 2.449 -4.180
98 H SER 47 H SER 47 -3.487 0.039 -0.345
99 HA SER 47 HA SER 47 -5.744 0.595 1.443
100 HG SER 47 HG SER 47 -5.180 -1.202 2.954
101 HB2 SER 47 1HB SER 47 -2.842 0.270 2.287
102 HB3 SER 47 2HB SER 47 -4.141 0.849 3.333
103 H THR 48 H THR 48 -6.221 2.739 1.365
104 HA THR 48 HA THR 48 -4.211 4.596 0.372
105 HB THR 48 HB THR 48 -6.825 5.503 1.548
106 HG1 THR 48 HG1 THR 48 -6.450 4.424 -1.083
107 HG21 THR 48 3HG2 THR 48 -5.181 7.180 0.856
108 HG22 THR 48 1HG2 THR 48 -6.602 7.238 -0.190
109 HG23 THR 48 2HG2 THR 48 -5.118 6.469 -0.758
110 H VAL 49 H VAL 49 -2.698 5.173 1.732
111 HA VAL 49 HA VAL 49 -3.358 5.668 4.556
112 HB VAL 49 HB VAL 49 -1.123 4.679 5.175
113 HG11 VAL 49 1HG1 VAL 49 -3.147 2.807 3.965
114 HG12 VAL 49 2HG1 VAL 49 -3.144 3.441 5.612
115 HG13 VAL 49 3HG1 VAL 49 -1.870 2.338 5.089
116 HG21 VAL 49 3HG2 VAL 49 -0.074 4.715 2.970
117 HG22 VAL 49 1HG2 VAL 49 -1.239 3.527 2.385
118 HG23 VAL 49 2HG2 VAL 49 -0.080 3.082 3.639
119 H GLN 50 H GLN 50 -1.442 6.826 5.634
120 HA GLN 50 HA GLN 50 -0.763 9.147 4.107
121 HB2 GLN 50 1HB GLN 50 0.080 8.159 6.831
122 HB3 GLN 50 2HB GLN 50 0.623 9.689 6.157
123 HG2 GLN 50 1HG GLN 50 -1.471 10.649 6.303
124 HG3 GLN 50 2HG GLN 50 -2.295 9.089 6.341
125 HE21 GLN 50 2HE2 GLN 50 -0.360 11.342 8.175
126 HE22 GLN 50 1HE2 GLN 50 -0.832 10.761 9.734
127 H PHE 51 H PHE 51 1.267 9.816 3.428
128 HA PHE 51 HA PHE 51 2.883 7.723 2.363
129 HD1 PHE 51 HD2 PHE 51 3.699 7.906 -0.070
130 HD2 PHE 51 HD1 PHE 51 5.704 11.008 2.037
131 HE1 PHE 51 HE2 PHE 51 5.743 7.449 -1.356
132 HE2 PHE 51 HE1 PHE 51 7.757 10.552 0.756
133 HZ PHE 51 HZ PHE 51 7.777 8.773 -0.943
134 HB2 PHE 51 1HB PHE 51 2.484 9.846 1.146
135 HB3 PHE 51 2HB PHE 51 3.423 10.704 2.364
136 H HIS 52 H HIS 52 4.159 6.611 3.553
137 HA HIS 52 HA HIS 52 5.751 7.913 5.640
138 HD1 HIS 52 HD1 HIS 52 6.813 3.804 6.717
139 HD2 HIS 52 HD2 HIS 52 5.636 7.368 8.505
140 HE1 HIS 52 HE1 HIS 52 8.059 3.907 8.899
141 HE2 HIS 52 HE2 HIS 52 7.464 6.144 9.888
142 HB2 HIS 52 1HB HIS 52 4.094 6.098 6.310
143 HB3 HIS 52 2HB HIS 52 5.081 4.963 5.402
144 H ILE 53 H ILE 53 7.795 8.187 5.138
145 HA ILE 53 HA ILE 53 8.865 7.419 2.657
146 HB ILE 53 HB ILE 53 10.112 8.679 5.096
147 HG12 ILE 53 1HG1 ILE 53 10.417 10.550 3.304
148 HG13 ILE 53 2HG1 ILE 53 9.201 9.653 2.410
149 HG21 ILE 53 1HG2 ILE 53 12.143 9.167 3.812
150 HG22 ILE 53 2HG2 ILE 53 11.549 8.151 2.499
151 HG23 ILE 53 3HG2 ILE 53 11.927 7.434 4.066
152 HD11 ILE 53 3HD1 ILE 53 7.636 9.937 4.280
153 HD12 ILE 53 1HD1 ILE 53 8.206 11.481 3.646
154 HD13 ILE 53 2HD1 ILE 53 8.865 10.852 5.154
155 H LEU 54 H LEU 54 9.263 6.031 5.882
156 HA LEU 54 HA LEU 54 11.087 3.995 4.878
157 HG LEU 54 HG LEU 54 12.485 4.532 8.250
158 HB2 LEU 54 1HB LEU 54 10.094 4.783 7.586
159 HB3 LEU 54 2HB LEU 54 10.747 3.177 7.361
160 HD11 LEU 54 1HD1 LEU 54 13.207 2.980 6.550
161 HD12 LEU 54 2HD1 LEU 54 14.197 4.439 6.520
162 HD13 LEU 54 3HD1 LEU 54 12.948 4.196 5.298
163 HD21 LEU 54 3HD2 LEU 54 13.299 6.580 7.209
164 HD22 LEU 54 1HD2 LEU 54 11.621 6.743 7.723
165 HD23 LEU 54 2HD2 LEU 54 12.001 6.500 6.017
166 H GLY 55 H GLY 55 8.452 4.000 3.730
167 HA2 GLY 55 1HA GLY 55 7.497 2.032 2.801
168 HA3 GLY 55 2HA GLY 55 7.842 1.186 4.299
169 H MET 56 H MET 56 5.461 2.625 2.450
170 HA MET 56 HA MET 56 3.630 3.370 4.506
171 HB2 MET 56 1HB MET 56 3.249 2.682 1.593
172 HB3 MET 56 2HB MET 56 1.890 3.033 2.646
173 HG2 MET 56 1HG MET 56 2.300 5.025 1.545
174 HG3 MET 56 2HG MET 56 3.048 5.251 3.119
175 HE1 MET 56 3HE MET 56 3.586 4.816 -0.721
176 HE2 MET 56 1HE MET 56 4.330 3.330 -0.134
177 HE3 MET 56 2HE MET 56 5.332 4.598 -0.844
178 H LYS 57 H LYS 57 2.178 2.156 5.615
179 HA LYS 57 HA LYS 57 2.446 -0.744 5.311
180 HB2 LYS 57 1HB LYS 57 3.036 0.146 7.496
181 HB3 LYS 57 2HB LYS 57 1.468 0.922 7.637
182 HG2 LYS 57 1HG LYS 57 0.376 -1.256 7.720
183 HG3 LYS 57 2HG LYS 57 1.933 -2.057 7.521
184 HD2 LYS 57 1HD LYS 57 1.284 -2.100 9.849
185 HD3 LYS 57 2HD LYS 57 2.689 -1.057 9.649
186 HE2 LYS 57 1HE LYS 57 1.099 -0.056 11.187
187 HE3 LYS 57 2HE LYS 57 1.219 0.913 9.720
188 HZ1 LYS 57 3HZ LYS 57 -0.845 0.077 8.958
189 HZ2 LYS 57 1HZ LYS 57 -1.082 0.551 10.564
190 HZ3 LYS 57 2HZ LYS 57 -0.924 -1.094 10.182
191 H CYS 58 H CYS 58 0.921 -1.831 4.368
192 HA CYS 58 HA CYS 58 -1.738 -0.962 3.839
193 HB2 CYS 58 1HB CYS 58 -0.903 -2.542 2.355
194 HB3 CYS 58 2HB CYS 58 -0.169 -3.495 3.611
195 H LYS 59 H LYS 59 -3.535 -1.109 5.102
196 HA LYS 59 HA LYS 59 -3.076 -1.987 7.834
197 HB2 LYS 59 1HB LYS 59 -5.363 -0.440 6.617
198 HB3 LYS 59 2HB LYS 59 -5.205 -0.823 8.327
199 HG2 LYS 59 1HG LYS 59 -3.127 0.454 8.429
200 HG3 LYS 59 2HG LYS 59 -3.276 0.833 6.713
201 HD2 LYS 59 1HD LYS 59 -5.295 1.597 8.819
202 HD3 LYS 59 2HD LYS 59 -4.037 2.666 8.205
203 HE2 LYS 59 1HE LYS 59 -4.978 2.567 5.981
204 HE3 LYS 59 2HE LYS 59 -6.170 1.379 6.503
205 HZ1 LYS 59 3HZ LYS 59 -7.121 3.591 6.372
206 HZ2 LYS 59 1HZ LYS 59 -5.981 4.175 7.482
207 HZ3 LYS 59 2HZ LYS 59 -7.129 3.033 7.973
208 H ILE 60 H ILE 60 -4.186 -3.510 5.161
209 HA ILE 60 HA ILE 60 -6.405 -4.922 6.367
210 HB ILE 60 HB ILE 60 -5.028 -5.822 3.838
211 HG12 ILE 60 1HG1 ILE 60 -7.176 -3.681 3.969
212 HG13 ILE 60 2HG1 ILE 60 -5.472 -3.341 3.700
213 HG21 ILE 60 1HG2 ILE 60 -7.319 -6.546 3.263
214 HG22 ILE 60 2HG2 ILE 60 -7.888 -5.923 4.813
215 HG23 ILE 60 3HG2 ILE 60 -6.746 -7.269 4.768
216 HD11 ILE 60 3HD1 ILE 60 -7.271 -4.950 1.905
217 HD12 ILE 60 1HD1 ILE 60 -5.552 -4.663 1.635
218 HD13 ILE 60 2HD1 ILE 60 -6.686 -3.311 1.614
219 H CYS 61 H CYS 61 -2.970 -5.454 5.785
220 HA CYS 61 HA CYS 61 -3.169 -7.992 7.248
221 HB2 CYS 61 1HB CYS 61 -1.740 -9.143 5.737
222 HB3 CYS 61 2HB CYS 61 -2.988 -8.374 4.771
223 H GLU 62 H GLU 62 -1.674 -4.996 6.935
224 HA GLU 62 HA GLU 62 -0.170 -3.885 8.178
225 HB2 GLU 62 1HB GLU 62 0.014 -6.405 9.837
226 HB3 GLU 62 2HB GLU 62 0.799 -4.888 10.250
227 HG2 GLU 62 1HG GLU 62 -2.175 -5.305 9.969
228 HG3 GLU 62 2HG GLU 62 -1.285 -5.247 11.493
229 H SER 63 H SER 63 0.596 -5.229 5.828
230 HA SER 63 HA SER 63 3.467 -5.627 6.327
231 HG SER 63 HG SER 63 2.800 -8.567 5.123
232 HB2 SER 63 1HB SER 63 1.886 -6.463 3.881
233 HB3 SER 63 2HB SER 63 3.576 -6.833 4.220
234 H TYR 64 H TYR 64 4.945 -4.368 5.238
235 HA TYR 64 HA TYR 64 3.842 -2.048 3.849
236 HD1 TYR 64 HD2 TYR 64 6.540 -3.715 6.601
237 HD2 TYR 64 HD1 TYR 64 8.041 -1.602 3.229
238 HE1 TYR 64 HE2 TYR 64 8.713 -4.837 6.866
239 HE2 TYR 64 HE1 TYR 64 10.212 -2.711 3.486
240 HH TYR 64 HH TYR 64 11.520 -3.817 5.216
241 HB2 TYR 64 1HB TYR 64 5.974 -0.963 4.193
242 HB3 TYR 64 2HB TYR 64 5.424 -1.639 5.714
243 H ASN 65 H ASN 65 4.840 -5.033 3.011
244 HA ASN 65 HA ASN 65 6.384 -4.563 0.659
245 HB2 ASN 65 1HB ASN 65 6.322 -6.744 1.859
246 HB3 ASN 65 2HB ASN 65 4.647 -6.941 1.364
247 HD21 ASN 65 2HD2 ASN 65 4.873 -8.723 0.152
248 HD22 ASN 65 1HD2 ASN 65 5.813 -8.812 -1.297
249 H THR 66 H THR 66 5.354 -2.984 -0.522
250 HA THR 66 HA THR 66 2.863 -3.728 -1.839
251 HB THR 66 HB THR 66 2.036 -1.343 -1.484
252 HG1 THR 66 HG1 THR 66 4.052 -1.478 0.527
253 HG21 THR 66 3HG2 THR 66 0.890 -1.858 0.543
254 HG22 THR 66 1HG2 THR 66 2.126 -3.025 1.012
255 HG23 THR 66 2HG2 THR 66 1.076 -3.355 -0.365
256 H ALA 67 H ALA 67 2.324 -2.332 -3.579
257 HA ALA 67 HA ALA 67 4.582 -0.859 -4.751
258 HB1 ALA 67 3HB ALA 67 4.165 -2.924 -6.000
259 HB2 ALA 67 1HB ALA 67 3.718 -1.515 -6.961
260 HB3 ALA 67 2HB ALA 67 2.466 -2.482 -6.180
261 H GLN 68 H GLN 68 4.136 1.228 -5.021
262 HA GLN 68 HA GLN 68 1.681 2.317 -4.132
263 HB2 GLN 68 1HB GLN 68 3.885 3.442 -3.935
264 HB3 GLN 68 2HB GLN 68 3.903 3.669 -5.675
265 HG2 GLN 68 1HG GLN 68 1.907 5.086 -5.506
266 HG3 GLN 68 2HG GLN 68 1.911 4.870 -3.757
267 HE21 GLN 68 2HE2 GLN 68 2.145 7.061 -3.386
268 HE22 GLN 68 1HE2 GLN 68 3.631 7.902 -3.667
269 H ALA 69 H ALA 69 -0.144 2.446 -5.167
270 HA ALA 69 HA ALA 69 -0.404 1.761 -7.922
271 HB1 ALA 69 3HB ALA 69 -2.058 1.088 -6.235
272 HB2 ALA 69 1HB ALA 69 -2.796 2.008 -7.547
273 HB3 ALA 69 2HB ALA 69 -2.492 2.781 -5.991
274 H GLY 70 H GLY 70 -0.085 3.109 -9.543
275 HA2 GLY 70 1HA GLY 70 0.040 5.960 -9.136
276 HA3 GLY 70 2HA GLY 70 0.339 5.101 -10.641
277 H GLY 71 H GLY 71 -1.949 3.801 -11.129
278 HA2 GLY 71 1HA GLY 71 -4.422 4.527 -10.815
279 HA3 GLY 71 2HA GLY 71 -3.836 6.005 -11.568
280 H ARG 72 H ARG 72 -5.820 4.022 -12.455
281 HA ARG 72 HA ARG 72 -4.579 2.743 -14.756
282 HE ARG 72 HE ARG 72 -9.517 2.155 -15.929
283 HB2 ARG 72 1HB ARG 72 -6.286 1.568 -13.368
284 HB3 ARG 72 2HB ARG 72 -7.470 2.766 -13.867
285 HG2 ARG 72 1HG ARG 72 -6.996 2.035 -16.250
286 HG3 ARG 72 2HG ARG 72 -6.129 0.667 -15.542
287 HD2 ARG 72 1HD ARG 72 -8.376 -0.027 -16.019
288 HD3 ARG 72 2HD ARG 72 -8.192 0.097 -14.272
289 HH11 ARG 72 1HH1 ARG 72 -9.306 0.303 -12.940
290 HH12 ARG 72 2HH1 ARG 72 -10.728 1.030 -12.255
291 HH21 ARG 72 1HH2 ARG 72 -11.366 3.106 -15.018
292 HH22 ARG 72 2HH2 ARG 72 -11.893 2.627 -13.431
293 H ARG 73 H ARG 73 -4.176 4.071 -16.398
294 HA ARG 73 HA ARG 73 -6.217 6.049 -17.145
295 HE ARG 73 HE ARG 73 -2.167 8.491 -19.464
296 HB2 ARG 73 1HB ARG 73 -3.862 6.835 -16.486
297 HB3 ARG 73 2HB ARG 73 -3.316 6.112 -17.989
298 HG2 ARG 73 1HG ARG 73 -5.564 8.045 -18.148
299 HG3 ARG 73 2HG ARG 73 -3.964 8.681 -17.780
300 HD2 ARG 73 1HD ARG 73 -4.563 6.911 -20.148
301 HD3 ARG 73 2HD ARG 73 -4.575 8.674 -20.212
302 HH11 ARG 73 1HH1 ARG 73 -3.695 5.905 -21.285
303 HH12 ARG 73 2HH1 ARG 73 -2.214 5.386 -22.025
304 HH21 ARG 73 1HH2 ARG 73 -0.223 7.796 -20.442
305 HH22 ARG 73 2HH2 ARG 73 -0.248 6.450 -21.536
306 H ILE 74 H ILE 74 -7.426 4.480 -18.220
307 HA ILE 74 HA ILE 74 -6.404 3.917 -20.920
308 HB ILE 74 HB ILE 74 -8.281 2.100 -19.364
309 HG12 ILE 74 1HG1 ILE 74 -5.904 1.900 -18.631
310 HG13 ILE 74 2HG1 ILE 74 -6.521 0.429 -19.374
311 HG21 ILE 74 1HG2 ILE 74 -8.844 2.137 -21.722
312 HG22 ILE 74 2HG2 ILE 74 -8.110 0.589 -21.299
313 HG23 ILE 74 3HG2 ILE 74 -7.164 1.808 -22.153
314 HD11 ILE 74 3HD1 ILE 74 -4.243 0.871 -20.077
315 HD12 ILE 74 1HD1 ILE 74 -4.717 2.460 -20.682
316 HD13 ILE 74 2HD1 ILE 74 -5.343 1.001 -21.450
317 H SER 75 H SER 75 -7.334 5.686 -21.819
318 HA SER 75 HA SER 75 -10.184 6.151 -21.436
319 HG SER 75 HG SER 75 -7.340 8.713 -22.668
320 HB2 SER 75 1HB SER 75 -9.657 8.150 -22.997
321 HB3 SER 75 2HB SER 75 -9.016 8.184 -21.355
322 H LEU 76 H LEU 76 -7.881 5.517 -24.065
323 HA LEU 76 HA LEU 76 -9.897 3.891 -25.362
324 HG LEU 76 HG LEU 76 -9.201 4.142 -28.320
325 HB2 LEU 76 1HB LEU 76 -10.121 6.210 -26.316
326 HB3 LEU 76 2HB LEU 76 -8.486 6.051 -26.926
327 HD11 LEU 76 1HD1 LEU 76 -11.578 3.656 -28.589
328 HD12 LEU 76 2HD1 LEU 76 -11.965 4.814 -27.316
329 HD13 LEU 76 3HD1 LEU 76 -11.054 3.354 -26.932
330 HD21 LEU 76 3HD2 LEU 76 -10.876 6.619 -28.689
331 HD22 LEU 76 1HD2 LEU 76 -10.482 5.432 -29.932
332 HD23 LEU 76 2HD2 LEU 76 -9.206 6.420 -29.219
333 H ASP 77 H ASP 77 -8.821 2.058 -25.253
334 HA ASP 77 HA ASP 77 -6.001 1.975 -26.065
335 HB2 ASP 77 1HB ASP 77 -6.595 1.014 -23.848
336 HB3 ASP 77 2HB ASP 77 -7.657 -0.130 -24.652
337 H GLN 78 H GLN 78 -6.273 2.071 -28.284
338 HA GLN 78 HA GLN 78 -7.319 -0.303 -29.583
339 HB2 GLN 78 1HB GLN 78 -9.281 1.232 -29.289
340 HB3 GLN 78 2HB GLN 78 -8.433 2.431 -30.248
341 HG2 GLN 78 1HG GLN 78 -10.102 1.248 -31.568
342 HG3 GLN 78 2HG GLN 78 -8.474 0.956 -32.182
343 HE21 GLN 78 2HE2 GLN 78 -11.241 -0.414 -30.583
344 HE22 GLN 78 1HE2 GLN 78 -10.760 -2.070 -30.730
345 H GLN 79 H GLN 79 -6.089 -0.814 -31.250
346 HA GLN 79 HA GLN 79 -4.345 1.241 -32.381
347 HB2 GLN 79 1HB GLN 79 -3.021 -0.625 -33.333
348 HB3 GLN 79 2HB GLN 79 -3.094 -0.651 -31.581
349 HG2 GLN 79 1HG GLN 79 -4.859 -2.385 -31.743
350 HG3 GLN 79 2HG GLN 79 -4.603 -2.419 -33.485
351 HE21 GLN 79 2HE2 GLN 79 -3.950 -4.551 -33.485
352 HE22 GLN 79 1HE2 GLN 79 -2.424 -5.065 -32.848
Start of MODEL 8
1 H ASN 33 H ASN 33 0.334 13.021 6.047
2 HA ASN 33 HA ASN 33 1.737 14.085 3.736
3 HB2 ASN 33 1HB ASN 33 1.383 11.169 4.434
4 HB3 ASN 33 2HB ASN 33 2.608 11.882 3.397
5 HD21 ASN 33 2HD2 ASN 33 4.360 12.950 4.347
6 HD22 ASN 33 1HD2 ASN 33 4.777 12.710 6.007
7 H MET 34 H MET 34 1.319 13.153 1.571
8 HA MET 34 HA MET 34 -1.416 13.384 0.899
9 HB2 MET 34 1HB MET 34 -0.733 12.875 -1.389
10 HB3 MET 34 2HB MET 34 0.354 14.041 -0.657
11 HG2 MET 34 1HG MET 34 1.998 12.279 -0.287
12 HG3 MET 34 2HG MET 34 0.907 11.102 -1.006
13 HE1 MET 34 3HE MET 34 3.763 11.192 -2.035
14 HE2 MET 34 1HE MET 34 3.589 11.296 -3.786
15 HE3 MET 34 2HE MET 34 2.530 10.234 -2.856
16 H THR 35 H THR 35 -2.989 11.899 0.582
17 HA THR 35 HA THR 35 -2.329 9.205 1.436
18 HB THR 35 HB THR 35 -4.922 8.933 1.217
19 HG1 THR 35 HG1 THR 35 -5.420 10.864 0.192
20 HG21 THR 35 3HG2 THR 35 -3.695 8.926 3.330
21 HG22 THR 35 1HG2 THR 35 -5.215 9.817 3.478
22 HG23 THR 35 2HG2 THR 35 -3.689 10.690 3.337
23 H VAL 36 H VAL 36 -2.039 7.610 0.174
24 HA VAL 36 HA VAL 36 -3.037 7.686 -2.589
25 HB VAL 36 HB VAL 36 -0.943 6.534 -3.306
26 HG11 VAL 36 1HG1 VAL 36 -1.127 8.935 -3.641
27 HG12 VAL 36 2HG1 VAL 36 0.537 8.474 -3.284
28 HG13 VAL 36 3HG1 VAL 36 -0.458 9.226 -2.033
29 HG21 VAL 36 3HG2 VAL 36 1.041 6.575 -1.872
30 HG22 VAL 36 1HG2 VAL 36 -0.244 5.587 -1.178
31 HG23 VAL 36 2HG2 VAL 36 0.068 7.203 -0.541
32 H ASP 37 H ASP 37 -3.340 5.554 -3.527
33 HA ASP 37 HA ASP 37 -3.915 3.561 -1.473
34 HB2 ASP 37 1HB ASP 37 -5.383 2.515 -3.208
35 HB3 ASP 37 2HB ASP 37 -5.878 4.114 -2.677
36 H ILE 38 H ILE 38 -2.773 1.847 -1.272
37 HA ILE 38 HA ILE 38 -1.014 0.976 -3.468
38 HB ILE 38 HB ILE 38 0.463 0.054 -1.584
39 HG12 ILE 38 1HG1 ILE 38 -0.752 2.243 0.090
40 HG13 ILE 38 2HG1 ILE 38 -1.413 0.615 0.137
41 HG21 ILE 38 1HG2 ILE 38 1.661 2.178 -1.344
42 HG22 ILE 38 2HG2 ILE 38 0.261 3.033 -1.993
43 HG23 ILE 38 3HG2 ILE 38 1.145 1.887 -3.004
44 HD11 ILE 38 3HD1 ILE 38 1.363 1.468 0.875
45 HD12 ILE 38 1HD1 ILE 38 0.820 -0.206 0.779
46 HD13 ILE 38 2HD1 ILE 38 0.091 0.889 1.952
47 H LEU 39 H LEU 39 -1.022 -1.166 -3.969
48 HA LEU 39 HA LEU 39 -3.033 -2.784 -2.549
49 HG LEU 39 HG LEU 39 -4.917 -3.418 -4.149
50 HB2 LEU 39 1HB LEU 39 -3.108 -2.013 -5.126
51 HB3 LEU 39 2HB LEU 39 -2.125 -3.442 -5.330
52 HD11 LEU 39 1HD1 LEU 39 -3.942 -4.195 -6.889
53 HD12 LEU 39 2HD1 LEU 39 -4.937 -2.795 -6.485
54 HD13 LEU 39 3HD1 LEU 39 -5.580 -4.422 -6.275
55 HD21 LEU 39 3HD2 LEU 39 -3.581 -5.312 -3.349
56 HD22 LEU 39 1HD2 LEU 39 -3.200 -5.743 -5.016
57 HD23 LEU 39 2HD2 LEU 39 -4.866 -5.833 -4.441
58 H CYS 40 H CYS 40 -2.311 -4.471 -1.477
59 HA CYS 40 HA CYS 40 0.428 -5.087 -1.194
60 HB2 CYS 40 1HB CYS 40 -2.028 -5.772 0.035
61 HB3 CYS 40 2HB CYS 40 -1.173 -7.262 -0.328
62 H ASN 41 H ASN 41 1.678 -6.762 -1.857
63 HA ASN 41 HA ASN 41 0.644 -8.445 -3.986
64 HB2 ASN 41 1HB ASN 41 3.414 -8.182 -2.811
65 HB3 ASN 41 2HB ASN 41 3.001 -9.299 -4.100
66 HD21 ASN 41 2HD2 ASN 41 4.150 -8.503 -5.732
67 HD22 ASN 41 1HD2 ASN 41 3.987 -6.906 -6.373
68 H ASP 42 H ASP 42 1.240 -8.591 -0.586
69 HA ASP 42 HA ASP 42 1.435 -11.488 -0.568
70 HB2 ASP 42 1HB ASP 42 1.778 -11.198 1.920
71 HB3 ASP 42 2HB ASP 42 2.997 -10.465 0.888
72 H CYS 43 H CYS 43 -0.715 -9.065 0.993
73 HA CYS 43 HA CYS 43 -2.578 -11.239 1.558
74 HB2 CYS 43 1HB CYS 43 -3.587 -9.910 3.218
75 HB3 CYS 43 2HB CYS 43 -1.869 -9.567 3.345
76 H ASN 44 H ASN 44 -2.027 -9.260 -0.925
77 HA ASN 44 HA ASN 44 -3.101 -8.437 -2.713
78 HB2 ASN 44 1HB ASN 44 -4.807 -10.797 -1.994
79 HB3 ASN 44 2HB ASN 44 -5.078 -9.857 -3.456
80 HD21 ASN 44 2HD2 ASN 44 -4.550 -11.356 -4.871
81 HD22 ASN 44 1HD2 ASN 44 -2.974 -12.029 -5.064
82 H GLY 45 H GLY 45 -3.865 -7.124 -0.241
83 HA2 GLY 45 1HA GLY 45 -6.465 -6.064 -1.121
84 HA3 GLY 45 2HA GLY 45 -6.067 -6.263 0.583
85 H ARG 46 H ARG 46 -6.735 -3.836 -1.051
86 HA ARG 46 HA ARG 46 -4.185 -2.432 -0.878
87 HE ARG 46 HE ARG 46 -9.369 -0.065 -3.065
88 HB2 ARG 46 1HB ARG 46 -5.069 -0.736 -2.275
89 HB3 ARG 46 2HB ARG 46 -5.482 -2.276 -2.990
90 HG2 ARG 46 1HG ARG 46 -7.769 -2.040 -2.180
91 HG3 ARG 46 2HG ARG 46 -7.337 -0.490 -1.447
92 HD2 ARG 46 1HD ARG 46 -6.544 0.191 -3.758
93 HD3 ARG 46 2HD ARG 46 -7.408 -1.222 -4.356
94 HH11 ARG 46 1HH1 ARG 46 -6.902 1.423 -5.054
95 HH12 ARG 46 2HH1 ARG 46 -7.883 2.788 -5.475
96 HH21 ARG 46 1HH2 ARG 46 -10.673 1.729 -3.664
97 HH22 ARG 46 2HH2 ARG 46 -10.007 2.959 -4.697
98 H SER 47 H SER 47 -3.888 -0.543 0.192
99 HA SER 47 HA SER 47 -5.924 0.199 2.184
100 HG SER 47 HG SER 47 -4.932 -1.649 3.165
101 HB2 SER 47 1HB SER 47 -2.915 0.150 2.587
102 HB3 SER 47 2HB SER 47 -4.103 0.696 3.771
103 H THR 48 H THR 48 -6.321 2.366 2.341
104 HA THR 48 HA THR 48 -4.703 4.133 0.642
105 HB THR 48 HB THR 48 -7.284 4.835 2.066
106 HG1 THR 48 HG1 THR 48 -7.080 3.076 0.200
107 HG21 THR 48 3HG2 THR 48 -7.406 6.638 0.409
108 HG22 THR 48 1HG2 THR 48 -5.893 6.086 -0.316
109 HG23 THR 48 2HG2 THR 48 -5.901 6.738 1.322
110 H VAL 49 H VAL 49 -3.032 4.945 1.658
111 HA VAL 49 HA VAL 49 -3.277 5.756 4.471
112 HB VAL 49 HB VAL 49 -0.940 4.884 4.869
113 HG11 VAL 49 1HG1 VAL 49 -2.856 3.701 5.759
114 HG12 VAL 49 2HG1 VAL 49 -1.623 2.552 5.233
115 HG13 VAL 49 3HG1 VAL 49 -3.053 2.829 4.238
116 HG21 VAL 49 3HG2 VAL 49 -0.220 4.627 2.549
117 HG22 VAL 49 1HG2 VAL 49 -1.427 3.366 2.300
118 HG23 VAL 49 2HG2 VAL 49 -0.088 3.097 3.415
119 H GLN 50 H GLN 50 -1.361 7.088 5.145
120 HA GLN 50 HA GLN 50 -0.847 9.160 3.228
121 HB2 GLN 50 1HB GLN 50 0.263 8.671 5.999
122 HB3 GLN 50 2HB GLN 50 0.600 10.103 5.037
123 HG2 GLN 50 1HG GLN 50 -1.857 10.552 5.000
124 HG3 GLN 50 2HG GLN 50 -2.056 9.230 6.148
125 HE21 GLN 50 2HE2 GLN 50 0.509 9.921 7.485
126 HE22 GLN 50 1HE2 GLN 50 0.151 11.311 8.449
127 H PHE 51 H PHE 51 1.223 9.781 2.440
128 HA PHE 51 HA PHE 51 2.851 7.604 1.603
129 HD1 PHE 51 HD2 PHE 51 3.774 7.470 -0.697
130 HD2 PHE 51 HD1 PHE 51 5.595 10.981 0.857
131 HE1 PHE 51 HE2 PHE 51 5.836 6.933 -1.920
132 HE2 PHE 51 HE1 PHE 51 7.666 10.449 -0.359
133 HZ PHE 51 HZ PHE 51 7.787 8.422 -1.748
134 HB2 PHE 51 1HB PHE 51 2.466 9.611 0.192
135 HB3 PHE 51 2HB PHE 51 3.389 10.576 1.336
136 H HIS 52 H HIS 52 3.822 6.610 3.190
137 HA HIS 52 HA HIS 52 5.542 8.054 5.037
138 HD1 HIS 52 HD1 HIS 52 6.485 4.000 6.666
139 HD2 HIS 52 HD2 HIS 52 5.550 7.922 7.679
140 HE1 HIS 52 HE1 HIS 52 7.661 4.429 8.846
141 HE2 HIS 52 HE2 HIS 52 7.139 6.828 9.420
142 HB2 HIS 52 1HB HIS 52 3.925 6.153 5.726
143 HB3 HIS 52 2HB HIS 52 5.075 5.065 4.957
144 H ILE 53 H ILE 53 7.504 8.398 4.485
145 HA ILE 53 HA ILE 53 8.706 7.435 2.106
146 HB ILE 53 HB ILE 53 9.860 9.037 4.421
147 HG12 ILE 53 1HG1 ILE 53 9.788 10.800 2.413
148 HG13 ILE 53 2HG1 ILE 53 8.478 9.758 1.877
149 HG21 ILE 53 1HG2 ILE 53 11.706 7.975 3.255
150 HG22 ILE 53 2HG2 ILE 53 11.687 9.708 2.921
151 HG23 ILE 53 3HG2 ILE 53 11.099 8.570 1.708
152 HD11 ILE 53 3HD1 ILE 53 8.626 11.197 4.522
153 HD12 ILE 53 1HD1 ILE 53 7.314 10.141 3.997
154 HD13 ILE 53 2HD1 ILE 53 7.633 11.646 3.135
155 H LEU 54 H LEU 54 8.797 6.415 5.425
156 HA LEU 54 HA LEU 54 11.090 4.668 5.014
157 HG LEU 54 HG LEU 54 10.563 7.169 6.861
158 HB2 LEU 54 1HB LEU 54 9.383 5.062 7.471
159 HB3 LEU 54 2HB LEU 54 10.916 4.217 7.393
160 HD11 LEU 54 1HD1 LEU 54 11.634 7.479 9.041
161 HD12 LEU 54 2HD1 LEU 54 11.580 5.735 9.306
162 HD13 LEU 54 3HD1 LEU 54 10.080 6.655 9.175
163 HD21 LEU 54 3HD2 LEU 54 12.477 6.211 5.696
164 HD22 LEU 54 1HD2 LEU 54 13.050 5.490 7.203
165 HD23 LEU 54 2HD2 LEU 54 13.003 7.244 7.025
166 H GLY 55 H GLY 55 8.073 4.319 4.007
167 HA2 GLY 55 1HA GLY 55 7.652 2.024 3.133
168 HA3 GLY 55 2HA GLY 55 7.938 1.463 4.773
169 H MET 56 H MET 56 5.638 2.442 2.537
170 HA MET 56 HA MET 56 3.642 3.465 4.294
171 HB2 MET 56 1HB MET 56 3.564 2.449 1.468
172 HB3 MET 56 2HB MET 56 2.099 2.938 2.312
173 HG2 MET 56 1HG MET 56 3.025 5.153 2.658
174 HG3 MET 56 2HG MET 56 4.509 4.677 1.839
175 HE1 MET 56 3HE MET 56 3.662 3.087 -0.682
176 HE2 MET 56 1HE MET 56 4.780 4.450 -0.719
177 HE3 MET 56 2HE MET 56 3.436 4.380 -1.862
178 H LYS 57 H LYS 57 2.408 2.440 5.663
179 HA LYS 57 HA LYS 57 2.623 -0.452 5.788
180 HB2 LYS 57 1HB LYS 57 3.134 0.952 7.777
181 HB3 LYS 57 2HB LYS 57 1.457 1.476 7.802
182 HG2 LYS 57 1HG LYS 57 0.770 -0.884 8.135
183 HG3 LYS 57 2HG LYS 57 2.473 -1.330 8.223
184 HD2 LYS 57 1HD LYS 57 1.064 0.591 10.077
185 HD3 LYS 57 2HD LYS 57 1.464 -1.085 10.453
186 HE2 LYS 57 1HE LYS 57 3.855 -0.551 10.159
187 HE3 LYS 57 2HE LYS 57 3.423 1.127 9.840
188 HZ1 LYS 57 3HZ LYS 57 2.443 1.223 12.070
189 HZ2 LYS 57 1HZ LYS 57 4.103 0.885 12.104
190 HZ3 LYS 57 2HZ LYS 57 2.981 -0.359 12.371
191 H CYS 58 H CYS 58 1.205 -1.490 4.653
192 HA CYS 58 HA CYS 58 -1.537 -0.944 4.311
193 HB2 CYS 58 1HB CYS 58 -0.504 -2.532 2.903
194 HB3 CYS 58 2HB CYS 58 0.172 -3.419 4.250
195 H LYS 59 H LYS 59 -3.125 -0.938 5.824
196 HA LYS 59 HA LYS 59 -2.481 -1.845 8.511
197 HB2 LYS 59 1HB LYS 59 -4.876 -0.349 7.442
198 HB3 LYS 59 2HB LYS 59 -4.626 -0.749 9.136
199 HG2 LYS 59 1HG LYS 59 -2.511 0.547 9.073
200 HG3 LYS 59 2HG LYS 59 -2.912 1.043 7.430
201 HD2 LYS 59 1HD LYS 59 -3.563 2.795 8.943
202 HD3 LYS 59 2HD LYS 59 -5.020 2.033 8.305
203 HE2 LYS 59 1HE LYS 59 -5.307 0.771 10.348
204 HE3 LYS 59 2HE LYS 59 -3.776 1.376 10.976
205 HZ1 LYS 59 3HZ LYS 59 -4.714 3.612 10.962
206 HZ2 LYS 59 1HZ LYS 59 -5.627 2.565 11.937
207 HZ3 LYS 59 2HZ LYS 59 -6.189 2.999 10.396
208 H ILE 60 H ILE 60 -3.284 -3.632 6.165
209 HA ILE 60 HA ILE 60 -5.464 -5.147 7.405
210 HB ILE 60 HB ILE 60 -4.115 -5.742 4.754
211 HG12 ILE 60 1HG1 ILE 60 -6.649 -4.120 5.116
212 HG13 ILE 60 2HG1 ILE 60 -5.068 -3.389 4.863
213 HG21 ILE 60 1HG2 ILE 60 -6.836 -6.477 5.848
214 HG22 ILE 60 2HG2 ILE 60 -5.460 -7.564 5.654
215 HG23 ILE 60 3HG2 ILE 60 -6.240 -6.869 4.233
216 HD11 ILE 60 3HD1 ILE 60 -6.322 -3.474 2.797
217 HD12 ILE 60 1HD1 ILE 60 -6.502 -5.222 2.959
218 HD13 ILE 60 2HD1 ILE 60 -4.905 -4.521 2.702
219 H CYS 61 H CYS 61 -2.018 -5.251 6.763
220 HA CYS 61 HA CYS 61 -1.834 -7.763 8.245
221 HB2 CYS 61 1HB CYS 61 -0.354 -8.806 6.628
222 HB3 CYS 61 2HB CYS 61 -1.879 -8.389 5.854
223 H GLU 62 H GLU 62 -0.626 -4.663 7.683
224 HA GLU 62 HA GLU 62 0.956 -3.392 8.665
225 HB2 GLU 62 1HB GLU 62 1.656 -5.868 10.237
226 HB3 GLU 62 2HB GLU 62 2.433 -4.310 10.467
227 HG2 GLU 62 1HG GLU 62 0.336 -3.322 11.135
228 HG3 GLU 62 2HG GLU 62 -0.511 -4.838 10.820
229 H SER 63 H SER 63 1.465 -5.158 6.268
230 HA SER 63 HA SER 63 4.397 -5.109 6.325
231 HG SER 63 HG SER 63 4.515 -7.591 3.766
232 HB2 SER 63 1HB SER 63 3.413 -7.304 5.773
233 HB3 SER 63 2HB SER 63 2.559 -6.580 4.410
234 H TYR 64 H TYR 64 5.539 -4.075 4.729
235 HA TYR 64 HA TYR 64 4.066 -1.987 3.325
236 HD1 TYR 64 HD2 TYR 64 7.053 -2.816 6.089
237 HD2 TYR 64 HD1 TYR 64 8.203 -2.022 2.073
238 HE1 TYR 64 HE2 TYR 64 9.211 -3.923 6.492
239 HE2 TYR 64 HE1 TYR 64 10.362 -3.121 2.464
240 HH TYR 64 HH TYR 64 10.958 -5.129 5.012
241 HB2 TYR 64 1HB TYR 64 6.291 -0.903 3.042
242 HB3 TYR 64 2HB TYR 64 5.845 -1.151 4.723
243 H ASN 65 H ASN 65 4.833 -4.999 2.596
244 HA ASN 65 HA ASN 65 6.037 -4.695 -0.003
245 HB2 ASN 65 1HB ASN 65 6.252 -6.766 1.462
246 HB3 ASN 65 2HB ASN 65 4.577 -7.120 1.076
247 HD21 ASN 65 2HD2 ASN 65 7.033 -8.617 0.564
248 HD22 ASN 65 1HD2 ASN 65 7.061 -8.912 -1.139
249 H THR 66 H THR 66 4.811 -3.329 -1.144
250 HA THR 66 HA THR 66 2.144 -4.195 -1.982
251 HB THR 66 HB THR 66 1.436 -1.724 -1.803
252 HG1 THR 66 HG1 THR 66 3.738 -1.760 -0.135
253 HG21 THR 66 3HG2 THR 66 0.696 -1.931 0.516
254 HG22 THR 66 1HG2 THR 66 1.822 -3.262 0.768
255 HG23 THR 66 2HG2 THR 66 0.473 -3.446 -0.355
256 H ALA 67 H ALA 67 1.411 -2.911 -3.856
257 HA ALA 67 HA ALA 67 3.580 -1.591 -5.349
258 HB1 ALA 67 3HB ALA 67 1.338 -3.290 -6.475
259 HB2 ALA 67 1HB ALA 67 3.040 -3.748 -6.387
260 HB3 ALA 67 2HB ALA 67 2.541 -2.410 -7.421
261 H GLN 68 H GLN 68 3.067 0.448 -6.039
262 HA GLN 68 HA GLN 68 0.714 1.659 -4.983
263 HB2 GLN 68 1HB GLN 68 2.867 2.865 -5.209
264 HB3 GLN 68 2HB GLN 68 2.700 2.800 -6.957
265 HG2 GLN 68 1HG GLN 68 0.648 4.137 -6.802
266 HG3 GLN 68 2HG GLN 68 0.844 4.224 -5.054
267 HE21 GLN 68 2HE2 GLN 68 0.952 6.450 -5.075
268 HE22 GLN 68 1HE2 GLN 68 2.341 7.308 -5.650
269 H ALA 69 H ALA 69 -1.225 1.732 -5.830
270 HA ALA 69 HA ALA 69 -1.676 0.530 -8.419
271 HB1 ALA 69 3HB ALA 69 -3.646 1.482 -6.342
272 HB2 ALA 69 1HB ALA 69 -2.993 -0.152 -6.465
273 HB3 ALA 69 2HB ALA 69 -4.015 0.489 -7.751
274 H GLY 70 H GLY 70 -2.963 1.472 -10.074
275 HA2 GLY 70 1HA GLY 70 -4.211 3.397 -10.909
276 HA3 GLY 70 2HA GLY 70 -3.122 4.421 -9.987
277 H GLY 71 H GLY 71 -1.525 5.348 -11.060
278 HA2 GLY 71 1HA GLY 71 0.319 5.413 -12.535
279 HA3 GLY 71 2HA GLY 71 -0.310 3.990 -13.353
280 H ARG 72 H ARG 72 -0.197 4.844 -15.424
281 HA ARG 72 HA ARG 72 -2.175 6.949 -15.935
282 HE ARG 72 HE ARG 72 -0.428 10.241 -15.987
283 HB2 ARG 72 1HB ARG 72 0.175 7.835 -16.028
284 HB3 ARG 72 2HB ARG 72 0.471 6.758 -17.382
285 HG2 ARG 72 1HG ARG 72 0.002 9.020 -18.144
286 HG3 ARG 72 2HG ARG 72 -1.250 7.902 -18.684
287 HD2 ARG 72 1HD ARG 72 -2.221 9.997 -17.898
288 HD3 ARG 72 2HD ARG 72 -2.707 8.642 -16.883
289 HH11 ARG 72 1HH1 ARG 72 -3.821 9.410 -15.619
290 HH12 ARG 72 2HH1 ARG 72 -3.971 10.187 -14.076
291 HH21 ARG 72 1HH2 ARG 72 -0.630 11.243 -13.957
292 HH22 ARG 72 2HH2 ARG 72 -2.156 11.221 -13.134
293 H ARG 73 H ARG 73 -3.729 5.669 -16.689
294 HA ARG 73 HA ARG 73 -3.176 4.330 -19.253
295 HE ARG 73 HE ARG 73 -7.311 2.918 -18.218
296 HB2 ARG 73 1HB ARG 73 -3.988 2.891 -17.222
297 HB3 ARG 73 2HB ARG 73 -5.538 3.668 -17.490
298 HG2 ARG 73 1HG ARG 73 -4.103 2.102 -19.625
299 HG3 ARG 73 2HG ARG 73 -5.236 1.371 -18.497
300 HD2 ARG 73 1HD ARG 73 -5.810 3.489 -20.570
301 HD3 ARG 73 2HD ARG 73 -6.386 1.821 -20.557
302 HH11 ARG 73 1HH1 ARG 73 -7.760 3.639 -21.627
303 HH12 ARG 73 2HH1 ARG 73 -9.279 4.438 -21.374
304 HH21 ARG 73 1HH2 ARG 73 -9.277 3.969 -17.903
305 HH22 ARG 73 2HH2 ARG 73 -10.157 4.598 -19.261
306 H ILE 74 H ILE 74 -3.557 6.089 -20.507
307 HA ILE 74 HA ILE 74 -6.344 7.007 -20.564
308 HB ILE 74 HB ILE 74 -5.515 9.247 -21.405
309 HG12 ILE 74 1HG1 ILE 74 -2.918 8.447 -20.070
310 HG13 ILE 74 2HG1 ILE 74 -3.155 8.486 -21.813
311 HG21 ILE 74 1HG2 ILE 74 -4.938 8.531 -18.538
312 HG22 ILE 74 2HG2 ILE 74 -6.499 8.996 -19.212
313 HG23 ILE 74 3HG2 ILE 74 -5.178 10.164 -19.158
314 HD11 ILE 74 3HD1 ILE 74 -2.008 10.479 -21.033
315 HD12 ILE 74 1HD1 ILE 74 -3.352 10.843 -19.950
316 HD13 ILE 74 2HD1 ILE 74 -3.590 10.887 -21.697
317 H SER 75 H SER 75 -7.152 7.480 -22.638
318 HA SER 75 HA SER 75 -5.656 6.288 -24.826
319 HG SER 75 HG SER 75 -7.487 4.824 -24.552
320 HB2 SER 75 1HB SER 75 -8.441 7.480 -24.790
321 HB3 SER 75 2HB SER 75 -7.716 6.599 -26.138
322 H LEU 76 H LEU 76 -3.978 7.911 -24.711
323 HA LEU 76 HA LEU 76 -4.743 10.577 -25.596
324 HG LEU 76 HG LEU 76 -1.908 11.590 -26.213
325 HB2 LEU 76 1HB LEU 76 -3.128 10.362 -23.734
326 HB3 LEU 76 2HB LEU 76 -2.013 9.541 -24.813
327 HD11 LEU 76 1HD1 LEU 76 -3.545 12.813 -23.995
328 HD12 LEU 76 2HD1 LEU 76 -4.077 12.540 -25.654
329 HD13 LEU 76 3HD1 LEU 76 -2.784 13.692 -25.322
330 HD21 LEU 76 3HD2 LEU 76 -0.226 11.152 -24.517
331 HD22 LEU 76 1HD2 LEU 76 -1.213 11.974 -23.309
332 HD23 LEU 76 2HD2 LEU 76 -0.539 12.882 -24.662
333 H ASP 77 H ASP 77 -5.291 10.343 -27.631
334 HA ASP 77 HA ASP 77 -3.189 10.177 -29.579
335 HB2 ASP 77 1HB ASP 77 -3.950 7.773 -29.284
336 HB3 ASP 77 2HB ASP 77 -5.546 8.279 -29.831
337 H GLN 78 H GLN 78 -3.611 12.200 -30.221
338 HA GLN 78 HA GLN 78 -6.325 12.764 -31.156
339 HB2 GLN 78 1HB GLN 78 -5.893 15.187 -30.495
340 HB3 GLN 78 2HB GLN 78 -6.209 14.052 -29.198
341 HG2 GLN 78 1HG GLN 78 -3.817 13.963 -28.691
342 HG3 GLN 78 2HG GLN 78 -3.499 15.093 -30.007
343 HE21 GLN 78 2HE2 GLN 78 -2.927 15.365 -27.176
344 HE22 GLN 78 1HE2 GLN 78 -3.753 16.788 -26.645
345 H GLN 79 H GLN 79 -6.226 12.665 -33.230
346 HA GLN 79 HA GLN 79 -4.261 14.284 -34.635
347 HB2 GLN 79 1HB GLN 79 -4.156 12.350 -36.374
348 HB3 GLN 79 2HB GLN 79 -3.147 12.291 -34.939
349 HG2 GLN 79 1HG GLN 79 -4.711 10.731 -33.894
350 HG3 GLN 79 2HG GLN 79 -5.751 10.813 -35.314
351 HE21 GLN 79 2HE2 GLN 79 -4.328 8.545 -34.055
352 HE22 GLN 79 1HE2 GLN 79 -3.359 7.856 -35.322
Start of MODEL 9
1 H ASN 33 H ASN 33 -4.550 13.251 7.135
2 HA ASN 33 HA ASN 33 -2.101 14.847 7.384
3 HB2 ASN 33 1HB ASN 33 -2.109 12.720 8.904
4 HB3 ASN 33 2HB ASN 33 -1.998 11.820 7.398
5 HD21 ASN 33 2HD2 ASN 33 -0.365 13.989 9.570
6 HD22 ASN 33 1HD2 ASN 33 1.223 13.778 8.916
7 H MET 34 H MET 34 -0.528 14.022 5.512
8 HA MET 34 HA MET 34 -1.985 13.883 3.054
9 HB2 MET 34 1HB MET 34 0.321 14.930 3.345
10 HB3 MET 34 2HB MET 34 0.957 13.291 3.406
11 HG2 MET 34 1HG MET 34 -0.027 12.878 1.170
12 HG3 MET 34 2HG MET 34 -0.507 14.571 1.107
13 HE1 MET 34 3HE MET 34 3.711 12.839 0.592
14 HE2 MET 34 1HE MET 34 2.179 11.988 0.383
15 HE3 MET 34 2HE MET 34 2.729 12.432 1.998
16 H THR 35 H THR 35 -3.161 12.107 2.741
17 HA THR 35 HA THR 35 -1.970 9.510 3.381
18 HB THR 35 HB THR 35 -4.345 8.667 3.275
19 HG1 THR 35 HG1 THR 35 -4.898 10.907 2.181
20 HG21 THR 35 3HG2 THR 35 -4.947 9.538 5.486
21 HG22 THR 35 1HG2 THR 35 -3.747 10.817 5.312
22 HG23 THR 35 2HG2 THR 35 -3.233 9.131 5.403
23 H VAL 36 H VAL 36 -1.495 8.131 1.851
24 HA VAL 36 HA VAL 36 -2.328 8.785 -0.890
25 HB VAL 36 HB VAL 36 -0.215 7.723 -1.658
26 HG11 VAL 36 1HG1 VAL 36 0.151 10.008 0.282
27 HG12 VAL 36 2HG1 VAL 36 -0.335 10.140 -1.409
28 HG13 VAL 36 3HG1 VAL 36 1.277 9.557 -0.999
29 HG21 VAL 36 3HG2 VAL 36 0.525 7.670 1.273
30 HG22 VAL 36 1HG2 VAL 36 1.620 7.341 -0.072
31 HG23 VAL 36 2HG2 VAL 36 0.260 6.264 0.241
32 H ASP 37 H ASP 37 -3.076 7.183 -2.204
33 HA ASP 37 HA ASP 37 -3.879 4.710 -0.898
34 HB2 ASP 37 1HB ASP 37 -5.493 6.041 -2.276
35 HB3 ASP 37 2HB ASP 37 -4.512 5.683 -3.693
36 H ILE 38 H ILE 38 -2.843 2.901 -1.111
37 HA ILE 38 HA ILE 38 -0.682 2.678 -3.109
38 HB ILE 38 HB ILE 38 0.510 1.294 -1.370
39 HG12 ILE 38 1HG1 ILE 38 -1.446 2.543 0.571
40 HG13 ILE 38 2HG1 ILE 38 -1.650 0.917 -0.055
41 HG21 ILE 38 1HG2 ILE 38 -0.080 4.173 -0.683
42 HG22 ILE 38 2HG2 ILE 38 1.149 3.590 -1.807
43 HG23 ILE 38 3HG2 ILE 38 1.290 3.236 -0.086
44 HD11 ILE 38 3HD1 ILE 38 -0.694 0.763 2.089
45 HD12 ILE 38 1HD1 ILE 38 0.548 1.952 1.682
46 HD13 ILE 38 2HD1 ILE 38 0.563 0.369 0.910
47 H LEU 39 H LEU 39 -0.413 0.672 -4.128
48 HA LEU 39 HA LEU 39 -2.514 -1.292 -3.510
49 HG LEU 39 HG LEU 39 -4.007 -1.679 -5.230
50 HB2 LEU 39 1HB LEU 39 -2.110 -0.036 -5.890
51 HB3 LEU 39 2HB LEU 39 -1.136 -1.476 -6.117
52 HD11 LEU 39 1HD1 LEU 39 -4.012 -0.340 -7.247
53 HD12 LEU 39 2HD1 LEU 39 -4.610 -1.963 -7.589
54 HD13 LEU 39 3HD1 LEU 39 -2.970 -1.511 -8.056
55 HD21 LEU 39 3HD2 LEU 39 -2.183 -3.556 -6.738
56 HD22 LEU 39 1HD2 LEU 39 -3.862 -3.873 -6.300
57 HD23 LEU 39 2HD2 LEU 39 -2.641 -3.694 -5.039
58 H CYS 40 H CYS 40 -1.945 -3.233 -2.893
59 HA CYS 40 HA CYS 40 0.695 -3.667 -1.955
60 HB2 CYS 40 1HB CYS 40 -1.769 -4.550 -1.271
61 HB3 CYS 40 2HB CYS 40 -1.117 -5.966 -2.078
62 H ASN 41 H ASN 41 2.257 -5.040 -2.537
63 HA ASN 41 HA ASN 41 2.104 -6.249 -5.164
64 HB2 ASN 41 1HB ASN 41 4.357 -5.911 -3.178
65 HB3 ASN 41 2HB ASN 41 4.533 -6.810 -4.678
66 HD21 ASN 41 2HD2 ASN 41 6.072 -5.478 -5.497
67 HD22 ASN 41 1HD2 ASN 41 5.744 -3.866 -6.030
68 H ASP 42 H ASP 42 1.561 -7.196 -1.923
69 HA ASP 42 HA ASP 42 2.168 -9.979 -2.579
70 HB2 ASP 42 1HB ASP 42 2.122 -10.383 -0.084
71 HB3 ASP 42 2HB ASP 42 3.441 -9.394 -0.688
72 H CYS 43 H CYS 43 -0.436 -8.124 -0.877
73 HA CYS 43 HA CYS 43 -2.030 -10.570 -1.012
74 HB2 CYS 43 1HB CYS 43 -3.455 -9.734 0.677
75 HB3 CYS 43 2HB CYS 43 -1.820 -9.339 1.172
76 H ASN 44 H ASN 44 -1.608 -8.101 -3.048
77 HA ASN 44 HA ASN 44 -2.747 -6.868 -4.524
78 HB2 ASN 44 1HB ASN 44 -3.078 -9.394 -5.179
79 HB3 ASN 44 2HB ASN 44 -4.774 -9.037 -4.845
80 HD21 ASN 44 2HD2 ASN 44 -1.995 -8.227 -6.774
81 HD22 ASN 44 1HD2 ASN 44 -2.859 -7.436 -8.041
82 H GLY 45 H GLY 45 -3.457 -5.253 -3.169
83 HA2 GLY 45 1HA GLY 45 -6.191 -4.688 -3.148
84 HA3 GLY 45 2HA GLY 45 -5.755 -5.324 -1.565
85 H ARG 46 H ARG 46 -6.602 -2.608 -2.503
86 HA ARG 46 HA ARG 46 -4.155 -1.098 -1.989
87 HE ARG 46 HE ARG 46 -9.689 0.579 -3.924
88 HB2 ARG 46 1HB ARG 46 -5.283 0.825 -2.916
89 HB3 ARG 46 2HB ARG 46 -5.410 -0.536 -4.018
90 HG2 ARG 46 1HG ARG 46 -7.696 -0.935 -3.221
91 HG3 ARG 46 2HG ARG 46 -7.555 0.480 -2.176
92 HD2 ARG 46 1HD ARG 46 -7.049 1.814 -4.236
93 HD3 ARG 46 2HD ARG 46 -7.491 0.389 -5.179
94 HH11 ARG 46 1HH1 ARG 46 -7.689 3.353 -4.721
95 HH12 ARG 46 2HH1 ARG 46 -9.039 4.446 -4.785
96 HH21 ARG 46 1HH2 ARG 46 -11.429 2.014 -3.952
97 HH22 ARG 46 2HH2 ARG 46 -11.162 3.687 -4.342
98 H SER 47 H SER 47 -4.129 0.699 -0.606
99 HA SER 47 HA SER 47 -6.133 0.816 1.529
100 HG SER 47 HG SER 47 -5.319 -1.249 2.466
101 HB2 SER 47 1HB SER 47 -3.142 0.518 2.017
102 HB3 SER 47 2HB SER 47 -4.366 0.774 3.258
103 H THR 48 H THR 48 -6.536 2.963 2.050
104 HA THR 48 HA THR 48 -4.576 4.942 1.115
105 HB THR 48 HB THR 48 -7.238 5.582 2.392
106 HG1 THR 48 HG1 THR 48 -6.696 4.487 -0.085
107 HG21 THR 48 3HG2 THR 48 -5.612 7.424 2.146
108 HG22 THR 48 1HG2 THR 48 -7.013 7.654 1.099
109 HG23 THR 48 2HG2 THR 48 -5.491 7.075 0.421
110 H VAL 49 H VAL 49 -3.019 5.335 2.508
111 HA VAL 49 HA VAL 49 -3.591 5.572 5.373
112 HB VAL 49 HB VAL 49 -1.485 4.273 5.896
113 HG11 VAL 49 1HG1 VAL 49 -3.743 2.730 4.624
114 HG12 VAL 49 2HG1 VAL 49 -3.663 3.284 6.297
115 HG13 VAL 49 3HG1 VAL 49 -2.534 2.057 5.719
116 HG21 VAL 49 3HG2 VAL 49 -0.458 4.310 3.692
117 HG22 VAL 49 1HG2 VAL 49 -1.779 3.336 3.043
118 HG23 VAL 49 2HG2 VAL 49 -0.684 2.649 4.245
119 H GLN 50 H GLN 50 -1.486 6.262 6.536
120 HA GLN 50 HA GLN 50 -0.659 8.751 5.416
121 HB2 GLN 50 1HB GLN 50 -0.985 8.393 7.828
122 HB3 GLN 50 2HB GLN 50 0.318 7.219 7.844
123 HG2 GLN 50 1HG GLN 50 1.918 8.970 7.309
124 HG3 GLN 50 2HG GLN 50 0.610 10.150 7.229
125 HE21 GLN 50 2HE2 GLN 50 2.557 8.167 9.310
126 HE22 GLN 50 1HE2 GLN 50 2.112 8.935 10.796
127 H PHE 51 H PHE 51 1.195 9.292 4.395
128 HA PHE 51 HA PHE 51 2.654 7.306 3.015
129 HD1 PHE 51 HD2 PHE 51 3.417 8.027 0.417
130 HD2 PHE 51 HD1 PHE 51 5.596 10.420 3.180
131 HE1 PHE 51 HE2 PHE 51 5.439 7.761 -0.954
132 HE2 PHE 51 HE1 PHE 51 7.624 10.156 1.813
133 HZ PHE 51 HZ PHE 51 7.546 8.824 -0.256
134 HB2 PHE 51 1HB PHE 51 2.284 9.526 2.061
135 HB3 PHE 51 2HB PHE 51 3.234 10.262 3.347
136 H HIS 52 H HIS 52 4.447 6.287 3.448
137 HA HIS 52 HA HIS 52 6.109 7.103 5.734
138 HD1 HIS 52 HD1 HIS 52 6.976 2.777 6.316
139 HD2 HIS 52 HD2 HIS 52 6.160 6.271 8.414
140 HE1 HIS 52 HE1 HIS 52 8.259 2.581 8.473
141 HE2 HIS 52 HE2 HIS 52 7.762 4.710 9.731
142 HB2 HIS 52 1HB HIS 52 4.429 5.183 6.172
143 HB3 HIS 52 2HB HIS 52 5.421 4.216 5.091
144 H ILE 53 H ILE 53 8.228 7.218 5.185
145 HA ILE 53 HA ILE 53 9.012 6.854 2.478
146 HB ILE 53 HB ILE 53 10.616 7.560 4.945
147 HG12 ILE 53 1HG1 ILE 53 10.856 9.712 3.413
148 HG13 ILE 53 2HG1 ILE 53 9.378 9.090 2.695
149 HG21 ILE 53 1HG2 ILE 53 12.159 6.441 3.425
150 HG22 ILE 53 2HG2 ILE 53 12.500 8.169 3.507
151 HG23 ILE 53 3HG2 ILE 53 11.653 7.503 2.110
152 HD11 ILE 53 3HD1 ILE 53 9.766 9.786 5.601
153 HD12 ILE 53 1HD1 ILE 53 8.278 9.177 4.871
154 HD13 ILE 53 2HD1 ILE 53 8.912 10.755 4.400
155 H LEU 54 H LEU 54 9.368 4.865 5.345
156 HA LEU 54 HA LEU 54 11.054 2.913 4.006
157 HG LEU 54 HG LEU 54 12.205 2.542 7.498
158 HB2 LEU 54 1HB LEU 54 9.938 3.222 6.754
159 HB3 LEU 54 2HB LEU 54 10.412 1.622 6.230
160 HD11 LEU 54 1HD1 LEU 54 14.042 2.515 5.908
161 HD12 LEU 54 2HD1 LEU 54 12.900 2.698 4.576
162 HD13 LEU 54 3HD1 LEU 54 12.872 1.240 5.571
163 HD21 LEU 54 3HD2 LEU 54 11.683 4.905 7.367
164 HD22 LEU 54 1HD2 LEU 54 12.161 4.937 5.668
165 HD23 LEU 54 2HD2 LEU 54 13.364 4.617 6.918
166 H GLY 55 H GLY 55 8.091 3.542 3.253
167 HA2 GLY 55 1HA GLY 55 6.872 1.979 1.884
168 HA3 GLY 55 2HA GLY 55 7.309 0.709 3.020
169 H MET 56 H MET 56 4.797 2.386 1.959
170 HA MET 56 HA MET 56 3.490 3.211 4.353
171 HB2 MET 56 1HB MET 56 2.532 2.747 1.536
172 HB3 MET 56 2HB MET 56 1.425 3.179 2.826
173 HG2 MET 56 1HG MET 56 1.936 5.141 1.630
174 HG3 MET 56 2HG MET 56 2.755 5.246 3.180
175 HE1 MET 56 3HE MET 56 4.889 4.497 -0.861
176 HE2 MET 56 1HE MET 56 3.163 4.830 -0.703
177 HE3 MET 56 2HE MET 56 3.820 3.293 -0.140
178 H LYS 57 H LYS 57 1.953 2.181 5.575
179 HA LYS 57 HA LYS 57 2.104 -0.710 5.497
180 HB2 LYS 57 1HB LYS 57 2.431 0.522 7.620
181 HB3 LYS 57 2HB LYS 57 0.777 1.106 7.520
182 HG2 LYS 57 1HG LYS 57 -0.067 -1.170 7.728
183 HG3 LYS 57 2HG LYS 57 1.585 -1.792 7.750
184 HD2 LYS 57 1HD LYS 57 0.528 0.172 9.778
185 HD3 LYS 57 2HD LYS 57 0.478 -1.578 10.005
186 HE2 LYS 57 1HE LYS 57 2.877 -1.712 9.917
187 HE3 LYS 57 2HE LYS 57 3.000 -0.012 9.469
188 HZ1 LYS 57 3HZ LYS 57 1.975 -1.047 12.057
189 HZ2 LYS 57 1HZ LYS 57 2.105 0.587 11.623
190 HZ3 LYS 57 2HZ LYS 57 3.500 -0.354 11.801
191 H CYS 58 H CYS 58 0.825 -1.599 4.069
192 HA CYS 58 HA CYS 58 -1.845 -0.930 3.422
193 HB2 CYS 58 1HB CYS 58 -0.651 -2.340 1.950
194 HB3 CYS 58 2HB CYS 58 -0.154 -3.411 3.236
195 H LYS 59 H LYS 59 -3.705 -1.261 4.588
196 HA LYS 59 HA LYS 59 -3.363 -2.390 7.244
197 HB2 LYS 59 1HB LYS 59 -4.733 -0.210 6.261
198 HB3 LYS 59 2HB LYS 59 -6.021 -1.365 6.584
199 HG2 LYS 59 1HG LYS 59 -5.671 0.028 8.518
200 HG3 LYS 59 2HG LYS 59 -5.174 -1.625 8.889
201 HD2 LYS 59 1HD LYS 59 -2.826 -0.951 8.362
202 HD3 LYS 59 2HD LYS 59 -3.389 0.714 8.219
203 HE2 LYS 59 1HE LYS 59 -2.453 0.355 10.415
204 HE3 LYS 59 2HE LYS 59 -4.192 0.611 10.550
205 HZ1 LYS 59 3HZ LYS 59 -3.350 -1.217 11.944
206 HZ2 LYS 59 1HZ LYS 59 -2.879 -2.058 10.550
207 HZ3 LYS 59 2HZ LYS 59 -4.519 -1.730 10.837
208 H ILE 60 H ILE 60 -3.973 -3.832 4.472
209 HA ILE 60 HA ILE 60 -6.160 -5.554 5.321
210 HB ILE 60 HB ILE 60 -4.491 -5.615 2.783
211 HG12 ILE 60 1HG1 ILE 60 -7.318 -4.596 3.192
212 HG13 ILE 60 2HG1 ILE 60 -5.899 -3.561 3.108
213 HG21 ILE 60 1HG2 ILE 60 -5.463 -7.807 3.269
214 HG22 ILE 60 2HG2 ILE 60 -6.238 -7.070 1.868
215 HG23 ILE 60 3HG2 ILE 60 -7.059 -7.074 3.428
216 HD11 ILE 60 3HD1 ILE 60 -6.922 -5.342 0.910
217 HD12 ILE 60 1HD1 ILE 60 -5.500 -4.305 0.816
218 HD13 ILE 60 2HD1 ILE 60 -7.103 -3.589 1.001
219 H CYS 61 H CYS 61 -2.657 -5.616 5.000
220 HA CYS 61 HA CYS 61 -2.639 -8.306 6.181
221 HB2 CYS 61 1HB CYS 61 -0.887 -9.051 4.682
222 HB3 CYS 61 2HB CYS 61 -2.289 -8.536 3.750
223 H GLU 62 H GLU 62 -1.511 -5.162 6.272
224 HA GLU 62 HA GLU 62 -0.204 -4.021 7.697
225 HB2 GLU 62 1HB GLU 62 0.320 -6.681 9.038
226 HB3 GLU 62 2HB GLU 62 0.868 -5.130 9.656
227 HG2 GLU 62 1HG GLU 62 -1.999 -5.976 9.268
228 HG3 GLU 62 2HG GLU 62 -1.141 -5.875 10.803
229 H SER 63 H SER 63 0.804 -5.345 5.239
230 HA SER 63 HA SER 63 3.673 -5.387 5.801
231 HG SER 63 HG SER 63 4.091 -7.000 2.574
232 HB2 SER 63 1HB SER 63 2.796 -7.327 4.568
233 HB3 SER 63 2HB SER 63 2.157 -6.260 3.321
234 H TYR 64 H TYR 64 5.088 -4.077 4.724
235 HA TYR 64 HA TYR 64 3.973 -1.574 3.748
236 HD1 TYR 64 HD1 TYR 64 8.124 -2.400 2.932
237 HD2 TYR 64 HD2 TYR 64 6.393 -2.951 6.779
238 HE1 TYR 64 HE1 TYR 64 9.946 -3.934 3.526
239 HE2 TYR 64 HE2 TYR 64 8.209 -4.492 7.379
240 HH TYR 64 HH TYR 64 11.051 -4.769 5.551
241 HB2 TYR 64 1HB TYR 64 6.412 -0.828 3.852
242 HB3 TYR 64 2HB TYR 64 5.619 -1.192 5.376
243 H ASN 65 H ASN 65 4.749 -4.382 2.300
244 HA ASN 65 HA ASN 65 6.296 -3.466 0.047
245 HB2 ASN 65 1HB ASN 65 6.195 -5.863 1.041
246 HB3 ASN 65 2HB ASN 65 4.689 -6.018 0.148
247 HD21 ASN 65 2HD2 ASN 65 6.983 -7.600 -0.189
248 HD22 ASN 65 1HD2 ASN 65 7.565 -7.366 -1.800
249 H THR 66 H THR 66 5.095 -1.757 -0.751
250 HA THR 66 HA THR 66 2.686 -2.416 -2.258
251 HB THR 66 HB THR 66 1.629 -0.258 -1.402
252 HG1 THR 66 HG1 THR 66 3.648 -0.635 0.567
253 HG21 THR 66 3HG2 THR 66 1.912 -2.630 0.438
254 HG22 THR 66 1HG2 THR 66 0.660 -2.351 -0.769
255 HG23 THR 66 2HG2 THR 66 0.736 -1.340 0.671
256 H ALA 67 H ALA 67 2.368 -1.173 -4.017
257 HA ALA 67 HA ALA 67 4.249 1.039 -4.528
258 HB1 ALA 67 3HB ALA 67 2.959 -0.856 -6.506
259 HB2 ALA 67 1HB ALA 67 4.662 -0.815 -6.052
260 HB3 ALA 67 2HB ALA 67 3.954 0.539 -6.936
261 H GLN 68 H GLN 68 3.319 2.942 -4.623
262 HA GLN 68 HA GLN 68 0.691 3.422 -3.924
263 HB2 GLN 68 1HB GLN 68 2.434 5.073 -3.642
264 HB3 GLN 68 2HB GLN 68 2.637 5.207 -5.381
265 HG2 GLN 68 1HG GLN 68 0.381 6.160 -5.565
266 HG3 GLN 68 2HG GLN 68 0.195 6.048 -3.818
267 HE21 GLN 68 2HE2 GLN 68 -0.163 8.263 -3.746
268 HE22 GLN 68 1HE2 GLN 68 1.139 9.401 -3.853
269 H ALA 69 H ALA 69 -1.150 3.214 -4.916
270 HA ALA 69 HA ALA 69 -1.380 2.382 -7.613
271 HB1 ALA 69 3HB ALA 69 -2.884 1.612 -5.823
272 HB2 ALA 69 1HB ALA 69 -3.772 2.317 -7.175
273 HB3 ALA 69 2HB ALA 69 -3.546 3.241 -5.692
274 H GLY 70 H GLY 70 -1.140 3.648 -9.256
275 HA2 GLY 70 1HA GLY 70 -2.683 5.686 -10.119
276 HA3 GLY 70 2HA GLY 70 -1.501 6.497 -9.099
277 H GLY 71 H GLY 71 -2.128 6.072 -12.144
278 HA2 GLY 71 1HA GLY 71 -0.504 6.736 -13.803
279 HA3 GLY 71 2HA GLY 71 0.714 5.843 -12.906
280 H ARG 72 H ARG 72 -1.008 3.535 -12.492
281 HA ARG 72 HA ARG 72 -0.804 2.370 -15.174
282 HE ARG 72 HE ARG 72 0.583 0.825 -11.129
283 HB2 ARG 72 1HB ARG 72 -0.798 1.108 -12.429
284 HB3 ARG 72 2HB ARG 72 -1.057 0.168 -13.889
285 HG2 ARG 72 1HG ARG 72 1.189 -0.127 -13.524
286 HG3 ARG 72 2HG ARG 72 1.192 1.222 -14.660
287 HD2 ARG 72 1HD ARG 72 2.758 1.583 -12.815
288 HD3 ARG 72 2HD ARG 72 1.473 2.791 -12.821
289 HH11 ARG 72 1HH1 ARG 72 3.469 2.821 -11.235
290 HH12 ARG 72 2HH1 ARG 72 3.656 2.849 -9.510
291 HH21 ARG 72 1HH2 ARG 72 0.836 0.872 -8.879
292 HH22 ARG 72 2HH2 ARG 72 2.149 1.757 -8.172
293 H ARG 73 H ARG 73 -2.453 1.226 -16.079
294 HA ARG 73 HA ARG 73 -5.070 1.450 -14.757
295 HE ARG 73 HE ARG 73 -8.980 0.989 -17.562
296 HB2 ARG 73 1HB ARG 73 -5.061 2.885 -16.696
297 HB3 ARG 73 2HB ARG 73 -4.377 1.614 -17.696
298 HG2 ARG 73 1HG ARG 73 -6.738 1.950 -18.184
299 HG3 ARG 73 2HG ARG 73 -6.444 0.340 -17.532
300 HD2 ARG 73 1HD ARG 73 -7.181 1.159 -15.310
301 HD3 ARG 73 2HD ARG 73 -7.576 2.709 -16.054
302 HH11 ARG 73 1HH1 ARG 73 -8.741 1.306 -14.068
303 HH12 ARG 73 2HH1 ARG 73 -10.368 0.771 -13.788
304 HH21 ARG 73 1HH2 ARG 73 -11.085 0.269 -17.191
305 HH22 ARG 73 2HH2 ARG 73 -11.707 0.179 -15.569
306 H ILE 74 H ILE 74 -5.530 -0.485 -13.938
307 HA ILE 74 HA ILE 74 -4.918 -2.872 -15.456
308 HB ILE 74 HB ILE 74 -4.610 -3.191 -13.123
309 HG12 ILE 74 1HG1 ILE 74 -7.236 -4.512 -13.844
310 HG13 ILE 74 2HG1 ILE 74 -5.649 -5.071 -14.349
311 HG21 ILE 74 1HG2 ILE 74 -6.371 -2.871 -11.424
312 HG22 ILE 74 2HG2 ILE 74 -7.404 -2.163 -12.668
313 HG23 ILE 74 3HG2 ILE 74 -5.893 -1.372 -12.225
314 HD11 ILE 74 3HD1 ILE 74 -5.061 -5.507 -12.026
315 HD12 ILE 74 1HD1 ILE 74 -6.513 -6.386 -12.505
316 HD13 ILE 74 2HD1 ILE 74 -6.647 -4.933 -11.514
317 H SER 75 H SER 75 -6.047 -3.001 -17.230
318 HA SER 75 HA SER 75 -8.904 -2.476 -17.226
319 HG SER 75 HG SER 75 -7.713 -0.896 -19.944
320 HB2 SER 75 1HB SER 75 -7.092 -3.293 -19.510
321 HB3 SER 75 2HB SER 75 -8.758 -2.735 -19.654
322 H LEU 76 H LEU 76 -9.163 -4.260 -15.691
323 HA LEU 76 HA LEU 76 -8.736 -6.964 -16.565
324 HG LEU 76 HG LEU 76 -8.745 -8.548 -14.680
325 HB2 LEU 76 1HB LEU 76 -8.701 -5.997 -14.158
326 HB3 LEU 76 2HB LEU 76 -10.446 -6.093 -14.238
327 HD11 LEU 76 1HD1 LEU 76 -8.987 -9.034 -12.292
328 HD12 LEU 76 2HD1 LEU 76 -9.731 -7.453 -12.047
329 HD13 LEU 76 3HD1 LEU 76 -8.048 -7.565 -12.560
330 HD21 LEU 76 3HD2 LEU 76 -10.722 -9.715 -13.861
331 HD22 LEU 76 1HD2 LEU 76 -11.140 -8.697 -15.241
332 HD23 LEU 76 2HD2 LEU 76 -11.546 -8.177 -13.604
333 H ASP 77 H ASP 77 -9.980 -7.867 -18.043
334 HA ASP 77 HA ASP 77 -12.582 -6.867 -18.704
335 HB2 ASP 77 1HB ASP 77 -11.013 -7.845 -20.381
336 HB3 ASP 77 2HB ASP 77 -11.239 -9.419 -19.626
337 H GLN 78 H GLN 78 -14.113 -7.123 -17.294
338 HA GLN 78 HA GLN 78 -14.529 -9.760 -16.060
339 HB2 GLN 78 1HB GLN 78 -13.887 -7.998 -14.444
340 HB3 GLN 78 2HB GLN 78 -15.235 -7.011 -14.986
341 HG2 GLN 78 1HG GLN 78 -16.806 -8.693 -14.154
342 HG3 GLN 78 2HG GLN 78 -15.453 -9.687 -13.619
343 HE21 GLN 78 2HE2 GLN 78 -17.657 -8.488 -12.107
344 HE22 GLN 78 1HE2 GLN 78 -16.912 -7.519 -10.882
345 H GLN 79 H GLN 79 -16.553 -10.632 -16.189
346 HA GLN 79 HA GLN 79 -18.527 -9.154 -17.773
347 HB2 GLN 79 1HB GLN 79 -18.385 -12.128 -17.199
348 HB3 GLN 79 2HB GLN 79 -19.545 -11.337 -18.254
349 HG2 GLN 79 1HG GLN 79 -16.571 -11.452 -18.700
350 HG3 GLN 79 2HG GLN 79 -17.771 -12.469 -19.494
351 HE21 GLN 79 2HE2 GLN 79 -15.813 -10.545 -20.540
352 HE22 GLN 79 1HE2 GLN 79 -16.726 -9.432 -21.501
Start of MODEL 10
1 H ASN 33 H ASN 33 -2.543 17.368 3.921
2 HA ASN 33 HA ASN 33 -0.796 15.829 5.693
3 HB2 ASN 33 1HB ASN 33 -3.120 15.850 6.677
4 HB3 ASN 33 2HB ASN 33 -3.699 15.097 5.197
5 HD21 ASN 33 2HD2 ASN 33 -4.417 13.280 6.195
6 HD22 ASN 33 1HD2 ASN 33 -3.364 12.093 6.885
7 H MET 34 H MET 34 0.083 14.042 4.682
8 HA MET 34 HA MET 34 -0.529 13.805 1.828
9 HB2 MET 34 1HB MET 34 1.799 14.323 2.391
10 HB3 MET 34 2HB MET 34 1.888 12.876 3.383
11 HG2 MET 34 1HG MET 34 2.970 12.579 1.216
12 HG3 MET 34 2HG MET 34 1.615 11.476 1.438
13 HE1 MET 34 3HE MET 34 1.542 10.918 -1.114
14 HE2 MET 34 1HE MET 34 2.920 11.983 -1.399
15 HE3 MET 34 2HE MET 34 1.470 12.133 -2.390
16 H THR 35 H THR 35 -2.056 12.336 1.498
17 HA THR 35 HA THR 35 -1.561 9.637 2.542
18 HB THR 35 HB THR 35 -4.032 9.183 2.295
19 HG1 THR 35 HG1 THR 35 -4.023 11.929 1.760
20 HG21 THR 35 3HG2 THR 35 -4.651 10.102 4.449
21 HG22 THR 35 1HG2 THR 35 -3.293 11.227 4.381
22 HG23 THR 35 2HG2 THR 35 -2.996 9.490 4.487
23 H VAL 36 H VAL 36 -1.757 7.983 1.148
24 HA VAL 36 HA VAL 36 -2.554 8.479 -1.631
25 HB VAL 36 HB VAL 36 -0.659 6.877 -2.317
26 HG11 VAL 36 1HG1 VAL 36 0.962 8.680 -2.587
27 HG12 VAL 36 2HG1 VAL 36 0.067 9.657 -1.422
28 HG13 VAL 36 3HG1 VAL 36 -0.677 9.216 -2.959
29 HG21 VAL 36 3HG2 VAL 36 0.030 6.159 -0.096
30 HG22 VAL 36 1HG2 VAL 36 0.483 7.813 0.315
31 HG23 VAL 36 2HG2 VAL 36 1.370 6.941 -0.937
32 H ASP 37 H ASP 37 -3.105 6.518 -2.764
33 HA ASP 37 HA ASP 37 -3.990 4.345 -1.004
34 HB2 ASP 37 1HB ASP 37 -5.562 5.483 -2.643
35 HB3 ASP 37 2HB ASP 37 -4.633 4.709 -3.923
36 H ILE 38 H ILE 38 -2.989 2.440 -1.032
37 HA ILE 38 HA ILE 38 -1.074 1.895 -3.208
38 HB ILE 38 HB ILE 38 0.321 0.695 -1.414
39 HG12 ILE 38 1HG1 ILE 38 -0.895 2.663 0.506
40 HG13 ILE 38 2HG1 ILE 38 -1.627 1.076 0.294
41 HG21 ILE 38 1HG2 ILE 38 1.538 2.746 -0.842
42 HG22 ILE 38 2HG2 ILE 38 0.171 3.700 -1.417
43 HG23 ILE 38 3HG2 ILE 38 1.077 2.694 -2.545
44 HD11 ILE 38 3HD1 ILE 38 -0.160 1.067 2.184
45 HD12 ILE 38 1HD1 ILE 38 1.172 1.655 1.187
46 HD13 ILE 38 2HD1 ILE 38 0.506 0.048 0.905
47 H LEU 39 H LEU 39 -1.233 -0.017 -4.097
48 HA LEU 39 HA LEU 39 -3.026 -1.981 -2.869
49 HG LEU 39 HG LEU 39 -4.722 -2.890 -4.282
50 HB2 LEU 39 1HB LEU 39 -3.507 -0.726 -5.123
51 HB3 LEU 39 2HB LEU 39 -2.347 -1.854 -5.790
52 HD11 LEU 39 1HD1 LEU 39 -5.973 -2.906 -6.381
53 HD12 LEU 39 2HD1 LEU 39 -4.676 -1.996 -7.157
54 HD13 LEU 39 3HD1 LEU 39 -5.606 -1.265 -5.849
55 HD21 LEU 39 3HD2 LEU 39 -4.477 -4.760 -5.820
56 HD22 LEU 39 1HD2 LEU 39 -2.958 -4.449 -4.979
57 HD23 LEU 39 2HD2 LEU 39 -3.163 -3.926 -6.652
58 H CYS 40 H CYS 40 -2.105 -3.835 -2.251
59 HA CYS 40 HA CYS 40 0.670 -4.255 -2.349
60 HB2 CYS 40 1HB CYS 40 -1.653 -5.799 -1.425
61 HB3 CYS 40 2HB CYS 40 -0.227 -6.741 -1.821
62 H ASN 41 H ASN 41 1.965 -5.600 -3.407
63 HA ASN 41 HA ASN 41 1.078 -6.794 -5.889
64 HB2 ASN 41 1HB ASN 41 3.769 -6.890 -4.492
65 HB3 ASN 41 2HB ASN 41 3.457 -7.423 -6.138
66 HD21 ASN 41 2HD2 ASN 41 5.293 -5.380 -5.083
67 HD22 ASN 41 1HD2 ASN 41 4.881 -3.916 -5.905
68 H ASP 42 H ASP 42 1.490 -7.681 -2.584
69 HA ASP 42 HA ASP 42 1.692 -10.520 -3.155
70 HB2 ASP 42 1HB ASP 42 1.928 -10.691 -0.627
71 HB3 ASP 42 2HB ASP 42 3.214 -9.844 -1.479
72 H CYS 43 H CYS 43 -0.467 -8.483 -1.111
73 HA CYS 43 HA CYS 43 -2.314 -10.736 -0.984
74 HB2 CYS 43 1HB CYS 43 -3.229 -9.820 0.969
75 HB3 CYS 43 2HB CYS 43 -1.538 -9.362 1.084
76 H ASN 44 H ASN 44 -1.829 -8.199 -2.956
77 HA ASN 44 HA ASN 44 -2.945 -6.907 -4.394
78 HB2 ASN 44 1HB ASN 44 -4.691 -9.353 -4.355
79 HB3 ASN 44 2HB ASN 44 -4.928 -8.030 -5.492
80 HD21 ASN 44 2HD2 ASN 44 -4.426 -9.102 -7.270
81 HD22 ASN 44 1HD2 ASN 44 -2.862 -9.736 -7.634
82 H GLY 45 H GLY 45 -3.551 -6.355 -1.648
83 HA2 GLY 45 1HA GLY 45 -6.288 -5.309 -1.855
84 HA3 GLY 45 2HA GLY 45 -5.506 -5.739 -0.339
85 H ARG 46 H ARG 46 -6.653 -3.232 -1.615
86 HA ARG 46 HA ARG 46 -4.304 -1.503 -1.429
87 HE ARG 46 HE ARG 46 -7.404 1.670 -2.902
88 HB2 ARG 46 1HB ARG 46 -5.807 0.215 -2.507
89 HB3 ARG 46 2HB ARG 46 -5.348 -1.156 -3.496
90 HG2 ARG 46 1HG ARG 46 -7.473 -2.101 -3.392
91 HG3 ARG 46 2HG ARG 46 -7.952 -1.103 -2.018
92 HD2 ARG 46 1HD ARG 46 -7.254 0.070 -4.693
93 HD3 ARG 46 2HD ARG 46 -8.891 -0.464 -4.296
94 HH11 ARG 46 1HH1 ARG 46 -10.438 0.221 -3.901
95 HH12 ARG 46 2HH1 ARG 46 -11.399 1.511 -3.243
96 HH21 ARG 46 1HH2 ARG 46 -8.647 3.327 -2.057
97 HH22 ARG 46 2HH2 ARG 46 -10.381 3.301 -2.198
98 H SER 47 H SER 47 -4.286 0.322 -0.216
99 HA SER 47 HA SER 47 -6.397 0.754 1.761
100 HG SER 47 HG SER 47 -5.582 -1.385 2.378
101 HB2 SER 47 1HB SER 47 -3.472 0.361 2.496
102 HB3 SER 47 2HB SER 47 -4.779 0.758 3.611
103 H THR 48 H THR 48 -6.744 2.919 2.026
104 HA THR 48 HA THR 48 -4.795 4.791 0.934
105 HB THR 48 HB THR 48 -7.319 5.614 2.359
106 HG1 THR 48 HG1 THR 48 -7.028 4.341 -0.130
107 HG21 THR 48 3HG2 THR 48 -7.208 7.496 0.781
108 HG22 THR 48 1HG2 THR 48 -5.753 6.810 0.064
109 HG23 THR 48 2HG2 THR 48 -5.732 7.371 1.738
110 H VAL 49 H VAL 49 -3.162 5.307 2.152
111 HA VAL 49 HA VAL 49 -3.503 5.747 5.036
112 HB VAL 49 HB VAL 49 -1.245 4.671 5.396
113 HG11 VAL 49 1HG1 VAL 49 -3.512 2.906 4.497
114 HG12 VAL 49 2HG1 VAL 49 -3.259 3.562 6.116
115 HG13 VAL 49 3HG1 VAL 49 -2.131 2.375 5.456
116 HG21 VAL 49 3HG2 VAL 49 -0.504 2.992 3.750
117 HG22 VAL 49 1HG2 VAL 49 -0.461 4.630 3.095
118 HG23 VAL 49 2HG2 VAL 49 -1.769 3.537 2.647
119 H GLN 50 H GLN 50 -1.450 6.793 5.948
120 HA GLN 50 HA GLN 50 -0.662 9.009 4.314
121 HB2 GLN 50 1HB GLN 50 0.384 8.047 6.985
122 HB3 GLN 50 2HB GLN 50 0.874 9.546 6.206
123 HG2 GLN 50 1HG GLN 50 -1.490 10.294 6.282
124 HG3 GLN 50 2HG GLN 50 -1.879 8.836 7.194
125 HE21 GLN 50 2HE2 GLN 50 1.095 10.658 7.601
126 HE22 GLN 50 1HE2 GLN 50 0.743 11.216 9.197
127 H PHE 51 H PHE 51 1.407 9.446 3.481
128 HA PHE 51 HA PHE 51 2.825 7.176 2.495
129 HD1 PHE 51 HD2 PHE 51 4.200 7.254 0.119
130 HD2 PHE 51 HD1 PHE 51 5.695 10.542 2.358
131 HE1 PHE 51 HE2 PHE 51 6.440 6.865 -0.811
132 HE2 PHE 51 HE1 PHE 51 7.941 10.156 1.435
133 HZ PHE 51 HZ PHE 51 8.314 8.315 -0.153
134 HB2 PHE 51 1HB PHE 51 2.701 9.112 1.083
135 HB3 PHE 51 2HB PHE 51 3.395 10.144 2.326
136 H HIS 52 H HIS 52 3.788 5.986 3.992
137 HA HIS 52 HA HIS 52 5.701 7.209 5.793
138 HD1 HIS 52 HD1 HIS 52 6.745 2.803 6.551
139 HD2 HIS 52 HD2 HIS 52 6.662 6.630 8.154
140 HE1 HIS 52 HE1 HIS 52 8.443 2.800 8.392
141 HE2 HIS 52 HE2 HIS 52 8.192 5.039 9.498
142 HB2 HIS 52 1HB HIS 52 4.334 5.232 6.529
143 HB3 HIS 52 2HB HIS 52 5.176 4.251 5.336
144 H ILE 53 H ILE 53 7.728 7.501 5.309
145 HA ILE 53 HA ILE 53 8.575 7.283 2.616
146 HB ILE 53 HB ILE 53 10.378 7.954 4.947
147 HG12 ILE 53 1HG1 ILE 53 9.662 10.400 4.076
148 HG13 ILE 53 2HG1 ILE 53 8.160 9.545 3.755
149 HG21 ILE 53 1HG2 ILE 53 10.404 8.835 2.061
150 HG22 ILE 53 2HG2 ILE 53 11.500 7.674 2.810
151 HG23 ILE 53 3HG2 ILE 53 11.534 9.367 3.308
152 HD11 ILE 53 3HD1 ILE 53 8.113 10.661 5.922
153 HD12 ILE 53 1HD1 ILE 53 9.531 9.745 6.434
154 HD13 ILE 53 2HD1 ILE 53 8.014 8.909 6.106
155 H LEU 54 H LEU 54 9.232 5.412 5.509
156 HA LEU 54 HA LEU 54 11.242 3.784 4.171
157 HG LEU 54 HG LEU 54 11.480 5.688 6.624
158 HB2 LEU 54 1HB LEU 54 10.125 3.625 6.970
159 HB3 LEU 54 2HB LEU 54 11.464 2.677 6.356
160 HD11 LEU 54 1HD1 LEU 54 11.394 4.633 8.811
161 HD12 LEU 54 2HD1 LEU 54 12.994 5.312 8.509
162 HD13 LEU 54 3HD1 LEU 54 12.733 3.573 8.368
163 HD21 LEU 54 3HD2 LEU 54 12.959 4.881 4.870
164 HD22 LEU 54 1HD2 LEU 54 13.680 3.725 5.989
165 HD23 LEU 54 2HD2 LEU 54 13.891 5.457 6.253
166 H GLY 55 H GLY 55 8.171 3.794 3.613
167 HA2 GLY 55 1HA GLY 55 7.513 1.730 2.349
168 HA3 GLY 55 2HA GLY 55 7.811 0.877 3.856
169 H MET 56 H MET 56 5.528 2.336 1.947
170 HA MET 56 HA MET 56 3.741 3.442 3.862
171 HB2 MET 56 1HB MET 56 3.424 2.556 1.003
172 HB3 MET 56 2HB MET 56 2.096 3.240 1.932
173 HG2 MET 56 1HG MET 56 3.168 5.316 2.133
174 HG3 MET 56 2HG MET 56 4.714 4.656 1.597
175 HE1 MET 56 3HE MET 56 4.308 3.063 -0.926
176 HE2 MET 56 1HE MET 56 5.437 4.415 -0.853
177 HE3 MET 56 2HE MET 56 4.304 4.283 -2.199
178 H LYS 57 H LYS 57 2.079 2.585 4.949
179 HA LYS 57 HA LYS 57 2.253 -0.272 5.345
180 HB2 LYS 57 1HB LYS 57 2.392 1.161 7.270
181 HB3 LYS 57 2HB LYS 57 0.888 1.961 6.850
182 HG2 LYS 57 1HG LYS 57 -0.354 -0.058 7.349
183 HG3 LYS 57 2HG LYS 57 1.147 -0.920 7.688
184 HD2 LYS 57 1HD LYS 57 0.226 1.529 9.189
185 HD3 LYS 57 2HD LYS 57 -0.080 -0.125 9.718
186 HE2 LYS 57 1HE LYS 57 2.630 1.142 9.313
187 HE3 LYS 57 2HE LYS 57 1.857 0.820 10.864
188 HZ1 LYS 57 3HZ LYS 57 1.882 -1.559 10.296
189 HZ2 LYS 57 1HZ LYS 57 3.443 -0.893 10.379
190 HZ3 LYS 57 2HZ LYS 57 2.732 -1.201 8.874
191 H CYS 58 H CYS 58 1.016 -1.576 4.149
192 HA CYS 58 HA CYS 58 -1.678 -0.902 3.395
193 HB2 CYS 58 1HB CYS 58 -0.621 -2.413 1.945
194 HB3 CYS 58 2HB CYS 58 0.030 -3.370 3.251
195 H LYS 59 H LYS 59 -3.358 -0.940 4.721
196 HA LYS 59 HA LYS 59 -2.996 -1.909 7.429
197 HB2 LYS 59 1HB LYS 59 -3.953 0.353 6.685
198 HB3 LYS 59 2HB LYS 59 -5.423 -0.523 6.290
199 HG2 LYS 59 1HG LYS 59 -5.608 -1.247 8.635
200 HG3 LYS 59 2HG LYS 59 -4.150 -0.329 9.021
201 HD2 LYS 59 1HD LYS 59 -6.081 0.970 9.639
202 HD3 LYS 59 2HD LYS 59 -5.295 1.728 8.257
203 HE2 LYS 59 1HE LYS 59 -6.959 0.671 6.768
204 HE3 LYS 59 2HE LYS 59 -7.765 -0.008 8.182
205 HZ1 LYS 59 3HZ LYS 59 -8.867 1.993 7.460
206 HZ2 LYS 59 1HZ LYS 59 -7.427 2.881 7.579
207 HZ3 LYS 59 2HZ LYS 59 -8.156 2.252 8.974
208 H ILE 60 H ILE 60 -3.358 -3.839 5.213
209 HA ILE 60 HA ILE 60 -5.673 -5.279 6.304
210 HB ILE 60 HB ILE 60 -4.495 -5.750 3.547
211 HG12 ILE 60 1HG1 ILE 60 -7.029 -4.222 4.211
212 HG13 ILE 60 2HG1 ILE 60 -5.508 -3.453 3.785
213 HG21 ILE 60 1HG2 ILE 60 -7.098 -6.625 4.824
214 HG22 ILE 60 2HG2 ILE 60 -5.696 -7.648 4.507
215 HG23 ILE 60 3HG2 ILE 60 -6.608 -6.962 3.163
216 HD11 ILE 60 3HD1 ILE 60 -5.585 -4.496 1.594
217 HD12 ILE 60 1HD1 ILE 60 -7.038 -3.543 1.899
218 HD13 ILE 60 2HD1 ILE 60 -7.092 -5.302 2.026
219 H CYS 61 H CYS 61 -2.288 -5.491 5.210
220 HA CYS 61 HA CYS 61 -2.075 -8.048 6.653
221 HB2 CYS 61 1HB CYS 61 -0.686 -9.023 4.961
222 HB3 CYS 61 2HB CYS 61 -2.149 -8.426 4.187
223 H GLU 62 H GLU 62 -0.897 -4.937 6.387
224 HA GLU 62 HA GLU 62 0.800 -3.768 7.301
225 HB2 GLU 62 1HB GLU 62 1.402 -6.315 8.820
226 HB3 GLU 62 2HB GLU 62 2.190 -4.773 9.119
227 HG2 GLU 62 1HG GLU 62 -0.761 -5.294 9.384
228 HG3 GLU 62 2HG GLU 62 0.394 -5.282 10.719
229 H SER 63 H SER 63 1.229 -5.358 4.814
230 HA SER 63 HA SER 63 4.161 -5.352 4.818
231 HG SER 63 HG SER 63 4.934 -7.123 2.775
232 HB2 SER 63 1HB SER 63 3.109 -7.377 3.858
233 HB3 SER 63 2HB SER 63 2.250 -6.374 2.693
234 H TYR 64 H TYR 64 5.296 -4.015 3.476
235 HA TYR 64 HA TYR 64 3.774 -1.764 2.405
236 HD1 TYR 64 HD2 TYR 64 6.503 -2.690 5.295
237 HD2 TYR 64 HD1 TYR 64 7.991 -1.580 1.474
238 HE1 TYR 64 HE2 TYR 64 8.639 -3.776 5.821
239 HE2 TYR 64 HE1 TYR 64 10.137 -2.657 1.988
240 HH TYR 64 HH TYR 64 11.446 -3.276 4.009
241 HB2 TYR 64 1HB TYR 64 5.989 -0.570 2.385
242 HB3 TYR 64 2HB TYR 64 5.388 -1.007 3.976
243 H ASN 65 H ASN 65 4.797 -4.563 1.237
244 HA ASN 65 HA ASN 65 6.017 -3.755 -1.232
245 HB2 ASN 65 1HB ASN 65 6.394 -5.990 -0.274
246 HB3 ASN 65 2HB ASN 65 4.680 -6.351 -0.429
247 HD21 ASN 65 2HD2 ASN 65 4.804 -8.020 -1.792
248 HD22 ASN 65 1HD2 ASN 65 5.413 -7.925 -3.407
249 H THR 66 H THR 66 4.732 -2.265 -2.203
250 HA THR 66 HA THR 66 2.053 -3.062 -3.068
251 HB THR 66 HB THR 66 1.244 -0.730 -2.433
252 HG1 THR 66 HG1 THR 66 3.576 -0.811 -0.790
253 HG21 THR 66 3HG2 THR 66 0.617 -2.762 -1.147
254 HG22 THR 66 1HG2 THR 66 0.686 -1.306 -0.155
255 HG23 THR 66 2HG2 THR 66 2.001 -2.476 -0.091
256 H ALA 67 H ALA 67 1.140 -1.212 -4.425
257 HA ALA 67 HA ALA 67 3.115 0.402 -5.865
258 HB1 ALA 67 3HB ALA 67 2.698 -1.567 -7.272
259 HB2 ALA 67 1HB ALA 67 1.992 -0.124 -7.999
260 HB3 ALA 67 2HB ALA 67 0.960 -1.289 -7.167
261 H GLN 68 H GLN 68 2.357 2.481 -6.074
262 HA GLN 68 HA GLN 68 -0.011 3.214 -4.700
263 HB2 GLN 68 1HB GLN 68 1.779 4.823 -6.518
264 HB3 GLN 68 2HB GLN 68 0.428 5.502 -5.624
265 HG2 GLN 68 1HG GLN 68 1.487 4.830 -3.521
266 HG3 GLN 68 2HG GLN 68 2.847 4.170 -4.427
267 HE21 GLN 68 2HE2 GLN 68 2.800 6.272 -2.418
268 HE22 GLN 68 1HE2 GLN 68 3.465 7.677 -3.172
269 H ALA 69 H ALA 69 -1.996 3.146 -5.326
270 HA ALA 69 HA ALA 69 -2.657 2.604 -8.073
271 HB1 ALA 69 3HB ALA 69 -4.921 2.216 -7.265
272 HB2 ALA 69 1HB ALA 69 -4.457 2.812 -5.671
273 HB3 ALA 69 2HB ALA 69 -3.741 1.327 -6.300
274 H GLY 70 H GLY 70 -2.126 4.529 -9.046
275 HA2 GLY 70 1HA GLY 70 -4.072 6.448 -9.480
276 HA3 GLY 70 2HA GLY 70 -3.015 7.082 -8.220
277 H GLY 71 H GLY 71 -3.519 7.402 -11.335
278 HA2 GLY 71 1HA GLY 71 -2.101 8.235 -13.013
279 HA3 GLY 71 2HA GLY 71 -0.708 7.749 -12.049
280 H ARG 72 H ARG 72 -0.564 5.302 -11.728
281 HA ARG 72 HA ARG 72 -1.433 3.839 -14.118
282 HE ARG 72 HE ARG 72 2.502 4.924 -16.065
283 HB2 ARG 72 1HB ARG 72 0.692 3.158 -12.070
284 HB3 ARG 72 2HB ARG 72 0.195 2.092 -13.374
285 HG2 ARG 72 1HG ARG 72 1.375 4.829 -13.786
286 HG3 ARG 72 2HG ARG 72 2.307 3.332 -13.797
287 HD2 ARG 72 1HD ARG 72 0.877 2.522 -15.662
288 HD3 ARG 72 2HD ARG 72 0.082 4.096 -15.689
289 HH11 ARG 72 1HH1 ARG 72 1.161 1.949 -17.374
290 HH12 ARG 72 2HH1 ARG 72 2.197 1.964 -18.769
291 HH21 ARG 72 1HH2 ARG 72 3.860 4.911 -17.879
292 HH22 ARG 72 2HH2 ARG 72 3.735 3.638 -19.049
293 H ARG 73 H ARG 73 -3.503 3.342 -13.601
294 HA ARG 73 HA ARG 73 -4.141 2.106 -11.053
295 HE ARG 73 HE ARG 73 -8.873 1.485 -9.813
296 HB2 ARG 73 1HB ARG 73 -5.731 3.721 -11.941
297 HB3 ARG 73 2HB ARG 73 -5.857 2.826 -13.441
298 HG2 ARG 73 1HG ARG 73 -7.826 2.511 -12.045
299 HG3 ARG 73 2HG ARG 73 -6.965 0.995 -12.290
300 HD2 ARG 73 1HD ARG 73 -5.949 1.218 -10.072
301 HD3 ARG 73 2HD ARG 73 -6.816 2.733 -9.828
302 HH11 ARG 73 1HH1 ARG 73 -5.980 -0.491 -9.631
303 HH12 ARG 73 2HH1 ARG 73 -6.806 -1.844 -8.927
304 HH21 ARG 73 1HH2 ARG 73 -9.936 -0.287 -8.871
305 HH22 ARG 73 2HH2 ARG 73 -9.043 -1.727 -8.483
306 H ILE 74 H ILE 74 -3.249 0.158 -10.967
307 HA ILE 74 HA ILE 74 -3.909 -1.742 -13.109
308 HB ILE 74 HB ILE 74 -1.839 -3.002 -12.495
309 HG12 ILE 74 1HG1 ILE 74 -1.046 -0.491 -10.994
310 HG13 ILE 74 2HG1 ILE 74 -1.553 -1.988 -10.222
311 HG21 ILE 74 1HG2 ILE 74 -1.886 -1.599 -14.459
312 HG22 ILE 74 2HG2 ILE 74 -0.296 -1.519 -13.702
313 HG23 ILE 74 3HG2 ILE 74 -1.437 -0.189 -13.500
314 HD11 ILE 74 3HD1 ILE 74 0.363 -3.142 -11.212
315 HD12 ILE 74 1HD1 ILE 74 0.860 -1.778 -10.208
316 HD13 ILE 74 2HD1 ILE 74 0.873 -1.631 -11.966
317 H SER 75 H SER 75 -4.522 -3.793 -12.553
318 HA SER 75 HA SER 75 -5.347 -4.272 -9.820
319 HG SER 75 HG SER 75 -6.162 -5.517 -13.348
320 HB2 SER 75 1HB SER 75 -6.095 -6.511 -10.829
321 HB3 SER 75 2HB SER 75 -6.901 -5.070 -11.439
322 H LEU 76 H LEU 76 -3.335 -5.949 -12.194
323 HA LEU 76 HA LEU 76 -1.333 -6.455 -10.108
324 HG LEU 76 HG LEU 76 -2.355 -8.610 -9.362
325 HB2 LEU 76 1HB LEU 76 -2.151 -8.332 -12.344
326 HB3 LEU 76 2HB LEU 76 -0.693 -8.531 -11.399
327 HD11 LEU 76 1HD1 LEU 76 -4.383 -8.051 -10.592
328 HD12 LEU 76 2HD1 LEU 76 -4.485 -9.673 -9.908
329 HD13 LEU 76 3HD1 LEU 76 -4.155 -9.463 -11.627
330 HD21 LEU 76 3HD2 LEU 76 -0.881 -10.419 -10.158
331 HD22 LEU 76 1HD2 LEU 76 -2.151 -10.921 -11.274
332 HD23 LEU 76 2HD2 LEU 76 -2.425 -11.001 -9.535
333 H ASP 77 H ASP 77 0.863 -6.820 -11.180
334 HA ASP 77 HA ASP 77 1.413 -4.481 -12.706
335 HB2 ASP 77 1HB ASP 77 2.933 -5.353 -10.995
336 HB3 ASP 77 2HB ASP 77 3.216 -6.787 -11.971
337 H GLN 78 H GLN 78 1.282 -7.917 -13.538
338 HA GLN 78 HA GLN 78 2.311 -7.389 -16.212
339 HB2 GLN 78 1HB GLN 78 2.662 -9.687 -16.448
340 HB3 GLN 78 2HB GLN 78 3.064 -9.346 -14.778
341 HG2 GLN 78 1HG GLN 78 0.458 -10.549 -15.699
342 HG3 GLN 78 2HG GLN 78 1.836 -11.475 -15.125
343 HE21 GLN 78 2HE2 GLN 78 -0.873 -11.351 -14.131
344 HE22 GLN 78 1HE2 GLN 78 -0.758 -10.880 -12.475
345 H GLN 79 H GLN 79 -0.629 -7.055 -14.900
346 HA GLN 79 HA GLN 79 -2.133 -8.277 -17.068
347 HB2 GLN 79 1HB GLN 79 -3.057 -6.656 -14.690
348 HB3 GLN 79 2HB GLN 79 -4.133 -7.324 -15.907
349 HG2 GLN 79 1HG GLN 79 -2.381 -8.855 -14.000
350 HG3 GLN 79 2HG GLN 79 -4.137 -8.731 -13.950
351 HE21 GLN 79 2HE2 GLN 79 -5.360 -9.845 -15.528
352 HE22 GLN 79 1HE2 GLN 79 -4.687 -11.172 -16.412
Start of MODEL 11
1 H ASN 33 H ASN 33 0.809 14.628 5.021
2 HA ASN 33 HA ASN 33 -0.132 12.043 6.055
3 HB2 ASN 33 1HB ASN 33 -2.300 13.083 6.589
4 HB3 ASN 33 2HB ASN 33 -0.997 13.836 7.491
5 HD21 ASN 33 2HD2 ASN 33 -0.439 15.960 7.061
6 HD22 ASN 33 1HD2 ASN 33 -1.435 17.012 6.109
7 H MET 34 H MET 34 0.808 13.244 3.417
8 HA MET 34 HA MET 34 -1.174 13.328 1.479
9 HB2 MET 34 1HB MET 34 1.089 13.991 1.006
10 HB3 MET 34 2HB MET 34 1.699 12.388 1.385
11 HG2 MET 34 1HG MET 34 0.368 11.561 -0.606
12 HG3 MET 34 2HG MET 34 0.134 13.260 -1.024
13 HE1 MET 34 3HE MET 34 2.927 11.717 -3.472
14 HE2 MET 34 1HE MET 34 1.290 12.372 -3.425
15 HE3 MET 34 2HE MET 34 1.633 10.802 -2.695
16 H THR 35 H THR 35 -2.682 11.816 0.989
17 HA THR 35 HA THR 35 -2.162 9.099 1.845
18 HB THR 35 HB THR 35 -4.640 8.791 1.266
19 HG1 THR 35 HG1 THR 35 -5.554 11.143 1.582
20 HG21 THR 35 3HG2 THR 35 -3.826 10.745 3.418
21 HG22 THR 35 1HG2 THR 35 -3.793 8.987 3.548
22 HG23 THR 35 2HG2 THR 35 -5.333 9.829 3.371
23 H VAL 36 H VAL 36 -1.606 7.545 0.580
24 HA VAL 36 HA VAL 36 -2.419 7.563 -2.245
25 HB VAL 36 HB VAL 36 -0.241 6.428 -2.813
26 HG11 VAL 36 1HG1 VAL 36 -0.621 8.759 -3.370
27 HG12 VAL 36 2HG1 VAL 36 1.067 8.488 -2.939
28 HG13 VAL 36 3HG1 VAL 36 -0.029 9.255 -1.787
29 HG21 VAL 36 3HG2 VAL 36 0.474 5.757 -0.574
30 HG22 VAL 36 1HG2 VAL 36 0.642 7.444 -0.104
31 HG23 VAL 36 2HG2 VAL 36 1.699 6.765 -1.347
32 H ASP 37 H ASP 37 -3.125 5.609 -3.001
33 HA ASP 37 HA ASP 37 -3.449 3.483 -1.072
34 HB2 ASP 37 1HB ASP 37 -4.832 2.388 -2.823
35 HB3 ASP 37 2HB ASP 37 -5.391 4.001 -2.396
36 H ILE 38 H ILE 38 -2.198 1.820 -0.886
37 HA ILE 38 HA ILE 38 -0.317 1.230 -3.061
38 HB ILE 38 HB ILE 38 1.131 0.324 -1.043
39 HG12 ILE 38 1HG1 ILE 38 0.887 2.308 0.733
40 HG13 ILE 38 2HG1 ILE 38 -0.794 2.219 0.229
41 HG21 ILE 38 1HG2 ILE 38 1.888 1.940 -2.645
42 HG22 ILE 38 2HG2 ILE 38 2.306 2.483 -1.021
43 HG23 ILE 38 3HG2 ILE 38 0.943 3.213 -1.868
44 HD11 ILE 38 3HD1 ILE 38 0.828 -0.016 1.413
45 HD12 ILE 38 1HD1 ILE 38 -0.849 -0.135 0.882
46 HD13 ILE 38 2HD1 ILE 38 -0.423 0.922 2.230
47 H LEU 39 H LEU 39 -0.021 -0.815 -3.670
48 HA LEU 39 HA LEU 39 -2.036 -2.696 -2.637
49 HG LEU 39 HG LEU 39 -3.555 -3.475 -4.336
50 HB2 LEU 39 1HB LEU 39 -1.903 -1.661 -5.093
51 HB3 LEU 39 2HB LEU 39 -0.757 -2.956 -5.329
52 HD11 LEU 39 1HD1 LEU 39 -4.156 -3.948 -6.670
53 HD12 LEU 39 2HD1 LEU 39 -2.585 -3.334 -7.188
54 HD13 LEU 39 3HD1 LEU 39 -3.745 -2.252 -6.418
55 HD21 LEU 39 3HD2 LEU 39 -1.534 -5.184 -5.787
56 HD22 LEU 39 1HD2 LEU 39 -3.160 -5.680 -5.317
57 HD23 LEU 39 2HD2 LEU 39 -1.964 -5.299 -4.079
58 H CYS 40 H CYS 40 -1.298 -4.371 -1.616
59 HA CYS 40 HA CYS 40 1.425 -4.860 -1.136
60 HB2 CYS 40 1HB CYS 40 -1.106 -6.213 -0.470
61 HB3 CYS 40 2HB CYS 40 0.357 -7.173 -0.370
62 H ASN 41 H ASN 41 2.815 -6.261 -1.805
63 HA ASN 41 HA ASN 41 2.282 -7.882 -4.137
64 HB2 ASN 41 1HB ASN 41 4.768 -7.672 -2.408
65 HB3 ASN 41 2HB ASN 41 4.672 -8.432 -3.991
66 HD21 ASN 41 2HD2 ASN 41 6.263 -6.124 -2.937
67 HD22 ASN 41 1HD2 ASN 41 5.949 -4.831 -4.044
68 H ASP 42 H ASP 42 1.989 -8.150 -0.768
69 HA ASP 42 HA ASP 42 2.393 -11.029 -0.726
70 HB2 ASP 42 1HB ASP 42 2.183 -10.750 1.770
71 HB3 ASP 42 2HB ASP 42 3.576 -9.974 1.023
72 H CYS 43 H CYS 43 -0.185 -8.729 0.336
73 HA CYS 43 HA CYS 43 -1.904 -11.062 0.687
74 HB2 CYS 43 1HB CYS 43 -3.294 -9.803 2.122
75 HB3 CYS 43 2HB CYS 43 -1.647 -9.378 2.557
76 H ASN 44 H ASN 44 -1.275 -9.024 -1.761
77 HA ASN 44 HA ASN 44 -2.273 -8.154 -3.556
78 HB2 ASN 44 1HB ASN 44 -2.459 -10.612 -3.883
79 HB3 ASN 44 2HB ASN 44 -4.096 -10.547 -3.254
80 HD21 ASN 44 2HD2 ASN 44 -5.668 -9.640 -4.450
81 HD22 ASN 44 1HD2 ASN 44 -5.518 -9.317 -6.141
82 H GLY 45 H GLY 45 -2.963 -6.268 -2.547
83 HA2 GLY 45 1HA GLY 45 -5.576 -5.475 -2.836
84 HA3 GLY 45 2HA GLY 45 -5.452 -6.041 -1.176
85 H ARG 46 H ARG 46 -5.928 -3.349 -2.270
86 HA ARG 46 HA ARG 46 -3.443 -1.995 -1.496
87 HE ARG 46 HE ARG 46 -8.147 -0.474 -4.912
88 HB2 ARG 46 1HB ARG 46 -4.227 -0.073 -2.797
89 HB3 ARG 46 2HB ARG 46 -4.087 -1.519 -3.771
90 HG2 ARG 46 1HG ARG 46 -6.487 -1.817 -3.719
91 HG3 ARG 46 2HG ARG 46 -6.651 -0.405 -2.675
92 HD2 ARG 46 1HD ARG 46 -5.708 1.002 -4.431
93 HD3 ARG 46 2HD ARG 46 -5.542 -0.409 -5.475
94 HH11 ARG 46 1HH1 ARG 46 -6.144 2.224 -5.934
95 HH12 ARG 46 2HH1 ARG 46 -7.446 3.008 -6.785
96 HH21 ARG 46 1HH2 ARG 46 -9.830 0.573 -5.986
97 HH22 ARG 46 2HH2 ARG 46 -9.535 2.082 -6.797
98 H SER 47 H SER 47 -3.433 -0.192 -0.197
99 HA SER 47 HA SER 47 -5.868 0.405 1.335
100 HG SER 47 HG SER 47 -5.339 -1.654 2.304
101 HB2 SER 47 1HB SER 47 -3.108 0.001 2.521
102 HB3 SER 47 2HB SER 47 -4.557 0.467 3.409
103 H THR 48 H THR 48 -6.242 2.540 1.466
104 HA THR 48 HA THR 48 -4.240 4.381 0.450
105 HB THR 48 HB THR 48 -6.975 5.102 1.519
106 HG1 THR 48 HG1 THR 48 -7.510 4.962 -0.840
107 HG21 THR 48 3HG2 THR 48 -5.456 6.968 1.112
108 HG22 THR 48 1HG2 THR 48 -6.766 6.965 -0.077
109 HG23 THR 48 2HG2 THR 48 -5.161 6.390 -0.527
110 H VAL 49 H VAL 49 -2.739 5.048 1.779
111 HA VAL 49 HA VAL 49 -3.398 5.831 4.528
112 HB VAL 49 HB VAL 49 -1.220 4.800 5.300
113 HG11 VAL 49 1HG1 VAL 49 -3.336 3.791 5.884
114 HG12 VAL 49 2HG1 VAL 49 -2.137 2.539 5.560
115 HG13 VAL 49 3HG1 VAL 49 -3.370 2.913 4.355
116 HG21 VAL 49 3HG2 VAL 49 -0.304 2.926 4.018
117 HG22 VAL 49 1HG2 VAL 49 -0.179 4.442 3.124
118 HG23 VAL 49 2HG2 VAL 49 -1.430 3.272 2.705
119 H GLN 50 H GLN 50 -1.364 6.961 5.520
120 HA GLN 50 HA GLN 50 -0.668 9.064 3.706
121 HB2 GLN 50 1HB GLN 50 0.628 9.996 5.624
122 HB3 GLN 50 2HB GLN 50 -1.050 9.673 6.004
123 HG2 GLN 50 1HG GLN 50 -0.043 8.889 7.887
124 HG3 GLN 50 2HG GLN 50 -0.100 7.417 6.929
125 HE21 GLN 50 2HE2 GLN 50 2.171 10.092 6.502
126 HE22 GLN 50 1HE2 GLN 50 3.580 9.189 6.933
127 H PHE 51 H PHE 51 1.409 9.699 3.073
128 HA PHE 51 HA PHE 51 2.951 7.559 2.035
129 HD1 PHE 51 HD2 PHE 51 3.584 7.738 -0.418
130 HD2 PHE 51 HD1 PHE 51 5.822 10.778 1.518
131 HE1 PHE 51 HE2 PHE 51 5.516 7.211 -1.845
132 HE2 PHE 51 HE1 PHE 51 7.770 10.251 0.109
133 HZ PHE 51 HZ PHE 51 7.613 8.464 -1.577
134 HB2 PHE 51 1HB PHE 51 2.532 9.730 0.869
135 HB3 PHE 51 2HB PHE 51 3.586 10.520 2.037
136 H HIS 52 H HIS 52 4.549 6.536 2.906
137 HA HIS 52 HA HIS 52 5.915 7.719 5.209
138 HD1 HIS 52 HD1 HIS 52 6.158 3.370 6.681
139 HD2 HIS 52 HD2 HIS 52 6.237 7.386 7.729
140 HE1 HIS 52 HE1 HIS 52 7.314 3.461 8.910
141 HE2 HIS 52 HE2 HIS 52 7.145 5.869 9.615
142 HB2 HIS 52 1HB HIS 52 4.188 5.935 5.739
143 HB3 HIS 52 2HB HIS 52 5.224 4.790 4.900
144 H ILE 53 H ILE 53 8.026 7.734 5.126
145 HA ILE 53 HA ILE 53 9.444 7.103 2.768
146 HB ILE 53 HB ILE 53 10.521 7.734 5.528
147 HG12 ILE 53 1HG1 ILE 53 10.143 9.654 3.229
148 HG13 ILE 53 2HG1 ILE 53 8.885 9.365 4.423
149 HG21 ILE 53 1HG2 ILE 53 11.869 7.978 2.832
150 HG22 ILE 53 2HG2 ILE 53 12.267 6.813 4.094
151 HG23 ILE 53 3HG2 ILE 53 12.534 8.534 4.371
152 HD11 ILE 53 3HD1 ILE 53 10.154 11.373 4.930
153 HD12 ILE 53 1HD1 ILE 53 11.640 10.427 4.997
154 HD13 ILE 53 2HD1 ILE 53 10.366 10.154 6.187
155 H LEU 54 H LEU 54 8.996 5.345 5.779
156 HA LEU 54 HA LEU 54 10.876 3.261 4.969
157 HG LEU 54 HG LEU 54 11.582 3.564 8.603
158 HB2 LEU 54 1HB LEU 54 9.298 3.676 7.507
159 HB3 LEU 54 2HB LEU 54 10.262 2.249 7.210
160 HD11 LEU 54 1HD1 LEU 54 13.498 4.292 7.283
161 HD12 LEU 54 2HD1 LEU 54 12.525 4.190 5.816
162 HD13 LEU 54 3HD1 LEU 54 12.876 2.732 6.746
163 HD21 LEU 54 3HD2 LEU 54 10.926 5.979 6.924
164 HD22 LEU 54 1HD2 LEU 54 12.035 5.953 8.297
165 HD23 LEU 54 2HD2 LEU 54 10.320 5.623 8.542
166 H GLY 55 H GLY 55 8.241 3.790 3.611
167 HA2 GLY 55 1HA GLY 55 7.107 2.168 2.311
168 HA3 GLY 55 2HA GLY 55 7.373 0.991 3.591
169 H MET 56 H MET 56 5.020 2.495 2.063
170 HA MET 56 HA MET 56 3.383 3.504 4.165
171 HB2 MET 56 1HB MET 56 2.824 2.703 1.321
172 HB3 MET 56 2HB MET 56 1.538 3.199 2.407
173 HG2 MET 56 1HG MET 56 2.114 5.070 1.117
174 HG3 MET 56 2HG MET 56 2.751 5.356 2.729
175 HE1 MET 56 3HE MET 56 4.178 3.182 -0.286
176 HE2 MET 56 1HE MET 56 5.311 4.338 -0.985
177 HE3 MET 56 2HE MET 56 3.576 4.662 -1.035
178 H LYS 57 H LYS 57 1.940 2.510 5.447
179 HA LYS 57 HA LYS 57 2.174 -0.398 5.488
180 HB2 LYS 57 1HB LYS 57 2.781 0.888 7.505
181 HB3 LYS 57 2HB LYS 57 1.129 1.474 7.621
182 HG2 LYS 57 1HG LYS 57 0.311 -0.747 8.050
183 HG3 LYS 57 2HG LYS 57 1.902 -1.439 7.735
184 HD2 LYS 57 1HD LYS 57 1.251 0.470 9.981
185 HD3 LYS 57 2HD LYS 57 1.390 -1.282 10.144
186 HE2 LYS 57 1HE LYS 57 3.728 -1.128 9.340
187 HE3 LYS 57 2HE LYS 57 3.568 0.627 9.298
188 HZ1 LYS 57 3HZ LYS 57 3.481 -1.140 11.669
189 HZ2 LYS 57 1HZ LYS 57 3.020 0.493 11.715
190 HZ3 LYS 57 2HZ LYS 57 4.609 0.071 11.313
191 H CYS 58 H CYS 58 0.751 -1.411 4.390
192 HA CYS 58 HA CYS 58 -1.926 -0.761 3.873
193 HB2 CYS 58 1HB CYS 58 -0.990 -2.323 2.465
194 HB3 CYS 58 2HB CYS 58 -0.182 -3.169 3.751
195 H LYS 59 H LYS 59 -3.755 -0.955 5.083
196 HA LYS 59 HA LYS 59 -3.417 -1.674 7.871
197 HB2 LYS 59 1HB LYS 59 -5.873 -0.618 6.456
198 HB3 LYS 59 2HB LYS 59 -5.634 -0.711 8.193
199 HG2 LYS 59 1HG LYS 59 -3.652 0.830 6.634
200 HG3 LYS 59 2HG LYS 59 -5.260 1.518 6.783
201 HD2 LYS 59 1HD LYS 59 -3.904 2.440 8.498
202 HD3 LYS 59 2HD LYS 59 -5.029 1.328 9.264
203 HE2 LYS 59 1HE LYS 59 -2.414 0.190 8.513
204 HE3 LYS 59 2HE LYS 59 -2.380 1.413 9.788
205 HZ1 LYS 59 3HZ LYS 59 -3.914 0.145 11.074
206 HZ2 LYS 59 1HZ LYS 59 -2.664 -0.895 10.596
207 HZ3 LYS 59 2HZ LYS 59 -4.164 -0.962 9.815
208 H ILE 60 H ILE 60 -4.190 -3.401 5.173
209 HA ILE 60 HA ILE 60 -6.259 -5.099 6.216
210 HB ILE 60 HB ILE 60 -4.435 -5.651 3.856
211 HG12 ILE 60 1HG1 ILE 60 -7.146 -4.307 3.760
212 HG13 ILE 60 2HG1 ILE 60 -5.626 -3.422 3.726
213 HG21 ILE 60 1HG2 ILE 60 -7.204 -6.659 4.508
214 HG22 ILE 60 2HG2 ILE 60 -5.708 -7.589 4.600
215 HG23 ILE 60 3HG2 ILE 60 -6.300 -7.018 3.039
216 HD11 ILE 60 3HD1 ILE 60 -6.575 -3.700 1.494
217 HD12 ILE 60 1HD1 ILE 60 -6.517 -5.451 1.691
218 HD13 ILE 60 2HD1 ILE 60 -5.020 -4.521 1.643
219 H CYS 61 H CYS 61 -2.733 -5.172 6.076
220 HA CYS 61 HA CYS 61 -2.754 -7.660 7.618
221 HB2 CYS 61 1HB CYS 61 -1.252 -8.808 6.150
222 HB3 CYS 61 2HB CYS 61 -2.589 -8.203 5.175
223 H GLU 62 H GLU 62 -1.479 -4.602 7.171
224 HA GLU 62 HA GLU 62 -0.017 -3.343 8.302
225 HB2 GLU 62 1HB GLU 62 0.524 -5.762 10.036
226 HB3 GLU 62 2HB GLU 62 1.052 -4.123 10.391
227 HG2 GLU 62 1HG GLU 62 -1.766 -5.182 10.320
228 HG3 GLU 62 2HG GLU 62 -0.866 -4.572 11.709
229 H SER 63 H SER 63 0.787 -5.183 6.093
230 HA SER 63 HA SER 63 3.686 -5.147 6.465
231 HG SER 63 HG SER 63 3.698 -7.008 3.310
232 HB2 SER 63 1HB SER 63 2.803 -7.272 5.676
233 HB3 SER 63 2HB SER 63 1.946 -6.474 4.361
234 H TYR 64 H TYR 64 4.955 -3.811 5.355
235 HA TYR 64 HA TYR 64 3.644 -1.831 3.662
236 HD1 TYR 64 HD1 TYR 64 7.782 -1.150 3.243
237 HD2 TYR 64 HD2 TYR 64 6.206 -2.375 6.994
238 HE1 TYR 64 HE1 TYR 64 10.029 -1.833 3.947
239 HE2 TYR 64 HE2 TYR 64 8.451 -3.071 7.714
240 HH TYR 64 HH TYR 64 11.287 -2.186 5.982
241 HB2 TYR 64 1HB TYR 64 5.587 -0.412 3.989
242 HB3 TYR 64 2HB TYR 64 4.931 -0.923 5.533
243 H ASN 65 H ASN 65 4.972 -4.698 3.143
244 HA ASN 65 HA ASN 65 6.585 -4.224 0.831
245 HB2 ASN 65 1HB ASN 65 6.702 -6.357 2.064
246 HB3 ASN 65 2HB ASN 65 5.024 -6.692 1.659
247 HD21 ASN 65 2HD2 ASN 65 5.383 -8.553 0.578
248 HD22 ASN 65 1HD2 ASN 65 6.220 -8.640 -0.936
249 H THR 66 H THR 66 5.539 -2.808 -0.454
250 HA THR 66 HA THR 66 3.068 -3.645 -1.762
251 HB THR 66 HB THR 66 2.174 -1.279 -1.451
252 HG1 THR 66 HG1 THR 66 4.154 -1.260 0.603
253 HG21 THR 66 3HG2 THR 66 1.177 -3.134 -0.234
254 HG22 THR 66 1HG2 THR 66 1.217 -1.683 0.769
255 HG23 THR 66 2HG2 THR 66 2.392 -2.971 1.034
256 H ALA 67 H ALA 67 2.567 -2.284 -3.543
257 HA ALA 67 HA ALA 67 4.748 -0.605 -4.576
258 HB1 ALA 67 3HB ALA 67 4.088 -1.327 -6.846
259 HB2 ALA 67 1HB ALA 67 2.936 -2.464 -6.138
260 HB3 ALA 67 2HB ALA 67 4.666 -2.680 -5.870
261 H GLN 68 H GLN 68 3.983 1.332 -5.566
262 HA GLN 68 HA GLN 68 1.530 2.244 -4.455
263 HB2 GLN 68 1HB GLN 68 3.426 3.757 -4.755
264 HB3 GLN 68 2HB GLN 68 3.309 3.573 -6.499
265 HG2 GLN 68 1HG GLN 68 1.103 4.594 -6.471
266 HG3 GLN 68 2HG GLN 68 1.183 4.758 -4.722
267 HE21 GLN 68 2HE2 GLN 68 0.921 6.952 -4.848
268 HE22 GLN 68 1HE2 GLN 68 2.187 8.010 -5.373
269 H ALA 69 H ALA 69 -0.423 1.899 -5.192
270 HA ALA 69 HA ALA 69 -0.800 0.758 -7.814
271 HB1 ALA 69 3HB ALA 69 -3.079 0.381 -7.113
272 HB2 ALA 69 1HB ALA 69 -2.849 1.408 -5.699
273 HB3 ALA 69 2HB ALA 69 -1.974 -0.114 -5.835
274 H GLY 70 H GLY 70 -1.786 1.624 -9.507
275 HA2 GLY 70 1HA GLY 70 -2.917 4.326 -9.237
276 HA3 GLY 70 2HA GLY 70 -1.729 3.985 -10.491
277 H GLY 71 H GLY 71 -4.996 4.048 -9.743
278 HA2 GLY 71 1HA GLY 71 -5.835 2.128 -11.749
279 HA3 GLY 71 2HA GLY 71 -6.879 3.201 -10.823
280 H ARG 72 H ARG 72 -4.416 3.261 -13.376
281 HA ARG 72 HA ARG 72 -5.299 5.857 -14.289
282 HE ARG 72 HE ARG 72 -1.759 7.562 -15.419
283 HB2 ARG 72 1HB ARG 72 -3.121 4.021 -15.302
284 HB3 ARG 72 2HB ARG 72 -3.416 5.650 -15.890
285 HG2 ARG 72 1HG ARG 72 -2.963 6.497 -13.593
286 HG3 ARG 72 2HG ARG 72 -2.526 4.852 -13.127
287 HD2 ARG 72 1HD ARG 72 -0.525 6.089 -13.645
288 HD3 ARG 72 2HD ARG 72 -0.784 4.861 -14.881
289 HH11 ARG 72 1HH1 ARG 72 0.657 5.094 -16.066
290 HH12 ARG 72 2HH1 ARG 72 1.234 5.870 -17.507
291 HH21 ARG 72 1HH2 ARG 72 -0.976 8.571 -17.296
292 HH22 ARG 72 2HH2 ARG 72 0.312 7.834 -18.200
293 H ARG 73 H ARG 73 -6.843 6.108 -15.684
294 HA ARG 73 HA ARG 73 -7.749 3.886 -17.327
295 HE ARG 73 HE ARG 73 -12.215 4.466 -19.234
296 HB2 ARG 73 1HB ARG 73 -9.178 5.629 -15.953
297 HB3 ARG 73 2HB ARG 73 -8.953 6.639 -17.369
298 HG2 ARG 73 1HG ARG 73 -10.122 3.871 -17.512
299 HG3 ARG 73 2HG ARG 73 -11.095 5.315 -17.254
300 HD2 ARG 73 1HD ARG 73 -10.225 6.223 -19.390
301 HD3 ARG 73 2HD ARG 73 -9.358 4.710 -19.642
302 HH11 ARG 73 1HH1 ARG 73 -9.598 4.674 -21.565
303 HH12 ARG 73 2HH1 ARG 73 -10.561 4.058 -22.872
304 HH21 ARG 73 1HH2 ARG 73 -13.439 3.637 -20.950
305 HH22 ARG 73 2HH2 ARG 73 -12.725 3.456 -22.524
306 H ILE 74 H ILE 74 -6.506 3.578 -19.047
307 HA ILE 74 HA ILE 74 -5.417 5.840 -20.530
308 HB ILE 74 HB ILE 74 -4.943 2.865 -20.883
309 HG12 ILE 74 1HG1 ILE 74 -3.159 4.989 -19.664
310 HG13 ILE 74 2HG1 ILE 74 -4.117 3.847 -18.735
311 HG21 ILE 74 1HG2 ILE 74 -3.048 3.534 -22.302
312 HG22 ILE 74 2HG2 ILE 74 -3.526 5.224 -22.139
313 HG23 ILE 74 3HG2 ILE 74 -4.584 4.083 -22.970
314 HD11 ILE 74 3HD1 ILE 74 -1.863 3.147 -20.608
315 HD12 ILE 74 1HD1 ILE 74 -2.817 2.001 -19.664
316 HD13 ILE 74 2HD1 ILE 74 -1.788 3.177 -18.845
317 H SER 75 H SER 75 -6.365 6.612 -22.289
318 HA SER 75 HA SER 75 -8.780 5.399 -23.290
319 HG SER 75 HG SER 75 -7.856 8.495 -22.306
320 HB2 SER 75 1HB SER 75 -7.320 7.864 -24.262
321 HB3 SER 75 2HB SER 75 -8.996 7.433 -24.605
322 H LEU 76 H LEU 76 -8.732 3.837 -24.743
323 HA LEU 76 HA LEU 76 -6.567 3.760 -26.736
324 HG LEU 76 HG LEU 76 -6.544 0.060 -26.582
325 HB2 LEU 76 1HB LEU 76 -7.369 1.765 -25.132
326 HB3 LEU 76 2HB LEU 76 -8.527 1.532 -26.421
327 HD11 LEU 76 1HD1 LEU 76 -6.827 1.998 -28.863
328 HD12 LEU 76 2HD1 LEU 76 -7.767 0.528 -28.604
329 HD13 LEU 76 3HD1 LEU 76 -6.039 0.422 -28.946
330 HD21 LEU 76 3HD2 LEU 76 -5.042 2.624 -27.071
331 HD22 LEU 76 1HD2 LEU 76 -4.395 0.999 -27.295
332 HD23 LEU 76 2HD2 LEU 76 -4.861 1.547 -25.686
333 H ASP 77 H ASP 77 -7.243 5.178 -28.229
334 HA ASP 77 HA ASP 77 -9.928 5.002 -29.329
335 HB2 ASP 77 1HB ASP 77 -7.620 6.872 -29.868
336 HB3 ASP 77 2HB ASP 77 -9.112 6.898 -30.801
337 H GLN 78 H GLN 78 -6.593 4.487 -30.300
338 HA GLN 78 HA GLN 78 -5.549 3.564 -32.058
339 HB2 GLN 78 1HB GLN 78 -6.964 1.598 -31.230
340 HB3 GLN 78 2HB GLN 78 -8.041 1.932 -32.570
341 HG2 GLN 78 1HG GLN 78 -6.610 0.145 -33.202
342 HG3 GLN 78 2HG GLN 78 -6.115 1.574 -34.107
343 HE21 GLN 78 2HE2 GLN 78 -4.139 2.542 -33.665
344 HE22 GLN 78 1HE2 GLN 78 -2.920 1.743 -32.730
345 H GLN 79 H GLN 79 -6.510 5.977 -32.572
346 HA GLN 79 HA GLN 79 -7.703 5.860 -35.248
347 HB2 GLN 79 1HB GLN 79 -7.444 8.150 -33.289
348 HB3 GLN 79 2HB GLN 79 -8.037 8.333 -34.934
349 HG2 GLN 79 1HG GLN 79 -9.904 6.852 -34.455
350 HG3 GLN 79 2HG GLN 79 -9.301 6.595 -32.819
351 HE21 GLN 79 2HE2 GLN 79 -11.846 7.718 -33.803
352 HE22 GLN 79 1HE2 GLN 79 -11.972 9.289 -33.093
Start of MODEL 12
1 H ASN 33 H ASN 33 0.014 13.962 6.599
2 HA ASN 33 HA ASN 33 0.396 16.482 5.305
3 HB2 ASN 33 1HB ASN 33 2.194 15.278 6.528
4 HB3 ASN 33 2HB ASN 33 2.168 14.020 5.300
5 HD21 ASN 33 2HD2 ASN 33 1.904 17.507 4.742
6 HD22 ASN 33 1HD2 ASN 33 3.402 17.648 3.880
7 H MET 34 H MET 34 0.660 13.131 4.054
8 HA MET 34 HA MET 34 -0.950 13.849 1.753
9 HB2 MET 34 1HB MET 34 1.408 14.410 1.106
10 HB3 MET 34 2HB MET 34 1.829 12.721 1.355
11 HG2 MET 34 1HG MET 34 0.277 12.065 -0.413
12 HG3 MET 34 2HG MET 34 -0.167 13.754 -0.654
13 HE1 MET 34 3HE MET 34 3.995 11.985 -1.583
14 HE2 MET 34 1HE MET 34 2.617 11.034 -1.029
15 HE3 MET 34 2HE MET 34 3.388 12.186 0.061
16 H THR 35 H THR 35 -2.333 12.242 1.427
17 HA THR 35 HA THR 35 -1.625 9.568 2.412
18 HB THR 35 HB THR 35 -4.054 9.045 2.239
19 HG1 THR 35 HG1 THR 35 -4.454 10.797 0.669
20 HG21 THR 35 3HG2 THR 35 -3.087 9.765 4.372
21 HG22 THR 35 1HG2 THR 35 -4.749 10.327 4.196
22 HG23 THR 35 2HG2 THR 35 -3.410 11.449 3.950
23 H VAL 36 H VAL 36 -1.211 8.000 1.054
24 HA VAL 36 HA VAL 36 -2.274 8.146 -1.680
25 HB VAL 36 HB VAL 36 -0.269 6.806 -2.425
26 HG11 VAL 36 1HG1 VAL 36 -0.425 9.192 -2.892
27 HG12 VAL 36 2HG1 VAL 36 1.244 8.720 -2.571
28 HG13 VAL 36 3HG1 VAL 36 0.310 9.556 -1.329
29 HG21 VAL 36 3HG2 VAL 36 1.770 6.906 -1.062
30 HG22 VAL 36 1HG2 VAL 36 0.495 5.979 -0.267
31 HG23 VAL 36 2HG2 VAL 36 0.847 7.625 0.257
32 H ASP 37 H ASP 37 -3.201 6.305 -2.475
33 HA ASP 37 HA ASP 37 -3.748 4.193 -0.552
34 HB2 ASP 37 1HB ASP 37 -5.553 5.178 -2.012
35 HB3 ASP 37 2HB ASP 37 -4.756 4.445 -3.396
36 H ILE 38 H ILE 38 -2.641 2.377 -0.473
37 HA ILE 38 HA ILE 38 -0.911 1.704 -2.752
38 HB ILE 38 HB ILE 38 0.538 0.509 -1.054
39 HG12 ILE 38 1HG1 ILE 38 -0.716 2.354 0.971
40 HG13 ILE 38 2HG1 ILE 38 -1.329 0.721 0.740
41 HG21 ILE 38 1HG2 ILE 38 1.227 2.561 -2.112
42 HG22 ILE 38 2HG2 ILE 38 1.709 2.578 -0.416
43 HG23 ILE 38 3HG2 ILE 38 0.307 3.510 -0.943
44 HD11 ILE 38 3HD1 ILE 38 0.192 0.745 2.576
45 HD12 ILE 38 1HD1 ILE 38 1.438 1.507 1.586
46 HD13 ILE 38 2HD1 ILE 38 0.920 -0.139 1.236
47 H LEU 39 H LEU 39 -1.107 -0.195 -3.662
48 HA LEU 39 HA LEU 39 -2.858 -2.176 -2.384
49 HG LEU 39 HG LEU 39 -4.680 -2.964 -3.720
50 HB2 LEU 39 1HB LEU 39 -3.356 -0.940 -4.683
51 HB3 LEU 39 2HB LEU 39 -2.266 -2.152 -5.320
52 HD11 LEU 39 1HD1 LEU 39 -4.573 -2.370 -6.674
53 HD12 LEU 39 2HD1 LEU 39 -5.477 -1.462 -5.462
54 HD13 LEU 39 3HD1 LEU 39 -5.916 -3.131 -5.821
55 HD21 LEU 39 3HD2 LEU 39 -4.515 -4.969 -5.105
56 HD22 LEU 39 1HD2 LEU 39 -3.018 -4.678 -4.220
57 HD23 LEU 39 2HD2 LEU 39 -3.118 -4.285 -5.936
58 H CYS 40 H CYS 40 -1.948 -4.029 -1.809
59 HA CYS 40 HA CYS 40 0.846 -4.447 -1.995
60 HB2 CYS 40 1HB CYS 40 -1.434 -6.069 -0.999
61 HB3 CYS 40 2HB CYS 40 0.126 -6.838 -1.220
62 H ASN 41 H ASN 41 2.069 -5.845 -3.065
63 HA ASN 41 HA ASN 41 1.095 -7.149 -5.436
64 HB2 ASN 41 1HB ASN 41 3.763 -7.391 -4.008
65 HB3 ASN 41 2HB ASN 41 3.400 -8.073 -5.582
66 HD21 ASN 41 2HD2 ASN 41 4.934 -6.982 -6.699
67 HD22 ASN 41 1HD2 ASN 41 4.926 -5.271 -6.938
68 H ASP 42 H ASP 42 1.502 -7.936 -2.089
69 HA ASP 42 HA ASP 42 1.568 -10.799 -2.523
70 HB2 ASP 42 1HB ASP 42 1.701 -10.768 0.075
71 HB3 ASP 42 2HB ASP 42 3.089 -10.238 -0.872
72 H CYS 43 H CYS 43 -0.492 -8.602 -0.536
73 HA CYS 43 HA CYS 43 -2.393 -10.782 -0.265
74 HB2 CYS 43 1HB CYS 43 -3.363 -9.656 1.548
75 HB3 CYS 43 2HB CYS 43 -1.654 -9.269 1.671
76 H ASN 44 H ASN 44 -1.928 -8.299 -2.401
77 HA ASN 44 HA ASN 44 -3.127 -7.155 -3.933
78 HB2 ASN 44 1HB ASN 44 -4.804 -9.660 -3.710
79 HB3 ASN 44 2HB ASN 44 -5.128 -8.402 -4.901
80 HD21 ASN 44 2HD2 ASN 44 -2.917 -10.901 -3.893
81 HD22 ASN 44 1HD2 ASN 44 -2.011 -10.969 -5.365
82 H GLY 45 H GLY 45 -3.502 -6.232 -1.433
83 HA2 GLY 45 1HA GLY 45 -6.312 -5.379 -1.430
84 HA3 GLY 45 2HA GLY 45 -5.483 -5.811 0.061
85 H ARG 46 H ARG 46 -6.696 -3.303 -1.069
86 HA ARG 46 HA ARG 46 -4.357 -1.543 -1.173
87 HE ARG 46 HE ARG 46 -10.275 -0.789 -2.304
88 HB2 ARG 46 1HB ARG 46 -5.863 0.094 -2.179
89 HB3 ARG 46 2HB ARG 46 -5.932 -1.429 -3.051
90 HG2 ARG 46 1HG ARG 46 -8.014 -1.992 -1.997
91 HG3 ARG 46 2HG ARG 46 -7.924 -0.552 -0.985
92 HD2 ARG 46 1HD ARG 46 -7.933 0.800 -3.105
93 HD3 ARG 46 2HD ARG 46 -8.314 -0.697 -3.962
94 HH11 ARG 46 1HH1 ARG 46 -8.980 2.143 -3.738
95 HH12 ARG 46 2HH1 ARG 46 -10.454 3.042 -3.517
96 HH21 ARG 46 1HH2 ARG 46 -12.186 0.385 -2.007
97 HH22 ARG 46 2HH2 ARG 46 -12.276 2.041 -2.527
98 H SER 47 H SER 47 -4.224 0.328 0.078
99 HA SER 47 HA SER 47 -6.155 0.763 2.218
100 HG SER 47 HG SER 47 -5.430 -1.359 2.888
101 HB2 SER 47 1HB SER 47 -3.211 0.280 2.777
102 HB3 SER 47 2HB SER 47 -4.418 0.757 3.967
103 H THR 48 H THR 48 -6.532 2.924 2.286
104 HA THR 48 HA THR 48 -4.656 4.765 1.070
105 HB THR 48 HB THR 48 -7.079 5.571 2.686
106 HG1 THR 48 HG1 THR 48 -6.989 4.121 0.343
107 HG21 THR 48 3HG2 THR 48 -7.127 7.454 1.106
108 HG22 THR 48 1HG2 THR 48 -5.723 6.795 0.269
109 HG23 THR 48 2HG2 THR 48 -5.572 7.362 1.933
110 H VAL 49 H VAL 49 -2.891 5.277 2.161
111 HA VAL 49 HA VAL 49 -3.056 5.687 5.070
112 HB VAL 49 HB VAL 49 -0.900 4.556 5.384
113 HG11 VAL 49 1HG1 VAL 49 -1.646 2.248 5.037
114 HG12 VAL 49 2HG1 VAL 49 -2.952 2.839 4.008
115 HG13 VAL 49 3HG1 VAL 49 -2.913 3.269 5.718
116 HG21 VAL 49 3HG2 VAL 49 0.066 4.887 3.157
117 HG22 VAL 49 1HG2 VAL 49 -1.107 3.759 2.476
118 HG23 VAL 49 2HG2 VAL 49 0.103 3.187 3.623
119 H GLN 50 H GLN 50 -0.975 6.763 5.862
120 HA GLN 50 HA GLN 50 -0.420 9.019 4.143
121 HB2 GLN 50 1HB GLN 50 0.605 8.336 6.903
122 HB3 GLN 50 2HB GLN 50 0.894 9.852 6.059
123 HG2 GLN 50 1HG GLN 50 -1.441 10.388 6.105
124 HG3 GLN 50 2HG GLN 50 -1.830 8.808 6.784
125 HE21 GLN 50 2HE2 GLN 50 -0.424 11.906 7.387
126 HE22 GLN 50 1HE2 GLN 50 -0.441 11.810 9.108
127 H PHE 51 H PHE 51 1.582 9.572 3.310
128 HA PHE 51 HA PHE 51 3.284 7.438 2.516
129 HD1 PHE 51 HD2 PHE 51 4.305 7.434 0.179
130 HD2 PHE 51 HD1 PHE 51 5.934 10.923 1.980
131 HE1 PHE 51 HE2 PHE 51 6.429 7.036 -0.991
132 HE2 PHE 51 HE1 PHE 51 8.064 10.530 0.815
133 HZ PHE 51 HZ PHE 51 8.312 8.587 -0.673
134 HB2 PHE 51 1HB PHE 51 2.882 9.423 1.116
135 HB3 PHE 51 2HB PHE 51 3.698 10.433 2.303
136 H HIS 52 H HIS 52 4.507 6.450 3.883
137 HA HIS 52 HA HIS 52 5.850 7.936 6.016
138 HD1 HIS 52 HD1 HIS 52 6.451 3.724 7.623
139 HD2 HIS 52 HD2 HIS 52 5.877 7.688 8.738
140 HE1 HIS 52 HE1 HIS 52 7.550 3.956 9.872
141 HE2 HIS 52 HE2 HIS 52 7.141 6.345 10.565
142 HB2 HIS 52 1HB HIS 52 4.172 6.151 6.641
143 HB3 HIS 52 2HB HIS 52 5.237 4.965 5.899
144 H ILE 53 H ILE 53 7.983 8.043 6.030
145 HA ILE 53 HA ILE 53 9.488 7.305 3.754
146 HB ILE 53 HB ILE 53 10.449 8.251 6.464
147 HG12 ILE 53 1HG1 ILE 53 8.926 9.859 5.469
148 HG13 ILE 53 2HG1 ILE 53 10.568 10.487 5.405
149 HG21 ILE 53 1HG2 ILE 53 12.284 7.239 5.221
150 HG22 ILE 53 2HG2 ILE 53 12.497 8.985 5.350
151 HG23 ILE 53 3HG2 ILE 53 11.934 8.276 3.837
152 HD11 ILE 53 3HD1 ILE 53 9.074 9.237 3.107
153 HD12 ILE 53 1HD1 ILE 53 10.708 9.897 3.047
154 HD13 ILE 53 2HD1 ILE 53 9.338 10.963 3.360
155 H LEU 54 H LEU 54 9.099 5.829 6.916
156 HA LEU 54 HA LEU 54 11.136 3.825 6.355
157 HG LEU 54 HG LEU 54 12.136 5.254 8.219
158 HB2 LEU 54 1HB LEU 54 9.409 4.196 8.806
159 HB3 LEU 54 2HB LEU 54 10.723 3.054 8.654
160 HD11 LEU 54 1HD1 LEU 54 10.269 6.811 8.270
161 HD12 LEU 54 2HD1 LEU 54 11.367 7.113 9.618
162 HD13 LEU 54 3HD1 LEU 54 9.843 6.269 9.894
163 HD21 LEU 54 3HD2 LEU 54 12.525 3.645 10.001
164 HD22 LEU 54 1HD2 LEU 54 11.217 4.360 10.945
165 HD23 LEU 54 2HD2 LEU 54 12.672 5.297 10.601
166 H GLY 55 H GLY 55 8.711 3.865 4.736
167 HA2 GLY 55 1HA GLY 55 7.860 1.897 3.687
168 HA3 GLY 55 2HA GLY 55 7.878 1.094 5.249
169 H MET 56 H MET 56 5.838 2.022 2.995
170 HA MET 56 HA MET 56 3.831 3.285 4.664
171 HB2 MET 56 1HB MET 56 3.849 2.429 1.775
172 HB3 MET 56 2HB MET 56 2.419 3.080 2.569
173 HG2 MET 56 1HG MET 56 3.572 5.151 3.022
174 HG3 MET 56 2HG MET 56 5.061 4.502 2.337
175 HE1 MET 56 3HE MET 56 4.322 3.062 -0.289
176 HE2 MET 56 1HE MET 56 5.573 4.299 -0.168
177 HE3 MET 56 2HE MET 56 4.362 4.394 -1.447
178 H LYS 57 H LYS 57 2.351 2.261 5.786
179 HA LYS 57 HA LYS 57 2.466 -0.646 5.802
180 HB2 LYS 57 1HB LYS 57 2.820 0.680 7.879
181 HB3 LYS 57 2HB LYS 57 1.168 1.264 7.759
182 HG2 LYS 57 1HG LYS 57 0.425 -1.140 7.913
183 HG3 LYS 57 2HG LYS 57 2.098 -1.545 8.296
184 HD2 LYS 57 1HD LYS 57 0.446 0.439 9.855
185 HD3 LYS 57 2HD LYS 57 0.606 -1.260 10.288
186 HE2 LYS 57 1HE LYS 57 2.917 0.671 10.046
187 HE3 LYS 57 2HE LYS 57 2.118 0.258 11.561
188 HZ1 LYS 57 3HZ LYS 57 4.070 -1.066 11.347
189 HZ2 LYS 57 1HZ LYS 57 3.641 -1.574 9.788
190 HZ3 LYS 57 2HZ LYS 57 2.736 -2.090 11.126
191 H CYS 58 H CYS 58 1.085 -1.535 4.372
192 HA CYS 58 HA CYS 58 -1.593 -0.782 3.904
193 HB2 CYS 58 1HB CYS 58 -0.781 -2.269 2.333
194 HB3 CYS 58 2HB CYS 58 0.067 -3.230 3.527
195 H LYS 59 H LYS 59 -3.482 -1.224 5.007
196 HA LYS 59 HA LYS 59 -3.089 -1.790 7.812
197 HB2 LYS 59 1HB LYS 59 -5.578 -0.974 6.307
198 HB3 LYS 59 2HB LYS 59 -5.414 -1.029 8.056
199 HG2 LYS 59 1HG LYS 59 -3.830 0.754 6.220
200 HG3 LYS 59 2HG LYS 59 -5.235 1.247 7.163
201 HD2 LYS 59 1HD LYS 59 -4.032 0.672 9.226
202 HD3 LYS 59 2HD LYS 59 -2.623 0.218 8.269
203 HE2 LYS 59 1HE LYS 59 -2.313 2.444 9.155
204 HE3 LYS 59 2HE LYS 59 -2.501 2.528 7.405
205 HZ1 LYS 59 3HZ LYS 59 -4.767 3.246 7.682
206 HZ2 LYS 59 1HZ LYS 59 -3.756 4.258 8.592
207 HZ3 LYS 59 2HZ LYS 59 -4.673 3.059 9.362
208 H ILE 60 H ILE 60 -3.870 -3.656 5.160
209 HA ILE 60 HA ILE 60 -5.744 -5.398 6.531
210 HB ILE 60 HB ILE 60 -4.616 -5.924 3.779
211 HG12 ILE 60 1HG1 ILE 60 -6.995 -4.160 4.444
212 HG13 ILE 60 2HG1 ILE 60 -5.442 -3.572 3.870
213 HG21 ILE 60 1HG2 ILE 60 -5.940 -7.703 4.805
214 HG22 ILE 60 2HG2 ILE 60 -6.801 -7.000 3.435
215 HG23 ILE 60 3HG2 ILE 60 -7.263 -6.571 5.082
216 HD11 ILE 60 3HD1 ILE 60 -5.774 -4.753 1.764
217 HD12 ILE 60 1HD1 ILE 60 -7.085 -3.619 2.090
218 HD13 ILE 60 2HD1 ILE 60 -7.330 -5.347 2.345
219 H CYS 61 H CYS 61 -2.323 -5.375 5.674
220 HA CYS 61 HA CYS 61 -1.996 -7.922 7.080
221 HB2 CYS 61 1HB CYS 61 -0.815 -9.026 5.357
222 HB3 CYS 61 2HB CYS 61 -2.254 -8.356 4.594
223 H GLU 62 H GLU 62 -0.934 -4.833 6.622
224 HA GLU 62 HA GLU 62 0.797 -3.558 7.232
225 HB2 GLU 62 1HB GLU 62 1.484 -5.949 8.911
226 HB3 GLU 62 2HB GLU 62 2.376 -4.435 8.981
227 HG2 GLU 62 1HG GLU 62 0.262 -3.278 9.564
228 HG3 GLU 62 2HG GLU 62 -0.535 -4.852 9.633
229 H SER 63 H SER 63 1.208 -5.436 4.863
230 HA SER 63 HA SER 63 4.092 -5.714 4.862
231 HG SER 63 HG SER 63 3.741 -7.215 1.593
232 HB2 SER 63 1HB SER 63 2.736 -7.497 3.842
233 HB3 SER 63 2HB SER 63 2.098 -6.341 2.672
234 H TYR 64 H TYR 64 5.481 -4.688 3.549
235 HA TYR 64 HA TYR 64 4.636 -2.030 2.639
236 HD1 TYR 64 HD1 TYR 64 5.265 -0.426 4.721
237 HD2 TYR 64 HD2 TYR 64 7.507 -3.986 5.330
238 HE1 TYR 64 HE1 TYR 64 4.834 -0.274 7.134
239 HE2 TYR 64 HE2 TYR 64 7.089 -3.840 7.746
240 HH TYR 64 HH TYR 64 6.470 -2.266 9.434
241 HB2 TYR 64 1HB TYR 64 7.447 -3.022 3.187
242 HB3 TYR 64 2HB TYR 64 6.926 -1.351 2.989
243 H ASN 65 H ASN 65 5.268 -5.050 1.427
244 HA ASN 65 HA ASN 65 6.417 -4.301 -1.106
245 HB2 ASN 65 1HB ASN 65 6.714 -6.581 -0.192
246 HB3 ASN 65 2HB ASN 65 4.975 -6.835 -0.256
247 HD21 ASN 65 2HD2 ASN 65 5.076 -8.575 -1.604
248 HD22 ASN 65 1HD2 ASN 65 5.565 -8.472 -3.259
249 H THR 66 H THR 66 5.142 -2.671 -1.871
250 HA THR 66 HA THR 66 2.394 -3.333 -2.638
251 HB THR 66 HB THR 66 1.779 -0.941 -1.945
252 HG1 THR 66 HG1 THR 66 4.138 -1.284 -0.369
253 HG21 THR 66 3HG2 THR 66 1.248 -1.571 0.343
254 HG22 THR 66 1HG2 THR 66 2.396 -2.904 0.263
255 HG23 THR 66 2HG2 THR 66 0.953 -2.918 -0.749
256 H ALA 67 H ALA 67 1.494 -1.553 -3.997
257 HA ALA 67 HA ALA 67 3.467 0.065 -5.433
258 HB1 ALA 67 3HB ALA 67 2.971 -1.886 -6.850
259 HB2 ALA 67 1HB ALA 67 2.327 -0.401 -7.558
260 HB3 ALA 67 2HB ALA 67 1.247 -1.529 -6.734
261 H GLN 68 H GLN 68 2.357 1.959 -6.499
262 HA GLN 68 HA GLN 68 0.261 2.960 -4.804
263 HB2 GLN 68 1HB GLN 68 1.589 4.130 -7.244
264 HB3 GLN 68 2HB GLN 68 0.319 4.952 -6.342
265 HG2 GLN 68 1HG GLN 68 1.789 4.744 -4.306
266 HG3 GLN 68 2HG GLN 68 3.069 4.198 -5.388
267 HE21 GLN 68 2HE2 GLN 68 1.118 6.871 -4.367
268 HE22 GLN 68 1HE2 GLN 68 2.033 8.114 -5.152
269 H ALA 69 H ALA 69 -1.851 3.472 -5.397
270 HA ALA 69 HA ALA 69 -3.001 1.384 -6.965
271 HB1 ALA 69 3HB ALA 69 -5.127 2.203 -6.189
272 HB2 ALA 69 1HB ALA 69 -4.366 3.678 -5.590
273 HB3 ALA 69 2HB ALA 69 -3.973 2.123 -4.858
274 H GLY 70 H GLY 70 -4.942 1.894 -8.369
275 HA2 GLY 70 1HA GLY 70 -5.725 3.076 -10.290
276 HA3 GLY 70 2HA GLY 70 -4.181 3.930 -10.350
277 H GLY 71 H GLY 71 -2.268 2.236 -10.346
278 HA2 GLY 71 1HA GLY 71 -1.164 0.460 -11.280
279 HA3 GLY 71 2HA GLY 71 -2.718 -0.269 -11.642
280 H ARG 72 H ARG 72 -3.502 -0.178 -13.620
281 HA ARG 72 HA ARG 72 -1.872 1.032 -15.704
282 HE ARG 72 HE ARG 72 -1.545 0.098 -19.925
283 HB2 ARG 72 1HB ARG 72 -2.789 -1.366 -15.777
284 HB3 ARG 72 2HB ARG 72 -4.360 -0.639 -16.064
285 HG2 ARG 72 1HG ARG 72 -3.526 -1.231 -18.172
286 HG3 ARG 72 2HG ARG 72 -3.321 0.520 -18.051
287 HD2 ARG 72 1HD ARG 72 -0.980 0.233 -17.483
288 HD3 ARG 72 2HD ARG 72 -1.172 -1.517 -17.483
289 HH11 ARG 72 1HH1 ARG 72 -0.165 -2.682 -18.258
290 HH12 ARG 72 2HH1 ARG 72 0.609 -3.307 -19.681
291 HH21 ARG 72 1HH2 ARG 72 -0.520 -0.733 -21.792
292 HH22 ARG 72 2HH2 ARG 72 0.397 -2.207 -21.693
293 H ARG 73 H ARG 73 -2.390 2.997 -16.471
294 HA ARG 73 HA ARG 73 -4.969 4.168 -15.906
295 HE ARG 73 HE ARG 73 -5.794 8.618 -17.637
296 HB2 ARG 73 1HB ARG 73 -2.766 5.461 -15.952
297 HB3 ARG 73 2HB ARG 73 -2.817 5.310 -17.700
298 HG2 ARG 73 1HG ARG 73 -5.201 6.461 -16.355
299 HG3 ARG 73 2HG ARG 73 -3.743 7.447 -16.425
300 HD2 ARG 73 1HD ARG 73 -3.732 7.442 -18.786
301 HD3 ARG 73 2HD ARG 73 -4.906 6.130 -18.868
302 HH11 ARG 73 1HH1 ARG 73 -5.756 6.605 -20.518
303 HH12 ARG 73 2HH1 ARG 73 -7.142 7.378 -21.219
304 HH21 ARG 73 1HH2 ARG 73 -7.638 9.591 -18.547
305 HH22 ARG 73 2HH2 ARG 73 -8.234 9.052 -20.087
306 H ILE 74 H ILE 74 -6.533 3.176 -16.940
307 HA ILE 74 HA ILE 74 -6.286 2.473 -19.762
308 HB ILE 74 HB ILE 74 -8.519 1.874 -17.781
309 HG12 ILE 74 1HG1 ILE 74 -6.335 0.020 -18.767
310 HG13 ILE 74 2HG1 ILE 74 -6.272 0.870 -17.229
311 HG21 ILE 74 1HG2 ILE 74 -9.233 0.159 -19.388
312 HG22 ILE 74 2HG2 ILE 74 -7.977 0.689 -20.507
313 HG23 ILE 74 3HG2 ILE 74 -9.303 1.775 -20.092
314 HD11 ILE 74 3HD1 ILE 74 -6.976 -1.439 -16.946
315 HD12 ILE 74 1HD1 ILE 74 -8.339 -1.170 -18.031
316 HD13 ILE 74 2HD1 ILE 74 -8.263 -0.327 -16.483
317 H SER 75 H SER 75 -7.594 3.395 -21.371
318 HA SER 75 HA SER 75 -8.756 5.953 -20.975
319 HG SER 75 HG SER 75 -7.405 6.151 -23.297
320 HB2 SER 75 1HB SER 75 -9.214 3.981 -23.230
321 HB3 SER 75 2HB SER 75 -9.559 5.709 -23.277
322 H LEU 76 H LEU 76 -10.341 6.047 -19.501
323 HA LEU 76 HA LEU 76 -12.859 4.709 -19.939
324 HG LEU 76 HG LEU 76 -13.562 4.223 -16.875
325 HB2 LEU 76 1HB LEU 76 -11.578 2.981 -18.780
326 HB3 LEU 76 2HB LEU 76 -11.156 4.109 -17.511
327 HD11 LEU 76 1HD1 LEU 76 -14.554 3.590 -19.015
328 HD12 LEU 76 2HD1 LEU 76 -15.096 2.520 -17.723
329 HD13 LEU 76 3HD1 LEU 76 -13.866 1.973 -18.863
330 HD21 LEU 76 3HD2 LEU 76 -12.322 1.477 -16.887
331 HD22 LEU 76 1HD2 LEU 76 -13.607 2.025 -15.811
332 HD23 LEU 76 2HD2 LEU 76 -12.005 2.755 -15.714
333 H ASP 77 H ASP 77 -14.236 6.304 -19.665
334 HA ASP 77 HA ASP 77 -13.745 8.365 -17.664
335 HB2 ASP 77 1HB ASP 77 -14.599 8.984 -19.947
336 HB3 ASP 77 2HB ASP 77 -16.077 8.103 -19.585
337 H GLN 78 H GLN 78 -14.018 7.382 -15.740
338 HA GLN 78 HA GLN 78 -16.743 6.706 -14.997
339 HB2 GLN 78 1HB GLN 78 -15.567 4.563 -15.675
340 HB3 GLN 78 2HB GLN 78 -14.464 4.831 -14.333
341 HG2 GLN 78 1HG GLN 78 -16.440 4.827 -12.809
342 HG3 GLN 78 2HG GLN 78 -17.427 4.340 -14.184
343 HE21 GLN 78 2HE2 GLN 78 -17.998 2.396 -13.254
344 HE22 GLN 78 1HE2 GLN 78 -16.887 1.082 -13.076
345 H GLN 79 H GLN 79 -17.102 8.061 -13.405
346 HA GLN 79 HA GLN 79 -14.968 8.846 -11.602
347 HB2 GLN 79 1HB GLN 79 -16.813 10.382 -10.665
348 HB3 GLN 79 2HB GLN 79 -16.178 10.723 -12.265
349 HG2 GLN 79 1HG GLN 79 -18.126 9.635 -13.271
350 HG3 GLN 79 2HG GLN 79 -18.769 9.298 -11.669
351 HE21 GLN 79 2HE2 GLN 79 -17.913 11.914 -10.620
352 HE22 GLN 79 1HE2 GLN 79 -19.024 13.063 -11.278
Start of MODEL 13
1 H ASN 33 H ASN 33 -6.597 13.598 1.806
2 HA ASN 33 HA ASN 33 -4.838 15.574 0.628
3 HB2 ASN 33 1HB ASN 33 -4.446 13.528 2.829
4 HB3 ASN 33 2HB ASN 33 -3.174 14.612 2.284
5 HD21 ASN 33 2HD2 ASN 33 -6.099 14.303 4.094
6 HD22 ASN 33 1HD2 ASN 33 -6.102 15.891 4.774
7 H MET 34 H MET 34 -2.380 14.433 0.407
8 HA MET 34 HA MET 34 -2.589 12.939 -1.996
9 HB2 MET 34 1HB MET 34 -0.676 14.483 -1.350
10 HB3 MET 34 2HB MET 34 -0.099 13.201 -0.293
11 HG2 MET 34 1HG MET 34 -0.548 12.692 -3.216
12 HG3 MET 34 2HG MET 34 0.925 13.467 -2.650
13 HE1 MET 34 3HE MET 34 2.013 9.784 -3.546
14 HE2 MET 34 1HE MET 34 2.128 11.488 -3.992
15 HE3 MET 34 2HE MET 34 0.644 10.587 -4.315
16 H THR 35 H THR 35 -3.397 11.004 -2.004
17 HA THR 35 HA THR 35 -2.290 8.948 -0.249
18 HB THR 35 HB THR 35 -4.698 7.998 -0.099
19 HG1 THR 35 HG1 THR 35 -5.213 10.730 -0.718
20 HG21 THR 35 3HG2 THR 35 -3.487 8.792 1.859
21 HG22 THR 35 1HG2 THR 35 -5.186 9.262 1.943
22 HG23 THR 35 2HG2 THR 35 -3.962 10.451 1.496
23 H VAL 36 H VAL 36 -1.781 7.181 -1.308
24 HA VAL 36 HA VAL 36 -3.057 6.649 -3.902
25 HB VAL 36 HB VAL 36 -0.925 5.464 -4.547
26 HG11 VAL 36 1HG1 VAL 36 0.279 7.515 -5.144
27 HG12 VAL 36 2HG1 VAL 36 -0.719 8.428 -4.014
28 HG13 VAL 36 3HG1 VAL 36 -1.455 7.667 -5.426
29 HG21 VAL 36 3HG2 VAL 36 0.082 5.164 -2.335
30 HG22 VAL 36 1HG2 VAL 36 0.226 6.911 -2.148
31 HG23 VAL 36 2HG2 VAL 36 1.160 6.076 -3.390
32 H ASP 37 H ASP 37 -3.713 4.558 -4.309
33 HA ASP 37 HA ASP 37 -3.909 2.789 -2.044
34 HB2 ASP 37 1HB ASP 37 -5.126 1.278 -3.569
35 HB3 ASP 37 2HB ASP 37 -5.818 2.891 -3.516
36 H ILE 38 H ILE 38 -2.689 1.133 -1.582
37 HA ILE 38 HA ILE 38 -0.512 0.511 -3.435
38 HB ILE 38 HB ILE 38 0.901 0.205 -1.288
39 HG12 ILE 38 1HG1 ILE 38 0.071 2.249 0.273
40 HG13 ILE 38 2HG1 ILE 38 -1.492 1.646 -0.260
41 HG21 ILE 38 1HG2 ILE 38 0.096 2.897 -2.352
42 HG22 ILE 38 2HG2 ILE 38 1.368 1.841 -2.967
43 HG23 ILE 38 3HG2 ILE 38 1.533 2.585 -1.378
44 HD11 ILE 38 3HD1 ILE 38 -0.949 -0.553 0.645
45 HD12 ILE 38 1HD1 ILE 38 -0.876 0.709 1.880
46 HD13 ILE 38 2HD1 ILE 38 0.614 0.059 1.187
47 H LEU 39 H LEU 39 0.106 -1.546 -3.639
48 HA LEU 39 HA LEU 39 -1.883 -3.453 -2.614
49 HG LEU 39 HG LEU 39 -3.339 -3.739 -4.557
50 HB2 LEU 39 1HB LEU 39 -1.138 -2.702 -5.206
51 HB3 LEU 39 2HB LEU 39 -0.396 -4.269 -4.970
52 HD11 LEU 39 1HD1 LEU 39 -3.636 -4.801 -6.747
53 HD12 LEU 39 2HD1 LEU 39 -1.885 -4.842 -6.959
54 HD13 LEU 39 3HD1 LEU 39 -2.728 -3.294 -6.866
55 HD21 LEU 39 3HD2 LEU 39 -2.494 -5.702 -3.380
56 HD22 LEU 39 1HD2 LEU 39 -1.756 -6.292 -4.870
57 HD23 LEU 39 2HD2 LEU 39 -3.511 -6.180 -4.738
58 H CYS 40 H CYS 40 -1.134 -4.844 -1.212
59 HA CYS 40 HA CYS 40 1.551 -5.297 -0.538
60 HB2 CYS 40 1HB CYS 40 -1.023 -6.523 0.116
61 HB3 CYS 40 2HB CYS 40 0.348 -7.611 0.235
62 H ASN 41 H ASN 41 3.047 -6.704 -1.142
63 HA ASN 41 HA ASN 41 2.501 -8.584 -3.283
64 HB2 ASN 41 1HB ASN 41 5.036 -8.174 -1.674
65 HB3 ASN 41 2HB ASN 41 4.888 -9.101 -3.159
66 HD21 ASN 41 2HD2 ASN 41 4.610 -8.018 -5.115
67 HD22 ASN 41 1HD2 ASN 41 4.992 -6.338 -5.282
68 H ASP 42 H ASP 42 2.310 -8.566 0.100
69 HA ASP 42 HA ASP 42 2.785 -11.415 0.373
70 HB2 ASP 42 1HB ASP 42 2.457 -10.925 2.850
71 HB3 ASP 42 2HB ASP 42 3.868 -10.214 2.081
72 H CYS 43 H CYS 43 0.115 -9.125 1.222
73 HA CYS 43 HA CYS 43 -1.622 -11.463 1.494
74 HB2 CYS 43 1HB CYS 43 -3.020 -10.261 2.937
75 HB3 CYS 43 2HB CYS 43 -1.412 -9.685 3.348
76 H ASN 44 H ASN 44 -0.840 -9.391 -0.879
77 HA ASN 44 HA ASN 44 -1.741 -8.519 -2.764
78 HB2 ASN 44 1HB ASN 44 -3.433 -10.987 -2.402
79 HB3 ASN 44 2HB ASN 44 -3.585 -9.947 -3.818
80 HD21 ASN 44 2HD2 ASN 44 -1.574 -12.211 -2.110
81 HD22 ASN 44 1HD2 ASN 44 -0.432 -12.475 -3.386
82 H GLY 45 H GLY 45 -2.542 -7.019 -0.716
83 HA2 GLY 45 1HA GLY 45 -5.314 -6.337 -1.402
84 HA3 GLY 45 2HA GLY 45 -4.814 -6.424 0.282
85 H ARG 46 H ARG 46 -5.737 -4.267 -1.716
86 HA ARG 46 HA ARG 46 -3.508 -2.407 -1.441
87 HE ARG 46 HE ARG 46 -8.870 -1.317 -3.769
88 HB2 ARG 46 1HB ARG 46 -4.640 -0.966 -3.012
89 HB3 ARG 46 2HB ARG 46 -4.569 -2.596 -3.664
90 HG2 ARG 46 1HG ARG 46 -6.883 -2.962 -3.121
91 HG3 ARG 46 2HG ARG 46 -6.969 -1.397 -2.311
92 HD2 ARG 46 1HD ARG 46 -6.379 -0.331 -4.496
93 HD3 ARG 46 2HD ARG 46 -6.548 -1.920 -5.244
94 HH11 ARG 46 1HH1 ARG 46 -7.254 -0.382 -6.738
95 HH12 ARG 46 2HH1 ARG 46 -8.725 0.097 -7.520
96 HH21 ARG 46 1HH2 ARG 46 -10.767 -0.680 -4.779
97 HH22 ARG 46 2HH2 ARG 46 -10.727 -0.069 -6.407
98 H SER 47 H SER 47 -3.619 -0.476 -0.392
99 HA SER 47 HA SER 47 -6.049 0.169 1.133
100 HG SER 47 HG SER 47 -5.438 -1.524 2.704
101 HB2 SER 47 1HB SER 47 -3.229 0.201 2.247
102 HB3 SER 47 2HB SER 47 -4.690 0.685 3.110
103 H THR 48 H THR 48 -6.527 2.372 1.096
104 HA THR 48 HA THR 48 -4.677 4.015 -0.437
105 HB THR 48 HB THR 48 -7.313 4.982 0.660
106 HG1 THR 48 HG1 THR 48 -7.540 4.131 -1.892
107 HG21 THR 48 3HG2 THR 48 -5.925 6.669 -0.357
108 HG22 THR 48 1HG2 THR 48 -7.277 6.313 -1.437
109 HG23 THR 48 2HG2 THR 48 -5.674 5.660 -1.782
110 H VAL 49 H VAL 49 -3.077 4.811 0.659
111 HA VAL 49 HA VAL 49 -3.505 6.382 3.091
112 HB VAL 49 HB VAL 49 -1.355 5.492 4.051
113 HG11 VAL 49 1HG1 VAL 49 -2.277 3.428 4.984
114 HG12 VAL 49 2HG1 VAL 49 -3.564 3.466 3.779
115 HG13 VAL 49 3HG1 VAL 49 -3.452 4.746 4.992
116 HG21 VAL 49 3HG2 VAL 49 -0.396 4.517 2.048
117 HG22 VAL 49 1HG2 VAL 49 -1.693 3.322 1.983
118 HG23 VAL 49 2HG2 VAL 49 -0.539 3.300 3.317
119 H GLN 50 H GLN 50 -1.288 7.596 3.538
120 HA GLN 50 HA GLN 50 -0.629 8.976 1.117
121 HB2 GLN 50 1HB GLN 50 0.882 10.316 2.489
122 HB3 GLN 50 2HB GLN 50 -0.678 10.147 3.278
123 HG2 GLN 50 1HG GLN 50 0.268 8.399 4.728
124 HG3 GLN 50 2HG GLN 50 1.835 8.631 3.960
125 HE21 GLN 50 2HE2 GLN 50 1.508 11.542 3.789
126 HE22 GLN 50 1HE2 GLN 50 1.733 12.131 5.399
127 H PHE 51 H PHE 51 1.503 9.183 0.191
128 HA PHE 51 HA PHE 51 2.803 6.648 -0.078
129 HD1 PHE 51 HD2 PHE 51 3.723 5.784 -2.342
130 HD2 PHE 51 HD1 PHE 51 5.752 9.480 -1.752
131 HE1 PHE 51 HE2 PHE 51 5.747 4.834 -3.367
132 HE2 PHE 51 HE1 PHE 51 7.779 8.532 -2.774
133 HZ PHE 51 HZ PHE 51 7.777 6.209 -3.585
134 HB2 PHE 51 1HB PHE 51 2.528 8.079 -2.017
135 HB3 PHE 51 2HB PHE 51 3.487 9.349 -1.265
136 H HIS 52 H HIS 52 3.673 6.113 1.830
137 HA HIS 52 HA HIS 52 5.754 7.767 2.989
138 HD1 HIS 52 HD1 HIS 52 6.346 3.965 5.304
139 HD2 HIS 52 HD2 HIS 52 6.385 8.096 5.763
140 HE1 HIS 52 HE1 HIS 52 8.082 4.434 7.060
141 HE2 HIS 52 HE2 HIS 52 7.917 6.909 7.483
142 HB2 HIS 52 1HB HIS 52 4.119 6.610 4.471
143 HB3 HIS 52 2HB HIS 52 4.683 5.061 3.859
144 H ILE 53 H ILE 53 7.751 7.603 2.250
145 HA ILE 53 HA ILE 53 8.299 5.958 0.021
146 HB ILE 53 HB ILE 53 10.376 7.462 1.612
147 HG12 ILE 53 1HG1 ILE 53 8.662 8.645 -0.580
148 HG13 ILE 53 2HG1 ILE 53 8.239 8.792 1.118
149 HG21 ILE 53 1HG2 ILE 53 10.111 6.869 -1.335
150 HG22 ILE 53 2HG2 ILE 53 11.207 6.064 -0.213
151 HG23 ILE 53 3HG2 ILE 53 11.421 7.776 -0.579
152 HD11 ILE 53 3HD1 ILE 53 10.320 9.988 1.539
153 HD12 ILE 53 1HD1 ILE 53 9.349 10.788 0.303
154 HD13 ILE 53 2HD1 ILE 53 10.755 9.831 -0.164
155 H LEU 54 H LEU 54 8.952 5.509 3.427
156 HA LEU 54 HA LEU 54 10.867 3.369 3.005
157 HG LEU 54 HG LEU 54 12.300 4.891 4.346
158 HB2 LEU 54 1HB LEU 54 9.584 4.440 5.515
159 HB3 LEU 54 2HB LEU 54 10.742 3.132 5.498
160 HD11 LEU 54 1HD1 LEU 54 10.635 6.647 4.066
161 HD12 LEU 54 2HD1 LEU 54 11.936 7.169 5.136
162 HD13 LEU 54 3HD1 LEU 54 10.378 6.691 5.811
163 HD21 LEU 54 3HD2 LEU 54 12.691 3.837 6.499
164 HD22 LEU 54 1HD2 LEU 54 11.615 4.999 7.274
165 HD23 LEU 54 2HD2 LEU 54 13.122 5.547 6.539
166 H GLY 55 H GLY 55 7.827 3.262 2.258
167 HA2 GLY 55 1HA GLY 55 6.872 1.029 1.878
168 HA3 GLY 55 2HA GLY 55 7.306 0.648 3.540
169 H MET 56 H MET 56 4.814 1.397 1.596
170 HA MET 56 HA MET 56 3.383 3.252 3.262
171 HB2 MET 56 1HB MET 56 2.647 1.693 0.798
172 HB3 MET 56 2HB MET 56 1.463 2.639 1.679
173 HG2 MET 56 1HG MET 56 2.169 3.945 -0.131
174 HG3 MET 56 2HG MET 56 2.916 4.637 1.298
175 HE1 MET 56 3HE MET 56 5.189 2.240 -1.949
176 HE2 MET 56 1HE MET 56 3.470 2.629 -2.024
177 HE3 MET 56 2HE MET 56 4.057 1.445 -0.849
178 H LYS 57 H LYS 57 1.467 2.847 4.416
179 HA LYS 57 HA LYS 57 1.481 0.270 5.723
180 HB2 LYS 57 1HB LYS 57 1.212 2.301 7.076
181 HB3 LYS 57 2HB LYS 57 -0.280 2.680 6.224
182 HG2 LYS 57 1HG LYS 57 -1.109 0.390 7.043
183 HG3 LYS 57 2HG LYS 57 0.256 0.442 8.155
184 HD2 LYS 57 1HD LYS 57 -1.768 2.661 7.986
185 HD3 LYS 57 2HD LYS 57 -1.983 1.259 9.033
186 HE2 LYS 57 1HE LYS 57 0.348 3.176 9.131
187 HE3 LYS 57 2HE LYS 57 -1.022 3.172 10.240
188 HZ1 LYS 57 3HZ LYS 57 1.087 1.109 9.943
189 HZ2 LYS 57 1HZ LYS 57 -0.355 0.816 10.783
190 HZ3 LYS 57 2HZ LYS 57 0.712 2.022 11.315
191 H CYS 58 H CYS 58 0.531 -1.348 4.643
192 HA CYS 58 HA CYS 58 -2.130 -1.056 3.567
193 HB2 CYS 58 1HB CYS 58 -0.907 -2.746 2.523
194 HB3 CYS 58 2HB CYS 58 -0.252 -3.342 4.027
195 H LYS 59 H LYS 59 -3.893 -0.988 4.783
196 HA LYS 59 HA LYS 59 -3.597 -1.273 7.641
197 HB2 LYS 59 1HB LYS 59 -6.029 -0.455 6.041
198 HB3 LYS 59 2HB LYS 59 -5.794 -0.241 7.771
199 HG2 LYS 59 1HG LYS 59 -3.939 1.289 7.336
200 HG3 LYS 59 2HG LYS 59 -4.162 1.066 5.602
201 HD2 LYS 59 1HD LYS 59 -5.207 3.120 6.196
202 HD3 LYS 59 2HD LYS 59 -6.489 1.950 5.873
203 HE2 LYS 59 1HE LYS 59 -6.786 1.591 8.262
204 HE3 LYS 59 2HE LYS 59 -5.458 2.697 8.611
205 HZ1 LYS 59 3HZ LYS 59 -6.761 4.469 7.529
206 HZ2 LYS 59 1HZ LYS 59 -7.539 3.829 8.894
207 HZ3 LYS 59 2HZ LYS 59 -8.050 3.386 7.342
208 H ILE 60 H ILE 60 -4.383 -3.383 5.210
209 HA ILE 60 HA ILE 60 -6.491 -4.845 6.507
210 HB ILE 60 HB ILE 60 -4.798 -5.707 4.139
211 HG12 ILE 60 1HG1 ILE 60 -7.483 -4.306 4.092
212 HG13 ILE 60 2HG1 ILE 60 -5.951 -3.484 3.837
213 HG21 ILE 60 1HG2 ILE 60 -6.058 -7.544 5.144
214 HG22 ILE 60 2HG2 ILE 60 -6.730 -7.119 3.569
215 HG23 ILE 60 3HG2 ILE 60 -7.541 -6.593 5.043
216 HD11 ILE 60 3HD1 ILE 60 -7.083 -5.674 2.109
217 HD12 ILE 60 1HD1 ILE 60 -5.560 -4.829 1.840
218 HD13 ILE 60 2HD1 ILE 60 -7.087 -3.951 1.735
219 H CYS 61 H CYS 61 -2.979 -5.038 6.338
220 HA CYS 61 HA CYS 61 -3.084 -7.281 8.226
221 HB2 CYS 61 1HB CYS 61 -1.440 -8.561 7.079
222 HB3 CYS 61 2HB CYS 61 -2.684 -8.131 5.908
223 H GLU 62 H GLU 62 -1.794 -4.292 7.409
224 HA GLU 62 HA GLU 62 -0.394 -2.841 8.390
225 HB2 GLU 62 1HB GLU 62 -0.304 -4.882 10.608
226 HB3 GLU 62 2HB GLU 62 0.514 -3.328 10.693
227 HG2 GLU 62 1HG GLU 62 -2.454 -3.736 10.343
228 HG3 GLU 62 2HG GLU 62 -1.641 -3.302 11.852
229 H SER 63 H SER 63 0.571 -4.847 6.542
230 HA SER 63 HA SER 63 3.412 -4.901 7.221
231 HG SER 63 HG SER 63 3.964 -7.259 4.610
232 HB2 SER 63 1HB SER 63 2.440 -6.982 6.286
233 HB3 SER 63 2HB SER 63 1.974 -6.102 4.833
234 H TYR 64 H TYR 64 4.927 -3.876 5.992
235 HA TYR 64 HA TYR 64 3.926 -1.647 4.367
236 HD1 TYR 64 HD1 TYR 64 4.140 0.830 5.817
237 HD2 TYR 64 HD2 TYR 64 5.825 -2.399 8.018
238 HE1 TYR 64 HE1 TYR 64 3.042 1.649 7.859
239 HE2 TYR 64 HE2 TYR 64 4.733 -1.583 10.060
240 HH TYR 64 HH TYR 64 3.865 0.579 10.942
241 HB2 TYR 64 1HB TYR 64 6.588 -1.938 5.785
242 HB3 TYR 64 2HB TYR 64 6.028 -0.514 4.914
243 H ASN 65 H ASN 65 4.978 -4.633 3.897
244 HA ASN 65 HA ASN 65 6.754 -4.243 1.650
245 HB2 ASN 65 1HB ASN 65 6.988 -6.246 3.012
246 HB3 ASN 65 2HB ASN 65 5.310 -6.679 2.739
247 HD21 ASN 65 2HD2 ASN 65 4.819 -7.936 1.056
248 HD22 ASN 65 1HD2 ASN 65 5.953 -8.477 -0.139
249 H THR 66 H THR 66 5.585 -2.838 0.386
250 HA THR 66 HA THR 66 3.231 -3.912 -0.984
251 HB THR 66 HB THR 66 2.153 -1.648 -0.848
252 HG1 THR 66 HG1 THR 66 3.771 -1.142 1.419
253 HG21 THR 66 3HG2 THR 66 2.528 -3.087 1.772
254 HG22 THR 66 1HG2 THR 66 1.309 -3.435 0.547
255 HG23 THR 66 2HG2 THR 66 1.261 -1.907 1.429
256 H ALA 67 H ALA 67 2.883 -3.128 -3.003
257 HA ALA 67 HA ALA 67 4.977 -1.435 -4.183
258 HB1 ALA 67 3HB ALA 67 4.734 -3.629 -5.236
259 HB2 ALA 67 1HB ALA 67 4.222 -2.351 -6.338
260 HB3 ALA 67 2HB ALA 67 3.016 -3.323 -5.494
261 H GLN 68 H GLN 68 4.231 0.336 -5.560
262 HA GLN 68 HA GLN 68 1.730 1.444 -4.629
263 HB2 GLN 68 1HB GLN 68 3.738 2.867 -4.933
264 HB3 GLN 68 2HB GLN 68 3.670 2.557 -6.661
265 HG2 GLN 68 1HG GLN 68 1.418 3.600 -6.704
266 HG3 GLN 68 2HG GLN 68 1.620 4.013 -5.003
267 HE21 GLN 68 2HE2 GLN 68 1.476 6.189 -5.398
268 HE22 GLN 68 1HE2 GLN 68 2.724 7.091 -6.181
269 H ALA 69 H ALA 69 -0.180 1.145 -5.583
270 HA ALA 69 HA ALA 69 -0.223 -0.328 -8.080
271 HB1 ALA 69 3HB ALA 69 -1.599 -1.101 -6.215
272 HB2 ALA 69 1HB ALA 69 -2.584 -0.695 -7.620
273 HB3 ALA 69 2HB ALA 69 -2.503 0.412 -6.249
274 H GLY 70 H GLY 70 -2.283 2.369 -6.917
275 HA2 GLY 70 1HA GLY 70 -2.764 4.392 -8.000
276 HA3 GLY 70 2HA GLY 70 -1.737 3.885 -9.335
277 H GLY 71 H GLY 71 -4.911 3.714 -7.918
278 HA2 GLY 71 1HA GLY 71 -6.096 1.848 -9.641
279 HA3 GLY 71 2HA GLY 71 -6.954 3.036 -8.681
280 H ARG 72 H ARG 72 -6.163 5.411 -9.824
281 HA ARG 72 HA ARG 72 -7.160 5.127 -12.587
282 HE ARG 72 HE ARG 72 -9.215 7.586 -9.061
283 HB2 ARG 72 1HB ARG 72 -7.700 7.358 -10.626
284 HB3 ARG 72 2HB ARG 72 -8.160 7.386 -12.322
285 HG2 ARG 72 1HG ARG 72 -9.628 5.500 -11.995
286 HG3 ARG 72 2HG ARG 72 -9.121 5.361 -10.311
287 HD2 ARG 72 1HD ARG 72 -10.631 7.635 -11.588
288 HD3 ARG 72 2HD ARG 72 -11.240 6.481 -10.400
289 HH11 ARG 72 1HH1 ARG 72 -11.882 9.030 -10.815
290 HH12 ARG 72 2HH1 ARG 72 -11.783 10.543 -9.963
291 HH21 ARG 72 1HH2 ARG 72 -9.067 9.581 -7.974
292 HH22 ARG 72 2HH2 ARG 72 -10.178 10.860 -8.375
293 H ARG 73 H ARG 73 -5.886 5.820 -14.121
294 HA ARG 73 HA ARG 73 -3.768 7.739 -13.446
295 HE ARG 73 HE ARG 73 -0.420 8.627 -16.446
296 HB2 ARG 73 1HB ARG 73 -2.922 5.609 -14.296
297 HB3 ARG 73 2HB ARG 73 -3.937 5.750 -15.724
298 HG2 ARG 73 1HG ARG 73 -1.633 6.311 -16.236
299 HG3 ARG 73 2HG ARG 73 -2.674 7.722 -16.428
300 HD2 ARG 73 1HD ARG 73 -1.991 8.425 -14.123
301 HD3 ARG 73 2HD ARG 73 -0.812 7.111 -14.140
302 HH11 ARG 73 1HH1 ARG 73 -0.082 9.043 -12.967
303 HH12 ARG 73 2HH1 ARG 73 1.165 10.237 -13.115
304 HH21 ARG 73 1HH2 ARG 73 1.207 10.170 -16.623
305 HH22 ARG 73 2HH2 ARG 73 1.907 10.866 -15.194
306 H ILE 74 H ILE 74 -4.154 9.735 -14.027
307 HA ILE 74 HA ILE 74 -5.859 10.250 -16.356
308 HB ILE 74 HB ILE 74 -6.103 12.592 -15.291
309 HG12 ILE 74 1HG1 ILE 74 -5.430 11.044 -12.768
310 HG13 ILE 74 2HG1 ILE 74 -4.330 12.184 -13.526
311 HG21 ILE 74 1HG2 ILE 74 -8.019 11.836 -13.971
312 HG22 ILE 74 2HG2 ILE 74 -7.415 10.181 -14.045
313 HG23 ILE 74 3HG2 ILE 74 -7.920 11.004 -15.523
314 HD11 ILE 74 3HD1 ILE 74 -5.489 13.186 -11.637
315 HD12 ILE 74 1HD1 ILE 74 -7.042 12.840 -12.398
316 HD13 ILE 74 2HD1 ILE 74 -5.931 13.986 -13.146
317 H SER 75 H SER 75 -4.392 10.275 -17.961
318 HA SER 75 HA SER 75 -2.132 12.131 -17.803
319 HG SER 75 HG SER 75 -1.031 9.025 -19.089
320 HB2 SER 75 1HB SER 75 -2.883 10.184 -20.006
321 HB3 SER 75 2HB SER 75 -1.374 11.088 -19.879
322 H LEU 76 H LEU 76 -2.262 14.122 -18.648
323 HA LEU 76 HA LEU 76 -4.612 14.712 -20.334
324 HG LEU 76 HG LEU 76 -6.168 16.427 -19.709
325 HB2 LEU 76 1HB LEU 76 -4.639 15.419 -17.836
326 HB3 LEU 76 2HB LEU 76 -3.503 16.655 -18.332
327 HD11 LEU 76 1HD1 LEU 76 -5.602 17.862 -17.116
328 HD12 LEU 76 2HD1 LEU 76 -6.653 16.461 -17.326
329 HD13 LEU 76 3HD1 LEU 76 -7.078 18.001 -18.071
330 HD21 LEU 76 3HD2 LEU 76 -4.479 17.944 -20.660
331 HD22 LEU 76 1HD2 LEU 76 -4.365 18.778 -19.109
332 HD23 LEU 76 2HD2 LEU 76 -5.870 18.822 -20.026
333 H ASP 77 H ASP 77 -3.832 15.087 -22.287
334 HA ASP 77 HA ASP 77 -1.823 17.210 -22.570
335 HB2 ASP 77 1HB ASP 77 -1.330 16.268 -24.833
336 HB3 ASP 77 2HB ASP 77 -0.879 15.205 -23.509
337 H GLN 78 H GLN 78 -2.543 19.061 -23.437
338 HA GLN 78 HA GLN 78 -5.378 19.049 -24.214
339 HB2 GLN 78 1HB GLN 78 -4.343 20.282 -22.115
340 HB3 GLN 78 2HB GLN 78 -3.958 21.522 -23.293
341 HG2 GLN 78 1HG GLN 78 -6.751 20.474 -22.969
342 HG3 GLN 78 2HG GLN 78 -6.114 21.746 -21.934
343 HE21 GLN 78 2HE2 GLN 78 -7.269 20.928 -25.098
344 HE22 GLN 78 1HE2 GLN 78 -7.324 22.542 -25.719
345 H GLN 79 H GLN 79 -5.266 18.823 -26.420
346 HA GLN 79 HA GLN 79 -4.093 21.109 -27.856
347 HB2 GLN 79 1HB GLN 79 -4.635 18.328 -28.921
348 HB3 GLN 79 2HB GLN 79 -4.136 19.684 -29.913
349 HG2 GLN 79 1HG GLN 79 -2.147 18.596 -29.614
350 HG3 GLN 79 2HG GLN 79 -2.090 19.765 -28.300
351 HE21 GLN 79 2HE2 GLN 79 -4.072 16.867 -28.276
352 HE22 GLN 79 1HE2 GLN 79 -3.191 16.055 -27.017
Start of MODEL 14
1 H ASN 33 H ASN 33 -0.300 13.822 8.469
2 HA ASN 33 HA ASN 33 0.817 14.779 6.030
3 HB2 ASN 33 1HB ASN 33 0.729 11.957 7.134
4 HB3 ASN 33 2HB ASN 33 1.713 12.482 5.774
5 HD21 ASN 33 2HD2 ASN 33 2.415 11.321 8.397
6 HD22 ASN 33 1HD2 ASN 33 3.549 12.425 9.095
7 H MET 34 H MET 34 0.612 13.738 3.936
8 HA MET 34 HA MET 34 -2.062 13.736 3.033
9 HB2 MET 34 1HB MET 34 -0.157 14.455 1.671
10 HB3 MET 34 2HB MET 34 0.471 12.816 1.664
11 HG2 MET 34 1HG MET 34 -1.510 12.077 0.416
12 HG3 MET 34 2HG MET 34 -2.109 13.737 0.408
13 HE1 MET 34 3HE MET 34 1.709 12.331 -1.790
14 HE2 MET 34 1HE MET 34 0.631 11.257 -0.896
15 HE3 MET 34 2HE MET 34 1.609 12.447 -0.035
16 H THR 35 H THR 35 -3.531 12.154 3.047
17 HA THR 35 HA THR 35 -2.660 9.488 3.774
18 HB THR 35 HB THR 35 -5.219 9.108 3.845
19 HG1 THR 35 HG1 THR 35 -6.097 10.854 2.893
20 HG21 THR 35 3HG2 THR 35 -5.366 10.126 6.072
21 HG22 THR 35 1HG2 THR 35 -3.904 11.055 5.739
22 HG23 THR 35 2HG2 THR 35 -3.827 9.296 5.839
23 H VAL 36 H VAL 36 -2.421 7.904 2.420
24 HA VAL 36 HA VAL 36 -3.726 7.991 -0.209
25 HB VAL 36 HB VAL 36 -1.629 6.996 -1.201
26 HG11 VAL 36 1HG1 VAL 36 -1.392 9.785 -0.087
27 HG12 VAL 36 2HG1 VAL 36 -2.185 9.317 -1.592
28 HG13 VAL 36 3HG1 VAL 36 -0.441 9.129 -1.418
29 HG21 VAL 36 3HG2 VAL 36 -0.371 7.903 1.396
30 HG22 VAL 36 1HG2 VAL 36 0.520 7.416 -0.048
31 HG23 VAL 36 2HG2 VAL 36 -0.487 6.246 0.804
32 H ASP 37 H ASP 37 -4.455 6.064 -0.965
33 HA ASP 37 HA ASP 37 -4.284 3.809 0.864
34 HB2 ASP 37 1HB ASP 37 -6.137 2.829 -0.472
35 HB3 ASP 37 2HB ASP 37 -6.537 4.380 0.247
36 H ILE 38 H ILE 38 -2.995 2.204 0.547
37 HA ILE 38 HA ILE 38 -1.765 1.903 -2.109
38 HB ILE 38 HB ILE 38 0.105 0.731 -0.810
39 HG12 ILE 38 1HG1 ILE 38 -0.592 2.467 1.503
40 HG13 ILE 38 2HG1 ILE 38 -1.478 0.955 1.342
41 HG21 ILE 38 1HG2 ILE 38 0.398 2.839 -1.931
42 HG22 ILE 38 2HG2 ILE 38 1.229 2.863 -0.376
43 HG23 ILE 38 3HG2 ILE 38 -0.310 3.701 -0.563
44 HD11 ILE 38 3HD1 ILE 38 1.495 1.278 1.525
45 HD12 ILE 38 1HD1 ILE 38 0.647 -0.250 1.281
46 HD13 ILE 38 2HD1 ILE 38 0.415 0.660 2.779
47 H LEU 39 H LEU 39 -1.820 0.051 -3.104
48 HA LEU 39 HA LEU 39 -3.500 -2.010 -1.869
49 HG LEU 39 HG LEU 39 -5.250 -2.883 -3.197
50 HB2 LEU 39 1HB LEU 39 -4.204 -0.528 -3.908
51 HB3 LEU 39 2HB LEU 39 -3.126 -1.566 -4.818
52 HD11 LEU 39 1HD1 LEU 39 -5.738 -1.470 -5.821
53 HD12 LEU 39 2HD1 LEU 39 -6.428 -1.024 -4.260
54 HD13 LEU 39 3HD1 LEU 39 -6.863 -2.561 -5.009
55 HD21 LEU 39 3HD2 LEU 39 -4.073 -3.341 -5.930
56 HD22 LEU 39 1HD2 LEU 39 -5.249 -4.378 -5.125
57 HD23 LEU 39 2HD2 LEU 39 -3.630 -4.192 -4.448
58 H CYS 40 H CYS 40 -2.684 -3.966 -1.658
59 HA CYS 40 HA CYS 40 0.075 -4.422 -2.034
60 HB2 CYS 40 1HB CYS 40 -2.201 -6.030 -1.065
61 HB3 CYS 40 2HB CYS 40 -0.779 -6.901 -1.605
62 H ASN 41 H ASN 41 1.198 -5.694 -3.306
63 HA ASN 41 HA ASN 41 -0.001 -6.682 -5.749
64 HB2 ASN 41 1HB ASN 41 2.855 -6.938 -4.747
65 HB3 ASN 41 2HB ASN 41 2.292 -7.243 -6.385
66 HD21 ASN 41 2HD2 ASN 41 4.314 -5.359 -5.352
67 HD22 ASN 41 1HD2 ASN 41 3.828 -3.797 -5.922
68 H ASP 42 H ASP 42 0.511 -7.765 -2.581
69 HA ASP 42 HA ASP 42 0.679 -10.583 -3.313
70 HB2 ASP 42 1HB ASP 42 1.108 -10.891 -0.807
71 HB3 ASP 42 2HB ASP 42 2.364 -10.106 -1.755
72 H CYS 43 H CYS 43 -1.228 -8.602 -0.964
73 HA CYS 43 HA CYS 43 -3.212 -10.746 -0.940
74 HB2 CYS 43 1HB CYS 43 -4.024 -9.928 1.113
75 HB3 CYS 43 2HB CYS 43 -2.291 -9.670 1.208
76 H ASN 44 H ASN 44 -2.670 -8.059 -2.692
77 HA ASN 44 HA ASN 44 -3.796 -6.662 -4.024
78 HB2 ASN 44 1HB ASN 44 -5.577 -9.080 -4.035
79 HB3 ASN 44 2HB ASN 44 -5.853 -7.697 -5.091
80 HD21 ASN 44 2HD2 ASN 44 -5.443 -8.758 -6.938
81 HD22 ASN 44 1HD2 ASN 44 -3.882 -9.334 -7.403
82 H GLY 45 H GLY 45 -4.295 -6.211 -1.237
83 HA2 GLY 45 1HA GLY 45 -6.912 -4.876 -1.401
84 HA3 GLY 45 2HA GLY 45 -6.337 -5.634 0.078
85 H ARG 46 H ARG 46 -7.093 -2.858 -0.426
86 HA ARG 46 HA ARG 46 -4.498 -1.496 -0.315
87 HE ARG 46 HE ARG 46 -10.108 0.092 -1.723
88 HB2 ARG 46 1HB ARG 46 -5.629 0.495 -1.106
89 HB3 ARG 46 2HB ARG 46 -5.965 -0.848 -2.175
90 HG2 ARG 46 1HG ARG 46 -8.151 -1.138 -1.104
91 HG3 ARG 46 2HG ARG 46 -7.817 0.268 -0.094
92 HD2 ARG 46 1HD ARG 46 -7.694 1.688 -2.031
93 HD3 ARG 46 2HD ARG 46 -7.876 0.298 -3.103
94 HH11 ARG 46 1HH1 ARG 46 -8.638 3.021 -2.990
95 HH12 ARG 46 2HH1 ARG 46 -10.168 3.808 -3.258
96 HH21 ARG 46 1HH2 ARG 46 -12.089 1.124 -2.086
97 HH22 ARG 46 2HH2 ARG 46 -12.125 2.726 -2.757
98 H SER 47 H SER 47 -4.126 0.167 1.162
99 HA SER 47 HA SER 47 -5.953 0.364 3.450
100 HG SER 47 HG SER 47 -5.205 -1.749 4.287
101 HB2 SER 47 1HB SER 47 -2.967 -0.110 3.654
102 HB3 SER 47 2HB SER 47 -4.058 0.177 5.009
103 H THR 48 H THR 48 -6.300 2.420 4.000
104 HA THR 48 HA THR 48 -4.715 4.481 2.713
105 HB THR 48 HB THR 48 -7.087 4.951 4.524
106 HG1 THR 48 HG1 THR 48 -7.172 4.597 1.692
107 HG21 THR 48 3HG2 THR 48 -7.355 6.954 3.106
108 HG22 THR 48 1HG2 THR 48 -5.904 6.504 2.215
109 HG23 THR 48 2HG2 THR 48 -5.791 6.931 3.924
110 H VAL 49 H VAL 49 -2.978 5.119 3.619
111 HA VAL 49 HA VAL 49 -2.771 5.444 6.540
112 HB VAL 49 HB VAL 49 -0.300 4.834 6.238
113 HG11 VAL 49 1HG1 VAL 49 -1.772 3.342 7.402
114 HG12 VAL 49 2HG1 VAL 49 -0.727 2.397 6.335
115 HG13 VAL 49 3HG1 VAL 49 -2.400 2.713 5.880
116 HG21 VAL 49 3HG2 VAL 49 -1.352 3.608 3.686
117 HG22 VAL 49 1HG2 VAL 49 0.248 3.334 4.377
118 HG23 VAL 49 2HG2 VAL 49 -0.200 4.939 3.802
119 H GLN 50 H GLN 50 -0.790 6.884 7.055
120 HA GLN 50 HA GLN 50 -0.808 9.246 5.425
121 HB2 GLN 50 1HB GLN 50 0.778 8.406 7.848
122 HB3 GLN 50 2HB GLN 50 1.208 9.854 6.957
123 HG2 GLN 50 1HG GLN 50 -0.097 10.640 8.694
124 HG3 GLN 50 2HG GLN 50 -1.216 10.581 7.336
125 HE21 GLN 50 2HE2 GLN 50 -2.946 9.204 7.409
126 HE22 GLN 50 1HE2 GLN 50 -3.385 8.310 8.820
127 H PHE 51 H PHE 51 1.081 10.132 4.333
128 HA PHE 51 HA PHE 51 2.387 8.128 2.756
129 HD1 PHE 51 HD2 PHE 51 2.585 8.511 0.112
130 HD2 PHE 51 HD1 PHE 51 4.891 11.559 1.986
131 HE1 PHE 51 HE2 PHE 51 4.320 8.253 -1.609
132 HE2 PHE 51 HE1 PHE 51 6.633 11.303 0.270
133 HZ PHE 51 HZ PHE 51 6.347 9.649 -1.532
134 HB2 PHE 51 1HB PHE 51 1.598 10.221 1.737
135 HB3 PHE 51 2HB PHE 51 2.720 11.141 2.733
136 H HIS 52 H HIS 52 4.136 7.148 3.236
137 HA HIS 52 HA HIS 52 6.168 8.433 4.932
138 HD1 HIS 52 HD1 HIS 52 8.010 4.512 5.150
139 HD2 HIS 52 HD2 HIS 52 6.844 7.596 7.674
140 HE1 HIS 52 HE1 HIS 52 9.764 4.597 6.947
141 HE2 HIS 52 HE2 HIS 52 9.032 6.467 8.486
142 HB2 HIS 52 1HB HIS 52 4.979 6.322 5.789
143 HB3 HIS 52 2HB HIS 52 5.818 5.449 4.516
144 H ILE 53 H ILE 53 8.102 8.787 4.001
145 HA ILE 53 HA ILE 53 8.329 8.566 1.185
146 HB ILE 53 HB ILE 53 10.371 9.386 3.268
147 HG12 ILE 53 1HG1 ILE 53 9.930 11.630 1.914
148 HG13 ILE 53 2HG1 ILE 53 8.395 10.845 1.568
149 HG21 ILE 53 1HG2 ILE 53 11.591 8.589 1.314
150 HG22 ILE 53 2HG2 ILE 53 11.730 10.340 1.474
151 HG23 ILE 53 3HG2 ILE 53 10.639 9.647 0.273
152 HD11 ILE 53 3HD1 ILE 53 8.214 12.335 3.471
153 HD12 ILE 53 1HD1 ILE 53 9.497 11.460 4.304
154 HD13 ILE 53 2HD1 ILE 53 7.959 10.662 3.970
155 H LEU 54 H LEU 54 9.638 6.640 3.827
156 HA LEU 54 HA LEU 54 11.137 4.977 1.953
157 HG LEU 54 HG LEU 54 13.626 5.053 4.642
158 HB2 LEU 54 1HB LEU 54 11.162 5.355 4.899
159 HB3 LEU 54 2HB LEU 54 11.648 3.790 4.288
160 HD11 LEU 54 1HD1 LEU 54 14.617 5.167 2.418
161 HD12 LEU 54 2HD1 LEU 54 13.010 5.083 1.694
162 HD13 LEU 54 3HD1 LEU 54 13.635 3.716 2.618
163 HD21 LEU 54 3HD2 LEU 54 14.066 7.228 3.611
164 HD22 LEU 54 1HD2 LEU 54 12.695 7.294 4.719
165 HD23 LEU 54 2HD2 LEU 54 12.420 7.259 2.977
166 H GLY 55 H GLY 55 8.123 4.936 2.086
167 HA2 GLY 55 1HA GLY 55 7.014 2.992 1.175
168 HA3 GLY 55 2HA GLY 55 7.962 1.994 2.267
169 H MET 56 H MET 56 4.978 2.562 1.712
170 HA MET 56 HA MET 56 4.095 3.326 4.395
171 HB2 MET 56 1HB MET 56 2.653 3.004 1.770
172 HB3 MET 56 2HB MET 56 1.780 3.138 3.286
173 HG2 MET 56 1HG MET 56 1.761 5.286 2.452
174 HG3 MET 56 2HG MET 56 3.070 5.320 3.624
175 HE1 MET 56 3HE MET 56 2.018 5.532 -0.109
176 HE2 MET 56 1HE MET 56 2.889 4.001 -0.136
177 HE3 MET 56 2HE MET 56 3.556 5.408 -0.967
178 H LYS 57 H LYS 57 2.011 2.029 5.126
179 HA LYS 57 HA LYS 57 2.726 -0.827 4.994
180 HB2 LYS 57 1HB LYS 57 3.266 0.138 7.180
181 HB3 LYS 57 2HB LYS 57 1.614 0.717 7.346
182 HG2 LYS 57 1HG LYS 57 0.819 -1.615 7.312
183 HG3 LYS 57 2HG LYS 57 2.489 -2.163 7.228
184 HD2 LYS 57 1HD LYS 57 1.510 -0.403 9.446
185 HD3 LYS 57 2HD LYS 57 1.337 -2.157 9.506
186 HE2 LYS 57 1HE LYS 57 3.835 -2.274 9.077
187 HE3 LYS 57 2HE LYS 57 3.868 -0.537 9.397
188 HZ1 LYS 57 3HZ LYS 57 2.937 -0.952 11.581
189 HZ2 LYS 57 1HZ LYS 57 4.370 -1.828 11.385
190 HZ3 LYS 57 2HZ LYS 57 2.873 -2.616 11.273
191 H CYS 58 H CYS 58 1.221 -2.188 4.302
192 HA CYS 58 HA CYS 58 -1.585 -1.515 4.154
193 HB2 CYS 58 1HB CYS 58 -0.781 -2.925 2.435
194 HB3 CYS 58 2HB CYS 58 0.076 -3.953 3.556
195 H LYS 59 H LYS 59 -2.989 -1.768 5.804
196 HA LYS 59 HA LYS 59 -2.045 -2.717 8.348
197 HB2 LYS 59 1HB LYS 59 -4.801 -1.793 7.512
198 HB3 LYS 59 2HB LYS 59 -4.267 -2.042 9.168
199 HG2 LYS 59 1HG LYS 59 -2.627 -0.265 8.917
200 HG3 LYS 59 2HG LYS 59 -3.135 -0.024 7.245
201 HD2 LYS 59 1HD LYS 59 -5.378 0.574 8.010
202 HD3 LYS 59 2HD LYS 59 -4.878 0.316 9.682
203 HE2 LYS 59 1HE LYS 59 -3.235 2.107 9.477
204 HE3 LYS 59 2HE LYS 59 -3.703 2.357 7.796
205 HZ1 LYS 59 3HZ LYS 59 -5.912 2.982 8.543
206 HZ2 LYS 59 1HZ LYS 59 -4.736 3.971 9.249
207 HZ3 LYS 59 2HZ LYS 59 -5.464 2.742 10.159
208 H ILE 60 H ILE 60 -3.561 -4.201 5.717
209 HA ILE 60 HA ILE 60 -5.236 -6.050 7.141
210 HB ILE 60 HB ILE 60 -4.425 -6.204 4.225
211 HG12 ILE 60 1HG1 ILE 60 -6.820 -4.720 5.347
212 HG13 ILE 60 2HG1 ILE 60 -5.319 -3.924 4.896
213 HG21 ILE 60 1HG2 ILE 60 -5.576 -8.174 5.095
214 HG22 ILE 60 2HG2 ILE 60 -6.603 -7.302 3.955
215 HG23 ILE 60 3HG2 ILE 60 -6.888 -7.154 5.689
216 HD11 ILE 60 3HD1 ILE 60 -6.983 -3.693 3.153
217 HD12 ILE 60 1HD1 ILE 60 -7.144 -5.447 3.051
218 HD13 ILE 60 2HD1 ILE 60 -5.630 -4.673 2.586
219 H CYS 61 H CYS 61 -1.996 -6.124 5.719
220 HA CYS 61 HA CYS 61 -1.636 -8.789 6.865
221 HB2 CYS 61 1HB CYS 61 -0.808 -9.787 4.884
222 HB3 CYS 61 2HB CYS 61 -2.307 -8.973 4.436
223 H GLU 62 H GLU 62 -0.517 -5.745 6.729
224 HA GLU 62 HA GLU 62 1.303 -4.705 7.562
225 HB2 GLU 62 1HB GLU 62 2.092 -7.484 8.438
226 HB3 GLU 62 2HB GLU 62 2.955 -6.028 8.908
227 HG2 GLU 62 1HG GLU 62 0.058 -6.597 9.517
228 HG3 GLU 62 2HG GLU 62 1.400 -6.839 10.636
229 H SER 63 H SER 63 1.334 -5.513 4.808
230 HA SER 63 HA SER 63 4.167 -6.091 4.306
231 HG SER 63 HG SER 63 3.178 -7.246 1.011
232 HB2 SER 63 1HB SER 63 2.553 -7.646 3.289
233 HB3 SER 63 2HB SER 63 1.782 -6.305 2.447
234 H TYR 64 H TYR 64 5.431 -4.772 3.062
235 HA TYR 64 HA TYR 64 4.374 -2.132 2.393
236 HD1 TYR 64 HD2 TYR 64 7.405 -4.308 4.298
237 HD2 TYR 64 HD1 TYR 64 8.219 -2.491 0.545
238 HE1 TYR 64 HE2 TYR 64 9.303 -5.835 3.981
239 HE2 TYR 64 HE1 TYR 64 10.130 -3.999 0.215
240 HH TYR 64 HH TYR 64 10.647 -6.772 2.132
241 HB2 TYR 64 1HB TYR 64 6.721 -1.442 2.121
242 HB3 TYR 64 2HB TYR 64 6.436 -2.131 3.710
243 H ASN 65 H ASN 65 4.803 -5.071 0.921
244 HA ASN 65 HA ASN 65 5.610 -4.261 -1.704
245 HB2 ASN 65 1HB ASN 65 5.917 -6.576 -0.887
246 HB3 ASN 65 2HB ASN 65 4.175 -6.768 -0.772
247 HD21 ASN 65 2HD2 ASN 65 3.995 -8.433 -2.179
248 HD22 ASN 65 1HD2 ASN 65 4.343 -8.315 -3.868
249 H THR 66 H THR 66 4.301 -2.522 -2.156
250 HA THR 66 HA THR 66 1.522 -3.061 -2.863
251 HB THR 66 HB THR 66 0.863 -0.872 -1.758
252 HG1 THR 66 HG1 THR 66 3.403 -1.267 -0.531
253 HG21 THR 66 3HG2 THR 66 1.694 -3.065 0.140
254 HG22 THR 66 1HG2 THR 66 0.192 -3.017 -0.785
255 HG23 THR 66 2HG2 THR 66 0.502 -1.806 0.456
256 H ALA 67 H ALA 67 0.613 -1.395 -4.133
257 HA ALA 67 HA ALA 67 2.468 0.584 -5.277
258 HB1 ALA 67 3HB ALA 67 0.333 -1.013 -6.722
259 HB2 ALA 67 1HB ALA 67 2.076 -1.168 -6.937
260 HB3 ALA 67 2HB ALA 67 1.256 0.315 -7.430
261 H GLN 68 H GLN 68 1.380 2.620 -5.822
262 HA GLN 68 HA GLN 68 -0.737 3.257 -4.007
263 HB2 GLN 68 1HB GLN 68 0.496 4.842 -6.258
264 HB3 GLN 68 2HB GLN 68 -0.748 5.475 -5.187
265 HG2 GLN 68 1HG GLN 68 0.715 5.174 -3.272
266 HG3 GLN 68 2HG GLN 68 1.952 4.467 -4.310
267 HE21 GLN 68 2HE2 GLN 68 2.062 6.827 -2.590
268 HE22 GLN 68 1HE2 GLN 68 2.505 8.148 -3.614
269 H ALA 69 H ALA 69 -2.843 3.044 -4.270
270 HA ALA 69 HA ALA 69 -3.821 1.866 -6.697
271 HB1 ALA 69 3HB ALA 69 -5.383 2.685 -4.254
272 HB2 ALA 69 1HB ALA 69 -4.581 1.128 -4.466
273 HB3 ALA 69 2HB ALA 69 -5.906 1.589 -5.533
274 H GLY 70 H GLY 70 -4.418 2.950 -8.379
275 HA2 GLY 70 1HA GLY 70 -6.293 5.061 -8.342
276 HA3 GLY 70 2HA GLY 70 -4.673 5.705 -8.596
277 H GLY 71 H GLY 71 -3.438 3.956 -10.160
278 HA2 GLY 71 1HA GLY 71 -4.889 2.691 -12.179
279 HA3 GLY 71 2HA GLY 71 -4.576 4.336 -12.710
280 H ARG 72 H ARG 72 -3.555 1.422 -13.261
281 HA ARG 72 HA ARG 72 -0.689 1.979 -13.224
282 HE ARG 72 HE ARG 72 -1.649 -2.349 -12.560
283 HB2 ARG 72 1HB ARG 72 -1.732 -0.307 -12.672
284 HB3 ARG 72 2HB ARG 72 -2.047 -0.446 -14.395
285 HG2 ARG 72 1HG ARG 72 0.358 -0.252 -14.844
286 HG3 ARG 72 2HG ARG 72 0.662 -0.132 -13.110
287 HD2 ARG 72 1HD ARG 72 -0.389 -2.484 -14.665
288 HD3 ARG 72 2HD ARG 72 1.078 -2.386 -13.694
289 HH11 ARG 72 1HH1 ARG 72 1.740 -3.263 -12.283
290 HH12 ARG 72 2HH1 ARG 72 1.478 -4.189 -10.837
291 HH21 ARG 72 1HH2 ARG 72 -1.958 -3.529 -10.675
292 HH22 ARG 72 2HH2 ARG 72 -0.611 -4.332 -9.922
293 H ARG 73 H ARG 73 -0.034 3.300 -14.806
294 HA ARG 73 HA ARG 73 -1.496 3.434 -17.285
295 HE ARG 73 HE ARG 73 -0.132 5.409 -20.809
296 HB2 ARG 73 1HB ARG 73 -0.642 5.507 -16.302
297 HB3 ARG 73 2HB ARG 73 1.005 4.907 -16.435
298 HG2 ARG 73 1HG ARG 73 0.492 6.506 -18.204
299 HG3 ARG 73 2HG ARG 73 0.832 4.907 -18.866
300 HD2 ARG 73 1HD ARG 73 -1.804 4.674 -18.665
301 HD3 ARG 73 2HD ARG 73 -1.720 6.433 -18.775
302 HH11 ARG 73 1HH1 ARG 73 -3.540 5.450 -19.951
303 HH12 ARG 73 2HH1 ARG 73 -4.078 5.219 -21.586
304 HH21 ARG 73 1HH2 ARG 73 -0.848 5.086 -22.936
305 HH22 ARG 73 2HH2 ARG 73 -2.552 5.016 -23.275
306 H ILE 74 H ILE 74 -1.290 1.750 -18.487
307 HA ILE 74 HA ILE 74 1.380 1.005 -19.455
308 HB ILE 74 HB ILE 74 0.231 -1.315 -19.891
309 HG12 ILE 74 1HG1 ILE 74 -1.403 -0.300 -17.537
310 HG13 ILE 74 2HG1 ILE 74 -2.027 -0.652 -19.141
311 HG21 ILE 74 1HG2 ILE 74 1.077 -2.138 -17.745
312 HG22 ILE 74 2HG2 ILE 74 1.173 -0.480 -17.152
313 HG23 ILE 74 3HG2 ILE 74 2.185 -0.994 -18.504
314 HD11 ILE 74 3HD1 ILE 74 -0.877 -2.650 -17.208
315 HD12 ILE 74 1HD1 ILE 74 -1.475 -3.013 -18.827
316 HD13 ILE 74 2HD1 ILE 74 -2.583 -2.420 -17.590
317 H SER 75 H SER 75 1.506 1.826 -21.420
318 HA SER 75 HA SER 75 -0.812 2.270 -23.063
319 HG SER 75 HG SER 75 2.086 4.257 -22.575
320 HB2 SER 75 1HB SER 75 2.113 2.564 -23.796
321 HB3 SER 75 2HB SER 75 0.734 3.256 -24.653
322 H LEU 76 H LEU 76 -1.765 0.545 -23.842
323 HA LEU 76 HA LEU 76 -0.141 -1.627 -24.979
324 HG LEU 76 HG LEU 76 -2.379 -3.483 -25.777
325 HB2 LEU 76 1HB LEU 76 -1.763 -2.152 -23.137
326 HB3 LEU 76 2HB LEU 76 -3.063 -1.650 -24.197
327 HD11 LEU 76 1HD1 LEU 76 -0.651 -4.325 -23.454
328 HD12 LEU 76 2HD1 LEU 76 -0.081 -3.772 -25.028
329 HD13 LEU 76 3HD1 LEU 76 -0.977 -5.286 -24.896
330 HD21 LEU 76 3HD2 LEU 76 -3.400 -5.262 -24.443
331 HD22 LEU 76 1HD2 LEU 76 -4.260 -3.734 -24.256
332 HD23 LEU 76 2HD2 LEU 76 -3.174 -4.295 -22.985
333 H ASP 77 H ASP 77 -0.479 -2.303 -27.068
334 HA ASP 77 HA ASP 77 -1.742 -0.399 -28.847
335 HB2 ASP 77 1HB ASP 77 -0.030 -2.835 -29.305
336 HB3 ASP 77 2HB ASP 77 -0.827 -2.008 -30.637
337 H GLN 78 H GLN 78 -3.858 -0.992 -27.808
338 HA GLN 78 HA GLN 78 -5.208 -2.944 -29.543
339 HB2 GLN 78 1HB GLN 78 -5.603 -2.590 -26.568
340 HB3 GLN 78 2HB GLN 78 -6.817 -3.333 -27.595
341 HG2 GLN 78 1HG GLN 78 -3.997 -4.347 -27.373
342 HG3 GLN 78 2HG GLN 78 -5.315 -4.905 -26.343
343 HE21 GLN 78 2HE2 GLN 78 -3.911 -4.970 -29.512
344 HE22 GLN 78 1HE2 GLN 78 -4.912 -6.223 -30.167
345 H GLN 79 H GLN 79 -6.908 -2.119 -30.565
346 HA GLN 79 HA GLN 79 -8.274 0.261 -29.594
347 HB2 GLN 79 1HB GLN 79 -6.372 1.103 -30.942
348 HB3 GLN 79 2HB GLN 79 -6.916 0.137 -32.302
349 HG2 GLN 79 1HG GLN 79 -9.007 1.453 -32.345
350 HG3 GLN 79 2HG GLN 79 -8.364 2.455 -31.046
351 HE21 GLN 79 2HE2 GLN 79 -6.715 3.896 -31.480
352 HE22 GLN 79 1HE2 GLN 79 -6.259 4.326 -33.093
Start of MODEL 15
1 H ASN 33 H ASN 33 -2.879 13.794 3.232
2 HA ASN 33 HA ASN 33 -1.868 16.015 1.692
3 HB2 ASN 33 1HB ASN 33 0.068 14.615 2.948
4 HB3 ASN 33 2HB ASN 33 -0.164 13.550 1.570
5 HD21 ASN 33 2HD2 ASN 33 2.137 15.154 2.359
6 HD22 ASN 33 1HD2 ASN 33 2.489 16.179 1.005
7 H MET 34 H MET 34 -1.071 14.462 -0.530
8 HA MET 34 HA MET 34 -3.462 13.455 -1.609
9 HB2 MET 34 1HB MET 34 -1.662 14.266 -3.012
10 HB3 MET 34 2HB MET 34 -0.576 13.030 -2.396
11 HG2 MET 34 1HG MET 34 -2.081 11.312 -3.404
12 HG3 MET 34 2HG MET 34 -2.992 12.626 -4.144
13 HE1 MET 34 3HE MET 34 0.477 10.776 -3.974
14 HE2 MET 34 1HE MET 34 0.878 12.441 -3.553
15 HE3 MET 34 2HE MET 34 1.444 11.757 -5.077
16 H THR 35 H THR 35 -4.477 11.650 -1.072
17 HA THR 35 HA THR 35 -3.023 9.486 0.214
18 HB THR 35 HB THR 35 -5.349 8.479 0.442
19 HG1 THR 35 HG1 THR 35 -6.829 10.608 0.310
20 HG21 THR 35 3HG2 THR 35 -4.841 11.173 1.713
21 HG22 THR 35 1HG2 THR 35 -4.226 9.623 2.289
22 HG23 THR 35 2HG2 THR 35 -5.960 9.946 2.310
23 H VAL 36 H VAL 36 -2.611 7.583 -0.692
24 HA VAL 36 HA VAL 36 -3.595 7.088 -3.428
25 HB VAL 36 HB VAL 36 -1.481 5.837 -3.847
26 HG11 VAL 36 1HG1 VAL 36 -1.096 8.739 -3.113
27 HG12 VAL 36 2HG1 VAL 36 -1.685 8.119 -4.656
28 HG13 VAL 36 3HG1 VAL 36 -0.029 7.790 -4.150
29 HG21 VAL 36 3HG2 VAL 36 -0.585 7.041 -1.224
30 HG22 VAL 36 1HG2 VAL 36 0.457 6.202 -2.378
31 HG23 VAL 36 2HG2 VAL 36 -0.836 5.326 -1.562
32 H ASP 37 H ASP 37 -3.950 4.867 -3.962
33 HA ASP 37 HA ASP 37 -4.500 3.218 -1.591
34 HB2 ASP 37 1HB ASP 37 -6.467 3.859 -2.963
35 HB3 ASP 37 2HB ASP 37 -5.737 3.059 -4.350
36 H ILE 38 H ILE 38 -3.257 1.477 -1.312
37 HA ILE 38 HA ILE 38 -1.811 0.400 -3.653
38 HB ILE 38 HB ILE 38 -0.096 -0.445 -2.004
39 HG12 ILE 38 1HG1 ILE 38 -1.138 1.644 -0.098
40 HG13 ILE 38 2HG1 ILE 38 -1.700 -0.020 -0.008
41 HG21 ILE 38 1HG2 ILE 38 1.078 1.695 -1.830
42 HG22 ILE 38 2HG2 ILE 38 -0.413 2.542 -2.244
43 HG23 ILE 38 3HG2 ILE 38 0.348 1.468 -3.419
44 HD11 ILE 38 3HD1 ILE 38 0.055 0.293 1.570
45 HD12 ILE 38 1HD1 ILE 38 1.113 0.963 0.326
46 HD13 ILE 38 2HD1 ILE 38 0.644 -0.736 0.260
47 H LEU 39 H LEU 39 -1.976 -1.746 -4.073
48 HA LEU 39 HA LEU 39 -3.703 -3.320 -2.273
49 HG LEU 39 HG LEU 39 -5.878 -3.933 -3.643
50 HB2 LEU 39 1HB LEU 39 -4.179 -2.654 -4.843
51 HB3 LEU 39 2HB LEU 39 -3.239 -4.097 -5.121
52 HD11 LEU 39 1HD1 LEU 39 -5.121 -5.109 -6.310
53 HD12 LEU 39 2HD1 LEU 39 -6.078 -3.652 -6.038
54 HD13 LEU 39 3HD1 LEU 39 -6.707 -5.224 -5.547
55 HD21 LEU 39 3HD2 LEU 39 -5.848 -6.374 -3.624
56 HD22 LEU 39 1HD2 LEU 39 -4.512 -5.710 -2.685
57 HD23 LEU 39 2HD2 LEU 39 -4.216 -6.365 -4.296
58 H CYS 40 H CYS 40 -2.828 -5.074 -1.358
59 HA CYS 40 HA CYS 40 -0.083 -5.699 -1.597
60 HB2 CYS 40 1HB CYS 40 -2.389 -6.782 -0.136
61 HB3 CYS 40 2HB CYS 40 -1.079 -7.909 -0.428
62 H ASN 41 H ASN 41 1.004 -7.272 -2.540
63 HA ASN 41 HA ASN 41 -0.393 -9.071 -4.380
64 HB2 ASN 41 1HB ASN 41 2.555 -8.505 -3.952
65 HB3 ASN 41 2HB ASN 41 1.937 -9.692 -5.095
66 HD21 ASN 41 2HD2 ASN 41 3.516 -7.257 -5.554
67 HD22 ASN 41 1HD2 ASN 41 2.591 -6.312 -6.671
68 H ASP 42 H ASP 42 -0.212 -9.168 -1.303
69 HA ASP 42 HA ASP 42 0.479 -12.009 -1.116
70 HB2 ASP 42 1HB ASP 42 1.104 -11.517 1.319
71 HB3 ASP 42 2HB ASP 42 2.230 -10.997 0.072
72 H CYS 43 H CYS 43 -1.442 -9.471 0.570
73 HA CYS 43 HA CYS 43 -3.124 -11.613 1.610
74 HB2 CYS 43 1HB CYS 43 -3.879 -10.159 3.312
75 HB3 CYS 43 2HB CYS 43 -2.158 -9.867 3.163
76 H ASN 44 H ASN 44 -3.151 -9.825 -1.076
77 HA ASN 44 HA ASN 44 -4.599 -8.983 -2.571
78 HB2 ASN 44 1HB ASN 44 -5.377 -11.481 -2.070
79 HB3 ASN 44 2HB ASN 44 -6.831 -10.659 -1.517
80 HD21 ASN 44 2HD2 ASN 44 -4.694 -9.698 -4.164
81 HD22 ASN 44 1HD2 ASN 44 -5.879 -9.873 -5.402
82 H GLY 45 H GLY 45 -4.460 -7.552 -0.098
83 HA2 GLY 45 1HA GLY 45 -7.142 -6.341 -0.009
84 HA3 GLY 45 2HA GLY 45 -6.165 -6.567 1.437
85 H ARG 46 H ARG 46 -7.269 -4.190 -0.095
86 HA ARG 46 HA ARG 46 -4.781 -2.775 -0.712
87 HE ARG 46 HE ARG 46 -9.261 -3.321 -3.332
88 HB2 ARG 46 1HB ARG 46 -6.177 -1.149 -1.870
89 HB3 ARG 46 2HB ARG 46 -6.489 -2.771 -2.462
90 HG2 ARG 46 1HG ARG 46 -8.521 -2.863 -1.076
91 HG3 ARG 46 2HG ARG 46 -8.219 -1.202 -0.562
92 HD2 ARG 46 1HD ARG 46 -9.795 -1.074 -2.307
93 HD3 ARG 46 2HD ARG 46 -8.251 -0.578 -2.997
94 HH11 ARG 46 1HH1 ARG 46 -7.873 -0.401 -4.689
95 HH12 ARG 46 2HH1 ARG 46 -7.990 -0.965 -6.331
96 HH21 ARG 46 1HH2 ARG 46 -9.374 -4.068 -5.455
97 HH22 ARG 46 2HH2 ARG 46 -8.819 -3.068 -6.764
98 H SER 47 H SER 47 -4.394 -0.705 0.087
99 HA SER 47 HA SER 47 -5.939 0.162 2.424
100 HG SER 47 HG SER 47 -4.780 -1.367 4.027
101 HB2 SER 47 1HB SER 47 -2.917 -0.093 2.301
102 HB3 SER 47 2HB SER 47 -3.818 0.647 3.622
103 H THR 48 H THR 48 -6.610 2.173 1.965
104 HA THR 48 HA THR 48 -5.025 3.903 0.261
105 HB THR 48 HB THR 48 -7.537 4.605 1.805
106 HG1 THR 48 HG1 THR 48 -7.145 3.129 -0.497
107 HG21 THR 48 3HG2 THR 48 -6.244 6.558 1.075
108 HG22 THR 48 1HG2 THR 48 -7.741 6.427 0.152
109 HG23 THR 48 2HG2 THR 48 -6.211 5.933 -0.573
110 H VAL 49 H VAL 49 -3.323 4.756 1.082
111 HA VAL 49 HA VAL 49 -3.284 5.663 3.886
112 HB VAL 49 HB VAL 49 -0.805 5.183 3.846
113 HG11 VAL 49 1HG1 VAL 49 -2.337 3.673 4.978
114 HG12 VAL 49 2HG1 VAL 49 -1.023 2.769 4.224
115 HG13 VAL 49 3HG1 VAL 49 -2.618 2.802 3.471
116 HG21 VAL 49 3HG2 VAL 49 -0.464 5.089 1.427
117 HG22 VAL 49 1HG2 VAL 49 -1.477 3.650 1.327
118 HG23 VAL 49 2HG2 VAL 49 0.061 3.587 2.187
119 H GLN 50 H GLN 50 -1.459 7.330 4.188
120 HA GLN 50 HA GLN 50 -1.708 9.390 2.185
121 HB2 GLN 50 1HB GLN 50 -1.496 9.797 4.681
122 HB3 GLN 50 2HB GLN 50 0.185 9.303 4.550
123 HG2 GLN 50 1HG GLN 50 0.479 11.144 2.864
124 HG3 GLN 50 2HG GLN 50 -1.133 11.702 3.314
125 HE21 GLN 50 2HE2 GLN 50 -1.475 12.486 5.396
126 HE22 GLN 50 1HE2 GLN 50 -0.168 13.046 6.383
127 H PHE 51 H PHE 51 -0.087 10.077 0.766
128 HA PHE 51 HA PHE 51 1.714 8.068 -0.144
129 HD1 PHE 51 HD2 PHE 51 2.000 7.760 -2.710
130 HD2 PHE 51 HD1 PHE 51 3.652 11.576 -1.828
131 HE1 PHE 51 HE2 PHE 51 3.792 7.354 -4.345
132 HE2 PHE 51 HE1 PHE 51 5.446 11.179 -3.460
133 HZ PHE 51 HZ PHE 51 5.519 9.067 -4.720
134 HB2 PHE 51 1HB PHE 51 0.660 9.703 -1.664
135 HB3 PHE 51 2HB PHE 51 1.599 10.988 -0.917
136 H HIS 52 H HIS 52 3.571 7.580 0.613
137 HA HIS 52 HA HIS 52 5.104 9.522 2.177
138 HD1 HIS 52 HD1 HIS 52 6.583 6.273 4.548
139 HD2 HIS 52 HD2 HIS 52 4.903 10.024 5.119
140 HE1 HIS 52 HE1 HIS 52 7.752 7.232 6.551
141 HE2 HIS 52 HE2 HIS 52 6.570 9.411 7.000
142 HB2 HIS 52 1HB HIS 52 3.565 7.941 3.534
143 HB3 HIS 52 2HB HIS 52 4.667 6.661 3.053
144 H ILE 53 H ILE 53 7.038 9.646 1.290
145 HA ILE 53 HA ILE 53 8.057 7.941 -0.706
146 HB ILE 53 HB ILE 53 9.529 9.925 1.046
147 HG12 ILE 53 1HG1 ILE 53 7.696 10.954 -0.201
148 HG13 ILE 53 2HG1 ILE 53 9.252 11.505 -0.807
149 HG21 ILE 53 1HG2 ILE 53 10.412 8.738 -1.584
150 HG22 ILE 53 2HG2 ILE 53 11.122 8.422 -0.002
151 HG23 ILE 53 3HG2 ILE 53 11.234 10.033 -0.709
152 HD11 ILE 53 3HD1 ILE 53 7.482 9.435 -2.096
153 HD12 ILE 53 1HD1 ILE 53 9.040 9.990 -2.711
154 HD13 ILE 53 2HD1 ILE 53 7.680 11.110 -2.616
155 H LEU 54 H LEU 54 8.675 8.120 2.768
156 HA LEU 54 HA LEU 54 10.630 5.971 2.644
157 HG LEU 54 HG LEU 54 12.192 8.116 5.193
158 HB2 LEU 54 1HB LEU 54 9.735 7.882 4.766
159 HB3 LEU 54 2HB LEU 54 10.563 6.416 5.236
160 HD11 LEU 54 1HD1 LEU 54 13.748 7.421 3.447
161 HD12 LEU 54 2HD1 LEU 54 12.441 6.569 2.624
162 HD13 LEU 54 3HD1 LEU 54 12.969 6.045 4.224
163 HD21 LEU 54 3HD2 LEU 54 12.628 9.567 3.276
164 HD22 LEU 54 1HD2 LEU 54 11.004 9.798 3.922
165 HD23 LEU 54 2HD2 LEU 54 11.238 8.871 2.440
166 H GLY 55 H GLY 55 7.846 5.272 2.003
167 HA2 GLY 55 1HA GLY 55 7.481 2.858 2.307
168 HA3 GLY 55 2HA GLY 55 7.690 3.123 4.028
169 H MET 56 H MET 56 5.519 2.788 1.530
170 HA MET 56 HA MET 56 3.300 3.649 3.258
171 HB2 MET 56 1HB MET 56 3.329 3.017 0.301
172 HB3 MET 56 2HB MET 56 1.884 3.408 1.229
173 HG2 MET 56 1HG MET 56 2.709 5.602 1.694
174 HG3 MET 56 2HG MET 56 4.259 5.226 0.945
175 HE1 MET 56 3HE MET 56 3.203 3.538 -1.624
176 HE2 MET 56 1HE MET 56 4.515 4.719 -1.685
177 HE3 MET 56 2HE MET 56 3.171 4.828 -2.826
178 H LYS 57 H LYS 57 2.453 2.100 4.413
179 HA LYS 57 HA LYS 57 2.890 -0.671 3.548
180 HB2 LYS 57 1HB LYS 57 4.421 -0.016 5.320
181 HB3 LYS 57 2HB LYS 57 3.084 0.531 6.313
182 HG2 LYS 57 1HG LYS 57 2.464 -1.602 6.891
183 HG3 LYS 57 2HG LYS 57 3.184 -2.321 5.450
184 HD2 LYS 57 1HD LYS 57 4.433 -2.861 7.510
185 HD3 LYS 57 2HD LYS 57 5.408 -1.981 6.337
186 HE2 LYS 57 1HE LYS 57 5.837 -1.150 8.582
187 HE3 LYS 57 2HE LYS 57 5.049 0.093 7.615
188 HZ1 LYS 57 3HZ LYS 57 4.125 -0.017 9.833
189 HZ2 LYS 57 1HZ LYS 57 3.716 -1.644 9.622
190 HZ3 LYS 57 2HZ LYS 57 2.957 -0.453 8.692
191 H CYS 58 H CYS 58 1.248 -1.930 3.435
192 HA CYS 58 HA CYS 58 -1.434 -1.184 3.842
193 HB2 CYS 58 1HB CYS 58 -1.105 -2.865 2.283
194 HB3 CYS 58 2HB CYS 58 0.051 -3.715 3.275
195 H LYS 59 H LYS 59 -2.628 -1.129 5.668
196 HA LYS 59 HA LYS 59 -1.325 -1.905 8.143
197 HB2 LYS 59 1HB LYS 59 -3.917 -0.437 7.677
198 HB3 LYS 59 2HB LYS 59 -3.123 -0.649 9.234
199 HG2 LYS 59 1HG LYS 59 -1.171 0.577 8.373
200 HG3 LYS 59 2HG LYS 59 -2.037 0.845 6.860
201 HD2 LYS 59 1HD LYS 59 -3.723 2.127 7.996
202 HD3 LYS 59 2HD LYS 59 -3.007 1.742 9.564
203 HE2 LYS 59 1HE LYS 59 -1.690 3.328 7.363
204 HE3 LYS 59 2HE LYS 59 -2.399 3.994 8.833
205 HZ1 LYS 59 3HZ LYS 59 -0.089 2.132 8.706
206 HZ2 LYS 59 1HZ LYS 59 -0.786 2.733 10.129
207 HZ3 LYS 59 2HZ LYS 59 -0.019 3.789 9.052
208 H ILE 60 H ILE 60 -3.190 -3.552 6.074
209 HA ILE 60 HA ILE 60 -4.944 -4.900 7.919
210 HB ILE 60 HB ILE 60 -4.233 -5.768 5.097
211 HG12 ILE 60 1HG1 ILE 60 -6.514 -3.947 5.926
212 HG13 ILE 60 2HG1 ILE 60 -5.028 -3.382 5.174
213 HG21 ILE 60 1HG2 ILE 60 -5.410 -7.444 6.413
214 HG22 ILE 60 2HG2 ILE 60 -6.458 -6.810 5.143
215 HG23 ILE 60 3HG2 ILE 60 -6.668 -6.273 6.810
216 HD11 ILE 60 3HD1 ILE 60 -7.046 -5.239 3.932
217 HD12 ILE 60 1HD1 ILE 60 -5.558 -4.679 3.171
218 HD13 ILE 60 2HD1 ILE 60 -6.835 -3.526 3.561
219 H CYS 61 H CYS 61 -1.750 -5.410 6.526
220 HA CYS 61 HA CYS 61 -1.477 -7.828 8.154
221 HB2 CYS 61 1HB CYS 61 -0.595 -9.149 6.377
222 HB3 CYS 61 2HB CYS 61 -2.124 -8.472 5.825
223 H GLU 62 H GLU 62 -0.141 -4.945 7.024
224 HA GLU 62 HA GLU 62 1.721 -3.808 7.513
225 HB2 GLU 62 1HB GLU 62 2.399 -6.115 9.336
226 HB3 GLU 62 2HB GLU 62 3.291 -4.602 9.267
227 HG2 GLU 62 1HG GLU 62 0.385 -4.883 10.009
228 HG3 GLU 62 2HG GLU 62 1.718 -4.695 11.145
229 H SER 63 H SER 63 1.603 -5.625 5.284
230 HA SER 63 HA SER 63 4.443 -6.171 4.851
231 HG SER 63 HG SER 63 3.364 -7.873 1.831
232 HB2 SER 63 1HB SER 63 2.866 -7.970 4.269
233 HB3 SER 63 2HB SER 63 2.027 -6.880 3.168
234 H TYR 64 H TYR 64 5.585 -5.222 3.253
235 HA TYR 64 HA TYR 64 4.575 -2.672 2.282
236 HD1 TYR 64 HD1 TYR 64 5.799 -0.481 2.650
237 HD2 TYR 64 HD2 TYR 64 8.445 -2.837 0.308
238 HE1 TYR 64 HE1 TYR 64 6.427 1.516 1.361
239 HE2 TYR 64 HE2 TYR 64 9.086 -0.855 -0.985
240 HH TYR 64 HH TYR 64 8.027 1.381 -1.558
241 HB2 TYR 64 1HB TYR 64 6.809 -2.811 3.398
242 HB3 TYR 64 2HB TYR 64 7.370 -3.827 2.075
243 H ASN 65 H ASN 65 4.929 -5.862 1.188
244 HA ASN 65 HA ASN 65 5.563 -5.396 -1.554
245 HB2 ASN 65 1HB ASN 65 5.912 -7.583 -0.318
246 HB3 ASN 65 2HB ASN 65 4.172 -7.840 -0.436
247 HD21 ASN 65 2HD2 ASN 65 4.277 -9.629 -1.745
248 HD22 ASN 65 1HD2 ASN 65 4.837 -9.572 -3.380
249 H THR 66 H THR 66 4.221 -3.900 -2.398
250 HA THR 66 HA THR 66 1.422 -4.628 -2.802
251 HB THR 66 HB THR 66 0.786 -2.213 -2.324
252 HG1 THR 66 HG1 THR 66 3.336 -2.265 -1.045
253 HG21 THR 66 3HG2 THR 66 0.166 -3.991 -0.778
254 HG22 THR 66 1HG2 THR 66 0.578 -2.515 0.096
255 HG23 THR 66 2HG2 THR 66 1.730 -3.847 0.026
256 H ALA 67 H ALA 67 0.433 -3.523 -4.454
257 HA ALA 67 HA ALA 67 2.154 -2.083 -6.360
258 HB1 ALA 67 3HB ALA 67 1.576 -4.307 -7.207
259 HB2 ALA 67 1HB ALA 67 0.739 -3.065 -8.137
260 HB3 ALA 67 2HB ALA 67 -0.135 -3.992 -6.916
261 H GLN 68 H GLN 68 1.472 -0.012 -6.583
262 HA GLN 68 HA GLN 68 -0.747 0.970 -5.129
263 HB2 GLN 68 1HB GLN 68 1.389 2.185 -5.772
264 HB3 GLN 68 2HB GLN 68 0.652 2.443 -7.348
265 HG2 GLN 68 1HG GLN 68 -1.026 3.812 -6.465
266 HG3 GLN 68 2HG GLN 68 -0.716 3.282 -4.812
267 HE21 GLN 68 2HE2 GLN 68 1.111 4.050 -3.742
268 HE22 GLN 68 1HE2 GLN 68 1.914 5.493 -4.248
269 H ALA 69 H ALA 69 -2.769 0.532 -5.648
270 HA ALA 69 HA ALA 69 -3.492 -0.218 -8.350
271 HB1 ALA 69 3HB ALA 69 -5.087 -0.346 -5.797
272 HB2 ALA 69 1HB ALA 69 -4.108 -1.657 -6.461
273 HB3 ALA 69 2HB ALA 69 -5.526 -1.080 -7.339
274 H GLY 70 H GLY 70 -5.204 0.652 -9.501
275 HA2 GLY 70 1HA GLY 70 -6.818 2.161 -10.142
276 HA3 GLY 70 2HA GLY 70 -6.811 2.806 -8.506
277 H GLY 71 H GLY 71 -5.721 4.606 -8.054
278 HA2 GLY 71 1HA GLY 71 -4.572 6.088 -10.276
279 HA3 GLY 71 2HA GLY 71 -4.946 6.715 -8.676
280 H ARG 72 H ARG 72 -2.705 4.698 -10.485
281 HA ARG 72 HA ARG 72 -0.700 4.804 -8.434
282 HE ARG 72 HE ARG 72 -0.778 3.383 -14.255
283 HB2 ARG 72 1HB ARG 72 0.804 3.835 -10.195
284 HB3 ARG 72 2HB ARG 72 -0.624 2.880 -9.837
285 HG2 ARG 72 1HG ARG 72 -1.696 3.685 -11.858
286 HG3 ARG 72 2HG ARG 72 -0.304 4.713 -12.204
287 HD2 ARG 72 1HD ARG 72 1.112 2.726 -12.361
288 HD3 ARG 72 2HD ARG 72 -0.285 1.705 -12.024
289 HH11 ARG 72 1HH1 ARG 72 0.997 0.493 -13.356
290 HH12 ARG 72 2HH1 ARG 72 0.958 -0.168 -14.961
291 HH21 ARG 72 1HH2 ARG 72 -0.834 2.500 -16.334
292 HH22 ARG 72 2HH2 ARG 72 -0.088 0.961 -16.644
293 H ARG 73 H ARG 73 0.713 6.313 -8.082
294 HA ARG 73 HA ARG 73 0.535 8.729 -9.654
295 HE ARG 73 HE ARG 73 0.371 12.717 -7.857
296 HB2 ARG 73 1HB ARG 73 0.839 8.177 -6.940
297 HB3 ARG 73 2HB ARG 73 2.404 8.809 -7.432
298 HG2 ARG 73 1HG ARG 73 -0.242 10.173 -7.877
299 HG3 ARG 73 2HG ARG 73 0.921 10.561 -6.609
300 HD2 ARG 73 1HD ARG 73 2.565 11.198 -8.258
301 HD3 ARG 73 2HD ARG 73 1.492 10.698 -9.562
302 HH11 ARG 73 1HH1 ARG 73 2.349 12.127 -10.707
303 HH12 ARG 73 2HH1 ARG 73 2.123 13.724 -11.340
304 HH21 ARG 73 1HH2 ARG 73 0.066 14.791 -8.706
305 HH22 ARG 73 2HH2 ARG 73 0.831 15.241 -10.201
306 H ILE 74 H ILE 74 1.691 8.740 -11.398
307 HA ILE 74 HA ILE 74 4.444 7.801 -11.397
308 HB ILE 74 HB ILE 74 2.857 9.049 -13.664
309 HG12 ILE 74 1HG1 ILE 74 3.436 6.112 -13.215
310 HG13 ILE 74 2HG1 ILE 74 1.917 6.877 -12.766
311 HG21 ILE 74 1HG2 ILE 74 5.272 9.213 -13.980
312 HG22 ILE 74 2HG2 ILE 74 4.574 8.058 -15.115
313 HG23 ILE 74 3HG2 ILE 74 5.439 7.480 -13.692
314 HD11 ILE 74 3HD1 ILE 74 1.708 5.713 -14.879
315 HD12 ILE 74 1HD1 ILE 74 3.044 6.651 -15.550
316 HD13 ILE 74 2HD1 ILE 74 1.532 7.452 -15.118
317 H SER 75 H SER 75 5.430 9.237 -10.056
318 HA SER 75 HA SER 75 5.523 12.044 -10.885
319 HG SER 75 HG SER 75 4.570 12.498 -8.258
320 HB2 SER 75 1HB SER 75 6.709 10.723 -8.421
321 HB3 SER 75 2HB SER 75 6.646 12.455 -8.743
322 H LEU 76 H LEU 76 7.729 9.462 -9.862
323 HA LEU 76 HA LEU 76 9.645 10.368 -11.892
324 HG LEU 76 HG LEU 76 11.911 8.437 -10.818
325 HB2 LEU 76 1HB LEU 76 10.474 10.821 -9.651
326 HB3 LEU 76 2HB LEU 76 10.192 9.157 -9.183
327 HD11 LEU 76 1HD1 LEU 76 13.420 10.094 -11.771
328 HD12 LEU 76 2HD1 LEU 76 12.417 11.391 -11.119
329 HD13 LEU 76 3HD1 LEU 76 11.773 10.316 -12.360
330 HD21 LEU 76 3HD2 LEU 76 12.800 10.458 -8.781
331 HD22 LEU 76 1HD2 LEU 76 13.815 9.217 -9.517
332 HD23 LEU 76 2HD2 LEU 76 12.461 8.752 -8.486
333 H ASP 77 H ASP 77 9.185 9.024 -13.490
334 HA ASP 77 HA ASP 77 9.995 6.255 -13.222
335 HB2 ASP 77 1HB ASP 77 7.505 6.339 -12.693
336 HB3 ASP 77 2HB ASP 77 7.246 6.899 -14.338
337 H GLN 78 H GLN 78 10.695 8.856 -14.518
338 HA GLN 78 HA GLN 78 10.381 8.171 -17.363
339 HB2 GLN 78 1HB GLN 78 10.835 10.946 -16.254
340 HB3 GLN 78 2HB GLN 78 10.300 10.497 -17.866
341 HG2 GLN 78 1HG GLN 78 8.195 9.647 -16.907
342 HG3 GLN 78 2HG GLN 78 8.738 10.179 -15.315
343 HE21 GLN 78 2HE2 GLN 78 8.775 12.341 -14.826
344 HE22 GLN 78 1HE2 GLN 78 7.955 13.527 -15.791
345 H GLN 79 H GLN 79 12.173 9.301 -18.715
346 HA GLN 79 HA GLN 79 14.712 8.428 -17.629
347 HB2 GLN 79 1HB GLN 79 14.054 9.620 -20.338
348 HB3 GLN 79 2HB GLN 79 15.607 8.946 -19.875
349 HG2 GLN 79 1HG GLN 79 13.015 7.421 -20.082
350 HG3 GLN 79 2HG GLN 79 14.324 7.407 -21.262
351 HE21 GLN 79 2HE2 GLN 79 13.226 6.280 -18.187
352 HE22 GLN 79 1HE2 GLN 79 14.484 5.125 -17.920
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