Result table
| image | mrblock_id | pdb_id | bmrb_id | cing | stage | position | program | type |
|
|
513392 | 2kzy RC | 17023 | cing | 1-original | 4 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name
Start of MODEL 1
1 H1 GLY 1 1HT GLY 1 -44.891 -5.754 11.216
2 H2 GLY 1 2HT GLY 1 -44.571 -7.154 12.125
3 H3 GLY 1 3HT GLY 1 -45.605 -7.231 10.779
4 HA2 GLY 1 2HA GLY 1 -43.702 -6.573 9.348
5 HA3 GLY 1 1HA GLY 1 -42.677 -6.761 10.772
6 H SER 2 H SER 2 -45.122 -8.511 8.850
7 HA SER 2 HA SER 2 -44.194 -11.091 9.799
8 HB2 SER 2 2HB SER 2 -46.128 -10.531 7.546
9 HB3 SER 2 1HB SER 2 -45.959 -12.019 8.474
10 HG SER 2 HG SER 2 -47.458 -9.887 9.003
11 H MET 3 H MET 3 -44.361 -9.448 6.627
12 HA MET 3 HA MET 3 -42.770 -11.404 5.293
13 HB2 MET 3 2HB MET 3 -42.667 -9.717 3.457
14 HB3 MET 3 1HB MET 3 -44.308 -10.043 4.009
15 HG2 MET 3 2HG MET 3 -44.472 -7.984 5.144
16 HG3 MET 3 1HG MET 3 -42.723 -7.764 5.187
17 HE1 MET 3 3HE MET 3 -42.912 -5.249 4.264
18 HE2 MET 3 1HE MET 3 -44.636 -5.568 4.506
19 HE3 MET 3 2HE MET 3 -44.075 -4.827 3.009
20 H ALA 4 H ALA 4 -40.645 -11.104 4.391
21 HA ALA 4 HA ALA 4 -38.931 -9.211 5.894
22 HB1 ALA 4 1HB ALA 4 -38.555 -12.162 5.404
23 HB2 ALA 4 2HB ALA 4 -38.457 -11.276 6.926
24 HB3 ALA 4 3HB ALA 4 -37.181 -11.103 5.722
25 H GLN 5 H GLN 5 -40.105 -8.953 3.219
26 HA GLN 5 HA GLN 5 -37.682 -9.113 1.524
27 HB2 GLN 5 2HB GLN 5 -39.269 -8.967 -0.397
28 HB3 GLN 5 1HB GLN 5 -39.514 -10.402 0.594
29 HG2 GLN 5 2HG GLN 5 -41.473 -9.529 1.586
30 HG3 GLN 5 1HG GLN 5 -41.085 -7.878 1.106
31 HE21 GLN 5 1HE2 GLN 5 -42.466 -7.205 -0.529
32 HE22 GLN 5 2HE2 GLN 5 -43.025 -8.190 -1.804
33 H GLU 6 H GLU 6 -38.172 -6.996 3.469
34 HA GLU 6 HA GLU 6 -38.701 -4.675 1.716
35 HB2 GLU 6 2HB GLU 6 -39.933 -5.051 3.974
36 HB3 GLU 6 1HB GLU 6 -38.417 -4.522 4.704
37 HG2 GLU 6 2HG GLU 6 -38.522 -2.489 3.186
38 HG3 GLU 6 1HG GLU 6 -40.161 -2.983 2.768
39 H THR 7 H THR 7 -36.763 -4.332 0.706
40 HA THR 7 HA THR 7 -34.323 -4.139 2.339
41 HB THR 7 HB THR 7 -34.481 -3.836 -0.655
42 HG1 THR 7 1HG THR 7 -34.287 -6.222 0.868
43 HG21 THR 7 3HG2 THR 7 -32.391 -3.284 0.669
44 HG22 THR 7 1HG2 THR 7 -32.182 -4.522 -0.571
45 HG23 THR 7 2HG2 THR 7 -32.323 -4.986 1.126
46 H ASN 8 H ASN 8 -33.655 -2.214 3.043
47 HA ASN 8 HA ASN 8 -34.575 0.218 1.621
48 HB2 ASN 8 2HB ASN 8 -34.325 1.384 3.808
49 HB3 ASN 8 1HB ASN 8 -35.546 0.118 3.837
50 HD21 ASN 8 1HD2 ASN 8 -32.746 1.279 5.422
51 HD22 ASN 8 2HD2 ASN 8 -32.444 -0.095 6.387
52 H GLN 9 H GLN 9 -31.876 -1.216 3.452
53 HA GLN 9 HA GLN 9 -30.003 0.385 1.838
54 HB2 GLN 9 2HB GLN 9 -30.080 0.224 4.853
55 HB3 GLN 9 1HB GLN 9 -28.631 0.693 3.963
56 HG2 GLN 9 2HG GLN 9 -29.890 2.521 2.880
57 HG3 GLN 9 1HG GLN 9 -31.331 2.062 3.787
58 HE21 GLN 9 1HE2 GLN 9 -30.961 2.021 6.291
59 HE22 GLN 9 2HE2 GLN 9 -29.985 3.266 6.929
60 H THR 10 H THR 10 -27.886 -0.553 1.665
61 HA THR 10 HA THR 10 -27.924 -3.461 2.053
62 HB THR 10 HB THR 10 -27.373 -2.702 -0.191
63 HG1 THR 10 1HG THR 10 -25.018 -3.596 1.113
64 HG21 THR 10 3HG2 THR 10 -26.373 -0.663 -0.307
65 HG22 THR 10 1HG2 THR 10 -24.873 -1.573 -0.131
66 HG23 THR 10 2HG2 THR 10 -25.623 -0.829 1.279
67 HA PRO 11 HA PRO 11 -24.894 -2.981 5.308
68 HB2 PRO 11 2HB PRO 11 -24.392 -5.572 5.839
69 HB3 PRO 11 1HB PRO 11 -25.983 -4.855 6.169
70 HG2 PRO 11 2HG PRO 11 -25.155 -6.695 4.013
71 HG3 PRO 11 1HG PRO 11 -26.729 -6.503 4.796
72 HD2 PRO 11 2HD PRO 11 -25.920 -5.410 2.286
73 HD3 PRO 11 1HD PRO 11 -27.435 -5.088 3.157
74 H GLY 12 H GLY 12 -22.615 -3.374 5.785
75 HA2 GLY 12 2HA GLY 12 -20.406 -3.923 5.291
76 HA3 GLY 12 1HA GLY 12 -20.954 -4.655 3.784
77 HA PRO 13 HA PRO 13 -20.711 -0.150 2.347
78 HB2 PRO 13 2HB PRO 13 -20.669 1.937 4.102
79 HB3 PRO 13 1HB PRO 13 -22.180 1.192 3.537
80 HG2 PRO 13 2HG PRO 13 -20.716 0.801 6.100
81 HG3 PRO 13 1HG PRO 13 -22.460 0.933 5.803
82 HD2 PRO 13 2HD PRO 13 -21.184 -1.463 6.201
83 HD3 PRO 13 1HD PRO 13 -22.664 -1.298 5.231
84 H MET 14 H MET 14 -18.566 -1.090 2.005
85 HA MET 14 HA MET 14 -16.376 -0.500 3.750
86 HB2 MET 14 2HB MET 14 -16.755 -1.809 1.106
87 HB3 MET 14 1HB MET 14 -15.164 -1.103 1.385
88 HG2 MET 14 2HG MET 14 -16.490 -2.922 3.406
89 HG3 MET 14 1HG MET 14 -15.468 -3.542 2.113
90 HE1 MET 14 3HE MET 14 -14.737 -3.582 5.640
91 HE2 MET 14 1HE MET 14 -15.955 -2.337 5.329
92 HE3 MET 14 2HE MET 14 -14.413 -1.902 6.061
93 H LEU 15 H LEU 15 -17.147 1.879 3.812
94 HA LEU 15 HA LEU 15 -16.455 3.542 1.576
95 HB2 LEU 15 2HB LEU 15 -17.745 3.857 4.159
96 HB3 LEU 15 1HB LEU 15 -16.557 5.132 3.922
97 HG LEU 15 HG LEU 15 -18.786 5.796 3.084
98 HD11 LEU 15 1HD1 LEU 15 -16.927 5.350 0.744
99 HD12 LEU 15 2HD1 LEU 15 -16.632 6.563 1.990
100 HD13 LEU 15 3HD1 LEU 15 -18.071 6.671 0.979
101 HD21 LEU 15 3HD2 LEU 15 -19.432 3.403 2.425
102 HD22 LEU 15 1HD2 LEU 15 -18.491 3.664 0.955
103 HD23 LEU 15 2HD2 LEU 15 -19.897 4.673 1.294
104 H CYS 16 H CYS 16 -14.655 4.851 1.321
105 HA CYS 16 HA CYS 16 -12.163 3.872 1.993
106 HB2 CYS 16 2HB CYS 16 -12.772 5.663 0.276
107 HB3 CYS 16 1HB CYS 16 -12.645 6.821 1.606
108 H SER 17 H SER 17 -10.905 3.828 3.720
109 HA SER 17 HA SER 17 -11.761 4.743 6.252
110 HB2 SER 17 2HB SER 17 -9.113 3.714 5.245
111 HB3 SER 17 1HB SER 17 -9.350 4.209 6.923
112 HG SER 17 HG SER 17 -9.847 1.888 6.028
113 H THR 18 H THR 18 -9.729 6.252 3.803
114 HA THR 18 HA THR 18 -8.650 8.259 5.547
115 HB THR 18 HB THR 18 -7.881 9.360 3.484
116 HG1 THR 18 1HG THR 18 -9.195 9.051 1.883
117 HG21 THR 18 3HG2 THR 18 -7.519 6.350 3.411
118 HG22 THR 18 1HG2 THR 18 -6.627 7.445 4.468
119 HG23 THR 18 2HG2 THR 18 -6.429 7.553 2.720
120 H GLY 19 H GLY 19 -11.708 7.922 3.948
121 HA2 GLY 19 2HA GLY 19 -13.582 9.247 4.294
122 HA3 GLY 19 1HA GLY 19 -12.560 10.458 5.056
123 H CYS 20 H CYS 20 -12.314 9.043 1.767
124 HA CYS 20 HA CYS 20 -12.205 11.747 0.681
125 HB2 CYS 20 2HB CYS 20 -11.606 10.706 -1.444
126 HB3 CYS 20 1HB CYS 20 -10.594 10.086 -0.145
127 H GLY 21 H GLY 21 -14.565 9.214 1.033
128 HA2 GLY 21 2HA GLY 21 -16.894 9.677 0.835
129 HA3 GLY 21 1HA GLY 21 -16.527 10.892 -0.383
130 H PHE 22 H PHE 22 -14.753 8.057 -0.998
131 HA PHE 22 HA PHE 22 -16.744 7.173 -2.987
132 HB2 PHE 22 2HB PHE 22 -13.716 7.088 -3.048
133 HB3 PHE 22 1HB PHE 22 -14.759 6.325 -4.253
134 HD1 PHE 22 1HD PHE 22 -14.085 9.625 -2.616
135 HD2 PHE 22 2HD PHE 22 -15.527 7.570 -6.100
136 HE1 PHE 22 1HE PHE 22 -14.252 11.787 -3.820
137 HE2 PHE 22 2HE PHE 22 -15.701 9.734 -7.302
138 HZ PHE 22 HZ PHE 22 -15.064 11.843 -6.162
139 H TYR 23 H TYR 23 -16.730 4.882 -3.502
140 HA TYR 23 HA TYR 23 -16.782 3.232 -1.182
141 HB2 TYR 23 2HB TYR 23 -18.120 3.044 -3.409
142 HB3 TYR 23 1HB TYR 23 -16.715 2.148 -3.986
143 HD1 TYR 23 1HD TYR 23 -18.933 2.278 -0.937
144 HD2 TYR 23 2HD TYR 23 -16.744 -0.151 -3.723
145 HE1 TYR 23 1HE TYR 23 -19.794 0.229 0.168
146 HE2 TYR 23 2HE TYR 23 -17.597 -2.197 -2.611
147 HH TYR 23 HH TYR 23 -19.032 -2.204 0.392
148 H GLY 24 H GLY 24 -15.480 1.533 -0.578
149 HA2 GLY 24 2HA GLY 24 -12.763 1.453 -1.776
150 HA3 GLY 24 1HA GLY 24 -13.065 1.284 -0.048
151 H ASN 25 H ASN 25 -11.660 -0.730 -0.861
152 HA ASN 25 HA ASN 25 -13.572 -2.953 -1.308
153 HB2 ASN 25 2HB ASN 25 -11.811 -2.271 -3.199
154 HB3 ASN 25 1HB ASN 25 -10.735 -3.250 -2.207
155 HD21 ASN 25 1HD2 ASN 25 -10.616 -5.164 -3.458
156 HD22 ASN 25 2HD2 ASN 25 -11.979 -6.096 -3.881
157 HA PRO 26 HA PRO 26 -11.655 -4.389 2.457
158 HB2 PRO 26 2HB PRO 26 -12.729 -6.883 2.624
159 HB3 PRO 26 1HB PRO 26 -13.629 -5.395 2.973
160 HG2 PRO 26 2HG PRO 26 -13.736 -7.151 0.599
161 HG3 PRO 26 1HG PRO 26 -15.010 -6.179 1.347
162 HD2 PRO 26 2HD PRO 26 -13.564 -5.475 -0.956
163 HD3 PRO 26 1HD PRO 26 -14.547 -4.371 0.029
164 H ARG 27 H ARG 27 -11.257 -6.087 -0.592
165 HA ARG 27 HA ARG 27 -9.273 -7.957 0.311
166 HB2 ARG 27 2HB ARG 27 -10.159 -6.948 -2.386
167 HB3 ARG 27 1HB ARG 27 -8.719 -7.954 -2.224
168 HG2 ARG 27 2HG ARG 27 -10.325 -9.493 -0.794
169 HG3 ARG 27 1HG ARG 27 -11.589 -8.658 -1.701
170 HD2 ARG 27 2HD ARG 27 -9.254 -10.188 -2.879
171 HD3 ARG 27 1HD ARG 27 -10.936 -10.703 -2.883
172 HE ARG 27 HE ARG 27 -11.074 -8.312 -4.135
173 HH11 ARG 27 1HH2 ARG 27 -8.965 -11.087 -4.656
174 HH12 ARG 27 2HH2 ARG 27 -8.778 -10.751 -6.341
175 HH21 ARG 27 1HH1 ARG 27 -10.786 -7.935 -6.327
176 HH22 ARG 27 2HH1 ARG 27 -9.793 -8.988 -7.278
177 H THR 28 H THR 28 -9.318 -4.662 -0.906
178 HA THR 28 HA THR 28 -6.437 -4.421 -1.159
179 HB THR 28 HB THR 28 -6.892 -2.039 -1.527
180 HG1 THR 28 1HG THR 28 -8.442 -1.420 -0.212
181 HG21 THR 28 3HG2 THR 28 -8.628 -4.061 -2.896
182 HG22 THR 28 1HG2 THR 28 -7.293 -3.109 -3.542
183 HG23 THR 28 2HG2 THR 28 -8.858 -2.351 -3.263
184 H ASN 29 H ASN 29 -6.147 -1.890 0.318
185 HA ASN 29 HA ASN 29 -5.927 -3.011 3.008
186 HB2 ASN 29 2HB ASN 29 -4.571 -0.912 1.446
187 HB3 ASN 29 1HB ASN 29 -4.868 -0.455 3.125
188 HD21 ASN 29 1HD2 ASN 29 -4.538 -2.876 4.477
189 HD22 ASN 29 2HD2 ASN 29 -2.947 -3.446 4.256
190 H GLY 30 H GLY 30 -8.596 -2.118 1.831
191 HA2 GLY 30 2HA GLY 30 -10.506 -1.307 2.838
192 HA3 GLY 30 1HA GLY 30 -9.516 -0.647 4.137
193 H MET 31 H MET 31 -8.301 0.230 1.064
194 HA MET 31 HA MET 31 -9.579 2.890 1.244
195 HB2 MET 31 2HB MET 31 -6.792 1.973 0.641
196 HB3 MET 31 1HB MET 31 -7.375 3.449 -0.129
197 HG2 MET 31 2HG MET 31 -6.324 4.103 1.921
198 HG3 MET 31 1HG MET 31 -8.058 4.254 2.182
199 HE1 MET 31 3HE MET 31 -4.883 3.254 3.445
200 HE2 MET 31 1HE MET 31 -5.000 1.737 2.544
201 HE3 MET 31 2HE MET 31 -5.014 1.723 4.306
202 H CYS 32 H CYS 32 -9.969 3.985 -0.769
203 HA CYS 32 HA CYS 32 -11.078 2.291 -2.765
204 HB2 CYS 32 2HB CYS 32 -11.786 4.338 -3.855
205 HB3 CYS 32 1HB CYS 32 -12.036 4.504 -2.118
206 H SER 33 H SER 33 -10.373 3.716 -5.170
207 HA SER 33 HA SER 33 -7.983 2.281 -5.835
208 HB2 SER 33 2HB SER 33 -10.124 3.090 -7.268
209 HB3 SER 33 1HB SER 33 -8.967 4.335 -7.730
210 HG SER 33 HG SER 33 -8.517 2.726 -9.093
211 H VAL 34 H VAL 34 -8.728 5.773 -5.643
212 HA VAL 34 HA VAL 34 -6.117 6.617 -6.381
213 HB VAL 34 HB VAL 34 -8.106 8.235 -4.767
214 HG11 VAL 34 1HG1 VAL 34 -7.018 10.121 -5.710
215 HG12 VAL 34 2HG1 VAL 34 -6.201 9.141 -6.927
216 HG13 VAL 34 3HG1 VAL 34 -5.707 9.040 -5.236
217 HG21 VAL 34 3HG2 VAL 34 -9.393 7.425 -6.622
218 HG22 VAL 34 1HG2 VAL 34 -8.034 7.607 -7.732
219 HG23 VAL 34 2HG2 VAL 34 -8.847 9.034 -7.091
220 H CYS 35 H CYS 35 -7.707 6.690 -3.177
221 HA CYS 35 HA CYS 35 -5.520 7.547 -1.677
222 HB2 CYS 35 2HB CYS 35 -7.799 5.757 -0.802
223 HB3 CYS 35 1HB CYS 35 -6.704 6.623 0.277
224 H TYR 36 H TYR 36 -6.392 4.257 -2.668
225 HA TYR 36 HA TYR 36 -4.632 2.860 -0.948
226 HB2 TYR 36 2HB TYR 36 -6.450 1.747 -2.153
227 HB3 TYR 36 1HB TYR 36 -5.655 2.069 -3.693
228 HD1 TYR 36 1HD TYR 36 -4.489 0.753 -0.354
229 HD2 TYR 36 2HD TYR 36 -4.756 0.128 -4.597
230 HE1 TYR 36 1HE TYR 36 -3.209 -1.358 -0.124
231 HE2 TYR 36 2HE TYR 36 -3.479 -1.984 -4.366
232 HH TYR 36 HH TYR 36 -3.138 -3.712 -2.308
233 H LYS 37 H LYS 37 -4.086 4.494 -4.018
234 HA LYS 37 HA LYS 37 -1.514 3.316 -4.496
235 HB2 LYS 37 2HB LYS 37 -3.216 4.496 -6.130
236 HB3 LYS 37 1HB LYS 37 -2.351 5.953 -5.646
237 HG2 LYS 37 2HG LYS 37 -0.205 4.835 -6.275
238 HG3 LYS 37 1HG LYS 37 -1.140 3.462 -6.873
239 HD2 LYS 37 2HD LYS 37 -2.089 4.703 -8.624
240 HD3 LYS 37 1HD LYS 37 -1.754 6.246 -7.838
241 HE2 LYS 37 2HE LYS 37 0.618 6.016 -8.257
242 HE3 LYS 37 1HE LYS 37 0.394 4.379 -8.871
243 HZ1 LYS 37 3HZ LYS 37 0.584 6.291 -10.541
244 HZ2 LYS 37 1HZ LYS 37 -1.013 6.662 -10.107
245 HZ3 LYS 37 2HZ LYS 37 -0.647 5.144 -10.777
246 H GLU 38 H GLU 38 -2.640 6.486 -3.315
247 HA GLU 38 HA GLU 38 -0.089 7.625 -2.892
248 HB2 GLU 38 2HB GLU 38 -2.623 8.262 -1.359
249 HB3 GLU 38 1HB GLU 38 -1.229 9.315 -1.592
250 HG2 GLU 38 2HG GLU 38 -1.689 9.059 -4.123
251 HG3 GLU 38 1HG GLU 38 -3.267 8.425 -3.639
252 H HIS 39 H HIS 39 -2.243 5.815 -0.722
253 HA HIS 39 HA HIS 39 -0.743 6.125 1.649
254 HB2 HIS 39 2HB HIS 39 -3.121 5.356 1.500
255 HB3 HIS 39 1HB HIS 39 -2.541 3.808 0.889
256 HD1 HIS 39 1HD HIS 39 -2.413 5.982 3.999
257 HD2 HIS 39 2HD HIS 39 -1.585 2.061 2.854
258 HE1 HIS 39 1HE HIS 39 -1.967 4.691 6.129
259 HE2 HIS 39 2HE HIS 39 -1.471 2.298 5.450
260 H LEU 40 H LEU 40 -0.763 3.460 -0.736
261 HA LEU 40 HA LEU 40 1.137 1.857 0.601
262 HB2 LEU 40 2HB LEU 40 -0.471 1.507 -1.576
263 HB3 LEU 40 1HB LEU 40 1.104 1.662 -2.357
264 HG LEU 40 HG LEU 40 1.985 -0.087 -0.777
265 HD11 LEU 40 1HD1 LEU 40 -0.855 0.069 0.165
266 HD12 LEU 40 2HD1 LEU 40 0.623 -0.194 1.090
267 HD13 LEU 40 3HD1 LEU 40 -0.076 -1.515 0.155
268 HD21 LEU 40 3HD2 LEU 40 -0.396 -0.876 -2.488
269 HD22 LEU 40 1HD2 LEU 40 0.864 -1.976 -1.931
270 HD23 LEU 40 2HD2 LEU 40 1.262 -0.675 -3.053
271 H GLN 41 H GLN 41 1.530 4.569 -1.590
272 HA GLN 41 HA GLN 41 4.254 4.147 -2.281
273 HB2 GLN 41 2HB GLN 41 2.643 5.736 -3.413
274 HB3 GLN 41 1HB GLN 41 2.861 6.822 -2.042
275 HG2 GLN 41 2HG GLN 41 4.451 7.585 -3.609
276 HG3 GLN 41 1HG GLN 41 5.398 6.579 -2.512
277 HE21 GLN 41 1HE2 GLN 41 4.471 7.015 -5.801
278 HE22 GLN 41 2HE2 GLN 41 5.149 5.573 -6.407
279 H ARG 42 H ARG 42 2.680 5.887 0.373
280 HA ARG 42 HA ARG 42 5.105 6.909 1.505
281 HB2 ARG 42 2HB ARG 42 2.411 7.422 1.846
282 HB3 ARG 42 1HB ARG 42 2.815 6.593 3.345
283 HG2 ARG 42 2HG ARG 42 3.246 8.877 3.802
284 HG3 ARG 42 1HG ARG 42 4.839 8.194 3.471
285 HD2 ARG 42 2HD ARG 42 4.981 9.198 1.370
286 HD3 ARG 42 1HD ARG 42 3.235 9.338 1.204
287 HE ARG 42 HE ARG 42 4.029 10.952 3.362
288 HH11 ARG 42 1HH2 ARG 42 4.500 10.831 -0.123
289 HH12 ARG 42 2HH2 ARG 42 4.610 12.550 -0.269
290 HH21 ARG 42 1HH1 ARG 42 4.186 13.173 3.108
291 HH22 ARG 42 2HH1 ARG 42 4.432 13.862 1.538
292 H GLN 43 H GLN 43 3.236 3.960 1.920
293 HA GLN 43 HA GLN 43 4.546 3.125 4.339
294 HB2 GLN 43 2HB GLN 43 2.231 2.398 3.322
295 HB3 GLN 43 1HB GLN 43 3.204 1.208 2.460
296 HG2 GLN 43 2HG GLN 43 3.990 0.234 4.488
297 HG3 GLN 43 1HG GLN 43 3.407 1.589 5.452
298 HE21 GLN 43 1HE2 GLN 43 0.928 1.875 5.447
299 HE22 GLN 43 2HE2 GLN 43 -0.019 0.470 5.361
300 H GLN 44 H GLN 44 4.937 2.461 0.889
301 HA GLN 44 HA GLN 44 6.898 0.420 1.134
302 HB2 GLN 44 2HB GLN 44 5.499 1.021 -0.916
303 HB3 GLN 44 1HB GLN 44 6.658 2.320 -1.193
304 HG2 GLN 44 2HG GLN 44 8.395 0.862 -1.676
305 HG3 GLN 44 1HG GLN 44 7.712 -0.444 -0.708
306 HE21 GLN 44 1HE2 GLN 44 6.485 -2.008 -1.810
307 HE22 GLN 44 2HE2 GLN 44 5.992 -1.863 -3.437
308 H ASN 45 H ASN 45 7.124 3.945 0.869
309 HA ASN 45 HA ASN 45 9.917 4.132 0.473
310 HB2 ASN 45 2HB ASN 45 8.175 5.968 0.196
311 HB3 ASN 45 1HB ASN 45 8.247 6.166 1.946
312 HD21 ASN 45 1HD2 ASN 45 9.829 6.947 -1.039
313 HD22 ASN 45 2HD2 ASN 45 11.191 7.713 -0.355
314 H SER 46 H SER 46 8.019 3.597 3.369
315 HA SER 46 HA SER 46 9.993 4.341 5.279
316 HB2 SER 46 2HB SER 46 7.487 3.946 5.666
317 HB3 SER 46 1HB SER 46 7.884 2.231 5.711
318 HG SER 46 HG SER 46 8.202 4.103 7.607
319 H GLY 47 H GLY 47 8.886 1.061 4.357
320 HA2 GLY 47 2HA GLY 47 10.217 -0.807 3.848
321 HA3 GLY 47 1HA GLY 47 11.643 0.096 4.353
322 H ARG 48 H ARG 48 11.275 0.826 6.858
323 HA ARG 48 HA ARG 48 11.159 -1.705 8.299
324 HB2 ARG 48 2HB ARG 48 12.049 1.079 9.076
325 HB3 ARG 48 1HB ARG 48 12.011 -0.276 10.206
326 HG2 ARG 48 2HG ARG 48 13.429 -0.519 7.557
327 HG3 ARG 48 1HG ARG 48 14.236 0.200 8.951
328 HD2 ARG 48 2HD ARG 48 13.550 -1.887 10.249
329 HD3 ARG 48 1HD ARG 48 13.117 -2.596 8.696
330 HE ARG 48 HE ARG 48 15.661 -1.734 8.279
331 HH11 ARG 48 1HH2 ARG 48 14.228 -3.716 10.812
332 HH12 ARG 48 2HH2 ARG 48 15.681 -4.617 11.065
333 HH21 ARG 48 1HH1 ARG 48 17.511 -2.943 8.657
334 HH22 ARG 48 2HH1 ARG 48 17.516 -4.190 9.860
335 H MET 49 H MET 49 8.807 -1.901 7.982
336 HA MET 49 HA MET 49 7.109 -0.042 9.431
337 HB2 MET 49 2HB MET 49 5.246 -1.413 8.641
338 HB3 MET 49 1HB MET 49 6.319 -1.012 7.305
339 HG2 MET 49 2HG MET 49 7.430 -3.290 7.694
340 HG3 MET 49 1HG MET 49 6.078 -3.657 8.760
341 HE1 MET 49 3HE MET 49 5.644 -5.851 6.888
342 HE2 MET 49 1HE MET 49 7.150 -5.116 6.320
343 HE3 MET 49 2HE MET 49 5.854 -5.467 5.181
344 H SER 50 H SER 50 6.780 -0.169 11.546
345 HA SER 50 HA SER 50 6.315 -2.724 12.833
346 HB2 SER 50 2HB SER 50 8.799 -1.116 13.322
347 HB3 SER 50 1HB SER 50 8.087 -2.059 14.627
348 HG SER 50 HG SER 50 9.001 -2.950 12.093
349 HA PRO 51 HA PRO 51 3.992 0.691 14.825
350 HB2 PRO 51 2HB PRO 51 1.589 -0.540 15.011
351 HB3 PRO 51 1HB PRO 51 2.160 0.195 13.501
352 HG2 PRO 51 2HG PRO 51 2.021 -2.659 14.279
353 HG3 PRO 51 1HG PRO 51 1.828 -1.906 12.688
354 HD2 PRO 51 2HD PRO 51 4.155 -3.180 13.638
355 HD3 PRO 51 1HD PRO 51 4.049 -2.129 12.210
356 H MET 52 H MET 52 5.402 0.271 16.683
357 HA MET 52 HA MET 52 3.964 -1.084 18.855
358 HB2 MET 52 2HB MET 52 5.815 -2.558 17.726
359 HB3 MET 52 1HB MET 52 6.928 -1.513 18.609
360 HG2 MET 52 2HG MET 52 6.535 -3.285 20.114
361 HG3 MET 52 1HG MET 52 5.435 -2.024 20.671
362 HE1 MET 52 3HE MET 52 4.890 -4.579 17.423
363 HE2 MET 52 1HE MET 52 4.653 -5.928 18.542
364 HE3 MET 52 2HE MET 52 6.121 -4.958 18.627
365 H GLY 53 H GLY 53 4.197 1.680 18.287
366 HA2 GLY 53 2HA GLY 53 4.424 3.559 19.651
367 HA3 GLY 53 1HA GLY 53 5.383 2.599 20.774
368 H THR 54 H THR 54 7.574 1.867 19.802
369 HA THR 54 HA THR 54 8.817 4.211 18.486
370 HB THR 54 HB THR 54 9.718 3.872 20.705
371 HG1 THR 54 1HG THR 54 11.616 4.190 19.917
372 HG21 THR 54 3HG2 THR 54 10.140 1.009 19.802
373 HG22 THR 54 1HG2 THR 54 9.116 1.568 21.125
374 HG23 THR 54 2HG2 THR 54 10.871 1.695 21.254
375 H ALA 55 H ALA 55 10.801 3.658 17.183
376 HA ALA 55 HA ALA 55 10.712 1.018 15.909
377 HB1 ALA 55 1HB ALA 55 10.818 2.191 13.646
378 HB2 ALA 55 2HB ALA 55 10.268 3.642 14.483
379 HB3 ALA 55 3HB ALA 55 9.251 2.202 14.454
380 H SER 56 H SER 56 12.692 0.311 15.260
381 HA SER 56 HA SER 56 14.995 1.907 16.018
382 HB2 SER 56 2HB SER 56 14.928 -0.501 16.527
383 HB3 SER 56 1HB SER 56 14.828 -0.864 14.807
384 HG SER 56 HG SER 56 16.963 -0.979 15.327
385 H GLY 57 H GLY 57 16.720 2.472 14.626
386 HA2 GLY 57 2HA GLY 57 17.764 2.978 12.611
387 HA3 GLY 57 1HA GLY 57 16.470 2.138 11.760
388 H SER 58 H SER 58 17.288 5.149 13.445
389 HA SER 58 HA SER 58 15.486 6.602 11.626
390 HB2 SER 58 2HB SER 58 14.442 6.113 13.950
391 HB3 SER 58 1HB SER 58 15.582 7.313 14.550
392 HG SER 58 HG SER 58 13.529 8.189 13.914
393 H ASN 59 H ASN 59 18.367 6.289 11.639
394 HA ASN 59 HA ASN 59 19.484 8.753 12.692
395 HB2 ASN 59 2HB ASN 59 20.624 6.479 11.063
396 HB3 ASN 59 1HB ASN 59 21.556 7.918 11.480
397 HD21 ASN 59 1HD2 ASN 59 20.689 4.818 12.586
398 HD22 ASN 59 2HD2 ASN 59 21.138 5.012 14.211
399 H SER 60 H SER 60 20.422 10.412 11.408
400 HA SER 60 HA SER 60 19.773 10.458 8.553
401 HB2 SER 60 2HB SER 60 17.869 11.483 9.991
402 HB3 SER 60 1HB SER 60 18.990 12.816 10.255
403 HG SER 60 HG SER 60 18.693 13.432 8.264
404 HA PRO 61 HA PRO 61 24.004 12.135 9.485
405 HB2 PRO 61 2HB PRO 61 24.448 11.321 6.664
406 HB3 PRO 61 1HB PRO 61 25.397 10.941 8.112
407 HG2 PRO 61 2HG PRO 61 23.871 9.115 6.895
408 HG3 PRO 61 1HG PRO 61 24.105 9.133 8.651
409 HD2 PRO 61 2HD PRO 61 21.729 10.020 7.058
410 HD3 PRO 61 1HD PRO 61 21.790 9.228 8.648
411 H THR 62 H THR 62 24.939 14.093 8.838
412 HA THR 62 HA THR 62 23.208 15.839 7.268
413 HB THR 62 HB THR 62 24.976 17.565 8.001
414 HG1 THR 62 1HG THR 62 26.651 16.623 8.839
415 HG21 THR 62 3HG2 THR 62 23.995 17.685 10.263
416 HG22 THR 62 1HG2 THR 62 23.379 16.043 10.082
417 HG23 THR 62 2HG2 THR 62 22.761 17.336 9.053
Start of MODEL 2
1 H1 GLY 1 1HT GLY 1 -48.658 -14.741 1.000
2 H2 GLY 1 2HT GLY 1 -47.150 -14.543 1.757
3 H3 GLY 1 3HT GLY 1 -47.387 -15.812 0.651
4 HA2 GLY 1 2HA GLY 1 -47.722 -14.193 -1.136
5 HA3 GLY 1 1HA GLY 1 -47.383 -12.909 0.024
6 H SER 2 H SER 2 -45.613 -12.432 -1.551
7 HA SER 2 HA SER 2 -43.375 -14.265 -1.666
8 HB2 SER 2 2HB SER 2 -42.284 -12.174 -2.746
9 HB3 SER 2 1HB SER 2 -43.586 -12.981 -3.614
10 HG SER 2 HG SER 2 -43.590 -10.534 -3.171
11 H MET 3 H MET 3 -41.478 -14.152 -0.536
12 HA MET 3 HA MET 3 -41.489 -12.458 1.850
13 HB2 MET 3 2HB MET 3 -39.725 -14.772 1.014
14 HB3 MET 3 1HB MET 3 -39.549 -13.882 2.527
15 HG2 MET 3 2HG MET 3 -42.155 -15.176 1.704
16 HG3 MET 3 1HG MET 3 -40.933 -16.028 2.650
17 HE1 MET 3 3HE MET 3 -44.290 -14.201 4.379
18 HE2 MET 3 1HE MET 3 -43.943 -15.067 2.875
19 HE3 MET 3 2HE MET 3 -43.903 -13.306 2.911
20 H ALA 4 H ALA 4 -41.018 -10.436 0.886
21 HA ALA 4 HA ALA 4 -38.171 -10.098 0.196
22 HB1 ALA 4 1HB ALA 4 -40.451 -8.781 -1.300
23 HB2 ALA 4 2HB ALA 4 -39.510 -10.147 -1.902
24 HB3 ALA 4 3HB ALA 4 -38.728 -8.590 -1.626
25 H GLN 5 H GLN 5 -39.676 -9.615 2.671
26 HA GLN 5 HA GLN 5 -39.323 -6.679 2.878
27 HB2 GLN 5 2HB GLN 5 -41.714 -7.705 3.113
28 HB3 GLN 5 1HB GLN 5 -41.145 -8.223 4.701
29 HG2 GLN 5 2HG GLN 5 -42.113 -6.101 5.100
30 HG3 GLN 5 1HG GLN 5 -40.380 -5.780 5.020
31 HE21 GLN 5 1HE2 GLN 5 -43.322 -5.765 2.942
32 HE22 GLN 5 2HE2 GLN 5 -42.774 -4.506 1.929
33 H GLU 6 H GLU 6 -37.309 -8.763 3.264
34 HA GLU 6 HA GLU 6 -36.928 -9.224 6.059
35 HB2 GLU 6 2HB GLU 6 -34.643 -9.950 5.375
36 HB3 GLU 6 1HB GLU 6 -35.919 -10.734 4.448
37 HG2 GLU 6 2HG GLU 6 -35.510 -9.390 2.534
38 HG3 GLU 6 1HG GLU 6 -34.569 -8.220 3.456
39 H THR 7 H THR 7 -34.558 -8.546 6.887
40 HA THR 7 HA THR 7 -34.674 -5.654 7.116
41 HB THR 7 HB THR 7 -32.630 -6.122 8.635
42 HG1 THR 7 1HG THR 7 -31.996 -8.110 8.282
43 HG21 THR 7 3HG2 THR 7 -35.129 -5.781 9.245
44 HG22 THR 7 1HG2 THR 7 -34.072 -6.516 10.451
45 HG23 THR 7 2HG2 THR 7 -35.152 -7.528 9.490
46 H ASN 8 H ASN 8 -33.592 -4.302 5.834
47 HA ASN 8 HA ASN 8 -31.398 -5.341 4.176
48 HB2 ASN 8 2HB ASN 8 -33.401 -4.032 3.234
49 HB3 ASN 8 1HB ASN 8 -32.640 -2.610 3.947
50 HD21 ASN 8 1HD2 ASN 8 -31.447 -1.523 2.380
51 HD22 ASN 8 2HD2 ASN 8 -30.515 -2.274 1.166
52 H GLN 9 H GLN 9 -32.056 -3.026 6.742
53 HA GLN 9 HA GLN 9 -29.666 -1.515 6.562
54 HB2 GLN 9 2HB GLN 9 -31.539 -2.097 8.860
55 HB3 GLN 9 1HB GLN 9 -30.140 -1.033 9.017
56 HG2 GLN 9 2HG GLN 9 -32.225 -0.654 6.860
57 HG3 GLN 9 1HG GLN 9 -32.361 0.104 8.445
58 HE21 GLN 9 1HE2 GLN 9 -30.600 1.644 9.071
59 HE22 GLN 9 2HE2 GLN 9 -29.703 2.425 7.848
60 H THR 10 H THR 10 -27.816 -2.731 6.350
61 HA THR 10 HA THR 10 -26.816 -4.000 8.759
62 HB THR 10 HB THR 10 -26.128 -6.053 7.309
63 HG1 THR 10 1HG THR 10 -28.473 -5.197 5.961
64 HG21 THR 10 3HG2 THR 10 -27.785 -7.235 8.369
65 HG22 THR 10 1HG2 THR 10 -29.053 -6.125 7.852
66 HG23 THR 10 2HG2 THR 10 -28.010 -5.702 9.210
67 HA PRO 11 HA PRO 11 -22.965 -2.373 7.323
68 HB2 PRO 11 2HB PRO 11 -21.186 -4.432 7.928
69 HB3 PRO 11 1HB PRO 11 -21.779 -3.224 9.079
70 HG2 PRO 11 2HG PRO 11 -22.662 -6.025 8.650
71 HG3 PRO 11 1HG PRO 11 -22.523 -5.096 10.153
72 HD2 PRO 11 2HD PRO 11 -24.920 -5.563 8.963
73 HD3 PRO 11 1HD PRO 11 -24.585 -4.074 9.877
74 H GLY 12 H GLY 12 -21.482 -2.421 5.575
75 HA2 GLY 12 2HA GLY 12 -20.799 -4.539 3.936
76 HA3 GLY 12 1HA GLY 12 -22.328 -3.936 3.299
77 HA PRO 13 HA PRO 13 -20.445 -0.554 1.163
78 HB2 PRO 13 2HB PRO 13 -21.237 1.821 2.370
79 HB3 PRO 13 1HB PRO 13 -22.224 0.877 1.235
80 HG2 PRO 13 2HG PRO 13 -22.295 0.930 4.213
81 HG3 PRO 13 1HG PRO 13 -23.635 0.884 3.051
82 HD2 PRO 13 2HD PRO 13 -22.862 -1.329 4.360
83 HD3 PRO 13 1HD PRO 13 -23.401 -1.409 2.668
84 H MET 14 H MET 14 -18.318 -1.231 1.887
85 HA MET 14 HA MET 14 -17.027 -0.019 4.139
86 HB2 MET 14 2HB MET 14 -16.365 -1.951 2.036
87 HB3 MET 14 1HB MET 14 -15.012 -0.877 2.383
88 HG2 MET 14 2HG MET 14 -14.821 -2.768 3.861
89 HG3 MET 14 1HG MET 14 -15.348 -1.400 4.838
90 HE1 MET 14 3HE MET 14 -16.740 -2.038 6.720
91 HE2 MET 14 1HE MET 14 -15.772 -3.501 6.496
92 HE3 MET 14 2HE MET 14 -17.494 -3.624 6.847
93 H LEU 15 H LEU 15 -17.322 2.223 3.926
94 HA LEU 15 HA LEU 15 -16.485 3.636 1.565
95 HB2 LEU 15 2HB LEU 15 -17.819 4.263 4.082
96 HB3 LEU 15 1HB LEU 15 -16.611 5.483 3.692
97 HG LEU 15 HG LEU 15 -17.613 5.603 1.371
98 HD11 LEU 15 1HD1 LEU 15 -19.807 3.972 2.691
99 HD12 LEU 15 2HD1 LEU 15 -18.743 3.406 1.403
100 HD13 LEU 15 3HD1 LEU 15 -19.894 4.705 1.090
101 HD21 LEU 15 3HD2 LEU 15 -18.173 7.327 2.951
102 HD22 LEU 15 1HD2 LEU 15 -19.306 6.267 3.790
103 HD23 LEU 15 2HD2 LEU 15 -19.674 6.841 2.163
104 H CYS 16 H CYS 16 -14.653 4.922 1.279
105 HA CYS 16 HA CYS 16 -12.192 3.950 2.013
106 HB2 CYS 16 2HB CYS 16 -12.770 5.751 0.276
107 HB3 CYS 16 1HB CYS 16 -12.593 6.905 1.601
108 H SER 17 H SER 17 -10.757 4.138 3.626
109 HA SER 17 HA SER 17 -11.586 4.953 6.217
110 HB2 SER 17 2HB SER 17 -8.699 4.627 5.438
111 HB3 SER 17 1HB SER 17 -9.490 4.211 6.961
112 HG SER 17 HG SER 17 -10.311 2.429 6.058
113 H THR 18 H THR 18 -9.715 6.540 3.679
114 HA THR 18 HA THR 18 -8.747 8.697 5.280
115 HB THR 18 HB THR 18 -8.204 9.760 3.125
116 HG1 THR 18 1HG THR 18 -9.752 9.265 1.741
117 HG21 THR 18 3HG2 THR 18 -7.576 6.837 2.823
118 HG22 THR 18 1HG2 THR 18 -6.920 7.747 4.183
119 HG23 THR 18 2HG2 THR 18 -6.535 8.229 2.530
120 H GLY 19 H GLY 19 -11.894 8.031 4.050
121 HA2 GLY 19 2HA GLY 19 -13.839 9.223 4.314
122 HA3 GLY 19 1HA GLY 19 -12.899 10.535 5.029
123 H CYS 20 H CYS 20 -12.028 9.285 1.863
124 HA CYS 20 HA CYS 20 -12.237 11.850 0.687
125 HB2 CYS 20 2HB CYS 20 -11.676 10.742 -1.436
126 HB3 CYS 20 1HB CYS 20 -10.617 10.209 -0.127
127 H GLY 21 H GLY 21 -14.628 9.393 1.157
128 HA2 GLY 21 2HA GLY 21 -16.944 9.797 0.884
129 HA3 GLY 21 1HA GLY 21 -16.568 11.026 -0.319
130 H PHE 22 H PHE 22 -14.758 8.211 -0.930
131 HA PHE 22 HA PHE 22 -16.614 7.440 -3.066
132 HB2 PHE 22 2HB PHE 22 -13.624 7.206 -2.719
133 HB3 PHE 22 1HB PHE 22 -14.486 6.311 -3.969
134 HD1 PHE 22 2HD PHE 22 -13.965 9.765 -2.628
135 HD2 PHE 22 1HD PHE 22 -15.076 7.336 -5.997
136 HE1 PHE 22 2HE PHE 22 -13.985 11.777 -4.076
137 HE2 PHE 22 1HE PHE 22 -15.091 9.351 -7.444
138 HZ PHE 22 HZ PHE 22 -14.547 11.569 -6.484
139 H TYR 23 H TYR 23 -15.848 4.961 -3.687
140 HA TYR 23 HA TYR 23 -16.684 3.387 -1.347
141 HB2 TYR 23 2HB TYR 23 -17.785 3.328 -3.740
142 HB3 TYR 23 1HB TYR 23 -16.437 2.252 -4.115
143 HD1 TYR 23 1HD TYR 23 -18.972 2.793 -1.399
144 HD2 TYR 23 2HD TYR 23 -16.747 -0.036 -3.749
145 HE1 TYR 23 1HE TYR 23 -20.169 0.930 -0.285
146 HE2 TYR 23 2HE TYR 23 -17.941 -1.900 -2.633
147 HH TYR 23 HH TYR 23 -20.688 -1.683 -1.132
148 H GLY 24 H GLY 24 -15.499 1.690 -0.540
149 HA2 GLY 24 2HA GLY 24 -12.725 1.397 -1.569
150 HA3 GLY 24 1HA GLY 24 -13.176 1.228 0.130
151 H ASN 25 H ASN 25 -11.784 -0.839 -0.763
152 HA ASN 25 HA ASN 25 -13.785 -2.963 -1.281
153 HB2 ASN 25 2HB ASN 25 -11.950 -2.307 -3.116
154 HB3 ASN 25 1HB ASN 25 -10.943 -3.361 -2.132
155 HD21 ASN 25 1HD2 ASN 25 -13.870 -3.282 -4.159
156 HD22 ASN 25 2HD2 ASN 25 -13.998 -4.974 -4.320
157 HA PRO 26 HA PRO 26 -12.053 -4.659 2.487
158 HB2 PRO 26 2HB PRO 26 -13.091 -7.168 2.425
159 HB3 PRO 26 1HB PRO 26 -14.065 -5.727 2.773
160 HG2 PRO 26 2HG PRO 26 -13.827 -7.281 0.247
161 HG3 PRO 26 1HG PRO 26 -15.259 -6.548 0.988
162 HD2 PRO 26 2HD PRO 26 -13.868 -5.409 -1.100
163 HD3 PRO 26 1HD PRO 26 -14.842 -4.481 0.059
164 H ARG 27 H ARG 27 -11.492 -6.193 -0.632
165 HA ARG 27 HA ARG 27 -9.531 -8.083 0.290
166 HB2 ARG 27 2HB ARG 27 -9.902 -6.963 -2.504
167 HB3 ARG 27 1HB ARG 27 -9.035 -8.436 -2.061
168 HG2 ARG 27 2HG ARG 27 -11.054 -9.515 -1.350
169 HG3 ARG 27 1HG ARG 27 -11.966 -8.011 -1.442
170 HD2 ARG 27 2HD ARG 27 -11.111 -8.110 -3.985
171 HD3 ARG 27 1HD ARG 27 -11.090 -9.835 -3.630
172 HE ARG 27 HE ARG 27 -13.412 -8.210 -4.011
173 HH11 ARG 27 1HH2 ARG 27 -12.221 -10.981 -2.202
174 HH12 ARG 27 2HH2 ARG 27 -13.799 -11.644 -1.975
175 HH21 ARG 27 1HH1 ARG 27 -15.434 -9.128 -3.700
176 HH22 ARG 27 2HH1 ARG 27 -15.601 -10.610 -2.818
177 H THR 28 H THR 28 -9.543 -4.758 -0.790
178 HA THR 28 HA THR 28 -6.637 -4.563 -0.916
179 HB THR 28 HB THR 28 -7.013 -2.222 -1.474
180 HG1 THR 28 1HG THR 28 -9.663 -2.756 -0.625
181 HG21 THR 28 3HG2 THR 28 -8.572 -2.458 -3.414
182 HG22 THR 28 1HG2 THR 28 -9.054 -4.036 -2.786
183 HG23 THR 28 2HG2 THR 28 -7.392 -3.768 -3.311
184 H ASN 29 H ASN 29 -6.596 -1.912 0.472
185 HA ASN 29 HA ASN 29 -6.445 -2.938 3.211
186 HB2 ASN 29 2HB ASN 29 -5.270 -0.561 1.800
187 HB3 ASN 29 1HB ASN 29 -5.353 -0.603 3.565
188 HD21 ASN 29 1HD2 ASN 29 -3.460 -1.431 4.463
189 HD22 ASN 29 2HD2 ASN 29 -2.487 -2.636 3.748
190 H GLY 30 H GLY 30 -9.085 -2.297 1.948
191 HA2 GLY 30 2HA GLY 30 -11.069 -1.469 2.774
192 HA3 GLY 30 1HA GLY 30 -10.176 -0.792 4.134
193 H MET 31 H MET 31 -8.835 0.133 1.099
194 HA MET 31 HA MET 31 -10.221 2.746 1.257
195 HB2 MET 31 2HB MET 31 -7.356 2.067 0.585
196 HB3 MET 31 1HB MET 31 -8.077 3.649 0.266
197 HG2 MET 31 2HG MET 31 -8.711 3.772 2.696
198 HG3 MET 31 1HG MET 31 -7.797 2.288 2.959
199 HE1 MET 31 3HE MET 31 -4.543 3.544 3.914
200 HE2 MET 31 1HE MET 31 -5.485 2.126 3.430
201 HE3 MET 31 2HE MET 31 -6.106 3.225 4.658
202 H CYS 32 H CYS 32 -10.109 3.977 -0.827
203 HA CYS 32 HA CYS 32 -11.212 2.352 -2.918
204 HB2 CYS 32 2HB CYS 32 -11.793 4.446 -3.977
205 HB3 CYS 32 1HB CYS 32 -12.125 4.574 -2.253
206 H SER 33 H SER 33 -10.389 3.707 -5.244
207 HA SER 33 HA SER 33 -7.974 2.286 -5.832
208 HB2 SER 33 2HB SER 33 -10.085 3.062 -7.318
209 HB3 SER 33 1HB SER 33 -8.937 4.319 -7.764
210 HG SER 33 HG SER 33 -8.661 1.503 -7.957
211 H VAL 34 H VAL 34 -8.717 5.777 -5.601
212 HA VAL 34 HA VAL 34 -6.100 6.627 -6.353
213 HB VAL 34 HB VAL 34 -8.169 8.186 -4.777
214 HG11 VAL 34 1HG1 VAL 34 -7.038 10.066 -6.172
215 HG12 VAL 34 2HG1 VAL 34 -5.725 8.908 -6.392
216 HG13 VAL 34 3HG1 VAL 34 -6.171 9.439 -4.770
217 HG21 VAL 34 3HG2 VAL 34 -8.799 9.041 -7.083
218 HG22 VAL 34 1HG2 VAL 34 -9.255 7.368 -6.760
219 HG23 VAL 34 2HG2 VAL 34 -7.839 7.722 -7.751
220 H CYS 35 H CYS 35 -7.712 6.704 -3.165
221 HA CYS 35 HA CYS 35 -5.518 7.567 -1.670
222 HB2 CYS 35 2HB CYS 35 -7.830 5.833 -0.764
223 HB3 CYS 35 1HB CYS 35 -6.734 6.721 0.294
224 H TYR 36 H TYR 36 -6.449 4.285 -2.618
225 HA TYR 36 HA TYR 36 -4.681 2.923 -0.859
226 HB2 TYR 36 2HB TYR 36 -6.608 1.844 -1.971
227 HB3 TYR 36 1HB TYR 36 -5.785 1.981 -3.522
228 HD1 TYR 36 1HD TYR 36 -4.579 0.967 -0.097
229 HD2 TYR 36 2HD TYR 36 -5.126 -0.146 -4.210
230 HE1 TYR 36 1HE TYR 36 -3.431 -1.187 0.333
231 HE2 TYR 36 2HE TYR 36 -3.982 -2.304 -3.777
232 HH TYR 36 HH TYR 36 -3.567 -3.616 -0.889
233 H LYS 37 H LYS 37 -4.192 4.412 -4.018
234 HA LYS 37 HA LYS 37 -1.679 3.106 -4.528
235 HB2 LYS 37 2HB LYS 37 -3.362 4.234 -6.190
236 HB3 LYS 37 1HB LYS 37 -2.486 5.709 -5.783
237 HG2 LYS 37 2HG LYS 37 -0.352 4.302 -6.287
238 HG3 LYS 37 1HG LYS 37 -1.461 3.217 -7.128
239 HD2 LYS 37 2HD LYS 37 -2.116 4.880 -8.668
240 HD3 LYS 37 1HD LYS 37 -1.490 6.185 -7.659
241 HE2 LYS 37 2HE LYS 37 0.805 5.440 -8.073
242 HE3 LYS 37 1HE LYS 37 0.212 4.082 -9.029
243 HZ1 LYS 37 3HZ LYS 37 -0.932 5.819 -10.438
244 HZ2 LYS 37 1HZ LYS 37 0.758 5.741 -10.570
245 HZ3 LYS 37 2HZ LYS 37 0.036 6.970 -9.646
246 H GLU 38 H GLU 38 -2.645 6.366 -3.437
247 HA GLU 38 HA GLU 38 -0.039 7.417 -3.122
248 HB2 GLU 38 2HB GLU 38 -2.630 8.107 -1.719
249 HB3 GLU 38 1HB GLU 38 -1.149 9.052 -1.582
250 HG2 GLU 38 2HG GLU 38 -2.316 8.390 -4.282
251 HG3 GLU 38 1HG GLU 38 -2.895 9.779 -3.357
252 H HIS 39 H HIS 39 -2.145 5.598 -0.953
253 HA HIS 39 HA HIS 39 -0.714 5.901 1.441
254 HB2 HIS 39 2HB HIS 39 -3.050 4.885 1.008
255 HB3 HIS 39 1HB HIS 39 -2.183 3.378 0.716
256 HD1 HIS 39 1HD HIS 39 -2.409 6.068 3.414
257 HD2 HIS 39 2HD HIS 39 -1.598 2.001 3.016
258 HE1 HIS 39 1HE HIS 39 -2.153 5.153 5.762
259 HE2 HIS 39 2HE HIS 39 -1.666 2.673 5.537
260 H LEU 40 H LEU 40 -0.503 3.285 -0.988
261 HA LEU 40 HA LEU 40 1.422 1.738 0.340
262 HB2 LEU 40 2HB LEU 40 0.233 1.841 -2.336
263 HB3 LEU 40 1HB LEU 40 1.908 1.283 -2.368
264 HG LEU 40 HG LEU 40 1.284 -0.314 -0.485
265 HD11 LEU 40 1HD1 LEU 40 -1.113 -0.814 -0.221
266 HD12 LEU 40 2HD1 LEU 40 -1.515 0.481 -1.348
267 HD13 LEU 40 3HD1 LEU 40 -0.778 0.864 0.208
268 HD21 LEU 40 3HD2 LEU 40 1.377 -0.797 -3.045
269 HD22 LEU 40 1HD2 LEU 40 -0.384 -0.833 -2.939
270 HD23 LEU 40 2HD2 LEU 40 0.581 -1.972 -1.997
271 H GLN 41 H GLN 41 1.816 4.658 -1.576
272 HA GLN 41 HA GLN 41 4.538 4.450 -2.231
273 HB2 GLN 41 2HB GLN 41 2.760 6.199 -2.945
274 HB3 GLN 41 1HB GLN 41 3.237 7.057 -1.483
275 HG2 GLN 41 2HG GLN 41 4.674 7.981 -3.074
276 HG3 GLN 41 1HG GLN 41 5.674 6.699 -2.383
277 HE21 GLN 41 1HE2 GLN 41 5.515 7.948 -5.223
278 HE22 GLN 41 2HE2 GLN 41 5.383 6.590 -6.248
279 H ARG 42 H ARG 42 2.968 5.736 0.697
280 HA ARG 42 HA ARG 42 5.378 6.606 1.956
281 HB2 ARG 42 2HB ARG 42 2.933 7.286 2.474
282 HB3 ARG 42 1HB ARG 42 2.889 5.828 3.462
283 HG2 ARG 42 2HG ARG 42 3.559 7.534 4.966
284 HG3 ARG 42 1HG ARG 42 5.063 6.714 4.540
285 HD2 ARG 42 2HD ARG 42 5.621 8.431 2.935
286 HD3 ARG 42 1HD ARG 42 4.044 9.189 3.123
287 HE ARG 42 HE ARG 42 5.344 9.100 5.643
288 HH11 ARG 42 1HH2 ARG 42 5.501 10.783 2.559
289 HH12 ARG 42 2HH2 ARG 42 6.305 12.157 3.232
290 HH21 ARG 42 1HH1 ARG 42 6.397 10.923 6.455
291 HH22 ARG 42 2HH1 ARG 42 6.806 12.238 5.404
292 H GLN 43 H GLN 43 3.691 3.531 1.828
293 HA GLN 43 HA GLN 43 4.907 2.290 4.079
294 HB2 GLN 43 2HB GLN 43 2.896 1.567 2.464
295 HB3 GLN 43 1HB GLN 43 4.183 0.656 1.682
296 HG2 GLN 43 2HG GLN 43 3.616 -0.919 3.247
297 HG3 GLN 43 1HG GLN 43 4.716 0.016 4.256
298 HE21 GLN 43 1HE2 GLN 43 3.829 0.797 6.190
299 HE22 GLN 43 2HE2 GLN 43 2.167 0.922 6.505
300 H GLN 44 H GLN 44 5.821 2.452 0.643
301 HA GLN 44 HA GLN 44 8.164 0.791 1.023
302 HB2 GLN 44 2HB GLN 44 6.652 1.014 -1.090
303 HB3 GLN 44 1HB GLN 44 7.668 2.409 -1.446
304 HG2 GLN 44 2HG GLN 44 9.681 1.009 -1.335
305 HG3 GLN 44 1HG GLN 44 8.703 -0.389 -0.896
306 HE21 GLN 44 1HE2 GLN 44 8.832 2.108 -3.505
307 HE22 GLN 44 2HE2 GLN 44 8.449 1.016 -4.757
308 H ASN 45 H ASN 45 7.922 3.674 2.296
309 HA ASN 45 HA ASN 45 9.839 5.334 1.081
310 HB2 ASN 45 2HB ASN 45 8.497 5.178 3.700
311 HB3 ASN 45 1HB ASN 45 10.103 5.894 3.783
312 HD21 ASN 45 1HD2 ASN 45 7.645 6.112 1.150
313 HD22 ASN 45 2HD2 ASN 45 7.544 7.814 1.197
314 H SER 46 H SER 46 10.213 2.588 3.251
315 HA SER 46 HA SER 46 13.062 3.023 3.609
316 HB2 SER 46 2HB SER 46 11.683 2.012 5.399
317 HB3 SER 46 1HB SER 46 11.345 0.642 4.346
318 HG SER 46 HG SER 46 13.377 -0.027 4.542
319 H GLY 47 H GLY 47 11.133 0.311 2.267
320 HA2 GLY 47 2HA GLY 47 11.458 -0.678 0.136
321 HA3 GLY 47 1HA GLY 47 13.045 0.074 0.048
322 H ARG 48 H ARG 48 14.250 -0.728 2.372
323 HA ARG 48 HA ARG 48 14.854 -3.486 1.786
324 HB2 ARG 48 2HB ARG 48 15.892 -1.512 3.822
325 HB3 ARG 48 1HB ARG 48 16.435 -3.189 3.769
326 HG2 ARG 48 2HG ARG 48 17.198 -2.912 1.467
327 HG3 ARG 48 1HG ARG 48 16.556 -1.270 1.425
328 HD2 ARG 48 2HD ARG 48 18.520 -1.998 3.573
329 HD3 ARG 48 1HD ARG 48 19.117 -1.694 1.944
330 HE ARG 48 HE ARG 48 17.479 0.445 2.468
331 HH11 ARG 48 1HH2 ARG 48 20.257 -0.961 4.101
332 HH12 ARG 48 2HH2 ARG 48 20.771 0.556 4.751
333 HH21 ARG 48 1HH1 ARG 48 18.204 2.385 3.331
334 HH22 ARG 48 2HH1 ARG 48 19.624 2.430 4.320
335 H MET 49 H MET 49 15.120 -5.032 3.719
336 HA MET 49 HA MET 49 12.522 -5.418 4.892
337 HB2 MET 49 2HB MET 49 15.136 -6.901 4.986
338 HB3 MET 49 1HB MET 49 13.831 -7.325 6.093
339 HG2 MET 49 2HG MET 49 12.311 -7.538 4.094
340 HG3 MET 49 1HG MET 49 13.729 -7.332 3.065
341 HE1 MET 49 3HE MET 49 13.884 -9.427 1.828
342 HE2 MET 49 1HE MET 49 14.865 -10.725 2.520
343 HE3 MET 49 2HE MET 49 15.449 -9.064 2.550
344 H SER 50 H SER 50 15.757 -4.578 6.105
345 HA SER 50 HA SER 50 14.501 -3.567 8.587
346 HB2 SER 50 2HB SER 50 16.652 -4.340 9.731
347 HB3 SER 50 1HB SER 50 15.506 -5.597 9.279
348 HG SER 50 HG SER 50 16.765 -6.126 7.559
349 HA PRO 51 HA PRO 51 16.945 0.028 7.702
350 HB2 PRO 51 2HB PRO 51 17.037 1.246 10.116
351 HB3 PRO 51 1HB PRO 51 15.531 1.096 9.190
352 HG2 PRO 51 2HG PRO 51 16.474 -0.467 11.534
353 HG3 PRO 51 1HG PRO 51 14.842 0.083 11.122
354 HD2 PRO 51 2HD PRO 51 15.799 -2.496 10.692
355 HD3 PRO 51 1HD PRO 51 14.408 -1.776 9.855
356 H MET 52 H MET 52 18.790 1.409 9.077
357 HA MET 52 HA MET 52 20.849 -0.461 10.041
358 HB2 MET 52 2HB MET 52 21.052 0.003 7.521
359 HB3 MET 52 1HB MET 52 21.503 1.643 7.985
360 HG2 MET 52 2HG MET 52 23.343 0.763 9.359
361 HG3 MET 52 1HG MET 52 22.890 -0.885 8.922
362 HE1 MET 52 3HE MET 52 25.506 -1.437 6.605
363 HE2 MET 52 1HE MET 52 23.849 -2.036 6.443
364 HE3 MET 52 2HE MET 52 24.559 -1.817 8.041
365 H GLY 53 H GLY 53 20.280 2.984 9.249
366 HA2 GLY 53 2HA GLY 53 20.072 4.380 11.401
367 HA3 GLY 53 1HA GLY 53 21.678 3.742 11.742
368 H THR 54 H THR 54 23.124 3.934 9.575
369 HA THR 54 HA THR 54 22.740 6.559 8.319
370 HB THR 54 HB THR 54 25.392 5.866 9.569
371 HG1 THR 54 1HG THR 54 24.258 6.068 11.360
372 HG21 THR 54 3HG2 THR 54 25.577 7.592 7.952
373 HG22 THR 54 1HG2 THR 54 25.494 8.433 9.500
374 HG23 THR 54 2HG2 THR 54 24.066 8.344 8.467
375 H ALA 55 H ALA 55 24.204 6.897 6.480
376 HA ALA 55 HA ALA 55 24.574 4.440 4.987
377 HB1 ALA 55 1HB ALA 55 25.004 5.850 3.103
378 HB2 ALA 55 2HB ALA 55 25.320 7.243 4.137
379 HB3 ALA 55 3HB ALA 55 23.684 6.598 4.001
380 H SER 56 H SER 56 26.350 3.250 5.258
381 HA SER 56 HA SER 56 28.942 4.627 5.680
382 HB2 SER 56 2HB SER 56 29.648 2.545 6.857
383 HB3 SER 56 1HB SER 56 28.328 3.383 7.669
384 HG SER 56 HG SER 56 28.175 0.991 7.265
385 H GLY 57 H GLY 57 30.763 2.846 5.154
386 HA2 GLY 57 2HA GLY 57 31.602 1.249 3.624
387 HA3 GLY 57 1HA GLY 57 30.118 1.394 2.688
388 H SER 58 H SER 58 32.711 3.601 3.799
389 HA SER 58 HA SER 58 33.248 4.363 1.026
390 HB2 SER 58 2HB SER 58 31.451 5.896 1.932
391 HB3 SER 58 1HB SER 58 32.630 6.465 3.111
392 HG SER 58 HG SER 58 32.395 7.604 0.972
393 H ASN 59 H ASN 59 34.730 2.903 3.078
394 HA ASN 59 HA ASN 59 36.920 4.772 3.726
395 HB2 ASN 59 2HB ASN 59 35.820 3.258 5.496
396 HB3 ASN 59 1HB ASN 59 36.670 1.933 4.704
397 HD21 ASN 59 1HD2 ASN 59 37.300 5.168 6.166
398 HD22 ASN 59 2HD2 ASN 59 38.864 4.780 6.701
399 H SER 60 H SER 60 39.089 4.212 3.223
400 HA SER 60 HA SER 60 39.399 2.152 1.114
401 HB2 SER 60 2HB SER 60 40.954 4.735 1.164
402 HB3 SER 60 1HB SER 60 40.777 3.588 -0.161
403 HG SER 60 HG SER 60 39.402 5.306 -0.528
404 HA PRO 61 HA PRO 61 42.526 1.283 4.373
405 HB2 PRO 61 2HB PRO 61 42.318 -1.410 4.389
406 HB3 PRO 61 1HB PRO 61 41.140 -0.373 5.220
407 HG2 PRO 61 2HG PRO 61 40.912 -1.790 2.616
408 HG3 PRO 61 1HG PRO 61 39.691 -1.526 3.871
409 HD2 PRO 61 2HD PRO 61 39.911 -0.026 1.534
410 HD3 PRO 61 1HD PRO 61 39.068 0.502 3.005
411 H THR 62 H THR 62 44.591 1.451 3.694
412 HA THR 62 HA THR 62 45.704 -0.528 1.874
413 HB THR 62 HB THR 62 46.085 2.375 1.170
414 HG1 THR 62 1HG THR 62 43.939 2.092 0.873
415 HG21 THR 62 3HG2 THR 62 46.596 1.291 -1.056
416 HG22 THR 62 1HG2 THR 62 46.474 -0.271 -0.246
417 HG23 THR 62 2HG2 THR 62 47.722 0.878 0.237
Start of MODEL 3
1 H1 GLY 1 1HT GLY 1 -41.639 2.759 5.214
2 H2 GLY 1 2HT GLY 1 -42.937 2.464 4.158
3 H3 GLY 1 3HT GLY 1 -43.220 2.662 5.821
4 HA2 GLY 1 2HA GLY 1 -42.457 4.704 3.824
5 HA3 GLY 1 1HA GLY 1 -43.851 4.697 4.905
6 H SER 2 H SER 2 -40.305 4.876 4.845
7 HA SER 2 HA SER 2 -40.188 5.852 7.582
8 HB2 SER 2 2HB SER 2 -38.024 5.511 5.496
9 HB3 SER 2 1HB SER 2 -37.753 5.958 7.177
10 HG SER 2 HG SER 2 -37.694 3.870 7.454
11 H MET 3 H MET 3 -39.857 7.118 4.295
12 HA MET 3 HA MET 3 -40.021 9.853 5.392
13 HB2 MET 3 2HB MET 3 -37.996 8.804 3.417
14 HB3 MET 3 1HB MET 3 -38.390 10.520 3.540
15 HG2 MET 3 2HG MET 3 -37.648 10.634 5.800
16 HG3 MET 3 1HG MET 3 -37.592 8.878 5.946
17 HE1 MET 3 3HE MET 3 -34.588 11.752 4.127
18 HE2 MET 3 1HE MET 3 -35.446 11.907 5.667
19 HE3 MET 3 2HE MET 3 -36.338 11.961 4.150
20 H ALA 4 H ALA 4 -39.969 8.002 2.328
21 HA ALA 4 HA ALA 4 -42.407 9.451 1.494
22 HB1 ALA 4 1HB ALA 4 -40.031 8.860 -0.287
23 HB2 ALA 4 2HB ALA 4 -40.437 10.448 0.365
24 HB3 ALA 4 3HB ALA 4 -41.528 9.657 -0.771
25 H GLN 5 H GLN 5 -40.232 6.857 0.323
26 HA GLN 5 HA GLN 5 -42.564 5.043 0.195
27 HB2 GLN 5 2HB GLN 5 -41.923 6.055 -2.067
28 HB3 GLN 5 1HB GLN 5 -40.433 5.120 -1.940
29 HG2 GLN 5 2HG GLN 5 -41.834 3.061 -1.601
30 HG3 GLN 5 1HG GLN 5 -43.264 4.038 -1.937
31 HE21 GLN 5 1HE2 GLN 5 -40.170 2.961 -3.400
32 HE22 GLN 5 2HE2 GLN 5 -40.712 3.104 -5.012
33 H GLU 6 H GLU 6 -39.012 5.139 -0.247
34 HA GLU 6 HA GLU 6 -38.786 2.838 1.593
35 HB2 GLU 6 2HB GLU 6 -37.655 3.098 -1.185
36 HB3 GLU 6 1HB GLU 6 -36.879 2.073 0.024
37 HG2 GLU 6 2HG GLU 6 -39.185 1.021 0.394
38 HG3 GLU 6 1HG GLU 6 -39.679 1.840 -1.088
39 H THR 7 H THR 7 -36.253 2.489 1.963
40 HA THR 7 HA THR 7 -35.297 5.041 3.013
41 HB THR 7 HB THR 7 -33.424 3.375 3.878
42 HG1 THR 7 1HG THR 7 -33.882 1.497 3.000
43 HG21 THR 7 3HG2 THR 7 -34.600 3.244 5.885
44 HG22 THR 7 1HG2 THR 7 -36.144 2.965 5.079
45 HG23 THR 7 2HG2 THR 7 -35.429 4.578 5.082
46 H ASN 8 H ASN 8 -33.103 5.767 2.685
47 HA ASN 8 HA ASN 8 -32.107 5.136 -0.026
48 HB2 ASN 8 2HB ASN 8 -31.820 7.584 1.724
49 HB3 ASN 8 1HB ASN 8 -30.930 7.359 0.220
50 HD21 ASN 8 1HD2 ASN 8 -33.523 8.986 1.314
51 HD22 ASN 8 2HD2 ASN 8 -34.541 8.911 -0.053
52 H GLN 9 H GLN 9 -31.480 3.564 2.446
53 HA GLN 9 HA GLN 9 -28.583 4.101 2.704
54 HB2 GLN 9 2HB GLN 9 -30.438 2.442 4.428
55 HB3 GLN 9 1HB GLN 9 -28.705 2.634 4.696
56 HG2 GLN 9 2HG GLN 9 -29.053 5.107 4.846
57 HG3 GLN 9 1HG GLN 9 -30.792 4.829 4.732
58 HE21 GLN 9 1HE2 GLN 9 -31.614 5.127 6.814
59 HE22 GLN 9 2HE2 GLN 9 -30.950 4.434 8.224
60 H THR 10 H THR 10 -27.372 1.922 3.216
61 HA THR 10 HA THR 10 -28.297 -0.305 1.580
62 HB THR 10 HB THR 10 -27.148 1.083 -0.069
63 HG1 THR 10 1HG THR 10 -26.185 -0.610 -0.833
64 HG21 THR 10 3HG2 THR 10 -25.715 2.385 1.439
65 HG22 THR 10 1HG2 THR 10 -24.737 1.602 0.197
66 HG23 THR 10 2HG2 THR 10 -24.787 0.937 1.829
67 HA PRO 11 HA PRO 11 -26.029 -2.356 4.827
68 HB2 PRO 11 2HB PRO 11 -26.117 -4.915 3.969
69 HB3 PRO 11 1HB PRO 11 -27.576 -4.053 4.499
70 HG2 PRO 11 2HG PRO 11 -26.644 -4.688 1.757
71 HG3 PRO 11 1HG PRO 11 -28.288 -4.622 2.407
72 HD2 PRO 11 2HD PRO 11 -27.051 -2.598 0.906
73 HD3 PRO 11 1HD PRO 11 -28.510 -2.404 1.900
74 H GLY 12 H GLY 12 -23.890 -2.430 5.240
75 HA2 GLY 12 2HA GLY 12 -21.665 -3.071 5.024
76 HA3 GLY 12 1HA GLY 12 -22.049 -3.788 3.461
77 HA PRO 13 HA PRO 13 -21.383 0.664 2.074
78 HB2 PRO 13 2HB PRO 13 -21.516 2.786 3.777
79 HB3 PRO 13 1HB PRO 13 -22.952 2.080 3.005
80 HG2 PRO 13 2HG PRO 13 -21.943 1.760 5.781
81 HG3 PRO 13 1HG PRO 13 -23.609 1.849 5.181
82 HD2 PRO 13 2HD PRO 13 -22.316 -0.510 5.877
83 HD3 PRO 13 1HD PRO 13 -23.718 -0.405 4.786
84 H MET 14 H MET 14 -19.293 -0.620 2.298
85 HA MET 14 HA MET 14 -17.339 0.132 4.242
86 HB2 MET 14 2HB MET 14 -17.132 -1.294 1.578
87 HB3 MET 14 1HB MET 14 -15.758 -1.055 2.662
88 HG2 MET 14 2HG MET 14 -17.235 -2.144 4.475
89 HG3 MET 14 1HG MET 14 -18.263 -2.671 3.140
90 HE1 MET 14 3HE MET 14 -17.012 -4.122 5.275
91 HE2 MET 14 1HE MET 14 -15.257 -4.335 5.236
92 HE3 MET 14 2HE MET 14 -16.315 -5.592 4.601
93 H LEU 15 H LEU 15 -17.695 2.510 3.965
94 HA LEU 15 HA LEU 15 -16.755 3.824 1.592
95 HB2 LEU 15 2HB LEU 15 -17.883 4.598 4.205
96 HB3 LEU 15 1HB LEU 15 -16.708 5.744 3.577
97 HG LEU 15 HG LEU 15 -19.030 6.284 2.864
98 HD11 LEU 15 1HD1 LEU 15 -16.810 6.546 1.423
99 HD12 LEU 15 2HD1 LEU 15 -18.387 6.982 0.771
100 HD13 LEU 15 3HD1 LEU 15 -17.659 5.432 0.352
101 HD21 LEU 15 3HD2 LEU 15 -18.855 3.596 1.468
102 HD22 LEU 15 1HD2 LEU 15 -20.067 4.821 1.095
103 HD23 LEU 15 2HD2 LEU 15 -20.026 4.083 2.695
104 H CYS 16 H CYS 16 -14.826 4.928 1.248
105 HA CYS 16 HA CYS 16 -12.435 3.812 1.958
106 HB2 CYS 16 2HB CYS 16 -12.926 5.641 0.224
107 HB3 CYS 16 1HB CYS 16 -12.659 6.785 1.547
108 H SER 17 H SER 17 -10.957 3.925 3.542
109 HA SER 17 HA SER 17 -11.714 4.869 6.128
110 HB2 SER 17 2HB SER 17 -9.063 3.863 5.082
111 HB3 SER 17 1HB SER 17 -9.416 4.173 6.784
112 HG SER 17 HG SER 17 -10.174 2.095 5.156
113 H THR 18 H THR 18 -9.924 6.327 3.499
114 HA THR 18 HA THR 18 -8.629 8.312 5.144
115 HB THR 18 HB THR 18 -7.936 9.292 2.979
116 HG1 THR 18 1HG THR 18 -9.213 8.876 1.379
117 HG21 THR 18 3HG2 THR 18 -7.618 6.283 2.988
118 HG22 THR 18 1HG2 THR 18 -6.746 7.351 4.088
119 HG23 THR 18 2HG2 THR 18 -6.491 7.478 2.347
120 H GLY 19 H GLY 19 -11.763 8.025 3.693
121 HA2 GLY 19 2HA GLY 19 -13.565 9.449 4.043
122 HA3 GLY 19 1HA GLY 19 -12.457 10.666 4.672
123 H CYS 20 H CYS 20 -12.008 9.092 1.545
124 HA CYS 20 HA CYS 20 -11.949 11.646 0.227
125 HB2 CYS 20 2HB CYS 20 -11.551 10.366 -1.838
126 HB3 CYS 20 1HB CYS 20 -10.487 9.832 -0.535
127 H GLY 21 H GLY 21 -14.461 9.373 0.942
128 HA2 GLY 21 2HA GLY 21 -16.749 9.916 0.765
129 HA3 GLY 21 1HA GLY 21 -16.371 11.016 -0.552
130 H PHE 22 H PHE 22 -14.809 8.000 -0.956
131 HA PHE 22 HA PHE 22 -16.915 7.103 -2.823
132 HB2 PHE 22 2HB PHE 22 -13.905 6.895 -3.004
133 HB3 PHE 22 1HB PHE 22 -15.015 6.037 -4.076
134 HD1 PHE 22 1HD PHE 22 -16.795 7.462 -5.312
135 HD2 PHE 22 2HD PHE 22 -13.268 9.094 -3.493
136 HE1 PHE 22 1HE PHE 22 -17.008 9.490 -6.725
137 HE2 PHE 22 2HE PHE 22 -13.480 11.126 -4.900
138 HZ PHE 22 HZ PHE 22 -15.349 11.324 -6.519
139 H TYR 23 H TYR 23 -16.852 4.744 -3.295
140 HA TYR 23 HA TYR 23 -17.030 3.212 -0.898
141 HB2 TYR 23 2HB TYR 23 -18.262 2.874 -3.154
142 HB3 TYR 23 1HB TYR 23 -16.804 2.010 -3.652
143 HD1 TYR 23 2HD TYR 23 -19.203 2.189 -0.770
144 HD2 TYR 23 1HD TYR 23 -16.660 -0.277 -3.199
145 HE1 TYR 23 2HE TYR 23 -19.978 0.180 0.462
146 HE2 TYR 23 1HE TYR 23 -17.438 -2.287 -1.973
147 HH TYR 23 HH TYR 23 -20.095 -2.486 -0.268
148 H GLY 24 H GLY 24 -15.702 1.582 -0.106
149 HA2 GLY 24 2HA GLY 24 -12.914 1.594 -1.128
150 HA3 GLY 24 1HA GLY 24 -13.371 1.302 0.552
151 H ASN 25 H ASN 25 -11.724 -0.476 -0.828
152 HA ASN 25 HA ASN 25 -13.498 -2.793 -1.338
153 HB2 ASN 25 2HB ASN 25 -11.692 -1.850 -3.077
154 HB3 ASN 25 1HB ASN 25 -10.619 -2.872 -2.130
155 HD21 ASN 25 1HD2 ASN 25 -10.411 -4.354 -3.992
156 HD22 ASN 25 2HD2 ASN 25 -11.677 -5.432 -4.378
157 HA PRO 26 HA PRO 26 -11.657 -4.249 2.512
158 HB2 PRO 26 2HB PRO 26 -12.827 -6.708 2.633
159 HB3 PRO 26 1HB PRO 26 -13.661 -5.195 3.035
160 HG2 PRO 26 2HG PRO 26 -13.804 -6.833 0.562
161 HG3 PRO 26 1HG PRO 26 -15.089 -5.962 1.413
162 HD2 PRO 26 2HD PRO 26 -13.840 -5.019 -0.856
163 HD3 PRO 26 1HD PRO 26 -14.617 -3.973 0.351
164 H ARG 27 H ARG 27 -11.238 -5.739 -0.606
165 HA ARG 27 HA ARG 27 -9.372 -7.768 0.262
166 HB2 ARG 27 2HB ARG 27 -10.277 -6.696 -2.399
167 HB3 ARG 27 1HB ARG 27 -8.823 -7.691 -2.297
168 HG2 ARG 27 2HG ARG 27 -10.008 -9.568 -1.518
169 HG3 ARG 27 1HG ARG 27 -11.387 -8.596 -1.000
170 HD2 ARG 27 2HD ARG 27 -12.114 -8.236 -3.228
171 HD3 ARG 27 1HD ARG 27 -10.576 -8.770 -3.899
172 HE ARG 27 HE ARG 27 -11.909 -10.839 -2.402
173 HH11 ARG 27 1HH2 ARG 27 -11.744 -9.251 -5.537
174 HH12 ARG 27 2HH2 ARG 27 -12.365 -10.623 -6.382
175 HH21 ARG 27 1HH1 ARG 27 -12.721 -12.590 -3.556
176 HH22 ARG 27 2HH1 ARG 27 -12.917 -12.492 -5.274
177 H THR 28 H THR 28 -9.290 -4.461 -0.926
178 HA THR 28 HA THR 28 -6.417 -4.329 -1.214
179 HB THR 28 HB THR 28 -6.766 -1.945 -1.570
180 HG1 THR 28 1HG THR 28 -9.363 -2.463 -0.554
181 HG21 THR 28 3HG2 THR 28 -8.696 -2.049 -3.270
182 HG22 THR 28 1HG2 THR 28 -8.837 -3.747 -2.820
183 HG23 THR 28 2HG2 THR 28 -7.337 -3.143 -3.519
184 H ASN 29 H ASN 29 -6.068 -1.793 0.301
185 HA ASN 29 HA ASN 29 -5.703 -2.977 2.945
186 HB2 ASN 29 2HB ASN 29 -4.290 -1.074 1.327
187 HB3 ASN 29 1HB ASN 29 -4.735 -0.276 2.834
188 HD21 ASN 29 1HD2 ASN 29 -2.866 -2.962 1.456
189 HD22 ASN 29 2HD2 ASN 29 -1.968 -3.289 2.866
190 H GLY 30 H GLY 30 -8.446 -2.140 1.990
191 HA2 GLY 30 2HA GLY 30 -10.282 -1.382 3.179
192 HA3 GLY 30 1HA GLY 30 -9.191 -0.628 4.341
193 H MET 31 H MET 31 -8.333 0.146 1.127
194 HA MET 31 HA MET 31 -9.768 2.724 1.282
195 HB2 MET 31 2HB MET 31 -6.914 2.052 0.631
196 HB3 MET 31 1HB MET 31 -7.665 3.479 -0.094
197 HG2 MET 31 2HG MET 31 -6.671 4.262 1.904
198 HG3 MET 31 1HG MET 31 -8.381 4.113 2.290
199 HE1 MET 31 3HE MET 31 -5.681 4.367 3.678
200 HE2 MET 31 1HE MET 31 -4.761 2.867 3.858
201 HE3 MET 31 2HE MET 31 -5.805 3.424 5.162
202 H CYS 32 H CYS 32 -10.030 3.776 -0.827
203 HA CYS 32 HA CYS 32 -11.137 1.981 -2.742
204 HB2 CYS 32 2HB CYS 32 -11.837 3.979 -3.931
205 HB3 CYS 32 1HB CYS 32 -12.108 4.215 -2.209
206 H SER 33 H SER 33 -10.368 3.376 -5.191
207 HA SER 33 HA SER 33 -7.974 1.892 -5.743
208 HB2 SER 33 2HB SER 33 -10.120 2.818 -7.231
209 HB3 SER 33 1HB SER 33 -8.775 3.787 -7.817
210 HG SER 33 HG SER 33 -9.329 1.180 -8.222
211 H VAL 34 H VAL 34 -8.711 5.406 -5.823
212 HA VAL 34 HA VAL 34 -6.070 6.197 -6.486
213 HB VAL 34 HB VAL 34 -8.080 7.909 -5.002
214 HG11 VAL 34 1HG1 VAL 34 -5.995 9.035 -5.179
215 HG12 VAL 34 2HG1 VAL 34 -6.944 9.648 -6.535
216 HG13 VAL 34 3HG1 VAL 34 -5.709 8.420 -6.808
217 HG21 VAL 34 3HG2 VAL 34 -7.892 7.245 -7.959
218 HG22 VAL 34 1HG2 VAL 34 -8.779 8.632 -7.328
219 HG23 VAL 34 2HG2 VAL 34 -9.278 6.998 -6.897
220 H CYS 35 H CYS 35 -7.759 6.364 -3.338
221 HA CYS 35 HA CYS 35 -5.620 7.319 -1.822
222 HB2 CYS 35 2HB CYS 35 -7.896 5.538 -0.938
223 HB3 CYS 35 1HB CYS 35 -6.830 6.436 0.140
224 H TYR 36 H TYR 36 -6.419 3.966 -2.673
225 HA TYR 36 HA TYR 36 -4.742 2.632 -0.875
226 HB2 TYR 36 2HB TYR 36 -6.378 1.406 -2.178
227 HB3 TYR 36 1HB TYR 36 -5.572 1.845 -3.682
228 HD1 TYR 36 2HD TYR 36 -4.216 0.558 -0.405
229 HD2 TYR 36 1HD TYR 36 -4.683 -0.111 -4.623
230 HE1 TYR 36 2HE TYR 36 -2.786 -1.457 -0.240
231 HE2 TYR 36 1HE TYR 36 -3.254 -2.130 -4.456
232 HH TYR 36 HH TYR 36 -2.589 -3.694 -1.712
233 H LYS 37 H LYS 37 -3.970 3.994 -4.063
234 HA LYS 37 HA LYS 37 -1.268 3.017 -4.074
235 HB2 LYS 37 2HB LYS 37 -2.724 3.678 -6.099
236 HB3 LYS 37 1HB LYS 37 -2.278 5.336 -5.705
237 HG2 LYS 37 2HG LYS 37 0.145 4.581 -5.747
238 HG3 LYS 37 1HG LYS 37 -0.425 3.053 -6.418
239 HD2 LYS 37 2HD LYS 37 0.147 4.390 -8.305
240 HD3 LYS 37 1HD LYS 37 -1.613 4.450 -8.205
241 HE2 LYS 37 2HE LYS 37 -1.571 6.621 -7.189
242 HE3 LYS 37 1HE LYS 37 0.172 6.537 -6.935
243 HZ1 LYS 37 3HZ LYS 37 -1.170 6.562 -9.583
244 HZ2 LYS 37 1HZ LYS 37 0.503 6.539 -9.312
245 HZ3 LYS 37 2HZ LYS 37 -0.411 7.899 -8.859
246 H GLU 38 H GLU 38 -2.823 6.146 -3.458
247 HA GLU 38 HA GLU 38 -0.579 7.729 -3.060
248 HB2 GLU 38 2HB GLU 38 -3.309 7.858 -1.773
249 HB3 GLU 38 1HB GLU 38 -2.089 9.120 -1.595
250 HG2 GLU 38 2HG GLU 38 -2.926 8.119 -4.317
251 HG3 GLU 38 1HG GLU 38 -3.810 9.410 -3.497
252 H HIS 39 H HIS 39 -2.198 5.606 -0.683
253 HA HIS 39 HA HIS 39 -0.332 6.480 1.378
254 HB2 HIS 39 2HB HIS 39 -1.604 5.320 2.959
255 HB3 HIS 39 1HB HIS 39 -2.795 5.928 1.817
256 HD1 HIS 39 1HD HIS 39 -4.565 4.217 1.520
257 HD2 HIS 39 2HD HIS 39 -0.817 2.431 1.893
258 HE1 HIS 39 1HE HIS 39 -4.939 1.718 1.372
259 HE2 HIS 39 2HE HIS 39 -2.665 0.616 1.595
260 H LEU 40 H LEU 40 -0.711 3.738 -0.770
261 HA LEU 40 HA LEU 40 1.082 1.951 0.487
262 HB2 LEU 40 2HB LEU 40 -0.501 1.381 -1.386
263 HB3 LEU 40 1HB LEU 40 0.607 2.196 -2.495
264 HG LEU 40 HG LEU 40 2.414 0.626 -1.427
265 HD11 LEU 40 1HD1 LEU 40 -0.197 -0.703 -0.669
266 HD12 LEU 40 2HD1 LEU 40 1.161 -0.306 0.385
267 HD13 LEU 40 3HD1 LEU 40 1.316 -1.598 -0.806
268 HD21 LEU 40 3HD2 LEU 40 1.616 -1.251 -3.012
269 HD22 LEU 40 1HD2 LEU 40 1.894 0.338 -3.724
270 HD23 LEU 40 2HD2 LEU 40 0.250 -0.196 -3.371
271 H GLN 41 H GLN 41 1.641 4.802 -1.476
272 HA GLN 41 HA GLN 41 4.345 4.240 -2.192
273 HB2 GLN 41 2HB GLN 41 2.534 6.608 -2.245
274 HB3 GLN 41 1HB GLN 41 4.262 6.927 -2.280
275 HG2 GLN 41 2HG GLN 41 4.280 5.053 -4.131
276 HG3 GLN 41 1HG GLN 41 2.571 5.463 -4.280
277 HE21 GLN 41 1HE2 GLN 41 5.666 7.310 -3.914
278 HE22 GLN 41 2HE2 GLN 41 5.288 8.446 -5.133
279 H ARG 42 H ARG 42 2.797 5.890 0.537
280 HA ARG 42 HA ARG 42 5.236 6.814 1.728
281 HB2 ARG 42 2HB ARG 42 2.472 6.394 2.888
282 HB3 ARG 42 1HB ARG 42 3.807 7.162 3.747
283 HG2 ARG 42 2HG ARG 42 3.957 8.893 2.012
284 HG3 ARG 42 1HG ARG 42 2.662 8.112 1.105
285 HD2 ARG 42 2HD ARG 42 1.026 8.795 2.577
286 HD3 ARG 42 1HD ARG 42 2.120 8.809 3.958
287 HE ARG 42 HE ARG 42 1.538 11.012 2.227
288 HH11 ARG 42 1HH2 ARG 42 4.120 9.587 4.145
289 HH12 ARG 42 2HH2 ARG 42 4.909 11.104 4.397
290 HH21 ARG 42 1HH1 ARG 42 2.620 12.954 2.592
291 HH22 ARG 42 2HH1 ARG 42 4.082 12.980 3.521
292 H GLN 43 H GLN 43 3.373 3.839 1.900
293 HA GLN 43 HA GLN 43 4.651 2.793 4.242
294 HB2 GLN 43 2HB GLN 43 2.937 1.619 2.066
295 HB3 GLN 43 1HB GLN 43 3.706 0.584 3.270
296 HG2 GLN 43 2HG GLN 43 2.675 2.320 4.975
297 HG3 GLN 43 1HG GLN 43 1.576 2.665 3.642
298 HE21 GLN 43 1HE2 GLN 43 0.514 0.603 2.648
299 HE22 GLN 43 2HE2 GLN 43 0.091 -0.629 3.737
300 H GLN 44 H GLN 44 5.281 2.643 0.770
301 HA GLN 44 HA GLN 44 7.308 0.612 0.976
302 HB2 GLN 44 2HB GLN 44 5.850 1.303 -1.085
303 HB3 GLN 44 1HB GLN 44 7.101 2.524 -1.330
304 HG2 GLN 44 2HG GLN 44 8.815 0.861 -1.519
305 HG3 GLN 44 1HG GLN 44 7.734 -0.409 -0.946
306 HE21 GLN 44 1HE2 GLN 44 8.376 1.758 -3.704
307 HE22 GLN 44 2HE2 GLN 44 7.510 0.826 -4.843
308 H ASN 45 H ASN 45 7.228 4.136 0.960
309 HA ASN 45 HA ASN 45 10.001 4.580 0.577
310 HB2 ASN 45 2HB ASN 45 7.714 6.208 1.610
311 HB3 ASN 45 1HB ASN 45 9.356 6.807 1.832
312 HD21 ASN 45 1HD2 ASN 45 10.383 7.748 0.019
313 HD22 ASN 45 2HD2 ASN 45 9.713 7.753 -1.549
314 H SER 46 H SER 46 8.279 3.420 3.352
315 HA SER 46 HA SER 46 10.003 4.415 5.384
316 HB2 SER 46 2HB SER 46 8.531 1.802 5.594
317 HB3 SER 46 1HB SER 46 8.879 2.979 6.856
318 HG SER 46 HG SER 46 7.121 3.995 6.331
319 H GLY 47 H GLY 47 10.107 1.572 3.296
320 HA2 GLY 47 2HA GLY 47 11.815 0.099 2.827
321 HA3 GLY 47 1HA GLY 47 12.906 1.209 3.651
322 H ARG 48 H ARG 48 10.211 -0.980 4.539
323 HA ARG 48 HA ARG 48 11.519 -1.615 7.067
324 HB2 ARG 48 2HB ARG 48 8.841 -2.226 5.848
325 HB3 ARG 48 1HB ARG 48 9.408 -3.128 7.254
326 HG2 ARG 48 2HG ARG 48 9.807 -0.944 8.423
327 HG3 ARG 48 1HG ARG 48 9.069 -0.123 7.048
328 HD2 ARG 48 2HD ARG 48 7.668 -2.308 8.598
329 HD3 ARG 48 1HD ARG 48 7.507 -0.602 8.998
330 HE ARG 48 HE ARG 48 6.947 -0.866 6.268
331 HH11 ARG 48 1HH2 ARG 48 5.566 -1.957 9.314
332 HH12 ARG 48 2HH2 ARG 48 3.956 -1.993 8.687
333 HH21 ARG 48 1HH1 ARG 48 4.836 -0.926 5.519
334 HH22 ARG 48 2HH1 ARG 48 3.545 -1.416 6.564
335 H MET 49 H MET 49 10.628 -3.253 4.042
336 HA MET 49 HA MET 49 12.227 -5.597 4.900
337 HB2 MET 49 2HB MET 49 9.659 -5.728 4.260
338 HB3 MET 49 1HB MET 49 10.292 -5.721 2.615
339 HG2 MET 49 2HG MET 49 11.798 -7.626 3.249
340 HG3 MET 49 1HG MET 49 10.993 -7.683 4.817
341 HE1 MET 49 3HE MET 49 11.236 -10.001 3.698
342 HE2 MET 49 1HE MET 49 9.908 -10.786 2.834
343 HE3 MET 49 2HE MET 49 9.710 -10.319 4.520
344 H SER 50 H SER 50 13.380 -3.185 3.808
345 HA SER 50 HA SER 50 14.754 -4.359 1.510
346 HB2 SER 50 2HB SER 50 14.540 -2.114 0.310
347 HB3 SER 50 1HB SER 50 13.101 -3.130 0.332
348 HG SER 50 HG SER 50 13.673 -0.764 1.717
349 HA PRO 51 HA PRO 51 18.175 -2.317 3.468
350 HB2 PRO 51 2HB PRO 51 19.945 -2.016 1.432
351 HB3 PRO 51 1HB PRO 51 19.528 -3.607 2.101
352 HG2 PRO 51 2HG PRO 51 18.591 -2.300 -0.399
353 HG3 PRO 51 1HG PRO 51 18.986 -3.997 -0.089
354 HD2 PRO 51 2HD PRO 51 16.407 -2.989 -0.157
355 HD3 PRO 51 1HD PRO 51 16.880 -4.475 0.691
356 H MET 52 H MET 52 19.155 -0.287 3.825
357 HA MET 52 HA MET 52 18.520 1.908 1.984
358 HB2 MET 52 2HB MET 52 17.731 3.323 3.879
359 HB3 MET 52 1HB MET 52 16.654 1.973 3.529
360 HG2 MET 52 2HG MET 52 18.823 1.577 5.565
361 HG3 MET 52 1HG MET 52 17.406 2.518 6.027
362 HE1 MET 52 3HE MET 52 16.844 0.146 7.991
363 HE2 MET 52 1HE MET 52 18.485 0.273 7.340
364 HE3 MET 52 2HE MET 52 17.629 -1.267 7.295
365 H GLY 53 H GLY 53 19.692 3.931 2.591
366 HA2 GLY 53 2HA GLY 53 21.484 5.021 3.760
367 HA3 GLY 53 1HA GLY 53 22.150 3.439 4.152
368 H THR 54 H THR 54 22.493 2.087 1.968
369 HA THR 54 HA THR 54 24.456 3.603 0.459
370 HB THR 54 HB THR 54 24.896 1.389 -0.624
371 HG1 THR 54 1HG THR 54 23.590 -0.223 -0.265
372 HG21 THR 54 3HG2 THR 54 26.129 2.029 1.385
373 HG22 THR 54 1HG2 THR 54 25.757 0.307 1.446
374 HG23 THR 54 2HG2 THR 54 24.814 1.447 2.405
375 H ALA 55 H ALA 55 23.794 4.834 -1.188
376 HA ALA 55 HA ALA 55 21.407 4.094 -2.716
377 HB1 ALA 55 1HB ALA 55 21.910 6.373 -3.814
378 HB2 ALA 55 2HB ALA 55 23.087 6.586 -2.516
379 HB3 ALA 55 3HB ALA 55 21.378 6.374 -2.132
380 H SER 56 H SER 56 21.474 4.320 -5.101
381 HA SER 56 HA SER 56 24.079 3.837 -6.345
382 HB2 SER 56 2HB SER 56 23.226 1.806 -7.497
383 HB3 SER 56 1HB SER 56 23.335 1.594 -5.750
384 HG SER 56 HG SER 56 21.334 0.890 -6.299
385 H GLY 57 H GLY 57 22.202 6.040 -6.446
386 HA2 GLY 57 2HA GLY 57 21.641 7.513 -8.166
387 HA3 GLY 57 1HA GLY 57 21.884 6.213 -9.329
388 H SER 58 H SER 58 19.786 6.474 -6.455
389 HA SER 58 HA SER 58 17.393 6.430 -8.129
390 HB2 SER 58 2HB SER 58 16.527 4.485 -6.661
391 HB3 SER 58 1HB SER 58 17.646 4.097 -7.965
392 HG SER 58 HG SER 58 17.967 3.970 -5.229
393 H ASN 59 H ASN 59 18.588 8.371 -6.323
394 HA ASN 59 HA ASN 59 17.141 8.338 -3.835
395 HB2 ASN 59 2HB ASN 59 18.767 10.457 -5.248
396 HB3 ASN 59 1HB ASN 59 17.989 10.720 -3.687
397 HD21 ASN 59 1HD2 ASN 59 18.930 9.723 -1.821
398 HD22 ASN 59 2HD2 ASN 59 20.385 8.852 -1.884
399 H SER 60 H SER 60 15.189 9.178 -3.380
400 HA SER 60 HA SER 60 13.600 10.258 -5.577
401 HB2 SER 60 2HB SER 60 12.767 9.702 -2.722
402 HB3 SER 60 1HB SER 60 11.707 9.973 -4.103
403 HG SER 60 HG SER 60 12.024 7.982 -4.720
404 HA PRO 61 HA PRO 61 14.016 14.457 -4.215
405 HB2 PRO 61 2HB PRO 61 11.719 15.595 -5.120
406 HB3 PRO 61 1HB PRO 61 13.011 15.055 -6.209
407 HG2 PRO 61 2HG PRO 61 10.427 13.747 -5.546
408 HG3 PRO 61 1HG PRO 61 11.292 13.830 -7.090
409 HD2 PRO 61 2HD PRO 61 11.318 11.629 -5.406
410 HD3 PRO 61 1HD PRO 61 12.571 11.983 -6.614
411 H THR 62 H THR 62 13.232 16.059 -2.706
412 HA THR 62 HA THR 62 11.852 14.918 -0.447
413 HB THR 62 HB THR 62 12.216 17.177 0.558
414 HG1 THR 62 1HG THR 62 12.101 18.415 -1.304
415 HG21 THR 62 3HG2 THR 62 14.596 15.890 -0.810
416 HG22 THR 62 1HG2 THR 62 13.942 15.458 0.770
417 HG23 THR 62 2HG2 THR 62 14.702 17.030 0.530
Start of MODEL 4
1 H1 GLY 1 1HT GLY 1 -37.962 6.006 4.828
2 H2 GLY 1 2HT GLY 1 -39.191 5.757 5.973
3 H3 GLY 1 3HT GLY 1 -38.339 7.226 5.946
4 HA2 GLY 1 2HA GLY 1 -40.581 7.398 4.962
5 HA3 GLY 1 1HA GLY 1 -39.283 7.829 3.849
6 H SER 2 H SER 2 -38.684 6.364 2.187
7 HA SER 2 HA SER 2 -40.861 4.648 1.296
8 HB2 SER 2 2HB SER 2 -39.627 6.196 -0.252
9 HB3 SER 2 1HB SER 2 -38.198 5.190 -0.039
10 HG SER 2 HG SER 2 -39.222 3.525 -1.024
11 H MET 3 H MET 3 -37.328 4.254 1.726
12 HA MET 3 HA MET 3 -37.628 1.353 1.832
13 HB2 MET 3 2HB MET 3 -35.193 3.145 1.963
14 HB3 MET 3 1HB MET 3 -35.140 1.382 1.980
15 HG2 MET 3 2HG MET 3 -36.520 2.936 -0.217
16 HG3 MET 3 1HG MET 3 -34.816 2.492 -0.302
17 HE1 MET 3 3HE MET 3 -34.942 1.539 -2.216
18 HE2 MET 3 1HE MET 3 -36.512 0.964 -2.792
19 HE3 MET 3 2HE MET 3 -35.210 -0.183 -2.481
20 H ALA 4 H ALA 4 -38.438 0.659 3.743
21 HA ALA 4 HA ALA 4 -36.932 1.355 6.183
22 HB1 ALA 4 1HB ALA 4 -39.943 1.405 5.870
23 HB2 ALA 4 2HB ALA 4 -38.892 2.760 6.286
24 HB3 ALA 4 3HB ALA 4 -39.113 1.431 7.427
25 H GLN 5 H GLN 5 -36.832 -0.982 4.450
26 HA GLN 5 HA GLN 5 -38.180 -3.087 5.977
27 HB2 GLN 5 2HB GLN 5 -38.009 -2.990 3.400
28 HB3 GLN 5 1HB GLN 5 -36.339 -3.508 3.631
29 HG2 GLN 5 2HG GLN 5 -37.052 -5.510 4.785
30 HG3 GLN 5 1HG GLN 5 -38.729 -4.966 4.790
31 HE21 GLN 5 1HE2 GLN 5 -36.174 -6.343 2.778
32 HE22 GLN 5 2HE2 GLN 5 -37.172 -6.683 1.437
33 H GLU 6 H GLU 6 -34.870 -2.346 4.842
34 HA GLU 6 HA GLU 6 -33.678 -4.237 6.662
35 HB2 GLU 6 2HB GLU 6 -31.521 -3.268 5.850
36 HB3 GLU 6 1HB GLU 6 -32.569 -3.824 4.547
37 HG2 GLU 6 2HG GLU 6 -33.175 -1.622 3.936
38 HG3 GLU 6 1HG GLU 6 -32.629 -0.953 5.471
39 H THR 7 H THR 7 -31.722 -3.341 8.011
40 HA THR 7 HA THR 7 -32.857 -1.385 9.868
41 HB THR 7 HB THR 7 -30.942 -2.096 11.322
42 HG1 THR 7 1HG THR 7 -29.411 -3.213 10.460
43 HG21 THR 7 3HG2 THR 7 -31.782 -4.455 11.626
44 HG22 THR 7 1HG2 THR 7 -32.762 -4.225 10.177
45 HG23 THR 7 2HG2 THR 7 -33.048 -3.227 11.603
46 H ASN 8 H ASN 8 -30.846 -0.109 10.995
47 HA ASN 8 HA ASN 8 -29.823 1.607 8.862
48 HB2 ASN 8 2HB ASN 8 -30.966 2.344 11.108
49 HB3 ASN 8 1HB ASN 8 -29.357 2.097 11.784
50 HD21 ASN 8 1HD2 ASN 8 -31.195 4.008 9.405
51 HD22 ASN 8 2HD2 ASN 8 -30.019 5.233 9.239
52 H GLN 9 H GLN 9 -28.610 -0.274 11.635
53 HA GLN 9 HA GLN 9 -25.846 0.145 10.793
54 HB2 GLN 9 2HB GLN 9 -26.594 0.158 13.222
55 HB3 GLN 9 1HB GLN 9 -26.828 -1.584 13.067
56 HG2 GLN 9 2HG GLN 9 -24.501 -1.912 12.502
57 HG3 GLN 9 1HG GLN 9 -24.228 -0.173 12.417
58 HE21 GLN 9 1HE2 GLN 9 -23.289 -2.534 14.317
59 HE22 GLN 9 2HE2 GLN 9 -23.460 -1.833 15.863
60 H THR 10 H THR 10 -25.231 -1.040 9.088
61 HA THR 10 HA THR 10 -25.504 -3.956 9.249
62 HB THR 10 HB THR 10 -26.014 -3.850 6.696
63 HG1 THR 10 1HG THR 10 -26.951 -2.014 6.019
64 HG21 THR 10 3HG2 THR 10 -28.253 -2.995 8.530
65 HG22 THR 10 1HG2 THR 10 -27.528 -4.600 8.634
66 HG23 THR 10 2HG2 THR 10 -28.329 -4.088 7.148
67 HA PRO 11 HA PRO 11 -21.178 -2.732 8.171
68 HB2 PRO 11 2HB PRO 11 -20.143 -5.264 8.714
69 HB3 PRO 11 1HB PRO 11 -20.270 -3.939 9.885
70 HG2 PRO 11 2HG PRO 11 -22.061 -6.276 9.471
71 HG3 PRO 11 1HG PRO 11 -21.543 -5.499 10.979
72 HD2 PRO 11 2HD PRO 11 -24.000 -5.071 9.958
73 HD3 PRO 11 1HD PRO 11 -23.107 -3.777 10.789
74 H GLY 12 H GLY 12 -21.114 -2.537 5.985
75 HA2 GLY 12 2HA GLY 12 -20.560 -4.878 4.382
76 HA3 GLY 12 1HA GLY 12 -22.100 -4.107 4.002
77 HA PRO 13 HA PRO 13 -20.224 -0.947 1.536
78 HB2 PRO 13 2HB PRO 13 -20.944 1.277 3.375
79 HB3 PRO 13 1HB PRO 13 -21.413 1.010 1.684
80 HG2 PRO 13 2HG PRO 13 -23.135 0.681 3.688
81 HG3 PRO 13 1HG PRO 13 -23.163 -0.358 2.249
82 HD2 PRO 13 2HD PRO 13 -22.101 -0.961 4.990
83 HD3 PRO 13 1HD PRO 13 -22.972 -2.023 3.858
84 H MET 14 H MET 14 -18.041 -1.664 1.989
85 HA MET 14 HA MET 14 -16.513 -0.553 4.143
86 HB2 MET 14 2HB MET 14 -15.764 -2.077 1.646
87 HB3 MET 14 1HB MET 14 -14.556 -1.483 2.790
88 HG2 MET 14 2HG MET 14 -16.914 -3.130 3.705
89 HG3 MET 14 1HG MET 14 -15.424 -3.889 3.147
90 HE1 MET 14 3HE MET 14 -13.081 -3.373 4.098
91 HE2 MET 14 1HE MET 14 -13.920 -4.755 4.816
92 HE3 MET 14 2HE MET 14 -12.987 -3.657 5.833
93 H LEU 15 H LEU 15 -16.940 1.687 3.926
94 HA LEU 15 HA LEU 15 -16.161 3.092 1.534
95 HB2 LEU 15 2HB LEU 15 -17.644 3.653 3.955
96 HB3 LEU 15 1HB LEU 15 -16.472 4.934 3.670
97 HG LEU 15 HG LEU 15 -17.336 5.118 1.313
98 HD11 LEU 15 1HD1 LEU 15 -19.174 2.974 2.360
99 HD12 LEU 15 2HD1 LEU 15 -18.349 3.061 0.804
100 HD13 LEU 15 3HD1 LEU 15 -19.744 4.092 1.121
101 HD21 LEU 15 3HD2 LEU 15 -18.158 6.661 2.999
102 HD22 LEU 15 1HD2 LEU 15 -19.314 5.463 3.582
103 HD23 LEU 15 2HD2 LEU 15 -19.511 6.173 1.979
104 H CYS 16 H CYS 16 -14.412 4.438 1.230
105 HA CYS 16 HA CYS 16 -11.919 3.686 2.011
106 HB2 CYS 16 2HB CYS 16 -12.606 5.362 0.220
107 HB3 CYS 16 1HB CYS 16 -12.580 6.581 1.498
108 H SER 17 H SER 17 -10.613 3.846 3.663
109 HA SER 17 HA SER 17 -11.434 4.721 6.217
110 HB2 SER 17 2HB SER 17 -8.603 4.288 5.252
111 HB3 SER 17 1HB SER 17 -9.152 4.279 6.926
112 HG SER 17 HG SER 17 -8.931 2.187 5.784
113 H THR 18 H THR 18 -9.867 6.478 3.619
114 HA THR 18 HA THR 18 -8.872 8.586 5.331
115 HB THR 18 HB THR 18 -8.143 9.674 3.314
116 HG1 THR 18 1HG THR 18 -9.663 9.486 1.843
117 HG21 THR 18 3HG2 THR 18 -6.698 7.980 2.406
118 HG22 THR 18 1HG2 THR 18 -7.805 6.696 2.894
119 HG23 THR 18 2HG2 THR 18 -6.923 7.610 4.117
120 H GLY 19 H GLY 19 -11.981 7.925 4.072
121 HA2 GLY 19 2HA GLY 19 -13.913 9.153 4.334
122 HA3 GLY 19 1HA GLY 19 -12.948 10.467 5.002
123 H CYS 20 H CYS 20 -12.137 9.134 1.852
124 HA CYS 20 HA CYS 20 -12.410 11.687 0.613
125 HB2 CYS 20 2HB CYS 20 -11.833 10.527 -1.481
126 HB3 CYS 20 1HB CYS 20 -10.748 10.066 -0.170
127 H GLY 21 H GLY 21 -14.736 9.235 1.285
128 HA2 GLY 21 2HA GLY 21 -17.047 9.463 1.028
129 HA3 GLY 21 1HA GLY 21 -16.776 10.734 -0.159
130 H PHE 22 H PHE 22 -14.866 8.014 -0.856
131 HA PHE 22 HA PHE 22 -16.762 7.149 -2.932
132 HB2 PHE 22 2HB PHE 22 -13.745 7.068 -2.734
133 HB3 PHE 22 1HB PHE 22 -14.634 6.170 -3.960
134 HD1 PHE 22 2HD PHE 22 -14.013 9.589 -2.622
135 HD2 PHE 22 1HD PHE 22 -15.507 7.241 -5.894
136 HE1 PHE 22 2HE PHE 22 -14.149 11.631 -4.024
137 HE2 PHE 22 1HE PHE 22 -15.643 9.283 -7.296
138 HZ PHE 22 HZ PHE 22 -14.965 11.476 -6.361
139 H TYR 23 H TYR 23 -15.889 4.712 -3.590
140 HA TYR 23 HA TYR 23 -16.534 3.105 -1.222
141 HB2 TYR 23 2HB TYR 23 -17.656 2.874 -3.559
142 HB3 TYR 23 1HB TYR 23 -16.181 1.999 -3.996
143 HD1 TYR 23 1HD TYR 23 -18.937 2.111 -1.478
144 HD2 TYR 23 2HD TYR 23 -15.872 -0.255 -3.339
145 HE1 TYR 23 1HE TYR 23 -19.791 0.098 -0.315
146 HE2 TYR 23 2HE TYR 23 -16.733 -2.277 -2.184
147 HH TYR 23 HH TYR 23 -18.132 -2.626 0.106
148 H GLY 24 H GLY 24 -15.209 1.538 -0.369
149 HA2 GLY 24 2HA GLY 24 -12.421 1.477 -1.394
150 HA3 GLY 24 1HA GLY 24 -12.863 1.276 0.302
151 H ASN 25 H ASN 25 -11.262 -0.626 -0.815
152 HA ASN 25 HA ASN 25 -13.064 -2.924 -1.328
153 HB2 ASN 25 2HB ASN 25 -11.163 -2.079 -3.008
154 HB3 ASN 25 1HB ASN 25 -10.154 -3.067 -1.966
155 HD21 ASN 25 1HD2 ASN 25 -9.817 -4.853 -3.371
156 HD22 ASN 25 2HD2 ASN 25 -11.089 -5.835 -3.945
157 HA PRO 26 HA PRO 26 -11.456 -4.467 2.575
158 HB2 PRO 26 2HB PRO 26 -12.445 -6.972 2.551
159 HB3 PRO 26 1HB PRO 26 -13.498 -5.548 2.720
160 HG2 PRO 26 2HG PRO 26 -12.902 -7.175 0.284
161 HG3 PRO 26 1HG PRO 26 -14.465 -6.585 0.884
162 HD2 PRO 26 2HD PRO 26 -13.062 -5.320 -1.099
163 HD3 PRO 26 1HD PRO 26 -14.146 -4.461 0.022
164 H ARG 27 H ARG 27 -10.792 -6.077 -0.490
165 HA ARG 27 HA ARG 27 -8.805 -7.876 0.543
166 HB2 ARG 27 2HB ARG 27 -9.335 -6.937 -2.289
167 HB3 ARG 27 1HB ARG 27 -8.267 -8.267 -1.832
168 HG2 ARG 27 2HG ARG 27 -10.125 -9.503 -0.866
169 HG3 ARG 27 1HG ARG 27 -11.216 -8.145 -1.141
170 HD2 ARG 27 2HD ARG 27 -11.448 -8.607 -3.366
171 HD3 ARG 27 1HD ARG 27 -9.774 -9.128 -3.544
172 HE ARG 27 HE ARG 27 -12.049 -10.806 -2.929
173 HH11 ARG 27 1HH2 ARG 27 -8.563 -10.508 -2.585
174 HH12 ARG 27 2HH2 ARG 27 -8.312 -12.219 -2.589
175 HH21 ARG 27 1HH1 ARG 27 -11.656 -13.028 -2.925
176 HH22 ARG 27 2HH1 ARG 27 -10.038 -13.628 -2.764
177 H THR 28 H THR 28 -8.876 -4.584 -0.623
178 HA THR 28 HA THR 28 -5.957 -4.385 -0.749
179 HB THR 28 HB THR 28 -6.369 -2.054 -1.432
180 HG1 THR 28 1HG THR 28 -8.168 -1.663 -0.124
181 HG21 THR 28 3HG2 THR 28 -6.931 -2.653 -3.543
182 HG22 THR 28 1HG2 THR 28 -8.479 -3.328 -3.040
183 HG23 THR 28 2HG2 THR 28 -7.010 -4.294 -2.909
184 H ASN 29 H ASN 29 -6.045 -1.589 0.476
185 HA ASN 29 HA ASN 29 -5.908 -2.480 3.259
186 HB2 ASN 29 2HB ASN 29 -4.339 -0.729 1.718
187 HB3 ASN 29 1HB ASN 29 -5.178 0.312 2.864
188 HD21 ASN 29 1HD2 ASN 29 -3.962 -3.066 3.262
189 HD22 ASN 29 2HD2 ASN 29 -2.965 -2.701 4.597
190 H GLY 30 H GLY 30 -8.551 -2.036 1.932
191 HA2 GLY 30 2HA GLY 30 -10.603 -1.292 2.671
192 HA3 GLY 30 1HA GLY 30 -9.790 -0.566 4.055
193 H MET 31 H MET 31 -8.504 0.355 0.978
194 HA MET 31 HA MET 31 -9.955 2.929 1.125
195 HB2 MET 31 2HB MET 31 -7.114 2.371 0.222
196 HB3 MET 31 1HB MET 31 -7.913 3.942 0.148
197 HG2 MET 31 2HG MET 31 -8.167 3.997 2.557
198 HG3 MET 31 1HG MET 31 -7.560 2.349 2.702
199 HE1 MET 31 3HE MET 31 -6.178 2.589 4.212
200 HE2 MET 31 1HE MET 31 -5.287 4.073 4.580
201 HE3 MET 31 2HE MET 31 -4.464 2.707 3.836
202 H CYS 32 H CYS 32 -10.107 4.047 -0.994
203 HA CYS 32 HA CYS 32 -11.150 2.266 -2.964
204 HB2 CYS 32 2HB CYS 32 -11.776 4.314 -4.163
205 HB3 CYS 32 1HB CYS 32 -12.197 4.447 -2.457
206 H SER 33 H SER 33 -10.374 3.525 -5.379
207 HA SER 33 HA SER 33 -7.915 2.147 -5.853
208 HB2 SER 33 2HB SER 33 -10.013 2.791 -7.415
209 HB3 SER 33 1HB SER 33 -8.883 4.051 -7.903
210 HG SER 33 HG SER 33 -7.434 2.510 -8.506
211 H VAL 34 H VAL 34 -8.736 5.598 -5.700
212 HA VAL 34 HA VAL 34 -6.127 6.488 -6.489
213 HB VAL 34 HB VAL 34 -8.169 8.116 -4.955
214 HG11 VAL 34 1HG1 VAL 34 -7.136 9.970 -6.245
215 HG12 VAL 34 2HG1 VAL 34 -5.999 8.824 -6.955
216 HG13 VAL 34 3HG1 VAL 34 -5.958 9.149 -5.222
217 HG21 VAL 34 3HG2 VAL 34 -9.457 7.342 -6.762
218 HG22 VAL 34 1HG2 VAL 34 -8.070 7.276 -7.847
219 HG23 VAL 34 2HG2 VAL 34 -8.771 8.835 -7.405
220 H CYS 35 H CYS 35 -7.775 6.373 -3.353
221 HA CYS 35 HA CYS 35 -5.611 7.333 -1.815
222 HB2 CYS 35 2HB CYS 35 -7.958 5.607 -1.001
223 HB3 CYS 35 1HB CYS 35 -6.852 6.398 0.122
224 H TYR 36 H TYR 36 -6.535 4.046 -2.799
225 HA TYR 36 HA TYR 36 -4.752 2.694 -1.060
226 HB2 TYR 36 2HB TYR 36 -6.641 1.556 -2.148
227 HB3 TYR 36 1HB TYR 36 -5.852 1.737 -3.720
228 HD1 TYR 36 1HD TYR 36 -4.628 0.713 -0.299
229 HD2 TYR 36 2HD TYR 36 -5.028 -0.321 -4.452
230 HE1 TYR 36 1HE TYR 36 -3.347 -1.370 0.095
231 HE2 TYR 36 2HE TYR 36 -3.748 -2.409 -4.053
232 HH TYR 36 HH TYR 36 -3.041 -3.575 -0.903
233 H LYS 37 H LYS 37 -4.266 4.017 -4.342
234 HA LYS 37 HA LYS 37 -1.681 2.784 -4.594
235 HB2 LYS 37 2HB LYS 37 -1.403 4.287 -6.573
236 HB3 LYS 37 1HB LYS 37 -2.846 3.286 -6.645
237 HG2 LYS 37 2HG LYS 37 -4.203 5.198 -5.857
238 HG3 LYS 37 1HG LYS 37 -2.756 6.206 -5.813
239 HD2 LYS 37 2HD LYS 37 -3.571 4.742 -8.322
240 HD3 LYS 37 1HD LYS 37 -4.270 6.310 -7.926
241 HE2 LYS 37 2HE LYS 37 -2.465 7.235 -8.918
242 HE3 LYS 37 1HE LYS 37 -1.513 6.675 -7.545
243 HZ1 LYS 37 3HZ LYS 37 -1.273 4.525 -8.748
244 HZ2 LYS 37 1HZ LYS 37 -0.515 5.835 -9.514
245 HZ3 LYS 37 2HZ LYS 37 -1.997 5.247 -10.103
246 H GLU 38 H GLU 38 -2.864 6.039 -3.774
247 HA GLU 38 HA GLU 38 -0.314 7.234 -3.443
248 HB2 GLU 38 2HB GLU 38 -3.002 7.908 -2.230
249 HB3 GLU 38 1HB GLU 38 -1.570 8.930 -2.086
250 HG2 GLU 38 2HG GLU 38 -1.465 8.805 -4.669
251 HG3 GLU 38 1HG GLU 38 -3.127 8.218 -4.571
252 H HIS 39 H HIS 39 -2.511 5.637 -1.122
253 HA HIS 39 HA HIS 39 -1.097 6.185 1.229
254 HB2 HIS 39 2HB HIS 39 -3.421 5.218 1.031
255 HB3 HIS 39 1HB HIS 39 -2.670 3.659 0.682
256 HD1 HIS 39 1HD HIS 39 -2.741 6.319 3.395
257 HD2 HIS 39 2HD HIS 39 -1.855 2.271 2.940
258 HE1 HIS 39 1HE HIS 39 -2.296 5.421 5.720
259 HE2 HIS 39 2HE HIS 39 -1.723 2.960 5.458
260 H LEU 40 H LEU 40 -0.859 3.297 -0.871
261 HA LEU 40 HA LEU 40 1.059 1.932 0.658
262 HB2 LEU 40 2HB LEU 40 -0.305 1.503 -1.767
263 HB3 LEU 40 1HB LEU 40 1.405 1.416 -2.190
264 HG LEU 40 HG LEU 40 1.703 -0.176 -0.236
265 HD11 LEU 40 1HD1 LEU 40 -0.280 -1.222 0.710
266 HD12 LEU 40 2HD1 LEU 40 -1.325 -0.272 -0.346
267 HD13 LEU 40 3HD1 LEU 40 -0.408 0.524 0.931
268 HD21 LEU 40 3HD2 LEU 40 1.523 -0.987 -2.553
269 HD22 LEU 40 1HD2 LEU 40 -0.238 -0.981 -2.427
270 HD23 LEU 40 2HD2 LEU 40 0.714 -2.098 -1.449
271 H GLN 41 H GLN 41 1.457 4.618 -1.540
272 HA GLN 41 HA GLN 41 4.199 4.297 -2.150
273 HB2 GLN 41 2HB GLN 41 2.521 5.876 -3.251
274 HB3 GLN 41 1HB GLN 41 2.813 6.960 -1.890
275 HG2 GLN 41 2HG GLN 41 5.240 6.914 -2.394
276 HG3 GLN 41 1HG GLN 41 4.915 5.879 -3.787
277 HE21 GLN 41 1HE2 GLN 41 3.814 6.840 -5.645
278 HE22 GLN 41 2HE2 GLN 41 3.687 8.533 -5.812
279 H ARG 42 H ARG 42 2.559 5.929 0.544
280 HA ARG 42 HA ARG 42 4.981 7.010 1.659
281 HB2 ARG 42 2HB ARG 42 2.310 6.584 3.021
282 HB3 ARG 42 1HB ARG 42 3.615 7.636 3.567
283 HG2 ARG 42 2HG ARG 42 3.208 8.534 0.984
284 HG3 ARG 42 1HG ARG 42 1.575 8.091 1.477
285 HD2 ARG 42 2HD ARG 42 1.698 9.537 3.414
286 HD3 ARG 42 1HD ARG 42 3.406 9.853 3.127
287 HE ARG 42 HE ARG 42 1.200 11.164 1.856
288 HH11 ARG 42 1HH2 ARG 42 4.511 10.094 1.323
289 HH12 ARG 42 2HH2 ARG 42 4.784 11.240 0.057
290 HH21 ARG 42 1HH1 ARG 42 1.625 12.629 0.197
291 HH22 ARG 42 2HH1 ARG 42 3.175 12.654 -0.574
292 H GLN 43 H GLN 43 3.168 4.029 2.040
293 HA GLN 43 HA GLN 43 4.414 3.171 4.472
294 HB2 GLN 43 2HB GLN 43 2.208 2.356 3.342
295 HB3 GLN 43 1HB GLN 43 3.273 1.283 2.431
296 HG2 GLN 43 2HG GLN 43 2.702 -0.010 4.306
297 HG3 GLN 43 1HG GLN 43 4.263 0.673 4.762
298 HE21 GLN 43 1HE2 GLN 43 0.732 1.150 5.183
299 HE22 GLN 43 2HE2 GLN 43 0.865 1.986 6.653
300 H GLN 44 H GLN 44 5.069 2.677 1.030
301 HA GLN 44 HA GLN 44 7.191 0.788 1.424
302 HB2 GLN 44 2HB GLN 44 5.814 1.165 -0.710
303 HB3 GLN 44 1HB GLN 44 6.872 2.546 -1.004
304 HG2 GLN 44 2HG GLN 44 8.801 1.186 -1.154
305 HG3 GLN 44 1HG GLN 44 7.996 -0.185 -0.392
306 HE21 GLN 44 1HE2 GLN 44 5.944 -0.952 -1.736
307 HE22 GLN 44 2HE2 GLN 44 6.168 -1.024 -3.426
308 H ASN 45 H ASN 45 7.016 4.294 1.020
309 HA ASN 45 HA ASN 45 9.885 4.631 0.957
310 HB2 ASN 45 2HB ASN 45 7.515 6.466 0.958
311 HB3 ASN 45 1HB ASN 45 9.123 7.112 1.284
312 HD21 ASN 45 1HD2 ASN 45 7.164 7.163 -1.188
313 HD22 ASN 45 2HD2 ASN 45 8.202 6.786 -2.487
314 H SER 46 H SER 46 7.759 3.964 3.496
315 HA SER 46 HA SER 46 8.573 5.703 5.545
316 HB2 SER 46 2HB SER 46 6.664 4.218 5.817
317 HB3 SER 46 1HB SER 46 7.707 2.806 5.704
318 HG SER 46 HG SER 46 7.731 4.832 7.693
319 H GLY 47 H GLY 47 9.817 2.432 4.769
320 HA2 GLY 47 2HA GLY 47 12.384 2.443 4.725
321 HA3 GLY 47 1HA GLY 47 12.227 3.025 6.380
322 H ARG 48 H ARG 48 11.080 0.361 4.288
323 HA ARG 48 HA ARG 48 11.141 -1.439 6.633
324 HB2 ARG 48 2HB ARG 48 9.546 -1.388 4.091
325 HB3 ARG 48 1HB ARG 48 9.831 -2.929 4.900
326 HG2 ARG 48 2HG ARG 48 8.973 -1.868 7.030
327 HG3 ARG 48 1HG ARG 48 8.498 -0.470 6.065
328 HD2 ARG 48 2HD ARG 48 6.803 -1.614 4.990
329 HD3 ARG 48 1HD ARG 48 7.611 -3.172 5.134
330 HE ARG 48 HE ARG 48 6.555 -3.474 7.170
331 HH11 ARG 48 1HH2 ARG 48 6.370 -0.066 6.318
332 HH12 ARG 48 2HH2 ARG 48 5.298 0.305 7.624
333 HH21 ARG 48 1HH1 ARG 48 5.164 -2.926 8.845
334 HH22 ARG 48 2HH1 ARG 48 4.623 -1.292 9.037
335 H MET 49 H MET 49 13.565 -0.667 5.323
336 HA MET 49 HA MET 49 14.346 -3.163 3.930
337 HB2 MET 49 2HB MET 49 14.585 -0.897 2.750
338 HB3 MET 49 1HB MET 49 15.892 -0.578 3.890
339 HG2 MET 49 2HG MET 49 16.980 -1.535 2.018
340 HG3 MET 49 1HG MET 49 16.836 -2.867 3.165
341 HE1 MET 49 3HE MET 49 17.471 -4.206 1.111
342 HE2 MET 49 1HE MET 49 17.198 -3.044 -0.195
343 HE3 MET 49 2HE MET 49 16.409 -4.619 -0.233
344 H SER 50 H SER 50 15.720 -0.666 6.099
345 HA SER 50 HA SER 50 17.623 -2.622 7.160
346 HB2 SER 50 2HB SER 50 17.325 0.359 7.342
347 HB3 SER 50 1HB SER 50 18.330 -0.500 8.504
348 HG SER 50 HG SER 50 19.646 -0.009 6.816
349 HA PRO 51 HA PRO 51 15.583 -3.545 10.971
350 HB2 PRO 51 2HB PRO 51 17.838 -2.447 12.574
351 HB3 PRO 51 1HB PRO 51 17.149 -4.081 12.560
352 HG2 PRO 51 2HG PRO 51 19.511 -3.550 11.452
353 HG3 PRO 51 1HG PRO 51 18.397 -4.738 10.752
354 HD2 PRO 51 2HD PRO 51 19.000 -1.950 9.834
355 HD3 PRO 51 1HD PRO 51 18.649 -3.404 8.872
356 H MET 52 H MET 52 17.443 -0.583 11.763
357 HA MET 52 HA MET 52 15.183 0.519 13.213
358 HB2 MET 52 2HB MET 52 17.678 0.746 13.835
359 HB3 MET 52 1HB MET 52 17.736 1.984 12.581
360 HG2 MET 52 2HG MET 52 15.918 3.215 13.692
361 HG3 MET 52 1HG MET 52 15.827 1.970 14.937
362 HE1 MET 52 3HE MET 52 16.594 5.376 15.033
363 HE2 MET 52 1HE MET 52 17.337 5.160 16.624
364 HE3 MET 52 2HE MET 52 15.869 4.281 16.206
365 H GLY 53 H GLY 53 17.250 1.802 10.581
366 HA2 GLY 53 2HA GLY 53 15.784 2.380 8.522
367 HA3 GLY 53 1HA GLY 53 14.979 3.447 9.668
368 H THR 54 H THR 54 16.565 4.905 10.932
369 HA THR 54 HA THR 54 18.384 6.144 8.967
370 HB THR 54 HB THR 54 18.264 8.069 10.689
371 HG1 THR 54 1HG THR 54 16.472 7.976 12.026
372 HG21 THR 54 3HG2 THR 54 15.813 7.183 9.143
373 HG22 THR 54 1HG2 THR 54 17.151 8.143 8.512
374 HG23 THR 54 2HG2 THR 54 16.090 8.817 9.749
375 H ALA 55 H ALA 55 20.502 6.699 9.507
376 HA ALA 55 HA ALA 55 21.730 5.002 11.525
377 HB1 ALA 55 1HB ALA 55 22.907 6.913 9.494
378 HB2 ALA 55 2HB ALA 55 22.818 5.157 9.362
379 HB3 ALA 55 3HB ALA 55 23.857 5.898 10.578
380 H SER 56 H SER 56 21.427 8.479 10.822
381 HA SER 56 HA SER 56 22.606 9.133 13.433
382 HB2 SER 56 2HB SER 56 23.166 10.305 11.165
383 HB3 SER 56 1HB SER 56 21.652 11.164 11.438
384 HG SER 56 HG SER 56 24.067 11.478 12.625
385 H GLY 57 H GLY 57 19.616 9.538 11.563
386 HA2 GLY 57 2HA GLY 57 17.440 9.855 12.256
387 HA3 GLY 57 1HA GLY 57 17.977 9.530 13.901
388 H SER 58 H SER 58 18.001 12.061 11.393
389 HA SER 58 HA SER 58 18.156 14.120 13.505
390 HB2 SER 58 2HB SER 58 18.488 14.483 10.522
391 HB3 SER 58 1HB SER 58 18.890 15.636 11.790
392 HG SER 58 HG SER 58 20.620 14.209 10.844
393 H ASN 59 H ASN 59 15.708 12.647 13.012
394 HA ASN 59 HA ASN 59 13.978 14.714 11.794
395 HB2 ASN 59 2HB ASN 59 12.255 12.903 11.722
396 HB3 ASN 59 1HB ASN 59 13.680 12.557 10.747
397 HD21 ASN 59 1HD2 ASN 59 15.179 10.893 11.542
398 HD22 ASN 59 2HD2 ASN 59 14.698 9.788 12.738
399 H SER 60 H SER 60 12.265 15.581 12.925
400 HA SER 60 HA SER 60 11.537 14.635 15.552
401 HB2 SER 60 2HB SER 60 12.099 16.875 16.622
402 HB3 SER 60 1HB SER 60 13.468 15.819 16.281
403 HG SER 60 HG SER 60 13.947 17.039 14.497
404 HA PRO 61 HA PRO 61 7.654 16.523 14.597
405 HB2 PRO 61 2HB PRO 61 7.654 17.912 17.234
406 HB3 PRO 61 1HB PRO 61 6.463 16.796 16.544
407 HG2 PRO 61 2HG PRO 61 8.115 16.042 18.488
408 HG3 PRO 61 1HG PRO 61 7.630 14.933 17.194
409 HD2 PRO 61 2HD PRO 61 10.233 16.360 17.574
410 HD3 PRO 61 1HD PRO 61 9.917 14.748 16.897
411 H THR 62 H THR 62 6.449 18.755 14.695
412 HA THR 62 HA THR 62 8.285 21.036 14.556
413 HB THR 62 HB THR 62 8.306 20.234 12.270
414 HG1 THR 62 1HG THR 62 8.057 22.203 11.636
415 HG21 THR 62 3HG2 THR 62 6.239 18.885 12.342
416 HG22 THR 62 1HG2 THR 62 6.219 19.997 10.972
417 HG23 THR 62 2HG2 THR 62 5.278 20.362 12.418
Start of MODEL 5
1 H1 GLY 1 1HT GLY 1 -42.902 -4.980 12.754
2 H2 GLY 1 2HT GLY 1 -42.088 -5.873 11.559
3 H3 GLY 1 3HT GLY 1 -42.013 -4.177 11.553
4 HA2 GLY 1 2HA GLY 1 -40.943 -5.874 13.740
5 HA3 GLY 1 1HA GLY 1 -39.967 -5.252 12.409
6 H SER 2 H SER 2 -40.624 -4.688 15.524
7 HA SER 2 HA SER 2 -40.985 -1.806 15.443
8 HB2 SER 2 2HB SER 2 -41.915 -3.374 17.242
9 HB3 SER 2 1HB SER 2 -40.270 -3.459 17.862
10 HG SER 2 HG SER 2 -40.446 -1.480 18.576
11 H MET 3 H MET 3 -39.398 -0.343 15.390
12 HA MET 3 HA MET 3 -36.632 -1.213 15.366
13 HB2 MET 3 2HB MET 3 -37.734 0.589 13.866
14 HB3 MET 3 1HB MET 3 -37.552 1.648 15.263
15 HG2 MET 3 2HG MET 3 -35.554 1.997 14.069
16 HG3 MET 3 1HG MET 3 -35.088 0.817 15.295
17 HE1 MET 3 3HE MET 3 -36.126 1.703 11.945
18 HE2 MET 3 1HE MET 3 -37.066 0.233 11.660
19 HE3 MET 3 2HE MET 3 -35.530 0.475 10.831
20 H ALA 4 H ALA 4 -35.993 -1.785 17.416
21 HA ALA 4 HA ALA 4 -35.870 0.401 19.396
22 HB1 ALA 4 1HB ALA 4 -36.375 -1.224 21.194
23 HB2 ALA 4 2HB ALA 4 -36.681 -2.460 19.973
24 HB3 ALA 4 3HB ALA 4 -37.726 -1.043 20.075
25 H GLN 5 H GLN 5 -34.854 -3.015 19.036
26 HA GLN 5 HA GLN 5 -32.172 -2.271 20.005
27 HB2 GLN 5 2HB GLN 5 -33.696 -4.865 19.861
28 HB3 GLN 5 1HB GLN 5 -31.946 -4.849 20.077
29 HG2 GLN 5 2HG GLN 5 -32.193 -3.426 22.069
30 HG3 GLN 5 1HG GLN 5 -33.943 -3.416 21.852
31 HE21 GLN 5 1HE2 GLN 5 -31.227 -5.309 23.010
32 HE22 GLN 5 2HE2 GLN 5 -32.149 -6.628 23.578
33 H GLU 6 H GLU 6 -33.001 -1.580 17.312
34 HA GLU 6 HA GLU 6 -31.409 -3.426 15.650
35 HB2 GLU 6 2HB GLU 6 -33.853 -2.587 15.097
36 HB3 GLU 6 1HB GLU 6 -33.004 -1.157 14.513
37 HG2 GLU 6 2HG GLU 6 -32.044 -3.878 13.679
38 HG3 GLU 6 1HG GLU 6 -33.450 -3.177 12.879
39 H THR 7 H THR 7 -29.416 -2.860 15.071
40 HA THR 7 HA THR 7 -28.273 -0.353 15.848
41 HB THR 7 HB THR 7 -26.286 -1.240 14.506
42 HG1 THR 7 1HG THR 7 -26.557 -3.018 13.428
43 HG21 THR 7 3HG2 THR 7 -26.402 -1.548 16.904
44 HG22 THR 7 1HG2 THR 7 -25.871 -3.067 16.180
45 HG23 THR 7 2HG2 THR 7 -27.541 -2.882 16.720
46 H ASN 8 H ASN 8 -27.252 1.195 14.432
47 HA ASN 8 HA ASN 8 -28.770 1.593 11.933
48 HB2 ASN 8 2HB ASN 8 -28.673 3.335 13.858
49 HB3 ASN 8 1HB ASN 8 -27.047 3.673 13.260
50 HD21 ASN 8 1HD2 ASN 8 -26.929 5.180 11.594
51 HD22 ASN 8 2HD2 ASN 8 -28.236 5.624 10.591
52 H GLN 9 H GLN 9 -26.465 -0.243 12.149
53 HA GLN 9 HA GLN 9 -24.793 0.975 10.054
54 HB2 GLN 9 2HB GLN 9 -23.739 -0.466 12.501
55 HB3 GLN 9 1HB GLN 9 -22.764 0.032 11.118
56 HG2 GLN 9 2HG GLN 9 -23.456 2.388 11.513
57 HG3 GLN 9 1HG GLN 9 -24.348 1.866 12.941
58 HE21 GLN 9 1HE2 GLN 9 -21.050 2.065 11.565
59 HE22 GLN 9 2HE2 GLN 9 -20.253 2.017 13.073
60 H THR 10 H THR 10 -25.020 -0.293 8.326
61 HA THR 10 HA THR 10 -25.386 -3.199 8.706
62 HB THR 10 HB THR 10 -26.246 -3.159 6.367
63 HG1 THR 10 1HG THR 10 -25.739 -1.457 5.277
64 HG21 THR 10 3HG2 THR 10 -27.881 -3.035 8.111
65 HG22 THR 10 1HG2 THR 10 -28.326 -1.807 6.927
66 HG23 THR 10 2HG2 THR 10 -27.514 -1.337 8.422
67 HA PRO 11 HA PRO 11 -21.264 -3.527 6.941
68 HB2 PRO 11 2HB PRO 11 -21.011 -6.207 6.851
69 HB3 PRO 11 1HB PRO 11 -21.051 -5.330 8.393
70 HG2 PRO 11 2HG PRO 11 -23.203 -6.883 7.044
71 HG3 PRO 11 1HG PRO 11 -22.786 -6.792 8.763
72 HD2 PRO 11 2HD PRO 11 -24.853 -5.366 7.571
73 HD3 PRO 11 1HD PRO 11 -24.066 -4.919 9.099
74 H GLY 12 H GLY 12 -20.754 -3.160 4.834
75 HA2 GLY 12 2HA GLY 12 -20.908 -4.911 2.734
76 HA3 GLY 12 1HA GLY 12 -22.450 -4.058 2.684
77 HA PRO 13 HA PRO 13 -20.465 -0.592 0.769
78 HB2 PRO 13 2HB PRO 13 -21.173 1.661 2.099
79 HB3 PRO 13 1HB PRO 13 -22.353 0.667 1.218
80 HG2 PRO 13 2HG PRO 13 -21.812 0.826 4.136
81 HG3 PRO 13 1HG PRO 13 -23.352 0.631 3.277
82 HD2 PRO 13 2HD PRO 13 -21.936 -1.446 4.476
83 HD3 PRO 13 1HD PRO 13 -23.156 -1.654 3.199
84 H MET 14 H MET 14 -18.275 -1.353 1.310
85 HA MET 14 HA MET 14 -16.856 -0.273 3.550
86 HB2 MET 14 2HB MET 14 -16.093 -1.835 1.106
87 HB3 MET 14 1HB MET 14 -14.837 -1.089 2.095
88 HG2 MET 14 2HG MET 14 -17.006 -2.820 3.295
89 HG3 MET 14 1HG MET 14 -15.483 -3.492 2.712
90 HE1 MET 14 3HE MET 14 -15.462 -3.404 6.665
91 HE2 MET 14 1HE MET 14 -14.994 -4.431 5.303
92 HE3 MET 14 2HE MET 14 -16.647 -3.840 5.435
93 H LEU 15 H LEU 15 -17.323 1.991 3.336
94 HA LEU 15 HA LEU 15 -16.337 3.474 1.069
95 HB2 LEU 15 2HB LEU 15 -17.960 3.990 3.401
96 HB3 LEU 15 1HB LEU 15 -16.684 5.198 3.328
97 HG LEU 15 HG LEU 15 -17.313 5.688 0.966
98 HD11 LEU 15 1HD1 LEU 15 -18.275 3.605 0.248
99 HD12 LEU 15 2HD1 LEU 15 -19.577 4.794 0.220
100 HD13 LEU 15 3HD1 LEU 15 -19.468 3.637 1.546
101 HD21 LEU 15 3HD2 LEU 15 -19.323 6.926 1.496
102 HD22 LEU 15 1HD2 LEU 15 -18.316 6.905 2.945
103 HD23 LEU 15 2HD2 LEU 15 -19.708 5.828 2.821
104 H CYS 16 H CYS 16 -14.449 4.684 0.927
105 HA CYS 16 HA CYS 16 -12.070 3.782 1.808
106 HB2 CYS 16 2HB CYS 16 -12.585 5.710 0.202
107 HB3 CYS 16 1HB CYS 16 -12.534 6.748 1.630
108 H SER 17 H SER 17 -10.856 3.699 3.599
109 HA SER 17 HA SER 17 -11.898 4.450 6.130
110 HB2 SER 17 2HB SER 17 -9.151 3.558 5.254
111 HB3 SER 17 1HB SER 17 -9.556 3.895 6.936
112 HG SER 17 HG SER 17 -9.997 1.682 5.581
113 H THR 18 H THR 18 -9.895 6.147 3.809
114 HA THR 18 HA THR 18 -8.959 8.116 5.699
115 HB THR 18 HB THR 18 -8.005 9.246 3.772
116 HG1 THR 18 1HG THR 18 -8.812 8.977 1.868
117 HG21 THR 18 3HG2 THR 18 -6.573 7.435 2.922
118 HG22 THR 18 1HG2 THR 18 -7.716 6.232 3.523
119 HG23 THR 18 2HG2 THR 18 -6.825 7.249 4.657
120 H GLY 19 H GLY 19 -11.937 7.634 4.052
121 HA2 GLY 19 2HA GLY 19 -13.874 8.866 4.200
122 HA3 GLY 19 1HA GLY 19 -12.981 10.100 5.084
123 H CYS 20 H CYS 20 -12.221 8.905 1.820
124 HA CYS 20 HA CYS 20 -12.220 11.622 0.831
125 HB2 CYS 20 2HB CYS 20 -11.510 10.649 -1.309
126 HB3 CYS 20 1HB CYS 20 -10.538 10.032 0.026
127 H GLY 21 H GLY 21 -14.717 9.373 1.265
128 HA2 GLY 21 2HA GLY 21 -16.967 9.698 0.785
129 HA3 GLY 21 1HA GLY 21 -16.521 10.980 -0.337
130 H PHE 22 H PHE 22 -14.666 8.229 -1.029
131 HA PHE 22 HA PHE 22 -16.519 7.450 -3.188
132 HB2 PHE 22 2HB PHE 22 -13.504 7.395 -2.991
133 HB3 PHE 22 1HB PHE 22 -14.398 6.569 -4.271
134 HD1 PHE 22 2HD PHE 22 -13.542 9.859 -2.815
135 HD2 PHE 22 1HD PHE 22 -15.540 7.806 -6.017
136 HE1 PHE 22 2HE PHE 22 -13.742 11.994 -4.060
137 HE2 PHE 22 1HE PHE 22 -15.736 9.941 -7.263
138 HZ PHE 22 HZ PHE 22 -14.840 12.038 -6.285
139 H TYR 23 H TYR 23 -16.103 5.119 -3.919
140 HA TYR 23 HA TYR 23 -16.588 3.424 -1.642
141 HB2 TYR 23 2HB TYR 23 -17.625 3.318 -4.049
142 HB3 TYR 23 1HB TYR 23 -16.189 2.359 -4.421
143 HD1 TYR 23 1HD TYR 23 -18.935 2.630 -1.874
144 HD2 TYR 23 2HD TYR 23 -16.187 0.064 -3.952
145 HE1 TYR 23 1HE TYR 23 -19.975 0.649 -0.800
146 HE2 TYR 23 2HE TYR 23 -17.225 -1.916 -2.882
147 HH TYR 23 HH TYR 23 -18.575 -2.287 -0.624
148 H GLY 24 H GLY 24 -15.376 1.699 -0.906
149 HA2 GLY 24 2HA GLY 24 -12.540 1.602 -1.791
150 HA3 GLY 24 1HA GLY 24 -13.043 1.405 -0.109
151 H ASN 25 H ASN 25 -11.494 -0.570 -1.200
152 HA ASN 25 HA ASN 25 -13.400 -2.748 -1.841
153 HB2 ASN 25 2HB ASN 25 -11.300 -2.017 -3.350
154 HB3 ASN 25 1HB ASN 25 -10.467 -3.115 -2.256
155 HD21 ASN 25 1HD2 ASN 25 -10.409 -5.204 -3.061
156 HD22 ASN 25 2HD2 ASN 25 -11.628 -5.924 -4.011
157 HA PRO 26 HA PRO 26 -12.241 -4.469 2.114
158 HB2 PRO 26 2HB PRO 26 -13.237 -6.966 1.900
159 HB3 PRO 26 1HB PRO 26 -14.269 -5.530 2.045
160 HG2 PRO 26 2HG PRO 26 -13.559 -7.101 -0.388
161 HG3 PRO 26 1HG PRO 26 -15.119 -6.416 0.093
162 HD2 PRO 26 2HD PRO 26 -13.428 -5.225 -1.727
163 HD3 PRO 26 1HD PRO 26 -14.612 -4.332 -0.747
164 H ARG 27 H ARG 27 -11.298 -6.099 -0.878
165 HA ARG 27 HA ARG 27 -9.384 -7.867 0.339
166 HB2 ARG 27 2HB ARG 27 -9.457 -6.902 -2.533
167 HB3 ARG 27 1HB ARG 27 -8.621 -8.322 -1.915
168 HG2 ARG 27 2HG ARG 27 -10.769 -9.344 -1.292
169 HG3 ARG 27 1HG ARG 27 -11.628 -7.912 -1.863
170 HD2 ARG 27 2HD ARG 27 -10.915 -8.296 -4.131
171 HD3 ARG 27 1HD ARG 27 -9.803 -9.562 -3.628
172 HE ARG 27 HE ARG 27 -12.310 -10.399 -2.790
173 HH11 ARG 27 1HH2 ARG 27 -10.847 -9.556 -5.885
174 HH12 ARG 27 2HH2 ARG 27 -11.850 -10.654 -6.768
175 HH21 ARG 27 1HH1 ARG 27 -13.580 -11.799 -4.004
176 HH22 ARG 27 2HH1 ARG 27 -13.380 -11.904 -5.722
177 H THR 28 H THR 28 -9.399 -4.548 -0.744
178 HA THR 28 HA THR 28 -6.496 -4.264 -0.672
179 HB THR 28 HB THR 28 -6.951 -1.911 -1.251
180 HG1 THR 28 1HG THR 28 -8.791 -1.577 -0.025
181 HG21 THR 28 3HG2 THR 28 -8.544 -3.982 -2.759
182 HG22 THR 28 1HG2 THR 28 -6.946 -3.346 -3.149
183 HG23 THR 28 2HG2 THR 28 -8.369 -2.322 -3.329
184 H ASN 29 H ASN 29 -6.632 -1.585 0.660
185 HA ASN 29 HA ASN 29 -6.613 -2.548 3.418
186 HB2 ASN 29 2HB ASN 29 -5.042 -0.722 1.938
187 HB3 ASN 29 1HB ASN 29 -5.916 0.263 3.112
188 HD21 ASN 29 1HD2 ASN 29 -3.343 -2.050 2.710
189 HD22 ASN 29 2HD2 ASN 29 -2.910 -2.156 4.359
190 H GLY 30 H GLY 30 -9.216 -2.031 1.931
191 HA2 GLY 30 2HA GLY 30 -11.296 -1.253 2.559
192 HA3 GLY 30 1HA GLY 30 -10.564 -0.612 4.030
193 H MET 31 H MET 31 -8.968 0.354 1.125
194 HA MET 31 HA MET 31 -10.339 2.969 1.171
195 HB2 MET 31 2HB MET 31 -7.400 2.322 0.821
196 HB3 MET 31 1HB MET 31 -8.101 3.910 0.498
197 HG2 MET 31 2HG MET 31 -8.422 4.385 2.725
198 HG3 MET 31 1HG MET 31 -8.770 2.710 3.145
199 HE1 MET 31 3HE MET 31 -5.255 3.845 1.204
200 HE2 MET 31 1HE MET 31 -4.804 4.836 2.598
201 HE3 MET 31 2HE MET 31 -6.344 5.101 1.783
202 H CYS 32 H CYS 32 -10.138 4.151 -0.892
203 HA CYS 32 HA CYS 32 -10.888 2.480 -3.071
204 HB2 CYS 32 2HB CYS 32 -11.322 4.565 -4.259
205 HB3 CYS 32 1HB CYS 32 -11.957 4.666 -2.626
206 H SER 33 H SER 33 -9.856 3.709 -5.304
207 HA SER 33 HA SER 33 -7.318 2.410 -5.528
208 HB2 SER 33 2HB SER 33 -7.560 3.801 -7.869
209 HB3 SER 33 1HB SER 33 -8.291 2.241 -7.546
210 HG SER 33 HG SER 33 -9.510 4.491 -8.116
211 H VAL 34 H VAL 34 -8.299 5.817 -5.368
212 HA VAL 34 HA VAL 34 -5.724 6.853 -6.043
213 HB VAL 34 HB VAL 34 -7.835 8.354 -4.484
214 HG11 VAL 34 1HG1 VAL 34 -6.901 10.245 -5.802
215 HG12 VAL 34 2HG1 VAL 34 -5.731 9.135 -6.516
216 HG13 VAL 34 3HG1 VAL 34 -5.687 9.472 -4.785
217 HG21 VAL 34 3HG2 VAL 34 -9.126 7.524 -6.283
218 HG22 VAL 34 1HG2 VAL 34 -7.762 7.572 -7.401
219 HG23 VAL 34 2HG2 VAL 34 -8.540 9.071 -6.893
220 H CYS 35 H CYS 35 -7.433 6.532 -2.951
221 HA CYS 35 HA CYS 35 -5.312 7.535 -1.348
222 HB2 CYS 35 2HB CYS 35 -7.646 5.792 -0.527
223 HB3 CYS 35 1HB CYS 35 -6.601 6.707 0.560
224 H TYR 36 H TYR 36 -6.217 4.283 -2.396
225 HA TYR 36 HA TYR 36 -4.489 2.907 -0.596
226 HB2 TYR 36 2HB TYR 36 -6.411 1.803 -1.658
227 HB3 TYR 36 1HB TYR 36 -5.646 1.970 -3.237
228 HD1 TYR 36 1HD TYR 36 -4.887 0.613 0.202
229 HD2 TYR 36 2HD TYR 36 -4.383 0.182 -4.046
230 HE1 TYR 36 1HE TYR 36 -3.675 -1.523 0.559
231 HE2 TYR 36 2HE TYR 36 -3.171 -1.953 -3.684
232 HH TYR 36 HH TYR 36 -1.742 -2.870 -1.246
233 H LYS 37 H LYS 37 -3.925 4.476 -3.725
234 HA LYS 37 HA LYS 37 -1.436 3.096 -4.190
235 HB2 LYS 37 2HB LYS 37 -3.092 4.323 -5.880
236 HB3 LYS 37 1HB LYS 37 -2.082 5.714 -5.489
237 HG2 LYS 37 2HG LYS 37 -0.169 4.766 -6.418
238 HG3 LYS 37 1HG LYS 37 -0.747 3.117 -6.181
239 HD2 LYS 37 2HD LYS 37 -0.990 3.388 -8.490
240 HD3 LYS 37 1HD LYS 37 -2.602 3.796 -7.902
241 HE2 LYS 37 2HE LYS 37 -2.224 6.124 -8.147
242 HE3 LYS 37 1HE LYS 37 -0.478 5.908 -8.273
243 HZ1 LYS 37 3HZ LYS 37 -2.542 5.172 -10.268
244 HZ2 LYS 37 1HZ LYS 37 -0.940 4.619 -10.356
245 HZ3 LYS 37 2HZ LYS 37 -1.270 6.284 -10.446
246 H GLU 38 H GLU 38 -2.458 6.309 -3.067
247 HA GLU 38 HA GLU 38 0.141 7.375 -2.679
248 HB2 GLU 38 2HB GLU 38 -2.548 8.065 -1.488
249 HB3 GLU 38 1HB GLU 38 -1.088 8.985 -1.130
250 HG2 GLU 38 2HG GLU 38 -1.536 8.500 -4.021
251 HG3 GLU 38 1HG GLU 38 -2.783 9.480 -3.250
252 H HIS 39 H HIS 39 -2.064 5.576 -0.566
253 HA HIS 39 HA HIS 39 -0.585 5.850 1.836
254 HB2 HIS 39 2HB HIS 39 -3.002 5.058 1.532
255 HB3 HIS 39 1HB HIS 39 -2.316 3.487 1.105
256 HD1 HIS 39 1HD HIS 39 -2.070 6.021 3.946
257 HD2 HIS 39 2HD HIS 39 -1.802 1.909 3.309
258 HE1 HIS 39 1HE HIS 39 -1.840 4.958 6.225
259 HE2 HIS 39 2HE HIS 39 -1.637 2.453 5.861
260 H LEU 40 H LEU 40 -0.557 3.396 -0.731
261 HA LEU 40 HA LEU 40 1.271 1.656 0.600
262 HB2 LEU 40 2HB LEU 40 -0.356 1.520 -1.670
263 HB3 LEU 40 1HB LEU 40 1.274 1.369 -2.312
264 HG LEU 40 HG LEU 40 1.685 -0.419 -0.559
265 HD11 LEU 40 1HD1 LEU 40 -1.323 -0.142 -0.229
266 HD12 LEU 40 2HD1 LEU 40 -0.112 0.231 0.998
267 HD13 LEU 40 3HD1 LEU 40 -0.343 -1.435 0.464
268 HD21 LEU 40 3HD2 LEU 40 0.714 -2.125 -1.889
269 HD22 LEU 40 1HD2 LEU 40 0.914 -0.778 -3.007
270 HD23 LEU 40 2HD2 LEU 40 -0.671 -1.123 -2.315
271 H GLN 41 H GLN 41 1.739 4.165 -1.914
272 HA GLN 41 HA GLN 41 4.484 3.595 -2.338
273 HB2 GLN 41 2HB GLN 41 4.606 5.805 -3.400
274 HB3 GLN 41 1HB GLN 41 3.187 4.915 -3.939
275 HG2 GLN 41 2HG GLN 41 1.794 6.172 -2.319
276 HG3 GLN 41 1HG GLN 41 3.223 7.078 -1.810
277 HE21 GLN 41 1HE2 GLN 41 4.075 8.695 -3.267
278 HE22 GLN 41 2HE2 GLN 41 3.212 9.201 -4.652
279 H ARG 42 H ARG 42 2.811 5.649 -0.017
280 HA ARG 42 HA ARG 42 5.222 6.839 1.029
281 HB2 ARG 42 2HB ARG 42 2.766 7.760 1.082
282 HB3 ARG 42 1HB ARG 42 2.628 6.779 2.542
283 HG2 ARG 42 2HG ARG 42 4.397 7.960 3.624
284 HG3 ARG 42 1HG ARG 42 4.905 8.726 2.121
285 HD2 ARG 42 2HD ARG 42 2.350 9.615 2.223
286 HD3 ARG 42 1HD ARG 42 2.660 9.429 3.947
287 HE ARG 42 HE ARG 42 4.854 10.792 3.006
288 HH11 ARG 42 1HH2 ARG 42 1.386 11.354 2.884
289 HH12 ARG 42 2HH2 ARG 42 1.560 13.072 2.893
290 HH21 ARG 42 1HH1 ARG 42 5.012 13.042 2.996
291 HH22 ARG 42 2HH1 ARG 42 3.582 14.020 2.954
292 H GLN 43 H GLN 43 3.309 3.984 1.702
293 HA GLN 43 HA GLN 43 4.435 3.462 4.306
294 HB2 GLN 43 2HB GLN 43 2.175 2.641 3.453
295 HB3 GLN 43 1HB GLN 43 3.071 1.472 2.486
296 HG2 GLN 43 2HG GLN 43 4.147 0.608 4.541
297 HG3 GLN 43 1HG GLN 43 3.219 1.756 5.500
298 HE21 GLN 43 1HE2 GLN 43 1.217 1.032 6.237
299 HE22 GLN 43 2HE2 GLN 43 0.387 -0.314 5.618
300 H GLN 44 H GLN 44 5.109 2.451 0.985
301 HA GLN 44 HA GLN 44 7.039 0.451 1.741
302 HB2 GLN 44 2HB GLN 44 7.481 0.234 -0.653
303 HB3 GLN 44 1HB GLN 44 5.746 0.257 -0.346
304 HG2 GLN 44 2HG GLN 44 5.693 2.670 -0.950
305 HG3 GLN 44 1HG GLN 44 7.418 2.606 -1.300
306 HE21 GLN 44 1HE2 GLN 44 4.265 1.266 -2.336
307 HE22 GLN 44 2HE2 GLN 44 4.776 0.872 -3.916
308 H ASN 45 H ASN 45 7.224 3.878 1.174
309 HA ASN 45 HA ASN 45 9.866 4.176 0.317
310 HB2 ASN 45 2HB ASN 45 8.056 5.964 0.549
311 HB3 ASN 45 1HB ASN 45 8.531 6.067 2.244
312 HD21 ASN 45 1HD2 ASN 45 9.063 7.603 -0.619
313 HD22 ASN 45 2HD2 ASN 45 10.659 8.146 -0.362
314 H SER 46 H SER 46 8.617 3.789 3.627
315 HA SER 46 HA SER 46 11.384 3.293 4.538
316 HB2 SER 46 2HB SER 46 10.576 5.636 5.115
317 HB3 SER 46 1HB SER 46 9.384 4.868 6.160
318 HG SER 46 HG SER 46 10.907 4.476 7.548
319 H GLY 47 H GLY 47 7.983 3.233 5.657
320 HA2 GLY 47 2HA GLY 47 6.756 1.554 6.654
321 HA3 GLY 47 1HA GLY 47 8.017 0.421 6.168
322 H ARG 48 H ARG 48 8.000 3.282 8.316
323 HA ARG 48 HA ARG 48 9.113 1.581 10.480
324 HB2 ARG 48 2HB ARG 48 10.647 3.346 9.425
325 HB3 ARG 48 1HB ARG 48 9.601 4.542 10.189
326 HG2 ARG 48 2HG ARG 48 10.077 3.671 12.387
327 HG3 ARG 48 1HG ARG 48 10.913 2.272 11.710
328 HD2 ARG 48 2HD ARG 48 11.800 5.158 11.431
329 HD3 ARG 48 1HD ARG 48 12.524 3.966 12.505
330 HE ARG 48 HE ARG 48 12.668 2.799 10.031
331 HH11 ARG 48 1HH2 ARG 48 13.744 5.892 11.319
332 HH12 ARG 48 2HH2 ARG 48 15.078 5.996 10.225
333 HH21 ARG 48 1HH1 ARG 48 14.414 2.998 8.638
334 HH22 ARG 48 2HH1 ARG 48 15.453 4.380 8.722
335 H MET 49 H MET 49 8.547 2.231 12.666
336 HA MET 49 HA MET 49 5.775 2.877 12.937
337 HB2 MET 49 2HB MET 49 7.957 2.722 15.036
338 HB3 MET 49 1HB MET 49 6.225 2.796 15.363
339 HG2 MET 49 2HG MET 49 5.872 0.690 14.173
340 HG3 MET 49 1HG MET 49 7.581 0.620 13.740
341 HE1 MET 49 3HE MET 49 7.234 -2.245 16.313
342 HE2 MET 49 1HE MET 49 7.781 -1.760 14.704
343 HE3 MET 49 2HE MET 49 6.065 -1.721 15.103
344 H SER 50 H SER 50 5.009 4.878 12.600
345 HA SER 50 HA SER 50 6.260 7.117 14.014
346 HB2 SER 50 2HB SER 50 6.133 8.515 11.932
347 HB3 SER 50 1HB SER 50 7.357 7.251 11.883
348 HG SER 50 HG SER 50 6.310 6.920 10.035
349 HA PRO 51 HA PRO 51 2.051 8.330 14.656
350 HB2 PRO 51 2HB PRO 51 2.188 11.079 14.600
351 HB3 PRO 51 1HB PRO 51 2.750 10.091 15.962
352 HG2 PRO 51 2HG PRO 51 4.317 11.341 13.762
353 HG3 PRO 51 1HG PRO 51 4.696 11.215 15.488
354 HD2 PRO 51 2HD PRO 51 5.821 9.576 13.639
355 HD3 PRO 51 1HD PRO 51 5.481 9.043 15.299
356 H MET 52 H MET 52 0.180 9.490 13.696
357 HA MET 52 HA MET 52 0.018 9.104 10.894
358 HB2 MET 52 2HB MET 52 -2.215 10.205 11.096
359 HB3 MET 52 1HB MET 52 -1.979 8.895 12.248
360 HG2 MET 52 2HG MET 52 -1.546 10.452 14.042
361 HG3 MET 52 1HG MET 52 -1.489 11.810 12.922
362 HE1 MET 52 3HE MET 52 -3.256 10.950 15.649
363 HE2 MET 52 1HE MET 52 -4.724 11.885 15.331
364 HE3 MET 52 2HE MET 52 -3.140 12.604 15.051
365 H GLY 53 H GLY 53 0.654 11.948 12.875
366 HA2 GLY 53 2HA GLY 53 1.798 13.873 12.174
367 HA3 GLY 53 1HA GLY 53 1.536 13.395 10.501
368 H THR 54 H THR 54 -0.872 13.408 9.838
369 HA THR 54 HA THR 54 -1.889 16.063 10.379
370 HB THR 54 HB THR 54 -3.277 13.954 8.737
371 HG1 THR 54 1HG THR 54 -1.134 15.649 7.977
372 HG21 THR 54 3HG2 THR 54 -4.166 15.837 7.557
373 HG22 THR 54 1HG2 THR 54 -3.024 16.940 8.326
374 HG23 THR 54 2HG2 THR 54 -4.321 16.213 9.274
375 H ALA 55 H ALA 55 -3.676 16.626 11.522
376 HA ALA 55 HA ALA 55 -4.698 14.758 13.455
377 HB1 ALA 55 1HB ALA 55 -4.485 17.022 14.176
378 HB2 ALA 55 2HB ALA 55 -6.216 16.716 14.037
379 HB3 ALA 55 3HB ALA 55 -5.377 17.622 12.779
380 H SER 56 H SER 56 -7.031 14.362 13.761
381 HA SER 56 HA SER 56 -8.267 13.606 11.236
382 HB2 SER 56 2HB SER 56 -8.185 12.140 13.330
383 HB3 SER 56 1HB SER 56 -9.410 13.213 14.002
384 HG SER 56 HG SER 56 -10.820 12.223 12.813
385 H GLY 57 H GLY 57 -10.851 13.830 11.413
386 HA2 GLY 57 2HA GLY 57 -12.699 15.217 11.439
387 HA3 GLY 57 1HA GLY 57 -11.819 16.299 12.515
388 H SER 58 H SER 58 -11.109 15.167 9.202
389 HA SER 58 HA SER 58 -10.497 17.897 8.390
390 HB2 SER 58 2HB SER 58 -9.749 16.857 6.294
391 HB3 SER 58 1HB SER 58 -9.025 16.055 7.685
392 HG SER 58 HG SER 58 -9.958 14.645 6.042
393 H ASN 59 H ASN 59 -12.852 15.349 7.651
394 HA ASN 59 HA ASN 59 -14.239 16.980 5.695
395 HB2 ASN 59 2HB ASN 59 -14.710 14.250 6.881
396 HB3 ASN 59 1HB ASN 59 -15.906 15.029 5.845
397 HD21 ASN 59 1HD2 ASN 59 -12.907 13.281 5.860
398 HD22 ASN 59 2HD2 ASN 59 -12.610 13.367 4.191
399 H SER 60 H SER 60 -15.775 18.419 6.145
400 HA SER 60 HA SER 60 -17.645 18.023 8.320
401 HB2 SER 60 2HB SER 60 -15.713 20.353 8.373
402 HB3 SER 60 1HB SER 60 -17.127 20.191 9.410
403 HG SER 60 HG SER 60 -15.472 19.340 10.561
404 HA PRO 61 HA PRO 61 -20.382 20.236 5.641
405 HB2 PRO 61 2HB PRO 61 -21.234 21.977 7.902
406 HB3 PRO 61 1HB PRO 61 -22.203 20.913 6.867
407 HG2 PRO 61 2HG PRO 61 -21.642 20.277 9.391
408 HG3 PRO 61 1HG PRO 61 -21.738 19.049 8.116
409 HD2 PRO 61 2HD PRO 61 -19.313 20.210 9.436
410 HD3 PRO 61 1HD PRO 61 -19.597 18.556 8.848
411 H THR 62 H THR 62 -20.237 21.955 4.259
412 HA THR 62 HA THR 62 -18.140 23.890 4.686
413 HB THR 62 HB THR 62 -18.459 23.001 2.450
414 HG1 THR 62 1HG THR 62 -18.548 24.961 1.374
415 HG21 THR 62 3HG2 THR 62 -20.634 23.918 1.258
416 HG22 THR 62 1HG2 THR 62 -21.279 23.910 2.898
417 HG23 THR 62 2HG2 THR 62 -20.688 22.413 2.175
Start of MODEL 6
1 H1 GLY 1 1HT GLY 1 -28.872 -18.380 5.906
2 H2 GLY 1 2HT GLY 1 -29.910 -19.425 5.060
3 H3 GLY 1 3HT GLY 1 -30.463 -17.900 5.568
4 HA2 GLY 1 2HA GLY 1 -28.468 -18.495 3.457
5 HA3 GLY 1 1HA GLY 1 -30.037 -17.710 3.265
6 H SER 2 H SER 2 -30.351 -15.619 4.385
7 HA SER 2 HA SER 2 -27.851 -14.155 4.949
8 HB2 SER 2 2HB SER 2 -28.518 -13.748 2.579
9 HB3 SER 2 1HB SER 2 -30.059 -13.122 3.153
10 HG SER 2 HG SER 2 -28.667 -11.404 2.907
11 H MET 3 H MET 3 -28.161 -13.723 7.068
12 HA MET 3 HA MET 3 -30.792 -12.737 7.964
13 HB2 MET 3 2HB MET 3 -28.388 -13.719 9.522
14 HB3 MET 3 1HB MET 3 -29.888 -13.138 10.245
15 HG2 MET 3 2HG MET 3 -31.156 -14.919 9.221
16 HG3 MET 3 1HG MET 3 -29.764 -15.426 8.264
17 HE1 MET 3 3HE MET 3 -30.749 -14.766 12.157
18 HE2 MET 3 1HE MET 3 -30.966 -16.500 12.441
19 HE3 MET 3 2HE MET 3 -31.837 -15.700 11.134
20 H ALA 4 H ALA 4 -30.739 -10.595 7.295
21 HA ALA 4 HA ALA 4 -28.607 -8.899 8.468
22 HB1 ALA 4 1HB ALA 4 -30.337 -8.155 6.113
23 HB2 ALA 4 2HB ALA 4 -28.815 -9.024 5.924
24 HB3 ALA 4 3HB ALA 4 -28.827 -7.412 6.638
25 H GLN 5 H GLN 5 -32.086 -9.242 7.916
26 HA GLN 5 HA GLN 5 -32.859 -6.749 9.034
27 HB2 GLN 5 2HB GLN 5 -34.389 -9.340 8.721
28 HB3 GLN 5 1HB GLN 5 -35.113 -7.812 9.223
29 HG2 GLN 5 2HG GLN 5 -34.609 -6.772 7.140
30 HG3 GLN 5 1HG GLN 5 -33.521 -8.076 6.669
31 HE21 GLN 5 1HE2 GLN 5 -34.667 -10.326 6.503
32 HE22 GLN 5 2HE2 GLN 5 -36.240 -10.322 5.844
33 H GLU 6 H GLU 6 -32.265 -9.932 10.444
34 HA GLU 6 HA GLU 6 -33.141 -8.974 13.079
35 HB2 GLU 6 2HB GLU 6 -32.363 -11.712 12.055
36 HB3 GLU 6 1HB GLU 6 -32.762 -11.373 13.740
37 HG2 GLU 6 2HG GLU 6 -34.637 -10.549 11.534
38 HG3 GLU 6 1HG GLU 6 -34.665 -12.196 12.162
39 H THR 7 H THR 7 -31.014 -7.535 12.412
40 HA THR 7 HA THR 7 -28.951 -8.510 14.250
41 HB THR 7 HB THR 7 -27.133 -7.953 12.696
42 HG1 THR 7 1HG THR 7 -28.129 -6.454 11.403
43 HG21 THR 7 3HG2 THR 7 -29.090 -9.837 11.364
44 HG22 THR 7 1HG2 THR 7 -28.131 -10.267 12.780
45 HG23 THR 7 2HG2 THR 7 -27.330 -9.875 11.259
46 H ASN 8 H ASN 8 -27.621 -6.817 15.105
47 HA ASN 8 HA ASN 8 -28.997 -4.342 15.473
48 HB2 ASN 8 2HB ASN 8 -26.226 -5.280 16.220
49 HB3 ASN 8 1HB ASN 8 -26.822 -3.670 16.620
50 HD21 ASN 8 1HD2 ASN 8 -26.301 -6.403 18.183
51 HD22 ASN 8 2HD2 ASN 8 -27.680 -6.497 19.183
52 H GLN 9 H GLN 9 -25.986 -5.209 13.771
53 HA GLN 9 HA GLN 9 -26.253 -2.720 12.182
54 HB2 GLN 9 2HB GLN 9 -23.756 -2.812 11.936
55 HB3 GLN 9 1HB GLN 9 -24.300 -2.492 13.581
56 HG2 GLN 9 2HG GLN 9 -23.943 -4.829 14.194
57 HG3 GLN 9 1HG GLN 9 -23.513 -5.230 12.531
58 HE21 GLN 9 1HE2 GLN 9 -22.078 -4.730 15.450
59 HE22 GLN 9 2HE2 GLN 9 -20.593 -4.066 14.938
60 H THR 10 H THR 10 -24.856 -2.986 10.076
61 HA THR 10 HA THR 10 -25.126 -5.699 8.972
62 HB THR 10 HB THR 10 -26.208 -4.760 6.935
63 HG1 THR 10 1HG THR 10 -26.440 -2.449 8.563
64 HG21 THR 10 3HG2 THR 10 -27.797 -4.087 9.415
65 HG22 THR 10 1HG2 THR 10 -27.466 -5.748 8.923
66 HG23 THR 10 2HG2 THR 10 -28.403 -4.687 7.871
67 HA PRO 11 HA PRO 11 -21.084 -3.809 7.770
68 HB2 PRO 11 2HB PRO 11 -20.180 -6.619 7.662
69 HB3 PRO 11 1HB PRO 11 -19.533 -5.265 8.606
70 HG2 PRO 11 2HG PRO 11 -20.858 -7.306 9.737
71 HG3 PRO 11 1HG PRO 11 -20.928 -5.652 10.371
72 HD2 PRO 11 2HD PRO 11 -22.962 -7.124 8.723
73 HD3 PRO 11 1HD PRO 11 -23.209 -6.017 10.093
74 H GLY 12 H GLY 12 -20.405 -3.465 5.686
75 HA2 GLY 12 2HA GLY 12 -20.248 -5.272 3.596
76 HA3 GLY 12 1HA GLY 12 -21.877 -4.602 3.513
77 HA PRO 13 HA PRO 13 -20.392 -0.918 1.585
78 HB2 PRO 13 2HB PRO 13 -21.114 1.240 3.129
79 HB3 PRO 13 1HB PRO 13 -22.250 0.308 2.132
80 HG2 PRO 13 2HG PRO 13 -21.775 0.208 5.060
81 HG3 PRO 13 1HG PRO 13 -23.283 0.027 4.144
82 HD2 PRO 13 2HD PRO 13 -21.882 -2.087 5.210
83 HD3 PRO 13 1HD PRO 13 -22.960 -2.223 3.802
84 H MET 14 H MET 14 -18.163 -1.712 2.083
85 HA MET 14 HA MET 14 -16.659 -0.540 4.214
86 HB2 MET 14 2HB MET 14 -15.949 -2.130 1.757
87 HB3 MET 14 1HB MET 14 -14.688 -1.394 2.747
88 HG2 MET 14 2HG MET 14 -16.857 -3.150 3.920
89 HG3 MET 14 1HG MET 14 -15.316 -3.794 3.354
90 HE1 MET 14 3HE MET 14 -15.034 -4.572 6.404
91 HE2 MET 14 1HE MET 14 -13.398 -3.920 6.239
92 HE3 MET 14 2HE MET 14 -14.208 -4.639 4.850
93 H LEU 15 H LEU 15 -17.192 1.697 3.956
94 HA LEU 15 HA LEU 15 -16.443 3.142 1.586
95 HB2 LEU 15 2HB LEU 15 -17.950 3.654 3.941
96 HB3 LEU 15 1HB LEU 15 -16.654 4.843 3.925
97 HG LEU 15 HG LEU 15 -17.280 5.425 1.569
98 HD11 LEU 15 1HD1 LEU 15 -19.670 4.656 0.943
99 HD12 LEU 15 2HD1 LEU 15 -19.430 3.383 2.139
100 HD13 LEU 15 3HD1 LEU 15 -18.363 3.491 0.738
101 HD21 LEU 15 3HD2 LEU 15 -19.233 5.684 3.847
102 HD22 LEU 15 1HD2 LEU 15 -19.601 6.395 2.275
103 HD23 LEU 15 2HD2 LEU 15 -18.162 6.906 3.166
104 H CYS 16 H CYS 16 -14.655 4.455 1.236
105 HA CYS 16 HA CYS 16 -12.168 3.673 1.966
106 HB2 CYS 16 2HB CYS 16 -12.876 5.420 0.238
107 HB3 CYS 16 1HB CYS 16 -12.751 6.594 1.555
108 H SER 17 H SER 17 -10.807 3.803 3.577
109 HA SER 17 HA SER 17 -11.597 4.652 6.168
110 HB2 SER 17 2HB SER 17 -8.815 4.039 5.147
111 HB3 SER 17 1HB SER 17 -9.301 4.124 6.841
112 HG SER 17 HG SER 17 -10.651 2.373 6.502
113 H THR 18 H THR 18 -9.733 6.233 3.626
114 HA THR 18 HA THR 18 -8.750 8.352 5.282
115 HB THR 18 HB THR 18 -8.147 9.441 3.142
116 HG1 THR 18 1HG THR 18 -9.446 8.928 1.585
117 HG21 THR 18 3HG2 THR 18 -7.515 6.478 3.236
118 HG22 THR 18 1HG2 THR 18 -6.692 7.715 4.183
119 HG23 THR 18 2HG2 THR 18 -6.561 7.720 2.424
120 H GLY 19 H GLY 19 -11.881 7.772 3.972
121 HA2 GLY 19 2HA GLY 19 -13.805 9.024 4.193
122 HA3 GLY 19 1HA GLY 19 -12.854 10.268 5.002
123 H CYS 20 H CYS 20 -12.476 8.901 1.722
124 HA CYS 20 HA CYS 20 -12.372 11.600 0.656
125 HB2 CYS 20 2HB CYS 20 -11.644 10.582 -1.424
126 HB3 CYS 20 1HB CYS 20 -10.728 9.911 -0.077
127 H GLY 21 H GLY 21 -14.839 9.245 1.079
128 HA2 GLY 21 2HA GLY 21 -17.123 9.732 0.681
129 HA3 GLY 21 1HA GLY 21 -16.639 10.874 -0.568
130 H PHE 22 H PHE 22 -14.895 8.029 -1.044
131 HA PHE 22 HA PHE 22 -16.863 7.064 -3.022
132 HB2 PHE 22 2HB PHE 22 -13.836 7.030 -3.077
133 HB3 PHE 22 1HB PHE 22 -14.870 6.240 -4.280
134 HD1 PHE 22 1HD PHE 22 -16.774 7.772 -5.292
135 HD2 PHE 22 2HD PHE 22 -13.184 9.245 -3.453
136 HE1 PHE 22 1HE PHE 22 -17.059 9.936 -6.470
137 HE2 PHE 22 2HE PHE 22 -13.468 11.411 -4.631
138 HZ PHE 22 HZ PHE 22 -15.409 11.753 -6.140
139 H TYR 23 H TYR 23 -16.693 4.729 -3.533
140 HA TYR 23 HA TYR 23 -16.901 3.162 -1.165
141 HB2 TYR 23 2HB TYR 23 -17.975 2.875 -3.564
142 HB3 TYR 23 1HB TYR 23 -16.535 1.902 -3.864
143 HD1 TYR 23 2HD TYR 23 -19.187 2.377 -1.258
144 HD2 TYR 23 1HD TYR 23 -16.604 -0.372 -3.310
145 HE1 TYR 23 2HE TYR 23 -20.242 0.488 -0.048
146 HE2 TYR 23 1HE TYR 23 -17.662 -2.267 -2.106
147 HH TYR 23 HH TYR 23 -19.860 -2.730 -0.972
148 H GLY 24 H GLY 24 -15.559 1.570 -0.328
149 HA2 GLY 24 2HA GLY 24 -12.745 1.633 -1.269
150 HA3 GLY 24 1HA GLY 24 -13.248 1.324 0.395
151 H ASN 25 H ASN 25 -11.532 -0.393 -1.028
152 HA ASN 25 HA ASN 25 -13.223 -2.747 -1.614
153 HB2 ASN 25 2HB ASN 25 -11.379 -1.770 -3.232
154 HB3 ASN 25 1HB ASN 25 -10.292 -2.675 -2.189
155 HD21 ASN 25 1HD2 ASN 25 -9.966 -3.933 -4.308
156 HD22 ASN 25 2HD2 ASN 25 -11.042 -5.216 -4.632
157 HA PRO 26 HA PRO 26 -11.647 -4.126 2.417
158 HB2 PRO 26 2HB PRO 26 -12.866 -6.566 2.476
159 HB3 PRO 26 1HB PRO 26 -13.688 -5.043 2.863
160 HG2 PRO 26 2HG PRO 26 -13.710 -6.602 0.317
161 HG3 PRO 26 1HG PRO 26 -15.057 -5.829 1.169
162 HD2 PRO 26 2HD PRO 26 -13.876 -4.669 -0.979
163 HD3 PRO 26 1HD PRO 26 -14.526 -3.710 0.369
164 H ARG 27 H ARG 27 -11.215 -5.664 -0.693
165 HA ARG 27 HA ARG 27 -9.392 -7.716 0.193
166 HB2 ARG 27 2HB ARG 27 -10.088 -6.553 -2.508
167 HB3 ARG 27 1HB ARG 27 -8.840 -7.780 -2.301
168 HG2 ARG 27 2HG ARG 27 -10.543 -9.236 -1.169
169 HG3 ARG 27 1HG ARG 27 -11.771 -8.035 -1.569
170 HD2 ARG 27 2HD ARG 27 -11.959 -9.487 -3.380
171 HD3 ARG 27 1HD ARG 27 -10.826 -8.299 -4.010
172 HE ARG 27 HE ARG 27 -9.374 -10.366 -2.733
173 HH11 ARG 27 1HH2 ARG 27 -11.344 -9.875 -5.610
174 HH12 ARG 27 2HH2 ARG 27 -10.488 -11.070 -6.521
175 HH21 ARG 27 1HH1 ARG 27 -8.303 -11.900 -3.979
176 HH22 ARG 27 2HH1 ARG 27 -8.787 -12.196 -5.614
177 H THR 28 H THR 28 -9.230 -4.391 -0.881
178 HA THR 28 HA THR 28 -6.328 -4.347 -1.131
179 HB THR 28 HB THR 28 -6.622 -1.947 -1.564
180 HG1 THR 28 1HG THR 28 -8.581 -0.984 -1.279
181 HG21 THR 28 3HG2 THR 28 -8.343 -3.942 -2.960
182 HG22 THR 28 1HG2 THR 28 -7.023 -2.954 -3.588
183 HG23 THR 28 2HG2 THR 28 -8.612 -2.238 -3.326
184 H ASN 29 H ASN 29 -6.017 -1.743 0.298
185 HA ASN 29 HA ASN 29 -5.693 -2.839 2.978
186 HB2 ASN 29 2HB ASN 29 -4.644 -0.452 1.494
187 HB3 ASN 29 1HB ASN 29 -4.549 -0.500 3.257
188 HD21 ASN 29 1HD2 ASN 29 -2.444 -1.136 3.784
189 HD22 ASN 29 2HD2 ASN 29 -1.620 -2.435 3.044
190 H GLY 30 H GLY 30 -8.442 -2.030 1.951
191 HA2 GLY 30 2HA GLY 30 -10.305 -1.265 3.119
192 HA3 GLY 30 1HA GLY 30 -9.225 -0.494 4.283
193 H MET 31 H MET 31 -8.304 0.236 1.072
194 HA MET 31 HA MET 31 -9.725 2.827 1.181
195 HB2 MET 31 2HB MET 31 -6.870 2.112 0.619
196 HB3 MET 31 1HB MET 31 -7.572 3.520 -0.182
197 HG2 MET 31 2HG MET 31 -6.625 4.352 1.813
198 HG3 MET 31 1HG MET 31 -8.348 4.261 2.147
199 HE1 MET 31 3HE MET 31 -5.720 4.529 3.618
200 HE2 MET 31 1HE MET 31 -4.816 3.030 3.876
201 HE3 MET 31 2HE MET 31 -5.893 3.642 5.130
202 H CYS 32 H CYS 32 -9.990 3.878 -0.899
203 HA CYS 32 HA CYS 32 -11.041 2.094 -2.866
204 HB2 CYS 32 2HB CYS 32 -11.728 4.126 -4.045
205 HB3 CYS 32 1HB CYS 32 -12.085 4.277 -2.332
206 H SER 33 H SER 33 -10.242 3.576 -5.270
207 HA SER 33 HA SER 33 -7.844 2.118 -5.835
208 HB2 SER 33 2HB SER 33 -8.199 3.700 -8.034
209 HB3 SER 33 1HB SER 33 -9.003 2.164 -7.762
210 HG SER 33 HG SER 33 -10.311 4.154 -8.257
211 H VAL 34 H VAL 34 -8.589 5.613 -5.708
212 HA VAL 34 HA VAL 34 -5.941 6.451 -6.326
213 HB VAL 34 HB VAL 34 -8.023 8.078 -4.851
214 HG11 VAL 34 1HG1 VAL 34 -5.673 8.708 -6.649
215 HG12 VAL 34 2HG1 VAL 34 -5.922 9.209 -4.977
216 HG13 VAL 34 3HG1 VAL 34 -6.919 9.895 -6.259
217 HG21 VAL 34 3HG2 VAL 34 -9.314 7.434 -6.670
218 HG22 VAL 34 1HG2 VAL 34 -7.915 7.143 -7.700
219 HG23 VAL 34 2HG2 VAL 34 -8.460 8.794 -7.398
220 H CYS 35 H CYS 35 -7.703 6.429 -3.221
221 HA CYS 35 HA CYS 35 -5.626 7.410 -1.618
222 HB2 CYS 35 2HB CYS 35 -7.904 5.561 -0.874
223 HB3 CYS 35 1HB CYS 35 -6.880 6.415 0.282
224 H TYR 36 H TYR 36 -6.345 4.094 -2.609
225 HA TYR 36 HA TYR 36 -4.669 2.720 -0.852
226 HB2 TYR 36 2HB TYR 36 -6.330 1.590 -2.218
227 HB3 TYR 36 1HB TYR 36 -5.449 2.005 -3.686
228 HD1 TYR 36 1HD TYR 36 -4.081 0.744 -0.405
229 HD2 TYR 36 2HD TYR 36 -4.818 -0.083 -4.557
230 HE1 TYR 36 1HE TYR 36 -2.788 -1.361 -0.217
231 HE2 TYR 36 2HE TYR 36 -3.528 -2.188 -4.365
232 HH TYR 36 HH TYR 36 -2.983 -3.816 -2.207
233 H LYS 37 H LYS 37 -3.872 3.956 -4.102
234 HA LYS 37 HA LYS 37 -1.157 3.049 -3.953
235 HB2 LYS 37 2HB LYS 37 -0.787 4.355 -6.008
236 HB3 LYS 37 1HB LYS 37 -2.224 3.348 -6.136
237 HG2 LYS 37 2HG LYS 37 -3.634 5.308 -5.590
238 HG3 LYS 37 1HG LYS 37 -2.191 6.315 -5.500
239 HD2 LYS 37 2HD LYS 37 -1.680 5.584 -7.880
240 HD3 LYS 37 1HD LYS 37 -3.307 4.899 -7.923
241 HE2 LYS 37 2HE LYS 37 -4.146 7.195 -7.187
242 HE3 LYS 37 1HE LYS 37 -2.524 7.794 -7.534
243 HZ1 LYS 37 3HZ LYS 37 -3.928 8.088 -9.447
244 HZ2 LYS 37 1HZ LYS 37 -4.352 6.446 -9.446
245 HZ3 LYS 37 2HZ LYS 37 -2.755 6.907 -9.795
246 H GLU 38 H GLU 38 -2.767 6.173 -3.506
247 HA GLU 38 HA GLU 38 -0.561 7.812 -3.118
248 HB2 GLU 38 2HB GLU 38 -3.366 7.867 -2.051
249 HB3 GLU 38 1HB GLU 38 -2.194 9.087 -1.543
250 HG2 GLU 38 2HG GLU 38 -2.629 8.455 -4.463
251 HG3 GLU 38 1HG GLU 38 -3.649 9.621 -3.614
252 H HIS 39 H HIS 39 -2.175 5.702 -0.726
253 HA HIS 39 HA HIS 39 -0.366 6.654 1.351
254 HB2 HIS 39 2HB HIS 39 -1.659 5.503 2.924
255 HB3 HIS 39 1HB HIS 39 -2.821 6.093 1.746
256 HD1 HIS 39 1HD HIS 39 -4.597 4.394 1.525
257 HD2 HIS 39 2HD HIS 39 -0.860 2.586 1.845
258 HE1 HIS 39 1HE HIS 39 -4.998 1.896 1.438
259 HE2 HIS 39 2HE HIS 39 -2.724 0.782 1.609
260 H LEU 40 H LEU 40 -0.675 3.846 -0.716
261 HA LEU 40 HA LEU 40 1.103 2.101 0.623
262 HB2 LEU 40 2HB LEU 40 -0.480 1.539 -1.286
263 HB3 LEU 40 1HB LEU 40 0.724 2.239 -2.371
264 HG LEU 40 HG LEU 40 2.406 0.651 -1.258
265 HD11 LEU 40 1HD1 LEU 40 1.233 -1.435 -0.347
266 HD12 LEU 40 2HD1 LEU 40 -0.221 -0.442 -0.228
267 HD13 LEU 40 3HD1 LEU 40 1.216 -0.018 0.702
268 HD21 LEU 40 3HD2 LEU 40 0.243 -0.896 -2.665
269 HD22 LEU 40 1HD2 LEU 40 1.990 -0.959 -2.898
270 HD23 LEU 40 2HD2 LEU 40 1.067 0.405 -3.526
271 H GLN 41 H GLN 41 1.675 4.801 -1.547
272 HA GLN 41 HA GLN 41 4.364 4.219 -2.226
273 HB2 GLN 41 2HB GLN 41 2.575 6.605 -2.339
274 HB3 GLN 41 1HB GLN 41 4.305 6.884 -2.480
275 HG2 GLN 41 2HG GLN 41 4.447 5.310 -4.346
276 HG3 GLN 41 1HG GLN 41 2.736 4.915 -4.167
277 HE21 GLN 41 1HE2 GLN 41 5.006 7.338 -5.344
278 HE22 GLN 41 2HE2 GLN 41 3.838 8.323 -6.104
279 H ARG 42 H ARG 42 2.925 6.043 0.458
280 HA ARG 42 HA ARG 42 5.484 6.895 1.503
281 HB2 ARG 42 2HB ARG 42 2.665 7.019 2.574
282 HB3 ARG 42 1HB ARG 42 4.061 7.601 3.481
283 HG2 ARG 42 2HG ARG 42 4.579 9.241 1.831
284 HG3 ARG 42 1HG ARG 42 3.488 8.509 0.657
285 HD2 ARG 42 2HD ARG 42 1.588 9.018 2.246
286 HD3 ARG 42 1HD ARG 42 2.732 9.956 3.205
287 HE ARG 42 HE ARG 42 1.505 10.761 0.742
288 HH11 ARG 42 1HH2 ARG 42 4.448 11.102 2.641
289 HH12 ARG 42 2HH2 ARG 42 4.873 12.601 1.896
290 HH21 ARG 42 1HH1 ARG 42 2.114 12.717 -0.177
291 HH22 ARG 42 2HH1 ARG 42 3.573 13.505 0.324
292 H GLN 43 H GLN 43 3.264 4.234 2.041
293 HA GLN 43 HA GLN 43 4.468 3.347 4.501
294 HB2 GLN 43 2HB GLN 43 2.072 2.894 3.541
295 HB3 GLN 43 1HB GLN 43 2.864 1.574 2.685
296 HG2 GLN 43 2HG GLN 43 2.261 0.499 4.646
297 HG3 GLN 43 1HG GLN 43 3.878 1.052 5.073
298 HE21 GLN 43 1HE2 GLN 43 3.343 1.199 7.361
299 HE22 GLN 43 2HE2 GLN 43 2.314 2.410 7.954
300 H GLN 44 H GLN 44 4.764 2.566 1.069
301 HA GLN 44 HA GLN 44 6.521 0.327 1.432
302 HB2 GLN 44 2HB GLN 44 5.032 0.900 -0.606
303 HB3 GLN 44 1HB GLN 44 6.356 1.961 -1.086
304 HG2 GLN 44 2HG GLN 44 7.907 0.139 -1.161
305 HG3 GLN 44 1HG GLN 44 6.763 -0.951 -0.382
306 HE21 GLN 44 1HE2 GLN 44 6.774 1.215 -3.278
307 HE22 GLN 44 2HE2 GLN 44 6.024 0.075 -4.303
308 H ASN 45 H ASN 45 6.977 3.771 0.695
309 HA ASN 45 HA ASN 45 9.780 3.645 0.237
310 HB2 ASN 45 2HB ASN 45 7.841 5.843 0.883
311 HB3 ASN 45 1HB ASN 45 9.573 6.170 0.908
312 HD21 ASN 45 1HD2 ASN 45 7.389 7.047 -1.062
313 HD22 ASN 45 2HD2 ASN 45 7.990 6.570 -2.587
314 H SER 46 H SER 46 7.838 4.314 3.137
315 HA SER 46 HA SER 46 10.110 4.827 4.820
316 HB2 SER 46 2HB SER 46 7.629 5.572 5.123
317 HB3 SER 46 1HB SER 46 7.419 3.984 5.858
318 HG SER 46 HG SER 46 8.019 5.329 7.489
319 H GLY 47 H GLY 47 7.694 2.184 4.931
320 HA2 GLY 47 2HA GLY 47 7.936 -0.067 5.379
321 HA3 GLY 47 1HA GLY 47 9.665 0.121 5.108
322 H ARG 48 H ARG 48 7.310 1.365 7.504
323 HA ARG 48 HA ARG 48 9.107 0.406 9.659
324 HB2 ARG 48 2HB ARG 48 7.579 3.006 9.450
325 HB3 ARG 48 1HB ARG 48 8.238 2.397 10.968
326 HG2 ARG 48 2HG ARG 48 9.951 2.692 8.498
327 HG3 ARG 48 1HG ARG 48 9.720 4.024 9.633
328 HD2 ARG 48 2HD ARG 48 10.393 2.294 11.452
329 HD3 ARG 48 1HD ARG 48 11.037 1.357 10.106
330 HE ARG 48 HE ARG 48 12.173 3.747 11.229
331 HH11 ARG 48 1HH2 ARG 48 11.877 1.897 8.251
332 HH12 ARG 48 2HH2 ARG 48 13.337 2.544 7.586
333 HH21 ARG 48 1HH1 ARG 48 14.056 4.552 10.306
334 HH22 ARG 48 2HH1 ARG 48 14.554 4.030 8.732
335 H MET 49 H MET 49 5.767 1.381 8.856
336 HA MET 49 HA MET 49 4.760 -0.337 11.033
337 HB2 MET 49 2HB MET 49 3.629 1.977 9.492
338 HB3 MET 49 1HB MET 49 2.538 0.830 10.265
339 HG2 MET 49 2HG MET 49 3.563 1.230 12.430
340 HG3 MET 49 1HG MET 49 4.796 2.256 11.698
341 HE1 MET 49 3HE MET 49 3.875 4.028 9.828
342 HE2 MET 49 1HE MET 49 4.551 4.757 11.290
343 HE3 MET 49 2HE MET 49 3.067 5.395 10.589
344 H SER 50 H SER 50 4.339 -2.372 10.452
345 HA SER 50 HA SER 50 3.641 -3.009 7.685
346 HB2 SER 50 2HB SER 50 3.859 -4.990 9.940
347 HB3 SER 50 1HB SER 50 4.122 -5.247 8.218
348 HG SER 50 HG SER 50 6.137 -4.914 8.740
349 HA PRO 51 HA PRO 51 -0.714 -3.584 8.171
350 HB2 PRO 51 2HB PRO 51 -0.542 -6.465 7.446
351 HB3 PRO 51 1HB PRO 51 -1.445 -5.154 6.665
352 HG2 PRO 51 2HG PRO 51 0.752 -6.188 5.571
353 HG3 PRO 51 1HG PRO 51 0.358 -4.465 5.432
354 HD2 PRO 51 2HD PRO 51 2.391 -5.797 7.184
355 HD3 PRO 51 1HD PRO 51 2.471 -4.226 6.355
356 H MET 52 H MET 52 -2.450 -4.937 9.287
357 HA MET 52 HA MET 52 -1.514 -5.639 11.948
358 HB2 MET 52 2HB MET 52 -4.286 -5.481 10.742
359 HB3 MET 52 1HB MET 52 -3.956 -5.858 12.433
360 HG2 MET 52 2HG MET 52 -2.865 -3.364 11.128
361 HG3 MET 52 1HG MET 52 -4.466 -3.398 11.864
362 HE1 MET 52 3HE MET 52 -4.901 -4.547 13.963
363 HE2 MET 52 1HE MET 52 -4.745 -2.906 14.601
364 HE3 MET 52 2HE MET 52 -3.996 -4.258 15.447
365 H GLY 53 H GLY 53 -2.732 -7.596 12.976
366 HA2 GLY 53 2HA GLY 53 -3.172 -9.865 13.041
367 HA3 GLY 53 1HA GLY 53 -3.288 -9.847 11.284
368 H THR 54 H THR 54 -0.507 -8.745 13.164
369 HA THR 54 HA THR 54 1.177 -10.695 11.763
370 HB THR 54 HB THR 54 3.032 -9.308 12.846
371 HG1 THR 54 1HG THR 54 2.439 -7.417 13.764
372 HG21 THR 54 3HG2 THR 54 2.090 -9.089 10.476
373 HG22 THR 54 1HG2 THR 54 2.918 -7.671 11.119
374 HG23 THR 54 2HG2 THR 54 1.156 -7.723 11.087
375 H ALA 55 H ALA 55 2.805 -11.903 12.942
376 HA ALA 55 HA ALA 55 1.744 -12.978 15.429
377 HB1 ALA 55 1HB ALA 55 4.200 -13.789 13.857
378 HB2 ALA 55 2HB ALA 55 2.592 -14.480 13.644
379 HB3 ALA 55 3HB ALA 55 3.450 -14.699 15.169
380 H SER 56 H SER 56 2.671 -12.808 17.426
381 HA SER 56 HA SER 56 4.547 -10.641 17.831
382 HB2 SER 56 2HB SER 56 2.611 -11.061 19.351
383 HB3 SER 56 1HB SER 56 3.378 -12.564 19.854
384 HG SER 56 HG SER 56 3.754 -10.348 20.990
385 H GLY 57 H GLY 57 6.327 -11.086 19.558
386 HA2 GLY 57 2HA GLY 57 8.087 -12.437 20.363
387 HA3 GLY 57 1HA GLY 57 7.621 -13.692 19.220
388 H SER 58 H SER 58 9.113 -10.478 19.454
389 HA SER 58 HA SER 58 10.677 -11.092 17.011
390 HB2 SER 58 2HB SER 58 8.893 -9.164 16.984
391 HB3 SER 58 1HB SER 58 10.120 -8.276 17.883
392 HG SER 58 HG SER 58 10.009 -8.878 15.255
393 H ASN 59 H ASN 59 11.401 -11.807 19.700
394 HA ASN 59 HA ASN 59 13.239 -9.910 20.799
395 HB2 ASN 59 2HB ASN 59 12.817 -12.869 21.229
396 HB3 ASN 59 1HB ASN 59 14.070 -11.958 22.072
397 HD21 ASN 59 1HD2 ASN 59 13.426 -10.660 23.848
398 HD22 ASN 59 2HD2 ASN 59 11.811 -10.478 24.338
399 H SER 60 H SER 60 15.271 -9.472 20.216
400 HA SER 60 HA SER 60 16.977 -11.462 18.995
401 HB2 SER 60 2HB SER 60 17.439 -9.882 17.017
402 HB3 SER 60 1HB SER 60 15.958 -10.834 16.963
403 HG SER 60 HG SER 60 15.103 -8.919 16.681
404 HA PRO 61 HA PRO 61 19.251 -8.297 21.448
405 HB2 PRO 61 2HB PRO 61 20.801 -9.983 22.887
406 HB3 PRO 61 1HB PRO 61 19.111 -9.656 23.319
407 HG2 PRO 61 2HG PRO 61 20.296 -12.015 21.954
408 HG3 PRO 61 1HG PRO 61 18.978 -11.933 23.134
409 HD2 PRO 61 2HD PRO 61 18.629 -12.182 20.381
410 HD3 PRO 61 1HD PRO 61 17.390 -11.600 21.513
411 H THR 62 H THR 62 21.876 -8.493 21.983
412 HA THR 62 HA THR 62 23.414 -9.651 19.845
413 HB THR 62 HB THR 62 22.567 -7.758 18.593
414 HG1 THR 62 1HG THR 62 24.547 -6.770 18.148
415 HG21 THR 62 3HG2 THR 62 22.927 -5.440 19.371
416 HG22 THR 62 1HG2 THR 62 23.591 -6.054 20.885
417 HG23 THR 62 2HG2 THR 62 21.895 -6.333 20.488
Start of MODEL 7
1 H1 GLY 1 1HT GLY 1 -31.477 21.562 3.574
2 H2 GLY 1 2HT GLY 1 -31.536 19.901 3.222
3 H3 GLY 1 3HT GLY 1 -32.784 20.927 2.699
4 HA2 GLY 1 2HA GLY 1 -31.260 22.086 1.228
5 HA3 GLY 1 1HA GLY 1 -29.963 21.023 1.773
6 H SER 2 H SER 2 -29.824 20.471 -0.557
7 HA SER 2 HA SER 2 -31.931 18.606 -1.463
8 HB2 SER 2 2HB SER 2 -29.698 19.641 -3.189
9 HB3 SER 2 1HB SER 2 -31.286 19.052 -3.669
10 HG SER 2 HG SER 2 -30.821 21.452 -3.565
11 H MET 3 H MET 3 -31.491 16.554 -0.926
12 HA MET 3 HA MET 3 -28.903 15.419 -1.661
13 HB2 MET 3 2HB MET 3 -29.967 15.478 1.162
14 HB3 MET 3 1HB MET 3 -28.803 14.268 0.619
15 HG2 MET 3 2HG MET 3 -27.327 16.163 -0.163
16 HG3 MET 3 1HG MET 3 -28.444 17.277 0.627
17 HE1 MET 3 3HE MET 3 -25.464 17.097 1.042
18 HE2 MET 3 1HE MET 3 -25.143 17.031 2.781
19 HE3 MET 3 2HE MET 3 -26.307 18.188 2.139
20 H ALA 4 H ALA 4 -29.674 13.934 -3.068
21 HA ALA 4 HA ALA 4 -31.563 11.921 -2.023
22 HB1 ALA 4 1HB ALA 4 -31.755 12.867 -4.871
23 HB2 ALA 4 2HB ALA 4 -32.615 13.716 -3.587
24 HB3 ALA 4 3HB ALA 4 -32.956 12.015 -3.902
25 H GLN 5 H GLN 5 -28.659 11.873 -2.297
26 HA GLN 5 HA GLN 5 -28.434 9.574 -4.135
27 HB2 GLN 5 2HB GLN 5 -26.642 11.996 -4.002
28 HB3 GLN 5 1HB GLN 5 -26.066 10.450 -4.630
29 HG2 GLN 5 2HG GLN 5 -28.217 10.511 -6.097
30 HG3 GLN 5 1HG GLN 5 -28.242 12.230 -5.711
31 HE21 GLN 5 1HE2 GLN 5 -26.806 13.588 -6.857
32 HE22 GLN 5 2HE2 GLN 5 -25.633 13.010 -7.953
33 H GLU 6 H GLU 6 -28.836 9.628 -1.284
34 HA GLU 6 HA GLU 6 -26.345 8.287 -0.426
35 HB2 GLU 6 2HB GLU 6 -28.008 10.205 1.227
36 HB3 GLU 6 1HB GLU 6 -26.681 9.223 1.847
37 HG2 GLU 6 2HG GLU 6 -25.187 10.301 0.124
38 HG3 GLU 6 1HG GLU 6 -26.516 11.393 -0.259
39 H THR 7 H THR 7 -27.010 6.205 -0.445
40 HA THR 7 HA THR 7 -29.674 5.432 0.379
41 HB THR 7 HB THR 7 -28.697 3.094 0.052
42 HG1 THR 7 1HG THR 7 -26.671 2.935 -0.553
43 HG21 THR 7 3HG2 THR 7 -28.629 5.142 -2.180
44 HG22 THR 7 1HG2 THR 7 -30.002 4.144 -1.697
45 HG23 THR 7 2HG2 THR 7 -28.587 3.398 -2.442
46 H ASN 8 H ASN 8 -30.199 4.133 2.182
47 HA ASN 8 HA ASN 8 -28.314 4.409 4.441
48 HB2 ASN 8 2HB ASN 8 -30.339 4.048 5.863
49 HB3 ASN 8 1HB ASN 8 -30.426 5.495 4.863
50 HD21 ASN 8 1HD2 ASN 8 -32.062 5.584 3.223
51 HD22 ASN 8 2HD2 ASN 8 -33.233 4.358 3.025
52 H GLN 9 H GLN 9 -30.309 2.089 2.679
53 HA GLN 9 HA GLN 9 -29.352 -0.102 4.395
54 HB2 GLN 9 2HB GLN 9 -31.823 0.236 3.661
55 HB3 GLN 9 1HB GLN 9 -31.285 -0.418 2.114
56 HG2 GLN 9 2HG GLN 9 -30.575 -2.470 3.123
57 HG3 GLN 9 1HG GLN 9 -30.743 -1.806 4.747
58 HE21 GLN 9 1HE2 GLN 9 -32.673 -2.329 5.779
59 HE22 GLN 9 2HE2 GLN 9 -34.110 -2.790 4.982
60 H THR 10 H THR 10 -27.239 -0.410 3.728
61 HA THR 10 HA THR 10 -26.934 -1.738 1.149
62 HB THR 10 HB THR 10 -26.408 0.547 0.540
63 HG1 THR 10 1HG THR 10 -24.570 0.035 -0.391
64 HG21 THR 10 3HG2 THR 10 -24.143 0.694 2.491
65 HG22 THR 10 1HG2 THR 10 -25.768 1.053 3.074
66 HG23 THR 10 2HG2 THR 10 -25.076 1.999 1.758
67 HA PRO 11 HA PRO 11 -24.757 -3.961 4.586
68 HB2 PRO 11 2HB PRO 11 -24.947 -6.158 2.581
69 HB3 PRO 11 1HB PRO 11 -25.370 -6.161 4.303
70 HG2 PRO 11 2HG PRO 11 -27.247 -6.146 2.428
71 HG3 PRO 11 1HG PRO 11 -27.438 -5.231 3.935
72 HD2 PRO 11 2HD PRO 11 -26.738 -4.223 1.197
73 HD3 PRO 11 1HD PRO 11 -27.770 -3.481 2.442
74 H GLY 12 H GLY 12 -22.577 -4.295 4.819
75 HA2 GLY 12 2HA GLY 12 -20.347 -4.540 4.293
76 HA3 GLY 12 1HA GLY 12 -20.827 -4.985 2.660
77 HA PRO 13 HA PRO 13 -20.607 -0.295 2.107
78 HB2 PRO 13 2HB PRO 13 -20.835 1.453 4.169
79 HB3 PRO 13 1HB PRO 13 -22.251 0.695 3.409
80 HG2 PRO 13 2HG PRO 13 -20.868 -0.000 5.957
81 HG3 PRO 13 1HG PRO 13 -22.604 0.058 5.592
82 HD2 PRO 13 2HD PRO 13 -21.137 -2.276 5.649
83 HD3 PRO 13 1HD PRO 13 -22.620 -2.057 4.694
84 H MET 14 H MET 14 -18.360 -1.395 2.018
85 HA MET 14 HA MET 14 -16.379 -0.620 3.940
86 HB2 MET 14 2HB MET 14 -16.134 -1.729 1.132
87 HB3 MET 14 1HB MET 14 -14.770 -1.478 2.220
88 HG2 MET 14 2HG MET 14 -17.161 -3.100 3.079
89 HG3 MET 14 1HG MET 14 -15.849 -3.833 2.157
90 HE1 MET 14 3HE MET 14 -16.655 -4.924 4.951
91 HE2 MET 14 1HE MET 14 -17.288 -3.329 5.376
92 HE3 MET 14 2HE MET 14 -16.043 -4.079 6.370
93 H LEU 15 H LEU 15 -17.082 1.727 3.891
94 HA LEU 15 HA LEU 15 -16.320 3.265 1.560
95 HB2 LEU 15 2HB LEU 15 -17.414 3.916 4.275
96 HB3 LEU 15 1HB LEU 15 -16.675 5.195 3.311
97 HG LEU 15 HG LEU 15 -18.884 3.373 2.304
98 HD11 LEU 15 1HD1 LEU 15 -19.684 4.803 4.123
99 HD12 LEU 15 2HD1 LEU 15 -20.315 5.379 2.582
100 HD13 LEU 15 3HD1 LEU 15 -18.961 6.212 3.348
101 HD21 LEU 15 3HD2 LEU 15 -18.949 5.613 0.747
102 HD22 LEU 15 1HD2 LEU 15 -18.001 4.185 0.331
103 HD23 LEU 15 2HD2 LEU 15 -17.228 5.557 1.121
104 H CYS 16 H CYS 16 -14.512 4.471 1.246
105 HA CYS 16 HA CYS 16 -12.059 3.716 1.981
106 HB2 CYS 16 2HB CYS 16 -12.777 5.573 0.357
107 HB3 CYS 16 1HB CYS 16 -12.594 6.663 1.733
108 H SER 17 H SER 17 -10.606 3.859 3.556
109 HA SER 17 HA SER 17 -11.395 4.475 6.207
110 HB2 SER 17 2HB SER 17 -8.530 4.313 5.278
111 HB3 SER 17 1HB SER 17 -9.198 3.871 6.848
112 HG SER 17 HG SER 17 -10.361 2.204 5.752
113 H THR 18 H THR 18 -9.817 6.397 3.714
114 HA THR 18 HA THR 18 -8.989 8.470 5.555
115 HB THR 18 HB THR 18 -8.197 9.643 3.588
116 HG1 THR 18 1HG THR 18 -9.821 9.277 2.148
117 HG21 THR 18 3HG2 THR 18 -7.661 6.695 3.128
118 HG22 THR 18 1HG2 THR 18 -6.937 7.604 4.459
119 HG23 THR 18 2HG2 THR 18 -6.589 8.057 2.792
120 H GLY 19 H GLY 19 -12.000 7.662 4.199
121 HA2 GLY 19 2HA GLY 19 -14.010 8.766 4.270
122 HA3 GLY 19 1HA GLY 19 -13.193 10.078 5.118
123 H CYS 20 H CYS 20 -12.571 8.769 1.851
124 HA CYS 20 HA CYS 20 -12.591 11.468 0.803
125 HB2 CYS 20 2HB CYS 20 -11.856 10.470 -1.305
126 HB3 CYS 20 1HB CYS 20 -10.884 9.881 0.044
127 H GLY 21 H GLY 21 -15.066 9.234 1.315
128 HA2 GLY 21 2HA GLY 21 -17.327 9.603 0.816
129 HA3 GLY 21 1HA GLY 21 -16.843 10.742 -0.433
130 H PHE 22 H PHE 22 -14.980 8.010 -0.954
131 HA PHE 22 HA PHE 22 -16.903 6.979 -2.935
132 HB2 PHE 22 2HB PHE 22 -13.878 7.021 -2.917
133 HB3 PHE 22 1HB PHE 22 -14.846 6.146 -4.108
134 HD1 PHE 22 2HD PHE 22 -14.003 9.503 -2.773
135 HD2 PHE 22 1HD PHE 22 -16.033 7.303 -5.853
136 HE1 PHE 22 2HE PHE 22 -14.288 11.592 -4.082
137 HE2 PHE 22 1HE PHE 22 -16.319 9.390 -7.157
138 HZ PHE 22 HZ PHE 22 -15.448 11.533 -6.272
139 H TYR 23 H TYR 23 -16.208 4.656 -3.598
140 HA TYR 23 HA TYR 23 -16.553 3.038 -1.216
141 HB2 TYR 23 2HB TYR 23 -17.731 2.743 -3.511
142 HB3 TYR 23 1HB TYR 23 -16.250 1.899 -3.971
143 HD1 TYR 23 1HD TYR 23 -18.394 2.016 -0.850
144 HD2 TYR 23 2HD TYR 23 -16.434 -0.392 -3.832
145 HE1 TYR 23 1HE TYR 23 -19.159 -0.046 0.302
146 HE2 TYR 23 2HE TYR 23 -17.197 -2.442 -2.674
147 HH TYR 23 HH TYR 23 -19.360 -2.906 -0.993
148 H GLY 24 H GLY 24 -15.270 1.430 -0.444
149 HA2 GLY 24 2HA GLY 24 -12.469 1.373 -1.444
150 HA3 GLY 24 1HA GLY 24 -12.919 1.159 0.256
151 H ASN 25 H ASN 25 -11.376 -0.715 -1.209
152 HA ASN 25 HA ASN 25 -13.249 -2.973 -1.608
153 HB2 ASN 25 2HB ASN 25 -11.397 -2.241 -3.354
154 HB3 ASN 25 1HB ASN 25 -10.344 -3.182 -2.307
155 HD21 ASN 25 1HD2 ASN 25 -13.504 -3.467 -4.038
156 HD22 ASN 25 2HD2 ASN 25 -13.344 -5.139 -4.344
157 HA PRO 26 HA PRO 26 -11.651 -4.571 2.230
158 HB2 PRO 26 2HB PRO 26 -12.579 -7.149 2.088
159 HB3 PRO 26 1HB PRO 26 -13.558 -5.744 2.534
160 HG2 PRO 26 2HG PRO 26 -13.513 -7.282 0.027
161 HG3 PRO 26 1HG PRO 26 -14.821 -6.339 0.755
162 HD2 PRO 26 2HD PRO 26 -13.190 -5.528 -1.398
163 HD3 PRO 26 1HD PRO 26 -14.283 -4.493 -0.459
164 H ARG 27 H ARG 27 -10.862 -6.067 -0.847
165 HA ARG 27 HA ARG 27 -8.852 -7.857 0.189
166 HB2 ARG 27 2HB ARG 27 -9.433 -6.826 -2.598
167 HB3 ARG 27 1HB ARG 27 -8.170 -7.997 -2.231
168 HG2 ARG 27 2HG ARG 27 -9.840 -9.542 -1.302
169 HG3 ARG 27 1HG ARG 27 -11.115 -8.362 -1.606
170 HD2 ARG 27 2HD ARG 27 -10.329 -8.418 -4.060
171 HD3 ARG 27 1HD ARG 27 -9.455 -9.879 -3.619
172 HE ARG 27 HE ARG 27 -12.312 -9.610 -3.955
173 HH11 ARG 27 1HH2 ARG 27 -9.779 -11.489 -2.394
174 HH12 ARG 27 2HH2 ARG 27 -10.784 -12.886 -2.223
175 HH21 ARG 27 1HH1 ARG 27 -13.553 -11.465 -3.720
176 HH22 ARG 27 2HH1 ARG 27 -12.889 -12.875 -2.961
177 H THR 28 H THR 28 -9.019 -4.532 -0.853
178 HA THR 28 HA THR 28 -6.124 -4.192 -1.022
179 HB THR 28 HB THR 28 -6.662 -1.834 -1.482
180 HG1 THR 28 1HG THR 28 -8.553 -1.030 -1.024
181 HG21 THR 28 3HG2 THR 28 -8.187 -2.211 -3.468
182 HG22 THR 28 1HG2 THR 28 -8.348 -3.880 -2.924
183 HG23 THR 28 2HG2 THR 28 -6.769 -3.253 -3.393
184 H ASN 29 H ASN 29 -6.233 -1.550 0.383
185 HA ASN 29 HA ASN 29 -5.903 -2.575 3.102
186 HB2 ASN 29 2HB ASN 29 -4.957 -0.126 1.654
187 HB3 ASN 29 1HB ASN 29 -4.993 -0.142 3.422
188 HD21 ASN 29 1HD2 ASN 29 -2.744 -0.385 3.874
189 HD22 ASN 29 2HD2 ASN 29 -1.824 -1.711 3.313
190 H GLY 30 H GLY 30 -8.628 -2.130 1.918
191 HA2 GLY 30 2HA GLY 30 -10.647 -1.465 2.816
192 HA3 GLY 30 1HA GLY 30 -9.763 -0.715 4.146
193 H MET 31 H MET 31 -8.641 0.230 1.016
194 HA MET 31 HA MET 31 -10.195 2.744 1.180
195 HB2 MET 31 2HB MET 31 -7.284 2.331 0.472
196 HB3 MET 31 1HB MET 31 -8.153 3.854 0.263
197 HG2 MET 31 2HG MET 31 -8.659 3.920 2.663
198 HG3 MET 31 1HG MET 31 -7.838 2.375 2.894
199 HE1 MET 31 3HE MET 31 -5.552 4.499 4.730
200 HE2 MET 31 1HE MET 31 -5.174 2.864 4.170
201 HE3 MET 31 2HE MET 31 -6.820 3.279 4.643
202 H CYS 32 H CYS 32 -10.112 3.975 -0.910
203 HA CYS 32 HA CYS 32 -11.058 2.259 -3.014
204 HB2 CYS 32 2HB CYS 32 -11.753 4.298 -4.116
205 HB3 CYS 32 1HB CYS 32 -12.162 4.404 -2.408
206 H SER 33 H SER 33 -10.272 3.601 -5.345
207 HA SER 33 HA SER 33 -7.690 2.414 -5.764
208 HB2 SER 33 2HB SER 33 -9.805 2.871 -7.385
209 HB3 SER 33 1HB SER 33 -8.771 4.220 -7.851
210 HG SER 33 HG SER 33 -8.556 1.848 -8.744
211 H VAL 34 H VAL 34 -8.835 5.800 -5.636
212 HA VAL 34 HA VAL 34 -6.373 6.963 -6.427
213 HB VAL 34 HB VAL 34 -8.512 8.278 -4.732
214 HG11 VAL 34 1HG1 VAL 34 -6.454 9.329 -6.703
215 HG12 VAL 34 2HG1 VAL 34 -6.487 9.607 -4.961
216 HG13 VAL 34 3HG1 VAL 34 -7.738 10.307 -5.988
217 HG21 VAL 34 3HG2 VAL 34 -9.396 9.046 -7.011
218 HG22 VAL 34 1HG2 VAL 34 -9.695 7.356 -6.609
219 HG23 VAL 34 2HG2 VAL 34 -8.396 7.781 -7.724
220 H CYS 35 H CYS 35 -7.812 6.549 -3.196
221 HA CYS 35 HA CYS 35 -5.628 7.720 -1.799
222 HB2 CYS 35 2HB CYS 35 -7.775 5.871 -0.733
223 HB3 CYS 35 1HB CYS 35 -6.726 6.915 0.227
224 H TYR 36 H TYR 36 -6.444 4.400 -2.675
225 HA TYR 36 HA TYR 36 -4.609 3.107 -0.950
226 HB2 TYR 36 2HB TYR 36 -6.469 1.916 -1.981
227 HB3 TYR 36 1HB TYR 36 -5.775 2.167 -3.583
228 HD1 TYR 36 1HD TYR 36 -4.655 0.881 -0.221
229 HD2 TYR 36 2HD TYR 36 -4.646 0.361 -4.483
230 HE1 TYR 36 1HE TYR 36 -3.340 -1.206 0.031
231 HE2 TYR 36 2HE TYR 36 -3.330 -1.723 -4.230
232 HH TYR 36 HH TYR 36 -1.666 -2.631 -2.353
233 H LYS 37 H LYS 37 -4.133 4.713 -4.052
234 HA LYS 37 HA LYS 37 -1.613 3.445 -4.604
235 HB2 LYS 37 2HB LYS 37 -3.264 4.601 -6.257
236 HB3 LYS 37 1HB LYS 37 -2.489 6.098 -5.732
237 HG2 LYS 37 2HG LYS 37 -0.287 5.169 -6.343
238 HG3 LYS 37 1HG LYS 37 -1.063 3.686 -6.896
239 HD2 LYS 37 2HD LYS 37 -2.083 4.756 -8.728
240 HD3 LYS 37 1HD LYS 37 -1.913 6.355 -8.005
241 HE2 LYS 37 2HE LYS 37 0.543 6.211 -8.279
242 HE3 LYS 37 1HE LYS 37 0.358 4.626 -9.029
243 HZ1 LYS 37 3HZ LYS 37 -1.052 5.696 -10.726
244 HZ2 LYS 37 1HZ LYS 37 0.542 6.274 -10.729
245 HZ3 LYS 37 2HZ LYS 37 -0.697 7.210 -10.041
246 H GLU 38 H GLU 38 -2.721 6.502 -3.189
247 HA GLU 38 HA GLU 38 -0.159 7.667 -2.832
248 HB2 GLU 38 2HB GLU 38 -2.809 8.145 -1.454
249 HB3 GLU 38 1HB GLU 38 -1.372 9.125 -1.166
250 HG2 GLU 38 2HG GLU 38 -2.469 8.655 -3.940
251 HG3 GLU 38 1HG GLU 38 -3.014 9.996 -2.927
252 H HIS 39 H HIS 39 -2.266 5.817 -0.608
253 HA HIS 39 HA HIS 39 -0.737 6.020 1.719
254 HB2 HIS 39 2HB HIS 39 -3.082 5.022 1.324
255 HB3 HIS 39 1HB HIS 39 -2.238 3.526 0.926
256 HD1 HIS 39 1HD HIS 39 -2.244 6.077 3.778
257 HD2 HIS 39 2HD HIS 39 -1.819 1.976 3.154
258 HE1 HIS 39 1HE HIS 39 -2.140 5.010 6.071
259 HE2 HIS 39 2HE HIS 39 -1.842 2.514 5.710
260 H LEU 40 H LEU 40 -0.566 3.550 -0.843
261 HA LEU 40 HA LEU 40 1.412 1.949 0.368
262 HB2 LEU 40 2HB LEU 40 0.092 2.121 -2.237
263 HB3 LEU 40 1HB LEU 40 1.770 1.593 -2.378
264 HG LEU 40 HG LEU 40 1.263 -0.072 -0.512
265 HD11 LEU 40 1HD1 LEU 40 -1.082 -0.613 -0.117
266 HD12 LEU 40 2HD1 LEU 40 -1.590 0.633 -1.258
267 HD13 LEU 40 3HD1 LEU 40 -0.810 1.089 0.256
268 HD21 LEU 40 3HD2 LEU 40 0.176 -1.658 -2.064
269 HD22 LEU 40 1HD2 LEU 40 1.421 -0.721 -2.889
270 HD23 LEU 40 2HD2 LEU 40 -0.282 -0.318 -3.116
271 H GLN 41 H GLN 41 1.710 4.909 -1.510
272 HA GLN 41 HA GLN 41 4.463 4.648 -2.167
273 HB2 GLN 41 2HB GLN 41 2.749 6.299 -3.130
274 HB3 GLN 41 1HB GLN 41 3.058 7.273 -1.693
275 HG2 GLN 41 2HG GLN 41 4.611 8.132 -3.230
276 HG3 GLN 41 1HG GLN 41 5.574 6.964 -2.320
277 HE21 GLN 41 1HE2 GLN 41 4.252 7.719 -5.466
278 HE22 GLN 41 2HE2 GLN 41 4.889 6.362 -6.276
279 H ARG 42 H ARG 42 2.769 5.796 0.698
280 HA ARG 42 HA ARG 42 5.159 6.898 1.914
281 HB2 ARG 42 2HB ARG 42 2.299 6.562 2.782
282 HB3 ARG 42 1HB ARG 42 3.552 7.059 3.924
283 HG2 ARG 42 2HG ARG 42 3.259 8.459 1.273
284 HG3 ARG 42 1HG ARG 42 2.249 8.916 2.645
285 HD2 ARG 42 2HD ARG 42 4.136 9.504 3.972
286 HD3 ARG 42 1HD ARG 42 5.251 8.705 2.869
287 HE ARG 42 HE ARG 42 3.945 10.714 1.420
288 HH11 ARG 42 1HH2 ARG 42 6.144 10.491 4.160
289 HH12 ARG 42 2HH2 ARG 42 6.881 12.019 3.821
290 HH21 ARG 42 1HH1 ARG 42 4.953 12.680 1.027
291 HH22 ARG 42 2HH1 ARG 42 6.222 13.238 2.065
292 H GLN 43 H GLN 43 3.265 3.939 2.116
293 HA GLN 43 HA GLN 43 4.649 2.943 4.450
294 HB2 GLN 43 2HB GLN 43 2.707 1.709 2.497
295 HB3 GLN 43 1HB GLN 43 3.440 0.796 3.816
296 HG2 GLN 43 2HG GLN 43 2.058 3.426 4.327
297 HG3 GLN 43 1HG GLN 43 1.147 1.920 4.260
298 HE21 GLN 43 1HE2 GLN 43 1.969 0.141 5.797
299 HE22 GLN 43 2HE2 GLN 43 2.616 0.633 7.289
300 H GLN 44 H GLN 44 5.065 2.753 0.979
301 HA GLN 44 HA GLN 44 6.839 0.485 1.024
302 HB2 GLN 44 2HB GLN 44 5.397 1.227 -0.936
303 HB3 GLN 44 1HB GLN 44 6.570 2.518 -1.188
304 HG2 GLN 44 2HG GLN 44 8.306 1.012 -1.699
305 HG3 GLN 44 1HG GLN 44 7.470 -0.347 -0.945
306 HE21 GLN 44 1HE2 GLN 44 6.437 2.066 -3.425
307 HE22 GLN 44 2HE2 GLN 44 5.943 0.893 -4.559
308 H ASN 45 H ASN 45 7.262 4.016 0.810
309 HA ASN 45 HA ASN 45 10.082 3.964 0.436
310 HB2 ASN 45 2HB ASN 45 8.063 6.030 1.197
311 HB3 ASN 45 1HB ASN 45 9.756 6.384 1.531
312 HD21 ASN 45 1HD2 ASN 45 7.402 5.848 -1.056
313 HD22 ASN 45 2HD2 ASN 45 8.427 6.341 -2.328
314 H SER 46 H SER 46 8.046 4.174 3.342
315 HA SER 46 HA SER 46 10.245 4.480 5.160
316 HB2 SER 46 2HB SER 46 7.429 3.515 5.707
317 HB3 SER 46 1HB SER 46 8.592 4.067 6.909
318 HG SER 46 HG SER 46 8.290 6.084 6.287
319 H GLY 47 H GLY 47 7.967 1.750 4.749
320 HA2 GLY 47 2HA GLY 47 8.504 -0.522 4.495
321 HA3 GLY 47 1HA GLY 47 10.183 -0.147 4.863
322 H ARG 48 H ARG 48 10.225 0.984 7.260
323 HA ARG 48 HA ARG 48 8.648 -0.732 9.078
324 HB2 ARG 48 2HB ARG 48 11.032 -1.580 8.603
325 HB3 ARG 48 1HB ARG 48 11.573 -0.189 9.543
326 HG2 ARG 48 2HG ARG 48 10.325 -0.931 11.479
327 HG3 ARG 48 1HG ARG 48 9.560 -2.219 10.549
328 HD2 ARG 48 2HD ARG 48 12.549 -2.005 10.978
329 HD3 ARG 48 1HD ARG 48 11.487 -2.987 11.983
330 HE ARG 48 HE ARG 48 11.220 -3.552 9.165
331 HH11 ARG 48 1HH2 ARG 48 13.092 -4.295 12.052
332 HH12 ARG 48 2HH2 ARG 48 13.607 -5.830 11.443
333 HH21 ARG 48 1HH1 ARG 48 11.922 -5.555 8.436
334 HH22 ARG 48 2HH1 ARG 48 12.956 -6.535 9.422
335 H MET 49 H MET 49 11.103 1.877 9.149
336 HA MET 49 HA MET 49 10.063 3.013 11.559
337 HB2 MET 49 2HB MET 49 12.109 3.847 9.527
338 HB3 MET 49 1HB MET 49 11.563 4.998 10.747
339 HG2 MET 49 2HG MET 49 12.480 2.222 11.502
340 HG3 MET 49 1HG MET 49 13.624 3.553 11.328
341 HE1 MET 49 3HE MET 49 13.733 3.858 15.014
342 HE2 MET 49 1HE MET 49 14.487 4.391 13.506
343 HE3 MET 49 2HE MET 49 14.160 2.681 13.776
344 H SER 50 H SER 50 8.072 3.854 11.595
345 HA SER 50 HA SER 50 7.099 5.419 9.305
346 HB2 SER 50 2HB SER 50 5.684 4.393 11.776
347 HB3 SER 50 1HB SER 50 4.915 5.308 10.483
348 HG SER 50 HG SER 50 4.962 3.590 9.250
349 HA PRO 51 HA PRO 51 7.697 9.228 11.501
350 HB2 PRO 51 2HB PRO 51 5.754 10.827 10.488
351 HB3 PRO 51 1HB PRO 51 7.132 10.276 9.515
352 HG2 PRO 51 2HG PRO 51 4.330 9.279 9.563
353 HG3 PRO 51 1HG PRO 51 5.431 9.495 8.192
354 HD2 PRO 51 2HD PRO 51 4.934 7.058 9.412
355 HD3 PRO 51 1HD PRO 51 6.401 7.430 8.482
356 H MET 52 H MET 52 6.234 11.075 12.628
357 HA MET 52 HA MET 52 4.742 9.688 14.719
358 HB2 MET 52 2HB MET 52 5.739 12.521 14.397
359 HB3 MET 52 1HB MET 52 4.712 12.017 15.742
360 HG2 MET 52 2HG MET 52 6.355 10.327 16.403
361 HG3 MET 52 1HG MET 52 7.367 10.742 15.021
362 HE1 MET 52 3HE MET 52 9.520 12.331 15.511
363 HE2 MET 52 1HE MET 52 8.924 13.992 15.638
364 HE3 MET 52 2HE MET 52 8.201 12.880 14.480
365 H GLY 53 H GLY 53 4.186 12.699 12.870
366 HA2 GLY 53 2HA GLY 53 2.003 12.476 11.478
367 HA3 GLY 53 1HA GLY 53 1.282 12.241 13.067
368 H THR 54 H THR 54 2.227 14.013 14.706
369 HA THR 54 HA THR 54 1.220 16.522 13.762
370 HB THR 54 HB THR 54 0.883 15.906 16.084
371 HG1 THR 54 1HG THR 54 1.268 17.866 16.795
372 HG21 THR 54 3HG2 THR 54 3.039 16.037 17.569
373 HG22 THR 54 1HG2 THR 54 3.876 15.641 16.068
374 HG23 THR 54 2HG2 THR 54 2.667 14.536 16.720
375 H ALA 55 H ALA 55 2.528 18.585 14.204
376 HA ALA 55 HA ALA 55 5.079 18.324 12.780
377 HB1 ALA 55 1HB ALA 55 3.349 20.715 13.441
378 HB2 ALA 55 2HB ALA 55 3.559 19.956 11.864
379 HB3 ALA 55 3HB ALA 55 4.901 20.820 12.612
380 H SER 56 H SER 56 6.822 19.921 13.497
381 HA SER 56 HA SER 56 6.915 20.337 16.397
382 HB2 SER 56 2HB SER 56 9.278 19.347 16.359
383 HB3 SER 56 1HB SER 56 7.937 18.206 16.312
384 HG SER 56 HG SER 56 9.298 17.608 14.694
385 H GLY 57 H GLY 57 8.940 20.505 13.450
386 HA2 GLY 57 2HA GLY 57 9.770 22.452 12.427
387 HA3 GLY 57 1HA GLY 57 9.287 23.381 13.844
388 H SER 58 H SER 58 11.388 20.527 13.348
389 HA SER 58 HA SER 58 13.688 22.037 14.354
390 HB2 SER 58 2HB SER 58 12.878 19.402 15.594
391 HB3 SER 58 1HB SER 58 14.214 20.443 16.077
392 HG SER 58 HG SER 58 11.439 20.801 16.385
393 H ASN 59 H ASN 59 12.651 18.714 13.514
394 HA ASN 59 HA ASN 59 15.185 18.300 12.093
395 HB2 ASN 59 2HB ASN 59 14.444 15.930 11.966
396 HB3 ASN 59 1HB ASN 59 14.526 16.530 13.618
397 HD21 ASN 59 1HD2 ASN 59 12.268 15.643 11.011
398 HD22 ASN 59 2HD2 ASN 59 10.903 15.522 12.011
399 H SER 60 H SER 60 15.309 17.753 9.912
400 HA SER 60 HA SER 60 13.126 18.766 8.271
401 HB2 SER 60 2HB SER 60 15.939 17.857 7.673
402 HB3 SER 60 1HB SER 60 14.791 18.270 6.403
403 HG SER 60 HG SER 60 15.825 20.140 6.871
404 HA PRO 61 HA PRO 61 11.613 14.721 7.226
405 HB2 PRO 61 2HB PRO 61 10.337 15.190 4.885
406 HB3 PRO 61 1HB PRO 61 9.751 15.848 6.425
407 HG2 PRO 61 2HG PRO 61 11.251 17.193 4.241
408 HG3 PRO 61 1HG PRO 61 9.949 17.813 5.268
409 HD2 PRO 61 2HD PRO 61 12.655 18.341 5.656
410 HD3 PRO 61 1HD PRO 61 11.404 18.486 6.909
411 H THR 62 H THR 62 13.342 13.357 6.828
412 HA THR 62 HA THR 62 14.993 13.558 4.484
413 HB THR 62 HB THR 62 14.739 11.139 6.270
414 HG1 THR 62 1HG THR 62 16.248 13.508 6.676
415 HG21 THR 62 3HG2 THR 62 17.032 10.767 5.641
416 HG22 THR 62 1HG2 THR 62 17.132 12.345 4.862
417 HG23 THR 62 2HG2 THR 62 16.127 11.078 4.160
Start of MODEL 8
1 H1 GLY 1 1HT GLY 1 -40.268 -8.757 -5.594
2 H2 GLY 1 2HT GLY 1 -40.303 -8.920 -7.284
3 H3 GLY 1 3HT GLY 1 -41.048 -7.586 -6.540
4 HA2 GLY 1 2HA GLY 1 -38.152 -8.158 -6.781
5 HA3 GLY 1 1HA GLY 1 -39.038 -6.768 -7.409
6 H SER 2 H SER 2 -37.675 -8.269 -4.553
7 HA SER 2 HA SER 2 -38.252 -5.825 -2.979
8 HB2 SER 2 2HB SER 2 -37.575 -8.615 -2.015
9 HB3 SER 2 1HB SER 2 -37.930 -7.227 -0.991
10 HG SER 2 HG SER 2 -39.632 -8.924 -2.037
11 H MET 3 H MET 3 -36.069 -6.097 -4.926
12 HA MET 3 HA MET 3 -33.605 -6.599 -3.578
13 HB2 MET 3 2HB MET 3 -34.308 -5.144 -6.126
14 HB3 MET 3 1HB MET 3 -32.648 -5.273 -5.544
15 HG2 MET 3 2HG MET 3 -32.755 -7.698 -5.604
16 HG3 MET 3 1HG MET 3 -34.470 -7.650 -6.012
17 HE1 MET 3 3HE MET 3 -34.136 -9.083 -8.572
18 HE2 MET 3 1HE MET 3 -32.893 -9.360 -7.343
19 HE3 MET 3 2HE MET 3 -32.430 -9.039 -9.012
20 H ALA 4 H ALA 4 -35.169 -3.542 -4.588
21 HA ALA 4 HA ALA 4 -33.464 -2.087 -2.668
22 HB1 ALA 4 1HB ALA 4 -33.393 -1.271 -4.972
23 HB2 ALA 4 2HB ALA 4 -34.153 -0.071 -3.926
24 HB3 ALA 4 3HB ALA 4 -35.146 -1.081 -4.979
25 H GLN 5 H GLN 5 -35.761 -3.685 -1.810
26 HA GLN 5 HA GLN 5 -37.535 -1.546 -0.777
27 HB2 GLN 5 2HB GLN 5 -38.084 -4.431 -1.486
28 HB3 GLN 5 1HB GLN 5 -39.157 -3.508 -0.434
29 HG2 GLN 5 2HG GLN 5 -39.245 -1.747 -2.268
30 HG3 GLN 5 1HG GLN 5 -38.433 -2.914 -3.310
31 HE21 GLN 5 1HE2 GLN 5 -41.363 -1.767 -3.139
32 HE22 GLN 5 2HE2 GLN 5 -42.320 -3.174 -3.261
33 H GLU 6 H GLU 6 -34.958 -2.367 0.371
34 HA GLU 6 HA GLU 6 -35.850 -3.676 2.871
35 HB2 GLU 6 2HB GLU 6 -33.439 -4.161 3.246
36 HB3 GLU 6 1HB GLU 6 -34.063 -4.898 1.773
37 HG2 GLU 6 2HG GLU 6 -33.032 -3.236 0.390
38 HG3 GLU 6 1HG GLU 6 -32.665 -2.216 1.781
39 H THR 7 H THR 7 -34.179 -2.965 4.727
40 HA THR 7 HA THR 7 -34.810 -0.220 5.280
41 HB THR 7 HB THR 7 -33.460 -0.645 7.363
42 HG1 THR 7 1HG THR 7 -32.035 -2.163 6.934
43 HG21 THR 7 3HG2 THR 7 -35.497 -2.793 6.721
44 HG22 THR 7 1HG2 THR 7 -35.912 -1.138 7.165
45 HG23 THR 7 2HG2 THR 7 -35.079 -2.179 8.320
46 H ASN 8 H ASN 8 -33.089 1.322 6.053
47 HA ASN 8 HA ASN 8 -30.803 1.265 4.173
48 HB2 ASN 8 2HB ASN 8 -32.464 3.455 5.356
49 HB3 ASN 8 1HB ASN 8 -30.793 3.804 4.918
50 HD21 ASN 8 1HD2 ASN 8 -30.903 4.875 2.941
51 HD22 ASN 8 2HD2 ASN 8 -31.804 4.332 1.597
52 H GLN 9 H GLN 9 -30.894 -0.109 6.815
53 HA GLN 9 HA GLN 9 -28.477 1.125 7.949
54 HB2 GLN 9 2HB GLN 9 -29.348 0.518 10.251
55 HB3 GLN 9 1HB GLN 9 -30.157 1.879 9.478
56 HG2 GLN 9 2HG GLN 9 -32.130 0.725 9.187
57 HG3 GLN 9 1HG GLN 9 -31.319 -0.825 8.978
58 HE21 GLN 9 1HE2 GLN 9 -31.153 -2.180 10.803
59 HE22 GLN 9 2HE2 GLN 9 -31.635 -1.720 12.372
60 H THR 10 H THR 10 -27.544 -0.589 6.620
61 HA THR 10 HA THR 10 -27.156 -3.012 8.174
62 HB THR 10 HB THR 10 -27.508 -4.383 5.996
63 HG1 THR 10 1HG THR 10 -28.107 -3.138 4.424
64 HG21 THR 10 3HG2 THR 10 -29.711 -4.926 6.682
65 HG22 THR 10 1HG2 THR 10 -30.020 -3.286 7.255
66 HG23 THR 10 2HG2 THR 10 -28.923 -4.338 8.147
67 HA PRO 11 HA PRO 11 -23.123 -2.368 6.460
68 HB2 PRO 11 2HB PRO 11 -21.984 -4.822 6.711
69 HB3 PRO 11 1HB PRO 11 -22.353 -3.793 8.115
70 HG2 PRO 11 2HG PRO 11 -23.874 -6.111 7.019
71 HG3 PRO 11 1HG PRO 11 -23.512 -5.692 8.704
72 HD2 PRO 11 2HD PRO 11 -25.930 -5.158 7.528
73 HD3 PRO 11 1HD PRO 11 -25.253 -4.173 8.844
74 H GLY 12 H GLY 12 -21.588 -3.159 4.731
75 HA2 GLY 12 2HA GLY 12 -21.670 -4.953 2.826
76 HA3 GLY 12 1HA GLY 12 -23.126 -4.059 2.389
77 HA PRO 13 HA PRO 13 -20.649 -0.985 0.396
78 HB2 PRO 13 2HB PRO 13 -21.406 1.463 1.270
79 HB3 PRO 13 1HB PRO 13 -22.488 0.402 0.341
80 HG2 PRO 13 2HG PRO 13 -22.444 0.979 3.251
81 HG3 PRO 13 1HG PRO 13 -23.815 0.689 2.170
82 HD2 PRO 13 2HD PRO 13 -22.712 -1.207 3.898
83 HD3 PRO 13 1HD PRO 13 -23.743 -1.572 2.495
84 H MET 14 H MET 14 -18.521 -1.459 1.081
85 HA MET 14 HA MET 14 -17.399 -0.379 3.485
86 HB2 MET 14 2HB MET 14 -16.351 -1.878 1.114
87 HB3 MET 14 1HB MET 14 -15.203 -1.034 2.152
88 HG2 MET 14 2HG MET 14 -15.285 -3.057 3.271
89 HG3 MET 14 1HG MET 14 -16.606 -2.224 4.086
90 HE1 MET 14 3HE MET 14 -17.869 -5.802 3.974
91 HE2 MET 14 1HE MET 14 -16.794 -4.645 4.768
92 HE3 MET 14 2HE MET 14 -16.167 -5.717 3.522
93 H LEU 15 H LEU 15 -17.594 1.831 3.546
94 HA LEU 15 HA LEU 15 -16.810 3.509 1.324
95 HB2 LEU 15 2HB LEU 15 -18.050 3.839 3.975
96 HB3 LEU 15 1HB LEU 15 -16.951 5.150 3.565
97 HG LEU 15 HG LEU 15 -19.261 5.630 2.850
98 HD11 LEU 15 1HD1 LEU 15 -18.723 6.508 0.741
99 HD12 LEU 15 2HD1 LEU 15 -17.679 5.147 0.356
100 HD13 LEU 15 3HD1 LEU 15 -17.158 6.348 1.539
101 HD21 LEU 15 3HD2 LEU 15 -20.315 4.366 1.044
102 HD22 LEU 15 1HD2 LEU 15 -19.998 3.312 2.420
103 HD23 LEU 15 2HD2 LEU 15 -18.947 3.260 1.000
104 H CYS 16 H CYS 16 -14.925 4.701 1.106
105 HA CYS 16 HA CYS 16 -12.511 3.668 1.965
106 HB2 CYS 16 2HB CYS 16 -12.983 5.412 0.136
107 HB3 CYS 16 1HB CYS 16 -12.845 6.612 1.425
108 H SER 17 H SER 17 -11.545 3.539 3.848
109 HA SER 17 HA SER 17 -12.459 4.695 6.237
110 HB2 SER 17 2HB SER 17 -9.823 3.436 5.500
111 HB3 SER 17 1HB SER 17 -10.186 3.996 7.135
112 HG SER 17 HG SER 17 -10.756 1.693 6.273
113 H THR 18 H THR 18 -10.255 5.994 3.837
114 HA THR 18 HA THR 18 -9.023 7.909 5.575
115 HB THR 18 HB THR 18 -8.222 8.974 3.475
116 HG1 THR 18 1HG THR 18 -9.692 8.657 1.970
117 HG21 THR 18 3HG2 THR 18 -6.769 7.299 4.247
118 HG22 THR 18 1HG2 THR 18 -7.101 6.782 2.594
119 HG23 THR 18 2HG2 THR 18 -7.937 6.012 3.939
120 H GLY 19 H GLY 19 -12.121 7.824 4.016
121 HA2 GLY 19 2HA GLY 19 -13.882 9.300 4.410
122 HA3 GLY 19 1HA GLY 19 -12.744 10.431 5.134
123 H CYS 20 H CYS 20 -12.571 8.947 1.911
124 HA CYS 20 HA CYS 20 -12.401 11.629 0.751
125 HB2 CYS 20 2HB CYS 20 -11.678 10.533 -1.312
126 HB3 CYS 20 1HB CYS 20 -10.708 9.993 0.058
127 H GLY 21 H GLY 21 -14.748 9.100 1.115
128 HA2 GLY 21 2HA GLY 21 -17.058 9.410 0.740
129 HA3 GLY 21 1HA GLY 21 -16.684 10.683 -0.412
130 H PHE 22 H PHE 22 -14.729 8.026 -1.092
131 HA PHE 22 HA PHE 22 -16.484 7.208 -3.284
132 HB2 PHE 22 2HB PHE 22 -13.499 7.153 -2.865
133 HB3 PHE 22 1HB PHE 22 -14.269 6.194 -4.134
134 HD1 PHE 22 2HD PHE 22 -14.363 9.676 -2.735
135 HD2 PHE 22 1HD PHE 22 -14.565 7.175 -6.223
136 HE1 PHE 22 2HE PHE 22 -14.534 11.691 -4.168
137 HE2 PHE 22 1HE PHE 22 -14.745 9.191 -7.656
138 HZ PHE 22 HZ PHE 22 -14.728 11.447 -6.628
139 H TYR 23 H TYR 23 -15.713 4.827 -3.993
140 HA TYR 23 HA TYR 23 -16.533 3.123 -1.763
141 HB2 TYR 23 2HB TYR 23 -17.499 3.037 -4.157
142 HB3 TYR 23 1HB TYR 23 -16.010 2.182 -4.576
143 HD1 TYR 23 1HD TYR 23 -18.440 2.136 -1.704
144 HD2 TYR 23 2HD TYR 23 -16.227 -0.133 -4.604
145 HE1 TYR 23 1HE TYR 23 -19.368 0.049 -0.767
146 HE2 TYR 23 2HE TYR 23 -17.165 -2.233 -3.670
147 HH TYR 23 HH TYR 23 -19.328 -2.846 -2.339
148 H GLY 24 H GLY 24 -15.287 1.685 -0.723
149 HA2 GLY 24 2HA GLY 24 -12.439 1.507 -1.552
150 HA3 GLY 24 1HA GLY 24 -13.026 1.316 0.097
151 H ASN 25 H ASN 25 -11.318 -0.567 -1.003
152 HA ASN 25 HA ASN 25 -13.070 -2.886 -1.568
153 HB2 ASN 25 2HB ASN 25 -11.170 -2.046 -3.215
154 HB3 ASN 25 1HB ASN 25 -10.131 -2.949 -2.121
155 HD21 ASN 25 1HD2 ASN 25 -12.779 -3.265 -4.461
156 HD22 ASN 25 2HD2 ASN 25 -12.685 -4.966 -4.579
157 HA PRO 26 HA PRO 26 -11.552 -4.409 2.387
158 HB2 PRO 26 2HB PRO 26 -12.634 -6.879 2.383
159 HB3 PRO 26 1HB PRO 26 -13.622 -5.416 2.567
160 HG2 PRO 26 2HG PRO 26 -13.158 -7.083 0.139
161 HG3 PRO 26 1HG PRO 26 -14.669 -6.382 0.753
162 HD2 PRO 26 2HD PRO 26 -13.201 -5.239 -1.267
163 HD3 PRO 26 1HD PRO 26 -14.239 -4.307 -0.167
164 H ARG 27 H ARG 27 -10.957 -6.085 -0.669
165 HA ARG 27 HA ARG 27 -9.028 -7.944 0.362
166 HB2 ARG 27 2HB ARG 27 -9.796 -6.997 -2.387
167 HB3 ARG 27 1HB ARG 27 -8.332 -7.947 -2.159
168 HG2 ARG 27 2HG ARG 27 -9.499 -9.844 -1.479
169 HG3 ARG 27 1HG ARG 27 -10.890 -8.913 -0.919
170 HD2 ARG 27 2HD ARG 27 -11.356 -8.326 -3.332
171 HD3 ARG 27 1HD ARG 27 -10.099 -9.473 -3.789
172 HE ARG 27 HE ARG 27 -12.763 -10.103 -2.883
173 HH11 ARG 27 1HH2 ARG 27 -9.463 -11.308 -3.068
174 HH12 ARG 27 2HH2 ARG 27 -9.954 -12.963 -2.979
175 HH21 ARG 27 1HH1 ARG 27 -13.338 -12.264 -2.768
176 HH22 ARG 27 2HH1 ARG 27 -12.127 -13.500 -2.807
177 H THR 28 H THR 28 -8.995 -4.656 -0.873
178 HA THR 28 HA THR 28 -6.100 -4.453 -0.957
179 HB THR 28 HB THR 28 -6.484 -2.101 -1.484
180 HG1 THR 28 1HG THR 28 -8.097 -1.271 -0.442
181 HG21 THR 28 3HG2 THR 28 -6.819 -3.585 -3.356
182 HG22 THR 28 1HG2 THR 28 -8.068 -2.343 -3.422
183 HG23 THR 28 2HG2 THR 28 -8.460 -3.956 -2.829
184 H ASN 29 H ASN 29 -6.006 -1.805 0.431
185 HA ASN 29 HA ASN 29 -5.874 -2.828 3.164
186 HB2 ASN 29 2HB ASN 29 -4.651 -0.538 1.679
187 HB3 ASN 29 1HB ASN 29 -4.810 -0.408 3.433
188 HD21 ASN 29 1HD2 ASN 29 -3.931 -3.114 1.189
189 HD22 ASN 29 2HD2 ASN 29 -2.523 -3.551 2.048
190 H GLY 30 H GLY 30 -8.524 -2.153 1.895
191 HA2 GLY 30 2HA GLY 30 -10.514 -1.377 2.760
192 HA3 GLY 30 1HA GLY 30 -9.614 -0.648 4.087
193 H MET 31 H MET 31 -8.439 0.202 0.956
194 HA MET 31 HA MET 31 -9.818 2.815 1.126
195 HB2 MET 31 2HB MET 31 -6.973 2.061 0.592
196 HB3 MET 31 1HB MET 31 -7.626 3.483 -0.221
197 HG2 MET 31 2HG MET 31 -6.625 4.210 1.846
198 HG3 MET 31 1HG MET 31 -8.369 4.344 2.025
199 HE1 MET 31 3HE MET 31 -5.960 4.365 3.890
200 HE2 MET 31 1HE MET 31 -5.124 2.806 3.826
201 HE3 MET 31 2HE MET 31 -6.103 3.228 5.228
202 H CYS 32 H CYS 32 -9.966 3.951 -0.958
203 HA CYS 32 HA CYS 32 -11.056 2.241 -2.983
204 HB2 CYS 32 2HB CYS 32 -11.728 4.330 -4.065
205 HB3 CYS 32 1HB CYS 32 -12.089 4.410 -2.346
206 H SER 33 H SER 33 -10.241 3.801 -5.312
207 HA SER 33 HA SER 33 -7.837 2.379 -5.919
208 HB2 SER 33 2HB SER 33 -9.873 3.294 -7.439
209 HB3 SER 33 1HB SER 33 -8.688 4.563 -7.740
210 HG SER 33 HG SER 33 -7.258 3.037 -8.449
211 H VAL 34 H VAL 34 -8.563 5.864 -5.631
212 HA VAL 34 HA VAL 34 -5.912 6.732 -6.139
213 HB VAL 34 HB VAL 34 -8.053 8.220 -4.593
214 HG11 VAL 34 1HG1 VAL 34 -5.893 9.319 -4.458
215 HG12 VAL 34 2HG1 VAL 34 -6.891 10.208 -5.608
216 HG13 VAL 34 3HG1 VAL 34 -5.634 9.119 -6.191
217 HG21 VAL 34 3HG2 VAL 34 -7.573 7.903 -7.565
218 HG22 VAL 34 1HG2 VAL 34 -8.528 9.220 -6.883
219 HG23 VAL 34 2HG2 VAL 34 -9.050 7.552 -6.664
220 H CYS 35 H CYS 35 -7.693 6.607 -3.033
221 HA CYS 35 HA CYS 35 -5.630 7.444 -1.370
222 HB2 CYS 35 2HB CYS 35 -7.910 5.542 -0.794
223 HB3 CYS 35 1HB CYS 35 -6.874 6.259 0.437
224 H TYR 36 H TYR 36 -6.326 4.196 -2.592
225 HA TYR 36 HA TYR 36 -4.617 2.745 -0.923
226 HB2 TYR 36 2HB TYR 36 -6.307 1.720 -2.399
227 HB3 TYR 36 1HB TYR 36 -5.299 2.105 -3.796
228 HD1 TYR 36 1HD TYR 36 -4.742 0.632 -0.368
229 HD2 TYR 36 2HD TYR 36 -4.099 0.276 -4.605
230 HE1 TYR 36 1HE TYR 36 -3.438 -1.444 0.004
231 HE2 TYR 36 2HE TYR 36 -2.793 -1.800 -4.230
232 HH TYR 36 HH TYR 36 -1.426 -2.646 -1.578
233 H LYS 37 H LYS 37 -3.875 4.329 -4.029
234 HA LYS 37 HA LYS 37 -1.185 3.365 -4.112
235 HB2 LYS 37 2HB LYS 37 -2.616 4.155 -6.083
236 HB3 LYS 37 1HB LYS 37 -2.254 5.795 -5.548
237 HG2 LYS 37 2HG LYS 37 0.177 5.280 -5.695
238 HG3 LYS 37 1HG LYS 37 -0.221 3.676 -6.308
239 HD2 LYS 37 2HD LYS 37 0.081 4.821 -8.309
240 HD3 LYS 37 1HD LYS 37 -1.649 5.050 -8.069
241 HE2 LYS 37 2HE LYS 37 -1.344 7.259 -7.233
242 HE3 LYS 37 1HE LYS 37 0.391 7.023 -7.030
243 HZ1 LYS 37 3HZ LYS 37 0.030 8.290 -8.998
244 HZ2 LYS 37 1HZ LYS 37 -1.109 7.178 -9.585
245 HZ3 LYS 37 2HZ LYS 37 0.528 6.737 -9.473
246 H GLU 38 H GLU 38 -2.703 6.461 -3.250
247 HA GLU 38 HA GLU 38 -0.440 7.976 -2.725
248 HB2 GLU 38 2HB GLU 38 -3.159 8.035 -1.413
249 HB3 GLU 38 1HB GLU 38 -1.919 9.260 -1.140
250 HG2 GLU 38 2HG GLU 38 -2.817 8.517 -3.925
251 HG3 GLU 38 1HG GLU 38 -3.664 9.739 -2.974
252 H HIS 39 H HIS 39 -2.095 5.687 -0.535
253 HA HIS 39 HA HIS 39 -0.229 6.379 1.596
254 HB2 HIS 39 2HB HIS 39 -1.529 5.117 3.081
255 HB3 HIS 39 1HB HIS 39 -2.674 5.916 2.018
256 HD1 HIS 39 1HD HIS 39 -4.576 4.366 1.722
257 HD2 HIS 39 2HD HIS 39 -0.963 2.313 1.609
258 HE1 HIS 39 1HE HIS 39 -5.138 1.922 1.370
259 HE2 HIS 39 2HE HIS 39 -2.944 0.665 1.269
260 H LEU 40 H LEU 40 -0.659 3.764 -0.699
261 HA LEU 40 HA LEU 40 1.103 1.894 0.505
262 HB2 LEU 40 2HB LEU 40 -0.526 1.448 -1.382
263 HB3 LEU 40 1HB LEU 40 0.643 2.210 -2.466
264 HG LEU 40 HG LEU 40 2.363 0.561 -1.555
265 HD11 LEU 40 1HD1 LEU 40 1.085 -1.582 -0.702
266 HD12 LEU 40 2HD1 LEU 40 -0.153 -0.418 -0.232
267 HD13 LEU 40 3HD1 LEU 40 1.476 -0.288 0.431
268 HD21 LEU 40 3HD2 LEU 40 1.245 0.292 -3.757
269 HD22 LEU 40 1HD2 LEU 40 -0.065 -0.588 -2.970
270 HD23 LEU 40 2HD2 LEU 40 1.561 -1.268 -2.996
271 H GLN 41 H GLN 41 1.652 4.665 -1.589
272 HA GLN 41 HA GLN 41 4.384 4.099 -2.223
273 HB2 GLN 41 2HB GLN 41 2.729 5.751 -3.359
274 HB3 GLN 41 1HB GLN 41 3.210 6.868 -2.086
275 HG2 GLN 41 2HG GLN 41 5.605 6.490 -2.746
276 HG3 GLN 41 1HG GLN 41 5.023 5.541 -4.119
277 HE21 GLN 41 1HE2 GLN 41 4.230 8.738 -2.619
278 HE22 GLN 41 2HE2 GLN 41 4.139 9.568 -4.107
279 H ARG 42 H ARG 42 2.745 5.915 0.331
280 HA ARG 42 HA ARG 42 5.122 6.970 1.534
281 HB2 ARG 42 2HB ARG 42 2.237 6.760 2.333
282 HB3 ARG 42 1HB ARG 42 3.442 7.244 3.526
283 HG2 ARG 42 2HG ARG 42 4.152 9.103 2.120
284 HG3 ARG 42 1HG ARG 42 3.068 8.581 0.831
285 HD2 ARG 42 2HD ARG 42 1.896 10.319 1.959
286 HD3 ARG 42 1HD ARG 42 1.169 8.819 2.529
287 HE ARG 42 HE ARG 42 3.157 9.334 4.348
288 HH11 ARG 42 1HH2 ARG 42 0.405 11.174 3.154
289 HH12 ARG 42 2HH2 ARG 42 0.210 12.037 4.640
290 HH21 ARG 42 1HH1 ARG 42 2.847 10.478 6.248
291 HH22 ARG 42 2HH1 ARG 42 1.578 11.649 6.371
292 H GLN 43 H GLN 43 3.229 4.030 1.952
293 HA GLN 43 HA GLN 43 4.499 3.242 4.415
294 HB2 GLN 43 2HB GLN 43 2.649 1.905 2.460
295 HB3 GLN 43 1HB GLN 43 3.419 0.977 3.747
296 HG2 GLN 43 2HG GLN 43 1.957 3.547 4.333
297 HG3 GLN 43 1HG GLN 43 1.102 2.009 4.245
298 HE21 GLN 43 1HE2 GLN 43 1.132 0.724 6.116
299 HE22 GLN 43 2HE2 GLN 43 2.150 0.998 7.448
300 H GLN 44 H GLN 44 4.956 2.569 0.984
301 HA GLN 44 HA GLN 44 6.924 0.508 1.388
302 HB2 GLN 44 2HB GLN 44 5.907 2.055 -0.977
303 HB3 GLN 44 1HB GLN 44 7.371 1.083 -1.127
304 HG2 GLN 44 2HG GLN 44 6.095 -0.876 -0.221
305 HG3 GLN 44 1HG GLN 44 4.636 0.113 -0.257
306 HE21 GLN 44 1HE2 GLN 44 5.773 -2.328 -1.943
307 HE22 GLN 44 2HE2 GLN 44 5.418 -1.850 -3.541
308 H ASN 45 H ASN 45 6.988 3.988 0.770
309 HA ASN 45 HA ASN 45 9.792 4.203 0.325
310 HB2 ASN 45 2HB ASN 45 7.594 6.127 1.002
311 HB3 ASN 45 1HB ASN 45 9.273 6.663 1.085
312 HD21 ASN 45 1HD2 ASN 45 9.761 7.743 -0.825
313 HD22 ASN 45 2HD2 ASN 45 9.300 7.224 -2.385
314 H SER 46 H SER 46 7.764 4.364 3.217
315 HA SER 46 HA SER 46 9.928 5.139 4.960
316 HB2 SER 46 2HB SER 46 7.113 4.168 5.451
317 HB3 SER 46 1HB SER 46 8.237 4.523 6.759
318 HG SER 46 HG SER 46 6.722 6.237 5.696
319 H GLY 47 H GLY 47 8.071 2.135 4.432
320 HA2 GLY 47 2HA GLY 47 8.660 -0.075 4.704
321 HA3 GLY 47 1HA GLY 47 10.340 0.451 4.774
322 H ARG 48 H ARG 48 7.543 1.178 6.869
323 HA ARG 48 HA ARG 48 9.176 0.474 9.210
324 HB2 ARG 48 2HB ARG 48 6.589 2.013 8.912
325 HB3 ARG 48 1HB ARG 48 7.311 1.605 10.470
326 HG2 ARG 48 2HG ARG 48 9.362 2.809 9.862
327 HG3 ARG 48 1HG ARG 48 8.689 3.181 8.274
328 HD2 ARG 48 2HD ARG 48 6.951 4.536 9.242
329 HD3 ARG 48 1HD ARG 48 7.371 4.010 10.870
330 HE ARG 48 HE ARG 48 9.635 5.227 9.690
331 HH11 ARG 48 1HH2 ARG 48 6.451 6.106 10.906
332 HH12 ARG 48 2HH2 ARG 48 6.944 7.708 11.327
333 HH21 ARG 48 1HH1 ARG 48 10.208 7.321 10.258
334 HH22 ARG 48 2HH1 ARG 48 9.043 8.391 10.967
335 H MET 49 H MET 49 5.751 0.069 8.222
336 HA MET 49 HA MET 49 5.692 -2.480 9.721
337 HB2 MET 49 2HB MET 49 4.019 -0.579 10.197
338 HB3 MET 49 1HB MET 49 3.287 -1.012 8.652
339 HG2 MET 49 2HG MET 49 2.105 -2.280 10.290
340 HG3 MET 49 1HG MET 49 3.212 -3.418 9.525
341 HE1 MET 49 3HE MET 49 5.636 -4.242 10.820
342 HE2 MET 49 1HE MET 49 4.052 -5.013 10.668
343 HE3 MET 49 2HE MET 49 4.893 -5.020 12.215
344 H SER 50 H SER 50 6.314 -4.075 8.358
345 HA SER 50 HA SER 50 4.597 -4.757 6.146
346 HB2 SER 50 2HB SER 50 6.320 -4.713 4.413
347 HB3 SER 50 1HB SER 50 6.097 -3.098 5.078
348 HG SER 50 HG SER 50 8.334 -3.931 4.852
349 HA PRO 51 HA PRO 51 6.125 -8.745 7.359
350 HB2 PRO 51 2HB PRO 51 5.644 -10.263 5.155
351 HB3 PRO 51 1HB PRO 51 4.342 -9.639 6.187
352 HG2 PRO 51 2HG PRO 51 5.325 -8.634 3.565
353 HG3 PRO 51 1HG PRO 51 3.668 -8.756 4.180
354 HD2 PRO 51 2HD PRO 51 5.113 -6.409 4.152
355 HD3 PRO 51 1HD PRO 51 3.790 -6.743 5.290
356 H MET 52 H MET 52 7.265 -7.555 4.216
357 HA MET 52 HA MET 52 9.942 -8.634 4.807
358 HB2 MET 52 2HB MET 52 8.370 -9.051 2.261
359 HB3 MET 52 1HB MET 52 10.123 -9.231 2.343
360 HG2 MET 52 2HG MET 52 8.269 -10.687 4.234
361 HG3 MET 52 1HG MET 52 8.752 -11.369 2.682
362 HE1 MET 52 3HE MET 52 9.866 -13.311 3.249
363 HE2 MET 52 1HE MET 52 9.491 -13.218 4.975
364 HE3 MET 52 2HE MET 52 11.136 -13.562 4.444
365 H GLY 53 H GLY 53 8.244 -6.826 2.222
366 HA2 GLY 53 2HA GLY 53 8.526 -4.491 1.814
367 HA3 GLY 53 1HA GLY 53 10.063 -4.551 2.670
368 H THR 54 H THR 54 11.054 -6.918 1.334
369 HA THR 54 HA THR 54 11.440 -5.895 -1.423
370 HB THR 54 HB THR 54 13.778 -6.766 -1.253
371 HG1 THR 54 1HG THR 54 13.090 -6.964 1.492
372 HG21 THR 54 3HG2 THR 54 14.597 -4.902 0.171
373 HG22 THR 54 1HG2 THR 54 12.955 -4.661 0.764
374 HG23 THR 54 2HG2 THR 54 13.325 -4.385 -0.937
375 H ALA 55 H ALA 55 11.930 -7.493 -3.025
376 HA ALA 55 HA ALA 55 10.597 -10.038 -2.502
377 HB1 ALA 55 1HB ALA 55 11.727 -8.916 -5.079
378 HB2 ALA 55 2HB ALA 55 10.054 -8.748 -4.545
379 HB3 ALA 55 3HB ALA 55 10.703 -10.344 -4.925
380 H SER 56 H SER 56 11.728 -11.743 -1.834
381 HA SER 56 HA SER 56 14.620 -11.836 -2.204
382 HB2 SER 56 2HB SER 56 12.765 -13.744 -0.766
383 HB3 SER 56 1HB SER 56 14.525 -13.781 -0.716
384 HG SER 56 HG SER 56 12.716 -12.019 0.464
385 H GLY 57 H GLY 57 15.465 -14.190 -2.655
386 HA2 GLY 57 2HA GLY 57 15.457 -16.121 -3.985
387 HA3 GLY 57 1HA GLY 57 13.897 -15.634 -4.646
388 H SER 58 H SER 58 17.371 -14.883 -4.721
389 HA SER 58 HA SER 58 17.145 -14.282 -7.580
390 HB2 SER 58 2HB SER 58 18.488 -12.387 -5.640
391 HB3 SER 58 1HB SER 58 18.360 -12.188 -7.386
392 HG SER 58 HG SER 58 16.178 -11.921 -7.185
393 H ASN 59 H ASN 59 18.256 -16.510 -6.076
394 HA ASN 59 HA ASN 59 21.123 -16.239 -6.025
395 HB2 ASN 59 2HB ASN 59 21.090 -18.709 -5.654
396 HB3 ASN 59 1HB ASN 59 20.094 -17.817 -4.509
397 HD21 ASN 59 1HD2 ASN 59 20.006 -20.096 -7.206
398 HD22 ASN 59 2HD2 ASN 59 18.348 -20.444 -7.088
399 H SER 60 H SER 60 22.623 -17.321 -7.396
400 HA SER 60 HA SER 60 21.590 -18.189 -10.020
401 HB2 SER 60 2HB SER 60 22.242 -15.864 -10.314
402 HB3 SER 60 1HB SER 60 23.803 -16.175 -9.558
403 HG SER 60 HG SER 60 22.844 -16.873 -12.082
404 HA PRO 61 HA PRO 61 24.385 -21.602 -9.526
405 HB2 PRO 61 2HB PRO 61 25.139 -21.287 -12.390
406 HB3 PRO 61 1HB PRO 61 24.468 -22.694 -11.545
407 HG2 PRO 61 2HG PRO 61 22.995 -21.229 -13.208
408 HG3 PRO 61 1HG PRO 61 22.310 -21.954 -11.743
409 HD2 PRO 61 2HD PRO 61 23.051 -19.098 -12.264
410 HD3 PRO 61 1HD PRO 61 21.711 -19.762 -11.302
411 H THR 62 H THR 62 26.549 -21.989 -9.092
412 HA THR 62 HA THR 62 28.325 -19.690 -9.198
413 HB THR 62 HB THR 62 29.051 -22.427 -8.172
414 HG1 THR 62 1HG THR 62 27.938 -22.044 -6.378
415 HG21 THR 62 3HG2 THR 62 29.810 -19.604 -7.371
416 HG22 THR 62 1HG2 THR 62 30.814 -20.714 -8.302
417 HG23 THR 62 2HG2 THR 62 30.421 -21.078 -6.622
Start of MODEL 9
1 H1 GLY 1 1HT GLY 1 -37.123 -9.450 22.621
2 H2 GLY 1 2HT GLY 1 -37.372 -10.506 21.313
3 H3 GLY 1 3HT GLY 1 -37.854 -8.881 21.202
4 HA2 GLY 1 2HA GLY 1 -35.031 -9.664 21.616
5 HA3 GLY 1 1HA GLY 1 -35.734 -9.485 20.008
6 H SER 2 H SER 2 -35.626 -7.725 23.123
7 HA SER 2 HA SER 2 -34.985 -5.254 21.644
8 HB2 SER 2 2HB SER 2 -36.948 -5.289 23.934
9 HB3 SER 2 1HB SER 2 -36.599 -3.971 22.822
10 HG SER 2 HG SER 2 -38.549 -5.205 22.370
11 H MET 3 H MET 3 -33.549 -3.911 22.662
12 HA MET 3 HA MET 3 -32.828 -4.397 25.455
13 HB2 MET 3 2HB MET 3 -31.016 -4.895 23.111
14 HB3 MET 3 1HB MET 3 -30.352 -4.389 24.664
15 HG2 MET 3 2HG MET 3 -31.691 -6.294 25.708
16 HG3 MET 3 1HG MET 3 -31.974 -6.868 24.064
17 HE1 MET 3 3HE MET 3 -31.058 -9.039 24.626
18 HE2 MET 3 1HE MET 3 -30.466 -8.713 26.259
19 HE3 MET 3 2HE MET 3 -29.397 -9.438 25.061
20 H ALA 4 H ALA 4 -30.830 -2.827 25.939
21 HA ALA 4 HA ALA 4 -31.759 -0.168 25.145
22 HB1 ALA 4 1HB ALA 4 -29.996 0.507 26.914
23 HB2 ALA 4 2HB ALA 4 -29.949 -1.211 27.313
24 HB3 ALA 4 3HB ALA 4 -31.456 -0.309 27.472
25 H GLN 5 H GLN 5 -28.847 -2.184 25.005
26 HA GLN 5 HA GLN 5 -27.456 -0.117 23.437
27 HB2 GLN 5 2HB GLN 5 -26.416 -1.394 25.442
28 HB3 GLN 5 1HB GLN 5 -26.258 -2.735 24.308
29 HG2 GLN 5 2HG GLN 5 -24.892 -1.433 22.823
30 HG3 GLN 5 1HG GLN 5 -25.235 0.050 23.712
31 HE21 GLN 5 1HE2 GLN 5 -24.544 -0.099 26.161
32 HE22 GLN 5 2HE2 GLN 5 -23.047 -0.860 26.459
33 H GLU 6 H GLU 6 -29.698 -1.705 22.319
34 HA GLU 6 HA GLU 6 -28.549 -3.645 20.521
35 HB2 GLU 6 2HB GLU 6 -30.974 -3.559 21.427
36 HB3 GLU 6 1HB GLU 6 -31.244 -2.355 20.166
37 HG2 GLU 6 2HG GLU 6 -30.495 -3.933 18.452
38 HG3 GLU 6 1HG GLU 6 -30.129 -5.134 19.691
39 H THR 7 H THR 7 -27.312 -3.060 18.856
40 HA THR 7 HA THR 7 -27.551 -0.410 17.674
41 HB THR 7 HB THR 7 -25.306 -1.262 18.042
42 HG1 THR 7 1HG THR 7 -24.702 -0.452 16.215
43 HG21 THR 7 3HG2 THR 7 -26.398 -3.659 16.634
44 HG22 THR 7 1HG2 THR 7 -25.282 -3.566 17.996
45 HG23 THR 7 2HG2 THR 7 -24.704 -3.251 16.361
46 H ASN 8 H ASN 8 -27.626 -0.170 15.286
47 HA ASN 8 HA ASN 8 -29.248 -2.273 13.977
48 HB2 ASN 8 2HB ASN 8 -29.771 0.686 14.175
49 HB3 ASN 8 1HB ASN 8 -30.432 -0.273 12.852
50 HD21 ASN 8 1HD2 ASN 8 -31.722 -2.279 13.574
51 HD22 ASN 8 2HD2 ASN 8 -32.636 -2.142 15.007
52 H GLN 9 H GLN 9 -26.398 -1.777 13.776
53 HA GLN 9 HA GLN 9 -26.108 -0.637 11.073
54 HB2 GLN 9 2HB GLN 9 -23.672 -0.699 11.558
55 HB3 GLN 9 1HB GLN 9 -24.571 0.278 12.712
56 HG2 GLN 9 2HG GLN 9 -23.841 -0.989 14.429
57 HG3 GLN 9 1HG GLN 9 -24.489 -2.443 13.682
58 HE21 GLN 9 1HE2 GLN 9 -21.600 -1.001 14.693
59 HE22 GLN 9 2HE2 GLN 9 -20.518 -1.945 13.772
60 H THR 10 H THR 10 -24.360 -1.815 9.733
61 HA THR 10 HA THR 10 -24.160 -4.666 10.097
62 HB THR 10 HB THR 10 -26.403 -4.630 9.183
63 HG1 THR 10 1HG THR 10 -25.581 -6.278 8.184
64 HG21 THR 10 3HG2 THR 10 -25.183 -2.751 7.163
65 HG22 THR 10 1HG2 THR 10 -26.635 -2.525 8.141
66 HG23 THR 10 2HG2 THR 10 -26.647 -3.661 6.792
67 HA PRO 11 HA PRO 11 -20.568 -3.654 7.661
68 HB2 PRO 11 2HB PRO 11 -19.649 -6.146 7.045
69 HB3 PRO 11 1HB PRO 11 -19.517 -5.441 8.667
70 HG2 PRO 11 2HG PRO 11 -21.426 -7.461 7.630
71 HG3 PRO 11 1HG PRO 11 -20.672 -7.329 9.227
72 HD2 PRO 11 2HD PRO 11 -23.273 -6.548 8.658
73 HD3 PRO 11 1HD PRO 11 -22.317 -5.942 10.025
74 H GLY 12 H GLY 12 -19.590 -4.011 5.476
75 HA2 GLY 12 2HA GLY 12 -20.098 -5.191 3.262
76 HA3 GLY 12 1HA GLY 12 -21.698 -4.468 3.450
77 HA PRO 13 HA PRO 13 -20.306 -0.652 1.692
78 HB2 PRO 13 2HB PRO 13 -21.001 1.351 3.420
79 HB3 PRO 13 1HB PRO 13 -22.185 0.434 2.465
80 HG2 PRO 13 2HG PRO 13 -21.389 0.100 5.322
81 HG3 PRO 13 1HG PRO 13 -23.004 0.050 4.585
82 HD2 PRO 13 2HD PRO 13 -21.634 -2.212 5.246
83 HD3 PRO 13 1HD PRO 13 -22.762 -2.143 3.872
84 H MET 14 H MET 14 -18.009 -1.502 2.121
85 HA MET 14 HA MET 14 -16.466 -0.332 4.236
86 HB2 MET 14 2HB MET 14 -15.725 -1.775 1.690
87 HB3 MET 14 1HB MET 14 -14.508 -1.101 2.771
88 HG2 MET 14 2HG MET 14 -16.668 -2.963 3.766
89 HG3 MET 14 1HG MET 14 -15.135 -3.562 3.136
90 HE1 MET 14 3HE MET 14 -13.275 -3.913 6.204
91 HE2 MET 14 1HE MET 14 -13.400 -4.157 4.456
92 HE3 MET 14 2HE MET 14 -14.662 -4.763 5.527
93 H LEU 15 H LEU 15 -17.019 1.918 4.045
94 HA LEU 15 HA LEU 15 -16.364 3.390 1.656
95 HB2 LEU 15 2HB LEU 15 -17.771 3.883 4.109
96 HB3 LEU 15 1HB LEU 15 -16.536 5.127 3.940
97 HG LEU 15 HG LEU 15 -17.364 5.561 1.610
98 HD11 LEU 15 1HD1 LEU 15 -19.410 3.497 2.456
99 HD12 LEU 15 2HD1 LEU 15 -18.425 3.517 0.993
100 HD13 LEU 15 3HD1 LEU 15 -19.739 4.676 1.186
101 HD21 LEU 15 3HD2 LEU 15 -19.506 6.640 2.356
102 HD22 LEU 15 1HD2 LEU 15 -18.138 6.982 3.414
103 HD23 LEU 15 2HD2 LEU 15 -19.345 5.790 3.892
104 H CYS 16 H CYS 16 -14.588 4.732 1.289
105 HA CYS 16 HA CYS 16 -12.093 3.904 1.987
106 HB2 CYS 16 2HB CYS 16 -12.781 5.632 0.234
107 HB3 CYS 16 1HB CYS 16 -12.636 6.827 1.529
108 H SER 17 H SER 17 -10.681 4.087 3.548
109 HA SER 17 HA SER 17 -11.422 4.979 6.144
110 HB2 SER 17 2HB SER 17 -8.600 4.434 5.230
111 HB3 SER 17 1HB SER 17 -9.285 4.228 6.843
112 HG SER 17 HG SER 17 -10.335 2.451 6.177
113 H THR 18 H THR 18 -9.814 6.587 3.490
114 HA THR 18 HA THR 18 -8.636 8.655 5.130
115 HB THR 18 HB THR 18 -8.003 9.679 2.979
116 HG1 THR 18 1HG THR 18 -9.288 9.238 1.399
117 HG21 THR 18 3HG2 THR 18 -7.203 7.052 2.200
118 HG22 THR 18 1HG2 THR 18 -7.213 7.100 3.964
119 HG23 THR 18 2HG2 THR 18 -6.256 8.267 3.055
120 H GLY 19 H GLY 19 -11.773 8.170 3.746
121 HA2 GLY 19 2HA GLY 19 -13.646 9.492 4.128
122 HA3 GLY 19 1HA GLY 19 -12.590 10.773 4.726
123 H CYS 20 H CYS 20 -12.230 9.174 1.584
124 HA CYS 20 HA CYS 20 -12.330 11.749 0.270
125 HB2 CYS 20 2HB CYS 20 -11.869 10.495 -1.809
126 HB3 CYS 20 1HB CYS 20 -10.725 10.092 -0.527
127 H GLY 21 H GLY 21 -14.653 9.306 1.036
128 HA2 GLY 21 2HA GLY 21 -16.974 9.584 0.867
129 HA3 GLY 21 1HA GLY 21 -16.722 10.811 -0.374
130 H PHE 22 H PHE 22 -14.861 8.023 -1.011
131 HA PHE 22 HA PHE 22 -16.792 7.151 -3.039
132 HB2 PHE 22 2HB PHE 22 -13.779 7.045 -2.868
133 HB3 PHE 22 1HB PHE 22 -14.680 6.116 -4.065
134 HD1 PHE 22 1HD PHE 22 -16.408 7.391 -5.503
135 HD2 PHE 22 2HD PHE 22 -13.263 9.314 -3.300
136 HE1 PHE 22 1HE PHE 22 -16.634 9.398 -6.935
137 HE2 PHE 22 2HE PHE 22 -13.486 11.325 -4.735
138 HZ PHE 22 HZ PHE 22 -15.173 11.368 -6.553
139 H TYR 23 H TYR 23 -15.885 4.669 -3.642
140 HA TYR 23 HA TYR 23 -16.596 3.150 -1.223
141 HB2 TYR 23 2HB TYR 23 -17.770 2.931 -3.561
142 HB3 TYR 23 1HB TYR 23 -16.382 1.907 -3.942
143 HD1 TYR 23 1HD TYR 23 -18.878 2.446 -1.189
144 HD2 TYR 23 2HD TYR 23 -16.512 -0.365 -3.417
145 HE1 TYR 23 1HE TYR 23 -19.921 0.578 0.062
146 HE2 TYR 23 2HE TYR 23 -17.555 -2.235 -2.165
147 HH TYR 23 HH TYR 23 -18.709 -2.407 0.253
148 H GLY 24 H GLY 24 -15.354 1.502 -0.407
149 HA2 GLY 24 2HA GLY 24 -12.584 1.293 -1.450
150 HA3 GLY 24 1HA GLY 24 -13.021 1.130 0.252
151 H ASN 25 H ASN 25 -11.552 -0.882 -0.811
152 HA ASN 25 HA ASN 25 -13.515 -3.073 -1.197
153 HB2 ASN 25 2HB ASN 25 -11.799 -2.353 -3.109
154 HB3 ASN 25 1HB ASN 25 -10.704 -3.363 -2.175
155 HD21 ASN 25 1HD2 ASN 25 -14.214 -3.679 -3.008
156 HD22 ASN 25 2HD2 ASN 25 -14.059 -5.256 -3.639
157 HA PRO 26 HA PRO 26 -11.553 -4.662 2.493
158 HB2 PRO 26 2HB PRO 26 -12.549 -7.194 2.528
159 HB3 PRO 26 1HB PRO 26 -13.507 -5.762 2.945
160 HG2 PRO 26 2HG PRO 26 -13.499 -7.374 0.457
161 HG3 PRO 26 1HG PRO 26 -14.839 -6.551 1.272
162 HD2 PRO 26 2HD PRO 26 -13.503 -5.572 -0.969
163 HD3 PRO 26 1HD PRO 26 -14.468 -4.585 0.148
164 H ARG 27 H ARG 27 -11.023 -6.043 -0.656
165 HA ARG 27 HA ARG 27 -9.029 -7.963 0.167
166 HB2 ARG 27 2HB ARG 27 -10.013 -6.894 -2.470
167 HB3 ARG 27 1HB ARG 27 -8.540 -7.858 -2.392
168 HG2 ARG 27 2HG ARG 27 -10.939 -8.923 -0.956
169 HG3 ARG 27 1HG ARG 27 -10.966 -8.974 -2.718
170 HD2 ARG 27 2HD ARG 27 -8.612 -10.021 -2.537
171 HD3 ARG 27 1HD ARG 27 -9.001 -10.283 -0.840
172 HE ARG 27 HE ARG 27 -11.143 -11.298 -2.314
173 HH11 ARG 27 1HH2 ARG 27 -7.703 -11.957 -2.001
174 HH12 ARG 27 2HH2 ARG 27 -7.889 -13.638 -2.359
175 HH21 ARG 27 1HH1 ARG 27 -11.314 -13.491 -2.792
176 HH22 ARG 27 2HH1 ARG 27 -9.903 -14.495 -2.812
177 H THR 28 H THR 28 -9.141 -4.635 -0.968
178 HA THR 28 HA THR 28 -6.265 -4.382 -1.262
179 HB THR 28 HB THR 28 -6.726 -2.035 -1.726
180 HG1 THR 28 1HG THR 28 -9.353 -2.620 -0.839
181 HG21 THR 28 3HG2 THR 28 -7.249 -3.545 -3.564
182 HG22 THR 28 1HG2 THR 28 -8.439 -2.244 -3.526
183 HG23 THR 28 2HG2 THR 28 -8.856 -3.840 -2.903
184 H ASN 29 H ASN 29 -6.173 -1.716 0.186
185 HA ASN 29 HA ASN 29 -5.674 -2.774 2.849
186 HB2 ASN 29 2HB ASN 29 -4.911 -0.314 1.319
187 HB3 ASN 29 1HB ASN 29 -4.883 -0.248 3.079
188 HD21 ASN 29 1HD2 ASN 29 -4.059 -3.077 0.994
189 HD22 ASN 29 2HD2 ASN 29 -2.445 -3.178 1.531
190 H GLY 30 H GLY 30 -8.523 -2.407 1.935
191 HA2 GLY 30 2HA GLY 30 -10.477 -1.804 2.960
192 HA3 GLY 30 1HA GLY 30 -9.526 -1.106 4.269
193 H MET 31 H MET 31 -8.673 0.056 1.130
194 HA MET 31 HA MET 31 -10.381 2.444 1.463
195 HB2 MET 31 2HB MET 31 -7.446 2.416 0.697
196 HB3 MET 31 1HB MET 31 -8.480 3.849 0.790
197 HG2 MET 31 2HG MET 31 -8.941 3.089 3.233
198 HG3 MET 31 1HG MET 31 -7.520 2.071 3.036
199 HE1 MET 31 3HE MET 31 -6.271 3.658 5.205
200 HE2 MET 31 1HE MET 31 -4.880 4.089 4.199
201 HE3 MET 31 2HE MET 31 -5.714 2.559 3.945
202 H CYS 32 H CYS 32 -10.143 3.818 -0.681
203 HA CYS 32 HA CYS 32 -11.095 2.106 -2.766
204 HB2 CYS 32 2HB CYS 32 -11.778 4.085 -3.898
205 HB3 CYS 32 1HB CYS 32 -12.083 4.354 -2.186
206 H SER 33 H SER 33 -10.256 3.252 -5.111
207 HA SER 33 HA SER 33 -7.729 1.951 -5.452
208 HB2 SER 33 2HB SER 33 -9.822 2.410 -7.098
209 HB3 SER 33 1HB SER 33 -8.709 3.651 -7.664
210 HG SER 33 HG SER 33 -8.486 1.499 -8.632
211 H VAL 34 H VAL 34 -8.658 5.416 -5.721
212 HA VAL 34 HA VAL 34 -6.045 6.273 -6.470
213 HB VAL 34 HB VAL 34 -8.162 7.972 -5.121
214 HG11 VAL 34 1HG1 VAL 34 -6.966 9.654 -6.791
215 HG12 VAL 34 2HG1 VAL 34 -5.639 8.498 -6.668
216 HG13 VAL 34 3HG1 VAL 34 -6.245 9.300 -5.220
217 HG21 VAL 34 3HG2 VAL 34 -7.742 7.484 -8.084
218 HG22 VAL 34 1HG2 VAL 34 -8.979 8.503 -7.351
219 HG23 VAL 34 2HG2 VAL 34 -9.038 6.755 -7.141
220 H CYS 35 H CYS 35 -7.751 6.478 -3.342
221 HA CYS 35 HA CYS 35 -5.660 7.608 -1.857
222 HB2 CYS 35 2HB CYS 35 -7.926 5.815 -0.968
223 HB3 CYS 35 1HB CYS 35 -6.881 6.723 0.122
224 H TYR 36 H TYR 36 -6.443 4.234 -2.587
225 HA TYR 36 HA TYR 36 -4.697 2.979 -0.800
226 HB2 TYR 36 2HB TYR 36 -6.340 1.661 -1.948
227 HB3 TYR 36 1HB TYR 36 -5.686 2.105 -3.526
228 HD1 TYR 36 2HD TYR 36 -4.261 0.771 -0.303
229 HD2 TYR 36 1HD TYR 36 -4.576 0.328 -4.561
230 HE1 TYR 36 2HE TYR 36 -2.738 -1.176 -0.208
231 HE2 TYR 36 1HE TYR 36 -3.056 -1.630 -4.467
232 HH TYR 36 HH TYR 36 -2.266 -3.211 -1.598
233 H LYS 37 H LYS 37 -4.073 4.505 -3.905
234 HA LYS 37 HA LYS 37 -1.386 3.502 -4.128
235 HB2 LYS 37 2HB LYS 37 -3.195 5.299 -5.647
236 HB3 LYS 37 1HB LYS 37 -1.477 5.642 -5.808
237 HG2 LYS 37 2HG LYS 37 -1.181 3.132 -6.270
238 HG3 LYS 37 1HG LYS 37 -2.933 3.076 -6.463
239 HD2 LYS 37 2HD LYS 37 -1.941 3.385 -8.655
240 HD3 LYS 37 1HD LYS 37 -2.734 4.891 -8.194
241 HE2 LYS 37 2HE LYS 37 -0.667 5.943 -7.670
242 HE3 LYS 37 1HE LYS 37 0.201 4.408 -7.649
243 HZ1 LYS 37 3HZ LYS 37 -0.915 5.830 -9.995
244 HZ2 LYS 37 1HZ LYS 37 -0.399 4.214 -10.059
245 HZ3 LYS 37 2HZ LYS 37 0.711 5.443 -9.685
246 H GLU 38 H GLU 38 -2.913 6.579 -3.208
247 HA GLU 38 HA GLU 38 -0.602 8.088 -2.788
248 HB2 GLU 38 2HB GLU 38 -3.312 8.267 -1.469
249 HB3 GLU 38 1HB GLU 38 -2.040 9.471 -1.262
250 HG2 GLU 38 2HG GLU 38 -1.973 9.555 -3.848
251 HG3 GLU 38 1HG GLU 38 -3.531 8.734 -3.779
252 H HIS 39 H HIS 39 -2.320 5.958 -0.469
253 HA HIS 39 HA HIS 39 -0.456 6.716 1.624
254 HB2 HIS 39 2HB HIS 39 -1.778 5.543 3.144
255 HB3 HIS 39 1HB HIS 39 -2.935 6.166 1.977
256 HD1 HIS 39 1HD HIS 39 -4.676 4.470 1.496
257 HD2 HIS 39 2HD HIS 39 -0.985 2.664 2.173
258 HE1 HIS 39 1HE HIS 39 -5.067 1.972 1.379
259 HE2 HIS 39 2HE HIS 39 -2.820 0.859 1.764
260 H LEU 40 H LEU 40 -0.865 3.956 -0.539
261 HA LEU 40 HA LEU 40 0.990 2.211 0.700
262 HB2 LEU 40 2HB LEU 40 -0.648 1.660 -1.179
263 HB3 LEU 40 1HB LEU 40 0.536 2.369 -2.281
264 HG LEU 40 HG LEU 40 2.226 0.769 -1.107
265 HD11 LEU 40 1HD1 LEU 40 0.780 0.091 0.739
266 HD12 LEU 40 2HD1 LEU 40 1.124 -1.313 -0.274
267 HD13 LEU 40 3HD1 LEU 40 -0.436 -0.500 -0.394
268 HD21 LEU 40 3HD2 LEU 40 0.989 0.624 -3.461
269 HD22 LEU 40 1HD2 LEU 40 0.181 -0.749 -2.702
270 HD23 LEU 40 2HD2 LEU 40 1.938 -0.733 -2.860
271 H GLN 41 H GLN 41 1.421 4.994 -1.373
272 HA GLN 41 HA GLN 41 4.075 4.562 -2.243
273 HB2 GLN 41 2HB GLN 41 2.462 6.326 -3.086
274 HB3 GLN 41 1HB GLN 41 2.840 7.251 -1.633
275 HG2 GLN 41 2HG GLN 41 4.311 8.070 -3.323
276 HG3 GLN 41 1HG GLN 41 5.292 7.031 -2.286
277 HE21 GLN 41 1HE2 GLN 41 3.127 6.534 -5.148
278 HE22 GLN 41 2HE2 GLN 41 4.222 5.519 -5.972
279 H ARG 42 H ARG 42 2.761 6.007 0.716
280 HA ARG 42 HA ARG 42 5.350 6.775 1.741
281 HB2 ARG 42 2HB ARG 42 2.592 6.676 2.977
282 HB3 ARG 42 1HB ARG 42 4.030 7.129 3.893
283 HG2 ARG 42 2HG ARG 42 4.430 8.778 1.867
284 HG3 ARG 42 1HG ARG 42 2.696 8.572 1.626
285 HD2 ARG 42 2HD ARG 42 2.248 9.305 3.911
286 HD3 ARG 42 1HD ARG 42 3.974 9.403 4.251
287 HE ARG 42 HE ARG 42 3.160 11.035 2.007
288 HH11 ARG 42 1HH2 ARG 42 3.462 10.945 5.510
289 HH12 ARG 42 2HH2 ARG 42 3.554 12.664 5.649
290 HH21 ARG 42 1HH1 ARG 42 3.256 13.264 2.259
291 HH22 ARG 42 2HH1 ARG 42 3.428 13.966 3.834
292 H GLN 43 H GLN 43 3.261 3.963 1.934
293 HA GLN 43 HA GLN 43 4.568 2.737 4.180
294 HB2 GLN 43 2HB GLN 43 2.812 1.552 2.016
295 HB3 GLN 43 1HB GLN 43 3.306 0.716 3.486
296 HG2 GLN 43 2HG GLN 43 2.077 3.375 3.952
297 HG3 GLN 43 1HG GLN 43 0.996 2.196 3.219
298 HE21 GLN 43 1HE2 GLN 43 3.343 2.417 5.966
299 HE22 GLN 43 2HE2 GLN 43 2.433 1.424 7.001
300 H GLN 44 H GLN 44 4.917 2.592 0.661
301 HA GLN 44 HA GLN 44 6.755 0.396 0.647
302 HB2 GLN 44 2HB GLN 44 5.311 1.166 -1.301
303 HB3 GLN 44 1HB GLN 44 6.468 2.481 -1.518
304 HG2 GLN 44 2HG GLN 44 8.297 0.826 -1.737
305 HG3 GLN 44 1HG GLN 44 7.132 -0.477 -1.550
306 HE21 GLN 44 1HE2 GLN 44 5.987 -1.144 -3.404
307 HE22 GLN 44 2HE2 GLN 44 6.114 -0.369 -4.921
308 H ASN 45 H ASN 45 7.130 3.827 1.172
309 HA ASN 45 HA ASN 45 9.712 4.331 0.319
310 HB2 ASN 45 2HB ASN 45 8.058 5.940 1.399
311 HB3 ASN 45 1HB ASN 45 8.647 5.342 2.950
312 HD21 ASN 45 1HD2 ASN 45 9.306 7.560 0.391
313 HD22 ASN 45 2HD2 ASN 45 10.867 8.020 0.908
314 H SER 46 H SER 46 8.726 2.790 3.375
315 HA SER 46 HA SER 46 11.517 2.446 4.169
316 HB2 SER 46 2HB SER 46 10.584 1.505 6.236
317 HB3 SER 46 1HB SER 46 9.859 3.069 5.874
318 HG SER 46 HG SER 46 8.147 1.798 6.264
319 H GLY 47 H GLY 47 8.688 0.349 3.538
320 HA2 GLY 47 2HA GLY 47 8.724 -1.671 2.321
321 HA3 GLY 47 1HA GLY 47 10.480 -1.702 2.466
322 H ARG 48 H ARG 48 11.022 -1.594 5.069
323 HA ARG 48 HA ARG 48 9.435 -3.741 6.350
324 HB2 ARG 48 2HB ARG 48 11.715 -4.445 5.312
325 HB3 ARG 48 1HB ARG 48 12.418 -3.575 6.674
326 HG2 ARG 48 2HG ARG 48 10.658 -4.987 8.072
327 HG3 ARG 48 1HG ARG 48 10.741 -6.063 6.678
328 HD2 ARG 48 2HD ARG 48 13.165 -6.252 6.924
329 HD3 ARG 48 1HD ARG 48 13.146 -5.092 8.248
330 HE ARG 48 HE ARG 48 12.456 -6.793 9.660
331 HH11 ARG 48 1HH2 ARG 48 11.876 -7.798 6.340
332 HH12 ARG 48 2HH2 ARG 48 11.489 -9.421 6.789
333 HH21 ARG 48 1HH1 ARG 48 11.945 -8.921 10.181
334 HH22 ARG 48 2HH1 ARG 48 11.529 -10.052 8.938
335 H MET 49 H MET 49 8.397 -2.449 7.820
336 HA MET 49 HA MET 49 10.115 -0.967 9.731
337 HB2 MET 49 2HB MET 49 8.550 0.432 8.272
338 HB3 MET 49 1HB MET 49 7.221 -0.331 9.145
339 HG2 MET 49 2HG MET 49 8.095 0.493 11.271
340 HG3 MET 49 1HG MET 49 9.499 1.182 10.454
341 HE1 MET 49 3HE MET 49 7.864 2.627 12.384
342 HE2 MET 49 1HE MET 49 6.209 2.130 12.006
343 HE3 MET 49 2HE MET 49 6.692 3.813 11.815
344 H SER 50 H SER 50 6.801 -2.302 9.536
345 HA SER 50 HA SER 50 7.061 -3.234 12.319
346 HB2 SER 50 2HB SER 50 4.565 -3.133 10.621
347 HB3 SER 50 1HB SER 50 4.669 -3.332 12.369
348 HG SER 50 HG SER 50 4.202 -1.154 11.600
349 HA PRO 51 HA PRO 51 7.359 -7.543 11.387
350 HB2 PRO 51 2HB PRO 51 4.876 -8.091 12.942
351 HB3 PRO 51 1HB PRO 51 6.509 -8.750 13.145
352 HG2 PRO 51 2HG PRO 51 5.501 -6.934 14.817
353 HG3 PRO 51 1HG PRO 51 7.220 -6.974 14.393
354 HD2 PRO 51 2HD PRO 51 5.100 -5.077 13.486
355 HD3 PRO 51 1HD PRO 51 6.835 -4.795 13.744
356 H MET 52 H MET 52 6.869 -8.544 9.522
357 HA MET 52 HA MET 52 4.189 -8.166 8.345
358 HB2 MET 52 2HB MET 52 6.407 -7.563 7.126
359 HB3 MET 52 1HB MET 52 6.558 -9.304 6.886
360 HG2 MET 52 2HG MET 52 4.526 -9.418 5.651
361 HG3 MET 52 1HG MET 52 4.029 -7.810 6.175
362 HE1 MET 52 3HE MET 52 3.653 -8.650 3.602
363 HE2 MET 52 1HE MET 52 4.647 -7.974 2.304
364 HE3 MET 52 2HE MET 52 3.709 -6.907 3.345
365 H GLY 53 H GLY 53 6.614 -10.650 9.102
366 HA2 GLY 53 2HA GLY 53 6.027 -12.811 9.933
367 HA3 GLY 53 1HA GLY 53 4.473 -12.676 9.114
368 H THR 54 H THR 54 5.079 -12.034 6.571
369 HA THR 54 HA THR 54 6.401 -14.457 5.603
370 HB THR 54 HB THR 54 5.040 -12.342 3.936
371 HG1 THR 54 1HG THR 54 3.170 -13.602 4.210
372 HG21 THR 54 3HG2 THR 54 5.561 -15.306 3.578
373 HG22 THR 54 1HG2 THR 54 6.360 -13.991 2.714
374 HG23 THR 54 2HG2 THR 54 4.643 -14.302 2.456
375 H ALA 55 H ALA 55 8.215 -14.483 4.315
376 HA ALA 55 HA ALA 55 9.555 -11.903 3.766
377 HB1 ALA 55 1HB ALA 55 10.633 -14.304 5.215
378 HB2 ALA 55 2HB ALA 55 10.779 -12.597 5.632
379 HB3 ALA 55 3HB ALA 55 11.719 -13.262 4.296
380 H SER 56 H SER 56 9.667 -15.426 3.172
381 HA SER 56 HA SER 56 10.928 -15.025 0.581
382 HB2 SER 56 2HB SER 56 11.317 -16.977 2.275
383 HB3 SER 56 1HB SER 56 9.858 -17.653 1.559
384 HG SER 56 HG SER 56 11.130 -18.292 0.020
385 H GLY 57 H GLY 57 7.780 -15.977 1.890
386 HA2 GLY 57 2HA GLY 57 5.731 -15.452 0.772
387 HA3 GLY 57 1HA GLY 57 6.585 -15.519 -0.767
388 H SER 58 H SER 58 6.720 -17.872 1.883
389 HA SER 58 HA SER 58 6.101 -20.026 0.031
390 HB2 SER 58 2HB SER 58 6.558 -20.236 3.009
391 HB3 SER 58 1HB SER 58 6.735 -21.502 1.797
392 HG SER 58 HG SER 58 8.456 -20.300 0.906
393 H ASN 59 H ASN 59 4.804 -19.002 3.210
394 HA ASN 59 HA ASN 59 2.310 -20.424 2.655
395 HB2 ASN 59 2HB ASN 59 3.561 -20.432 4.909
396 HB3 ASN 59 1HB ASN 59 2.914 -18.808 5.124
397 HD21 ASN 59 1HD2 ASN 59 2.258 -21.681 6.302
398 HD22 ASN 59 2HD2 ASN 59 0.562 -21.712 6.241
399 H SER 60 H SER 60 0.406 -19.471 2.167
400 HA SER 60 HA SER 60 -0.007 -16.625 2.590
401 HB2 SER 60 2HB SER 60 1.219 -16.921 0.355
402 HB3 SER 60 1HB SER 60 -0.262 -17.678 -0.226
403 HG SER 60 HG SER 60 -1.363 -15.755 0.396
404 HA PRO 61 HA PRO 61 -3.805 -19.221 3.213
405 HB2 PRO 61 2HB PRO 61 -4.552 -16.861 4.862
406 HB3 PRO 61 1HB PRO 61 -4.586 -18.586 5.275
407 HG2 PRO 61 2HG PRO 61 -2.748 -16.929 6.276
408 HG3 PRO 61 1HG PRO 61 -2.381 -18.620 5.890
409 HD2 PRO 61 2HD PRO 61 -1.642 -16.140 4.384
410 HD3 PRO 61 1HD PRO 61 -0.726 -17.648 4.597
411 H THR 62 H THR 62 -5.920 -18.960 2.392
412 HA THR 62 HA THR 62 -6.215 -16.782 0.465
413 HB THR 62 HB THR 62 -8.226 -18.119 -0.258
414 HG1 THR 62 1HG THR 62 -8.852 -19.470 1.216
415 HG21 THR 62 3HG2 THR 62 -5.563 -19.562 -0.130
416 HG22 THR 62 1HG2 THR 62 -6.041 -18.382 -1.350
417 HG23 THR 62 2HG2 THR 62 -6.870 -19.935 -1.252
Start of MODEL 10
1 H1 GLY 1 1HT GLY 1 -32.213 0.423 29.949
2 H2 GLY 1 2HT GLY 1 -33.873 0.215 29.648
3 H3 GLY 1 3HT GLY 1 -32.889 0.995 28.502
4 HA2 GLY 1 2HA GLY 1 -32.508 -1.829 29.325
5 HA3 GLY 1 1HA GLY 1 -33.473 -1.344 27.929
6 H SER 2 H SER 2 -30.360 -2.081 29.045
7 HA SER 2 HA SER 2 -28.900 -0.585 27.035
8 HB2 SER 2 2HB SER 2 -27.978 -2.781 28.901
9 HB3 SER 2 1HB SER 2 -26.936 -1.750 27.926
10 HG SER 2 HG SER 2 -27.204 -0.195 29.320
11 H MET 3 H MET 3 -28.736 -1.207 24.983
12 HA MET 3 HA MET 3 -28.365 -4.021 24.321
13 HB2 MET 3 2HB MET 3 -30.174 -3.962 22.595
14 HB3 MET 3 1HB MET 3 -30.781 -3.875 24.247
15 HG2 MET 3 2HG MET 3 -30.763 -1.328 23.964
16 HG3 MET 3 1HG MET 3 -30.521 -1.625 22.242
17 HE1 MET 3 3HE MET 3 -31.689 -3.559 21.173
18 HE2 MET 3 1HE MET 3 -32.703 -2.241 20.565
19 HE3 MET 3 2HE MET 3 -33.445 -3.722 21.163
20 H ALA 4 H ALA 4 -26.699 -1.641 24.197
21 HA ALA 4 HA ALA 4 -26.448 -1.173 21.294
22 HB1 ALA 4 1HB ALA 4 -25.149 0.764 21.853
23 HB2 ALA 4 2HB ALA 4 -25.020 0.263 23.539
24 HB3 ALA 4 3HB ALA 4 -26.575 0.779 22.890
25 H GLN 5 H GLN 5 -25.621 -3.693 22.578
26 HA GLN 5 HA GLN 5 -22.683 -3.565 22.371
27 HB2 GLN 5 2HB GLN 5 -23.832 -4.654 24.369
28 HB3 GLN 5 1HB GLN 5 -24.344 -5.926 23.257
29 HG2 GLN 5 2HG GLN 5 -22.047 -6.456 22.707
30 HG3 GLN 5 1HG GLN 5 -21.460 -5.076 23.634
31 HE21 GLN 5 1HE2 GLN 5 -22.172 -8.416 23.822
32 HE22 GLN 5 2HE2 GLN 5 -22.125 -8.566 25.520
33 H GLU 6 H GLU 6 -25.487 -5.413 21.167
34 HA GLU 6 HA GLU 6 -23.812 -6.396 18.928
35 HB2 GLU 6 2HB GLU 6 -25.085 -7.989 20.579
36 HB3 GLU 6 1HB GLU 6 -26.498 -7.542 19.624
37 HG2 GLU 6 2HG GLU 6 -25.075 -8.131 17.561
38 HG3 GLU 6 1HG GLU 6 -23.978 -8.918 18.694
39 H THR 7 H THR 7 -24.223 -5.665 16.938
40 HA THR 7 HA THR 7 -26.773 -4.231 16.451
41 HB THR 7 HB THR 7 -24.888 -2.707 16.316
42 HG1 THR 7 1HG THR 7 -25.274 -1.984 14.268
43 HG21 THR 7 3HG2 THR 7 -23.235 -3.260 14.320
44 HG22 THR 7 1HG2 THR 7 -23.697 -4.924 14.684
45 HG23 THR 7 2HG2 THR 7 -22.947 -3.926 15.929
46 H ASN 8 H ASN 8 -27.634 -4.370 14.259
47 HA ASN 8 HA ASN 8 -27.177 -7.042 13.097
48 HB2 ASN 8 2HB ASN 8 -29.482 -5.096 12.833
49 HB3 ASN 8 1HB ASN 8 -29.379 -6.638 11.982
50 HD21 ASN 8 1HD2 ASN 8 -28.703 -8.526 13.714
51 HD22 ASN 8 2HD2 ASN 8 -29.662 -8.523 15.124
52 H GLN 9 H GLN 9 -25.330 -4.843 12.603
53 HA GLN 9 HA GLN 9 -25.876 -3.970 9.871
54 HB2 GLN 9 2HB GLN 9 -24.799 -2.522 11.699
55 HB3 GLN 9 1HB GLN 9 -23.344 -3.483 11.430
56 HG2 GLN 9 2HG GLN 9 -23.605 -2.927 8.949
57 HG3 GLN 9 1HG GLN 9 -24.805 -1.734 9.442
58 HE21 GLN 9 1HE2 GLN 9 -23.688 -0.632 11.735
59 HE22 GLN 9 2HE2 GLN 9 -22.189 0.092 11.366
60 H THR 10 H THR 10 -25.470 -5.371 8.275
61 HA THR 10 HA THR 10 -23.423 -7.423 8.576
62 HB THR 10 HB THR 10 -24.249 -8.063 6.243
63 HG1 THR 10 1HG THR 10 -25.350 -6.477 5.406
64 HG21 THR 10 3HG2 THR 10 -26.144 -7.974 8.602
65 HG22 THR 10 1HG2 THR 10 -25.030 -9.276 8.179
66 HG23 THR 10 2HG2 THR 10 -26.425 -8.940 7.153
67 HA PRO 11 HA PRO 11 -20.396 -5.034 6.348
68 HB2 PRO 11 2HB PRO 11 -18.681 -6.984 5.539
69 HB3 PRO 11 1HB PRO 11 -18.823 -6.482 7.234
70 HG2 PRO 11 2HG PRO 11 -19.946 -8.870 5.867
71 HG3 PRO 11 1HG PRO 11 -19.268 -8.712 7.496
72 HD2 PRO 11 2HD PRO 11 -21.979 -8.758 6.944
73 HD3 PRO 11 1HD PRO 11 -21.269 -8.029 8.400
74 H GLY 12 H GLY 12 -20.030 -4.296 4.259
75 HA2 GLY 12 2HA GLY 12 -20.128 -5.777 1.889
76 HA3 GLY 12 1HA GLY 12 -21.748 -5.137 2.164
77 HA PRO 13 HA PRO 13 -20.314 -1.224 0.636
78 HB2 PRO 13 2HB PRO 13 -21.581 0.658 2.091
79 HB3 PRO 13 1HB PRO 13 -22.471 -0.488 1.063
80 HG2 PRO 13 2HG PRO 13 -22.129 -0.459 4.011
81 HG3 PRO 13 1HG PRO 13 -23.521 -0.964 3.033
82 HD2 PRO 13 2HD PRO 13 -21.612 -2.686 4.184
83 HD3 PRO 13 1HD PRO 13 -22.779 -3.123 2.916
84 H MET 14 H MET 14 -18.092 -1.889 1.595
85 HA MET 14 HA MET 14 -17.124 -0.571 3.935
86 HB2 MET 14 2HB MET 14 -15.757 -1.910 1.600
87 HB3 MET 14 1HB MET 14 -14.856 -1.161 2.918
88 HG2 MET 14 2HG MET 14 -16.367 -2.591 4.475
89 HG3 MET 14 1HG MET 14 -16.719 -3.527 3.021
90 HE1 MET 14 3HE MET 14 -14.188 -5.480 5.324
91 HE2 MET 14 1HE MET 14 -15.848 -4.872 5.254
92 HE3 MET 14 2HE MET 14 -14.593 -3.933 6.060
93 H LEU 15 H LEU 15 -17.439 1.633 3.882
94 HA LEU 15 HA LEU 15 -16.748 3.251 1.610
95 HB2 LEU 15 2HB LEU 15 -17.994 3.623 4.219
96 HB3 LEU 15 1HB LEU 15 -16.831 4.902 3.911
97 HG LEU 15 HG LEU 15 -19.098 5.499 3.122
98 HD11 LEU 15 1HD1 LEU 15 -16.860 5.185 1.154
99 HD12 LEU 15 2HD1 LEU 15 -17.445 6.644 1.937
100 HD13 LEU 15 3HD1 LEU 15 -18.387 5.897 0.647
101 HD21 LEU 15 3HD2 LEU 15 -20.305 4.271 1.547
102 HD22 LEU 15 1HD2 LEU 15 -19.530 2.977 2.463
103 HD23 LEU 15 2HD2 LEU 15 -18.864 3.480 0.909
104 H CYS 16 H CYS 16 -14.879 4.444 1.245
105 HA CYS 16 HA CYS 16 -12.407 3.566 1.844
106 HB2 CYS 16 2HB CYS 16 -13.051 5.458 0.282
107 HB3 CYS 16 1HB CYS 16 -12.971 6.528 1.687
108 H SER 17 H SER 17 -10.897 3.629 3.387
109 HA SER 17 HA SER 17 -11.580 4.055 6.085
110 HB2 SER 17 2HB SER 17 -8.900 3.782 4.717
111 HB3 SER 17 1HB SER 17 -9.090 3.851 6.469
112 HG SER 17 HG SER 17 -9.385 1.773 6.236
113 H THR 18 H THR 18 -10.295 6.274 3.698
114 HA THR 18 HA THR 18 -9.470 8.206 5.714
115 HB THR 18 HB THR 18 -8.666 9.532 3.834
116 HG1 THR 18 1HG THR 18 -9.944 9.270 2.165
117 HG21 THR 18 3HG2 THR 18 -7.192 7.689 2.758
118 HG22 THR 18 1HG2 THR 18 -8.014 6.587 3.858
119 HG23 THR 18 2HG2 THR 18 -7.067 7.929 4.500
120 H GLY 19 H GLY 19 -12.425 7.457 4.252
121 HA2 GLY 19 2HA GLY 19 -14.445 8.547 4.275
122 HA3 GLY 19 1HA GLY 19 -13.693 9.780 5.283
123 H CYS 20 H CYS 20 -12.796 8.777 1.986
124 HA CYS 20 HA CYS 20 -12.919 11.559 1.148
125 HB2 CYS 20 2HB CYS 20 -11.676 10.913 -0.785
126 HB3 CYS 20 1HB CYS 20 -10.976 10.047 0.578
127 H GLY 21 H GLY 21 -15.074 8.901 1.080
128 HA2 GLY 21 2HA GLY 21 -17.349 9.229 0.425
129 HA3 GLY 21 1HA GLY 21 -16.807 10.363 -0.801
130 H PHE 22 H PHE 22 -14.679 7.933 -1.221
131 HA PHE 22 HA PHE 22 -16.202 6.777 -3.409
132 HB2 PHE 22 2HB PHE 22 -13.284 6.742 -2.632
133 HB3 PHE 22 1HB PHE 22 -13.924 5.733 -3.929
134 HD1 PHE 22 1HD PHE 22 -14.212 9.319 -2.775
135 HD2 PHE 22 2HD PHE 22 -13.779 6.593 -6.070
136 HE1 PHE 22 1HE PHE 22 -14.133 11.233 -4.349
137 HE2 PHE 22 2HE PHE 22 -13.695 8.508 -7.641
138 HZ PHE 22 HZ PHE 22 -13.875 10.828 -6.783
139 H TYR 23 H TYR 23 -15.473 4.346 -3.818
140 HA TYR 23 HA TYR 23 -16.468 2.854 -1.502
141 HB2 TYR 23 2HB TYR 23 -17.168 2.642 -4.041
142 HB3 TYR 23 1HB TYR 23 -15.754 1.587 -4.124
143 HD1 TYR 23 2HD TYR 23 -18.529 2.169 -1.641
144 HD2 TYR 23 1HD TYR 23 -16.296 -0.667 -3.973
145 HE1 TYR 23 2HE TYR 23 -19.896 0.325 -0.707
146 HE2 TYR 23 1HE TYR 23 -17.669 -2.511 -3.046
147 HH TYR 23 HH TYR 23 -20.529 -2.149 -1.642
148 H GLY 24 H GLY 24 -15.284 1.465 -0.302
149 HA2 GLY 24 2HA GLY 24 -12.384 1.314 -0.851
150 HA3 GLY 24 1HA GLY 24 -13.153 1.031 0.711
151 H ASN 25 H ASN 25 -11.328 -0.604 -1.135
152 HA ASN 25 HA ASN 25 -13.008 -2.989 -1.542
153 HB2 ASN 25 2HB ASN 25 -11.214 -1.954 -3.232
154 HB3 ASN 25 1HB ASN 25 -10.113 -2.964 -2.297
155 HD21 ASN 25 1HD2 ASN 25 -13.334 -3.225 -3.926
156 HD22 ASN 25 2HD2 ASN 25 -13.085 -4.825 -4.463
157 HA PRO 26 HA PRO 26 -11.209 -4.654 2.205
158 HB2 PRO 26 2HB PRO 26 -12.094 -7.217 2.062
159 HB3 PRO 26 1HB PRO 26 -13.132 -5.842 2.474
160 HG2 PRO 26 2HG PRO 26 -12.872 -7.310 -0.091
161 HG3 PRO 26 1HG PRO 26 -14.318 -6.642 0.686
162 HD2 PRO 26 2HD PRO 26 -12.968 -5.418 -1.399
163 HD3 PRO 26 1HD PRO 26 -14.006 -4.563 -0.237
164 H ARG 27 H ARG 27 -10.518 -5.968 -0.967
165 HA ARG 27 HA ARG 27 -8.448 -7.780 -0.106
166 HB2 ARG 27 2HB ARG 27 -9.437 -6.735 -2.738
167 HB3 ARG 27 1HB ARG 27 -7.849 -7.495 -2.663
168 HG2 ARG 27 2HG ARG 27 -9.120 -9.377 -3.053
169 HG3 ARG 27 1HG ARG 27 -9.208 -9.349 -1.294
170 HD2 ARG 27 2HD ARG 27 -11.344 -8.058 -1.467
171 HD3 ARG 27 1HD ARG 27 -11.269 -8.233 -3.216
172 HE ARG 27 HE ARG 27 -11.075 -10.808 -2.289
173 HH11 ARG 27 1HH2 ARG 27 -13.401 -8.208 -1.826
174 HH12 ARG 27 2HH2 ARG 27 -14.716 -9.295 -1.545
175 HH21 ARG 27 1HH1 ARG 27 -12.818 -12.172 -1.913
176 HH22 ARG 27 2HH1 ARG 27 -14.392 -11.520 -1.600
177 H THR 28 H THR 28 -8.687 -4.421 -1.062
178 HA THR 28 HA THR 28 -5.807 -4.044 -1.239
179 HB THR 28 HB THR 28 -6.353 -1.690 -1.625
180 HG1 THR 28 1HG THR 28 -8.235 -0.878 -1.084
181 HG21 THR 28 3HG2 THR 28 -7.951 -1.945 -3.552
182 HG22 THR 28 1HG2 THR 28 -8.220 -3.611 -3.040
183 HG23 THR 28 2HG2 THR 28 -6.617 -3.099 -3.572
184 H ASN 29 H ASN 29 -5.863 -1.472 0.300
185 HA ASN 29 HA ASN 29 -5.591 -2.648 2.972
186 HB2 ASN 29 2HB ASN 29 -4.531 -0.207 1.617
187 HB3 ASN 29 1HB ASN 29 -4.726 -0.152 3.370
188 HD21 ASN 29 1HD2 ASN 29 -3.694 -2.860 1.195
189 HD22 ASN 29 2HD2 ASN 29 -2.225 -3.133 2.014
190 H GLY 30 H GLY 30 -8.294 -2.076 1.751
191 HA2 GLY 30 2HA GLY 30 -10.322 -1.461 2.680
192 HA3 GLY 30 1HA GLY 30 -9.451 -0.743 4.038
193 H MET 31 H MET 31 -8.335 0.220 0.898
194 HA MET 31 HA MET 31 -9.760 2.802 1.154
195 HB2 MET 31 2HB MET 31 -6.919 2.155 0.389
196 HB3 MET 31 1HB MET 31 -7.678 3.683 -0.065
197 HG2 MET 31 2HG MET 31 -8.022 4.304 2.208
198 HG3 MET 31 1HG MET 31 -7.658 2.677 2.783
199 HE1 MET 31 3HE MET 31 -4.605 4.036 4.319
200 HE2 MET 31 1HE MET 31 -5.401 2.472 4.110
201 HE3 MET 31 2HE MET 31 -6.355 3.907 4.472
202 H CYS 32 H CYS 32 -10.053 3.980 -0.819
203 HA CYS 32 HA CYS 32 -11.033 2.332 -2.941
204 HB2 CYS 32 2HB CYS 32 -11.832 4.395 -3.930
205 HB3 CYS 32 1HB CYS 32 -12.145 4.446 -2.198
206 H SER 33 H SER 33 -10.350 3.914 -5.235
207 HA SER 33 HA SER 33 -7.823 2.711 -5.869
208 HB2 SER 33 2HB SER 33 -9.988 3.371 -7.348
209 HB3 SER 33 1HB SER 33 -8.939 4.732 -7.728
210 HG SER 33 HG SER 33 -8.421 3.116 -9.143
211 H VAL 34 H VAL 34 -8.880 6.089 -5.412
212 HA VAL 34 HA VAL 34 -6.383 7.255 -6.130
213 HB VAL 34 HB VAL 34 -8.412 8.531 -4.289
214 HG11 VAL 34 1HG1 VAL 34 -6.176 9.620 -4.788
215 HG12 VAL 34 2HG1 VAL 34 -7.589 10.584 -5.215
216 HG13 VAL 34 3HG1 VAL 34 -6.694 9.729 -6.469
217 HG21 VAL 34 3HG2 VAL 34 -9.775 7.764 -6.099
218 HG22 VAL 34 1HG2 VAL 34 -8.530 8.142 -7.290
219 HG23 VAL 34 2HG2 VAL 34 -9.397 9.444 -6.474
220 H CYS 35 H CYS 35 -7.840 6.532 -2.987
221 HA CYS 35 HA CYS 35 -5.691 7.581 -1.437
222 HB2 CYS 35 2HB CYS 35 -7.930 5.699 -0.660
223 HB3 CYS 35 1HB CYS 35 -6.838 6.506 0.471
224 H TYR 36 H TYR 36 -6.502 4.316 -2.568
225 HA TYR 36 HA TYR 36 -4.685 2.930 -0.918
226 HB2 TYR 36 2HB TYR 36 -6.522 1.824 -2.120
227 HB3 TYR 36 1HB TYR 36 -5.702 2.124 -3.655
228 HD1 TYR 36 1HD TYR 36 -4.567 0.883 -0.274
229 HD2 TYR 36 2HD TYR 36 -4.785 0.169 -4.505
230 HE1 TYR 36 1HE TYR 36 -3.259 -1.196 0.010
231 HE2 TYR 36 2HE TYR 36 -3.473 -1.915 -4.219
232 HH TYR 36 HH TYR 36 -3.093 -3.478 -1.437
233 H LYS 37 H LYS 37 -4.185 4.474 -4.095
234 HA LYS 37 HA LYS 37 -1.526 3.402 -4.359
235 HB2 LYS 37 2HB LYS 37 -1.302 4.917 -6.277
236 HB3 LYS 37 1HB LYS 37 -2.817 4.024 -6.367
237 HG2 LYS 37 2HG LYS 37 -3.971 6.011 -5.351
238 HG3 LYS 37 1HG LYS 37 -2.455 6.898 -5.462
239 HD2 LYS 37 2HD LYS 37 -3.074 5.642 -8.016
240 HD3 LYS 37 1HD LYS 37 -4.438 6.609 -7.470
241 HE2 LYS 37 2HE LYS 37 -1.778 7.896 -7.180
242 HE3 LYS 37 1HE LYS 37 -2.326 7.637 -8.833
243 HZ1 LYS 37 3HZ LYS 37 -3.829 9.032 -6.687
244 HZ2 LYS 37 1HZ LYS 37 -4.426 8.722 -8.245
245 HZ3 LYS 37 2HZ LYS 37 -3.094 9.756 -8.036
246 H GLU 38 H GLU 38 -2.974 6.472 -3.359
247 HA GLU 38 HA GLU 38 -0.594 7.917 -2.905
248 HB2 GLU 38 2HB GLU 38 -3.350 8.148 -1.680
249 HB3 GLU 38 1HB GLU 38 -2.055 9.309 -1.385
250 HG2 GLU 38 2HG GLU 38 -2.956 8.554 -4.173
251 HG3 GLU 38 1HG GLU 38 -3.672 9.899 -3.278
252 H HIS 39 H HIS 39 -2.628 5.994 -0.665
253 HA HIS 39 HA HIS 39 -1.170 6.396 1.687
254 HB2 HIS 39 2HB HIS 39 -3.442 5.255 1.348
255 HB3 HIS 39 1HB HIS 39 -2.529 3.807 0.919
256 HD1 HIS 39 1HD HIS 39 -2.675 6.311 3.805
257 HD2 HIS 39 2HD HIS 39 -1.890 2.273 3.109
258 HE1 HIS 39 1HE HIS 39 -2.335 5.245 6.077
259 HE2 HIS 39 2HE HIS 39 -1.846 2.788 5.671
260 H LEU 40 H LEU 40 -0.856 3.848 -0.774
261 HA LEU 40 HA LEU 40 1.173 2.369 0.479
262 HB2 LEU 40 2HB LEU 40 -0.210 2.349 -2.047
263 HB3 LEU 40 1HB LEU 40 1.513 2.115 -2.344
264 HG LEU 40 HG LEU 40 1.472 0.332 -0.533
265 HD11 LEU 40 1HD1 LEU 40 -1.482 0.926 -0.769
266 HD12 LEU 40 2HD1 LEU 40 -0.500 0.839 0.695
267 HD13 LEU 40 3HD1 LEU 40 -0.892 -0.633 -0.195
268 HD21 LEU 40 3HD2 LEU 40 -0.420 -0.216 -2.837
269 HD22 LEU 40 1HD2 LEU 40 0.649 -1.363 -2.027
270 HD23 LEU 40 2HD2 LEU 40 1.328 -0.088 -3.037
271 H GLN 41 H GLN 41 1.401 5.375 -1.368
272 HA GLN 41 HA GLN 41 4.059 5.293 -2.203
273 HB2 GLN 41 2HB GLN 41 2.139 7.120 -2.449
274 HB3 GLN 41 1HB GLN 41 2.976 7.852 -1.081
275 HG2 GLN 41 2HG GLN 41 5.102 7.768 -2.357
276 HG3 GLN 41 1HG GLN 41 4.233 7.085 -3.736
277 HE21 GLN 41 1HE2 GLN 41 2.825 8.517 -4.963
278 HE22 GLN 41 2HE2 GLN 41 2.857 10.207 -4.738
279 H ARG 42 H ARG 42 2.729 6.028 0.978
280 HA ARG 42 HA ARG 42 5.310 6.748 2.077
281 HB2 ARG 42 2HB ARG 42 2.530 6.511 3.203
282 HB3 ARG 42 1HB ARG 42 3.928 6.735 4.257
283 HG2 ARG 42 2HG ARG 42 4.551 8.697 2.687
284 HG3 ARG 42 1HG ARG 42 2.892 8.580 2.105
285 HD2 ARG 42 2HD ARG 42 3.264 8.649 5.062
286 HD3 ARG 42 1HD ARG 42 3.596 10.135 4.189
287 HE ARG 42 HE ARG 42 1.338 10.271 3.569
288 HH11 ARG 42 1HH2 ARG 42 1.929 7.263 5.314
289 HH12 ARG 42 2HH2 ARG 42 0.248 6.967 5.563
290 HH21 ARG 42 1HH1 ARG 42 -0.822 9.815 3.929
291 HH22 ARG 42 2HH1 ARG 42 -1.290 8.388 4.792
292 H GLN 43 H GLN 43 3.282 3.898 1.897
293 HA GLN 43 HA GLN 43 4.475 2.395 3.998
294 HB2 GLN 43 2HB GLN 43 2.279 1.968 2.660
295 HB3 GLN 43 1HB GLN 43 3.335 1.132 1.523
296 HG2 GLN 43 2HG GLN 43 2.693 -0.585 2.986
297 HG3 GLN 43 1HG GLN 43 4.255 -0.085 3.632
298 HE21 GLN 43 1HE2 GLN 43 0.749 0.086 4.178
299 HE22 GLN 43 2HE2 GLN 43 0.857 0.613 5.788
300 H GLN 44 H GLN 44 5.190 2.690 0.536
301 HA GLN 44 HA GLN 44 7.168 0.658 0.457
302 HB2 GLN 44 2HB GLN 44 7.843 1.632 -1.705
303 HB3 GLN 44 1HB GLN 44 6.099 1.421 -1.590
304 HG2 GLN 44 2HG GLN 44 5.839 3.802 -1.023
305 HG3 GLN 44 1HG GLN 44 7.584 4.023 -1.105
306 HE21 GLN 44 1HE2 GLN 44 4.682 3.389 -3.059
307 HE22 GLN 44 2HE2 GLN 44 5.410 3.753 -4.560
308 H ASN 45 H ASN 45 7.406 4.151 1.069
309 HA ASN 45 HA ASN 45 10.283 4.148 1.112
310 HB2 ASN 45 2HB ASN 45 8.750 6.158 0.668
311 HB3 ASN 45 1HB ASN 45 8.528 6.218 2.415
312 HD21 ASN 45 1HD2 ASN 45 10.151 7.936 0.315
313 HD22 ASN 45 2HD2 ASN 45 11.659 8.120 1.092
314 H SER 46 H SER 46 7.734 4.177 3.605
315 HA SER 46 HA SER 46 9.553 4.188 5.814
316 HB2 SER 46 2HB SER 46 7.258 4.982 6.085
317 HB3 SER 46 1HB SER 46 6.634 3.386 5.674
318 HG SER 46 HG SER 46 7.249 2.643 7.581
319 H GLY 47 H GLY 47 7.443 1.612 4.490
320 HA2 GLY 47 2HA GLY 47 8.217 -0.619 4.075
321 HA3 GLY 47 1HA GLY 47 9.461 -0.384 5.299
322 H ARG 48 H ARG 48 8.158 0.500 7.473
323 HA ARG 48 HA ARG 48 5.913 -1.337 7.991
324 HB2 ARG 48 2HB ARG 48 8.447 -1.147 9.643
325 HB3 ARG 48 1HB ARG 48 6.979 -1.983 10.157
326 HG2 ARG 48 2HG ARG 48 7.114 -3.411 8.123
327 HG3 ARG 48 1HG ARG 48 8.629 -2.620 7.694
328 HD2 ARG 48 2HD ARG 48 9.667 -3.412 9.761
329 HD3 ARG 48 1HD ARG 48 8.143 -4.127 10.280
330 HE ARG 48 HE ARG 48 8.929 -5.145 7.728
331 HH11 ARG 48 1HH2 ARG 48 9.679 -5.441 11.154
332 HH12 ARG 48 2HH2 ARG 48 10.226 -7.073 10.991
333 HH21 ARG 48 1HH1 ARG 48 9.659 -7.258 7.589
334 HH22 ARG 48 2HH1 ARG 48 10.218 -8.089 9.003
335 H MET 49 H MET 49 4.460 0.356 8.161
336 HA MET 49 HA MET 49 5.037 2.657 9.828
337 HB2 MET 49 2HB MET 49 3.632 2.653 7.680
338 HB3 MET 49 1HB MET 49 2.351 1.943 8.663
339 HG2 MET 49 2HG MET 49 2.672 3.880 10.279
340 HG3 MET 49 1HG MET 49 3.699 4.623 9.055
341 HE1 MET 49 3HE MET 49 1.383 6.571 9.672
342 HE2 MET 49 1HE MET 49 1.131 6.908 7.952
343 HE3 MET 49 2HE MET 49 2.745 6.541 8.554
344 H SER 50 H SER 50 2.345 0.292 9.862
345 HA SER 50 HA SER 50 1.918 0.829 12.699
346 HB2 SER 50 2HB SER 50 0.414 -0.920 10.742
347 HB3 SER 50 1HB SER 50 -0.069 -0.620 12.409
348 HG SER 50 HG SER 50 0.154 1.222 10.265
349 HA PRO 51 HA PRO 51 4.023 -2.820 14.084
350 HB2 PRO 51 2HB PRO 51 2.658 -3.467 16.349
351 HB3 PRO 51 1HB PRO 51 3.710 -2.042 16.239
352 HG2 PRO 51 2HG PRO 51 0.744 -2.222 16.067
353 HG3 PRO 51 1HG PRO 51 1.759 -1.008 16.864
354 HD2 PRO 51 2HD PRO 51 0.583 -0.621 14.408
355 HD3 PRO 51 1HD PRO 51 2.074 0.197 14.923
356 H MET 52 H MET 52 3.482 -5.160 14.981
357 HA MET 52 HA MET 52 1.077 -6.265 13.698
358 HB2 MET 52 2HB MET 52 2.444 -8.090 12.686
359 HB3 MET 52 1HB MET 52 2.772 -6.509 11.985
360 HG2 MET 52 2HG MET 52 4.447 -7.418 14.305
361 HG3 MET 52 1HG MET 52 4.760 -8.123 12.722
362 HE1 MET 52 3HE MET 52 5.134 -6.248 10.415
363 HE2 MET 52 1HE MET 52 6.117 -7.450 11.263
364 HE3 MET 52 2HE MET 52 6.783 -5.860 10.901
365 H GLY 53 H GLY 53 0.940 -8.709 14.221
366 HA2 GLY 53 2HA GLY 53 2.039 -10.233 16.060
367 HA3 GLY 53 1HA GLY 53 1.374 -8.987 17.111
368 H THR 54 H THR 54 -1.050 -8.427 16.026
369 HA THR 54 HA THR 54 -2.488 -10.952 15.631
370 HB THR 54 HB THR 54 -4.130 -10.323 17.404
371 HG1 THR 54 1HG THR 54 -2.107 -8.449 18.067
372 HG21 THR 54 3HG2 THR 54 -2.771 -11.106 19.257
373 HG22 THR 54 1HG2 THR 54 -1.294 -10.622 18.424
374 HG23 THR 54 2HG2 THR 54 -2.267 -11.950 17.794
375 H ALA 55 H ALA 55 -3.647 -10.611 13.841
376 HA ALA 55 HA ALA 55 -4.888 -7.950 13.429
377 HB1 ALA 55 1HB ALA 55 -3.190 -8.550 11.729
378 HB2 ALA 55 2HB ALA 55 -4.804 -8.415 11.034
379 HB3 ALA 55 3HB ALA 55 -4.110 -10.006 11.344
380 H SER 56 H SER 56 -6.725 -8.561 14.693
381 HA SER 56 HA SER 56 -8.725 -9.998 13.138
382 HB2 SER 56 2HB SER 56 -9.364 -11.442 15.045
383 HB3 SER 56 1HB SER 56 -7.744 -11.804 14.456
384 HG SER 56 HG SER 56 -8.421 -11.209 16.894
385 H GLY 57 H GLY 57 -8.023 -8.493 16.300
386 HA2 GLY 57 2HA GLY 57 -9.041 -6.552 17.165
387 HA3 GLY 57 1HA GLY 57 -10.300 -6.691 15.940
388 H SER 58 H SER 58 -9.036 -8.702 18.623
389 HA SER 58 HA SER 58 -11.696 -9.710 19.204
390 HB2 SER 58 2HB SER 58 -9.030 -10.159 20.563
391 HB3 SER 58 1HB SER 58 -10.527 -10.974 21.002
392 HG SER 58 HG SER 58 -9.860 -12.334 19.523
393 H ASN 59 H ASN 59 -9.198 -8.072 21.182
394 HA ASN 59 HA ASN 59 -11.160 -7.272 23.149
395 HB2 ASN 59 2HB ASN 59 -8.206 -6.717 22.838
396 HB3 ASN 59 1HB ASN 59 -9.175 -6.088 24.171
397 HD21 ASN 59 1HD2 ASN 59 -10.273 -7.760 25.577
398 HD22 ASN 59 2HD2 ASN 59 -9.555 -9.290 25.735
399 H SER 60 H SER 60 -12.493 -5.617 22.791
400 HA SER 60 HA SER 60 -11.887 -3.538 20.879
401 HB2 SER 60 2HB SER 60 -14.206 -4.593 21.533
402 HB3 SER 60 1HB SER 60 -14.176 -3.384 22.811
403 HG SER 60 HG SER 60 -15.120 -2.445 21.044
404 HA PRO 61 HA PRO 61 -10.143 -0.735 23.867
405 HB2 PRO 61 2HB PRO 61 -10.324 1.622 22.544
406 HB3 PRO 61 1HB PRO 61 -9.219 0.331 22.032
407 HG2 PRO 61 2HG PRO 61 -11.843 1.134 20.900
408 HG3 PRO 61 1HG PRO 61 -10.381 0.566 20.077
409 HD2 PRO 61 2HD PRO 61 -12.607 -1.016 20.631
410 HD3 PRO 61 1HD PRO 61 -10.979 -1.636 20.286
411 H THR 62 H THR 62 -10.676 0.932 25.381
412 HA THR 62 HA THR 62 -13.556 1.220 25.829
413 HB THR 62 HB THR 62 -12.737 2.220 28.032
414 HG1 THR 62 1HG THR 62 -10.685 2.709 27.822
415 HG21 THR 62 3HG2 THR 62 -11.876 -0.120 28.786
416 HG22 THR 62 1HG2 THR 62 -12.221 -0.603 27.125
417 HG23 THR 62 2HG2 THR 62 -13.518 0.009 28.153
Start of MODEL 11
1 H1 GLY 1 1HT GLY 1 -31.416 3.642 0.015
2 H2 GLY 1 2HT GLY 1 -31.195 4.040 1.652
3 H3 GLY 1 3HT GLY 1 -32.621 4.492 0.850
4 HA2 GLY 1 2HA GLY 1 -31.796 1.674 1.257
5 HA3 GLY 1 1HA GLY 1 -32.876 2.541 2.349
6 H SER 2 H SER 2 -32.892 0.410 -0.112
7 HA SER 2 HA SER 2 -35.142 1.487 -1.622
8 HB2 SER 2 2HB SER 2 -33.913 -1.269 -1.802
9 HB3 SER 2 1HB SER 2 -34.923 -0.465 -3.001
10 HG SER 2 HG SER 2 -32.554 -0.403 -3.313
11 H MET 3 H MET 3 -34.520 -1.487 0.271
12 HA MET 3 HA MET 3 -37.416 -1.766 0.725
13 HB2 MET 3 2HB MET 3 -36.819 -4.037 1.567
14 HB3 MET 3 1HB MET 3 -36.327 -3.772 -0.105
15 HG2 MET 3 2HG MET 3 -34.038 -3.458 0.521
16 HG3 MET 3 1HG MET 3 -34.450 -3.338 2.231
17 HE1 MET 3 3HE MET 3 -32.859 -5.796 -0.259
18 HE2 MET 3 1HE MET 3 -34.411 -5.244 -0.902
19 HE3 MET 3 2HE MET 3 -34.175 -6.943 -0.498
20 H ALA 4 H ALA 4 -38.168 -2.330 2.898
21 HA ALA 4 HA ALA 4 -36.681 -0.823 4.951
22 HB1 ALA 4 1HB ALA 4 -39.558 -1.750 5.049
23 HB2 ALA 4 2HB ALA 4 -39.060 -0.196 4.381
24 HB3 ALA 4 3HB ALA 4 -38.777 -0.553 6.084
25 H GLN 5 H GLN 5 -35.833 -3.468 4.230
26 HA GLN 5 HA GLN 5 -36.592 -5.055 6.611
27 HB2 GLN 5 2HB GLN 5 -36.921 -6.017 4.267
28 HB3 GLN 5 1HB GLN 5 -35.161 -6.079 4.159
29 HG2 GLN 5 2HG GLN 5 -35.003 -7.583 6.006
30 HG3 GLN 5 1HG GLN 5 -36.683 -7.310 6.463
31 HE21 GLN 5 1HE2 GLN 5 -34.572 -9.064 4.257
32 HE22 GLN 5 2HE2 GLN 5 -35.800 -10.019 3.555
33 H GLU 6 H GLU 6 -33.862 -3.829 4.710
34 HA GLU 6 HA GLU 6 -31.859 -4.962 6.444
35 HB2 GLU 6 2HB GLU 6 -31.558 -4.380 3.979
36 HB3 GLU 6 1HB GLU 6 -31.473 -2.693 4.489
37 HG2 GLU 6 2HG GLU 6 -29.583 -3.217 5.970
38 HG3 GLU 6 1HG GLU 6 -29.677 -4.915 5.506
39 H THR 7 H THR 7 -30.818 -4.030 8.143
40 HA THR 7 HA THR 7 -32.014 -1.666 9.320
41 HB THR 7 HB THR 7 -30.246 -2.140 11.118
42 HG1 THR 7 1HG THR 7 -28.799 -3.490 10.441
43 HG21 THR 7 3HG2 THR 7 -32.307 -4.226 10.355
44 HG22 THR 7 1HG2 THR 7 -32.558 -2.825 11.397
45 HG23 THR 7 2HG2 THR 7 -31.511 -4.143 11.927
46 H ASN 8 H ASN 8 -30.335 -0.119 10.427
47 HA ASN 8 HA ASN 8 -28.909 1.193 8.294
48 HB2 ASN 8 2HB ASN 8 -30.153 2.318 10.226
49 HB3 ASN 8 1HB ASN 8 -28.771 1.881 11.228
50 HD21 ASN 8 1HD2 ASN 8 -26.635 2.828 10.614
51 HD22 ASN 8 2HD2 ASN 8 -26.586 4.268 9.701
52 H GLN 9 H GLN 9 -27.949 -0.249 11.419
53 HA GLN 9 HA GLN 9 -25.135 -0.103 10.730
54 HB2 GLN 9 2HB GLN 9 -26.669 -1.153 13.105
55 HB3 GLN 9 1HB GLN 9 -24.927 -1.376 12.942
56 HG2 GLN 9 2HG GLN 9 -26.258 1.332 12.728
57 HG3 GLN 9 1HG GLN 9 -25.643 0.688 14.249
58 HE21 GLN 9 1HE2 GLN 9 -23.231 -0.131 14.050
59 HE22 GLN 9 2HE2 GLN 9 -22.187 0.875 13.150
60 H THR 10 H THR 10 -24.474 -1.480 9.185
61 HA THR 10 HA THR 10 -24.660 -4.332 9.686
62 HB THR 10 HB THR 10 -25.639 -3.296 7.027
63 HG1 THR 10 1HG THR 10 -27.599 -3.196 7.805
64 HG21 THR 10 3HG2 THR 10 -25.635 -5.959 8.452
65 HG22 THR 10 1HG2 THR 10 -24.918 -5.556 6.891
66 HG23 THR 10 2HG2 THR 10 -26.672 -5.640 7.060
67 HA PRO 11 HA PRO 11 -20.630 -3.732 7.804
68 HB2 PRO 11 2HB PRO 11 -19.839 -6.336 7.551
69 HB3 PRO 11 1HB PRO 11 -19.854 -5.475 9.101
70 HG2 PRO 11 2HG PRO 11 -21.790 -7.446 8.014
71 HG3 PRO 11 1HG PRO 11 -21.212 -7.221 9.674
72 HD2 PRO 11 2HD PRO 11 -23.654 -6.316 8.763
73 HD3 PRO 11 1HD PRO 11 -22.784 -5.606 10.139
74 H GLY 12 H GLY 12 -20.288 -3.192 5.721
75 HA2 GLY 12 2HA GLY 12 -20.231 -4.852 3.523
76 HA3 GLY 12 1HA GLY 12 -21.884 -4.242 3.585
77 HA PRO 13 HA PRO 13 -20.605 -0.370 1.846
78 HB2 PRO 13 2HB PRO 13 -21.346 1.652 3.539
79 HB3 PRO 13 1HB PRO 13 -22.499 0.712 2.568
80 HG2 PRO 13 2HG PRO 13 -21.837 0.501 5.453
81 HG3 PRO 13 1HG PRO 13 -23.387 0.279 4.622
82 HD2 PRO 13 2HD PRO 13 -21.783 -1.796 5.493
83 HD3 PRO 13 1HD PRO 13 -22.981 -1.938 4.187
84 H MET 14 H MET 14 -18.341 -1.325 2.479
85 HA MET 14 HA MET 14 -16.834 0.001 4.518
86 HB2 MET 14 2HB MET 14 -16.280 -1.969 2.352
87 HB3 MET 14 1HB MET 14 -14.905 -1.044 2.952
88 HG2 MET 14 2HG MET 14 -15.746 -1.690 5.311
89 HG3 MET 14 1HG MET 14 -16.730 -2.898 4.486
90 HE1 MET 14 3HE MET 14 -13.856 -5.000 5.997
91 HE2 MET 14 1HE MET 14 -15.588 -4.980 5.639
92 HE3 MET 14 2HE MET 14 -14.874 -3.708 6.629
93 H LEU 15 H LEU 15 -17.233 2.235 4.062
94 HA LEU 15 HA LEU 15 -16.367 3.418 1.592
95 HB2 LEU 15 2HB LEU 15 -17.418 4.447 4.196
96 HB3 LEU 15 1HB LEU 15 -16.536 5.566 3.157
97 HG LEU 15 HG LEU 15 -18.814 3.848 2.143
98 HD11 LEU 15 1HD1 LEU 15 -19.024 6.775 2.807
99 HD12 LEU 15 2HD1 LEU 15 -19.355 5.547 4.030
100 HD13 LEU 15 3HD1 LEU 15 -20.319 5.605 2.554
101 HD21 LEU 15 3HD2 LEU 15 -18.822 5.654 0.372
102 HD22 LEU 15 1HD2 LEU 15 -17.353 4.680 0.390
103 HD23 LEU 15 2HD2 LEU 15 -17.350 6.294 1.101
104 H CYS 16 H CYS 16 -14.576 4.738 1.221
105 HA CYS 16 HA CYS 16 -12.103 3.841 1.942
106 HB2 CYS 16 2HB CYS 16 -12.697 5.536 0.148
107 HB3 CYS 16 1HB CYS 16 -12.600 6.766 1.410
108 H SER 17 H SER 17 -10.714 3.973 3.530
109 HA SER 17 HA SER 17 -11.402 4.851 6.117
110 HB2 SER 17 2HB SER 17 -8.561 4.494 5.191
111 HB3 SER 17 1HB SER 17 -9.250 4.170 6.784
112 HG SER 17 HG SER 17 -9.331 2.205 5.964
113 H THR 18 H THR 18 -9.778 6.524 3.487
114 HA THR 18 HA THR 18 -8.766 8.656 5.138
115 HB THR 18 HB THR 18 -8.142 9.710 3.010
116 HG1 THR 18 1HG THR 18 -9.608 9.260 1.550
117 HG21 THR 18 3HG2 THR 18 -7.218 7.203 3.979
118 HG22 THR 18 1HG2 THR 18 -6.353 8.341 2.946
119 HG23 THR 18 2HG2 THR 18 -7.316 7.054 2.225
120 H GLY 19 H GLY 19 -11.887 7.965 3.946
121 HA2 GLY 19 2HA GLY 19 -13.841 9.171 4.081
122 HA3 GLY 19 1HA GLY 19 -12.929 10.466 4.857
123 H CYS 20 H CYS 20 -12.139 9.111 1.694
124 HA CYS 20 HA CYS 20 -12.146 11.706 0.503
125 HB2 CYS 20 2HB CYS 20 -11.476 10.576 -1.553
126 HB3 CYS 20 1HB CYS 20 -10.556 9.950 -0.184
127 H GLY 21 H GLY 21 -14.626 9.328 0.921
128 HA2 GLY 21 2HA GLY 21 -16.914 9.909 0.580
129 HA3 GLY 21 1HA GLY 21 -16.424 10.971 -0.733
130 H PHE 22 H PHE 22 -14.771 8.044 -1.092
131 HA PHE 22 HA PHE 22 -16.821 7.030 -2.962
132 HB2 PHE 22 2HB PHE 22 -13.804 7.023 -3.145
133 HB3 PHE 22 1HB PHE 22 -14.834 6.019 -4.174
134 HD1 PHE 22 2HD PHE 22 -16.563 7.113 -5.645
135 HD2 PHE 22 1HD PHE 22 -13.562 9.356 -3.546
136 HE1 PHE 22 2HE PHE 22 -16.982 9.058 -7.125
137 HE2 PHE 22 1HE PHE 22 -13.978 11.301 -5.025
138 HZ PHE 22 HZ PHE 22 -15.690 11.151 -6.811
139 H TYR 23 H TYR 23 -16.691 4.690 -3.391
140 HA TYR 23 HA TYR 23 -16.802 3.214 -0.963
141 HB2 TYR 23 2HB TYR 23 -18.182 2.784 -3.032
142 HB3 TYR 23 1HB TYR 23 -16.734 2.081 -3.761
143 HD1 TYR 23 2HD TYR 23 -18.501 1.890 -0.433
144 HD2 TYR 23 1HD TYR 23 -16.605 -0.217 -3.661
145 HE1 TYR 23 2HE TYR 23 -18.940 -0.266 0.709
146 HE2 TYR 23 1HE TYR 23 -17.042 -2.370 -2.514
147 HH TYR 23 HH TYR 23 -19.116 -2.983 -0.493
148 H GLY 24 H GLY 24 -15.518 1.566 -0.192
149 HA2 GLY 24 2HA GLY 24 -12.737 1.495 -1.228
150 HA3 GLY 24 1HA GLY 24 -13.190 1.213 0.457
151 H ASN 25 H ASN 25 -11.626 -0.650 -0.832
152 HA ASN 25 HA ASN 25 -13.501 -2.886 -1.373
153 HB2 ASN 25 2HB ASN 25 -11.713 -2.073 -3.150
154 HB3 ASN 25 1HB ASN 25 -10.610 -3.030 -2.158
155 HD21 ASN 25 1HD2 ASN 25 -13.469 -3.217 -4.256
156 HD22 ASN 25 2HD2 ASN 25 -13.437 -4.914 -4.432
157 HA PRO 26 HA PRO 26 -11.796 -4.509 2.433
158 HB2 PRO 26 2HB PRO 26 -12.823 -7.013 2.396
159 HB3 PRO 26 1HB PRO 26 -13.807 -5.570 2.703
160 HG2 PRO 26 2HG PRO 26 -13.507 -7.153 0.197
161 HG3 PRO 26 1HG PRO 26 -14.968 -6.450 0.922
162 HD2 PRO 26 2HD PRO 26 -13.600 -5.279 -1.156
163 HD3 PRO 26 1HD PRO 26 -14.580 -4.368 0.013
164 H ARG 27 H ARG 27 -11.208 -6.036 -0.673
165 HA ARG 27 HA ARG 27 -9.226 -7.895 0.284
166 HB2 ARG 27 2HB ARG 27 -9.907 -6.879 -2.483
167 HB3 ARG 27 1HB ARG 27 -8.695 -8.120 -2.157
168 HG2 ARG 27 2HG ARG 27 -10.417 -9.521 -1.080
169 HG3 ARG 27 1HG ARG 27 -11.630 -8.281 -1.412
170 HD2 ARG 27 2HD ARG 27 -11.147 -8.499 -3.840
171 HD3 ARG 27 1HD ARG 27 -10.009 -9.792 -3.477
172 HE ARG 27 HE ARG 27 -12.507 -10.433 -2.328
173 HH11 ARG 27 1HH2 ARG 27 -11.005 -10.142 -5.498
174 HH12 ARG 27 2HH2 ARG 27 -12.091 -11.270 -6.228
175 HH21 ARG 27 1HH1 ARG 27 -13.876 -11.902 -3.333
176 HH22 ARG 27 2HH1 ARG 27 -13.699 -12.258 -5.018
177 H THR 28 H THR 28 -9.307 -4.640 -1.078
178 HA THR 28 HA THR 28 -6.450 -4.339 -1.297
179 HB THR 28 HB THR 28 -6.982 -1.950 -1.645
180 HG1 THR 28 1HG THR 28 -8.577 -1.402 -0.367
181 HG21 THR 28 3HG2 THR 28 -8.482 -4.084 -3.074
182 HG22 THR 28 1HG2 THR 28 -7.347 -2.887 -3.701
183 HG23 THR 28 2HG2 THR 28 -9.014 -2.428 -3.354
184 H ASN 29 H ASN 29 -6.265 -1.755 0.198
185 HA ASN 29 HA ASN 29 -5.919 -2.887 2.860
186 HB2 ASN 29 2HB ASN 29 -4.839 -0.551 1.365
187 HB3 ASN 29 1HB ASN 29 -4.968 -0.374 3.115
188 HD21 ASN 29 1HD2 ASN 29 -4.109 -3.218 1.055
189 HD22 ASN 29 2HD2 ASN 29 -2.617 -3.503 1.827
190 H GLY 30 H GLY 30 -8.684 -2.313 1.856
191 HA2 GLY 30 2HA GLY 30 -10.614 -1.659 2.901
192 HA3 GLY 30 1HA GLY 30 -9.641 -0.925 4.174
193 H MET 31 H MET 31 -8.800 0.081 0.967
194 HA MET 31 HA MET 31 -10.446 2.520 1.245
195 HB2 MET 31 2HB MET 31 -7.521 2.422 0.460
196 HB3 MET 31 1HB MET 31 -8.527 3.872 0.578
197 HG2 MET 31 2HG MET 31 -8.978 3.080 3.018
198 HG3 MET 31 1HG MET 31 -7.560 2.065 2.788
199 HE1 MET 31 3HE MET 31 -6.216 3.718 4.973
200 HE2 MET 31 1HE MET 31 -4.873 3.979 3.852
201 HE3 MET 31 2HE MET 31 -5.841 2.512 3.748
202 H CYS 32 H CYS 32 -10.158 3.877 -0.868
203 HA CYS 32 HA CYS 32 -11.146 2.230 -2.985
204 HB2 CYS 32 2HB CYS 32 -11.680 4.290 -4.107
205 HB3 CYS 32 1HB CYS 32 -12.075 4.488 -2.412
206 H SER 33 H SER 33 -10.222 3.447 -5.265
207 HA SER 33 HA SER 33 -7.759 2.054 -5.645
208 HB2 SER 33 2HB SER 33 -8.033 3.498 -7.943
209 HB3 SER 33 1HB SER 33 -8.841 1.972 -7.613
210 HG SER 33 HG SER 33 -10.018 4.148 -8.198
211 H VAL 34 H VAL 34 -8.550 5.543 -5.733
212 HA VAL 34 HA VAL 34 -5.933 6.402 -6.350
213 HB VAL 34 HB VAL 34 -7.931 8.087 -4.839
214 HG11 VAL 34 1HG1 VAL 34 -6.870 9.804 -6.444
215 HG12 VAL 34 2HG1 VAL 34 -5.636 8.577 -6.736
216 HG13 VAL 34 3HG1 VAL 34 -5.871 9.221 -5.111
217 HG21 VAL 34 3HG2 VAL 34 -7.870 7.356 -7.783
218 HG22 VAL 34 1HG2 VAL 34 -8.710 8.777 -7.164
219 HG23 VAL 34 2HG2 VAL 34 -9.218 7.169 -6.660
220 H CYS 35 H CYS 35 -7.617 6.595 -3.193
221 HA CYS 35 HA CYS 35 -5.466 7.564 -1.706
222 HB2 CYS 35 2HB CYS 35 -7.715 5.772 -0.756
223 HB3 CYS 35 1HB CYS 35 -6.670 6.749 0.277
224 H TYR 36 H TYR 36 -6.313 4.245 -2.572
225 HA TYR 36 HA TYR 36 -4.629 2.851 -0.830
226 HB2 TYR 36 2HB TYR 36 -6.320 1.702 -2.141
227 HB3 TYR 36 1HB TYR 36 -5.494 2.133 -3.640
228 HD1 TYR 36 2HD TYR 36 -4.506 0.618 -0.326
229 HD2 TYR 36 1HD TYR 36 -4.341 0.372 -4.614
230 HE1 TYR 36 2HE TYR 36 -3.110 -1.422 -0.157
231 HE2 TYR 36 1HE TYR 36 -2.940 -1.665 -4.443
232 HH TYR 36 HH TYR 36 -1.262 -2.534 -1.963
233 H LYS 37 H LYS 37 -3.909 4.274 -3.998
234 HA LYS 37 HA LYS 37 -1.224 3.270 -4.068
235 HB2 LYS 37 2HB LYS 37 -2.795 4.105 -6.022
236 HB3 LYS 37 1HB LYS 37 -2.084 5.673 -5.644
237 HG2 LYS 37 2HG LYS 37 0.146 4.835 -6.039
238 HG3 LYS 37 1HG LYS 37 -0.447 3.179 -6.167
239 HD2 LYS 37 2HD LYS 37 -0.240 3.778 -8.420
240 HD3 LYS 37 1HD LYS 37 -1.935 4.135 -8.107
241 HE2 LYS 37 2HE LYS 37 -0.428 6.463 -7.394
242 HE3 LYS 37 1HE LYS 37 0.132 5.927 -8.976
243 HZ1 LYS 37 3HZ LYS 37 -2.707 6.350 -8.225
244 HZ2 LYS 37 1HZ LYS 37 -2.136 5.898 -9.756
245 HZ3 LYS 37 2HZ LYS 37 -1.763 7.433 -9.129
246 H GLU 38 H GLU 38 -2.751 6.390 -3.314
247 HA GLU 38 HA GLU 38 -0.468 7.912 -2.862
248 HB2 GLU 38 2HB GLU 38 -3.262 8.061 -1.777
249 HB3 GLU 38 1HB GLU 38 -2.024 9.186 -1.222
250 HG2 GLU 38 2HG GLU 38 -2.552 8.719 -4.159
251 HG3 GLU 38 1HG GLU 38 -3.435 9.936 -3.233
252 H HIS 39 H HIS 39 -2.160 5.747 -0.544
253 HA HIS 39 HA HIS 39 -0.300 6.567 1.543
254 HB2 HIS 39 2HB HIS 39 -1.564 5.339 3.092
255 HB3 HIS 39 1HB HIS 39 -2.729 6.076 2.002
256 HD1 HIS 39 1HD HIS 39 -4.576 4.513 1.561
257 HD2 HIS 39 2HD HIS 39 -0.984 2.465 1.934
258 HE1 HIS 39 1HE HIS 39 -5.142 2.047 1.440
259 HE2 HIS 39 2HE HIS 39 -2.950 0.788 1.628
260 H LEU 40 H LEU 40 -0.685 3.844 -0.621
261 HA LEU 40 HA LEU 40 1.115 2.045 0.620
262 HB2 LEU 40 2HB LEU 40 -0.483 1.493 -1.233
263 HB3 LEU 40 1HB LEU 40 0.597 2.331 -2.348
264 HG LEU 40 HG LEU 40 2.441 0.758 -1.444
265 HD11 LEU 40 1HD1 LEU 40 -0.043 -0.747 -0.562
266 HD12 LEU 40 2HD1 LEU 40 1.164 -0.045 0.512
267 HD13 LEU 40 3HD1 LEU 40 1.601 -1.386 -0.547
268 HD21 LEU 40 3HD2 LEU 40 1.041 0.659 -3.663
269 HD22 LEU 40 1HD2 LEU 40 0.261 -0.725 -2.898
270 HD23 LEU 40 2HD2 LEU 40 2.001 -0.745 -3.193
271 H GLN 41 H GLN 41 1.662 4.844 -1.434
272 HA GLN 41 HA GLN 41 4.350 4.310 -2.187
273 HB2 GLN 41 2HB GLN 41 2.713 6.092 -3.103
274 HB3 GLN 41 1HB GLN 41 3.278 7.088 -1.763
275 HG2 GLN 41 2HG GLN 41 5.628 6.721 -2.533
276 HG3 GLN 41 1HG GLN 41 4.998 5.836 -3.926
277 HE21 GLN 41 1HE2 GLN 41 2.838 7.399 -4.734
278 HE22 GLN 41 2HE2 GLN 41 3.380 8.960 -5.162
279 H ARG 42 H ARG 42 2.927 5.961 0.598
280 HA ARG 42 HA ARG 42 5.453 6.802 1.687
281 HB2 ARG 42 2HB ARG 42 2.696 6.640 2.927
282 HB3 ARG 42 1HB ARG 42 4.095 7.420 3.668
283 HG2 ARG 42 2HG ARG 42 4.253 8.795 1.490
284 HG3 ARG 42 1HG ARG 42 2.618 8.218 1.158
285 HD2 ARG 42 2HD ARG 42 3.431 9.643 3.708
286 HD3 ARG 42 1HD ARG 42 2.676 10.437 2.329
287 HE ARG 42 HE ARG 42 1.114 8.203 3.156
288 HH11 ARG 42 1HH2 ARG 42 1.924 11.485 4.145
289 HH12 ARG 42 2HH2 ARG 42 0.423 11.714 4.973
290 HH21 ARG 42 1HH1 ARG 42 -0.821 8.575 4.251
291 HH22 ARG 42 2HH1 ARG 42 -1.106 10.096 5.029
292 H GLN 43 H GLN 43 3.375 3.992 2.038
293 HA GLN 43 HA GLN 43 4.672 3.003 4.412
294 HB2 GLN 43 2HB GLN 43 2.354 2.353 2.847
295 HB3 GLN 43 1HB GLN 43 3.323 0.893 3.007
296 HG2 GLN 43 2HG GLN 43 1.941 0.871 4.920
297 HG3 GLN 43 1HG GLN 43 3.473 1.508 5.519
298 HE21 GLN 43 1HE2 GLN 43 3.347 3.474 6.622
299 HE22 GLN 43 2HE2 GLN 43 2.033 4.539 6.544
300 H GLN 44 H GLN 44 4.947 2.412 0.930
301 HA GLN 44 HA GLN 44 6.822 0.249 1.207
302 HB2 GLN 44 2HB GLN 44 5.918 1.944 -1.117
303 HB3 GLN 44 1HB GLN 44 7.170 0.713 -1.282
304 HG2 GLN 44 2HG GLN 44 4.543 0.031 0.015
305 HG3 GLN 44 1HG GLN 44 4.685 0.049 -1.740
306 HE21 GLN 44 1HE2 GLN 44 5.754 -1.613 1.202
307 HE22 GLN 44 2HE2 GLN 44 6.457 -2.943 0.396
308 H ASN 45 H ASN 45 7.031 3.742 0.851
309 HA ASN 45 HA ASN 45 9.688 4.063 0.055
310 HB2 ASN 45 2HB ASN 45 7.921 5.856 0.333
311 HB3 ASN 45 1HB ASN 45 8.270 5.822 2.060
312 HD21 ASN 45 1HD2 ASN 45 10.113 6.071 -1.053
313 HD22 ASN 45 2HD2 ASN 45 11.215 7.228 -0.456
314 H SER 46 H SER 46 8.395 3.184 3.201
315 HA SER 46 HA SER 46 10.608 3.791 4.834
316 HB2 SER 46 2HB SER 46 8.418 1.737 5.049
317 HB3 SER 46 1HB SER 46 9.682 1.869 6.267
318 HG SER 46 HG SER 46 7.705 3.728 5.507
319 H GLY 47 H GLY 47 9.696 0.539 3.643
320 HA2 GLY 47 2HA GLY 47 10.981 -1.249 2.972
321 HA3 GLY 47 1HA GLY 47 12.305 -0.117 2.719
322 H ARG 48 H ARG 48 10.480 -1.492 5.473
323 HA ARG 48 HA ARG 48 12.707 -1.302 7.268
324 HB2 ARG 48 2HB ARG 48 10.034 -2.697 7.411
325 HB3 ARG 48 1HB ARG 48 11.224 -2.807 8.709
326 HG2 ARG 48 2HG ARG 48 11.199 -0.422 9.037
327 HG3 ARG 48 1HG ARG 48 10.225 -0.177 7.588
328 HD2 ARG 48 2HD ARG 48 8.490 -1.712 8.758
329 HD3 ARG 48 1HD ARG 48 9.401 -1.374 10.226
330 HE ARG 48 HE ARG 48 8.739 1.033 8.812
331 HH11 ARG 48 1HH2 ARG 48 7.398 -1.382 10.992
332 HH12 ARG 48 2HH2 ARG 48 6.230 -0.289 11.645
333 HH21 ARG 48 1HH1 ARG 48 7.198 2.399 9.696
334 HH22 ARG 48 2HH1 ARG 48 6.116 1.827 10.922
335 H MET 49 H MET 49 13.864 -3.065 8.235
336 HA MET 49 HA MET 49 14.153 -5.389 6.422
337 HB2 MET 49 2HB MET 49 16.129 -3.861 8.100
338 HB3 MET 49 1HB MET 49 16.468 -5.509 7.569
339 HG2 MET 49 2HG MET 49 15.970 -4.776 5.213
340 HG3 MET 49 1HG MET 49 15.853 -3.119 5.808
341 HE1 MET 49 3HE MET 49 17.992 -5.618 4.189
342 HE2 MET 49 1HE MET 49 19.356 -4.521 3.922
343 HE3 MET 49 2HE MET 49 17.719 -4.012 3.516
344 H SER 50 H SER 50 12.744 -6.828 7.339
345 HA SER 50 HA SER 50 13.600 -8.135 9.765
346 HB2 SER 50 2HB SER 50 11.996 -6.077 10.305
347 HB3 SER 50 1HB SER 50 10.749 -7.238 9.866
348 HG SER 50 HG SER 50 11.446 -7.193 12.137
349 HA PRO 51 HA PRO 51 11.874 -11.686 7.738
350 HB2 PRO 51 2HB PRO 51 10.453 -12.466 10.236
351 HB3 PRO 51 1HB PRO 51 11.644 -13.371 9.285
352 HG2 PRO 51 2HG PRO 51 12.263 -12.278 11.632
353 HG3 PRO 51 1HG PRO 51 13.427 -12.347 10.296
354 HD2 PRO 51 2HD PRO 51 11.853 -10.010 11.307
355 HD3 PRO 51 1HD PRO 51 13.503 -10.058 10.645
356 H MET 52 H MET 52 9.565 -13.029 7.800
357 HA MET 52 HA MET 52 7.480 -10.965 7.367
358 HB2 MET 52 2HB MET 52 6.456 -12.599 5.793
359 HB3 MET 52 1HB MET 52 8.065 -12.089 5.295
360 HG2 MET 52 2HG MET 52 9.047 -14.146 6.056
361 HG3 MET 52 1HG MET 52 7.561 -14.619 6.881
362 HE1 MET 52 3HE MET 52 8.930 -13.332 3.574
363 HE2 MET 52 1HE MET 52 8.473 -14.574 2.399
364 HE3 MET 52 2HE MET 52 9.630 -14.947 3.674
365 H GLY 53 H GLY 53 5.340 -11.405 8.027
366 HA2 GLY 53 2HA GLY 53 3.646 -12.401 9.262
367 HA3 GLY 53 1HA GLY 53 4.686 -13.801 9.498
368 H THR 54 H THR 54 5.516 -10.453 10.287
369 HA THR 54 HA THR 54 5.860 -11.255 13.106
370 HB THR 54 HB THR 54 6.846 -8.693 11.863
371 HG1 THR 54 1HG THR 54 7.696 -10.317 10.610
372 HG21 THR 54 3HG2 THR 54 6.871 -8.937 14.333
373 HG22 THR 54 1HG2 THR 54 8.499 -8.847 13.666
374 HG23 THR 54 2HG2 THR 54 7.835 -10.403 14.164
375 H ALA 55 H ALA 55 4.610 -10.438 14.683
376 HA ALA 55 HA ALA 55 2.380 -8.734 13.975
377 HB1 ALA 55 1HB ALA 55 1.902 -10.507 15.504
378 HB2 ALA 55 2HB ALA 55 1.823 -9.010 16.434
379 HB3 ALA 55 3HB ALA 55 3.243 -10.049 16.555
380 H SER 56 H SER 56 3.367 -6.759 13.419
381 HA SER 56 HA SER 56 3.962 -5.057 15.705
382 HB2 SER 56 2HB SER 56 6.156 -6.103 14.865
383 HB3 SER 56 1HB SER 56 5.933 -5.116 13.425
384 HG SER 56 HG SER 56 7.128 -3.939 14.891
385 H GLY 57 H GLY 57 4.621 -2.752 14.638
386 HA2 GLY 57 2HA GLY 57 4.123 -1.095 13.035
387 HA3 GLY 57 1HA GLY 57 3.036 -2.226 12.233
388 H SER 58 H SER 58 3.402 -0.153 15.084
389 HA SER 58 HA SER 58 0.515 0.358 15.043
390 HB2 SER 58 2HB SER 58 1.088 -1.528 16.686
391 HB3 SER 58 1HB SER 58 1.899 -0.292 17.643
392 HG SER 58 HG SER 58 -0.040 0.051 18.388
393 H ASN 59 H ASN 59 2.850 1.935 14.283
394 HA ASN 59 HA ASN 59 2.980 3.987 16.395
395 HB2 ASN 59 2HB ASN 59 5.063 3.033 15.218
396 HB3 ASN 59 1HB ASN 59 4.552 3.990 13.828
397 HD21 ASN 59 1HD2 ASN 59 5.869 4.174 17.092
398 HD22 ASN 59 2HD2 ASN 59 6.169 5.845 17.070
399 H SER 60 H SER 60 2.415 6.132 16.011
400 HA SER 60 HA SER 60 1.266 6.870 13.429
401 HB2 SER 60 2HB SER 60 -0.868 7.541 14.356
402 HB3 SER 60 1HB SER 60 -0.598 5.844 14.743
403 HG SER 60 HG SER 60 -0.470 8.119 16.391
404 HA PRO 61 HA PRO 61 3.008 10.760 14.675
405 HB2 PRO 61 2HB PRO 61 1.681 12.513 13.083
406 HB3 PRO 61 1HB PRO 61 2.863 11.354 12.444
407 HG2 PRO 61 2HG PRO 61 -0.106 11.248 12.399
408 HG3 PRO 61 1HG PRO 61 1.062 10.755 11.163
409 HD2 PRO 61 2HD PRO 61 -0.217 9.000 12.883
410 HD3 PRO 61 1HD PRO 61 1.326 8.661 12.070
411 H THR 62 H THR 62 2.694 12.385 16.170
412 HA THR 62 HA THR 62 -0.033 13.183 16.896
413 HB THR 62 HB THR 62 0.421 12.769 19.297
414 HG1 THR 62 1HG THR 62 2.703 11.437 18.268
415 HG21 THR 62 3HG2 THR 62 -0.692 11.084 17.708
416 HG22 THR 62 1HG2 THR 62 -0.073 10.451 19.234
417 HG23 THR 62 2HG2 THR 62 0.843 10.216 17.745
Start of MODEL 12
1 H1 GLY 1 1HT GLY 1 -36.765 -19.213 14.509
2 H2 GLY 1 2HT GLY 1 -36.291 -19.820 12.995
3 H3 GLY 1 3HT GLY 1 -37.757 -18.975 13.155
4 HA2 GLY 1 2HA GLY 1 -35.060 -17.807 13.582
5 HA3 GLY 1 1HA GLY 1 -36.032 -17.602 12.125
6 H SER 2 H SER 2 -35.084 -15.671 14.258
7 HA SER 2 HA SER 2 -37.626 -14.726 15.378
8 HB2 SER 2 2HB SER 2 -36.034 -12.989 16.430
9 HB3 SER 2 1HB SER 2 -35.922 -14.653 16.996
10 HG SER 2 HG SER 2 -33.877 -14.244 16.510
11 H MET 3 H MET 3 -34.917 -13.490 13.402
12 HA MET 3 HA MET 3 -36.805 -11.804 11.928
13 HB2 MET 3 2HB MET 3 -35.192 -9.854 12.112
14 HB3 MET 3 1HB MET 3 -36.114 -10.216 13.566
15 HG2 MET 3 2HG MET 3 -33.470 -11.584 13.283
16 HG3 MET 3 1HG MET 3 -33.431 -9.849 13.585
17 HE1 MET 3 3HE MET 3 -32.616 -9.421 15.611
18 HE2 MET 3 1HE MET 3 -32.019 -11.060 15.911
19 HE3 MET 3 2HE MET 3 -32.926 -10.207 17.157
20 H ALA 4 H ALA 4 -36.413 -13.217 10.186
21 HA ALA 4 HA ALA 4 -33.682 -13.398 9.141
22 HB1 ALA 4 1HB ALA 4 -34.700 -14.947 7.484
23 HB2 ALA 4 2HB ALA 4 -36.273 -14.670 8.230
24 HB3 ALA 4 3HB ALA 4 -34.985 -15.452 9.149
25 H GLN 5 H GLN 5 -36.850 -12.057 8.312
26 HA GLN 5 HA GLN 5 -35.889 -10.986 5.784
27 HB2 GLN 5 2HB GLN 5 -38.519 -10.967 7.241
28 HB3 GLN 5 1HB GLN 5 -38.244 -9.892 5.871
29 HG2 GLN 5 2HG GLN 5 -39.191 -11.857 4.927
30 HG3 GLN 5 1HG GLN 5 -37.464 -11.973 4.594
31 HE21 GLN 5 1HE2 GLN 5 -39.687 -12.864 7.310
32 HE22 GLN 5 2HE2 GLN 5 -38.983 -14.397 7.561
33 H GLU 6 H GLU 6 -37.164 -9.636 8.841
34 HA GLU 6 HA GLU 6 -36.351 -6.956 8.124
35 HB2 GLU 6 2HB GLU 6 -37.489 -8.123 10.672
36 HB3 GLU 6 1HB GLU 6 -37.153 -6.408 10.432
37 HG2 GLU 6 2HG GLU 6 -38.887 -7.968 8.515
38 HG3 GLU 6 1HG GLU 6 -39.554 -7.200 9.954
39 H THR 7 H THR 7 -34.127 -6.905 7.922
40 HA THR 7 HA THR 7 -32.521 -7.665 10.285
41 HB THR 7 HB THR 7 -30.585 -7.481 8.708
42 HG1 THR 7 1HG THR 7 -31.060 -6.376 6.990
43 HG21 THR 7 3HG2 THR 7 -31.057 -9.567 7.541
44 HG22 THR 7 1HG2 THR 7 -32.790 -9.334 7.768
45 HG23 THR 7 2HG2 THR 7 -31.752 -9.639 9.160
46 H ASN 8 H ASN 8 -31.367 -6.157 11.395
47 HA ASN 8 HA ASN 8 -31.934 -3.354 10.808
48 HB2 ASN 8 2HB ASN 8 -30.719 -4.802 13.155
49 HB3 ASN 8 1HB ASN 8 -30.689 -3.043 13.027
50 HD21 ASN 8 1HD2 ASN 8 -32.362 -2.190 14.258
51 HD22 ASN 8 2HD2 ASN 8 -33.936 -2.840 14.353
52 H GLN 9 H GLN 9 -28.974 -5.093 11.829
53 HA GLN 9 HA GLN 9 -27.345 -3.132 10.389
54 HB2 GLN 9 2HB GLN 9 -26.688 -5.358 12.323
55 HB3 GLN 9 1HB GLN 9 -25.446 -4.460 11.452
56 HG2 GLN 9 2HG GLN 9 -26.703 -2.350 12.361
57 HG3 GLN 9 1HG GLN 9 -27.370 -3.477 13.542
58 HE21 GLN 9 1HE2 GLN 9 -24.244 -2.279 12.240
59 HE22 GLN 9 2HE2 GLN 9 -23.360 -2.596 13.664
60 H THR 10 H THR 10 -25.832 -3.705 8.786
61 HA THR 10 HA THR 10 -25.577 -6.375 7.796
62 HB THR 10 HB THR 10 -27.775 -6.025 6.873
63 HG1 THR 10 1HG THR 10 -27.213 -6.617 4.917
64 HG21 THR 10 3HG2 THR 10 -27.431 -3.413 6.971
65 HG22 THR 10 1HG2 THR 10 -28.492 -4.114 5.750
66 HG23 THR 10 2HG2 THR 10 -26.854 -3.627 5.318
67 HA PRO 11 HA PRO 11 -22.092 -3.673 6.580
68 HB2 PRO 11 2HB PRO 11 -20.157 -5.606 6.596
69 HB3 PRO 11 1HB PRO 11 -20.701 -4.761 8.056
70 HG2 PRO 11 2HG PRO 11 -21.354 -7.485 7.092
71 HG3 PRO 11 1HG PRO 11 -21.152 -6.882 8.744
72 HD2 PRO 11 2HD PRO 11 -23.606 -7.345 7.528
73 HD3 PRO 11 1HD PRO 11 -23.354 -6.270 8.919
74 H GLY 12 H GLY 12 -20.595 -3.697 4.699
75 HA2 GLY 12 2HA GLY 12 -20.285 -5.439 2.673
76 HA3 GLY 12 1HA GLY 12 -21.915 -4.835 2.373
77 HA PRO 13 HA PRO 13 -20.252 -1.122 0.629
78 HB2 PRO 13 2HB PRO 13 -21.312 1.037 1.892
79 HB3 PRO 13 1HB PRO 13 -22.285 -0.058 0.889
80 HG2 PRO 13 2HG PRO 13 -22.060 0.104 3.849
81 HG3 PRO 13 1HG PRO 13 -23.476 -0.230 2.835
82 HD2 PRO 13 2HD PRO 13 -22.011 -2.171 4.159
83 HD3 PRO 13 1HD PRO 13 -23.027 -2.479 2.732
84 H MET 14 H MET 14 -18.055 -1.671 1.393
85 HA MET 14 HA MET 14 -16.943 -0.437 3.725
86 HB2 MET 14 2HB MET 14 -15.702 -1.749 1.301
87 HB3 MET 14 1HB MET 14 -14.743 -1.079 2.618
88 HG2 MET 14 2HG MET 14 -16.946 -3.097 3.081
89 HG3 MET 14 1HG MET 14 -15.272 -3.567 2.784
90 HE1 MET 14 3HE MET 14 -16.713 -4.426 5.614
91 HE2 MET 14 1HE MET 14 -15.137 -4.302 6.409
92 HE3 MET 14 2HE MET 14 -15.246 -4.851 4.738
93 H LEU 15 H LEU 15 -17.301 1.790 3.664
94 HA LEU 15 HA LEU 15 -16.509 3.347 1.356
95 HB2 LEU 15 2HB LEU 15 -17.888 3.848 3.920
96 HB3 LEU 15 1HB LEU 15 -16.853 5.175 3.401
97 HG LEU 15 HG LEU 15 -19.143 5.470 2.548
98 HD11 LEU 15 1HD1 LEU 15 -18.573 6.076 0.365
99 HD12 LEU 15 2HD1 LEU 15 -17.526 4.675 0.142
100 HD13 LEU 15 3HD1 LEU 15 -17.000 6.017 1.158
101 HD21 LEU 15 3HD2 LEU 15 -19.445 2.867 2.415
102 HD22 LEU 15 1HD2 LEU 15 -18.812 3.065 0.779
103 HD23 LEU 15 2HD2 LEU 15 -20.288 3.902 1.262
104 H CYS 16 H CYS 16 -14.669 4.539 1.089
105 HA CYS 16 HA CYS 16 -12.238 3.753 1.988
106 HB2 CYS 16 2HB CYS 16 -12.836 5.510 0.215
107 HB3 CYS 16 1HB CYS 16 -12.768 6.678 1.536
108 H SER 17 H SER 17 -11.235 3.636 3.851
109 HA SER 17 HA SER 17 -12.171 4.615 6.290
110 HB2 SER 17 2HB SER 17 -9.282 3.988 5.662
111 HB3 SER 17 1HB SER 17 -10.071 3.937 7.239
112 HG SER 17 HG SER 17 -9.850 1.881 6.058
113 H THR 18 H THR 18 -10.314 6.305 3.859
114 HA THR 18 HA THR 18 -9.348 8.342 5.677
115 HB THR 18 HB THR 18 -8.513 9.459 3.688
116 HG1 THR 18 1HG THR 18 -9.327 9.074 1.799
117 HG21 THR 18 3HG2 THR 18 -7.399 7.331 4.644
118 HG22 THR 18 1HG2 THR 18 -6.920 7.843 3.026
119 HG23 THR 18 2HG2 THR 18 -8.060 6.514 3.228
120 H GLY 19 H GLY 19 -12.384 7.748 4.226
121 HA2 GLY 19 2HA GLY 19 -14.318 8.981 4.307
122 HA3 GLY 19 1HA GLY 19 -13.421 10.250 5.132
123 H CYS 20 H CYS 20 -12.766 8.871 1.909
124 HA CYS 20 HA CYS 20 -12.812 11.573 0.813
125 HB2 CYS 20 2HB CYS 20 -11.794 10.644 -1.180
126 HB3 CYS 20 1HB CYS 20 -10.944 10.043 0.241
127 H GLY 21 H GLY 21 -15.125 9.121 1.181
128 HA2 GLY 21 2HA GLY 21 -17.374 9.287 0.575
129 HA3 GLY 21 1HA GLY 21 -16.948 10.505 -0.613
130 H PHE 22 H PHE 22 -14.812 8.057 -1.205
131 HA PHE 22 HA PHE 22 -16.508 6.965 -3.331
132 HB2 PHE 22 2HB PHE 22 -13.522 7.156 -2.961
133 HB3 PHE 22 1HB PHE 22 -14.251 6.127 -4.197
134 HD1 PHE 22 2HD PHE 22 -15.671 7.135 -5.990
135 HD2 PHE 22 1HD PHE 22 -13.482 9.543 -3.185
136 HE1 PHE 22 2HE PHE 22 -15.937 9.104 -7.474
137 HE2 PHE 22 1HE PHE 22 -13.749 11.514 -4.668
138 HZ PHE 22 HZ PHE 22 -14.976 11.295 -6.813
139 H TYR 23 H TYR 23 -15.904 4.640 -3.930
140 HA TYR 23 HA TYR 23 -16.421 2.989 -1.615
141 HB2 TYR 23 2HB TYR 23 -17.357 2.750 -4.036
142 HB3 TYR 23 1HB TYR 23 -15.837 1.908 -4.355
143 HD1 TYR 23 1HD TYR 23 -18.771 1.961 -2.050
144 HD2 TYR 23 2HD TYR 23 -15.560 -0.349 -3.719
145 HE1 TYR 23 1HE TYR 23 -19.699 -0.083 -1.005
146 HE2 TYR 23 2HE TYR 23 -16.487 -2.396 -2.673
147 HH TYR 23 HH TYR 23 -17.979 -2.912 -0.655
148 H GLY 24 H GLY 24 -15.114 1.547 -0.633
149 HA2 GLY 24 2HA GLY 24 -12.271 1.468 -1.486
150 HA3 GLY 24 1HA GLY 24 -12.819 1.315 0.188
151 H ASN 25 H ASN 25 -11.179 -0.580 -1.260
152 HA ASN 25 HA ASN 25 -13.007 -2.866 -1.647
153 HB2 ASN 25 2HB ASN 25 -11.037 -2.151 -3.278
154 HB3 ASN 25 1HB ASN 25 -10.072 -3.102 -2.152
155 HD21 ASN 25 1HD2 ASN 25 -13.083 -3.348 -4.128
156 HD22 ASN 25 2HD2 ASN 25 -12.935 -5.027 -4.402
157 HA PRO 26 HA PRO 26 -11.691 -4.381 2.344
158 HB2 PRO 26 2HB PRO 26 -12.646 -6.937 2.216
159 HB3 PRO 26 1HB PRO 26 -13.666 -5.512 2.485
160 HG2 PRO 26 2HG PRO 26 -13.249 -7.098 0.014
161 HG3 PRO 26 1HG PRO 26 -14.717 -6.318 0.624
162 HD2 PRO 26 2HD PRO 26 -13.115 -5.267 -1.379
163 HD3 PRO 26 1HD PRO 26 -14.207 -4.307 -0.360
164 H ARG 27 H ARG 27 -10.823 -6.041 -0.641
165 HA ARG 27 HA ARG 27 -8.840 -7.757 0.546
166 HB2 ARG 27 2HB ARG 27 -9.608 -7.003 -2.256
167 HB3 ARG 27 1HB ARG 27 -8.076 -7.826 -1.967
168 HG2 ARG 27 2HG ARG 27 -10.587 -8.907 -0.718
169 HG3 ARG 27 1HG ARG 27 -10.246 -9.245 -2.415
170 HD2 ARG 27 2HD ARG 27 -8.217 -10.363 -1.897
171 HD3 ARG 27 1HD ARG 27 -8.182 -9.717 -0.260
172 HE ARG 27 HE ARG 27 -10.511 -11.334 -0.737
173 HH11 ARG 27 1HH2 ARG 27 -7.093 -11.486 0.091
174 HH12 ARG 27 2HH2 ARG 27 -7.242 -13.039 0.836
175 HH21 ARG 27 1HH1 ARG 27 -10.632 -13.348 0.246
176 HH22 ARG 27 2HH1 ARG 27 -9.218 -14.081 0.926
177 H THR 28 H THR 28 -8.928 -4.475 -0.637
178 HA THR 28 HA THR 28 -6.031 -4.200 -0.762
179 HB THR 28 HB THR 28 -6.506 -1.859 -1.334
180 HG1 THR 28 1HG THR 28 -8.296 -0.980 -0.723
181 HG21 THR 28 3HG2 THR 28 -6.681 -3.272 -3.228
182 HG22 THR 28 1HG2 THR 28 -8.138 -2.279 -3.272
183 HG23 THR 28 2HG2 THR 28 -8.220 -3.940 -2.688
184 H ASN 29 H ASN 29 -6.139 -1.478 0.565
185 HA ASN 29 HA ASN 29 -5.892 -2.425 3.322
186 HB2 ASN 29 2HB ASN 29 -4.916 -0.026 1.812
187 HB3 ASN 29 1HB ASN 29 -5.068 0.072 3.569
188 HD21 ASN 29 1HD2 ASN 29 -2.547 0.021 1.932
189 HD22 ASN 29 2HD2 ASN 29 -1.669 -1.326 2.503
190 H GLY 30 H GLY 30 -8.601 -2.049 2.049
191 HA2 GLY 30 2HA GLY 30 -10.651 -1.379 2.851
192 HA3 GLY 30 1HA GLY 30 -9.827 -0.607 4.207
193 H MET 31 H MET 31 -8.672 0.298 1.055
194 HA MET 31 HA MET 31 -10.218 2.822 1.190
195 HB2 MET 31 2HB MET 31 -7.345 2.456 0.303
196 HB3 MET 31 1HB MET 31 -8.246 3.975 0.307
197 HG2 MET 31 2HG MET 31 -8.522 3.801 2.755
198 HG3 MET 31 1HG MET 31 -7.600 2.297 2.750
199 HE1 MET 31 3HE MET 31 -6.468 4.131 4.700
200 HE2 MET 31 1HE MET 31 -4.760 4.174 4.238
201 HE3 MET 31 2HE MET 31 -5.677 2.675 4.099
202 H CYS 32 H CYS 32 -10.134 4.019 -0.921
203 HA CYS 32 HA CYS 32 -11.090 2.301 -3.018
204 HB2 CYS 32 2HB CYS 32 -11.656 4.380 -4.164
205 HB3 CYS 32 1HB CYS 32 -12.162 4.473 -2.481
206 H SER 33 H SER 33 -10.203 3.529 -5.347
207 HA SER 33 HA SER 33 -7.641 2.285 -5.636
208 HB2 SER 33 2HB SER 33 -9.688 2.852 -7.345
209 HB3 SER 33 1HB SER 33 -8.508 4.072 -7.816
210 HG SER 33 HG SER 33 -7.091 2.511 -8.331
211 H VAL 34 H VAL 34 -8.689 5.693 -5.669
212 HA VAL 34 HA VAL 34 -6.196 6.837 -6.321
213 HB VAL 34 HB VAL 34 -8.348 8.111 -4.607
214 HG11 VAL 34 1HG1 VAL 34 -6.223 9.230 -6.462
215 HG12 VAL 34 2HG1 VAL 34 -6.292 9.412 -4.709
216 HG13 VAL 34 3HG1 VAL 34 -7.506 10.190 -5.725
217 HG21 VAL 34 3HG2 VAL 34 -8.134 7.781 -7.609
218 HG22 VAL 34 1HG2 VAL 34 -9.158 9.001 -6.853
219 HG23 VAL 34 2HG2 VAL 34 -9.469 7.291 -6.567
220 H CYS 35 H CYS 35 -7.703 6.404 -3.121
221 HA CYS 35 HA CYS 35 -5.506 7.448 -1.658
222 HB2 CYS 35 2HB CYS 35 -7.764 5.663 -0.718
223 HB3 CYS 35 1HB CYS 35 -6.677 6.586 0.320
224 H TYR 36 H TYR 36 -6.419 4.177 -2.658
225 HA TYR 36 HA TYR 36 -4.661 2.797 -0.926
226 HB2 TYR 36 2HB TYR 36 -6.537 1.699 -2.067
227 HB3 TYR 36 1HB TYR 36 -5.715 1.893 -3.616
228 HD1 TYR 36 2HD TYR 36 -4.758 0.726 -0.156
229 HD2 TYR 36 1HD TYR 36 -4.719 -0.062 -4.383
230 HE1 TYR 36 2HE TYR 36 -3.539 -1.395 0.247
231 HE2 TYR 36 1HE TYR 36 -3.497 -2.180 -3.976
232 HH TYR 36 HH TYR 36 -3.341 -3.685 -1.111
233 H LYS 37 H LYS 37 -4.066 4.300 -4.112
234 HA LYS 37 HA LYS 37 -1.512 3.003 -4.377
235 HB2 LYS 37 2HB LYS 37 -1.182 4.534 -6.308
236 HB3 LYS 37 1HB LYS 37 -2.666 3.596 -6.409
237 HG2 LYS 37 2HG LYS 37 -3.985 5.507 -5.683
238 HG3 LYS 37 1HG LYS 37 -2.526 6.454 -5.402
239 HD2 LYS 37 2HD LYS 37 -3.231 7.172 -7.529
240 HD3 LYS 37 1HD LYS 37 -1.995 5.967 -7.896
241 HE2 LYS 37 2HE LYS 37 -3.808 4.247 -8.097
242 HE3 LYS 37 1HE LYS 37 -4.997 5.534 -7.895
243 HZ1 LYS 37 3HZ LYS 37 -4.438 4.915 -10.243
244 HZ2 LYS 37 1HZ LYS 37 -2.905 5.592 -9.989
245 HZ3 LYS 37 2HZ LYS 37 -4.292 6.565 -9.873
246 H GLU 38 H GLU 38 -2.641 6.239 -3.400
247 HA GLU 38 HA GLU 38 -0.076 7.400 -3.080
248 HB2 GLU 38 2HB GLU 38 -2.650 8.035 -1.615
249 HB3 GLU 38 1HB GLU 38 -1.214 9.053 -1.652
250 HG2 GLU 38 2HG GLU 38 -1.533 8.792 -4.292
251 HG3 GLU 38 1HG GLU 38 -3.204 8.494 -3.815
252 H HIS 39 H HIS 39 -2.243 5.725 -0.809
253 HA HIS 39 HA HIS 39 -0.717 5.991 1.528
254 HB2 HIS 39 2HB HIS 39 -3.120 5.141 1.200
255 HB3 HIS 39 1HB HIS 39 -2.389 3.577 0.837
256 HD1 HIS 39 1HD HIS 39 -2.410 6.185 3.613
257 HD2 HIS 39 2HD HIS 39 -1.785 2.097 3.081
258 HE1 HIS 39 1HE HIS 39 -2.189 5.189 5.926
259 HE2 HIS 39 2HE HIS 39 -1.751 2.707 5.624
260 H LEU 40 H LEU 40 -0.703 3.415 -0.938
261 HA LEU 40 HA LEU 40 1.170 1.748 0.376
262 HB2 LEU 40 2HB LEU 40 -0.309 1.734 -2.089
263 HB3 LEU 40 1HB LEU 40 1.371 1.331 -2.447
264 HG LEU 40 HG LEU 40 1.265 -0.350 -0.550
265 HD11 LEU 40 1HD1 LEU 40 -1.119 -1.080 0.006
266 HD12 LEU 40 2HD1 LEU 40 -1.657 0.437 -0.711
267 HD13 LEU 40 3HD1 LEU 40 -0.617 0.457 0.713
268 HD21 LEU 40 3HD2 LEU 40 -0.559 -0.612 -2.953
269 HD22 LEU 40 1HD2 LEU 40 -0.158 -1.970 -1.899
270 HD23 LEU 40 2HD2 LEU 40 1.113 -1.155 -2.812
271 H GLN 41 H GLN 41 1.611 4.540 -1.705
272 HA GLN 41 HA GLN 41 4.383 4.038 -2.268
273 HB2 GLN 41 2HB GLN 41 2.417 6.084 -2.919
274 HB3 GLN 41 1HB GLN 41 3.948 6.827 -2.460
275 HG2 GLN 41 2HG GLN 41 5.126 5.366 -4.083
276 HG3 GLN 41 1HG GLN 41 3.577 4.675 -4.568
277 HE21 GLN 41 1HE2 GLN 41 5.553 7.626 -4.692
278 HE22 GLN 41 2HE2 GLN 41 4.624 8.391 -5.901
279 H ARG 42 H ARG 42 2.615 5.631 0.315
280 HA ARG 42 HA ARG 42 4.889 6.933 1.489
281 HB2 ARG 42 2HB ARG 42 2.401 7.528 1.764
282 HB3 ARG 42 1HB ARG 42 2.357 6.221 2.948
283 HG2 ARG 42 2HG ARG 42 3.911 7.301 4.369
284 HG3 ARG 42 1HG ARG 42 4.447 8.395 3.095
285 HD2 ARG 42 2HD ARG 42 2.385 9.611 3.149
286 HD3 ARG 42 1HD ARG 42 1.621 8.392 4.165
287 HE ARG 42 HE ARG 42 3.394 10.508 5.036
288 HH11 ARG 42 1HH2 ARG 42 2.062 7.352 5.846
289 HH12 ARG 42 2HH2 ARG 42 2.402 7.527 7.528
290 HH21 ARG 42 1HH1 ARG 42 3.840 10.655 7.235
291 HH22 ARG 42 2HH1 ARG 42 3.397 9.366 8.306
292 H GLN 43 H GLN 43 3.338 3.798 1.847
293 HA GLN 43 HA GLN 43 4.670 3.088 4.285
294 HB2 GLN 43 2HB GLN 43 2.505 2.079 3.300
295 HB3 GLN 43 1HB GLN 43 3.586 1.089 2.316
296 HG2 GLN 43 2HG GLN 43 3.124 -0.178 4.304
297 HG3 GLN 43 1HG GLN 43 4.764 0.437 4.471
298 HE21 GLN 43 1HE2 GLN 43 1.382 1.320 5.354
299 HE22 GLN 43 2HE2 GLN 43 1.806 2.062 6.822
300 H GLN 44 H GLN 44 5.520 2.965 0.899
301 HA GLN 44 HA GLN 44 7.637 1.034 1.202
302 HB2 GLN 44 2HB GLN 44 6.950 2.948 -1.042
303 HB3 GLN 44 1HB GLN 44 8.180 1.689 -1.140
304 HG2 GLN 44 2HG GLN 44 5.518 0.752 -0.212
305 HG3 GLN 44 1HG GLN 44 5.558 1.353 -1.867
306 HE21 GLN 44 1HE2 GLN 44 6.172 -1.388 0.056
307 HE22 GLN 44 2HE2 GLN 44 7.068 -2.274 -1.086
308 H ASN 45 H ASN 45 7.336 4.485 1.590
309 HA ASN 45 HA ASN 45 9.997 5.260 1.046
310 HB2 ASN 45 2HB ASN 45 7.627 6.444 2.346
311 HB3 ASN 45 1HB ASN 45 9.163 7.087 2.918
312 HD21 ASN 45 1HD2 ASN 45 10.412 8.387 1.462
313 HD22 ASN 45 2HD2 ASN 45 9.835 8.844 -0.075
314 H SER 46 H SER 46 8.490 4.009 4.004
315 HA SER 46 HA SER 46 10.777 4.552 5.657
316 HB2 SER 46 2HB SER 46 9.637 3.164 7.328
317 HB3 SER 46 1HB SER 46 8.517 4.317 6.613
318 HG SER 46 HG SER 46 8.219 1.746 6.752
319 H GLY 47 H GLY 47 9.374 1.452 4.547
320 HA2 GLY 47 2HA GLY 47 10.333 -0.564 4.016
321 HA3 GLY 47 1HA GLY 47 11.715 0.373 3.467
322 H ARG 48 H ARG 48 10.262 -0.437 6.650
323 HA ARG 48 HA ARG 48 12.908 -0.713 7.823
324 HB2 ARG 48 2HB ARG 48 10.122 -0.546 8.810
325 HB3 ARG 48 1HB ARG 48 11.159 -1.618 9.746
326 HG2 ARG 48 2HG ARG 48 11.778 0.292 10.825
327 HG3 ARG 48 1HG ARG 48 12.825 0.537 9.431
328 HD2 ARG 48 2HD ARG 48 11.633 2.574 9.661
329 HD3 ARG 48 1HD ARG 48 10.823 1.728 8.345
330 HE ARG 48 HE ARG 48 9.402 0.926 10.502
331 HH11 ARG 48 1HH2 ARG 48 10.360 4.127 9.391
332 HH12 ARG 48 2HH2 ARG 48 8.997 4.897 10.124
333 HH21 ARG 48 1HH1 ARG 48 7.656 1.987 11.424
334 HH22 ARG 48 2HH1 ARG 48 7.484 3.703 11.260
335 H MET 49 H MET 49 13.252 -2.734 9.259
336 HA MET 49 HA MET 49 12.645 -5.114 7.608
337 HB2 MET 49 2HB MET 49 14.969 -4.477 9.434
338 HB3 MET 49 1HB MET 49 14.688 -6.072 8.735
339 HG2 MET 49 2HG MET 49 14.930 -5.244 6.507
340 HG3 MET 49 1HG MET 49 14.855 -3.566 7.051
341 HE1 MET 49 3HE MET 49 16.780 -5.428 5.295
342 HE2 MET 49 1HE MET 49 18.453 -4.989 5.667
343 HE3 MET 49 2HE MET 49 17.276 -3.738 5.277
344 H SER 50 H SER 50 10.714 -4.195 9.457
345 HA SER 50 HA SER 50 10.944 -6.029 11.753
346 HB2 SER 50 2HB SER 50 9.068 -3.745 11.134
347 HB3 SER 50 1HB SER 50 8.811 -4.853 12.478
348 HG SER 50 HG SER 50 11.099 -3.236 12.000
349 HA PRO 51 HA PRO 51 8.061 -8.806 9.834
350 HB2 PRO 51 2HB PRO 51 7.098 -10.175 11.956
351 HB3 PRO 51 1HB PRO 51 8.788 -10.317 11.436
352 HG2 PRO 51 2HG PRO 51 7.630 -8.811 13.715
353 HG3 PRO 51 1HG PRO 51 9.173 -9.671 13.593
354 HD2 PRO 51 2HD PRO 51 8.844 -6.899 13.340
355 HD3 PRO 51 1HD PRO 51 10.263 -7.822 12.799
356 H MET 52 H MET 52 5.689 -9.643 10.093
357 HA MET 52 HA MET 52 3.978 -7.291 10.344
358 HB2 MET 52 2HB MET 52 3.650 -10.044 9.182
359 HB3 MET 52 1HB MET 52 2.237 -9.042 9.512
360 HG2 MET 52 2HG MET 52 2.777 -8.479 7.291
361 HG3 MET 52 1HG MET 52 3.527 -7.186 8.226
362 HE1 MET 52 3HE MET 52 5.550 -8.816 4.973
363 HE2 MET 52 1HE MET 52 4.066 -7.931 5.349
364 HE3 MET 52 2HE MET 52 4.093 -9.690 5.439
365 H GLY 53 H GLY 53 1.655 -7.921 11.215
366 HA2 GLY 53 2HA GLY 53 0.321 -8.768 12.934
367 HA3 GLY 53 1HA GLY 53 1.704 -9.682 13.529
368 H THR 54 H THR 54 1.673 -6.214 12.845
369 HA THR 54 HA THR 54 2.048 -5.681 15.740
370 HB THR 54 HB THR 54 3.127 -3.973 13.498
371 HG1 THR 54 1HG THR 54 4.773 -5.264 13.347
372 HG21 THR 54 3HG2 THR 54 2.871 -3.035 15.816
373 HG22 THR 54 1HG2 THR 54 4.539 -3.074 15.246
374 HG23 THR 54 2HG2 THR 54 3.971 -4.289 16.390
375 H ALA 55 H ALA 55 0.191 -4.860 16.501
376 HA ALA 55 HA ALA 55 -1.443 -3.108 14.802
377 HB1 ALA 55 1HB ALA 55 -3.169 -3.400 16.496
378 HB2 ALA 55 2HB ALA 55 -2.030 -4.242 17.547
379 HB3 ALA 55 3HB ALA 55 -2.531 -4.976 16.024
380 H SER 56 H SER 56 0.211 -3.125 17.950
381 HA SER 56 HA SER 56 -0.449 -0.377 18.521
382 HB2 SER 56 2HB SER 56 1.714 -2.027 19.827
383 HB3 SER 56 1HB SER 56 0.848 -0.650 20.500
384 HG SER 56 HG SER 56 0.105 -2.786 21.178
385 H GLY 57 H GLY 57 1.116 1.344 18.732
386 HA2 GLY 57 2HA GLY 57 3.076 2.504 18.206
387 HA3 GLY 57 1HA GLY 57 3.693 1.060 17.407
388 H SER 58 H SER 58 0.882 3.240 17.003
389 HA SER 58 HA SER 58 1.719 3.891 14.290
390 HB2 SER 58 2HB SER 58 -0.985 2.624 14.758
391 HB3 SER 58 1HB SER 58 -0.279 3.101 13.216
392 HG SER 58 HG SER 58 0.110 0.849 14.721
393 H ASN 59 H ASN 59 -1.220 4.004 16.334
394 HA ASN 59 HA ASN 59 -1.687 6.768 15.543
395 HB2 ASN 59 2HB ASN 59 -3.753 6.548 16.922
396 HB3 ASN 59 1HB ASN 59 -3.629 5.324 15.663
397 HD21 ASN 59 1HD2 ASN 59 -4.376 5.698 18.906
398 HD22 ASN 59 2HD2 ASN 59 -4.048 4.120 19.438
399 H SER 60 H SER 60 -1.221 8.530 16.726
400 HA SER 60 HA SER 60 -0.907 8.430 19.590
401 HB2 SER 60 2HB SER 60 1.283 7.556 18.897
402 HB3 SER 60 1HB SER 60 1.525 8.960 17.860
403 HG SER 60 HG SER 60 2.304 8.829 20.252
404 HA PRO 61 HA PRO 61 -2.442 12.467 17.871
405 HB2 PRO 61 2HB PRO 61 -3.693 12.586 20.566
406 HB3 PRO 61 1HB PRO 61 -4.422 12.833 18.970
407 HG2 PRO 61 2HG PRO 61 -4.890 10.636 20.408
408 HG3 PRO 61 1HG PRO 61 -4.781 10.596 18.638
409 HD2 PRO 61 2HD PRO 61 -2.763 9.713 20.672
410 HD3 PRO 61 1HD PRO 61 -3.157 9.002 19.090
411 H THR 62 H THR 62 -2.074 14.686 18.626
412 HA THR 62 HA THR 62 -0.554 15.189 21.007
413 HB THR 62 HB THR 62 1.248 14.231 19.685
414 HG1 THR 62 1HG THR 62 1.458 17.059 19.661
415 HG21 THR 62 3HG2 THR 62 0.746 16.377 17.612
416 HG22 THR 62 1HG2 THR 62 0.126 14.732 17.455
417 HG23 THR 62 2HG2 THR 62 1.865 15.018 17.510
Start of MODEL 13
1 H1 GLY 1 1HT GLY 1 -19.210 -30.915 -14.549
2 H2 GLY 1 2HT GLY 1 -17.558 -30.850 -14.937
3 H3 GLY 1 3HT GLY 1 -18.661 -31.552 -16.022
4 HA2 GLY 1 2HA GLY 1 -17.860 -29.225 -16.565
5 HA3 GLY 1 1HA GLY 1 -19.600 -29.513 -16.608
6 H SER 2 H SER 2 -17.008 -28.516 -14.360
7 HA SER 2 HA SER 2 -18.954 -26.742 -12.995
8 HB2 SER 2 2HB SER 2 -17.991 -28.536 -11.572
9 HB3 SER 2 1HB SER 2 -16.380 -27.909 -11.907
10 HG SER 2 HG SER 2 -17.611 -27.168 -9.934
11 H MET 3 H MET 3 -18.669 -24.630 -13.326
12 HA MET 3 HA MET 3 -16.193 -23.663 -14.539
13 HB2 MET 3 2HB MET 3 -18.855 -22.344 -13.973
14 HB3 MET 3 1HB MET 3 -17.477 -21.498 -14.675
15 HG2 MET 3 2HG MET 3 -17.439 -23.052 -16.563
16 HG3 MET 3 1HG MET 3 -18.755 -23.985 -15.848
17 HE1 MET 3 3HE MET 3 -18.862 -22.425 -18.966
18 HE2 MET 3 1HE MET 3 -20.613 -22.557 -18.761
19 HE3 MET 3 2HE MET 3 -19.553 -23.823 -18.149
20 H ALA 4 H ALA 4 -15.673 -21.270 -13.694
21 HA ALA 4 HA ALA 4 -15.648 -21.243 -10.748
22 HB1 ALA 4 1HB ALA 4 -13.528 -22.144 -11.067
23 HB2 ALA 4 2HB ALA 4 -13.179 -20.415 -11.058
24 HB3 ALA 4 3HB ALA 4 -13.279 -21.287 -12.587
25 H GLN 5 H GLN 5 -17.199 -19.704 -12.660
26 HA GLN 5 HA GLN 5 -16.092 -16.992 -12.180
27 HB2 GLN 5 2HB GLN 5 -17.739 -18.054 -14.483
28 HB3 GLN 5 1HB GLN 5 -17.530 -16.331 -14.168
29 HG2 GLN 5 2HG GLN 5 -15.803 -16.817 -15.693
30 HG3 GLN 5 1HG GLN 5 -14.993 -16.861 -14.128
31 HE21 GLN 5 1HE2 GLN 5 -16.796 -19.143 -16.279
32 HE22 GLN 5 2HE2 GLN 5 -15.739 -20.453 -15.999
33 H GLU 6 H GLU 6 -17.677 -18.507 -10.302
34 HA GLU 6 HA GLU 6 -20.411 -17.630 -10.419
35 HB2 GLU 6 2HB GLU 6 -18.761 -18.802 -8.169
36 HB3 GLU 6 1HB GLU 6 -20.490 -18.475 -8.063
37 HG2 GLU 6 2HG GLU 6 -21.001 -20.060 -9.765
38 HG3 GLU 6 1HG GLU 6 -19.312 -20.181 -10.261
39 H THR 7 H THR 7 -21.432 -16.059 -9.145
40 HA THR 7 HA THR 7 -19.836 -13.718 -8.609
41 HB THR 7 HB THR 7 -22.053 -13.457 -9.586
42 HG1 THR 7 1HG THR 7 -22.641 -11.815 -8.311
43 HG21 THR 7 3HG2 THR 7 -22.940 -14.919 -7.096
44 HG22 THR 7 1HG2 THR 7 -23.301 -15.305 -8.779
45 HG23 THR 7 2HG2 THR 7 -24.048 -13.902 -8.016
46 H ASN 8 H ASN 8 -19.620 -12.644 -6.598
47 HA ASN 8 HA ASN 8 -20.159 -14.289 -4.196
48 HB2 ASN 8 2HB ASN 8 -17.732 -14.348 -5.021
49 HB3 ASN 8 1HB ASN 8 -17.649 -12.651 -4.554
50 HD21 ASN 8 1HD2 ASN 8 -17.376 -12.177 -2.332
51 HD22 ASN 8 2HD2 ASN 8 -17.361 -13.369 -1.110
52 H GLN 9 H GLN 9 -21.709 -12.102 -5.279
53 HA GLN 9 HA GLN 9 -21.112 -9.679 -3.871
54 HB2 GLN 9 2HB GLN 9 -23.650 -10.655 -5.199
55 HB3 GLN 9 1HB GLN 9 -23.435 -9.034 -4.538
56 HG2 GLN 9 2HG GLN 9 -21.455 -10.150 -6.514
57 HG3 GLN 9 1HG GLN 9 -22.957 -9.413 -7.071
58 HE21 GLN 9 1HE2 GLN 9 -23.383 -7.162 -5.843
59 HE22 GLN 9 2HE2 GLN 9 -22.022 -6.137 -5.760
60 H THR 10 H THR 10 -21.380 -9.283 -1.785
61 HA THR 10 HA THR 10 -23.660 -10.386 -0.332
62 HB THR 10 HB THR 10 -21.973 -11.021 1.550
63 HG1 THR 10 1HG THR 10 -19.959 -11.598 0.764
64 HG21 THR 10 3HG2 THR 10 -23.347 -12.496 -0.246
65 HG22 THR 10 1HG2 THR 10 -22.243 -13.215 0.926
66 HG23 THR 10 2HG2 THR 10 -21.704 -12.921 -0.726
67 HA PRO 11 HA PRO 11 -23.639 -6.461 1.720
68 HB2 PRO 11 2HB PRO 11 -23.755 -7.173 4.437
69 HB3 PRO 11 1HB PRO 11 -25.141 -6.986 3.349
70 HG2 PRO 11 2HG PRO 11 -23.762 -9.448 4.246
71 HG3 PRO 11 1HG PRO 11 -25.471 -9.176 3.869
72 HD2 PRO 11 2HD PRO 11 -23.810 -10.502 2.182
73 HD3 PRO 11 1HD PRO 11 -25.164 -9.513 1.595
74 H GLY 12 H GLY 12 -21.657 -5.519 1.383
75 HA2 GLY 12 2HA GLY 12 -19.747 -5.530 3.563
76 HA3 GLY 12 1HA GLY 12 -19.142 -6.250 2.073
77 HA PRO 13 HA PRO 13 -19.914 -1.808 0.507
78 HB2 PRO 13 2HB PRO 13 -21.308 -0.007 2.024
79 HB3 PRO 13 1HB PRO 13 -22.075 -1.111 0.862
80 HG2 PRO 13 2HG PRO 13 -21.832 -1.352 3.826
81 HG3 PRO 13 1HG PRO 13 -23.219 -1.696 2.775
82 HD2 PRO 13 2HD PRO 13 -21.612 -3.667 3.745
83 HD3 PRO 13 1HD PRO 13 -22.411 -3.783 2.159
84 H MET 14 H MET 14 -17.652 -2.250 1.431
85 HA MET 14 HA MET 14 -16.800 -0.838 3.769
86 HB2 MET 14 2HB MET 14 -15.384 -2.242 1.521
87 HB3 MET 14 1HB MET 14 -14.484 -1.323 2.728
88 HG2 MET 14 2HG MET 14 -16.541 -3.375 3.526
89 HG3 MET 14 1HG MET 14 -14.867 -3.832 3.210
90 HE1 MET 14 3HE MET 14 -15.341 -3.841 7.114
91 HE2 MET 14 1HE MET 14 -14.600 -4.737 5.782
92 HE3 MET 14 2HE MET 14 -16.329 -4.404 5.768
93 H LEU 15 H LEU 15 -17.219 1.342 3.678
94 HA LEU 15 HA LEU 15 -16.557 2.940 1.367
95 HB2 LEU 15 2HB LEU 15 -18.032 3.268 3.819
96 HB3 LEU 15 1HB LEU 15 -16.865 4.581 3.695
97 HG LEU 15 HG LEU 15 -17.702 5.061 1.387
98 HD11 LEU 15 1HD1 LEU 15 -19.940 4.017 0.803
99 HD12 LEU 15 2HD1 LEU 15 -19.656 2.862 2.105
100 HD13 LEU 15 3HD1 LEU 15 -18.562 2.918 0.722
101 HD21 LEU 15 3HD2 LEU 15 -19.975 4.993 3.383
102 HD22 LEU 15 1HD2 LEU 15 -19.702 6.172 2.100
103 HD23 LEU 15 2HD2 LEU 15 -18.635 6.132 3.503
104 H CYS 16 H CYS 16 -14.805 4.339 1.105
105 HA CYS 16 HA CYS 16 -12.307 3.570 1.953
106 HB2 CYS 16 2HB CYS 16 -12.950 5.259 0.132
107 HB3 CYS 16 1HB CYS 16 -12.926 6.467 1.422
108 H SER 17 H SER 17 -11.238 3.583 3.786
109 HA SER 17 HA SER 17 -12.242 4.657 6.204
110 HB2 SER 17 2HB SER 17 -9.373 3.888 5.694
111 HB3 SER 17 1HB SER 17 -10.263 3.816 7.215
112 HG SER 17 HG SER 17 -9.978 1.889 5.533
113 H THR 18 H THR 18 -9.989 5.946 3.823
114 HA THR 18 HA THR 18 -8.806 7.939 5.441
115 HB THR 18 HB THR 18 -8.064 8.963 3.373
116 HG1 THR 18 1HG THR 18 -9.427 8.902 1.798
117 HG21 THR 18 3HG2 THR 18 -7.295 6.557 4.218
118 HG22 THR 18 1HG2 THR 18 -6.701 7.221 2.694
119 HG23 THR 18 2HG2 THR 18 -8.024 6.056 2.693
120 H GLY 19 H GLY 19 -11.950 7.821 3.935
121 HA2 GLY 19 2HA GLY 19 -13.716 9.256 4.483
122 HA3 GLY 19 1HA GLY 19 -12.549 10.422 5.105
123 H CYS 20 H CYS 20 -12.466 8.890 1.893
124 HA CYS 20 HA CYS 20 -12.435 11.547 0.687
125 HB2 CYS 20 2HB CYS 20 -11.840 10.445 -1.400
126 HB3 CYS 20 1HB CYS 20 -10.822 9.832 -0.098
127 H GLY 21 H GLY 21 -14.786 9.137 1.383
128 HA2 GLY 21 2HA GLY 21 -17.088 9.374 1.191
129 HA3 GLY 21 1HA GLY 21 -16.845 10.687 0.050
130 H PHE 22 H PHE 22 -15.023 7.885 -0.750
131 HA PHE 22 HA PHE 22 -17.024 7.159 -2.790
132 HB2 PHE 22 2HB PHE 22 -14.007 7.173 -2.848
133 HB3 PHE 22 1HB PHE 22 -14.982 6.335 -4.063
134 HD1 PHE 22 2HD PHE 22 -16.823 7.692 -5.257
135 HD2 PHE 22 1HD PHE 22 -13.618 9.493 -3.033
136 HE1 PHE 22 2HE PHE 22 -17.223 9.840 -6.426
137 HE2 PHE 22 1HE PHE 22 -14.019 11.646 -4.203
138 HZ PHE 22 HZ PHE 22 -15.824 11.817 -5.896
139 H TYR 23 H TYR 23 -16.483 4.915 -3.705
140 HA TYR 23 HA TYR 23 -16.856 3.014 -1.555
141 HB2 TYR 23 2HB TYR 23 -18.009 3.104 -3.899
142 HB3 TYR 23 1HB TYR 23 -16.563 2.253 -4.447
143 HD1 TYR 23 2HD TYR 23 -18.903 2.115 -1.502
144 HD2 TYR 23 1HD TYR 23 -16.727 -0.058 -4.503
145 HE1 TYR 23 2HE TYR 23 -19.824 -0.006 -0.622
146 HE2 TYR 23 1HE TYR 23 -17.653 -2.186 -3.627
147 HH TYR 23 HH TYR 23 -19.975 -2.729 -2.207
148 H GLY 24 H GLY 24 -15.486 1.388 -0.893
149 HA2 GLY 24 2HA GLY 24 -12.782 1.324 -2.128
150 HA3 GLY 24 1HA GLY 24 -13.030 1.264 -0.379
151 H ASN 25 H ASN 25 -11.619 -0.769 -1.019
152 HA ASN 25 HA ASN 25 -13.481 -3.056 -1.289
153 HB2 ASN 25 2HB ASN 25 -11.818 -2.468 -3.280
154 HB3 ASN 25 1HB ASN 25 -10.669 -3.332 -2.272
155 HD21 ASN 25 1HD2 ASN 25 -14.167 -3.857 -3.037
156 HD22 ASN 25 2HD2 ASN 25 -13.962 -5.491 -3.479
157 HA PRO 26 HA PRO 26 -11.394 -4.288 2.465
158 HB2 PRO 26 2HB PRO 26 -12.414 -6.805 2.752
159 HB3 PRO 26 1HB PRO 26 -13.311 -5.322 3.118
160 HG2 PRO 26 2HG PRO 26 -13.542 -7.147 0.810
161 HG3 PRO 26 1HG PRO 26 -14.769 -6.133 1.582
162 HD2 PRO 26 2HD PRO 26 -13.422 -5.540 -0.814
163 HD3 PRO 26 1HD PRO 26 -14.376 -4.403 0.156
164 H ARG 27 H ARG 27 -10.922 -5.892 -0.586
165 HA ARG 27 HA ARG 27 -8.965 -7.810 0.344
166 HB2 ARG 27 2HB ARG 27 -9.614 -6.786 -2.432
167 HB3 ARG 27 1HB ARG 27 -8.507 -8.109 -2.079
168 HG2 ARG 27 2HG ARG 27 -10.247 -9.491 -1.252
169 HG3 ARG 27 1HG ARG 27 -11.368 -8.136 -1.118
170 HD2 ARG 27 2HD ARG 27 -11.226 -7.873 -3.619
171 HD3 ARG 27 1HD ARG 27 -10.289 -9.362 -3.668
172 HE ARG 27 HE ARG 27 -12.605 -9.977 -2.276
173 HH11 ARG 27 1HH2 ARG 27 -11.793 -8.844 -5.508
174 HH12 ARG 27 2HH2 ARG 27 -13.236 -9.493 -6.207
175 HH21 ARG 27 1HH1 ARG 27 -14.447 -10.813 -3.250
176 HH22 ARG 27 2HH1 ARG 27 -14.717 -10.596 -4.948
177 H THR 28 H THR 28 -9.032 -4.567 -1.010
178 HA THR 28 HA THR 28 -6.155 -4.328 -1.298
179 HB THR 28 HB THR 28 -6.617 -1.948 -1.717
180 HG1 THR 28 1HG THR 28 -8.288 -1.085 -0.828
181 HG21 THR 28 3HG2 THR 28 -8.560 -2.336 -3.460
182 HG22 THR 28 1HG2 THR 28 -8.323 -4.028 -3.030
183 HG23 THR 28 2HG2 THR 28 -6.986 -3.095 -3.695
184 H ASN 29 H ASN 29 -5.922 -1.719 0.135
185 HA ASN 29 HA ASN 29 -5.560 -2.823 2.819
186 HB2 ASN 29 2HB ASN 29 -4.555 -0.375 1.400
187 HB3 ASN 29 1HB ASN 29 -4.445 -0.509 3.157
188 HD21 ASN 29 1HD2 ASN 29 -2.258 -1.011 3.517
189 HD22 ASN 29 2HD2 ASN 29 -1.439 -2.304 2.760
190 H GLY 30 H GLY 30 -8.314 -2.070 1.774
191 HA2 GLY 30 2HA GLY 30 -10.200 -1.354 2.895
192 HA3 GLY 30 1HA GLY 30 -9.166 -0.600 4.109
193 H MET 31 H MET 31 -8.144 0.288 0.993
194 HA MET 31 HA MET 31 -9.622 2.841 1.145
195 HB2 MET 31 2HB MET 31 -6.785 2.127 0.492
196 HB3 MET 31 1HB MET 31 -7.496 3.570 -0.236
197 HG2 MET 31 2HG MET 31 -6.553 4.365 1.754
198 HG3 MET 31 1HG MET 31 -8.247 4.153 2.172
199 HE1 MET 31 3HE MET 31 -5.476 4.456 3.456
200 HE2 MET 31 1HE MET 31 -4.612 2.980 3.904
201 HE3 MET 31 2HE MET 31 -5.786 3.688 5.009
202 H CYS 32 H CYS 32 -9.898 3.938 -0.945
203 HA CYS 32 HA CYS 32 -10.948 2.140 -2.916
204 HB2 CYS 32 2HB CYS 32 -11.738 4.158 -4.041
205 HB3 CYS 32 1HB CYS 32 -12.076 4.270 -2.316
206 H SER 33 H SER 33 -10.242 3.691 -5.308
207 HA SER 33 HA SER 33 -7.765 2.369 -5.897
208 HB2 SER 33 2HB SER 33 -9.892 3.199 -7.406
209 HB3 SER 33 1HB SER 33 -8.673 4.395 -7.831
210 HG SER 33 HG SER 33 -8.534 2.523 -9.133
211 H VAL 34 H VAL 34 -8.673 5.825 -5.654
212 HA VAL 34 HA VAL 34 -6.066 6.791 -6.237
213 HB VAL 34 HB VAL 34 -8.176 8.280 -4.663
214 HG11 VAL 34 1HG1 VAL 34 -5.865 9.098 -6.444
215 HG12 VAL 34 2HG1 VAL 34 -6.078 9.446 -4.727
216 HG13 VAL 34 3HG1 VAL 34 -7.122 10.220 -5.919
217 HG21 VAL 34 3HG2 VAL 34 -8.072 7.509 -7.553
218 HG22 VAL 34 1HG2 VAL 34 -8.607 9.146 -7.169
219 HG23 VAL 34 2HG2 VAL 34 -9.467 7.759 -6.507
220 H CYS 35 H CYS 35 -7.810 6.667 -3.112
221 HA CYS 35 HA CYS 35 -5.744 7.619 -1.504
222 HB2 CYS 35 2HB CYS 35 -7.941 5.669 -0.777
223 HB3 CYS 35 1HB CYS 35 -6.941 6.553 0.376
224 H TYR 36 H TYR 36 -6.361 4.320 -2.624
225 HA TYR 36 HA TYR 36 -4.627 2.943 -0.919
226 HB2 TYR 36 2HB TYR 36 -6.222 1.769 -2.327
227 HB3 TYR 36 1HB TYR 36 -5.384 2.310 -3.780
228 HD1 TYR 36 2HD TYR 36 -4.237 0.806 -0.514
229 HD2 TYR 36 1HD TYR 36 -4.266 0.546 -4.803
230 HE1 TYR 36 2HE TYR 36 -2.748 -1.171 -0.404
231 HE2 TYR 36 1HE TYR 36 -2.777 -1.435 -4.692
232 HH TYR 36 HH TYR 36 -1.058 -2.351 -3.007
233 H LYS 37 H LYS 37 -3.910 4.584 -3.987
234 HA LYS 37 HA LYS 37 -1.190 3.684 -4.086
235 HB2 LYS 37 2HB LYS 37 -2.665 4.480 -6.040
236 HB3 LYS 37 1HB LYS 37 -2.274 6.114 -5.505
237 HG2 LYS 37 2HG LYS 37 0.112 5.665 -5.755
238 HG3 LYS 37 1HG LYS 37 -0.217 3.987 -6.175
239 HD2 LYS 37 2HD LYS 37 -1.336 4.642 -8.211
240 HD3 LYS 37 1HD LYS 37 -1.275 6.343 -7.758
241 HE2 LYS 37 2HE LYS 37 1.357 4.977 -7.812
242 HE3 LYS 37 1HE LYS 37 0.563 5.134 -9.379
243 HZ1 LYS 37 3HZ LYS 37 1.007 7.368 -7.472
244 HZ2 LYS 37 1HZ LYS 37 0.327 7.489 -9.021
245 HZ3 LYS 37 2HZ LYS 37 1.960 7.054 -8.842
246 H GLU 38 H GLU 38 -2.804 6.709 -3.166
247 HA GLU 38 HA GLU 38 -0.578 8.276 -2.634
248 HB2 GLU 38 2HB GLU 38 -3.287 8.280 -1.297
249 HB3 GLU 38 1HB GLU 38 -2.075 9.547 -1.086
250 HG2 GLU 38 2HG GLU 38 -3.004 8.696 -3.827
251 HG3 GLU 38 1HG GLU 38 -3.869 9.925 -2.899
252 H HIS 39 H HIS 39 -2.153 5.916 -0.450
253 HA HIS 39 HA HIS 39 -0.322 6.697 1.690
254 HB2 HIS 39 2HB HIS 39 -1.564 5.384 3.182
255 HB3 HIS 39 1HB HIS 39 -2.755 6.099 2.104
256 HD1 HIS 39 1HD HIS 39 -4.521 4.454 1.575
257 HD2 HIS 39 2HD HIS 39 -0.823 2.575 1.954
258 HE1 HIS 39 1HE HIS 39 -4.935 1.975 1.272
259 HE2 HIS 39 2HE HIS 39 -2.690 0.821 1.479
260 H LEU 40 H LEU 40 -0.639 4.056 -0.594
261 HA LEU 40 HA LEU 40 1.231 2.288 0.620
262 HB2 LEU 40 2HB LEU 40 -0.467 1.812 -1.255
263 HB3 LEU 40 1HB LEU 40 0.739 2.478 -2.356
264 HG LEU 40 HG LEU 40 1.679 0.413 -0.403
265 HD11 LEU 40 1HD1 LEU 40 0.918 -1.415 -1.913
266 HD12 LEU 40 2HD1 LEU 40 -0.017 -0.237 -2.831
267 HD13 LEU 40 3HD1 LEU 40 -0.431 -0.573 -1.152
268 HD21 LEU 40 3HD2 LEU 40 2.184 0.509 -3.375
269 HD22 LEU 40 1HD2 LEU 40 3.238 -0.083 -2.093
270 HD23 LEU 40 2HD2 LEU 40 2.998 1.649 -2.308
271 H GLN 41 H GLN 41 1.590 5.097 -1.476
272 HA GLN 41 HA GLN 41 4.204 4.724 -2.418
273 HB2 GLN 41 2HB GLN 41 2.426 6.522 -2.999
274 HB3 GLN 41 1HB GLN 41 3.114 7.421 -1.650
275 HG2 GLN 41 2HG GLN 41 4.388 8.211 -3.421
276 HG3 GLN 41 1HG GLN 41 5.401 6.892 -2.836
277 HE21 GLN 41 1HE2 GLN 41 6.262 5.874 -4.653
278 HE22 GLN 41 2HE2 GLN 41 5.368 5.450 -6.043
279 H ARG 42 H ARG 42 3.030 6.128 0.615
280 HA ARG 42 HA ARG 42 5.721 6.737 1.538
281 HB2 ARG 42 2HB ARG 42 3.422 7.984 2.034
282 HB3 ARG 42 1HB ARG 42 3.350 6.826 3.362
283 HG2 ARG 42 2HG ARG 42 5.706 7.545 3.976
284 HG3 ARG 42 1HG ARG 42 5.535 8.846 2.797
285 HD2 ARG 42 2HD ARG 42 3.426 8.465 4.904
286 HD3 ARG 42 1HD ARG 42 4.927 9.288 5.315
287 HE ARG 42 HE ARG 42 3.990 10.481 2.976
288 HH11 ARG 42 1HH2 ARG 42 2.797 10.062 6.258
289 HH12 ARG 42 2HH2 ARG 42 1.970 11.580 6.260
290 HH21 ARG 42 1HH1 ARG 42 2.899 12.442 3.045
291 HH22 ARG 42 2HH1 ARG 42 2.028 12.913 4.466
292 H GLN 43 H GLN 43 3.313 4.224 1.920
293 HA GLN 43 HA GLN 43 4.412 2.986 4.261
294 HB2 GLN 43 2HB GLN 43 2.059 2.677 3.320
295 HB3 GLN 43 1HB GLN 43 2.788 1.627 2.104
296 HG2 GLN 43 2HG GLN 43 3.662 0.155 3.839
297 HG3 GLN 43 1HG GLN 43 3.055 1.232 5.098
298 HE21 GLN 43 1HE2 GLN 43 2.125 -1.216 2.744
299 HE22 GLN 43 2HE2 GLN 43 0.510 -1.349 3.252
300 H GLN 44 H GLN 44 4.710 2.428 0.773
301 HA GLN 44 HA GLN 44 6.427 0.171 0.938
302 HB2 GLN 44 2HB GLN 44 5.018 1.000 -1.052
303 HB3 GLN 44 1HB GLN 44 6.368 2.087 -1.382
304 HG2 GLN 44 2HG GLN 44 7.898 0.122 -1.427
305 HG3 GLN 44 1HG GLN 44 6.504 -0.936 -1.202
306 HE21 GLN 44 1HE2 GLN 44 5.100 -1.295 -3.022
307 HE22 GLN 44 2HE2 GLN 44 5.461 -0.704 -4.581
308 H ASN 45 H ASN 45 7.056 3.619 1.076
309 HA ASN 45 HA ASN 45 9.785 3.615 0.337
310 HB2 ASN 45 2HB ASN 45 8.216 5.619 0.654
311 HB3 ASN 45 1HB ASN 45 8.592 5.490 2.370
312 HD21 ASN 45 1HD2 ASN 45 10.308 5.641 -0.806
313 HD22 ASN 45 2HD2 ASN 45 11.607 6.578 -0.217
314 H SER 46 H SER 46 8.252 3.371 3.554
315 HA SER 46 HA SER 46 10.867 2.665 4.722
316 HB2 SER 46 2HB SER 46 9.570 2.902 6.904
317 HB3 SER 46 1HB SER 46 9.802 4.382 5.976
318 HG SER 46 HG SER 46 7.727 4.434 5.532
319 H GLY 47 H GLY 47 7.470 1.632 5.190
320 HA2 GLY 47 2HA GLY 47 6.542 -0.492 5.158
321 HA3 GLY 47 1HA GLY 47 8.106 -1.134 4.671
322 H ARG 48 H ARG 48 7.545 0.869 7.523
323 HA ARG 48 HA ARG 48 8.428 -1.388 9.216
324 HB2 ARG 48 2HB ARG 48 8.401 1.587 9.796
325 HB3 ARG 48 1HB ARG 48 9.013 0.332 10.874
326 HG2 ARG 48 2HG ARG 48 10.067 0.594 8.062
327 HG3 ARG 48 1HG ARG 48 10.721 1.585 9.367
328 HD2 ARG 48 2HD ARG 48 11.386 -0.356 10.615
329 HD3 ARG 48 1HD ARG 48 10.506 -1.428 9.531
330 HE ARG 48 HE ARG 48 12.487 0.085 8.121
331 HH11 ARG 48 1HH2 ARG 48 12.080 -2.726 10.198
332 HH12 ARG 48 2HH2 ARG 48 13.529 -3.480 9.629
333 HH21 ARG 48 1HH1 ARG 48 14.348 -0.947 7.425
334 HH22 ARG 48 2HH1 ARG 48 14.798 -2.487 8.079
335 H MET 49 H MET 49 7.410 -1.584 11.353
336 HA MET 49 HA MET 49 4.515 -1.044 11.188
337 HB2 MET 49 2HB MET 49 6.082 -2.998 12.889
338 HB3 MET 49 1HB MET 49 4.328 -2.809 12.921
339 HG2 MET 49 2HG MET 49 4.431 -3.211 10.371
340 HG3 MET 49 1HG MET 49 6.063 -3.809 10.663
341 HE1 MET 49 3HE MET 49 3.291 -5.981 9.636
342 HE2 MET 49 1HE MET 49 4.656 -7.031 10.041
343 HE3 MET 49 2HE MET 49 4.939 -5.459 9.297
344 H SER 50 H SER 50 7.356 -0.610 13.244
345 HA SER 50 HA SER 50 5.831 1.355 14.842
346 HB2 SER 50 2HB SER 50 7.218 0.575 16.817
347 HB3 SER 50 1HB SER 50 5.977 -0.549 16.272
348 HG SER 50 HG SER 50 8.178 -1.407 16.640
349 HA PRO 51 HA PRO 51 9.312 3.984 14.066
350 HB2 PRO 51 2HB PRO 51 9.369 5.576 16.288
351 HB3 PRO 51 1HB PRO 51 8.129 5.711 15.026
352 HG2 PRO 51 2HG PRO 51 7.972 4.433 17.702
353 HG3 PRO 51 1HG PRO 51 6.749 5.353 16.811
354 HD2 PRO 51 2HD PRO 51 6.786 2.597 16.972
355 HD3 PRO 51 1HD PRO 51 6.017 3.507 15.655
356 H MET 52 H MET 52 11.330 3.147 14.052
357 HA MET 52 HA MET 52 12.474 1.917 16.430
358 HB2 MET 52 2HB MET 52 12.703 1.196 13.892
359 HB3 MET 52 1HB MET 52 14.034 2.353 13.908
360 HG2 MET 52 2HG MET 52 13.806 0.281 16.082
361 HG3 MET 52 1HG MET 52 14.520 -0.143 14.528
362 HE1 MET 52 3HE MET 52 16.640 -0.830 15.811
363 HE2 MET 52 1HE MET 52 15.988 -0.295 17.367
364 HE3 MET 52 2HE MET 52 17.594 0.220 16.856
365 H GLY 53 H GLY 53 13.024 4.755 14.375
366 HA2 GLY 53 2HA GLY 53 13.809 6.840 15.169
367 HA3 GLY 53 1HA GLY 53 14.501 6.027 16.568
368 H THR 54 H THR 54 14.905 5.031 13.199
369 HA THR 54 HA THR 54 17.813 5.506 13.459
370 HB THR 54 HB THR 54 16.462 3.726 11.431
371 HG1 THR 54 1HG THR 54 16.594 2.100 12.856
372 HG21 THR 54 3HG2 THR 54 18.795 2.616 11.714
373 HG22 THR 54 1HG2 THR 54 19.258 4.143 12.464
374 HG23 THR 54 2HG2 THR 54 18.690 4.118 10.795
375 H ALA 55 H ALA 55 18.945 6.526 11.785
376 HA ALA 55 HA ALA 55 17.485 8.532 10.349
377 HB1 ALA 55 1HB ALA 55 19.611 9.309 9.599
378 HB2 ALA 55 2HB ALA 55 20.365 7.743 9.899
379 HB3 ALA 55 3HB ALA 55 19.852 8.749 11.255
380 H SER 56 H SER 56 18.361 8.815 7.899
381 HA SER 56 HA SER 56 17.045 6.762 6.411
382 HB2 SER 56 2HB SER 56 18.879 8.871 5.271
383 HB3 SER 56 1HB SER 56 17.529 8.067 4.478
384 HG SER 56 HG SER 56 17.033 10.191 5.270
385 H GLY 57 H GLY 57 20.447 7.652 6.909
386 HA2 GLY 57 2HA GLY 57 22.138 5.934 7.066
387 HA3 GLY 57 1HA GLY 57 21.232 4.987 5.891
388 H SER 58 H SER 58 23.173 7.926 6.303
389 HA SER 58 HA SER 58 23.919 7.765 3.438
390 HB2 SER 58 2HB SER 58 24.213 10.258 3.558
391 HB3 SER 58 1HB SER 58 22.544 9.723 3.722
392 HG SER 58 HG SER 58 23.477 11.320 5.307
393 H ASN 59 H ASN 59 25.236 6.490 5.705
394 HA ASN 59 HA ASN 59 27.663 8.075 6.122
395 HB2 ASN 59 2HB ASN 59 28.320 6.205 7.637
396 HB3 ASN 59 1HB ASN 59 26.793 6.958 8.084
397 HD21 ASN 59 1HD2 ASN 59 28.293 3.969 7.145
398 HD22 ASN 59 2HD2 ASN 59 26.876 3.036 7.096
399 H SER 60 H SER 60 29.540 7.745 5.087
400 HA SER 60 HA SER 60 29.626 5.705 2.992
401 HB2 SER 60 2HB SER 60 31.666 7.847 3.607
402 HB3 SER 60 1HB SER 60 31.507 6.920 2.119
403 HG SER 60 HG SER 60 30.451 9.205 2.556
404 HA PRO 61 HA PRO 61 32.417 3.114 5.272
405 HB2 PRO 61 2HB PRO 61 33.788 1.841 3.317
406 HB3 PRO 61 1HB PRO 61 32.055 1.567 3.582
407 HG2 PRO 61 2HG PRO 61 33.414 3.218 1.517
408 HG3 PRO 61 1HG PRO 61 31.976 2.195 1.378
409 HD2 PRO 61 2HD PRO 61 31.913 4.958 1.663
410 HD3 PRO 61 1HD PRO 61 30.566 3.872 2.070
411 H THR 62 H THR 62 34.372 3.282 6.287
412 HA THR 62 HA THR 62 36.726 4.298 4.977
413 HB THR 62 HB THR 62 35.641 6.429 5.374
414 HG1 THR 62 1HG THR 62 37.581 6.012 7.403
415 HG21 THR 62 3HG2 THR 62 34.040 6.035 7.059
416 HG22 THR 62 1HG2 THR 62 35.235 7.053 7.861
417 HG23 THR 62 2HG2 THR 62 35.226 5.312 8.145
Start of MODEL 14
1 H1 GLY 1 1HT GLY 1 -27.002 -17.360 -13.155
2 H2 GLY 1 2HT GLY 1 -26.181 -15.916 -12.796
3 H3 GLY 1 3HT GLY 1 -27.740 -15.867 -13.469
4 HA2 GLY 1 2HA GLY 1 -28.737 -16.690 -11.507
5 HA3 GLY 1 1HA GLY 1 -27.157 -17.076 -10.826
6 H SER 2 H SER 2 -29.293 -14.433 -11.804
7 HA SER 2 HA SER 2 -27.979 -12.693 -9.819
8 HB2 SER 2 2HB SER 2 -28.837 -11.666 -12.524
9 HB3 SER 2 1HB SER 2 -27.870 -10.843 -11.303
10 HG SER 2 HG SER 2 -26.695 -11.817 -13.114
11 H MET 3 H MET 3 -29.370 -11.544 -8.588
12 HA MET 3 HA MET 3 -32.147 -11.183 -9.475
13 HB2 MET 3 2HB MET 3 -31.260 -12.708 -7.037
14 HB3 MET 3 1HB MET 3 -32.823 -11.892 -7.078
15 HG2 MET 3 2HG MET 3 -33.391 -13.127 -9.158
16 HG3 MET 3 1HG MET 3 -31.851 -13.983 -9.048
17 HE1 MET 3 3HE MET 3 -32.015 -16.177 -6.051
18 HE2 MET 3 1HE MET 3 -31.047 -14.942 -6.870
19 HE3 MET 3 2HE MET 3 -31.671 -16.320 -7.772
20 H ALA 4 H ALA 4 -32.725 -9.133 -9.135
21 HA ALA 4 HA ALA 4 -31.514 -7.660 -6.868
22 HB1 ALA 4 1HB ALA 4 -30.566 -7.002 -9.107
23 HB2 ALA 4 2HB ALA 4 -31.341 -5.685 -8.229
24 HB3 ALA 4 3HB ALA 4 -32.181 -6.467 -9.567
25 H GLN 5 H GLN 5 -34.055 -9.093 -6.964
26 HA GLN 5 HA GLN 5 -36.147 -7.114 -7.247
27 HB2 GLN 5 2HB GLN 5 -36.362 -9.646 -7.642
28 HB3 GLN 5 1HB GLN 5 -36.417 -9.789 -5.883
29 HG2 GLN 5 2HG GLN 5 -38.690 -9.621 -6.547
30 HG3 GLN 5 1HG GLN 5 -38.269 -8.013 -5.959
31 HE21 GLN 5 1HE2 GLN 5 -38.187 -6.274 -7.492
32 HE22 GLN 5 2HE2 GLN 5 -38.687 -6.464 -9.113
33 H GLU 6 H GLU 6 -34.982 -9.079 -4.487
34 HA GLU 6 HA GLU 6 -35.955 -6.984 -2.645
35 HB2 GLU 6 2HB GLU 6 -35.261 -9.899 -2.227
36 HB3 GLU 6 1HB GLU 6 -35.635 -8.788 -0.910
37 HG2 GLU 6 2HG GLU 6 -37.847 -8.365 -1.828
38 HG3 GLU 6 1HG GLU 6 -37.478 -9.339 -3.252
39 H THR 7 H THR 7 -34.413 -5.536 -2.147
40 HA THR 7 HA THR 7 -31.599 -6.297 -2.137
41 HB THR 7 HB THR 7 -32.683 -3.607 -1.328
42 HG1 THR 7 1HG THR 7 -32.200 -4.567 -3.956
43 HG21 THR 7 3HG2 THR 7 -30.253 -4.184 -1.066
44 HG22 THR 7 1HG2 THR 7 -30.546 -2.835 -2.164
45 HG23 THR 7 2HG2 THR 7 -30.174 -4.433 -2.811
46 H ASN 8 H ASN 8 -30.647 -7.098 -0.382
47 HA ASN 8 HA ASN 8 -31.905 -6.798 2.237
48 HB2 ASN 8 2HB ASN 8 -30.980 -8.995 1.284
49 HB3 ASN 8 1HB ASN 8 -29.385 -8.332 1.628
50 HD21 ASN 8 1HD2 ASN 8 -32.530 -8.385 3.425
51 HD22 ASN 8 2HD2 ASN 8 -31.840 -8.946 4.880
52 H GLN 9 H GLN 9 -28.644 -6.342 0.831
53 HA GLN 9 HA GLN 9 -27.877 -4.686 3.113
54 HB2 GLN 9 2HB GLN 9 -25.636 -4.660 2.022
55 HB3 GLN 9 1HB GLN 9 -26.229 -6.290 2.332
56 HG2 GLN 9 2HG GLN 9 -26.686 -6.693 0.065
57 HG3 GLN 9 1HG GLN 9 -26.747 -4.976 -0.326
58 HE21 GLN 9 1HE2 GLN 9 -24.895 -4.171 -1.315
59 HE22 GLN 9 2HE2 GLN 9 -23.347 -4.878 -1.204
60 H THR 10 H THR 10 -27.102 -2.529 2.898
61 HA THR 10 HA THR 10 -28.493 -1.025 0.806
62 HB THR 10 HB THR 10 -27.584 0.937 2.270
63 HG1 THR 10 1HG THR 10 -26.246 0.087 3.679
64 HG21 THR 10 3HG2 THR 10 -29.654 -1.057 3.221
65 HG22 THR 10 1HG2 THR 10 -29.931 0.357 2.204
66 HG23 THR 10 2HG2 THR 10 -29.465 0.561 3.893
67 HA PRO 11 HA PRO 11 -24.781 -0.114 -1.447
68 HB2 PRO 11 2HB PRO 11 -25.282 2.326 -2.510
69 HB3 PRO 11 1HB PRO 11 -26.169 0.875 -3.014
70 HG2 PRO 11 2HG PRO 11 -26.994 3.038 -1.135
71 HG3 PRO 11 1HG PRO 11 -27.937 2.210 -2.388
72 HD2 PRO 11 2HD PRO 11 -28.088 1.575 0.286
73 HD3 PRO 11 1HD PRO 11 -28.431 0.418 -1.020
74 H GLY 12 H GLY 12 -22.860 1.221 -1.554
75 HA2 GLY 12 2HA GLY 12 -21.184 2.546 -0.715
76 HA3 GLY 12 1HA GLY 12 -22.433 3.522 0.055
77 HA PRO 13 HA PRO 13 -21.720 0.399 3.525
78 HB2 PRO 13 2HB PRO 13 -20.512 -2.021 3.089
79 HB3 PRO 13 1HB PRO 13 -22.253 -1.734 2.904
80 HG2 PRO 13 2HG PRO 13 -20.136 -1.935 0.826
81 HG3 PRO 13 1HG PRO 13 -21.818 -2.493 0.795
82 HD2 PRO 13 2HD PRO 13 -20.941 -0.188 -0.441
83 HD3 PRO 13 1HD PRO 13 -22.616 -0.471 0.087
84 H MET 14 H MET 14 -18.823 -1.134 2.093
85 HA MET 14 HA MET 14 -17.152 -0.088 4.142
86 HB2 MET 14 2HB MET 14 -16.816 -1.871 1.785
87 HB3 MET 14 1HB MET 14 -15.360 -1.104 2.417
88 HG2 MET 14 2HG MET 14 -16.268 -1.922 4.742
89 HG3 MET 14 1HG MET 14 -17.226 -3.039 3.773
90 HE1 MET 14 3HE MET 14 -14.153 -2.211 5.469
91 HE2 MET 14 1HE MET 14 -13.172 -3.671 5.271
92 HE3 MET 14 2HE MET 14 -14.782 -3.777 5.976
93 H LEU 15 H LEU 15 -17.542 2.204 3.822
94 HA LEU 15 HA LEU 15 -16.584 3.571 1.490
95 HB2 LEU 15 2HB LEU 15 -17.741 4.294 4.113
96 HB3 LEU 15 1HB LEU 15 -16.606 5.478 3.475
97 HG LEU 15 HG LEU 15 -19.056 5.808 2.836
98 HD11 LEU 15 1HD1 LEU 15 -16.935 6.670 1.623
99 HD12 LEU 15 2HD1 LEU 15 -18.476 6.747 0.771
100 HD13 LEU 15 3HD1 LEU 15 -17.326 5.463 0.398
101 HD21 LEU 15 3HD2 LEU 15 -18.629 3.742 0.695
102 HD22 LEU 15 1HD2 LEU 15 -20.139 4.398 1.329
103 HD23 LEU 15 2HD2 LEU 15 -19.222 3.223 2.273
104 H CYS 16 H CYS 16 -14.697 4.788 1.240
105 HA CYS 16 HA CYS 16 -12.276 3.714 1.818
106 HB2 CYS 16 2HB CYS 16 -12.808 5.684 0.309
107 HB3 CYS 16 1HB CYS 16 -12.659 6.704 1.741
108 H SER 17 H SER 17 -10.726 3.752 3.345
109 HA SER 17 HA SER 17 -11.438 4.118 6.053
110 HB2 SER 17 2HB SER 17 -8.713 3.838 4.771
111 HB3 SER 17 1HB SER 17 -9.023 3.740 6.508
112 HG SER 17 HG SER 17 -9.004 1.685 5.383
113 H THR 18 H THR 18 -9.926 6.282 3.737
114 HA THR 18 HA THR 18 -9.147 8.174 5.814
115 HB THR 18 HB THR 18 -8.058 9.438 4.134
116 HG1 THR 18 1HG THR 18 -9.718 8.022 2.345
117 HG21 THR 18 3HG2 THR 18 -7.796 6.593 3.139
118 HG22 THR 18 1HG2 THR 18 -7.104 7.135 4.669
119 HG23 THR 18 2HG2 THR 18 -6.563 7.854 3.155
120 H GLY 19 H GLY 19 -12.052 7.543 4.244
121 HA2 GLY 19 2HA GLY 19 -14.053 8.650 4.289
122 HA3 GLY 19 1HA GLY 19 -13.286 9.885 5.276
123 H CYS 20 H CYS 20 -12.358 8.915 1.979
124 HA CYS 20 HA CYS 20 -12.453 11.678 1.142
125 HB2 CYS 20 2HB CYS 20 -11.565 10.889 -0.985
126 HB3 CYS 20 1HB CYS 20 -10.665 10.179 0.357
127 H GLY 21 H GLY 21 -14.726 9.080 1.108
128 HA2 GLY 21 2HA GLY 21 -17.039 9.554 0.679
129 HA3 GLY 21 1HA GLY 21 -16.544 10.708 -0.555
130 H PHE 22 H PHE 22 -14.620 7.997 -0.983
131 HA PHE 22 HA PHE 22 -16.410 6.937 -3.061
132 HB2 PHE 22 2HB PHE 22 -13.407 7.079 -2.805
133 HB3 PHE 22 1HB PHE 22 -14.203 6.020 -3.980
134 HD1 PHE 22 1HD PHE 22 -15.603 6.972 -5.786
135 HD2 PHE 22 2HD PHE 22 -13.379 9.477 -3.096
136 HE1 PHE 22 1HE PHE 22 -15.882 8.886 -7.336
137 HE2 PHE 22 2HE PHE 22 -13.665 11.395 -4.645
138 HZ PHE 22 HZ PHE 22 -14.917 11.095 -6.762
139 H TYR 23 H TYR 23 -16.395 4.639 -3.440
140 HA TYR 23 HA TYR 23 -16.605 3.082 -1.082
141 HB2 TYR 23 2HB TYR 23 -17.799 2.688 -3.303
142 HB3 TYR 23 1HB TYR 23 -16.289 1.964 -3.874
143 HD1 TYR 23 1HD TYR 23 -18.466 1.841 -0.817
144 HD2 TYR 23 2HD TYR 23 -16.110 -0.354 -3.655
145 HE1 TYR 23 1HE TYR 23 -19.047 -0.268 0.328
146 HE2 TYR 23 2HE TYR 23 -16.698 -2.473 -2.503
147 HH TYR 23 HH TYR 23 -18.977 -3.081 -0.836
148 H GLY 24 H GLY 24 -15.342 1.444 -0.251
149 HA2 GLY 24 2HA GLY 24 -12.499 1.447 -1.109
150 HA3 GLY 24 1HA GLY 24 -13.059 1.103 0.531
151 H ASN 25 H ASN 25 -11.360 -0.664 -0.827
152 HA ASN 25 HA ASN 25 -13.142 -2.927 -1.534
153 HB2 ASN 25 2HB ASN 25 -11.224 -1.904 -3.105
154 HB3 ASN 25 1HB ASN 25 -10.219 -2.992 -2.158
155 HD21 ASN 25 1HD2 ASN 25 -12.478 -2.833 -4.766
156 HD22 ASN 25 2HD2 ASN 25 -12.631 -4.513 -5.012
157 HA PRO 26 HA PRO 26 -11.509 -4.710 2.260
158 HB2 PRO 26 2HB PRO 26 -12.548 -7.207 2.096
159 HB3 PRO 26 1HB PRO 26 -13.517 -5.769 2.471
160 HG2 PRO 26 2HG PRO 26 -13.290 -7.281 -0.075
161 HG3 PRO 26 1HG PRO 26 -14.699 -6.492 0.651
162 HD2 PRO 26 2HD PRO 26 -13.156 -5.409 -1.399
163 HD3 PRO 26 1HD PRO 26 -14.223 -4.475 -0.332
164 H ARG 27 H ARG 27 -10.871 -6.053 -0.906
165 HA ARG 27 HA ARG 27 -8.886 -7.965 -0.065
166 HB2 ARG 27 2HB ARG 27 -9.645 -6.755 -2.726
167 HB3 ARG 27 1HB ARG 27 -8.285 -7.862 -2.554
168 HG2 ARG 27 2HG ARG 27 -9.651 -9.663 -1.957
169 HG3 ARG 27 1HG ARG 27 -10.964 -8.616 -1.421
170 HD2 ARG 27 2HD ARG 27 -11.591 -9.639 -3.533
171 HD3 ARG 27 1HD ARG 27 -11.320 -7.916 -3.791
172 HE ARG 27 HE ARG 27 -8.926 -9.394 -4.273
173 HH11 ARG 27 1HH2 ARG 27 -12.046 -8.659 -5.724
174 HH12 ARG 27 2HH2 ARG 27 -11.462 -8.890 -7.335
175 HH21 ARG 27 1HH1 ARG 27 -8.236 -9.676 -6.394
176 HH22 ARG 27 2HH1 ARG 27 -9.342 -9.467 -7.709
177 H THR 28 H THR 28 -8.969 -4.592 -1.045
178 HA THR 28 HA THR 28 -6.072 -4.316 -1.111
179 HB THR 28 HB THR 28 -6.528 -1.971 -1.618
180 HG1 THR 28 1HG THR 28 -8.222 -1.133 -0.755
181 HG21 THR 28 3HG2 THR 28 -8.317 -3.962 -3.024
182 HG22 THR 28 1HG2 THR 28 -6.777 -3.299 -3.569
183 HG23 THR 28 2HG2 THR 28 -8.216 -2.279 -3.537
184 H ASN 29 H ASN 29 -6.038 -1.700 0.332
185 HA ASN 29 HA ASN 29 -5.972 -2.791 3.040
186 HB2 ASN 29 2HB ASN 29 -4.822 -0.395 1.669
187 HB3 ASN 29 1HB ASN 29 -5.048 -0.328 3.418
188 HD21 ASN 29 1HD2 ASN 29 -4.300 -2.699 4.417
189 HD22 ASN 29 2HD2 ASN 29 -2.727 -3.141 3.922
190 H GLY 30 H GLY 30 -8.618 -2.086 1.649
191 HA2 GLY 30 2HA GLY 30 -10.656 -1.385 2.510
192 HA3 GLY 30 1HA GLY 30 -9.807 -0.749 3.919
193 H MET 31 H MET 31 -8.538 0.246 0.846
194 HA MET 31 HA MET 31 -9.877 2.871 1.110
195 HB2 MET 31 2HB MET 31 -7.023 2.175 0.416
196 HB3 MET 31 1HB MET 31 -7.731 3.748 0.027
197 HG2 MET 31 2HG MET 31 -8.113 4.260 2.318
198 HG3 MET 31 1HG MET 31 -7.849 2.588 2.814
199 HE1 MET 31 3HE MET 31 -5.840 1.913 3.954
200 HE2 MET 31 1HE MET 31 -6.293 3.454 4.696
201 HE3 MET 31 2HE MET 31 -4.599 3.096 4.364
202 H CYS 32 H CYS 32 -10.220 4.034 -0.847
203 HA CYS 32 HA CYS 32 -11.196 2.464 -2.983
204 HB2 CYS 32 2HB CYS 32 -11.779 4.598 -4.022
205 HB3 CYS 32 1HB CYS 32 -12.161 4.659 -2.304
206 H SER 33 H SER 33 -10.382 3.909 -5.285
207 HA SER 33 HA SER 33 -7.946 2.524 -5.878
208 HB2 SER 33 2HB SER 33 -10.048 3.419 -7.376
209 HB3 SER 33 1HB SER 33 -8.810 4.600 -7.789
210 HG SER 33 HG SER 33 -8.947 2.465 -8.975
211 H VAL 34 H VAL 34 -8.765 5.981 -5.642
212 HA VAL 34 HA VAL 34 -6.211 6.996 -6.282
213 HB VAL 34 HB VAL 34 -8.242 8.323 -4.472
214 HG11 VAL 34 1HG1 VAL 34 -7.288 10.395 -5.451
215 HG12 VAL 34 2HG1 VAL 34 -6.129 9.419 -6.355
216 HG13 VAL 34 3HG1 VAL 34 -6.067 9.451 -4.593
217 HG21 VAL 34 3HG2 VAL 34 -9.657 8.113 -6.245
218 HG22 VAL 34 1HG2 VAL 34 -8.366 7.635 -7.345
219 HG23 VAL 34 2HG2 VAL 34 -8.661 9.343 -7.016
220 H CYS 35 H CYS 35 -7.697 6.696 -3.055
221 HA CYS 35 HA CYS 35 -5.473 7.508 -1.573
222 HB2 CYS 35 2HB CYS 35 -7.733 5.665 -0.762
223 HB3 CYS 35 1HB CYS 35 -6.599 6.431 0.351
224 H TYR 36 H TYR 36 -6.311 4.309 -2.813
225 HA TYR 36 HA TYR 36 -4.515 2.836 -1.196
226 HB2 TYR 36 2HB TYR 36 -6.407 1.864 -2.516
227 HB3 TYR 36 1HB TYR 36 -5.434 2.071 -3.972
228 HD1 TYR 36 1HD TYR 36 -4.942 0.797 -0.466
229 HD2 TYR 36 2HD TYR 36 -4.295 0.159 -4.666
230 HE1 TYR 36 1HE TYR 36 -3.788 -1.331 0.032
231 HE2 TYR 36 2HE TYR 36 -3.131 -1.975 -4.158
232 HH TYR 36 HH TYR 36 -3.331 -3.697 -1.957
233 H LYS 37 H LYS 37 -3.997 4.545 -4.299
234 HA LYS 37 HA LYS 37 -1.410 3.358 -4.694
235 HB2 LYS 37 2HB LYS 37 -2.979 4.328 -6.490
236 HB3 LYS 37 1HB LYS 37 -2.377 5.906 -5.977
237 HG2 LYS 37 2HG LYS 37 -0.046 5.072 -6.337
238 HG3 LYS 37 1HG LYS 37 -0.719 3.583 -6.998
239 HD2 LYS 37 2HD LYS 37 -1.573 4.659 -8.894
240 HD3 LYS 37 1HD LYS 37 -1.577 6.242 -8.115
241 HE2 LYS 37 2HE LYS 37 1.002 5.959 -8.009
242 HE3 LYS 37 1HE LYS 37 0.766 4.702 -9.223
243 HZ1 LYS 37 3HZ LYS 37 -0.216 6.251 -10.695
244 HZ2 LYS 37 1HZ LYS 37 1.202 6.979 -10.115
245 HZ3 LYS 37 2HZ LYS 37 -0.307 7.452 -9.497
246 H GLU 38 H GLU 38 -2.587 6.558 -3.636
247 HA GLU 38 HA GLU 38 -0.019 7.690 -3.239
248 HB2 GLU 38 2HB GLU 38 -2.692 8.391 -2.010
249 HB3 GLU 38 1HB GLU 38 -1.237 9.384 -1.887
250 HG2 GLU 38 2HG GLU 38 -2.230 8.493 -4.582
251 HG3 GLU 38 1HG GLU 38 -2.955 9.896 -3.787
252 H HIS 39 H HIS 39 -2.269 6.062 -1.008
253 HA HIS 39 HA HIS 39 -0.889 6.502 1.386
254 HB2 HIS 39 2HB HIS 39 -3.204 5.640 1.215
255 HB3 HIS 39 1HB HIS 39 -2.580 4.110 0.595
256 HD1 HIS 39 1HD HIS 39 -2.325 6.285 3.725
257 HD2 HIS 39 2HD HIS 39 -1.892 2.304 2.568
258 HE1 HIS 39 1HE HIS 39 -1.963 4.955 5.846
259 HE2 HIS 39 2HE HIS 39 -1.691 2.529 5.163
260 H LEU 40 H LEU 40 -0.659 3.690 -0.823
261 HA LEU 40 HA LEU 40 1.250 2.294 0.709
262 HB2 LEU 40 2HB LEU 40 0.203 2.098 -2.066
263 HB3 LEU 40 1HB LEU 40 1.756 1.323 -1.761
264 HG LEU 40 HG LEU 40 -0.121 -0.254 -1.426
265 HD11 LEU 40 1HD1 LEU 40 1.020 0.382 1.294
266 HD12 LEU 40 2HD1 LEU 40 2.017 -0.283 0.000
267 HD13 LEU 40 3HD1 LEU 40 0.634 -1.195 0.605
268 HD21 LEU 40 3HD2 LEU 40 -1.911 1.189 -0.735
269 HD22 LEU 40 1HD2 LEU 40 -0.995 1.770 0.653
270 HD23 LEU 40 2HD2 LEU 40 -1.585 0.110 0.620
271 H GLN 41 H GLN 41 1.642 4.892 -1.631
272 HA GLN 41 HA GLN 41 4.350 4.568 -2.276
273 HB2 GLN 41 2HB GLN 41 2.757 6.196 -3.339
274 HB3 GLN 41 1HB GLN 41 2.922 7.213 -1.910
275 HG2 GLN 41 2HG GLN 41 5.377 7.317 -2.291
276 HG3 GLN 41 1HG GLN 41 5.173 6.348 -3.752
277 HE21 GLN 41 1HE2 GLN 41 4.191 9.474 -2.280
278 HE22 GLN 41 2HE2 GLN 41 3.957 10.271 -3.770
279 H ARG 42 H ARG 42 2.844 6.174 0.520
280 HA ARG 42 HA ARG 42 5.414 6.986 1.596
281 HB2 ARG 42 2HB ARG 42 4.108 7.847 3.502
282 HB3 ARG 42 1HB ARG 42 3.466 8.421 1.967
283 HG2 ARG 42 2HG ARG 42 1.600 6.974 2.072
284 HG3 ARG 42 1HG ARG 42 2.346 5.950 3.294
285 HD2 ARG 42 2HD ARG 42 0.923 7.164 4.640
286 HD3 ARG 42 1HD ARG 42 2.336 8.214 4.695
287 HE ARG 42 HE ARG 42 0.889 9.081 2.513
288 HH11 ARG 42 1HH2 ARG 42 0.216 8.701 5.950
289 HH12 ARG 42 2HH2 ARG 42 -0.950 9.977 5.960
290 HH21 ARG 42 1HH1 ARG 42 -0.642 10.700 2.591
291 HH22 ARG 42 2HH1 ARG 42 -1.437 11.094 4.077
292 H GLN 43 H GLN 43 3.133 4.352 2.030
293 HA GLN 43 HA GLN 43 4.181 3.361 4.486
294 HB2 GLN 43 2HB GLN 43 1.904 2.873 3.416
295 HB3 GLN 43 1HB GLN 43 2.759 1.712 2.401
296 HG2 GLN 43 2HG GLN 43 2.143 0.350 4.178
297 HG3 GLN 43 1HG GLN 43 3.739 0.879 4.711
298 HE21 GLN 43 1HE2 GLN 43 0.803 0.361 6.000
299 HE22 GLN 43 2HE2 GLN 43 0.730 1.619 7.140
300 H GLN 44 H GLN 44 4.592 2.250 1.107
301 HA GLN 44 HA GLN 44 6.378 0.151 1.613
302 HB2 GLN 44 2HB GLN 44 6.136 1.923 -0.829
303 HB3 GLN 44 1HB GLN 44 7.061 0.422 -0.770
304 HG2 GLN 44 2HG GLN 44 5.120 -0.890 -0.417
305 HG3 GLN 44 1HG GLN 44 4.147 0.519 0.003
306 HE21 GLN 44 1HE2 GLN 44 4.021 -1.606 -2.292
307 HE22 GLN 44 2HE2 GLN 44 3.819 -0.646 -3.688
308 H ASN 45 H ASN 45 6.981 3.601 1.229
309 HA ASN 45 HA ASN 45 9.803 3.466 0.949
310 HB2 ASN 45 2HB ASN 45 8.267 5.451 0.477
311 HB3 ASN 45 1HB ASN 45 8.293 5.750 2.213
312 HD21 ASN 45 1HD2 ASN 45 10.377 6.379 3.191
313 HD22 ASN 45 2HD2 ASN 45 11.657 6.945 2.215
314 H SER 46 H SER 46 7.816 4.264 3.826
315 HA SER 46 HA SER 46 10.032 3.272 5.529
316 HB2 SER 46 2HB SER 46 8.245 5.674 5.941
317 HB3 SER 46 1HB SER 46 9.215 4.962 7.226
318 HG SER 46 HG SER 46 10.078 6.758 5.743
319 H GLY 47 H GLY 47 6.605 4.246 5.885
320 HA2 GLY 47 2HA GLY 47 4.778 3.074 6.673
321 HA3 GLY 47 1HA GLY 47 5.734 1.601 6.564
322 H ARG 48 H ARG 48 6.702 4.457 8.398
323 HA ARG 48 HA ARG 48 6.120 3.036 10.926
324 HB2 ARG 48 2HB ARG 48 8.565 2.872 10.147
325 HB3 ARG 48 1HB ARG 48 8.664 4.595 10.507
326 HG2 ARG 48 2HG ARG 48 7.997 4.199 12.816
327 HG3 ARG 48 1HG ARG 48 7.742 2.486 12.481
328 HD2 ARG 48 2HD ARG 48 10.081 2.131 12.076
329 HD3 ARG 48 1HD ARG 48 10.406 3.861 12.076
330 HE ARG 48 HE ARG 48 9.336 3.326 14.567
331 HH11 ARG 48 1HH2 ARG 48 12.112 2.167 12.742
332 HH12 ARG 48 2HH2 ARG 48 13.045 1.861 14.164
333 HH21 ARG 48 1HH1 ARG 48 10.601 2.913 16.372
334 HH22 ARG 48 2HH1 ARG 48 12.203 2.278 16.196
335 H MET 49 H MET 49 7.541 6.155 9.865
336 HA MET 49 HA MET 49 5.566 7.533 11.597
337 HB2 MET 49 2HB MET 49 8.470 8.181 11.074
338 HB3 MET 49 1HB MET 49 7.346 9.320 11.811
339 HG2 MET 49 2HG MET 49 6.969 7.879 13.685
340 HG3 MET 49 1HG MET 49 7.783 6.528 12.893
341 HE1 MET 49 3HE MET 49 9.769 5.937 12.876
342 HE2 MET 49 1HE MET 49 11.186 6.596 13.702
343 HE3 MET 49 2HE MET 49 10.778 7.140 12.076
344 H SER 50 H SER 50 7.834 8.244 8.912
345 HA SER 50 HA SER 50 5.668 9.294 7.291
346 HB2 SER 50 2HB SER 50 7.049 11.498 7.036
347 HB3 SER 50 1HB SER 50 5.960 11.315 8.407
348 HG SER 50 HG SER 50 8.764 10.854 8.347
349 HA PRO 51 HA PRO 51 8.472 8.042 4.094
350 HB2 PRO 51 2HB PRO 51 7.720 9.579 1.980
351 HB3 PRO 51 1HB PRO 51 6.707 8.275 2.628
352 HG2 PRO 51 2HG PRO 51 6.486 11.211 3.012
353 HG3 PRO 51 1HG PRO 51 5.213 9.994 2.825
354 HD2 PRO 51 2HD PRO 51 5.989 11.071 5.257
355 HD3 PRO 51 1HD PRO 51 5.180 9.501 5.066
356 H MET 52 H MET 52 8.162 11.614 4.115
357 HA MET 52 HA MET 52 10.960 11.884 3.287
358 HB2 MET 52 2HB MET 52 8.626 13.765 3.480
359 HB3 MET 52 1HB MET 52 10.269 14.395 3.384
360 HG2 MET 52 2HG MET 52 9.622 14.268 1.124
361 HG3 MET 52 1HG MET 52 10.533 12.776 1.362
362 HE1 MET 52 3HE MET 52 9.278 12.764 -0.920
363 HE2 MET 52 1HE MET 52 7.845 11.749 -1.126
364 HE3 MET 52 2HE MET 52 9.335 11.059 -0.485
365 H GLY 53 H GLY 53 8.820 12.825 5.974
366 HA2 GLY 53 2HA GLY 53 9.517 12.770 8.259
367 HA3 GLY 53 1HA GLY 53 11.183 12.991 7.729
368 H THR 54 H THR 54 11.350 15.151 6.303
369 HA THR 54 HA THR 54 10.469 17.294 8.092
370 HB THR 54 HB THR 54 12.034 18.674 6.647
371 HG1 THR 54 1HG THR 54 12.284 17.579 4.820
372 HG21 THR 54 3HG2 THR 54 12.651 17.609 8.834
373 HG22 THR 54 1HG2 THR 54 14.013 17.798 7.731
374 HG23 THR 54 2HG2 THR 54 13.254 16.219 7.931
375 H ALA 55 H ALA 55 9.977 19.446 6.881
376 HA ALA 55 HA ALA 55 7.614 18.989 5.298
377 HB1 ALA 55 1HB ALA 55 8.985 21.619 5.903
378 HB2 ALA 55 2HB ALA 55 7.838 20.833 6.986
379 HB3 ALA 55 3HB ALA 55 7.312 21.383 5.395
380 H SER 56 H SER 56 7.448 18.940 3.142
381 HA SER 56 HA SER 56 9.365 20.363 1.464
382 HB2 SER 56 2HB SER 56 8.952 17.379 1.178
383 HB3 SER 56 1HB SER 56 9.963 18.400 0.159
384 HG SER 56 HG SER 56 10.935 17.176 2.033
385 H GLY 57 H GLY 57 8.752 19.774 -0.966
386 HA2 GLY 57 2HA GLY 57 7.026 19.334 -2.548
387 HA3 GLY 57 1HA GLY 57 5.838 19.481 -1.258
388 H SER 58 H SER 58 8.483 21.601 -2.403
389 HA SER 58 HA SER 58 6.545 23.633 -3.204
390 HB2 SER 58 2HB SER 58 7.641 25.373 -1.821
391 HB3 SER 58 1HB SER 58 6.875 24.128 -0.840
392 HG SER 58 HG SER 58 9.059 24.700 -0.213
393 H ASN 59 H ASN 59 8.434 21.980 -4.643
394 HA ASN 59 HA ASN 59 10.463 23.945 -5.518
395 HB2 ASN 59 2HB ASN 59 10.292 20.956 -5.974
396 HB3 ASN 59 1HB ASN 59 11.569 22.007 -6.585
397 HD21 ASN 59 1HD2 ASN 59 13.221 22.672 -5.114
398 HD22 ASN 59 2HD2 ASN 59 13.283 22.148 -3.500
399 H SER 60 H SER 60 10.307 24.871 -7.471
400 HA SER 60 HA SER 60 8.021 24.236 -9.156
401 HB2 SER 60 2HB SER 60 8.671 26.591 -8.643
402 HB3 SER 60 1HB SER 60 10.173 26.336 -9.528
403 HG SER 60 HG SER 60 8.383 27.273 -10.749
404 HA PRO 61 HA PRO 61 10.093 21.605 -12.062
405 HB2 PRO 61 2HB PRO 61 8.866 23.207 -14.255
406 HB3 PRO 61 1HB PRO 61 8.763 21.467 -13.931
407 HG2 PRO 61 2HG PRO 61 6.716 23.098 -13.449
408 HG3 PRO 61 1HG PRO 61 7.071 21.714 -12.402
409 HD2 PRO 61 2HD PRO 61 7.564 24.623 -11.913
410 HD3 PRO 61 1HD PRO 61 7.123 23.342 -10.761
411 H THR 62 H THR 62 12.125 21.600 -12.864
412 HA THR 62 HA THR 62 14.154 22.306 -13.658
413 HB THR 62 HB THR 62 12.715 24.561 -15.051
414 HG1 THR 62 1HG THR 62 12.915 21.836 -15.813
415 HG21 THR 62 3HG2 THR 62 15.078 24.654 -15.344
416 HG22 THR 62 1HG2 THR 62 14.451 23.904 -16.811
417 HG23 THR 62 2HG2 THR 62 15.193 22.907 -15.560
Start of MODEL 15
1 H1 GLY 1 1HT GLY 1 -42.752 -7.122 -7.146
2 H2 GLY 1 2HT GLY 1 -42.825 -6.970 -8.837
3 H3 GLY 1 3HT GLY 1 -44.053 -6.308 -7.868
4 HA2 GLY 1 2HA GLY 1 -42.488 -4.623 -8.726
5 HA3 GLY 1 1HA GLY 1 -42.577 -4.680 -6.964
6 H SER 2 H SER 2 -40.476 -4.532 -9.504
7 HA SER 2 HA SER 2 -38.372 -6.222 -8.428
8 HB2 SER 2 2HB SER 2 -38.795 -5.734 -10.912
9 HB3 SER 2 1HB SER 2 -38.072 -4.157 -10.604
10 HG SER 2 HG SER 2 -36.177 -5.112 -10.123
11 H MET 3 H MET 3 -37.168 -5.588 -6.752
12 HA MET 3 HA MET 3 -36.220 -2.810 -6.642
13 HB2 MET 3 2HB MET 3 -36.727 -2.698 -4.206
14 HB3 MET 3 1HB MET 3 -38.175 -2.783 -5.206
15 HG2 MET 3 2HG MET 3 -38.120 -5.315 -4.819
16 HG3 MET 3 1HG MET 3 -36.915 -4.995 -3.571
17 HE1 MET 3 3HE MET 3 -40.644 -5.520 -4.133
18 HE2 MET 3 1HE MET 3 -40.230 -4.061 -5.046
19 HE3 MET 3 2HE MET 3 -41.345 -3.966 -3.685
20 H ALA 4 H ALA 4 -34.927 -5.326 -7.352
21 HA ALA 4 HA ALA 4 -33.277 -6.144 -5.130
22 HB1 ALA 4 1HB ALA 4 -33.907 -7.630 -7.066
23 HB2 ALA 4 2HB ALA 4 -32.179 -7.583 -6.712
24 HB3 ALA 4 3HB ALA 4 -32.825 -6.669 -8.074
25 H GLN 5 H GLN 5 -32.713 -4.323 -8.152
26 HA GLN 5 HA GLN 5 -30.015 -3.627 -7.468
27 HB2 GLN 5 2HB GLN 5 -31.925 -2.553 -9.553
28 HB3 GLN 5 1HB GLN 5 -30.242 -2.042 -9.406
29 HG2 GLN 5 2HG GLN 5 -29.415 -4.155 -10.002
30 HG3 GLN 5 1HG GLN 5 -30.928 -4.964 -9.599
31 HE21 GLN 5 1HE2 GLN 5 -32.288 -5.408 -11.338
32 HE22 GLN 5 2HE2 GLN 5 -32.187 -4.655 -12.866
33 H GLU 6 H GLU 6 -33.128 -1.900 -7.425
34 HA GLU 6 HA GLU 6 -31.919 0.458 -6.226
35 HB2 GLU 6 2HB GLU 6 -34.766 -0.250 -6.961
36 HB3 GLU 6 1HB GLU 6 -34.302 1.280 -6.216
37 HG2 GLU 6 2HG GLU 6 -32.795 1.764 -8.087
38 HG3 GLU 6 1HG GLU 6 -33.186 0.211 -8.824
39 H THR 7 H THR 7 -31.412 0.394 -4.123
40 HA THR 7 HA THR 7 -33.441 -0.560 -2.218
41 HB THR 7 HB THR 7 -30.549 -1.258 -1.791
42 HG1 THR 7 1HG THR 7 -30.728 -2.620 -3.360
43 HG21 THR 7 3HG2 THR 7 -31.591 -3.019 -0.386
44 HG22 THR 7 1HG2 THR 7 -33.184 -2.400 -0.822
45 HG23 THR 7 2HG2 THR 7 -32.076 -1.399 0.117
46 H ASN 8 H ASN 8 -33.204 0.309 -0.085
47 HA ASN 8 HA ASN 8 -31.984 2.966 -0.102
48 HB2 ASN 8 2HB ASN 8 -34.366 2.506 0.667
49 HB3 ASN 8 1HB ASN 8 -33.657 1.733 2.084
50 HD21 ASN 8 1HD2 ASN 8 -34.799 4.691 0.950
51 HD22 ASN 8 2HD2 ASN 8 -33.985 5.714 2.047
52 H GLN 9 H GLN 9 -31.819 -0.086 1.703
53 HA GLN 9 HA GLN 9 -29.840 0.904 3.558
54 HB2 GLN 9 2HB GLN 9 -31.027 -1.812 3.011
55 HB3 GLN 9 1HB GLN 9 -29.698 -1.589 4.150
56 HG2 GLN 9 2HG GLN 9 -31.066 0.112 5.357
57 HG3 GLN 9 1HG GLN 9 -32.407 -0.233 4.265
58 HE21 GLN 9 1HE2 GLN 9 -33.292 -2.500 4.326
59 HE22 GLN 9 2HE2 GLN 9 -33.141 -3.403 5.766
60 H THR 10 H THR 10 -27.821 -0.612 3.846
61 HA THR 10 HA THR 10 -26.615 -1.465 1.334
62 HB THR 10 HB THR 10 -25.277 0.697 2.963
63 HG1 THR 10 1HG THR 10 -26.769 1.869 2.034
64 HG21 THR 10 3HG2 THR 10 -23.929 0.887 0.841
65 HG22 THR 10 1HG2 THR 10 -24.743 -0.568 0.264
66 HG23 THR 10 2HG2 THR 10 -23.719 -0.641 1.698
67 HA PRO 11 HA PRO 11 -24.960 -3.913 4.823
68 HB2 PRO 11 2HB PRO 11 -24.836 -6.308 3.605
69 HB3 PRO 11 1HB PRO 11 -26.384 -5.606 4.114
70 HG2 PRO 11 2HG PRO 11 -25.200 -5.808 1.404
71 HG3 PRO 11 1HG PRO 11 -26.896 -5.884 1.909
72 HD2 PRO 11 2HD PRO 11 -25.576 -3.621 0.843
73 HD3 PRO 11 1HD PRO 11 -27.170 -3.637 1.628
74 H GLY 12 H GLY 12 -22.845 -4.011 5.378
75 HA2 GLY 12 2HA GLY 12 -20.557 -4.186 5.260
76 HA3 GLY 12 1HA GLY 12 -20.784 -5.109 3.778
77 HA PRO 13 HA PRO 13 -20.494 -0.768 1.894
78 HB2 PRO 13 2HB PRO 13 -20.856 1.488 3.398
79 HB3 PRO 13 1HB PRO 13 -22.194 0.603 2.636
80 HG2 PRO 13 2HG PRO 13 -21.262 0.565 5.463
81 HG3 PRO 13 1HG PRO 13 -22.913 0.530 4.813
82 HD2 PRO 13 2HD PRO 13 -21.603 -1.708 5.723
83 HD3 PRO 13 1HD PRO 13 -22.879 -1.748 4.488
84 H MET 14 H MET 14 -18.256 -1.502 1.938
85 HA MET 14 HA MET 14 -16.419 -0.602 3.951
86 HB2 MET 14 2HB MET 14 -16.255 -2.091 1.378
87 HB3 MET 14 1HB MET 14 -14.794 -1.243 1.877
88 HG2 MET 14 2HG MET 14 -15.838 -2.567 4.198
89 HG3 MET 14 1HG MET 14 -15.874 -3.730 2.878
90 HE1 MET 14 3HE MET 14 -14.168 -4.236 5.427
91 HE2 MET 14 1HE MET 14 -14.069 -2.491 5.693
92 HE3 MET 14 2HE MET 14 -12.595 -3.447 5.536
93 H LEU 15 H LEU 15 -17.023 1.695 3.942
94 HA LEU 15 HA LEU 15 -16.365 3.292 1.620
95 HB2 LEU 15 2HB LEU 15 -17.766 3.676 4.121
96 HB3 LEU 15 1HB LEU 15 -16.568 4.952 3.932
97 HG LEU 15 HG LEU 15 -18.317 4.218 1.600
98 HD11 LEU 15 1HD1 LEU 15 -19.071 5.866 4.009
99 HD12 LEU 15 2HD1 LEU 15 -19.974 4.547 3.269
100 HD13 LEU 15 3HD1 LEU 15 -19.838 6.099 2.439
101 HD21 LEU 15 3HD2 LEU 15 -17.336 6.930 2.496
102 HD22 LEU 15 1HD2 LEU 15 -17.824 6.419 0.880
103 HD23 LEU 15 2HD2 LEU 15 -16.306 5.840 1.569
104 H CYS 16 H CYS 16 -14.610 4.655 1.354
105 HA CYS 16 HA CYS 16 -12.115 3.785 2.151
106 HB2 CYS 16 2HB CYS 16 -12.764 5.495 0.328
107 HB3 CYS 16 1HB CYS 16 -12.608 6.702 1.609
108 H SER 17 H SER 17 -10.996 3.803 3.952
109 HA SER 17 HA SER 17 -11.918 4.955 6.364
110 HB2 SER 17 2HB SER 17 -9.084 4.080 5.816
111 HB3 SER 17 1HB SER 17 -9.932 4.104 7.364
112 HG SER 17 HG SER 17 -9.772 2.105 5.733
113 H THR 18 H THR 18 -9.940 6.303 3.813
114 HA THR 18 HA THR 18 -8.678 8.298 5.457
115 HB THR 18 HB THR 18 -7.920 9.269 3.340
116 HG1 THR 18 1HG THR 18 -9.300 9.036 1.793
117 HG21 THR 18 3HG2 THR 18 -7.724 6.282 3.013
118 HG22 THR 18 1HG2 THR 18 -6.953 7.087 4.380
119 HG23 THR 18 2HG2 THR 18 -6.490 7.509 2.732
120 H GLY 19 H GLY 19 -11.806 8.050 3.955
121 HA2 GLY 19 2HA GLY 19 -13.608 9.485 4.303
122 HA3 GLY 19 1HA GLY 19 -12.496 10.682 4.965
123 H CYS 20 H CYS 20 -12.428 9.050 1.784
124 HA CYS 20 HA CYS 20 -12.207 11.673 0.517
125 HB2 CYS 20 2HB CYS 20 -11.639 10.452 -1.534
126 HB3 CYS 20 1HB CYS 20 -10.619 9.958 -0.177
127 H GLY 21 H GLY 21 -14.634 9.231 1.007
128 HA2 GLY 21 2HA GLY 21 -16.947 9.713 0.742
129 HA3 GLY 21 1HA GLY 21 -16.542 10.880 -0.508
130 H PHE 22 H PHE 22 -14.818 8.001 -1.055
131 HA PHE 22 HA PHE 22 -16.799 7.156 -3.064
132 HB2 PHE 22 2HB PHE 22 -13.782 7.050 -2.973
133 HB3 PHE 22 1HB PHE 22 -14.710 6.096 -4.133
134 HD1 PHE 22 1HD PHE 22 -16.326 7.270 -5.697
135 HD2 PHE 22 2HD PHE 22 -13.458 9.389 -3.299
136 HE1 PHE 22 1HE PHE 22 -16.598 9.269 -7.138
137 HE2 PHE 22 2HE PHE 22 -13.729 11.386 -4.745
138 HZ PHE 22 HZ PHE 22 -15.299 11.326 -6.660
139 H TYR 23 H TYR 23 -15.914 4.675 -3.689
140 HA TYR 23 HA TYR 23 -16.642 3.118 -1.304
141 HB2 TYR 23 2HB TYR 23 -17.784 2.979 -3.656
142 HB3 TYR 23 1HB TYR 23 -16.389 1.981 -4.072
143 HD1 TYR 23 2HD TYR 23 -18.718 2.333 -1.129
144 HD2 TYR 23 1HD TYR 23 -16.751 -0.302 -3.898
145 HE1 TYR 23 2HE TYR 23 -19.800 0.385 -0.044
146 HE2 TYR 23 1HE TYR 23 -17.836 -2.250 -2.810
147 HH TYR 23 HH TYR 23 -19.191 -2.174 0.161
148 H GLY 24 H GLY 24 -15.383 1.520 -0.451
149 HA2 GLY 24 2HA GLY 24 -12.610 1.304 -1.482
150 HA3 GLY 24 1HA GLY 24 -13.072 1.117 0.213
151 H ASN 25 H ASN 25 -11.563 -0.861 -0.790
152 HA ASN 25 HA ASN 25 -13.465 -3.086 -1.258
153 HB2 ASN 25 2HB ASN 25 -11.732 -2.303 -3.133
154 HB3 ASN 25 1HB ASN 25 -10.625 -3.295 -2.188
155 HD21 ASN 25 1HD2 ASN 25 -13.473 -3.377 -4.274
156 HD22 ASN 25 2HD2 ASN 25 -13.539 -5.078 -4.410
157 HA PRO 26 HA PRO 26 -11.507 -4.682 2.469
158 HB2 PRO 26 2HB PRO 26 -12.531 -7.174 2.529
159 HB3 PRO 26 1HB PRO 26 -13.529 -5.734 2.828
160 HG2 PRO 26 2HG PRO 26 -13.238 -7.333 0.322
161 HG3 PRO 26 1HG PRO 26 -14.715 -6.733 1.101
162 HD2 PRO 26 2HD PRO 26 -13.544 -5.451 -1.010
163 HD3 PRO 26 1HD PRO 26 -14.454 -4.591 0.250
164 H ARG 27 H ARG 27 -11.058 -6.092 -0.702
165 HA ARG 27 HA ARG 27 -9.080 -8.036 0.087
166 HB2 ARG 27 2HB ARG 27 -9.654 -6.863 -2.656
167 HB3 ARG 27 1HB ARG 27 -8.730 -8.326 -2.313
168 HG2 ARG 27 2HG ARG 27 -10.712 -9.407 -1.378
169 HG3 ARG 27 1HG ARG 27 -11.651 -7.930 -1.587
170 HD2 ARG 27 2HD ARG 27 -11.671 -8.125 -3.930
171 HD3 ARG 27 1HD ARG 27 -10.284 -9.207 -3.944
172 HE ARG 27 HE ARG 27 -12.468 -10.396 -2.546
173 HH11 ARG 27 1HH2 ARG 27 -11.406 -9.634 -5.812
174 HH12 ARG 27 2HH2 ARG 27 -12.231 -10.986 -6.505
175 HH21 ARG 27 1HH1 ARG 27 -13.515 -12.130 -3.504
176 HH22 ARG 27 2HH1 ARG 27 -13.414 -12.384 -5.214
177 H THR 28 H THR 28 -9.179 -4.701 -1.034
178 HA THR 28 HA THR 28 -6.309 -4.437 -1.310
179 HB THR 28 HB THR 28 -6.815 -2.071 -1.737
180 HG1 THR 28 1HG THR 28 -8.845 -1.278 -1.401
181 HG21 THR 28 3HG2 THR 28 -7.149 -3.389 -3.676
182 HG22 THR 28 1HG2 THR 28 -8.609 -2.408 -3.553
183 HG23 THR 28 2HG2 THR 28 -8.637 -4.095 -3.042
184 H ASN 29 H ASN 29 -6.151 -1.819 0.119
185 HA ASN 29 HA ASN 29 -5.768 -2.887 2.809
186 HB2 ASN 29 2HB ASN 29 -4.473 -0.907 1.165
187 HB3 ASN 29 1HB ASN 29 -4.964 -0.146 2.674
188 HD21 ASN 29 1HD2 ASN 29 -3.616 -3.382 1.773
189 HD22 ASN 29 2HD2 ASN 29 -2.410 -3.369 2.979
190 H GLY 30 H GLY 30 -8.550 -2.262 1.806
191 HA2 GLY 30 2HA GLY 30 -10.455 -1.540 2.868
192 HA3 GLY 30 1HA GLY 30 -9.446 -0.826 4.126
193 H MET 31 H MET 31 -8.433 0.147 1.004
194 HA MET 31 HA MET 31 -9.898 2.702 1.270
195 HB2 MET 31 2HB MET 31 -7.046 2.012 0.705
196 HB3 MET 31 1HB MET 31 -7.721 3.431 -0.100
197 HG2 MET 31 2HG MET 31 -6.768 4.188 1.951
198 HG3 MET 31 1HG MET 31 -8.507 4.212 2.186
199 HE1 MET 31 3HE MET 31 -5.977 4.307 3.891
200 HE2 MET 31 1HE MET 31 -5.116 2.763 3.850
201 HE3 MET 31 2HE MET 31 -6.064 3.209 5.265
202 H CYS 32 H CYS 32 -9.942 3.924 -0.840
203 HA CYS 32 HA CYS 32 -11.109 2.258 -2.871
204 HB2 CYS 32 2HB CYS 32 -11.789 4.341 -3.915
205 HB3 CYS 32 1HB CYS 32 -12.067 4.462 -2.180
206 H SER 33 H SER 33 -10.369 3.700 -5.211
207 HA SER 33 HA SER 33 -7.931 2.329 -5.840
208 HB2 SER 33 2HB SER 33 -10.102 3.200 -7.286
209 HB3 SER 33 1HB SER 33 -8.836 4.306 -7.810
210 HG SER 33 HG SER 33 -9.123 2.067 -8.824
211 H VAL 34 H VAL 34 -8.739 5.817 -5.568
212 HA VAL 34 HA VAL 34 -6.146 6.710 -6.311
213 HB VAL 34 HB VAL 34 -8.128 8.235 -4.610
214 HG11 VAL 34 1HG1 VAL 34 -6.075 9.145 -6.652
215 HG12 VAL 34 2HG1 VAL 34 -5.853 9.206 -4.904
216 HG13 VAL 34 3HG1 VAL 34 -7.101 10.188 -5.668
217 HG21 VAL 34 3HG2 VAL 34 -8.743 9.144 -7.026
218 HG22 VAL 34 1HG2 VAL 34 -9.505 7.675 -6.412
219 HG23 VAL 34 2HG2 VAL 34 -8.158 7.561 -7.541
220 H CYS 35 H CYS 35 -7.712 6.665 -3.101
221 HA CYS 35 HA CYS 35 -5.550 7.529 -1.585
222 HB2 CYS 35 2HB CYS 35 -7.794 5.665 -0.778
223 HB3 CYS 35 1HB CYS 35 -6.701 6.483 0.343
224 H TYR 36 H TYR 36 -6.338 4.256 -2.674
225 HA TYR 36 HA TYR 36 -4.595 2.813 -1.032
226 HB2 TYR 36 2HB TYR 36 -6.306 1.743 -2.416
227 HB3 TYR 36 1HB TYR 36 -5.411 2.167 -3.870
228 HD1 TYR 36 2HD TYR 36 -4.460 0.720 -0.527
229 HD2 TYR 36 1HD TYR 36 -4.375 0.279 -4.800
230 HE1 TYR 36 2HE TYR 36 -3.138 -1.358 -0.285
231 HE2 TYR 36 1HE TYR 36 -3.058 -1.809 -4.554
232 HH TYR 36 HH TYR 36 -2.768 -3.590 -2.690
233 H LYS 37 H LYS 37 -3.950 4.521 -4.052
234 HA LYS 37 HA LYS 37 -1.224 3.586 -4.226
235 HB2 LYS 37 2HB LYS 37 -2.766 4.423 -6.151
236 HB3 LYS 37 1HB LYS 37 -2.260 6.031 -5.629
237 HG2 LYS 37 2HG LYS 37 0.142 5.181 -5.785
238 HG3 LYS 37 1HG LYS 37 -0.512 3.773 -6.622
239 HD2 LYS 37 2HD LYS 37 -1.420 5.142 -8.383
240 HD3 LYS 37 1HD LYS 37 -1.051 6.621 -7.496
241 HE2 LYS 37 2HE LYS 37 1.394 5.903 -7.579
242 HE3 LYS 37 1HE LYS 37 0.899 4.678 -8.745
243 HZ1 LYS 37 3HZ LYS 37 -0.000 6.429 -10.148
244 HZ2 LYS 37 1HZ LYS 37 1.650 6.685 -9.854
245 HZ3 LYS 37 2HZ LYS 37 0.488 7.608 -9.027
246 H GLU 38 H GLU 38 -2.852 6.603 -3.294
247 HA GLU 38 HA GLU 38 -0.617 8.178 -2.787
248 HB2 GLU 38 2HB GLU 38 -3.381 8.192 -1.597
249 HB3 GLU 38 1HB GLU 38 -2.165 9.391 -1.154
250 HG2 GLU 38 2HG GLU 38 -1.880 9.685 -3.738
251 HG3 GLU 38 1HG GLU 38 -3.465 8.915 -3.829
252 H HIS 39 H HIS 39 -2.248 5.899 -0.547
253 HA HIS 39 HA HIS 39 -0.427 6.679 1.581
254 HB2 HIS 39 2HB HIS 39 -1.639 5.297 3.053
255 HB3 HIS 39 1HB HIS 39 -2.836 6.031 2.001
256 HD1 HIS 39 1HD HIS 39 -4.622 4.358 1.637
257 HD2 HIS 39 2HD HIS 39 -0.871 2.554 1.559
258 HE1 HIS 39 1HE HIS 39 -5.017 1.891 1.231
259 HE2 HIS 39 2HE HIS 39 -2.736 0.784 1.165
260 H LEU 40 H LEU 40 -0.683 4.043 -0.713
261 HA LEU 40 HA LEU 40 1.209 2.298 0.465
262 HB2 LEU 40 2HB LEU 40 -0.398 1.758 -1.425
263 HB3 LEU 40 1HB LEU 40 0.730 2.585 -2.505
264 HG LEU 40 HG LEU 40 2.522 1.024 -1.460
265 HD11 LEU 40 1HD1 LEU 40 1.006 0.263 0.381
266 HD12 LEU 40 2HD1 LEU 40 1.671 -1.073 -0.561
267 HD13 LEU 40 3HD1 LEU 40 0.007 -0.548 -0.825
268 HD21 LEU 40 3HD2 LEU 40 2.060 -0.675 -3.132
269 HD22 LEU 40 1HD2 LEU 40 1.566 0.884 -3.790
270 HD23 LEU 40 2HD2 LEU 40 0.352 -0.235 -3.170
271 H GLN 41 H GLN 41 1.601 5.165 -1.512
272 HA GLN 41 HA GLN 41 4.251 4.767 -2.393
273 HB2 GLN 41 2HB GLN 41 2.583 6.587 -3.115
274 HB3 GLN 41 1HB GLN 41 3.133 7.475 -1.692
275 HG2 GLN 41 2HG GLN 41 4.610 8.273 -3.306
276 HG3 GLN 41 1HG GLN 41 5.534 6.923 -2.638
277 HE21 GLN 41 1HE2 GLN 41 5.460 8.144 -5.461
278 HE22 GLN 41 2HE2 GLN 41 5.181 6.805 -6.481
279 H ARG 42 H ARG 42 2.980 6.216 0.582
280 HA ARG 42 HA ARG 42 5.626 6.855 1.586
281 HB2 ARG 42 2HB ARG 42 3.523 8.219 2.011
282 HB3 ARG 42 1HB ARG 42 3.017 6.932 3.105
283 HG2 ARG 42 2HG ARG 42 5.256 7.226 4.287
284 HG3 ARG 42 1HG ARG 42 5.467 8.695 3.331
285 HD2 ARG 42 2HD ARG 42 3.255 9.505 4.206
286 HD3 ARG 42 1HD ARG 42 3.208 8.098 5.264
287 HE ARG 42 HE ARG 42 4.683 9.190 6.657
288 HH11 ARG 42 1HH2 ARG 42 4.928 10.643 3.462
289 HH12 ARG 42 2HH2 ARG 42 6.063 11.837 3.982
290 HH21 ARG 42 1HH1 ARG 42 6.135 10.779 7.274
291 HH22 ARG 42 2HH1 ARG 42 6.729 11.923 6.119
292 H GLN 43 H GLN 43 3.221 4.314 2.013
293 HA GLN 43 HA GLN 43 4.404 3.192 4.372
294 HB2 GLN 43 2HB GLN 43 1.993 2.881 3.505
295 HB3 GLN 43 1HB GLN 43 2.682 1.659 2.435
296 HG2 GLN 43 2HG GLN 43 3.610 0.461 4.366
297 HG3 GLN 43 1HG GLN 43 2.978 1.697 5.452
298 HE21 GLN 43 1HE2 GLN 43 1.830 -0.634 2.953
299 HE22 GLN 43 2HE2 GLN 43 0.337 -0.925 3.707
300 H GLN 44 H GLN 44 4.476 2.294 0.921
301 HA GLN 44 HA GLN 44 6.163 0.041 1.211
302 HB2 GLN 44 2HB GLN 44 4.730 0.887 -0.826
303 HB3 GLN 44 1HB GLN 44 6.227 1.701 -1.282
304 HG2 GLN 44 2HG GLN 44 7.430 -0.465 -1.133
305 HG3 GLN 44 1HG GLN 44 5.912 -1.264 -0.735
306 HE21 GLN 44 1HE2 GLN 44 4.424 -1.700 -2.452
307 HE22 GLN 44 2HE2 GLN 44 4.784 -1.363 -4.085
308 H ASN 45 H ASN 45 6.912 3.441 1.234
309 HA ASN 45 HA ASN 45 9.547 3.471 0.302
310 HB2 ASN 45 2HB ASN 45 8.099 5.455 0.919
311 HB3 ASN 45 1HB ASN 45 8.520 5.137 2.601
312 HD21 ASN 45 1HD2 ASN 45 10.914 5.190 3.130
313 HD22 ASN 45 2HD2 ASN 45 11.927 6.205 2.206
314 H SER 46 H SER 46 8.282 2.438 3.421
315 HA SER 46 HA SER 46 10.654 2.472 4.927
316 HB2 SER 46 2HB SER 46 8.198 2.010 5.654
317 HB3 SER 46 1HB SER 46 8.587 0.330 5.306
318 HG SER 46 HG SER 46 9.044 1.394 7.515
319 H GLY 47 H GLY 47 9.155 -0.486 3.557
320 HA2 GLY 47 2HA GLY 47 10.091 -2.391 2.668
321 HA3 GLY 47 1HA GLY 47 11.530 -1.435 2.326
322 H ARG 48 H ARG 48 9.833 -2.765 5.190
323 HA ARG 48 HA ARG 48 12.429 -3.252 6.467
324 HB2 ARG 48 2HB ARG 48 11.071 -3.773 8.490
325 HB3 ARG 48 1HB ARG 48 10.796 -2.149 7.868
326 HG2 ARG 48 2HG ARG 48 8.656 -2.634 7.133
327 HG3 ARG 48 1HG ARG 48 9.014 -4.341 6.875
328 HD2 ARG 48 2HD ARG 48 8.842 -4.846 9.179
329 HD3 ARG 48 1HD ARG 48 8.983 -3.155 9.647
330 HE ARG 48 HE ARG 48 6.676 -3.385 8.081
331 HH11 ARG 48 1HH2 ARG 48 7.843 -4.599 11.173
332 HH12 ARG 48 2HH2 ARG 48 6.253 -4.697 11.848
333 HH21 ARG 48 1HH1 ARG 48 4.643 -3.532 9.016
334 HH22 ARG 48 2HH1 ARG 48 4.462 -4.099 10.644
335 H MET 49 H MET 49 12.651 -4.911 4.606
336 HA MET 49 HA MET 49 11.284 -7.441 5.090
337 HB2 MET 49 2HB MET 49 11.954 -6.449 2.783
338 HB3 MET 49 1HB MET 49 13.566 -7.050 3.172
339 HG2 MET 49 2HG MET 49 12.534 -8.829 1.988
340 HG3 MET 49 1HG MET 49 12.421 -9.296 3.684
341 HE1 MET 49 3HE MET 49 10.066 -9.962 0.797
342 HE2 MET 49 1HE MET 49 9.367 -10.793 2.194
343 HE3 MET 49 2HE MET 49 11.114 -10.754 1.971
344 H SER 50 H SER 50 14.713 -6.446 4.814
345 HA SER 50 HA SER 50 15.503 -8.709 6.497
346 HB2 SER 50 2HB SER 50 16.685 -7.806 4.299
347 HB3 SER 50 1HB SER 50 17.462 -6.709 5.437
348 HG SER 50 HG SER 50 18.572 -8.329 6.205
349 HA PRO 51 HA PRO 51 15.863 -6.395 10.253
350 HB2 PRO 51 2HB PRO 51 18.601 -7.476 10.670
351 HB3 PRO 51 1HB PRO 51 17.159 -7.618 11.694
352 HG2 PRO 51 2HG PRO 51 18.092 -9.674 10.266
353 HG3 PRO 51 1HG PRO 51 16.361 -9.433 10.554
354 HD2 PRO 51 2HD PRO 51 17.947 -8.931 8.066
355 HD3 PRO 51 1HD PRO 51 16.268 -9.489 8.243
356 H MET 52 H MET 52 18.832 -6.407 8.286
357 HA MET 52 HA MET 52 19.819 -3.920 9.322
358 HB2 MET 52 2HB MET 52 20.551 -5.434 6.802
359 HB3 MET 52 1HB MET 52 21.452 -4.073 7.472
360 HG2 MET 52 2HG MET 52 21.906 -5.321 9.515
361 HG3 MET 52 1HG MET 52 20.898 -6.657 8.959
362 HE1 MET 52 3HE MET 52 24.120 -8.533 8.573
363 HE2 MET 52 1HE MET 52 22.400 -8.565 8.983
364 HE3 MET 52 2HE MET 52 23.511 -7.556 9.905
365 H GLY 53 H GLY 53 18.664 -4.787 6.044
366 HA2 GLY 53 2HA GLY 53 16.717 -3.280 5.314
367 HA3 GLY 53 1HA GLY 53 17.846 -1.972 5.651
368 H THR 54 H THR 54 20.214 -3.153 4.683
369 HA THR 54 HA THR 54 19.646 -3.540 1.801
370 HB THR 54 HB THR 54 21.713 -2.184 1.363
371 HG1 THR 54 1HG THR 54 22.768 -2.144 3.248
372 HG21 THR 54 3HG2 THR 54 20.570 0.033 2.090
373 HG22 THR 54 1HG2 THR 54 19.276 -1.009 2.685
374 HG23 THR 54 2HG2 THR 54 19.705 -1.024 0.974
375 H ALA 55 H ALA 55 20.551 -5.323 0.997
376 HA ALA 55 HA ALA 55 22.496 -6.793 2.614
377 HB1 ALA 55 1HB ALA 55 20.492 -7.922 1.602
378 HB2 ALA 55 2HB ALA 55 22.033 -8.658 1.161
379 HB3 ALA 55 3HB ALA 55 21.192 -7.617 0.012
380 H SER 56 H SER 56 24.226 -7.993 1.244
381 HA SER 56 HA SER 56 25.298 -6.374 -0.942
382 HB2 SER 56 2HB SER 56 26.728 -6.803 1.685
383 HB3 SER 56 1HB SER 56 27.550 -6.314 0.206
384 HG SER 56 HG SER 56 26.720 -4.623 1.735
385 H GLY 57 H GLY 57 27.528 -7.423 -1.608
386 HA2 GLY 57 2HA GLY 57 28.719 -9.277 -2.302
387 HA3 GLY 57 1HA GLY 57 27.828 -10.238 -1.126
388 H SER 58 H SER 58 27.318 -8.540 -4.231
389 HA SER 58 HA SER 58 26.013 -10.918 -5.311
390 HB2 SER 58 2HB SER 58 24.062 -9.524 -6.097
391 HB3 SER 58 1HB SER 58 24.110 -9.812 -4.359
392 HG SER 58 HG SER 58 23.908 -7.521 -5.465
393 H ASN 59 H ASN 59 28.505 -9.486 -5.853
394 HA ASN 59 HA ASN 59 28.016 -8.253 -8.478
395 HB2 ASN 59 2HB ASN 59 30.441 -7.658 -8.370
396 HB3 ASN 59 1HB ASN 59 29.495 -6.985 -7.047
397 HD21 ASN 59 1HD2 ASN 59 31.993 -9.351 -7.862
398 HD22 ASN 59 2HD2 ASN 59 32.417 -9.716 -6.260
399 H SER 60 H SER 60 28.340 -9.321 -10.322
400 HA SER 60 HA SER 60 30.299 -11.457 -10.518
401 HB2 SER 60 2HB SER 60 27.337 -11.960 -10.614
402 HB3 SER 60 1HB SER 60 28.446 -12.966 -11.541
403 HG SER 60 HG SER 60 28.161 -13.863 -9.505
404 HA PRO 61 HA PRO 61 30.389 -9.924 -14.675
405 HB2 PRO 61 2HB PRO 61 31.301 -12.061 -16.098
406 HB3 PRO 61 1HB PRO 61 32.325 -11.148 -14.973
407 HG2 PRO 61 2HG PRO 61 30.973 -13.769 -14.601
408 HG3 PRO 61 1HG PRO 61 32.569 -13.231 -14.054
409 HD2 PRO 61 2HD PRO 61 30.343 -13.340 -12.426
410 HD3 PRO 61 1HD PRO 61 31.731 -12.271 -12.138
411 H THR 62 H THR 62 29.285 -9.913 -16.693
412 HA THR 62 HA THR 62 26.733 -11.325 -16.659
413 HB THR 62 HB THR 62 26.266 -9.874 -18.665
414 HG1 THR 62 1HG THR 62 27.987 -9.080 -19.542
415 HG21 THR 62 3HG2 THR 62 27.261 -8.291 -16.290
416 HG22 THR 62 1HG2 THR 62 25.790 -9.262 -16.235
417 HG23 THR 62 2HG2 THR 62 25.910 -7.908 -17.358
Start of MODEL 16
1 H1 GLY 1 1HT GLY 1 -32.343 -20.354 11.170
2 H2 GLY 1 2HT GLY 1 -31.867 -20.011 9.574
3 H3 GLY 1 3HT GLY 1 -33.516 -20.077 9.977
4 HA2 GLY 1 2HA GLY 1 -32.956 -17.795 9.802
5 HA3 GLY 1 1HA GLY 1 -33.145 -18.168 11.516
6 H SER 2 H SER 2 -31.384 -16.266 9.770
7 HA SER 2 HA SER 2 -28.701 -17.047 10.607
8 HB2 SER 2 2HB SER 2 -29.832 -14.822 8.931
9 HB3 SER 2 1HB SER 2 -28.173 -14.755 9.517
10 HG SER 2 HG SER 2 -28.527 -15.784 7.410
11 H MET 3 H MET 3 -27.550 -16.136 12.244
12 HA MET 3 HA MET 3 -28.990 -14.261 14.010
13 HB2 MET 3 2HB MET 3 -27.987 -16.546 14.783
14 HB3 MET 3 1HB MET 3 -26.447 -15.689 14.745
15 HG2 MET 3 2HG MET 3 -27.385 -13.952 16.242
16 HG3 MET 3 1HG MET 3 -28.908 -14.840 16.302
17 HE1 MET 3 3HE MET 3 -25.322 -14.551 17.001
18 HE2 MET 3 1HE MET 3 -25.045 -16.218 16.477
19 HE3 MET 3 2HE MET 3 -24.884 -15.787 18.177
20 H ALA 4 H ALA 4 -27.758 -13.331 11.570
21 HA ALA 4 HA ALA 4 -25.484 -11.741 12.600
22 HB1 ALA 4 1HB ALA 4 -24.766 -11.500 10.298
23 HB2 ALA 4 2HB ALA 4 -26.214 -12.327 9.723
24 HB3 ALA 4 3HB ALA 4 -25.001 -13.211 10.647
25 H GLN 5 H GLN 5 -28.594 -11.605 10.932
26 HA GLN 5 HA GLN 5 -28.446 -8.678 10.765
27 HB2 GLN 5 2HB GLN 5 -30.368 -10.712 9.621
28 HB3 GLN 5 1HB GLN 5 -30.621 -8.971 9.499
29 HG2 GLN 5 2HG GLN 5 -28.000 -10.174 8.648
30 HG3 GLN 5 1HG GLN 5 -29.383 -10.206 7.555
31 HE21 GLN 5 1HE2 GLN 5 -30.322 -8.072 6.923
32 HE22 GLN 5 2HE2 GLN 5 -29.345 -6.674 6.992
33 H GLU 6 H GLU 6 -28.566 -9.637 13.383
34 HA GLU 6 HA GLU 6 -31.224 -8.660 14.210
35 HB2 GLU 6 2HB GLU 6 -31.202 -10.335 16.076
36 HB3 GLU 6 1HB GLU 6 -31.363 -11.060 14.477
37 HG2 GLU 6 2HG GLU 6 -29.141 -11.843 14.474
38 HG3 GLU 6 1HG GLU 6 -28.649 -10.726 15.745
39 H THR 7 H THR 7 -29.123 -6.979 14.028
40 HA THR 7 HA THR 7 -28.583 -6.359 16.845
41 HB THR 7 HB THR 7 -26.200 -5.776 16.222
42 HG1 THR 7 1HG THR 7 -25.689 -6.019 14.220
43 HG21 THR 7 3HG2 THR 7 -26.894 -8.703 15.893
44 HG22 THR 7 1HG2 THR 7 -26.947 -7.866 17.443
45 HG23 THR 7 2HG2 THR 7 -25.419 -8.020 16.577
46 H ASN 8 H ASN 8 -27.618 -4.113 17.041
47 HA ASN 8 HA ASN 8 -29.270 -2.273 15.598
48 HB2 ASN 8 2HB ASN 8 -28.459 -2.061 18.008
49 HB3 ASN 8 1HB ASN 8 -26.915 -1.547 17.334
50 HD21 ASN 8 1HD2 ASN 8 -30.293 -0.618 17.786
51 HD22 ASN 8 2HD2 ASN 8 -30.101 0.994 17.261
52 H GLN 9 H GLN 9 -25.865 -3.207 15.438
53 HA GLN 9 HA GLN 9 -25.365 -1.238 13.313
54 HB2 GLN 9 2HB GLN 9 -23.762 -1.677 15.290
55 HB3 GLN 9 1HB GLN 9 -23.349 -3.168 14.448
56 HG2 GLN 9 2HG GLN 9 -21.780 -1.800 13.472
57 HG3 GLN 9 1HG GLN 9 -23.117 -1.464 12.376
58 HE21 GLN 9 1HE2 GLN 9 -24.356 0.568 12.764
59 HE22 GLN 9 2HE2 GLN 9 -23.618 1.857 13.605
60 H THR 10 H THR 10 -25.253 -1.789 11.208
61 HA THR 10 HA THR 10 -24.932 -4.632 10.488
62 HB THR 10 HB THR 10 -27.316 -4.254 10.382
63 HG1 THR 10 1HG THR 10 -27.598 -4.710 8.193
64 HG21 THR 10 3HG2 THR 10 -27.015 -2.112 8.312
65 HG22 THR 10 1HG2 THR 10 -26.893 -1.662 10.013
66 HG23 THR 10 2HG2 THR 10 -28.359 -2.430 9.407
67 HA PRO 11 HA PRO 11 -22.091 -2.130 7.891
68 HB2 PRO 11 2HB PRO 11 -20.083 -3.915 7.714
69 HB3 PRO 11 1HB PRO 11 -20.353 -2.971 9.195
70 HG2 PRO 11 2HG PRO 11 -21.145 -5.784 8.579
71 HG3 PRO 11 1HG PRO 11 -20.406 -5.118 10.048
72 HD2 PRO 11 2HD PRO 11 -23.097 -5.604 9.826
73 HD3 PRO 11 1HD PRO 11 -22.419 -4.339 10.875
74 H GLY 12 H GLY 12 -20.699 -2.995 5.851
75 HA2 GLY 12 2HA GLY 12 -21.229 -5.105 4.264
76 HA3 GLY 12 1HA GLY 12 -22.658 -4.101 4.014
77 HA PRO 13 HA PRO 13 -20.269 -1.534 1.301
78 HB2 PRO 13 2HB PRO 13 -20.864 1.045 1.911
79 HB3 PRO 13 1HB PRO 13 -22.062 -0.081 1.243
80 HG2 PRO 13 2HG PRO 13 -21.762 0.949 3.990
81 HG3 PRO 13 1HG PRO 13 -23.212 0.399 3.133
82 HD2 PRO 13 2HD PRO 13 -21.705 -1.075 5.040
83 HD3 PRO 13 1HD PRO 13 -23.028 -1.684 4.021
84 H MET 14 H MET 14 -18.085 -1.901 1.685
85 HA MET 14 HA MET 14 -16.642 -0.713 3.848
86 HB2 MET 14 2HB MET 14 -15.945 -2.311 1.416
87 HB3 MET 14 1HB MET 14 -14.654 -1.417 2.220
88 HG2 MET 14 2HG MET 14 -16.536 -3.140 3.823
89 HG3 MET 14 1HG MET 14 -15.155 -3.859 2.994
90 HE1 MET 14 3HE MET 14 -16.410 -1.715 5.970
91 HE2 MET 14 1HE MET 14 -15.148 -2.317 7.054
92 HE3 MET 14 2HE MET 14 -16.127 -3.448 6.123
93 H LEU 15 H LEU 15 -17.243 1.520 3.651
94 HA LEU 15 HA LEU 15 -16.491 3.047 1.332
95 HB2 LEU 15 2HB LEU 15 -18.068 3.465 3.663
96 HB3 LEU 15 1HB LEU 15 -16.792 4.679 3.709
97 HG LEU 15 HG LEU 15 -17.373 5.264 1.321
98 HD11 LEU 15 1HD1 LEU 15 -18.589 2.943 1.094
99 HD12 LEU 15 2HD1 LEU 15 -19.246 4.349 0.254
100 HD13 LEU 15 3HD1 LEU 15 -19.969 3.807 1.768
101 HD21 LEU 15 3HD2 LEU 15 -18.303 6.341 3.502
102 HD22 LEU 15 1HD2 LEU 15 -19.805 5.516 3.084
103 HD23 LEU 15 2HD2 LEU 15 -19.117 6.707 1.980
104 H CYS 16 H CYS 16 -14.734 4.462 1.119
105 HA CYS 16 HA CYS 16 -12.262 3.622 1.948
106 HB2 CYS 16 2HB CYS 16 -12.899 5.395 0.184
107 HB3 CYS 16 1HB CYS 16 -12.782 6.549 1.517
108 H SER 17 H SER 17 -11.163 3.585 3.743
109 HA SER 17 HA SER 17 -12.087 4.601 6.211
110 HB2 SER 17 2HB SER 17 -9.426 3.521 5.306
111 HB3 SER 17 1HB SER 17 -9.682 4.087 6.959
112 HG SER 17 HG SER 17 -10.995 2.447 7.329
113 H THR 18 H THR 18 -10.049 6.033 3.745
114 HA THR 18 HA THR 18 -8.880 8.043 5.394
115 HB THR 18 HB THR 18 -8.164 9.083 3.306
116 HG1 THR 18 1HG THR 18 -9.459 8.894 1.698
117 HG21 THR 18 3HG2 THR 18 -6.974 7.132 2.333
118 HG22 THR 18 1HG2 THR 18 -8.033 6.050 3.242
119 HG23 THR 18 2HG2 THR 18 -6.921 7.120 4.094
120 H GLY 19 H GLY 19 -12.026 7.765 3.918
121 HA2 GLY 19 2HA GLY 19 -13.868 9.119 4.338
122 HA3 GLY 19 1HA GLY 19 -12.800 10.310 5.077
123 H CYS 20 H CYS 20 -12.350 8.940 1.851
124 HA CYS 20 HA CYS 20 -12.290 11.594 0.712
125 HB2 CYS 20 2HB CYS 20 -11.663 10.487 -1.373
126 HB3 CYS 20 1HB CYS 20 -10.699 9.867 -0.031
127 H GLY 21 H GLY 21 -14.760 9.231 1.182
128 HA2 GLY 21 2HA GLY 21 -17.046 9.702 0.863
129 HA3 GLY 21 1HA GLY 21 -16.611 10.886 -0.361
130 H PHE 22 H PHE 22 -14.916 8.006 -0.951
131 HA PHE 22 HA PHE 22 -16.958 7.120 -2.892
132 HB2 PHE 22 2HB PHE 22 -13.945 7.101 -3.112
133 HB3 PHE 22 1HB PHE 22 -15.032 6.310 -4.260
134 HD1 PHE 22 2HD PHE 22 -16.839 7.735 -5.388
135 HD2 PHE 22 1HD PHE 22 -13.486 9.417 -3.297
136 HE1 PHE 22 2HE PHE 22 -17.190 9.888 -6.567
137 HE2 PHE 22 1HE PHE 22 -13.830 11.575 -4.480
138 HZ PHE 22 HZ PHE 22 -15.686 11.806 -6.115
139 H TYR 23 H TYR 23 -16.684 4.799 -3.569
140 HA TYR 23 HA TYR 23 -16.861 3.105 -1.280
141 HB2 TYR 23 2HB TYR 23 -17.983 2.905 -3.637
142 HB3 TYR 23 1HB TYR 23 -16.505 2.041 -4.064
143 HD1 TYR 23 2HD TYR 23 -18.799 2.141 -1.068
144 HD2 TYR 23 1HD TYR 23 -16.708 -0.257 -3.955
145 HE1 TYR 23 2HE TYR 23 -19.677 0.085 0.007
146 HE2 TYR 23 1HE TYR 23 -17.585 -2.313 -2.884
147 HH TYR 23 HH TYR 23 -18.505 -2.715 -0.156
148 H GLY 24 H GLY 24 -15.509 1.513 -0.516
149 HA2 GLY 24 2HA GLY 24 -12.714 1.541 -1.513
150 HA3 GLY 24 1HA GLY 24 -13.165 1.298 0.176
151 H ASN 25 H ASN 25 -11.524 -0.567 -0.910
152 HA ASN 25 HA ASN 25 -13.295 -2.882 -1.460
153 HB2 ASN 25 2HB ASN 25 -11.500 -2.060 -3.209
154 HB3 ASN 25 1HB ASN 25 -10.386 -2.935 -2.167
155 HD21 ASN 25 1HD2 ASN 25 -10.145 -5.092 -2.737
156 HD22 ASN 25 2HD2 ASN 25 -11.324 -6.027 -3.537
157 HA PRO 26 HA PRO 26 -11.570 -4.467 2.338
158 HB2 PRO 26 2HB PRO 26 -12.566 -6.986 2.305
159 HB3 PRO 26 1HB PRO 26 -13.550 -5.547 2.633
160 HG2 PRO 26 2HG PRO 26 -13.366 -7.194 0.177
161 HG3 PRO 26 1HG PRO 26 -14.752 -6.328 0.857
162 HD2 PRO 26 2HD PRO 26 -13.153 -5.433 -1.267
163 HD3 PRO 26 1HD PRO 26 -14.271 -4.432 -0.320
164 H ARG 27 H ARG 27 -10.942 -6.062 -0.746
165 HA ARG 27 HA ARG 27 -8.937 -7.846 0.298
166 HB2 ARG 27 2HB ARG 27 -9.353 -6.949 -2.571
167 HB3 ARG 27 1HB ARG 27 -8.420 -8.339 -2.026
168 HG2 ARG 27 2HG ARG 27 -11.324 -8.107 -1.259
169 HG3 ARG 27 1HG ARG 27 -10.893 -8.697 -2.860
170 HD2 ARG 27 2HD ARG 27 -9.491 -10.455 -1.833
171 HD3 ARG 27 1HD ARG 27 -9.928 -9.863 -0.231
172 HE ARG 27 HE ARG 27 -12.258 -10.472 -1.775
173 HH11 ARG 27 1HH2 ARG 27 -9.706 -11.996 0.110
174 HH12 ARG 27 2HH2 ARG 27 -10.663 -13.392 0.460
175 HH21 ARG 27 1HH1 ARG 27 -13.446 -12.309 -1.281
176 HH22 ARG 27 2HH1 ARG 27 -12.766 -13.561 -0.294
177 H THR 28 H THR 28 -9.056 -4.573 -1.012
178 HA THR 28 HA THR 28 -6.186 -4.259 -1.197
179 HB THR 28 HB THR 28 -6.699 -1.892 -1.597
180 HG1 THR 28 1HG THR 28 -8.627 -1.064 -1.143
181 HG21 THR 28 3HG2 THR 28 -8.233 -2.129 -3.528
182 HG22 THR 28 1HG2 THR 28 -8.664 -3.743 -2.966
183 HG23 THR 28 2HG2 THR 28 -7.014 -3.404 -3.488
184 H ASN 29 H ASN 29 -6.040 -1.673 0.250
185 HA ASN 29 HA ASN 29 -5.727 -2.734 2.949
186 HB2 ASN 29 2HB ASN 29 -4.675 -0.416 1.394
187 HB3 ASN 29 1HB ASN 29 -4.809 -0.204 3.140
188 HD21 ASN 29 1HD2 ASN 29 -4.011 -3.254 1.398
189 HD22 ASN 29 2HD2 ASN 29 -2.460 -3.406 2.088
190 H GLY 30 H GLY 30 -8.504 -2.066 1.823
191 HA2 GLY 30 2HA GLY 30 -10.440 -1.351 2.873
192 HA3 GLY 30 1HA GLY 30 -9.451 -0.616 4.132
193 H MET 31 H MET 31 -8.383 0.289 1.010
194 HA MET 31 HA MET 31 -9.858 2.848 1.165
195 HB2 MET 31 2HB MET 31 -6.976 2.200 0.657
196 HB3 MET 31 1HB MET 31 -7.680 3.621 -0.116
197 HG2 MET 31 2HG MET 31 -6.759 4.356 1.951
198 HG3 MET 31 1HG MET 31 -8.502 4.327 2.180
199 HE1 MET 31 3HE MET 31 -5.079 2.820 3.933
200 HE2 MET 31 1HE MET 31 -6.095 3.436 5.241
201 HE3 MET 31 2HE MET 31 -5.866 4.389 3.778
202 H CYS 32 H CYS 32 -10.042 3.958 -0.923
203 HA CYS 32 HA CYS 32 -11.030 2.212 -2.949
204 HB2 CYS 32 2HB CYS 32 -11.758 4.259 -4.069
205 HB3 CYS 32 1HB CYS 32 -12.129 4.369 -2.350
206 H SER 33 H SER 33 -10.254 3.743 -5.292
207 HA SER 33 HA SER 33 -7.791 2.400 -5.856
208 HB2 SER 33 2HB SER 33 -9.889 3.173 -7.378
209 HB3 SER 33 1HB SER 33 -8.744 4.452 -7.765
210 HG SER 33 HG SER 33 -8.541 1.670 -8.137
211 H VAL 34 H VAL 34 -8.651 5.872 -5.598
212 HA VAL 34 HA VAL 34 -6.028 6.813 -6.205
213 HB VAL 34 HB VAL 34 -8.158 8.304 -4.644
214 HG11 VAL 34 1HG1 VAL 34 -6.981 10.177 -6.145
215 HG12 VAL 34 2HG1 VAL 34 -5.638 9.033 -6.093
216 HG13 VAL 34 3HG1 VAL 34 -6.300 9.685 -4.595
217 HG21 VAL 34 3HG2 VAL 34 -8.866 9.179 -6.889
218 HG22 VAL 34 1HG2 VAL 34 -9.195 7.459 -6.684
219 HG23 VAL 34 2HG2 VAL 34 -7.816 7.983 -7.647
220 H CYS 35 H CYS 35 -7.772 6.552 -3.118
221 HA CYS 35 HA CYS 35 -5.700 7.482 -1.463
222 HB2 CYS 35 2HB CYS 35 -7.990 5.618 -0.829
223 HB3 CYS 35 1HB CYS 35 -6.962 6.388 0.377
224 H TYR 36 H TYR 36 -6.447 4.185 -2.564
225 HA TYR 36 HA TYR 36 -4.751 2.790 -0.830
226 HB2 TYR 36 2HB TYR 36 -6.419 1.634 -2.153
227 HB3 TYR 36 1HB TYR 36 -5.596 2.080 -3.647
228 HD1 TYR 36 1HD TYR 36 -4.359 0.687 -0.363
229 HD2 TYR 36 2HD TYR 36 -4.653 0.184 -4.620
230 HE1 TYR 36 1HE TYR 36 -2.948 -1.348 -0.221
231 HE2 TYR 36 2HE TYR 36 -3.244 -1.852 -4.476
232 HH TYR 36 HH TYR 36 -2.563 -3.424 -1.564
233 H LYS 37 H LYS 37 -4.004 4.124 -4.042
234 HA LYS 37 HA LYS 37 -1.294 3.186 -3.949
235 HB2 LYS 37 2HB LYS 37 -0.935 4.522 -5.987
236 HB3 LYS 37 1HB LYS 37 -2.364 3.506 -6.118
237 HG2 LYS 37 2HG LYS 37 -3.737 5.522 -5.430
238 HG3 LYS 37 1HG LYS 37 -2.274 6.489 -5.603
239 HD2 LYS 37 2HD LYS 37 -2.106 5.408 -7.956
240 HD3 LYS 37 1HD LYS 37 -3.802 4.987 -7.721
241 HE2 LYS 37 2HE LYS 37 -4.217 7.433 -7.183
242 HE3 LYS 37 1HE LYS 37 -2.572 7.752 -7.731
243 HZ1 LYS 37 3HZ LYS 37 -3.077 7.092 -9.887
244 HZ2 LYS 37 1HZ LYS 37 -4.442 7.981 -9.423
245 HZ3 LYS 37 2HZ LYS 37 -4.499 6.284 -9.430
246 H GLU 38 H GLU 38 -2.868 6.327 -3.415
247 HA GLU 38 HA GLU 38 -0.610 7.897 -3.006
248 HB2 GLU 38 2HB GLU 38 -3.338 8.058 -1.716
249 HB3 GLU 38 1HB GLU 38 -2.102 9.305 -1.554
250 HG2 GLU 38 2HG GLU 38 -2.814 8.354 -4.312
251 HG3 GLU 38 1HG GLU 38 -3.925 9.449 -3.485
252 H HIS 39 H HIS 39 -2.206 5.694 -0.677
253 HA HIS 39 HA HIS 39 -0.401 6.622 1.425
254 HB2 HIS 39 2HB HIS 39 -1.640 5.395 2.995
255 HB3 HIS 39 1HB HIS 39 -2.820 6.076 1.888
256 HD1 HIS 39 1HD HIS 39 -4.654 4.438 1.756
257 HD2 HIS 39 2HD HIS 39 -0.959 2.514 1.657
258 HE1 HIS 39 1HE HIS 39 -5.138 1.966 1.525
259 HE2 HIS 39 2HE HIS 39 -2.898 0.781 1.431
260 H LEU 40 H LEU 40 -0.671 3.807 -0.675
261 HA LEU 40 HA LEU 40 1.149 2.119 0.685
262 HB2 LEU 40 2HB LEU 40 -0.399 1.537 -1.285
263 HB3 LEU 40 1HB LEU 40 0.875 2.199 -2.318
264 HG LEU 40 HG LEU 40 2.475 0.639 -1.006
265 HD11 LEU 40 1HD1 LEU 40 1.081 -1.496 -0.355
266 HD12 LEU 40 2HD1 LEU 40 -0.237 -0.341 -0.156
267 HD13 LEU 40 3HD1 LEU 40 1.237 -0.173 0.801
268 HD21 LEU 40 3HD2 LEU 40 2.040 0.175 -3.305
269 HD22 LEU 40 1HD2 LEU 40 0.379 -0.312 -2.967
270 HD23 LEU 40 2HD2 LEU 40 1.719 -1.337 -2.456
271 H GLN 41 H GLN 41 1.666 4.852 -1.435
272 HA GLN 41 HA GLN 41 4.361 4.362 -2.154
273 HB2 GLN 41 2HB GLN 41 2.565 6.193 -2.935
274 HB3 GLN 41 1HB GLN 41 3.477 7.185 -1.799
275 HG2 GLN 41 2HG GLN 41 4.627 7.500 -3.832
276 HG3 GLN 41 1HG GLN 41 5.579 6.254 -3.018
277 HE21 GLN 41 1HE2 GLN 41 4.581 6.950 -6.018
278 HE22 GLN 41 2HE2 GLN 41 4.259 5.385 -6.617
279 H ARG 42 H ARG 42 2.936 5.999 0.643
280 HA ARG 42 HA ARG 42 5.471 6.855 1.724
281 HB2 ARG 42 2HB ARG 42 3.110 7.868 2.150
282 HB3 ARG 42 1HB ARG 42 2.953 6.580 3.342
283 HG2 ARG 42 2HG ARG 42 3.912 8.160 4.710
284 HG3 ARG 42 1HG ARG 42 5.396 7.481 4.044
285 HD2 ARG 42 2HD ARG 42 5.709 9.777 3.718
286 HD3 ARG 42 1HD ARG 42 5.074 9.257 2.159
287 HE ARG 42 HE ARG 42 2.974 10.058 3.938
288 HH11 ARG 42 1HH2 ARG 42 5.426 11.315 1.746
289 HH12 ARG 42 2HH2 ARG 42 4.587 12.808 1.501
290 HH21 ARG 42 1HH1 ARG 42 1.931 12.016 3.573
291 HH22 ARG 42 2HH1 ARG 42 2.632 13.201 2.520
292 H GLN 43 H GLN 43 3.410 4.027 1.999
293 HA GLN 43 HA GLN 43 4.638 2.973 4.371
294 HB2 GLN 43 2HB GLN 43 2.309 2.446 3.080
295 HB3 GLN 43 1HB GLN 43 3.294 1.125 2.464
296 HG2 GLN 43 2HG GLN 43 2.507 0.132 4.389
297 HG3 GLN 43 1HG GLN 43 3.961 0.891 5.035
298 HE21 GLN 43 1HE2 GLN 43 0.628 0.603 5.550
299 HE22 GLN 43 2HE2 GLN 43 0.406 1.973 6.526
300 H GLN 44 H GLN 44 5.075 2.529 0.883
301 HA GLN 44 HA GLN 44 6.982 0.399 1.137
302 HB2 GLN 44 2HB GLN 44 5.476 1.027 -0.891
303 HB3 GLN 44 1HB GLN 44 6.770 2.158 -1.287
304 HG2 GLN 44 2HG GLN 44 8.400 0.336 -1.306
305 HG3 GLN 44 1HG GLN 44 7.157 -0.813 -0.818
306 HE21 GLN 44 1HE2 GLN 44 5.897 -1.753 -2.464
307 HE22 GLN 44 2HE2 GLN 44 5.960 -1.273 -4.100
308 H ASN 45 H ASN 45 7.212 3.901 0.565
309 HA ASN 45 HA ASN 45 10.005 4.032 0.175
310 HB2 ASN 45 2HB ASN 45 8.240 5.843 -0.240
311 HB3 ASN 45 1HB ASN 45 8.386 6.215 1.478
312 HD21 ASN 45 1HD2 ASN 45 9.785 7.934 1.778
313 HD22 ASN 45 2HD2 ASN 45 11.214 8.202 0.885
314 H SER 46 H SER 46 8.062 3.937 3.112
315 HA SER 46 HA SER 46 10.302 4.529 4.857
316 HB2 SER 46 2HB SER 46 7.537 3.495 5.531
317 HB3 SER 46 1HB SER 46 8.709 4.153 6.669
318 HG SER 46 HG SER 46 7.548 5.898 6.183
319 H GLY 47 H GLY 47 8.084 1.722 4.667
320 HA2 GLY 47 2HA GLY 47 8.647 -0.549 4.492
321 HA3 GLY 47 1HA GLY 47 10.342 -0.127 4.704
322 H ARG 48 H ARG 48 10.571 1.097 7.026
323 HA ARG 48 HA ARG 48 9.117 -0.440 9.072
324 HB2 ARG 48 2HB ARG 48 12.103 -0.396 8.651
325 HB3 ARG 48 1HB ARG 48 11.409 -0.701 10.244
326 HG2 ARG 48 2HG ARG 48 10.082 -2.569 9.288
327 HG3 ARG 48 1HG ARG 48 10.840 -2.284 7.720
328 HD2 ARG 48 2HD ARG 48 12.156 -3.999 8.648
329 HD3 ARG 48 1HD ARG 48 13.082 -2.540 8.985
330 HE ARG 48 HE ARG 48 12.658 -2.835 11.252
331 HH11 ARG 48 1HH2 ARG 48 10.565 -4.990 9.412
332 HH12 ARG 48 2HH2 ARG 48 10.031 -5.834 10.822
333 HH21 ARG 48 1HH1 ARG 48 11.936 -3.987 13.034
334 HH22 ARG 48 2HH1 ARG 48 10.797 -5.278 12.846
335 H MET 49 H MET 49 11.930 1.767 8.989
336 HA MET 49 HA MET 49 10.617 3.453 11.016
337 HB2 MET 49 2HB MET 49 13.476 3.202 10.077
338 HB3 MET 49 1HB MET 49 12.933 4.486 11.157
339 HG2 MET 49 2HG MET 49 12.007 2.683 12.675
340 HG3 MET 49 1HG MET 49 12.832 1.502 11.658
341 HE1 MET 49 3HE MET 49 13.071 3.239 14.869
342 HE2 MET 49 1HE MET 49 14.593 2.426 15.261
343 HE3 MET 49 2HE MET 49 13.258 1.514 14.561
344 H SER 50 H SER 50 10.316 5.667 10.714
345 HA SER 50 HA SER 50 10.409 6.567 7.900
346 HB2 SER 50 2HB SER 50 8.683 8.176 8.535
347 HB3 SER 50 1HB SER 50 8.181 6.548 8.984
348 HG SER 50 HG SER 50 9.143 8.647 10.611
349 HA PRO 51 HA PRO 51 13.699 9.416 8.838
350 HB2 PRO 51 2HB PRO 51 12.266 11.416 7.155
351 HB3 PRO 51 1HB PRO 51 13.922 10.795 7.012
352 HG2 PRO 51 2HG PRO 51 12.013 10.040 5.328
353 HG3 PRO 51 1HG PRO 51 13.262 8.911 5.881
354 HD2 PRO 51 2HD PRO 51 10.392 9.105 6.725
355 HD3 PRO 51 1HD PRO 51 11.413 7.666 6.517
356 H MET 52 H MET 52 10.713 11.368 8.488
357 HA MET 52 HA MET 52 11.376 12.755 11.008
358 HB2 MET 52 2HB MET 52 10.952 14.039 8.841
359 HB3 MET 52 1HB MET 52 9.265 13.554 9.003
360 HG2 MET 52 2HG MET 52 9.283 14.546 11.321
361 HG3 MET 52 1HG MET 52 10.890 15.185 10.970
362 HE1 MET 52 3HE MET 52 8.885 18.385 10.806
363 HE2 MET 52 1HE MET 52 10.578 17.872 10.842
364 HE3 MET 52 2HE MET 52 9.404 17.123 11.920
365 H GLY 53 H GLY 53 8.454 11.595 9.294
366 HA2 GLY 53 2HA GLY 53 7.255 9.836 10.803
367 HA3 GLY 53 1HA GLY 53 7.108 11.221 11.884
368 H THR 54 H THR 54 6.439 13.298 10.403
369 HA THR 54 HA THR 54 4.281 12.561 8.563
370 HB THR 54 HB THR 54 3.114 12.626 10.680
371 HG1 THR 54 1HG THR 54 1.648 13.688 9.661
372 HG21 THR 54 3HG2 THR 54 4.699 13.876 12.033
373 HG22 THR 54 1HG2 THR 54 3.148 14.716 12.065
374 HG23 THR 54 2HG2 THR 54 4.457 15.320 11.049
375 H ALA 55 H ALA 55 3.628 14.256 7.175
376 HA ALA 55 HA ALA 55 5.151 16.771 7.313
377 HB1 ALA 55 1HB ALA 55 5.688 16.568 4.888
378 HB2 ALA 55 2HB ALA 55 5.065 14.919 4.921
379 HB3 ALA 55 3HB ALA 55 6.489 15.342 5.872
380 H SER 56 H SER 56 3.737 18.386 7.167
381 HA SER 56 HA SER 56 1.582 18.269 5.192
382 HB2 SER 56 2HB SER 56 0.679 17.367 7.371
383 HB3 SER 56 1HB SER 56 1.003 18.947 8.081
384 HG SER 56 HG SER 56 -1.157 18.332 6.938
385 H GLY 57 H GLY 57 2.202 20.009 4.024
386 HA2 GLY 57 2HA GLY 57 2.467 22.229 3.473
387 HA3 GLY 57 1HA GLY 57 1.835 22.633 5.066
388 H SER 58 H SER 58 4.709 20.705 4.271
389 HA SER 58 HA SER 58 6.333 22.529 5.914
390 HB2 SER 58 2HB SER 58 7.182 19.855 4.814
391 HB3 SER 58 1HB SER 58 7.861 20.739 6.177
392 HG SER 58 HG SER 58 6.068 18.905 6.317
393 H ASN 59 H ASN 59 6.817 20.608 2.930
394 HA ASN 59 HA ASN 59 8.694 22.652 1.963
395 HB2 ASN 59 2HB ASN 59 9.243 20.962 0.210
396 HB3 ASN 59 1HB ASN 59 9.534 20.389 1.849
397 HD21 ASN 59 1HD2 ASN 59 8.165 19.461 -1.072
398 HD22 ASN 59 2HD2 ASN 59 7.092 18.279 -0.496
399 H SER 60 H SER 60 8.117 24.118 0.500
400 HA SER 60 HA SER 60 6.148 23.507 -1.548
401 HB2 SER 60 2HB SER 60 4.913 24.353 0.550
402 HB3 SER 60 1HB SER 60 5.642 25.916 0.189
403 HG SER 60 HG SER 60 3.549 25.569 -0.780
404 HA PRO 61 HA PRO 61 9.381 26.439 -3.003
405 HB2 PRO 61 2HB PRO 61 9.972 25.226 -5.342
406 HB3 PRO 61 1HB PRO 61 10.616 24.639 -3.796
407 HG2 PRO 61 2HG PRO 61 8.390 23.571 -5.448
408 HG3 PRO 61 1HG PRO 61 9.604 22.708 -4.488
409 HD2 PRO 61 2HD PRO 61 6.981 23.219 -3.669
410 HD3 PRO 61 1HD PRO 61 8.324 22.795 -2.590
411 H THR 62 H THR 62 9.338 28.019 -4.705
412 HA THR 62 HA THR 62 7.148 27.981 -6.622
413 HB THR 62 HB THR 62 7.336 30.307 -4.712
414 HG1 THR 62 1HG THR 62 6.112 29.262 -3.370
415 HG21 THR 62 3HG2 THR 62 5.168 29.336 -6.593
416 HG22 THR 62 1HG2 THR 62 6.275 30.670 -6.921
417 HG23 THR 62 2HG2 THR 62 5.106 30.797 -5.606
Start of MODEL 17
1 H1 GLY 1 1HT GLY 1 -41.368 -3.337 8.544
2 H2 GLY 1 2HT GLY 1 -40.124 -3.621 9.667
3 H3 GLY 1 3HT GLY 1 -39.838 -2.640 8.309
4 HA2 GLY 1 2HA GLY 1 -41.241 -0.930 9.117
5 HA3 GLY 1 1HA GLY 1 -41.817 -1.975 10.416
6 H SER 2 H SER 2 -41.100 -0.316 11.912
7 HA SER 2 HA SER 2 -38.216 0.109 12.149
8 HB2 SER 2 2HB SER 2 -38.877 1.658 13.988
9 HB3 SER 2 1HB SER 2 -39.632 2.056 12.447
10 HG SER 2 HG SER 2 -40.769 0.623 14.622
11 H MET 3 H MET 3 -36.942 -0.782 13.694
12 HA MET 3 HA MET 3 -38.176 -2.264 15.911
13 HB2 MET 3 2HB MET 3 -36.338 -3.439 13.825
14 HB3 MET 3 1HB MET 3 -36.526 -4.154 15.426
15 HG2 MET 3 2HG MET 3 -38.985 -4.290 15.045
16 HG3 MET 3 1HG MET 3 -38.742 -3.668 13.412
17 HE1 MET 3 3HE MET 3 -40.108 -5.790 12.672
18 HE2 MET 3 1HE MET 3 -40.150 -6.443 14.316
19 HE3 MET 3 2HE MET 3 -39.622 -7.456 12.974
20 H ALA 4 H ALA 4 -37.212 -1.660 17.735
21 HA ALA 4 HA ALA 4 -34.575 -0.391 17.630
22 HB1 ALA 4 1HB ALA 4 -35.052 0.405 19.849
23 HB2 ALA 4 2HB ALA 4 -36.424 -0.694 20.004
24 HB3 ALA 4 3HB ALA 4 -36.497 0.656 18.870
25 H GLN 5 H GLN 5 -36.186 -3.231 18.979
26 HA GLN 5 HA GLN 5 -33.866 -4.070 20.494
27 HB2 GLN 5 2HB GLN 5 -36.399 -4.562 20.950
28 HB3 GLN 5 1HB GLN 5 -36.158 -5.881 19.805
29 HG2 GLN 5 2HG GLN 5 -34.230 -5.480 22.081
30 HG3 GLN 5 1HG GLN 5 -35.749 -6.334 22.344
31 HE21 GLN 5 1HE2 GLN 5 -32.807 -7.301 22.196
32 HE22 GLN 5 2HE2 GLN 5 -32.871 -8.592 21.085
33 H GLU 6 H GLU 6 -35.426 -4.918 17.432
34 HA GLU 6 HA GLU 6 -33.733 -7.139 16.823
35 HB2 GLU 6 2HB GLU 6 -36.050 -6.446 15.815
36 HB3 GLU 6 1HB GLU 6 -35.076 -5.476 14.712
37 HG2 GLU 6 2HG GLU 6 -35.406 -7.602 13.652
38 HG3 GLU 6 1HG GLU 6 -33.737 -7.572 14.214
39 H THR 7 H THR 7 -32.035 -7.241 15.263
40 HA THR 7 HA THR 7 -30.165 -5.101 15.410
41 HB THR 7 HB THR 7 -30.058 -7.317 13.371
42 HG1 THR 7 1HG THR 7 -30.337 -8.525 15.097
43 HG21 THR 7 3HG2 THR 7 -28.256 -5.801 13.135
44 HG22 THR 7 1HG2 THR 7 -27.595 -7.125 14.095
45 HG23 THR 7 2HG2 THR 7 -28.072 -5.620 14.879
46 H ASN 8 H ASN 8 -30.783 -3.194 14.503
47 HA ASN 8 HA ASN 8 -31.918 -3.171 11.802
48 HB2 ASN 8 2HB ASN 8 -32.808 -1.765 13.753
49 HB3 ASN 8 1HB ASN 8 -31.371 -0.767 13.536
50 HD21 ASN 8 1HD2 ASN 8 -31.065 0.145 11.251
51 HD22 ASN 8 2HD2 ASN 8 -32.468 0.523 10.356
52 H GLN 9 H GLN 9 -29.062 -2.075 13.586
53 HA GLN 9 HA GLN 9 -27.859 -0.802 11.288
54 HB2 GLN 9 2HB GLN 9 -26.872 -1.483 14.058
55 HB3 GLN 9 1HB GLN 9 -25.827 -0.760 12.834
56 HG2 GLN 9 2HG GLN 9 -26.655 1.109 13.987
57 HG3 GLN 9 1HG GLN 9 -27.720 1.005 12.586
58 HE21 GLN 9 1HE2 GLN 9 -29.736 1.663 13.396
59 HE22 GLN 9 2HE2 GLN 9 -30.483 0.982 14.772
60 H THR 10 H THR 10 -26.424 -1.657 9.860
61 HA THR 10 HA THR 10 -25.112 -4.197 10.423
62 HB THR 10 HB THR 10 -27.222 -4.966 9.509
63 HG1 THR 10 1HG THR 10 -25.238 -5.068 7.486
64 HG21 THR 10 3HG2 THR 10 -28.366 -3.896 7.887
65 HG22 THR 10 1HG2 THR 10 -26.965 -3.893 6.815
66 HG23 THR 10 2HG2 THR 10 -27.173 -2.602 7.999
67 HA PRO 11 HA PRO 11 -22.343 -1.249 8.179
68 HB2 PRO 11 2HB PRO 11 -20.277 -3.120 9.217
69 HB3 PRO 11 1HB PRO 11 -20.367 -1.354 9.338
70 HG2 PRO 11 2HG PRO 11 -20.827 -2.943 11.434
71 HG3 PRO 11 1HG PRO 11 -21.689 -1.412 11.204
72 HD2 PRO 11 2HD PRO 11 -22.660 -4.210 10.759
73 HD3 PRO 11 1HD PRO 11 -23.545 -2.789 11.354
74 H GLY 12 H GLY 12 -22.821 -1.796 6.064
75 HA2 GLY 12 2HA GLY 12 -21.615 -4.282 4.981
76 HA3 GLY 12 1HA GLY 12 -23.063 -3.520 4.328
77 HA PRO 13 HA PRO 13 -20.772 -0.995 1.520
78 HB2 PRO 13 2HB PRO 13 -21.383 1.608 2.791
79 HB3 PRO 13 1HB PRO 13 -21.828 1.002 1.183
80 HG2 PRO 13 2HG PRO 13 -23.604 1.278 3.187
81 HG3 PRO 13 1HG PRO 13 -23.746 0.024 1.939
82 HD2 PRO 13 2HD PRO 13 -22.855 -0.229 4.781
83 HD3 PRO 13 1HD PRO 13 -23.753 -1.386 3.768
84 H MET 14 H MET 14 -18.626 -1.507 1.907
85 HA MET 14 HA MET 14 -17.115 -0.437 4.093
86 HB2 MET 14 2HB MET 14 -16.584 -2.169 1.730
87 HB3 MET 14 1HB MET 14 -15.196 -1.306 2.390
88 HG2 MET 14 2HG MET 14 -17.059 -2.814 4.217
89 HG3 MET 14 1HG MET 14 -15.784 -3.666 3.349
90 HE1 MET 14 3HE MET 14 -16.734 -2.944 6.269
91 HE2 MET 14 1HE MET 14 -16.423 -1.225 6.552
92 HE3 MET 14 2HE MET 14 -15.392 -2.445 7.297
93 H LEU 15 H LEU 15 -17.523 1.830 3.876
94 HA LEU 15 HA LEU 15 -16.688 3.272 1.537
95 HB2 LEU 15 2HB LEU 15 -17.927 3.883 4.135
96 HB3 LEU 15 1HB LEU 15 -16.811 5.135 3.596
97 HG LEU 15 HG LEU 15 -17.999 5.201 1.398
98 HD11 LEU 15 1HD1 LEU 15 -20.088 3.472 2.744
99 HD12 LEU 15 2HD1 LEU 15 -18.895 2.826 1.617
100 HD13 LEU 15 3HD1 LEU 15 -20.065 4.028 1.070
101 HD21 LEU 15 3HD2 LEU 15 -19.895 6.439 2.192
102 HD22 LEU 15 1HD2 LEU 15 -18.610 6.670 3.379
103 HD23 LEU 15 2HD2 LEU 15 -19.924 5.537 3.706
104 H CYS 16 H CYS 16 -14.871 4.563 1.256
105 HA CYS 16 HA CYS 16 -12.397 3.606 1.959
106 HB2 CYS 16 2HB CYS 16 -13.026 5.441 0.266
107 HB3 CYS 16 1HB CYS 16 -12.840 6.563 1.618
108 H SER 17 H SER 17 -11.075 3.638 3.663
109 HA SER 17 HA SER 17 -11.928 4.498 6.212
110 HB2 SER 17 2HB SER 17 -9.666 3.103 5.116
111 HB3 SER 17 1HB SER 17 -9.097 4.296 6.283
112 HG SER 17 HG SER 17 -9.687 2.297 7.257
113 H THR 18 H THR 18 -10.019 6.119 3.727
114 HA THR 18 HA THR 18 -9.135 8.274 5.408
115 HB THR 18 HB THR 18 -8.526 9.397 3.302
116 HG1 THR 18 1HG THR 18 -9.745 8.916 1.685
117 HG21 THR 18 3HG2 THR 18 -6.895 7.763 2.533
118 HG22 THR 18 1HG2 THR 18 -7.822 6.451 3.262
119 HG23 THR 18 2HG2 THR 18 -7.040 7.656 4.287
120 H GLY 19 H GLY 19 -12.195 7.514 4.013
121 HA2 GLY 19 2HA GLY 19 -14.196 8.624 4.156
122 HA3 GLY 19 1HA GLY 19 -13.364 9.922 5.014
123 H CYS 20 H CYS 20 -12.727 8.643 1.737
124 HA CYS 20 HA CYS 20 -12.733 11.346 0.700
125 HB2 CYS 20 2HB CYS 20 -12.056 10.344 -1.436
126 HB3 CYS 20 1HB CYS 20 -11.053 9.758 -0.111
127 H GLY 21 H GLY 21 -15.137 8.902 1.050
128 HA2 GLY 21 2HA GLY 21 -17.436 9.321 0.674
129 HA3 GLY 21 1HA GLY 21 -17.000 10.533 -0.525
130 H PHE 22 H PHE 22 -15.136 7.831 -1.153
131 HA PHE 22 HA PHE 22 -16.966 6.932 -3.261
132 HB2 PHE 22 2HB PHE 22 -13.958 6.825 -2.945
133 HB3 PHE 22 1HB PHE 22 -14.805 5.941 -4.210
134 HD1 PHE 22 2HD PHE 22 -14.499 9.382 -2.755
135 HD2 PHE 22 1HD PHE 22 -15.308 6.995 -6.236
136 HE1 PHE 22 2HE PHE 22 -14.585 11.437 -4.144
137 HE2 PHE 22 1HE PHE 22 -15.388 9.047 -7.626
138 HZ PHE 22 HZ PHE 22 -15.025 11.266 -6.579
139 H TYR 23 H TYR 23 -15.900 4.442 -3.795
140 HA TYR 23 HA TYR 23 -16.741 2.924 -1.414
141 HB2 TYR 23 2HB TYR 23 -17.743 2.677 -3.835
142 HB3 TYR 23 1HB TYR 23 -16.316 1.674 -4.107
143 HD1 TYR 23 2HD TYR 23 -18.812 2.178 -1.333
144 HD2 TYR 23 1HD TYR 23 -16.664 -0.597 -3.808
145 HE1 TYR 23 2HE TYR 23 -19.914 0.294 -0.168
146 HE2 TYR 23 1HE TYR 23 -17.771 -2.488 -2.646
147 HH TYR 23 HH TYR 23 -19.000 -2.489 0.086
148 H GLY 24 H GLY 24 -15.454 1.359 -0.460
149 HA2 GLY 24 2HA GLY 24 -12.620 1.339 -1.330
150 HA3 GLY 24 1HA GLY 24 -13.176 1.055 0.321
151 H ASN 25 H ASN 25 -11.421 -0.709 -0.909
152 HA ASN 25 HA ASN 25 -13.100 -3.088 -1.479
153 HB2 ASN 25 2HB ASN 25 -11.484 -2.128 -3.276
154 HB3 ASN 25 1HB ASN 25 -10.220 -2.826 -2.276
155 HD21 ASN 25 1HD2 ASN 25 -11.740 -3.560 -5.000
156 HD22 ASN 25 2HD2 ASN 25 -11.918 -5.250 -4.832
157 HA PRO 26 HA PRO 26 -11.157 -4.453 2.384
158 HB2 PRO 26 2HB PRO 26 -12.368 -7.080 1.969
159 HB3 PRO 26 1HB PRO 26 -12.668 -5.876 3.233
160 HG2 PRO 26 2HG PRO 26 -14.439 -6.486 1.257
161 HG3 PRO 26 1HG PRO 26 -14.393 -4.932 2.108
162 HD2 PRO 26 2HD PRO 26 -13.398 -5.612 -0.632
163 HD3 PRO 26 1HD PRO 26 -14.098 -4.094 -0.028
164 H ARG 27 H ARG 27 -10.722 -5.864 -0.768
165 HA ARG 27 HA ARG 27 -8.741 -7.811 0.028
166 HB2 ARG 27 2HB ARG 27 -9.794 -6.743 -2.575
167 HB3 ARG 27 1HB ARG 27 -8.243 -7.584 -2.561
168 HG2 ARG 27 2HG ARG 27 -9.855 -9.276 -2.984
169 HG3 ARG 27 1HG ARG 27 -9.438 -9.454 -1.280
170 HD2 ARG 27 2HD ARG 27 -11.466 -8.574 -0.552
171 HD3 ARG 27 1HD ARG 27 -11.722 -7.664 -2.037
172 HE ARG 27 HE ARG 27 -11.752 -10.475 -2.547
173 HH11 ARG 27 1HH2 ARG 27 -13.718 -7.918 -1.144
174 HH12 ARG 27 2HH2 ARG 27 -15.207 -8.677 -1.588
175 HH21 ARG 27 1HH1 ARG 27 -13.719 -11.417 -3.090
176 HH22 ARG 27 2HH1 ARG 27 -15.211 -10.632 -2.687
177 H THR 28 H THR 28 -8.857 -4.476 -1.105
178 HA THR 28 HA THR 28 -6.003 -4.186 -1.416
179 HB THR 28 HB THR 28 -6.473 -1.803 -1.679
180 HG1 THR 28 1HG THR 28 -9.031 -2.503 -0.680
181 HG21 THR 28 3HG2 THR 28 -6.978 -2.721 -3.721
182 HG22 THR 28 1HG2 THR 28 -8.569 -2.082 -3.311
183 HG23 THR 28 2HG2 THR 28 -8.216 -3.789 -3.061
184 H ASN 29 H ASN 29 -5.710 -1.702 0.155
185 HA ASN 29 HA ASN 29 -5.297 -2.954 2.768
186 HB2 ASN 29 2HB ASN 29 -4.344 -0.307 1.661
187 HB3 ASN 29 1HB ASN 29 -3.958 -0.925 3.266
188 HD21 ASN 29 1HD2 ASN 29 -1.649 -0.794 2.398
189 HD22 ASN 29 2HD2 ASN 29 -1.062 -2.121 1.497
190 H GLY 30 H GLY 30 -8.052 -2.096 1.861
191 HA2 GLY 30 2HA GLY 30 -9.857 -1.465 3.193
192 HA3 GLY 30 1HA GLY 30 -8.744 -0.652 4.288
193 H MET 31 H MET 31 -8.059 0.205 1.057
194 HA MET 31 HA MET 31 -9.740 2.629 1.269
195 HB2 MET 31 2HB MET 31 -6.820 2.341 0.597
196 HB3 MET 31 1HB MET 31 -7.749 3.753 0.087
197 HG2 MET 31 2HG MET 31 -6.916 4.439 2.158
198 HG3 MET 31 1HG MET 31 -8.511 3.837 2.594
199 HE1 MET 31 3HE MET 31 -5.556 4.412 3.630
200 HE2 MET 31 1HE MET 31 -4.666 3.024 4.268
201 HE3 MET 31 2HE MET 31 -6.013 3.703 5.176
202 H CYS 32 H CYS 32 -9.984 3.774 -0.825
203 HA CYS 32 HA CYS 32 -10.943 1.966 -2.813
204 HB2 CYS 32 2HB CYS 32 -11.781 3.957 -3.932
205 HB3 CYS 32 1HB CYS 32 -12.080 4.092 -2.208
206 H SER 33 H SER 33 -10.272 3.558 -5.197
207 HA SER 33 HA SER 33 -7.800 2.249 -5.835
208 HB2 SER 33 2HB SER 33 -8.304 3.853 -7.992
209 HB3 SER 33 1HB SER 33 -8.980 2.252 -7.742
210 HG SER 33 HG SER 33 -10.226 4.636 -7.803
211 H VAL 34 H VAL 34 -8.763 5.708 -5.699
212 HA VAL 34 HA VAL 34 -6.178 6.706 -6.283
213 HB VAL 34 HB VAL 34 -8.240 8.241 -4.702
214 HG11 VAL 34 1HG1 VAL 34 -6.008 8.889 -6.619
215 HG12 VAL 34 2HG1 VAL 34 -6.264 9.491 -4.981
216 HG13 VAL 34 3HG1 VAL 34 -7.300 10.046 -6.297
217 HG21 VAL 34 3HG2 VAL 34 -8.284 7.479 -7.626
218 HG22 VAL 34 1HG2 VAL 34 -9.022 8.981 -7.069
219 HG23 VAL 34 2HG2 VAL 34 -9.604 7.434 -6.457
220 H CYS 35 H CYS 35 -7.918 6.672 -3.152
221 HA CYS 35 HA CYS 35 -5.868 7.719 -1.573
222 HB2 CYS 35 2HB CYS 35 -8.047 5.775 -0.784
223 HB3 CYS 35 1HB CYS 35 -7.080 6.730 0.337
224 H TYR 36 H TYR 36 -6.521 4.349 -2.462
225 HA TYR 36 HA TYR 36 -4.807 3.064 -0.672
226 HB2 TYR 36 2HB TYR 36 -6.404 1.820 -1.959
227 HB3 TYR 36 1HB TYR 36 -5.650 2.305 -3.473
228 HD1 TYR 36 1HD TYR 36 -3.692 1.256 -0.471
229 HD2 TYR 36 2HD TYR 36 -5.288 0.079 -4.282
230 HE1 TYR 36 1HE TYR 36 -2.290 -0.787 -0.428
231 HE2 TYR 36 2HE TYR 36 -3.899 -1.968 -4.232
232 HH TYR 36 HH TYR 36 -2.780 -3.401 -2.567
233 H LYS 37 H LYS 37 -4.090 4.505 -3.802
234 HA LYS 37 HA LYS 37 -1.353 3.615 -3.855
235 HB2 LYS 37 2HB LYS 37 -2.814 4.208 -5.865
236 HB3 LYS 37 1HB LYS 37 -2.525 5.897 -5.445
237 HG2 LYS 37 2HG LYS 37 0.006 5.120 -5.391
238 HG3 LYS 37 1HG LYS 37 -0.590 3.825 -6.431
239 HD2 LYS 37 2HD LYS 37 -0.110 5.405 -8.051
240 HD3 LYS 37 1HD LYS 37 -1.771 5.870 -7.688
241 HE2 LYS 37 2HE LYS 37 -0.709 7.405 -5.875
242 HE3 LYS 37 1HE LYS 37 0.788 7.169 -6.773
243 HZ1 LYS 37 3HZ LYS 37 -1.716 8.452 -7.661
244 HZ2 LYS 37 1HZ LYS 37 -0.624 7.821 -8.797
245 HZ3 LYS 37 2HZ LYS 37 -0.126 9.048 -7.733
246 H GLU 38 H GLU 38 -3.020 6.669 -3.155
247 HA GLU 38 HA GLU 38 -0.840 8.329 -2.728
248 HB2 GLU 38 2HB GLU 38 -3.629 8.302 -1.621
249 HB3 GLU 38 1HB GLU 38 -2.469 9.514 -1.082
250 HG2 GLU 38 2HG GLU 38 -2.816 9.013 -4.028
251 HG3 GLU 38 1HG GLU 38 -3.994 10.010 -3.171
252 H HIS 39 H HIS 39 -2.339 6.075 -0.395
253 HA HIS 39 HA HIS 39 -0.515 7.030 1.681
254 HB2 HIS 39 2HB HIS 39 -1.702 5.771 3.256
255 HB3 HIS 39 1HB HIS 39 -2.930 6.359 2.148
256 HD1 HIS 39 1HD HIS 39 -4.589 4.612 1.581
257 HD2 HIS 39 2HD HIS 39 -0.857 2.929 2.349
258 HE1 HIS 39 1HE HIS 39 -4.876 2.104 1.402
259 HE2 HIS 39 2HE HIS 39 -2.617 1.064 1.888
260 H LEU 40 H LEU 40 -0.767 4.312 -0.499
261 HA LEU 40 HA LEU 40 1.103 2.576 0.705
262 HB2 LEU 40 2HB LEU 40 -0.461 2.021 -1.196
263 HB3 LEU 40 1HB LEU 40 0.627 2.913 -2.263
264 HG LEU 40 HG LEU 40 2.491 1.404 -1.499
265 HD11 LEU 40 1HD1 LEU 40 1.645 -0.810 -0.510
266 HD12 LEU 40 2HD1 LEU 40 0.169 0.066 -0.103
267 HD13 LEU 40 3HD1 LEU 40 1.713 0.570 0.586
268 HD21 LEU 40 3HD2 LEU 40 0.991 1.071 -3.576
269 HD22 LEU 40 1HD2 LEU 40 0.200 -0.201 -2.646
270 HD23 LEU 40 2HD2 LEU 40 1.920 -0.322 -3.025
271 H GLN 41 H GLN 41 1.545 5.436 -1.288
272 HA GLN 41 HA GLN 41 4.186 5.076 -2.163
273 HB2 GLN 41 2HB GLN 41 2.519 6.968 -2.718
274 HB3 GLN 41 1HB GLN 41 3.164 7.762 -1.281
275 HG2 GLN 41 2HG GLN 41 5.494 7.258 -2.317
276 HG3 GLN 41 1HG GLN 41 4.603 7.015 -3.823
277 HE21 GLN 41 1HE2 GLN 41 4.223 8.877 -5.029
278 HE22 GLN 41 2HE2 GLN 41 4.291 10.466 -4.410
279 H ARG 42 H ARG 42 2.965 6.245 0.936
280 HA ARG 42 HA ARG 42 5.577 6.901 1.968
281 HB2 ARG 42 2HB ARG 42 2.842 6.717 3.232
282 HB3 ARG 42 1HB ARG 42 4.292 7.136 4.143
283 HG2 ARG 42 2HG ARG 42 3.522 8.614 1.623
284 HG3 ARG 42 1HG ARG 42 2.898 9.089 3.202
285 HD2 ARG 42 2HD ARG 42 5.854 8.773 2.633
286 HD3 ARG 42 1HD ARG 42 5.007 10.302 2.456
287 HE ARG 42 HE ARG 42 5.670 8.949 4.947
288 HH11 ARG 42 1HH2 ARG 42 3.734 11.475 3.429
289 HH12 ARG 42 2HH2 ARG 42 3.535 12.341 4.908
290 HH21 ARG 42 1HH1 ARG 42 5.365 10.126 6.825
291 HH22 ARG 42 2HH1 ARG 42 4.441 11.591 6.805
292 H GLN 43 H GLN 43 3.504 4.077 1.981
293 HA GLN 43 HA GLN 43 4.930 2.764 4.133
294 HB2 GLN 43 2HB GLN 43 2.687 1.997 2.293
295 HB3 GLN 43 1HB GLN 43 3.533 0.750 3.207
296 HG2 GLN 43 2HG GLN 43 3.145 2.407 5.230
297 HG3 GLN 43 1HG GLN 43 1.845 3.021 4.212
298 HE21 GLN 43 1HE2 GLN 43 -0.029 2.111 5.113
299 HE22 GLN 43 2HE2 GLN 43 -0.234 0.454 5.426
300 H GLN 44 H GLN 44 5.008 2.762 0.606
301 HA GLN 44 HA GLN 44 6.671 0.433 0.397
302 HB2 GLN 44 2HB GLN 44 6.888 1.024 -1.966
303 HB3 GLN 44 1HB GLN 44 5.207 1.128 -1.455
304 HG2 GLN 44 2HG GLN 44 5.426 3.578 -1.215
305 HG3 GLN 44 1HG GLN 44 7.114 3.475 -1.704
306 HE21 GLN 44 1HE2 GLN 44 7.511 3.672 -3.907
307 HE22 GLN 44 2HE2 GLN 44 6.332 3.494 -5.127
308 H ASN 45 H ASN 45 7.282 3.824 0.919
309 HA ASN 45 HA ASN 45 9.943 3.988 -0.006
310 HB2 ASN 45 2HB ASN 45 8.224 5.808 0.912
311 HB3 ASN 45 1HB ASN 45 9.110 5.543 2.411
312 HD21 ASN 45 1HD2 ASN 45 11.625 5.643 2.108
313 HD22 ASN 45 2HD2 ASN 45 12.200 6.847 1.047
314 H SER 46 H SER 46 8.585 2.975 3.103
315 HA SER 46 HA SER 46 11.275 2.410 4.149
316 HB2 SER 46 2HB SER 46 10.091 1.993 6.284
317 HB3 SER 46 1HB SER 46 9.742 3.598 5.647
318 HG SER 46 HG SER 46 7.749 2.935 5.895
319 H GLY 47 H GLY 47 8.155 0.826 3.491
320 HA2 GLY 47 2HA GLY 47 7.642 -1.360 2.979
321 HA3 GLY 47 1HA GLY 47 9.363 -1.631 2.704
322 H ARG 48 H ARG 48 7.687 -0.562 5.648
323 HA ARG 48 HA ARG 48 9.174 -2.394 7.282
324 HB2 ARG 48 2HB ARG 48 6.980 -0.406 7.807
325 HB3 ARG 48 1HB ARG 48 7.537 -1.507 9.069
326 HG2 ARG 48 2HG ARG 48 9.534 0.088 7.485
327 HG3 ARG 48 1HG ARG 48 8.683 0.836 8.836
328 HD2 ARG 48 2HD ARG 48 9.399 -1.155 10.240
329 HD3 ARG 48 1HD ARG 48 10.444 -1.624 8.903
330 HE ARG 48 HE ARG 48 10.981 1.067 9.530
331 HH11 ARG 48 1HH2 ARG 48 11.350 -2.110 10.999
332 HH12 ARG 48 2HH2 ARG 48 12.735 -1.632 11.917
333 HH21 ARG 48 1HH1 ARG 48 12.776 1.619 10.745
334 HH22 ARG 48 2HH1 ARG 48 13.534 0.452 11.776
335 H MET 49 H MET 49 8.521 -4.229 8.313
336 HA MET 49 HA MET 49 5.845 -5.301 7.624
337 HB2 MET 49 2HB MET 49 6.906 -7.563 7.644
338 HB3 MET 49 1HB MET 49 7.498 -6.529 6.348
339 HG2 MET 49 2HG MET 49 8.984 -6.467 8.948
340 HG3 MET 49 1HG MET 49 9.165 -7.907 7.947
341 HE1 MET 49 3HE MET 49 12.440 -6.250 7.223
342 HE2 MET 49 1HE MET 49 11.491 -7.242 8.339
343 HE3 MET 49 2HE MET 49 11.665 -5.511 8.621
344 H SER 50 H SER 50 6.577 -3.755 9.975
345 HA SER 50 HA SER 50 5.584 -5.553 11.997
346 HB2 SER 50 2HB SER 50 8.054 -6.008 11.984
347 HB3 SER 50 1HB SER 50 8.312 -4.323 12.425
348 HG SER 50 HG SER 50 8.136 -5.980 14.172
349 HA PRO 51 HA PRO 51 4.164 -1.527 13.336
350 HB2 PRO 51 2HB PRO 51 2.896 -2.200 15.627
351 HB3 PRO 51 1HB PRO 51 2.278 -2.684 14.036
352 HG2 PRO 51 2HG PRO 51 3.734 -4.285 16.066
353 HG3 PRO 51 1HG PRO 51 2.434 -4.766 14.967
354 HD2 PRO 51 2HD PRO 51 5.155 -5.275 14.566
355 HD3 PRO 51 1HD PRO 51 3.903 -5.342 13.311
356 H MET 52 H MET 52 6.084 -0.395 13.793
357 HA MET 52 HA MET 52 7.264 -0.734 16.477
358 HB2 MET 52 2HB MET 52 8.286 0.465 13.908
359 HB3 MET 52 1HB MET 52 9.073 0.778 15.457
360 HG2 MET 52 2HG MET 52 8.463 -2.028 14.519
361 HG3 MET 52 1HG MET 52 9.966 -1.211 14.093
362 HE1 MET 52 3HE MET 52 9.449 -3.863 17.358
363 HE2 MET 52 1HE MET 52 8.632 -3.643 15.804
364 HE3 MET 52 2HE MET 52 7.970 -2.911 17.263
365 H GLY 53 H GLY 53 6.252 1.845 14.216
366 HA2 GLY 53 2HA GLY 53 5.191 3.856 14.632
367 HA3 GLY 53 1HA GLY 53 4.982 3.349 16.304
368 H THR 54 H THR 54 8.064 3.563 14.583
369 HA THR 54 HA THR 54 9.020 5.465 16.608
370 HB THR 54 HB THR 54 10.683 4.121 14.481
371 HG1 THR 54 1HG THR 54 10.457 2.326 15.514
372 HG21 THR 54 3HG2 THR 54 11.678 5.992 15.764
373 HG22 THR 54 1HG2 THR 54 12.467 4.458 16.134
374 HG23 THR 54 2HG2 THR 54 11.304 5.146 17.267
375 H ALA 55 H ALA 55 8.982 7.569 16.150
376 HA ALA 55 HA ALA 55 8.766 8.469 13.380
377 HB1 ALA 55 1HB ALA 55 8.463 9.805 16.061
378 HB2 ALA 55 2HB ALA 55 7.256 9.596 14.792
379 HB3 ALA 55 3HB ALA 55 8.574 10.748 14.575
380 H SER 56 H SER 56 10.704 8.455 12.356
381 HA SER 56 HA SER 56 12.805 10.193 13.437
382 HB2 SER 56 2HB SER 56 13.383 7.892 14.160
383 HB3 SER 56 1HB SER 56 13.342 7.371 12.479
384 HG SER 56 HG SER 56 15.450 8.016 13.404
385 H GLY 57 H GLY 57 12.704 11.700 11.844
386 HA2 GLY 57 2HA GLY 57 13.233 12.632 9.797
387 HA3 GLY 57 1HA GLY 57 13.764 11.043 9.257
388 H SER 58 H SER 58 10.578 12.070 10.471
389 HA SER 58 HA SER 58 9.284 10.822 8.182
390 HB2 SER 58 2HB SER 58 7.192 11.431 9.382
391 HB3 SER 58 1HB SER 58 8.298 10.495 10.382
392 HG SER 58 HG SER 58 7.344 12.466 11.330
393 H ASN 59 H ASN 59 9.342 14.061 9.687
394 HA ASN 59 HA ASN 59 8.083 15.250 7.348
395 HB2 ASN 59 2HB ASN 59 7.653 15.920 9.786
396 HB3 ASN 59 1HB ASN 59 9.221 16.722 9.720
397 HD21 ASN 59 1HD2 ASN 59 9.473 18.422 7.963
398 HD22 ASN 59 2HD2 ASN 59 8.092 19.276 7.466
399 H SER 60 H SER 60 9.324 15.594 5.606
400 HA SER 60 HA SER 60 12.176 16.121 5.867
401 HB2 SER 60 2HB SER 60 12.055 16.178 3.342
402 HB3 SER 60 1HB SER 60 11.550 14.658 4.075
403 HG SER 60 HG SER 60 10.073 16.606 2.752
404 HA PRO 61 HA PRO 61 11.816 20.522 5.517
405 HB2 PRO 61 2HB PRO 61 14.085 21.231 4.191
406 HB3 PRO 61 1HB PRO 61 14.098 20.625 5.859
407 HG2 PRO 61 2HG PRO 61 14.753 19.214 3.326
408 HG3 PRO 61 1HG PRO 61 15.513 19.090 4.921
409 HD2 PRO 61 2HD PRO 61 13.696 17.256 3.927
410 HD3 PRO 61 1HD PRO 61 14.005 17.517 5.657
411 H THR 62 H THR 62 12.170 22.400 3.785
412 HA THR 62 HA THR 62 11.234 21.536 1.124
413 HB THR 62 HB THR 62 9.616 23.503 1.213
414 HG1 THR 62 1HG THR 62 10.163 24.616 2.968
415 HG21 THR 62 3HG2 THR 62 8.967 21.092 1.418
416 HG22 THR 62 1HG2 THR 62 7.892 22.182 2.292
417 HG23 THR 62 2HG2 THR 62 9.104 21.248 3.169
Start of MODEL 18
1 H1 GLY 1 1HT GLY 1 -26.812 -12.053 -20.840
2 H2 GLY 1 2HT GLY 1 -27.167 -12.269 -19.193
3 H3 GLY 1 3HT GLY 1 -26.527 -10.794 -19.740
4 HA2 GLY 1 2HA GLY 1 -28.568 -10.528 -21.140
5 HA3 GLY 1 1HA GLY 1 -29.228 -11.901 -20.249
6 H SER 2 H SER 2 -30.882 -10.427 -19.457
7 HA SER 2 HA SER 2 -30.012 -8.341 -17.596
8 HB2 SER 2 2HB SER 2 -32.761 -9.167 -18.552
9 HB3 SER 2 1HB SER 2 -32.441 -7.831 -17.449
10 HG SER 2 HG SER 2 -31.934 -6.675 -19.117
11 H MET 3 H MET 3 -29.248 -9.331 -15.771
12 HA MET 3 HA MET 3 -31.229 -10.577 -14.047
13 HB2 MET 3 2HB MET 3 -28.812 -12.059 -15.083
14 HB3 MET 3 1HB MET 3 -29.592 -12.494 -13.563
15 HG2 MET 3 2HG MET 3 -31.776 -12.643 -14.852
16 HG3 MET 3 1HG MET 3 -30.823 -12.493 -16.329
17 HE1 MET 3 3HE MET 3 -31.083 -16.105 -16.965
18 HE2 MET 3 1HE MET 3 -31.011 -14.437 -17.550
19 HE3 MET 3 2HE MET 3 -32.374 -14.971 -16.571
20 H ALA 4 H ALA 4 -29.661 -8.102 -14.052
21 HA ALA 4 HA ALA 4 -27.939 -8.518 -11.679
22 HB1 ALA 4 1HB ALA 4 -27.877 -6.494 -13.912
23 HB2 ALA 4 2HB ALA 4 -26.591 -7.567 -13.360
24 HB3 ALA 4 3HB ALA 4 -27.070 -6.187 -12.374
25 H GLN 5 H GLN 5 -30.830 -8.347 -11.547
26 HA GLN 5 HA GLN 5 -31.082 -5.884 -9.929
27 HB2 GLN 5 2HB GLN 5 -33.090 -6.999 -11.900
28 HB3 GLN 5 1HB GLN 5 -33.468 -5.754 -10.708
29 HG2 GLN 5 2HG GLN 5 -31.962 -4.203 -11.690
30 HG3 GLN 5 1HG GLN 5 -31.163 -5.458 -12.636
31 HE21 GLN 5 1HE2 GLN 5 -33.420 -2.976 -12.882
32 HE22 GLN 5 2HE2 GLN 5 -34.247 -3.520 -14.272
33 H GLU 6 H GLU 6 -30.375 -8.487 -9.029
34 HA GLU 6 HA GLU 6 -32.806 -9.525 -7.736
35 HB2 GLU 6 2HB GLU 6 -31.015 -10.993 -8.912
36 HB3 GLU 6 1HB GLU 6 -30.051 -10.702 -7.465
37 HG2 GLU 6 2HG GLU 6 -31.722 -11.685 -6.050
38 HG3 GLU 6 1HG GLU 6 -32.891 -11.739 -7.368
39 H THR 7 H THR 7 -29.466 -8.580 -6.881
40 HA THR 7 HA THR 7 -30.226 -8.292 -4.075
41 HB THR 7 HB THR 7 -27.526 -7.681 -5.264
42 HG1 THR 7 1HG THR 7 -27.561 -9.694 -5.863
43 HG21 THR 7 3HG2 THR 7 -28.539 -8.583 -2.557
44 HG22 THR 7 1HG2 THR 7 -27.786 -7.039 -2.956
45 HG23 THR 7 2HG2 THR 7 -26.829 -8.520 -2.989
46 H ASN 8 H ASN 8 -30.340 -6.379 -2.981
47 HA ASN 8 HA ASN 8 -29.838 -3.877 -4.478
48 HB2 ASN 8 2HB ASN 8 -32.321 -4.568 -4.270
49 HB3 ASN 8 1HB ASN 8 -32.143 -4.177 -2.560
50 HD21 ASN 8 1HD2 ASN 8 -33.000 -2.837 -5.520
51 HD22 ASN 8 2HD2 ASN 8 -32.724 -1.195 -5.151
52 H GLN 9 H GLN 9 -30.525 -5.285 -1.273
53 HA GLN 9 HA GLN 9 -28.999 -3.160 0.035
54 HB2 GLN 9 2HB GLN 9 -31.221 -4.102 0.914
55 HB3 GLN 9 1HB GLN 9 -30.298 -5.532 1.374
56 HG2 GLN 9 2HG GLN 9 -29.006 -4.359 2.933
57 HG3 GLN 9 1HG GLN 9 -29.341 -2.799 2.183
58 HE21 GLN 9 1HE2 GLN 9 -31.766 -2.123 2.297
59 HE22 GLN 9 2HE2 GLN 9 -32.592 -2.506 3.740
60 H THR 10 H THR 10 -27.038 -3.448 1.001
61 HA THR 10 HA THR 10 -25.881 -6.113 1.248
62 HB THR 10 HB THR 10 -24.409 -4.011 -0.344
63 HG1 THR 10 1HG THR 10 -25.451 -4.647 -2.039
64 HG21 THR 10 3HG2 THR 10 -23.148 -5.857 0.821
65 HG22 THR 10 1HG2 THR 10 -22.963 -5.853 -0.932
66 HG23 THR 10 2HG2 THR 10 -24.048 -7.012 -0.163
67 HA PRO 11 HA PRO 11 -24.886 -3.308 4.787
68 HB2 PRO 11 2HB PRO 11 -24.295 -5.898 6.109
69 HB3 PRO 11 1HB PRO 11 -25.337 -4.567 6.644
70 HG2 PRO 11 2HG PRO 11 -26.329 -6.882 5.748
71 HG3 PRO 11 1HG PRO 11 -27.143 -5.331 5.475
72 HD2 PRO 11 2HD PRO 11 -25.551 -6.990 3.557
73 HD3 PRO 11 1HD PRO 11 -26.988 -5.985 3.259
74 H GLY 12 H GLY 12 -22.907 -3.028 6.092
75 HA2 GLY 12 2HA GLY 12 -20.627 -3.063 6.461
76 HA3 GLY 12 1HA GLY 12 -20.515 -4.482 5.422
77 HA PRO 13 HA PRO 13 -20.408 -1.126 2.073
78 HB2 PRO 13 2HB PRO 13 -21.037 1.484 2.659
79 HB3 PRO 13 1HB PRO 13 -22.226 0.280 2.116
80 HG2 PRO 13 2HG PRO 13 -21.652 1.276 4.860
81 HG3 PRO 13 1HG PRO 13 -23.205 0.873 4.099
82 HD2 PRO 13 2HD PRO 13 -21.929 -0.796 5.856
83 HD3 PRO 13 1HD PRO 13 -23.000 -1.380 4.561
84 H MET 14 H MET 14 -18.180 -1.549 2.417
85 HA MET 14 HA MET 14 -16.521 -0.120 4.209
86 HB2 MET 14 2HB MET 14 -15.932 -1.708 1.707
87 HB3 MET 14 1HB MET 14 -14.663 -0.964 2.677
88 HG2 MET 14 2HG MET 14 -16.734 -2.788 3.905
89 HG3 MET 14 1HG MET 14 -15.242 -3.411 3.207
90 HE1 MET 14 3HE MET 14 -15.451 -4.037 6.505
91 HE2 MET 14 1HE MET 14 -13.693 -3.911 6.343
92 HE3 MET 14 2HE MET 14 -14.663 -4.520 5.005
93 H LEU 15 H LEU 15 -17.181 2.098 3.877
94 HA LEU 15 HA LEU 15 -16.569 3.394 1.356
95 HB2 LEU 15 2HB LEU 15 -17.835 4.158 3.925
96 HB3 LEU 15 1HB LEU 15 -16.927 5.447 3.138
97 HG LEU 15 HG LEU 15 -18.187 4.912 1.007
98 HD11 LEU 15 1HD1 LEU 15 -19.572 3.058 2.930
99 HD12 LEU 15 2HD1 LEU 15 -19.015 2.734 1.289
100 HD13 LEU 15 3HD1 LEU 15 -20.449 3.727 1.553
101 HD21 LEU 15 3HD2 LEU 15 -19.961 5.656 3.342
102 HD22 LEU 15 1HD2 LEU 15 -20.166 6.133 1.658
103 HD23 LEU 15 2HD2 LEU 15 -18.811 6.763 2.594
104 H CYS 16 H CYS 16 -14.844 4.856 0.994
105 HA CYS 16 HA CYS 16 -12.343 4.135 1.925
106 HB2 CYS 16 2HB CYS 16 -12.889 5.667 -0.039
107 HB3 CYS 16 1HB CYS 16 -12.949 6.975 1.147
108 H SER 17 H SER 17 -11.508 4.125 3.842
109 HA SER 17 HA SER 17 -12.494 5.446 6.111
110 HB2 SER 17 2HB SER 17 -9.759 4.259 5.626
111 HB3 SER 17 1HB SER 17 -10.395 4.721 7.208
112 HG SER 17 HG SER 17 -11.155 2.647 5.483
113 H THR 18 H THR 18 -10.346 6.708 3.667
114 HA THR 18 HA THR 18 -9.189 8.704 5.415
115 HB THR 18 HB THR 18 -8.192 9.619 3.346
116 HG1 THR 18 1HG THR 18 -9.631 9.208 1.789
117 HG21 THR 18 3HG2 THR 18 -6.766 8.028 4.237
118 HG22 THR 18 1HG2 THR 18 -7.104 7.284 2.676
119 HG23 THR 18 2HG2 THR 18 -7.961 6.737 4.116
120 H GLY 19 H GLY 19 -12.204 8.452 3.806
121 HA2 GLY 19 2HA GLY 19 -13.930 10.034 4.170
122 HA3 GLY 19 1HA GLY 19 -12.709 11.290 4.357
123 H CYS 20 H CYS 20 -13.025 8.928 1.710
124 HA CYS 20 HA CYS 20 -12.954 11.109 -0.224
125 HB2 CYS 20 2HB CYS 20 -12.818 8.109 -0.491
126 HB3 CYS 20 1HB CYS 20 -12.995 9.167 -1.890
127 H GLY 21 H GLY 21 -15.272 8.813 1.072
128 HA2 GLY 21 2HA GLY 21 -17.606 8.915 0.912
129 HA3 GLY 21 1HA GLY 21 -17.442 10.181 -0.305
130 H PHE 22 H PHE 22 -15.403 7.571 -1.055
131 HA PHE 22 HA PHE 22 -17.327 6.539 -3.034
132 HB2 PHE 22 2HB PHE 22 -14.298 6.574 -2.999
133 HB3 PHE 22 1HB PHE 22 -15.256 5.730 -4.219
134 HD1 PHE 22 1HD PHE 22 -17.396 7.433 -4.977
135 HD2 PHE 22 2HD PHE 22 -13.415 8.569 -3.810
136 HE1 PHE 22 1HE PHE 22 -17.632 9.557 -6.234
137 HE2 PHE 22 2HE PHE 22 -13.656 10.691 -5.069
138 HZ PHE 22 HZ PHE 22 -15.764 11.186 -6.281
139 H TYR 23 H TYR 23 -16.392 4.138 -3.659
140 HA TYR 23 HA TYR 23 -16.736 2.623 -1.172
141 HB2 TYR 23 2HB TYR 23 -18.056 2.253 -3.396
142 HB3 TYR 23 1HB TYR 23 -16.607 1.379 -3.903
143 HD1 TYR 23 1HD TYR 23 -18.692 1.670 -0.781
144 HD2 TYR 23 2HD TYR 23 -16.673 -0.922 -3.550
145 HE1 TYR 23 1HE TYR 23 -19.414 -0.294 0.534
146 HE2 TYR 23 2HE TYR 23 -17.403 -2.892 -2.237
147 HH TYR 23 HH TYR 23 -19.757 -3.036 -0.278
148 H GLY 24 H GLY 24 -15.319 1.143 -0.389
149 HA2 GLY 24 2HA GLY 24 -12.619 1.082 -1.624
150 HA3 GLY 24 1HA GLY 24 -12.921 0.965 0.113
151 H ASN 25 H ASN 25 -11.401 -0.982 -1.024
152 HA ASN 25 HA ASN 25 -13.232 -3.292 -1.307
153 HB2 ASN 25 2HB ASN 25 -11.485 -2.627 -3.155
154 HB3 ASN 25 1HB ASN 25 -10.342 -3.421 -2.076
155 HD21 ASN 25 1HD2 ASN 25 -13.322 -3.989 -3.965
156 HD22 ASN 25 2HD2 ASN 25 -13.159 -5.686 -4.004
157 HA PRO 26 HA PRO 26 -11.551 -4.608 2.620
158 HB2 PRO 26 2HB PRO 26 -12.412 -7.193 2.671
159 HB3 PRO 26 1HB PRO 26 -13.476 -5.800 2.940
160 HG2 PRO 26 2HG PRO 26 -13.124 -7.473 0.509
161 HG3 PRO 26 1HG PRO 26 -14.595 -6.756 1.185
162 HD2 PRO 26 2HD PRO 26 -13.210 -5.696 -0.955
163 HD3 PRO 26 1HD PRO 26 -14.263 -4.751 0.119
164 H ARG 27 H ARG 27 -10.837 -6.372 -0.354
165 HA ARG 27 HA ARG 27 -8.727 -7.986 0.753
166 HB2 ARG 27 2HB ARG 27 -9.365 -7.204 -2.108
167 HB3 ARG 27 1HB ARG 27 -8.143 -8.387 -1.635
168 HG2 ARG 27 2HG ARG 27 -9.753 -9.902 -0.813
169 HG3 ARG 27 1HG ARG 27 -10.997 -8.657 -0.695
170 HD2 ARG 27 2HD ARG 27 -11.372 -8.628 -3.006
171 HD3 ARG 27 1HD ARG 27 -9.801 -9.339 -3.367
172 HE ARG 27 HE ARG 27 -11.068 -11.306 -1.966
173 HH11 ARG 27 1HH2 ARG 27 -11.950 -9.424 -4.806
174 HH12 ARG 27 2HH2 ARG 27 -12.940 -10.684 -5.457
175 HH21 ARG 27 1HH1 ARG 27 -12.377 -12.888 -2.846
176 HH22 ARG 27 2HH1 ARG 27 -13.181 -12.625 -4.358
177 H THR 28 H THR 28 -9.014 -4.831 -0.805
178 HA THR 28 HA THR 28 -6.164 -4.365 -0.957
179 HB THR 28 HB THR 28 -6.808 -2.105 -1.665
180 HG1 THR 28 1HG THR 28 -8.725 -1.305 -1.249
181 HG21 THR 28 3HG2 THR 28 -8.642 -4.207 -2.833
182 HG22 THR 28 1HG2 THR 28 -6.986 -3.886 -3.341
183 HG23 THR 28 2HG2 THR 28 -8.237 -2.668 -3.595
184 H ASN 29 H ASN 29 -6.280 -1.613 0.183
185 HA ASN 29 HA ASN 29 -5.950 -2.368 2.975
186 HB2 ASN 29 2HB ASN 29 -4.539 -0.703 1.275
187 HB3 ASN 29 1HB ASN 29 -5.407 0.440 2.292
188 HD21 ASN 29 1HD2 ASN 29 -3.330 -2.497 2.523
189 HD22 ASN 29 2HD2 ASN 29 -2.631 -2.058 4.015
190 H GLY 30 H GLY 30 -8.733 -2.112 1.883
191 HA2 GLY 30 2HA GLY 30 -10.746 -1.327 2.639
192 HA3 GLY 30 1HA GLY 30 -9.885 -0.707 4.044
193 H MET 31 H MET 31 -8.728 0.452 0.988
194 HA MET 31 HA MET 31 -10.259 2.962 1.323
195 HB2 MET 31 2HB MET 31 -7.356 2.734 0.485
196 HB3 MET 31 1HB MET 31 -8.279 4.226 0.701
197 HG2 MET 31 2HG MET 31 -8.709 3.348 3.112
198 HG3 MET 31 1HG MET 31 -7.350 2.270 2.798
199 HE1 MET 31 3HE MET 31 -5.064 4.444 4.678
200 HE2 MET 31 1HE MET 31 -5.262 2.879 3.876
201 HE3 MET 31 2HE MET 31 -6.484 3.455 5.009
202 H CYS 32 H CYS 32 -9.785 4.336 -0.851
203 HA CYS 32 HA CYS 32 -10.903 2.681 -2.935
204 HB2 CYS 32 2HB CYS 32 -11.438 4.745 -4.056
205 HB3 CYS 32 1HB CYS 32 -11.852 4.918 -2.357
206 H SER 33 H SER 33 -10.025 3.618 -5.279
207 HA SER 33 HA SER 33 -7.542 2.291 -5.614
208 HB2 SER 33 2HB SER 33 -9.583 2.990 -7.275
209 HB3 SER 33 1HB SER 33 -8.360 4.156 -7.764
210 HG SER 33 HG SER 33 -7.137 2.574 -8.492
211 H VAL 34 H VAL 34 -8.343 5.763 -5.693
212 HA VAL 34 HA VAL 34 -5.735 6.668 -6.369
213 HB VAL 34 HB VAL 34 -7.768 8.269 -4.796
214 HG11 VAL 34 1HG1 VAL 34 -5.535 9.266 -5.133
215 HG12 VAL 34 2HG1 VAL 34 -6.767 10.140 -6.045
216 HG13 VAL 34 3HG1 VAL 34 -5.687 9.017 -6.873
217 HG21 VAL 34 3HG2 VAL 34 -7.745 7.464 -7.705
218 HG22 VAL 34 1HG2 VAL 34 -8.449 9.005 -7.212
219 HG23 VAL 34 2HG2 VAL 34 -9.100 7.495 -6.578
220 H CYS 35 H CYS 35 -7.321 6.087 -3.282
221 HA CYS 35 HA CYS 35 -5.292 7.258 -1.641
222 HB2 CYS 35 2HB CYS 35 -7.668 5.481 -1.159
223 HB3 CYS 35 1HB CYS 35 -6.520 5.806 0.143
224 H TYR 36 H TYR 36 -5.995 3.934 -2.676
225 HA TYR 36 HA TYR 36 -4.176 2.637 -0.985
226 HB2 TYR 36 2HB TYR 36 -5.994 1.509 -2.238
227 HB3 TYR 36 1HB TYR 36 -5.069 1.715 -3.718
228 HD1 TYR 36 1HD TYR 36 -4.028 0.730 -0.233
229 HD2 TYR 36 2HD TYR 36 -4.255 -0.372 -4.378
230 HE1 TYR 36 1HE TYR 36 -2.772 -1.351 0.252
231 HE2 TYR 36 2HE TYR 36 -2.999 -2.455 -3.890
232 HH TYR 36 HH TYR 36 -2.652 -3.942 -1.785
233 H LYS 37 H LYS 37 -3.632 4.196 -4.101
234 HA LYS 37 HA LYS 37 -0.970 3.116 -4.355
235 HB2 LYS 37 2HB LYS 37 -2.819 4.739 -5.965
236 HB3 LYS 37 1HB LYS 37 -1.153 5.283 -6.090
237 HG2 LYS 37 2HG LYS 37 -1.255 3.659 -7.774
238 HG3 LYS 37 1HG LYS 37 -0.621 2.731 -6.415
239 HD2 LYS 37 2HD LYS 37 -3.173 2.305 -5.894
240 HD3 LYS 37 1HD LYS 37 -3.383 2.703 -7.601
241 HE2 LYS 37 2HE LYS 37 -1.369 0.652 -6.646
242 HE3 LYS 37 1HE LYS 37 -3.028 0.227 -7.072
243 HZ1 LYS 37 3HZ LYS 37 -1.061 1.567 -8.854
244 HZ2 LYS 37 1HZ LYS 37 -2.664 1.194 -9.267
245 HZ3 LYS 37 2HZ LYS 37 -1.556 -0.055 -8.957
246 H GLU 38 H GLU 38 -2.440 6.235 -3.518
247 HA GLU 38 HA GLU 38 -0.069 7.690 -3.148
248 HB2 GLU 38 2HB GLU 38 -2.835 8.038 -1.998
249 HB3 GLU 38 1HB GLU 38 -1.531 9.188 -1.712
250 HG2 GLU 38 2HG GLU 38 -2.331 8.321 -4.497
251 HG3 GLU 38 1HG GLU 38 -3.079 9.701 -3.687
252 H HIS 39 H HIS 39 -2.044 5.938 -0.695
253 HA HIS 39 HA HIS 39 -0.195 6.735 1.369
254 HB2 HIS 39 2HB HIS 39 -1.587 5.729 2.947
255 HB3 HIS 39 1HB HIS 39 -2.672 6.359 1.715
256 HD1 HIS 39 1HD HIS 39 -4.500 4.800 1.249
257 HD2 HIS 39 2HD HIS 39 -1.023 2.739 2.228
258 HE1 HIS 39 1HE HIS 39 -5.121 2.346 1.321
259 HE2 HIS 39 2HE HIS 39 -3.006 1.075 1.921
260 H LEU 40 H LEU 40 -0.680 3.725 -0.435
261 HA LEU 40 HA LEU 40 1.145 2.123 1.024
262 HB2 LEU 40 2HB LEU 40 -0.481 1.328 -0.748
263 HB3 LEU 40 1HB LEU 40 0.638 1.963 -1.955
264 HG LEU 40 HG LEU 40 2.433 0.501 -1.014
265 HD11 LEU 40 1HD1 LEU 40 1.707 0.181 1.252
266 HD12 LEU 40 2HD1 LEU 40 1.605 -1.397 0.473
267 HD13 LEU 40 3HD1 LEU 40 0.143 -0.446 0.729
268 HD21 LEU 40 3HD2 LEU 40 1.259 -0.345 -2.932
269 HD22 LEU 40 1HD2 LEU 40 -0.145 -0.782 -1.958
270 HD23 LEU 40 2HD2 LEU 40 1.361 -1.680 -1.785
271 H GLN 41 H GLN 41 1.629 4.633 -1.324
272 HA GLN 41 HA GLN 41 4.318 4.042 -2.076
273 HB2 GLN 41 2HB GLN 41 2.396 6.201 -2.506
274 HB3 GLN 41 1HB GLN 41 4.029 6.825 -2.300
275 HG2 GLN 41 2HG GLN 41 4.812 5.178 -4.023
276 HG3 GLN 41 1HG GLN 41 3.125 4.733 -4.300
277 HE21 GLN 41 1HE2 GLN 41 5.370 7.532 -4.430
278 HE22 GLN 41 2HE2 GLN 41 4.472 8.387 -5.602
279 H ARG 42 H ARG 42 2.902 5.972 0.534
280 HA ARG 42 HA ARG 42 5.411 7.021 1.464
281 HB2 ARG 42 2HB ARG 42 2.673 6.905 2.740
282 HB3 ARG 42 1HB ARG 42 4.058 7.748 3.438
283 HG2 ARG 42 2HG ARG 42 4.244 9.095 1.339
284 HG3 ARG 42 1HG ARG 42 2.780 8.314 0.744
285 HD2 ARG 42 2HD ARG 42 1.452 9.267 2.480
286 HD3 ARG 42 1HD ARG 42 2.871 9.778 3.385
287 HE ARG 42 HE ARG 42 2.998 11.047 0.898
288 HH11 ARG 42 1HH2 ARG 42 0.823 11.030 3.667
289 HH12 ARG 42 2HH2 ARG 42 0.383 12.688 3.458
290 HH21 ARG 42 1HH1 ARG 42 2.390 13.199 0.688
291 HH22 ARG 42 2HH1 ARG 42 1.259 13.904 1.794
292 H GLN 43 H GLN 43 3.500 4.159 2.172
293 HA GLN 43 HA GLN 43 4.932 3.496 4.599
294 HB2 GLN 43 2HB GLN 43 3.005 1.934 2.870
295 HB3 GLN 43 1HB GLN 43 3.720 1.302 4.354
296 HG2 GLN 43 2HG GLN 43 2.739 3.123 5.646
297 HG3 GLN 43 1HG GLN 43 2.106 3.861 4.174
298 HE21 GLN 43 1HE2 GLN 43 -0.131 3.581 4.434
299 HE22 GLN 43 2HE2 GLN 43 -0.877 2.073 4.666
300 H GLN 44 H GLN 44 5.105 2.632 1.185
301 HA GLN 44 HA GLN 44 6.925 0.458 1.470
302 HB2 GLN 44 2HB GLN 44 5.416 1.178 -0.552
303 HB3 GLN 44 1HB GLN 44 6.812 2.157 -0.998
304 HG2 GLN 44 2HG GLN 44 8.231 0.085 -0.822
305 HG3 GLN 44 1HG GLN 44 6.751 -0.845 -0.588
306 HE21 GLN 44 1HE2 GLN 44 4.981 0.087 -2.416
307 HE22 GLN 44 2HE2 GLN 44 5.607 0.009 -4.001
308 H ASN 45 H ASN 45 7.352 3.923 0.785
309 HA ASN 45 HA ASN 45 10.165 3.831 0.408
310 HB2 ASN 45 2HB ASN 45 8.193 6.006 1.020
311 HB3 ASN 45 1HB ASN 45 9.922 6.347 1.082
312 HD21 ASN 45 1HD2 ASN 45 7.368 5.086 -1.104
313 HD22 ASN 45 2HD2 ASN 45 8.178 5.523 -2.540
314 H SER 46 H SER 46 8.231 3.720 3.301
315 HA SER 46 HA SER 46 9.998 4.858 5.169
316 HB2 SER 46 2HB SER 46 7.585 4.143 5.548
317 HB3 SER 46 1HB SER 46 8.198 2.502 5.729
318 HG SER 46 HG SER 46 7.999 3.859 7.695
319 H GLY 47 H GLY 47 9.572 1.397 4.333
320 HA2 GLY 47 2HA GLY 47 11.990 0.440 3.937
321 HA3 GLY 47 1HA GLY 47 12.116 0.775 5.661
322 H ARG 48 H ARG 48 9.957 -0.869 3.331
323 HA ARG 48 HA ARG 48 9.589 -3.040 5.319
324 HB2 ARG 48 2HB ARG 48 7.544 -1.551 4.826
325 HB3 ARG 48 1HB ARG 48 7.536 -2.314 3.235
326 HG2 ARG 48 2HG ARG 48 7.162 -4.470 4.141
327 HG3 ARG 48 1HG ARG 48 7.625 -3.958 5.765
328 HD2 ARG 48 2HD ARG 48 5.273 -2.699 4.373
329 HD3 ARG 48 1HD ARG 48 5.095 -4.227 5.230
330 HE ARG 48 HE ARG 48 6.384 -2.166 6.795
331 HH11 ARG 48 1HH2 ARG 48 3.281 -3.537 5.855
332 HH12 ARG 48 2HH2 ARG 48 2.471 -2.911 7.247
333 HH21 ARG 48 1HH1 ARG 48 5.270 -1.376 8.573
334 HH22 ARG 48 2HH1 ARG 48 3.579 -1.701 8.767
335 H MET 49 H MET 49 9.954 -5.078 4.618
336 HA MET 49 HA MET 49 10.541 -5.467 1.736
337 HB2 MET 49 2HB MET 49 11.899 -6.570 4.195
338 HB3 MET 49 1HB MET 49 12.061 -7.337 2.615
339 HG2 MET 49 2HG MET 49 12.821 -5.114 1.701
340 HG3 MET 49 1HG MET 49 12.843 -4.506 3.357
341 HE1 MET 49 3HE MET 49 15.045 -4.791 1.043
342 HE2 MET 49 1HE MET 49 16.531 -5.282 1.867
343 HE3 MET 49 2HE MET 49 15.550 -3.973 2.519
344 H SER 50 H SER 50 10.498 -7.943 1.244
345 HA SER 50 HA SER 50 8.459 -9.400 2.728
346 HB2 SER 50 2HB SER 50 7.169 -9.809 0.580
347 HB3 SER 50 1HB SER 50 7.010 -8.197 1.269
348 HG SER 50 HG SER 50 7.566 -8.536 -1.109
349 HA PRO 51 HA PRO 51 10.970 -12.755 1.290
350 HB2 PRO 51 2HB PRO 51 9.305 -14.879 1.550
351 HB3 PRO 51 1HB PRO 51 9.947 -13.999 2.951
352 HG2 PRO 51 2HG PRO 51 7.258 -13.851 1.691
353 HG3 PRO 51 1HG PRO 51 7.713 -13.783 3.401
354 HD2 PRO 51 2HD PRO 51 7.106 -11.560 1.856
355 HD3 PRO 51 1HD PRO 51 8.076 -11.518 3.344
356 H MET 52 H MET 52 7.668 -12.863 -0.078
357 HA MET 52 HA MET 52 8.796 -13.826 -2.644
358 HB2 MET 52 2HB MET 52 7.051 -15.229 -1.371
359 HB3 MET 52 1HB MET 52 5.894 -13.982 -1.842
360 HG2 MET 52 2HG MET 52 6.607 -14.317 -4.229
361 HG3 MET 52 1HG MET 52 7.589 -15.681 -3.693
362 HE1 MET 52 3HE MET 52 4.119 -14.099 -3.981
363 HE2 MET 52 1HE MET 52 3.185 -15.488 -4.554
364 HE3 MET 52 2HE MET 52 4.579 -14.919 -5.471
365 H GLY 53 H GLY 53 8.213 -12.797 -4.558
366 HA2 GLY 53 2HA GLY 53 7.099 -11.200 -5.896
367 HA3 GLY 53 1HA GLY 53 6.468 -10.446 -4.434
368 H THR 54 H THR 54 9.844 -11.321 -5.012
369 HA THR 54 HA THR 54 10.710 -8.644 -4.353
370 HB THR 54 HB THR 54 12.998 -9.630 -4.781
371 HG1 THR 54 1HG THR 54 13.084 -11.820 -5.174
372 HG21 THR 54 3HG2 THR 54 11.770 -9.649 -2.559
373 HG22 THR 54 1HG2 THR 54 12.991 -10.906 -2.751
374 HG23 THR 54 2HG2 THR 54 11.283 -11.301 -2.933
375 H ALA 55 H ALA 55 10.671 -7.055 -5.813
376 HA ALA 55 HA ALA 55 10.683 -7.609 -8.656
377 HB1 ALA 55 1HB ALA 55 9.353 -5.764 -7.448
378 HB2 ALA 55 2HB ALA 55 10.172 -5.328 -8.947
379 HB3 ALA 55 3HB ALA 55 10.879 -4.881 -7.394
380 H SER 56 H SER 56 12.118 -5.976 -9.993
381 HA SER 56 HA SER 56 14.829 -5.778 -8.871
382 HB2 SER 56 2HB SER 56 14.420 -7.968 -10.223
383 HB3 SER 56 1HB SER 56 14.454 -6.910 -11.630
384 HG SER 56 HG SER 56 16.538 -6.946 -11.437
385 H GLY 57 H GLY 57 16.292 -4.590 -10.483
386 HA2 GLY 57 2HA GLY 57 16.424 -3.036 -12.349
387 HA3 GLY 57 1HA GLY 57 14.765 -2.556 -12.003
388 H SER 58 H SER 58 15.032 -2.380 -9.158
389 HA SER 58 HA SER 58 16.123 0.271 -8.948
390 HB2 SER 58 2HB SER 58 14.806 -1.637 -7.036
391 HB3 SER 58 1HB SER 58 15.586 -0.175 -6.438
392 HG SER 58 HG SER 58 13.235 -0.156 -7.136
393 H ASN 59 H ASN 59 16.994 -2.912 -7.596
394 HA ASN 59 HA ASN 59 19.398 -1.899 -6.352
395 HB2 ASN 59 2HB ASN 59 18.356 -4.707 -6.780
396 HB3 ASN 59 1HB ASN 59 19.819 -4.320 -5.876
397 HD21 ASN 59 1HD2 ASN 59 19.560 -3.698 -3.696
398 HD22 ASN 59 2HD2 ASN 59 18.056 -3.404 -2.967
399 H SER 60 H SER 60 21.212 -1.470 -7.432
400 HA SER 60 HA SER 60 21.645 -2.524 -10.105
401 HB2 SER 60 2HB SER 60 22.214 -0.137 -9.149
402 HB3 SER 60 1HB SER 60 23.693 -0.927 -8.605
403 HG SER 60 HG SER 60 24.329 -0.644 -10.585
404 HA PRO 61 HA PRO 61 24.325 -5.786 -8.702
405 HB2 PRO 61 2HB PRO 61 25.563 -6.462 -11.010
406 HB3 PRO 61 1HB PRO 61 23.834 -6.756 -10.748
407 HG2 PRO 61 2HG PRO 61 25.172 -4.664 -12.359
408 HG3 PRO 61 1HG PRO 61 23.636 -5.497 -12.635
409 HD2 PRO 61 2HD PRO 61 23.933 -2.920 -11.545
410 HD3 PRO 61 1HD PRO 61 22.458 -3.909 -11.492
411 H THR 62 H THR 62 26.554 -6.348 -8.296
412 HA THR 62 HA THR 62 28.619 -4.421 -9.042
413 HB THR 62 HB THR 62 29.335 -4.191 -6.652
414 HG1 THR 62 1HG THR 62 26.775 -5.320 -6.193
415 HG21 THR 62 3HG2 THR 62 26.505 -3.214 -7.034
416 HG22 THR 62 1HG2 THR 62 27.855 -2.540 -7.946
417 HG23 THR 62 2HG2 THR 62 27.830 -2.415 -6.187
Start of MODEL 19
1 H1 GLY 1 1HT GLY 1 -29.381 4.777 19.853
2 H2 GLY 1 2HT GLY 1 -29.072 5.752 18.497
3 H3 GLY 1 3HT GLY 1 -28.737 4.087 18.445
4 HA2 GLY 1 2HA GLY 1 -30.748 4.504 17.231
5 HA3 GLY 1 1HA GLY 1 -31.121 3.615 18.709
6 H SER 2 H SER 2 -32.529 5.763 16.939
7 HA SER 2 HA SER 2 -33.567 7.325 19.219
8 HB2 SER 2 2HB SER 2 -33.696 9.319 17.718
9 HB3 SER 2 1HB SER 2 -32.046 8.829 18.087
10 HG SER 2 HG SER 2 -32.961 9.206 15.744
11 H MET 3 H MET 3 -34.054 6.619 15.745
12 HA MET 3 HA MET 3 -36.812 5.837 16.280
13 HB2 MET 3 2HB MET 3 -36.052 8.232 14.613
14 HB3 MET 3 1HB MET 3 -37.566 7.363 14.357
15 HG2 MET 3 2HG MET 3 -38.118 7.700 16.771
16 HG3 MET 3 1HG MET 3 -36.656 8.672 16.936
17 HE1 MET 3 3HE MET 3 -37.142 11.737 14.862
18 HE2 MET 3 1HE MET 3 -36.631 10.272 14.011
19 HE3 MET 3 2HE MET 3 -36.061 10.588 15.647
20 H ALA 4 H ALA 4 -37.575 4.354 14.821
21 HA ALA 4 HA ALA 4 -35.670 3.454 12.756
22 HB1 ALA 4 1HB ALA 4 -38.087 1.985 13.829
23 HB2 ALA 4 2HB ALA 4 -36.476 1.852 14.534
24 HB3 ALA 4 3HB ALA 4 -36.760 1.318 12.876
25 H GLN 5 H GLN 5 -37.349 5.788 12.331
26 HA GLN 5 HA GLN 5 -39.421 4.887 10.470
27 HB2 GLN 5 2HB GLN 5 -38.661 7.541 11.662
28 HB3 GLN 5 1HB GLN 5 -39.717 7.455 10.251
29 HG2 GLN 5 2HG GLN 5 -41.148 5.816 11.551
30 HG3 GLN 5 1HG GLN 5 -40.183 6.213 12.971
31 HE21 GLN 5 1HE2 GLN 5 -42.864 7.217 11.055
32 HE22 GLN 5 2HE2 GLN 5 -43.109 8.731 11.801
33 H GLU 6 H GLU 6 -36.291 6.525 10.495
34 HA GLU 6 HA GLU 6 -36.317 7.176 7.694
35 HB2 GLU 6 2HB GLU 6 -34.054 7.044 9.702
36 HB3 GLU 6 1HB GLU 6 -33.898 7.658 8.057
37 HG2 GLU 6 2HG GLU 6 -35.766 9.285 8.595
38 HG3 GLU 6 1HG GLU 6 -35.626 8.775 10.278
39 H THR 7 H THR 7 -34.501 6.341 6.254
40 HA THR 7 HA THR 7 -34.775 3.499 5.997
41 HB THR 7 HB THR 7 -32.754 5.164 4.510
42 HG1 THR 7 1HG THR 7 -34.301 6.152 3.484
43 HG21 THR 7 3HG2 THR 7 -34.453 2.742 3.879
44 HG22 THR 7 1HG2 THR 7 -32.698 2.804 4.032
45 HG23 THR 7 2HG2 THR 7 -33.492 3.598 2.673
46 H ASN 8 H ASN 8 -33.751 2.153 7.341
47 HA ASN 8 HA ASN 8 -31.336 2.809 8.726
48 HB2 ASN 8 2HB ASN 8 -33.228 1.125 9.360
49 HB3 ASN 8 1HB ASN 8 -32.318 -0.006 8.362
50 HD21 ASN 8 1HD2 ASN 8 -29.964 -0.323 8.992
51 HD22 ASN 8 2HD2 ASN 8 -29.537 -0.145 10.634
52 H GLN 9 H GLN 9 -32.103 0.913 5.842
53 HA GLN 9 HA GLN 9 -29.461 -0.136 5.480
54 HB2 GLN 9 2HB GLN 9 -31.703 -1.009 4.523
55 HB3 GLN 9 1HB GLN 9 -31.474 0.211 3.272
56 HG2 GLN 9 2HG GLN 9 -29.228 -0.745 2.791
57 HG3 GLN 9 1HG GLN 9 -29.537 -2.009 3.980
58 HE21 GLN 9 1HE2 GLN 9 -31.208 -3.626 3.463
59 HE22 GLN 9 2HE2 GLN 9 -31.765 -3.817 1.862
60 H THR 10 H THR 10 -27.721 0.814 4.630
61 HA THR 10 HA THR 10 -28.005 3.017 2.726
62 HB THR 10 HB THR 10 -26.234 4.290 4.102
63 HG1 THR 10 1HG THR 10 -25.756 2.735 5.605
64 HG21 THR 10 3HG2 THR 10 -28.566 5.039 3.816
65 HG22 THR 10 1HG2 THR 10 -27.988 5.378 5.447
66 HG23 THR 10 2HG2 THR 10 -29.061 4.009 5.159
67 HA PRO 11 HA PRO 11 -24.650 0.257 1.290
68 HB2 PRO 11 2HB PRO 11 -24.565 2.162 -0.991
69 HB3 PRO 11 1HB PRO 11 -24.746 0.397 -0.995
70 HG2 PRO 11 2HG PRO 11 -26.789 2.015 -1.551
71 HG3 PRO 11 1HG PRO 11 -27.012 0.494 -0.670
72 HD2 PRO 11 2HD PRO 11 -26.975 3.297 0.397
73 HD3 PRO 11 1HD PRO 11 -27.984 1.918 0.888
74 H GLY 12 H GLY 12 -22.402 0.852 0.198
75 HA2 GLY 12 2HA GLY 12 -20.434 2.094 0.202
76 HA3 GLY 12 1HA GLY 12 -21.273 3.380 1.062
77 HA PRO 13 HA PRO 13 -20.374 0.492 4.801
78 HB2 PRO 13 2HB PRO 13 -19.206 -1.979 4.255
79 HB3 PRO 13 1HB PRO 13 -20.934 -1.707 4.554
80 HG2 PRO 13 2HG PRO 13 -19.487 -2.015 1.971
81 HG3 PRO 13 1HG PRO 13 -21.080 -2.622 2.459
82 HD2 PRO 13 2HD PRO 13 -20.834 -0.463 0.861
83 HD3 PRO 13 1HD PRO 13 -22.132 -0.585 2.074
84 H MET 14 H MET 14 -17.904 -0.959 2.648
85 HA MET 14 HA MET 14 -15.749 -0.017 4.287
86 HB2 MET 14 2HB MET 14 -16.052 -1.674 1.828
87 HB3 MET 14 1HB MET 14 -14.499 -0.872 2.041
88 HG2 MET 14 2HG MET 14 -14.163 -2.897 3.162
89 HG3 MET 14 1HG MET 14 -14.627 -1.819 4.476
90 HE1 MET 14 3HE MET 14 -15.285 -3.923 6.006
91 HE2 MET 14 1HE MET 14 -17.042 -3.862 6.196
92 HE3 MET 14 2HE MET 14 -16.111 -2.370 6.106
93 H LEU 15 H LEU 15 -16.695 2.305 4.007
94 HA LEU 15 HA LEU 15 -16.036 3.623 1.525
95 HB2 LEU 15 2HB LEU 15 -17.821 4.171 3.494
96 HB3 LEU 15 1HB LEU 15 -16.514 5.254 3.964
97 HG LEU 15 HG LEU 15 -16.491 6.154 1.616
98 HD11 LEU 15 1HD1 LEU 15 -18.693 4.125 1.371
99 HD12 LEU 15 2HD1 LEU 15 -17.446 4.562 0.208
100 HD13 LEU 15 3HD1 LEU 15 -18.830 5.625 0.451
101 HD21 LEU 15 3HD2 LEU 15 -18.652 7.401 1.863
102 HD22 LEU 15 1HD2 LEU 15 -17.709 7.352 3.353
103 HD23 LEU 15 2HD2 LEU 15 -19.102 6.288 3.155
104 H CYS 16 H CYS 16 -14.351 5.045 1.124
105 HA CYS 16 HA CYS 16 -11.819 4.561 1.816
106 HB2 CYS 16 2HB CYS 16 -12.761 6.317 0.206
107 HB3 CYS 16 1HB CYS 16 -12.713 7.421 1.579
108 H SER 17 H SER 17 -10.741 4.387 3.627
109 HA SER 17 HA SER 17 -11.508 5.355 6.154
110 HB2 SER 17 2HB SER 17 -8.743 4.593 5.193
111 HB3 SER 17 1HB SER 17 -9.231 4.765 6.880
112 HG SER 17 HG SER 17 -10.403 2.969 6.734
113 H THR 18 H THR 18 -9.710 6.923 3.575
114 HA THR 18 HA THR 18 -8.694 9.026 5.296
115 HB THR 18 HB THR 18 -7.666 9.949 3.353
116 HG1 THR 18 1HG THR 18 -8.884 9.936 1.660
117 HG21 THR 18 3HG2 THR 18 -6.232 8.219 2.775
118 HG22 THR 18 1HG2 THR 18 -7.535 7.035 2.658
119 HG23 THR 18 2HG2 THR 18 -6.960 7.564 4.240
120 H GLY 19 H GLY 19 -11.727 8.420 3.877
121 HA2 GLY 19 2HA GLY 19 -13.629 9.706 3.862
122 HA3 GLY 19 1HA GLY 19 -12.702 10.995 4.626
123 H CYS 20 H CYS 20 -12.177 9.414 1.453
124 HA CYS 20 HA CYS 20 -12.058 12.052 0.236
125 HB2 CYS 20 2HB CYS 20 -10.935 11.104 -1.555
126 HB3 CYS 20 1HB CYS 20 -10.448 10.052 -0.233
127 H GLY 21 H GLY 21 -14.504 9.720 0.721
128 HA2 GLY 21 2HA GLY 21 -16.772 10.163 0.249
129 HA3 GLY 21 1HA GLY 21 -16.273 11.216 -1.067
130 H PHE 22 H PHE 22 -14.519 8.352 -1.399
131 HA PHE 22 HA PHE 22 -16.451 7.361 -3.389
132 HB2 PHE 22 2HB PHE 22 -13.450 7.209 -3.180
133 HB3 PHE 22 1HB PHE 22 -14.346 6.196 -4.299
134 HD1 PHE 22 1HD PHE 22 -14.272 9.807 -3.225
135 HD2 PHE 22 2HD PHE 22 -14.564 6.991 -6.457
136 HE1 PHE 22 1HE PHE 22 -14.363 11.677 -4.843
137 HE2 PHE 22 2HE PHE 22 -14.647 8.867 -8.076
138 HZ PHE 22 HZ PHE 22 -14.547 11.208 -7.268
139 H TYR 23 H TYR 23 -15.593 4.814 -3.801
140 HA TYR 23 HA TYR 23 -16.376 3.491 -1.299
141 HB2 TYR 23 2HB TYR 23 -17.564 3.086 -3.548
142 HB3 TYR 23 1HB TYR 23 -16.135 2.146 -3.983
143 HD1 TYR 23 1HD TYR 23 -18.214 2.535 -0.860
144 HD2 TYR 23 2HD TYR 23 -16.457 -0.145 -3.724
145 HE1 TYR 23 1HE TYR 23 -19.091 0.603 0.416
146 HE2 TYR 23 2HE TYR 23 -17.334 -2.082 -2.443
147 HH TYR 23 HH TYR 23 -19.709 -1.992 -0.373
148 H GLY 24 H GLY 24 -15.208 1.885 -0.331
149 HA2 GLY 24 2HA GLY 24 -12.407 1.563 -1.260
150 HA3 GLY 24 1HA GLY 24 -12.919 1.480 0.427
151 H ASN 25 H ASN 25 -11.434 -0.566 -0.827
152 HA ASN 25 HA ASN 25 -13.414 -2.735 -1.174
153 HB2 ASN 25 2HB ASN 25 -11.443 -2.159 -2.872
154 HB3 ASN 25 1HB ASN 25 -10.506 -3.144 -1.752
155 HD21 ASN 25 1HD2 ASN 25 -10.309 -5.067 -3.006
156 HD22 ASN 25 2HD2 ASN 25 -11.651 -5.978 -3.531
157 HA PRO 26 HA PRO 26 -12.061 -4.123 2.857
158 HB2 PRO 26 2HB PRO 26 -13.113 -6.646 2.870
159 HB3 PRO 26 1HB PRO 26 -14.081 -5.179 3.104
160 HG2 PRO 26 2HG PRO 26 -13.774 -6.879 0.690
161 HG3 PRO 26 1HG PRO 26 -15.199 -6.026 1.300
162 HD2 PRO 26 2HD PRO 26 -13.629 -5.117 -0.782
163 HD3 PRO 26 1HD PRO 26 -14.646 -4.070 0.230
164 H ARG 27 H ARG 27 -11.377 -5.970 -0.065
165 HA ARG 27 HA ARG 27 -9.440 -7.735 1.101
166 HB2 ARG 27 2HB ARG 27 -9.983 -6.896 -1.757
167 HB3 ARG 27 1HB ARG 27 -8.775 -8.097 -1.303
168 HG2 ARG 27 2HG ARG 27 -10.386 -9.621 -0.539
169 HG3 ARG 27 1HG ARG 27 -11.618 -8.372 -0.351
170 HD2 ARG 27 2HD ARG 27 -11.706 -8.091 -2.801
171 HD3 ARG 27 1HD ARG 27 -10.473 -9.332 -2.985
172 HE ARG 27 HE ARG 27 -12.839 -10.187 -1.537
173 HH11 ARG 27 1HH2 ARG 27 -11.331 -9.912 -4.708
174 HH12 ARG 27 2HH2 ARG 27 -12.291 -11.179 -5.385
175 HH21 ARG 27 1HH1 ARG 27 -14.077 -11.804 -2.494
176 HH22 ARG 27 2HH1 ARG 27 -13.830 -12.230 -4.155
177 H THR 28 H THR 28 -9.395 -4.518 -0.302
178 HA THR 28 HA THR 28 -6.505 -4.355 -0.448
179 HB THR 28 HB THR 28 -6.902 -1.991 -1.044
180 HG1 THR 28 1HG THR 28 -8.668 -1.063 -0.453
181 HG21 THR 28 3HG2 THR 28 -7.079 -3.415 -2.915
182 HG22 THR 28 1HG2 THR 28 -8.533 -2.421 -2.986
183 HG23 THR 28 2HG2 THR 28 -8.624 -4.073 -2.377
184 H ASN 29 H ASN 29 -6.448 -1.593 0.831
185 HA ASN 29 HA ASN 29 -6.164 -2.524 3.578
186 HB2 ASN 29 2HB ASN 29 -4.795 -0.654 1.900
187 HB3 ASN 29 1HB ASN 29 -5.432 0.247 3.274
188 HD21 ASN 29 1HD2 ASN 29 -3.787 -2.933 2.703
189 HD22 ASN 29 2HD2 ASN 29 -2.755 -2.791 4.056
190 H GLY 30 H GLY 30 -8.897 -2.093 2.450
191 HA2 GLY 30 2HA GLY 30 -10.890 -1.319 3.289
192 HA3 GLY 30 1HA GLY 30 -9.996 -0.582 4.618
193 H MET 31 H MET 31 -8.899 0.221 1.428
194 HA MET 31 HA MET 31 -10.350 2.790 1.514
195 HB2 MET 31 2HB MET 31 -7.421 2.342 0.889
196 HB3 MET 31 1HB MET 31 -8.266 3.889 0.764
197 HG2 MET 31 2HG MET 31 -8.923 3.530 3.226
198 HG3 MET 31 1HG MET 31 -7.700 2.264 3.251
199 HE1 MET 31 3HE MET 31 -4.717 3.973 4.254
200 HE2 MET 31 1HE MET 31 -5.576 2.489 3.819
201 HE3 MET 31 2HE MET 31 -6.158 3.490 5.145
202 H CYS 32 H CYS 32 -10.059 3.955 -0.658
203 HA CYS 32 HA CYS 32 -11.257 2.421 -2.697
204 HB2 CYS 32 2HB CYS 32 -9.748 5.014 -3.021
205 HB3 CYS 32 1HB CYS 32 -10.940 4.363 -4.137
206 H SER 33 H SER 33 -10.316 2.374 -5.009
207 HA SER 33 HA SER 33 -7.960 0.737 -4.967
208 HB2 SER 33 2HB SER 33 -9.654 1.867 -7.201
209 HB3 SER 33 1HB SER 33 -8.217 0.892 -7.501
210 HG SER 33 HG SER 33 -10.594 0.183 -6.132
211 H VAL 34 H VAL 34 -8.725 4.009 -6.162
212 HA VAL 34 HA VAL 34 -6.073 4.585 -7.062
213 HB VAL 34 HB VAL 34 -8.222 6.584 -6.280
214 HG11 VAL 34 1HG1 VAL 34 -5.814 6.654 -8.113
215 HG12 VAL 34 2HG1 VAL 34 -6.123 7.662 -6.699
216 HG13 VAL 34 3HG1 VAL 34 -7.088 7.870 -8.160
217 HG21 VAL 34 3HG2 VAL 34 -8.779 6.474 -8.772
218 HG22 VAL 34 1HG2 VAL 34 -9.291 5.086 -7.811
219 HG23 VAL 34 2HG2 VAL 34 -7.848 4.976 -8.819
220 H CYS 35 H CYS 35 -7.863 5.086 -4.066
221 HA CYS 35 HA CYS 35 -5.888 6.735 -2.808
222 HB2 CYS 35 2HB CYS 35 -8.174 5.115 -1.652
223 HB3 CYS 35 1HB CYS 35 -7.189 6.263 -0.739
224 H TYR 36 H TYR 36 -6.570 3.264 -2.859
225 HA TYR 36 HA TYR 36 -4.875 2.425 -0.799
226 HB2 TYR 36 2HB TYR 36 -6.509 0.926 -1.764
227 HB3 TYR 36 1HB TYR 36 -5.710 0.997 -3.335
228 HD1 TYR 36 1HD TYR 36 -4.427 0.462 0.176
229 HD2 TYR 36 2HD TYR 36 -4.753 -1.066 -3.821
230 HE1 TYR 36 1HE TYR 36 -3.008 -1.472 0.803
231 HE2 TYR 36 2HE TYR 36 -3.333 -3.000 -3.196
232 HH TYR 36 HH TYR 36 -1.507 -3.427 -1.370
233 H LYS 37 H LYS 37 -4.091 3.286 -4.121
234 HA LYS 37 HA LYS 37 -1.396 2.258 -4.007
235 HB2 LYS 37 2HB LYS 37 -2.945 2.722 -6.095
236 HB3 LYS 37 1HB LYS 37 -2.258 4.342 -5.986
237 HG2 LYS 37 2HG LYS 37 0.037 3.135 -5.850
238 HG3 LYS 37 1HG LYS 37 -0.831 1.726 -6.462
239 HD2 LYS 37 2HD LYS 37 -1.413 2.826 -8.485
240 HD3 LYS 37 1HD LYS 37 -1.000 4.415 -7.834
241 HE2 LYS 37 2HE LYS 37 1.391 3.611 -7.639
242 HE3 LYS 37 1HE LYS 37 0.909 2.169 -8.533
243 HZ1 LYS 37 3HZ LYS 37 1.841 3.939 -9.949
244 HZ2 LYS 37 1HZ LYS 37 0.549 4.946 -9.510
245 HZ3 LYS 37 2HZ LYS 37 0.251 3.518 -10.378
246 H GLU 38 H GLU 38 -2.954 5.427 -3.820
247 HA GLU 38 HA GLU 38 -0.717 7.068 -3.682
248 HB2 GLU 38 2HB GLU 38 -3.393 7.419 -2.322
249 HB3 GLU 38 1HB GLU 38 -2.196 8.693 -2.543
250 HG2 GLU 38 2HG GLU 38 -3.146 7.110 -4.919
251 HG3 GLU 38 1HG GLU 38 -4.125 8.442 -4.299
252 H HIS 39 H HIS 39 -2.346 5.358 -0.980
253 HA HIS 39 HA HIS 39 -0.497 6.587 0.903
254 HB2 HIS 39 2HB HIS 39 -1.771 5.675 2.652
255 HB3 HIS 39 1HB HIS 39 -2.930 6.161 1.424
256 HD1 HIS 39 1HD HIS 39 -4.725 4.495 1.177
257 HD2 HIS 39 2HD HIS 39 -1.125 2.654 2.163
258 HE1 HIS 39 1HE HIS 39 -5.247 2.046 1.526
259 HE2 HIS 39 2HE HIS 39 -3.051 0.900 2.082
260 H LEU 40 H LEU 40 -0.853 3.464 -0.664
261 HA LEU 40 HA LEU 40 0.926 1.961 0.933
262 HB2 LEU 40 2HB LEU 40 -0.624 1.076 -0.857
263 HB3 LEU 40 1HB LEU 40 0.543 1.649 -2.050
264 HG LEU 40 HG LEU 40 2.278 0.293 -0.657
265 HD11 LEU 40 1HD1 LEU 40 1.258 -1.683 0.463
266 HD12 LEU 40 2HD1 LEU 40 -0.339 -0.981 0.205
267 HD13 LEU 40 3HD1 LEU 40 0.821 -0.173 1.259
268 HD21 LEU 40 3HD2 LEU 40 1.833 -1.678 -2.010
269 HD22 LEU 40 1HD2 LEU 40 1.421 -0.250 -2.962
270 HD23 LEU 40 2HD2 LEU 40 0.145 -1.210 -2.209
271 H GLN 41 H GLN 41 1.521 4.295 -1.620
272 HA GLN 41 HA GLN 41 4.254 3.635 -2.113
273 HB2 GLN 41 2HB GLN 41 2.571 5.133 -3.482
274 HB3 GLN 41 1HB GLN 41 3.204 6.422 -2.463
275 HG2 GLN 41 2HG GLN 41 5.532 5.700 -3.136
276 HG3 GLN 41 1HG GLN 41 4.786 4.605 -4.302
277 HE21 GLN 41 1HE2 GLN 41 6.114 7.665 -4.057
278 HE22 GLN 41 2HE2 GLN 41 5.300 8.419 -5.353
279 H ARG 42 H ARG 42 2.627 5.778 0.166
280 HA ARG 42 HA ARG 42 4.983 7.108 1.091
281 HB2 ARG 42 2HB ARG 42 2.201 6.814 2.217
282 HB3 ARG 42 1HB ARG 42 3.461 7.738 3.032
283 HG2 ARG 42 2HG ARG 42 3.161 8.385 0.158
284 HG3 ARG 42 1HG ARG 42 1.736 8.748 1.127
285 HD2 ARG 42 2HD ARG 42 4.493 9.621 2.001
286 HD3 ARG 42 1HD ARG 42 3.521 10.598 0.908
287 HE ARG 42 HE ARG 42 3.072 10.205 3.738
288 HH11 ARG 42 1HH2 ARG 42 1.564 11.088 0.678
289 HH12 ARG 42 2HH2 ARG 42 0.286 11.962 1.445
290 HH21 ARG 42 1HH1 ARG 42 1.382 11.351 4.671
291 HH22 ARG 42 2HH1 ARG 42 0.183 12.113 3.679
292 H GLN 43 H GLN 43 3.360 4.118 1.991
293 HA GLN 43 HA GLN 43 4.745 3.825 4.503
294 HB2 GLN 43 2HB GLN 43 3.141 1.881 2.835
295 HB3 GLN 43 1HB GLN 43 3.815 1.500 4.421
296 HG2 GLN 43 2HG GLN 43 2.589 3.726 5.140
297 HG3 GLN 43 1HG GLN 43 1.614 3.411 3.707
298 HE21 GLN 43 1HE2 GLN 43 0.863 0.934 3.622
299 HE22 GLN 43 2HE2 GLN 43 0.284 0.318 5.092
300 H GLN 44 H GLN 44 5.315 2.826 1.177
301 HA GLN 44 HA GLN 44 7.390 0.938 1.832
302 HB2 GLN 44 2HB GLN 44 6.162 2.035 -0.648
303 HB3 GLN 44 1HB GLN 44 7.816 1.449 -0.792
304 HG2 GLN 44 2HG GLN 44 6.972 -0.664 0.430
305 HG3 GLN 44 1HG GLN 44 5.355 -0.080 0.046
306 HE21 GLN 44 1HE2 GLN 44 4.704 -1.415 -1.663
307 HE22 GLN 44 2HE2 GLN 44 5.597 -1.633 -3.097
308 H ASN 45 H ASN 45 7.314 4.226 0.460
309 HA ASN 45 HA ASN 45 10.107 4.569 0.240
310 HB2 ASN 45 2HB ASN 45 7.807 6.499 0.437
311 HB3 ASN 45 1HB ASN 45 9.472 7.064 0.347
312 HD21 ASN 45 1HD2 ASN 45 6.869 5.544 -1.491
313 HD22 ASN 45 2HD2 ASN 45 7.682 5.553 -2.990
314 H SER 46 H SER 46 8.088 4.552 3.051
315 HA SER 46 HA SER 46 9.415 6.344 4.743
316 HB2 SER 46 2HB SER 46 7.814 3.850 5.231
317 HB3 SER 46 1HB SER 46 8.586 4.690 6.573
318 HG SER 46 HG SER 46 6.470 5.453 4.937
319 H GLY 47 H GLY 47 9.839 2.785 4.656
320 HA2 GLY 47 2HA GLY 47 12.371 2.234 4.410
321 HA3 GLY 47 1HA GLY 47 12.478 3.117 5.931
322 H ARG 48 H ARG 48 10.653 0.432 4.429
323 HA ARG 48 HA ARG 48 9.714 -0.766 6.788
324 HB2 ARG 48 2HB ARG 48 9.078 -1.271 4.357
325 HB3 ARG 48 1HB ARG 48 10.493 -2.322 4.330
326 HG2 ARG 48 2HG ARG 48 9.422 -3.273 6.566
327 HG3 ARG 48 1HG ARG 48 7.939 -2.614 5.876
328 HD2 ARG 48 2HD ARG 48 8.373 -3.877 3.784
329 HD3 ARG 48 1HD ARG 48 9.811 -4.572 4.520
330 HE ARG 48 HE ARG 48 7.560 -5.069 6.177
331 HH11 ARG 48 1HH2 ARG 48 8.933 -6.077 3.095
332 HH12 ARG 48 2HH2 ARG 48 8.219 -7.649 3.175
333 HH21 ARG 48 1HH1 ARG 48 6.653 -7.123 6.215
334 HH22 ARG 48 2HH1 ARG 48 6.943 -8.237 4.919
335 H MET 49 H MET 49 12.803 -1.130 5.105
336 HA MET 49 HA MET 49 13.706 -3.253 6.868
337 HB2 MET 49 2HB MET 49 14.723 -1.886 4.435
338 HB3 MET 49 1HB MET 49 15.964 -2.428 5.562
339 HG2 MET 49 2HG MET 49 14.648 -4.675 5.577
340 HG3 MET 49 1HG MET 49 13.906 -4.072 4.096
341 HE1 MET 49 3HE MET 49 18.229 -4.544 5.153
342 HE2 MET 49 1HE MET 49 17.392 -6.102 5.175
343 HE3 MET 49 2HE MET 49 16.776 -4.754 6.127
344 H SER 50 H SER 50 14.564 0.162 6.276
345 HA SER 50 HA SER 50 15.375 0.405 9.085
346 HB2 SER 50 2HB SER 50 17.444 1.684 8.259
347 HB3 SER 50 1HB SER 50 17.493 -0.074 8.156
348 HG SER 50 HG SER 50 17.040 0.060 5.990
349 HA PRO 51 HA PRO 51 12.744 3.998 7.800
350 HB2 PRO 51 2HB PRO 51 12.733 4.373 10.756
351 HB3 PRO 51 1HB PRO 51 11.377 4.357 9.614
352 HG2 PRO 51 2HG PRO 51 11.845 2.324 11.269
353 HG3 PRO 51 1HG PRO 51 11.217 2.073 9.631
354 HD2 PRO 51 2HD PRO 51 13.978 1.599 10.683
355 HD3 PRO 51 1HD PRO 51 13.074 0.709 9.437
356 H MET 52 H MET 52 14.797 4.351 10.715
357 HA MET 52 HA MET 52 16.140 6.658 9.424
358 HB2 MET 52 2HB MET 52 15.068 6.361 12.225
359 HB3 MET 52 1HB MET 52 16.380 7.481 11.865
360 HG2 MET 52 2HG MET 52 14.548 8.872 11.545
361 HG3 MET 52 1HG MET 52 14.775 8.257 9.909
362 HE1 MET 52 3HE MET 52 10.975 8.409 9.960
363 HE2 MET 52 1HE MET 52 12.508 8.943 9.256
364 HE3 MET 52 2HE MET 52 12.010 9.532 10.838
365 H GLY 53 H GLY 53 16.400 4.240 12.044
366 HA2 GLY 53 2HA GLY 53 18.552 2.829 11.541
367 HA3 GLY 53 1HA GLY 53 19.331 4.372 11.878
368 H THR 54 H THR 54 17.506 5.233 13.923
369 HA THR 54 HA THR 54 17.904 3.220 16.048
370 HB THR 54 HB THR 54 19.752 4.766 16.288
371 HG1 THR 54 1HG THR 54 19.269 5.499 18.358
372 HG21 THR 54 3HG2 THR 54 19.088 6.699 15.089
373 HG22 THR 54 1HG2 THR 54 19.149 7.226 16.771
374 HG23 THR 54 2HG2 THR 54 17.597 6.862 16.017
375 H ALA 55 H ALA 55 16.412 3.279 17.746
376 HA ALA 55 HA ALA 55 14.233 5.237 17.619
377 HB1 ALA 55 1HB ALA 55 13.608 3.267 16.176
378 HB2 ALA 55 2HB ALA 55 12.505 3.569 17.519
379 HB3 ALA 55 3HB ALA 55 13.685 2.263 17.623
380 H SER 56 H SER 56 13.094 5.469 19.569
381 HA SER 56 HA SER 56 13.816 3.786 21.845
382 HB2 SER 56 2HB SER 56 14.260 6.773 21.955
383 HB3 SER 56 1HB SER 56 14.628 5.592 23.208
384 HG SER 56 HG SER 56 16.433 6.265 21.846
385 H GLY 57 H GLY 57 12.401 4.045 23.648
386 HA2 GLY 57 2HA GLY 57 10.559 5.376 24.657
387 HA3 GLY 57 1HA GLY 57 9.900 5.520 23.031
388 H SER 58 H SER 58 10.833 3.081 25.461
389 HA SER 58 HA SER 58 8.810 1.239 24.347
390 HB2 SER 58 2HB SER 58 11.162 0.757 26.190
391 HB3 SER 58 1HB SER 58 9.991 -0.477 25.732
392 HG SER 58 HG SER 58 11.755 -0.546 24.334
393 H ASN 59 H ASN 59 8.046 3.535 25.935
394 HA ASN 59 HA ASN 59 7.517 2.758 28.635
395 HB2 ASN 59 2HB ASN 59 5.968 4.717 28.631
396 HB3 ASN 59 1HB ASN 59 7.594 5.110 28.079
397 HD21 ASN 59 1HD2 ASN 59 7.712 6.199 26.103
398 HD22 ASN 59 2HD2 ASN 59 6.460 6.266 24.959
399 H SER 60 H SER 60 5.589 2.063 29.581
400 HA SER 60 HA SER 60 3.894 0.462 27.834
401 HB2 SER 60 2HB SER 60 2.865 -0.171 30.114
402 HB3 SER 60 1HB SER 60 4.516 -0.689 29.790
403 HG SER 60 HG SER 60 5.201 0.604 31.308
404 HA PRO 61 HA PRO 61 0.506 3.317 27.772
405 HB2 PRO 61 2HB PRO 61 -1.681 1.693 27.738
406 HB3 PRO 61 1HB PRO 61 -0.578 1.852 26.355
407 HG2 PRO 61 2HG PRO 61 -0.742 -0.298 28.409
408 HG3 PRO 61 1HG PRO 61 -0.457 -0.419 26.663
409 HD2 PRO 61 2HD PRO 61 1.551 -0.571 28.534
410 HD3 PRO 61 1HD PRO 61 1.803 -0.004 26.870
411 H THR 62 H THR 62 -0.012 4.593 29.453
412 HA THR 62 HA THR 62 -0.645 5.330 31.526
413 HB THR 62 HB THR 62 -2.766 4.480 32.362
414 HG1 THR 62 1HG THR 62 -2.869 2.383 32.185
415 HG21 THR 62 3HG2 THR 62 -2.915 5.946 30.447
416 HG22 THR 62 1HG2 THR 62 -4.099 4.655 30.239
417 HG23 THR 62 2HG2 THR 62 -2.581 4.613 29.342
Start of MODEL 20
1 H1 GLY 1 1HT GLY 1 -36.624 -7.861 26.253
2 H2 GLY 1 2HT GLY 1 -35.572 -9.014 26.924
3 H3 GLY 1 3HT GLY 1 -37.086 -8.724 27.638
4 HA2 GLY 1 2HA GLY 1 -37.308 -10.736 26.458
5 HA3 GLY 1 1HA GLY 1 -38.133 -9.495 25.514
6 H SER 2 H SER 2 -37.647 -9.450 23.409
7 HA SER 2 HA SER 2 -35.363 -10.942 22.410
8 HB2 SER 2 2HB SER 2 -37.311 -9.316 20.780
9 HB3 SER 2 1HB SER 2 -36.330 -10.684 20.260
10 HG SER 2 HG SER 2 -38.517 -11.256 20.694
11 H MET 3 H MET 3 -33.997 -9.954 20.667
12 HA MET 3 HA MET 3 -32.818 -7.512 21.648
13 HB2 MET 3 2HB MET 3 -31.218 -7.828 19.753
14 HB3 MET 3 1HB MET 3 -31.343 -9.235 20.805
15 HG2 MET 3 2HG MET 3 -32.571 -10.469 19.227
16 HG3 MET 3 1HG MET 3 -33.071 -9.025 18.346
17 HE1 MET 3 3HE MET 3 -30.689 -11.510 16.231
18 HE2 MET 3 1HE MET 3 -32.329 -11.324 16.868
19 HE3 MET 3 2HE MET 3 -31.074 -12.064 17.859
20 H ALA 4 H ALA 4 -32.792 -5.499 20.703
21 HA ALA 4 HA ALA 4 -34.383 -5.085 18.256
22 HB1 ALA 4 1HB ALA 4 -35.811 -4.639 20.267
23 HB2 ALA 4 2HB ALA 4 -35.572 -3.224 19.241
24 HB3 ALA 4 3HB ALA 4 -34.666 -3.386 20.745
25 H GLN 5 H GLN 5 -32.596 -3.171 20.703
26 HA GLN 5 HA GLN 5 -31.235 -1.753 18.499
27 HB2 GLN 5 2HB GLN 5 -32.540 -0.522 20.352
28 HB3 GLN 5 1HB GLN 5 -31.181 -0.936 21.398
29 HG2 GLN 5 2HG GLN 5 -29.643 0.290 20.073
30 HG3 GLN 5 1HG GLN 5 -30.766 0.389 18.718
31 HE21 GLN 5 1HE2 GLN 5 -29.519 2.198 21.254
32 HE22 GLN 5 2HE2 GLN 5 -30.781 3.337 21.405
33 H GLU 6 H GLU 6 -30.459 -4.445 19.310
34 HA GLU 6 HA GLU 6 -28.028 -4.201 20.871
35 HB2 GLU 6 2HB GLU 6 -29.369 -6.465 19.400
36 HB3 GLU 6 1HB GLU 6 -27.755 -6.637 20.087
37 HG2 GLU 6 2HG GLU 6 -30.011 -5.569 21.766
38 HG3 GLU 6 1HG GLU 6 -29.813 -7.305 21.542
39 H THR 7 H THR 7 -28.922 -4.701 17.473
40 HA THR 7 HA THR 7 -26.215 -4.913 16.549
41 HB THR 7 HB THR 7 -27.285 -4.652 14.284
42 HG1 THR 7 1HG THR 7 -29.401 -4.297 14.164
43 HG21 THR 7 3HG2 THR 7 -28.619 -6.660 16.120
44 HG22 THR 7 1HG2 THR 7 -26.998 -6.847 15.454
45 HG23 THR 7 2HG2 THR 7 -28.395 -6.816 14.378
46 H ASN 8 H ASN 8 -24.900 -3.225 16.845
47 HA ASN 8 HA ASN 8 -25.867 -0.510 16.181
48 HB2 ASN 8 2HB ASN 8 -23.857 0.254 17.469
49 HB3 ASN 8 1HB ASN 8 -25.023 -0.641 18.439
50 HD21 ASN 8 1HD2 ASN 8 -24.324 -2.593 19.422
51 HD22 ASN 8 2HD2 ASN 8 -22.759 -3.239 19.218
52 H GLN 9 H GLN 9 -23.247 -2.827 15.632
53 HA GLN 9 HA GLN 9 -22.035 -1.080 13.616
54 HB2 GLN 9 2HB GLN 9 -20.278 -2.846 13.511
55 HB3 GLN 9 1HB GLN 9 -20.496 -2.187 15.131
56 HG2 GLN 9 2HG GLN 9 -21.624 -4.114 15.895
57 HG3 GLN 9 1HG GLN 9 -21.984 -4.663 14.258
58 HE21 GLN 9 1HE2 GLN 9 -20.486 -6.068 13.276
59 HE22 GLN 9 2HE2 GLN 9 -18.975 -6.471 13.957
60 H THR 10 H THR 10 -21.460 -1.987 11.485
61 HA THR 10 HA THR 10 -22.968 -4.260 10.516
62 HB THR 10 HB THR 10 -24.712 -2.587 10.356
63 HG1 THR 10 1HG THR 10 -25.162 -3.287 8.445
64 HG21 THR 10 3HG2 THR 10 -24.456 -0.446 9.509
65 HG22 THR 10 1HG2 THR 10 -23.092 -0.901 8.487
66 HG23 THR 10 2HG2 THR 10 -22.861 -0.691 10.222
67 HA PRO 11 HA PRO 11 -19.054 -3.613 8.213
68 HB2 PRO 11 2HB PRO 11 -18.281 -6.214 8.072
69 HB3 PRO 11 1HB PRO 11 -18.029 -5.219 9.519
70 HG2 PRO 11 2HG PRO 11 -20.041 -7.325 9.001
71 HG3 PRO 11 1HG PRO 11 -19.232 -6.877 10.509
72 HD2 PRO 11 2HD PRO 11 -21.837 -6.130 9.776
73 HD3 PRO 11 1HD PRO 11 -20.868 -5.381 11.061
74 H GLY 12 H GLY 12 -19.370 -3.177 6.099
75 HA2 GLY 12 2HA GLY 12 -19.816 -5.197 4.159
76 HA3 GLY 12 1HA GLY 12 -21.308 -4.297 4.430
77 HA PRO 13 HA PRO 13 -19.716 -1.046 1.862
78 HB2 PRO 13 2HB PRO 13 -20.438 1.284 3.028
79 HB3 PRO 13 1HB PRO 13 -21.640 0.133 2.407
80 HG2 PRO 13 2HG PRO 13 -20.776 0.645 5.203
81 HG3 PRO 13 1HG PRO 13 -22.389 0.273 4.564
82 HD2 PRO 13 2HD PRO 13 -20.693 -1.578 5.784
83 HD3 PRO 13 1HD PRO 13 -22.051 -1.991 4.710
84 H MET 14 H MET 14 -17.443 -1.580 2.186
85 HA MET 14 HA MET 14 -15.861 -0.302 4.194
86 HB2 MET 14 2HB MET 14 -15.310 -1.941 1.747
87 HB3 MET 14 1HB MET 14 -13.985 -1.036 2.474
88 HG2 MET 14 2HG MET 14 -15.742 -2.679 4.266
89 HG3 MET 14 1HG MET 14 -14.553 -3.511 3.273
90 HE1 MET 14 3HE MET 14 -14.775 -0.408 6.018
91 HE2 MET 14 1HE MET 14 -14.109 -1.574 7.171
92 HE3 MET 14 2HE MET 14 -15.522 -1.991 6.204
93 H LEU 15 H LEU 15 -16.541 1.923 3.937
94 HA LEU 15 HA LEU 15 -15.901 3.347 1.504
95 HB2 LEU 15 2HB LEU 15 -17.477 3.822 3.826
96 HB3 LEU 15 1HB LEU 15 -16.265 5.100 3.789
97 HG LEU 15 HG LEU 15 -16.901 5.456 1.346
98 HD11 LEU 15 1HD1 LEU 15 -19.130 3.597 2.211
99 HD12 LEU 15 2HD1 LEU 15 -18.012 3.369 0.865
100 HD13 LEU 15 3HD1 LEU 15 -19.235 4.640 0.791
101 HD21 LEU 15 3HD2 LEU 15 -18.859 6.800 1.923
102 HD22 LEU 15 1HD2 LEU 15 -17.686 6.896 3.236
103 HD23 LEU 15 2HD2 LEU 15 -19.104 5.861 3.394
104 H CYS 16 H CYS 16 -14.201 4.802 1.180
105 HA CYS 16 HA CYS 16 -11.676 4.178 1.899
106 HB2 CYS 16 2HB CYS 16 -12.597 5.994 0.291
107 HB3 CYS 16 1HB CYS 16 -12.398 7.081 1.665
108 H SER 17 H SER 17 -10.642 3.999 3.749
109 HA SER 17 HA SER 17 -11.453 4.982 6.250
110 HB2 SER 17 2HB SER 17 -9.000 3.732 5.162
111 HB3 SER 17 1HB SER 17 -8.790 4.650 6.654
112 HG SER 17 HG SER 17 -10.377 3.400 7.608
113 H THR 18 H THR 18 -9.674 6.594 3.706
114 HA THR 18 HA THR 18 -8.571 8.635 5.429
115 HB THR 18 HB THR 18 -7.741 9.660 3.393
116 HG1 THR 18 1HG THR 18 -8.688 9.325 1.563
117 HG21 THR 18 3HG2 THR 18 -6.846 7.352 4.362
118 HG22 THR 18 1HG2 THR 18 -6.199 8.015 2.859
119 HG23 THR 18 2HG2 THR 18 -7.414 6.739 2.808
120 H GLY 19 H GLY 19 -11.675 8.167 4.037
121 HA2 GLY 19 2HA GLY 19 -13.545 9.501 4.254
122 HA3 GLY 19 1HA GLY 19 -12.533 10.759 4.963
123 H CYS 20 H CYS 20 -12.294 9.203 1.747
124 HA CYS 20 HA CYS 20 -12.217 11.866 0.560
125 HB2 CYS 20 2HB CYS 20 -11.241 10.931 -1.337
126 HB3 CYS 20 1HB CYS 20 -10.592 9.963 -0.019
127 H GLY 21 H GLY 21 -14.610 9.476 1.106
128 HA2 GLY 21 2HA GLY 21 -16.901 9.843 0.764
129 HA3 GLY 21 1HA GLY 21 -16.508 11.043 -0.459
130 H PHE 22 H PHE 22 -14.720 8.258 -1.121
131 HA PHE 22 HA PHE 22 -16.706 7.384 -3.112
132 HB2 PHE 22 2HB PHE 22 -13.689 7.303 -3.082
133 HB3 PHE 22 1HB PHE 22 -14.627 6.344 -4.219
134 HD1 PHE 22 1HD PHE 22 -16.723 7.842 -5.252
135 HD2 PHE 22 2HD PHE 22 -12.898 9.310 -3.954
136 HE1 PHE 22 1HE PHE 22 -16.984 9.820 -6.720
137 HE2 PHE 22 2HE PHE 22 -13.167 11.293 -5.416
138 HZ PHE 22 HZ PHE 22 -15.208 11.543 -6.794
139 H TYR 23 H TYR 23 -15.753 4.878 -3.745
140 HA TYR 23 HA TYR 23 -16.457 3.379 -1.318
141 HB2 TYR 23 2HB TYR 23 -17.593 3.123 -3.650
142 HB3 TYR 23 1HB TYR 23 -16.163 2.168 -4.052
143 HD1 TYR 23 1HD TYR 23 -18.720 2.526 -1.324
144 HD2 TYR 23 2HD TYR 23 -16.156 -0.102 -3.555
145 HE1 TYR 23 1HE TYR 23 -19.671 0.577 -0.123
146 HE2 TYR 23 2HE TYR 23 -17.107 -2.051 -2.356
147 HH TYR 23 HH TYR 23 -18.336 -2.234 0.159
148 H GLY 24 H GLY 24 -15.206 1.806 -0.410
149 HA2 GLY 24 2HA GLY 24 -12.446 1.497 -1.459
150 HA3 GLY 24 1HA GLY 24 -12.842 1.506 0.262
151 H ASN 25 H ASN 25 -11.424 -0.634 -0.601
152 HA ASN 25 HA ASN 25 -13.432 -2.810 -0.796
153 HB2 ASN 25 2HB ASN 25 -11.668 -2.280 -2.733
154 HB3 ASN 25 1HB ASN 25 -10.622 -3.253 -1.708
155 HD21 ASN 25 1HD2 ASN 25 -13.979 -3.379 -3.062
156 HD22 ASN 25 2HD2 ASN 25 -13.943 -5.058 -3.359
157 HA PRO 26 HA PRO 26 -11.545 -4.196 2.997
158 HB2 PRO 26 2HB PRO 26 -12.585 -6.706 3.177
159 HB3 PRO 26 1HB PRO 26 -13.499 -5.225 3.505
160 HG2 PRO 26 2HG PRO 26 -13.582 -7.011 1.154
161 HG3 PRO 26 1HG PRO 26 -14.860 -6.020 1.870
162 HD2 PRO 26 2HD PRO 26 -13.373 -5.371 -0.427
163 HD3 PRO 26 1HD PRO 26 -14.385 -4.252 0.509
164 H ARG 27 H ARG 27 -11.025 -5.921 -0.011
165 HA ARG 27 HA ARG 27 -9.042 -7.752 1.002
166 HB2 ARG 27 2HB ARG 27 -9.968 -6.884 -1.721
167 HB3 ARG 27 1HB ARG 27 -8.460 -7.782 -1.557
168 HG2 ARG 27 2HG ARG 27 -9.979 -9.523 -1.813
169 HG3 ARG 27 1HG ARG 27 -9.930 -9.386 -0.055
170 HD2 ARG 27 2HD ARG 27 -11.902 -7.811 -0.217
171 HD3 ARG 27 1HD ARG 27 -12.010 -8.229 -1.926
172 HE ARG 27 HE ARG 27 -11.992 -10.542 -0.199
173 HH11 ARG 27 1HH2 ARG 27 -14.054 -8.057 -1.598
174 HH12 ARG 27 2HH2 ARG 27 -15.477 -9.029 -1.483
175 HH21 ARG 27 1HH1 ARG 27 -13.882 -11.746 -0.066
176 HH22 ARG 27 2HH1 ARG 27 -15.384 -11.093 -0.635
177 H THR 28 H THR 28 -9.129 -4.531 -0.392
178 HA THR 28 HA THR 28 -6.264 -4.263 -0.632
179 HB THR 28 HB THR 28 -6.770 -1.907 -1.150
180 HG1 THR 28 1HG THR 28 -8.429 -1.124 -0.157
181 HG21 THR 28 3HG2 THR 28 -8.464 -4.049 -2.414
182 HG22 THR 28 1HG2 THR 28 -7.044 -3.232 -3.062
183 HG23 THR 28 2HG2 THR 28 -8.584 -2.380 -2.962
184 H ASN 29 H ASN 29 -6.059 -1.631 0.687
185 HA ASN 29 HA ASN 29 -5.794 -2.611 3.438
186 HB2 ASN 29 2HB ASN 29 -4.543 -0.442 1.827
187 HB3 ASN 29 1HB ASN 29 -4.717 -0.138 3.557
188 HD21 ASN 29 1HD2 ASN 29 -3.788 -2.997 1.530
189 HD22 ASN 29 2HD2 ASN 29 -2.425 -3.393 2.479
190 H GLY 30 H GLY 30 -8.496 -1.833 2.260
191 HA2 GLY 30 2HA GLY 30 -10.390 -1.036 3.328
192 HA3 GLY 30 1HA GLY 30 -9.358 -0.238 4.511
193 H MET 31 H MET 31 -8.428 0.420 1.258
194 HA MET 31 HA MET 31 -9.891 2.993 1.301
195 HB2 MET 31 2HB MET 31 -7.002 2.380 0.762
196 HB3 MET 31 1HB MET 31 -7.760 3.803 0.045
197 HG2 MET 31 2HG MET 31 -6.918 4.634 2.049
198 HG3 MET 31 1HG MET 31 -8.589 4.284 2.473
199 HE1 MET 31 3HE MET 31 -5.653 4.659 3.599
200 HE2 MET 31 1HE MET 31 -4.734 3.162 3.784
201 HE3 MET 31 2HE MET 31 -5.688 3.787 5.126
202 H CYS 32 H CYS 32 -9.994 4.045 -0.838
203 HA CYS 32 HA CYS 32 -11.225 2.443 -2.783
204 HB2 CYS 32 2HB CYS 32 -9.870 5.108 -3.244
205 HB3 CYS 32 1HB CYS 32 -11.094 4.377 -4.275
206 H SER 33 H SER 33 -10.391 2.594 -5.214
207 HA SER 33 HA SER 33 -8.042 0.948 -5.349
208 HB2 SER 33 2HB SER 33 -9.456 2.316 -7.646
209 HB3 SER 33 1HB SER 33 -8.429 0.886 -7.717
210 HG SER 33 HG SER 33 -11.068 1.138 -7.028
211 H VAL 34 H VAL 34 -8.816 4.307 -6.185
212 HA VAL 34 HA VAL 34 -6.175 4.948 -7.136
213 HB VAL 34 HB VAL 34 -8.301 6.887 -6.175
214 HG11 VAL 34 1HG1 VAL 34 -6.088 7.866 -6.565
215 HG12 VAL 34 2HG1 VAL 34 -7.204 8.386 -7.827
216 HG13 VAL 34 3HG1 VAL 34 -6.021 7.123 -8.163
217 HG21 VAL 34 3HG2 VAL 34 -8.082 5.281 -8.704
218 HG22 VAL 34 1HG2 VAL 34 -8.690 6.936 -8.809
219 HG23 VAL 34 2HG2 VAL 34 -9.521 5.751 -7.800
220 H CYS 35 H CYS 35 -7.945 5.250 -4.124
221 HA CYS 35 HA CYS 35 -5.965 6.795 -2.747
222 HB2 CYS 35 2HB CYS 35 -8.254 5.116 -1.689
223 HB3 CYS 35 1HB CYS 35 -7.280 6.229 -0.723
224 H TYR 36 H TYR 36 -6.666 3.327 -2.993
225 HA TYR 36 HA TYR 36 -4.974 2.350 -0.996
226 HB2 TYR 36 2HB TYR 36 -6.544 0.883 -2.133
227 HB3 TYR 36 1HB TYR 36 -5.720 1.123 -3.671
228 HD1 TYR 36 2HD TYR 36 -4.380 0.401 -0.221
229 HD2 TYR 36 1HD TYR 36 -4.753 -0.921 -4.293
230 HE1 TYR 36 2HE TYR 36 -2.874 -1.506 0.260
231 HE2 TYR 36 1HE TYR 36 -3.241 -2.828 -3.811
232 HH TYR 36 HH TYR 36 -2.528 -3.893 -0.801
233 H LYS 37 H LYS 37 -4.223 3.311 -4.297
234 HA LYS 37 HA LYS 37 -1.475 2.441 -4.181
235 HB2 LYS 37 2HB LYS 37 -2.884 2.650 -6.292
236 HB3 LYS 37 1HB LYS 37 -2.665 4.397 -6.151
237 HG2 LYS 37 2HG LYS 37 -0.140 3.865 -5.970
238 HG3 LYS 37 1HG LYS 37 -0.570 2.274 -6.601
239 HD2 LYS 37 2HD LYS 37 -1.446 3.210 -8.624
240 HD3 LYS 37 1HD LYS 37 -1.398 4.844 -7.966
241 HE2 LYS 37 2HE LYS 37 1.049 4.768 -7.878
242 HE3 LYS 37 1HE LYS 37 1.036 3.107 -8.472
243 HZ1 LYS 37 3HZ LYS 37 1.452 4.584 -10.289
244 HZ2 LYS 37 1HZ LYS 37 0.086 5.520 -9.920
245 HZ3 LYS 37 2HZ LYS 37 -0.103 3.927 -10.483
246 H GLU 38 H GLU 38 -3.200 5.533 -3.974
247 HA GLU 38 HA GLU 38 -1.042 7.273 -3.818
248 HB2 GLU 38 2HB GLU 38 -3.799 7.423 -2.610
249 HB3 GLU 38 1HB GLU 38 -2.633 8.739 -2.471
250 HG2 GLU 38 2HG GLU 38 -3.299 7.514 -5.144
251 HG3 GLU 38 1HG GLU 38 -4.270 8.824 -4.462
252 H HIS 39 H HIS 39 -2.550 5.417 -1.140
253 HA HIS 39 HA HIS 39 -0.737 6.694 0.751
254 HB2 HIS 39 2HB HIS 39 -1.886 5.628 2.507
255 HB3 HIS 39 1HB HIS 39 -3.122 6.094 1.350
256 HD1 HIS 39 1HD HIS 39 -4.851 4.328 1.244
257 HD2 HIS 39 2HD HIS 39 -1.052 2.675 1.729
258 HE1 HIS 39 1HE HIS 39 -5.165 1.819 1.359
259 HE2 HIS 39 2HE HIS 39 -2.863 0.794 1.639
260 H LEU 40 H LEU 40 -0.933 3.649 -0.967
261 HA LEU 40 HA LEU 40 0.959 2.182 0.519
262 HB2 LEU 40 2HB LEU 40 -0.550 1.288 -1.305
263 HB3 LEU 40 1HB LEU 40 0.579 1.982 -2.474
264 HG LEU 40 HG LEU 40 2.413 0.685 -1.214
265 HD11 LEU 40 1HD1 LEU 40 1.421 0.004 0.799
266 HD12 LEU 40 2HD1 LEU 40 1.322 -1.460 -0.177
267 HD13 LEU 40 3HD1 LEU 40 -0.098 -0.431 0.015
268 HD21 LEU 40 3HD2 LEU 40 1.855 -0.120 -3.362
269 HD22 LEU 40 1HD2 LEU 40 0.231 -0.588 -2.858
270 HD23 LEU 40 2HD2 LEU 40 1.626 -1.526 -2.322
271 H GLN 41 H GLN 41 1.398 4.801 -1.785
272 HA GLN 41 HA GLN 41 4.130 4.292 -2.402
273 HB2 GLN 41 2HB GLN 41 2.149 6.117 -3.230
274 HB3 GLN 41 1HB GLN 41 3.412 7.122 -2.525
275 HG2 GLN 41 2HG GLN 41 5.065 5.762 -3.944
276 HG3 GLN 41 1HG GLN 41 3.649 5.152 -4.806
277 HE21 GLN 41 1HE2 GLN 41 2.383 6.697 -6.083
278 HE22 GLN 41 2HE2 GLN 41 3.035 8.216 -6.507
279 H ARG 42 H ARG 42 2.487 6.166 0.109
280 HA ARG 42 HA ARG 42 4.903 7.331 1.154
281 HB2 ARG 42 2HB ARG 42 2.442 8.170 1.362
282 HB3 ARG 42 1HB ARG 42 2.356 7.057 2.726
283 HG2 ARG 42 2HG ARG 42 4.718 8.898 2.583
284 HG3 ARG 42 1HG ARG 42 3.162 9.594 3.032
285 HD2 ARG 42 2HD ARG 42 3.064 7.505 4.659
286 HD3 ARG 42 1HD ARG 42 4.811 7.556 4.481
287 HE ARG 42 HE ARG 42 3.138 9.511 5.839
288 HH11 ARG 42 1HH2 ARG 42 6.305 8.872 4.429
289 HH12 ARG 42 2HH2 ARG 42 7.071 10.122 5.346
290 HH21 ARG 42 1HH1 ARG 42 4.197 11.126 6.982
291 HH22 ARG 42 2HH1 ARG 42 5.898 11.381 6.772
292 H GLN 43 H GLN 43 2.997 4.443 1.795
293 HA GLN 43 HA GLN 43 4.231 3.778 4.284
294 HB2 GLN 43 2HB GLN 43 2.014 2.901 3.283
295 HB3 GLN 43 1HB GLN 43 3.035 1.763 2.401
296 HG2 GLN 43 2HG GLN 43 4.105 1.233 4.686
297 HG3 GLN 43 1HG GLN 43 2.709 2.056 5.385
298 HE21 GLN 43 1HE2 GLN 43 0.512 1.138 4.766
299 HE22 GLN 43 2HE2 GLN 43 0.403 -0.519 4.407
300 H GLN 44 H GLN 44 4.816 2.804 0.915
301 HA GLN 44 HA GLN 44 6.783 0.858 1.366
302 HB2 GLN 44 2HB GLN 44 5.563 1.652 -0.832
303 HB3 GLN 44 1HB GLN 44 6.998 2.657 -1.016
304 HG2 GLN 44 2HG GLN 44 7.575 0.662 -2.138
305 HG3 GLN 44 1HG GLN 44 8.334 0.481 -0.558
306 HE21 GLN 44 1HE2 GLN 44 6.021 -0.892 -2.748
307 HE22 GLN 44 2HE2 GLN 44 5.460 -2.123 -1.708
308 H ASN 45 H ASN 45 7.019 4.346 1.528
309 HA ASN 45 HA ASN 45 9.808 4.660 1.197
310 HB2 ASN 45 2HB ASN 45 7.612 6.248 2.444
311 HB3 ASN 45 1HB ASN 45 9.260 6.675 2.889
312 HD21 ASN 45 1HD2 ASN 45 7.945 5.530 -0.271
313 HD22 ASN 45 2HD2 ASN 45 8.480 6.894 -1.144
314 H SER 46 H SER 46 7.998 3.256 3.809
315 HA SER 46 HA SER 46 9.672 3.760 6.006
316 HB2 SER 46 2HB SER 46 7.382 2.681 6.051
317 HB3 SER 46 1HB SER 46 8.153 1.191 5.510
318 HG SER 46 HG SER 46 8.011 1.279 7.781
319 H GLY 47 H GLY 47 9.880 1.327 3.447
320 HA2 GLY 47 2HA GLY 47 12.018 0.507 2.709
321 HA3 GLY 47 1HA GLY 47 12.615 0.674 4.358
322 H ARG 48 H ARG 48 10.481 -0.545 5.739
323 HA ARG 48 HA ARG 48 11.143 -3.319 5.316
324 HB2 ARG 48 2HB ARG 48 10.700 -2.068 7.560
325 HB3 ARG 48 1HB ARG 48 9.001 -2.368 7.194
326 HG2 ARG 48 2HG ARG 48 9.565 -4.276 8.421
327 HG3 ARG 48 1HG ARG 48 9.805 -4.829 6.764
328 HD2 ARG 48 2HD ARG 48 12.239 -4.066 7.026
329 HD3 ARG 48 1HD ARG 48 11.904 -3.944 8.750
330 HE ARG 48 HE ARG 48 11.062 -6.465 8.110
331 HH11 ARG 48 1HH2 ARG 48 14.094 -4.745 7.613
332 HH12 ARG 48 2HH2 ARG 48 15.043 -6.185 7.710
333 HH21 ARG 48 1HH1 ARG 48 12.358 -8.299 8.234
334 HH22 ARG 48 2HH1 ARG 48 14.076 -8.172 8.059
335 H MET 49 H MET 49 9.957 -4.872 4.350
336 HA MET 49 HA MET 49 7.470 -4.066 3.012
337 HB2 MET 49 2HB MET 49 9.452 -6.295 2.630
338 HB3 MET 49 1HB MET 49 7.832 -6.412 1.941
339 HG2 MET 49 2HG MET 49 8.148 -4.424 0.637
340 HG3 MET 49 1HG MET 49 9.634 -4.022 1.496
341 HE1 MET 49 3HE MET 49 12.011 -4.530 -0.053
342 HE2 MET 49 1HE MET 49 10.614 -3.520 -0.445
343 HE3 MET 49 2HE MET 49 11.303 -4.589 -1.665
344 H SER 50 H SER 50 5.691 -5.707 2.931
345 HA SER 50 HA SER 50 5.529 -7.673 5.031
346 HB2 SER 50 2HB SER 50 5.086 -5.355 6.110
347 HB3 SER 50 1HB SER 50 3.546 -5.427 5.259
348 HG SER 50 HG SER 50 2.923 -6.667 6.830
349 HA PRO 51 HA PRO 51 2.786 -8.573 1.438
350 HB2 PRO 51 2HB PRO 51 3.131 -11.278 1.447
351 HB3 PRO 51 1HB PRO 51 4.278 -10.162 0.684
352 HG2 PRO 51 2HG PRO 51 4.441 -11.532 3.320
353 HG3 PRO 51 1HG PRO 51 5.711 -11.234 2.122
354 HD2 PRO 51 2HD PRO 51 5.392 -9.715 4.388
355 HD3 PRO 51 1HD PRO 51 6.118 -9.099 2.889
356 H MET 52 H MET 52 2.909 -10.255 4.566
357 HA MET 52 HA MET 52 0.069 -10.970 4.353
358 HB2 MET 52 2HB MET 52 2.342 -12.188 5.560
359 HB3 MET 52 1HB MET 52 1.262 -11.741 6.876
360 HG2 MET 52 2HG MET 52 0.509 -13.887 6.259
361 HG3 MET 52 1HG MET 52 -0.606 -12.812 5.415
362 HE1 MET 52 3HE MET 52 -1.308 -13.301 3.242
363 HE2 MET 52 1HE MET 52 -1.210 -14.938 3.905
364 HE3 MET 52 2HE MET 52 -0.654 -14.613 2.266
365 H GLY 53 H GLY 53 -0.907 -10.864 6.815
366 HA2 GLY 53 2HA GLY 53 -0.685 -9.165 8.751
367 HA3 GLY 53 1HA GLY 53 -0.872 -7.981 7.460
368 H THR 54 H THR 54 -2.809 -8.906 5.879
369 HA THR 54 HA THR 54 -5.187 -8.546 7.448
370 HB THR 54 HB THR 54 -6.357 -8.774 5.279
371 HG1 THR 54 1HG THR 54 -5.377 -9.640 3.635
372 HG21 THR 54 3HG2 THR 54 -5.200 -6.637 6.024
373 HG22 THR 54 1HG2 THR 54 -5.462 -6.784 4.286
374 HG23 THR 54 2HG2 THR 54 -3.863 -7.090 4.967
375 H ALA 55 H ALA 55 -6.606 -10.031 8.185
376 HA ALA 55 HA ALA 55 -5.870 -12.787 8.261
377 HB1 ALA 55 1HB ALA 55 -8.078 -13.087 9.375
378 HB2 ALA 55 2HB ALA 55 -8.451 -11.400 9.023
379 HB3 ALA 55 3HB ALA 55 -7.114 -11.802 10.103
380 H SER 56 H SER 56 -6.497 -14.474 7.021
381 HA SER 56 HA SER 56 -7.810 -13.944 4.511
382 HB2 SER 56 2HB SER 56 -5.960 -15.592 4.748
383 HB3 SER 56 1HB SER 56 -7.012 -16.595 5.741
384 HG SER 56 HG SER 56 -7.097 -17.258 3.581
385 H GLY 57 H GLY 57 -9.955 -13.710 4.388
386 HA2 GLY 57 2HA GLY 57 -12.168 -14.474 4.403
387 HA3 GLY 57 1HA GLY 57 -11.699 -15.754 5.517
388 H SER 58 H SER 58 -11.466 -12.187 5.633
389 HA SER 58 HA SER 58 -12.252 -12.160 8.417
390 HB2 SER 58 2HB SER 58 -10.575 -10.577 7.318
391 HB3 SER 58 1HB SER 58 -11.964 -9.768 6.597
392 HG SER 58 HG SER 58 -11.201 -8.952 8.695
393 H ASN 59 H ASN 59 -13.652 -11.115 5.319
394 HA ASN 59 HA ASN 59 -16.095 -10.172 6.530
395 HB2 ASN 59 2HB ASN 59 -14.981 -9.408 4.307
396 HB3 ASN 59 1HB ASN 59 -15.783 -10.815 3.611
397 HD21 ASN 59 1HD2 ASN 59 -16.316 -7.611 4.979
398 HD22 ASN 59 2HD2 ASN 59 -17.978 -7.543 4.636
399 H SER 60 H SER 60 -18.160 -11.104 6.347
400 HA SER 60 HA SER 60 -18.307 -13.901 5.435
401 HB2 SER 60 2HB SER 60 -17.911 -13.654 7.990
402 HB3 SER 60 1HB SER 60 -19.578 -13.088 8.039
403 HG SER 60 HG SER 60 -18.886 -15.523 8.131
404 HA PRO 61 HA PRO 61 -21.812 -11.402 3.719
405 HB2 PRO 61 2HB PRO 61 -21.936 -13.735 1.876
406 HB3 PRO 61 1HB PRO 61 -21.894 -12.000 1.506
407 HG2 PRO 61 2HG PRO 61 -19.784 -13.576 1.096
408 HG3 PRO 61 1HG PRO 61 -19.609 -11.894 1.623
409 HD2 PRO 61 2HD PRO 61 -19.316 -14.410 3.223
410 HD3 PRO 61 1HD PRO 61 -18.411 -12.883 3.343
411 H THR 62 H THR 62 -24.107 -11.825 3.635
412 HA THR 62 HA THR 62 -24.954 -13.845 5.540
413 HB THR 62 HB THR 62 -27.204 -12.791 5.200
414 HG1 THR 62 1HG THR 62 -26.997 -12.051 3.121
415 HG21 THR 62 3HG2 THR 62 -25.411 -12.001 6.852
416 HG22 THR 62 1HG2 THR 62 -26.669 -10.834 6.441
417 HG23 THR 62 2HG2 THR 62 -25.074 -10.710 5.700