Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
505678 | 2ytk RC | 10310 | cing | 1-original | 5 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 H GLY 1 -8.607 -30.088 -5.485
2 HA2 GLY 1 1HA GLY 1 -5.965 -30.293 -6.537
3 HA3 GLY 1 2HA GLY 1 -7.009 -29.390 -7.625
4 H SER 2 H SER 2 -5.174 -27.825 -6.977
5 HA SER 2 HA SER 2 -6.184 -26.194 -4.747
6 HB2 SER 2 1HB SER 2 -3.305 -26.878 -5.359
7 HB3 SER 2 2HB SER 2 -3.774 -25.545 -4.304
8 HG SER 2 HG SER 2 -3.900 -26.992 -2.798
9 H SER 3 H SER 3 -6.560 -24.135 -5.260
10 HA SER 3 HA SER 3 -5.728 -23.203 -7.908
11 HB2 SER 3 1HB SER 3 -7.924 -22.419 -6.015
12 HB3 SER 3 2HB SER 3 -7.403 -21.303 -7.278
13 HG SER 3 HG SER 3 -7.679 -23.433 -8.597
14 H GLY 4 H GLY 4 -3.939 -22.026 -8.014
15 HA2 GLY 4 1HA GLY 4 -3.223 -20.349 -5.694
16 HA3 GLY 4 2HA GLY 4 -2.071 -21.009 -6.846
17 H SER 5 H SER 5 -4.954 -18.911 -6.810
18 HA SER 5 HA SER 5 -3.553 -17.150 -8.714
19 HB2 SER 5 1HB SER 5 -5.635 -16.645 -9.792
20 HB3 SER 5 2HB SER 5 -5.527 -18.402 -9.675
21 HG SER 5 HG SER 5 -7.584 -17.594 -9.040
22 H SER 6 H SER 6 -3.322 -15.083 -8.134
23 HA SER 6 HA SER 6 -4.510 -14.232 -5.601
24 HB2 SER 6 1HB SER 6 -2.804 -12.569 -5.497
25 HB3 SER 6 2HB SER 6 -2.016 -14.045 -6.055
26 HG SER 6 HG SER 6 -1.809 -13.209 -8.037
27 H GLY 7 H GLY 7 -4.900 -11.718 -5.569
28 HA2 GLY 7 1HA GLY 7 -5.634 -9.873 -7.091
29 HA3 GLY 7 2HA GLY 7 -6.591 -11.097 -7.912
30 H SER 8 H SER 8 -8.374 -12.062 -6.763
31 HA SER 8 HA SER 8 -9.962 -10.171 -5.425
32 HB2 SER 8 1HB SER 8 -10.288 -13.181 -5.472
33 HB3 SER 8 2HB SER 8 -11.541 -12.008 -5.068
34 HG SER 8 HG SER 8 -11.522 -12.822 -7.295
35 H GLY 9 H GLY 9 -8.436 -13.139 -4.154
36 HA2 GLY 9 1HA GLY 9 -9.118 -12.715 -1.467
37 HA3 GLY 9 2HA GLY 9 -7.785 -13.712 -2.030
38 H GLU 10 H GLU 10 -5.867 -12.308 -2.878
39 HA GLU 10 HA GLU 10 -4.734 -11.000 -0.714
40 HB2 GLU 10 1HB GLU 10 -4.117 -10.954 -3.655
41 HB3 GLU 10 2HB GLU 10 -3.183 -9.988 -2.521
42 HG2 GLU 10 1HG GLU 10 -3.526 -12.975 -2.389
43 HG3 GLU 10 2HG GLU 10 -2.118 -12.134 -3.034
44 H LYS 11 H LYS 11 -4.032 -8.723 -0.571
45 HA LYS 11 HA LYS 11 -6.292 -6.976 -0.903
46 HB2 LYS 11 1HB LYS 11 -3.635 -6.826 0.427
47 HB3 LYS 11 2HB LYS 11 -4.402 -5.306 -0.015
48 HG2 LYS 11 1HG LYS 11 -5.157 -5.607 2.132
49 HG3 LYS 11 2HG LYS 11 -6.476 -6.308 1.190
50 HD2 LYS 11 1HD LYS 11 -4.252 -8.096 2.027
51 HD3 LYS 11 2HD LYS 11 -5.403 -7.573 3.259
52 HE2 LYS 11 1HE LYS 11 -7.221 -8.545 2.111
53 HE3 LYS 11 2HE LYS 11 -6.278 -8.753 0.636
54 HZ1 LYS 11 3HZ LYS 11 -4.851 -10.314 1.977
55 HZ2 LYS 11 1HZ LYS 11 -6.414 -10.861 1.629
56 HZ3 LYS 11 2HZ LYS 11 -6.049 -10.267 3.170
57 HA PRO 12 HA PRO 12 -5.233 -4.920 -4.631
58 HB2 PRO 12 1HB PRO 12 -5.925 -2.352 -4.085
59 HB3 PRO 12 2HB PRO 12 -7.115 -3.634 -4.339
60 HG2 PRO 12 1HG PRO 12 -6.090 -2.483 -1.773
61 HG3 PRO 12 2HG PRO 12 -7.753 -2.904 -2.226
62 HD2 PRO 12 1HD PRO 12 -6.217 -4.505 -0.674
63 HD3 PRO 12 2HD PRO 12 -7.438 -5.145 -1.792
64 H TYR 13 H TYR 13 -3.701 -4.039 -1.688
65 HA TYR 13 HA TYR 13 -1.670 -2.487 -3.149
66 HB2 TYR 13 1HB TYR 13 -2.173 -2.508 -0.169
67 HB3 TYR 13 2HB TYR 13 -1.090 -1.437 -1.050
68 HD1 TYR 13 HD2 TYR 13 -1.966 0.420 -2.359
69 HD2 TYR 13 HD1 TYR 13 -4.573 -2.153 -0.195
70 HE1 TYR 13 HE2 TYR 13 -3.786 2.054 -2.620
71 HE2 TYR 13 HE1 TYR 13 -6.401 -0.527 -0.450
72 HH TYR 13 HH TYR 13 -6.117 2.478 -1.052
73 H LYS 14 H LYS 14 0.172 -3.498 -3.540
74 HA LYS 14 HA LYS 14 1.293 -5.303 -1.542
75 HB2 LYS 14 1HB LYS 14 0.093 -6.838 -2.947
76 HB3 LYS 14 2HB LYS 14 0.728 -6.084 -4.404
77 HG2 LYS 14 1HG LYS 14 3.039 -6.774 -3.371
78 HG3 LYS 14 2HG LYS 14 2.049 -7.946 -2.497
79 HD2 LYS 14 1HD LYS 14 1.505 -9.103 -4.393
80 HD3 LYS 14 2HD LYS 14 1.629 -7.678 -5.428
81 HE2 LYS 14 1HE LYS 14 4.046 -7.765 -5.310
82 HE3 LYS 14 2HE LYS 14 3.969 -9.114 -4.177
83 HZ1 LYS 14 3HZ LYS 14 4.356 -10.137 -6.196
84 HZ2 LYS 14 1HZ LYS 14 3.352 -9.083 -7.059
85 HZ3 LYS 14 2HZ LYS 14 2.675 -10.265 -6.057
86 H CYS 15 H CYS 15 3.405 -4.961 -1.291
87 HA CYS 15 HA CYS 15 4.778 -2.950 -2.670
88 HB2 CYS 15 1HB CYS 15 5.381 -3.702 -0.403
89 HB3 CYS 15 2HB CYS 15 5.928 -5.240 -1.062
90 H ASN 16 H ASN 16 5.607 -2.931 -4.643
91 HA ASN 16 HA ASN 16 6.078 -5.463 -6.024
92 HB2 ASN 16 1HB ASN 16 5.759 -2.615 -6.939
93 HB3 ASN 16 2HB ASN 16 6.431 -3.840 -8.011
94 HD21 ASN 16 1HD2 ASN 16 5.122 -5.570 -8.671
95 HD22 ASN 16 2HD2 ASN 16 3.398 -5.474 -8.594
96 H GLU 17 H GLU 17 7.909 -4.706 -3.972
97 HA GLU 17 HA GLU 17 10.341 -4.333 -5.591
98 HB2 GLU 17 1HB GLU 17 9.501 -2.998 -3.069
99 HB3 GLU 17 2HB GLU 17 11.200 -3.421 -3.230
100 HG2 GLU 17 1HG GLU 17 9.712 -1.844 -5.307
101 HG3 GLU 17 2HG GLU 17 10.549 -1.096 -3.948
102 H CYS 18 H CYS 18 8.763 -5.919 -2.909
103 HA CYS 18 HA CYS 18 10.947 -7.889 -2.860
104 HB2 CYS 18 1HB CYS 18 10.734 -8.103 -0.444
105 HB3 CYS 18 2HB CYS 18 11.108 -6.436 -0.868
106 H GLY 19 H GLY 19 7.556 -7.228 -2.041
107 HA2 GLY 19 1HA GLY 19 5.966 -8.821 -3.140
108 HA3 GLY 19 2HA GLY 19 6.995 -10.094 -2.500
109 H LYS 20 H LYS 20 5.925 -7.132 -0.887
110 HA LYS 20 HA LYS 20 4.810 -8.788 1.255
111 HB2 LYS 20 1HB LYS 20 6.500 -6.805 1.554
112 HB3 LYS 20 2HB LYS 20 5.058 -5.807 1.416
113 HG2 LYS 20 1HG LYS 20 4.177 -6.563 3.398
114 HG3 LYS 20 2HG LYS 20 5.081 -8.078 3.346
115 HD2 LYS 20 1HD LYS 20 7.098 -6.998 3.975
116 HD3 LYS 20 2HD LYS 20 6.400 -5.397 3.715
117 HE2 LYS 20 1HE LYS 20 5.219 -5.444 5.678
118 HE3 LYS 20 2HE LYS 20 5.103 -7.203 5.692
119 HZ1 LYS 20 3HZ LYS 20 6.665 -6.994 7.277
120 HZ2 LYS 20 1HZ LYS 20 7.185 -5.475 6.741
121 HZ3 LYS 20 2HZ LYS 20 7.728 -6.877 5.966
122 H VAL 21 H VAL 21 2.854 -7.708 2.387
123 HA VAL 21 HA VAL 21 1.000 -6.524 0.453
124 HB VAL 21 HB VAL 21 0.378 -8.992 2.082
125 HG11 VAL 21 1HG1 VAL 21 -1.843 -8.894 1.147
126 HG12 VAL 21 2HG1 VAL 21 -1.497 -7.378 1.982
127 HG13 VAL 21 3HG1 VAL 21 -1.427 -7.452 0.221
128 HG21 VAL 21 3HG2 VAL 21 0.382 -10.211 0.122
129 HG22 VAL 21 1HG2 VAL 21 0.139 -8.786 -0.888
130 HG23 VAL 21 2HG2 VAL 21 1.714 -9.091 -0.157
131 H PHE 22 H PHE 22 -0.302 -5.011 1.314
132 HA PHE 22 HA PHE 22 -0.480 -4.845 4.248
133 HB2 PHE 22 1HB PHE 22 -0.189 -2.480 2.386
134 HB3 PHE 22 2HB PHE 22 -0.252 -2.435 4.144
135 HD1 PHE 22 HD1 PHE 22 1.795 -3.293 1.228
136 HD2 PHE 22 HD2 PHE 22 1.664 -2.993 5.472
137 HE1 PHE 22 HE1 PHE 22 4.246 -3.488 1.314
138 HE2 PHE 22 HE2 PHE 22 4.115 -3.186 5.564
139 HZ PHE 22 HZ PHE 22 5.410 -3.433 3.484
140 H THR 23 H THR 23 -2.316 -3.498 5.000
141 HA THR 23 HA THR 23 -4.690 -4.169 3.472
142 HB THR 23 HB THR 23 -4.748 -4.624 5.852
143 HG1 THR 23 HG1 THR 23 -6.773 -3.999 5.924
144 HG21 THR 23 3HG2 THR 23 -4.730 -2.752 7.484
145 HG22 THR 23 1HG2 THR 23 -4.261 -1.662 6.180
146 HG23 THR 23 2HG2 THR 23 -3.184 -2.972 6.665
147 H GLN 24 H GLN 24 -3.050 -1.275 4.678
148 HA GLN 24 HA GLN 24 -4.911 0.380 3.116
149 HB2 GLN 24 1HB GLN 24 -3.097 1.066 5.429
150 HB3 GLN 24 2HB GLN 24 -3.959 2.273 4.485
151 HG2 GLN 24 1HG GLN 24 -5.081 0.167 6.297
152 HG3 GLN 24 2HG GLN 24 -5.268 1.917 6.390
153 HE21 GLN 24 1HE2 GLN 24 -6.934 2.861 5.374
154 HE22 GLN 24 2HE2 GLN 24 -8.083 2.031 4.387
155 H ASN 25 H ASN 25 -3.780 2.489 2.329
156 HA ASN 25 HA ASN 25 -1.647 1.639 0.569
157 HB2 ASN 25 1HB ASN 25 -3.186 2.960 -0.572
158 HB3 ASN 25 2HB ASN 25 -3.386 4.072 0.779
159 HD21 ASN 25 1HD2 ASN 25 -1.169 3.044 -1.748
160 HD22 ASN 25 2HD2 ASN 25 -0.323 4.546 -1.871
161 H SER 26 H SER 26 -2.105 4.219 2.981
162 HA SER 26 HA SER 26 0.368 5.395 2.926
163 HB2 SER 26 1HB SER 26 -1.678 5.967 4.382
164 HB3 SER 26 2HB SER 26 -1.014 4.816 5.542
165 HG SER 26 HG SER 26 0.312 6.316 6.140
166 H HIS 27 H HIS 27 -0.515 2.299 4.276
167 HA HIS 27 HA HIS 27 1.853 1.889 5.792
168 HB2 HIS 27 1HB HIS 27 -0.134 -0.090 4.659
169 HB3 HIS 27 2HB HIS 27 1.146 -0.501 5.796
170 HD1 HIS 27 HD1 HIS 27 -0.198 -1.078 7.827
171 HD2 HIS 27 HD2 HIS 27 -1.288 2.580 6.186
172 HE1 HIS 27 HE1 HIS 27 -1.803 -0.056 9.471
173 H LEU 28 H LEU 28 0.822 0.745 2.584
174 HA LEU 28 HA LEU 28 3.154 -0.680 1.965
175 HB2 LEU 28 1HB LEU 28 1.277 -1.091 0.627
176 HB3 LEU 28 2HB LEU 28 1.032 0.622 0.293
177 HG LEU 28 HG LEU 28 3.065 0.598 -1.117
178 HD11 LEU 28 1HD1 LEU 28 3.555 -1.830 0.177
179 HD12 LEU 28 2HD1 LEU 28 4.492 -1.099 -1.125
180 HD13 LEU 28 3HD1 LEU 28 3.207 -2.247 -1.501
181 HD21 LEU 28 3HD2 LEU 28 2.076 -0.681 -2.972
182 HD22 LEU 28 1HD2 LEU 28 0.887 0.326 -2.145
183 HD23 LEU 28 2HD2 LEU 28 0.934 -1.412 -1.843
184 H THR 29 H THR 29 2.199 2.559 0.806
185 HA THR 29 HA THR 29 4.486 3.277 -0.511
186 HB THR 29 HB THR 29 2.514 4.706 -0.495
187 HG1 THR 29 HG1 THR 29 4.301 5.856 -1.055
188 HG21 THR 29 3HG2 THR 29 1.952 6.101 1.413
189 HG22 THR 29 1HG2 THR 29 3.283 5.411 2.340
190 HG23 THR 29 2HG2 THR 29 1.912 4.402 1.881
191 H ASN 30 H ASN 30 3.847 3.609 2.967
192 HA ASN 30 HA ASN 30 6.237 4.889 3.661
193 HB2 ASN 30 1HB ASN 30 4.702 4.940 5.381
194 HB3 ASN 30 2HB ASN 30 4.211 3.266 5.135
195 HD21 ASN 30 1HD2 ASN 30 4.991 1.783 6.463
196 HD22 ASN 30 2HD2 ASN 30 6.308 2.007 7.559
197 H HIS 31 H HIS 31 5.416 1.425 3.868
198 HA HIS 31 HA HIS 31 7.730 0.359 4.788
199 HB2 HIS 31 1HB HIS 31 5.976 -1.147 4.338
200 HB3 HIS 31 2HB HIS 31 5.855 -0.640 2.656
201 HD1 HIS 31 HD1 HIS 31 8.631 -2.161 4.786
202 HD2 HIS 31 HD2 HIS 31 6.845 -2.564 1.056
203 HE1 HIS 31 HE1 HIS 31 9.850 -4.049 3.657
204 H TRP 32 H TRP 32 7.079 0.957 1.331
205 HA TRP 32 HA TRP 32 9.312 0.192 0.098
206 HB2 TRP 32 1HB TRP 32 7.630 2.627 -0.239
207 HB3 TRP 32 2HB TRP 32 9.141 2.547 -1.140
208 HD1 TRP 32 HD1 TRP 32 5.997 0.321 -0.626
209 HE1 TRP 32 HE1 TRP 32 5.500 -0.864 -2.856
210 HE3 TRP 32 HE3 TRP 32 9.958 2.043 -3.361
211 HZ2 TRP 32 HZ2 TRP 32 6.636 -1.045 -5.433
212 HZ3 TRP 32 HZ3 TRP 32 10.180 1.316 -5.701
213 HH2 TRP 32 HH2 TRP 32 8.553 -0.197 -6.714
214 H ARG 33 H ARG 33 9.108 2.901 2.314
215 HA ARG 33 HA ARG 33 11.419 4.276 1.875
216 HB2 ARG 33 1HB ARG 33 10.066 3.504 4.449
217 HB3 ARG 33 2HB ARG 33 11.509 4.508 4.440
218 HG2 ARG 33 1HG ARG 33 10.263 6.057 2.878
219 HG3 ARG 33 2HG ARG 33 8.816 5.123 3.264
220 HD2 ARG 33 1HD ARG 33 8.651 6.764 4.844
221 HD3 ARG 33 2HD ARG 33 9.605 5.582 5.739
222 HE ARG 33 HE ARG 33 11.423 6.996 5.634
223 HH11 ARG 33 1HH1 ARG 33 8.874 8.169 3.573
224 HH12 ARG 33 2HH1 ARG 33 9.622 9.709 3.305
225 HH21 ARG 33 1HH2 ARG 33 12.417 9.020 5.289
226 HH22 ARG 33 2HH2 ARG 33 11.638 10.191 4.281
227 H ILE 34 H ILE 34 11.117 1.309 3.817
228 HA ILE 34 HA ILE 34 13.781 1.051 4.570
229 HB ILE 34 HB ILE 34 13.346 -1.281 4.976
230 HG12 ILE 34 1HG1 ILE 34 10.880 -1.999 4.232
231 HG13 ILE 34 2HG1 ILE 34 11.217 -0.854 2.938
232 HG21 ILE 34 1HG2 ILE 34 12.374 0.046 6.637
233 HG22 ILE 34 2HG2 ILE 34 11.076 0.585 5.573
234 HG23 ILE 34 3HG2 ILE 34 11.093 -1.073 6.174
235 HD11 ILE 34 3HD1 ILE 34 11.756 -3.203 2.381
236 HD12 ILE 34 1HD1 ILE 34 13.132 -2.108 2.248
237 HD13 ILE 34 2HD1 ILE 34 12.988 -3.179 3.642
238 H HIS 35 H HIS 35 12.199 0.270 1.551
239 HA HIS 35 HA HIS 35 14.383 -1.250 0.487
240 HB2 HIS 35 1HB HIS 35 11.905 -0.048 -0.738
241 HB3 HIS 35 2HB HIS 35 13.116 -0.886 -1.704
242 HD1 HIS 35 HD1 HIS 35 13.714 -3.340 -0.110
243 HD2 HIS 35 HD2 HIS 35 9.871 -1.801 -0.463
244 HE1 HIS 35 HE1 HIS 35 12.171 -5.268 0.368
245 H THR 36 H THR 36 13.241 2.081 0.178
246 HA THR 36 HA THR 36 15.301 2.802 -1.698
247 HB THR 36 HB THR 36 14.482 5.144 -1.296
248 HG1 THR 36 HG1 THR 36 13.479 5.316 0.576
249 HG21 THR 36 3HG2 THR 36 12.095 3.444 -1.862
250 HG22 THR 36 1HG2 THR 36 13.494 3.338 -2.930
251 HG23 THR 36 2HG2 THR 36 12.675 4.883 -2.700
252 H GLY 37 H GLY 37 17.173 2.142 -0.480
253 HA2 GLY 37 1HA GLY 37 19.104 2.992 0.540
254 HA3 GLY 37 2HA GLY 37 18.145 4.300 1.217
255 H GLU 38 H GLU 38 19.178 3.953 3.242
256 HA GLU 38 HA GLU 38 19.094 3.236 5.409
257 HB2 GLU 38 1HB GLU 38 16.630 2.813 4.793
258 HB3 GLU 38 2HB GLU 38 17.099 1.128 4.618
259 HG2 GLU 38 1HG GLU 38 16.117 1.700 6.825
260 HG3 GLU 38 2HG GLU 38 17.723 0.979 6.908
261 H LYS 39 H LYS 39 21.144 2.377 3.917
262 HA LYS 39 HA LYS 39 22.798 0.821 3.781
263 HB2 LYS 39 1HB LYS 39 21.348 0.029 6.276
264 HB3 LYS 39 2HB LYS 39 22.620 -1.015 5.656
265 HG2 LYS 39 1HG LYS 39 24.185 0.885 5.738
266 HG3 LYS 39 2HG LYS 39 22.905 1.880 6.436
267 HD2 LYS 39 1HD LYS 39 23.834 -0.702 7.675
268 HD3 LYS 39 2HD LYS 39 24.543 0.864 8.074
269 HE2 LYS 39 1HE LYS 39 21.582 0.480 8.224
270 HE3 LYS 39 2HE LYS 39 22.611 -0.103 9.531
271 HZ1 LYS 39 3HZ LYS 39 22.953 2.652 8.582
272 HZ2 LYS 39 1HZ LYS 39 23.214 2.005 10.123
273 HZ3 LYS 39 2HZ LYS 39 21.637 2.296 9.584
274 HA PRO 40 HA PRO 40 19.711 -2.123 1.748
275 HB2 PRO 40 1HB PRO 40 20.169 -1.347 -0.813
276 HB3 PRO 40 2HB PRO 40 18.935 -0.602 0.210
277 HG2 PRO 40 1HG PRO 40 21.697 0.358 -0.429
278 HG3 PRO 40 2HG PRO 40 20.183 1.277 -0.353
279 HD2 PRO 40 1HD PRO 40 21.992 1.281 1.662
280 HD3 PRO 40 2HD PRO 40 20.246 1.433 1.946
281 H SER 41 H SER 41 23.007 -1.391 1.742
282 HA SER 41 HA SER 41 23.719 -3.642 0.016
283 HB2 SER 41 1HB SER 41 24.953 -1.561 -0.340
284 HB3 SER 41 2HB SER 41 25.456 -1.550 1.350
285 HG SER 41 HG SER 41 26.317 -3.777 0.710
286 H GLY 42 H GLY 42 23.170 -5.411 1.278
287 HA2 GLY 42 1HA GLY 42 25.129 -6.280 3.136
288 HA3 GLY 42 2HA GLY 42 23.677 -5.774 3.987
289 HA PRO 43 HA PRO 43 23.246 -10.255 2.841
290 HB2 PRO 43 1HB PRO 43 22.453 -11.060 5.310
291 HB3 PRO 43 2HB PRO 43 24.152 -10.946 4.837
292 HG2 PRO 43 1HG PRO 43 22.490 -9.016 6.410
293 HG3 PRO 43 2HG PRO 43 24.155 -9.553 6.699
294 HD2 PRO 43 1HD PRO 43 23.572 -7.180 5.531
295 HD3 PRO 43 2HD PRO 43 25.027 -8.113 5.124
296 H SER 44 H SER 44 21.401 -10.705 1.833
297 HA SER 44 HA SER 44 19.025 -9.303 2.071
298 HB2 SER 44 1HB SER 44 19.656 -10.801 0.167
299 HB3 SER 44 2HB SER 44 19.278 -12.187 1.190
300 HG SER 44 HG SER 44 17.603 -11.063 -0.327
301 H SER 45 H SER 45 17.207 -9.483 3.276
302 HA SER 45 HA SER 45 17.356 -11.231 5.609
303 HB2 SER 45 1HB SER 45 15.514 -9.850 6.495
304 HB3 SER 45 2HB SER 45 16.883 -8.856 5.997
305 HG SER 45 HG SER 45 14.349 -8.769 5.139
306 H GLY 46 H GLY 46 15.090 -10.414 2.993
307 HA2 GLY 46 1HA GLY 46 13.396 -11.628 2.031
308 HA3 GLY 46 2HA GLY 46 14.211 -13.062 2.638
Start of MODEL 2
1 H1 GLY 1 H GLY 1 -10.413 -10.995 -12.348
2 HA2 GLY 1 1HA GLY 1 -12.312 -10.889 -13.880
3 HA3 GLY 1 2HA GLY 1 -12.485 -12.626 -13.679
4 H SER 2 H SER 2 -14.746 -11.499 -13.315
5 HA SER 2 HA SER 2 -15.069 -11.269 -10.397
6 HB2 SER 2 1HB SER 2 -15.323 -9.073 -11.702
7 HB3 SER 2 2HB SER 2 -16.805 -9.770 -12.357
8 HG SER 2 HG SER 2 -16.463 -9.868 -9.596
9 H SER 3 H SER 3 -15.713 -13.391 -10.148
10 HA SER 3 HA SER 3 -18.121 -14.232 -11.610
11 HB2 SER 3 1HB SER 3 -17.521 -16.517 -11.029
12 HB3 SER 3 2HB SER 3 -16.134 -15.720 -11.771
13 HG SER 3 HG SER 3 -16.575 -16.190 -9.008
14 H GLY 4 H GLY 4 -19.629 -15.656 -10.314
15 HA2 GLY 4 1HA GLY 4 -20.446 -14.199 -7.977
16 HA3 GLY 4 2HA GLY 4 -21.254 -15.597 -8.671
17 H SER 5 H SER 5 -17.944 -15.220 -7.435
18 HA SER 5 HA SER 5 -18.474 -16.714 -5.052
19 HB2 SER 5 1HB SER 5 -17.126 -18.061 -7.388
20 HB3 SER 5 2HB SER 5 -16.844 -18.581 -5.727
21 HG SER 5 HG SER 5 -18.656 -19.557 -7.080
22 H SER 6 H SER 6 -17.072 -16.069 -3.557
23 HA SER 6 HA SER 6 -14.560 -14.824 -4.457
24 HB2 SER 6 1HB SER 6 -16.479 -14.186 -2.270
25 HB3 SER 6 2HB SER 6 -14.769 -13.880 -1.966
26 HG SER 6 HG SER 6 -15.807 -13.006 -4.397
27 H GLY 7 H GLY 7 -12.634 -15.496 -3.650
28 HA2 GLY 7 1HA GLY 7 -12.668 -17.502 -1.496
29 HA3 GLY 7 2HA GLY 7 -11.838 -17.859 -3.003
30 H SER 8 H SER 8 -9.940 -16.701 -3.537
31 HA SER 8 HA SER 8 -8.105 -16.342 -1.539
32 HB2 SER 8 1HB SER 8 -6.825 -14.933 -3.198
33 HB3 SER 8 2HB SER 8 -7.363 -16.495 -3.815
34 HG SER 8 HG SER 8 -9.059 -15.446 -4.868
35 H GLY 9 H GLY 9 -7.086 -14.449 -0.635
36 HA2 GLY 9 1HA GLY 9 -8.870 -12.100 -0.504
37 HA3 GLY 9 2HA GLY 9 -8.184 -12.804 0.952
38 H GLU 10 H GLU 10 -7.240 -11.396 -2.172
39 HA GLU 10 HA GLU 10 -4.680 -10.588 -1.009
40 HB2 GLU 10 1HB GLU 10 -4.076 -9.973 -3.331
41 HB3 GLU 10 2HB GLU 10 -4.538 -11.661 -3.170
42 HG2 GLU 10 1HG GLU 10 -6.717 -11.193 -4.098
43 HG3 GLU 10 2HG GLU 10 -6.344 -9.472 -4.171
44 H LYS 11 H LYS 11 -4.081 -8.493 -0.707
45 HA LYS 11 HA LYS 11 -6.215 -6.528 -0.691
46 HB2 LYS 11 1HB LYS 11 -3.397 -6.565 0.367
47 HB3 LYS 11 2HB LYS 11 -4.348 -5.086 0.338
48 HG2 LYS 11 1HG LYS 11 -5.778 -5.807 1.969
49 HG3 LYS 11 2HG LYS 11 -5.533 -7.512 1.584
50 HD2 LYS 11 1HD LYS 11 -3.070 -6.951 2.396
51 HD3 LYS 11 2HD LYS 11 -3.921 -5.693 3.295
52 HE2 LYS 11 1HE LYS 11 -4.030 -7.388 4.818
53 HE3 LYS 11 2HE LYS 11 -5.511 -7.710 3.916
54 HZ1 LYS 11 3HZ LYS 11 -3.904 -9.174 2.495
55 HZ2 LYS 11 1HZ LYS 11 -4.560 -9.768 3.937
56 HZ3 LYS 11 2HZ LYS 11 -2.974 -9.180 3.908
57 HA PRO 12 HA PRO 12 -5.117 -4.414 -4.381
58 HB2 PRO 12 1HB PRO 12 -5.794 -1.867 -3.728
59 HB3 PRO 12 2HB PRO 12 -6.992 -3.127 -4.051
60 HG2 PRO 12 1HG PRO 12 -5.985 -2.099 -1.426
61 HG3 PRO 12 2HG PRO 12 -7.646 -2.485 -1.914
62 HD2 PRO 12 1HD PRO 12 -6.139 -4.166 -0.419
63 HD3 PRO 12 2HD PRO 12 -7.353 -4.746 -1.577
64 H TYR 13 H TYR 13 -3.382 -4.106 -1.571
65 HA TYR 13 HA TYR 13 -1.393 -2.375 -2.884
66 HB2 TYR 13 1HB TYR 13 -1.988 -2.485 0.080
67 HB3 TYR 13 2HB TYR 13 -0.765 -1.484 -0.694
68 HD1 TYR 13 HD2 TYR 13 -1.412 0.474 -2.011
69 HD2 TYR 13 HD1 TYR 13 -4.327 -1.891 -0.009
70 HE1 TYR 13 HE2 TYR 13 -3.060 2.277 -2.294
71 HE2 TYR 13 HE1 TYR 13 -5.984 -0.095 -0.287
72 HH TYR 13 HH TYR 13 -6.217 1.929 -2.093
73 H LYS 14 H LYS 14 0.218 -3.661 -3.488
74 HA LYS 14 HA LYS 14 1.465 -5.379 -1.486
75 HB2 LYS 14 1HB LYS 14 0.086 -6.985 -2.547
76 HB3 LYS 14 2HB LYS 14 0.409 -6.323 -4.144
77 HG2 LYS 14 1HG LYS 14 2.657 -7.156 -4.099
78 HG3 LYS 14 2HG LYS 14 2.475 -7.674 -2.422
79 HD2 LYS 14 1HD LYS 14 1.111 -9.454 -2.982
80 HD3 LYS 14 2HD LYS 14 0.604 -8.719 -4.505
81 HE2 LYS 14 1HE LYS 14 3.392 -9.724 -3.952
82 HE3 LYS 14 2HE LYS 14 2.142 -10.671 -4.757
83 HZ1 LYS 14 3HZ LYS 14 3.880 -9.189 -6.075
84 HZ2 LYS 14 1HZ LYS 14 2.679 -8.021 -5.840
85 HZ3 LYS 14 2HZ LYS 14 2.310 -9.463 -6.642
86 H CYS 15 H CYS 15 3.529 -4.817 -1.419
87 HA CYS 15 HA CYS 15 4.800 -3.228 -3.361
88 HB2 CYS 15 1HB CYS 15 5.523 -3.239 -1.031
89 HB3 CYS 15 2HB CYS 15 5.999 -4.929 -1.164
90 H ASN 16 H ASN 16 5.989 -3.695 -5.118
91 HA ASN 16 HA ASN 16 6.092 -6.476 -5.973
92 HB2 ASN 16 1HB ASN 16 5.279 -4.956 -7.632
93 HB3 ASN 16 2HB ASN 16 6.646 -3.870 -7.396
94 HD21 ASN 16 1HD2 ASN 16 5.666 -7.005 -8.618
95 HD22 ASN 16 2HD2 ASN 16 7.000 -7.212 -9.696
96 H GLU 17 H GLU 17 8.197 -3.948 -4.861
97 HA GLU 17 HA GLU 17 10.659 -4.747 -5.825
98 HB2 GLU 17 1HB GLU 17 10.110 -2.711 -4.405
99 HB3 GLU 17 2HB GLU 17 10.214 -3.771 -3.006
100 HG2 GLU 17 1HG GLU 17 12.325 -2.919 -3.037
101 HG3 GLU 17 2HG GLU 17 12.555 -4.366 -4.017
102 H CYS 18 H CYS 18 9.243 -5.687 -2.686
103 HA CYS 18 HA CYS 18 11.016 -8.034 -2.681
104 HB2 CYS 18 1HB CYS 18 10.589 -8.126 -0.251
105 HB3 CYS 18 2HB CYS 18 11.287 -6.586 -0.741
106 H GLY 19 H GLY 19 7.673 -7.035 -2.005
107 HA2 GLY 19 1HA GLY 19 5.951 -8.478 -3.079
108 HA3 GLY 19 2HA GLY 19 6.863 -9.843 -2.452
109 H LYS 20 H LYS 20 6.007 -6.803 -0.843
110 HA LYS 20 HA LYS 20 4.877 -8.344 1.360
111 HB2 LYS 20 1HB LYS 20 6.516 -6.265 1.470
112 HB3 LYS 20 2HB LYS 20 5.009 -5.362 1.387
113 HG2 LYS 20 1HG LYS 20 5.208 -5.537 3.639
114 HG3 LYS 20 2HG LYS 20 4.325 -7.033 3.321
115 HD2 LYS 20 1HD LYS 20 6.757 -8.011 3.045
116 HD3 LYS 20 2HD LYS 20 7.186 -6.626 4.052
117 HE2 LYS 20 1HE LYS 20 4.891 -8.319 4.893
118 HE3 LYS 20 2HE LYS 20 6.517 -8.968 5.096
119 HZ1 LYS 20 3HZ LYS 20 5.180 -6.888 6.563
120 HZ2 LYS 20 1HZ LYS 20 6.741 -6.458 6.073
121 HZ3 LYS 20 2HZ LYS 20 6.500 -7.847 7.007
122 H VAL 21 H VAL 21 2.826 -7.719 2.323
123 HA VAL 21 HA VAL 21 0.947 -6.545 0.380
124 HB VAL 21 HB VAL 21 0.411 -8.901 2.194
125 HG11 VAL 21 1HG1 VAL 21 -1.744 -8.413 1.999
126 HG12 VAL 21 2HG1 VAL 21 -1.359 -6.999 1.016
127 HG13 VAL 21 3HG1 VAL 21 -1.607 -8.567 0.248
128 HG21 VAL 21 3HG2 VAL 21 1.822 -9.343 0.167
129 HG22 VAL 21 1HG2 VAL 21 0.303 -10.238 0.224
130 HG23 VAL 21 2HG2 VAL 21 0.454 -8.823 -0.818
131 H PHE 22 H PHE 22 -0.519 -5.113 1.157
132 HA PHE 22 HA PHE 22 -0.785 -4.794 4.055
133 HB2 PHE 22 1HB PHE 22 -0.392 -2.378 2.307
134 HB3 PHE 22 2HB PHE 22 -0.269 -2.500 4.059
135 HD1 PHE 22 HD1 PHE 22 1.377 -3.475 0.891
136 HD2 PHE 22 HD2 PHE 22 1.782 -2.946 5.095
137 HE1 PHE 22 HE1 PHE 22 3.810 -3.780 0.691
138 HE2 PHE 22 HE2 PHE 22 4.216 -3.250 4.901
139 HZ PHE 22 HZ PHE 22 5.233 -3.667 2.698
140 H THR 23 H THR 23 -2.650 -3.521 4.687
141 HA THR 23 HA THR 23 -4.878 -3.974 2.879
142 HB THR 23 HB THR 23 -5.165 -4.636 5.204
143 HG1 THR 23 HG1 THR 23 -7.169 -3.729 5.436
144 HG21 THR 23 3HG2 THR 23 -4.666 -1.720 5.800
145 HG22 THR 23 1HG2 THR 23 -3.706 -3.099 6.334
146 HG23 THR 23 2HG2 THR 23 -5.338 -2.865 6.961
147 H GLN 24 H GLN 24 -3.252 -1.272 4.472
148 HA GLN 24 HA GLN 24 -4.859 0.579 2.839
149 HB2 GLN 24 1HB GLN 24 -3.445 1.061 5.466
150 HB3 GLN 24 2HB GLN 24 -4.256 2.307 4.526
151 HG2 GLN 24 1HG GLN 24 -5.776 -0.122 5.335
152 HG3 GLN 24 2HG GLN 24 -5.461 1.140 6.525
153 HE21 GLN 24 1HE2 GLN 24 -7.736 1.464 6.620
154 HE22 GLN 24 2HE2 GLN 24 -8.542 2.391 5.405
155 H ASN 25 H ASN 25 -3.813 2.327 1.816
156 HA ASN 25 HA ASN 25 -1.361 1.729 0.613
157 HB2 ASN 25 1HB ASN 25 -3.171 3.312 -0.226
158 HB3 ASN 25 2HB ASN 25 -2.499 4.512 0.874
159 HD21 ASN 25 1HD2 ASN 25 -0.056 4.761 0.651
160 HD22 ASN 25 2HD2 ASN 25 0.548 4.853 -0.965
161 H SER 26 H SER 26 -2.124 4.035 3.210
162 HA SER 26 HA SER 26 0.265 5.239 3.646
163 HB2 SER 26 1HB SER 26 -1.618 5.802 5.024
164 HB3 SER 26 2HB SER 26 -1.683 4.175 5.700
165 HG SER 26 HG SER 26 0.080 4.583 6.899
166 H HIS 27 H HIS 27 -0.601 1.943 4.520
167 HA HIS 27 HA HIS 27 1.757 1.403 6.020
168 HB2 HIS 27 1HB HIS 27 -0.039 -0.586 4.620
169 HB3 HIS 27 2HB HIS 27 1.059 -0.912 5.957
170 HD1 HIS 27 HD1 HIS 27 -1.747 -1.725 6.437
171 HD2 HIS 27 HD2 HIS 27 -0.421 2.134 7.221
172 HE1 HIS 27 HE1 HIS 27 -3.368 -0.785 8.113
173 H LEU 28 H LEU 28 0.823 0.921 2.649
174 HA LEU 28 HA LEU 28 3.186 -0.497 1.922
175 HB2 LEU 28 1HB LEU 28 1.283 -0.827 0.569
176 HB3 LEU 28 2HB LEU 28 1.043 0.906 0.353
177 HG LEU 28 HG LEU 28 3.130 0.959 -1.008
178 HD11 LEU 28 1HD1 LEU 28 3.466 -1.623 0.046
179 HD12 LEU 28 2HD1 LEU 28 4.495 -0.783 -1.114
180 HD13 LEU 28 3HD1 LEU 28 3.188 -1.821 -1.684
181 HD21 LEU 28 3HD2 LEU 28 2.096 -0.336 -2.951
182 HD22 LEU 28 1HD2 LEU 28 1.133 0.956 -2.234
183 HD23 LEU 28 2HD2 LEU 28 0.786 -0.727 -1.836
184 H THR 29 H THR 29 2.099 2.744 0.900
185 HA THR 29 HA THR 29 4.327 3.709 -0.276
186 HB THR 29 HB THR 29 2.323 5.064 -0.093
187 HG1 THR 29 HG1 THR 29 4.369 6.507 1.243
188 HG21 THR 29 3HG2 THR 29 1.387 5.804 1.846
189 HG22 THR 29 1HG2 THR 29 2.939 5.949 2.669
190 HG23 THR 29 2HG2 THR 29 2.182 4.367 2.485
191 H ASN 30 H ASN 30 3.804 3.421 3.202
192 HA ASN 30 HA ASN 30 6.192 4.764 3.964
193 HB2 ASN 30 1HB ASN 30 4.171 3.055 5.348
194 HB3 ASN 30 2HB ASN 30 5.719 3.329 6.142
195 HD21 ASN 30 1HD2 ASN 30 6.229 5.358 6.896
196 HD22 ASN 30 2HD2 ASN 30 5.068 6.631 7.011
197 H HIS 31 H HIS 31 5.323 1.323 3.721
198 HA HIS 31 HA HIS 31 7.599 0.113 4.598
199 HB2 HIS 31 1HB HIS 31 5.876 -1.330 3.948
200 HB3 HIS 31 2HB HIS 31 5.725 -0.588 2.358
201 HD1 HIS 31 HD1 HIS 31 7.813 -3.042 4.278
202 HD2 HIS 31 HD2 HIS 31 7.406 -1.616 0.397
203 HE1 HIS 31 HE1 HIS 31 9.189 -4.586 2.846
204 H TRP 32 H TRP 32 7.044 0.994 1.184
205 HA TRP 32 HA TRP 32 9.341 0.375 -0.015
206 HB2 TRP 32 1HB TRP 32 7.600 2.782 -0.253
207 HB3 TRP 32 2HB TRP 32 9.142 2.799 -1.104
208 HD1 TRP 32 HD1 TRP 32 6.037 0.476 -0.846
209 HE1 TRP 32 HE1 TRP 32 5.649 -0.579 -3.161
210 HE3 TRP 32 HE3 TRP 32 10.056 2.444 -3.318
211 HZ2 TRP 32 HZ2 TRP 32 6.884 -0.578 -5.699
212 HZ3 TRP 32 HZ3 TRP 32 10.382 1.866 -5.687
213 HH2 TRP 32 HH2 TRP 32 8.828 0.386 -6.852
214 H ARG 33 H ARG 33 8.982 2.896 2.388
215 HA ARG 33 HA ARG 33 11.191 4.430 2.165
216 HB2 ARG 33 1HB ARG 33 10.039 3.183 4.660
217 HB3 ARG 33 2HB ARG 33 11.305 4.403 4.700
218 HG2 ARG 33 1HG ARG 33 8.845 5.008 3.156
219 HG3 ARG 33 2HG ARG 33 8.750 5.026 4.918
220 HD2 ARG 33 1HD ARG 33 9.359 7.192 4.562
221 HD3 ARG 33 2HD ARG 33 10.960 6.459 4.653
222 HE ARG 33 HE ARG 33 10.247 6.353 2.000
223 HH11 ARG 33 1HH1 ARG 33 10.666 8.841 4.399
224 HH12 ARG 33 2HH1 ARG 33 11.143 10.049 3.252
225 HH21 ARG 33 1HH2 ARG 33 10.874 7.934 0.480
226 HH22 ARG 33 2HH2 ARG 33 11.261 9.532 1.023
227 H ILE 34 H ILE 34 11.154 1.240 3.753
228 HA ILE 34 HA ILE 34 13.869 1.095 4.360
229 HB ILE 34 HB ILE 34 13.592 -1.322 4.492
230 HG12 ILE 34 1HG1 ILE 34 11.060 -2.019 3.965
231 HG13 ILE 34 2HG1 ILE 34 11.233 -0.731 2.778
232 HG21 ILE 34 1HG2 ILE 34 11.592 0.524 5.655
233 HG22 ILE 34 2HG2 ILE 34 11.293 -1.203 5.838
234 HG23 ILE 34 3HG2 ILE 34 12.790 -0.498 6.448
235 HD11 ILE 34 3HD1 ILE 34 11.753 -2.817 1.742
236 HD12 ILE 34 1HD1 ILE 34 13.243 -1.888 1.904
237 HD13 ILE 34 2HD1 ILE 34 12.907 -3.217 3.014
238 H HIS 35 H HIS 35 12.162 0.425 1.372
239 HA HIS 35 HA HIS 35 14.363 -0.838 0.061
240 HB2 HIS 35 1HB HIS 35 11.751 0.317 -0.893
241 HB3 HIS 35 2HB HIS 35 12.955 -0.290 -2.026
242 HD1 HIS 35 HD1 HIS 35 13.840 -2.866 -0.805
243 HD2 HIS 35 HD2 HIS 35 9.878 -1.619 -0.731
244 HE1 HIS 35 HE1 HIS 35 12.482 -4.960 -0.496
245 H THR 36 H THR 36 13.083 2.448 0.181
246 HA THR 36 HA THR 36 14.979 3.453 -1.740
247 HB THR 36 HB THR 36 14.091 5.680 -1.146
248 HG1 THR 36 HG1 THR 36 13.636 5.253 1.070
249 HG21 THR 36 3HG2 THR 36 12.695 3.541 -2.351
250 HG22 THR 36 1HG2 THR 36 12.472 5.269 -2.620
251 HG23 THR 36 2HG2 THR 36 11.523 4.439 -1.387
252 H GLY 37 H GLY 37 16.961 2.771 -0.743
253 HA2 GLY 37 1HA GLY 37 18.491 4.633 0.449
254 HA3 GLY 37 2HA GLY 37 17.679 3.905 1.827
255 H GLU 38 H GLU 38 17.616 1.262 1.184
256 HA GLU 38 HA GLU 38 20.365 0.522 1.602
257 HB2 GLU 38 1HB GLU 38 18.242 -0.509 2.679
258 HB3 GLU 38 2HB GLU 38 18.121 -1.429 1.186
259 HG2 GLU 38 1HG GLU 38 20.200 -2.497 1.570
260 HG3 GLU 38 2HG GLU 38 20.586 -1.408 2.902
261 H LYS 39 H LYS 39 20.174 1.668 -0.873
262 HA LYS 39 HA LYS 39 20.746 -0.621 -2.622
263 HB2 LYS 39 1HB LYS 39 18.462 0.440 -3.060
264 HB3 LYS 39 2HB LYS 39 19.345 1.852 -3.625
265 HG2 LYS 39 1HG LYS 39 20.132 0.783 -5.498
266 HG3 LYS 39 2HG LYS 39 19.991 -0.820 -4.774
267 HD2 LYS 39 1HD LYS 39 17.461 -0.401 -4.811
268 HD3 LYS 39 2HD LYS 39 17.829 0.925 -5.917
269 HE2 LYS 39 1HE LYS 39 18.988 -0.681 -7.395
270 HE3 LYS 39 2HE LYS 39 18.515 -1.987 -6.309
271 HZ1 LYS 39 3HZ LYS 39 16.149 -0.986 -6.742
272 HZ2 LYS 39 1HZ LYS 39 16.841 -2.083 -7.828
273 HZ3 LYS 39 2HZ LYS 39 16.873 -0.425 -8.164
274 HA PRO 40 HA PRO 40 24.040 2.753 -2.534
275 HB2 PRO 40 1HB PRO 40 26.034 1.208 -1.529
276 HB3 PRO 40 2HB PRO 40 24.920 2.124 -0.506
277 HG2 PRO 40 1HG PRO 40 24.869 -0.778 -1.236
278 HG3 PRO 40 2HG PRO 40 24.579 -0.015 0.338
279 HD2 PRO 40 1HD PRO 40 22.566 -0.855 -1.266
280 HD3 PRO 40 2HD PRO 40 22.409 0.552 -0.195
281 H SER 41 H SER 41 23.285 -0.050 -4.097
282 HA SER 41 HA SER 41 25.771 -0.314 -5.584
283 HB2 SER 41 1HB SER 41 24.879 -2.291 -6.492
284 HB3 SER 41 2HB SER 41 24.241 -2.262 -4.849
285 HG SER 41 HG SER 41 22.335 -1.244 -5.811
286 H GLY 42 H GLY 42 25.893 -0.100 -7.876
287 HA2 GLY 42 1HA GLY 42 25.003 0.573 -9.985
288 HA3 GLY 42 2HA GLY 42 23.718 1.420 -9.136
289 HA PRO 43 HA PRO 43 27.235 4.316 -10.433
290 HB2 PRO 43 1HB PRO 43 25.871 5.693 -12.333
291 HB3 PRO 43 2HB PRO 43 26.814 4.242 -12.690
292 HG2 PRO 43 1HG PRO 43 23.863 4.530 -12.283
293 HG3 PRO 43 2HG PRO 43 24.737 3.585 -13.503
294 HD2 PRO 43 1HD PRO 43 23.677 2.465 -11.277
295 HD3 PRO 43 2HD PRO 43 25.157 1.853 -12.041
296 H SER 44 H SER 44 24.281 4.328 -8.967
297 HA SER 44 HA SER 44 24.650 7.075 -8.045
298 HB2 SER 44 1HB SER 44 23.005 7.278 -9.840
299 HB3 SER 44 2HB SER 44 22.021 6.011 -9.107
300 HG SER 44 HG SER 44 21.370 8.225 -8.632
301 H SER 45 H SER 45 23.420 7.542 -6.070
302 HA SER 45 HA SER 45 22.269 5.337 -4.616
303 HB2 SER 45 1HB SER 45 24.578 4.824 -4.174
304 HB3 SER 45 2HB SER 45 24.932 6.507 -3.784
305 HG SER 45 HG SER 45 24.028 6.271 -1.864
306 H GLY 46 H GLY 46 20.886 6.023 -3.058
307 HA2 GLY 46 1HA GLY 46 20.061 8.709 -3.027
308 HA3 GLY 46 2HA GLY 46 19.572 7.481 -1.869
Start of MODEL 3
1 H1 GLY 1 H GLY 1 -13.733 -31.438 -14.662
2 HA2 GLY 1 1HA GLY 1 -13.266 -28.580 -14.679
3 HA3 GLY 1 2HA GLY 1 -14.416 -29.121 -13.465
4 H SER 2 H SER 2 -11.764 -27.887 -13.153
5 HA SER 2 HA SER 2 -10.419 -30.059 -11.683
6 HB2 SER 2 1HB SER 2 -9.257 -27.605 -13.014
7 HB3 SER 2 2HB SER 2 -8.343 -28.638 -11.915
8 HG SER 2 HG SER 2 -7.991 -29.859 -13.575
9 H SER 3 H SER 3 -9.824 -29.728 -9.577
10 HA SER 3 HA SER 3 -10.492 -27.131 -8.372
11 HB2 SER 3 1HB SER 3 -12.252 -29.036 -8.062
12 HB3 SER 3 2HB SER 3 -11.089 -29.682 -6.904
13 HG SER 3 HG SER 3 -11.232 -27.749 -5.750
14 H GLY 4 H GLY 4 -8.578 -26.375 -7.720
15 HA2 GLY 4 1HA GLY 4 -7.069 -27.901 -5.771
16 HA3 GLY 4 2HA GLY 4 -6.218 -27.587 -7.276
17 H SER 5 H SER 5 -7.093 -25.023 -7.849
18 HA SER 5 HA SER 5 -5.613 -23.525 -5.833
19 HB2 SER 5 1HB SER 5 -5.563 -21.725 -7.504
20 HB3 SER 5 2HB SER 5 -4.998 -23.243 -8.201
21 HG SER 5 HG SER 5 -6.885 -23.449 -9.301
22 H SER 6 H SER 6 -6.781 -22.803 -4.176
23 HA SER 6 HA SER 6 -9.187 -21.242 -4.751
24 HB2 SER 6 1HB SER 6 -10.481 -22.318 -3.022
25 HB3 SER 6 2HB SER 6 -9.884 -23.567 -4.114
26 HG SER 6 HG SER 6 -9.658 -23.767 -1.657
27 H GLY 7 H GLY 7 -9.063 -19.325 -3.793
28 HA2 GLY 7 1HA GLY 7 -8.698 -18.601 -1.253
29 HA3 GLY 7 2HA GLY 7 -7.036 -18.884 -1.750
30 H SER 8 H SER 8 -9.302 -16.553 -1.357
31 HA SER 8 HA SER 8 -8.150 -14.859 -3.475
32 HB2 SER 8 1HB SER 8 -10.564 -15.173 -3.742
33 HB3 SER 8 2HB SER 8 -10.833 -14.612 -2.092
34 HG SER 8 HG SER 8 -10.689 -12.633 -2.771
35 H GLY 9 H GLY 9 -6.692 -15.202 -1.169
36 HA2 GLY 9 1HA GLY 9 -7.258 -12.896 0.543
37 HA3 GLY 9 2HA GLY 9 -6.068 -14.151 0.855
38 H GLU 10 H GLU 10 -6.758 -11.506 -1.424
39 HA GLU 10 HA GLU 10 -3.940 -10.732 -1.260
40 HB2 GLU 10 1HB GLU 10 -5.444 -11.084 -3.858
41 HB3 GLU 10 2HB GLU 10 -3.831 -10.404 -3.700
42 HG2 GLU 10 1HG GLU 10 -2.942 -12.489 -2.968
43 HG3 GLU 10 2HG GLU 10 -4.553 -13.193 -2.843
44 H LYS 11 H LYS 11 -3.927 -8.704 -0.577
45 HA LYS 11 HA LYS 11 -6.201 -6.983 -0.836
46 HB2 LYS 11 1HB LYS 11 -3.511 -6.816 0.424
47 HB3 LYS 11 2HB LYS 11 -4.321 -5.301 0.047
48 HG2 LYS 11 1HG LYS 11 -5.065 -5.634 2.172
49 HG3 LYS 11 2HG LYS 11 -6.341 -6.459 1.272
50 HD2 LYS 11 1HD LYS 11 -3.954 -8.038 2.079
51 HD3 LYS 11 2HD LYS 11 -5.119 -7.597 3.330
52 HE2 LYS 11 1HE LYS 11 -6.839 -8.796 2.321
53 HE3 LYS 11 2HE LYS 11 -6.031 -8.822 0.754
54 HZ1 LYS 11 3HZ LYS 11 -5.298 -10.376 3.173
55 HZ2 LYS 11 1HZ LYS 11 -4.333 -10.290 1.785
56 HZ3 LYS 11 2HZ LYS 11 -5.875 -10.980 1.702
57 HA PRO 12 HA PRO 12 -5.284 -4.767 -4.510
58 HB2 PRO 12 1HB PRO 12 -5.916 -2.214 -3.837
59 HB3 PRO 12 2HB PRO 12 -7.133 -3.472 -4.084
60 HG2 PRO 12 1HG PRO 12 -5.977 -2.431 -1.526
61 HG3 PRO 12 2HG PRO 12 -7.663 -2.814 -1.917
62 HD2 PRO 12 1HD PRO 12 -6.079 -4.491 -0.499
63 HD3 PRO 12 2HD PRO 12 -7.359 -5.074 -1.582
64 H TYR 13 H TYR 13 -3.512 -4.206 -1.679
65 HA TYR 13 HA TYR 13 -1.543 -2.593 -3.166
66 HB2 TYR 13 1HB TYR 13 -2.037 -2.603 -0.181
67 HB3 TYR 13 2HB TYR 13 -0.834 -1.634 -1.025
68 HD1 TYR 13 HD2 TYR 13 -1.539 0.248 -2.454
69 HD2 TYR 13 HD1 TYR 13 -4.350 -1.968 -0.154
70 HE1 TYR 13 HE2 TYR 13 -3.190 2.047 -2.748
71 HE2 TYR 13 HE1 TYR 13 -6.009 -0.175 -0.442
72 HH TYR 13 HH TYR 13 -5.300 2.682 -2.422
73 H LYS 14 H LYS 14 0.204 -3.716 -3.671
74 HA LYS 14 HA LYS 14 1.393 -5.506 -1.698
75 HB2 LYS 14 1HB LYS 14 0.054 -7.038 -2.970
76 HB3 LYS 14 2HB LYS 14 0.601 -6.341 -4.490
77 HG2 LYS 14 1HG LYS 14 2.913 -7.115 -3.899
78 HG3 LYS 14 2HG LYS 14 2.194 -7.993 -2.547
79 HD2 LYS 14 1HD LYS 14 0.611 -8.906 -4.467
80 HD3 LYS 14 2HD LYS 14 2.008 -8.506 -5.470
81 HE2 LYS 14 1HE LYS 14 3.339 -9.804 -3.646
82 HE3 LYS 14 2HE LYS 14 1.767 -10.501 -3.256
83 HZ1 LYS 14 3HZ LYS 14 3.179 -10.632 -5.863
84 HZ2 LYS 14 1HZ LYS 14 1.587 -11.153 -5.625
85 HZ3 LYS 14 2HZ LYS 14 2.857 -11.917 -4.810
86 H CYS 15 H CYS 15 3.403 -4.801 -1.471
87 HA CYS 15 HA CYS 15 4.750 -3.057 -3.140
88 HB2 CYS 15 1HB CYS 15 5.450 -3.451 -0.843
89 HB3 CYS 15 2HB CYS 15 5.899 -5.107 -1.236
90 H ASN 16 H ASN 16 6.511 -3.326 -4.591
91 HA ASN 16 HA ASN 16 6.376 -5.854 -6.081
92 HB2 ASN 16 1HB ASN 16 7.574 -3.262 -7.058
93 HB3 ASN 16 2HB ASN 16 7.075 -4.653 -8.015
94 HD21 ASN 16 1HD2 ASN 16 4.885 -5.003 -8.402
95 HD22 ASN 16 2HD2 ASN 16 3.709 -3.757 -8.180
96 H GLU 17 H GLU 17 8.563 -3.650 -4.463
97 HA GLU 17 HA GLU 17 11.017 -4.593 -5.338
98 HB2 GLU 17 1HB GLU 17 10.156 -3.492 -2.667
99 HB3 GLU 17 2HB GLU 17 11.830 -3.895 -3.022
100 HG2 GLU 17 1HG GLU 17 10.150 -1.906 -4.532
101 HG3 GLU 17 2HG GLU 17 11.373 -1.516 -3.324
102 H CYS 18 H CYS 18 9.282 -5.624 -2.394
103 HA CYS 18 HA CYS 18 10.866 -8.098 -2.413
104 HB2 CYS 18 1HB CYS 18 10.173 -8.348 -0.064
105 HB3 CYS 18 2HB CYS 18 10.984 -6.810 -0.339
106 H GLY 19 H GLY 19 7.537 -6.908 -2.072
107 HA2 GLY 19 1HA GLY 19 5.811 -8.072 -3.362
108 HA3 GLY 19 2HA GLY 19 6.617 -9.576 -2.943
109 H LYS 20 H LYS 20 6.046 -6.927 -0.707
110 HA LYS 20 HA LYS 20 4.648 -8.727 1.073
111 HB2 LYS 20 1HB LYS 20 5.801 -5.988 1.266
112 HB3 LYS 20 2HB LYS 20 4.513 -6.410 2.386
113 HG2 LYS 20 1HG LYS 20 5.774 -8.054 3.421
114 HG3 LYS 20 2HG LYS 20 6.876 -8.210 2.051
115 HD2 LYS 20 1HD LYS 20 8.136 -7.063 3.645
116 HD3 LYS 20 2HD LYS 20 7.546 -5.783 2.582
117 HE2 LYS 20 1HE LYS 20 7.188 -4.961 4.744
118 HE3 LYS 20 2HE LYS 20 5.609 -5.552 4.231
119 HZ1 LYS 20 3HZ LYS 20 7.376 -7.376 5.695
120 HZ2 LYS 20 1HZ LYS 20 5.686 -7.296 5.678
121 HZ3 LYS 20 2HZ LYS 20 6.577 -6.163 6.563
122 H VAL 21 H VAL 21 2.673 -7.772 2.252
123 HA VAL 21 HA VAL 21 0.894 -6.408 0.348
124 HB VAL 21 HB VAL 21 0.177 -8.847 1.980
125 HG11 VAL 21 1HG1 VAL 21 -1.753 -7.917 0.007
126 HG12 VAL 21 2HG1 VAL 21 -1.994 -8.405 1.686
127 HG13 VAL 21 3HG1 VAL 21 -1.484 -6.759 1.309
128 HG21 VAL 21 3HG2 VAL 21 0.518 -8.401 -0.979
129 HG22 VAL 21 1HG2 VAL 21 1.406 -9.517 0.058
130 HG23 VAL 21 2HG2 VAL 21 -0.298 -9.807 -0.296
131 H PHE 22 H PHE 22 -0.393 -4.873 1.208
132 HA PHE 22 HA PHE 22 -0.616 -4.717 4.133
133 HB2 PHE 22 1HB PHE 22 -0.125 -2.300 2.392
134 HB3 PHE 22 2HB PHE 22 -0.119 -2.378 4.151
135 HD1 PHE 22 HD1 PHE 22 1.699 -3.445 1.115
136 HD2 PHE 22 HD2 PHE 22 1.835 -2.918 5.337
137 HE1 PHE 22 HE1 PHE 22 4.128 -3.841 1.083
138 HE2 PHE 22 HE2 PHE 22 4.263 -3.312 5.311
139 HZ PHE 22 HZ PHE 22 5.413 -3.773 3.183
140 H THR 23 H THR 23 -2.481 -3.686 4.921
141 HA THR 23 HA THR 23 -4.775 -3.958 3.224
142 HB THR 23 HB THR 23 -6.078 -3.255 5.187
143 HG1 THR 23 HG1 THR 23 -3.757 -3.143 6.759
144 HG21 THR 23 3HG2 THR 23 -3.954 -5.153 6.146
145 HG22 THR 23 1HG2 THR 23 -5.107 -5.611 4.894
146 HG23 THR 23 2HG2 THR 23 -5.681 -5.162 6.500
147 H GLN 24 H GLN 24 -3.242 -1.215 4.900
148 HA GLN 24 HA GLN 24 -4.829 0.619 3.249
149 HB2 GLN 24 1HB GLN 24 -3.411 0.892 5.873
150 HB3 GLN 24 2HB GLN 24 -3.734 2.325 4.906
151 HG2 GLN 24 1HG GLN 24 -5.887 0.379 5.671
152 HG3 GLN 24 2HG GLN 24 -5.425 1.738 6.694
153 HE21 GLN 24 1HE2 GLN 24 -5.607 3.884 5.774
154 HE22 GLN 24 2HE2 GLN 24 -6.837 4.201 4.603
155 H ASN 25 H ASN 25 -3.874 2.216 1.996
156 HA ASN 25 HA ASN 25 -1.497 1.576 0.689
157 HB2 ASN 25 1HB ASN 25 -1.808 3.514 -0.559
158 HB3 ASN 25 2HB ASN 25 -3.442 3.179 0.009
159 HD21 ASN 25 1HD2 ASN 25 -3.923 4.220 2.201
160 HD22 ASN 25 2HD2 ASN 25 -3.435 5.868 2.369
161 H SER 26 H SER 26 -2.106 3.957 3.251
162 HA SER 26 HA SER 26 0.331 5.189 3.427
163 HB2 SER 26 1HB SER 26 -1.601 4.374 5.595
164 HB3 SER 26 2HB SER 26 -0.153 5.322 5.939
165 HG SER 26 HG SER 26 -0.961 6.995 4.831
166 H HIS 27 H HIS 27 -0.579 2.032 4.722
167 HA HIS 27 HA HIS 27 1.805 1.533 6.141
168 HB2 HIS 27 1HB HIS 27 -0.145 -0.419 4.901
169 HB3 HIS 27 2HB HIS 27 1.106 -0.842 6.067
170 HD1 HIS 27 HD1 HIS 27 -0.940 -1.706 7.547
171 HD2 HIS 27 HD2 HIS 27 -0.741 2.401 6.953
172 HE1 HIS 27 HE1 HIS 27 -2.449 -0.701 9.290
173 H LEU 28 H LEU 28 0.908 1.107 2.785
174 HA LEU 28 HA LEU 28 3.289 -0.401 2.146
175 HB2 LEU 28 1HB LEU 28 1.425 -0.976 0.852
176 HB3 LEU 28 2HB LEU 28 1.007 0.709 0.549
177 HG LEU 28 HG LEU 28 3.231 0.768 -0.781
178 HD11 LEU 28 1HD1 LEU 28 3.879 -1.523 0.093
179 HD12 LEU 28 2HD1 LEU 28 4.037 -1.267 -1.644
180 HD13 LEU 28 3HD1 LEU 28 2.666 -2.174 -1.008
181 HD21 LEU 28 3HD2 LEU 28 1.787 -0.662 -2.618
182 HD22 LEU 28 1HD2 LEU 28 1.582 1.054 -2.262
183 HD23 LEU 28 2HD2 LEU 28 0.546 -0.139 -1.479
184 H THR 29 H THR 29 2.004 2.673 0.869
185 HA THR 29 HA THR 29 4.143 3.650 -0.446
186 HB THR 29 HB THR 29 2.152 4.962 -0.386
187 HG1 THR 29 HG1 THR 29 4.405 6.023 -0.290
188 HG21 THR 29 3HG2 THR 29 2.210 4.432 2.383
189 HG22 THR 29 1HG2 THR 29 0.965 5.285 1.472
190 HG23 THR 29 2HG2 THR 29 2.296 6.184 2.203
191 H ASN 30 H ASN 30 3.910 3.204 2.980
192 HA ASN 30 HA ASN 30 6.234 4.840 3.555
193 HB2 ASN 30 1HB ASN 30 4.185 4.497 5.089
194 HB3 ASN 30 2HB ASN 30 4.918 2.947 5.489
195 HD21 ASN 30 1HD2 ASN 30 4.436 5.571 6.950
196 HD22 ASN 30 2HD2 ASN 30 5.960 5.913 7.690
197 H HIS 31 H HIS 31 5.368 1.395 3.632
198 HA HIS 31 HA HIS 31 7.660 0.263 4.579
199 HB2 HIS 31 1HB HIS 31 6.028 -1.299 4.108
200 HB3 HIS 31 2HB HIS 31 5.667 -0.604 2.531
201 HD1 HIS 31 HD1 HIS 31 8.472 -2.562 4.193
202 HD2 HIS 31 HD2 HIS 31 6.724 -2.001 0.466
203 HE1 HIS 31 HE1 HIS 31 9.621 -4.190 2.659
204 H TRP 32 H TRP 32 7.043 0.938 1.129
205 HA TRP 32 HA TRP 32 9.311 0.189 -0.072
206 HB2 TRP 32 1HB TRP 32 7.611 2.617 -0.443
207 HB3 TRP 32 2HB TRP 32 9.116 2.502 -1.351
208 HD1 TRP 32 HD1 TRP 32 5.962 0.307 -0.763
209 HE1 TRP 32 HE1 TRP 32 5.436 -0.919 -2.964
210 HE3 TRP 32 HE3 TRP 32 9.903 1.955 -3.571
211 HZ2 TRP 32 HZ2 TRP 32 6.545 -1.156 -5.549
212 HZ3 TRP 32 HZ3 TRP 32 10.098 1.181 -5.899
213 HH2 TRP 32 HH2 TRP 32 8.453 -0.343 -6.865
214 H ARG 33 H ARG 33 9.012 2.926 2.106
215 HA ARG 33 HA ARG 33 11.306 4.333 1.696
216 HB2 ARG 33 1HB ARG 33 10.101 3.534 4.350
217 HB3 ARG 33 2HB ARG 33 11.318 4.786 4.149
218 HG2 ARG 33 1HG ARG 33 8.836 4.995 2.538
219 HG3 ARG 33 2HG ARG 33 8.741 5.342 4.266
220 HD2 ARG 33 1HD ARG 33 9.265 7.424 3.504
221 HD3 ARG 33 2HD ARG 33 10.894 6.782 3.718
222 HE ARG 33 HE ARG 33 10.172 6.154 1.136
223 HH11 ARG 33 1HH1 ARG 33 10.541 9.053 3.028
224 HH12 ARG 33 2HH1 ARG 33 10.981 10.038 1.672
225 HH21 ARG 33 1HH2 ARG 33 10.751 7.439 -0.657
226 HH22 ARG 33 2HH2 ARG 33 11.100 9.119 -0.423
227 H ILE 34 H ILE 34 11.011 1.361 3.625
228 HA ILE 34 HA ILE 34 13.666 1.169 4.452
229 HB ILE 34 HB ILE 34 13.261 -1.145 4.910
230 HG12 ILE 34 1HG1 ILE 34 10.862 -1.968 4.068
231 HG13 ILE 34 2HG1 ILE 34 11.220 -0.842 2.763
232 HG21 ILE 34 1HG2 ILE 34 10.558 -0.563 5.538
233 HG22 ILE 34 2HG2 ILE 34 11.968 -0.511 6.595
234 HG23 ILE 34 3HG2 ILE 34 11.487 0.927 5.695
235 HD11 ILE 34 3HD1 ILE 34 12.354 -2.469 1.790
236 HD12 ILE 34 1HD1 ILE 34 13.542 -2.342 3.086
237 HD13 ILE 34 2HD1 ILE 34 12.215 -3.496 3.217
238 H HIS 35 H HIS 35 12.140 0.255 1.430
239 HA HIS 35 HA HIS 35 14.349 -1.238 0.417
240 HB2 HIS 35 1HB HIS 35 11.875 -0.055 -0.813
241 HB3 HIS 35 2HB HIS 35 13.128 -0.770 -1.823
242 HD1 HIS 35 HD1 HIS 35 13.839 -3.276 -0.319
243 HD2 HIS 35 HD2 HIS 35 9.930 -1.930 -0.726
244 HE1 HIS 35 HE1 HIS 35 12.392 -5.306 0.010
245 H THR 36 H THR 36 13.356 2.126 0.266
246 HA THR 36 HA THR 36 15.415 2.831 -1.637
247 HB THR 36 HB THR 36 14.668 5.192 -1.142
248 HG1 THR 36 HG1 THR 36 12.908 5.481 0.174
249 HG21 THR 36 3HG2 THR 36 12.349 4.814 -2.152
250 HG22 THR 36 1HG2 THR 36 12.741 3.095 -2.108
251 HG23 THR 36 2HG2 THR 36 13.731 4.202 -3.060
252 H GLY 37 H GLY 37 16.606 1.596 0.497
253 HA2 GLY 37 1HA GLY 37 18.062 3.846 1.729
254 HA3 GLY 37 2HA GLY 37 17.551 2.473 2.701
255 H GLU 38 H GLU 38 18.107 0.600 0.458
256 HA GLU 38 HA GLU 38 20.926 0.242 1.043
257 HB2 GLU 38 1HB GLU 38 19.129 -1.603 1.033
258 HB3 GLU 38 2HB GLU 38 19.258 -1.537 -0.719
259 HG2 GLU 38 1HG GLU 38 20.740 -3.200 -0.288
260 HG3 GLU 38 2HG GLU 38 21.824 -1.812 -0.203
261 H LYS 39 H LYS 39 20.538 2.498 -0.483
262 HA LYS 39 HA LYS 39 20.898 3.473 -2.551
263 HB2 LYS 39 1HB LYS 39 23.248 1.709 -1.936
264 HB3 LYS 39 2HB LYS 39 23.229 2.686 -3.398
265 HG2 LYS 39 1HG LYS 39 24.361 4.007 -1.864
266 HG3 LYS 39 2HG LYS 39 22.720 4.657 -1.837
267 HD2 LYS 39 1HD LYS 39 23.248 4.494 0.418
268 HD3 LYS 39 2HD LYS 39 22.352 3.003 0.119
269 HE2 LYS 39 1HE LYS 39 24.236 2.364 1.378
270 HE3 LYS 39 2HE LYS 39 24.602 1.903 -0.284
271 HZ1 LYS 39 3HZ LYS 39 26.496 3.006 0.059
272 HZ2 LYS 39 1HZ LYS 39 25.906 3.823 1.418
273 HZ3 LYS 39 2HZ LYS 39 25.579 4.415 -0.132
274 HA PRO 40 HA PRO 40 19.528 -0.343 -4.978
275 HB2 PRO 40 1HB PRO 40 16.966 0.450 -5.400
276 HB3 PRO 40 2HB PRO 40 17.458 -0.501 -3.993
277 HG2 PRO 40 1HG PRO 40 16.983 2.446 -4.216
278 HG3 PRO 40 2HG PRO 40 16.493 1.328 -2.930
279 HD2 PRO 40 1HD PRO 40 18.648 2.953 -2.706
280 HD3 PRO 40 2HD PRO 40 18.577 1.350 -1.945
281 H SER 41 H SER 41 20.089 2.886 -5.362
282 HA SER 41 HA SER 41 19.150 3.038 -8.123
283 HB2 SER 41 1HB SER 41 20.232 5.038 -6.162
284 HB3 SER 41 2HB SER 41 20.225 5.405 -7.887
285 HG SER 41 HG SER 41 17.862 4.546 -7.516
286 H GLY 42 H GLY 42 20.554 3.514 -9.873
287 HA2 GLY 42 1HA GLY 42 23.334 3.745 -9.726
288 HA3 GLY 42 2HA GLY 42 22.959 2.035 -9.873
289 HA PRO 43 HA PRO 43 22.838 2.510 -14.232
290 HB2 PRO 43 1HB PRO 43 21.197 0.450 -14.891
291 HB3 PRO 43 2HB PRO 43 22.862 0.215 -14.346
292 HG2 PRO 43 1HG PRO 43 20.311 -0.019 -12.797
293 HG3 PRO 43 2HG PRO 43 21.735 -1.076 -12.774
294 HD2 PRO 43 1HD PRO 43 21.270 0.784 -10.862
295 HD3 PRO 43 2HD PRO 43 22.908 0.326 -11.369
296 H SER 44 H SER 44 21.454 3.049 -16.009
297 HA SER 44 HA SER 44 19.754 4.198 -16.991
298 HB2 SER 44 1HB SER 44 18.551 2.062 -16.307
299 HB3 SER 44 2HB SER 44 17.935 2.961 -14.921
300 HG SER 44 HG SER 44 17.637 4.165 -17.403
301 H SER 45 H SER 45 21.227 5.619 -15.123
302 HA SER 45 HA SER 45 19.853 6.933 -13.113
303 HB2 SER 45 1HB SER 45 21.484 8.792 -13.460
304 HB3 SER 45 2HB SER 45 22.246 7.204 -13.376
305 HG SER 45 HG SER 45 22.919 7.448 -15.350
306 H GLY 46 H GLY 46 20.130 7.837 -16.543
307 HA2 GLY 46 1HA GLY 46 17.645 8.663 -17.099
308 HA3 GLY 46 2HA GLY 46 18.260 10.030 -16.182
Start of MODEL 4
1 H1 GLY 1 H GLY 1 -9.305 -26.377 -14.476
2 HA2 GLY 1 1HA GLY 1 -10.160 -27.429 -11.959
3 HA3 GLY 1 2HA GLY 1 -8.734 -28.265 -12.557
4 H SER 2 H SER 2 -9.983 -25.354 -11.180
5 HA SER 2 HA SER 2 -7.265 -24.482 -10.599
6 HB2 SER 2 1HB SER 2 -9.283 -22.823 -12.109
7 HB3 SER 2 2HB SER 2 -7.938 -22.097 -11.230
8 HG SER 2 HG SER 2 -6.739 -22.566 -12.875
9 H SER 3 H SER 3 -7.081 -23.243 -8.737
10 HA SER 3 HA SER 3 -9.554 -22.994 -7.152
11 HB2 SER 3 1HB SER 3 -6.811 -23.931 -6.423
12 HB3 SER 3 2HB SER 3 -7.764 -23.090 -5.200
13 HG SER 3 HG SER 3 -8.004 -25.621 -6.111
14 H GLY 4 H GLY 4 -10.060 -21.042 -6.362
15 HA2 GLY 4 1HA GLY 4 -7.973 -18.954 -6.401
16 HA3 GLY 4 2HA GLY 4 -9.579 -18.651 -7.048
17 H SER 5 H SER 5 -11.246 -19.703 -5.211
18 HA SER 5 HA SER 5 -11.281 -17.748 -3.194
19 HB2 SER 5 1HB SER 5 -13.280 -18.993 -4.075
20 HB3 SER 5 2HB SER 5 -12.748 -20.394 -3.146
21 HG SER 5 HG SER 5 -13.392 -17.838 -2.089
22 H SER 6 H SER 6 -10.692 -17.753 -1.071
23 HA SER 6 HA SER 6 -9.935 -20.049 0.392
24 HB2 SER 6 1HB SER 6 -7.968 -20.150 -0.960
25 HB3 SER 6 2HB SER 6 -7.706 -18.411 -0.824
26 HG SER 6 HG SER 6 -7.649 -20.191 1.383
27 H GLY 7 H GLY 7 -9.235 -19.548 2.552
28 HA2 GLY 7 1HA GLY 7 -10.555 -17.465 3.771
29 HA3 GLY 7 2HA GLY 7 -9.166 -18.283 4.471
30 H SER 8 H SER 8 -7.008 -17.494 3.767
31 HA SER 8 HA SER 8 -6.817 -14.707 4.162
32 HB2 SER 8 1HB SER 8 -4.384 -15.057 3.612
33 HB3 SER 8 2HB SER 8 -5.005 -16.115 4.878
34 HG SER 8 HG SER 8 -4.868 -16.878 2.154
35 H GLY 9 H GLY 9 -7.514 -13.276 2.706
36 HA2 GLY 9 1HA GLY 9 -7.054 -13.815 -0.148
37 HA3 GLY 9 2HA GLY 9 -8.213 -12.665 0.502
38 H GLU 10 H GLU 10 -5.975 -12.413 -1.484
39 HA GLU 10 HA GLU 10 -3.923 -10.844 -0.316
40 HB2 GLU 10 1HB GLU 10 -3.719 -12.000 -2.504
41 HB3 GLU 10 2HB GLU 10 -4.871 -10.862 -3.186
42 HG2 GLU 10 1HG GLU 10 -3.353 -9.028 -2.793
43 HG3 GLU 10 2HG GLU 10 -2.214 -10.108 -1.991
44 H LYS 11 H LYS 11 -3.532 -8.547 -0.787
45 HA LYS 11 HA LYS 11 -6.043 -7.015 -0.654
46 HB2 LYS 11 1HB LYS 11 -3.403 -6.728 0.689
47 HB3 LYS 11 2HB LYS 11 -4.268 -5.252 0.283
48 HG2 LYS 11 1HG LYS 11 -4.959 -5.693 2.446
49 HG3 LYS 11 2HG LYS 11 -6.270 -6.355 1.467
50 HD2 LYS 11 1HD LYS 11 -4.874 -8.560 1.613
51 HD3 LYS 11 2HD LYS 11 -4.154 -7.779 3.023
52 HE2 LYS 11 1HE LYS 11 -7.128 -8.026 2.657
53 HE3 LYS 11 2HE LYS 11 -6.166 -9.283 3.433
54 HZ1 LYS 11 3HZ LYS 11 -7.004 -7.899 5.135
55 HZ2 LYS 11 1HZ LYS 11 -6.543 -6.484 4.331
56 HZ3 LYS 11 2HZ LYS 11 -5.365 -7.508 4.982
57 HA PRO 12 HA PRO 12 -5.102 -4.770 -4.303
58 HB2 PRO 12 1HB PRO 12 -5.852 -2.242 -3.658
59 HB3 PRO 12 2HB PRO 12 -7.012 -3.546 -3.936
60 HG2 PRO 12 1HG PRO 12 -5.973 -2.455 -1.349
61 HG3 PRO 12 2HG PRO 12 -7.631 -2.904 -1.789
62 HD2 PRO 12 1HD PRO 12 -6.027 -4.515 -0.318
63 HD3 PRO 12 2HD PRO 12 -7.250 -5.150 -1.437
64 H TYR 13 H TYR 13 -3.468 -4.083 -1.402
65 HA TYR 13 HA TYR 13 -1.554 -2.338 -2.805
66 HB2 TYR 13 1HB TYR 13 -2.047 -2.610 0.167
67 HB3 TYR 13 2HB TYR 13 -0.862 -1.544 -0.579
68 HD1 TYR 13 HD2 TYR 13 -1.568 0.472 -1.755
69 HD2 TYR 13 HD1 TYR 13 -4.412 -2.084 0.110
70 HE1 TYR 13 HE2 TYR 13 -3.264 2.245 -1.924
71 HE2 TYR 13 HE1 TYR 13 -6.116 -0.319 -0.054
72 HH TYR 13 HH TYR 13 -5.576 2.592 -1.875
73 H LYS 14 H LYS 14 0.225 -3.345 -3.432
74 HA LYS 14 HA LYS 14 1.508 -5.248 -1.618
75 HB2 LYS 14 1HB LYS 14 0.152 -6.574 -3.210
76 HB3 LYS 14 2HB LYS 14 1.015 -5.823 -4.546
77 HG2 LYS 14 1HG LYS 14 3.115 -6.762 -3.240
78 HG3 LYS 14 2HG LYS 14 1.912 -7.902 -2.633
79 HD2 LYS 14 1HD LYS 14 1.266 -8.347 -5.014
80 HD3 LYS 14 2HD LYS 14 2.651 -7.370 -5.507
81 HE2 LYS 14 1HE LYS 14 4.179 -8.886 -4.484
82 HE3 LYS 14 2HE LYS 14 2.871 -9.766 -3.696
83 HZ1 LYS 14 3HZ LYS 14 3.309 -11.107 -5.479
84 HZ2 LYS 14 1HZ LYS 14 3.722 -9.826 -6.504
85 HZ3 LYS 14 2HZ LYS 14 2.098 -10.128 -6.140
86 H CYS 15 H CYS 15 3.729 -5.285 -1.734
87 HA CYS 15 HA CYS 15 4.944 -3.039 -3.101
88 HB2 CYS 15 1HB CYS 15 5.564 -3.523 -0.779
89 HB3 CYS 15 2HB CYS 15 6.147 -5.114 -1.257
90 H ASN 16 H ASN 16 5.635 -3.212 -5.120
91 HA ASN 16 HA ASN 16 6.192 -5.800 -6.287
92 HB2 ASN 16 1HB ASN 16 4.956 -4.002 -7.514
93 HB3 ASN 16 2HB ASN 16 6.446 -3.065 -7.552
94 HD21 ASN 16 1HD2 ASN 16 5.500 -6.429 -8.191
95 HD22 ASN 16 2HD2 ASN 16 6.307 -6.543 -9.715
96 H GLU 17 H GLU 17 7.957 -4.601 -4.182
97 HA GLU 17 HA GLU 17 10.469 -4.453 -5.708
98 HB2 GLU 17 1HB GLU 17 9.633 -2.623 -3.983
99 HB3 GLU 17 2HB GLU 17 10.334 -3.734 -2.815
100 HG2 GLU 17 1HG GLU 17 11.724 -2.340 -5.083
101 HG3 GLU 17 2HG GLU 17 11.978 -2.110 -3.354
102 H CYS 18 H CYS 18 8.873 -6.005 -2.974
103 HA CYS 18 HA CYS 18 10.912 -8.121 -3.080
104 HB2 CYS 18 1HB CYS 18 10.699 -8.348 -0.601
105 HB3 CYS 18 2HB CYS 18 11.428 -6.829 -1.113
106 H GLY 19 H GLY 19 7.629 -7.203 -2.123
107 HA2 GLY 19 1HA GLY 19 5.877 -8.704 -3.082
108 HA3 GLY 19 2HA GLY 19 6.844 -10.033 -2.461
109 H LYS 20 H LYS 20 5.695 -6.950 -1.089
110 HA LYS 20 HA LYS 20 4.734 -8.465 1.243
111 HB2 LYS 20 1HB LYS 20 6.484 -6.476 1.331
112 HB3 LYS 20 2HB LYS 20 5.025 -5.494 1.294
113 HG2 LYS 20 1HG LYS 20 5.268 -5.705 3.538
114 HG3 LYS 20 2HG LYS 20 4.302 -7.148 3.228
115 HD2 LYS 20 1HD LYS 20 7.260 -7.382 3.049
116 HD3 LYS 20 2HD LYS 20 6.536 -7.237 4.652
117 HE2 LYS 20 1HE LYS 20 5.017 -9.132 4.035
118 HE3 LYS 20 2HE LYS 20 5.964 -9.332 2.562
119 HZ1 LYS 20 3HZ LYS 20 7.535 -9.246 4.979
120 HZ2 LYS 20 1HZ LYS 20 7.619 -10.315 3.670
121 HZ3 LYS 20 2HZ LYS 20 6.479 -10.565 4.894
122 H VAL 21 H VAL 21 2.730 -7.802 2.234
123 HA VAL 21 HA VAL 21 0.894 -6.391 0.417
124 HB VAL 21 HB VAL 21 0.277 -8.938 1.922
125 HG11 VAL 21 1HG1 VAL 21 -1.487 -7.195 0.204
126 HG12 VAL 21 2HG1 VAL 21 -1.924 -8.793 0.813
127 HG13 VAL 21 3HG1 VAL 21 -1.641 -7.466 1.940
128 HG21 VAL 21 3HG2 VAL 21 1.191 -8.383 -0.784
129 HG22 VAL 21 1HG2 VAL 21 1.125 -9.908 0.098
130 HG23 VAL 21 2HG2 VAL 21 -0.306 -9.315 -0.746
131 H PHE 22 H PHE 22 -0.367 -4.901 1.360
132 HA PHE 22 HA PHE 22 -0.568 -4.908 4.297
133 HB2 PHE 22 1HB PHE 22 -0.323 -2.404 2.629
134 HB3 PHE 22 2HB PHE 22 -0.244 -2.542 4.382
135 HD1 PHE 22 HD1 PHE 22 1.555 -3.068 1.237
136 HD2 PHE 22 HD2 PHE 22 1.765 -3.268 5.484
137 HE1 PHE 22 HE1 PHE 22 4.003 -3.276 1.103
138 HE2 PHE 22 HE2 PHE 22 4.213 -3.475 5.356
139 HZ PHE 22 HZ PHE 22 5.335 -3.478 3.164
140 H THR 23 H THR 23 -2.351 -3.354 5.036
141 HA THR 23 HA THR 23 -4.732 -3.942 3.436
142 HB THR 23 HB THR 23 -4.665 -4.622 5.847
143 HG1 THR 23 HG1 THR 23 -6.693 -2.685 5.524
144 HG21 THR 23 3HG2 THR 23 -5.365 -2.039 6.915
145 HG22 THR 23 1HG2 THR 23 -3.748 -2.000 6.214
146 HG23 THR 23 2HG2 THR 23 -4.139 -3.180 7.465
147 H GLN 24 H GLN 24 -2.851 -1.288 4.702
148 HA GLN 24 HA GLN 24 -4.758 0.608 3.499
149 HB2 GLN 24 1HB GLN 24 -2.906 0.841 5.849
150 HB3 GLN 24 2HB GLN 24 -3.436 2.281 4.989
151 HG2 GLN 24 1HG GLN 24 -5.808 1.420 5.369
152 HG3 GLN 24 2HG GLN 24 -5.084 0.315 6.536
153 HE21 GLN 24 1HE2 GLN 24 -4.779 3.751 5.683
154 HE22 GLN 24 2HE2 GLN 24 -4.888 4.337 7.305
155 H ASN 25 H ASN 25 -3.841 2.497 2.445
156 HA ASN 25 HA ASN 25 -1.785 1.801 0.625
157 HB2 ASN 25 1HB ASN 25 -2.292 3.764 -0.468
158 HB3 ASN 25 2HB ASN 25 -3.778 3.532 0.449
159 HD21 ASN 25 1HD2 ASN 25 -3.771 4.573 2.646
160 HD22 ASN 25 2HD2 ASN 25 -3.085 6.154 2.755
161 H SER 26 H SER 26 -1.893 4.001 3.406
162 HA SER 26 HA SER 26 0.624 5.122 3.224
163 HB2 SER 26 1HB SER 26 -1.163 5.720 4.891
164 HB3 SER 26 2HB SER 26 -0.700 4.290 5.814
165 HG SER 26 HG SER 26 1.536 5.419 5.500
166 H HIS 27 H HIS 27 -0.316 2.040 4.696
167 HA HIS 27 HA HIS 27 2.154 1.332 5.784
168 HB2 HIS 27 1HB HIS 27 -0.008 -0.452 4.646
169 HB3 HIS 27 2HB HIS 27 1.327 -1.006 5.653
170 HD1 HIS 27 HD1 HIS 27 -0.549 -1.847 7.328
171 HD2 HIS 27 HD2 HIS 27 -0.288 2.273 6.855
172 HE1 HIS 27 HE1 HIS 27 -1.829 -0.866 9.258
173 H LEU 28 H LEU 28 0.868 0.881 2.527
174 HA LEU 28 HA LEU 28 3.110 -0.643 1.608
175 HB2 LEU 28 1HB LEU 28 1.061 -0.996 0.490
176 HB3 LEU 28 2HB LEU 28 0.822 0.731 0.227
177 HG LEU 28 HG LEU 28 2.747 0.689 -1.356
178 HD11 LEU 28 1HD1 LEU 28 2.858 -1.981 -2.088
179 HD12 LEU 28 2HD1 LEU 28 2.955 -2.007 -0.328
180 HD13 LEU 28 3HD1 LEU 28 4.114 -1.060 -1.261
181 HD21 LEU 28 3HD2 LEU 28 0.494 -1.203 -2.024
182 HD22 LEU 28 1HD2 LEU 28 1.512 -0.337 -3.174
183 HD23 LEU 28 2HD2 LEU 28 0.415 0.557 -2.122
184 H THR 29 H THR 29 1.947 2.568 0.572
185 HA THR 29 HA THR 29 4.159 3.393 -0.819
186 HB THR 29 HB THR 29 2.160 4.733 -0.834
187 HG1 THR 29 HG1 THR 29 3.167 6.827 -0.290
188 HG21 THR 29 3HG2 THR 29 2.541 5.995 1.782
189 HG22 THR 29 1HG2 THR 29 2.057 4.302 1.866
190 HG23 THR 29 2HG2 THR 29 1.060 5.462 0.987
191 H ASN 30 H ASN 30 3.674 3.385 2.660
192 HA ASN 30 HA ASN 30 6.042 4.889 3.245
193 HB2 ASN 30 1HB ASN 30 4.074 4.793 4.767
194 HB3 ASN 30 2HB ASN 30 4.434 3.097 5.078
195 HD21 ASN 30 1HD2 ASN 30 4.722 6.074 6.318
196 HD22 ASN 30 2HD2 ASN 30 6.130 5.868 7.298
197 H HIS 31 H HIS 31 5.167 1.452 3.338
198 HA HIS 31 HA HIS 31 7.378 0.313 4.438
199 HB2 HIS 31 1HB HIS 31 5.689 -1.178 3.813
200 HB3 HIS 31 2HB HIS 31 5.627 -0.566 2.162
201 HD1 HIS 31 HD1 HIS 31 7.788 -2.711 4.401
202 HD2 HIS 31 HD2 HIS 31 7.211 -1.903 0.367
203 HE1 HIS 31 HE1 HIS 31 9.179 -4.406 3.170
204 H TRP 32 H TRP 32 7.026 1.042 0.963
205 HA TRP 32 HA TRP 32 9.339 0.276 -0.110
206 HB2 TRP 32 1HB TRP 32 7.729 2.752 -0.496
207 HB3 TRP 32 2HB TRP 32 9.311 2.681 -1.267
208 HD1 TRP 32 HD1 TRP 32 6.116 0.472 -1.101
209 HE1 TRP 32 HE1 TRP 32 5.791 -0.614 -3.411
210 HE3 TRP 32 HE3 TRP 32 10.292 2.270 -3.438
211 HZ2 TRP 32 HZ2 TRP 32 7.128 -0.698 -5.896
212 HZ3 TRP 32 HZ3 TRP 32 10.696 1.639 -5.782
213 HH2 TRP 32 HH2 TRP 32 9.146 0.185 -6.983
214 H ARG 33 H ARG 33 8.995 3.017 2.079
215 HA ARG 33 HA ARG 33 11.425 4.250 1.877
216 HB2 ARG 33 1HB ARG 33 9.783 3.656 4.337
217 HB3 ARG 33 2HB ARG 33 11.204 4.692 4.364
218 HG2 ARG 33 1HG ARG 33 10.139 6.191 2.752
219 HG3 ARG 33 2HG ARG 33 8.712 5.154 2.738
220 HD2 ARG 33 1HD ARG 33 8.363 7.061 4.200
221 HD3 ARG 33 2HD ARG 33 8.400 5.567 5.134
222 HE ARG 33 HE ARG 33 10.953 6.858 4.990
223 HH11 ARG 33 1HH1 ARG 33 7.896 6.792 6.656
224 HH12 ARG 33 2HH1 ARG 33 8.529 7.477 8.116
225 HH21 ARG 33 1HH2 ARG 33 11.798 7.760 6.907
226 HH22 ARG 33 2HH2 ARG 33 10.748 8.028 8.257
227 H ILE 34 H ILE 34 10.684 1.406 3.883
228 HA ILE 34 HA ILE 34 13.105 0.988 5.092
229 HB ILE 34 HB ILE 34 12.551 -1.325 5.308
230 HG12 ILE 34 1HG1 ILE 34 10.380 -2.017 3.907
231 HG13 ILE 34 2HG1 ILE 34 11.048 -0.836 2.785
232 HG21 ILE 34 1HG2 ILE 34 10.319 -1.209 6.187
233 HG22 ILE 34 2HG2 ILE 34 11.129 0.326 6.498
234 HG23 ILE 34 3HG2 ILE 34 9.954 0.199 5.190
235 HD11 ILE 34 3HD1 ILE 34 13.251 -2.197 3.150
236 HD12 ILE 34 1HD1 ILE 34 12.131 -3.469 3.637
237 HD13 ILE 34 2HD1 ILE 34 12.014 -2.759 2.026
238 H HIS 35 H HIS 35 12.206 0.284 1.769
239 HA HIS 35 HA HIS 35 14.572 -1.187 1.146
240 HB2 HIS 35 1HB HIS 35 12.461 0.127 -0.564
241 HB3 HIS 35 2HB HIS 35 13.833 -0.739 -1.248
242 HD1 HIS 35 HD1 HIS 35 14.013 -3.309 0.014
243 HD2 HIS 35 HD2 HIS 35 10.310 -1.485 -0.455
244 HE1 HIS 35 HE1 HIS 35 12.325 -5.168 0.160
245 H THR 36 H THR 36 13.566 2.178 0.789
246 HA THR 36 HA THR 36 16.087 2.900 -0.465
247 HB THR 36 HB THR 36 15.160 5.198 -0.508
248 HG1 THR 36 HG1 THR 36 12.723 5.082 0.033
249 HG21 THR 36 3HG2 THR 36 14.098 4.717 -2.421
250 HG22 THR 36 1HG2 THR 36 12.865 3.768 -1.592
251 HG23 THR 36 2HG2 THR 36 14.402 3.024 -2.033
252 H GLY 37 H GLY 37 17.638 2.566 1.123
253 HA2 GLY 37 1HA GLY 37 17.992 4.714 2.973
254 HA3 GLY 37 2HA GLY 37 17.543 3.228 3.796
255 H GLU 38 H GLU 38 19.885 4.228 4.507
256 HA GLU 38 HA GLU 38 21.993 3.049 2.880
257 HB2 GLU 38 1HB GLU 38 21.993 4.791 5.337
258 HB3 GLU 38 2HB GLU 38 23.461 4.027 4.743
259 HG2 GLU 38 1HG GLU 38 21.762 5.746 2.975
260 HG3 GLU 38 2HG GLU 38 22.989 6.432 4.038
261 H LYS 39 H LYS 39 20.258 1.147 3.889
262 HA LYS 39 HA LYS 39 22.030 -0.289 5.738
263 HB2 LYS 39 1HB LYS 39 20.015 0.705 6.917
264 HB3 LYS 39 2HB LYS 39 19.021 -0.382 5.955
265 HG2 LYS 39 1HG LYS 39 19.249 -1.669 7.800
266 HG3 LYS 39 2HG LYS 39 20.709 -2.177 6.948
267 HD2 LYS 39 1HD LYS 39 20.885 0.190 8.740
268 HD3 LYS 39 2HD LYS 39 20.763 -1.407 9.483
269 HE2 LYS 39 1HE LYS 39 23.025 -1.286 9.283
270 HE3 LYS 39 2HE LYS 39 22.649 -1.956 7.696
271 HZ1 LYS 39 3HZ LYS 39 23.609 -0.199 6.787
272 HZ2 LYS 39 1HZ LYS 39 23.915 0.473 8.310
273 HZ3 LYS 39 2HZ LYS 39 22.467 0.819 7.509
274 HA PRO 40 HA PRO 40 20.656 -2.712 1.934
275 HB2 PRO 40 1HB PRO 40 23.135 -3.059 0.883
276 HB3 PRO 40 2HB PRO 40 22.113 -1.670 0.495
277 HG2 PRO 40 1HG PRO 40 24.381 -1.869 2.438
278 HG3 PRO 40 2HG PRO 40 24.004 -0.573 1.288
279 HD2 PRO 40 1HD PRO 40 23.399 -0.405 3.922
280 HD3 PRO 40 2HD PRO 40 22.402 0.352 2.663
281 H SER 41 H SER 41 20.335 -4.789 2.392
282 HA SER 41 HA SER 41 22.223 -6.177 4.148
283 HB2 SER 41 1HB SER 41 19.612 -6.073 4.453
284 HB3 SER 41 2HB SER 41 19.623 -7.374 3.262
285 HG SER 41 HG SER 41 19.723 -8.121 5.450
286 H GLY 42 H GLY 42 23.326 -7.990 3.556
287 HA2 GLY 42 1HA GLY 42 22.755 -9.316 1.041
288 HA3 GLY 42 2HA GLY 42 24.268 -8.424 1.077
289 HA PRO 43 HA PRO 43 26.199 -12.032 2.676
290 HB2 PRO 43 1HB PRO 43 28.388 -10.893 3.808
291 HB3 PRO 43 2HB PRO 43 28.188 -11.061 2.060
292 HG2 PRO 43 1HG PRO 43 27.712 -8.672 3.799
293 HG3 PRO 43 2HG PRO 43 28.499 -8.762 2.213
294 HD2 PRO 43 1HD PRO 43 25.937 -7.944 2.524
295 HD3 PRO 43 2HD PRO 43 26.493 -8.816 1.080
296 H SER 44 H SER 44 24.698 -9.750 4.556
297 HA SER 44 HA SER 44 25.583 -10.052 7.134
298 HB2 SER 44 1HB SER 44 23.548 -8.715 6.120
299 HB3 SER 44 2HB SER 44 22.631 -10.128 6.640
300 HG SER 44 HG SER 44 24.008 -9.648 8.701
301 H SER 45 H SER 45 25.948 -11.778 8.341
302 HA SER 45 HA SER 45 24.629 -14.298 7.705
303 HB2 SER 45 1HB SER 45 27.058 -14.330 8.006
304 HB3 SER 45 2HB SER 45 26.880 -13.675 9.633
305 HG SER 45 HG SER 45 25.911 -15.565 10.277
306 H GLY 46 H GLY 46 22.662 -14.495 8.589
307 HA2 GLY 46 1HA GLY 46 21.221 -15.010 10.349
308 HA3 GLY 46 2HA GLY 46 22.449 -14.465 11.481
Start of MODEL 5
1 H1 GLY 1 H GLY 1 6.209 -29.525 8.713
2 HA2 GLY 1 1HA GLY 1 6.226 -28.260 10.828
3 HA3 GLY 1 2HA GLY 1 7.065 -26.984 9.957
4 H SER 2 H SER 2 3.998 -28.707 10.237
5 HA SER 2 HA SER 2 2.410 -27.377 8.463
6 HB2 SER 2 1HB SER 2 1.790 -28.333 11.259
7 HB3 SER 2 2HB SER 2 0.550 -27.684 10.185
8 HG SER 2 HG SER 2 2.263 -29.807 9.431
9 H SER 3 H SER 3 1.950 -25.318 8.110
10 HA SER 3 HA SER 3 1.969 -23.452 10.388
11 HB2 SER 3 1HB SER 3 2.954 -22.817 7.598
12 HB3 SER 3 2HB SER 3 2.985 -21.743 8.996
13 HG SER 3 HG SER 3 4.531 -23.010 9.933
14 H GLY 4 H GLY 4 -0.023 -22.720 10.697
15 HA2 GLY 4 1HA GLY 4 -2.141 -22.960 8.882
16 HA3 GLY 4 2HA GLY 4 -2.132 -21.913 10.293
17 H SER 5 H SER 5 -1.722 -22.110 6.865
18 HA SER 5 HA SER 5 -0.996 -19.293 6.654
19 HB2 SER 5 1HB SER 5 -0.678 -19.717 4.296
20 HB3 SER 5 2HB SER 5 0.099 -21.015 5.202
21 HG SER 5 HG SER 5 -1.212 -22.384 4.306
22 H SER 6 H SER 6 -2.255 -17.752 5.581
23 HA SER 6 HA SER 6 -4.991 -18.483 4.862
24 HB2 SER 6 1HB SER 6 -4.927 -17.777 7.295
25 HB3 SER 6 2HB SER 6 -4.442 -16.176 6.736
26 HG SER 6 HG SER 6 -6.596 -16.026 6.820
27 H GLY 7 H GLY 7 -5.975 -17.086 3.393
28 HA2 GLY 7 1HA GLY 7 -5.002 -14.556 2.649
29 HA3 GLY 7 2HA GLY 7 -4.277 -15.760 1.593
30 H SER 8 H SER 8 -7.103 -13.962 2.349
31 HA SER 8 HA SER 8 -8.999 -15.480 0.896
32 HB2 SER 8 1HB SER 8 -10.374 -13.419 0.963
33 HB3 SER 8 2HB SER 8 -9.699 -13.819 2.542
34 HG SER 8 HG SER 8 -8.365 -12.049 0.800
35 H GLY 9 H GLY 9 -6.735 -12.948 0.000
36 HA2 GLY 9 1HA GLY 9 -6.592 -13.676 -2.686
37 HA3 GLY 9 2HA GLY 9 -7.794 -12.400 -2.566
38 H GLU 10 H GLU 10 -6.106 -11.424 -4.054
39 HA GLU 10 HA GLU 10 -3.765 -10.380 -2.679
40 HB2 GLU 10 1HB GLU 10 -3.646 -11.219 -5.034
41 HB3 GLU 10 2HB GLU 10 -4.674 -9.876 -5.516
42 HG2 GLU 10 1HG GLU 10 -2.495 -9.196 -6.014
43 HG3 GLU 10 2HG GLU 10 -2.911 -8.354 -4.522
44 H LYS 11 H LYS 11 -3.776 -8.510 -1.641
45 HA LYS 11 HA LYS 11 -6.038 -6.770 -1.691
46 HB2 LYS 11 1HB LYS 11 -3.322 -6.579 -0.395
47 HB3 LYS 11 2HB LYS 11 -4.530 -5.310 -0.243
48 HG2 LYS 11 1HG LYS 11 -6.032 -6.772 0.890
49 HG3 LYS 11 2HG LYS 11 -5.009 -8.171 0.555
50 HD2 LYS 11 1HD LYS 11 -3.200 -6.822 1.850
51 HD3 LYS 11 2HD LYS 11 -4.581 -5.927 2.488
52 HE2 LYS 11 1HE LYS 11 -4.424 -8.928 2.571
53 HE3 LYS 11 2HE LYS 11 -3.760 -7.914 3.851
54 HZ1 LYS 11 3HZ LYS 11 -5.773 -7.777 4.724
55 HZ2 LYS 11 1HZ LYS 11 -6.417 -8.722 3.476
56 HZ3 LYS 11 2HZ LYS 11 -6.358 -7.039 3.318
57 HA PRO 12 HA PRO 12 -4.957 -3.910 -4.840
58 HB2 PRO 12 1HB PRO 12 -5.899 -1.585 -3.803
59 HB3 PRO 12 2HB PRO 12 -6.957 -2.862 -4.416
60 HG2 PRO 12 1HG PRO 12 -6.181 -2.238 -1.593
61 HG3 PRO 12 2HG PRO 12 -7.772 -2.666 -2.247
62 HD2 PRO 12 1HD PRO 12 -6.192 -4.456 -0.970
63 HD3 PRO 12 2HD PRO 12 -7.288 -4.920 -2.287
64 H TYR 13 H TYR 13 -3.362 -4.010 -1.956
65 HA TYR 13 HA TYR 13 -1.431 -1.987 -2.854
66 HB2 TYR 13 1HB TYR 13 -2.384 -2.352 -0.006
67 HB3 TYR 13 2HB TYR 13 -1.068 -1.296 -0.507
68 HD1 TYR 13 HD2 TYR 13 -1.622 0.606 -2.124
69 HD2 TYR 13 HD1 TYR 13 -4.595 -1.580 -0.005
70 HE1 TYR 13 HE2 TYR 13 -3.225 2.434 -2.498
71 HE2 TYR 13 HE1 TYR 13 -6.206 0.242 -0.374
72 HH TYR 13 HH TYR 13 -6.133 2.353 -2.522
73 H LYS 14 H LYS 14 0.022 -3.485 -3.595
74 HA LYS 14 HA LYS 14 1.312 -5.125 -1.528
75 HB2 LYS 14 1HB LYS 14 0.068 -6.749 -2.696
76 HB3 LYS 14 2HB LYS 14 0.391 -6.000 -4.254
77 HG2 LYS 14 1HG LYS 14 2.700 -7.029 -2.700
78 HG3 LYS 14 2HG LYS 14 1.628 -8.196 -3.477
79 HD2 LYS 14 1HD LYS 14 1.931 -6.671 -5.567
80 HD3 LYS 14 2HD LYS 14 3.364 -6.094 -4.712
81 HE2 LYS 14 1HE LYS 14 4.258 -7.819 -5.932
82 HE3 LYS 14 2HE LYS 14 3.846 -8.657 -4.437
83 HZ1 LYS 14 3HZ LYS 14 2.082 -8.574 -6.821
84 HZ2 LYS 14 1HZ LYS 14 1.878 -9.517 -5.431
85 HZ3 LYS 14 2HZ LYS 14 3.159 -9.836 -6.489
86 H CYS 15 H CYS 15 3.508 -5.166 -1.590
87 HA CYS 15 HA CYS 15 4.807 -3.226 -3.282
88 HB2 CYS 15 1HB CYS 15 5.486 -3.381 -0.960
89 HB3 CYS 15 2HB CYS 15 5.886 -5.085 -1.154
90 H ASN 16 H ASN 16 6.237 -3.594 -4.921
91 HA ASN 16 HA ASN 16 6.293 -6.328 -5.976
92 HB2 ASN 16 1HB ASN 16 6.834 -3.652 -7.274
93 HB3 ASN 16 2HB ASN 16 7.085 -5.194 -8.086
94 HD21 ASN 16 1HD2 ASN 16 5.549 -5.110 -9.611
95 HD22 ASN 16 2HD2 ASN 16 3.856 -4.980 -9.293
96 H GLU 17 H GLU 17 8.323 -3.825 -4.696
97 HA GLU 17 HA GLU 17 10.814 -4.556 -5.680
98 HB2 GLU 17 1HB GLU 17 9.937 -3.308 -3.092
99 HB3 GLU 17 2HB GLU 17 11.633 -3.663 -3.391
100 HG2 GLU 17 1HG GLU 17 9.841 -1.763 -4.861
101 HG3 GLU 17 2HG GLU 17 11.333 -1.416 -3.989
102 H CYS 18 H CYS 18 9.017 -5.835 -2.915
103 HA CYS 18 HA CYS 18 10.912 -8.090 -2.834
104 HB2 CYS 18 1HB CYS 18 10.511 -8.231 -0.393
105 HB3 CYS 18 2HB CYS 18 11.272 -6.715 -0.864
106 H GLY 19 H GLY 19 7.614 -7.033 -2.014
107 HA2 GLY 19 1HA GLY 19 5.849 -8.429 -3.127
108 HA3 GLY 19 2HA GLY 19 6.723 -9.811 -2.485
109 H LYS 20 H LYS 20 6.339 -6.868 -0.654
110 HA LYS 20 HA LYS 20 5.065 -8.306 1.481
111 HB2 LYS 20 1HB LYS 20 6.724 -6.226 1.504
112 HB3 LYS 20 2HB LYS 20 5.212 -5.328 1.481
113 HG2 LYS 20 1HG LYS 20 5.486 -5.495 3.721
114 HG3 LYS 20 2HG LYS 20 4.623 -7.010 3.446
115 HD2 LYS 20 1HD LYS 20 7.096 -7.901 3.062
116 HD3 LYS 20 2HD LYS 20 7.480 -6.536 4.112
117 HE2 LYS 20 1HE LYS 20 5.296 -8.422 4.880
118 HE3 LYS 20 2HE LYS 20 6.977 -8.892 5.130
119 HZ1 LYS 20 3HZ LYS 20 6.663 -7.840 7.078
120 HZ2 LYS 20 1HZ LYS 20 5.389 -6.887 6.503
121 HZ3 LYS 20 2HZ LYS 20 6.988 -6.448 6.174
122 H VAL 21 H VAL 21 3.061 -7.546 2.517
123 HA VAL 21 HA VAL 21 1.154 -6.351 0.624
124 HB VAL 21 HB VAL 21 0.698 -8.841 2.269
125 HG11 VAL 21 1HG1 VAL 21 -1.351 -7.838 2.487
126 HG12 VAL 21 2HG1 VAL 21 -1.203 -6.953 0.967
127 HG13 VAL 21 3HG1 VAL 21 -1.570 -8.679 0.952
128 HG21 VAL 21 3HG2 VAL 21 0.432 -9.978 0.210
129 HG22 VAL 21 1HG2 VAL 21 0.397 -8.468 -0.701
130 HG23 VAL 21 2HG2 VAL 21 1.899 -9.012 0.048
131 H PHE 22 H PHE 22 -0.488 -5.126 1.531
132 HA PHE 22 HA PHE 22 -0.617 -4.888 4.435
133 HB2 PHE 22 1HB PHE 22 -0.298 -2.409 2.750
134 HB3 PHE 22 2HB PHE 22 -0.209 -2.554 4.502
135 HD1 PHE 22 HD1 PHE 22 1.541 -3.310 1.345
136 HD2 PHE 22 HD2 PHE 22 1.818 -3.095 5.587
137 HE1 PHE 22 HE1 PHE 22 3.985 -3.552 1.194
138 HE2 PHE 22 HE2 PHE 22 4.262 -3.336 5.443
139 HZ PHE 22 HZ PHE 22 5.349 -3.564 3.245
140 H THR 23 H THR 23 -2.494 -3.688 5.174
141 HA THR 23 HA THR 23 -4.793 -4.237 3.536
142 HB THR 23 HB THR 23 -6.108 -3.399 5.443
143 HG1 THR 23 HG1 THR 23 -3.538 -2.646 6.368
144 HG21 THR 23 3HG2 THR 23 -3.910 -5.171 6.487
145 HG22 THR 23 1HG2 THR 23 -5.129 -5.744 5.350
146 HG23 THR 23 2HG2 THR 23 -5.613 -5.160 6.942
147 H GLN 24 H GLN 24 -3.488 -1.280 5.049
148 HA GLN 24 HA GLN 24 -5.182 0.361 3.351
149 HB2 GLN 24 1HB GLN 24 -3.184 1.143 5.481
150 HB3 GLN 24 2HB GLN 24 -4.272 2.248 4.651
151 HG2 GLN 24 1HG GLN 24 -6.102 0.588 5.563
152 HG3 GLN 24 2HG GLN 24 -4.850 0.234 6.752
153 HE21 GLN 24 1HE2 GLN 24 -7.003 2.651 5.484
154 HE22 GLN 24 2HE2 GLN 24 -6.854 3.763 6.797
155 H ASN 25 H ASN 25 -4.031 2.419 2.470
156 HA ASN 25 HA ASN 25 -2.003 1.478 0.637
157 HB2 ASN 25 1HB ASN 25 -2.526 3.297 -0.674
158 HB3 ASN 25 2HB ASN 25 -4.037 3.116 0.212
159 HD21 ASN 25 1HD2 ASN 25 -1.200 5.029 -0.258
160 HD22 ASN 25 2HD2 ASN 25 -1.701 6.384 0.690
161 H SER 26 H SER 26 -2.274 3.955 3.163
162 HA SER 26 HA SER 26 0.250 5.089 2.932
163 HB2 SER 26 1HB SER 26 -0.088 5.999 5.091
164 HB3 SER 26 2HB SER 26 -1.708 5.820 4.418
165 HG SER 26 HG SER 26 -0.449 3.951 6.145
166 H HIS 27 H HIS 27 -0.716 2.039 4.283
167 HA HIS 27 HA HIS 27 1.593 1.536 5.843
168 HB2 HIS 27 1HB HIS 27 -0.445 -0.307 4.592
169 HB3 HIS 27 2HB HIS 27 0.862 -0.880 5.624
170 HD1 HIS 27 HD1 HIS 27 -0.354 -1.565 7.690
171 HD2 HIS 27 HD2 HIS 27 -1.479 2.214 6.380
172 HE1 HIS 27 HE1 HIS 27 -1.858 -0.651 9.486
173 H LEU 28 H LEU 28 0.744 0.820 2.488
174 HA LEU 28 HA LEU 28 3.105 -0.680 1.942
175 HB2 LEU 28 1HB LEU 28 1.232 -1.088 0.566
176 HB3 LEU 28 2HB LEU 28 1.030 0.625 0.205
177 HG LEU 28 HG LEU 28 3.236 0.482 -1.037
178 HD11 LEU 28 1HD1 LEU 28 3.134 -2.163 0.031
179 HD12 LEU 28 2HD1 LEU 28 4.411 -1.391 -0.908
180 HD13 LEU 28 3HD1 LEU 28 3.106 -2.245 -1.731
181 HD21 LEU 28 3HD2 LEU 28 0.827 -1.065 -1.976
182 HD22 LEU 28 1HD2 LEU 28 2.173 -0.604 -3.018
183 HD23 LEU 28 2HD2 LEU 28 1.185 0.640 -2.252
184 H THR 29 H THR 29 2.082 2.562 0.854
185 HA THR 29 HA THR 29 4.316 3.416 -0.428
186 HB THR 29 HB THR 29 3.000 5.283 1.521
187 HG1 THR 29 HG1 THR 29 1.212 4.362 0.669
188 HG21 THR 29 3HG2 THR 29 4.777 6.176 0.118
189 HG22 THR 29 1HG2 THR 29 3.223 6.854 -0.365
190 HG23 THR 29 2HG2 THR 29 3.964 5.575 -1.327
191 H ASN 30 H ASN 30 3.796 3.472 3.084
192 HA ASN 30 HA ASN 30 6.200 4.731 3.786
193 HB2 ASN 30 1HB ASN 30 4.706 4.645 5.547
194 HB3 ASN 30 2HB ASN 30 4.246 2.978 5.214
195 HD21 ASN 30 1HD2 ASN 30 5.319 1.343 6.188
196 HD22 ASN 30 2HD2 ASN 30 6.584 1.570 7.344
197 H HIS 31 H HIS 31 5.400 1.262 3.672
198 HA HIS 31 HA HIS 31 7.700 0.099 4.487
199 HB2 HIS 31 1HB HIS 31 6.003 -1.376 3.838
200 HB3 HIS 31 2HB HIS 31 5.833 -0.633 2.251
201 HD1 HIS 31 HD1 HIS 31 8.116 -2.938 4.175
202 HD2 HIS 31 HD2 HIS 31 7.385 -1.737 0.266
203 HE1 HIS 31 HE1 HIS 31 9.481 -4.481 2.731
204 H TRP 32 H TRP 32 7.114 1.111 1.116
205 HA TRP 32 HA TRP 32 9.373 0.501 -0.157
206 HB2 TRP 32 1HB TRP 32 7.680 2.949 -0.233
207 HB3 TRP 32 2HB TRP 32 9.217 2.999 -1.093
208 HD1 TRP 32 HD1 TRP 32 6.024 0.798 -0.984
209 HE1 TRP 32 HE1 TRP 32 5.630 -0.139 -3.349
210 HE3 TRP 32 HE3 TRP 32 10.193 2.646 -3.295
211 HZ2 TRP 32 HZ2 TRP 32 6.916 -0.100 -5.861
212 HZ3 TRP 32 HZ3 TRP 32 10.537 2.150 -5.680
213 HH2 TRP 32 HH2 TRP 32 8.932 0.804 -6.935
214 H ARG 33 H ARG 33 9.110 2.988 2.316
215 HA ARG 33 HA ARG 33 11.436 4.374 2.099
216 HB2 ARG 33 1HB ARG 33 10.009 3.341 4.537
217 HB3 ARG 33 2HB ARG 33 11.459 4.326 4.678
218 HG2 ARG 33 1HG ARG 33 10.132 5.935 3.082
219 HG3 ARG 33 2HG ARG 33 8.740 5.074 3.740
220 HD2 ARG 33 1HD ARG 33 8.951 6.829 5.221
221 HD3 ARG 33 2HD ARG 33 9.865 5.559 6.034
222 HE ARG 33 HE ARG 33 11.812 6.740 5.651
223 HH11 ARG 33 1HH1 ARG 33 9.160 8.196 3.930
224 HH12 ARG 33 2HH1 ARG 33 10.035 9.639 3.538
225 HH21 ARG 33 1HH2 ARG 33 12.975 8.635 5.142
226 HH22 ARG 33 2HH2 ARG 33 12.206 9.887 4.227
227 H ILE 34 H ILE 34 11.076 1.215 3.698
228 HA ILE 34 HA ILE 34 13.732 0.875 4.473
229 HB ILE 34 HB ILE 34 13.273 -1.457 4.708
230 HG12 ILE 34 1HG1 ILE 34 10.858 -2.145 3.782
231 HG13 ILE 34 2HG1 ILE 34 11.254 -0.911 2.590
232 HG21 ILE 34 1HG2 ILE 34 12.108 -0.723 6.468
233 HG22 ILE 34 2HG2 ILE 34 11.310 0.536 5.528
234 HG23 ILE 34 3HG2 ILE 34 10.675 -1.109 5.515
235 HD11 ILE 34 3HD1 ILE 34 11.876 -3.456 2.253
236 HD12 ILE 34 1HD1 ILE 34 12.900 -2.152 1.651
237 HD13 ILE 34 2HD1 ILE 34 13.305 -2.966 3.163
238 H HIS 35 H HIS 35 12.152 0.269 1.394
239 HA HIS 35 HA HIS 35 14.308 -1.156 0.208
240 HB2 HIS 35 1HB HIS 35 11.836 0.188 -0.821
241 HB3 HIS 35 2HB HIS 35 13.077 -0.330 -1.959
242 HD1 HIS 35 HD1 HIS 35 13.838 -3.015 -0.594
243 HD2 HIS 35 HD2 HIS 35 9.950 -1.731 -1.297
244 HE1 HIS 35 HE1 HIS 35 12.438 -5.104 -0.642
245 H THR 36 H THR 36 13.387 2.242 0.332
246 HA THR 36 HA THR 36 16.067 2.949 -0.610
247 HB THR 36 HB THR 36 14.646 3.078 -2.603
248 HG1 THR 36 HG1 THR 36 16.292 4.629 -2.419
249 HG21 THR 36 3HG2 THR 36 13.078 5.257 -1.249
250 HG22 THR 36 1HG2 THR 36 12.543 3.577 -1.228
251 HG23 THR 36 2HG2 THR 36 12.726 4.425 -2.764
252 H GLY 37 H GLY 37 16.926 4.167 0.937
253 HA2 GLY 37 1HA GLY 37 15.166 5.783 2.633
254 HA3 GLY 37 2HA GLY 37 16.834 5.355 2.986
255 H GLU 38 H GLU 38 16.254 7.882 3.440
256 HA GLU 38 HA GLU 38 17.003 9.411 1.050
257 HB2 GLU 38 1HB GLU 38 14.982 10.019 2.526
258 HB3 GLU 38 2HB GLU 38 16.170 10.591 3.689
259 HG2 GLU 38 1HG GLU 38 16.049 11.557 0.847
260 HG3 GLU 38 2HG GLU 38 15.193 12.335 2.176
261 H LYS 39 H LYS 39 19.045 9.997 0.799
262 HA LYS 39 HA LYS 39 21.259 10.347 1.217
263 HB2 LYS 39 1HB LYS 39 19.945 12.313 2.383
264 HB3 LYS 39 2HB LYS 39 20.546 11.562 3.855
265 HG2 LYS 39 1HG LYS 39 22.846 11.759 2.966
266 HG3 LYS 39 2HG LYS 39 22.196 12.619 1.569
267 HD2 LYS 39 1HD LYS 39 22.932 14.294 3.055
268 HD3 LYS 39 2HD LYS 39 21.176 14.247 3.232
269 HE2 LYS 39 1HE LYS 39 21.540 12.703 5.196
270 HE3 LYS 39 2HE LYS 39 23.256 13.092 5.078
271 HZ1 LYS 39 3HZ LYS 39 22.880 14.917 6.244
272 HZ2 LYS 39 1HZ LYS 39 21.230 14.553 6.342
273 HZ3 LYS 39 2HZ LYS 39 21.815 15.488 5.060
274 HA PRO 40 HA PRO 40 21.284 6.838 4.383
275 HB2 PRO 40 1HB PRO 40 21.966 4.854 2.659
276 HB3 PRO 40 2HB PRO 40 20.288 5.288 3.009
277 HG2 PRO 40 1HG PRO 40 21.998 6.063 0.678
278 HG3 PRO 40 2HG PRO 40 20.301 5.549 0.699
279 HD2 PRO 40 1HD PRO 40 21.034 8.149 0.508
280 HD3 PRO 40 2HD PRO 40 19.547 7.634 1.330
281 H SER 41 H SER 41 23.381 7.072 1.501
282 HA SER 41 HA SER 41 25.706 7.187 3.293
283 HB2 SER 41 1HB SER 41 25.300 4.865 2.252
284 HB3 SER 41 2HB SER 41 25.785 5.607 0.728
285 HG SER 41 HG SER 41 27.516 4.597 1.940
286 H GLY 42 H GLY 42 25.882 9.406 2.919
287 HA2 GLY 42 1HA GLY 42 27.551 10.248 0.885
288 HA3 GLY 42 2HA GLY 42 25.918 10.538 0.303
289 HA PRO 43 HA PRO 43 26.800 13.340 4.193
290 HB2 PRO 43 1HB PRO 43 29.428 13.933 4.525
291 HB3 PRO 43 2HB PRO 43 28.642 12.570 5.330
292 HG2 PRO 43 1HG PRO 43 30.337 12.592 2.863
293 HG3 PRO 43 2HG PRO 43 30.355 11.454 4.223
294 HD2 PRO 43 1HD PRO 43 29.132 10.896 1.873
295 HD3 PRO 43 2HD PRO 43 28.538 10.280 3.428
296 H SER 44 H SER 44 25.819 14.638 2.505
297 HA SER 44 HA SER 44 27.579 16.229 0.832
298 HB2 SER 44 1HB SER 44 25.266 15.269 0.160
299 HB3 SER 44 2HB SER 44 24.606 16.629 1.068
300 HG SER 44 HG SER 44 26.343 16.730 -1.172
301 H SER 45 H SER 45 26.887 18.656 0.682
302 HA SER 45 HA SER 45 26.827 19.718 3.431
303 HB2 SER 45 1HB SER 45 28.974 20.207 2.552
304 HB3 SER 45 2HB SER 45 28.313 20.666 0.983
305 HG SER 45 HG SER 45 28.320 22.613 1.755
306 H GLY 46 H GLY 46 25.657 21.625 3.829
307 HA2 GLY 46 1HA GLY 46 23.270 21.885 2.275
308 HA3 GLY 46 2HA GLY 46 23.715 22.857 3.670
Start of MODEL 6
1 H1 GLY 1 H GLY 1 11.125 -28.801 -7.088
2 HA2 GLY 1 1HA GLY 1 11.882 -26.028 -6.401
3 HA3 GLY 1 2HA GLY 1 10.821 -26.447 -7.737
4 H SER 2 H SER 2 10.908 -25.326 -4.627
5 HA SER 2 HA SER 2 8.406 -26.507 -3.752
6 HB2 SER 2 1HB SER 2 8.731 -25.193 -1.715
7 HB3 SER 2 2HB SER 2 10.213 -26.058 -2.122
8 HG SER 2 HG SER 2 10.613 -23.873 -1.563
9 H SER 3 H SER 3 6.442 -25.557 -3.781
10 HA SER 3 HA SER 3 6.116 -23.215 -5.436
11 HB2 SER 3 1HB SER 3 3.715 -23.653 -5.222
12 HB3 SER 3 2HB SER 3 4.576 -25.135 -5.636
13 HG SER 3 HG SER 3 3.149 -24.503 -3.382
14 H GLY 4 H GLY 4 5.495 -24.097 -2.055
15 HA2 GLY 4 1HA GLY 4 5.674 -22.671 -0.207
16 HA3 GLY 4 2HA GLY 4 5.761 -21.299 -1.303
17 H SER 5 H SER 5 4.008 -20.063 -1.525
18 HA SER 5 HA SER 5 1.354 -21.154 -1.107
19 HB2 SER 5 1HB SER 5 2.684 -19.291 0.817
20 HB3 SER 5 2HB SER 5 0.959 -19.093 0.507
21 HG SER 5 HG SER 5 0.736 -21.343 1.052
22 H SER 6 H SER 6 -0.345 -19.487 -1.524
23 HA SER 6 HA SER 6 0.518 -17.802 -3.751
24 HB2 SER 6 1HB SER 6 -1.829 -17.722 -4.381
25 HB3 SER 6 2HB SER 6 -1.364 -19.396 -4.083
26 HG SER 6 HG SER 6 -2.698 -17.697 -2.239
27 H GLY 7 H GLY 7 1.267 -16.840 -1.255
28 HA2 GLY 7 1HA GLY 7 1.132 -14.997 0.114
29 HA3 GLY 7 2HA GLY 7 0.512 -14.196 -1.321
30 H SER 8 H SER 8 -0.435 -16.103 1.500
31 HA SER 8 HA SER 8 -3.162 -16.057 1.323
32 HB2 SER 8 1HB SER 8 -1.357 -15.776 3.721
33 HB3 SER 8 2HB SER 8 -3.111 -15.865 3.884
34 HG SER 8 HG SER 8 -2.639 -17.939 3.933
35 H GLY 9 H GLY 9 -4.765 -14.594 1.499
36 HA2 GLY 9 1HA GLY 9 -5.837 -12.581 1.820
37 HA3 GLY 9 2HA GLY 9 -4.484 -12.089 2.827
38 H GLU 10 H GLU 10 -5.800 -12.128 -0.405
39 HA GLU 10 HA GLU 10 -3.565 -10.594 -1.463
40 HB2 GLU 10 1HB GLU 10 -4.522 -12.316 -2.887
41 HB3 GLU 10 2HB GLU 10 -6.112 -11.578 -2.759
42 HG2 GLU 10 1HG GLU 10 -5.291 -9.598 -3.927
43 HG3 GLU 10 2HG GLU 10 -3.696 -10.338 -4.056
44 H LYS 11 H LYS 11 -3.495 -8.467 -1.262
45 HA LYS 11 HA LYS 11 -6.034 -6.980 -1.084
46 HB2 LYS 11 1HB LYS 11 -3.445 -6.706 0.354
47 HB3 LYS 11 2HB LYS 11 -4.310 -5.226 -0.037
48 HG2 LYS 11 1HG LYS 11 -5.189 -5.648 2.014
49 HG3 LYS 11 2HG LYS 11 -6.337 -6.547 1.020
50 HD2 LYS 11 1HD LYS 11 -4.690 -8.528 1.379
51 HD3 LYS 11 2HD LYS 11 -4.113 -7.568 2.743
52 HE2 LYS 11 1HE LYS 11 -6.988 -8.359 2.299
53 HE3 LYS 11 2HE LYS 11 -5.866 -9.223 3.348
54 HZ1 LYS 11 3HZ LYS 11 -6.893 -7.838 4.829
55 HZ2 LYS 11 1HZ LYS 11 -7.090 -6.581 3.714
56 HZ3 LYS 11 2HZ LYS 11 -5.572 -6.874 4.398
57 HA PRO 12 HA PRO 12 -5.008 -4.606 -4.628
58 HB2 PRO 12 1HB PRO 12 -5.810 -2.109 -3.927
59 HB3 PRO 12 2HB PRO 12 -6.943 -3.418 -4.283
60 HG2 PRO 12 1HG PRO 12 -6.001 -2.399 -1.631
61 HG3 PRO 12 2HG PRO 12 -7.638 -2.853 -2.137
62 HD2 PRO 12 1HD PRO 12 -6.061 -4.492 -0.669
63 HD3 PRO 12 2HD PRO 12 -7.240 -5.105 -1.846
64 H TYR 13 H TYR 13 -3.261 -4.344 -1.850
65 HA TYR 13 HA TYR 13 -1.404 -2.404 -3.063
66 HB2 TYR 13 1HB TYR 13 -2.011 -2.807 -0.128
67 HB3 TYR 13 2HB TYR 13 -0.721 -1.784 -0.750
68 HD1 TYR 13 HD2 TYR 13 -1.261 0.296 -1.958
69 HD2 TYR 13 HD1 TYR 13 -4.300 -2.091 -0.177
70 HE1 TYR 13 HE2 TYR 13 -2.831 2.182 -2.123
71 HE2 TYR 13 HE1 TYR 13 -5.878 -0.212 -0.338
72 HH TYR 13 HH TYR 13 -5.466 2.376 -2.255
73 H LYS 14 H LYS 14 0.430 -3.325 -3.659
74 HA LYS 14 HA LYS 14 1.607 -5.408 -1.968
75 HB2 LYS 14 1HB LYS 14 0.391 -6.547 -3.790
76 HB3 LYS 14 2HB LYS 14 1.317 -5.629 -4.971
77 HG2 LYS 14 1HG LYS 14 3.349 -6.710 -4.313
78 HG3 LYS 14 2HG LYS 14 2.540 -7.507 -2.961
79 HD2 LYS 14 1HD LYS 14 1.180 -8.798 -4.488
80 HD3 LYS 14 2HD LYS 14 1.856 -7.933 -5.870
81 HE2 LYS 14 1HE LYS 14 4.000 -8.897 -5.529
82 HE3 LYS 14 2HE LYS 14 3.533 -9.539 -3.955
83 HZ1 LYS 14 3HZ LYS 14 3.563 -11.056 -6.061
84 HZ2 LYS 14 1HZ LYS 14 2.028 -10.395 -6.321
85 HZ3 LYS 14 2HZ LYS 14 2.355 -11.237 -4.891
86 H CYS 15 H CYS 15 3.830 -5.433 -1.920
87 HA CYS 15 HA CYS 15 5.128 -3.112 -3.144
88 HB2 CYS 15 1HB CYS 15 5.438 -3.263 -0.762
89 HB3 CYS 15 2HB CYS 15 5.964 -4.938 -0.887
90 H ASN 16 H ASN 16 5.098 -4.206 -5.252
91 HA ASN 16 HA ASN 16 6.134 -6.537 -6.057
92 HB2 ASN 16 1HB ASN 16 5.387 -4.555 -7.493
93 HB3 ASN 16 2HB ASN 16 7.051 -3.987 -7.382
94 HD21 ASN 16 1HD2 ASN 16 4.931 -6.434 -8.640
95 HD22 ASN 16 2HD2 ASN 16 6.051 -7.111 -9.768
96 H GLU 17 H GLU 17 8.015 -3.816 -4.855
97 HA GLU 17 HA GLU 17 10.572 -4.436 -5.506
98 HB2 GLU 17 1HB GLU 17 9.555 -2.629 -3.872
99 HB3 GLU 17 2HB GLU 17 10.034 -3.788 -2.640
100 HG2 GLU 17 1HG GLU 17 11.899 -2.671 -4.718
101 HG3 GLU 17 2HG GLU 17 11.707 -2.007 -3.096
102 H CYS 18 H CYS 18 9.094 -5.600 -2.473
103 HA CYS 18 HA CYS 18 10.931 -7.896 -2.564
104 HB2 CYS 18 1HB CYS 18 10.641 -8.078 -0.167
105 HB3 CYS 18 2HB CYS 18 11.079 -6.420 -0.569
106 H GLY 19 H GLY 19 7.556 -6.970 -2.069
107 HA2 GLY 19 1HA GLY 19 5.906 -8.451 -3.161
108 HA3 GLY 19 2HA GLY 19 6.821 -9.800 -2.504
109 H LYS 20 H LYS 20 6.085 -6.846 -0.751
110 HA LYS 20 HA LYS 20 4.743 -8.429 1.288
111 HB2 LYS 20 1HB LYS 20 6.512 -6.479 1.586
112 HB3 LYS 20 2HB LYS 20 5.073 -5.471 1.512
113 HG2 LYS 20 1HG LYS 20 5.175 -5.800 3.753
114 HG3 LYS 20 2HG LYS 20 4.208 -7.209 3.310
115 HD2 LYS 20 1HD LYS 20 7.186 -7.428 3.355
116 HD3 LYS 20 2HD LYS 20 6.291 -7.466 4.876
117 HE2 LYS 20 1HE LYS 20 6.297 -9.694 4.397
118 HE3 LYS 20 2HE LYS 20 4.828 -9.226 3.544
119 HZ1 LYS 20 3HZ LYS 20 7.175 -10.367 2.496
120 HZ2 LYS 20 1HZ LYS 20 6.958 -8.841 1.797
121 HZ3 LYS 20 2HZ LYS 20 5.731 -10.001 1.695
122 H VAL 21 H VAL 21 2.688 -7.805 2.180
123 HA VAL 21 HA VAL 21 0.988 -6.257 0.341
124 HB VAL 21 HB VAL 21 0.268 -8.890 1.637
125 HG11 VAL 21 1HG1 VAL 21 -1.398 -6.947 0.048
126 HG12 VAL 21 2HG1 VAL 21 -1.872 -8.616 0.369
127 HG13 VAL 21 3HG1 VAL 21 -1.661 -7.486 1.706
128 HG21 VAL 21 3HG2 VAL 21 0.951 -8.061 -1.151
129 HG22 VAL 21 1HG2 VAL 21 1.481 -9.474 -0.238
130 HG23 VAL 21 2HG2 VAL 21 -0.159 -9.405 -0.882
131 H PHE 22 H PHE 22 -0.420 -4.877 1.281
132 HA PHE 22 HA PHE 22 -0.764 -5.028 4.198
133 HB2 PHE 22 1HB PHE 22 -0.295 -2.486 2.626
134 HB3 PHE 22 2HB PHE 22 -0.547 -2.604 4.365
135 HD1 PHE 22 HD1 PHE 22 1.774 -3.443 1.620
136 HD2 PHE 22 HD2 PHE 22 1.232 -3.097 5.828
137 HE1 PHE 22 HE1 PHE 22 4.200 -3.690 1.949
138 HE2 PHE 22 HE2 PHE 22 3.657 -3.342 6.163
139 HZ PHE 22 HZ PHE 22 5.144 -3.638 4.223
140 H THR 23 H THR 23 -2.563 -3.406 4.876
141 HA THR 23 HA THR 23 -4.851 -3.922 3.114
142 HB THR 23 HB THR 23 -4.912 -4.721 5.505
143 HG1 THR 23 HG1 THR 23 -6.970 -2.834 5.148
144 HG21 THR 23 3HG2 THR 23 -4.055 -2.133 6.055
145 HG22 THR 23 1HG2 THR 23 -4.600 -3.332 7.228
146 HG23 THR 23 2HG2 THR 23 -5.741 -2.157 6.572
147 H GLN 24 H GLN 24 -3.034 -1.363 4.639
148 HA GLN 24 HA GLN 24 -4.824 0.612 3.383
149 HB2 GLN 24 1HB GLN 24 -3.122 0.836 5.866
150 HB3 GLN 24 2HB GLN 24 -3.882 2.218 5.087
151 HG2 GLN 24 1HG GLN 24 -6.071 0.900 5.360
152 HG3 GLN 24 2HG GLN 24 -5.164 -0.075 6.516
153 HE21 GLN 24 1HE2 GLN 24 -6.778 0.727 8.026
154 HE22 GLN 24 2HE2 GLN 24 -6.534 2.265 8.776
155 H ASN 25 H ASN 25 -3.951 2.213 2.124
156 HA ASN 25 HA ASN 25 -1.627 1.705 0.700
157 HB2 ASN 25 1HB ASN 25 -3.213 3.166 -0.280
158 HB3 ASN 25 2HB ASN 25 -3.204 4.240 1.116
159 HD21 ASN 25 1HD2 ASN 25 -0.982 2.919 -1.312
160 HD22 ASN 25 2HD2 ASN 25 -0.100 4.386 -1.550
161 H SER 26 H SER 26 -2.095 4.191 3.217
162 HA SER 26 HA SER 26 0.349 5.301 3.408
163 HB2 SER 26 1HB SER 26 -1.728 5.609 4.927
164 HB3 SER 26 2HB SER 26 -0.991 4.363 5.935
165 HG SER 26 HG SER 26 0.960 5.924 5.575
166 H HIS 27 H HIS 27 -0.547 2.139 4.723
167 HA HIS 27 HA HIS 27 1.857 1.558 6.031
168 HB2 HIS 27 1HB HIS 27 -0.087 -0.342 4.704
169 HB3 HIS 27 2HB HIS 27 1.166 -0.809 5.850
170 HD1 HIS 27 HD1 HIS 27 -0.519 -1.689 7.573
171 HD2 HIS 27 HD2 HIS 27 -1.060 2.313 6.597
172 HE1 HIS 27 HE1 HIS 27 -2.125 -0.791 9.287
173 H LEU 28 H LEU 28 0.830 0.890 2.701
174 HA LEU 28 HA LEU 28 3.222 -0.453 1.960
175 HB2 LEU 28 1HB LEU 28 1.248 -0.867 0.701
176 HB3 LEU 28 2HB LEU 28 1.031 0.849 0.363
177 HG LEU 28 HG LEU 28 3.182 0.712 -0.977
178 HD11 LEU 28 1HD1 LEU 28 3.527 -1.683 -1.863
179 HD12 LEU 28 2HD1 LEU 28 2.729 -2.184 -0.373
180 HD13 LEU 28 3HD1 LEU 28 4.222 -1.249 -0.301
181 HD21 LEU 28 3HD2 LEU 28 1.311 0.925 -2.295
182 HD22 LEU 28 1HD2 LEU 28 0.588 -0.570 -1.701
183 HD23 LEU 28 2HD2 LEU 28 1.932 -0.633 -2.842
184 H THR 29 H THR 29 2.011 2.690 0.785
185 HA THR 29 HA THR 29 4.215 3.653 -0.451
186 HB THR 29 HB THR 29 2.222 4.974 -0.450
187 HG1 THR 29 HG1 THR 29 3.359 6.757 -0.543
188 HG21 THR 29 3HG2 THR 29 1.809 6.316 1.791
189 HG22 THR 29 1HG2 THR 29 2.567 4.894 2.508
190 HG23 THR 29 2HG2 THR 29 1.105 4.719 1.537
191 H ASN 30 H ASN 30 3.805 3.221 2.970
192 HA ASN 30 HA ASN 30 6.105 4.823 3.674
193 HB2 ASN 30 1HB ASN 30 4.537 4.865 5.383
194 HB3 ASN 30 2HB ASN 30 4.122 3.165 5.185
195 HD21 ASN 30 1HD2 ASN 30 4.338 3.014 7.482
196 HD22 ASN 30 2HD2 ASN 30 5.902 2.840 8.195
197 H HIS 31 H HIS 31 5.276 1.361 3.772
198 HA HIS 31 HA HIS 31 7.587 0.276 4.716
199 HB2 HIS 31 1HB HIS 31 5.778 -1.182 4.219
200 HB3 HIS 31 2HB HIS 31 5.763 -0.705 2.523
201 HD1 HIS 31 HD1 HIS 31 7.695 -2.803 4.973
202 HD2 HIS 31 HD2 HIS 31 7.503 -2.100 0.883
203 HE1 HIS 31 HE1 HIS 31 9.119 -4.587 3.916
204 H TRP 32 H TRP 32 6.943 1.027 1.292
205 HA TRP 32 HA TRP 32 9.163 0.245 0.024
206 HB2 TRP 32 1HB TRP 32 7.516 2.714 -0.231
207 HB3 TRP 32 2HB TRP 32 9.026 2.643 -1.135
208 HD1 TRP 32 HD1 TRP 32 5.803 0.520 -0.719
209 HE1 TRP 32 HE1 TRP 32 5.307 -0.613 -2.976
210 HE3 TRP 32 HE3 TRP 32 9.901 2.097 -3.336
211 HZ2 TRP 32 HZ2 TRP 32 6.496 -0.812 -5.528
212 HZ3 TRP 32 HZ3 TRP 32 10.147 1.391 -5.680
213 HH2 TRP 32 HH2 TRP 32 8.479 -0.034 -6.752
214 H ARG 33 H ARG 33 9.020 2.787 2.408
215 HA ARG 33 HA ARG 33 11.279 4.239 2.036
216 HB2 ARG 33 1HB ARG 33 9.966 3.195 4.514
217 HB3 ARG 33 2HB ARG 33 11.496 4.052 4.651
218 HG2 ARG 33 1HG ARG 33 10.274 5.846 3.188
219 HG3 ARG 33 2HG ARG 33 8.824 5.061 3.816
220 HD2 ARG 33 1HD ARG 33 9.460 6.941 5.221
221 HD3 ARG 33 2HD ARG 33 9.625 5.423 6.101
222 HE ARG 33 HE ARG 33 12.103 5.936 5.016
223 HH11 ARG 33 1HH1 ARG 33 9.919 7.530 7.209
224 HH12 ARG 33 2HH1 ARG 33 11.180 8.317 8.099
225 HH21 ARG 33 1HH2 ARG 33 13.772 6.967 6.180
226 HH22 ARG 33 2HH2 ARG 33 13.372 7.997 7.512
227 H ILE 34 H ILE 34 11.205 1.180 3.874
228 HA ILE 34 HA ILE 34 13.910 0.906 4.333
229 HB ILE 34 HB ILE 34 13.537 -1.505 4.521
230 HG12 ILE 34 1HG1 ILE 34 10.667 -1.198 3.764
231 HG13 ILE 34 2HG1 ILE 34 11.854 -1.342 2.472
232 HG21 ILE 34 1HG2 ILE 34 12.902 -0.518 6.485
233 HG22 ILE 34 2HG2 ILE 34 11.628 0.433 5.723
234 HG23 ILE 34 3HG2 ILE 34 11.384 -1.288 6.022
235 HD11 ILE 34 3HD1 ILE 34 10.816 -3.355 4.304
236 HD12 ILE 34 1HD1 ILE 34 11.545 -3.534 2.709
237 HD13 ILE 34 2HD1 ILE 34 12.571 -3.379 4.135
238 H HIS 35 H HIS 35 12.141 0.443 1.384
239 HA HIS 35 HA HIS 35 14.314 -0.951 0.066
240 HB2 HIS 35 1HB HIS 35 11.647 0.069 -0.918
241 HB3 HIS 35 2HB HIS 35 12.820 -0.733 -1.957
242 HD1 HIS 35 HD1 HIS 35 13.669 -3.077 -0.237
243 HD2 HIS 35 HD2 HIS 35 9.727 -1.808 -0.569
244 HE1 HIS 35 HE1 HIS 35 12.266 -5.074 0.372
245 H THR 36 H THR 36 12.903 2.270 0.144
246 HA THR 36 HA THR 36 14.465 3.311 -2.005
247 HB THR 36 HB THR 36 13.694 5.515 -1.274
248 HG1 THR 36 HG1 THR 36 13.315 4.171 1.085
249 HG21 THR 36 3HG2 THR 36 12.191 3.844 -2.511
250 HG22 THR 36 1HG2 THR 36 11.412 5.225 -1.741
251 HG23 THR 36 2HG2 THR 36 11.364 3.641 -0.967
252 H GLY 37 H GLY 37 16.608 3.493 -1.910
253 HA2 GLY 37 1HA GLY 37 17.913 5.140 -0.041
254 HA3 GLY 37 2HA GLY 37 18.141 3.466 0.440
255 H GLU 38 H GLU 38 20.390 4.698 -0.053
256 HA GLU 38 HA GLU 38 21.117 4.272 -2.856
257 HB2 GLU 38 1HB GLU 38 23.202 5.435 -2.293
258 HB3 GLU 38 2HB GLU 38 21.794 6.395 -1.862
259 HG2 GLU 38 1HG GLU 38 22.086 5.400 0.485
260 HG3 GLU 38 2HG GLU 38 23.697 4.943 -0.068
261 H LYS 39 H LYS 39 20.971 2.485 -0.119
262 HA LYS 39 HA LYS 39 23.136 0.724 -1.034
263 HB2 LYS 39 1HB LYS 39 22.683 1.825 1.700
264 HB3 LYS 39 2HB LYS 39 23.270 0.173 1.560
265 HG2 LYS 39 1HG LYS 39 25.051 1.208 -0.014
266 HG3 LYS 39 2HG LYS 39 24.599 2.726 0.765
267 HD2 LYS 39 1HD LYS 39 25.198 0.357 2.472
268 HD3 LYS 39 2HD LYS 39 26.540 1.228 1.726
269 HE2 LYS 39 1HE LYS 39 24.391 2.606 3.316
270 HE3 LYS 39 2HE LYS 39 25.854 1.962 4.059
271 HZ1 LYS 39 3HZ LYS 39 25.510 4.293 2.355
272 HZ2 LYS 39 1HZ LYS 39 26.910 3.382 2.087
273 HZ3 LYS 39 2HZ LYS 39 26.602 4.027 3.620
274 HA PRO 40 HA PRO 40 18.956 -1.364 -0.371
275 HB2 PRO 40 1HB PRO 40 18.567 -2.110 -2.953
276 HB3 PRO 40 2HB PRO 40 18.010 -0.562 -2.306
277 HG2 PRO 40 1HG PRO 40 20.461 -1.172 -3.912
278 HG3 PRO 40 2HG PRO 40 19.332 0.187 -4.066
279 HD2 PRO 40 1HD PRO 40 21.723 0.415 -2.816
280 HD3 PRO 40 2HD PRO 40 20.295 1.349 -2.325
281 H SER 41 H SER 41 21.430 -2.333 -2.757
282 HA SER 41 HA SER 41 22.171 -4.458 -3.300
283 HB2 SER 41 1HB SER 41 22.779 -4.070 -0.370
284 HB3 SER 41 2HB SER 41 23.394 -5.448 -1.282
285 HG SER 41 HG SER 41 24.161 -2.806 -1.341
286 H GLY 42 H GLY 42 19.419 -4.591 -2.994
287 HA2 GLY 42 1HA GLY 42 17.669 -5.979 -2.375
288 HA3 GLY 42 2HA GLY 42 18.803 -7.212 -2.904
289 HA PRO 43 HA PRO 43 17.729 -8.189 1.465
290 HB2 PRO 43 1HB PRO 43 17.630 -10.873 1.068
291 HB3 PRO 43 2HB PRO 43 16.254 -9.806 0.766
292 HG2 PRO 43 1HG PRO 43 18.225 -10.950 -1.175
293 HG3 PRO 43 2HG PRO 43 16.465 -10.797 -1.327
294 HD2 PRO 43 1HD PRO 43 18.184 -9.073 -2.511
295 HD3 PRO 43 2HD PRO 43 16.583 -8.575 -1.927
296 H SER 44 H SER 44 18.823 -9.956 2.873
297 HA SER 44 HA SER 44 21.534 -9.432 3.050
298 HB2 SER 44 1HB SER 44 19.990 -11.825 4.074
299 HB3 SER 44 2HB SER 44 21.635 -11.420 4.562
300 HG SER 44 HG SER 44 19.917 -10.634 5.971
301 H SER 45 H SER 45 22.878 -9.767 1.380
302 HA SER 45 HA SER 45 22.829 -12.384 0.041
303 HB2 SER 45 1HB SER 45 24.105 -11.284 -1.764
304 HB3 SER 45 2HB SER 45 22.576 -10.461 -1.457
305 HG SER 45 HG SER 45 24.658 -9.187 -1.645
306 H GLY 46 H GLY 46 25.029 -10.007 1.493
307 HA2 GLY 46 1HA GLY 46 27.125 -10.235 2.402
308 HA3 GLY 46 2HA GLY 46 26.645 -11.885 2.773
Start of MODEL 7
1 H1 GLY 1 H GLY 1 -8.485 -31.809 -7.259
2 HA2 GLY 1 1HA GLY 1 -9.201 -29.855 -5.958
3 HA3 GLY 1 2HA GLY 1 -8.240 -29.330 -7.332
4 H SER 2 H SER 2 -11.581 -30.520 -7.231
5 HA SER 2 HA SER 2 -12.622 -28.773 -9.082
6 HB2 SER 2 1HB SER 2 -14.840 -29.188 -7.946
7 HB3 SER 2 2HB SER 2 -13.935 -30.643 -8.359
8 HG SER 2 HG SER 2 -13.147 -30.562 -6.134
9 H SER 3 H SER 3 -12.958 -28.405 -5.548
10 HA SER 3 HA SER 3 -13.737 -25.642 -5.848
11 HB2 SER 3 1HB SER 3 -13.942 -25.657 -3.401
12 HB3 SER 3 2HB SER 3 -14.762 -27.050 -4.106
13 HG SER 3 HG SER 3 -12.504 -26.937 -2.503
14 H GLY 4 H GLY 4 -12.569 -23.837 -5.280
15 HA2 GLY 4 1HA GLY 4 -10.139 -23.798 -3.892
16 HA3 GLY 4 2HA GLY 4 -9.770 -23.940 -5.605
17 H SER 5 H SER 5 -12.260 -22.115 -3.830
18 HA SER 5 HA SER 5 -11.116 -19.640 -4.935
19 HB2 SER 5 1HB SER 5 -14.059 -20.350 -4.856
20 HB3 SER 5 2HB SER 5 -13.394 -18.800 -5.372
21 HG SER 5 HG SER 5 -13.502 -19.802 -7.250
22 H SER 6 H SER 6 -10.610 -20.588 -2.378
23 HA SER 6 HA SER 6 -12.187 -18.736 -0.712
24 HB2 SER 6 1HB SER 6 -10.893 -21.352 0.094
25 HB3 SER 6 2HB SER 6 -11.678 -20.232 1.207
26 HG SER 6 HG SER 6 -13.559 -20.932 0.572
27 H GLY 7 H GLY 7 -10.864 -18.240 1.403
28 HA2 GLY 7 1HA GLY 7 -8.955 -17.389 2.391
29 HA3 GLY 7 2HA GLY 7 -8.013 -18.093 1.084
30 H SER 8 H SER 8 -9.732 -15.283 2.201
31 HA SER 8 HA SER 8 -9.583 -13.725 -0.139
32 HB2 SER 8 1HB SER 8 -9.713 -12.941 2.778
33 HB3 SER 8 2HB SER 8 -9.808 -11.778 1.456
34 HG SER 8 HG SER 8 -11.839 -12.789 2.418
35 H GLY 9 H GLY 9 -8.049 -12.368 -0.948
36 HA2 GLY 9 1HA GLY 9 -5.776 -11.457 0.453
37 HA3 GLY 9 2HA GLY 9 -5.348 -12.899 -0.457
38 H GLU 10 H GLU 10 -3.890 -11.611 -1.695
39 HA GLU 10 HA GLU 10 -3.253 -10.368 -3.492
40 HB2 GLU 10 1HB GLU 10 -5.993 -11.300 -4.293
41 HB3 GLU 10 2HB GLU 10 -5.067 -10.239 -5.346
42 HG2 GLU 10 1HG GLU 10 -4.728 -12.494 -6.045
43 HG3 GLU 10 2HG GLU 10 -3.231 -11.898 -5.329
44 H LYS 11 H LYS 11 -4.257 -8.935 -1.253
45 HA LYS 11 HA LYS 11 -6.116 -6.997 -1.582
46 HB2 LYS 11 1HB LYS 11 -3.394 -6.901 -0.320
47 HB3 LYS 11 2HB LYS 11 -4.412 -5.467 -0.345
48 HG2 LYS 11 1HG LYS 11 -4.779 -6.511 1.734
49 HG3 LYS 11 2HG LYS 11 -6.203 -6.857 0.750
50 HD2 LYS 11 1HD LYS 11 -5.498 -9.080 0.347
51 HD3 LYS 11 2HD LYS 11 -3.879 -8.756 0.969
52 HE2 LYS 11 1HE LYS 11 -5.109 -10.002 2.615
53 HE3 LYS 11 2HE LYS 11 -4.872 -8.359 3.206
54 HZ1 LYS 11 3HZ LYS 11 -7.219 -9.601 3.228
55 HZ2 LYS 11 1HZ LYS 11 -7.324 -8.832 1.725
56 HZ3 LYS 11 2HZ LYS 11 -7.063 -7.920 3.125
57 HA PRO 12 HA PRO 12 -5.068 -4.354 -4.925
58 HB2 PRO 12 1HB PRO 12 -5.838 -1.927 -3.983
59 HB3 PRO 12 2HB PRO 12 -6.988 -3.181 -4.461
60 HG2 PRO 12 1HG PRO 12 -6.029 -2.435 -1.726
61 HG3 PRO 12 2HG PRO 12 -7.673 -2.818 -2.269
62 HD2 PRO 12 1HD PRO 12 -6.113 -4.610 -0.970
63 HD3 PRO 12 2HD PRO 12 -7.302 -5.092 -2.198
64 H TYR 13 H TYR 13 -3.314 -4.384 -2.140
65 HA TYR 13 HA TYR 13 -1.372 -2.463 -3.229
66 HB2 TYR 13 1HB TYR 13 -1.984 -2.806 -0.288
67 HB3 TYR 13 2HB TYR 13 -0.829 -1.681 -0.995
68 HD1 TYR 13 HD2 TYR 13 -1.715 0.179 -2.474
69 HD2 TYR 13 HD1 TYR 13 -4.243 -2.208 -0.022
70 HE1 TYR 13 HE2 TYR 13 -3.472 1.894 -2.625
71 HE2 TYR 13 HE1 TYR 13 -6.007 -0.501 -0.167
72 HH TYR 13 HH TYR 13 -6.176 1.939 -0.611
73 H LYS 14 H LYS 14 0.418 -3.509 -3.748
74 HA LYS 14 HA LYS 14 1.524 -5.480 -1.903
75 HB2 LYS 14 1HB LYS 14 0.157 -6.735 -3.566
76 HB3 LYS 14 2HB LYS 14 1.162 -6.068 -4.846
77 HG2 LYS 14 1HG LYS 14 3.133 -7.137 -3.717
78 HG3 LYS 14 2HG LYS 14 1.984 -7.961 -2.660
79 HD2 LYS 14 1HD LYS 14 0.965 -9.063 -4.540
80 HD3 LYS 14 2HD LYS 14 1.947 -8.131 -5.672
81 HE2 LYS 14 1HE LYS 14 3.215 -9.875 -3.589
82 HE3 LYS 14 2HE LYS 14 2.652 -10.549 -5.118
83 HZ1 LYS 14 3HZ LYS 14 4.180 -8.218 -5.587
84 HZ2 LYS 14 1HZ LYS 14 4.461 -9.798 -6.122
85 HZ3 LYS 14 2HZ LYS 14 5.066 -9.292 -4.626
86 H CYS 15 H CYS 15 3.656 -5.236 -1.672
87 HA CYS 15 HA CYS 15 5.021 -3.245 -3.254
88 HB2 CYS 15 1HB CYS 15 5.316 -3.461 -0.778
89 HB3 CYS 15 2HB CYS 15 6.132 -4.996 -1.053
90 H ASN 16 H ASN 16 5.157 -4.181 -5.311
91 HA ASN 16 HA ASN 16 5.992 -6.710 -5.994
92 HB2 ASN 16 1HB ASN 16 5.248 -5.439 -7.793
93 HB3 ASN 16 2HB ASN 16 6.236 -4.049 -7.351
94 HD21 ASN 16 1HD2 ASN 16 6.020 -6.889 -9.203
95 HD22 ASN 16 2HD2 ASN 16 7.599 -6.835 -9.903
96 H GLU 17 H GLU 17 7.930 -3.960 -5.000
97 HA GLU 17 HA GLU 17 10.454 -4.615 -5.763
98 HB2 GLU 17 1HB GLU 17 9.860 -2.628 -4.415
99 HB3 GLU 17 2HB GLU 17 9.676 -3.658 -3.003
100 HG2 GLU 17 1HG GLU 17 11.787 -2.797 -2.713
101 HG3 GLU 17 2HG GLU 17 12.119 -4.348 -3.482
102 H CYS 18 H CYS 18 9.058 -5.673 -2.652
103 HA CYS 18 HA CYS 18 10.919 -7.951 -2.695
104 HB2 CYS 18 1HB CYS 18 10.605 -8.058 -0.262
105 HB3 CYS 18 2HB CYS 18 11.176 -6.469 -0.760
106 H GLY 19 H GLY 19 7.555 -7.030 -2.103
107 HA2 GLY 19 1HA GLY 19 5.859 -8.530 -3.073
108 HA3 GLY 19 2HA GLY 19 6.824 -9.870 -2.472
109 H LYS 20 H LYS 20 5.710 -6.849 -0.953
110 HA LYS 20 HA LYS 20 4.654 -8.465 1.262
111 HB2 LYS 20 1HB LYS 20 6.396 -6.478 1.478
112 HB3 LYS 20 2HB LYS 20 4.935 -5.499 1.448
113 HG2 LYS 20 1HG LYS 20 5.121 -5.805 3.686
114 HG3 LYS 20 2HG LYS 20 4.171 -7.239 3.291
115 HD2 LYS 20 1HD LYS 20 7.135 -7.449 3.176
116 HD3 LYS 20 2HD LYS 20 6.370 -7.377 4.766
117 HE2 LYS 20 1HE LYS 20 5.855 -9.381 2.575
118 HE3 LYS 20 2HE LYS 20 6.615 -9.679 4.137
119 HZ1 LYS 20 3HZ LYS 20 4.432 -10.414 4.384
120 HZ2 LYS 20 1HZ LYS 20 3.777 -9.090 3.561
121 HZ3 LYS 20 2HZ LYS 20 4.421 -8.887 5.111
122 H VAL 21 H VAL 21 2.644 -7.745 2.278
123 HA VAL 21 HA VAL 21 0.842 -6.317 0.444
124 HB VAL 21 HB VAL 21 0.122 -8.845 1.934
125 HG11 VAL 21 1HG1 VAL 21 -1.902 -8.594 0.306
126 HG12 VAL 21 2HG1 VAL 21 -1.866 -7.684 1.818
127 HG13 VAL 21 3HG1 VAL 21 -1.438 -6.893 0.301
128 HG21 VAL 21 3HG2 VAL 21 -0.145 -9.751 -0.413
129 HG22 VAL 21 1HG2 VAL 21 0.744 -8.331 -0.964
130 HG23 VAL 21 2HG2 VAL 21 1.512 -9.484 0.128
131 H PHE 22 H PHE 22 -0.526 -4.902 1.387
132 HA PHE 22 HA PHE 22 -0.756 -4.938 4.317
133 HB2 PHE 22 1HB PHE 22 -0.382 -2.427 2.677
134 HB3 PHE 22 2HB PHE 22 -0.459 -2.546 4.432
135 HD1 PHE 22 HD1 PHE 22 1.565 -3.479 1.477
136 HD2 PHE 22 HD2 PHE 22 1.467 -2.949 5.699
137 HE1 PHE 22 HE1 PHE 22 4.011 -3.727 1.561
138 HE2 PHE 22 HE2 PHE 22 3.913 -3.196 5.790
139 HZ PHE 22 HZ PHE 22 5.189 -3.585 3.719
140 H THR 23 H THR 23 -2.568 -3.509 5.088
141 HA THR 23 HA THR 23 -4.911 -4.036 3.441
142 HB THR 23 HB THR 23 -4.978 -4.666 5.818
143 HG1 THR 23 HG1 THR 23 -6.766 -2.499 5.389
144 HG21 THR 23 3HG2 THR 23 -4.543 -3.266 7.541
145 HG22 THR 23 1HG2 THR 23 -5.264 -1.875 6.732
146 HG23 THR 23 2HG2 THR 23 -3.626 -2.383 6.321
147 H GLN 24 H GLN 24 -3.150 -1.317 4.824
148 HA GLN 24 HA GLN 24 -5.009 0.546 3.525
149 HB2 GLN 24 1HB GLN 24 -2.952 0.917 5.697
150 HB3 GLN 24 2HB GLN 24 -3.730 2.273 4.890
151 HG2 GLN 24 1HG GLN 24 -5.905 1.501 5.648
152 HG3 GLN 24 2HG GLN 24 -5.152 0.107 6.421
153 HE21 GLN 24 1HE2 GLN 24 -5.902 0.674 8.451
154 HE22 GLN 24 2HE2 GLN 24 -5.258 2.008 9.339
155 H ASN 25 H ASN 25 -3.803 2.635 2.767
156 HA ASN 25 HA ASN 25 -1.928 1.766 0.738
157 HB2 ASN 25 1HB ASN 25 -3.735 3.286 0.108
158 HB3 ASN 25 2HB ASN 25 -3.163 4.477 1.272
159 HD21 ASN 25 1HD2 ASN 25 -1.739 5.939 0.617
160 HD22 ASN 25 2HD2 ASN 25 -0.881 5.901 -0.881
161 H SER 26 H SER 26 -1.974 4.089 3.425
162 HA SER 26 HA SER 26 0.563 5.155 3.148
163 HB2 SER 26 1HB SER 26 -1.094 4.607 5.611
164 HB3 SER 26 2HB SER 26 0.453 5.451 5.683
165 HG SER 26 HG SER 26 -1.968 6.259 4.511
166 H HIS 27 H HIS 27 -0.432 2.128 4.655
167 HA HIS 27 HA HIS 27 1.950 1.418 5.903
168 HB2 HIS 27 1HB HIS 27 -0.094 -0.371 4.571
169 HB3 HIS 27 2HB HIS 27 1.159 -0.924 5.678
170 HD1 HIS 27 HD1 HIS 27 -0.460 -1.744 7.467
171 HD2 HIS 27 HD2 HIS 27 -0.963 2.264 6.495
172 HE1 HIS 27 HE1 HIS 27 -2.001 -0.814 9.224
173 H LEU 28 H LEU 28 0.896 0.852 2.565
174 HA LEU 28 HA LEU 28 3.251 -0.573 1.819
175 HB2 LEU 28 1HB LEU 28 1.254 -0.965 0.586
176 HB3 LEU 28 2HB LEU 28 1.067 0.751 0.228
177 HG LEU 28 HG LEU 28 3.163 0.584 -1.154
178 HD11 LEU 28 1HD1 LEU 28 2.938 -2.240 -1.638
179 HD12 LEU 28 2HD1 LEU 28 3.334 -1.930 0.053
180 HD13 LEU 28 3HD1 LEU 28 4.360 -1.281 -1.226
181 HD21 LEU 28 3HD2 LEU 28 0.830 -1.143 -1.977
182 HD22 LEU 28 1HD2 LEU 28 2.027 -0.431 -3.058
183 HD23 LEU 28 2HD2 LEU 28 0.931 0.610 -2.150
184 H THR 29 H THR 29 2.119 2.752 1.281
185 HA THR 29 HA THR 29 4.279 3.666 -0.227
186 HB THR 29 HB THR 29 2.326 5.056 1.579
187 HG1 THR 29 HG1 THR 29 2.004 4.289 -0.740
188 HG21 THR 29 3HG2 THR 29 3.434 7.157 0.371
189 HG22 THR 29 1HG2 THR 29 4.866 6.136 0.483
190 HG23 THR 29 2HG2 THR 29 3.984 6.581 1.944
191 H ASN 30 H ASN 30 3.849 3.476 3.274
192 HA ASN 30 HA ASN 30 6.248 4.855 3.928
193 HB2 ASN 30 1HB ASN 30 4.299 3.153 5.430
194 HB3 ASN 30 2HB ASN 30 5.853 3.526 6.169
195 HD21 ASN 30 1HD2 ASN 30 5.639 5.106 7.565
196 HD22 ASN 30 2HD2 ASN 30 4.685 6.532 7.356
197 H HIS 31 H HIS 31 5.396 1.411 3.753
198 HA HIS 31 HA HIS 31 7.698 0.233 4.632
199 HB2 HIS 31 1HB HIS 31 5.865 -1.158 4.018
200 HB3 HIS 31 2HB HIS 31 5.876 -0.561 2.361
201 HD1 HIS 31 HD1 HIS 31 7.813 -2.809 4.683
202 HD2 HIS 31 HD2 HIS 31 7.559 -1.902 0.637
203 HE1 HIS 31 HE1 HIS 31 9.213 -4.542 3.516
204 H TRP 32 H TRP 32 7.060 1.205 1.261
205 HA TRP 32 HA TRP 32 9.314 0.515 -0.020
206 HB2 TRP 32 1HB TRP 32 7.587 2.933 -0.197
207 HB3 TRP 32 2HB TRP 32 9.115 2.965 -1.072
208 HD1 TRP 32 HD1 TRP 32 5.991 0.673 -0.812
209 HE1 TRP 32 HE1 TRP 32 5.577 -0.361 -3.133
210 HE3 TRP 32 HE3 TRP 32 10.029 2.594 -3.289
211 HZ2 TRP 32 HZ2 TRP 32 6.800 -0.363 -5.676
212 HZ3 TRP 32 HZ3 TRP 32 10.335 2.027 -5.664
213 HH2 TRP 32 HH2 TRP 32 8.753 0.579 -6.831
214 H ARG 33 H ARG 33 9.089 2.887 2.510
215 HA ARG 33 HA ARG 33 11.334 4.419 2.188
216 HB2 ARG 33 1HB ARG 33 10.117 3.260 4.690
217 HB3 ARG 33 2HB ARG 33 11.472 4.379 4.739
218 HG2 ARG 33 1HG ARG 33 10.182 6.122 3.782
219 HG3 ARG 33 2HG ARG 33 8.870 5.014 3.376
220 HD2 ARG 33 1HD ARG 33 8.336 4.697 5.687
221 HD3 ARG 33 2HD ARG 33 9.771 5.588 6.192
222 HE ARG 33 HE ARG 33 7.909 7.092 4.575
223 HH11 ARG 33 1HH1 ARG 33 8.888 6.179 7.789
224 HH12 ARG 33 2HH1 ARG 33 8.139 7.545 8.546
225 HH21 ARG 33 1HH2 ARG 33 6.919 8.895 5.560
226 HH22 ARG 33 2HH2 ARG 33 7.019 9.090 7.277
227 H ILE 34 H ILE 34 11.214 1.298 3.912
228 HA ILE 34 HA ILE 34 13.906 1.044 4.487
229 HB ILE 34 HB ILE 34 13.557 -1.345 4.660
230 HG12 ILE 34 1HG1 ILE 34 10.766 -1.144 3.621
231 HG13 ILE 34 2HG1 ILE 34 12.081 -1.237 2.455
232 HG21 ILE 34 1HG2 ILE 34 11.230 0.325 5.584
233 HG22 ILE 34 2HG2 ILE 34 11.496 -1.341 6.097
234 HG23 ILE 34 3HG2 ILE 34 12.686 -0.099 6.485
235 HD11 ILE 34 3HD1 ILE 34 12.827 -3.285 3.863
236 HD12 ILE 34 1HD1 ILE 34 11.159 -3.263 4.435
237 HD13 ILE 34 2HD1 ILE 34 11.499 -3.443 2.713
238 H HIS 35 H HIS 35 12.296 0.770 1.450
239 HA HIS 35 HA HIS 35 14.518 -0.610 0.180
240 HB2 HIS 35 1HB HIS 35 11.884 0.425 -0.878
241 HB3 HIS 35 2HB HIS 35 13.107 -0.331 -1.895
242 HD1 HIS 35 HD1 HIS 35 13.897 -2.691 -0.089
243 HD2 HIS 35 HD2 HIS 35 9.978 -1.516 -0.813
244 HE1 HIS 35 HE1 HIS 35 12.491 -4.728 0.356
245 H THR 36 H THR 36 13.052 2.593 0.269
246 HA THR 36 HA THR 36 14.958 3.646 -1.651
247 HB THR 36 HB THR 36 13.811 5.847 -1.131
248 HG1 THR 36 HG1 THR 36 12.751 5.677 0.727
249 HG21 THR 36 3HG2 THR 36 13.210 4.471 -3.072
250 HG22 THR 36 1HG2 THR 36 11.799 5.287 -2.400
251 HG23 THR 36 2HG2 THR 36 12.062 3.573 -2.079
252 H GLY 37 H GLY 37 16.934 3.360 -0.551
253 HA2 GLY 37 1HA GLY 37 17.499 5.491 1.352
254 HA3 GLY 37 2HA GLY 37 17.750 3.853 1.938
255 H GLU 38 H GLU 38 19.979 4.328 2.221
256 HA GLU 38 HA GLU 38 21.504 4.621 -0.277
257 HB2 GLU 38 1HB GLU 38 22.192 5.256 2.588
258 HB3 GLU 38 2HB GLU 38 23.413 5.177 1.326
259 HG2 GLU 38 1HG GLU 38 22.972 7.401 1.288
260 HG3 GLU 38 2HG GLU 38 21.777 6.850 0.115
261 H LYS 39 H LYS 39 22.918 3.087 -0.918
262 HA LYS 39 HA LYS 39 23.541 0.869 -1.140
263 HB2 LYS 39 1HB LYS 39 25.309 0.311 0.469
264 HB3 LYS 39 2HB LYS 39 25.451 1.971 -0.092
265 HG2 LYS 39 1HG LYS 39 24.772 2.854 1.942
266 HG3 LYS 39 2HG LYS 39 24.014 1.344 2.455
267 HD2 LYS 39 1HD LYS 39 26.976 1.548 1.998
268 HD3 LYS 39 2HD LYS 39 26.243 1.991 3.542
269 HE2 LYS 39 1HE LYS 39 25.206 -0.278 3.613
270 HE3 LYS 39 2HE LYS 39 26.133 -0.692 2.172
271 HZ1 LYS 39 3HZ LYS 39 27.879 -1.139 3.434
272 HZ2 LYS 39 1HZ LYS 39 26.955 -0.841 4.820
273 HZ3 LYS 39 2HZ LYS 39 27.851 0.409 4.115
274 HA PRO 40 HA PRO 40 20.356 -0.701 1.978
275 HB2 PRO 40 1HB PRO 40 18.448 -1.381 0.171
276 HB3 PRO 40 2HB PRO 40 18.537 0.218 0.918
277 HG2 PRO 40 1HG PRO 40 19.493 -0.668 -1.776
278 HG3 PRO 40 2HG PRO 40 18.631 0.815 -1.327
279 HD2 PRO 40 1HD PRO 40 21.307 0.752 -1.735
280 HD3 PRO 40 2HD PRO 40 20.545 1.846 -0.562
281 H SER 41 H SER 41 22.345 -1.770 -0.430
282 HA SER 41 HA SER 41 21.384 -4.437 -0.782
283 HB2 SER 41 1HB SER 41 23.447 -4.843 -1.957
284 HB3 SER 41 2HB SER 41 22.883 -3.232 -2.400
285 HG SER 41 HG SER 41 24.490 -2.340 -1.286
286 H GLY 42 H GLY 42 22.150 -6.352 0.121
287 HA2 GLY 42 1HA GLY 42 24.126 -6.232 2.252
288 HA3 GLY 42 2HA GLY 42 22.491 -6.629 2.758
289 HA PRO 43 HA PRO 43 23.406 -10.854 1.988
290 HB2 PRO 43 1HB PRO 43 20.886 -11.807 1.657
291 HB3 PRO 43 2HB PRO 43 21.535 -11.336 3.232
292 HG2 PRO 43 1HG PRO 43 19.750 -9.801 1.383
293 HG3 PRO 43 2HG PRO 43 19.653 -9.973 3.145
294 HD2 PRO 43 1HD PRO 43 20.697 -7.779 1.950
295 HD3 PRO 43 2HD PRO 43 21.278 -8.382 3.516
296 H SER 44 H SER 44 24.477 -10.856 0.014
297 HA SER 44 HA SER 44 22.777 -11.434 -2.313
298 HB2 SER 44 1HB SER 44 25.287 -9.745 -2.401
299 HB3 SER 44 2HB SER 44 24.244 -10.145 -3.765
300 HG SER 44 HG SER 44 23.685 -8.482 -1.549
301 H SER 45 H SER 45 23.354 -13.192 -3.441
302 HA SER 45 HA SER 45 26.065 -14.188 -3.415
303 HB2 SER 45 1HB SER 45 24.785 -15.056 -1.308
304 HB3 SER 45 2HB SER 45 23.979 -16.123 -2.458
305 HG SER 45 HG SER 45 26.796 -15.903 -2.283
306 H GLY 46 H GLY 46 26.486 -15.672 -5.063
307 HA2 GLY 46 1HA GLY 46 24.246 -16.505 -6.754
308 HA3 GLY 46 2HA GLY 46 25.477 -15.485 -7.483
Start of MODEL 8
1 H1 GLY 1 H GLY 1 -6.784 -37.555 1.896
2 HA2 GLY 1 1HA GLY 1 -7.238 -35.538 0.101
3 HA3 GLY 1 2HA GLY 1 -8.847 -36.049 0.590
4 H SER 2 H SER 2 -9.691 -34.906 2.186
5 HA SER 2 HA SER 2 -9.915 -33.682 4.092
6 HB2 SER 2 1HB SER 2 -8.308 -35.608 4.899
7 HB3 SER 2 2HB SER 2 -7.116 -34.310 4.952
8 HG SER 2 HG SER 2 -7.967 -33.951 6.844
9 H SER 3 H SER 3 -9.132 -32.376 1.777
10 HA SER 3 HA SER 3 -7.032 -30.499 2.544
11 HB2 SER 3 1HB SER 3 -7.213 -29.656 0.253
12 HB3 SER 3 2HB SER 3 -7.029 -31.410 0.247
13 HG SER 3 HG SER 3 -8.677 -30.827 -1.165
14 H GLY 4 H GLY 4 -7.494 -28.135 1.977
15 HA2 GLY 4 1HA GLY 4 -10.034 -27.025 1.910
16 HA3 GLY 4 2HA GLY 4 -9.644 -27.247 3.609
17 H SER 5 H SER 5 -9.765 -24.964 1.386
18 HA SER 5 HA SER 5 -8.095 -23.165 2.781
19 HB2 SER 5 1HB SER 5 -6.449 -22.722 0.950
20 HB3 SER 5 2HB SER 5 -6.253 -24.304 1.704
21 HG SER 5 HG SER 5 -7.525 -23.733 -0.767
22 H SER 6 H SER 6 -8.778 -21.139 2.412
23 HA SER 6 HA SER 6 -9.650 -20.129 -0.066
24 HB2 SER 6 1HB SER 6 -12.037 -19.989 0.250
25 HB3 SER 6 2HB SER 6 -11.564 -21.679 0.422
26 HG SER 6 HG SER 6 -11.402 -20.888 2.808
27 H GLY 7 H GLY 7 -8.856 -18.148 0.202
28 HA2 GLY 7 1HA GLY 7 -9.560 -16.707 2.686
29 HA3 GLY 7 2HA GLY 7 -7.991 -16.545 1.910
30 H SER 8 H SER 8 -11.037 -15.217 2.221
31 HA SER 8 HA SER 8 -11.041 -13.935 -0.397
32 HB2 SER 8 1HB SER 8 -12.998 -13.554 1.879
33 HB3 SER 8 2HB SER 8 -13.224 -13.091 0.193
34 HG SER 8 HG SER 8 -12.753 -15.556 -0.041
35 H GLY 9 H GLY 9 -9.976 -12.104 -0.717
36 HA2 GLY 9 1HA GLY 9 -10.238 -9.774 0.742
37 HA3 GLY 9 2HA GLY 9 -8.842 -10.598 1.421
38 H GLU 10 H GLU 10 -9.815 -8.378 -0.827
39 HA GLU 10 HA GLU 10 -7.894 -8.959 -2.887
40 HB2 GLU 10 1HB GLU 10 -9.680 -6.594 -2.334
41 HB3 GLU 10 2HB GLU 10 -8.534 -6.618 -3.668
42 HG2 GLU 10 1HG GLU 10 -9.730 -8.866 -4.260
43 HG3 GLU 10 2HG GLU 10 -11.034 -8.187 -3.286
44 H LYS 11 H LYS 11 -6.006 -7.809 -3.358
45 HA LYS 11 HA LYS 11 -4.862 -6.373 -1.055
46 HB2 LYS 11 1HB LYS 11 -3.431 -7.854 -3.271
47 HB3 LYS 11 2HB LYS 11 -2.662 -7.051 -1.908
48 HG2 LYS 11 1HG LYS 11 -3.537 -8.621 -0.370
49 HG3 LYS 11 2HG LYS 11 -4.628 -9.300 -1.580
50 HD2 LYS 11 1HD LYS 11 -1.705 -9.336 -2.138
51 HD3 LYS 11 2HD LYS 11 -2.343 -10.478 -0.952
52 HE2 LYS 11 1HE LYS 11 -2.568 -11.726 -2.851
53 HE3 LYS 11 2HE LYS 11 -4.129 -10.906 -2.848
54 HZ1 LYS 11 3HZ LYS 11 -2.056 -9.431 -4.187
55 HZ2 LYS 11 1HZ LYS 11 -3.625 -9.800 -4.701
56 HZ3 LYS 11 2HZ LYS 11 -2.380 -10.926 -4.908
57 HA PRO 12 HA PRO 12 -5.355 -3.160 -4.325
58 HB2 PRO 12 1HB PRO 12 -5.981 -1.176 -2.581
59 HB3 PRO 12 2HB PRO 12 -7.183 -2.297 -3.233
60 HG2 PRO 12 1HG PRO 12 -5.787 -2.345 -0.585
61 HG3 PRO 12 2HG PRO 12 -7.495 -2.648 -0.955
62 HD2 PRO 12 1HD PRO 12 -5.721 -4.648 -0.524
63 HD3 PRO 12 2HD PRO 12 -7.093 -4.812 -1.639
64 H TYR 13 H TYR 13 -3.159 -3.913 -1.991
65 HA TYR 13 HA TYR 13 -1.270 -1.960 -2.965
66 HB2 TYR 13 1HB TYR 13 -1.813 -2.060 0.004
67 HB3 TYR 13 2HB TYR 13 -0.709 -0.983 -0.844
68 HD1 TYR 13 HD2 TYR 13 -1.691 0.742 -2.425
69 HD2 TYR 13 HD1 TYR 13 -4.063 -1.464 0.334
70 HE1 TYR 13 HE2 TYR 13 -3.477 2.422 -2.627
71 HE2 TYR 13 HE1 TYR 13 -5.856 0.209 0.139
72 HH TYR 13 HH TYR 13 -6.504 1.985 -1.872
73 H LYS 14 H LYS 14 0.269 -3.348 -3.562
74 HA LYS 14 HA LYS 14 1.440 -5.072 -1.512
75 HB2 LYS 14 1HB LYS 14 0.024 -6.627 -2.616
76 HB3 LYS 14 2HB LYS 14 0.441 -5.994 -4.202
77 HG2 LYS 14 1HG LYS 14 2.574 -6.980 -4.152
78 HG3 LYS 14 2HG LYS 14 2.470 -7.305 -2.421
79 HD2 LYS 14 1HD LYS 14 0.599 -8.875 -2.888
80 HD3 LYS 14 2HD LYS 14 0.864 -8.616 -4.614
81 HE2 LYS 14 1HE LYS 14 3.100 -9.502 -2.826
82 HE3 LYS 14 2HE LYS 14 1.947 -10.667 -3.475
83 HZ1 LYS 14 3HZ LYS 14 4.063 -10.258 -4.791
84 HZ2 LYS 14 1HZ LYS 14 3.383 -8.773 -5.231
85 HZ3 LYS 14 2HZ LYS 14 2.607 -10.216 -5.650
86 H CYS 15 H CYS 15 3.586 -4.909 -1.484
87 HA CYS 15 HA CYS 15 4.960 -3.205 -3.280
88 HB2 CYS 15 1HB CYS 15 5.670 -3.500 -0.951
89 HB3 CYS 15 2HB CYS 15 6.060 -5.186 -1.276
90 H ASN 16 H ASN 16 6.888 -3.831 -4.542
91 HA ASN 16 HA ASN 16 6.492 -6.446 -5.843
92 HB2 ASN 16 1HB ASN 16 7.736 -4.051 -7.182
93 HB3 ASN 16 2HB ASN 16 7.075 -5.502 -7.930
94 HD21 ASN 16 1HD2 ASN 16 6.426 -2.797 -8.558
95 HD22 ASN 16 2HD2 ASN 16 4.741 -2.587 -8.237
96 H GLU 17 H GLU 17 8.822 -4.098 -4.660
97 HA GLU 17 HA GLU 17 11.203 -5.202 -5.500
98 HB2 GLU 17 1HB GLU 17 10.430 -3.724 -3.005
99 HB3 GLU 17 2HB GLU 17 12.068 -4.330 -3.205
100 HG2 GLU 17 1HG GLU 17 12.153 -2.119 -3.937
101 HG3 GLU 17 2HG GLU 17 12.098 -3.079 -5.414
102 H CYS 18 H CYS 18 9.204 -6.137 -2.738
103 HA CYS 18 HA CYS 18 10.874 -8.548 -2.444
104 HB2 CYS 18 1HB CYS 18 10.139 -8.582 -0.060
105 HB3 CYS 18 2HB CYS 18 11.117 -7.177 -0.474
106 H GLY 19 H GLY 19 7.595 -7.224 -2.244
107 HA2 GLY 19 1HA GLY 19 5.822 -8.462 -3.379
108 HA3 GLY 19 2HA GLY 19 6.581 -9.940 -2.807
109 H LYS 20 H LYS 20 6.471 -7.321 -0.594
110 HA LYS 20 HA LYS 20 4.905 -8.798 1.260
111 HB2 LYS 20 1HB LYS 20 6.714 -6.900 1.604
112 HB3 LYS 20 2HB LYS 20 5.302 -5.852 1.558
113 HG2 LYS 20 1HG LYS 20 4.308 -7.133 3.399
114 HG3 LYS 20 2HG LYS 20 5.754 -8.143 3.460
115 HD2 LYS 20 1HD LYS 20 7.113 -6.245 4.056
116 HD3 LYS 20 2HD LYS 20 5.745 -5.150 3.840
117 HE2 LYS 20 1HE LYS 20 5.914 -5.480 6.162
118 HE3 LYS 20 2HE LYS 20 4.576 -6.505 5.646
119 HZ1 LYS 20 3HZ LYS 20 5.681 -8.360 6.192
120 HZ2 LYS 20 1HZ LYS 20 6.613 -7.338 7.166
121 HZ3 LYS 20 2HZ LYS 20 7.170 -7.785 5.633
122 H VAL 21 H VAL 21 2.853 -8.251 2.141
123 HA VAL 21 HA VAL 21 1.140 -6.723 0.290
124 HB VAL 21 HB VAL 21 0.344 -9.099 1.979
125 HG11 VAL 21 1HG1 VAL 21 -1.763 -8.482 1.659
126 HG12 VAL 21 2HG1 VAL 21 -1.205 -7.014 0.854
127 HG13 VAL 21 3HG1 VAL 21 -1.514 -8.475 -0.086
128 HG21 VAL 21 3HG2 VAL 21 -0.046 -10.090 -0.362
129 HG22 VAL 21 1HG2 VAL 21 1.025 -8.808 -0.926
130 HG23 VAL 21 2HG2 VAL 21 1.610 -9.998 0.237
131 H PHE 22 H PHE 22 -0.339 -5.304 1.135
132 HA PHE 22 HA PHE 22 -0.435 -5.022 4.057
133 HB2 PHE 22 1HB PHE 22 -0.249 -2.639 2.219
134 HB3 PHE 22 2HB PHE 22 -0.082 -2.675 3.972
135 HD1 PHE 22 HD1 PHE 22 1.545 -3.597 0.793
136 HD2 PHE 22 HD2 PHE 22 1.999 -3.110 4.997
137 HE1 PHE 22 HE1 PHE 22 3.985 -3.805 0.550
138 HE2 PHE 22 HE2 PHE 22 4.440 -3.317 4.761
139 HZ PHE 22 HZ PHE 22 5.436 -3.664 2.535
140 H THR 23 H THR 23 -2.199 -3.335 4.641
141 HA THR 23 HA THR 23 -4.582 -4.005 3.050
142 HB THR 23 HB THR 23 -4.435 -3.122 5.939
143 HG1 THR 23 HG1 THR 23 -4.809 -5.678 4.738
144 HG21 THR 23 3HG2 THR 23 -6.544 -2.459 5.161
145 HG22 THR 23 1HG2 THR 23 -6.834 -4.042 5.880
146 HG23 THR 23 2HG2 THR 23 -6.709 -3.879 4.129
147 H GLN 24 H GLN 24 -3.151 -1.347 4.939
148 HA GLN 24 HA GLN 24 -4.882 0.552 3.540
149 HB2 GLN 24 1HB GLN 24 -3.175 0.731 6.008
150 HB3 GLN 24 2HB GLN 24 -3.775 2.180 5.211
151 HG2 GLN 24 1HG GLN 24 -5.646 -0.014 6.000
152 HG3 GLN 24 2HG GLN 24 -5.106 1.185 7.175
153 HE21 GLN 24 1HE2 GLN 24 -7.100 0.550 4.450
154 HE22 GLN 24 2HE2 GLN 24 -7.886 2.087 4.389
155 H ASN 25 H ASN 25 -4.081 2.295 2.364
156 HA ASN 25 HA ASN 25 -1.779 1.819 0.830
157 HB2 ASN 25 1HB ASN 25 -3.228 3.183 -0.307
158 HB3 ASN 25 2HB ASN 25 -3.699 4.070 1.140
159 HD21 ASN 25 1HD2 ASN 25 -1.570 3.909 -1.542
160 HD22 ASN 25 2HD2 ASN 25 -0.740 5.397 -1.256
161 H SER 26 H SER 26 -2.330 3.823 3.675
162 HA SER 26 HA SER 26 0.112 5.209 3.663
163 HB2 SER 26 1HB SER 26 -1.608 4.407 6.023
164 HB3 SER 26 2HB SER 26 -0.331 5.623 6.057
165 HG SER 26 HG SER 26 -2.864 5.721 4.873
166 H HIS 27 H HIS 27 -0.461 1.941 4.027
167 HA HIS 27 HA HIS 27 1.873 1.490 5.736
168 HB2 HIS 27 1HB HIS 27 -0.210 -0.429 4.674
169 HB3 HIS 27 2HB HIS 27 1.140 -0.888 5.708
170 HD1 HIS 27 HD1 HIS 27 -0.640 -1.709 7.463
171 HD2 HIS 27 HD2 HIS 27 -0.667 2.376 6.707
172 HE1 HIS 27 HE1 HIS 27 -1.979 -0.689 9.331
173 H LEU 28 H LEU 28 0.747 1.117 2.454
174 HA LEU 28 HA LEU 28 2.924 -0.542 1.603
175 HB2 LEU 28 1HB LEU 28 0.843 -0.659 0.420
176 HB3 LEU 28 2HB LEU 28 0.883 1.071 0.086
177 HG LEU 28 HG LEU 28 2.810 0.730 -1.397
178 HD11 LEU 28 1HD1 LEU 28 3.984 -1.107 -0.683
179 HD12 LEU 28 2HD1 LEU 28 3.113 -1.782 -2.059
180 HD13 LEU 28 3HD1 LEU 28 2.532 -2.073 -0.420
181 HD21 LEU 28 3HD2 LEU 28 0.243 0.354 -1.992
182 HD22 LEU 28 1HD2 LEU 28 0.843 -1.261 -2.372
183 HD23 LEU 28 2HD2 LEU 28 1.530 0.148 -3.182
184 H THR 29 H THR 29 2.037 2.811 0.758
185 HA THR 29 HA THR 29 4.410 3.493 -0.511
186 HB THR 29 HB THR 29 2.438 4.912 -0.653
187 HG1 THR 29 HG1 THR 29 4.714 6.172 0.512
188 HG21 THR 29 3HG2 THR 29 2.371 4.640 2.130
189 HG22 THR 29 1HG2 THR 29 1.287 5.605 1.129
190 HG23 THR 29 2HG2 THR 29 2.724 6.343 1.837
191 H ASN 30 H ASN 30 3.663 3.302 2.886
192 HA ASN 30 HA ASN 30 5.938 4.792 3.777
193 HB2 ASN 30 1HB ASN 30 4.009 4.647 5.220
194 HB3 ASN 30 2HB ASN 30 4.084 2.887 5.218
195 HD21 ASN 30 1HD2 ASN 30 4.144 4.729 7.457
196 HD22 ASN 30 2HD2 ASN 30 5.620 4.421 8.300
197 H HIS 31 H HIS 31 5.199 1.375 3.304
198 HA HIS 31 HA HIS 31 7.468 0.273 4.505
199 HB2 HIS 31 1HB HIS 31 5.799 -1.268 3.955
200 HB3 HIS 31 2HB HIS 31 5.636 -0.652 2.313
201 HD1 HIS 31 HD1 HIS 31 8.002 -2.710 4.430
202 HD2 HIS 31 HD2 HIS 31 7.137 -1.962 0.436
203 HE1 HIS 31 HE1 HIS 31 9.374 -4.364 3.124
204 H TRP 32 H TRP 32 6.930 1.121 1.087
205 HA TRP 32 HA TRP 32 9.263 0.388 -0.066
206 HB2 TRP 32 1HB TRP 32 7.521 2.788 -0.472
207 HB3 TRP 32 2HB TRP 32 9.031 2.660 -1.370
208 HD1 TRP 32 HD1 TRP 32 5.942 0.380 -0.731
209 HE1 TRP 32 HE1 TRP 32 5.402 -0.842 -2.931
210 HE3 TRP 32 HE3 TRP 32 9.736 2.211 -3.628
211 HZ2 TRP 32 HZ2 TRP 32 6.447 -1.008 -5.548
212 HZ3 TRP 32 HZ3 TRP 32 9.896 1.470 -5.968
213 HH2 TRP 32 HH2 TRP 32 8.285 -0.107 -6.907
214 H ARG 33 H ARG 33 8.862 2.819 2.352
215 HA ARG 33 HA ARG 33 11.041 4.463 1.989
216 HB2 ARG 33 1HB ARG 33 9.835 3.398 4.543
217 HB3 ARG 33 2HB ARG 33 11.066 4.653 4.508
218 HG2 ARG 33 1HG ARG 33 9.594 6.113 3.266
219 HG3 ARG 33 2HG ARG 33 8.372 4.843 3.177
220 HD2 ARG 33 1HD ARG 33 7.719 6.312 4.924
221 HD3 ARG 33 2HD ARG 33 8.333 4.846 5.688
222 HE ARG 33 HE ARG 33 9.948 6.115 6.673
223 HH11 ARG 33 1HH1 ARG 33 8.759 7.816 3.877
224 HH12 ARG 33 2HH1 ARG 33 9.701 9.238 4.181
225 HH21 ARG 33 1HH2 ARG 33 11.192 7.982 7.083
226 HH22 ARG 33 2HH2 ARG 33 11.085 9.331 6.004
227 H ILE 34 H ILE 34 10.942 1.293 3.577
228 HA ILE 34 HA ILE 34 13.678 1.261 4.316
229 HB ILE 34 HB ILE 34 13.390 -1.088 4.776
230 HG12 ILE 34 1HG1 ILE 34 10.600 -1.106 3.715
231 HG13 ILE 34 2HG1 ILE 34 11.925 -1.290 2.571
232 HG21 ILE 34 1HG2 ILE 34 11.361 0.872 5.616
233 HG22 ILE 34 2HG2 ILE 34 10.970 -0.816 5.937
234 HG23 ILE 34 3HG2 ILE 34 12.455 -0.117 6.583
235 HD11 ILE 34 3HD1 ILE 34 12.752 -3.177 4.011
236 HD12 ILE 34 1HD1 ILE 34 11.227 -3.065 4.888
237 HD13 ILE 34 2HD1 ILE 34 11.229 -3.461 3.169
238 H HIS 35 H HIS 35 12.149 0.934 1.320
239 HA HIS 35 HA HIS 35 14.295 -0.676 0.162
240 HB2 HIS 35 1HB HIS 35 11.639 0.295 -0.870
241 HB3 HIS 35 2HB HIS 35 12.858 -0.371 -1.954
242 HD1 HIS 35 HD1 HIS 35 13.814 -2.675 -0.040
243 HD2 HIS 35 HD2 HIS 35 9.865 -1.800 -0.987
244 HE1 HIS 35 HE1 HIS 35 12.540 -4.807 0.353
245 H THR 36 H THR 36 13.155 2.596 0.338
246 HA THR 36 HA THR 36 15.553 3.505 -1.031
247 HB THR 36 HB THR 36 13.950 3.341 -2.868
248 HG1 THR 36 HG1 THR 36 15.153 5.055 -3.323
249 HG21 THR 36 3HG2 THR 36 11.788 3.815 -2.622
250 HG22 THR 36 1HG2 THR 36 12.168 5.471 -2.153
251 HG23 THR 36 2HG2 THR 36 12.096 4.203 -0.929
252 H GLY 37 H GLY 37 16.422 4.955 0.292
253 HA2 GLY 37 1HA GLY 37 15.725 7.375 1.017
254 HA3 GLY 37 2HA GLY 37 14.680 6.467 2.100
255 H GLU 38 H GLU 38 18.054 5.975 1.074
256 HA GLU 38 HA GLU 38 18.848 5.316 3.747
257 HB2 GLU 38 1HB GLU 38 20.191 5.487 1.093
258 HB3 GLU 38 2HB GLU 38 21.202 5.556 2.530
259 HG2 GLU 38 1HG GLU 38 19.376 3.339 1.659
260 HG3 GLU 38 2HG GLU 38 21.128 3.298 1.849
261 H LYS 39 H LYS 39 18.552 7.064 5.082
262 HA LYS 39 HA LYS 39 18.939 9.705 4.729
263 HB2 LYS 39 1HB LYS 39 18.282 9.304 6.873
264 HB3 LYS 39 2HB LYS 39 19.323 7.896 7.043
265 HG2 LYS 39 1HG LYS 39 21.257 9.349 7.340
266 HG3 LYS 39 2HG LYS 39 20.225 10.768 7.148
267 HD2 LYS 39 1HD LYS 39 20.264 10.640 9.427
268 HD3 LYS 39 2HD LYS 39 18.877 9.596 9.106
269 HE2 LYS 39 1HE LYS 39 20.638 7.699 9.024
270 HE3 LYS 39 2HE LYS 39 21.676 8.847 9.866
271 HZ1 LYS 39 3HZ LYS 39 20.490 8.669 11.754
272 HZ2 LYS 39 1HZ LYS 39 20.029 7.175 11.108
273 HZ3 LYS 39 2HZ LYS 39 19.006 8.513 10.958
274 HA PRO 40 HA PRO 40 23.687 9.457 5.571
275 HB2 PRO 40 1HB PRO 40 24.817 6.990 5.650
276 HB3 PRO 40 2HB PRO 40 24.159 7.792 7.082
277 HG2 PRO 40 1HG PRO 40 22.918 5.689 5.351
278 HG3 PRO 40 2HG PRO 40 22.926 5.821 7.119
279 HD2 PRO 40 1HD PRO 40 20.797 6.551 5.614
280 HD3 PRO 40 2HD PRO 40 21.212 7.362 7.138
281 H SER 41 H SER 41 24.264 10.231 3.624
282 HA SER 41 HA SER 41 24.741 8.285 1.470
283 HB2 SER 41 1HB SER 41 23.485 11.025 1.207
284 HB3 SER 41 2HB SER 41 24.046 10.061 -0.160
285 HG SER 41 HG SER 41 21.716 9.919 1.099
286 H GLY 42 H GLY 42 26.703 9.050 3.246
287 HA2 GLY 42 1HA GLY 42 28.861 9.681 1.732
288 HA3 GLY 42 2HA GLY 42 28.217 11.258 2.163
289 HA PRO 43 HA PRO 43 31.169 9.816 5.475
290 HB2 PRO 43 1HB PRO 43 32.693 12.063 5.458
291 HB3 PRO 43 2HB PRO 43 33.001 10.685 4.394
292 HG2 PRO 43 1HG PRO 43 31.593 13.260 3.800
293 HG3 PRO 43 2HG PRO 43 32.771 12.375 2.813
294 HD2 PRO 43 1HD PRO 43 30.105 12.254 2.357
295 HD3 PRO 43 2HD PRO 43 31.191 10.887 2.036
296 H SER 44 H SER 44 28.739 11.999 5.061
297 HA SER 44 HA SER 44 28.789 13.992 6.831
298 HB2 SER 44 1HB SER 44 26.775 12.846 5.541
299 HB3 SER 44 2HB SER 44 26.456 12.149 7.129
300 HG SER 44 HG SER 44 26.340 14.814 6.291
301 H SER 45 H SER 45 29.406 14.255 8.862
302 HA SER 45 HA SER 45 29.947 12.019 10.565
303 HB2 SER 45 1HB SER 45 31.191 14.290 10.445
304 HB3 SER 45 2HB SER 45 29.903 14.881 11.495
305 HG SER 45 HG SER 45 32.060 13.414 12.132
306 H GLY 46 H GLY 46 28.725 11.151 12.128
307 HA2 GLY 46 1HA GLY 46 27.143 11.701 13.995
308 HA3 GLY 46 2HA GLY 46 26.182 12.514 12.768
Start of MODEL 9
1 H1 GLY 1 H GLY 1 -2.394 -34.852 -7.439
2 HA2 GLY 1 1HA GLY 1 -2.670 -33.192 -5.159
3 HA3 GLY 1 2HA GLY 1 -1.219 -32.750 -6.046
4 H SER 2 H SER 2 -3.143 -30.881 -5.766
5 HA SER 2 HA SER 2 -3.992 -30.498 -8.522
6 HB2 SER 2 1HB SER 2 -5.988 -31.490 -7.719
7 HB3 SER 2 2HB SER 2 -5.899 -30.621 -6.188
8 HG SER 2 HG SER 2 -7.432 -29.678 -7.576
9 H SER 3 H SER 3 -4.543 -28.295 -9.012
10 HA SER 3 HA SER 3 -3.247 -26.411 -7.170
11 HB2 SER 3 1HB SER 3 -3.703 -26.386 -10.147
12 HB3 SER 3 2HB SER 3 -3.290 -24.911 -9.272
13 HG SER 3 HG SER 3 -1.726 -27.182 -8.830
14 H GLY 4 H GLY 4 -4.453 -25.034 -6.051
15 HA2 GLY 4 1HA GLY 4 -7.196 -24.496 -7.011
16 HA3 GLY 4 2HA GLY 4 -6.751 -24.579 -5.313
17 H SER 5 H SER 5 -8.063 -22.420 -5.813
18 HA SER 5 HA SER 5 -6.037 -20.304 -6.136
19 HB2 SER 5 1HB SER 5 -7.841 -20.529 -7.975
20 HB3 SER 5 2HB SER 5 -8.951 -19.885 -6.765
21 HG SER 5 HG SER 5 -8.070 -17.977 -6.969
22 H SER 6 H SER 6 -6.309 -18.418 -4.849
23 HA SER 6 HA SER 6 -6.996 -18.902 -2.187
24 HB2 SER 6 1HB SER 6 -5.533 -17.015 -3.310
25 HB3 SER 6 2HB SER 6 -7.043 -16.106 -3.254
26 HG SER 6 HG SER 6 -7.101 -16.482 -1.004
27 H GLY 7 H GLY 7 -8.785 -17.180 -4.728
28 HA2 GLY 7 1HA GLY 7 -11.139 -17.236 -4.948
29 HA3 GLY 7 2HA GLY 7 -11.260 -17.724 -3.264
30 H SER 8 H SER 8 -10.788 -16.080 -1.624
31 HA SER 8 HA SER 8 -11.221 -13.335 -2.583
32 HB2 SER 8 1HB SER 8 -13.331 -14.532 -1.682
33 HB3 SER 8 2HB SER 8 -12.577 -14.358 -0.097
34 HG SER 8 HG SER 8 -13.532 -12.381 -1.846
35 H GLY 9 H GLY 9 -8.739 -14.327 -1.925
36 HA2 GLY 9 1HA GLY 9 -8.207 -12.908 0.609
37 HA3 GLY 9 2HA GLY 9 -7.428 -14.440 0.246
38 H GLU 10 H GLU 10 -7.737 -11.083 -0.810
39 HA GLU 10 HA GLU 10 -4.941 -10.930 -1.387
40 HB2 GLU 10 1HB GLU 10 -5.112 -10.428 -3.767
41 HB3 GLU 10 2HB GLU 10 -5.706 -12.049 -3.434
42 HG2 GLU 10 1HG GLU 10 -8.024 -11.086 -3.427
43 HG3 GLU 10 2HG GLU 10 -7.320 -9.586 -4.029
44 H LYS 11 H LYS 11 -4.234 -8.786 -1.811
45 HA LYS 11 HA LYS 11 -6.285 -6.722 -1.341
46 HB2 LYS 11 1HB LYS 11 -3.526 -6.986 -0.155
47 HB3 LYS 11 2HB LYS 11 -4.398 -5.458 -0.167
48 HG2 LYS 11 1HG LYS 11 -5.904 -6.143 1.397
49 HG3 LYS 11 2HG LYS 11 -5.790 -7.840 0.927
50 HD2 LYS 11 1HD LYS 11 -3.762 -8.132 2.091
51 HD3 LYS 11 2HD LYS 11 -3.516 -6.393 2.260
52 HE2 LYS 11 1HE LYS 11 -4.220 -7.208 4.378
53 HE3 LYS 11 2HE LYS 11 -5.585 -6.337 3.680
54 HZ1 LYS 11 3HZ LYS 11 -5.493 -9.173 3.092
55 HZ2 LYS 11 1HZ LYS 11 -6.804 -8.198 3.532
56 HZ3 LYS 11 2HZ LYS 11 -5.753 -8.789 4.718
57 HA PRO 12 HA PRO 12 -4.804 -4.806 -5.017
58 HB2 PRO 12 1HB PRO 12 -5.631 -2.264 -4.544
59 HB3 PRO 12 2HB PRO 12 -6.741 -3.571 -4.975
60 HG2 PRO 12 1HG PRO 12 -6.111 -2.432 -2.279
61 HG3 PRO 12 2HG PRO 12 -7.683 -2.886 -2.962
62 HD2 PRO 12 1HD PRO 12 -6.335 -4.472 -1.230
63 HD3 PRO 12 2HD PRO 12 -7.373 -5.125 -2.513
64 H TYR 13 H TYR 13 -3.427 -4.402 -2.045
65 HA TYR 13 HA TYR 13 -1.414 -2.522 -3.095
66 HB2 TYR 13 1HB TYR 13 -2.123 -2.941 -0.186
67 HB3 TYR 13 2HB TYR 13 -1.017 -1.739 -0.842
68 HD1 TYR 13 HD2 TYR 13 -1.892 0.200 -2.091
69 HD2 TYR 13 HD1 TYR 13 -4.495 -2.593 -0.214
70 HE1 TYR 13 HE2 TYR 13 -3.742 1.811 -2.273
71 HE2 TYR 13 HE1 TYR 13 -6.353 -0.991 -0.392
72 HH TYR 13 HH TYR 13 -6.895 1.158 -0.835
73 H LYS 14 H LYS 14 0.326 -3.639 -3.672
74 HA LYS 14 HA LYS 14 1.517 -5.481 -1.747
75 HB2 LYS 14 1HB LYS 14 0.072 -6.762 -3.417
76 HB3 LYS 14 2HB LYS 14 1.241 -6.283 -4.640
77 HG2 LYS 14 1HG LYS 14 2.945 -7.315 -2.906
78 HG3 LYS 14 2HG LYS 14 1.511 -8.215 -2.405
79 HD2 LYS 14 1HD LYS 14 2.314 -9.623 -4.019
80 HD3 LYS 14 2HD LYS 14 1.272 -8.597 -5.007
81 HE2 LYS 14 1HE LYS 14 3.243 -7.199 -5.551
82 HE3 LYS 14 2HE LYS 14 4.255 -8.325 -4.648
83 HZ1 LYS 14 3HZ LYS 14 4.437 -9.505 -6.497
84 HZ2 LYS 14 1HZ LYS 14 3.332 -8.516 -7.312
85 HZ3 LYS 14 2HZ LYS 14 2.782 -9.848 -6.428
86 H CYS 15 H CYS 15 3.599 -5.020 -1.516
87 HA CYS 15 HA CYS 15 4.918 -3.052 -3.012
88 HB2 CYS 15 1HB CYS 15 5.501 -3.740 -0.680
89 HB3 CYS 15 2HB CYS 15 6.202 -5.216 -1.335
90 H ASN 16 H ASN 16 5.601 -3.165 -5.038
91 HA ASN 16 HA ASN 16 6.101 -5.732 -6.289
92 HB2 ASN 16 1HB ASN 16 4.844 -4.008 -7.509
93 HB3 ASN 16 2HB ASN 16 6.235 -2.931 -7.428
94 HD21 ASN 16 1HD2 ASN 16 7.208 -2.800 -9.305
95 HD22 ASN 16 2HD2 ASN 16 7.469 -4.097 -10.415
96 H GLU 17 H GLU 17 7.922 -4.944 -4.210
97 HA GLU 17 HA GLU 17 10.404 -4.820 -5.787
98 HB2 GLU 17 1HB GLU 17 9.581 -3.215 -3.423
99 HB3 GLU 17 2HB GLU 17 11.257 -3.740 -3.495
100 HG2 GLU 17 1HG GLU 17 9.877 -2.241 -5.705
101 HG3 GLU 17 2HG GLU 17 10.825 -1.474 -4.432
102 H CYS 18 H CYS 18 8.728 -6.009 -2.947
103 HA CYS 18 HA CYS 18 10.784 -8.099 -2.687
104 HB2 CYS 18 1HB CYS 18 10.458 -8.075 -0.250
105 HB3 CYS 18 2HB CYS 18 11.038 -6.520 -0.836
106 H GLY 19 H GLY 19 7.411 -7.167 -2.251
107 HA2 GLY 19 1HA GLY 19 5.740 -8.742 -3.115
108 HA3 GLY 19 2HA GLY 19 6.702 -10.031 -2.407
109 H LYS 20 H LYS 20 6.139 -7.020 -0.738
110 HA LYS 20 HA LYS 20 4.809 -8.474 1.398
111 HB2 LYS 20 1HB LYS 20 6.666 -6.615 1.584
112 HB3 LYS 20 2HB LYS 20 5.291 -5.523 1.478
113 HG2 LYS 20 1HG LYS 20 4.482 -6.116 3.523
114 HG3 LYS 20 2HG LYS 20 5.149 -7.748 3.438
115 HD2 LYS 20 1HD LYS 20 7.001 -5.410 3.597
116 HD3 LYS 20 2HD LYS 20 6.187 -5.973 5.059
117 HE2 LYS 20 1HE LYS 20 7.077 -8.241 4.629
118 HE3 LYS 20 2HE LYS 20 7.955 -7.606 3.239
119 HZ1 LYS 20 3HZ LYS 20 9.401 -6.443 4.570
120 HZ2 LYS 20 1HZ LYS 20 9.135 -7.821 5.515
121 HZ3 LYS 20 2HZ LYS 20 8.337 -6.377 5.883
122 H VAL 21 H VAL 21 2.826 -7.715 2.365
123 HA VAL 21 HA VAL 21 1.109 -6.160 0.552
124 HB VAL 21 HB VAL 21 0.248 -8.676 1.984
125 HG11 VAL 21 1HG1 VAL 21 -1.194 -6.740 0.191
126 HG12 VAL 21 2HG1 VAL 21 -1.782 -8.374 0.500
127 HG13 VAL 21 3HG1 VAL 21 -1.613 -7.230 1.832
128 HG21 VAL 21 3HG2 VAL 21 0.828 -9.868 0.195
129 HG22 VAL 21 1HG2 VAL 21 0.040 -8.727 -0.894
130 HG23 VAL 21 2HG2 VAL 21 1.705 -8.451 -0.381
131 H PHE 22 H PHE 22 -0.413 -4.856 1.522
132 HA PHE 22 HA PHE 22 -0.546 -4.876 4.454
133 HB2 PHE 22 1HB PHE 22 -0.200 -2.356 2.819
134 HB3 PHE 22 2HB PHE 22 -0.269 -2.477 4.574
135 HD1 PHE 22 HD1 PHE 22 1.731 -3.539 1.631
136 HD2 PHE 22 HD2 PHE 22 1.679 -2.735 5.810
137 HE1 PHE 22 HE1 PHE 22 4.179 -3.780 1.704
138 HE2 PHE 22 HE2 PHE 22 4.127 -2.973 5.890
139 HZ PHE 22 HZ PHE 22 5.380 -3.495 3.835
140 H THR 23 H THR 23 -2.332 -3.358 5.228
141 HA THR 23 HA THR 23 -4.742 -4.065 3.821
142 HB THR 23 HB THR 23 -5.942 -3.144 5.687
143 HG1 THR 23 HG1 THR 23 -3.432 -2.045 6.483
144 HG21 THR 23 3HG2 THR 23 -4.955 -4.383 7.555
145 HG22 THR 23 1HG2 THR 23 -3.435 -4.513 6.671
146 HG23 THR 23 2HG2 THR 23 -4.880 -5.319 6.063
147 H GLN 24 H GLN 24 -3.335 -0.969 4.906
148 HA GLN 24 HA GLN 24 -4.934 0.387 2.845
149 HB2 GLN 24 1HB GLN 24 -3.568 1.570 5.269
150 HB3 GLN 24 2HB GLN 24 -4.605 2.432 4.139
151 HG2 GLN 24 1HG GLN 24 -6.508 1.109 4.818
152 HG3 GLN 24 2HG GLN 24 -5.487 0.142 5.882
153 HE21 GLN 24 1HE2 GLN 24 -7.661 1.313 6.934
154 HE22 GLN 24 2HE2 GLN 24 -7.214 2.636 7.952
155 H ASN 25 H ASN 25 -3.864 2.364 1.895
156 HA ASN 25 HA ASN 25 -1.429 1.582 0.652
157 HB2 ASN 25 1HB ASN 25 -3.136 2.946 -0.495
158 HB3 ASN 25 2HB ASN 25 -2.817 4.271 0.620
159 HD21 ASN 25 1HD2 ASN 25 -1.152 5.612 0.240
160 HD22 ASN 25 2HD2 ASN 25 -0.061 5.463 -1.092
161 H SER 26 H SER 26 -2.229 4.239 2.887
162 HA SER 26 HA SER 26 0.179 5.449 3.199
163 HB2 SER 26 1HB SER 26 -2.079 4.918 5.070
164 HB3 SER 26 2HB SER 26 -0.578 5.537 5.759
165 HG SER 26 HG SER 26 -1.951 6.727 3.579
166 H HIS 27 H HIS 27 -0.642 2.235 4.137
167 HA HIS 27 HA HIS 27 1.613 1.921 5.924
168 HB2 HIS 27 1HB HIS 27 -0.237 -0.191 4.798
169 HB3 HIS 27 2HB HIS 27 0.866 -0.381 6.158
170 HD1 HIS 27 HD1 HIS 27 -1.295 -1.065 7.540
171 HD2 HIS 27 HD2 HIS 27 -1.166 2.882 6.248
172 HE1 HIS 27 HE1 HIS 27 -3.034 0.144 8.897
173 H LEU 28 H LEU 28 0.720 0.986 2.639
174 HA LEU 28 HA LEU 28 2.977 -0.639 2.132
175 HB2 LEU 28 1HB LEU 28 1.119 -0.901 0.711
176 HB3 LEU 28 2HB LEU 28 1.046 0.825 0.359
177 HG LEU 28 HG LEU 28 3.092 0.642 -0.970
178 HD11 LEU 28 1HD1 LEU 28 3.822 -1.733 -1.549
179 HD12 LEU 28 2HD1 LEU 28 2.963 -2.224 -0.090
180 HD13 LEU 28 3HD1 LEU 28 4.312 -1.093 0.020
181 HD21 LEU 28 3HD2 LEU 28 2.078 -1.101 -2.667
182 HD22 LEU 28 1HD2 LEU 28 1.298 0.454 -2.375
183 HD23 LEU 28 2HD2 LEU 28 0.688 -1.001 -1.585
184 H THR 29 H THR 29 2.263 2.673 1.006
185 HA THR 29 HA THR 29 4.686 3.256 -0.164
186 HB THR 29 HB THR 29 2.894 4.811 -0.416
187 HG1 THR 29 HG1 THR 29 3.999 6.727 0.039
188 HG21 THR 29 3HG2 THR 29 1.679 4.527 1.618
189 HG22 THR 29 1HG2 THR 29 2.153 6.223 1.530
190 HG23 THR 29 2HG2 THR 29 3.034 5.115 2.581
191 H ASN 30 H ASN 30 3.840 3.257 3.239
192 HA ASN 30 HA ASN 30 6.120 4.624 4.194
193 HB2 ASN 30 1HB ASN 30 4.352 4.473 5.726
194 HB3 ASN 30 2HB ASN 30 4.136 2.747 5.449
195 HD21 ASN 30 1HD2 ASN 30 4.402 1.948 7.439
196 HD22 ASN 30 2HD2 ASN 30 5.828 2.139 8.396
197 H HIS 31 H HIS 31 5.464 1.225 3.534
198 HA HIS 31 HA HIS 31 7.804 0.166 4.695
199 HB2 HIS 31 1HB HIS 31 6.124 -1.404 4.234
200 HB3 HIS 31 2HB HIS 31 5.900 -0.819 2.588
201 HD1 HIS 31 HD1 HIS 31 8.291 -2.866 4.669
202 HD2 HIS 31 HD2 HIS 31 7.442 -2.066 0.681
203 HE1 HIS 31 HE1 HIS 31 9.671 -4.501 3.347
204 H TRP 32 H TRP 32 7.071 0.815 1.263
205 HA TRP 32 HA TRP 32 9.335 0.183 -0.002
206 HB2 TRP 32 1HB TRP 32 7.497 2.507 -0.306
207 HB3 TRP 32 2HB TRP 32 9.003 2.534 -1.219
208 HD1 TRP 32 HD1 TRP 32 6.011 0.108 -0.702
209 HE1 TRP 32 HE1 TRP 32 5.577 -1.093 -2.937
210 HE3 TRP 32 HE3 TRP 32 9.841 2.091 -3.447
211 HZ2 TRP 32 HZ2 TRP 32 6.709 -1.188 -5.521
212 HZ3 TRP 32 HZ3 TRP 32 10.096 1.393 -5.792
213 HH2 TRP 32 HH2 TRP 32 8.562 -0.213 -6.806
214 H ARG 33 H ARG 33 9.003 2.799 2.291
215 HA ARG 33 HA ARG 33 11.206 4.349 1.825
216 HB2 ARG 33 1HB ARG 33 10.076 3.419 4.467
217 HB3 ARG 33 2HB ARG 33 11.304 4.670 4.323
218 HG2 ARG 33 1HG ARG 33 9.801 6.087 3.103
219 HG3 ARG 33 2HG ARG 33 8.587 4.807 3.036
220 HD2 ARG 33 1HD ARG 33 7.859 6.190 4.771
221 HD3 ARG 33 2HD ARG 33 8.668 4.858 5.595
222 HE ARG 33 HE ARG 33 10.631 6.695 5.331
223 HH11 ARG 33 1HH1 ARG 33 7.386 6.833 6.585
224 HH12 ARG 33 2HH1 ARG 33 7.744 8.079 7.734
225 HH21 ARG 33 1HH2 ARG 33 11.114 8.336 6.840
226 HH22 ARG 33 2HH2 ARG 33 9.865 8.934 7.878
227 H ILE 34 H ILE 34 11.125 1.320 3.687
228 HA ILE 34 HA ILE 34 13.819 1.230 4.399
229 HB ILE 34 HB ILE 34 13.540 -1.132 4.776
230 HG12 ILE 34 1HG1 ILE 34 11.103 -1.988 4.087
231 HG13 ILE 34 2HG1 ILE 34 11.332 -0.803 2.805
232 HG21 ILE 34 1HG2 ILE 34 12.504 0.299 6.407
233 HG22 ILE 34 2HG2 ILE 34 11.047 0.434 5.422
234 HG23 ILE 34 3HG2 ILE 34 11.477 -1.112 6.154
235 HD11 ILE 34 3HD1 ILE 34 13.296 -1.925 2.037
236 HD12 ILE 34 1HD1 ILE 34 13.267 -3.021 3.418
237 HD13 ILE 34 2HD1 ILE 34 11.999 -3.109 2.195
238 H HIS 35 H HIS 35 12.228 0.414 1.398
239 HA HIS 35 HA HIS 35 14.465 -0.973 0.266
240 HB2 HIS 35 1HB HIS 35 11.891 0.109 -0.859
241 HB3 HIS 35 2HB HIS 35 13.132 -0.578 -1.902
242 HD1 HIS 35 HD1 HIS 35 13.965 -3.030 -0.323
243 HD2 HIS 35 HD2 HIS 35 10.010 -1.839 -0.769
244 HE1 HIS 35 HE1 HIS 35 12.593 -5.104 0.052
245 H THR 36 H THR 36 13.256 2.324 0.219
246 HA THR 36 HA THR 36 15.316 3.154 -1.668
247 HB THR 36 HB THR 36 14.277 5.419 -1.422
248 HG1 THR 36 HG1 THR 36 13.168 5.557 0.400
249 HG21 THR 36 3HG2 THR 36 12.843 4.913 -3.076
250 HG22 THR 36 1HG2 THR 36 11.940 3.781 -2.070
251 HG23 THR 36 2HG2 THR 36 13.419 3.259 -2.876
252 H GLY 37 H GLY 37 17.289 3.540 -0.905
253 HA2 GLY 37 1HA GLY 37 17.978 5.531 0.851
254 HA3 GLY 37 2HA GLY 37 17.786 4.105 1.861
255 H GLU 38 H GLU 38 19.442 5.236 -1.075
256 HA GLU 38 HA GLU 38 21.487 3.195 -0.748
257 HB2 GLU 38 1HB GLU 38 20.734 5.134 -2.877
258 HB3 GLU 38 2HB GLU 38 22.410 4.608 -2.813
259 HG2 GLU 38 1HG GLU 38 21.556 3.050 -4.230
260 HG3 GLU 38 2HG GLU 38 21.321 2.223 -2.691
261 H LYS 39 H LYS 39 21.917 4.330 1.425
262 HA LYS 39 HA LYS 39 23.023 6.750 1.857
263 HB2 LYS 39 1HB LYS 39 23.030 5.547 3.791
264 HB3 LYS 39 2HB LYS 39 23.524 4.061 2.991
265 HG2 LYS 39 1HG LYS 39 25.819 4.924 2.841
266 HG3 LYS 39 2HG LYS 39 25.310 6.381 3.698
267 HD2 LYS 39 1HD LYS 39 24.430 4.617 5.456
268 HD3 LYS 39 2HD LYS 39 25.666 3.602 4.708
269 HE2 LYS 39 1HE LYS 39 26.056 6.288 6.021
270 HE3 LYS 39 2HE LYS 39 26.626 4.725 6.603
271 HZ1 LYS 39 3HZ LYS 39 28.339 4.706 5.152
272 HZ2 LYS 39 1HZ LYS 39 28.151 6.386 5.231
273 HZ3 LYS 39 2HZ LYS 39 27.489 5.520 3.937
274 HA PRO 40 HA PRO 40 27.402 5.374 0.362
275 HB2 PRO 40 1HB PRO 40 27.600 2.980 -0.903
276 HB3 PRO 40 2HB PRO 40 27.769 3.158 0.847
277 HG2 PRO 40 1HG PRO 40 25.391 2.281 -0.747
278 HG3 PRO 40 2HG PRO 40 26.036 1.609 0.762
279 HD2 PRO 40 1HD PRO 40 23.900 3.273 0.703
280 HD3 PRO 40 2HD PRO 40 25.047 3.240 2.057
281 H SER 41 H SER 41 28.457 5.448 -1.737
282 HA SER 41 HA SER 41 26.643 6.397 -3.789
283 HB2 SER 41 1HB SER 41 28.624 7.725 -3.340
284 HB3 SER 41 2HB SER 41 29.667 6.337 -3.648
285 HG SER 41 HG SER 41 28.826 6.352 -5.816
286 H GLY 42 H GLY 42 26.135 5.379 -5.641
287 HA2 GLY 42 1HA GLY 42 27.271 2.692 -6.035
288 HA3 GLY 42 2HA GLY 42 25.710 3.234 -6.633
289 HA PRO 43 HA PRO 43 28.610 3.337 -10.209
290 HB2 PRO 43 1HB PRO 43 26.788 2.402 -11.991
291 HB3 PRO 43 2HB PRO 43 27.772 1.340 -10.977
292 HG2 PRO 43 1HG PRO 43 24.940 2.233 -10.596
293 HG3 PRO 43 2HG PRO 43 25.645 0.621 -10.373
294 HD2 PRO 43 1HD PRO 43 25.138 2.288 -8.301
295 HD3 PRO 43 2HD PRO 43 26.493 1.141 -8.294
296 H SER 44 H SER 44 25.927 5.012 -9.192
297 HA SER 44 HA SER 44 26.321 7.049 -11.225
298 HB2 SER 44 1HB SER 44 24.077 7.176 -11.962
299 HB3 SER 44 2HB SER 44 24.466 5.456 -11.999
300 HG SER 44 HG SER 44 23.157 5.102 -10.345
301 H SER 45 H SER 45 26.578 8.883 -10.157
302 HA SER 45 HA SER 45 25.914 9.195 -7.423
303 HB2 SER 45 1HB SER 45 26.627 11.332 -9.447
304 HB3 SER 45 2HB SER 45 26.685 11.501 -7.693
305 HG SER 45 HG SER 45 28.514 10.447 -7.651
306 H GLY 46 H GLY 46 24.541 10.652 -10.372
307 HA2 GLY 46 1HA GLY 46 22.347 11.259 -10.799
308 HA3 GLY 46 2HA GLY 46 21.910 10.675 -9.200
Start of MODEL 10
1 H1 GLY 1 H GLY 1 -11.795 -20.095 -16.514
2 HA2 GLY 1 1HA GLY 1 -10.789 -20.565 -14.114
3 HA3 GLY 1 2HA GLY 1 -10.690 -18.810 -14.134
4 H SER 2 H SER 2 -12.608 -17.579 -14.142
5 HA SER 2 HA SER 2 -14.637 -17.115 -13.176
6 HB2 SER 2 1HB SER 2 -16.481 -17.943 -14.436
7 HB3 SER 2 2HB SER 2 -15.128 -17.848 -15.563
8 HG SER 2 HG SER 2 -16.531 -20.025 -14.697
9 H SER 3 H SER 3 -13.143 -18.748 -11.506
10 HA SER 3 HA SER 3 -15.278 -20.274 -10.194
11 HB2 SER 3 1HB SER 3 -12.469 -21.245 -10.739
12 HB3 SER 3 2HB SER 3 -13.532 -21.992 -9.547
13 HG SER 3 HG SER 3 -14.740 -22.803 -11.105
14 H GLY 4 H GLY 4 -15.414 -19.965 -8.041
15 HA2 GLY 4 1HA GLY 4 -14.256 -19.652 -5.904
16 HA3 GLY 4 2HA GLY 4 -13.181 -18.538 -6.734
17 H SER 5 H SER 5 -15.816 -18.760 -4.735
18 HA SER 5 HA SER 5 -17.096 -16.305 -5.633
19 HB2 SER 5 1HB SER 5 -17.719 -18.332 -3.495
20 HB3 SER 5 2HB SER 5 -18.540 -16.771 -3.537
21 HG SER 5 HG SER 5 -19.275 -17.275 -5.619
22 H SER 6 H SER 6 -15.312 -14.886 -5.272
23 HA SER 6 HA SER 6 -15.373 -13.617 -2.735
24 HB2 SER 6 1HB SER 6 -13.092 -14.011 -2.002
25 HB3 SER 6 2HB SER 6 -13.915 -15.561 -2.181
26 HG SER 6 HG SER 6 -12.909 -15.692 -4.281
27 H GLY 7 H GLY 7 -14.569 -11.553 -2.833
28 HA2 GLY 7 1HA GLY 7 -14.202 -10.402 -5.382
29 HA3 GLY 7 2HA GLY 7 -13.914 -9.600 -3.845
30 H SER 8 H SER 8 -11.993 -8.633 -4.109
31 HA SER 8 HA SER 8 -9.834 -9.926 -5.522
32 HB2 SER 8 1HB SER 8 -8.562 -7.852 -4.899
33 HB3 SER 8 2HB SER 8 -10.054 -7.539 -5.785
34 HG SER 8 HG SER 8 -9.366 -6.898 -3.195
35 H GLY 9 H GLY 9 -9.353 -11.760 -4.298
36 HA2 GLY 9 1HA GLY 9 -9.026 -12.030 -1.597
37 HA3 GLY 9 2HA GLY 9 -8.051 -12.896 -2.775
38 H GLU 10 H GLU 10 -6.529 -10.925 -3.880
39 HA GLU 10 HA GLU 10 -4.732 -10.322 -1.679
40 HB2 GLU 10 1HB GLU 10 -4.167 -11.250 -4.091
41 HB3 GLU 10 2HB GLU 10 -4.142 -9.540 -4.500
42 HG2 GLU 10 1HG GLU 10 -2.595 -10.454 -2.133
43 HG3 GLU 10 2HG GLU 10 -1.969 -10.806 -3.743
44 H LYS 11 H LYS 11 -4.394 -8.365 -0.823
45 HA LYS 11 HA LYS 11 -6.158 -6.255 -1.164
46 HB2 LYS 11 1HB LYS 11 -3.415 -6.472 0.022
47 HB3 LYS 11 2HB LYS 11 -4.177 -4.893 -0.122
48 HG2 LYS 11 1HG LYS 11 -4.773 -5.524 2.006
49 HG3 LYS 11 2HG LYS 11 -6.179 -6.035 1.070
50 HD2 LYS 11 1HD LYS 11 -5.694 -8.261 1.300
51 HD3 LYS 11 2HD LYS 11 -3.957 -7.979 1.440
52 HE2 LYS 11 1HE LYS 11 -5.845 -7.070 3.582
53 HE3 LYS 11 2HE LYS 11 -5.273 -8.736 3.530
54 HZ1 LYS 11 3HZ LYS 11 -3.716 -7.745 4.867
55 HZ2 LYS 11 1HZ LYS 11 -3.760 -6.269 4.040
56 HZ3 LYS 11 2HZ LYS 11 -2.963 -7.597 3.360
57 HA PRO 12 HA PRO 12 -4.916 -4.154 -4.819
58 HB2 PRO 12 1HB PRO 12 -5.646 -1.616 -4.192
59 HB3 PRO 12 2HB PRO 12 -6.816 -2.885 -4.574
60 HG2 PRO 12 1HG PRO 12 -5.942 -1.857 -1.901
61 HG3 PRO 12 2HG PRO 12 -7.575 -2.255 -2.468
62 HD2 PRO 12 1HD PRO 12 -6.124 -3.928 -0.909
63 HD3 PRO 12 2HD PRO 12 -7.278 -4.515 -2.123
64 H TYR 13 H TYR 13 -3.284 -3.895 -1.966
65 HA TYR 13 HA TYR 13 -1.247 -2.155 -3.180
66 HB2 TYR 13 1HB TYR 13 -1.918 -2.192 -0.233
67 HB3 TYR 13 2HB TYR 13 -0.775 -1.130 -1.049
68 HD1 TYR 13 HD2 TYR 13 -1.663 0.578 -2.683
69 HD2 TYR 13 HD1 TYR 13 -4.202 -1.625 -0.074
70 HE1 TYR 13 HE2 TYR 13 -3.442 2.243 -3.017
71 HE2 TYR 13 HE1 TYR 13 -5.988 0.033 -0.402
72 HH TYR 13 HH TYR 13 -6.482 1.811 -2.514
73 H LYS 14 H LYS 14 0.313 -3.555 -3.709
74 HA LYS 14 HA LYS 14 1.466 -5.184 -1.569
75 HB2 LYS 14 1HB LYS 14 0.117 -6.796 -2.679
76 HB3 LYS 14 2HB LYS 14 0.582 -6.198 -4.267
77 HG2 LYS 14 1HG LYS 14 2.820 -7.050 -3.979
78 HG3 LYS 14 2HG LYS 14 2.449 -7.549 -2.327
79 HD2 LYS 14 1HD LYS 14 1.115 -9.305 -3.018
80 HD3 LYS 14 2HD LYS 14 0.786 -8.572 -4.590
81 HE2 LYS 14 1HE LYS 14 3.120 -8.993 -5.247
82 HE3 LYS 14 2HE LYS 14 3.407 -9.767 -3.690
83 HZ1 LYS 14 3HZ LYS 14 1.145 -10.828 -5.124
84 HZ2 LYS 14 1HZ LYS 14 2.418 -11.638 -4.359
85 HZ3 LYS 14 2HZ LYS 14 2.617 -11.042 -5.929
86 H CYS 15 H CYS 15 3.556 -4.743 -1.418
87 HA CYS 15 HA CYS 15 4.977 -3.090 -3.128
88 HB2 CYS 15 1HB CYS 15 5.679 -3.556 -0.827
89 HB3 CYS 15 2HB CYS 15 6.060 -5.217 -1.268
90 H ASN 16 H ASN 16 6.705 -3.502 -4.600
91 HA ASN 16 HA ASN 16 6.386 -6.051 -6.035
92 HB2 ASN 16 1HB ASN 16 7.425 -3.402 -7.068
93 HB3 ASN 16 2HB ASN 16 7.205 -4.867 -8.021
94 HD21 ASN 16 1HD2 ASN 16 5.385 -2.721 -5.864
95 HD22 ASN 16 2HD2 ASN 16 3.920 -2.762 -6.780
96 H GLU 17 H GLU 17 8.625 -3.998 -4.385
97 HA GLU 17 HA GLU 17 11.041 -4.993 -5.430
98 HB2 GLU 17 1HB GLU 17 10.718 -2.931 -3.988
99 HB3 GLU 17 2HB GLU 17 10.626 -4.014 -2.607
100 HG2 GLU 17 1HG GLU 17 12.845 -3.125 -2.779
101 HG3 GLU 17 2HG GLU 17 12.878 -4.849 -3.143
102 H CYS 18 H CYS 18 9.108 -5.985 -2.625
103 HA CYS 18 HA CYS 18 10.701 -8.462 -2.508
104 HB2 CYS 18 1HB CYS 18 10.056 -8.589 -0.112
105 HB3 CYS 18 2HB CYS 18 11.019 -7.164 -0.488
106 H GLY 19 H GLY 19 7.470 -7.058 -2.229
107 HA2 GLY 19 1HA GLY 19 5.644 -8.209 -3.357
108 HA3 GLY 19 2HA GLY 19 6.370 -9.727 -2.849
109 H LYS 20 H LYS 20 6.439 -7.259 -0.500
110 HA LYS 20 HA LYS 20 4.757 -8.742 1.261
111 HB2 LYS 20 1HB LYS 20 6.765 -7.085 1.735
112 HB3 LYS 20 2HB LYS 20 5.473 -5.894 1.809
113 HG2 LYS 20 1HG LYS 20 4.429 -7.011 3.622
114 HG3 LYS 20 2HG LYS 20 5.473 -8.422 3.436
115 HD2 LYS 20 1HD LYS 20 6.538 -5.684 4.086
116 HD3 LYS 20 2HD LYS 20 6.046 -6.836 5.330
117 HE2 LYS 20 1HE LYS 20 7.672 -8.441 4.527
118 HE3 LYS 20 2HE LYS 20 8.115 -7.369 3.200
119 HZ1 LYS 20 3HZ LYS 20 9.624 -6.482 4.533
120 HZ2 LYS 20 1HZ LYS 20 9.091 -7.403 5.849
121 HZ3 LYS 20 2HZ LYS 20 8.388 -5.898 5.530
122 H VAL 21 H VAL 21 2.671 -8.422 1.849
123 HA VAL 21 HA VAL 21 1.175 -6.390 0.335
124 HB VAL 21 HB VAL 21 0.076 -8.866 1.670
125 HG11 VAL 21 1HG1 VAL 21 -1.536 -7.043 1.386
126 HG12 VAL 21 2HG1 VAL 21 -1.156 -6.978 -0.336
127 HG13 VAL 21 3HG1 VAL 21 -1.918 -8.415 0.347
128 HG21 VAL 21 3HG2 VAL 21 1.463 -9.669 -0.057
129 HG22 VAL 21 1HG2 VAL 21 -0.164 -9.651 -0.737
130 HG23 VAL 21 2HG2 VAL 21 0.981 -8.377 -1.156
131 H PHE 22 H PHE 22 -0.358 -5.097 1.363
132 HA PHE 22 HA PHE 22 -0.384 -5.170 4.299
133 HB2 PHE 22 1HB PHE 22 -0.198 -2.599 2.729
134 HB3 PHE 22 2HB PHE 22 -0.054 -2.811 4.470
135 HD1 PHE 22 HD1 PHE 22 1.592 -3.664 1.256
136 HD2 PHE 22 HD2 PHE 22 2.029 -3.116 5.454
137 HE1 PHE 22 HE1 PHE 22 4.034 -3.863 1.024
138 HE2 PHE 22 HE2 PHE 22 4.471 -3.313 5.229
139 HZ PHE 22 HZ PHE 22 5.477 -3.687 3.012
140 H THR 23 H THR 23 -2.100 -3.440 5.068
141 HA THR 23 HA THR 23 -4.577 -4.170 3.710
142 HB THR 23 HB THR 23 -4.139 -2.815 6.379
143 HG1 THR 23 HG1 THR 23 -5.229 -5.385 6.068
144 HG21 THR 23 3HG2 THR 23 -6.281 -2.179 5.390
145 HG22 THR 23 1HG2 THR 23 -6.523 -3.256 6.764
146 HG23 THR 23 2HG2 THR 23 -6.672 -3.877 5.121
147 H GLN 24 H GLN 24 -3.294 -1.197 5.217
148 HA GLN 24 HA GLN 24 -4.921 0.382 3.367
149 HB2 GLN 24 1HB GLN 24 -3.288 1.416 5.681
150 HB3 GLN 24 2HB GLN 24 -4.606 2.226 4.844
151 HG2 GLN 24 1HG GLN 24 -4.994 -0.317 6.391
152 HG3 GLN 24 2HG GLN 24 -5.117 1.279 7.129
153 HE21 GLN 24 1HE2 GLN 24 -7.245 1.331 7.577
154 HE22 GLN 24 2HE2 GLN 24 -8.496 1.241 6.390
155 H ASN 25 H ASN 25 -4.033 2.084 2.131
156 HA ASN 25 HA ASN 25 -1.596 1.486 0.864
157 HB2 ASN 25 1HB ASN 25 -1.877 3.802 -0.147
158 HB3 ASN 25 2HB ASN 25 -3.219 2.687 -0.389
159 HD21 ASN 25 1HD2 ASN 25 -2.132 5.570 1.186
160 HD22 ASN 25 2HD2 ASN 25 -3.680 6.098 1.744
161 H SER 26 H SER 26 -2.424 3.732 3.443
162 HA SER 26 HA SER 26 -0.077 5.232 3.524
163 HB2 SER 26 1HB SER 26 -0.678 5.355 6.072
164 HB3 SER 26 2HB SER 26 -1.764 6.075 4.883
165 HG SER 26 HG SER 26 -2.183 3.400 5.521
166 H HIS 27 H HIS 27 -0.526 1.941 4.145
167 HA HIS 27 HA HIS 27 1.755 1.714 5.943
168 HB2 HIS 27 1HB HIS 27 -0.105 -0.373 4.789
169 HB3 HIS 27 2HB HIS 27 1.210 -0.721 5.908
170 HD1 HIS 27 HD1 HIS 27 -1.336 -1.598 6.982
171 HD2 HIS 27 HD2 HIS 27 -0.147 2.367 7.336
172 HE1 HIS 27 HE1 HIS 27 -2.667 -0.666 8.901
173 H LEU 28 H LEU 28 0.858 0.998 2.619
174 HA LEU 28 HA LEU 28 3.320 -0.357 2.020
175 HB2 LEU 28 1HB LEU 28 1.481 -1.037 0.736
176 HB3 LEU 28 2HB LEU 28 1.006 0.623 0.382
177 HG LEU 28 HG LEU 28 3.259 0.705 -0.922
178 HD11 LEU 28 1HD1 LEU 28 4.414 -1.206 -0.683
179 HD12 LEU 28 2HD1 LEU 28 3.331 -1.799 -1.941
180 HD13 LEU 28 3HD1 LEU 28 2.983 -2.141 -0.247
181 HD21 LEU 28 3HD2 LEU 28 1.270 -1.029 -2.279
182 HD22 LEU 28 1HD2 LEU 28 2.055 0.449 -2.836
183 HD23 LEU 28 2HD2 LEU 28 0.723 0.539 -1.684
184 H THR 29 H THR 29 1.906 2.685 0.796
185 HA THR 29 HA THR 29 4.001 3.710 -0.587
186 HB THR 29 HB THR 29 1.816 4.845 -0.351
187 HG1 THR 29 HG1 THR 29 4.272 6.147 -0.088
188 HG21 THR 29 3HG2 THR 29 2.808 6.078 2.194
189 HG22 THR 29 1HG2 THR 29 1.891 4.573 2.226
190 HG23 THR 29 2HG2 THR 29 1.170 6.031 1.544
191 H ASN 30 H ASN 30 3.807 3.289 2.843
192 HA ASN 30 HA ASN 30 6.147 4.962 3.324
193 HB2 ASN 30 1HB ASN 30 4.477 5.226 4.988
194 HB3 ASN 30 2HB ASN 30 4.250 3.487 5.145
195 HD21 ASN 30 1HD2 ASN 30 5.607 2.314 6.429
196 HD22 ASN 30 2HD2 ASN 30 6.791 3.031 7.462
197 H HIS 31 H HIS 31 5.228 1.616 3.073
198 HA HIS 31 HA HIS 31 7.395 0.410 4.368
199 HB2 HIS 31 1HB HIS 31 5.610 -1.015 3.818
200 HB3 HIS 31 2HB HIS 31 5.580 -0.478 2.140
201 HD1 HIS 31 HD1 HIS 31 7.523 -2.693 4.484
202 HD2 HIS 31 HD2 HIS 31 7.222 -1.884 0.420
203 HE1 HIS 31 HE1 HIS 31 8.870 -4.482 3.341
204 H TRP 32 H TRP 32 6.999 1.399 0.984
205 HA TRP 32 HA TRP 32 9.270 0.418 -0.161
206 HB2 TRP 32 1HB TRP 32 7.724 2.943 -0.573
207 HB3 TRP 32 2HB TRP 32 9.254 2.742 -1.423
208 HD1 TRP 32 HD1 TRP 32 5.991 0.675 -0.952
209 HE1 TRP 32 HE1 TRP 32 5.462 -0.475 -3.193
210 HE3 TRP 32 HE3 TRP 32 10.035 2.255 -3.651
211 HZ2 TRP 32 HZ2 TRP 32 6.607 -0.685 -5.764
212 HZ3 TRP 32 HZ3 TRP 32 10.244 1.534 -5.994
213 HH2 TRP 32 HH2 TRP 32 8.565 0.094 -7.027
214 H ARG 33 H ARG 33 9.066 2.772 2.330
215 HA ARG 33 HA ARG 33 11.381 4.252 2.001
216 HB2 ARG 33 1HB ARG 33 9.937 3.296 4.461
217 HB3 ARG 33 2HB ARG 33 11.392 4.278 4.580
218 HG2 ARG 33 1HG ARG 33 10.188 5.937 3.061
219 HG3 ARG 33 2HG ARG 33 8.727 5.017 3.425
220 HD2 ARG 33 1HD ARG 33 8.850 5.529 5.718
221 HD3 ARG 33 2HD ARG 33 10.519 6.082 5.587
222 HE ARG 33 HE ARG 33 8.159 7.619 5.117
223 HH11 ARG 33 1HH1 ARG 33 11.495 7.234 4.201
224 HH12 ARG 33 2HH1 ARG 33 11.689 8.887 3.718
225 HH21 ARG 33 1HH2 ARG 33 8.401 9.797 4.485
226 HH22 ARG 33 2HH2 ARG 33 9.929 10.344 3.880
227 H ILE 34 H ILE 34 11.005 1.173 3.752
228 HA ILE 34 HA ILE 34 13.693 0.858 4.465
229 HB ILE 34 HB ILE 34 13.201 -1.466 4.869
230 HG12 ILE 34 1HG1 ILE 34 10.454 -1.244 3.725
231 HG13 ILE 34 2HG1 ILE 34 11.795 -1.507 2.615
232 HG21 ILE 34 1HG2 ILE 34 10.668 -0.865 5.839
233 HG22 ILE 34 2HG2 ILE 34 12.201 -0.662 6.685
234 HG23 ILE 34 3HG2 ILE 34 11.505 0.685 5.785
235 HD11 ILE 34 3HD1 ILE 34 12.200 -3.348 4.650
236 HD12 ILE 34 1HD1 ILE 34 10.460 -3.362 4.366
237 HD13 ILE 34 2HD1 ILE 34 11.574 -3.668 3.033
238 H HIS 35 H HIS 35 12.230 0.705 1.419
239 HA HIS 35 HA HIS 35 14.281 -1.045 0.292
240 HB2 HIS 35 1HB HIS 35 11.748 0.152 -0.817
241 HB3 HIS 35 2HB HIS 35 12.936 -0.633 -1.853
242 HD1 HIS 35 HD1 HIS 35 13.596 -2.988 0.145
243 HD2 HIS 35 HD2 HIS 35 9.798 -1.782 -1.028
244 HE1 HIS 35 HE1 HIS 35 12.117 -4.993 0.491
245 H THR 36 H THR 36 13.156 2.292 0.165
246 HA THR 36 HA THR 36 15.176 3.046 -1.768
247 HB THR 36 HB THR 36 14.302 5.361 -1.411
248 HG1 THR 36 HG1 THR 36 12.182 4.225 0.064
249 HG21 THR 36 3HG2 THR 36 13.229 4.466 -3.212
250 HG22 THR 36 1HG2 THR 36 11.842 4.621 -2.135
251 HG23 THR 36 2HG2 THR 36 12.651 3.064 -2.311
252 H GLY 37 H GLY 37 17.088 4.015 -1.359
253 HA2 GLY 37 1HA GLY 37 18.422 5.508 0.036
254 HA3 GLY 37 2HA GLY 37 17.659 4.772 1.438
255 H GLU 38 H GLU 38 19.161 3.328 -1.445
256 HA GLU 38 HA GLU 38 20.869 1.757 0.363
257 HB2 GLU 38 1HB GLU 38 20.062 1.192 -2.496
258 HB3 GLU 38 2HB GLU 38 21.084 0.162 -1.503
259 HG2 GLU 38 1HG GLU 38 18.384 0.875 -0.490
260 HG3 GLU 38 2HG GLU 38 18.516 -0.309 -1.789
261 H LYS 39 H LYS 39 23.066 1.660 0.066
262 HA LYS 39 HA LYS 39 24.450 3.856 -0.801
263 HB2 LYS 39 1HB LYS 39 25.818 2.508 0.425
264 HB3 LYS 39 2HB LYS 39 25.163 1.030 -0.270
265 HG2 LYS 39 1HG LYS 39 27.458 1.253 -0.919
266 HG3 LYS 39 2HG LYS 39 26.436 1.487 -2.340
267 HD2 LYS 39 1HD LYS 39 27.979 3.208 -2.535
268 HD3 LYS 39 2HD LYS 39 26.613 4.004 -1.750
269 HE2 LYS 39 1HE LYS 39 28.304 4.736 -0.404
270 HE3 LYS 39 2HE LYS 39 27.887 3.244 0.437
271 HZ1 LYS 39 3HZ LYS 39 30.161 3.717 -1.402
272 HZ2 LYS 39 1HZ LYS 39 29.672 2.165 -0.941
273 HZ3 LYS 39 2HZ LYS 39 30.215 3.261 0.226
274 HA PRO 40 HA PRO 40 25.336 1.778 -5.068
275 HB2 PRO 40 1HB PRO 40 23.955 -0.480 -5.671
276 HB3 PRO 40 2HB PRO 40 25.515 -0.501 -4.842
277 HG2 PRO 40 1HG PRO 40 22.759 -0.737 -3.698
278 HG3 PRO 40 2HG PRO 40 24.220 -1.659 -3.297
279 HD2 PRO 40 1HD PRO 40 23.330 0.395 -1.773
280 HD3 PRO 40 2HD PRO 40 25.054 0.010 -1.944
281 H SER 41 H SER 41 24.204 3.599 -5.789
282 HA SER 41 HA SER 41 21.408 3.810 -5.959
283 HB2 SER 41 1HB SER 41 21.887 5.624 -7.630
284 HB3 SER 41 2HB SER 41 22.766 5.795 -6.111
285 HG SER 41 HG SER 41 24.263 6.094 -7.680
286 H GLY 42 H GLY 42 23.757 3.141 -8.567
287 HA2 GLY 42 1HA GLY 42 22.148 2.693 -10.688
288 HA3 GLY 42 2HA GLY 42 23.564 1.702 -10.370
289 HA PRO 43 HA PRO 43 19.354 -0.580 -9.795
290 HB2 PRO 43 1HB PRO 43 18.833 -1.410 -12.326
291 HB3 PRO 43 2HB PRO 43 18.196 0.098 -11.660
292 HG2 PRO 43 1HG PRO 43 20.560 -0.335 -13.445
293 HG3 PRO 43 2HG PRO 43 19.308 0.919 -13.530
294 HD2 PRO 43 1HD PRO 43 21.760 1.376 -12.475
295 HD3 PRO 43 2HD PRO 43 20.299 2.196 -11.886
296 H SER 44 H SER 44 18.953 -2.941 -10.708
297 HA SER 44 HA SER 44 20.926 -4.596 -9.810
298 HB2 SER 44 1HB SER 44 19.002 -5.239 -12.058
299 HB3 SER 44 2HB SER 44 19.835 -6.410 -11.035
300 HG SER 44 HG SER 44 18.362 -4.468 -9.717
301 H SER 45 H SER 45 20.268 -4.136 -13.287
302 HA SER 45 HA SER 45 23.015 -4.952 -13.869
303 HB2 SER 45 1HB SER 45 21.184 -6.041 -15.119
304 HB3 SER 45 2HB SER 45 20.693 -4.471 -15.754
305 HG SER 45 HG SER 45 22.888 -6.055 -16.408
306 H GLY 46 H GLY 46 24.447 -3.695 -15.074
307 HA2 GLY 46 1HA GLY 46 23.906 -1.235 -16.270
308 HA3 GLY 46 2HA GLY 46 24.342 -0.909 -14.599
Start of MODEL 11
1 H1 GLY 1 H GLY 1 8.954 -27.013 -10.290
2 HA2 GLY 1 1HA GLY 1 6.875 -26.614 -11.400
3 HA3 GLY 1 2HA GLY 1 6.444 -27.360 -9.868
4 H SER 2 H SER 2 4.385 -26.230 -10.280
5 HA SER 2 HA SER 2 4.369 -23.354 -10.030
6 HB2 SER 2 1HB SER 2 2.697 -24.802 -11.361
7 HB3 SER 2 2HB SER 2 1.946 -25.129 -9.800
8 HG SER 2 HG SER 2 1.045 -23.247 -9.923
9 H SER 3 H SER 3 4.624 -22.373 -8.147
10 HA SER 3 HA SER 3 3.682 -23.728 -5.707
11 HB2 SER 3 1HB SER 3 5.331 -22.303 -4.501
12 HB3 SER 3 2HB SER 3 6.086 -23.377 -5.678
13 HG SER 3 HG SER 3 5.989 -21.511 -7.140
14 H GLY 4 H GLY 4 1.554 -22.945 -5.848
15 HA2 GLY 4 1HA GLY 4 1.184 -20.351 -4.679
16 HA3 GLY 4 2HA GLY 4 0.660 -20.408 -6.355
17 H SER 5 H SER 5 -1.104 -19.834 -4.301
18 HA SER 5 HA SER 5 -2.516 -22.159 -3.435
19 HB2 SER 5 1HB SER 5 -3.011 -19.208 -3.339
20 HB3 SER 5 2HB SER 5 -4.348 -20.310 -3.010
21 HG SER 5 HG SER 5 -3.538 -20.531 -1.097
22 H SER 6 H SER 6 -3.101 -19.716 -5.946
23 HA SER 6 HA SER 6 -4.246 -19.839 -7.917
24 HB2 SER 6 1HB SER 6 -3.280 -22.262 -7.848
25 HB3 SER 6 2HB SER 6 -4.927 -22.722 -7.416
26 HG SER 6 HG SER 6 -4.672 -22.803 -9.654
27 H GLY 7 H GLY 7 -5.512 -18.936 -5.617
28 HA2 GLY 7 1HA GLY 7 -8.273 -19.899 -6.049
29 HA3 GLY 7 2HA GLY 7 -7.673 -19.425 -4.467
30 H SER 8 H SER 8 -9.897 -18.216 -5.163
31 HA SER 8 HA SER 8 -9.451 -15.798 -6.654
32 HB2 SER 8 1HB SER 8 -11.793 -16.569 -4.896
33 HB3 SER 8 2HB SER 8 -11.759 -15.248 -6.063
34 HG SER 8 HG SER 8 -12.693 -16.938 -7.107
35 H GLY 9 H GLY 9 -9.015 -13.790 -5.907
36 HA2 GLY 9 1HA GLY 9 -9.439 -12.356 -3.799
37 HA3 GLY 9 2HA GLY 9 -8.422 -13.569 -3.034
38 H GLU 10 H GLU 10 -8.110 -10.611 -3.544
39 HA GLU 10 HA GLU 10 -5.320 -10.674 -4.113
40 HB2 GLU 10 1HB GLU 10 -6.081 -10.809 -6.413
41 HB3 GLU 10 2HB GLU 10 -7.149 -9.433 -6.174
42 HG2 GLU 10 1HG GLU 10 -5.161 -8.781 -7.390
43 HG3 GLU 10 2HG GLU 10 -5.220 -7.987 -5.817
44 H LYS 11 H LYS 11 -4.283 -8.826 -3.435
45 HA LYS 11 HA LYS 11 -5.988 -6.875 -2.062
46 HB2 LYS 11 1HB LYS 11 -4.114 -8.188 -0.884
47 HB3 LYS 11 2HB LYS 11 -3.005 -7.133 -1.749
48 HG2 LYS 11 1HG LYS 11 -3.303 -6.193 0.394
49 HG3 LYS 11 2HG LYS 11 -4.226 -5.187 -0.725
50 HD2 LYS 11 1HD LYS 11 -5.716 -5.463 1.023
51 HD3 LYS 11 2HD LYS 11 -6.203 -6.750 -0.083
52 HE2 LYS 11 1HE LYS 11 -6.133 -7.757 2.038
53 HE3 LYS 11 2HE LYS 11 -4.643 -8.261 1.241
54 HZ1 LYS 11 3HZ LYS 11 -3.368 -6.928 2.582
55 HZ2 LYS 11 1HZ LYS 11 -4.586 -7.382 3.665
56 HZ3 LYS 11 2HZ LYS 11 -4.630 -5.858 2.934
57 HA PRO 12 HA PRO 12 -5.068 -3.824 -5.122
58 HB2 PRO 12 1HB PRO 12 -5.858 -1.644 -3.710
59 HB3 PRO 12 2HB PRO 12 -6.998 -2.785 -4.434
60 HG2 PRO 12 1HG PRO 12 -6.044 -2.598 -1.602
61 HG3 PRO 12 2HG PRO 12 -7.684 -2.878 -2.214
62 HD2 PRO 12 1HD PRO 12 -6.108 -4.882 -1.301
63 HD3 PRO 12 2HD PRO 12 -7.293 -5.116 -2.602
64 H TYR 13 H TYR 13 -3.471 -4.195 -2.170
65 HA TYR 13 HA TYR 13 -1.419 -2.258 -2.999
66 HB2 TYR 13 1HB TYR 13 -2.151 -2.787 -0.117
67 HB3 TYR 13 2HB TYR 13 -1.054 -1.558 -0.737
68 HD1 TYR 13 HD2 TYR 13 -2.031 0.321 -2.143
69 HD2 TYR 13 HD1 TYR 13 -4.440 -2.331 0.152
70 HE1 TYR 13 HE2 TYR 13 -3.884 1.935 -2.234
71 HE2 TYR 13 HE1 TYR 13 -6.300 -0.724 0.067
72 HH TYR 13 HH TYR 13 -5.893 2.497 -1.098
73 H LYS 14 H LYS 14 0.202 -3.514 -3.668
74 HA LYS 14 HA LYS 14 1.326 -5.436 -1.782
75 HB2 LYS 14 1HB LYS 14 -0.075 -6.840 -3.156
76 HB3 LYS 14 2HB LYS 14 0.560 -6.111 -4.626
77 HG2 LYS 14 1HG LYS 14 2.726 -7.090 -4.229
78 HG3 LYS 14 2HG LYS 14 2.185 -7.729 -2.675
79 HD2 LYS 14 1HD LYS 14 0.372 -8.939 -4.044
80 HD3 LYS 14 2HD LYS 14 1.385 -8.571 -5.442
81 HE2 LYS 14 1HE LYS 14 3.137 -9.897 -4.672
82 HE3 LYS 14 2HE LYS 14 2.544 -9.885 -3.012
83 HZ1 LYS 14 3HZ LYS 14 1.301 -11.309 -5.303
84 HZ2 LYS 14 1HZ LYS 14 0.671 -11.258 -3.733
85 HZ3 LYS 14 2HZ LYS 14 2.152 -12.021 -4.026
86 H CYS 15 H CYS 15 3.406 -4.983 -1.560
87 HA CYS 15 HA CYS 15 4.797 -3.159 -3.178
88 HB2 CYS 15 1HB CYS 15 5.384 -3.631 -0.827
89 HB3 CYS 15 2HB CYS 15 5.930 -5.238 -1.295
90 H ASN 16 H ASN 16 6.768 -3.568 -4.424
91 HA ASN 16 HA ASN 16 6.540 -6.065 -5.966
92 HB2 ASN 16 1HB ASN 16 6.245 -3.655 -7.009
93 HB3 ASN 16 2HB ASN 16 8.006 -3.679 -7.015
94 HD21 ASN 16 1HD2 ASN 16 8.936 -4.489 -8.745
95 HD22 ASN 16 2HD2 ASN 16 8.207 -5.566 -9.882
96 H GLU 17 H GLU 17 8.823 -3.808 -4.489
97 HA GLU 17 HA GLU 17 11.234 -4.894 -5.192
98 HB2 GLU 17 1HB GLU 17 10.258 -3.542 -2.714
99 HB3 GLU 17 2HB GLU 17 11.865 -4.255 -2.708
100 HG2 GLU 17 1HG GLU 17 12.302 -2.091 -3.337
101 HG3 GLU 17 2HG GLU 17 12.198 -2.910 -4.895
102 H CYS 18 H CYS 18 9.329 -5.829 -2.325
103 HA CYS 18 HA CYS 18 10.843 -8.349 -2.235
104 HB2 CYS 18 1HB CYS 18 10.051 -8.523 0.104
105 HB3 CYS 18 2HB CYS 18 10.985 -7.058 -0.180
106 H GLY 19 H GLY 19 7.563 -7.012 -2.043
107 HA2 GLY 19 1HA GLY 19 5.808 -8.123 -3.315
108 HA3 GLY 19 2HA GLY 19 6.556 -9.655 -2.890
109 H LYS 20 H LYS 20 6.083 -7.012 -0.633
110 HA LYS 20 HA LYS 20 4.604 -8.757 1.127
111 HB2 LYS 20 1HB LYS 20 5.831 -6.053 1.316
112 HB3 LYS 20 2HB LYS 20 4.506 -6.416 2.415
113 HG2 LYS 20 1HG LYS 20 5.686 -8.142 3.456
114 HG3 LYS 20 2HG LYS 20 6.858 -8.253 2.140
115 HD2 LYS 20 1HD LYS 20 7.496 -5.847 2.775
116 HD3 LYS 20 2HD LYS 20 6.616 -6.155 4.274
117 HE2 LYS 20 1HE LYS 20 8.718 -8.062 3.323
118 HE3 LYS 20 2HE LYS 20 9.171 -6.591 4.182
119 HZ1 LYS 20 3HZ LYS 20 8.419 -8.972 5.309
120 HZ2 LYS 20 1HZ LYS 20 7.064 -7.977 5.507
121 HZ3 LYS 20 2HZ LYS 20 8.568 -7.487 6.106
122 H VAL 21 H VAL 21 2.663 -7.661 2.309
123 HA VAL 21 HA VAL 21 0.939 -6.252 0.400
124 HB VAL 21 HB VAL 21 0.109 -8.733 1.911
125 HG11 VAL 21 1HG1 VAL 21 -1.497 -7.040 0.001
126 HG12 VAL 21 2HG1 VAL 21 -2.050 -8.474 0.869
127 HG13 VAL 21 3HG1 VAL 21 -1.655 -7.001 1.757
128 HG21 VAL 21 3HG2 VAL 21 1.388 -8.460 -0.576
129 HG22 VAL 21 1HG2 VAL 21 0.649 -9.909 0.106
130 HG23 VAL 21 2HG2 VAL 21 -0.299 -8.838 -0.925
131 H PHE 22 H PHE 22 -0.493 -4.835 1.307
132 HA PHE 22 HA PHE 22 -0.729 -4.777 4.227
133 HB2 PHE 22 1HB PHE 22 -0.218 -2.258 2.653
134 HB3 PHE 22 2HB PHE 22 -0.168 -2.480 4.398
135 HD1 PHE 22 HD1 PHE 22 1.575 -3.241 1.237
136 HD2 PHE 22 HD2 PHE 22 1.803 -3.184 5.487
137 HE1 PHE 22 HE1 PHE 22 3.999 -3.643 1.109
138 HE2 PHE 22 HE2 PHE 22 4.228 -3.584 5.365
139 HZ PHE 22 HZ PHE 22 5.329 -3.813 3.174
140 H THR 23 H THR 23 -2.630 -3.870 5.015
141 HA THR 23 HA THR 23 -4.867 -3.996 3.242
142 HB THR 23 HB THR 23 -6.226 -3.421 5.202
143 HG1 THR 23 HG1 THR 23 -3.683 -2.973 6.403
144 HG21 THR 23 3HG2 THR 23 -5.946 -5.432 6.291
145 HG22 THR 23 1HG2 THR 23 -4.186 -5.327 6.262
146 HG23 THR 23 2HG2 THR 23 -5.069 -5.744 4.794
147 H GLN 24 H GLN 24 -3.183 -1.387 4.945
148 HA GLN 24 HA GLN 24 -4.830 0.572 3.504
149 HB2 GLN 24 1HB GLN 24 -3.036 0.907 5.913
150 HB3 GLN 24 2HB GLN 24 -3.918 2.214 5.134
151 HG2 GLN 24 1HG GLN 24 -6.017 1.246 5.734
152 HG3 GLN 24 2HG GLN 24 -5.229 -0.214 6.329
153 HE21 GLN 24 1HE2 GLN 24 -5.232 -0.312 8.446
154 HE22 GLN 24 2HE2 GLN 24 -5.048 1.017 9.534
155 H ASN 25 H ASN 25 -3.877 2.260 2.336
156 HA ASN 25 HA ASN 25 -1.594 1.591 0.848
157 HB2 ASN 25 1HB ASN 25 -1.758 3.856 -0.085
158 HB3 ASN 25 2HB ASN 25 -3.343 3.092 0.001
159 HD21 ASN 25 1HD2 ASN 25 -1.427 5.731 0.939
160 HD22 ASN 25 2HD2 ASN 25 -2.592 6.529 1.934
161 H SER 26 H SER 26 -2.031 3.981 3.447
162 HA SER 26 HA SER 26 0.418 5.149 3.563
163 HB2 SER 26 1HB SER 26 -1.613 5.470 5.114
164 HB3 SER 26 2HB SER 26 -0.911 4.179 6.089
165 HG SER 26 HG SER 26 0.455 5.570 6.849
166 H HIS 27 H HIS 27 -0.434 1.937 4.747
167 HA HIS 27 HA HIS 27 2.008 1.368 6.036
168 HB2 HIS 27 1HB HIS 27 0.010 -0.522 4.774
169 HB3 HIS 27 2HB HIS 27 1.306 -1.001 5.866
170 HD1 HIS 27 HD1 HIS 27 -0.581 -1.940 7.453
171 HD2 HIS 27 HD2 HIS 27 -0.605 2.180 6.918
172 HE1 HIS 27 HE1 HIS 27 -2.045 -1.033 9.285
173 H LEU 28 H LEU 28 0.876 0.763 2.733
174 HA LEU 28 HA LEU 28 3.228 -0.607 1.905
175 HB2 LEU 28 1HB LEU 28 1.120 -0.918 0.755
176 HB3 LEU 28 2HB LEU 28 1.083 0.787 0.312
177 HG LEU 28 HG LEU 28 3.100 0.414 -1.088
178 HD11 LEU 28 1HD1 LEU 28 4.042 -1.662 -1.433
179 HD12 LEU 28 2HD1 LEU 28 2.618 -2.524 -0.853
180 HD13 LEU 28 3HD1 LEU 28 3.682 -1.709 0.293
181 HD21 LEU 28 3HD2 LEU 28 1.928 -0.533 -2.911
182 HD22 LEU 28 1HD2 LEU 28 0.721 0.294 -1.926
183 HD23 LEU 28 2HD2 LEU 28 0.872 -1.462 -1.845
184 H THR 29 H THR 29 2.009 2.633 1.033
185 HA THR 29 HA THR 29 4.203 3.568 -0.331
186 HB THR 29 HB THR 29 2.188 4.878 -0.269
187 HG1 THR 29 HG1 THR 29 3.181 6.808 -0.181
188 HG21 THR 29 3HG2 THR 29 1.132 4.694 1.744
189 HG22 THR 29 1HG2 THR 29 1.921 6.250 2.000
190 HG23 THR 29 2HG2 THR 29 2.634 4.779 2.664
191 H ASN 30 H ASN 30 3.792 3.186 3.112
192 HA ASN 30 HA ASN 30 6.087 4.763 3.820
193 HB2 ASN 30 1HB ASN 30 4.287 4.571 5.420
194 HB3 ASN 30 2HB ASN 30 4.408 2.814 5.409
195 HD21 ASN 30 1HD2 ASN 30 5.200 2.143 7.258
196 HD22 ASN 30 2HD2 ASN 30 6.522 2.849 8.118
197 H HIS 31 H HIS 31 5.356 1.284 3.718
198 HA HIS 31 HA HIS 31 7.730 0.244 4.616
199 HB2 HIS 31 1HB HIS 31 6.024 -1.307 4.176
200 HB3 HIS 31 2HB HIS 31 5.791 -0.722 2.531
201 HD1 HIS 31 HD1 HIS 31 8.625 -2.367 4.482
202 HD2 HIS 31 HD2 HIS 31 6.857 -2.411 0.723
203 HE1 HIS 31 HE1 HIS 31 9.863 -4.124 3.178
204 H TRP 32 H TRP 32 6.950 0.885 1.193
205 HA TRP 32 HA TRP 32 9.202 0.247 -0.094
206 HB2 TRP 32 1HB TRP 32 7.376 2.589 -0.397
207 HB3 TRP 32 2HB TRP 32 8.850 2.549 -1.361
208 HD1 TRP 32 HD1 TRP 32 5.811 0.227 -0.671
209 HE1 TRP 32 HE1 TRP 32 5.272 -1.032 -2.850
210 HE3 TRP 32 HE3 TRP 32 9.607 2.007 -3.596
211 HZ2 TRP 32 HZ2 TRP 32 6.319 -1.243 -5.463
212 HZ3 TRP 32 HZ3 TRP 32 9.768 1.226 -5.924
213 HH2 TRP 32 HH2 TRP 32 8.157 -0.366 -6.836
214 H ARG 33 H ARG 33 8.863 2.950 2.115
215 HA ARG 33 HA ARG 33 11.027 4.507 1.641
216 HB2 ARG 33 1HB ARG 33 10.064 3.508 4.326
217 HB3 ARG 33 2HB ARG 33 11.193 4.839 4.114
218 HG2 ARG 33 1HG ARG 33 8.588 4.966 2.692
219 HG3 ARG 33 2HG ARG 33 8.614 5.249 4.433
220 HD2 ARG 33 1HD ARG 33 10.477 6.916 3.981
221 HD3 ARG 33 2HD ARG 33 10.055 6.768 2.275
222 HE ARG 33 HE ARG 33 7.771 7.359 3.862
223 HH11 ARG 33 1HH1 ARG 33 10.609 8.784 2.435
224 HH12 ARG 33 2HH1 ARG 33 9.918 10.369 2.327
225 HH21 ARG 33 1HH2 ARG 33 6.851 9.442 3.725
226 HH22 ARG 33 2HH2 ARG 33 7.781 10.742 3.061
227 H ILE 34 H ILE 34 11.114 1.536 3.611
228 HA ILE 34 HA ILE 34 13.840 1.497 4.134
229 HB ILE 34 HB ILE 34 13.629 -0.858 4.592
230 HG12 ILE 34 1HG1 ILE 34 11.173 -1.775 4.067
231 HG13 ILE 34 2HG1 ILE 34 11.309 -0.627 2.740
232 HG21 ILE 34 1HG2 ILE 34 12.580 -0.235 6.445
233 HG22 ILE 34 2HG2 ILE 34 11.835 1.123 5.603
234 HG23 ILE 34 3HG2 ILE 34 11.039 -0.450 5.615
235 HD11 ILE 34 3HD1 ILE 34 12.832 -3.126 3.253
236 HD12 ILE 34 1HD1 ILE 34 12.106 -2.528 1.761
237 HD13 ILE 34 2HD1 ILE 34 13.606 -1.819 2.358
238 H HIS 35 H HIS 35 12.071 0.401 1.299
239 HA HIS 35 HA HIS 35 14.263 -0.927 0.065
240 HB2 HIS 35 1HB HIS 35 11.611 0.087 -0.929
241 HB3 HIS 35 2HB HIS 35 12.799 -0.593 -2.037
242 HD1 HIS 35 HD1 HIS 35 13.780 -2.965 -0.334
243 HD2 HIS 35 HD2 HIS 35 9.786 -1.932 -0.826
244 HE1 HIS 35 HE1 HIS 35 12.480 -5.067 0.128
245 H THR 36 H THR 36 12.920 2.334 -0.174
246 HA THR 36 HA THR 36 14.739 3.161 -2.230
247 HB THR 36 HB THR 36 13.875 5.428 -1.817
248 HG1 THR 36 HG1 THR 36 11.974 5.306 -0.201
249 HG21 THR 36 3HG2 THR 36 12.349 3.147 -2.608
250 HG22 THR 36 1HG2 THR 36 12.223 4.811 -3.177
251 HG23 THR 36 2HG2 THR 36 11.287 4.284 -1.778
252 H GLY 37 H GLY 37 16.828 2.789 -1.487
253 HA2 GLY 37 1HA GLY 37 17.861 4.848 0.271
254 HA3 GLY 37 2HA GLY 37 18.017 3.211 0.890
255 H GLU 38 H GLU 38 19.421 1.754 -0.132
256 HA GLU 38 HA GLU 38 21.655 3.025 -1.436
257 HB2 GLU 38 1HB GLU 38 22.678 0.766 -1.340
258 HB3 GLU 38 2HB GLU 38 22.112 1.333 0.225
259 HG2 GLU 38 1HG GLU 38 20.258 -0.114 0.197
260 HG3 GLU 38 2HG GLU 38 20.465 -0.470 -1.517
261 H LYS 39 H LYS 39 22.609 2.198 -3.427
262 HA LYS 39 HA LYS 39 20.677 0.971 -5.267
263 HB2 LYS 39 1HB LYS 39 21.346 2.558 -7.032
264 HB3 LYS 39 2HB LYS 39 20.571 3.364 -5.675
265 HG2 LYS 39 1HG LYS 39 22.564 4.311 -4.938
266 HG3 LYS 39 2HG LYS 39 23.553 3.170 -5.853
267 HD2 LYS 39 1HD LYS 39 22.464 4.231 -7.934
268 HD3 LYS 39 2HD LYS 39 22.002 5.539 -6.843
269 HE2 LYS 39 1HE LYS 39 24.835 4.589 -6.926
270 HE3 LYS 39 2HE LYS 39 24.237 5.678 -8.177
271 HZ1 LYS 39 3HZ LYS 39 24.328 6.181 -5.255
272 HZ2 LYS 39 1HZ LYS 39 23.518 7.183 -6.351
273 HZ3 LYS 39 2HZ LYS 39 25.194 6.989 -6.463
274 HA PRO 40 HA PRO 40 25.037 -0.819 -5.402
275 HB2 PRO 40 1HB PRO 40 24.360 -3.329 -4.619
276 HB3 PRO 40 2HB PRO 40 24.807 -2.055 -3.478
277 HG2 PRO 40 1HG PRO 40 22.086 -3.021 -4.268
278 HG3 PRO 40 2HG PRO 40 22.705 -2.616 -2.657
279 HD2 PRO 40 1HD PRO 40 21.155 -0.921 -4.091
280 HD3 PRO 40 2HD PRO 40 22.415 -0.352 -2.977
281 H SER 41 H SER 41 25.490 -3.139 -6.463
282 HA SER 41 HA SER 41 24.811 -2.993 -9.122
283 HB2 SER 41 1HB SER 41 25.478 -5.416 -9.244
284 HB3 SER 41 2HB SER 41 26.645 -4.383 -8.421
285 HG SER 41 HG SER 41 25.341 -5.098 -6.456
286 H GLY 42 H GLY 42 23.480 -4.415 -10.459
287 HA2 GLY 42 1HA GLY 42 21.655 -6.122 -10.378
288 HA3 GLY 42 2HA GLY 42 20.980 -5.160 -9.071
289 HA PRO 43 HA PRO 43 18.982 -3.887 -13.074
290 HB2 PRO 43 1HB PRO 43 16.437 -4.065 -12.146
291 HB3 PRO 43 2HB PRO 43 17.302 -5.439 -12.846
292 HG2 PRO 43 1HG PRO 43 16.870 -4.739 -9.967
293 HG3 PRO 43 2HG PRO 43 16.759 -6.320 -10.763
294 HD2 PRO 43 1HD PRO 43 18.928 -5.558 -9.332
295 HD3 PRO 43 2HD PRO 43 19.042 -6.631 -10.742
296 H SER 44 H SER 44 19.512 -2.671 -10.059
297 HA SER 44 HA SER 44 17.839 -0.701 -9.401
298 HB2 SER 44 1HB SER 44 20.828 -0.332 -9.720
299 HB3 SER 44 2HB SER 44 19.773 0.693 -8.748
300 HG SER 44 HG SER 44 19.718 -2.055 -8.271
301 H SER 45 H SER 45 16.752 0.806 -10.458
302 HA SER 45 HA SER 45 17.655 1.676 -13.083
303 HB2 SER 45 1HB SER 45 15.083 1.799 -11.570
304 HB3 SER 45 2HB SER 45 15.361 2.992 -12.838
305 HG SER 45 HG SER 45 15.225 0.181 -13.053
306 H GLY 46 H GLY 46 19.450 2.957 -12.460
307 HA2 GLY 46 1HA GLY 46 18.750 5.694 -11.917
308 HA3 GLY 46 2HA GLY 46 19.626 4.937 -10.595
Start of MODEL 12
1 H1 GLY 1 H GLY 1 -0.299 -37.116 -14.226
2 HA2 GLY 1 1HA GLY 1 -1.590 -35.012 -14.413
3 HA3 GLY 1 2HA GLY 1 -2.992 -35.940 -13.905
4 H SER 2 H SER 2 0.202 -34.837 -12.843
5 HA SER 2 HA SER 2 -0.866 -34.700 -10.103
6 HB2 SER 2 1HB SER 2 1.722 -35.873 -11.064
7 HB3 SER 2 2HB SER 2 1.637 -35.149 -9.458
8 HG SER 2 HG SER 2 -0.396 -36.915 -10.138
9 H SER 3 H SER 3 -0.677 -32.768 -9.175
10 HA SER 3 HA SER 3 1.497 -30.978 -9.854
11 HB2 SER 3 1HB SER 3 -1.333 -30.497 -10.698
12 HB3 SER 3 2HB SER 3 -0.350 -29.121 -10.199
13 HG SER 3 HG SER 3 0.262 -29.217 -12.222
14 H GLY 4 H GLY 4 1.054 -28.774 -8.630
15 HA2 GLY 4 1HA GLY 4 -0.504 -28.959 -6.233
16 HA3 GLY 4 2HA GLY 4 1.206 -29.227 -5.928
17 H SER 5 H SER 5 -0.829 -27.003 -5.327
18 HA SER 5 HA SER 5 1.040 -24.852 -5.545
19 HB2 SER 5 1HB SER 5 -1.351 -24.929 -7.366
20 HB3 SER 5 2HB SER 5 -0.697 -23.389 -6.811
21 HG SER 5 HG SER 5 1.245 -25.070 -7.706
22 H SER 6 H SER 6 0.548 -23.149 -4.181
23 HA SER 6 HA SER 6 -2.047 -23.095 -2.859
24 HB2 SER 6 1HB SER 6 0.542 -23.469 -1.333
25 HB3 SER 6 2HB SER 6 -1.029 -23.138 -0.604
26 HG SER 6 HG SER 6 -0.584 -25.357 -2.301
27 H GLY 7 H GLY 7 -2.323 -21.172 -1.492
28 HA2 GLY 7 1HA GLY 7 -1.133 -19.052 -0.799
29 HA3 GLY 7 2HA GLY 7 -0.650 -18.950 -2.486
30 H SER 8 H SER 8 -2.865 -17.919 -0.237
31 HA SER 8 HA SER 8 -4.540 -16.773 -2.323
32 HB2 SER 8 1HB SER 8 -6.628 -17.492 -1.316
33 HB3 SER 8 2HB SER 8 -5.646 -18.912 -1.677
34 HG SER 8 HG SER 8 -5.330 -17.794 0.844
35 H GLY 9 H GLY 9 -5.420 -14.809 -1.780
36 HA2 GLY 9 1HA GLY 9 -6.222 -13.346 0.060
37 HA3 GLY 9 2HA GLY 9 -4.769 -13.819 0.928
38 H GLU 10 H GLU 10 -5.698 -12.401 -2.210
39 HA GLU 10 HA GLU 10 -3.254 -10.794 -2.155
40 HB2 GLU 10 1HB GLU 10 -5.276 -11.348 -4.325
41 HB3 GLU 10 2HB GLU 10 -3.969 -10.186 -4.505
42 HG2 GLU 10 1HG GLU 10 -3.355 -12.993 -3.707
43 HG3 GLU 10 2HG GLU 10 -3.693 -12.608 -5.394
44 H LYS 11 H LYS 11 -3.260 -8.553 -2.273
45 HA LYS 11 HA LYS 11 -5.856 -7.248 -1.784
46 HB2 LYS 11 1HB LYS 11 -3.256 -6.972 -0.330
47 HB3 LYS 11 2HB LYS 11 -4.327 -5.581 -0.440
48 HG2 LYS 11 1HG LYS 11 -6.083 -6.766 0.677
49 HG3 LYS 11 2HG LYS 11 -5.153 -8.266 0.641
50 HD2 LYS 11 1HD LYS 11 -3.381 -6.759 1.913
51 HD3 LYS 11 2HD LYS 11 -4.833 -5.864 2.365
52 HE2 LYS 11 1HE LYS 11 -4.722 -8.841 2.664
53 HE3 LYS 11 2HE LYS 11 -4.001 -7.793 3.885
54 HZ1 LYS 11 3HZ LYS 11 -6.182 -8.212 4.597
55 HZ2 LYS 11 1HZ LYS 11 -6.840 -7.942 3.061
56 HZ3 LYS 11 2HZ LYS 11 -6.228 -6.646 3.959
57 HA PRO 12 HA PRO 12 -4.905 -4.405 -4.988
58 HB2 PRO 12 1HB PRO 12 -5.947 -2.092 -4.022
59 HB3 PRO 12 2HB PRO 12 -6.948 -3.432 -4.592
60 HG2 PRO 12 1HG PRO 12 -6.198 -2.687 -1.792
61 HG3 PRO 12 2HG PRO 12 -7.769 -3.205 -2.428
62 HD2 PRO 12 1HD PRO 12 -6.111 -4.883 -1.100
63 HD3 PRO 12 2HD PRO 12 -7.187 -5.435 -2.399
64 H TYR 13 H TYR 13 -3.350 -4.291 -2.057
65 HA TYR 13 HA TYR 13 -1.487 -2.243 -3.043
66 HB2 TYR 13 1HB TYR 13 -2.449 -2.526 -0.188
67 HB3 TYR 13 2HB TYR 13 -1.173 -1.439 -0.724
68 HD1 TYR 13 HD2 TYR 13 -1.780 0.386 -2.394
69 HD2 TYR 13 HD1 TYR 13 -4.699 -1.865 -0.269
70 HE1 TYR 13 HE2 TYR 13 -3.453 2.128 -2.858
71 HE2 TYR 13 HE1 TYR 13 -6.381 -0.130 -0.729
72 HH TYR 13 HH TYR 13 -6.402 2.317 -1.265
73 H LYS 14 H LYS 14 0.072 -3.659 -3.689
74 HA LYS 14 HA LYS 14 1.353 -5.226 -1.555
75 HB2 LYS 14 1HB LYS 14 0.171 -6.834 -2.891
76 HB3 LYS 14 2HB LYS 14 0.773 -6.119 -4.381
77 HG2 LYS 14 1HG LYS 14 2.990 -6.883 -3.935
78 HG3 LYS 14 2HG LYS 14 2.535 -7.414 -2.314
79 HD2 LYS 14 1HD LYS 14 0.871 -8.963 -3.463
80 HD3 LYS 14 2HD LYS 14 1.723 -8.588 -4.963
81 HE2 LYS 14 1HE LYS 14 3.614 -9.712 -4.329
82 HE3 LYS 14 2HE LYS 14 3.325 -9.449 -2.610
83 HZ1 LYS 14 3HZ LYS 14 1.574 -11.096 -2.675
84 HZ2 LYS 14 1HZ LYS 14 3.018 -11.769 -3.245
85 HZ3 LYS 14 2HZ LYS 14 1.802 -11.327 -4.335
86 H CYS 15 H CYS 15 3.514 -5.018 -1.422
87 HA CYS 15 HA CYS 15 4.817 -2.984 -2.913
88 HB2 CYS 15 1HB CYS 15 5.421 -3.519 -0.587
89 HB3 CYS 15 2HB CYS 15 6.002 -5.099 -1.102
90 H ASN 16 H ASN 16 5.371 -3.199 -4.976
91 HA ASN 16 HA ASN 16 5.975 -5.796 -6.104
92 HB2 ASN 16 1HB ASN 16 4.667 -3.827 -7.213
93 HB3 ASN 16 2HB ASN 16 6.270 -3.207 -7.595
94 HD21 ASN 16 1HD2 ASN 16 4.272 -4.034 -9.447
95 HD22 ASN 16 2HD2 ASN 16 4.920 -5.359 -10.347
96 H GLU 17 H GLU 17 7.792 -4.720 -4.098
97 HA GLU 17 HA GLU 17 10.231 -4.477 -5.734
98 HB2 GLU 17 1HB GLU 17 9.421 -2.561 -4.095
99 HB3 GLU 17 2HB GLU 17 10.188 -3.582 -2.888
100 HG2 GLU 17 1HG GLU 17 11.720 -2.934 -5.345
101 HG3 GLU 17 2HG GLU 17 11.501 -1.669 -4.137
102 H CYS 18 H CYS 18 8.775 -5.893 -2.854
103 HA CYS 18 HA CYS 18 10.904 -7.928 -2.870
104 HB2 CYS 18 1HB CYS 18 10.821 -8.033 -0.439
105 HB3 CYS 18 2HB CYS 18 11.194 -6.392 -0.955
106 H GLY 19 H GLY 19 7.559 -7.157 -1.991
107 HA2 GLY 19 1HA GLY 19 5.905 -8.784 -2.915
108 HA3 GLY 19 2HA GLY 19 6.936 -10.036 -2.238
109 H LYS 20 H LYS 20 6.018 -6.968 -0.742
110 HA LYS 20 HA LYS 20 4.923 -8.479 1.515
111 HB2 LYS 20 1HB LYS 20 6.687 -6.509 1.612
112 HB3 LYS 20 2HB LYS 20 5.241 -5.509 1.563
113 HG2 LYS 20 1HG LYS 20 4.562 -6.140 3.641
114 HG3 LYS 20 2HG LYS 20 5.315 -7.733 3.525
115 HD2 LYS 20 1HD LYS 20 7.109 -5.369 3.551
116 HD3 LYS 20 2HD LYS 20 6.301 -5.793 5.062
117 HE2 LYS 20 1HE LYS 20 8.151 -7.092 5.288
118 HE3 LYS 20 2HE LYS 20 7.149 -8.218 4.374
119 HZ1 LYS 20 3HZ LYS 20 8.233 -7.312 2.333
120 HZ2 LYS 20 1HZ LYS 20 9.270 -8.169 3.358
121 HZ3 LYS 20 2HZ LYS 20 9.313 -6.479 3.334
122 H VAL 21 H VAL 21 2.911 -7.869 2.480
123 HA VAL 21 HA VAL 21 1.072 -6.494 0.631
124 HB VAL 21 HB VAL 21 0.458 -8.903 2.349
125 HG11 VAL 21 1HG1 VAL 21 -1.751 -8.812 1.163
126 HG12 VAL 21 2HG1 VAL 21 -1.471 -7.504 2.314
127 HG13 VAL 21 3HG1 VAL 21 -1.299 -7.209 0.584
128 HG21 VAL 21 3HG2 VAL 21 1.679 -9.612 0.439
129 HG22 VAL 21 1HG2 VAL 21 -0.020 -9.947 0.107
130 HG23 VAL 21 2HG2 VAL 21 0.762 -8.547 -0.626
131 H PHE 22 H PHE 22 -0.472 -5.155 1.520
132 HA PHE 22 HA PHE 22 -0.530 -4.862 4.432
133 HB2 PHE 22 1HB PHE 22 -0.238 -2.478 2.602
134 HB3 PHE 22 2HB PHE 22 -0.185 -2.494 4.362
135 HD1 PHE 22 HD1 PHE 22 1.627 -3.495 1.308
136 HD2 PHE 22 HD2 PHE 22 1.820 -2.934 5.523
137 HE1 PHE 22 HE1 PHE 22 4.074 -3.744 1.226
138 HE2 PHE 22 HE2 PHE 22 4.267 -3.181 5.447
139 HZ PHE 22 HZ PHE 22 5.397 -3.585 3.297
140 H THR 23 H THR 23 -2.255 -3.075 4.975
141 HA THR 23 HA THR 23 -4.681 -3.879 3.560
142 HB THR 23 HB THR 23 -4.415 -2.317 6.136
143 HG1 THR 23 HG1 THR 23 -3.644 -4.432 6.404
144 HG21 THR 23 3HG2 THR 23 -6.845 -3.849 5.334
145 HG22 THR 23 1HG2 THR 23 -6.569 -2.262 4.619
146 HG23 THR 23 2HG2 THR 23 -6.701 -2.430 6.370
147 H GLN 24 H GLN 24 -3.375 -0.845 4.919
148 HA GLN 24 HA GLN 24 -4.876 0.630 2.873
149 HB2 GLN 24 1HB GLN 24 -3.675 1.494 5.503
150 HB3 GLN 24 2HB GLN 24 -4.341 2.625 4.332
151 HG2 GLN 24 1HG GLN 24 -5.925 0.354 5.495
152 HG3 GLN 24 2HG GLN 24 -5.858 1.957 6.224
153 HE21 GLN 24 1HE2 GLN 24 -7.169 3.499 5.478
154 HE22 GLN 24 2HE2 GLN 24 -8.193 3.349 4.095
155 H ASN 25 H ASN 25 -3.887 2.003 1.449
156 HA ASN 25 HA ASN 25 -1.454 1.483 0.396
157 HB2 ASN 25 1HB ASN 25 -2.997 2.984 -0.707
158 HB3 ASN 25 2HB ASN 25 -2.813 4.179 0.574
159 HD21 ASN 25 1HD2 ASN 25 -1.114 2.503 -2.008
160 HD22 ASN 25 2HD2 ASN 25 0.054 3.744 -2.293
161 H SER 26 H SER 26 -2.058 4.032 2.813
162 HA SER 26 HA SER 26 0.368 5.123 3.184
163 HB2 SER 26 1HB SER 26 -1.493 4.198 5.386
164 HB3 SER 26 2HB SER 26 -0.173 5.348 5.603
165 HG SER 26 HG SER 26 -1.755 6.700 5.161
166 H HIS 27 H HIS 27 -0.641 2.011 4.571
167 HA HIS 27 HA HIS 27 1.710 1.424 5.955
168 HB2 HIS 27 1HB HIS 27 -0.208 -0.499 4.621
169 HB3 HIS 27 2HB HIS 27 0.979 -0.928 5.849
170 HD1 HIS 27 HD1 HIS 27 -1.169 -1.786 7.198
171 HD2 HIS 27 HD2 HIS 27 -0.869 2.324 6.667
172 HE1 HIS 27 HE1 HIS 27 -2.754 -0.775 8.868
173 H LEU 28 H LEU 28 0.786 0.683 2.613
174 HA LEU 28 HA LEU 28 3.162 -0.743 1.991
175 HB2 LEU 28 1HB LEU 28 1.277 -1.158 0.640
176 HB3 LEU 28 2HB LEU 28 1.030 0.558 0.323
177 HG LEU 28 HG LEU 28 3.132 0.541 -1.021
178 HD11 LEU 28 1HD1 LEU 28 3.268 -2.137 0.061
179 HD12 LEU 28 2HD1 LEU 28 4.508 -1.181 -0.750
180 HD13 LEU 28 3HD1 LEU 28 3.371 -2.136 -1.700
181 HD21 LEU 28 3HD2 LEU 28 1.337 0.489 -2.421
182 HD22 LEU 28 1HD2 LEU 28 0.675 -0.979 -1.700
183 HD23 LEU 28 2HD2 LEU 28 2.040 -1.082 -2.812
184 H THR 29 H THR 29 2.098 2.404 0.692
185 HA THR 29 HA THR 29 4.385 3.268 -0.468
186 HB THR 29 HB THR 29 2.372 4.611 -0.547
187 HG1 THR 29 HG1 THR 29 3.474 6.695 0.250
188 HG21 THR 29 3HG2 THR 29 1.306 4.528 1.489
189 HG22 THR 29 1HG2 THR 29 2.037 6.130 1.579
190 HG23 THR 29 2HG2 THR 29 2.796 4.767 2.402
191 H ASN 30 H ASN 30 3.752 3.065 2.961
192 HA ASN 30 HA ASN 30 6.010 4.625 3.768
193 HB2 ASN 30 1HB ASN 30 3.979 2.924 5.127
194 HB3 ASN 30 2HB ASN 30 5.490 3.221 5.982
195 HD21 ASN 30 1HD2 ASN 30 6.045 5.354 6.535
196 HD22 ASN 30 2HD2 ASN 30 4.846 6.594 6.635
197 H HIS 31 H HIS 31 5.339 1.151 3.519
198 HA HIS 31 HA HIS 31 7.637 0.104 4.603
199 HB2 HIS 31 1HB HIS 31 5.943 -1.413 3.946
200 HB3 HIS 31 2HB HIS 31 5.950 -0.826 2.286
201 HD1 HIS 31 HD1 HIS 31 7.974 -2.940 4.659
202 HD2 HIS 31 HD2 HIS 31 7.744 -2.071 0.603
203 HE1 HIS 31 HE1 HIS 31 9.499 -4.591 3.530
204 H TRP 32 H TRP 32 7.139 1.025 1.197
205 HA TRP 32 HA TRP 32 9.459 0.396 0.015
206 HB2 TRP 32 1HB TRP 32 7.753 2.841 -0.202
207 HB3 TRP 32 2HB TRP 32 9.282 2.797 -1.076
208 HD1 TRP 32 HD1 TRP 32 6.101 0.587 -0.756
209 HE1 TRP 32 HE1 TRP 32 5.640 -0.464 -3.060
210 HE3 TRP 32 HE3 TRP 32 10.146 2.403 -3.302
211 HZ2 TRP 32 HZ2 TRP 32 6.833 -0.517 -5.618
212 HZ3 TRP 32 HZ3 TRP 32 10.412 1.804 -5.674
213 HH2 TRP 32 HH2 TRP 32 8.790 0.374 -6.806
214 H ARG 33 H ARG 33 9.068 2.807 2.506
215 HA ARG 33 HA ARG 33 11.275 4.373 2.327
216 HB2 ARG 33 1HB ARG 33 9.936 3.130 4.709
217 HB3 ARG 33 2HB ARG 33 11.357 4.145 4.917
218 HG2 ARG 33 1HG ARG 33 10.229 6.015 3.901
219 HG3 ARG 33 2HG ARG 33 8.828 5.007 3.531
220 HD2 ARG 33 1HD ARG 33 9.843 5.820 6.248
221 HD3 ARG 33 2HD ARG 33 8.325 6.292 5.484
222 HE ARG 33 HE ARG 33 7.422 4.242 6.051
223 HH11 ARG 33 1HH1 ARG 33 10.835 4.292 6.733
224 HH12 ARG 33 2HH1 ARG 33 10.804 2.826 7.657
225 HH21 ARG 33 1HH2 ARG 33 7.368 2.312 7.265
226 HH22 ARG 33 2HH2 ARG 33 8.832 1.700 7.958
227 H ILE 34 H ILE 34 11.195 1.116 3.754
228 HA ILE 34 HA ILE 34 13.936 0.993 4.391
229 HB ILE 34 HB ILE 34 13.638 -1.411 4.602
230 HG12 ILE 34 1HG1 ILE 34 10.791 -1.234 3.719
231 HG13 ILE 34 2HG1 ILE 34 12.041 -1.353 2.486
232 HG21 ILE 34 1HG2 ILE 34 11.051 -0.656 5.695
233 HG22 ILE 34 2HG2 ILE 34 12.525 -1.159 6.519
234 HG23 ILE 34 3HG2 ILE 34 12.313 0.525 6.041
235 HD11 ILE 34 3HD1 ILE 34 12.762 -3.334 4.211
236 HD12 ILE 34 1HD1 ILE 34 11.002 -3.375 4.311
237 HD13 ILE 34 2HD1 ILE 34 11.801 -3.551 2.749
238 H HIS 35 H HIS 35 12.200 0.499 1.428
239 HA HIS 35 HA HIS 35 14.333 -0.906 0.100
240 HB2 HIS 35 1HB HIS 35 11.702 0.252 -0.772
241 HB3 HIS 35 2HB HIS 35 12.878 -0.288 -1.966
242 HD1 HIS 35 HD1 HIS 35 13.860 -2.861 -0.597
243 HD2 HIS 35 HD2 HIS 35 9.867 -1.754 -0.894
244 HE1 HIS 35 HE1 HIS 35 12.553 -4.999 -0.390
245 H THR 36 H THR 36 13.175 2.409 0.297
246 HA THR 36 HA THR 36 14.950 3.393 -1.732
247 HB THR 36 HB THR 36 14.252 5.641 -0.950
248 HG1 THR 36 HG1 THR 36 12.381 5.425 0.650
249 HG21 THR 36 3HG2 THR 36 12.458 5.433 -2.259
250 HG22 THR 36 1HG2 THR 36 11.619 4.466 -1.046
251 HG23 THR 36 2HG2 THR 36 12.694 3.686 -2.207
252 H GLY 37 H GLY 37 14.914 3.376 1.812
253 HA2 GLY 37 1HA GLY 37 16.586 3.725 3.344
254 HA3 GLY 37 2HA GLY 37 17.704 3.286 2.062
255 H GLU 38 H GLU 38 18.957 4.944 3.386
256 HA GLU 38 HA GLU 38 18.245 7.701 2.756
257 HB2 GLU 38 1HB GLU 38 19.065 6.975 5.043
258 HB3 GLU 38 2HB GLU 38 20.644 6.736 4.310
259 HG2 GLU 38 1HG GLU 38 20.956 9.003 3.931
260 HG3 GLU 38 2HG GLU 38 19.235 9.360 4.065
261 H LYS 39 H LYS 39 18.631 7.855 0.559
262 HA LYS 39 HA LYS 39 21.471 7.833 -0.193
263 HB2 LYS 39 1HB LYS 39 20.085 5.808 -1.034
264 HB3 LYS 39 2HB LYS 39 19.351 6.964 -2.138
265 HG2 LYS 39 1HG LYS 39 21.079 5.971 -3.358
266 HG3 LYS 39 2HG LYS 39 21.718 7.541 -2.863
267 HD2 LYS 39 1HD LYS 39 22.774 6.357 -0.899
268 HD3 LYS 39 2HD LYS 39 22.323 4.838 -1.677
269 HE2 LYS 39 1HE LYS 39 23.553 5.781 -3.734
270 HE3 LYS 39 2HE LYS 39 24.265 6.929 -2.602
271 HZ1 LYS 39 3HZ LYS 39 25.796 5.307 -2.412
272 HZ2 LYS 39 1HZ LYS 39 24.740 4.076 -2.896
273 HZ3 LYS 39 2HZ LYS 39 24.693 4.655 -1.308
274 HA PRO 40 HA PRO 40 19.103 11.755 -1.312
275 HB2 PRO 40 1HB PRO 40 20.560 13.444 0.236
276 HB3 PRO 40 2HB PRO 40 19.113 12.613 0.820
277 HG2 PRO 40 1HG PRO 40 21.995 11.912 1.230
278 HG3 PRO 40 2HG PRO 40 20.660 11.889 2.397
279 HD2 PRO 40 1HD PRO 40 21.576 9.647 1.186
280 HD3 PRO 40 2HD PRO 40 19.875 9.855 1.649
281 H SER 41 H SER 41 19.923 11.835 -3.368
282 HA SER 41 HA SER 41 22.494 11.760 -4.258
283 HB2 SER 41 1HB SER 41 20.530 11.858 -5.746
284 HB3 SER 41 2HB SER 41 20.316 13.562 -5.346
285 HG SER 41 HG SER 41 22.733 13.514 -6.099
286 H GLY 42 H GLY 42 24.159 13.217 -4.636
287 HA2 GLY 42 1HA GLY 42 23.865 15.953 -3.651
288 HA3 GLY 42 2HA GLY 42 25.041 14.934 -2.834
289 HA PRO 43 HA PRO 43 26.525 15.720 -7.404
290 HB2 PRO 43 1HB PRO 43 25.507 17.970 -8.530
291 HB3 PRO 43 2HB PRO 43 24.762 16.379 -8.722
292 HG2 PRO 43 1HG PRO 43 24.027 18.601 -6.856
293 HG3 PRO 43 2HG PRO 43 22.970 17.559 -7.826
294 HD2 PRO 43 1HD PRO 43 23.391 17.149 -5.183
295 HD3 PRO 43 2HD PRO 43 23.092 15.819 -6.320
296 H SER 44 H SER 44 28.358 16.201 -6.111
297 HA SER 44 HA SER 44 28.791 18.915 -5.207
298 HB2 SER 44 1HB SER 44 29.613 16.652 -4.130
299 HB3 SER 44 2HB SER 44 30.964 16.855 -5.246
300 HG SER 44 HG SER 44 31.545 17.897 -3.399
301 H SER 45 H SER 45 29.574 20.469 -6.449
302 HA SER 45 HA SER 45 30.956 19.755 -8.930
303 HB2 SER 45 1HB SER 45 29.034 21.278 -9.119
304 HB3 SER 45 2HB SER 45 29.821 22.414 -8.024
305 HG SER 45 HG SER 45 30.871 21.566 -10.522
306 H GLY 46 H GLY 46 32.985 19.233 -8.025
307 HA2 GLY 46 1HA GLY 46 35.169 19.720 -7.501
308 HA3 GLY 46 2HA GLY 46 34.801 21.398 -7.872
Start of MODEL 13
1 H1 GLY 1 H GLY 1 -8.647 -33.459 -1.232
2 HA2 GLY 1 1HA GLY 1 -8.415 -31.131 -0.447
3 HA3 GLY 1 2HA GLY 1 -6.915 -32.014 -0.204
4 H SER 2 H SER 2 -5.197 -30.877 -0.768
5 HA SER 2 HA SER 2 -3.853 -29.345 -1.786
6 HB2 SER 2 1HB SER 2 -5.462 -30.160 -4.219
7 HB3 SER 2 2HB SER 2 -3.903 -29.336 -4.247
8 HG SER 2 HG SER 2 -4.507 -31.976 -3.479
9 H SER 3 H SER 3 -6.029 -28.217 -0.483
10 HA SER 3 HA SER 3 -6.766 -25.987 -2.263
11 HB2 SER 3 1HB SER 3 -8.688 -27.331 -1.432
12 HB3 SER 3 2HB SER 3 -8.223 -26.925 0.220
13 HG SER 3 HG SER 3 -8.349 -24.635 -0.804
14 H GLY 4 H GLY 4 -6.242 -23.948 -1.688
15 HA2 GLY 4 1HA GLY 4 -4.723 -23.641 0.818
16 HA3 GLY 4 2HA GLY 4 -4.527 -22.640 -0.613
17 H SER 5 H SER 5 -5.142 -20.637 -0.167
18 HA SER 5 HA SER 5 -7.654 -20.257 1.328
19 HB2 SER 5 1HB SER 5 -5.202 -18.480 1.409
20 HB3 SER 5 2HB SER 5 -6.710 -18.203 2.281
21 HG SER 5 HG SER 5 -5.486 -20.669 2.655
22 H SER 6 H SER 6 -7.664 -20.520 -1.415
23 HA SER 6 HA SER 6 -7.409 -18.112 -2.849
24 HB2 SER 6 1HB SER 6 -7.541 -20.282 -3.972
25 HB3 SER 6 2HB SER 6 -9.195 -20.495 -3.400
26 HG SER 6 HG SER 6 -9.608 -19.607 -5.281
27 H GLY 7 H GLY 7 -8.859 -16.511 -3.381
28 HA2 GLY 7 1HA GLY 7 -11.617 -16.558 -2.800
29 HA3 GLY 7 2HA GLY 7 -10.770 -15.771 -1.476
30 H SER 8 H SER 8 -10.186 -13.685 -1.678
31 HA SER 8 HA SER 8 -11.024 -12.309 -4.103
32 HB2 SER 8 1HB SER 8 -10.907 -10.288 -2.825
33 HB3 SER 8 2HB SER 8 -11.650 -11.505 -1.787
34 HG SER 8 HG SER 8 -9.197 -11.789 -1.229
35 H GLY 9 H GLY 9 -8.792 -13.885 -4.527
36 HA2 GLY 9 1HA GLY 9 -6.561 -13.845 -5.145
37 HA3 GLY 9 2HA GLY 9 -7.066 -12.360 -5.938
38 H GLU 10 H GLU 10 -5.530 -10.894 -5.595
39 HA GLU 10 HA GLU 10 -4.321 -10.720 -2.922
40 HB2 GLU 10 1HB GLU 10 -2.482 -9.536 -3.969
41 HB3 GLU 10 2HB GLU 10 -2.767 -11.052 -4.812
42 HG2 GLU 10 1HG GLU 10 -3.697 -9.985 -6.666
43 HG3 GLU 10 2HG GLU 10 -3.961 -8.483 -5.782
44 H LYS 11 H LYS 11 -3.865 -8.563 -2.073
45 HA LYS 11 HA LYS 11 -6.176 -6.889 -2.233
46 HB2 LYS 11 1HB LYS 11 -3.652 -6.922 -0.659
47 HB3 LYS 11 2HB LYS 11 -4.498 -5.386 -0.792
48 HG2 LYS 11 1HG LYS 11 -5.475 -6.182 1.093
49 HG3 LYS 11 2HG LYS 11 -6.568 -6.883 -0.104
50 HD2 LYS 11 1HD LYS 11 -4.925 -8.895 -0.042
51 HD3 LYS 11 2HD LYS 11 -4.411 -8.203 1.498
52 HE2 LYS 11 1HE LYS 11 -6.904 -8.178 2.095
53 HE3 LYS 11 2HE LYS 11 -7.112 -9.258 0.718
54 HZ1 LYS 11 3HZ LYS 11 -5.104 -9.885 2.775
55 HZ2 LYS 11 1HZ LYS 11 -5.937 -10.932 1.739
56 HZ3 LYS 11 2HZ LYS 11 -6.733 -10.239 3.061
57 HA PRO 12 HA PRO 12 -4.993 -3.883 -5.202
58 HB2 PRO 12 1HB PRO 12 -5.823 -1.562 -4.065
59 HB3 PRO 12 2HB PRO 12 -6.941 -2.765 -4.716
60 HG2 PRO 12 1HG PRO 12 -6.114 -2.288 -1.879
61 HG3 PRO 12 2HG PRO 12 -7.728 -2.620 -2.533
62 HD2 PRO 12 1HD PRO 12 -6.218 -4.527 -1.344
63 HD3 PRO 12 2HD PRO 12 -7.345 -4.889 -2.667
64 H TYR 13 H TYR 13 -3.369 -4.181 -2.355
65 HA TYR 13 HA TYR 13 -1.365 -2.202 -3.186
66 HB2 TYR 13 1HB TYR 13 -2.196 -2.674 -0.316
67 HB3 TYR 13 2HB TYR 13 -0.967 -1.545 -0.876
68 HD1 TYR 13 HD2 TYR 13 -1.731 0.362 -2.414
69 HD2 TYR 13 HD1 TYR 13 -4.422 -1.992 -0.106
70 HE1 TYR 13 HE2 TYR 13 -3.435 2.124 -2.614
71 HE2 TYR 13 HE1 TYR 13 -6.134 -0.237 -0.301
72 HH TYR 13 HH TYR 13 -6.394 1.859 -2.348
73 H LYS 14 H LYS 14 0.294 -3.424 -3.809
74 HA LYS 14 HA LYS 14 1.392 -5.349 -1.906
75 HB2 LYS 14 1HB LYS 14 0.096 -6.782 -3.315
76 HB3 LYS 14 2HB LYS 14 0.675 -5.979 -4.769
77 HG2 LYS 14 1HG LYS 14 1.979 -7.834 -4.827
78 HG3 LYS 14 2HG LYS 14 3.017 -6.792 -3.851
79 HD2 LYS 14 1HD LYS 14 2.159 -7.812 -1.816
80 HD3 LYS 14 2HD LYS 14 1.058 -8.815 -2.763
81 HE2 LYS 14 1HE LYS 14 3.109 -9.739 -3.920
82 HE3 LYS 14 2HE LYS 14 4.065 -8.922 -2.685
83 HZ1 LYS 14 3HZ LYS 14 3.784 -11.066 -1.873
84 HZ2 LYS 14 1HZ LYS 14 2.165 -11.158 -2.357
85 HZ3 LYS 14 2HZ LYS 14 2.601 -10.185 -1.045
86 H CYS 15 H CYS 15 3.554 -5.245 -1.772
87 HA CYS 15 HA CYS 15 4.953 -3.257 -3.284
88 HB2 CYS 15 1HB CYS 15 5.454 -3.708 -0.907
89 HB3 CYS 15 2HB CYS 15 6.028 -5.314 -1.344
90 H ASN 16 H ASN 16 6.774 -3.582 -4.638
91 HA ASN 16 HA ASN 16 6.722 -6.170 -6.034
92 HB2 ASN 16 1HB ASN 16 6.128 -4.098 -7.336
93 HB3 ASN 16 2HB ASN 16 7.780 -3.542 -7.088
94 HD21 ASN 16 1HD2 ASN 16 8.978 -3.838 -8.807
95 HD22 ASN 16 2HD2 ASN 16 8.901 -5.180 -9.891
96 H GLU 17 H GLU 17 8.792 -3.802 -4.494
97 HA GLU 17 HA GLU 17 11.299 -4.667 -5.267
98 HB2 GLU 17 1HB GLU 17 10.294 -3.497 -2.683
99 HB3 GLU 17 2HB GLU 17 11.990 -3.903 -2.905
100 HG2 GLU 17 1HG GLU 17 10.390 -1.959 -4.552
101 HG3 GLU 17 2HG GLU 17 11.614 -1.559 -3.348
102 H CYS 18 H CYS 18 9.350 -5.825 -2.524
103 HA CYS 18 HA CYS 18 11.022 -8.252 -2.485
104 HB2 CYS 18 1HB CYS 18 10.533 -8.424 -0.070
105 HB3 CYS 18 2HB CYS 18 11.394 -6.940 -0.466
106 H GLY 19 H GLY 19 7.780 -6.943 -1.868
107 HA2 GLY 19 1HA GLY 19 5.881 -8.051 -2.907
108 HA3 GLY 19 2HA GLY 19 6.694 -9.582 -2.621
109 H LYS 20 H LYS 20 5.009 -6.903 -1.083
110 HA LYS 20 HA LYS 20 4.132 -8.743 1.017
111 HB2 LYS 20 1HB LYS 20 6.131 -7.278 1.739
112 HB3 LYS 20 2HB LYS 20 4.983 -5.946 1.725
113 HG2 LYS 20 1HG LYS 20 3.594 -7.137 3.356
114 HG3 LYS 20 2HG LYS 20 4.772 -8.451 3.384
115 HD2 LYS 20 1HD LYS 20 6.344 -7.196 4.508
116 HD3 LYS 20 2HD LYS 20 5.689 -5.663 3.928
117 HE2 LYS 20 1HE LYS 20 5.200 -5.855 6.265
118 HE3 LYS 20 2HE LYS 20 3.695 -6.047 5.368
119 HZ1 LYS 20 3HZ LYS 20 4.696 -8.586 5.623
120 HZ2 LYS 20 1HZ LYS 20 3.415 -7.916 6.503
121 HZ3 LYS 20 2HZ LYS 20 4.986 -7.873 7.130
122 H VAL 21 H VAL 21 2.114 -8.265 1.906
123 HA VAL 21 HA VAL 21 0.569 -6.259 0.401
124 HB VAL 21 HB VAL 21 -0.472 -8.700 1.845
125 HG11 VAL 21 1HG1 VAL 21 -1.785 -6.583 0.165
126 HG12 VAL 21 2HG1 VAL 21 -2.520 -8.165 0.434
127 HG13 VAL 21 3HG1 VAL 21 -2.194 -7.099 1.801
128 HG21 VAL 21 3HG2 VAL 21 -0.994 -9.278 -0.677
129 HG22 VAL 21 1HG2 VAL 21 0.404 -8.241 -0.961
130 HG23 VAL 21 2HG2 VAL 21 0.562 -9.676 0.051
131 H PHE 22 H PHE 22 -0.771 -4.834 1.468
132 HA PHE 22 HA PHE 22 -0.667 -4.857 4.407
133 HB2 PHE 22 1HB PHE 22 -0.385 -2.390 2.679
134 HB3 PHE 22 2HB PHE 22 -0.352 -2.443 4.439
135 HD1 PHE 22 HD1 PHE 22 1.438 -3.662 1.424
136 HD2 PHE 22 HD2 PHE 22 1.657 -2.730 5.571
137 HE1 PHE 22 HE1 PHE 22 3.877 -3.976 1.362
138 HE2 PHE 22 HE2 PHE 22 4.097 -3.042 5.515
139 HZ PHE 22 HZ PHE 22 5.210 -3.665 3.409
140 H THR 23 H THR 23 -2.399 -3.662 5.444
141 HA THR 23 HA THR 23 -4.918 -4.169 4.213
142 HB THR 23 HB THR 23 -5.868 -3.038 6.240
143 HG1 THR 23 HG1 THR 23 -4.472 -1.665 7.087
144 HG21 THR 23 3HG2 THR 23 -4.096 -5.391 6.233
145 HG22 THR 23 1HG2 THR 23 -5.774 -5.237 6.752
146 HG23 THR 23 2HG2 THR 23 -4.469 -4.733 7.826
147 H GLN 24 H GLN 24 -3.156 -1.197 5.044
148 HA GLN 24 HA GLN 24 -5.049 0.307 3.365
149 HB2 GLN 24 1HB GLN 24 -3.257 1.263 5.603
150 HB3 GLN 24 2HB GLN 24 -4.249 2.315 4.601
151 HG2 GLN 24 1HG GLN 24 -5.334 0.095 6.317
152 HG3 GLN 24 2HG GLN 24 -5.232 1.783 6.815
153 HE21 GLN 24 1HE2 GLN 24 -7.463 -0.221 6.164
154 HE22 GLN 24 2HE2 GLN 24 -8.530 0.686 5.153
155 H ASN 25 H ASN 25 -3.995 2.311 2.353
156 HA ASN 25 HA ASN 25 -1.856 1.400 0.680
157 HB2 ASN 25 1HB ASN 25 -3.600 2.792 -0.270
158 HB3 ASN 25 2HB ASN 25 -3.242 4.082 0.875
159 HD21 ASN 25 1HD2 ASN 25 -1.608 5.474 0.465
160 HD22 ASN 25 2HD2 ASN 25 -0.651 5.443 -0.974
161 H SER 26 H SER 26 -2.194 3.857 3.210
162 HA SER 26 HA SER 26 0.282 5.061 3.068
163 HB2 SER 26 1HB SER 26 -1.702 5.589 4.623
164 HB3 SER 26 2HB SER 26 -1.000 4.394 5.713
165 HG SER 26 HG SER 26 -0.183 6.390 6.264
166 H HIS 27 H HIS 27 -0.608 2.117 4.844
167 HA HIS 27 HA HIS 27 1.753 1.567 6.135
168 HB2 HIS 27 1HB HIS 27 -0.143 -0.378 4.805
169 HB3 HIS 27 2HB HIS 27 1.117 -0.840 5.945
170 HD1 HIS 27 HD1 HIS 27 -0.489 -1.701 7.726
171 HD2 HIS 27 HD2 HIS 27 -1.181 2.252 6.651
172 HE1 HIS 27 HE1 HIS 27 -2.106 -0.812 9.435
173 H LEU 28 H LEU 28 0.891 0.773 2.786
174 HA LEU 28 HA LEU 28 3.304 -0.576 2.181
175 HB2 LEU 28 1HB LEU 28 1.324 -0.911 0.848
176 HB3 LEU 28 2HB LEU 28 1.295 0.793 0.401
177 HG LEU 28 HG LEU 28 3.486 0.409 -0.780
178 HD11 LEU 28 1HD1 LEU 28 4.546 -1.520 -0.540
179 HD12 LEU 28 2HD1 LEU 28 3.175 -2.368 -1.254
180 HD13 LEU 28 3HD1 LEU 28 3.245 -2.118 0.490
181 HD21 LEU 28 3HD2 LEU 28 2.452 -0.451 -2.749
182 HD22 LEU 28 1HD2 LEU 28 1.241 0.494 -1.883
183 HD23 LEU 28 2HD2 LEU 28 1.203 -1.268 -1.808
184 H THR 29 H THR 29 2.191 2.676 1.222
185 HA THR 29 HA THR 29 4.387 3.634 -0.051
186 HB THR 29 HB THR 29 3.109 5.426 1.978
187 HG1 THR 29 HG1 THR 29 1.826 4.022 -0.068
188 HG21 THR 29 3HG2 THR 29 3.624 7.096 0.526
189 HG22 THR 29 1HG2 THR 29 3.333 6.097 -0.897
190 HG23 THR 29 2HG2 THR 29 4.844 5.937 -0.001
191 H ASN 30 H ASN 30 3.919 3.508 3.463
192 HA ASN 30 HA ASN 30 6.370 4.765 4.123
193 HB2 ASN 30 1HB ASN 30 4.628 2.891 5.740
194 HB3 ASN 30 2HB ASN 30 5.972 3.824 6.393
195 HD21 ASN 30 1HD2 ASN 30 3.777 4.284 7.651
196 HD22 ASN 30 2HD2 ASN 30 3.018 5.763 7.182
197 H HIS 31 H HIS 31 5.440 1.426 3.553
198 HA HIS 31 HA HIS 31 7.750 0.175 4.545
199 HB2 HIS 31 1HB HIS 31 5.869 -1.200 4.092
200 HB3 HIS 31 2HB HIS 31 5.755 -0.627 2.430
201 HD1 HIS 31 HD1 HIS 31 7.931 -2.810 4.618
202 HD2 HIS 31 HD2 HIS 31 7.173 -2.089 0.597
203 HE1 HIS 31 HE1 HIS 31 9.177 -4.601 3.368
204 H TRP 32 H TRP 32 6.922 0.812 1.131
205 HA TRP 32 HA TRP 32 9.150 0.113 -0.170
206 HB2 TRP 32 1HB TRP 32 7.303 2.420 -0.516
207 HB3 TRP 32 2HB TRP 32 8.792 2.430 -1.457
208 HD1 TRP 32 HD1 TRP 32 5.757 0.091 -0.849
209 HE1 TRP 32 HE1 TRP 32 5.319 -1.217 -3.023
210 HE3 TRP 32 HE3 TRP 32 9.691 1.800 -3.632
211 HZ2 TRP 32 HZ2 TRP 32 6.486 -1.488 -5.578
212 HZ3 TRP 32 HZ3 TRP 32 9.959 0.967 -5.931
213 HH2 TRP 32 HH2 TRP 32 8.389 -0.643 -6.882
214 H ARG 33 H ARG 33 8.898 2.789 2.053
215 HA ARG 33 HA ARG 33 11.069 4.339 1.479
216 HB2 ARG 33 1HB ARG 33 10.184 3.426 4.223
217 HB3 ARG 33 2HB ARG 33 11.241 4.795 3.904
218 HG2 ARG 33 1HG ARG 33 9.444 5.910 2.689
219 HG3 ARG 33 2HG ARG 33 8.384 4.531 2.988
220 HD2 ARG 33 1HD ARG 33 8.565 4.911 5.395
221 HD3 ARG 33 2HD ARG 33 9.639 6.278 5.102
222 HE ARG 33 HE ARG 33 7.465 6.981 3.708
223 HH11 ARG 33 1HH1 ARG 33 7.842 5.773 6.951
224 HH12 ARG 33 2HH1 ARG 33 6.455 6.611 7.564
225 HH21 ARG 33 1HH2 ARG 33 5.636 8.089 4.503
226 HH22 ARG 33 2HH2 ARG 33 5.200 7.927 6.170
227 H ILE 34 H ILE 34 11.122 1.410 3.511
228 HA ILE 34 HA ILE 34 13.834 1.330 4.054
229 HB ILE 34 HB ILE 34 13.595 -1.032 4.483
230 HG12 ILE 34 1HG1 ILE 34 10.799 -1.091 3.444
231 HG13 ILE 34 2HG1 ILE 34 12.115 -1.227 2.284
232 HG21 ILE 34 1HG2 ILE 34 12.640 -0.169 6.318
233 HG22 ILE 34 2HG2 ILE 34 11.597 0.907 5.389
234 HG23 ILE 34 3HG2 ILE 34 11.137 -0.779 5.626
235 HD11 ILE 34 3HD1 ILE 34 12.254 -3.381 2.738
236 HD12 ILE 34 1HD1 ILE 34 12.695 -2.992 4.401
237 HD13 ILE 34 2HD1 ILE 34 11.000 -3.224 3.968
238 H HIS 35 H HIS 35 12.169 0.642 1.102
239 HA HIS 35 HA HIS 35 14.424 -0.752 -0.080
240 HB2 HIS 35 1HB HIS 35 11.759 0.118 -1.214
241 HB3 HIS 35 2HB HIS 35 12.984 -0.751 -2.135
242 HD1 HIS 35 HD1 HIS 35 13.787 -2.843 -0.002
243 HD2 HIS 35 HD2 HIS 35 9.871 -1.834 -0.956
244 HE1 HIS 35 HE1 HIS 35 12.397 -4.824 0.681
245 H THR 36 H THR 36 12.877 2.405 -0.237
246 HA THR 36 HA THR 36 14.843 3.317 -2.204
247 HB THR 36 HB THR 36 13.486 5.425 -2.222
248 HG1 THR 36 HG1 THR 36 11.240 4.837 -1.262
249 HG21 THR 36 3HG2 THR 36 12.006 4.589 -3.757
250 HG22 THR 36 1HG2 THR 36 11.574 3.207 -2.752
251 HG23 THR 36 2HG2 THR 36 13.103 3.215 -3.631
252 H GLY 37 H GLY 37 16.738 3.751 -1.205
253 HA2 GLY 37 1HA GLY 37 17.039 6.089 0.312
254 HA3 GLY 37 2HA GLY 37 17.020 4.726 1.421
255 H GLU 38 H GLU 38 19.206 5.383 1.955
256 HA GLU 38 HA GLU 38 21.242 5.050 -0.079
257 HB2 GLU 38 1HB GLU 38 22.818 5.607 1.742
258 HB3 GLU 38 2HB GLU 38 21.549 6.810 1.557
259 HG2 GLU 38 1HG GLU 38 21.158 4.620 3.528
260 HG3 GLU 38 2HG GLU 38 22.271 5.929 3.921
261 H LYS 39 H LYS 39 20.132 2.727 -0.156
262 HA LYS 39 HA LYS 39 20.159 0.490 0.481
263 HB2 LYS 39 1HB LYS 39 22.526 -0.387 0.134
264 HB3 LYS 39 2HB LYS 39 21.820 0.524 -1.194
265 HG2 LYS 39 1HG LYS 39 23.953 1.383 -1.081
266 HG3 LYS 39 2HG LYS 39 23.031 2.548 -0.129
267 HD2 LYS 39 1HD LYS 39 23.929 1.833 1.865
268 HD3 LYS 39 2HD LYS 39 24.271 0.213 1.252
269 HE2 LYS 39 1HE LYS 39 26.056 1.186 -0.170
270 HE3 LYS 39 2HE LYS 39 25.755 2.752 0.583
271 HZ1 LYS 39 3HZ LYS 39 27.148 0.440 1.624
272 HZ2 LYS 39 1HZ LYS 39 26.101 1.186 2.724
273 HZ3 LYS 39 2HZ LYS 39 27.340 2.079 1.996
274 HA PRO 40 HA PRO 40 21.682 1.352 4.872
275 HB2 PRO 40 1HB PRO 40 19.249 1.286 6.074
276 HB3 PRO 40 2HB PRO 40 19.963 2.770 5.431
277 HG2 PRO 40 1HG PRO 40 17.907 0.971 4.207
278 HG3 PRO 40 2HG PRO 40 17.956 2.743 4.257
279 HD2 PRO 40 1HD PRO 40 18.691 1.327 2.070
280 HD3 PRO 40 2HD PRO 40 19.442 2.877 2.500
281 H SER 41 H SER 41 19.037 -0.739 3.738
282 HA SER 41 HA SER 41 20.347 -3.018 5.011
283 HB2 SER 41 1HB SER 41 17.593 -2.014 5.656
284 HB3 SER 41 2HB SER 41 17.942 -3.740 5.749
285 HG SER 41 HG SER 41 18.497 -1.864 7.534
286 H GLY 42 H GLY 42 20.336 -4.767 3.740
287 HA2 GLY 42 1HA GLY 42 18.175 -5.311 1.911
288 HA3 GLY 42 2HA GLY 42 19.654 -4.804 1.110
289 HA PRO 43 HA PRO 43 19.636 -9.445 1.922
290 HB2 PRO 43 1HB PRO 43 19.693 -10.217 -0.680
291 HB3 PRO 43 2HB PRO 43 18.190 -9.952 0.210
292 HG2 PRO 43 1HG PRO 43 19.606 -8.133 -1.700
293 HG3 PRO 43 2HG PRO 43 17.873 -8.485 -1.567
294 HD2 PRO 43 1HD PRO 43 18.986 -6.237 -0.546
295 HD3 PRO 43 2HD PRO 43 17.587 -7.034 0.202
296 H SER 44 H SER 44 21.323 -10.995 1.170
297 HA SER 44 HA SER 44 23.814 -9.558 0.530
298 HB2 SER 44 1HB SER 44 23.279 -11.960 2.268
299 HB3 SER 44 2HB SER 44 24.895 -11.609 1.656
300 HG SER 44 HG SER 44 23.626 -9.451 2.787
301 H SER 45 H SER 45 24.736 -10.001 -1.351
302 HA SER 45 HA SER 45 23.674 -11.903 -3.153
303 HB2 SER 45 1HB SER 45 25.409 -11.214 -4.662
304 HB3 SER 45 2HB SER 45 24.882 -9.780 -3.781
305 HG SER 45 HG SER 45 26.717 -10.370 -2.308
306 H GLY 46 H GLY 46 24.771 -13.730 -4.109
307 HA2 GLY 46 1HA GLY 46 26.505 -15.106 -2.152
308 HA3 GLY 46 2HA GLY 46 25.357 -15.924 -3.202
Start of MODEL 14
1 H1 GLY 1 H GLY 1 10.066 -30.196 -3.601
2 HA2 GLY 1 1HA GLY 1 9.792 -27.702 -3.222
3 HA3 GLY 1 2HA GLY 1 9.831 -27.595 -4.976
4 H SER 2 H SER 2 7.709 -26.581 -3.543
5 HA SER 2 HA SER 2 5.526 -27.989 -4.742
6 HB2 SER 2 1HB SER 2 5.759 -29.365 -2.737
7 HB3 SER 2 2HB SER 2 5.698 -27.927 -1.718
8 HG SER 2 HG SER 2 3.593 -28.352 -3.500
9 H SER 3 H SER 3 4.076 -26.527 -5.356
10 HA SER 3 HA SER 3 4.331 -23.798 -4.464
11 HB2 SER 3 1HB SER 3 2.592 -25.170 -6.510
12 HB3 SER 3 2HB SER 3 2.378 -23.469 -6.099
13 HG SER 3 HG SER 3 3.774 -23.563 -7.819
14 H GLY 4 H GLY 4 3.660 -23.702 -2.339
15 HA2 GLY 4 1HA GLY 4 0.760 -23.913 -1.963
16 HA3 GLY 4 2HA GLY 4 1.803 -24.794 -0.857
17 H SER 5 H SER 5 -0.054 -22.237 -0.890
18 HA SER 5 HA SER 5 1.743 -20.676 0.841
19 HB2 SER 5 1HB SER 5 1.327 -19.599 -1.419
20 HB3 SER 5 2HB SER 5 -0.362 -19.437 -0.938
21 HG SER 5 HG SER 5 1.907 -18.126 0.035
22 H SER 6 H SER 6 1.008 -20.839 2.847
23 HA SER 6 HA SER 6 -1.334 -21.823 3.773
24 HB2 SER 6 1HB SER 6 0.518 -21.235 5.255
25 HB3 SER 6 2HB SER 6 0.215 -19.519 4.984
26 HG SER 6 HG SER 6 -0.720 -20.662 6.941
27 H GLY 7 H GLY 7 -0.741 -18.342 3.246
28 HA2 GLY 7 1HA GLY 7 -3.621 -18.036 2.713
29 HA3 GLY 7 2HA GLY 7 -2.831 -16.972 3.866
30 H SER 8 H SER 8 -3.661 -17.439 0.637
31 HA SER 8 HA SER 8 -1.635 -16.134 -0.759
32 HB2 SER 8 1HB SER 8 -3.453 -15.579 -2.421
33 HB3 SER 8 2HB SER 8 -3.348 -17.284 -1.982
34 HG SER 8 HG SER 8 -5.472 -16.783 -1.827
35 H GLY 9 H GLY 9 -4.737 -14.693 0.277
36 HA2 GLY 9 1HA GLY 9 -5.201 -12.582 1.079
37 HA3 GLY 9 2HA GLY 9 -3.472 -12.328 1.267
38 H GLU 10 H GLU 10 -6.241 -11.786 -0.702
39 HA GLU 10 HA GLU 10 -4.619 -10.570 -2.817
40 HB2 GLU 10 1HB GLU 10 -7.462 -11.494 -2.639
41 HB3 GLU 10 2HB GLU 10 -7.017 -10.289 -3.840
42 HG2 GLU 10 1HG GLU 10 -6.856 -12.298 -4.984
43 HG3 GLU 10 2HG GLU 10 -5.189 -11.937 -4.539
44 H LYS 11 H LYS 11 -3.976 -8.792 -1.444
45 HA LYS 11 HA LYS 11 -6.068 -6.905 -0.687
46 HB2 LYS 11 1HB LYS 11 -3.186 -7.259 -0.028
47 HB3 LYS 11 2HB LYS 11 -3.842 -5.629 0.048
48 HG2 LYS 11 1HG LYS 11 -4.178 -6.319 2.197
49 HG3 LYS 11 2HG LYS 11 -5.717 -6.784 1.469
50 HD2 LYS 11 1HD LYS 11 -3.471 -8.745 1.465
51 HD3 LYS 11 2HD LYS 11 -4.358 -8.469 2.966
52 HE2 LYS 11 1HE LYS 11 -5.900 -8.942 0.464
53 HE3 LYS 11 2HE LYS 11 -5.110 -10.315 1.238
54 HZ1 LYS 11 3HZ LYS 11 -7.130 -8.506 2.442
55 HZ2 LYS 11 1HZ LYS 11 -6.268 -9.670 3.317
56 HZ3 LYS 11 2HZ LYS 11 -7.316 -10.147 2.078
57 HA PRO 12 HA PRO 12 -5.606 -4.320 -4.211
58 HB2 PRO 12 1HB PRO 12 -6.291 -1.924 -3.135
59 HB3 PRO 12 2HB PRO 12 -7.468 -3.201 -3.463
60 HG2 PRO 12 1HG PRO 12 -6.147 -2.461 -0.881
61 HG3 PRO 12 2HG PRO 12 -7.842 -2.880 -1.191
62 HD2 PRO 12 1HD PRO 12 -6.071 -4.646 -0.152
63 HD3 PRO 12 2HD PRO 12 -7.411 -5.144 -1.206
64 H TYR 13 H TYR 13 -3.499 -4.289 -1.660
65 HA TYR 13 HA TYR 13 -1.692 -2.471 -3.074
66 HB2 TYR 13 1HB TYR 13 -2.094 -2.376 -0.079
67 HB3 TYR 13 2HB TYR 13 -1.010 -1.365 -1.028
68 HD1 TYR 13 HD2 TYR 13 -1.975 0.326 -2.600
69 HD2 TYR 13 HD1 TYR 13 -4.388 -1.824 0.167
70 HE1 TYR 13 HE2 TYR 13 -3.761 1.994 -2.871
71 HE2 TYR 13 HE1 TYR 13 -6.182 -0.162 -0.096
72 HH TYR 13 HH TYR 13 -6.778 1.774 -1.013
73 H LYS 14 H LYS 14 0.054 -3.605 -3.560
74 HA LYS 14 HA LYS 14 1.273 -5.308 -1.521
75 HB2 LYS 14 1HB LYS 14 0.109 -6.982 -2.669
76 HB3 LYS 14 2HB LYS 14 0.345 -6.207 -4.231
77 HG2 LYS 14 1HG LYS 14 2.748 -7.155 -2.769
78 HG3 LYS 14 2HG LYS 14 1.697 -8.356 -3.522
79 HD2 LYS 14 1HD LYS 14 1.863 -6.810 -5.605
80 HD3 LYS 14 2HD LYS 14 3.295 -6.169 -4.796
81 HE2 LYS 14 1HE LYS 14 4.227 -7.842 -6.060
82 HE3 LYS 14 2HE LYS 14 3.912 -8.704 -4.555
83 HZ1 LYS 14 3HZ LYS 14 1.625 -9.123 -5.814
84 HZ2 LYS 14 1HZ LYS 14 2.957 -10.154 -5.972
85 HZ3 LYS 14 2HZ LYS 14 2.644 -8.990 -7.158
86 H CYS 15 H CYS 15 3.426 -5.094 -1.446
87 HA CYS 15 HA CYS 15 4.727 -3.192 -3.115
88 HB2 CYS 15 1HB CYS 15 5.471 -3.386 -0.852
89 HB3 CYS 15 2HB CYS 15 5.752 -5.115 -1.026
90 H ASN 16 H ASN 16 5.877 -3.457 -4.927
91 HA ASN 16 HA ASN 16 6.064 -6.143 -6.047
92 HB2 ASN 16 1HB ASN 16 5.195 -4.679 -7.644
93 HB3 ASN 16 2HB ASN 16 6.279 -3.372 -7.179
94 HD21 ASN 16 1HD2 ASN 16 6.239 -6.589 -8.635
95 HD22 ASN 16 2HD2 ASN 16 7.571 -6.316 -9.701
96 H GLU 17 H GLU 17 8.016 -3.872 -4.441
97 HA GLU 17 HA GLU 17 10.525 -4.379 -5.613
98 HB2 GLU 17 1HB GLU 17 9.788 -2.560 -3.895
99 HB3 GLU 17 2HB GLU 17 10.216 -3.769 -2.692
100 HG2 GLU 17 1HG GLU 17 12.013 -2.503 -4.740
101 HG3 GLU 17 2HG GLU 17 12.088 -2.341 -2.986
102 H CYS 18 H CYS 18 9.119 -5.703 -2.612
103 HA CYS 18 HA CYS 18 10.962 -7.986 -2.865
104 HB2 CYS 18 1HB CYS 18 10.658 -8.300 -0.436
105 HB3 CYS 18 2HB CYS 18 11.313 -6.711 -0.817
106 H GLY 19 H GLY 19 7.626 -7.019 -2.308
107 HA2 GLY 19 1HA GLY 19 5.930 -8.456 -3.367
108 HA3 GLY 19 2HA GLY 19 6.833 -9.832 -2.750
109 H LYS 20 H LYS 20 6.522 -7.075 -0.709
110 HA LYS 20 HA LYS 20 5.274 -8.542 1.351
111 HB2 LYS 20 1HB LYS 20 6.073 -5.724 0.908
112 HB3 LYS 20 2HB LYS 20 4.820 -5.993 2.113
113 HG2 LYS 20 1HG LYS 20 7.265 -7.672 2.241
114 HG3 LYS 20 2HG LYS 20 7.378 -5.984 2.745
115 HD2 LYS 20 1HD LYS 20 6.867 -7.207 4.699
116 HD3 LYS 20 2HD LYS 20 5.358 -6.433 4.211
117 HE2 LYS 20 1HE LYS 20 5.058 -8.789 4.891
118 HE3 LYS 20 2HE LYS 20 4.574 -8.489 3.223
119 HZ1 LYS 20 3HZ LYS 20 7.255 -9.527 3.929
120 HZ2 LYS 20 1HZ LYS 20 6.499 -9.529 2.416
121 HZ3 LYS 20 2HZ LYS 20 5.938 -10.548 3.642
122 H VAL 21 H VAL 21 3.283 -7.156 2.451
123 HA VAL 21 HA VAL 21 1.242 -6.482 0.526
124 HB VAL 21 HB VAL 21 0.930 -8.953 2.237
125 HG11 VAL 21 1HG1 VAL 21 -1.065 -7.541 0.469
126 HG12 VAL 21 2HG1 VAL 21 -1.309 -9.120 1.219
127 HG13 VAL 21 3HG1 VAL 21 -1.130 -7.682 2.226
128 HG21 VAL 21 3HG2 VAL 21 0.504 -10.006 -0.024
129 HG22 VAL 21 1HG2 VAL 21 1.141 -8.523 -0.734
130 HG23 VAL 21 2HG2 VAL 21 2.168 -9.518 0.299
131 H PHE 22 H PHE 22 -0.294 -5.175 1.384
132 HA PHE 22 HA PHE 22 -0.525 -4.986 4.296
133 HB2 PHE 22 1HB PHE 22 -0.222 -2.524 2.576
134 HB3 PHE 22 2HB PHE 22 -0.238 -2.616 4.334
135 HD1 PHE 22 HD1 PHE 22 1.741 -3.178 1.308
136 HD2 PHE 22 HD2 PHE 22 1.716 -3.292 5.563
137 HE1 PHE 22 HE1 PHE 22 4.196 -3.348 1.314
138 HE2 PHE 22 HE2 PHE 22 4.171 -3.461 5.576
139 HZ PHE 22 HZ PHE 22 5.414 -3.488 3.450
140 H THR 23 H THR 23 -2.337 -3.285 4.804
141 HA THR 23 HA THR 23 -4.635 -4.051 3.154
142 HB THR 23 HB THR 23 -4.641 -2.791 5.902
143 HG1 THR 23 HG1 THR 23 -5.179 -5.509 5.275
144 HG21 THR 23 3HG2 THR 23 -6.919 -4.388 4.912
145 HG22 THR 23 1HG2 THR 23 -6.678 -2.824 4.135
146 HG23 THR 23 2HG2 THR 23 -6.903 -2.916 5.882
147 H GLN 24 H GLN 24 -3.234 -1.188 4.734
148 HA GLN 24 HA GLN 24 -4.877 0.515 2.996
149 HB2 GLN 24 1HB GLN 24 -3.300 1.218 5.477
150 HB3 GLN 24 2HB GLN 24 -4.276 2.342 4.542
151 HG2 GLN 24 1HG GLN 24 -5.238 -0.031 6.118
152 HG3 GLN 24 2HG GLN 24 -5.511 1.675 6.470
153 HE21 GLN 24 1HE2 GLN 24 -6.410 2.808 4.331
154 HE22 GLN 24 2HE2 GLN 24 -7.819 2.036 3.695
155 H ASN 25 H ASN 25 -3.927 2.261 1.853
156 HA ASN 25 HA ASN 25 -1.559 1.647 0.502
157 HB2 ASN 25 1HB ASN 25 -1.706 3.928 -0.423
158 HB3 ASN 25 2HB ASN 25 -3.267 3.113 -0.451
159 HD21 ASN 25 1HD2 ASN 25 -2.095 6.001 -0.128
160 HD22 ASN 25 2HD2 ASN 25 -3.122 6.675 1.087
161 H SER 26 H SER 26 -2.143 4.100 3.018
162 HA SER 26 HA SER 26 0.263 5.294 3.265
163 HB2 SER 26 1HB SER 26 -1.695 4.396 5.357
164 HB3 SER 26 2HB SER 26 -0.190 5.181 5.836
165 HG SER 26 HG SER 26 -2.107 6.250 4.033
166 H HIS 27 H HIS 27 -0.552 2.066 4.450
167 HA HIS 27 HA HIS 27 1.844 1.543 5.817
168 HB2 HIS 27 1HB HIS 27 -0.015 -0.394 4.422
169 HB3 HIS 27 2HB HIS 27 1.229 -0.839 5.586
170 HD1 HIS 27 HD1 HIS 27 -0.729 -1.863 7.036
171 HD2 HIS 27 HD2 HIS 27 -0.840 2.262 6.560
172 HE1 HIS 27 HE1 HIS 27 -2.329 -1.028 8.787
173 H LEU 28 H LEU 28 0.883 0.815 2.473
174 HA LEU 28 HA LEU 28 3.317 -0.422 1.742
175 HB2 LEU 28 1HB LEU 28 1.278 -0.764 0.480
176 HB3 LEU 28 2HB LEU 28 1.227 0.946 0.055
177 HG LEU 28 HG LEU 28 3.354 0.613 -1.216
178 HD11 LEU 28 1HD1 LEU 28 3.484 -1.993 -1.835
179 HD12 LEU 28 2HD1 LEU 28 2.984 -2.112 -0.148
180 HD13 LEU 28 3HD1 LEU 28 4.460 -1.244 -0.571
181 HD21 LEU 28 3HD2 LEU 28 1.873 0.567 -2.873
182 HD22 LEU 28 1HD2 LEU 28 0.691 -0.277 -1.873
183 HD23 LEU 28 2HD2 LEU 28 1.903 -1.194 -2.767
184 H THR 29 H THR 29 2.088 2.715 0.574
185 HA THR 29 HA THR 29 4.310 3.738 -0.572
186 HB THR 29 HB THR 29 2.175 4.948 -0.498
187 HG1 THR 29 HG1 THR 29 4.603 6.168 0.169
188 HG21 THR 29 3HG2 THR 29 1.438 4.696 1.734
189 HG22 THR 29 1HG2 THR 29 1.781 6.415 1.544
190 HG23 THR 29 2HG2 THR 29 2.930 5.375 2.385
191 H ASN 30 H ASN 30 3.839 3.178 2.809
192 HA ASN 30 HA ASN 30 6.122 4.804 3.581
193 HB2 ASN 30 1HB ASN 30 4.056 3.217 5.066
194 HB3 ASN 30 2HB ASN 30 5.550 3.680 5.876
195 HD21 ASN 30 1HD2 ASN 30 2.726 4.492 6.274
196 HD22 ASN 30 2HD2 ASN 30 2.740 6.218 6.201
197 H HIS 31 H HIS 31 5.246 1.414 3.227
198 HA HIS 31 HA HIS 31 7.439 0.220 4.453
199 HB2 HIS 31 1HB HIS 31 5.685 -1.217 3.828
200 HB3 HIS 31 2HB HIS 31 5.676 -0.629 2.168
201 HD1 HIS 31 HD1 HIS 31 7.541 -2.934 4.468
202 HD2 HIS 31 HD2 HIS 31 7.455 -1.892 0.447
203 HE1 HIS 31 HE1 HIS 31 8.964 -4.646 3.299
204 H TRP 32 H TRP 32 7.079 1.465 1.165
205 HA TRP 32 HA TRP 32 9.355 0.535 -0.041
206 HB2 TRP 32 1HB TRP 32 7.760 3.036 -0.307
207 HB3 TRP 32 2HB TRP 32 9.331 2.985 -1.101
208 HD1 TRP 32 HD1 TRP 32 6.110 0.814 -0.990
209 HE1 TRP 32 HE1 TRP 32 5.754 -0.185 -3.335
210 HE3 TRP 32 HE3 TRP 32 10.302 2.625 -3.288
211 HZ2 TRP 32 HZ2 TRP 32 7.075 -0.203 -5.829
212 HZ3 TRP 32 HZ3 TRP 32 10.682 2.070 -5.655
213 HH2 TRP 32 HH2 TRP 32 9.101 0.685 -6.897
214 H ARG 33 H ARG 33 9.135 2.681 2.620
215 HA ARG 33 HA ARG 33 11.440 4.203 2.409
216 HB2 ARG 33 1HB ARG 33 9.945 3.079 4.757
217 HB3 ARG 33 2HB ARG 33 11.439 3.975 5.001
218 HG2 ARG 33 1HG ARG 33 10.306 5.796 3.559
219 HG3 ARG 33 2HG ARG 33 8.815 4.935 3.944
220 HD2 ARG 33 1HD ARG 33 8.864 6.409 5.685
221 HD3 ARG 33 2HD ARG 33 9.782 5.083 6.397
222 HE ARG 33 HE ARG 33 11.620 6.437 6.431
223 HH11 ARG 33 1HH1 ARG 33 9.292 7.760 4.206
224 HH12 ARG 33 2HH1 ARG 33 10.190 9.216 3.929
225 HH21 ARG 33 1HH2 ARG 33 12.812 8.349 6.074
226 HH22 ARG 33 2HH2 ARG 33 12.192 9.549 4.991
227 H ILE 34 H ILE 34 11.122 1.101 4.148
228 HA ILE 34 HA ILE 34 13.783 0.719 4.777
229 HB ILE 34 HB ILE 34 13.315 -1.640 4.987
230 HG12 ILE 34 1HG1 ILE 34 10.574 -1.343 3.843
231 HG13 ILE 34 2HG1 ILE 34 11.925 -1.515 2.728
232 HG21 ILE 34 1HG2 ILE 34 11.221 -1.528 6.358
233 HG22 ILE 34 2HG2 ILE 34 12.431 -0.306 6.750
234 HG23 ILE 34 3HG2 ILE 34 11.016 0.130 5.792
235 HD11 ILE 34 3HD1 ILE 34 10.539 -3.523 4.163
236 HD12 ILE 34 1HD1 ILE 34 11.866 -3.701 3.016
237 HD13 ILE 34 2HD1 ILE 34 12.207 -3.488 4.734
238 H HIS 35 H HIS 35 12.252 0.539 1.705
239 HA HIS 35 HA HIS 35 14.368 -1.029 0.488
240 HB2 HIS 35 1HB HIS 35 11.859 0.258 -0.572
241 HB3 HIS 35 2HB HIS 35 13.059 -0.458 -1.642
242 HD1 HIS 35 HD1 HIS 35 13.583 -2.862 0.508
243 HD2 HIS 35 HD2 HIS 35 9.998 -1.735 -1.265
244 HE1 HIS 35 HE1 HIS 35 12.113 -4.900 0.609
245 H THR 36 H THR 36 13.426 2.307 0.834
246 HA THR 36 HA THR 36 15.492 3.168 -1.053
247 HB THR 36 HB THR 36 14.554 5.472 -0.598
248 HG1 THR 36 HG1 THR 36 12.926 5.683 0.763
249 HG21 THR 36 3HG2 THR 36 12.446 5.042 -1.897
250 HG22 THR 36 1HG2 THR 36 12.774 3.318 -1.733
251 HG23 THR 36 2HG2 THR 36 13.905 4.351 -2.607
252 H GLY 37 H GLY 37 17.398 2.829 0.058
253 HA2 GLY 37 1HA GLY 37 17.723 4.422 2.527
254 HA3 GLY 37 2HA GLY 37 18.534 2.885 2.266
255 H GLU 38 H GLU 38 19.292 3.293 -0.434
256 HA GLU 38 HA GLU 38 21.678 4.803 -0.023
257 HB2 GLU 38 1HB GLU 38 20.507 3.228 -2.270
258 HB3 GLU 38 2HB GLU 38 21.803 4.360 -2.633
259 HG2 GLU 38 1HG GLU 38 21.931 2.085 -0.667
260 HG3 GLU 38 2HG GLU 38 22.673 2.128 -2.266
261 H LYS 39 H LYS 39 20.601 6.850 0.521
262 HA LYS 39 HA LYS 39 19.057 8.338 -1.270
263 HB2 LYS 39 1HB LYS 39 19.017 9.332 0.779
264 HB3 LYS 39 2HB LYS 39 20.692 8.925 1.128
265 HG2 LYS 39 1HG LYS 39 21.423 10.726 -0.375
266 HG3 LYS 39 2HG LYS 39 19.734 11.153 -0.657
267 HD2 LYS 39 1HD LYS 39 19.479 11.554 1.777
268 HD3 LYS 39 2HD LYS 39 21.205 11.242 1.976
269 HE2 LYS 39 1HE LYS 39 21.788 13.147 0.693
270 HE3 LYS 39 2HE LYS 39 20.134 13.353 0.119
271 HZ1 LYS 39 3HZ LYS 39 21.323 14.483 2.377
272 HZ2 LYS 39 1HZ LYS 39 20.127 13.418 2.923
273 HZ3 LYS 39 2HZ LYS 39 19.728 14.657 1.843
274 HA PRO 40 HA PRO 40 23.118 10.449 -2.803
275 HB2 PRO 40 1HB PRO 40 25.474 9.353 -2.016
276 HB3 PRO 40 2HB PRO 40 24.645 10.613 -1.095
277 HG2 PRO 40 1HG PRO 40 24.670 7.652 -0.657
278 HG3 PRO 40 2HG PRO 40 24.807 8.960 0.533
279 HD2 PRO 40 1HD PRO 40 22.493 7.623 0.098
280 HD3 PRO 40 2HD PRO 40 22.533 9.333 0.570
281 H SER 41 H SER 41 24.353 10.000 -4.666
282 HA SER 41 HA SER 41 23.798 7.400 -5.832
283 HB2 SER 41 1HB SER 41 23.621 9.792 -6.948
284 HB3 SER 41 2HB SER 41 25.330 9.518 -7.285
285 HG SER 41 HG SER 41 24.396 8.595 -8.985
286 H GLY 42 H GLY 42 25.173 5.806 -5.371
287 HA2 GLY 42 1HA GLY 42 27.263 4.750 -5.867
288 HA3 GLY 42 2HA GLY 42 28.043 6.320 -5.752
289 HA PRO 43 HA PRO 43 28.603 3.871 -1.782
290 HB2 PRO 43 1HB PRO 43 31.317 3.816 -1.852
291 HB3 PRO 43 2HB PRO 43 30.311 2.574 -2.607
292 HG2 PRO 43 1HG PRO 43 31.672 4.929 -3.858
293 HG3 PRO 43 2HG PRO 43 31.558 3.260 -4.446
294 HD2 PRO 43 1HD PRO 43 29.980 5.248 -5.389
295 HD3 PRO 43 2HD PRO 43 29.429 3.564 -5.274
296 H SER 44 H SER 44 28.675 4.995 0.061
297 HA SER 44 HA SER 44 29.605 7.750 -0.002
298 HB2 SER 44 1HB SER 44 28.550 7.910 2.234
299 HB3 SER 44 2HB SER 44 27.430 7.302 1.015
300 HG SER 44 HG SER 44 28.349 6.103 3.276
301 H SER 45 H SER 45 31.827 7.642 0.012
302 HA SER 45 HA SER 45 33.200 6.057 2.013
303 HB2 SER 45 1HB SER 45 34.102 7.818 -0.255
304 HB3 SER 45 2HB SER 45 35.246 7.238 0.955
305 HG SER 45 HG SER 45 33.779 5.793 -0.953
306 H GLY 46 H GLY 46 33.991 6.771 3.900
307 HA2 GLY 46 1HA GLY 46 34.170 9.674 4.346
308 HA3 GLY 46 2HA GLY 46 33.242 8.687 5.465
Start of MODEL 15
1 H1 GLY 1 H GLY 1 -4.731 -28.073 -5.848
2 HA2 GLY 1 1HA GLY 1 -7.615 -28.462 -6.259
3 HA3 GLY 1 2HA GLY 1 -6.660 -29.793 -5.624
4 H SER 2 H SER 2 -6.385 -26.337 -4.897
5 HA SER 2 HA SER 2 -7.359 -26.863 -2.180
6 HB2 SER 2 1HB SER 2 -4.746 -26.851 -2.490
7 HB3 SER 2 2HB SER 2 -4.962 -25.102 -2.540
8 HG SER 2 HG SER 2 -5.223 -25.129 -0.464
9 H SER 3 H SER 3 -9.088 -25.596 -2.016
10 HA SER 3 HA SER 3 -8.831 -22.754 -2.215
11 HB2 SER 3 1HB SER 3 -10.277 -22.299 -4.026
12 HB3 SER 3 2HB SER 3 -9.210 -23.570 -4.622
13 HG SER 3 HG SER 3 -11.093 -24.931 -3.637
14 H GLY 4 H GLY 4 -9.925 -22.056 -0.510
15 HA2 GLY 4 1HA GLY 4 -12.663 -22.544 -0.087
16 HA3 GLY 4 2HA GLY 4 -11.738 -23.608 0.962
17 H SER 5 H SER 5 -9.650 -22.067 1.748
18 HA SER 5 HA SER 5 -10.635 -20.606 3.862
19 HB2 SER 5 1HB SER 5 -7.999 -20.261 2.414
20 HB3 SER 5 2HB SER 5 -8.369 -19.565 3.992
21 HG SER 5 HG SER 5 -8.957 -21.989 4.375
22 H SER 6 H SER 6 -11.649 -18.728 4.041
23 HA SER 6 HA SER 6 -12.460 -17.135 1.954
24 HB2 SER 6 1HB SER 6 -13.421 -17.033 4.228
25 HB3 SER 6 2HB SER 6 -11.959 -16.230 4.801
26 HG SER 6 HG SER 6 -13.561 -15.208 2.701
27 H GLY 7 H GLY 7 -9.706 -16.528 4.136
28 HA2 GLY 7 1HA GLY 7 -7.649 -15.822 2.821
29 HA3 GLY 7 2HA GLY 7 -8.701 -14.578 2.161
30 H SER 8 H SER 8 -6.370 -15.157 4.401
31 HA SER 8 HA SER 8 -7.349 -13.040 6.201
32 HB2 SER 8 1HB SER 8 -5.616 -15.440 6.656
33 HB3 SER 8 2HB SER 8 -5.403 -14.020 7.680
34 HG SER 8 HG SER 8 -6.981 -15.706 8.362
35 H GLY 9 H GLY 9 -6.276 -12.289 3.762
36 HA2 GLY 9 1HA GLY 9 -4.595 -10.264 4.234
37 HA3 GLY 9 2HA GLY 9 -3.476 -11.617 4.171
38 H GLU 10 H GLU 10 -6.266 -10.433 2.285
39 HA GLU 10 HA GLU 10 -4.619 -10.744 -0.136
40 HB2 GLU 10 1HB GLU 10 -6.543 -12.474 0.322
41 HB3 GLU 10 2HB GLU 10 -7.579 -11.169 -0.239
42 HG2 GLU 10 1HG GLU 10 -6.127 -11.075 -2.302
43 HG3 GLU 10 2HG GLU 10 -5.405 -12.585 -1.749
44 H LYS 11 H LYS 11 -4.136 -8.521 -0.083
45 HA LYS 11 HA LYS 11 -6.408 -6.781 -0.789
46 HB2 LYS 11 1HB LYS 11 -3.928 -6.089 0.793
47 HB3 LYS 11 2HB LYS 11 -5.086 -4.903 0.206
48 HG2 LYS 11 1HG LYS 11 -5.777 -5.208 2.374
49 HG3 LYS 11 2HG LYS 11 -6.818 -6.338 1.505
50 HD2 LYS 11 1HD LYS 11 -6.084 -7.677 3.219
51 HD3 LYS 11 2HD LYS 11 -4.857 -8.019 1.997
52 HE2 LYS 11 1HE LYS 11 -3.235 -6.825 3.096
53 HE3 LYS 11 2HE LYS 11 -4.400 -5.764 3.887
54 HZ1 LYS 11 3HZ LYS 11 -4.925 -8.287 4.851
55 HZ2 LYS 11 1HZ LYS 11 -4.157 -7.025 5.676
56 HZ3 LYS 11 2HZ LYS 11 -3.237 -8.172 4.840
57 HA PRO 12 HA PRO 12 -4.336 -5.873 -4.555
58 HB2 PRO 12 1HB PRO 12 -5.237 -3.355 -5.020
59 HB3 PRO 12 2HB PRO 12 -6.257 -4.788 -5.198
60 HG2 PRO 12 1HG PRO 12 -6.084 -2.857 -2.917
61 HG3 PRO 12 2HG PRO 12 -7.521 -3.579 -3.666
62 HD2 PRO 12 1HD PRO 12 -6.474 -4.494 -1.342
63 HD3 PRO 12 2HD PRO 12 -7.283 -5.559 -2.509
64 H TYR 13 H TYR 13 -3.728 -4.126 -1.690
65 HA TYR 13 HA TYR 13 -1.710 -2.397 -2.851
66 HB2 TYR 13 1HB TYR 13 -2.691 -2.828 -0.031
67 HB3 TYR 13 2HB TYR 13 -1.323 -1.786 -0.407
68 HD1 TYR 13 HD1 TYR 13 -3.933 -1.881 -2.889
69 HD2 TYR 13 HD2 TYR 13 -2.671 0.029 0.698
70 HE1 TYR 13 HE1 TYR 13 -5.478 -0.022 -3.342
71 HE2 TYR 13 HE2 TYR 13 -4.213 1.893 0.255
72 HH TYR 13 HH TYR 13 -5.448 2.636 -2.527
73 H LYS 14 H LYS 14 -0.228 -3.897 -3.688
74 HA LYS 14 HA LYS 14 1.314 -5.366 -1.650
75 HB2 LYS 14 1HB LYS 14 0.203 -6.904 -3.177
76 HB3 LYS 14 2HB LYS 14 0.881 -6.058 -4.561
77 HG2 LYS 14 1HG LYS 14 3.089 -6.772 -4.008
78 HG3 LYS 14 2HG LYS 14 2.543 -7.437 -2.467
79 HD2 LYS 14 1HD LYS 14 1.131 -9.047 -3.706
80 HD3 LYS 14 2HD LYS 14 1.784 -8.416 -5.220
81 HE2 LYS 14 1HE LYS 14 3.068 -10.321 -4.785
82 HE3 LYS 14 2HE LYS 14 4.082 -8.983 -4.250
83 HZ1 LYS 14 3HZ LYS 14 3.925 -10.948 -2.708
84 HZ2 LYS 14 1HZ LYS 14 2.328 -10.483 -2.396
85 HZ3 LYS 14 2HZ LYS 14 3.602 -9.441 -2.011
86 H CYS 15 H CYS 15 3.612 -5.524 -2.007
87 HA CYS 15 HA CYS 15 4.686 -3.068 -3.130
88 HB2 CYS 15 1HB CYS 15 5.461 -3.712 -0.924
89 HB3 CYS 15 2HB CYS 15 5.976 -5.284 -1.527
90 H ASN 16 H ASN 16 6.338 -2.983 -4.683
91 HA ASN 16 HA ASN 16 6.524 -5.390 -6.370
92 HB2 ASN 16 1HB ASN 16 5.409 -3.215 -7.249
93 HB3 ASN 16 2HB ASN 16 7.057 -2.607 -7.370
94 HD21 ASN 16 1HD2 ASN 16 6.603 -2.452 -9.647
95 HD22 ASN 16 2HD2 ASN 16 6.767 -3.850 -10.648
96 H GLU 17 H GLU 17 8.227 -4.891 -4.115
97 HA GLU 17 HA GLU 17 10.801 -4.707 -5.523
98 HB2 GLU 17 1HB GLU 17 9.879 -3.192 -3.138
99 HB3 GLU 17 2HB GLU 17 11.539 -3.771 -3.126
100 HG2 GLU 17 1HG GLU 17 10.451 -2.232 -5.450
101 HG3 GLU 17 2HG GLU 17 11.069 -1.417 -4.015
102 H CYS 18 H CYS 18 8.909 -6.006 -2.879
103 HA CYS 18 HA CYS 18 10.866 -8.186 -2.628
104 HB2 CYS 18 1HB CYS 18 10.526 -8.243 -0.209
105 HB3 CYS 18 2HB CYS 18 11.136 -6.669 -0.708
106 H GLY 19 H GLY 19 7.538 -7.090 -2.183
107 HA2 GLY 19 1HA GLY 19 5.804 -8.532 -3.163
108 HA3 GLY 19 2HA GLY 19 6.679 -9.900 -2.491
109 H LYS 20 H LYS 20 6.289 -6.957 -0.676
110 HA LYS 20 HA LYS 20 4.959 -8.379 1.436
111 HB2 LYS 20 1HB LYS 20 6.656 -6.344 1.508
112 HB3 LYS 20 2HB LYS 20 5.173 -5.402 1.430
113 HG2 LYS 20 1HG LYS 20 5.384 -5.559 3.681
114 HG3 LYS 20 2HG LYS 20 4.463 -7.036 3.387
115 HD2 LYS 20 1HD LYS 20 6.721 -8.207 3.195
116 HD3 LYS 20 2HD LYS 20 7.414 -6.739 3.889
117 HE2 LYS 20 1HE LYS 20 5.926 -6.987 5.835
118 HE3 LYS 20 2HE LYS 20 5.295 -8.482 5.145
119 HZ1 LYS 20 3HZ LYS 20 6.925 -9.506 6.221
120 HZ2 LYS 20 1HZ LYS 20 7.686 -8.052 6.630
121 HZ3 LYS 20 2HZ LYS 20 8.019 -8.792 5.147
122 H VAL 21 H VAL 21 2.935 -7.682 2.410
123 HA VAL 21 HA VAL 21 1.083 -6.418 0.503
124 HB VAL 21 HB VAL 21 0.478 -8.856 2.182
125 HG11 VAL 21 1HG1 VAL 21 -1.691 -8.843 1.035
126 HG12 VAL 21 2HG1 VAL 21 -1.449 -7.382 1.996
127 HG13 VAL 21 3HG1 VAL 21 -1.256 -7.329 0.243
128 HG21 VAL 21 3HG2 VAL 21 0.467 -8.695 -0.816
129 HG22 VAL 21 1HG2 VAL 21 1.920 -9.122 0.088
130 HG23 VAL 21 2HG2 VAL 21 0.476 -10.128 0.212
131 H PHE 22 H PHE 22 -0.554 -5.171 1.386
132 HA PHE 22 HA PHE 22 -0.774 -4.966 4.281
133 HB2 PHE 22 1HB PHE 22 -0.367 -2.419 2.750
134 HB3 PHE 22 2HB PHE 22 -0.166 -2.723 4.472
135 HD1 PHE 22 HD1 PHE 22 1.311 -3.467 1.153
136 HD2 PHE 22 HD2 PHE 22 1.933 -3.208 5.355
137 HE1 PHE 22 HE1 PHE 22 3.728 -3.773 0.810
138 HE2 PHE 22 HE2 PHE 22 4.351 -3.512 5.020
139 HZ PHE 22 HZ PHE 22 5.252 -3.795 2.745
140 H THR 23 H THR 23 -2.441 -3.072 4.746
141 HA THR 23 HA THR 23 -4.742 -3.622 3.005
142 HB THR 23 HB THR 23 -4.882 -2.395 5.754
143 HG1 THR 23 HG1 THR 23 -4.296 -4.284 6.492
144 HG21 THR 23 3HG2 THR 23 -6.853 -2.305 4.186
145 HG22 THR 23 1HG2 THR 23 -7.155 -3.111 5.725
146 HG23 THR 23 2HG2 THR 23 -6.901 -4.066 4.264
147 H GLN 24 H GLN 24 -3.487 -0.925 4.981
148 HA GLN 24 HA GLN 24 -4.869 0.979 3.274
149 HB2 GLN 24 1HB GLN 24 -3.518 1.079 5.921
150 HB3 GLN 24 2HB GLN 24 -3.563 2.565 4.982
151 HG2 GLN 24 1HG GLN 24 -5.430 2.188 6.655
152 HG3 GLN 24 2HG GLN 24 -5.894 2.660 5.021
153 HE21 GLN 24 1HE2 GLN 24 -5.216 -0.311 6.846
154 HE22 GLN 24 2HE2 GLN 24 -6.563 -1.199 6.228
155 H ASN 25 H ASN 25 -3.880 2.534 2.010
156 HA ASN 25 HA ASN 25 -1.565 1.847 0.647
157 HB2 ASN 25 1HB ASN 25 -3.036 3.365 -0.413
158 HB3 ASN 25 2HB ASN 25 -3.006 4.475 0.954
159 HD21 ASN 25 1HD2 ASN 25 -2.511 6.099 -0.627
160 HD22 ASN 25 2HD2 ASN 25 -0.883 6.300 -1.171
161 H SER 26 H SER 26 -1.964 4.294 3.202
162 HA SER 26 HA SER 26 0.559 5.306 3.374
163 HB2 SER 26 1HB SER 26 -1.157 6.170 4.808
164 HB3 SER 26 2HB SER 26 -1.353 4.612 5.611
165 HG SER 26 HG SER 26 0.991 6.213 5.686
166 H HIS 27 H HIS 27 -0.595 2.299 4.865
167 HA HIS 27 HA HIS 27 1.772 1.605 6.188
168 HB2 HIS 27 1HB HIS 27 -0.218 -0.327 4.988
169 HB3 HIS 27 2HB HIS 27 0.866 -0.622 6.344
170 HD1 HIS 27 HD1 HIS 27 -1.656 -1.266 7.338
171 HD2 HIS 27 HD2 HIS 27 -0.680 2.749 6.903
172 HE1 HIS 27 HE1 HIS 27 -3.259 -0.020 8.822
173 H LEU 28 H LEU 28 0.766 1.169 2.859
174 HA LEU 28 HA LEU 28 3.004 -0.535 2.207
175 HB2 LEU 28 1HB LEU 28 1.111 -1.000 0.938
176 HB3 LEU 28 2HB LEU 28 0.761 0.705 0.662
177 HG LEU 28 HG LEU 28 2.750 0.799 -0.841
178 HD11 LEU 28 1HD1 LEU 28 2.886 -2.057 -0.033
179 HD12 LEU 28 2HD1 LEU 28 4.183 -0.904 -0.346
180 HD13 LEU 28 3HD1 LEU 28 3.310 -1.635 -1.692
181 HD21 LEU 28 3HD2 LEU 28 1.000 0.650 -2.232
182 HD22 LEU 28 1HD2 LEU 28 0.250 -0.651 -1.307
183 HD23 LEU 28 2HD2 LEU 28 1.527 -1.017 -2.468
184 H THR 29 H THR 29 1.953 2.639 0.956
185 HA THR 29 HA THR 29 4.185 3.378 -0.417
186 HB THR 29 HB THR 29 2.218 4.786 -0.404
187 HG1 THR 29 HG1 THR 29 3.994 5.965 -0.953
188 HG21 THR 29 3HG2 THR 29 1.322 5.836 1.428
189 HG22 THR 29 1HG2 THR 29 2.868 5.922 2.272
190 HG23 THR 29 2HG2 THR 29 1.985 4.396 2.200
191 H ASN 30 H ASN 30 3.786 3.261 3.047
192 HA ASN 30 HA ASN 30 6.196 4.733 3.612
193 HB2 ASN 30 1HB ASN 30 4.163 3.265 5.249
194 HB3 ASN 30 2HB ASN 30 5.719 3.668 5.969
195 HD21 ASN 30 1HD2 ASN 30 2.699 4.649 5.910
196 HD22 ASN 30 2HD2 ASN 30 2.894 6.361 6.030
197 H HIS 31 H HIS 31 5.241 1.368 3.342
198 HA HIS 31 HA HIS 31 7.468 0.154 4.509
199 HB2 HIS 31 1HB HIS 31 5.704 -1.300 4.043
200 HB3 HIS 31 2HB HIS 31 5.514 -0.701 2.398
201 HD1 HIS 31 HD1 HIS 31 7.745 -2.931 4.465
202 HD2 HIS 31 HD2 HIS 31 6.951 -2.057 0.482
203 HE1 HIS 31 HE1 HIS 31 8.988 -4.666 3.136
204 H TRP 32 H TRP 32 6.941 1.279 1.196
205 HA TRP 32 HA TRP 32 9.171 0.271 -0.060
206 HB2 TRP 32 1HB TRP 32 7.514 2.717 -0.427
207 HB3 TRP 32 2HB TRP 32 9.051 2.642 -1.284
208 HD1 TRP 32 HD1 TRP 32 5.831 0.508 -0.915
209 HE1 TRP 32 HE1 TRP 32 5.418 -0.693 -3.154
210 HE3 TRP 32 HE3 TRP 32 10.011 2.029 -3.434
211 HZ2 TRP 32 HZ2 TRP 32 6.696 -0.960 -5.657
212 HZ3 TRP 32 HZ3 TRP 32 10.342 1.256 -5.747
213 HH2 TRP 32 HH2 TRP 32 8.717 -0.208 -6.833
214 H ARG 33 H ARG 33 9.051 2.537 2.487
215 HA ARG 33 HA ARG 33 11.297 4.110 2.059
216 HB2 ARG 33 1HB ARG 33 10.009 3.062 4.567
217 HB3 ARG 33 2HB ARG 33 11.444 4.077 4.636
218 HG2 ARG 33 1HG ARG 33 10.184 5.788 3.308
219 HG3 ARG 33 2HG ARG 33 8.743 4.792 3.527
220 HD2 ARG 33 1HD ARG 33 8.504 6.187 5.314
221 HD3 ARG 33 2HD ARG 33 9.483 4.927 6.064
222 HE ARG 33 HE ARG 33 11.210 6.421 6.249
223 HH11 ARG 33 1HH1 ARG 33 8.823 7.688 4.053
224 HH12 ARG 33 2HH1 ARG 33 9.564 9.250 3.942
225 HH21 ARG 33 1HH2 ARG 33 12.195 8.474 6.110
226 HH22 ARG 33 2HH2 ARG 33 11.483 9.695 5.112
227 H ILE 34 H ILE 34 11.107 1.000 3.791
228 HA ILE 34 HA ILE 34 13.841 0.749 4.332
229 HB ILE 34 HB ILE 34 13.433 -1.604 4.715
230 HG12 ILE 34 1HG1 ILE 34 10.601 -1.398 3.795
231 HG13 ILE 34 2HG1 ILE 34 11.854 -1.627 2.580
232 HG21 ILE 34 1HG2 ILE 34 11.765 -1.443 6.407
233 HG22 ILE 34 2HG2 ILE 34 12.583 0.117 6.324
234 HG23 ILE 34 3HG2 ILE 34 10.989 -0.083 5.596
235 HD11 ILE 34 3HD1 ILE 34 11.080 -3.443 4.832
236 HD12 ILE 34 1HD1 ILE 34 11.104 -3.774 3.100
237 HD13 ILE 34 2HD1 ILE 34 12.619 -3.603 3.986
238 H HIS 35 H HIS 35 12.272 0.709 1.372
239 HA HIS 35 HA HIS 35 14.287 -1.001 0.104
240 HB2 HIS 35 1HB HIS 35 11.650 0.105 -0.851
241 HB3 HIS 35 2HB HIS 35 12.803 -0.651 -1.946
242 HD1 HIS 35 HD1 HIS 35 13.663 -3.028 -0.161
243 HD2 HIS 35 HD2 HIS 35 9.730 -1.830 -0.757
244 HE1 HIS 35 HE1 HIS 35 12.262 -5.058 0.324
245 H THR 36 H THR 36 13.063 2.292 0.161
246 HA THR 36 HA THR 36 14.895 3.156 -1.915
247 HB THR 36 HB THR 36 13.970 5.434 -1.427
248 HG1 THR 36 HG1 THR 36 11.861 5.099 -0.118
249 HG21 THR 36 3HG2 THR 36 12.134 5.079 -2.741
250 HG22 THR 36 1HG2 THR 36 11.607 3.673 -1.818
251 HG23 THR 36 2HG2 THR 36 12.940 3.527 -2.963
252 H GLY 37 H GLY 37 16.887 2.612 -0.861
253 HA2 GLY 37 1HA GLY 37 18.459 4.502 0.098
254 HA3 GLY 37 2HA GLY 37 17.553 4.121 1.554
255 H GLU 38 H GLU 38 19.835 2.897 -0.812
256 HA GLU 38 HA GLU 38 20.222 0.320 0.114
257 HB2 GLU 38 1HB GLU 38 22.091 2.304 -1.154
258 HB3 GLU 38 2HB GLU 38 22.646 0.702 -0.692
259 HG2 GLU 38 1HG GLU 38 20.857 -0.267 -2.114
260 HG3 GLU 38 2HG GLU 38 20.468 1.364 -2.657
261 H LYS 39 H LYS 39 20.193 0.057 2.308
262 HA LYS 39 HA LYS 39 21.662 1.656 4.130
263 HB2 LYS 39 1HB LYS 39 19.986 0.603 5.259
264 HB3 LYS 39 2HB LYS 39 20.073 -0.840 4.256
265 HG2 LYS 39 1HG LYS 39 22.120 -1.513 5.455
266 HG3 LYS 39 2HG LYS 39 21.940 -0.102 6.501
267 HD2 LYS 39 1HD LYS 39 19.513 -1.124 6.826
268 HD3 LYS 39 2HD LYS 39 20.356 -2.615 6.399
269 HE2 LYS 39 1HE LYS 39 22.016 -2.109 8.183
270 HE3 LYS 39 2HE LYS 39 21.025 -0.730 8.656
271 HZ1 LYS 39 3HZ LYS 39 20.498 -3.595 8.980
272 HZ2 LYS 39 1HZ LYS 39 19.179 -2.556 8.773
273 HZ3 LYS 39 2HZ LYS 39 20.244 -2.323 10.066
274 HA PRO 40 HA PRO 40 24.791 -2.017 4.272
275 HB2 PRO 40 1HB PRO 40 24.514 -3.971 2.407
276 HB3 PRO 40 2HB PRO 40 23.707 -4.022 3.979
277 HG2 PRO 40 1HG PRO 40 22.617 -3.193 1.317
278 HG3 PRO 40 2HG PRO 40 21.864 -4.194 2.572
279 HD2 PRO 40 1HD PRO 40 21.260 -1.576 2.239
280 HD3 PRO 40 2HD PRO 40 21.234 -2.367 3.828
281 H SER 41 H SER 41 26.272 -3.219 2.336
282 HA SER 41 HA SER 41 27.544 -1.046 1.072
283 HB2 SER 41 1HB SER 41 27.803 -4.020 0.573
284 HB3 SER 41 2HB SER 41 28.890 -2.798 -0.085
285 HG SER 41 HG SER 41 29.251 -2.181 2.172
286 H GLY 42 H GLY 42 25.736 -3.767 -0.371
287 HA2 GLY 42 1HA GLY 42 23.978 -2.944 -2.013
288 HA3 GLY 42 2HA GLY 42 25.316 -2.079 -2.756
289 HA PRO 43 HA PRO 43 24.841 -6.616 -4.248
290 HB2 PRO 43 1HB PRO 43 23.305 -6.237 -6.454
291 HB3 PRO 43 2HB PRO 43 22.628 -6.610 -4.864
292 HG2 PRO 43 1HG PRO 43 22.883 -3.964 -6.241
293 HG3 PRO 43 2HG PRO 43 21.516 -4.620 -5.322
294 HD2 PRO 43 1HD PRO 43 23.258 -2.836 -4.267
295 HD3 PRO 43 2HD PRO 43 22.463 -4.087 -3.289
296 H SER 44 H SER 44 24.992 -7.082 -6.906
297 HA SER 44 HA SER 44 27.412 -5.606 -7.659
298 HB2 SER 44 1HB SER 44 27.357 -8.169 -7.458
299 HB3 SER 44 2HB SER 44 26.426 -8.144 -8.955
300 HG SER 44 HG SER 44 28.370 -6.651 -9.559
301 H SER 45 H SER 45 26.327 -3.768 -8.490
302 HA SER 45 HA SER 45 25.763 -3.908 -11.264
303 HB2 SER 45 1HB SER 45 23.447 -3.495 -11.356
304 HB3 SER 45 2HB SER 45 23.603 -4.770 -10.147
305 HG SER 45 HG SER 45 22.250 -3.150 -9.367
306 H GLY 46 H GLY 46 26.028 -1.945 -12.206
307 HA2 GLY 46 1HA GLY 46 26.308 0.336 -12.409
308 HA3 GLY 46 2HA GLY 46 25.563 0.520 -10.828
Start of MODEL 16
1 H1 GLY 1 H GLY 1 -1.847 -30.529 0.609
2 HA2 GLY 1 1HA GLY 1 -1.571 -28.145 0.075
3 HA3 GLY 1 2HA GLY 1 -1.635 -28.601 -1.620
4 H SER 2 H SER 2 -3.702 -29.683 -2.317
5 HA SER 2 HA SER 2 -5.911 -29.258 -2.775
6 HB2 SER 2 1HB SER 2 -7.405 -29.884 -0.871
7 HB3 SER 2 2HB SER 2 -6.113 -31.050 -1.159
8 HG SER 2 HG SER 2 -5.607 -30.742 0.847
9 H SER 3 H SER 3 -4.524 -26.866 -2.403
10 HA SER 3 HA SER 3 -6.572 -25.205 -1.087
11 HB2 SER 3 1HB SER 3 -4.378 -25.221 0.121
12 HB3 SER 3 2HB SER 3 -3.630 -24.534 -1.320
13 HG SER 3 HG SER 3 -5.582 -22.954 -0.929
14 H GLY 4 H GLY 4 -7.404 -23.534 -2.230
15 HA2 GLY 4 1HA GLY 4 -6.982 -23.485 -5.053
16 HA3 GLY 4 2HA GLY 4 -8.013 -22.396 -4.138
17 H SER 5 H SER 5 -6.305 -21.704 -6.338
18 HA SER 5 HA SER 5 -3.983 -20.384 -5.258
19 HB2 SER 5 1HB SER 5 -4.103 -21.331 -7.588
20 HB3 SER 5 2HB SER 5 -5.215 -20.025 -7.997
21 HG SER 5 HG SER 5 -3.600 -18.666 -8.049
22 H SER 6 H SER 6 -7.020 -19.285 -6.763
23 HA SER 6 HA SER 6 -6.552 -16.543 -6.104
24 HB2 SER 6 1HB SER 6 -7.901 -16.972 -8.026
25 HB3 SER 6 2HB SER 6 -8.982 -18.026 -7.115
26 HG SER 6 HG SER 6 -10.077 -16.181 -7.108
27 H GLY 7 H GLY 7 -9.041 -18.849 -4.984
28 HA2 GLY 7 1HA GLY 7 -10.149 -19.018 -2.982
29 HA3 GLY 7 2HA GLY 7 -8.717 -18.305 -2.253
30 H SER 8 H SER 8 -9.367 -16.718 -0.959
31 HA SER 8 HA SER 8 -11.739 -15.197 -1.448
32 HB2 SER 8 1HB SER 8 -10.760 -15.778 0.832
33 HB3 SER 8 2HB SER 8 -9.565 -14.516 0.535
34 HG SER 8 HG SER 8 -11.250 -13.020 0.391
35 H GLY 9 H GLY 9 -8.342 -14.146 -1.093
36 HA2 GLY 9 1HA GLY 9 -7.541 -12.863 -3.147
37 HA3 GLY 9 2HA GLY 9 -8.974 -11.883 -2.876
38 H GLU 10 H GLU 10 -6.167 -11.078 -2.895
39 HA GLU 10 HA GLU 10 -5.946 -10.102 -0.122
40 HB2 GLU 10 1HB GLU 10 -3.839 -10.915 -2.100
41 HB3 GLU 10 2HB GLU 10 -3.462 -9.783 -0.809
42 HG2 GLU 10 1HG GLU 10 -2.835 -11.989 -0.128
43 HG3 GLU 10 2HG GLU 10 -4.212 -11.460 0.837
44 H LYS 11 H LYS 11 -5.585 -7.944 0.220
45 HA LYS 11 HA LYS 11 -6.655 -6.034 -1.355
46 HB2 LYS 11 1HB LYS 11 -4.260 -5.789 0.466
47 HB3 LYS 11 2HB LYS 11 -5.072 -4.402 -0.247
48 HG2 LYS 11 1HG LYS 11 -5.999 -4.563 1.875
49 HG3 LYS 11 2HG LYS 11 -7.199 -5.335 0.836
50 HD2 LYS 11 1HD LYS 11 -6.742 -7.436 1.639
51 HD3 LYS 11 2HD LYS 11 -5.077 -7.028 2.063
52 HE2 LYS 11 1HE LYS 11 -6.161 -7.247 4.123
53 HE3 LYS 11 2HE LYS 11 -6.101 -5.507 3.848
54 HZ1 LYS 11 3HZ LYS 11 -8.295 -5.421 3.969
55 HZ2 LYS 11 1HZ LYS 11 -8.342 -7.073 4.331
56 HZ3 LYS 11 2HZ LYS 11 -8.462 -6.556 2.726
57 HA PRO 12 HA PRO 12 -4.177 -5.528 -4.953
58 HB2 PRO 12 1HB PRO 12 -4.790 -2.956 -5.568
59 HB3 PRO 12 2HB PRO 12 -5.919 -4.295 -5.804
60 HG2 PRO 12 1HG PRO 12 -5.776 -2.309 -3.569
61 HG3 PRO 12 2HG PRO 12 -7.199 -2.922 -4.431
62 HD2 PRO 12 1HD PRO 12 -6.462 -3.846 -1.995
63 HD3 PRO 12 2HD PRO 12 -7.257 -4.873 -3.206
64 H TYR 13 H TYR 13 -3.637 -3.819 -2.073
65 HA TYR 13 HA TYR 13 -1.437 -2.219 -3.048
66 HB2 TYR 13 1HB TYR 13 -2.540 -2.741 -0.288
67 HB3 TYR 13 2HB TYR 13 -1.114 -1.750 -0.573
68 HD1 TYR 13 HD1 TYR 13 -3.553 -1.528 -3.181
69 HD2 TYR 13 HD2 TYR 13 -2.503 0.009 0.645
70 HE1 TYR 13 HE1 TYR 13 -4.994 0.426 -3.577
71 HE2 TYR 13 HE2 TYR 13 -3.941 1.967 0.260
72 HH TYR 13 HH TYR 13 -5.096 3.122 -1.313
73 H LYS 14 H LYS 14 -0.022 -3.765 -3.912
74 HA LYS 14 HA LYS 14 1.371 -5.398 -1.892
75 HB2 LYS 14 1HB LYS 14 -0.001 -6.595 -3.746
76 HB3 LYS 14 2HB LYS 14 1.318 -6.119 -4.807
77 HG2 LYS 14 1HG LYS 14 2.006 -7.499 -2.272
78 HG3 LYS 14 2HG LYS 14 1.285 -8.451 -3.572
79 HD2 LYS 14 1HD LYS 14 3.112 -7.163 -5.007
80 HD3 LYS 14 2HD LYS 14 3.924 -7.092 -3.441
81 HE2 LYS 14 1HE LYS 14 3.075 -9.522 -4.994
82 HE3 LYS 14 2HE LYS 14 4.701 -9.059 -4.496
83 HZ1 LYS 14 3HZ LYS 14 3.168 -10.814 -3.184
84 HZ2 LYS 14 1HZ LYS 14 2.810 -9.397 -2.333
85 HZ3 LYS 14 2HZ LYS 14 4.412 -9.923 -2.463
86 H CYS 15 H CYS 15 3.568 -5.302 -1.833
87 HA CYS 15 HA CYS 15 4.807 -3.169 -3.379
88 HB2 CYS 15 1HB CYS 15 5.329 -3.049 -1.076
89 HB3 CYS 15 2HB CYS 15 5.669 -4.774 -0.981
90 H ASN 16 H ASN 16 5.459 -3.758 -5.354
91 HA ASN 16 HA ASN 16 6.178 -6.362 -6.130
92 HB2 ASN 16 1HB ASN 16 5.443 -4.672 -7.741
93 HB3 ASN 16 2HB ASN 16 6.886 -3.715 -7.416
94 HD21 ASN 16 1HD2 ASN 16 5.715 -6.750 -8.729
95 HD22 ASN 16 2HD2 ASN 16 7.071 -7.042 -9.759
96 H GLU 17 H GLU 17 8.013 -3.745 -4.746
97 HA GLU 17 HA GLU 17 10.599 -4.348 -5.431
98 HB2 GLU 17 1HB GLU 17 9.555 -2.545 -3.797
99 HB3 GLU 17 2HB GLU 17 10.035 -3.710 -2.571
100 HG2 GLU 17 1HG GLU 17 11.703 -1.923 -3.007
101 HG3 GLU 17 2HG GLU 17 12.320 -3.562 -3.207
102 H CYS 18 H CYS 18 8.885 -5.627 -2.575
103 HA CYS 18 HA CYS 18 10.700 -7.948 -2.653
104 HB2 CYS 18 1HB CYS 18 10.510 -8.109 -0.235
105 HB3 CYS 18 2HB CYS 18 11.070 -6.500 -0.679
106 H GLY 19 H GLY 19 7.423 -6.817 -1.962
107 HA2 GLY 19 1HA GLY 19 5.622 -8.191 -2.949
108 HA3 GLY 19 2HA GLY 19 6.492 -9.595 -2.349
109 H LYS 20 H LYS 20 6.028 -6.600 -0.567
110 HA LYS 20 HA LYS 20 4.762 -8.098 1.576
111 HB2 LYS 20 1HB LYS 20 6.593 -6.188 1.716
112 HB3 LYS 20 2HB LYS 20 5.177 -5.145 1.711
113 HG2 LYS 20 1HG LYS 20 5.414 -5.429 3.948
114 HG3 LYS 20 2HG LYS 20 4.389 -6.822 3.600
115 HD2 LYS 20 1HD LYS 20 6.744 -7.978 3.202
116 HD3 LYS 20 2HD LYS 20 7.274 -6.706 4.306
117 HE2 LYS 20 1HE LYS 20 6.745 -8.633 5.612
118 HE3 LYS 20 2HE LYS 20 5.479 -7.437 5.882
119 HZ1 LYS 20 3HZ LYS 20 4.779 -9.836 5.474
120 HZ2 LYS 20 1HZ LYS 20 5.173 -9.560 3.852
121 HZ3 LYS 20 2HZ LYS 20 3.972 -8.634 4.600
122 H VAL 21 H VAL 21 2.663 -8.002 2.133
123 HA VAL 21 HA VAL 21 0.912 -6.310 0.485
124 HB VAL 21 HB VAL 21 0.231 -8.789 2.073
125 HG11 VAL 21 1HG1 VAL 21 -1.557 -6.979 1.774
126 HG12 VAL 21 2HG1 VAL 21 -1.536 -7.426 0.067
127 HG13 VAL 21 3HG1 VAL 21 -1.965 -8.625 1.289
128 HG21 VAL 21 3HG2 VAL 21 -0.117 -9.794 -0.177
129 HG22 VAL 21 1HG2 VAL 21 0.578 -8.337 -0.888
130 HG23 VAL 21 2HG2 VAL 21 1.561 -9.365 0.155
131 H PHE 22 H PHE 22 -0.630 -4.995 1.402
132 HA PHE 22 HA PHE 22 -0.767 -4.857 4.324
133 HB2 PHE 22 1HB PHE 22 -0.437 -2.366 2.656
134 HB3 PHE 22 2HB PHE 22 -0.362 -2.514 4.408
135 HD1 PHE 22 HD1 PHE 22 1.381 -3.516 1.290
136 HD2 PHE 22 HD2 PHE 22 1.675 -2.839 5.482
137 HE1 PHE 22 HE1 PHE 22 3.823 -3.780 1.158
138 HE2 PHE 22 HE2 PHE 22 4.118 -3.101 5.356
139 HZ PHE 22 HZ PHE 22 5.196 -3.571 3.192
140 H THR 23 H THR 23 -2.560 -3.375 5.042
141 HA THR 23 HA THR 23 -4.915 -3.951 3.438
142 HB THR 23 HB THR 23 -4.945 -4.405 5.870
143 HG1 THR 23 HG1 THR 23 -7.016 -3.813 5.989
144 HG21 THR 23 3HG2 THR 23 -5.286 -1.558 6.555
145 HG22 THR 23 1HG2 THR 23 -3.639 -2.053 6.168
146 HG23 THR 23 2HG2 THR 23 -4.520 -2.860 7.465
147 H GLN 24 H GLN 24 -3.074 -1.182 4.577
148 HA GLN 24 HA GLN 24 -4.791 0.555 2.929
149 HB2 GLN 24 1HB GLN 24 -3.427 1.108 5.557
150 HB3 GLN 24 2HB GLN 24 -3.964 2.405 4.497
151 HG2 GLN 24 1HG GLN 24 -6.234 1.052 4.599
152 HG3 GLN 24 2HG GLN 24 -5.547 0.504 6.127
153 HE21 GLN 24 1HE2 GLN 24 -7.348 1.609 7.102
154 HE22 GLN 24 2HE2 GLN 24 -7.266 3.313 7.369
155 H ASN 25 H ASN 25 -3.605 2.598 2.235
156 HA ASN 25 HA ASN 25 -1.302 1.830 0.754
157 HB2 ASN 25 1HB ASN 25 -2.692 3.428 -0.286
158 HB3 ASN 25 2HB ASN 25 -2.743 4.444 1.152
159 HD21 ASN 25 1HD2 ASN 25 -0.290 3.038 -0.998
160 HD22 ASN 25 2HD2 ASN 25 0.643 4.484 -1.154
161 H SER 26 H SER 26 -1.729 4.328 3.269
162 HA SER 26 HA SER 26 0.769 5.225 3.653
163 HB2 SER 26 1HB SER 26 -1.188 5.876 5.037
164 HB3 SER 26 2HB SER 26 -1.036 4.360 5.926
165 HG SER 26 HG SER 26 0.663 5.117 6.954
166 H HIS 27 H HIS 27 -0.402 2.049 4.581
167 HA HIS 27 HA HIS 27 1.906 1.293 6.067
168 HB2 HIS 27 1HB HIS 27 -0.161 -0.459 4.720
169 HB3 HIS 27 2HB HIS 27 0.991 -0.979 5.946
170 HD1 HIS 27 HD1 HIS 27 -1.114 -1.700 7.374
171 HD2 HIS 27 HD2 HIS 27 -0.734 2.382 6.699
172 HE1 HIS 27 HE1 HIS 27 -2.656 -0.599 9.028
173 H LEU 28 H LEU 28 0.838 0.698 2.735
174 HA LEU 28 HA LEU 28 3.138 -0.836 2.034
175 HB2 LEU 28 1HB LEU 28 1.271 -1.273 0.724
176 HB3 LEU 28 2HB LEU 28 0.898 0.437 0.515
177 HG LEU 28 HG LEU 28 2.950 0.592 -0.940
178 HD11 LEU 28 1HD1 LEU 28 4.248 -1.173 -1.385
179 HD12 LEU 28 2HD1 LEU 28 2.876 -2.270 -1.523
180 HD13 LEU 28 3HD1 LEU 28 3.534 -1.879 0.065
181 HD21 LEU 28 3HD2 LEU 28 1.713 0.148 -2.800
182 HD22 LEU 28 1HD2 LEU 28 0.426 0.112 -1.595
183 HD23 LEU 28 2HD2 LEU 28 1.127 -1.396 -2.181
184 H THR 29 H THR 29 2.110 2.480 1.230
185 HA THR 29 HA THR 29 4.393 3.229 -0.188
186 HB THR 29 HB THR 29 2.263 4.533 -0.106
187 HG1 THR 29 HG1 THR 29 4.820 5.517 0.009
188 HG21 THR 29 3HG2 THR 29 1.676 5.882 1.702
189 HG22 THR 29 1HG2 THR 29 3.286 5.793 2.416
190 HG23 THR 29 2HG2 THR 29 2.216 4.393 2.477
191 H ASN 30 H ASN 30 3.706 3.318 3.271
192 HA ASN 30 HA ASN 30 6.063 4.741 3.992
193 HB2 ASN 30 1HB ASN 30 4.109 4.688 5.462
194 HB3 ASN 30 2HB ASN 30 4.280 2.945 5.651
195 HD21 ASN 30 1HD2 ASN 30 4.771 5.754 7.163
196 HD22 ASN 30 2HD2 ASN 30 6.104 5.336 8.180
197 H HIS 31 H HIS 31 5.406 1.466 3.191
198 HA HIS 31 HA HIS 31 7.634 0.316 4.581
199 HB2 HIS 31 1HB HIS 31 5.926 -1.223 4.164
200 HB3 HIS 31 2HB HIS 31 5.698 -0.668 2.508
201 HD1 HIS 31 HD1 HIS 31 7.847 -2.904 4.601
202 HD2 HIS 31 HD2 HIS 31 7.381 -1.841 0.612
203 HE1 HIS 31 HE1 HIS 31 9.210 -4.568 3.299
204 H TRP 32 H TRP 32 6.963 0.934 1.133
205 HA TRP 32 HA TRP 32 9.240 0.152 -0.069
206 HB2 TRP 32 1HB TRP 32 7.431 2.470 -0.527
207 HB3 TRP 32 2HB TRP 32 8.959 2.452 -1.403
208 HD1 TRP 32 HD1 TRP 32 5.956 0.048 -0.846
209 HE1 TRP 32 HE1 TRP 32 5.571 -1.248 -3.036
210 HE3 TRP 32 HE3 TRP 32 9.838 1.923 -3.594
211 HZ2 TRP 32 HZ2 TRP 32 6.755 -1.450 -5.590
212 HZ3 TRP 32 HZ3 TRP 32 10.143 1.126 -5.902
213 HH2 TRP 32 HH2 TRP 32 8.633 -0.526 -6.877
214 H ARG 33 H ARG 33 8.951 2.748 2.206
215 HA ARG 33 HA ARG 33 11.148 4.315 1.677
216 HB2 ARG 33 1HB ARG 33 9.975 3.443 4.316
217 HB3 ARG 33 2HB ARG 33 11.262 4.635 4.194
218 HG2 ARG 33 1HG ARG 33 9.759 5.986 2.724
219 HG3 ARG 33 2HG ARG 33 8.469 4.843 3.102
220 HD2 ARG 33 1HD ARG 33 9.133 5.362 5.574
221 HD3 ARG 33 2HD ARG 33 9.839 6.818 4.874
222 HE ARG 33 HE ARG 33 7.316 6.749 3.855
223 HH11 ARG 33 1HH1 ARG 33 8.656 6.659 7.067
224 HH12 ARG 33 2HH1 ARG 33 7.293 7.437 7.799
225 HH21 ARG 33 1HH2 ARG 33 5.515 7.775 4.807
226 HH22 ARG 33 2HH2 ARG 33 5.506 8.071 6.512
227 H ILE 34 H ILE 34 11.057 1.310 3.576
228 HA ILE 34 HA ILE 34 13.777 1.239 4.247
229 HB ILE 34 HB ILE 34 13.476 -1.102 4.748
230 HG12 ILE 34 1HG1 ILE 34 10.691 -1.124 3.676
231 HG13 ILE 34 2HG1 ILE 34 12.019 -1.335 2.540
232 HG21 ILE 34 1HG2 ILE 34 11.139 -0.859 5.966
233 HG22 ILE 34 2HG2 ILE 34 12.563 0.032 6.501
234 HG23 ILE 34 3HG2 ILE 34 11.349 0.828 5.499
235 HD11 ILE 34 3HD1 ILE 34 10.848 -3.221 4.351
236 HD12 ILE 34 1HD1 ILE 34 12.014 -3.484 3.054
237 HD13 ILE 34 2HD1 ILE 34 12.575 -3.052 4.669
238 H HIS 35 H HIS 35 12.175 0.624 1.274
239 HA HIS 35 HA HIS 35 14.350 -0.946 0.165
240 HB2 HIS 35 1HB HIS 35 11.728 0.050 -0.935
241 HB3 HIS 35 2HB HIS 35 12.941 -0.702 -1.967
242 HD1 HIS 35 HD1 HIS 35 13.775 -2.911 0.158
243 HD2 HIS 35 HD2 HIS 35 9.909 -2.023 -1.076
244 HE1 HIS 35 HE1 HIS 35 12.433 -4.991 0.604
245 H THR 36 H THR 36 13.009 2.306 -0.115
246 HA THR 36 HA THR 36 15.060 3.068 -2.039
247 HB THR 36 HB THR 36 13.927 5.251 -2.098
248 HG1 THR 36 HG1 THR 36 12.607 4.151 0.105
249 HG21 THR 36 3HG2 THR 36 12.563 4.388 -3.634
250 HG22 THR 36 1HG2 THR 36 11.521 3.712 -2.384
251 HG23 THR 36 2HG2 THR 36 12.897 2.785 -2.981
252 H GLY 37 H GLY 37 17.001 3.190 -1.001
253 HA2 GLY 37 1HA GLY 37 17.466 5.475 0.655
254 HA3 GLY 37 2HA GLY 37 17.550 3.981 1.575
255 H GLU 38 H GLU 38 18.921 2.231 0.360
256 HA GLU 38 HA GLU 38 21.145 1.673 0.104
257 HB2 GLU 38 1HB GLU 38 20.234 3.196 -2.286
258 HB3 GLU 38 2HB GLU 38 21.942 2.792 -2.180
259 HG2 GLU 38 1HG GLU 38 21.574 0.554 -2.407
260 HG3 GLU 38 2HG GLU 38 19.962 0.634 -1.700
261 H LYS 39 H LYS 39 20.722 4.070 1.743
262 HA LYS 39 HA LYS 39 22.591 6.081 1.103
263 HB2 LYS 39 1HB LYS 39 21.187 6.851 2.724
264 HB3 LYS 39 2HB LYS 39 21.042 5.278 3.496
265 HG2 LYS 39 1HG LYS 39 22.141 6.811 4.985
266 HG3 LYS 39 2HG LYS 39 23.288 5.574 4.464
267 HD2 LYS 39 1HD LYS 39 24.553 7.483 4.229
268 HD3 LYS 39 2HD LYS 39 23.873 7.324 2.607
269 HE2 LYS 39 1HE LYS 39 22.658 9.016 4.785
270 HE3 LYS 39 2HE LYS 39 23.776 9.634 3.571
271 HZ1 LYS 39 3HZ LYS 39 22.062 8.547 1.951
272 HZ2 LYS 39 1HZ LYS 39 21.780 10.087 2.594
273 HZ3 LYS 39 2HZ LYS 39 21.002 8.739 3.256
274 HA PRO 40 HA PRO 40 25.641 3.809 4.077
275 HB2 PRO 40 1HB PRO 40 24.949 1.323 4.920
276 HB3 PRO 40 2HB PRO 40 24.499 2.792 5.793
277 HG2 PRO 40 1HG PRO 40 22.871 1.138 3.903
278 HG3 PRO 40 2HG PRO 40 22.395 1.865 5.449
279 HD2 PRO 40 1HD PRO 40 21.759 2.973 3.061
280 HD3 PRO 40 2HD PRO 40 22.069 3.946 4.514
281 H SER 41 H SER 41 23.812 1.382 2.206
282 HA SER 41 HA SER 41 26.352 0.498 1.011
283 HB2 SER 41 1HB SER 41 24.788 -1.137 2.281
284 HB3 SER 41 2HB SER 41 23.775 -1.045 0.840
285 HG SER 41 HG SER 41 25.568 -2.727 1.044
286 H GLY 42 H GLY 42 26.562 1.928 -0.676
287 HA2 GLY 42 1HA GLY 42 24.454 1.761 -2.739
288 HA3 GLY 42 2HA GLY 42 25.279 3.269 -2.374
289 HA PRO 43 HA PRO 43 28.553 0.386 -4.479
290 HB2 PRO 43 1HB PRO 43 27.594 -1.881 -5.625
291 HB3 PRO 43 2HB PRO 43 28.166 -1.817 -3.954
292 HG2 PRO 43 1HG PRO 43 25.364 -1.712 -5.001
293 HG3 PRO 43 2HG PRO 43 26.006 -2.607 -3.612
294 HD2 PRO 43 1HD PRO 43 24.669 -0.268 -3.345
295 HD3 PRO 43 2HD PRO 43 25.972 -0.755 -2.242
296 H SER 44 H SER 44 25.285 0.465 -5.813
297 HA SER 44 HA SER 44 26.410 1.100 -8.457
298 HB2 SER 44 1HB SER 44 24.291 0.402 -9.407
299 HB3 SER 44 2HB SER 44 24.879 -0.867 -8.333
300 HG SER 44 HG SER 44 23.451 -0.072 -6.737
301 H SER 45 H SER 45 24.994 2.624 -9.764
302 HA SER 45 HA SER 45 23.879 4.747 -8.059
303 HB2 SER 45 1HB SER 45 26.040 5.564 -8.656
304 HB3 SER 45 2HB SER 45 25.849 5.044 -10.330
305 HG SER 45 HG SER 45 23.962 6.829 -9.331
306 H GLY 46 H GLY 46 21.987 5.587 -8.728
307 HA2 GLY 46 1HA GLY 46 20.805 6.289 -10.897
308 HA3 GLY 46 2HA GLY 46 20.921 4.579 -11.283
Start of MODEL 17
1 H1 GLY 1 H GLY 1 -7.950 -18.522 -8.689
2 HA2 GLY 1 1HA GLY 1 -10.333 -19.572 -7.440
3 HA3 GLY 1 2HA GLY 1 -8.748 -19.413 -6.699
4 H SER 2 H SER 2 -10.716 -18.817 -5.080
5 HA SER 2 HA SER 2 -10.653 -15.882 -4.940
6 HB2 SER 2 1HB SER 2 -12.960 -15.788 -4.233
7 HB3 SER 2 2HB SER 2 -12.887 -16.678 -5.754
8 HG SER 2 HG SER 2 -12.854 -18.616 -4.398
9 H SER 3 H SER 3 -8.878 -17.571 -3.639
10 HA SER 3 HA SER 3 -9.674 -18.288 -1.026
11 HB2 SER 3 1HB SER 3 -7.070 -17.945 -2.440
12 HB3 SER 3 2HB SER 3 -7.049 -17.999 -0.678
13 HG SER 3 HG SER 3 -7.303 -20.068 -0.819
14 H GLY 4 H GLY 4 -7.661 -15.541 -2.108
15 HA2 GLY 4 1HA GLY 4 -8.268 -14.183 0.423
16 HA3 GLY 4 2HA GLY 4 -6.974 -13.758 -0.686
17 H SER 5 H SER 5 -10.439 -14.270 -1.278
18 HA SER 5 HA SER 5 -10.572 -11.494 -2.263
19 HB2 SER 5 1HB SER 5 -10.786 -13.535 -3.915
20 HB3 SER 5 2HB SER 5 -12.432 -13.607 -3.286
21 HG SER 5 HG SER 5 -12.762 -11.505 -3.990
22 H SER 6 H SER 6 -11.253 -10.775 -0.193
23 HA SER 6 HA SER 6 -13.878 -11.734 0.702
24 HB2 SER 6 1HB SER 6 -11.723 -10.130 2.083
25 HB3 SER 6 2HB SER 6 -13.333 -10.352 2.767
26 HG SER 6 HG SER 6 -12.663 -12.736 2.179
27 H GLY 7 H GLY 7 -15.520 -10.198 1.300
28 HA2 GLY 7 1HA GLY 7 -15.566 -7.929 -0.533
29 HA3 GLY 7 2HA GLY 7 -16.937 -8.578 0.354
30 H SER 8 H SER 8 -16.780 -5.939 0.326
31 HA SER 8 HA SER 8 -16.663 -4.058 1.602
32 HB2 SER 8 1HB SER 8 -16.793 -6.221 3.690
33 HB3 SER 8 2HB SER 8 -16.690 -4.521 4.147
34 HG SER 8 HG SER 8 -18.798 -5.940 3.114
35 H GLY 9 H GLY 9 -14.232 -4.867 0.518
36 HA2 GLY 9 1HA GLY 9 -12.375 -3.276 1.719
37 HA3 GLY 9 2HA GLY 9 -12.178 -4.820 2.535
38 H GLU 10 H GLU 10 -10.650 -3.098 0.426
39 HA GLU 10 HA GLU 10 -9.788 -5.421 -1.133
40 HB2 GLU 10 1HB GLU 10 -10.353 -2.717 -2.362
41 HB3 GLU 10 2HB GLU 10 -9.722 -4.127 -3.201
42 HG2 GLU 10 1HG GLU 10 -11.859 -5.308 -2.538
43 HG3 GLU 10 2HG GLU 10 -12.467 -3.724 -2.058
44 H LYS 11 H LYS 11 -7.718 -5.672 -0.643
45 HA LYS 11 HA LYS 11 -6.039 -3.268 -0.350
46 HB2 LYS 11 1HB LYS 11 -4.664 -4.467 1.214
47 HB3 LYS 11 2HB LYS 11 -6.339 -4.608 1.733
48 HG2 LYS 11 1HG LYS 11 -6.215 -6.838 0.323
49 HG3 LYS 11 2HG LYS 11 -4.494 -6.678 0.679
50 HD2 LYS 11 1HD LYS 11 -4.806 -6.923 2.952
51 HD3 LYS 11 2HD LYS 11 -6.482 -6.371 2.886
52 HE2 LYS 11 1HE LYS 11 -6.677 -8.657 3.277
53 HE3 LYS 11 2HE LYS 11 -6.912 -8.517 1.535
54 HZ1 LYS 11 3HZ LYS 11 -5.414 -10.339 2.136
55 HZ2 LYS 11 1HZ LYS 11 -4.349 -9.236 2.851
56 HZ3 LYS 11 2HZ LYS 11 -4.635 -9.176 1.185
57 HA PRO 12 HA PRO 12 -4.590 -5.823 -4.005
58 HB2 PRO 12 1HB PRO 12 -4.663 -3.792 -5.805
59 HB3 PRO 12 2HB PRO 12 -6.053 -4.832 -5.474
60 HG2 PRO 12 1HG PRO 12 -5.447 -2.092 -4.432
61 HG3 PRO 12 2HG PRO 12 -6.986 -2.752 -5.017
62 HD2 PRO 12 1HD PRO 12 -6.405 -2.526 -2.382
63 HD3 PRO 12 2HD PRO 12 -7.425 -3.829 -3.027
64 H TYR 13 H TYR 13 -3.553 -3.343 -2.060
65 HA TYR 13 HA TYR 13 -1.241 -2.483 -3.503
66 HB2 TYR 13 1HB TYR 13 -1.381 -2.311 -0.524
67 HB3 TYR 13 2HB TYR 13 -0.785 -1.132 -1.687
68 HD1 TYR 13 HD2 TYR 13 -3.207 -1.101 -3.509
69 HD2 TYR 13 HD1 TYR 13 -2.848 -0.945 0.728
70 HE1 TYR 13 HE2 TYR 13 -5.343 0.112 -3.379
71 HE2 TYR 13 HE1 TYR 13 -4.984 0.267 0.870
72 HH TYR 13 HH TYR 13 -7.188 0.396 -1.538
73 H LYS 14 H LYS 14 0.356 -3.835 -3.981
74 HA LYS 14 HA LYS 14 1.495 -5.468 -1.834
75 HB2 LYS 14 1HB LYS 14 0.094 -7.020 -3.034
76 HB3 LYS 14 2HB LYS 14 0.739 -6.479 -4.578
77 HG2 LYS 14 1HG LYS 14 2.920 -7.391 -4.006
78 HG3 LYS 14 2HG LYS 14 2.303 -7.902 -2.433
79 HD2 LYS 14 1HD LYS 14 0.700 -9.380 -3.540
80 HD3 LYS 14 2HD LYS 14 1.303 -8.860 -5.116
81 HE2 LYS 14 1HE LYS 14 3.372 -9.912 -4.793
82 HE3 LYS 14 2HE LYS 14 3.123 -10.063 -3.054
83 HZ1 LYS 14 3HZ LYS 14 1.470 -11.486 -5.063
84 HZ2 LYS 14 1HZ LYS 14 1.515 -11.748 -3.392
85 HZ3 LYS 14 2HZ LYS 14 2.848 -12.160 -4.349
86 H CYS 15 H CYS 15 3.467 -4.629 -1.619
87 HA CYS 15 HA CYS 15 4.903 -3.158 -3.453
88 HB2 CYS 15 1HB CYS 15 5.567 -3.187 -1.144
89 HB3 CYS 15 2HB CYS 15 5.887 -4.917 -1.202
90 H ASN 16 H ASN 16 6.491 -3.586 -4.963
91 HA ASN 16 HA ASN 16 6.507 -6.336 -5.984
92 HB2 ASN 16 1HB ASN 16 7.393 -3.785 -7.351
93 HB3 ASN 16 2HB ASN 16 7.266 -5.375 -8.097
94 HD21 ASN 16 1HD2 ASN 16 5.953 -3.675 -9.449
95 HD22 ASN 16 2HD2 ASN 16 4.255 -3.681 -9.130
96 H GLU 17 H GLU 17 8.514 -3.920 -4.553
97 HA GLU 17 HA GLU 17 11.046 -4.705 -5.406
98 HB2 GLU 17 1HB GLU 17 10.230 -2.736 -3.849
99 HB3 GLU 17 2HB GLU 17 10.635 -3.869 -2.567
100 HG2 GLU 17 1HG GLU 17 12.485 -2.809 -4.689
101 HG3 GLU 17 2HG GLU 17 12.498 -2.413 -2.971
102 H CYS 18 H CYS 18 9.099 -5.895 -2.692
103 HA CYS 18 HA CYS 18 10.907 -8.217 -2.528
104 HB2 CYS 18 1HB CYS 18 10.410 -8.344 -0.124
105 HB3 CYS 18 2HB CYS 18 11.157 -6.806 -0.545
106 H GLY 19 H GLY 19 7.593 -7.050 -2.036
107 HA2 GLY 19 1HA GLY 19 5.827 -8.353 -3.156
108 HA3 GLY 19 2HA GLY 19 6.661 -9.797 -2.602
109 H LYS 20 H LYS 20 5.945 -6.833 -0.801
110 HA LYS 20 HA LYS 20 4.637 -8.463 1.242
111 HB2 LYS 20 1HB LYS 20 6.476 -6.585 1.584
112 HB3 LYS 20 2HB LYS 20 5.071 -5.527 1.565
113 HG2 LYS 20 1HG LYS 20 5.188 -5.939 3.791
114 HG3 LYS 20 2HG LYS 20 4.168 -7.298 3.312
115 HD2 LYS 20 1HD LYS 20 7.122 -7.660 3.265
116 HD3 LYS 20 2HD LYS 20 6.306 -7.637 4.830
117 HE2 LYS 20 1HE LYS 20 6.181 -9.869 4.358
118 HE3 LYS 20 2HE LYS 20 4.680 -9.322 3.614
119 HZ1 LYS 20 3HZ LYS 20 6.454 -9.016 1.615
120 HZ2 LYS 20 1HZ LYS 20 5.460 -10.370 1.819
121 HZ3 LYS 20 2HZ LYS 20 7.054 -10.398 2.384
122 H VAL 21 H VAL 21 2.609 -7.829 2.165
123 HA VAL 21 HA VAL 21 0.930 -6.213 0.359
124 HB VAL 21 HB VAL 21 0.144 -8.760 1.781
125 HG11 VAL 21 1HG1 VAL 21 -1.439 -6.585 0.563
126 HG12 VAL 21 2HG1 VAL 21 -1.934 -8.232 0.169
127 HG13 VAL 21 3HG1 VAL 21 -1.859 -7.712 1.853
128 HG21 VAL 21 3HG2 VAL 21 1.530 -8.915 -0.337
129 HG22 VAL 21 1HG2 VAL 21 -0.017 -9.763 -0.350
130 HG23 VAL 21 2HG2 VAL 21 0.147 -8.214 -1.178
131 H PHE 22 H PHE 22 -0.405 -4.751 1.288
132 HA PHE 22 HA PHE 22 -0.696 -4.792 4.211
133 HB2 PHE 22 1HB PHE 22 -0.200 -2.236 2.693
134 HB3 PHE 22 2HB PHE 22 -0.146 -2.498 4.433
135 HD1 PHE 22 HD1 PHE 22 1.604 -3.131 1.253
136 HD2 PHE 22 HD2 PHE 22 1.823 -3.259 5.502
137 HE1 PHE 22 HE1 PHE 22 4.031 -3.515 1.113
138 HE2 PHE 22 HE2 PHE 22 4.250 -3.642 5.369
139 HZ PHE 22 HZ PHE 22 5.357 -3.769 3.173
140 H THR 23 H THR 23 -2.537 -3.643 5.017
141 HA THR 23 HA THR 23 -4.798 -3.818 3.228
142 HB THR 23 HB THR 23 -4.703 -2.985 6.134
143 HG1 THR 23 HG1 THR 23 -4.749 -5.061 6.567
144 HG21 THR 23 3HG2 THR 23 -7.151 -3.699 5.999
145 HG22 THR 23 1HG2 THR 23 -6.969 -3.588 4.249
146 HG23 THR 23 2HG2 THR 23 -6.727 -2.158 5.253
147 H GLN 24 H GLN 24 -3.307 -1.267 5.216
148 HA GLN 24 HA GLN 24 -4.910 0.753 3.862
149 HB2 GLN 24 1HB GLN 24 -3.028 0.823 6.210
150 HB3 GLN 24 2HB GLN 24 -3.630 2.297 5.465
151 HG2 GLN 24 1HG GLN 24 -5.022 1.857 7.314
152 HG3 GLN 24 2HG GLN 24 -5.951 1.436 5.876
153 HE21 GLN 24 1HE2 GLN 24 -7.285 -0.074 6.685
154 HE22 GLN 24 2HE2 GLN 24 -6.767 -1.559 7.399
155 H ASN 25 H ASN 25 -3.995 2.549 2.772
156 HA ASN 25 HA ASN 25 -1.859 1.895 1.043
157 HB2 ASN 25 1HB ASN 25 -3.375 3.390 0.107
158 HB3 ASN 25 2HB ASN 25 -3.461 4.373 1.566
159 HD21 ASN 25 1HD2 ASN 25 -2.371 6.202 1.574
160 HD22 ASN 25 2HD2 ASN 25 -1.085 6.620 0.498
161 H SER 26 H SER 26 -2.081 4.102 3.815
162 HA SER 26 HA SER 26 0.410 5.257 3.745
163 HB2 SER 26 1HB SER 26 -1.277 5.909 5.380
164 HB3 SER 26 2HB SER 26 -1.136 4.347 6.185
165 HG SER 26 HG SER 26 0.102 5.865 7.284
166 H HIS 27 H HIS 27 -0.462 2.019 4.750
167 HA HIS 27 HA HIS 27 2.001 1.358 5.990
168 HB2 HIS 27 1HB HIS 27 -0.006 -0.499 4.697
169 HB3 HIS 27 2HB HIS 27 1.235 -0.953 5.861
170 HD1 HIS 27 HD1 HIS 27 -0.839 -1.879 7.274
171 HD2 HIS 27 HD2 HIS 27 -0.621 2.248 6.852
172 HE1 HIS 27 HE1 HIS 27 -2.367 -0.941 9.038
173 H LEU 28 H LEU 28 0.818 1.176 2.688
174 HA LEU 28 HA LEU 28 3.048 -0.335 1.710
175 HB2 LEU 28 1HB LEU 28 1.034 -0.541 0.502
176 HB3 LEU 28 2HB LEU 28 0.834 1.206 0.389
177 HG LEU 28 HG LEU 28 2.887 1.209 -1.097
178 HD11 LEU 28 1HD1 LEU 28 2.476 -1.721 -0.734
179 HD12 LEU 28 2HD1 LEU 28 3.973 -0.793 -0.801
180 HD13 LEU 28 3HD1 LEU 28 3.067 -1.112 -2.280
181 HD21 LEU 28 3HD2 LEU 28 1.418 1.352 -2.757
182 HD22 LEU 28 1HD2 LEU 28 0.187 0.752 -1.646
183 HD23 LEU 28 2HD2 LEU 28 1.072 -0.376 -2.673
184 H THR 29 H THR 29 1.996 2.972 0.882
185 HA THR 29 HA THR 29 4.279 3.849 -0.349
186 HB THR 29 HB THR 29 2.285 5.219 -0.318
187 HG1 THR 29 HG1 THR 29 3.433 7.235 0.608
188 HG21 THR 29 3HG2 THR 29 2.151 4.642 2.358
189 HG22 THR 29 1HG2 THR 29 1.180 5.859 1.531
190 HG23 THR 29 2HG2 THR 29 2.662 6.330 2.364
191 H ASN 30 H ASN 30 3.759 3.313 3.038
192 HA ASN 30 HA ASN 30 6.105 4.800 3.852
193 HB2 ASN 30 1HB ASN 30 4.130 4.694 5.320
194 HB3 ASN 30 2HB ASN 30 4.315 2.947 5.442
195 HD21 ASN 30 1HD2 ASN 30 4.416 5.136 7.453
196 HD22 ASN 30 2HD2 ASN 30 5.915 4.909 8.283
197 H HIS 31 H HIS 31 5.200 1.485 3.198
198 HA HIS 31 HA HIS 31 7.397 0.198 4.392
199 HB2 HIS 31 1HB HIS 31 5.563 -1.165 3.779
200 HB3 HIS 31 2HB HIS 31 5.567 -0.565 2.123
201 HD1 HIS 31 HD1 HIS 31 7.438 -2.892 4.412
202 HD2 HIS 31 HD2 HIS 31 7.237 -1.912 0.380
203 HE1 HIS 31 HE1 HIS 31 8.792 -4.648 3.225
204 H TRP 32 H TRP 32 6.873 1.081 0.976
205 HA TRP 32 HA TRP 32 9.141 0.294 -0.219
206 HB2 TRP 32 1HB TRP 32 7.498 2.761 -0.522
207 HB3 TRP 32 2HB TRP 32 9.037 2.692 -1.375
208 HD1 TRP 32 HD1 TRP 32 5.828 0.526 -1.056
209 HE1 TRP 32 HE1 TRP 32 5.398 -0.585 -3.338
210 HE3 TRP 32 HE3 TRP 32 9.950 2.210 -3.568
211 HZ2 TRP 32 HZ2 TRP 32 6.643 -0.729 -5.867
212 HZ3 TRP 32 HZ3 TRP 32 10.256 1.539 -5.915
213 HH2 TRP 32 HH2 TRP 32 8.636 0.100 -7.039
214 H ARG 33 H ARG 33 8.908 2.773 2.209
215 HA ARG 33 HA ARG 33 11.203 4.228 1.896
216 HB2 ARG 33 1HB ARG 33 9.925 3.190 4.425
217 HB3 ARG 33 2HB ARG 33 11.263 4.331 4.430
218 HG2 ARG 33 1HG ARG 33 9.813 5.824 2.988
219 HG3 ARG 33 2HG ARG 33 8.480 4.738 3.384
220 HD2 ARG 33 1HD ARG 33 8.385 6.532 4.932
221 HD3 ARG 33 2HD ARG 33 9.015 5.137 5.807
222 HE ARG 33 HE ARG 33 10.934 6.309 6.175
223 HH11 ARG 33 1HH1 ARG 33 9.273 7.726 3.464
224 HH12 ARG 33 2HH1 ARG 33 10.381 9.048 3.309
225 HH21 ARG 33 1HH2 ARG 33 12.400 8.045 5.981
226 HH22 ARG 33 2HH2 ARG 33 12.160 9.228 4.741
227 H ILE 34 H ILE 34 10.937 1.158 3.690
228 HA ILE 34 HA ILE 34 13.613 0.864 4.364
229 HB ILE 34 HB ILE 34 13.190 -1.498 4.642
230 HG12 ILE 34 1HG1 ILE 34 10.441 -1.280 3.499
231 HG13 ILE 34 2HG1 ILE 34 11.792 -1.463 2.385
232 HG21 ILE 34 1HG2 ILE 34 12.272 -0.519 6.472
233 HG22 ILE 34 2HG2 ILE 34 11.176 0.484 5.524
234 HG23 ILE 34 3HG2 ILE 34 10.803 -1.218 5.792
235 HD11 ILE 34 3HD1 ILE 34 12.336 -3.415 4.175
236 HD12 ILE 34 1HD1 ILE 34 10.573 -3.400 4.211
237 HD13 ILE 34 2HD1 ILE 34 11.422 -3.647 2.685
238 H HIS 35 H HIS 35 12.074 0.532 1.302
239 HA HIS 35 HA HIS 35 14.272 -0.979 0.143
240 HB2 HIS 35 1HB HIS 35 11.688 0.089 -0.993
241 HB3 HIS 35 2HB HIS 35 12.915 -0.695 -1.984
242 HD1 HIS 35 HD1 HIS 35 13.647 -3.037 -0.119
243 HD2 HIS 35 HD2 HIS 35 9.758 -1.833 -0.950
244 HE1 HIS 35 HE1 HIS 35 12.210 -5.052 0.325
245 H THR 36 H THR 36 12.929 2.276 0.081
246 HA THR 36 HA THR 36 15.435 3.223 -1.111
247 HB THR 36 HB THR 36 14.133 3.281 -3.043
248 HG1 THR 36 HG1 THR 36 13.904 5.455 -3.421
249 HG21 THR 36 3HG2 THR 36 11.989 2.662 -2.352
250 HG22 THR 36 1HG2 THR 36 11.767 4.305 -2.954
251 HG23 THR 36 2HG2 THR 36 11.864 4.007 -1.218
252 H GLY 37 H GLY 37 16.263 4.464 0.449
253 HA2 GLY 37 1HA GLY 37 14.473 6.447 1.711
254 HA3 GLY 37 2HA GLY 37 15.685 5.572 2.635
255 H GLU 38 H GLU 38 15.054 8.236 0.564
256 HA GLU 38 HA GLU 38 16.447 9.788 -0.440
257 HB2 GLU 38 1HB GLU 38 17.609 11.096 1.228
258 HB3 GLU 38 2HB GLU 38 16.078 10.543 1.892
259 HG2 GLU 38 1HG GLU 38 17.083 9.067 3.346
260 HG3 GLU 38 2HG GLU 38 18.558 8.964 2.386
261 H LYS 39 H LYS 39 17.402 7.247 -1.059
262 HA LYS 39 HA LYS 39 20.294 7.763 -1.136
263 HB2 LYS 39 1HB LYS 39 19.567 5.936 0.528
264 HB3 LYS 39 2HB LYS 39 19.189 4.975 -0.895
265 HG2 LYS 39 1HG LYS 39 21.548 5.303 -1.646
266 HG3 LYS 39 2HG LYS 39 21.874 6.062 -0.086
267 HD2 LYS 39 1HD LYS 39 21.266 4.027 1.073
268 HD3 LYS 39 2HD LYS 39 20.798 3.266 -0.449
269 HE2 LYS 39 1HE LYS 39 22.953 2.441 0.078
270 HE3 LYS 39 2HE LYS 39 23.173 3.616 -1.218
271 HZ1 LYS 39 3HZ LYS 39 23.962 5.218 0.318
272 HZ2 LYS 39 1HZ LYS 39 24.796 3.783 0.649
273 HZ3 LYS 39 2HZ LYS 39 23.526 4.274 1.652
274 HA PRO 40 HA PRO 40 18.291 6.849 -5.309
275 HB2 PRO 40 1HB PRO 40 18.834 9.253 -6.447
276 HB3 PRO 40 2HB PRO 40 17.347 8.930 -5.548
277 HG2 PRO 40 1HG PRO 40 19.845 10.311 -4.644
278 HG3 PRO 40 2HG PRO 40 18.153 10.757 -4.355
279 HD2 PRO 40 1HD PRO 40 19.665 9.495 -2.497
280 HD3 PRO 40 2HD PRO 40 17.914 9.237 -2.639
281 H SER 41 H SER 41 19.817 5.467 -6.060
282 HA SER 41 HA SER 41 22.579 5.946 -6.145
283 HB2 SER 41 1HB SER 41 20.870 4.045 -7.764
284 HB3 SER 41 2HB SER 41 22.633 4.020 -7.749
285 HG SER 41 HG SER 41 22.446 3.733 -5.426
286 H GLY 42 H GLY 42 23.768 7.200 -7.418
287 HA2 GLY 42 1HA GLY 42 23.875 7.447 -10.084
288 HA3 GLY 42 2HA GLY 42 22.528 8.506 -9.697
289 HA PRO 43 HA PRO 43 25.424 11.759 -9.127
290 HB2 PRO 43 1HB PRO 43 23.931 13.412 -7.574
291 HB3 PRO 43 2HB PRO 43 23.633 13.187 -9.302
292 HG2 PRO 43 1HG PRO 43 22.243 11.941 -6.962
293 HG3 PRO 43 2HG PRO 43 21.548 12.606 -8.451
294 HD2 PRO 43 1HD PRO 43 21.902 9.949 -8.070
295 HD3 PRO 43 2HD PRO 43 22.023 10.708 -9.670
296 H SER 44 H SER 44 26.275 13.191 -7.263
297 HA SER 44 HA SER 44 27.551 11.575 -5.388
298 HB2 SER 44 1HB SER 44 28.494 13.712 -5.962
299 HB3 SER 44 2HB SER 44 27.058 14.560 -5.387
300 HG SER 44 HG SER 44 28.755 14.617 -3.855
301 H SER 45 H SER 45 27.291 11.292 -3.158
302 HA SER 45 HA SER 45 24.790 12.199 -1.950
303 HB2 SER 45 1HB SER 45 24.182 9.965 -1.197
304 HB3 SER 45 2HB SER 45 24.322 9.974 -2.954
305 HG SER 45 HG SER 45 25.365 8.168 -1.936
306 H GLY 46 H GLY 46 24.728 11.732 0.416
307 HA2 GLY 46 1HA GLY 46 27.038 12.681 1.683
308 HA3 GLY 46 2HA GLY 46 25.673 11.932 2.497
Start of MODEL 18
1 H1 GLY 1 H GLY 1 -2.385 -33.794 4.508
2 HA2 GLY 1 1HA GLY 1 -4.443 -32.304 3.972
3 HA3 GLY 1 2HA GLY 1 -4.591 -32.280 5.723
4 H SER 2 H SER 2 -3.460 -30.812 6.851
5 HA SER 2 HA SER 2 -2.217 -28.946 7.254
6 HB2 SER 2 1HB SER 2 -0.451 -30.784 6.895
7 HB3 SER 2 2HB SER 2 -0.190 -30.049 5.314
8 HG SER 2 HG SER 2 0.074 -28.779 7.839
9 H SER 3 H SER 3 -4.159 -28.592 5.303
10 HA SER 3 HA SER 3 -2.855 -26.608 3.563
11 HB2 SER 3 1HB SER 3 -4.410 -27.152 1.763
12 HB3 SER 3 2HB SER 3 -3.520 -28.597 2.240
13 HG SER 3 HG SER 3 -5.845 -28.864 1.976
14 H GLY 4 H GLY 4 -4.178 -24.793 2.969
15 HA2 GLY 4 1HA GLY 4 -6.735 -24.181 3.602
16 HA3 GLY 4 2HA GLY 4 -5.906 -23.978 5.138
17 H SER 5 H SER 5 -6.971 -21.766 4.507
18 HA SER 5 HA SER 5 -4.777 -20.085 3.593
19 HB2 SER 5 1HB SER 5 -6.459 -20.701 1.667
20 HB3 SER 5 2HB SER 5 -7.481 -19.494 2.446
21 HG SER 5 HG SER 5 -5.271 -19.154 0.901
22 H SER 6 H SER 6 -5.569 -17.670 3.765
23 HA SER 6 HA SER 6 -7.533 -17.156 5.796
24 HB2 SER 6 1HB SER 6 -5.685 -17.927 7.211
25 HB3 SER 6 2HB SER 6 -4.607 -16.748 6.462
26 HG SER 6 HG SER 6 -5.929 -16.323 8.581
27 H GLY 7 H GLY 7 -8.042 -14.960 5.995
28 HA2 GLY 7 1HA GLY 7 -7.889 -12.677 5.521
29 HA3 GLY 7 2HA GLY 7 -6.464 -12.999 4.545
30 H SER 8 H SER 8 -9.950 -12.882 4.595
31 HA SER 8 HA SER 8 -10.120 -13.497 1.752
32 HB2 SER 8 1HB SER 8 -12.274 -12.870 3.785
33 HB3 SER 8 2HB SER 8 -12.573 -13.312 2.104
34 HG SER 8 HG SER 8 -11.279 -14.907 4.065
35 H GLY 9 H GLY 9 -11.533 -12.047 0.392
36 HA2 GLY 9 1HA GLY 9 -12.382 -9.831 -0.026
37 HA3 GLY 9 2HA GLY 9 -11.211 -9.213 1.129
38 H GLU 10 H GLU 10 -10.194 -7.760 -0.186
39 HA GLU 10 HA GLU 10 -8.519 -8.923 -2.288
40 HB2 GLU 10 1HB GLU 10 -10.220 -6.448 -2.630
41 HB3 GLU 10 2HB GLU 10 -8.989 -6.984 -3.765
42 HG2 GLU 10 1HG GLU 10 -11.313 -8.715 -2.991
43 HG3 GLU 10 2HG GLU 10 -11.400 -7.548 -4.310
44 H LYS 11 H LYS 11 -6.475 -8.213 -2.237
45 HA LYS 11 HA LYS 11 -5.888 -5.786 -0.674
46 HB2 LYS 11 1HB LYS 11 -4.160 -8.262 -0.771
47 HB3 LYS 11 2HB LYS 11 -3.907 -6.832 0.221
48 HG2 LYS 11 1HG LYS 11 -5.661 -7.364 1.654
49 HG3 LYS 11 2HG LYS 11 -6.391 -8.480 0.497
50 HD2 LYS 11 1HD LYS 11 -4.249 -9.860 0.767
51 HD3 LYS 11 2HD LYS 11 -3.940 -8.866 2.192
52 HE2 LYS 11 1HE LYS 11 -5.049 -10.919 2.838
53 HE3 LYS 11 2HE LYS 11 -6.120 -9.545 3.110
54 HZ1 LYS 11 3HZ LYS 11 -7.620 -10.621 1.908
55 HZ2 LYS 11 1HZ LYS 11 -6.513 -11.820 1.461
56 HZ3 LYS 11 2HZ LYS 11 -6.642 -10.403 0.546
57 HA PRO 12 HA PRO 12 -4.155 -5.383 -4.959
58 HB2 PRO 12 1HB PRO 12 -4.974 -2.816 -5.297
59 HB3 PRO 12 2HB PRO 12 -5.999 -4.208 -5.667
60 HG2 PRO 12 1HG PRO 12 -5.982 -2.462 -3.235
61 HG3 PRO 12 2HG PRO 12 -7.364 -3.091 -4.151
62 HD2 PRO 12 1HD PRO 12 -6.525 -4.205 -1.830
63 HD3 PRO 12 2HD PRO 12 -7.254 -5.159 -3.137
64 H TYR 13 H TYR 13 -3.744 -3.892 -1.924
65 HA TYR 13 HA TYR 13 -1.611 -2.122 -2.783
66 HB2 TYR 13 1HB TYR 13 -2.833 -2.735 -0.095
67 HB3 TYR 13 2HB TYR 13 -1.418 -1.705 -0.275
68 HD1 TYR 13 HD1 TYR 13 -3.792 -1.534 -2.974
69 HD2 TYR 13 HD2 TYR 13 -2.833 0.047 0.858
70 HE1 TYR 13 HE1 TYR 13 -5.255 0.395 -3.410
71 HE2 TYR 13 HE2 TYR 13 -4.294 1.979 0.433
72 HH TYR 13 HH TYR 13 -5.325 3.158 -1.311
73 H LYS 14 H LYS 14 -0.126 -3.640 -3.624
74 HA LYS 14 HA LYS 14 1.334 -5.127 -1.544
75 HB2 LYS 14 1HB LYS 14 -0.019 -6.575 -3.143
76 HB3 LYS 14 2HB LYS 14 1.086 -6.048 -4.405
77 HG2 LYS 14 1HG LYS 14 2.964 -6.985 -3.125
78 HG3 LYS 14 2HG LYS 14 1.823 -7.560 -1.907
79 HD2 LYS 14 1HD LYS 14 0.676 -8.847 -3.733
80 HD3 LYS 14 2HD LYS 14 2.017 -8.408 -4.793
81 HE2 LYS 14 1HE LYS 14 3.549 -9.673 -3.579
82 HE3 LYS 14 2HE LYS 14 2.521 -9.720 -2.148
83 HZ1 LYS 14 3HZ LYS 14 0.968 -11.131 -3.428
84 HZ2 LYS 14 1HZ LYS 14 2.483 -11.849 -3.197
85 HZ3 LYS 14 2HZ LYS 14 2.086 -11.176 -4.697
86 H CYS 15 H CYS 15 3.618 -5.481 -2.028
87 HA CYS 15 HA CYS 15 4.744 -3.164 -3.414
88 HB2 CYS 15 1HB CYS 15 5.506 -3.460 -1.141
89 HB3 CYS 15 2HB CYS 15 5.957 -5.131 -1.464
90 H ASN 16 H ASN 16 6.651 -3.433 -4.761
91 HA ASN 16 HA ASN 16 6.516 -5.932 -6.303
92 HB2 ASN 16 1HB ASN 16 6.077 -4.216 -7.809
93 HB3 ASN 16 2HB ASN 16 7.191 -3.102 -7.022
94 HD21 ASN 16 1HD2 ASN 16 9.082 -2.798 -7.953
95 HD22 ASN 16 2HD2 ASN 16 9.809 -3.831 -9.132
96 H GLU 17 H GLU 17 8.678 -3.771 -4.593
97 HA GLU 17 HA GLU 17 11.140 -4.778 -5.411
98 HB2 GLU 17 1HB GLU 17 10.600 -2.761 -3.896
99 HB3 GLU 17 2HB GLU 17 10.608 -3.923 -2.578
100 HG2 GLU 17 1HG GLU 17 12.765 -3.246 -2.477
101 HG3 GLU 17 2HG GLU 17 12.942 -4.566 -3.632
102 H CYS 18 H CYS 18 9.290 -5.689 -2.499
103 HA CYS 18 HA CYS 18 10.798 -8.214 -2.431
104 HB2 CYS 18 1HB CYS 18 10.148 -8.358 -0.067
105 HB3 CYS 18 2HB CYS 18 11.000 -6.854 -0.403
106 H GLY 19 H GLY 19 7.532 -6.866 -2.063
107 HA2 GLY 19 1HA GLY 19 5.721 -7.973 -3.276
108 HA3 GLY 19 2HA GLY 19 6.478 -9.506 -2.867
109 H LYS 20 H LYS 20 6.134 -6.851 -0.605
110 HA LYS 20 HA LYS 20 4.699 -8.568 1.217
111 HB2 LYS 20 1HB LYS 20 6.519 -6.727 1.712
112 HB3 LYS 20 2HB LYS 20 5.126 -5.653 1.729
113 HG2 LYS 20 1HG LYS 20 4.107 -6.948 3.499
114 HG3 LYS 20 2HG LYS 20 5.436 -8.108 3.445
115 HD2 LYS 20 1HD LYS 20 6.994 -6.266 4.041
116 HD3 LYS 20 2HD LYS 20 5.601 -5.196 4.218
117 HE2 LYS 20 1HE LYS 20 5.919 -7.769 5.749
118 HE3 LYS 20 2HE LYS 20 6.483 -6.211 6.351
119 HZ1 LYS 20 3HZ LYS 20 3.751 -6.191 5.441
120 HZ2 LYS 20 1HZ LYS 20 4.419 -5.587 6.873
121 HZ3 LYS 20 2HZ LYS 20 4.018 -7.226 6.752
122 H VAL 21 H VAL 21 2.739 -7.754 2.358
123 HA VAL 21 HA VAL 21 0.962 -6.310 0.500
124 HB VAL 21 HB VAL 21 0.276 -8.630 2.307
125 HG11 VAL 21 1HG1 VAL 21 -2.006 -8.404 1.313
126 HG12 VAL 21 2HG1 VAL 21 -1.549 -7.087 2.395
127 HG13 VAL 21 3HG1 VAL 21 -1.502 -6.851 0.648
128 HG21 VAL 21 3HG2 VAL 21 -0.329 -9.752 0.211
129 HG22 VAL 21 1HG2 VAL 21 0.209 -8.338 -0.695
130 HG23 VAL 21 2HG2 VAL 21 1.372 -9.285 0.233
131 H PHE 22 H PHE 22 -0.880 -5.228 1.545
132 HA PHE 22 HA PHE 22 -0.710 -4.682 4.372
133 HB2 PHE 22 1HB PHE 22 -0.411 -2.322 2.524
134 HB3 PHE 22 2HB PHE 22 -0.189 -2.380 4.270
135 HD1 PHE 22 HD1 PHE 22 1.263 -3.456 1.045
136 HD2 PHE 22 HD2 PHE 22 1.905 -2.871 5.212
137 HE1 PHE 22 HE1 PHE 22 3.676 -3.812 0.720
138 HE2 PHE 22 HE2 PHE 22 4.319 -3.225 4.893
139 HZ PHE 22 HZ PHE 22 5.207 -3.696 2.645
140 H THR 23 H THR 23 -2.496 -3.387 5.147
141 HA THR 23 HA THR 23 -4.891 -3.866 3.599
142 HB THR 23 HB THR 23 -5.042 -4.358 5.940
143 HG1 THR 23 HG1 THR 23 -6.752 -2.942 4.729
144 HG21 THR 23 3HG2 THR 23 -4.184 -1.498 6.380
145 HG22 THR 23 1HG2 THR 23 -3.293 -2.954 6.820
146 HG23 THR 23 2HG2 THR 23 -4.800 -2.559 7.646
147 H GLN 24 H GLN 24 -3.121 -1.073 4.868
148 HA GLN 24 HA GLN 24 -4.818 0.670 3.207
149 HB2 GLN 24 1HB GLN 24 -3.261 1.295 5.719
150 HB3 GLN 24 2HB GLN 24 -4.055 2.510 4.727
151 HG2 GLN 24 1HG GLN 24 -5.297 0.343 6.380
152 HG3 GLN 24 2HG GLN 24 -5.533 2.087 6.485
153 HE21 GLN 24 1HE2 GLN 24 -7.063 3.044 5.257
154 HE22 GLN 24 2HE2 GLN 24 -8.114 2.196 4.179
155 H ASN 25 H ASN 25 -3.730 2.571 2.272
156 HA ASN 25 HA ASN 25 -1.482 1.831 0.760
157 HB2 ASN 25 1HB ASN 25 -1.456 4.170 -0.002
158 HB3 ASN 25 2HB ASN 25 -3.089 3.512 -0.010
159 HD21 ASN 25 1HD2 ASN 25 -1.857 6.277 0.285
160 HD22 ASN 25 2HD2 ASN 25 -2.672 6.944 1.654
161 H SER 26 H SER 26 -1.744 4.229 3.388
162 HA SER 26 HA SER 26 0.769 5.136 3.645
163 HB2 SER 26 1HB SER 26 -1.154 4.270 5.797
164 HB3 SER 26 2HB SER 26 0.397 5.010 6.192
165 HG SER 26 HG SER 26 -0.759 6.774 5.975
166 H HIS 27 H HIS 27 -0.337 2.029 4.981
167 HA HIS 27 HA HIS 27 2.099 1.214 6.078
168 HB2 HIS 27 1HB HIS 27 -0.111 -0.496 4.918
169 HB3 HIS 27 2HB HIS 27 1.175 -1.074 5.974
170 HD1 HIS 27 HD1 HIS 27 -0.829 -1.823 7.568
171 HD2 HIS 27 HD2 HIS 27 -0.314 2.274 7.109
172 HE1 HIS 27 HE1 HIS 27 -2.119 -0.768 9.451
173 H LEU 28 H LEU 28 0.794 0.815 2.820
174 HA LEU 28 HA LEU 28 2.996 -0.779 1.907
175 HB2 LEU 28 1HB LEU 28 0.935 -1.109 0.806
176 HB3 LEU 28 2HB LEU 28 0.722 0.618 0.527
177 HG LEU 28 HG LEU 28 2.635 0.528 -1.069
178 HD11 LEU 28 1HD1 LEU 28 2.682 -2.246 -0.110
179 HD12 LEU 28 2HD1 LEU 28 3.970 -1.255 -0.794
180 HD13 LEU 28 3HD1 LEU 28 2.814 -2.056 -1.858
181 HD21 LEU 28 3HD2 LEU 28 0.184 0.315 -1.687
182 HD22 LEU 28 1HD2 LEU 28 0.476 -1.419 -1.834
183 HD23 LEU 28 2HD2 LEU 28 1.349 -0.287 -2.867
184 H THR 29 H THR 29 1.887 2.455 0.881
185 HA THR 29 HA THR 29 4.075 3.234 -0.564
186 HB THR 29 HB THR 29 2.062 4.601 -0.444
187 HG1 THR 29 HG1 THR 29 3.442 6.078 -1.063
188 HG21 THR 29 3HG2 THR 29 2.875 5.751 2.182
189 HG22 THR 29 1HG2 THR 29 1.990 4.226 2.169
190 HG23 THR 29 2HG2 THR 29 1.280 5.664 1.435
191 H ASN 30 H ASN 30 3.626 3.509 2.943
192 HA ASN 30 HA ASN 30 6.061 4.849 3.457
193 HB2 ASN 30 1HB ASN 30 4.069 4.675 5.013
194 HB3 ASN 30 2HB ASN 30 4.596 3.034 5.376
195 HD21 ASN 30 1HD2 ASN 30 5.278 6.413 5.738
196 HD22 ASN 30 2HD2 ASN 30 6.492 6.248 6.955
197 H HIS 31 H HIS 31 5.158 1.420 3.548
198 HA HIS 31 HA HIS 31 7.418 0.273 4.564
199 HB2 HIS 31 1HB HIS 31 5.823 -1.307 4.088
200 HB3 HIS 31 2HB HIS 31 5.419 -0.587 2.532
201 HD1 HIS 31 HD1 HIS 31 8.014 -2.807 4.141
202 HD2 HIS 31 HD2 HIS 31 6.682 -1.704 0.364
203 HE1 HIS 31 HE1 HIS 31 9.191 -4.346 2.538
204 H TRP 32 H TRP 32 6.887 1.220 1.179
205 HA TRP 32 HA TRP 32 9.141 0.338 -0.040
206 HB2 TRP 32 1HB TRP 32 7.515 2.818 -0.365
207 HB3 TRP 32 2HB TRP 32 9.039 2.707 -1.240
208 HD1 TRP 32 HD1 TRP 32 5.796 0.609 -0.829
209 HE1 TRP 32 HE1 TRP 32 5.315 -0.546 -3.078
210 HE3 TRP 32 HE3 TRP 32 9.917 2.151 -3.432
211 HZ2 TRP 32 HZ2 TRP 32 6.522 -0.774 -5.620
212 HZ3 TRP 32 HZ3 TRP 32 10.179 1.420 -5.767
213 HH2 TRP 32 HH2 TRP 32 8.516 -0.013 -6.836
214 H ARG 33 H ARG 33 8.924 2.872 2.339
215 HA ARG 33 HA ARG 33 11.193 4.334 2.016
216 HB2 ARG 33 1HB ARG 33 9.840 3.295 4.483
217 HB3 ARG 33 2HB ARG 33 11.325 4.228 4.619
218 HG2 ARG 33 1HG ARG 33 10.027 5.911 3.076
219 HG3 ARG 33 2HG ARG 33 8.618 5.085 3.743
220 HD2 ARG 33 1HD ARG 33 10.821 6.354 5.366
221 HD3 ARG 33 2HD ARG 33 9.255 7.091 5.032
222 HE ARG 33 HE ARG 33 8.543 4.770 6.164
223 HH11 ARG 33 1HH1 ARG 33 10.860 7.194 7.099
224 HH12 ARG 33 2HH1 ARG 33 10.685 6.894 8.796
225 HH21 ARG 33 1HH2 ARG 33 8.303 4.365 8.396
226 HH22 ARG 33 2HH2 ARG 33 9.231 5.284 9.533
227 H ILE 34 H ILE 34 11.032 1.248 3.796
228 HA ILE 34 HA ILE 34 13.749 1.003 4.348
229 HB ILE 34 HB ILE 34 13.366 -1.349 4.708
230 HG12 ILE 34 1HG1 ILE 34 10.561 -1.239 3.722
231 HG13 ILE 34 2HG1 ILE 34 11.836 -1.350 2.513
232 HG21 ILE 34 1HG2 ILE 34 11.028 0.365 5.524
233 HG22 ILE 34 2HG2 ILE 34 11.359 -1.235 6.185
234 HG23 ILE 34 3HG2 ILE 34 12.513 0.075 6.430
235 HD11 ILE 34 3HD1 ILE 34 10.900 -3.533 3.178
236 HD12 ILE 34 1HD1 ILE 34 12.634 -3.398 3.469
237 HD13 ILE 34 2HD1 ILE 34 11.500 -3.258 4.813
238 H HIS 35 H HIS 35 12.028 0.548 1.390
239 HA HIS 35 HA HIS 35 14.159 -0.969 0.137
240 HB2 HIS 35 1HB HIS 35 11.499 0.075 -0.810
241 HB3 HIS 35 2HB HIS 35 12.675 -0.598 -1.936
242 HD1 HIS 35 HD1 HIS 35 13.613 -2.931 0.000
243 HD2 HIS 35 HD2 HIS 35 9.690 -2.001 -1.000
244 HE1 HIS 35 HE1 HIS 35 12.306 -5.047 0.369
245 H THR 36 H THR 36 12.869 2.307 0.112
246 HA THR 36 HA THR 36 14.684 3.185 -1.956
247 HB THR 36 HB THR 36 13.790 5.482 -1.340
248 HG1 THR 36 HG1 THR 36 11.783 4.087 0.079
249 HG21 THR 36 3HG2 THR 36 11.507 3.650 -1.947
250 HG22 THR 36 1HG2 THR 36 12.855 3.765 -3.078
251 HG23 THR 36 2HG2 THR 36 11.920 5.204 -2.670
252 H GLY 37 H GLY 37 16.786 3.281 -1.436
253 HA2 GLY 37 1HA GLY 37 18.483 4.711 -0.463
254 HA3 GLY 37 2HA GLY 37 17.504 4.791 0.994
255 H GLU 38 H GLU 38 18.324 1.915 -0.893
256 HA GLU 38 HA GLU 38 20.314 1.051 1.000
257 HB2 GLU 38 1HB GLU 38 18.208 0.509 2.182
258 HB3 GLU 38 2HB GLU 38 17.710 -0.473 0.812
259 HG2 GLU 38 1HG GLU 38 18.532 -2.017 2.330
260 HG3 GLU 38 2HG GLU 38 19.871 -1.784 1.207
261 H LYS 39 H LYS 39 21.411 -0.867 0.341
262 HA LYS 39 HA LYS 39 22.474 -2.099 -1.259
263 HB2 LYS 39 1HB LYS 39 20.195 -3.263 -0.887
264 HB3 LYS 39 2HB LYS 39 19.762 -2.600 -2.457
265 HG2 LYS 39 1HG LYS 39 21.762 -3.742 -3.411
266 HG3 LYS 39 2HG LYS 39 21.996 -4.520 -1.844
267 HD2 LYS 39 1HD LYS 39 20.106 -5.823 -2.060
268 HD3 LYS 39 2HD LYS 39 19.335 -4.703 -3.186
269 HE2 LYS 39 1HE LYS 39 21.049 -5.342 -4.881
270 HE3 LYS 39 2HE LYS 39 21.638 -6.564 -3.756
271 HZ1 LYS 39 3HZ LYS 39 19.237 -6.550 -5.385
272 HZ2 LYS 39 1HZ LYS 39 19.045 -7.151 -3.815
273 HZ3 LYS 39 2HZ LYS 39 20.180 -7.851 -4.855
274 HA PRO 40 HA PRO 40 21.805 1.324 -4.450
275 HB2 PRO 40 1HB PRO 40 24.129 2.651 -3.992
276 HB3 PRO 40 2HB PRO 40 22.627 3.021 -3.137
277 HG2 PRO 40 1HG PRO 40 24.960 1.374 -2.240
278 HG3 PRO 40 2HG PRO 40 24.022 2.572 -1.331
279 HD2 PRO 40 1HD PRO 40 23.629 -0.093 -1.064
280 HD3 PRO 40 2HD PRO 40 22.314 1.088 -0.892
281 H SER 41 H SER 41 22.728 1.284 -6.468
282 HA SER 41 HA SER 41 24.043 0.616 -8.206
283 HB2 SER 41 1HB SER 41 25.892 1.279 -6.483
284 HB3 SER 41 2HB SER 41 26.113 -0.462 -6.317
285 HG SER 41 HG SER 41 27.465 0.486 -7.935
286 H GLY 42 H GLY 42 22.033 -1.054 -7.367
287 HA2 GLY 42 1HA GLY 42 23.060 -3.751 -7.107
288 HA3 GLY 42 2HA GLY 42 21.369 -3.279 -7.186
289 HA PRO 43 HA PRO 43 22.372 -5.353 -11.177
290 HB2 PRO 43 1HB PRO 43 20.018 -6.698 -11.320
291 HB3 PRO 43 2HB PRO 43 21.421 -7.308 -10.435
292 HG2 PRO 43 1HG PRO 43 18.997 -5.890 -9.399
293 HG3 PRO 43 2HG PRO 43 19.838 -7.301 -8.732
294 HD2 PRO 43 1HD PRO 43 20.188 -4.800 -7.754
295 HD3 PRO 43 2HD PRO 43 21.482 -6.016 -7.751
296 H SER 44 H SER 44 20.347 -2.959 -10.114
297 HA SER 44 HA SER 44 18.364 -2.651 -11.998
298 HB2 SER 44 1HB SER 44 19.101 -1.173 -9.924
299 HB3 SER 44 2HB SER 44 19.894 -0.219 -11.177
300 HG SER 44 HG SER 44 17.525 -0.682 -12.116
301 H SER 45 H SER 45 18.197 -1.719 -14.018
302 HA SER 45 HA SER 45 20.556 -1.885 -15.657
303 HB2 SER 45 1HB SER 45 18.976 -1.282 -17.508
304 HB3 SER 45 2HB SER 45 18.479 -2.698 -16.581
305 HG SER 45 HG SER 45 16.868 -1.573 -15.686
306 H GLY 46 H GLY 46 21.902 -0.218 -14.943
307 HA2 GLY 46 1HA GLY 46 22.824 1.877 -15.325
308 HA3 GLY 46 2HA GLY 46 21.337 2.350 -16.134
Start of MODEL 19
1 H1 GLY 1 H GLY 1 2.500 -34.713 10.889
2 HA2 GLY 1 1HA GLY 1 1.740 -33.016 12.655
3 HA3 GLY 1 2HA GLY 1 2.674 -31.882 11.692
4 H SER 2 H SER 2 1.066 -30.566 10.986
5 HA SER 2 HA SER 2 -0.814 -31.746 9.077
6 HB2 SER 2 1HB SER 2 -2.044 -31.527 11.203
7 HB3 SER 2 2HB SER 2 -1.637 -29.812 11.258
8 HG SER 2 HG SER 2 -2.732 -29.716 9.138
9 H SER 3 H SER 3 -0.484 -30.755 7.211
10 HA SER 3 HA SER 3 0.782 -28.171 7.083
11 HB2 SER 3 1HB SER 3 0.894 -28.518 4.721
12 HB3 SER 3 2HB SER 3 1.214 -30.081 5.471
13 HG SER 3 HG SER 3 -0.551 -30.845 4.615
14 H GLY 4 H GLY 4 -0.095 -26.250 6.379
15 HA2 GLY 4 1HA GLY 4 -2.778 -26.058 5.388
16 HA3 GLY 4 2HA GLY 4 -2.657 -25.565 7.070
17 H SER 5 H SER 5 -2.630 -23.431 7.221
18 HA SER 5 HA SER 5 -2.380 -21.229 6.615
19 HB2 SER 5 1HB SER 5 -0.068 -20.536 6.549
20 HB3 SER 5 2HB SER 5 -0.207 -21.875 7.688
21 HG SER 5 HG SER 5 1.329 -22.716 6.526
22 H SER 6 H SER 6 -3.478 -22.622 4.504
23 HA SER 6 HA SER 6 -2.131 -22.435 2.061
24 HB2 SER 6 1HB SER 6 -4.438 -23.535 2.715
25 HB3 SER 6 2HB SER 6 -5.088 -21.985 2.180
26 HG SER 6 HG SER 6 -4.811 -23.771 0.569
27 H GLY 7 H GLY 7 -3.194 -20.970 0.234
28 HA2 GLY 7 1HA GLY 7 -2.980 -18.197 1.228
29 HA3 GLY 7 2HA GLY 7 -2.442 -18.724 -0.359
30 H SER 8 H SER 8 -4.908 -17.253 1.346
31 HA SER 8 HA SER 8 -6.650 -17.370 -1.002
32 HB2 SER 8 1HB SER 8 -7.315 -19.017 0.936
33 HB3 SER 8 2HB SER 8 -7.925 -17.552 1.705
34 HG SER 8 HG SER 8 -8.897 -17.320 -0.607
35 H GLY 9 H GLY 9 -6.789 -15.320 -1.631
36 HA2 GLY 9 1HA GLY 9 -7.960 -13.211 -1.151
37 HA3 GLY 9 2HA GLY 9 -7.232 -13.267 0.448
38 H GLU 10 H GLU 10 -7.112 -11.215 -1.695
39 HA GLU 10 HA GLU 10 -4.226 -10.843 -1.621
40 HB2 GLU 10 1HB GLU 10 -5.787 -10.731 -4.208
41 HB3 GLU 10 2HB GLU 10 -4.093 -10.305 -4.012
42 HG2 GLU 10 1HG GLU 10 -3.633 -12.633 -3.314
43 HG3 GLU 10 2HG GLU 10 -5.317 -13.030 -3.655
44 H LYS 11 H LYS 11 -3.955 -8.903 -0.760
45 HA LYS 11 HA LYS 11 -6.012 -6.924 -0.736
46 HB2 LYS 11 1HB LYS 11 -3.245 -7.160 0.332
47 HB3 LYS 11 2HB LYS 11 -3.902 -5.539 0.144
48 HG2 LYS 11 1HG LYS 11 -4.536 -5.988 2.285
49 HG3 LYS 11 2HG LYS 11 -5.955 -6.575 1.415
50 HD2 LYS 11 1HD LYS 11 -3.702 -8.455 1.954
51 HD3 LYS 11 2HD LYS 11 -4.810 -8.044 3.265
52 HE2 LYS 11 1HE LYS 11 -6.626 -8.590 1.429
53 HE3 LYS 11 2HE LYS 11 -5.312 -9.541 0.741
54 HZ1 LYS 11 3HZ LYS 11 -5.197 -10.292 3.294
55 HZ2 LYS 11 1HZ LYS 11 -6.107 -11.104 2.121
56 HZ3 LYS 11 2HZ LYS 11 -6.856 -9.992 3.153
57 HA PRO 12 HA PRO 12 -5.106 -4.657 -4.387
58 HB2 PRO 12 1HB PRO 12 -5.832 -2.158 -3.615
59 HB3 PRO 12 2HB PRO 12 -7.003 -3.439 -3.947
60 HG2 PRO 12 1HG PRO 12 -5.937 -2.482 -1.318
61 HG3 PRO 12 2HG PRO 12 -7.602 -2.898 -1.766
62 HD2 PRO 12 1HD PRO 12 -5.998 -4.589 -0.388
63 HD3 PRO 12 2HD PRO 12 -7.234 -5.160 -1.526
64 H TYR 13 H TYR 13 -3.261 -4.445 -1.658
65 HA TYR 13 HA TYR 13 -1.385 -2.578 -2.949
66 HB2 TYR 13 1HB TYR 13 -1.846 -2.872 0.026
67 HB3 TYR 13 2HB TYR 13 -0.686 -1.793 -0.740
68 HD1 TYR 13 HD2 TYR 13 -1.519 0.131 -2.103
69 HD2 TYR 13 HD1 TYR 13 -4.127 -2.260 0.259
70 HE1 TYR 13 HE2 TYR 13 -3.228 1.897 -2.213
71 HE2 TYR 13 HE1 TYR 13 -5.843 -0.502 0.155
72 HH TYR 13 HH TYR 13 -5.678 2.210 -0.237
73 H LYS 14 H LYS 14 0.401 -3.588 -3.546
74 HA LYS 14 HA LYS 14 1.612 -5.559 -1.762
75 HB2 LYS 14 1HB LYS 14 0.337 -6.958 -3.239
76 HB3 LYS 14 2HB LYS 14 0.901 -6.074 -4.651
77 HG2 LYS 14 1HG LYS 14 3.187 -6.879 -4.208
78 HG3 LYS 14 2HG LYS 14 2.566 -7.822 -2.850
79 HD2 LYS 14 1HD LYS 14 1.239 -9.174 -4.302
80 HD3 LYS 14 2HD LYS 14 1.574 -8.123 -5.680
81 HE2 LYS 14 1HE LYS 14 3.904 -8.766 -5.648
82 HE3 LYS 14 2HE LYS 14 3.651 -9.724 -4.190
83 HZ1 LYS 14 3HZ LYS 14 3.701 -11.106 -6.174
84 HZ2 LYS 14 1HZ LYS 14 2.400 -10.248 -6.832
85 HZ3 LYS 14 2HZ LYS 14 2.181 -11.175 -5.435
86 H CYS 15 H CYS 15 3.730 -5.228 -1.572
87 HA CYS 15 HA CYS 15 5.015 -3.190 -3.130
88 HB2 CYS 15 1HB CYS 15 5.449 -3.568 -0.695
89 HB3 CYS 15 2HB CYS 15 6.254 -5.076 -1.117
90 H ASN 16 H ASN 16 4.577 -4.463 -5.175
91 HA ASN 16 HA ASN 16 5.564 -6.785 -6.032
92 HB2 ASN 16 1HB ASN 16 6.059 -4.201 -7.526
93 HB3 ASN 16 2HB ASN 16 5.937 -5.813 -8.226
94 HD21 ASN 16 1HD2 ASN 16 3.845 -6.951 -7.783
95 HD22 ASN 16 2HD2 ASN 16 2.403 -6.002 -7.871
96 H GLU 17 H GLU 17 7.526 -3.956 -5.289
97 HA GLU 17 HA GLU 17 9.968 -4.583 -6.301
98 HB2 GLU 17 1HB GLU 17 9.588 -2.555 -5.024
99 HB3 GLU 17 2HB GLU 17 9.365 -3.488 -3.550
100 HG2 GLU 17 1HG GLU 17 11.561 -2.432 -3.640
101 HG3 GLU 17 2HG GLU 17 11.679 -4.190 -3.605
102 H CYS 18 H CYS 18 8.850 -5.632 -3.078
103 HA CYS 18 HA CYS 18 10.832 -7.803 -3.187
104 HB2 CYS 18 1HB CYS 18 10.628 -7.905 -0.745
105 HB3 CYS 18 2HB CYS 18 11.069 -6.285 -1.274
106 H GLY 19 H GLY 19 7.444 -7.083 -2.458
107 HA2 GLY 19 1HA GLY 19 5.859 -8.755 -3.416
108 HA3 GLY 19 2HA GLY 19 6.883 -9.977 -2.676
109 H LYS 20 H LYS 20 6.408 -7.078 -0.900
110 HA LYS 20 HA LYS 20 5.081 -8.517 1.204
111 HB2 LYS 20 1HB LYS 20 6.796 -6.489 1.281
112 HB3 LYS 20 2HB LYS 20 5.313 -5.544 1.247
113 HG2 LYS 20 1HG LYS 20 5.520 -5.746 3.486
114 HG3 LYS 20 2HG LYS 20 4.656 -7.254 3.180
115 HD2 LYS 20 1HD LYS 20 7.620 -7.300 3.002
116 HD3 LYS 20 2HD LYS 20 6.898 -7.167 4.607
117 HE2 LYS 20 1HE LYS 20 6.287 -9.307 2.569
118 HE3 LYS 20 2HE LYS 20 7.321 -9.501 3.984
119 HZ1 LYS 20 3HZ LYS 20 4.723 -8.474 4.629
120 HZ2 LYS 20 1HZ LYS 20 5.564 -9.780 5.299
121 HZ3 LYS 20 2HZ LYS 20 4.653 -9.994 3.890
122 H VAL 21 H VAL 21 3.085 -7.733 2.229
123 HA VAL 21 HA VAL 21 1.236 -6.417 0.365
124 HB VAL 21 HB VAL 21 0.636 -8.952 1.895
125 HG11 VAL 21 1HG1 VAL 21 -1.476 -8.593 0.252
126 HG12 VAL 21 2HG1 VAL 21 -1.438 -8.068 1.936
127 HG13 VAL 21 3HG1 VAL 21 -1.087 -6.919 0.645
128 HG21 VAL 21 3HG2 VAL 21 1.179 -8.352 -0.984
129 HG22 VAL 21 1HG2 VAL 21 1.797 -9.661 0.025
130 HG23 VAL 21 2HG2 VAL 21 0.128 -9.698 -0.543
131 H PHE 22 H PHE 22 -0.241 -5.071 1.290
132 HA PHE 22 HA PHE 22 -0.457 -5.031 4.212
133 HB2 PHE 22 1HB PHE 22 -0.075 -2.488 2.638
134 HB3 PHE 22 2HB PHE 22 -0.015 -2.706 4.384
135 HD1 PHE 22 HD1 PHE 22 1.756 -3.465 1.228
136 HD2 PHE 22 HD2 PHE 22 1.995 -3.232 5.471
137 HE1 PHE 22 HE1 PHE 22 4.197 -3.748 1.103
138 HE2 PHE 22 HE2 PHE 22 4.437 -3.513 5.353
139 HZ PHE 22 HZ PHE 22 5.541 -3.771 3.166
140 H THR 23 H THR 23 -2.214 -3.412 4.886
141 HA THR 23 HA THR 23 -4.534 -3.894 3.165
142 HB THR 23 HB THR 23 -4.472 -2.945 6.036
143 HG1 THR 23 HG1 THR 23 -3.698 -5.101 5.785
144 HG21 THR 23 3HG2 THR 23 -6.866 -4.280 5.024
145 HG22 THR 23 1HG2 THR 23 -6.521 -2.751 4.216
146 HG23 THR 23 2HG2 THR 23 -6.711 -2.799 5.969
147 H GLN 24 H GLN 24 -3.193 -1.257 5.161
148 HA GLN 24 HA GLN 24 -4.823 0.700 3.795
149 HB2 GLN 24 1HB GLN 24 -4.539 1.199 6.063
150 HB3 GLN 24 2HB GLN 24 -2.826 0.806 6.033
151 HG2 GLN 24 1HG GLN 24 -2.913 3.131 6.212
152 HG3 GLN 24 2HG GLN 24 -2.542 2.819 4.517
153 HE21 GLN 24 1HE2 GLN 24 -3.502 5.241 5.213
154 HE22 GLN 24 2HE2 GLN 24 -5.126 5.433 4.657
155 H ASN 25 H ASN 25 -4.077 2.377 2.484
156 HA ASN 25 HA ASN 25 -1.988 1.708 0.705
157 HB2 ASN 25 1HB ASN 25 -2.379 3.962 -0.256
158 HB3 ASN 25 2HB ASN 25 -3.872 3.056 -0.031
159 HD21 ASN 25 1HD2 ASN 25 -2.032 5.808 0.892
160 HD22 ASN 25 2HD2 ASN 25 -3.229 6.544 1.897
161 H SER 26 H SER 26 -2.232 4.314 3.124
162 HA SER 26 HA SER 26 0.254 5.447 2.839
163 HB2 SER 26 1HB SER 26 -1.736 6.011 4.457
164 HB3 SER 26 2HB SER 26 -0.829 5.022 5.602
165 HG SER 26 HG SER 26 0.325 7.174 4.168
166 H HIS 27 H HIS 27 -0.578 2.394 4.280
167 HA HIS 27 HA HIS 27 1.837 1.978 5.711
168 HB2 HIS 27 1HB HIS 27 -0.163 -0.016 4.627
169 HB3 HIS 27 2HB HIS 27 1.132 -0.403 5.755
170 HD1 HIS 27 HD1 HIS 27 -1.189 -1.181 7.087
171 HD2 HIS 27 HD2 HIS 27 -0.321 2.875 6.856
172 HE1 HIS 27 HE1 HIS 27 -2.532 -0.101 8.918
173 H LEU 28 H LEU 28 0.769 1.157 2.447
174 HA LEU 28 HA LEU 28 3.029 -0.400 1.755
175 HB2 LEU 28 1HB LEU 28 1.106 -0.683 0.438
176 HB3 LEU 28 2HB LEU 28 0.941 1.049 0.159
177 HG LEU 28 HG LEU 28 2.955 0.975 -1.272
178 HD11 LEU 28 1HD1 LEU 28 4.115 -0.907 -0.357
179 HD12 LEU 28 2HD1 LEU 28 3.728 -1.262 -2.040
180 HD13 LEU 28 3HD1 LEU 28 2.774 -1.986 -0.745
181 HD21 LEU 28 3HD2 LEU 28 1.845 -0.531 -3.069
182 HD22 LEU 28 1HD2 LEU 28 1.004 0.916 -2.512
183 HD23 LEU 28 2HD2 LEU 28 0.535 -0.669 -1.895
184 H THR 29 H THR 29 2.156 2.901 0.709
185 HA THR 29 HA THR 29 4.522 3.565 -0.543
186 HB THR 29 HB THR 29 2.660 5.045 -0.752
187 HG1 THR 29 HG1 THR 29 3.944 6.725 -0.825
188 HG21 THR 29 3HG2 THR 29 2.339 4.620 2.001
189 HG22 THR 29 1HG2 THR 29 1.326 5.605 0.946
190 HG23 THR 29 2HG2 THR 29 2.670 6.343 1.819
191 H ASN 30 H ASN 30 3.816 3.409 2.866
192 HA ASN 30 HA ASN 30 6.116 4.885 3.715
193 HB2 ASN 30 1HB ASN 30 4.280 4.817 5.229
194 HB3 ASN 30 2HB ASN 30 4.190 3.060 5.152
195 HD21 ASN 30 1HD2 ASN 30 5.320 5.672 6.878
196 HD22 ASN 30 2HD2 ASN 30 6.435 4.849 7.909
197 H HIS 31 H HIS 31 5.289 1.421 3.681
198 HA HIS 31 HA HIS 31 7.552 0.325 4.738
199 HB2 HIS 31 1HB HIS 31 5.930 -1.240 4.194
200 HB3 HIS 31 2HB HIS 31 5.691 -0.584 2.578
201 HD1 HIS 31 HD1 HIS 31 8.194 -2.649 4.530
202 HD2 HIS 31 HD2 HIS 31 7.081 -1.863 0.605
203 HE1 HIS 31 HE1 HIS 31 9.507 -4.267 3.122
204 H TRP 32 H TRP 32 7.079 1.196 1.319
205 HA TRP 32 HA TRP 32 9.355 0.411 0.136
206 HB2 TRP 32 1HB TRP 32 7.714 2.878 -0.146
207 HB3 TRP 32 2HB TRP 32 9.276 2.850 -0.959
208 HD1 TRP 32 HD1 TRP 32 6.123 0.584 -0.768
209 HE1 TRP 32 HE1 TRP 32 5.753 -0.445 -3.098
210 HE3 TRP 32 HE3 TRP 32 10.203 2.518 -3.167
211 HZ2 TRP 32 HZ2 TRP 32 7.023 -0.439 -5.619
212 HZ3 TRP 32 HZ3 TRP 32 10.553 1.957 -5.537
213 HH2 TRP 32 HH2 TRP 32 8.995 0.509 -6.735
214 H ARG 33 H ARG 33 9.081 3.080 2.415
215 HA ARG 33 HA ARG 33 11.505 4.331 2.144
216 HB2 ARG 33 1HB ARG 33 9.890 3.712 4.612
217 HB3 ARG 33 2HB ARG 33 11.358 4.678 4.676
218 HG2 ARG 33 1HG ARG 33 10.416 6.414 3.441
219 HG3 ARG 33 2HG ARG 33 9.117 5.392 2.824
220 HD2 ARG 33 1HD ARG 33 8.262 6.914 4.508
221 HD3 ARG 33 2HD ARG 33 8.173 5.251 5.086
222 HE ARG 33 HE ARG 33 9.685 5.770 6.732
223 HH11 ARG 33 1HH1 ARG 33 9.616 8.326 4.369
224 HH12 ARG 33 2HH1 ARG 33 10.585 9.405 5.316
225 HH21 ARG 33 1HH2 ARG 33 10.962 7.182 7.989
226 HH22 ARG 33 2HH2 ARG 33 11.351 8.753 7.375
227 H ILE 34 H ILE 34 10.816 1.403 4.035
228 HA ILE 34 HA ILE 34 13.307 0.991 5.162
229 HB ILE 34 HB ILE 34 12.718 -1.281 5.480
230 HG12 ILE 34 1HG1 ILE 34 10.529 -2.031 4.142
231 HG13 ILE 34 2HG1 ILE 34 11.166 -0.883 2.970
232 HG21 ILE 34 1HG2 ILE 34 10.024 0.025 5.339
233 HG22 ILE 34 2HG2 ILE 34 10.654 -1.094 6.546
234 HG23 ILE 34 3HG2 ILE 34 11.244 0.566 6.492
235 HD11 ILE 34 3HD1 ILE 34 11.817 -3.477 3.017
236 HD12 ILE 34 1HD1 ILE 34 12.888 -2.215 2.408
237 HD13 ILE 34 2HD1 ILE 34 13.093 -2.830 4.048
238 H HIS 35 H HIS 35 12.197 0.308 1.904
239 HA HIS 35 HA HIS 35 14.470 -1.233 1.136
240 HB2 HIS 35 1HB HIS 35 12.267 0.135 -0.393
241 HB3 HIS 35 2HB HIS 35 13.607 -0.653 -1.222
242 HD1 HIS 35 HD1 HIS 35 13.872 -3.195 0.466
243 HD2 HIS 35 HD2 HIS 35 10.242 -1.629 -0.811
244 HE1 HIS 35 HE1 HIS 35 12.263 -5.129 0.478
245 H THR 36 H THR 36 13.599 2.173 0.937
246 HA THR 36 HA THR 36 16.380 2.767 0.188
247 HB THR 36 HB THR 36 15.310 3.165 -1.855
248 HG1 THR 36 HG1 THR 36 15.292 5.480 -1.996
249 HG21 THR 36 3HG2 THR 36 13.010 3.822 -0.157
250 HG22 THR 36 1HG2 THR 36 13.062 3.104 -1.767
251 HG23 THR 36 2HG2 THR 36 13.181 4.853 -1.578
252 H GLY 37 H GLY 37 16.763 3.224 2.407
253 HA2 GLY 37 1HA GLY 37 16.138 5.953 3.110
254 HA3 GLY 37 2HA GLY 37 15.389 4.763 4.165
255 H GLU 38 H GLU 38 18.348 6.295 3.208
256 HA GLU 38 HA GLU 38 19.837 4.756 5.219
257 HB2 GLU 38 1HB GLU 38 20.644 6.309 2.792
258 HB3 GLU 38 2HB GLU 38 21.801 6.091 4.097
259 HG2 GLU 38 1HG GLU 38 22.305 4.312 2.754
260 HG3 GLU 38 2HG GLU 38 21.158 3.578 3.874
261 H LYS 39 H LYS 39 18.285 6.259 6.594
262 HA LYS 39 HA LYS 39 18.846 8.964 6.952
263 HB2 LYS 39 1HB LYS 39 17.590 6.826 8.570
264 HB3 LYS 39 2HB LYS 39 18.152 8.236 9.458
265 HG2 LYS 39 1HG LYS 39 16.852 9.559 7.627
266 HG3 LYS 39 2HG LYS 39 16.009 8.025 7.397
267 HD2 LYS 39 1HD LYS 39 15.816 8.133 10.027
268 HD3 LYS 39 2HD LYS 39 16.015 9.864 9.740
269 HE2 LYS 39 1HE LYS 39 13.971 8.174 8.315
270 HE3 LYS 39 2HE LYS 39 13.637 9.030 9.820
271 HZ1 LYS 39 3HZ LYS 39 13.771 10.042 7.150
272 HZ2 LYS 39 1HZ LYS 39 14.757 10.922 8.206
273 HZ3 LYS 39 2HZ LYS 39 13.107 10.748 8.536
274 HA PRO 40 HA PRO 40 21.996 7.753 10.404
275 HB2 PRO 40 1HB PRO 40 22.676 5.133 10.615
276 HB3 PRO 40 2HB PRO 40 21.317 5.847 11.492
277 HG2 PRO 40 1HG PRO 40 21.308 4.247 8.962
278 HG3 PRO 40 2HG PRO 40 20.216 4.144 10.355
279 HD2 PRO 40 1HD PRO 40 19.547 5.437 8.073
280 HD3 PRO 40 2HD PRO 40 18.965 5.953 9.668
281 H SER 41 H SER 41 24.291 6.516 10.413
282 HA SER 41 HA SER 41 25.883 7.523 8.509
283 HB2 SER 41 1HB SER 41 26.117 4.918 9.996
284 HB3 SER 41 2HB SER 41 27.370 5.430 8.865
285 HG SER 41 HG SER 41 27.877 6.156 10.934
286 H GLY 42 H GLY 42 25.370 7.568 6.393
287 HA2 GLY 42 1HA GLY 42 25.875 5.348 4.752
288 HA3 GLY 42 2HA GLY 42 24.135 5.491 4.955
289 HA PRO 43 HA PRO 43 25.797 9.428 2.620
290 HB2 PRO 43 1HB PRO 43 28.144 9.032 1.313
291 HB3 PRO 43 2HB PRO 43 28.057 9.671 2.959
292 HG2 PRO 43 1HG PRO 43 28.628 6.880 2.038
293 HG3 PRO 43 2HG PRO 43 29.423 7.823 3.313
294 HD2 PRO 43 1HD PRO 43 27.556 5.935 3.846
295 HD3 PRO 43 2HD PRO 43 27.758 7.387 4.847
296 H SER 44 H SER 44 25.610 9.900 0.362
297 HA SER 44 HA SER 44 25.547 7.685 -1.513
298 HB2 SER 44 1HB SER 44 23.219 8.102 -2.196
299 HB3 SER 44 2HB SER 44 23.306 7.601 -0.507
300 HG SER 44 HG SER 44 22.187 9.351 -0.180
301 H SER 45 H SER 45 24.813 8.535 -3.739
302 HA SER 45 HA SER 45 26.514 10.694 -4.431
303 HB2 SER 45 1HB SER 45 25.828 8.708 -5.895
304 HB3 SER 45 2HB SER 45 24.327 9.585 -6.190
305 HG SER 45 HG SER 45 26.694 9.916 -7.362
306 H GLY 46 H GLY 46 26.031 12.686 -3.713
307 HA2 GLY 46 1HA GLY 46 23.646 13.962 -4.747
308 HA3 GLY 46 2HA GLY 46 23.698 13.832 -2.995
Start of MODEL 20
1 H1 GLY 1 H GLY 1 10.076 -15.187 -7.890
2 HA2 GLY 1 1HA GLY 1 8.797 -16.934 -9.861
3 HA3 GLY 1 2HA GLY 1 9.769 -17.698 -8.612
4 H SER 2 H SER 2 7.714 -18.779 -8.107
5 HA SER 2 HA SER 2 6.458 -17.553 -5.869
6 HB2 SER 2 1HB SER 2 4.155 -17.485 -6.758
7 HB3 SER 2 2HB SER 2 5.215 -16.365 -7.614
8 HG SER 2 HG SER 2 4.985 -17.494 -9.385
9 H SER 3 H SER 3 6.446 -19.248 -4.557
10 HA SER 3 HA SER 3 5.814 -21.899 -5.642
11 HB2 SER 3 1HB SER 3 6.812 -22.786 -3.582
12 HB3 SER 3 2HB SER 3 7.929 -21.691 -4.396
13 HG SER 3 HG SER 3 7.856 -21.236 -2.182
14 H GLY 4 H GLY 4 3.658 -20.166 -5.371
15 HA2 GLY 4 1HA GLY 4 1.509 -20.171 -4.561
16 HA3 GLY 4 2HA GLY 4 1.877 -21.729 -3.837
17 H SER 5 H SER 5 0.227 -20.307 -2.400
18 HA SER 5 HA SER 5 1.582 -19.878 0.039
19 HB2 SER 5 1HB SER 5 2.006 -17.726 -1.440
20 HB3 SER 5 2HB SER 5 0.377 -17.309 -0.906
21 HG SER 5 HG SER 5 1.742 -16.487 0.610
22 H SER 6 H SER 6 0.069 -18.974 1.736
23 HA SER 6 HA SER 6 -2.658 -19.910 1.152
24 HB2 SER 6 1HB SER 6 -1.229 -19.691 3.813
25 HB3 SER 6 2HB SER 6 -2.868 -20.297 3.578
26 HG SER 6 HG SER 6 -2.069 -22.147 2.995
27 H GLY 7 H GLY 7 -4.423 -18.659 1.626
28 HA2 GLY 7 1HA GLY 7 -4.668 -16.488 3.262
29 HA3 GLY 7 2HA GLY 7 -3.970 -15.826 1.791
30 H SER 8 H SER 8 -6.618 -15.411 3.061
31 HA SER 8 HA SER 8 -8.419 -16.542 1.049
32 HB2 SER 8 1HB SER 8 -10.232 -15.703 2.497
33 HB3 SER 8 2HB SER 8 -9.119 -16.740 3.390
34 HG SER 8 HG SER 8 -9.669 -14.066 3.698
35 H GLY 9 H GLY 9 -7.787 -13.368 2.561
36 HA2 GLY 9 1HA GLY 9 -8.774 -12.108 0.081
37 HA3 GLY 9 2HA GLY 9 -8.799 -11.351 1.667
38 H GLU 10 H GLU 10 -7.037 -11.826 -1.213
39 HA GLU 10 HA GLU 10 -4.507 -10.932 -0.117
40 HB2 GLU 10 1HB GLU 10 -4.668 -12.600 -1.981
41 HB3 GLU 10 2HB GLU 10 -5.277 -11.314 -3.014
42 HG2 GLU 10 1HG GLU 10 -2.955 -11.595 -3.458
43 HG3 GLU 10 2HG GLU 10 -3.172 -10.066 -2.609
44 H LYS 11 H LYS 11 -4.862 -8.866 0.647
45 HA LYS 11 HA LYS 11 -6.274 -6.797 -0.411
46 HB2 LYS 11 1HB LYS 11 -3.538 -6.615 0.863
47 HB3 LYS 11 2HB LYS 11 -4.656 -5.272 0.668
48 HG2 LYS 11 1HG LYS 11 -6.016 -5.975 2.348
49 HG3 LYS 11 2HG LYS 11 -5.637 -7.680 2.092
50 HD2 LYS 11 1HD LYS 11 -3.322 -7.150 2.987
51 HD3 LYS 11 2HD LYS 11 -3.982 -5.594 3.495
52 HE2 LYS 11 1HE LYS 11 -5.531 -6.636 4.962
53 HE3 LYS 11 2HE LYS 11 -5.199 -8.230 4.287
54 HZ1 LYS 11 3HZ LYS 11 -3.751 -6.741 6.292
55 HZ2 LYS 11 1HZ LYS 11 -2.767 -7.461 5.119
56 HZ3 LYS 11 2HZ LYS 11 -3.830 -8.410 6.030
57 HA PRO 12 HA PRO 12 -4.495 -5.882 -4.342
58 HB2 PRO 12 1HB PRO 12 -5.506 -3.381 -4.655
59 HB3 PRO 12 2HB PRO 12 -6.487 -4.842 -4.824
60 HG2 PRO 12 1HG PRO 12 -6.236 -2.989 -2.486
61 HG3 PRO 12 2HG PRO 12 -7.691 -3.733 -3.173
62 HD2 PRO 12 1HD PRO 12 -6.472 -4.693 -0.954
63 HD3 PRO 12 2HD PRO 12 -7.317 -5.744 -2.109
64 H TYR 13 H TYR 13 -3.678 -4.346 -1.447
65 HA TYR 13 HA TYR 13 -1.782 -2.507 -2.692
66 HB2 TYR 13 1HB TYR 13 -2.695 -2.915 0.153
67 HB3 TYR 13 2HB TYR 13 -1.332 -1.879 -0.255
68 HD1 TYR 13 HD1 TYR 13 -4.053 -2.030 -2.638
69 HD2 TYR 13 HD2 TYR 13 -2.589 -0.010 0.808
70 HE1 TYR 13 HE1 TYR 13 -5.603 -0.172 -3.076
71 HE2 TYR 13 HE2 TYR 13 -4.136 1.854 0.380
72 HH TYR 13 HH TYR 13 -6.123 2.367 -0.782
73 H LYS 14 H LYS 14 -0.301 -3.992 -3.553
74 HA LYS 14 HA LYS 14 1.325 -5.406 -1.541
75 HB2 LYS 14 1HB LYS 14 -0.009 -6.790 -3.272
76 HB3 LYS 14 2HB LYS 14 1.185 -6.221 -4.432
77 HG2 LYS 14 1HG LYS 14 2.962 -7.183 -2.987
78 HG3 LYS 14 2HG LYS 14 1.696 -7.864 -1.962
79 HD2 LYS 14 1HD LYS 14 2.078 -9.648 -3.338
80 HD3 LYS 14 2HD LYS 14 0.834 -8.816 -4.274
81 HE2 LYS 14 1HE LYS 14 3.726 -8.192 -4.716
82 HE3 LYS 14 2HE LYS 14 3.007 -9.626 -5.449
83 HZ1 LYS 14 3HZ LYS 14 2.616 -6.827 -6.092
84 HZ2 LYS 14 1HZ LYS 14 1.210 -7.768 -6.095
85 HZ3 LYS 14 2HZ LYS 14 2.514 -8.192 -7.085
86 H CYS 15 H CYS 15 3.581 -5.395 -1.813
87 HA CYS 15 HA CYS 15 4.582 -3.016 -3.116
88 HB2 CYS 15 1HB CYS 15 5.450 -3.488 -0.928
89 HB3 CYS 15 2HB CYS 15 5.904 -5.122 -1.401
90 H ASN 16 H ASN 16 6.552 -3.098 -4.463
91 HA ASN 16 HA ASN 16 6.419 -5.377 -6.316
92 HB2 ASN 16 1HB ASN 16 5.949 -2.951 -7.083
93 HB3 ASN 16 2HB ASN 16 7.692 -2.727 -6.955
94 HD21 ASN 16 1HD2 ASN 16 8.813 -3.107 -8.716
95 HD22 ASN 16 2HD2 ASN 16 8.325 -4.104 -10.040
96 H GLU 17 H GLU 17 8.586 -3.376 -4.412
97 HA GLU 17 HA GLU 17 11.042 -4.278 -5.364
98 HB2 GLU 17 1HB GLU 17 10.460 -2.433 -3.618
99 HB3 GLU 17 2HB GLU 17 10.608 -3.735 -2.446
100 HG2 GLU 17 1HG GLU 17 12.687 -2.577 -2.559
101 HG3 GLU 17 2HG GLU 17 12.896 -4.168 -3.286
102 H CYS 18 H CYS 18 8.937 -5.640 -2.863
103 HA CYS 18 HA CYS 18 10.524 -8.119 -3.000
104 HB2 CYS 18 1HB CYS 18 9.906 -8.497 -0.605
105 HB3 CYS 18 2HB CYS 18 10.968 -7.116 -0.858
106 H GLY 19 H GLY 19 7.344 -6.755 -2.163
107 HA2 GLY 19 1HA GLY 19 5.478 -7.747 -3.515
108 HA3 GLY 19 2HA GLY 19 6.141 -9.306 -3.045
109 H LYS 20 H LYS 20 6.415 -7.043 -0.567
110 HA LYS 20 HA LYS 20 4.861 -8.417 1.257
111 HB2 LYS 20 1HB LYS 20 6.568 -6.442 1.547
112 HB3 LYS 20 2HB LYS 20 5.122 -5.443 1.482
113 HG2 LYS 20 1HG LYS 20 4.348 -6.182 3.491
114 HG3 LYS 20 2HG LYS 20 5.128 -7.758 3.338
115 HD2 LYS 20 1HD LYS 20 6.779 -5.280 3.641
116 HD3 LYS 20 2HD LYS 20 6.043 -6.036 5.056
117 HE2 LYS 20 1HE LYS 20 7.112 -8.213 4.073
118 HE3 LYS 20 2HE LYS 20 8.162 -7.077 3.228
119 HZ1 LYS 20 3HZ LYS 20 8.744 -6.108 5.385
120 HZ2 LYS 20 1HZ LYS 20 9.157 -7.746 5.301
121 HZ3 LYS 20 2HZ LYS 20 7.787 -7.262 6.168
122 H VAL 21 H VAL 21 2.868 -7.697 2.360
123 HA VAL 21 HA VAL 21 0.980 -6.386 0.518
124 HB VAL 21 HB VAL 21 0.385 -8.798 2.238
125 HG11 VAL 21 1HG1 VAL 21 -1.821 -8.754 1.301
126 HG12 VAL 21 2HG1 VAL 21 -1.483 -7.167 1.995
127 HG13 VAL 21 3HG1 VAL 21 -1.399 -7.404 0.249
128 HG21 VAL 21 3HG2 VAL 21 1.738 -8.914 -0.047
129 HG22 VAL 21 1HG2 VAL 21 0.542 -10.131 0.399
130 HG23 VAL 21 2HG2 VAL 21 0.108 -8.836 -0.716
131 H PHE 22 H PHE 22 -0.642 -5.141 1.454
132 HA PHE 22 HA PHE 22 -0.763 -4.908 4.348
133 HB2 PHE 22 1HB PHE 22 -0.264 -2.414 2.733
134 HB3 PHE 22 2HB PHE 22 -0.185 -2.620 4.480
135 HD1 PHE 22 HD1 PHE 22 1.497 -3.483 1.303
136 HD2 PHE 22 HD2 PHE 22 1.817 -3.231 5.539
137 HE1 PHE 22 HE1 PHE 22 3.920 -3.879 1.140
138 HE2 PHE 22 HE2 PHE 22 4.240 -3.626 5.384
139 HZ PHE 22 HZ PHE 22 5.295 -3.949 3.182
140 H THR 23 H THR 23 -2.501 -3.363 5.022
141 HA THR 23 HA THR 23 -4.826 -3.791 3.341
142 HB THR 23 HB THR 23 -4.674 -2.487 6.065
143 HG1 THR 23 HG1 THR 23 -4.084 -4.892 5.633
144 HG21 THR 23 3HG2 THR 23 -6.727 -1.863 5.120
145 HG22 THR 23 1HG2 THR 23 -7.115 -3.288 6.082
146 HG23 THR 23 2HG2 THR 23 -6.942 -3.425 4.332
147 H GLN 24 H GLN 24 -3.372 -0.987 5.005
148 HA GLN 24 HA GLN 24 -4.838 0.809 3.236
149 HB2 GLN 24 1HB GLN 24 -3.113 1.323 5.661
150 HB3 GLN 24 2HB GLN 24 -3.869 2.594 4.710
151 HG2 GLN 24 1HG GLN 24 -6.076 1.454 5.196
152 HG3 GLN 24 2HG GLN 24 -5.199 0.487 6.381
153 HE21 GLN 24 1HE2 GLN 24 -7.088 1.758 7.516
154 HE22 GLN 24 2HE2 GLN 24 -6.582 3.204 8.315
155 H ASN 25 H ASN 25 -3.673 2.668 2.276
156 HA ASN 25 HA ASN 25 -1.526 1.770 0.667
157 HB2 ASN 25 1HB ASN 25 -3.331 3.679 0.311
158 HB3 ASN 25 2HB ASN 25 -2.060 4.690 0.993
159 HD21 ASN 25 1HD2 ASN 25 -1.375 5.793 -0.729
160 HD22 ASN 25 2HD2 ASN 25 -0.757 5.083 -2.178
161 H SER 26 H SER 26 -1.592 4.417 3.061
162 HA SER 26 HA SER 26 0.952 5.192 3.216
163 HB2 SER 26 1HB SER 26 -1.008 5.770 4.789
164 HB3 SER 26 2HB SER 26 -0.433 4.431 5.782
165 HG SER 26 HG SER 26 0.421 6.837 5.922
166 H HIS 27 H HIS 27 -0.246 2.255 4.829
167 HA HIS 27 HA HIS 27 2.098 1.388 5.997
168 HB2 HIS 27 1HB HIS 27 -0.059 -0.310 4.724
169 HB3 HIS 27 2HB HIS 27 1.150 -0.890 5.865
170 HD1 HIS 27 HD1 HIS 27 -0.788 -1.586 7.477
171 HD2 HIS 27 HD2 HIS 27 -0.531 2.492 6.722
172 HE1 HIS 27 HE1 HIS 27 -2.222 -0.486 9.227
173 H LEU 28 H LEU 28 0.944 0.780 2.696
174 HA LEU 28 HA LEU 28 3.289 -0.722 1.983
175 HB2 LEU 28 1HB LEU 28 1.335 -1.341 0.846
176 HB3 LEU 28 2HB LEU 28 0.924 0.330 0.468
177 HG LEU 28 HG LEU 28 2.862 0.381 -1.100
178 HD11 LEU 28 1HD1 LEU 28 4.148 -1.435 -0.054
179 HD12 LEU 28 2HD1 LEU 28 3.893 -1.700 -1.779
180 HD13 LEU 28 3HD1 LEU 28 2.932 -2.591 -0.599
181 HD21 LEU 28 3HD2 LEU 28 1.538 -1.746 -2.391
182 HD22 LEU 28 1HD2 LEU 28 1.264 -0.015 -2.585
183 HD23 LEU 28 2HD2 LEU 28 0.338 -0.925 -1.392
184 H THR 29 H THR 29 1.956 2.375 0.811
185 HA THR 29 HA THR 29 4.054 3.220 -0.734
186 HB THR 29 HB THR 29 2.726 5.235 1.034
187 HG1 THR 29 HG1 THR 29 1.461 3.759 -1.053
188 HG21 THR 29 3HG2 THR 29 2.551 6.406 -1.197
189 HG22 THR 29 1HG2 THR 29 3.521 5.096 -1.871
190 HG23 THR 29 2HG2 THR 29 4.191 6.133 -0.611
191 H ASN 30 H ASN 30 3.850 3.135 2.745
192 HA ASN 30 HA ASN 30 6.246 4.732 3.095
193 HB2 ASN 30 1HB ASN 30 4.475 3.269 5.061
194 HB3 ASN 30 2HB ASN 30 5.898 4.197 5.526
195 HD21 ASN 30 1HD2 ASN 30 3.163 4.629 6.299
196 HD22 ASN 30 2HD2 ASN 30 2.734 6.212 5.757
197 H HIS 31 H HIS 31 5.247 1.357 3.361
198 HA HIS 31 HA HIS 31 7.487 0.238 4.517
199 HB2 HIS 31 1HB HIS 31 5.812 -1.311 4.215
200 HB3 HIS 31 2HB HIS 31 5.437 -0.748 2.589
201 HD1 HIS 31 HD1 HIS 31 7.930 -2.890 4.444
202 HD2 HIS 31 HD2 HIS 31 6.676 -2.126 0.557
203 HE1 HIS 31 HE1 HIS 31 9.054 -4.631 3.020
204 H TRP 32 H TRP 32 7.003 1.280 1.197
205 HA TRP 32 HA TRP 32 9.207 0.090 -0.012
206 HB2 TRP 32 1HB TRP 32 7.550 2.499 -0.563
207 HB3 TRP 32 2HB TRP 32 9.090 2.368 -1.408
208 HD1 TRP 32 HD1 TRP 32 5.962 0.130 -0.835
209 HE1 TRP 32 HE1 TRP 32 5.529 -1.184 -3.006
210 HE3 TRP 32 HE3 TRP 32 9.943 1.777 -3.588
211 HZ2 TRP 32 HZ2 TRP 32 6.718 -1.483 -5.549
212 HZ3 TRP 32 HZ3 TRP 32 10.223 0.928 -5.881
213 HH2 TRP 32 HH2 TRP 32 8.643 -0.668 -6.839
214 H ARG 33 H ARG 33 8.989 2.976 1.974
215 HA ARG 33 HA ARG 33 11.456 4.137 1.446
216 HB2 ARG 33 1HB ARG 33 9.830 4.035 3.986
217 HB3 ARG 33 2HB ARG 33 11.289 5.004 3.823
218 HG2 ARG 33 1HG ARG 33 10.303 6.376 2.165
219 HG3 ARG 33 2HG ARG 33 8.928 5.285 1.987
220 HD2 ARG 33 1HD ARG 33 8.264 7.216 3.273
221 HD3 ARG 33 2HD ARG 33 8.268 5.791 4.310
222 HE ARG 33 HE ARG 33 10.003 6.701 5.522
223 HH11 ARG 33 1HH1 ARG 33 9.466 8.562 2.629
224 HH12 ARG 33 2HH1 ARG 33 10.495 9.866 3.120
225 HH21 ARG 33 1HH2 ARG 33 11.361 8.412 6.180
226 HH22 ARG 33 2HH2 ARG 33 11.573 9.780 5.140
227 H ILE 34 H ILE 34 10.634 1.414 3.507
228 HA ILE 34 HA ILE 34 13.037 1.180 4.919
229 HB ILE 34 HB ILE 34 12.354 -0.946 5.566
230 HG12 ILE 34 1HG1 ILE 34 10.465 -2.066 4.042
231 HG13 ILE 34 2HG1 ILE 34 11.263 -1.108 2.800
232 HG21 ILE 34 1HG2 ILE 34 10.461 -0.276 6.512
233 HG22 ILE 34 2HG2 ILE 34 10.428 1.084 5.391
234 HG23 ILE 34 3HG2 ILE 34 9.597 -0.417 4.982
235 HD11 ILE 34 3HD1 ILE 34 13.075 -2.425 2.771
236 HD12 ILE 34 1HD1 ILE 34 13.058 -2.668 4.518
237 HD13 ILE 34 2HD1 ILE 34 11.980 -3.609 3.485
238 H HIS 35 H HIS 35 12.222 0.361 1.646
239 HA HIS 35 HA HIS 35 14.461 -1.380 1.212
240 HB2 HIS 35 1HB HIS 35 12.564 -0.003 -0.695
241 HB3 HIS 35 2HB HIS 35 13.830 -1.113 -1.210
242 HD1 HIS 35 HD1 HIS 35 13.488 -3.336 0.867
243 HD2 HIS 35 HD2 HIS 35 10.323 -1.488 -1.091
244 HE1 HIS 35 HE1 HIS 35 11.584 -4.976 0.970
245 H THR 36 H THR 36 13.812 2.037 0.866
246 HA THR 36 HA THR 36 16.178 2.594 -0.663
247 HB THR 36 HB THR 36 15.652 4.980 -0.180
248 HG1 THR 36 HG1 THR 36 13.468 5.221 0.841
249 HG21 THR 36 3HG2 THR 36 13.993 5.071 -1.751
250 HG22 THR 36 1HG2 THR 36 13.060 3.776 -1.002
251 HG23 THR 36 2HG2 THR 36 14.489 3.392 -1.961
252 H GLY 37 H GLY 37 15.187 3.297 2.696
253 HA2 GLY 37 1HA GLY 37 18.010 3.789 3.354
254 HA3 GLY 37 2HA GLY 37 16.630 4.292 4.320
255 H GLU 38 H GLU 38 18.339 3.236 5.866
256 HA GLU 38 HA GLU 38 19.061 1.425 7.100
257 HB2 GLU 38 1HB GLU 38 16.056 1.226 7.038
258 HB3 GLU 38 2HB GLU 38 17.039 0.178 8.051
259 HG2 GLU 38 1HG GLU 38 16.908 3.181 8.179
260 HG3 GLU 38 2HG GLU 38 16.210 2.045 9.332
261 H LYS 39 H LYS 39 19.043 0.918 4.221
262 HA LYS 39 HA LYS 39 17.978 -1.468 3.398
263 HB2 LYS 39 1HB LYS 39 19.108 -0.467 1.686
264 HB3 LYS 39 2HB LYS 39 20.433 0.052 2.720
265 HG2 LYS 39 1HG LYS 39 21.497 -2.029 2.593
266 HG3 LYS 39 2HG LYS 39 20.049 -2.828 1.977
267 HD2 LYS 39 1HD LYS 39 21.215 -2.612 0.026
268 HD3 LYS 39 2HD LYS 39 20.361 -1.067 0.020
269 HE2 LYS 39 1HE LYS 39 23.109 -1.415 1.195
270 HE3 LYS 39 2HE LYS 39 22.839 -0.984 -0.493
271 HZ1 LYS 39 3HZ LYS 39 22.871 1.099 0.279
272 HZ2 LYS 39 1HZ LYS 39 22.590 0.634 1.881
273 HZ3 LYS 39 2HZ LYS 39 21.293 0.793 0.807
274 HA PRO 40 HA PRO 40 21.749 -3.889 5.206
275 HB2 PRO 40 1HB PRO 40 23.402 -2.542 6.886
276 HB3 PRO 40 2HB PRO 40 23.651 -2.603 5.137
277 HG2 PRO 40 1HG PRO 40 22.411 -0.445 6.801
278 HG3 PRO 40 2HG PRO 40 23.556 -0.301 5.454
279 HD2 PRO 40 1HD PRO 40 20.897 0.120 5.158
280 HD3 PRO 40 2HD PRO 40 21.908 -0.551 3.862
281 H SER 41 H SER 41 22.350 -4.710 7.442
282 HA SER 41 HA SER 41 20.039 -4.339 9.191
283 HB2 SER 41 1HB SER 41 22.226 -6.434 9.254
284 HB3 SER 41 2HB SER 41 20.798 -6.410 10.290
285 HG SER 41 HG SER 41 19.692 -6.308 8.067
286 H GLY 42 H GLY 42 20.401 -4.321 11.558
287 HA2 GLY 42 1HA GLY 42 22.947 -3.554 12.605
288 HA3 GLY 42 2HA GLY 42 21.889 -2.165 12.402
289 HA PRO 43 HA PRO 43 21.108 -4.531 16.458
290 HB2 PRO 43 1HB PRO 43 22.294 -2.784 18.165
291 HB3 PRO 43 2HB PRO 43 23.151 -4.149 17.439
292 HG2 PRO 43 1HG PRO 43 23.149 -1.267 16.628
293 HG3 PRO 43 2HG PRO 43 24.510 -2.398 16.737
294 HD2 PRO 43 1HD PRO 43 23.321 -1.771 14.387
295 HD3 PRO 43 2HD PRO 43 24.030 -3.368 14.702
296 H SER 44 H SER 44 19.474 -3.974 17.886
297 HA SER 44 HA SER 44 17.769 -1.836 17.077
298 HB2 SER 44 1HB SER 44 17.674 -3.918 19.236
299 HB3 SER 44 2HB SER 44 16.527 -2.578 19.260
300 HG SER 44 HG SER 44 16.879 -3.971 16.863
301 H SER 45 H SER 45 16.847 -0.275 18.698
302 HA SER 45 HA SER 45 18.926 0.704 20.539
303 HB2 SER 45 1HB SER 45 18.686 1.996 18.319
304 HB3 SER 45 2HB SER 45 17.153 2.571 18.974
305 HG SER 45 HG SER 45 19.472 3.618 19.405
306 H GLY 46 H GLY 46 18.058 2.238 22.187
307 HA2 GLY 46 1HA GLY 46 16.218 1.189 23.847
308 HA3 GLY 46 2HA GLY 46 16.460 2.925 23.719